data_1VIT # _entry.id 1VIT # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1VIT WWPDB D_1000177052 # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1VIT _pdbx_database_status.recvd_initial_deposition_date 1996-01-31 _pdbx_database_status.deposit_site ? _pdbx_database_status.process_site ? _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Vitali, J.' 1 'Edwards, B.F.P.' 2 # _citation.id primary _citation.title ;Structure of a bovine thrombin-hirudin51-65 complex determined by a combination of molecular replacement and graphics. Incorporation of known structural information in molecular replacement. ; _citation.journal_abbrev 'Acta Crystallogr.,Sect.D' _citation.journal_volume 52 _citation.page_first 453 _citation.page_last 464 _citation.year 1996 _citation.journal_id_ASTM ABCRE6 _citation.country DK _citation.journal_id_ISSN 0907-4449 _citation.journal_id_CSD 0766 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 15299666 _citation.pdbx_database_id_DOI 10.1107/S0907444996000364 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Vitali, J.' 1 primary 'Martin, P.D.' 2 primary 'Malkowski, M.G.' 3 primary 'Olsen, C.M.' 4 primary 'Johnson, P.H.' 5 primary 'Edwards, B.F.' 6 # _cell.entry_id 1VIT _cell.length_a 116.400 _cell.length_b 116.400 _cell.length_c 200.600 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 120.00 _cell.Z_PDB 24 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 1VIT _symmetry.space_group_name_H-M 'P 61 2 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 178 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer nat 'EPSILON THROMBIN' 5735.240 2 3.4.21.5 ? ? ? 2 polymer nat 'ALPHA THROMBIN' 29772.422 1 3.4.21.5 ? ? ? 3 polymer man HIRUDIN 1835.854 2 ? ? 'RESIDUES 51 - 65' ? 4 polymer nat 'EPSILON THROMBIN' 17525.346 1 3.4.21.5 ? ? ? 5 polymer nat 'EPSILON THROMBIN' 12265.071 1 3.4.21.5 ? ? ? 6 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 3 ? ? ? ? # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no TSEDHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGR TSEDHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGR L,M ? 2 'polypeptide(L)' no no ;IVEGQDAEVGLSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISM LDKIYIHPRYNWKENLDRDIALLKLKRPIELSDYIHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVL QVVNLPLVERPVCKASTRIRITDNMFCAGYKPGEGKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFY THVFRLKKWIQKVIDRLGS ; ;IVEGQDAEVGLSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISM LDKIYIHPRYNWKENLDRDIALLKLKRPIELSDYIHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVL QVVNLPLVERPVCKASTRIRITDNMFCAGYKPGEGKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFY THVFRLKKWIQKVIDRLGS ; H ? 3 'polypeptide(L)' no no HNDGDFEEIPEEYLQ HNDGDFEEIPEEYLQ I,J ? 4 'polypeptide(L)' no no ;IVEGQDAEVGLSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISM LDKIYIHPRYNWKENLDRDIALLKLKRPIELSDYIHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTT ; ;IVEGQDAEVGLSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISM LDKIYIHPRYNWKENLDRDIALLKLKRPIELSDYIHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTT ; F ? 5 'polypeptide(L)' no no ;SVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGEGKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEG CDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; ;SVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGEGKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEG CDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; G ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 THR n 1 2 SER n 1 3 GLU n 1 4 ASP n 1 5 HIS n 1 6 PHE n 1 7 GLN n 1 8 PRO n 1 9 PHE n 1 10 PHE n 1 11 ASN n 1 12 GLU n 1 13 LYS n 1 14 THR n 1 15 PHE n 1 16 GLY n 1 17 ALA n 1 18 GLY n 1 19 GLU n 1 20 ALA n 1 21 ASP n 1 22 CYS n 1 23 GLY n 1 24 LEU n 1 25 ARG n 1 26 PRO n 1 27 LEU n 1 28 PHE n 1 29 GLU n 1 30 LYS n 1 31 LYS n 1 32 GLN n 1 33 VAL n 1 34 GLN n 1 35 ASP n 1 36 GLN n 1 37 THR n 1 38 GLU n 1 39 LYS n 1 40 GLU n 1 41 LEU n 1 42 PHE n 1 43 GLU n 1 44 SER n 1 45 TYR n 1 46 ILE n 1 47 GLU n 1 48 GLY n 1 49 ARG n 2 1 ILE n 2 2 VAL n 2 3 GLU n 2 4 GLY n 2 5 GLN n 2 6 ASP n 2 7 ALA n 2 8 GLU n 2 9 VAL n 2 10 GLY n 2 11 LEU n 2 12 SER n 2 13 PRO n 2 14 TRP n 2 15 GLN n 2 16 VAL n 2 17 MET n 2 18 LEU n 2 19 PHE n 2 20 ARG n 2 21 LYS n 2 22 SER n 2 23 PRO n 2 24 GLN n 2 25 GLU n 2 26 LEU n 2 27 LEU n 2 28 CYS n 2 29 GLY n 2 30 ALA n 2 31 SER n 2 32 LEU n 2 33 ILE n 2 34 SER n 2 35 ASP n 2 36 ARG n 2 37 TRP n 2 38 VAL n 2 39 LEU n 2 40 THR n 2 41 ALA n 2 42 ALA n 2 43 HIS n 2 44 CYS n 2 45 LEU n 2 46 LEU n 2 47 TYR n 2 48 PRO n 2 49 PRO n 2 50 TRP n 2 51 ASP n 2 52 LYS n 2 53 ASN n 2 54 PHE n 2 55 THR n 2 56 VAL n 2 57 ASP n 2 58 ASP n 2 59 LEU n 2 60 LEU n 2 61 VAL n 2 62 ARG n 2 63 ILE n 2 64 GLY n 2 65 LYS n 2 66 HIS n 2 67 SER n 2 68 ARG n 2 69 THR n 2 70 ARG n 2 71 TYR n 2 72 GLU n 2 73 ARG n 2 74 LYS n 2 75 VAL n 2 76 GLU n 2 77 LYS n 2 78 ILE n 2 79 SER n 2 80 MET n 2 81 LEU n 2 82 ASP n 2 83 LYS n 2 84 ILE n 2 85 TYR n 2 86 ILE n 2 87 HIS n 2 88 PRO n 2 89 ARG n 2 90 TYR n 2 91 ASN n 2 92 TRP n 2 93 LYS n 2 94 GLU n 2 95 ASN n 2 96 LEU n 2 97 ASP n 2 98 ARG n 2 99 ASP n 2 100 ILE n 2 101 ALA n 2 102 LEU n 2 103 LEU n 2 104 LYS n 2 105 LEU n 2 106 LYS n 2 107 ARG n 2 108 PRO n 2 109 ILE n 2 110 GLU n 2 111 LEU n 2 112 SER n 2 113 ASP n 2 114 TYR n 2 115 ILE n 2 116 HIS n 2 117 PRO n 2 118 VAL n 2 119 CYS n 2 120 LEU n 2 121 PRO n 2 122 ASP n 2 123 LYS n 2 124 GLN n 2 125 THR n 2 126 ALA n 2 127 ALA n 2 128 LYS n 2 129 LEU n 2 130 LEU n 2 131 HIS n 2 132 ALA n 2 133 GLY n 2 134 PHE n 2 135 LYS n 2 136 GLY n 2 137 ARG n 2 138 VAL n 2 139 THR n 2 140 GLY n 2 141 TRP n 2 142 GLY n 2 143 ASN n 2 144 ARG n 2 145 ARG n 2 146 GLU n 2 147 THR n 2 148 TRP n 2 149 THR n 2 150 THR n 2 151 SER n 2 152 VAL n 2 153 ALA n 2 154 GLU n 2 155 VAL n 2 156 GLN n 2 157 PRO n 2 158 SER n 2 159 VAL n 2 160 LEU n 2 161 GLN n 2 162 VAL n 2 163 VAL n 2 164 ASN n 2 165 LEU n 2 166 PRO n 2 167 LEU n 2 168 VAL n 2 169 GLU n 2 170 ARG n 2 171 PRO n 2 172 VAL n 2 173 CYS n 2 174 LYS n 2 175 ALA n 2 176 SER n 2 177 THR n 2 178 ARG n 2 179 ILE n 2 180 ARG n 2 181 ILE n 2 182 THR n 2 183 ASP n 2 184 ASN n 2 185 MET n 2 186 PHE n 2 187 CYS n 2 188 ALA n 2 189 GLY n 2 190 TYR n 2 191 LYS n 2 192 PRO n 2 193 GLY n 2 194 GLU n 2 195 GLY n 2 196 LYS n 2 197 ARG n 2 198 GLY n 2 199 ASP n 2 200 ALA n 2 201 CYS n 2 202 GLU n 2 203 GLY n 2 204 ASP n 2 205 SER n 2 206 GLY n 2 207 GLY n 2 208 PRO n 2 209 PHE n 2 210 VAL n 2 211 MET n 2 212 LYS n 2 213 SER n 2 214 PRO n 2 215 TYR n 2 216 ASN n 2 217 ASN n 2 218 ARG n 2 219 TRP n 2 220 TYR n 2 221 GLN n 2 222 MET n 2 223 GLY n 2 224 ILE n 2 225 VAL n 2 226 SER n 2 227 TRP n 2 228 GLY n 2 229 GLU n 2 230 GLY n 2 231 CYS n 2 232 ASP n 2 233 ARG n 2 234 ASP n 2 235 GLY n 2 236 LYS n 2 237 TYR n 2 238 GLY n 2 239 PHE n 2 240 TYR n 2 241 THR n 2 242 HIS n 2 243 VAL n 2 244 PHE n 2 245 ARG n 2 246 LEU n 2 247 LYS n 2 248 LYS n 2 249 TRP n 2 250 ILE n 2 251 GLN n 2 252 LYS n 2 253 VAL n 2 254 ILE n 2 255 ASP n 2 256 ARG n 2 257 LEU n 2 258 GLY n 2 259 SER n 3 1 HIS n 3 2 ASN n 3 3 ASP n 3 4 GLY n 3 5 ASP n 3 6 PHE n 3 7 GLU n 3 8 GLU n 3 9 ILE n 3 10 PRO n 3 11 GLU n 3 12 GLU n 3 13 TYR n 3 14 LEU n 3 15 GLN n 4 1 ILE n 4 2 VAL n 4 3 GLU n 4 4 GLY n 4 5 GLN n 4 6 ASP n 4 7 ALA n 4 8 GLU n 4 9 VAL n 4 10 GLY n 4 11 LEU n 4 12 SER n 4 13 PRO n 4 14 TRP n 4 15 GLN n 4 16 VAL n 4 17 MET n 4 18 LEU n 4 19 PHE n 4 20 ARG n 4 21 LYS n 4 22 SER n 4 23 PRO n 4 24 GLN n 4 25 GLU n 4 26 LEU n 4 27 LEU n 4 28 CYS n 4 29 GLY n 4 30 ALA n 4 31 SER n 4 32 LEU n 4 33 ILE n 4 34 SER n 4 35 ASP n 4 36 ARG n 4 37 TRP n 4 38 VAL n 4 39 LEU n 4 40 THR n 4 41 ALA n 4 42 ALA n 4 43 HIS n 4 44 CYS n 4 45 LEU n 4 46 LEU n 4 47 TYR n 4 48 PRO n 4 49 PRO n 4 50 TRP n 4 51 ASP n 4 52 LYS n 4 53 ASN n 4 54 PHE n 4 55 THR n 4 56 VAL n 4 57 ASP n 4 58 ASP n 4 59 LEU n 4 60 LEU n 4 61 VAL n 4 62 ARG n 4 63 ILE n 4 64 GLY n 4 65 LYS n 4 66 HIS n 4 67 SER n 4 68 ARG n 4 69 THR n 4 70 ARG n 4 71 TYR n 4 72 GLU n 4 73 ARG n 4 74 LYS n 4 75 VAL n 4 76 GLU n 4 77 LYS n 4 78 ILE n 4 79 SER n 4 80 MET n 4 81 LEU n 4 82 ASP n 4 83 LYS n 4 84 ILE n 4 85 TYR n 4 86 ILE n 4 87 HIS n 4 88 PRO n 4 89 ARG n 4 90 TYR n 4 91 ASN n 4 92 TRP n 4 93 LYS n 4 94 GLU n 4 95 ASN n 4 96 LEU n 4 97 ASP n 4 98 ARG n 4 99 ASP n 4 100 ILE n 4 101 ALA n 4 102 LEU n 4 103 LEU n 4 104 LYS n 4 105 LEU n 4 106 LYS n 4 107 ARG n 4 108 PRO n 4 109 ILE n 4 110 GLU n 4 111 LEU n 4 112 SER n 4 113 ASP n 4 114 TYR n 4 115 ILE n 4 116 HIS n 4 117 PRO n 4 118 VAL n 4 119 CYS n 4 120 LEU n 4 121 PRO n 4 122 ASP n 4 123 LYS n 4 124 GLN n 4 125 THR n 4 126 ALA n 4 127 ALA n 4 128 LYS n 4 129 LEU n 4 130 LEU n 4 131 HIS n 4 132 ALA n 4 133 GLY n 4 134 PHE n 4 135 LYS n 4 136 GLY n 4 137 ARG n 4 138 VAL n 4 139 THR n 4 140 GLY n 4 141 TRP n 4 142 GLY n 4 143 ASN n 4 144 ARG n 4 145 ARG n 4 146 GLU n 4 147 THR n 4 148 TRP n 4 149 THR n 4 150 THR n 5 1 SER n 5 2 VAL n 5 3 ALA n 5 4 GLU n 5 5 VAL n 5 6 GLN n 5 7 PRO n 5 8 SER n 5 9 VAL n 5 10 LEU n 5 11 GLN n 5 12 VAL n 5 13 VAL n 5 14 ASN n 5 15 LEU n 5 16 PRO n 5 17 LEU n 5 18 VAL n 5 19 GLU n 5 20 ARG n 5 21 PRO n 5 22 VAL n 5 23 CYS n 5 24 LYS n 5 25 ALA n 5 26 SER n 5 27 THR n 5 28 ARG n 5 29 ILE n 5 30 ARG n 5 31 ILE n 5 32 THR n 5 33 ASP n 5 34 ASN n 5 35 MET n 5 36 PHE n 5 37 CYS n 5 38 ALA n 5 39 GLY n 5 40 TYR n 5 41 LYS n 5 42 PRO n 5 43 GLY n 5 44 GLU n 5 45 GLY n 5 46 LYS n 5 47 ARG n 5 48 GLY n 5 49 ASP n 5 50 ALA n 5 51 CYS n 5 52 GLU n 5 53 GLY n 5 54 ASP n 5 55 SER n 5 56 GLY n 5 57 GLY n 5 58 PRO n 5 59 PHE n 5 60 VAL n 5 61 MET n 5 62 LYS n 5 63 SER n 5 64 PRO n 5 65 TYR n 5 66 ASN n 5 67 ASN n 5 68 ARG n 5 69 TRP n 5 70 TYR n 5 71 GLN n 5 72 MET n 5 73 GLY n 5 74 ILE n 5 75 VAL n 5 76 SER n 5 77 TRP n 5 78 GLY n 5 79 GLU n 5 80 GLY n 5 81 CYS n 5 82 ASP n 5 83 ARG n 5 84 ASP n 5 85 GLY n 5 86 LYS n 5 87 TYR n 5 88 GLY n 5 89 PHE n 5 90 TYR n 5 91 THR n 5 92 HIS n 5 93 VAL n 5 94 PHE n 5 95 ARG n 5 96 LEU n 5 97 LYS n 5 98 LYS n 5 99 TRP n 5 100 ILE n 5 101 GLN n 5 102 LYS n 5 103 VAL n 5 104 ILE n 5 105 ASP n 5 106 ARG n 5 107 LEU n 5 108 GLY n 5 109 SER n # loop_ _entity_src_nat.entity_id _entity_src_nat.pdbx_src_id _entity_src_nat.pdbx_alt_source_flag _entity_src_nat.pdbx_beg_seq_num _entity_src_nat.pdbx_end_seq_num _entity_src_nat.common_name _entity_src_nat.pdbx_organism_scientific _entity_src_nat.pdbx_ncbi_taxonomy_id _entity_src_nat.genus _entity_src_nat.species _entity_src_nat.strain _entity_src_nat.tissue _entity_src_nat.tissue_fraction _entity_src_nat.pdbx_secretion _entity_src_nat.pdbx_fragment _entity_src_nat.pdbx_variant _entity_src_nat.pdbx_cell_line _entity_src_nat.pdbx_atcc _entity_src_nat.pdbx_cellular_location _entity_src_nat.pdbx_organ _entity_src_nat.pdbx_organelle _entity_src_nat.pdbx_cell _entity_src_nat.pdbx_plasmid_name _entity_src_nat.pdbx_plasmid_details _entity_src_nat.details 1 1 sample ? ? cattle 'Bos taurus' 9913 Bos ? ? BLOOD ? ? ? ? ? ? ? BLOOD ? ? ? ? ? 2 1 sample ? ? cattle 'Bos taurus' 9913 Bos ? ? BLOOD ? ? ? ? ? ? ? BLOOD ? ? ? ? ? 4 1 sample ? ? cattle 'Bos taurus' 9913 Bos ? ? BLOOD ? ? ? ? ? ? ? BLOOD ? ? ? ? ? 5 1 sample ? ? cattle 'Bos taurus' 9913 Bos ? ? BLOOD ? ? ? ? ? ? ? BLOOD ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.entity_id _struct_ref.pdbx_db_accession _struct_ref.pdbx_align_begin _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_db_isoform 1 UNP THRB_BOVIN 1 P00735 1 ;MARVRGPRLPGCLALAALFSLVHSQHVFLAHQQASSLLQRARRANKGFLEEVRKGNLERECLEEPCSREEAFEALESLSA TDAFWAKYTACESARNPREKLNECLEGNCAEGVGMNYRGNVSVTRSGIECQLWRSRYPHKPEINSTTHPGADLRENFCRN PDGSITGPWCYTTSPTLRREECSVPVCGQDRVTVEVIPRSGGSTTSQSPLLETCVPDRGREYRGRLAVTTSGSRCLAWSS EQAKALSKDQDFNPAVPLAENFCRNPDGDEEGAWCYVADQPGDFEYCDLNYCEEPVDGDLGDRLGEDPDPDAAIEGRTSE DHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGRIVEGQDAEVGLSPWQVMLFRKSPQELLCGASLIS DRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISMLDKIYIHPRYNWKENLDRDIALLKLKRPIELSDY IHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGE GKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; ? 2 UNP THRB_BOVIN 2 P00735 1 ;MARVRGPRLPGCLALAALFSLVHSQHVFLAHQQASSLLQRARRANKGFLEEVRKGNLERECLEEPCSREEAFEALESLSA TDAFWAKYTACESARNPREKLNECLEGNCAEGVGMNYRGNVSVTRSGIECQLWRSRYPHKPEINSTTHPGADLRENFCRN PDGSITGPWCYTTSPTLRREECSVPVCGQDRVTVEVIPRSGGSTTSQSPLLETCVPDRGREYRGRLAVTTSGSRCLAWSS EQAKALSKDQDFNPAVPLAENFCRNPDGDEEGAWCYVADQPGDFEYCDLNYCEEPVDGDLGDRLGEDPDPDAAIEGRTSE DHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGRIVEGQDAEVGLSPWQVMLFRKSPQELLCGASLIS DRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISMLDKIYIHPRYNWKENLDRDIALLKLKRPIELSDY IHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGE GKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; ? 3 UNP ITHG_HIRME 3 P28507 1 VVYTDCTESGQNLCLCEDSNVCGEGNKCILGSNGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ ? 4 UNP THRB_BOVIN 4 P00735 1 ;MARVRGPRLPGCLALAALFSLVHSQHVFLAHQQASSLLQRARRANKGFLEEVRKGNLERECLEEPCSREEAFEALESLSA TDAFWAKYTACESARNPREKLNECLEGNCAEGVGMNYRGNVSVTRSGIECQLWRSRYPHKPEINSTTHPGADLRENFCRN PDGSITGPWCYTTSPTLRREECSVPVCGQDRVTVEVIPRSGGSTTSQSPLLETCVPDRGREYRGRLAVTTSGSRCLAWSS EQAKALSKDQDFNPAVPLAENFCRNPDGDEEGAWCYVADQPGDFEYCDLNYCEEPVDGDLGDRLGEDPDPDAAIEGRTSE DHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGRIVEGQDAEVGLSPWQVMLFRKSPQELLCGASLIS DRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISMLDKIYIHPRYNWKENLDRDIALLKLKRPIELSDY IHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGE GKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; ? 5 UNP THRB_BOVIN 5 P00735 1 ;MARVRGPRLPGCLALAALFSLVHSQHVFLAHQQASSLLQRARRANKGFLEEVRKGNLERECLEEPCSREEAFEALESLSA TDAFWAKYTACESARNPREKLNECLEGNCAEGVGMNYRGNVSVTRSGIECQLWRSRYPHKPEINSTTHPGADLRENFCRN PDGSITGPWCYTTSPTLRREECSVPVCGQDRVTVEVIPRSGGSTTSQSPLLETCVPDRGREYRGRLAVTTSGSRCLAWSS EQAKALSKDQDFNPAVPLAENFCRNPDGDEEGAWCYVADQPGDFEYCDLNYCEEPVDGDLGDRLGEDPDPDAAIEGRTSE DHFQPFFNEKTFGAGEADCGLRPLFEKKQVQDQTEKELFESYIEGRIVEGQDAEVGLSPWQVMLFRKSPQELLCGASLIS DRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISMLDKIYIHPRYNWKENLDRDIALLKLKRPIELSDY IHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGE GKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFYTHVFRLKKWIQKVIDRLGS ; ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 1VIT L 1 U 49 ? P00735 318 ? 366 ? 1 15 2 2 1VIT H 1 ? 259 ? P00735 367 ? 625 ? 16 247 3 3 1VIT I 1 ? 15 ? P28507 51 ? 65 ? 51 65 4 1 1VIT M 1 U 49 ? P00735 318 ? 366 ? 1 15 5 4 1VIT F 1 ? 150 A P00735 367 ? 516 ? 16 149 6 5 1VIT G 1 B 109 ? P00735 517 ? 625 ? 149 247 7 3 1VIT J 1 ? 15 ? P28507 51 ? 65 ? 51 65 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 1VIT _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.62 _exptl_crystal.density_percent_sol 53.13 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp ? _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 8.0 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details ;HANGING DROP, RESERVOIRS CONTAINING 39% SATURATED AMMONIUM SULFATE, 0.25 M AMMONIUM PHOSPHATE PH 8.0 AND 1% PEG4000. DROPS CONSISTED OF EQUAL VOLUMES OF RESERVOIR AND PROTEIN SOLUTION CONTAINING 23.5 MG/ML PROTEIN., vapor diffusion - hanging drop ; # _diffrn.id 1 _diffrn.ambient_temp 295 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'AREA DETECTOR' _diffrn_detector.type SIEMENS _diffrn_detector.pdbx_collection_date ? _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'GRAPHITE(002)' _diffrn_radiation.pdbx_diffrn_protocol ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.5418 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source 'ROTATING ANODE' _diffrn_source.type 'RIGAKU RUH2R' _diffrn_source.pdbx_synchrotron_site ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_wavelength 1.5418 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 1VIT _reflns.observed_criterion_sigma_I 0.0 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low ? _reflns.d_resolution_high 3.2 _reflns.number_obs 11300 _reflns.number_all ? _reflns.percent_possible_obs 80. _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.126 _reflns.pdbx_netI_over_sigmaI 7. _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 2.8 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 3.2 _reflns_shell.d_res_low 3.4 _reflns_shell.percent_possible_all 41. _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 2.0 _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1VIT _refine.ls_number_reflns_obs 8659 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 2.0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 7.0 _refine.ls_d_res_high 3.2 _refine.ls_percent_reflns_obs 69.8 _refine.ls_R_factor_obs 0.192 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.192 _refine.ls_R_factor_R_free ? _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free ? _refine.ls_number_reflns_R_free ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.B_iso_mean 24.8 _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_ls_cross_valid_method ? _refine.details ;RESIDUES 51, 54, 62, 64, AND 65 OF PEPTIDE 1 HAVE POOR DENSITY. MOST OF PEPTIDE 2 IS EFFECTIVELY DISORDERED WITH RESIDUES 53, 54, 58, 59, 60, 61, 64, 65 HAVING POOR DENSITY. EXCEPT FOR A FEW RESIDUES, THE TWO THROMBINS ARE GENERALLY WELL DEFINED IN THE ELECTRON DENSITY MAPS FOR RESIDUES 1C - 14K AND 16 - 243. ; _refine.pdbx_starting_model 'BOVINE THROMBIN IN COMPLEX WITH HIRUDIN' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT AND GRAPHICS' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.overall_SU_B ? _refine.ls_redundancy_reflns_obs ? _refine.pdbx_overall_phase_error ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 1VIT _refine_analyze.Luzzati_coordinate_error_obs ? _refine_analyze.Luzzati_sigma_a_obs 0.5 _refine_analyze.Luzzati_d_res_low_obs ? _refine_analyze.Luzzati_coordinate_error_free ? _refine_analyze.Luzzati_sigma_a_free ? _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 5029 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 42 _refine_hist.number_atoms_solvent 0 _refine_hist.number_atoms_total 5071 _refine_hist.d_res_high 3.2 _refine_hist.d_res_low 7.0 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function x_bond_d 0.009 ? ? ? 'X-RAY DIFFRACTION' ? x_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg 1.8 ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d 26.3 ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d 1.5 ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? # _struct.entry_id 1VIT _struct.title 'THROMBIN:HIRUDIN 51-65 COMPLEX' _struct.pdbx_descriptor 'EPSILON THROMBIN, ALPHA THROMBIN, HIRUDIN' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1VIT _struct_keywords.pdbx_keywords 'COMPLEX (SERINE PROTEASE/INHIBITOR)' _struct_keywords.text 'COMPLEX (SERINE PROTEASE-INHIBITOR), HYDROLASE, SERINE PROTEASE, BLOOD COAGULATION, COMPLEX (SERINE PROTEASE-INHIBITOR) complex' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 1 ? E N N 4 ? F N N 5 ? G N N 3 ? H N N 6 ? I N N 6 ? J N N 6 ? # loop_ _struct_biol.id _struct_biol.details _struct_biol.pdbx_parent_biol_id 1 ;THERE ARE TWO COMPLEXES PER ASYMMETRIC UNIT. EACH COMPLEX CONSISTS OF ONE MOLECULE OF THROMBIN AND ONE MOLECULE OF HIRUDIN 51 - 65. THROMBIN IN COMPLEX 1 IS ALPHA-THROMBIN AND IS CLEAVED BETWEEN RESIDUES 15 AND 16. CHAIN INDICATOR *L* IS USED FOR RESIDUES 1H - 15, CHAIN INDICATOR *H* IS CHAIN INDICATOR *H* IS USED FOR RESIDUES 16 - 246, AND CHAIN INDICATOR *I* IS USED FOR THE PEPTIDE. THROMBIN IN COMPLEX 2 IS EPSILON THROMBIN AND, IN ADDITION TO THE CUT BETWEEN RESIDUES 15 AND 16, IT IS ALSO CLEAVED BETWEEN RESIDUES 149A AND 149B. CHAIN INDICATORS IN COMPLEX 2 ARE *M* FOR RESIDUES 1H - 15, *F* FOR RESIDUES 15 - 149A, *G* FOR RESIDUES 149B - 247, AND *J* FOR THE PEPTIDE. ; ? 2 ? ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLU A 29 ? LYS A 31 ? GLU L 8 LYS L 10 5 ? 3 HELX_P HELX_P2 2 GLU A 38 C SER A 44 I GLU L 14 SER L 14 1 ? 7 HELX_P HELX_P3 3 ALA B 42 ? CYS B 44 ? ALA H 56 CYS H 58 5 ? 3 HELX_P HELX_P4 4 LYS B 123 ? LEU B 129 C LYS H 126 LEU H 129 1 ? 7 HELX_P HELX_P5 5 ARG B 170 ? LYS B 174 ? ARG H 165 LYS H 169 1 ? 5 HELX_P HELX_P6 6 PHE B 244 ? ILE B 254 ? PHE H 232 ILE H 242 5 ? 11 HELX_P HELX_P7 7 GLU D 29 ? LYS D 31 ? GLU M 8 LYS M 10 5 ? 3 HELX_P HELX_P8 8 LYS D 39 D TYR D 45 J LYS M 14 TYR M 14 1 ? 7 HELX_P HELX_P9 9 ALA E 42 ? CYS E 44 ? ALA F 56 CYS F 58 5 ? 3 HELX_P HELX_P10 10 PRO E 48 B TRP E 50 D PRO F 60 TRP F 60 5 ? 3 HELX_P HELX_P11 11 VAL E 56 ? ASP E 58 ? VAL F 61 ASP F 63 5 ? 3 HELX_P HELX_P12 12 THR E 125 ? LYS E 128 B THR F 128 LYS F 129 1 ? 4 HELX_P HELX_P13 13 ARG F 20 ? SER F 26 ? ARG G 165 SER G 171 1 ? 7 HELX_P HELX_P14 14 PHE F 94 ? ILE F 104 ? PHE G 232 ILE G 242 5 ? 11 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 22 SG ? ? ? 1_555 B CYS 119 SG ? ? L CYS 1 H CYS 122 1_555 ? ? ? ? ? ? ? 2.036 ? disulf2 disulf ? ? B CYS 28 SG ? ? ? 1_555 B CYS 44 SG ? ? H CYS 42 H CYS 58 1_555 ? ? ? ? ? ? ? 2.027 ? disulf3 disulf ? ? B CYS 173 SG ? ? ? 1_555 B CYS 187 SG ? ? H CYS 168 H CYS 182 1_555 ? ? ? ? ? ? ? 2.038 ? disulf4 disulf ? ? B CYS 201 SG ? ? ? 1_555 B CYS 231 SG ? ? H CYS 191 H CYS 220 1_555 ? ? ? ? ? ? ? 2.029 ? disulf5 disulf ? ? D CYS 22 SG ? ? ? 1_555 E CYS 119 SG ? ? M CYS 1 F CYS 122 1_555 ? ? ? ? ? ? ? 2.041 ? disulf6 disulf ? ? E CYS 28 SG ? ? ? 1_555 E CYS 44 SG ? ? F CYS 42 F CYS 58 1_555 ? ? ? ? ? ? ? 2.041 ? disulf7 disulf ? ? F CYS 23 SG ? ? ? 1_555 F CYS 37 SG ? ? G CYS 168 G CYS 182 1_555 ? ? ? ? ? ? ? 2.018 ? disulf8 disulf ? ? F CYS 51 SG ? ? ? 1_555 F CYS 81 SG ? ? G CYS 191 G CYS 220 1_555 ? ? ? ? ? ? ? 2.023 ? covale1 covale ? ? H NAG . C1 ? ? ? 1_555 B ASN 53 ND2 ? G H NAG 401 H ASN 60 1_555 ? ? ? ? ? ? ? 1.455 ? covale2 covale ? ? H NAG . O4 ? ? ? 1_555 I NAG . C1 ? ? H NAG 401 H NAG 402 1_555 ? ? ? ? ? ? ? 1.390 ? covale3 covale ? ? J NAG . C1 ? ? ? 1_555 E ASN 53 ND2 ? G F NAG 501 F ASN 60 1_555 ? ? ? ? ? ? ? 1.456 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 SER 22 B . A SER 36 H PRO 23 B ? PRO 37 H 1 0.06 2 SER 22 E . A SER 36 F PRO 23 E ? PRO 37 F 1 -0.06 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 4 ? B ? 3 ? C ? 2 ? D ? 4 ? E ? 4 ? F ? 3 ? G ? 2 ? H ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel G 1 2 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 LYS B 77 ? SER B 79 ? LYS H 81 SER H 83 A 2 LEU B 59 ? ILE B 63 ? LEU H 64 ILE H 68 A 3 GLN B 15 ? ARG B 20 ? GLN H 30 ARG H 35 A 4 LEU B 26 ? SER B 31 ? LEU H 40 SER H 45 B 1 TRP B 37 ? THR B 40 ? TRP H 51 THR H 54 B 2 ALA B 101 ? LYS B 104 ? ALA H 104 LYS H 107 B 3 ILE B 84 ? ILE B 86 ? ILE H 88 ILE H 90 C 1 LYS B 135 ? THR B 139 ? LYS H 135 THR H 139 C 2 VAL B 162 ? PRO B 166 ? VAL H 157 PRO H 161 D 1 MET B 185 ? ALA B 188 ? MET H 180 ALA H 183 D 2 GLY B 238 ? HIS B 242 ? GLY H 226 HIS H 230 D 3 TRP B 219 ? GLY B 228 ? TRP H 207 GLY H 216 D 4 PRO B 208 ? LYS B 212 ? PRO H 198 LYS H 202 E 1 LYS E 77 ? MET E 80 ? LYS F 81 MET F 84 E 2 LEU E 59 ? ILE E 63 ? LEU F 64 ILE F 68 E 3 VAL E 16 ? ARG E 20 ? VAL F 31 ARG F 35 E 4 GLU E 25 ? ALA E 30 ? GLU F 39 ALA F 44 F 1 TRP E 37 ? THR E 40 ? TRP F 51 THR F 54 F 2 ALA E 101 ? LYS E 104 ? ALA F 104 LYS F 107 F 3 ILE E 84 ? ILE E 86 ? ILE F 88 ILE F 90 G 1 LYS E 135 ? GLY E 140 ? LYS F 135 GLY F 140 G 2 GLN F 11 ? PRO F 16 ? GLN G 156 PRO G 161 H 1 MET F 35 ? ALA F 38 ? MET G 180 ALA G 183 H 2 GLY F 88 ? HIS F 92 ? GLY G 226 HIS G 230 H 3 TRP F 69 ? GLY F 78 ? TRP G 207 GLY G 216 H 4 PRO F 58 ? LYS F 62 ? PRO G 198 LYS G 202 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 O LYS B 77 ? O LYS H 81 N ILE B 63 ? N ILE H 68 A 2 3 O LEU B 60 ? O LEU H 65 N PHE B 19 ? N PHE H 34 A 3 4 O VAL B 16 ? O VAL H 31 N ALA B 30 ? N ALA H 44 B 1 2 O VAL B 38 ? O VAL H 52 N LEU B 103 ? N LEU H 106 B 2 3 O LEU B 102 ? O LEU H 105 N TYR B 85 ? N TYR H 89 C 1 2 O GLY B 136 ? O GLY H 136 N LEU B 165 ? N LEU H 160 D 1 2 O PHE B 186 ? O PHE H 181 N TYR B 240 ? N TYR H 228 D 2 3 O PHE B 239 ? O PHE H 227 N TRP B 227 ? N TRP H 215 D 3 4 O TYR B 220 ? O TYR H 208 N MET B 211 ? N MET H 201 E 1 2 O LYS E 77 ? O LYS F 81 N ILE E 63 ? N ILE F 68 E 2 3 O LEU E 60 ? O LEU F 65 N PHE E 19 ? N PHE F 34 E 3 4 O VAL E 16 ? O VAL F 31 N ALA E 30 ? N ALA F 44 F 1 2 O VAL E 38 ? O VAL F 52 N LEU E 103 ? N LEU F 106 F 2 3 O LEU E 102 ? O LEU F 105 N TYR E 85 ? N TYR F 89 G 1 2 O GLY E 136 ? O GLY F 136 N LEU F 15 ? N LEU G 160 H 1 2 O PHE F 36 ? O PHE G 181 N TYR F 90 ? N TYR G 228 H 2 3 O PHE F 89 ? O PHE G 227 N TRP F 77 ? N TRP G 215 H 3 4 O TYR F 70 ? O TYR G 208 N MET F 61 ? N MET G 201 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG H 401' AC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG H 402' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG F 501' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 4 ASN B 53 G ASN H 60 . ? 1_555 ? 2 AC1 4 PHE B 54 H PHE H 60 . ? 1_555 ? 3 AC1 4 THR B 55 I THR H 60 . ? 1_555 ? 4 AC1 4 NAG I . ? NAG H 402 . ? 1_555 ? 5 AC2 1 NAG H . ? NAG H 401 . ? 1_555 ? 6 AC3 2 LEU E 46 ? LEU F 60 . ? 1_555 ? 7 AC3 2 ASN E 53 G ASN F 60 . ? 1_555 ? # _database_PDB_matrix.entry_id 1VIT _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 1VIT _atom_sites.fract_transf_matrix[1][1] 0.008591 _atom_sites.fract_transf_matrix[1][2] 0.004960 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.009920 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.004985 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . THR A 1 14 H 25.212 44.090 78.148 1.00 99.50 ? 1 THR L N 1 ATOM 2 C CA . THR A 1 14 H 25.922 43.350 79.198 1.00 99.50 ? 1 THR L CA 1 ATOM 3 C C . THR A 1 14 H 27.344 43.078 78.675 1.00 99.50 ? 1 THR L C 1 ATOM 4 O O . THR A 1 14 H 27.703 43.513 77.579 1.00 111.41 ? 1 THR L O 1 ATOM 5 C CB . THR A 1 14 H 25.265 41.960 79.479 1.00 111.41 ? 1 THR L CB 1 ATOM 6 O OG1 . THR A 1 14 H 25.238 41.181 78.272 1.00 111.41 ? 1 THR L OG1 1 ATOM 7 C CG2 . THR A 1 14 H 23.845 42.116 80.023 1.00 111.41 ? 1 THR L CG2 1 ATOM 8 N N . PHE A 1 15 G 28.136 42.336 79.443 1.00 60.85 ? 1 PHE L N 1 ATOM 9 C CA . PHE A 1 15 G 29.494 41.984 79.026 1.00 60.85 ? 1 PHE L CA 1 ATOM 10 C C . PHE A 1 15 G 29.423 40.645 78.291 1.00 60.85 ? 1 PHE L C 1 ATOM 11 O O . PHE A 1 15 G 30.336 40.268 77.557 1.00 62.72 ? 1 PHE L O 1 ATOM 12 C CB . PHE A 1 15 G 30.423 41.848 80.243 1.00 62.72 ? 1 PHE L CB 1 ATOM 13 C CG . PHE A 1 15 G 30.071 40.698 81.157 1.00 62.72 ? 1 PHE L CG 1 ATOM 14 C CD1 . PHE A 1 15 G 30.483 39.400 80.862 1.00 62.72 ? 1 PHE L CD1 1 ATOM 15 C CD2 . PHE A 1 15 G 29.304 40.912 82.298 1.00 62.72 ? 1 PHE L CD2 1 ATOM 16 C CE1 . PHE A 1 15 G 30.140 38.334 81.683 1.00 62.72 ? 1 PHE L CE1 1 ATOM 17 C CE2 . PHE A 1 15 G 28.952 39.850 83.130 1.00 62.72 ? 1 PHE L CE2 1 ATOM 18 C CZ . PHE A 1 15 G 29.371 38.558 82.820 1.00 62.72 ? 1 PHE L CZ 1 ATOM 19 N N . GLY A 1 16 F 28.347 39.912 78.555 1.00 53.27 ? 1 GLY L N 1 ATOM 20 C CA . GLY A 1 16 F 28.138 38.612 77.950 1.00 53.27 ? 1 GLY L CA 1 ATOM 21 C C . GLY A 1 16 F 27.337 37.763 78.913 1.00 53.27 ? 1 GLY L C 1 ATOM 22 O O . GLY A 1 16 F 27.071 38.188 80.042 1.00 50.21 ? 1 GLY L O 1 ATOM 23 N N . ALA A 1 17 E 26.919 36.585 78.462 1.00 83.24 ? 1 ALA L N 1 ATOM 24 C CA . ALA A 1 17 E 26.153 35.657 79.296 1.00 83.24 ? 1 ALA L CA 1 ATOM 25 C C . ALA A 1 17 E 27.139 34.623 79.850 1.00 83.24 ? 1 ALA L C 1 ATOM 26 O O . ALA A 1 17 E 26.764 33.493 80.168 1.00 29.80 ? 1 ALA L O 1 ATOM 27 C CB . ALA A 1 17 E 25.065 34.967 78.457 1.00 29.80 ? 1 ALA L CB 1 ATOM 28 N N . GLY A 1 18 D 28.402 35.036 79.963 1.00 79.09 ? 1 GLY L N 1 ATOM 29 C CA . GLY A 1 18 D 29.460 34.155 80.427 1.00 79.09 ? 1 GLY L CA 1 ATOM 30 C C . GLY A 1 18 D 30.233 33.685 79.200 1.00 79.09 ? 1 GLY L C 1 ATOM 31 O O . GLY A 1 18 D 31.431 33.406 79.284 1.00 59.92 ? 1 GLY L O 1 ATOM 32 N N . GLU A 1 19 C 29.539 33.699 78.055 1.00 73.99 ? 1 GLU L N 1 ATOM 33 C CA . GLU A 1 19 C 30.026 33.299 76.726 1.00 73.99 ? 1 GLU L CA 1 ATOM 34 C C . GLU A 1 19 C 31.517 33.000 76.575 1.00 73.99 ? 1 GLU L C 1 ATOM 35 O O . GLU A 1 19 C 31.908 31.905 76.167 1.00 59.18 ? 1 GLU L O 1 ATOM 36 C CB . GLU A 1 19 C 29.608 34.340 75.679 1.00 59.18 ? 1 GLU L CB 1 ATOM 37 C CG . GLU A 1 19 C 30.121 35.761 75.940 1.00 59.18 ? 1 GLU L CG 1 ATOM 38 C CD . GLU A 1 19 C 30.280 36.586 74.659 1.00 59.18 ? 1 GLU L CD 1 ATOM 39 O OE1 . GLU A 1 19 C 31.326 36.436 73.983 1.00 59.18 ? 1 GLU L OE1 1 ATOM 40 O OE2 . GLU A 1 19 C 29.370 37.388 74.332 1.00 59.18 ? 1 GLU L OE2 1 ATOM 41 N N . ALA A 1 20 B 32.334 34.011 76.847 1.00 72.23 ? 1 ALA L N 1 ATOM 42 C CA . ALA A 1 20 B 33.782 33.901 76.765 1.00 72.23 ? 1 ALA L CA 1 ATOM 43 C C . ALA A 1 20 B 34.346 34.904 77.765 1.00 72.23 ? 1 ALA L C 1 ATOM 44 O O . ALA A 1 20 B 35.359 35.555 77.520 1.00 68.85 ? 1 ALA L O 1 ATOM 45 C CB . ALA A 1 20 B 34.265 34.213 75.347 1.00 68.85 ? 1 ALA L CB 1 ATOM 46 N N . ASP A 1 21 A 33.629 35.066 78.871 1.00 21.00 ? 1 ASP L N 1 ATOM 47 C CA . ASP A 1 21 A 34.029 35.973 79.935 1.00 21.00 ? 1 ASP L CA 1 ATOM 48 C C . ASP A 1 21 A 34.216 35.106 81.174 1.00 21.00 ? 1 ASP L C 1 ATOM 49 O O . ASP A 1 21 A 34.421 35.606 82.290 1.00 63.62 ? 1 ASP L O 1 ATOM 50 C CB . ASP A 1 21 A 32.933 37.013 80.162 1.00 63.62 ? 1 ASP L CB 1 ATOM 51 C CG . ASP A 1 21 A 33.489 38.372 80.545 1.00 63.62 ? 1 ASP L CG 1 ATOM 52 O OD1 . ASP A 1 21 A 33.947 38.521 81.698 1.00 63.62 ? 1 ASP L OD1 1 ATOM 53 O OD2 . ASP A 1 21 A 33.453 39.296 79.697 1.00 63.62 ? 1 ASP L OD2 1 ATOM 54 N N . CYS A 1 22 ? 34.102 33.796 80.975 1.00 18.01 ? 1 CYS L N 1 ATOM 55 C CA . CYS A 1 22 ? 34.276 32.850 82.061 1.00 18.01 ? 1 CYS L CA 1 ATOM 56 C C . CYS A 1 22 ? 35.738 32.799 82.467 1.00 18.01 ? 1 CYS L C 1 ATOM 57 O O . CYS A 1 22 ? 36.612 33.303 81.759 1.00 2.00 ? 1 CYS L O 1 ATOM 58 C CB . CYS A 1 22 ? 33.805 31.462 81.663 1.00 2.00 ? 1 CYS L CB 1 ATOM 59 S SG . CYS A 1 22 ? 34.658 30.864 80.185 1.00 2.00 ? 1 CYS L SG 1 ATOM 60 N N . GLY A 1 23 ? 35.990 32.227 83.639 1.00 18.68 ? 2 GLY L N 1 ATOM 61 C CA . GLY A 1 23 ? 37.347 32.118 84.136 1.00 18.68 ? 2 GLY L CA 1 ATOM 62 C C . GLY A 1 23 ? 37.925 33.447 84.575 1.00 18.68 ? 2 GLY L C 1 ATOM 63 O O . GLY A 1 23 ? 38.926 33.471 85.277 1.00 3.03 ? 2 GLY L O 1 ATOM 64 N N . LEU A 1 24 ? 37.300 34.553 84.187 1.00 15.16 ? 3 LEU L N 1 ATOM 65 C CA . LEU A 1 24 ? 37.805 35.869 84.561 1.00 15.16 ? 3 LEU L CA 1 ATOM 66 C C . LEU A 1 24 ? 37.214 36.407 85.852 1.00 15.16 ? 3 LEU L C 1 ATOM 67 O O . LEU A 1 24 ? 36.258 37.181 85.846 1.00 2.00 ? 3 LEU L O 1 ATOM 68 C CB . LEU A 1 24 ? 37.620 36.868 83.418 1.00 2.00 ? 3 LEU L CB 1 ATOM 69 C CG . LEU A 1 24 ? 38.486 36.603 82.181 1.00 2.00 ? 3 LEU L CG 1 ATOM 70 C CD1 . LEU A 1 24 ? 38.515 37.871 81.340 1.00 2.00 ? 3 LEU L CD1 1 ATOM 71 C CD2 . LEU A 1 24 ? 39.921 36.198 82.575 1.00 2.00 ? 3 LEU L CD2 1 ATOM 72 N N . ARG A 1 25 ? 37.825 35.990 86.954 1.00 2.00 ? 4 ARG L N 1 ATOM 73 C CA . ARG A 1 25 ? 37.419 36.368 88.303 1.00 2.00 ? 4 ARG L CA 1 ATOM 74 C C . ARG A 1 25 ? 37.252 37.874 88.531 1.00 2.00 ? 4 ARG L C 1 ATOM 75 O O . ARG A 1 25 ? 38.206 38.638 88.406 1.00 2.00 ? 4 ARG L O 1 ATOM 76 C CB . ARG A 1 25 ? 38.452 35.862 89.310 1.00 2.00 ? 4 ARG L CB 1 ATOM 77 C CG . ARG A 1 25 ? 38.740 34.389 89.301 1.00 2.00 ? 4 ARG L CG 1 ATOM 78 C CD . ARG A 1 25 ? 39.099 33.996 90.708 1.00 2.00 ? 4 ARG L CD 1 ATOM 79 N NE . ARG A 1 25 ? 40.330 33.224 90.838 1.00 2.00 ? 4 ARG L NE 1 ATOM 80 C CZ . ARG A 1 25 ? 41.557 33.695 90.628 1.00 2.00 ? 4 ARG L CZ 1 ATOM 81 N NH1 . ARG A 1 25 ? 41.743 34.926 90.193 1.00 2.00 ? 4 ARG L NH1 1 ATOM 82 N NH2 . ARG A 1 25 ? 42.604 32.905 90.804 1.00 2.00 ? 4 ARG L NH2 1 ATOM 83 N N . PRO A 1 26 ? 36.062 38.290 88.992 1.00 6.78 ? 5 PRO L N 1 ATOM 84 C CA . PRO A 1 26 ? 35.729 39.689 89.270 1.00 6.78 ? 5 PRO L CA 1 ATOM 85 C C . PRO A 1 26 ? 36.647 40.344 90.296 1.00 6.78 ? 5 PRO L C 1 ATOM 86 O O . PRO A 1 26 ? 37.083 41.486 90.125 1.00 2.00 ? 5 PRO L O 1 ATOM 87 C CB . PRO A 1 26 ? 34.299 39.583 89.808 1.00 2.00 ? 5 PRO L CB 1 ATOM 88 C CG . PRO A 1 26 ? 33.748 38.410 89.057 1.00 2.00 ? 5 PRO L CG 1 ATOM 89 C CD . PRO A 1 26 ? 34.881 37.431 89.186 1.00 2.00 ? 5 PRO L CD 1 ATOM 90 N N . LEU A 1 27 ? 36.932 39.624 91.369 1.00 5.46 ? 6 LEU L N 1 ATOM 91 C CA . LEU A 1 27 ? 37.777 40.175 92.412 1.00 5.46 ? 6 LEU L CA 1 ATOM 92 C C . LEU A 1 27 ? 39.259 39.979 92.133 1.00 5.46 ? 6 LEU L C 1 ATOM 93 O O . LEU A 1 27 ? 40.095 40.323 92.962 1.00 2.00 ? 6 LEU L O 1 ATOM 94 C CB . LEU A 1 27 ? 37.391 39.598 93.785 1.00 2.00 ? 6 LEU L CB 1 ATOM 95 C CG . LEU A 1 27 ? 35.915 39.673 94.202 1.00 2.00 ? 6 LEU L CG 1 ATOM 96 C CD1 . LEU A 1 27 ? 35.734 38.862 95.440 1.00 2.00 ? 6 LEU L CD1 1 ATOM 97 C CD2 . LEU A 1 27 ? 35.439 41.082 94.443 1.00 2.00 ? 6 LEU L CD2 1 ATOM 98 N N . PHE A 1 28 ? 39.598 39.442 90.968 1.00 2.00 ? 7 PHE L N 1 ATOM 99 C CA . PHE A 1 28 ? 40.997 39.237 90.662 1.00 2.00 ? 7 PHE L CA 1 ATOM 100 C C . PHE A 1 28 ? 41.356 39.624 89.237 1.00 2.00 ? 7 PHE L C 1 ATOM 101 O O . PHE A 1 28 ? 41.760 40.740 88.986 1.00 2.00 ? 7 PHE L O 1 ATOM 102 C CB . PHE A 1 28 ? 41.397 37.793 90.931 1.00 2.00 ? 7 PHE L CB 1 ATOM 103 C CG . PHE A 1 28 ? 41.492 37.426 92.393 1.00 2.00 ? 7 PHE L CG 1 ATOM 104 C CD1 . PHE A 1 28 ? 42.653 37.682 93.116 1.00 2.00 ? 7 PHE L CD1 1 ATOM 105 C CD2 . PHE A 1 28 ? 40.457 36.721 93.020 1.00 2.00 ? 7 PHE L CD2 1 ATOM 106 C CE1 . PHE A 1 28 ? 42.782 37.226 94.444 1.00 2.00 ? 7 PHE L CE1 1 ATOM 107 C CE2 . PHE A 1 28 ? 40.572 36.262 94.340 1.00 2.00 ? 7 PHE L CE2 1 ATOM 108 C CZ . PHE A 1 28 ? 41.731 36.510 95.053 1.00 2.00 ? 7 PHE L CZ 1 ATOM 109 N N . GLU A 1 29 ? 41.191 38.706 88.298 1.00 33.68 ? 8 GLU L N 1 ATOM 110 C CA . GLU A 1 29 ? 41.523 38.963 86.895 1.00 33.68 ? 8 GLU L CA 1 ATOM 111 C C . GLU A 1 29 ? 40.962 40.278 86.363 1.00 33.68 ? 8 GLU L C 1 ATOM 112 O O . GLU A 1 29 ? 41.656 41.009 85.660 1.00 2.00 ? 8 GLU L O 1 ATOM 113 C CB . GLU A 1 29 ? 41.075 37.800 86.002 1.00 2.00 ? 8 GLU L CB 1 ATOM 114 C CG . GLU A 1 29 ? 42.063 36.645 85.915 1.00 2.00 ? 8 GLU L CG 1 ATOM 115 C CD . GLU A 1 29 ? 42.302 35.950 87.244 1.00 2.00 ? 8 GLU L CD 1 ATOM 116 O OE1 . GLU A 1 29 ? 41.500 35.065 87.618 1.00 2.00 ? 8 GLU L OE1 1 ATOM 117 O OE2 . GLU A 1 29 ? 43.309 36.277 87.905 1.00 2.00 ? 8 GLU L OE2 1 ATOM 118 N N . LYS A 1 30 ? 39.711 40.576 86.693 1.00 2.00 ? 9 LYS L N 1 ATOM 119 C CA . LYS A 1 30 ? 39.087 41.816 86.252 1.00 2.00 ? 9 LYS L CA 1 ATOM 120 C C . LYS A 1 30 ? 39.568 43.011 87.097 1.00 2.00 ? 9 LYS L C 1 ATOM 121 O O . LYS A 1 30 ? 39.390 44.164 86.714 1.00 2.00 ? 9 LYS L O 1 ATOM 122 C CB . LYS A 1 30 ? 37.557 41.707 86.342 1.00 2.00 ? 9 LYS L CB 1 ATOM 123 C CG . LYS A 1 30 ? 36.922 40.657 85.441 1.00 2.00 ? 9 LYS L CG 1 ATOM 124 C CD . LYS A 1 30 ? 35.392 40.792 85.406 1.00 2.00 ? 9 LYS L CD 1 ATOM 125 C CE . LYS A 1 30 ? 34.764 39.711 84.523 1.00 2.00 ? 9 LYS L CE 1 ATOM 126 N NZ . LYS A 1 30 ? 33.285 39.621 84.617 1.00 2.00 ? 9 LYS L NZ 1 ATOM 127 N N . LYS A 1 31 ? 40.207 42.733 88.227 1.00 2.00 ? 10 LYS L N 1 ATOM 128 C CA . LYS A 1 31 ? 40.687 43.781 89.132 1.00 2.00 ? 10 LYS L CA 1 ATOM 129 C C . LYS A 1 31 ? 42.222 43.866 89.182 1.00 2.00 ? 10 LYS L C 1 ATOM 130 O O . LYS A 1 31 ? 42.802 44.413 90.126 1.00 16.95 ? 10 LYS L O 1 ATOM 131 C CB . LYS A 1 31 ? 40.125 43.508 90.537 1.00 16.95 ? 10 LYS L CB 1 ATOM 132 C CG . LYS A 1 31 ? 40.415 44.558 91.606 1.00 16.95 ? 10 LYS L CG 1 ATOM 133 C CD . LYS A 1 31 ? 39.704 44.200 92.910 1.00 16.95 ? 10 LYS L CD 1 ATOM 134 C CE . LYS A 1 31 ? 39.888 45.255 93.996 1.00 16.95 ? 10 LYS L CE 1 ATOM 135 N NZ . LYS A 1 31 ? 41.213 45.219 94.674 1.00 16.95 ? 10 LYS L NZ 1 ATOM 136 N N . GLN A 1 32 ? 42.876 43.285 88.183 1.00 18.58 ? 11 GLN L N 1 ATOM 137 C CA . GLN A 1 32 ? 44.339 43.278 88.087 1.00 18.58 ? 11 GLN L CA 1 ATOM 138 C C . GLN A 1 32 ? 45.091 42.676 89.284 1.00 18.58 ? 11 GLN L C 1 ATOM 139 O O . GLN A 1 32 ? 46.328 42.713 89.330 1.00 35.26 ? 11 GLN L O 1 ATOM 140 C CB . GLN A 1 32 ? 44.873 44.684 87.783 1.00 35.26 ? 11 GLN L CB 1 ATOM 141 C CG . GLN A 1 32 ? 46.019 44.685 86.791 1.00 35.26 ? 11 GLN L CG 1 ATOM 142 C CD . GLN A 1 32 ? 45.681 43.882 85.545 1.00 35.26 ? 11 GLN L CD 1 ATOM 143 O OE1 . GLN A 1 32 ? 46.268 42.825 85.292 1.00 35.26 ? 11 GLN L OE1 1 ATOM 144 N NE2 . GLN A 1 32 ? 44.700 44.362 84.778 1.00 35.26 ? 11 GLN L NE2 1 ATOM 145 N N . VAL A 1 33 ? 44.357 42.087 90.226 1.00 29.06 ? 12 VAL L N 1 ATOM 146 C CA . VAL A 1 33 ? 44.981 41.469 91.395 1.00 29.06 ? 12 VAL L CA 1 ATOM 147 C C . VAL A 1 33 ? 45.099 39.920 91.354 1.00 29.06 ? 12 VAL L C 1 ATOM 148 O O . VAL A 1 33 ? 44.142 39.212 91.024 1.00 2.00 ? 12 VAL L O 1 ATOM 149 C CB . VAL A 1 33 ? 44.341 41.986 92.741 1.00 2.00 ? 12 VAL L CB 1 ATOM 150 C CG1 . VAL A 1 33 ? 42.894 41.516 92.893 1.00 2.00 ? 12 VAL L CG1 1 ATOM 151 C CG2 . VAL A 1 33 ? 45.201 41.572 93.947 1.00 2.00 ? 12 VAL L CG2 1 ATOM 152 N N . GLN A 1 34 ? 46.313 39.425 91.607 1.00 15.44 ? 13 GLN L N 1 ATOM 153 C CA . GLN A 1 34 ? 46.622 37.990 91.635 1.00 15.44 ? 13 GLN L CA 1 ATOM 154 C C . GLN A 1 34 ? 46.308 37.401 93.006 1.00 15.44 ? 13 GLN L C 1 ATOM 155 O O . GLN A 1 34 ? 46.162 38.141 93.977 1.00 32.79 ? 13 GLN L O 1 ATOM 156 C CB . GLN A 1 34 ? 48.119 37.758 91.400 1.00 32.79 ? 13 GLN L CB 1 ATOM 157 C CG . GLN A 1 34 ? 48.647 38.092 90.009 1.00 32.79 ? 13 GLN L CG 1 ATOM 158 C CD . GLN A 1 34 ? 50.020 37.471 89.744 1.00 32.79 ? 13 GLN L CD 1 ATOM 159 O OE1 . GLN A 1 34 ? 50.124 36.291 89.398 1.00 32.79 ? 13 GLN L OE1 1 ATOM 160 N NE2 . GLN A 1 34 ? 51.073 38.260 89.913 1.00 32.79 ? 13 GLN L NE2 1 ATOM 161 N N . ASP A 1 35 ? 46.227 36.076 93.099 1.00 23.86 ? 14 ASP L N 1 ATOM 162 C CA . ASP A 1 35 ? 45.973 35.460 94.399 1.00 23.86 ? 14 ASP L CA 1 ATOM 163 C C . ASP A 1 35 ? 47.242 34.877 95.014 1.00 23.86 ? 14 ASP L C 1 ATOM 164 O O . ASP A 1 35 ? 48.222 34.623 94.311 1.00 2.00 ? 14 ASP L O 1 ATOM 165 C CB . ASP A 1 35 ? 44.805 34.444 94.379 1.00 2.00 ? 14 ASP L CB 1 ATOM 166 C CG . ASP A 1 35 ? 45.143 33.134 93.690 1.00 2.00 ? 14 ASP L CG 1 ATOM 167 O OD1 . ASP A 1 35 ? 45.933 32.328 94.236 1.00 2.00 ? 14 ASP L OD1 1 ATOM 168 O OD2 . ASP A 1 35 ? 44.552 32.883 92.620 1.00 2.00 ? 14 ASP L OD2 1 ATOM 169 N N . GLN A 1 36 A 47.200 34.646 96.322 1.00 2.00 ? 14 GLN L N 1 ATOM 170 C CA . GLN A 1 36 A 48.337 34.131 97.072 1.00 2.00 ? 14 GLN L CA 1 ATOM 171 C C . GLN A 1 36 A 49.019 32.874 96.500 1.00 2.00 ? 14 GLN L C 1 ATOM 172 O O . GLN A 1 36 A 50.253 32.794 96.442 1.00 28.85 ? 14 GLN L O 1 ATOM 173 C CB . GLN A 1 36 A 47.930 33.915 98.530 1.00 28.85 ? 14 GLN L CB 1 ATOM 174 C CG . GLN A 1 36 A 46.850 32.878 98.713 1.00 28.85 ? 14 GLN L CG 1 ATOM 175 C CD . GLN A 1 36 A 46.372 32.770 100.142 1.00 28.85 ? 14 GLN L CD 1 ATOM 176 O OE1 . GLN A 1 36 A 47.156 32.900 101.077 1.00 28.85 ? 14 GLN L OE1 1 ATOM 177 N NE2 . GLN A 1 36 A 45.081 32.514 100.321 1.00 28.85 ? 14 GLN L NE2 1 ATOM 178 N N . THR A 1 37 B 48.230 31.931 96.004 1.00 2.00 ? 14 THR L N 1 ATOM 179 C CA . THR A 1 37 B 48.797 30.700 95.481 1.00 2.00 ? 14 THR L CA 1 ATOM 180 C C . THR A 1 37 B 48.856 30.578 93.954 1.00 2.00 ? 14 THR L C 1 ATOM 181 O O . THR A 1 37 B 49.351 29.593 93.405 1.00 5.39 ? 14 THR L O 1 ATOM 182 C CB . THR A 1 37 B 48.095 29.513 96.132 1.00 5.39 ? 14 THR L CB 1 ATOM 183 O OG1 . THR A 1 37 B 48.213 29.658 97.559 1.00 5.39 ? 14 THR L OG1 1 ATOM 184 C CG2 . THR A 1 37 B 48.705 28.174 95.686 1.00 5.39 ? 14 THR L CG2 1 ATOM 185 N N . GLU A 1 38 C 48.459 31.639 93.273 1.00 2.00 ? 14 GLU L N 1 ATOM 186 C CA . GLU A 1 38 C 48.457 31.675 91.817 1.00 2.00 ? 14 GLU L CA 1 ATOM 187 C C . GLU A 1 38 C 49.802 31.319 91.179 1.00 2.00 ? 14 GLU L C 1 ATOM 188 O O . GLU A 1 38 C 49.879 30.383 90.382 1.00 2.00 ? 14 GLU L O 1 ATOM 189 C CB . GLU A 1 38 C 48.021 33.064 91.371 1.00 2.00 ? 14 GLU L CB 1 ATOM 190 C CG . GLU A 1 38 C 47.501 33.139 89.978 1.00 2.00 ? 14 GLU L CG 1 ATOM 191 C CD . GLU A 1 38 C 46.539 34.280 89.826 1.00 2.00 ? 14 GLU L CD 1 ATOM 192 O OE1 . GLU A 1 38 C 46.995 35.406 89.591 1.00 2.00 ? 14 GLU L OE1 1 ATOM 193 O OE2 . GLU A 1 38 C 45.323 34.055 89.959 1.00 2.00 ? 14 GLU L OE2 1 ATOM 194 N N . LYS A 1 39 D 50.858 32.043 91.560 1.00 17.11 ? 14 LYS L N 1 ATOM 195 C CA . LYS A 1 39 D 52.221 31.839 91.032 1.00 17.11 ? 14 LYS L CA 1 ATOM 196 C C . LYS A 1 39 D 52.674 30.388 91.041 1.00 17.11 ? 14 LYS L C 1 ATOM 197 O O . LYS A 1 39 D 53.419 29.970 90.163 1.00 2.00 ? 14 LYS L O 1 ATOM 198 C CB . LYS A 1 39 D 53.254 32.670 91.812 1.00 2.00 ? 14 LYS L CB 1 ATOM 199 C CG . LYS A 1 39 D 52.942 34.142 91.856 1.00 2.00 ? 14 LYS L CG 1 ATOM 200 C CD . LYS A 1 39 D 52.578 34.587 93.255 1.00 2.00 ? 14 LYS L CD 1 ATOM 201 C CE . LYS A 1 39 D 51.662 35.785 93.226 1.00 2.00 ? 14 LYS L CE 1 ATOM 202 N NZ . LYS A 1 39 D 50.337 35.345 92.748 1.00 2.00 ? 14 LYS L NZ 1 ATOM 203 N N . GLU A 1 40 E 52.219 29.630 92.032 1.00 2.00 ? 14 GLU L N 1 ATOM 204 C CA . GLU A 1 40 E 52.581 28.240 92.169 1.00 2.00 ? 14 GLU L CA 1 ATOM 205 C C . GLU A 1 40 E 52.261 27.480 90.864 1.00 2.00 ? 14 GLU L C 1 ATOM 206 O O . GLU A 1 40 E 53.079 26.678 90.361 1.00 6.85 ? 14 GLU L O 1 ATOM 207 C CB . GLU A 1 40 E 51.825 27.655 93.363 1.00 6.85 ? 14 GLU L CB 1 ATOM 208 C CG . GLU A 1 40 E 52.518 26.499 94.080 1.00 6.85 ? 14 GLU L CG 1 ATOM 209 C CD . GLU A 1 40 E 51.730 26.002 95.283 1.00 6.85 ? 14 GLU L CD 1 ATOM 210 O OE1 . GLU A 1 40 E 51.422 26.827 96.174 1.00 6.85 ? 14 GLU L OE1 1 ATOM 211 O OE2 . GLU A 1 40 E 51.421 24.786 95.340 1.00 6.85 ? 14 GLU L OE2 1 ATOM 212 N N . LEU A 1 41 F 51.093 27.777 90.294 1.00 2.00 ? 14 LEU L N 1 ATOM 213 C CA . LEU A 1 41 F 50.632 27.155 89.055 1.00 2.00 ? 14 LEU L CA 1 ATOM 214 C C . LEU A 1 41 F 51.525 27.452 87.862 1.00 2.00 ? 14 LEU L C 1 ATOM 215 O O . LEU A 1 41 F 52.053 26.545 87.239 1.00 2.00 ? 14 LEU L O 1 ATOM 216 C CB . LEU A 1 41 F 49.231 27.639 88.735 1.00 2.00 ? 14 LEU L CB 1 ATOM 217 C CG . LEU A 1 41 F 48.160 27.210 89.721 1.00 2.00 ? 14 LEU L CG 1 ATOM 218 C CD1 . LEU A 1 41 F 46.870 27.978 89.424 1.00 2.00 ? 14 LEU L CD1 1 ATOM 219 C CD2 . LEU A 1 41 F 47.966 25.698 89.618 1.00 2.00 ? 14 LEU L CD2 1 ATOM 220 N N . PHE A 1 42 G 51.675 28.733 87.536 1.00 7.71 ? 14 PHE L N 1 ATOM 221 C CA . PHE A 1 42 G 52.507 29.162 86.408 1.00 7.71 ? 14 PHE L CA 1 ATOM 222 C C . PHE A 1 42 G 53.955 28.699 86.549 1.00 7.71 ? 14 PHE L C 1 ATOM 223 O O . PHE A 1 42 G 54.573 28.282 85.571 1.00 9.53 ? 14 PHE L O 1 ATOM 224 C CB . PHE A 1 42 G 52.413 30.677 86.206 1.00 9.53 ? 14 PHE L CB 1 ATOM 225 C CG . PHE A 1 42 G 51.022 31.153 85.840 1.00 9.53 ? 14 PHE L CG 1 ATOM 226 C CD1 . PHE A 1 42 G 50.181 30.357 85.063 1.00 9.53 ? 14 PHE L CD1 1 ATOM 227 C CD2 . PHE A 1 42 G 50.552 32.393 86.278 1.00 9.53 ? 14 PHE L CD2 1 ATOM 228 C CE1 . PHE A 1 42 G 48.901 30.784 84.730 1.00 9.53 ? 14 PHE L CE1 1 ATOM 229 C CE2 . PHE A 1 42 G 49.267 32.826 85.944 1.00 9.53 ? 14 PHE L CE2 1 ATOM 230 C CZ . PHE A 1 42 G 48.446 32.016 85.169 1.00 9.53 ? 14 PHE L CZ 1 ATOM 231 N N . GLU A 1 43 H 54.457 28.711 87.781 1.00 2.00 ? 14 GLU L N 1 ATOM 232 C CA . GLU A 1 43 H 55.807 28.254 88.112 1.00 2.00 ? 14 GLU L CA 1 ATOM 233 C C . GLU A 1 43 H 55.950 26.780 87.684 1.00 2.00 ? 14 GLU L C 1 ATOM 234 O O . GLU A 1 43 H 57.010 26.362 87.226 1.00 2.04 ? 14 GLU L O 1 ATOM 235 C CB . GLU A 1 43 H 56.012 28.364 89.629 1.00 2.04 ? 14 GLU L CB 1 ATOM 236 C CG . GLU A 1 43 H 57.422 28.095 90.145 1.00 2.04 ? 14 GLU L CG 1 ATOM 237 C CD . GLU A 1 43 H 58.137 29.366 90.608 1.00 2.04 ? 14 GLU L CD 1 ATOM 238 O OE1 . GLU A 1 43 H 57.452 30.331 91.026 1.00 2.04 ? 14 GLU L OE1 1 ATOM 239 O OE2 . GLU A 1 43 H 59.390 29.399 90.562 1.00 2.04 ? 14 GLU L OE2 1 ATOM 240 N N . SER A 1 44 I 54.876 26.001 87.834 1.00 2.00 ? 14 SER L N 1 ATOM 241 C CA . SER A 1 44 I 54.879 24.583 87.460 1.00 2.00 ? 14 SER L CA 1 ATOM 242 C C . SER A 1 44 I 54.768 24.277 85.961 1.00 2.00 ? 14 SER L C 1 ATOM 243 O O . SER A 1 44 I 55.281 23.261 85.512 1.00 2.00 ? 14 SER L O 1 ATOM 244 C CB . SER A 1 44 I 53.811 23.801 88.243 1.00 2.00 ? 14 SER L CB 1 ATOM 245 O OG . SER A 1 44 I 52.523 24.386 88.143 1.00 2.00 ? 14 SER L OG 1 ATOM 246 N N . TYR A 1 45 J 54.094 25.132 85.188 1.00 13.40 ? 14 TYR L N 1 ATOM 247 C CA . TYR A 1 45 J 53.970 24.911 83.740 1.00 13.40 ? 14 TYR L CA 1 ATOM 248 C C . TYR A 1 45 J 55.312 25.134 83.043 1.00 13.40 ? 14 TYR L C 1 ATOM 249 O O . TYR A 1 45 J 55.419 24.935 81.835 1.00 2.00 ? 14 TYR L O 1 ATOM 250 C CB . TYR A 1 45 J 52.953 25.854 83.097 1.00 2.00 ? 14 TYR L CB 1 ATOM 251 C CG . TYR A 1 45 J 51.547 25.810 83.647 1.00 2.00 ? 14 TYR L CG 1 ATOM 252 C CD1 . TYR A 1 45 J 51.102 24.755 84.432 1.00 2.00 ? 14 TYR L CD1 1 ATOM 253 C CD2 . TYR A 1 45 J 50.675 26.867 83.415 1.00 2.00 ? 14 TYR L CD2 1 ATOM 254 C CE1 . TYR A 1 45 J 49.813 24.763 84.986 1.00 2.00 ? 14 TYR L CE1 1 ATOM 255 C CE2 . TYR A 1 45 J 49.397 26.888 83.954 1.00 2.00 ? 14 TYR L CE2 1 ATOM 256 C CZ . TYR A 1 45 J 48.965 25.843 84.743 1.00 2.00 ? 14 TYR L CZ 1 ATOM 257 O OH . TYR A 1 45 J 47.705 25.918 85.312 1.00 2.00 ? 14 TYR L OH 1 ATOM 258 N N . ILE A 1 46 K 56.309 25.596 83.800 1.00 25.24 ? 14 ILE L N 1 ATOM 259 C CA . ILE A 1 46 K 57.664 25.848 83.308 1.00 25.24 ? 14 ILE L CA 1 ATOM 260 C C . ILE A 1 46 K 57.785 26.952 82.263 1.00 25.24 ? 14 ILE L C 1 ATOM 261 O O . ILE A 1 46 K 58.527 27.908 82.472 1.00 52.26 ? 14 ILE L O 1 ATOM 262 C CB . ILE A 1 46 K 58.360 24.534 82.803 1.00 52.26 ? 14 ILE L CB 1 ATOM 263 C CG1 . ILE A 1 46 K 59.245 23.928 83.901 1.00 52.26 ? 14 ILE L CG1 1 ATOM 264 C CG2 . ILE A 1 46 K 59.216 24.793 81.565 1.00 52.26 ? 14 ILE L CG2 1 ATOM 265 C CD1 . ILE A 1 46 K 58.497 23.281 85.045 1.00 52.26 ? 14 ILE L CD1 1 ATOM 266 N N . GLU A 1 47 L 57.085 26.808 81.137 1.00 71.40 ? 14 GLU L N 1 ATOM 267 C CA . GLU A 1 47 L 57.132 27.790 80.047 1.00 71.40 ? 14 GLU L CA 1 ATOM 268 C C . GLU A 1 47 L 56.688 29.182 80.472 1.00 71.40 ? 14 GLU L C 1 ATOM 269 O O . GLU A 1 47 L 55.511 29.425 80.749 1.00 54.67 ? 14 GLU L O 1 ATOM 270 C CB . GLU A 1 47 L 56.293 27.329 78.842 1.00 54.67 ? 14 GLU L CB 1 ATOM 271 C CG . GLU A 1 47 L 56.404 28.225 77.592 1.00 54.67 ? 14 GLU L CG 1 ATOM 272 C CD . GLU A 1 47 L 57.689 28.006 76.796 1.00 54.67 ? 14 GLU L CD 1 ATOM 273 O OE1 . GLU A 1 47 L 58.791 27.990 77.392 1.00 54.67 ? 14 GLU L OE1 1 ATOM 274 O OE2 . GLU A 1 47 L 57.593 27.851 75.560 1.00 54.67 ? 14 GLU L OE2 1 ATOM 275 N N . GLY A 1 48 M 57.652 30.086 80.549 1.00 41.77 ? 14 GLY L N 1 ATOM 276 C CA . GLY A 1 48 M 57.344 31.443 80.928 1.00 41.77 ? 14 GLY L CA 1 ATOM 277 C C . GLY A 1 48 M 57.140 32.267 79.680 1.00 41.77 ? 14 GLY L C 1 ATOM 278 O O . GLY A 1 48 M 57.225 31.756 78.553 1.00 36.37 ? 14 GLY L O 1 ATOM 279 N N . ARG A 1 49 ? 56.801 33.530 79.893 1.00 42.69 ? 15 ARG L N 1 ATOM 280 C CA . ARG A 1 49 ? 56.594 34.473 78.808 1.00 42.69 ? 15 ARG L CA 1 ATOM 281 C C . ARG A 1 49 ? 57.766 35.447 78.923 1.00 42.69 ? 15 ARG L C 1 ATOM 282 O O . ARG A 1 49 ? 58.502 35.633 77.931 1.00 59.96 ? 15 ARG L O 1 ATOM 283 C CB . ARG A 1 49 ? 55.256 35.210 78.978 1.00 59.96 ? 15 ARG L CB 1 ATOM 284 C CG . ARG A 1 49 ? 54.055 34.311 79.328 1.00 59.96 ? 15 ARG L CG 1 ATOM 285 C CD . ARG A 1 49 ? 53.745 33.255 78.252 1.00 59.96 ? 15 ARG L CD 1 ATOM 286 N NE . ARG A 1 49 ? 53.952 31.876 78.718 1.00 59.96 ? 15 ARG L NE 1 ATOM 287 C CZ . ARG A 1 49 ? 53.336 30.802 78.214 1.00 59.96 ? 15 ARG L CZ 1 ATOM 288 N NH1 . ARG A 1 49 ? 52.453 30.931 77.229 1.00 59.96 ? 15 ARG L NH1 1 ATOM 289 N NH2 . ARG A 1 49 ? 53.592 29.594 78.701 1.00 59.96 ? 15 ARG L NH2 1 ATOM 290 O OXT . ARG A 1 49 ? 57.971 35.957 80.046 1.00 59.96 ? 15 ARG L OXT 1 ATOM 291 N N . ILE B 2 1 ? 39.406 19.560 102.487 1.00 12.54 ? 16 ILE H N 1 ATOM 292 C CA . ILE B 2 1 ? 40.709 19.322 101.804 1.00 12.54 ? 16 ILE H CA 1 ATOM 293 C C . ILE B 2 1 ? 41.888 19.172 102.788 1.00 12.54 ? 16 ILE H C 1 ATOM 294 O O . ILE B 2 1 ? 41.990 19.916 103.776 1.00 2.00 ? 16 ILE H O 1 ATOM 295 C CB . ILE B 2 1 ? 40.951 20.416 100.720 1.00 2.00 ? 16 ILE H CB 1 ATOM 296 C CG1 . ILE B 2 1 ? 40.379 19.931 99.389 1.00 2.00 ? 16 ILE H CG1 1 ATOM 297 C CG2 . ILE B 2 1 ? 42.426 20.770 100.592 1.00 2.00 ? 16 ILE H CG2 1 ATOM 298 C CD1 . ILE B 2 1 ? 40.245 20.979 98.340 1.00 2.00 ? 16 ILE H CD1 1 ATOM 299 N N . VAL B 2 2 ? 42.731 18.167 102.518 1.00 23.98 ? 17 VAL H N 1 ATOM 300 C CA . VAL B 2 2 ? 43.918 17.834 103.323 1.00 23.98 ? 17 VAL H CA 1 ATOM 301 C C . VAL B 2 2 ? 45.171 18.619 102.914 1.00 23.98 ? 17 VAL H C 1 ATOM 302 O O . VAL B 2 2 ? 45.605 18.554 101.765 1.00 2.00 ? 17 VAL H O 1 ATOM 303 C CB . VAL B 2 2 ? 44.245 16.325 103.229 1.00 2.00 ? 17 VAL H CB 1 ATOM 304 C CG1 . VAL B 2 2 ? 45.356 15.963 104.188 1.00 2.00 ? 17 VAL H CG1 1 ATOM 305 C CG2 . VAL B 2 2 ? 43.010 15.504 103.534 1.00 2.00 ? 17 VAL H CG2 1 ATOM 306 N N . GLU B 2 3 ? 45.755 19.337 103.872 1.00 36.64 ? 18 GLU H N 1 ATOM 307 C CA . GLU B 2 3 ? 46.962 20.137 103.648 1.00 36.64 ? 18 GLU H CA 1 ATOM 308 C C . GLU B 2 3 ? 46.788 21.323 102.678 1.00 36.64 ? 18 GLU H C 1 ATOM 309 O O . GLU B 2 3 ? 47.557 21.495 101.723 1.00 2.00 ? 18 GLU H O 1 ATOM 310 C CB . GLU B 2 3 ? 48.117 19.232 103.193 1.00 2.00 ? 18 GLU H CB 1 ATOM 311 C CG . GLU B 2 3 ? 48.570 18.201 104.228 1.00 2.00 ? 18 GLU H CG 1 ATOM 312 C CD . GLU B 2 3 ? 49.424 18.793 105.340 1.00 2.00 ? 18 GLU H CD 1 ATOM 313 O OE1 . GLU B 2 3 ? 49.554 20.039 105.407 1.00 2.00 ? 18 GLU H OE1 1 ATOM 314 O OE2 . GLU B 2 3 ? 49.974 18.003 106.144 1.00 2.00 ? 18 GLU H OE2 1 ATOM 315 N N . GLY B 2 4 ? 45.803 22.166 102.960 1.00 2.00 ? 19 GLY H N 1 ATOM 316 C CA . GLY B 2 4 ? 45.565 23.311 102.110 1.00 2.00 ? 19 GLY H CA 1 ATOM 317 C C . GLY B 2 4 ? 45.528 24.595 102.897 1.00 2.00 ? 19 GLY H C 1 ATOM 318 O O . GLY B 2 4 ? 45.617 24.575 104.122 1.00 37.58 ? 19 GLY H O 1 ATOM 319 N N . GLN B 2 5 ? 45.413 25.713 102.186 1.00 10.12 ? 20 GLN H N 1 ATOM 320 C CA . GLN B 2 5 ? 45.349 27.044 102.787 1.00 10.12 ? 20 GLN H CA 1 ATOM 321 C C . GLN B 2 5 ? 43.895 27.515 102.736 1.00 10.12 ? 20 GLN H C 1 ATOM 322 O O . GLN B 2 5 ? 43.022 26.840 102.169 1.00 23.96 ? 20 GLN H O 1 ATOM 323 C CB . GLN B 2 5 ? 46.198 28.042 101.980 1.00 23.96 ? 20 GLN H CB 1 ATOM 324 C CG . GLN B 2 5 ? 47.687 27.728 101.840 1.00 23.96 ? 20 GLN H CG 1 ATOM 325 C CD . GLN B 2 5 ? 47.999 26.524 100.942 1.00 23.96 ? 20 GLN H CD 1 ATOM 326 O OE1 . GLN B 2 5 ? 49.029 25.870 101.111 1.00 23.96 ? 20 GLN H OE1 1 ATOM 327 N NE2 . GLN B 2 5 ? 47.123 26.234 99.991 1.00 23.96 ? 20 GLN H NE2 1 ATOM 328 N N . ASP B 2 6 ? 43.646 28.684 103.318 1.00 27.09 ? 21 ASP H N 1 ATOM 329 C CA . ASP B 2 6 ? 42.309 29.262 103.319 1.00 27.09 ? 21 ASP H CA 1 ATOM 330 C C . ASP B 2 6 ? 42.105 30.077 102.045 1.00 27.09 ? 21 ASP H C 1 ATOM 331 O O . ASP B 2 6 ? 42.931 30.923 101.662 1.00 22.14 ? 21 ASP H O 1 ATOM 332 C CB . ASP B 2 6 ? 42.070 30.128 104.567 1.00 22.14 ? 21 ASP H CB 1 ATOM 333 C CG . ASP B 2 6 ? 41.310 29.385 105.675 1.00 22.14 ? 21 ASP H CG 1 ATOM 334 O OD1 . ASP B 2 6 ? 41.226 28.138 105.644 1.00 22.14 ? 21 ASP H OD1 1 ATOM 335 O OD2 . ASP B 2 6 ? 40.780 30.055 106.587 1.00 22.14 ? 21 ASP H OD2 1 ATOM 336 N N . ALA B 2 7 ? 41.028 29.751 101.348 1.00 49.44 ? 22 ALA H N 1 ATOM 337 C CA . ALA B 2 7 ? 40.680 30.434 100.119 1.00 49.44 ? 22 ALA H CA 1 ATOM 338 C C . ALA B 2 7 ? 40.439 31.898 100.408 1.00 49.44 ? 22 ALA H C 1 ATOM 339 O O . ALA B 2 7 ? 40.002 32.267 101.491 1.00 37.03 ? 22 ALA H O 1 ATOM 340 C CB . ALA B 2 7 ? 39.428 29.820 99.507 1.00 37.03 ? 22 ALA H CB 1 ATOM 341 N N . GLU B 2 8 ? 40.723 32.732 99.427 1.00 2.00 ? 23 GLU H N 1 ATOM 342 C CA . GLU B 2 8 ? 40.511 34.155 99.574 1.00 2.00 ? 23 GLU H CA 1 ATOM 343 C C . GLU B 2 8 ? 39.054 34.460 99.288 1.00 2.00 ? 23 GLU H C 1 ATOM 344 O O . GLU B 2 8 ? 38.319 33.609 98.784 1.00 2.00 ? 23 GLU H O 1 ATOM 345 C CB . GLU B 2 8 ? 41.412 34.921 98.606 1.00 2.00 ? 23 GLU H CB 1 ATOM 346 C CG . GLU B 2 8 ? 42.835 35.022 99.099 1.00 2.00 ? 23 GLU H CG 1 ATOM 347 C CD . GLU B 2 8 ? 43.844 34.710 98.037 1.00 2.00 ? 23 GLU H CD 1 ATOM 348 O OE1 . GLU B 2 8 ? 44.151 33.514 97.847 1.00 2.00 ? 23 GLU H OE1 1 ATOM 349 O OE2 . GLU B 2 8 ? 44.328 35.667 97.398 1.00 2.00 ? 23 GLU H OE2 1 ATOM 350 N N . VAL B 2 9 ? 38.615 35.649 99.674 1.00 2.00 ? 24 VAL H N 1 ATOM 351 C CA . VAL B 2 9 ? 37.249 36.024 99.411 1.00 2.00 ? 24 VAL H CA 1 ATOM 352 C C . VAL B 2 9 ? 37.158 36.277 97.919 1.00 2.00 ? 24 VAL H C 1 ATOM 353 O O . VAL B 2 9 ? 37.830 37.162 97.388 1.00 19.73 ? 24 VAL H O 1 ATOM 354 C CB . VAL B 2 9 ? 36.817 37.266 100.204 1.00 19.73 ? 24 VAL H CB 1 ATOM 355 C CG1 . VAL B 2 9 ? 35.470 37.762 99.715 1.00 19.73 ? 24 VAL H CG1 1 ATOM 356 C CG2 . VAL B 2 9 ? 36.716 36.917 101.675 1.00 19.73 ? 24 VAL H CG2 1 ATOM 357 N N . GLY B 2 10 ? 36.396 35.423 97.242 1.00 2.00 ? 25 GLY H N 1 ATOM 358 C CA . GLY B 2 10 ? 36.214 35.548 95.813 1.00 2.00 ? 25 GLY H CA 1 ATOM 359 C C . GLY B 2 10 ? 37.206 34.761 94.986 1.00 2.00 ? 25 GLY H C 1 ATOM 360 O O . GLY B 2 10 ? 37.123 34.784 93.764 1.00 48.13 ? 25 GLY H O 1 ATOM 361 N N . LEU B 2 11 ? 38.110 34.037 95.644 1.00 2.00 ? 26 LEU H N 1 ATOM 362 C CA . LEU B 2 11 ? 39.135 33.231 94.964 1.00 2.00 ? 26 LEU H CA 1 ATOM 363 C C . LEU B 2 11 ? 38.583 32.177 93.999 1.00 2.00 ? 26 LEU H C 1 ATOM 364 O O . LEU B 2 11 ? 39.280 31.726 93.094 1.00 2.00 ? 26 LEU H O 1 ATOM 365 C CB . LEU B 2 11 ? 40.081 32.581 95.996 1.00 2.00 ? 26 LEU H CB 1 ATOM 366 C CG . LEU B 2 11 ? 41.008 31.416 95.615 1.00 2.00 ? 26 LEU H CG 1 ATOM 367 C CD1 . LEU B 2 11 ? 42.258 31.433 96.469 1.00 2.00 ? 26 LEU H CD1 1 ATOM 368 C CD2 . LEU B 2 11 ? 40.291 30.081 95.748 1.00 2.00 ? 26 LEU H CD2 1 ATOM 369 N N . SER B 2 12 ? 37.337 31.772 94.194 1.00 2.00 ? 27 SER H N 1 ATOM 370 C CA . SER B 2 12 ? 36.749 30.765 93.323 1.00 2.00 ? 27 SER H CA 1 ATOM 371 C C . SER B 2 12 ? 35.266 30.980 93.134 1.00 2.00 ? 27 SER H C 1 ATOM 372 O O . SER B 2 12 ? 34.449 30.221 93.659 1.00 2.00 ? 27 SER H O 1 ATOM 373 C CB . SER B 2 12 ? 37.008 29.360 93.866 1.00 2.00 ? 27 SER H CB 1 ATOM 374 O OG . SER B 2 12 ? 36.228 28.404 93.172 1.00 2.00 ? 27 SER H OG 1 ATOM 375 N N . PRO B 2 13 ? 34.896 31.971 92.312 1.00 2.00 ? 28 PRO H N 1 ATOM 376 C CA . PRO B 2 13 ? 33.499 32.313 92.024 1.00 2.00 ? 28 PRO H CA 1 ATOM 377 C C . PRO B 2 13 ? 32.610 31.249 91.400 1.00 2.00 ? 28 PRO H C 1 ATOM 378 O O . PRO B 2 13 ? 31.414 31.459 91.246 1.00 19.13 ? 28 PRO H O 1 ATOM 379 C CB . PRO B 2 13 ? 33.620 33.553 91.134 1.00 19.13 ? 28 PRO H CB 1 ATOM 380 C CG . PRO B 2 13 ? 34.971 33.421 90.516 1.00 19.13 ? 28 PRO H CG 1 ATOM 381 C CD . PRO B 2 13 ? 35.807 32.921 91.655 1.00 19.13 ? 28 PRO H CD 1 ATOM 382 N N . TRP B 2 14 ? 33.181 30.100 91.077 1.00 2.00 ? 29 TRP H N 1 ATOM 383 C CA . TRP B 2 14 ? 32.412 29.036 90.458 1.00 2.00 ? 29 TRP H CA 1 ATOM 384 C C . TRP B 2 14 ? 32.077 27.898 91.397 1.00 2.00 ? 29 TRP H C 1 ATOM 385 O O . TRP B 2 14 ? 31.472 26.907 90.978 1.00 2.00 ? 29 TRP H O 1 ATOM 386 C CB . TRP B 2 14 ? 33.153 28.510 89.234 1.00 2.00 ? 29 TRP H CB 1 ATOM 387 C CG . TRP B 2 14 ? 34.628 28.492 89.395 1.00 2.00 ? 29 TRP H CG 1 ATOM 388 C CD1 . TRP B 2 14 ? 35.376 27.537 90.021 1.00 2.00 ? 29 TRP H CD1 1 ATOM 389 C CD2 . TRP B 2 14 ? 35.552 29.476 88.909 1.00 2.00 ? 29 TRP H CD2 1 ATOM 390 N NE1 . TRP B 2 14 ? 36.708 27.863 89.953 1.00 2.00 ? 29 TRP H NE1 1 ATOM 391 C CE2 . TRP B 2 14 ? 36.843 29.051 89.276 1.00 2.00 ? 29 TRP H CE2 1 ATOM 392 C CE3 . TRP B 2 14 ? 35.417 30.673 88.200 1.00 2.00 ? 29 TRP H CE3 1 ATOM 393 C CZ2 . TRP B 2 14 ? 37.992 29.788 88.956 1.00 2.00 ? 29 TRP H CZ2 1 ATOM 394 C CZ3 . TRP B 2 14 ? 36.560 31.401 87.885 1.00 2.00 ? 29 TRP H CZ3 1 ATOM 395 C CH2 . TRP B 2 14 ? 37.825 30.953 88.264 1.00 2.00 ? 29 TRP H CH2 1 ATOM 396 N N . GLN B 2 15 ? 32.466 28.022 92.659 1.00 15.26 ? 30 GLN H N 1 ATOM 397 C CA . GLN B 2 15 ? 32.168 26.968 93.620 1.00 15.26 ? 30 GLN H CA 1 ATOM 398 C C . GLN B 2 15 ? 30.665 26.929 93.926 1.00 15.26 ? 30 GLN H C 1 ATOM 399 O O . GLN B 2 15 ? 29.972 27.956 93.914 1.00 2.00 ? 30 GLN H O 1 ATOM 400 C CB . GLN B 2 15 ? 32.998 27.139 94.905 1.00 2.00 ? 30 GLN H CB 1 ATOM 401 C CG . GLN B 2 15 ? 33.069 25.898 95.832 1.00 2.00 ? 30 GLN H CG 1 ATOM 402 C CD . GLN B 2 15 ? 34.089 24.835 95.406 1.00 2.00 ? 30 GLN H CD 1 ATOM 403 O OE1 . GLN B 2 15 ? 33.883 23.651 95.636 1.00 2.00 ? 30 GLN H OE1 1 ATOM 404 N NE2 . GLN B 2 15 ? 35.198 25.260 94.828 1.00 2.00 ? 30 GLN H NE2 1 ATOM 405 N N . VAL B 2 16 ? 30.160 25.718 94.112 1.00 5.65 ? 31 VAL H N 1 ATOM 406 C CA . VAL B 2 16 ? 28.755 25.486 94.431 1.00 5.65 ? 31 VAL H CA 1 ATOM 407 C C . VAL B 2 16 ? 28.768 24.334 95.429 1.00 5.65 ? 31 VAL H C 1 ATOM 408 O O . VAL B 2 16 ? 29.652 23.475 95.377 1.00 2.00 ? 31 VAL H O 1 ATOM 409 C CB . VAL B 2 16 ? 27.932 25.049 93.165 1.00 2.00 ? 31 VAL H CB 1 ATOM 410 C CG1 . VAL B 2 16 ? 26.495 24.665 93.541 1.00 2.00 ? 31 VAL H CG1 1 ATOM 411 C CG2 . VAL B 2 16 ? 27.931 26.155 92.123 1.00 2.00 ? 31 VAL H CG2 1 ATOM 412 N N . MET B 2 17 ? 27.855 24.352 96.387 1.00 17.92 ? 32 MET H N 1 ATOM 413 C CA . MET B 2 17 ? 27.800 23.251 97.330 1.00 17.92 ? 32 MET H CA 1 ATOM 414 C C . MET B 2 17 ? 26.416 22.609 97.372 1.00 17.92 ? 32 MET H C 1 ATOM 415 O O . MET B 2 17 ? 25.417 23.273 97.687 1.00 2.00 ? 32 MET H O 1 ATOM 416 C CB . MET B 2 17 ? 28.299 23.649 98.730 1.00 2.00 ? 32 MET H CB 1 ATOM 417 C CG . MET B 2 17 ? 27.443 24.610 99.527 1.00 2.00 ? 32 MET H CG 1 ATOM 418 S SD . MET B 2 17 ? 27.676 24.290 101.264 1.00 2.00 ? 32 MET H SD 1 ATOM 419 C CE . MET B 2 17 ? 26.040 24.320 101.836 1.00 2.00 ? 32 MET H CE 1 ATOM 420 N N . LEU B 2 18 ? 26.353 21.352 96.921 1.00 72.38 ? 33 LEU H N 1 ATOM 421 C CA . LEU B 2 18 ? 25.104 20.589 96.911 1.00 72.38 ? 33 LEU H CA 1 ATOM 422 C C . LEU B 2 18 ? 24.728 20.366 98.355 1.00 72.38 ? 33 LEU H C 1 ATOM 423 O O . LEU B 2 18 ? 25.346 19.553 99.058 1.00 2.00 ? 33 LEU H O 1 ATOM 424 C CB . LEU B 2 18 ? 25.247 19.230 96.221 1.00 2.00 ? 33 LEU H CB 1 ATOM 425 C CG . LEU B 2 18 ? 25.516 19.236 94.723 1.00 2.00 ? 33 LEU H CG 1 ATOM 426 C CD1 . LEU B 2 18 ? 26.923 19.719 94.465 1.00 2.00 ? 33 LEU H CD1 1 ATOM 427 C CD2 . LEU B 2 18 ? 25.342 17.834 94.166 1.00 2.00 ? 33 LEU H CD2 1 ATOM 428 N N . PHE B 2 19 ? 23.787 21.182 98.806 1.00 11.38 ? 34 PHE H N 1 ATOM 429 C CA . PHE B 2 19 ? 23.284 21.123 100.155 1.00 11.38 ? 34 PHE H CA 1 ATOM 430 C C . PHE B 2 19 ? 22.074 20.205 100.160 1.00 11.38 ? 34 PHE H C 1 ATOM 431 O O . PHE B 2 19 ? 21.360 20.079 99.158 1.00 51.32 ? 34 PHE H O 1 ATOM 432 C CB . PHE B 2 19 ? 22.873 22.519 100.610 1.00 51.32 ? 34 PHE H CB 1 ATOM 433 C CG . PHE B 2 19 ? 22.690 22.643 102.090 1.00 51.32 ? 34 PHE H CG 1 ATOM 434 C CD1 . PHE B 2 19 ? 23.513 21.936 102.968 1.00 51.32 ? 34 PHE H CD1 1 ATOM 435 C CD2 . PHE B 2 19 ? 21.713 23.488 102.613 1.00 51.32 ? 34 PHE H CD2 1 ATOM 436 C CE1 . PHE B 2 19 ? 23.369 22.071 104.347 1.00 51.32 ? 34 PHE H CE1 1 ATOM 437 C CE2 . PHE B 2 19 ? 21.559 23.632 103.992 1.00 51.32 ? 34 PHE H CE2 1 ATOM 438 C CZ . PHE B 2 19 ? 22.392 22.921 104.860 1.00 51.32 ? 34 PHE H CZ 1 ATOM 439 N N . ARG B 2 20 ? 21.889 19.514 101.272 1.00 63.87 ? 35 ARG H N 1 ATOM 440 C CA . ARG B 2 20 ? 20.760 18.617 101.430 1.00 63.87 ? 35 ARG H CA 1 ATOM 441 C C . ARG B 2 20 ? 19.683 19.437 102.143 1.00 63.87 ? 35 ARG H C 1 ATOM 442 O O . ARG B 2 20 ? 19.999 20.239 103.028 1.00 13.31 ? 35 ARG H O 1 ATOM 443 C CB . ARG B 2 20 ? 21.168 17.441 102.307 1.00 13.31 ? 35 ARG H CB 1 ATOM 444 C CG . ARG B 2 20 ? 20.141 16.351 102.395 1.00 13.31 ? 35 ARG H CG 1 ATOM 445 C CD . ARG B 2 20 ? 20.685 15.219 103.225 1.00 13.31 ? 35 ARG H CD 1 ATOM 446 N NE . ARG B 2 20 ? 20.320 13.927 102.665 1.00 13.31 ? 35 ARG H NE 1 ATOM 447 C CZ . ARG B 2 20 ? 20.599 12.764 103.237 1.00 13.31 ? 35 ARG H CZ 1 ATOM 448 N NH1 . ARG B 2 20 ? 21.254 12.735 104.390 1.00 13.31 ? 35 ARG H NH1 1 ATOM 449 N NH2 . ARG B 2 20 ? 20.224 11.633 102.651 1.00 13.31 ? 35 ARG H NH2 1 ATOM 450 N N . LYS B 2 21 ? 18.424 19.275 101.746 1.00 50.16 ? 36 LYS H N 1 ATOM 451 C CA . LYS B 2 21 ? 17.356 20.023 102.393 1.00 50.16 ? 36 LYS H CA 1 ATOM 452 C C . LYS B 2 21 ? 17.133 19.504 103.812 1.00 50.16 ? 36 LYS H C 1 ATOM 453 O O . LYS B 2 21 ? 17.393 20.215 104.792 1.00 25.43 ? 36 LYS H O 1 ATOM 454 C CB . LYS B 2 21 ? 16.062 19.972 101.579 1.00 25.43 ? 36 LYS H CB 1 ATOM 455 C CG . LYS B 2 21 ? 16.062 20.887 100.371 1.00 25.43 ? 36 LYS H CG 1 ATOM 456 C CD . LYS B 2 21 ? 14.754 20.793 99.613 1.00 25.43 ? 36 LYS H CD 1 ATOM 457 C CE . LYS B 2 21 ? 14.854 21.507 98.276 1.00 25.43 ? 36 LYS H CE 1 ATOM 458 N NZ . LYS B 2 21 ? 13.604 21.408 97.467 1.00 25.43 ? 36 LYS H NZ 1 ATOM 459 N N . SER B 2 22 A 16.663 18.264 103.922 1.00 37.13 ? 36 SER H N 1 ATOM 460 C CA . SER B 2 22 A 16.436 17.659 105.227 1.00 37.13 ? 36 SER H CA 1 ATOM 461 C C . SER B 2 22 A 16.844 16.186 105.267 1.00 37.13 ? 36 SER H C 1 ATOM 462 O O . SER B 2 22 A 16.331 15.356 104.507 1.00 37.23 ? 36 SER H O 1 ATOM 463 C CB . SER B 2 22 A 14.986 17.837 105.683 1.00 37.23 ? 36 SER H CB 1 ATOM 464 O OG . SER B 2 22 A 14.831 17.450 107.042 1.00 37.23 ? 36 SER H OG 1 ATOM 465 N N . PRO B 2 23 ? 17.798 15.848 106.149 1.00 22.79 ? 37 PRO H N 1 ATOM 466 C CA . PRO B 2 23 ? 18.424 16.833 107.036 1.00 22.79 ? 37 PRO H CA 1 ATOM 467 C C . PRO B 2 23 ? 19.375 17.757 106.268 1.00 22.79 ? 37 PRO H C 1 ATOM 468 O O . PRO B 2 23 ? 19.944 17.377 105.236 1.00 29.82 ? 37 PRO H O 1 ATOM 469 C CB . PRO B 2 23 ? 19.171 15.949 108.034 1.00 29.82 ? 37 PRO H CB 1 ATOM 470 C CG . PRO B 2 23 ? 19.636 14.815 107.169 1.00 29.82 ? 37 PRO H CG 1 ATOM 471 C CD . PRO B 2 23 ? 18.402 14.517 106.328 1.00 29.82 ? 37 PRO H CD 1 ATOM 472 N N . GLN B 2 24 ? 19.513 18.984 106.750 1.00 29.70 ? 38 GLN H N 1 ATOM 473 C CA . GLN B 2 24 ? 20.384 19.935 106.086 1.00 29.70 ? 38 GLN H CA 1 ATOM 474 C C . GLN B 2 24 ? 21.873 19.650 106.329 1.00 29.70 ? 38 GLN H C 1 ATOM 475 O O . GLN B 2 24 ? 22.411 19.941 107.401 1.00 63.45 ? 38 GLN H O 1 ATOM 476 C CB . GLN B 2 24 ? 19.990 21.373 106.455 1.00 63.45 ? 38 GLN H CB 1 ATOM 477 C CG . GLN B 2 24 ? 19.885 21.672 107.948 1.00 63.45 ? 38 GLN H CG 1 ATOM 478 C CD . GLN B 2 24 ? 19.506 23.121 108.237 1.00 63.45 ? 38 GLN H CD 1 ATOM 479 O OE1 . GLN B 2 24 ? 18.987 23.829 107.371 1.00 63.45 ? 38 GLN H OE1 1 ATOM 480 N NE2 . GLN B 2 24 ? 19.751 23.561 109.466 1.00 63.45 ? 38 GLN H NE2 1 ATOM 481 N N . GLU B 2 25 ? 22.512 19.019 105.343 1.00 41.44 ? 39 GLU H N 1 ATOM 482 C CA . GLU B 2 25 ? 23.937 18.685 105.419 1.00 41.44 ? 39 GLU H CA 1 ATOM 483 C C . GLU B 2 25 ? 24.627 18.864 104.063 1.00 41.44 ? 39 GLU H C 1 ATOM 484 O O . GLU B 2 25 ? 23.971 18.808 103.016 1.00 28.54 ? 39 GLU H O 1 ATOM 485 C CB . GLU B 2 25 ? 24.149 17.246 105.911 1.00 28.54 ? 39 GLU H CB 1 ATOM 486 C CG . GLU B 2 25 ? 23.665 16.181 104.930 1.00 28.54 ? 39 GLU H CG 1 ATOM 487 C CD . GLU B 2 25 ? 24.246 14.798 105.199 1.00 28.54 ? 39 GLU H CD 1 ATOM 488 O OE1 . GLU B 2 25 ? 24.046 14.271 106.320 1.00 28.54 ? 39 GLU H OE1 1 ATOM 489 O OE2 . GLU B 2 25 ? 24.889 14.235 104.279 1.00 28.54 ? 39 GLU H OE2 1 ATOM 490 N N . LEU B 2 26 ? 25.937 19.120 104.083 1.00 2.00 ? 40 LEU H N 1 ATOM 491 C CA . LEU B 2 26 ? 26.690 19.287 102.844 1.00 2.00 ? 40 LEU H CA 1 ATOM 492 C C . LEU B 2 26 ? 26.901 17.931 102.209 1.00 2.00 ? 40 LEU H C 1 ATOM 493 O O . LEU B 2 26 ? 27.447 17.010 102.842 1.00 2.00 ? 40 LEU H O 1 ATOM 494 C CB . LEU B 2 26 ? 28.045 19.960 103.068 1.00 2.00 ? 40 LEU H CB 1 ATOM 495 C CG . LEU B 2 26 ? 28.928 19.998 101.807 1.00 2.00 ? 40 LEU H CG 1 ATOM 496 C CD1 . LEU B 2 26 ? 28.312 20.872 100.730 1.00 2.00 ? 40 LEU H CD1 1 ATOM 497 C CD2 . LEU B 2 26 ? 30.298 20.494 102.153 1.00 2.00 ? 40 LEU H CD2 1 ATOM 498 N N . LEU B 2 27 ? 26.439 17.806 100.972 1.00 21.44 ? 41 LEU H N 1 ATOM 499 C CA . LEU B 2 27 ? 26.563 16.565 100.226 1.00 21.44 ? 41 LEU H CA 1 ATOM 500 C C . LEU B 2 27 ? 27.876 16.559 99.450 1.00 21.44 ? 41 LEU H C 1 ATOM 501 O O . LEU B 2 27 ? 28.774 15.750 99.723 1.00 20.59 ? 41 LEU H O 1 ATOM 502 C CB . LEU B 2 27 ? 25.368 16.394 99.278 1.00 20.59 ? 41 LEU H CB 1 ATOM 503 C CG . LEU B 2 27 ? 24.021 16.190 99.989 1.00 20.59 ? 41 LEU H CG 1 ATOM 504 C CD1 . LEU B 2 27 ? 22.857 16.293 99.019 1.00 20.59 ? 41 LEU H CD1 1 ATOM 505 C CD2 . LEU B 2 27 ? 24.010 14.848 100.693 1.00 20.59 ? 41 LEU H CD2 1 ATOM 506 N N . CYS B 2 28 ? 28.017 17.521 98.547 1.00 17.39 ? 42 CYS H N 1 ATOM 507 C CA . CYS B 2 28 ? 29.211 17.617 97.723 1.00 17.39 ? 42 CYS H CA 1 ATOM 508 C C . CYS B 2 28 ? 29.454 19.046 97.278 1.00 17.39 ? 42 CYS H C 1 ATOM 509 O O . CYS B 2 28 ? 28.700 19.960 97.615 1.00 8.67 ? 42 CYS H O 1 ATOM 510 C CB . CYS B 2 28 ? 29.031 16.780 96.460 1.00 8.67 ? 42 CYS H CB 1 ATOM 511 S SG . CYS B 2 28 ? 29.064 14.982 96.659 1.00 8.67 ? 42 CYS H SG 1 ATOM 512 N N . GLY B 2 29 ? 30.521 19.210 96.507 1.00 2.00 ? 43 GLY H N 1 ATOM 513 C CA . GLY B 2 29 ? 30.864 20.490 95.935 1.00 2.00 ? 43 GLY H CA 1 ATOM 514 C C . GLY B 2 29 ? 30.410 20.423 94.485 1.00 2.00 ? 43 GLY H C 1 ATOM 515 O O . GLY B 2 29 ? 30.112 19.344 93.957 1.00 6.77 ? 43 GLY H O 1 ATOM 516 N N . ALA B 2 30 ? 30.305 21.570 93.840 1.00 21.66 ? 44 ALA H N 1 ATOM 517 C CA . ALA B 2 30 ? 29.895 21.605 92.449 1.00 21.66 ? 44 ALA H CA 1 ATOM 518 C C . ALA B 2 30 ? 30.596 22.762 91.734 1.00 21.66 ? 44 ALA H C 1 ATOM 519 O O . ALA B 2 30 ? 31.413 23.467 92.335 1.00 46.66 ? 44 ALA H O 1 ATOM 520 C CB . ALA B 2 30 ? 28.389 21.731 92.343 1.00 46.66 ? 44 ALA H CB 1 ATOM 521 N N . SER B 2 31 ? 30.267 22.978 90.469 1.00 2.00 ? 45 SER H N 1 ATOM 522 C CA . SER B 2 31 ? 30.903 24.037 89.725 1.00 2.00 ? 45 SER H CA 1 ATOM 523 C C . SER B 2 31 ? 29.919 24.668 88.746 1.00 2.00 ? 45 SER H C 1 ATOM 524 O O . SER B 2 31 ? 29.112 23.966 88.140 1.00 2.00 ? 45 SER H O 1 ATOM 525 C CB . SER B 2 31 ? 32.104 23.450 88.998 1.00 2.00 ? 45 SER H CB 1 ATOM 526 O OG . SER B 2 31 ? 33.114 24.421 88.832 1.00 2.00 ? 45 SER H OG 1 ATOM 527 N N . LEU B 2 32 ? 29.978 25.995 88.623 1.00 21.01 ? 46 LEU H N 1 ATOM 528 C CA . LEU B 2 32 ? 29.105 26.782 87.739 1.00 21.01 ? 46 LEU H CA 1 ATOM 529 C C . LEU B 2 32 ? 29.760 27.049 86.369 1.00 21.01 ? 46 LEU H C 1 ATOM 530 O O . LEU B 2 32 ? 30.787 27.755 86.272 1.00 9.26 ? 46 LEU H O 1 ATOM 531 C CB . LEU B 2 32 ? 28.810 28.122 88.406 1.00 9.26 ? 46 LEU H CB 1 ATOM 532 C CG . LEU B 2 32 ? 27.392 28.522 88.802 1.00 9.26 ? 46 LEU H CG 1 ATOM 533 C CD1 . LEU B 2 32 ? 27.467 29.661 89.787 1.00 9.26 ? 46 LEU H CD1 1 ATOM 534 C CD2 . LEU B 2 32 ? 26.625 28.959 87.616 1.00 9.26 ? 46 LEU H CD2 1 ATOM 535 N N . ILE B 2 33 ? 29.137 26.522 85.314 1.00 48.92 ? 47 ILE H N 1 ATOM 536 C CA . ILE B 2 33 ? 29.639 26.700 83.949 1.00 48.92 ? 47 ILE H CA 1 ATOM 537 C C . ILE B 2 33 ? 28.782 27.656 83.084 1.00 48.92 ? 47 ILE H C 1 ATOM 538 O O . ILE B 2 33 ? 29.206 28.089 82.010 1.00 14.58 ? 47 ILE H O 1 ATOM 539 C CB . ILE B 2 33 ? 29.857 25.343 83.219 1.00 14.58 ? 47 ILE H CB 1 ATOM 540 C CG1 . ILE B 2 33 ? 28.533 24.642 82.932 1.00 14.58 ? 47 ILE H CG1 1 ATOM 541 C CG2 . ILE B 2 33 ? 30.724 24.430 84.066 1.00 14.58 ? 47 ILE H CG2 1 ATOM 542 C CD1 . ILE B 2 33 ? 28.708 23.361 82.149 1.00 14.58 ? 47 ILE H CD1 1 ATOM 543 N N . SER B 2 34 ? 27.592 27.996 83.574 1.00 23.76 ? 48 SER H N 1 ATOM 544 C CA . SER B 2 34 ? 26.666 28.905 82.886 1.00 23.76 ? 48 SER H CA 1 ATOM 545 C C . SER B 2 34 ? 25.769 29.478 83.989 1.00 23.76 ? 48 SER H C 1 ATOM 546 O O . SER B 2 34 ? 25.912 29.068 85.122 1.00 2.00 ? 48 SER H O 1 ATOM 547 C CB . SER B 2 34 ? 25.796 28.131 81.882 1.00 2.00 ? 48 SER H CB 1 ATOM 548 O OG . SER B 2 34 ? 26.557 27.446 80.901 1.00 2.00 ? 48 SER H OG 1 ATOM 549 N N . ASP B 2 35 ? 24.828 30.374 83.686 1.00 2.00 ? 49 ASP H N 1 ATOM 550 C CA . ASP B 2 35 ? 23.967 30.908 84.753 1.00 2.00 ? 49 ASP H CA 1 ATOM 551 C C . ASP B 2 35 ? 22.900 29.897 85.172 1.00 2.00 ? 49 ASP H C 1 ATOM 552 O O . ASP B 2 35 ? 22.192 30.102 86.163 1.00 39.65 ? 49 ASP H O 1 ATOM 553 C CB . ASP B 2 35 ? 23.235 32.213 84.374 1.00 39.65 ? 49 ASP H CB 1 ATOM 554 C CG . ASP B 2 35 ? 23.848 32.938 83.194 1.00 39.65 ? 49 ASP H CG 1 ATOM 555 O OD1 . ASP B 2 35 ? 25.015 33.387 83.286 1.00 39.65 ? 49 ASP H OD1 1 ATOM 556 O OD2 . ASP B 2 35 ? 23.132 33.090 82.178 1.00 39.65 ? 49 ASP H OD2 1 ATOM 557 N N . ARG B 2 36 ? 22.776 28.807 84.422 1.00 18.27 ? 50 ARG H N 1 ATOM 558 C CA . ARG B 2 36 ? 21.749 27.821 84.733 1.00 18.27 ? 50 ARG H CA 1 ATOM 559 C C . ARG B 2 36 ? 22.185 26.354 84.713 1.00 18.27 ? 50 ARG H C 1 ATOM 560 O O . ARG B 2 36 ? 21.341 25.456 84.776 1.00 90.97 ? 50 ARG H O 1 ATOM 561 C CB . ARG B 2 36 ? 20.563 28.036 83.798 1.00 90.97 ? 50 ARG H CB 1 ATOM 562 C CG . ARG B 2 36 ? 19.204 27.878 84.444 1.00 90.97 ? 50 ARG H CG 1 ATOM 563 C CD . ARG B 2 36 ? 18.101 28.402 83.524 1.00 90.97 ? 50 ARG H CD 1 ATOM 564 N NE . ARG B 2 36 ? 18.135 27.787 82.195 1.00 90.97 ? 50 ARG H NE 1 ATOM 565 C CZ . ARG B 2 36 ? 18.553 28.402 81.091 1.00 90.97 ? 50 ARG H CZ 1 ATOM 566 N NH1 . ARG B 2 36 ? 18.980 29.663 81.138 1.00 90.97 ? 50 ARG H NH1 1 ATOM 567 N NH2 . ARG B 2 36 ? 18.553 27.748 79.938 1.00 90.97 ? 50 ARG H NH2 1 ATOM 568 N N . TRP B 2 37 ? 23.494 26.115 84.653 1.00 35.61 ? 51 TRP H N 1 ATOM 569 C CA . TRP B 2 37 ? 24.043 24.756 84.612 1.00 35.61 ? 51 TRP H CA 1 ATOM 570 C C . TRP B 2 37 ? 25.119 24.583 85.664 1.00 35.61 ? 51 TRP H C 1 ATOM 571 O O . TRP B 2 37 ? 25.979 25.450 85.825 1.00 41.11 ? 51 TRP H O 1 ATOM 572 C CB . TRP B 2 37 ? 24.586 24.454 83.211 1.00 41.11 ? 51 TRP H CB 1 ATOM 573 C CG . TRP B 2 37 ? 23.502 24.519 82.163 1.00 41.11 ? 51 TRP H CG 1 ATOM 574 C CD1 . TRP B 2 37 ? 23.259 25.543 81.294 1.00 41.11 ? 51 TRP H CD1 1 ATOM 575 C CD2 . TRP B 2 37 ? 22.480 23.537 81.920 1.00 41.11 ? 51 TRP H CD2 1 ATOM 576 N NE1 . TRP B 2 37 ? 22.148 25.267 80.530 1.00 41.11 ? 51 TRP H NE1 1 ATOM 577 C CE2 . TRP B 2 37 ? 21.653 24.042 80.889 1.00 41.11 ? 51 TRP H CE2 1 ATOM 578 C CE3 . TRP B 2 37 ? 22.186 22.279 82.471 1.00 41.11 ? 51 TRP H CE3 1 ATOM 579 C CZ2 . TRP B 2 37 ? 20.550 23.332 80.396 1.00 41.11 ? 51 TRP H CZ2 1 ATOM 580 C CZ3 . TRP B 2 37 ? 21.091 21.572 81.980 1.00 41.11 ? 51 TRP H CZ3 1 ATOM 581 C CH2 . TRP B 2 37 ? 20.286 22.101 80.951 1.00 41.11 ? 51 TRP H CH2 1 ATOM 582 N N . VAL B 2 38 ? 25.063 23.475 86.389 1.00 2.00 ? 52 VAL H N 1 ATOM 583 C CA . VAL B 2 38 ? 26.022 23.225 87.450 1.00 2.00 ? 52 VAL H CA 1 ATOM 584 C C . VAL B 2 38 ? 26.579 21.816 87.331 1.00 2.00 ? 52 VAL H C 1 ATOM 585 O O . VAL B 2 38 ? 25.846 20.842 87.343 1.00 2.00 ? 52 VAL H O 1 ATOM 586 C CB . VAL B 2 38 ? 25.375 23.436 88.832 1.00 2.00 ? 52 VAL H CB 1 ATOM 587 C CG1 . VAL B 2 38 ? 26.428 23.337 89.924 1.00 2.00 ? 52 VAL H CG1 1 ATOM 588 C CG2 . VAL B 2 38 ? 24.664 24.797 88.887 1.00 2.00 ? 52 VAL H CG2 1 ATOM 589 N N . LEU B 2 39 ? 27.892 21.714 87.231 1.00 2.00 ? 53 LEU H N 1 ATOM 590 C CA . LEU B 2 39 ? 28.556 20.428 87.081 1.00 2.00 ? 53 LEU H CA 1 ATOM 591 C C . LEU B 2 39 ? 28.985 19.758 88.398 1.00 2.00 ? 53 LEU H C 1 ATOM 592 O O . LEU B 2 39 ? 29.542 20.403 89.287 1.00 2.00 ? 53 LEU H O 1 ATOM 593 C CB . LEU B 2 39 ? 29.773 20.602 86.162 1.00 2.00 ? 53 LEU H CB 1 ATOM 594 C CG . LEU B 2 39 ? 30.464 19.365 85.577 1.00 2.00 ? 53 LEU H CG 1 ATOM 595 C CD1 . LEU B 2 39 ? 29.511 18.632 84.644 1.00 2.00 ? 53 LEU H CD1 1 ATOM 596 C CD2 . LEU B 2 39 ? 31.725 19.783 84.831 1.00 2.00 ? 53 LEU H CD2 1 ATOM 597 N N . THR B 2 40 ? 28.746 18.455 88.499 1.00 2.00 ? 54 THR H N 1 ATOM 598 C CA . THR B 2 40 ? 29.117 17.677 89.681 1.00 2.00 ? 54 THR H CA 1 ATOM 599 C C . THR B 2 40 ? 29.541 16.257 89.271 1.00 2.00 ? 54 THR H C 1 ATOM 600 O O . THR B 2 40 ? 29.616 15.944 88.079 1.00 11.71 ? 54 THR H O 1 ATOM 601 C CB . THR B 2 40 ? 27.951 17.597 90.713 1.00 11.71 ? 54 THR H CB 1 ATOM 602 O OG1 . THR B 2 40 ? 28.366 16.854 91.873 1.00 11.71 ? 54 THR H OG1 1 ATOM 603 C CG2 . THR B 2 40 ? 26.724 16.929 90.096 1.00 11.71 ? 54 THR H CG2 1 ATOM 604 N N . ALA B 2 41 ? 29.855 15.420 90.259 1.00 2.02 ? 55 ALA H N 1 ATOM 605 C CA . ALA B 2 41 ? 30.272 14.040 90.017 1.00 2.02 ? 55 ALA H CA 1 ATOM 606 C C . ALA B 2 41 ? 29.055 13.146 90.165 1.00 2.02 ? 55 ALA H C 1 ATOM 607 O O . ALA B 2 41 ? 28.401 13.147 91.207 1.00 42.99 ? 55 ALA H O 1 ATOM 608 C CB . ALA B 2 41 ? 31.357 13.629 91.014 1.00 42.99 ? 55 ALA H CB 1 ATOM 609 N N . ALA B 2 42 ? 28.802 12.322 89.159 1.00 2.00 ? 56 ALA H N 1 ATOM 610 C CA . ALA B 2 42 ? 27.636 11.447 89.152 1.00 2.00 ? 56 ALA H CA 1 ATOM 611 C C . ALA B 2 42 ? 27.338 10.603 90.401 1.00 2.00 ? 56 ALA H C 1 ATOM 612 O O . ALA B 2 42 ? 26.201 10.163 90.584 1.00 21.32 ? 56 ALA H O 1 ATOM 613 C CB . ALA B 2 42 ? 27.681 10.565 87.922 1.00 21.32 ? 56 ALA H CB 1 ATOM 614 N N . HIS B 2 43 ? 28.333 10.400 91.264 1.00 2.00 ? 57 HIS H N 1 ATOM 615 C CA . HIS B 2 43 ? 28.145 9.593 92.472 1.00 2.00 ? 57 HIS H CA 1 ATOM 616 C C . HIS B 2 43 ? 27.522 10.366 93.622 1.00 2.00 ? 57 HIS H C 1 ATOM 617 O O . HIS B 2 43 ? 27.164 9.781 94.644 1.00 18.56 ? 57 HIS H O 1 ATOM 618 C CB . HIS B 2 43 ? 29.470 9.000 92.939 1.00 18.56 ? 57 HIS H CB 1 ATOM 619 C CG . HIS B 2 43 ? 30.419 10.010 93.514 1.00 18.56 ? 57 HIS H CG 1 ATOM 620 N ND1 . HIS B 2 43 ? 31.498 10.499 92.816 1.00 18.56 ? 57 HIS H ND1 1 ATOM 621 C CD2 . HIS B 2 43 ? 30.463 10.603 94.733 1.00 18.56 ? 57 HIS H CD2 1 ATOM 622 C CE1 . HIS B 2 43 ? 32.172 11.344 93.576 1.00 18.56 ? 57 HIS H CE1 1 ATOM 623 N NE2 . HIS B 2 43 ? 31.561 11.423 94.743 1.00 18.56 ? 57 HIS H NE2 1 ATOM 624 N N . CYS B 2 44 ? 27.490 11.690 93.481 1.00 64.06 ? 58 CYS H N 1 ATOM 625 C CA . CYS B 2 44 ? 26.908 12.583 94.491 1.00 64.06 ? 58 CYS H CA 1 ATOM 626 C C . CYS B 2 44 ? 25.387 12.566 94.372 1.00 64.06 ? 58 CYS H C 1 ATOM 627 O O . CYS B 2 44 ? 24.684 13.168 95.179 1.00 16.49 ? 58 CYS H O 1 ATOM 628 C CB . CYS B 2 44 ? 27.424 14.027 94.306 1.00 16.49 ? 58 CYS H CB 1 ATOM 629 S SG . CYS B 2 44 ? 29.177 14.333 94.742 1.00 16.49 ? 58 CYS H SG 1 ATOM 630 N N . LEU B 2 45 ? 24.892 11.890 93.343 1.00 8.65 ? 59 LEU H N 1 ATOM 631 C CA . LEU B 2 45 ? 23.465 11.780 93.102 1.00 8.65 ? 59 LEU H CA 1 ATOM 632 C C . LEU B 2 45 ? 23.044 10.328 92.964 1.00 8.65 ? 59 LEU H C 1 ATOM 633 O O . LEU B 2 45 ? 22.013 9.927 93.504 1.00 33.99 ? 59 LEU H O 1 ATOM 634 C CB . LEU B 2 45 ? 23.089 12.544 91.840 1.00 33.99 ? 59 LEU H CB 1 ATOM 635 C CG . LEU B 2 45 ? 23.162 14.053 92.040 1.00 33.99 ? 59 LEU H CG 1 ATOM 636 C CD1 . LEU B 2 45 ? 23.170 14.789 90.711 1.00 33.99 ? 59 LEU H CD1 1 ATOM 637 C CD2 . LEU B 2 45 ? 21.996 14.475 92.914 1.00 33.99 ? 59 LEU H CD2 1 ATOM 638 N N . LEU B 2 46 ? 23.842 9.535 92.260 1.00 21.29 ? 60 LEU H N 1 ATOM 639 C CA . LEU B 2 46 ? 23.513 8.130 92.066 1.00 21.29 ? 60 LEU H CA 1 ATOM 640 C C . LEU B 2 46 ? 24.581 7.125 92.528 1.00 21.29 ? 60 LEU H C 1 ATOM 641 O O . LEU B 2 46 ? 25.575 6.910 91.834 1.00 19.24 ? 60 LEU H O 1 ATOM 642 C CB . LEU B 2 46 ? 23.168 7.879 90.589 1.00 19.24 ? 60 LEU H CB 1 ATOM 643 C CG . LEU B 2 46 ? 22.958 6.409 90.199 1.00 19.24 ? 60 LEU H CG 1 ATOM 644 C CD1 . LEU B 2 46 ? 21.620 5.934 90.720 1.00 19.24 ? 60 LEU H CD1 1 ATOM 645 C CD2 . LEU B 2 46 ? 23.051 6.199 88.695 1.00 19.24 ? 60 LEU H CD2 1 ATOM 646 N N . TYR B 2 47 A 24.394 6.537 93.710 1.00 48.71 ? 60 TYR H N 1 ATOM 647 C CA . TYR B 2 47 A 25.319 5.513 94.210 1.00 48.71 ? 60 TYR H CA 1 ATOM 648 C C . TYR B 2 47 A 24.599 4.421 94.970 1.00 48.71 ? 60 TYR H C 1 ATOM 649 O O . TYR B 2 47 A 24.577 4.420 96.199 1.00 12.12 ? 60 TYR H O 1 ATOM 650 C CB . TYR B 2 47 A 26.426 6.054 95.109 1.00 12.12 ? 60 TYR H CB 1 ATOM 651 C CG . TYR B 2 47 A 27.600 5.106 95.103 1.00 12.12 ? 60 TYR H CG 1 ATOM 652 C CD1 . TYR B 2 47 A 27.893 4.359 93.959 1.00 12.12 ? 60 TYR H CD1 1 ATOM 653 C CD2 . TYR B 2 47 A 28.448 4.996 96.189 1.00 12.12 ? 60 TYR H CD2 1 ATOM 654 C CE1 . TYR B 2 47 A 28.998 3.543 93.891 1.00 12.12 ? 60 TYR H CE1 1 ATOM 655 C CE2 . TYR B 2 47 A 29.572 4.171 96.130 1.00 12.12 ? 60 TYR H CE2 1 ATOM 656 C CZ . TYR B 2 47 A 29.837 3.454 94.974 1.00 12.12 ? 60 TYR H CZ 1 ATOM 657 O OH . TYR B 2 47 A 30.952 2.661 94.884 1.00 12.12 ? 60 TYR H OH 1 ATOM 658 N N . PRO B 2 48 B 24.054 3.441 94.245 1.00 28.07 ? 60 PRO H N 1 ATOM 659 C CA . PRO B 2 48 B 23.331 2.330 94.858 1.00 28.07 ? 60 PRO H CA 1 ATOM 660 C C . PRO B 2 48 B 23.986 1.729 96.102 1.00 28.07 ? 60 PRO H C 1 ATOM 661 O O . PRO B 2 48 B 23.291 1.457 97.080 1.00 49.25 ? 60 PRO H O 1 ATOM 662 C CB . PRO B 2 48 B 23.165 1.363 93.695 1.00 49.25 ? 60 PRO H CB 1 ATOM 663 C CG . PRO B 2 48 B 22.904 2.322 92.558 1.00 49.25 ? 60 PRO H CG 1 ATOM 664 C CD . PRO B 2 48 B 23.990 3.354 92.776 1.00 49.25 ? 60 PRO H CD 1 ATOM 665 N N . PRO B 2 49 C 25.316 1.507 96.089 1.00 81.05 ? 60 PRO H N 1 ATOM 666 C CA . PRO B 2 49 C 25.982 0.941 97.272 1.00 81.05 ? 60 PRO H CA 1 ATOM 667 C C . PRO B 2 49 C 25.562 1.691 98.547 1.00 81.05 ? 60 PRO H C 1 ATOM 668 O O . PRO B 2 49 C 24.926 1.122 99.431 1.00 65.43 ? 60 PRO H O 1 ATOM 669 C CB . PRO B 2 49 C 27.454 1.143 96.942 1.00 65.43 ? 60 PRO H CB 1 ATOM 670 C CG . PRO B 2 49 C 27.468 0.817 95.478 1.00 65.43 ? 60 PRO H CG 1 ATOM 671 C CD . PRO B 2 49 C 26.256 1.561 94.948 1.00 65.43 ? 60 PRO H CD 1 ATOM 672 N N . TRP B 2 50 D 25.844 2.988 98.593 1.00 68.49 ? 60 TRP H N 1 ATOM 673 C CA . TRP B 2 50 D 25.466 3.812 99.739 1.00 68.49 ? 60 TRP H CA 1 ATOM 674 C C . TRP B 2 50 D 23.994 4.209 99.597 1.00 68.49 ? 60 TRP H C 1 ATOM 675 O O . TRP B 2 50 D 23.592 5.279 100.056 1.00 85.24 ? 60 TRP H O 1 ATOM 676 C CB . TRP B 2 50 D 26.299 5.098 99.777 1.00 85.24 ? 60 TRP H CB 1 ATOM 677 C CG . TRP B 2 50 D 27.740 4.954 100.143 1.00 85.24 ? 60 TRP H CG 1 ATOM 678 C CD1 . TRP B 2 50 D 28.591 3.947 99.789 1.00 85.24 ? 60 TRP H CD1 1 ATOM 679 C CD2 . TRP B 2 50 D 28.517 5.894 100.892 1.00 85.24 ? 60 TRP H CD2 1 ATOM 680 N NE1 . TRP B 2 50 D 29.853 4.206 100.266 1.00 85.24 ? 60 TRP H NE1 1 ATOM 681 C CE2 . TRP B 2 50 D 29.836 5.395 100.946 1.00 85.24 ? 60 TRP H CE2 1 ATOM 682 C CE3 . TRP B 2 50 D 28.227 7.113 101.520 1.00 85.24 ? 60 TRP H CE3 1 ATOM 683 C CZ2 . TRP B 2 50 D 30.869 6.076 101.605 1.00 85.24 ? 60 TRP H CZ2 1 ATOM 684 C CZ3 . TRP B 2 50 D 29.251 7.789 102.175 1.00 85.24 ? 60 TRP H CZ3 1 ATOM 685 C CH2 . TRP B 2 50 D 30.556 7.269 102.211 1.00 85.24 ? 60 TRP H CH2 1 ATOM 686 N N . ASP B 2 51 E 23.211 3.376 98.918 1.00 2.00 ? 60 ASP H N 1 ATOM 687 C CA . ASP B 2 51 E 21.790 3.623 98.665 1.00 2.00 ? 60 ASP H CA 1 ATOM 688 C C . ASP B 2 51 E 21.481 5.015 98.110 1.00 2.00 ? 60 ASP H C 1 ATOM 689 O O . ASP B 2 51 E 20.332 5.460 98.132 1.00 110.93 ? 60 ASP H O 1 ATOM 690 C CB . ASP B 2 51 E 20.918 3.311 99.903 1.00 110.93 ? 60 ASP H CB 1 ATOM 691 C CG . ASP B 2 51 E 21.123 4.292 101.052 1.00 110.93 ? 60 ASP H CG 1 ATOM 692 O OD1 . ASP B 2 51 E 20.554 5.408 101.005 1.00 110.93 ? 60 ASP H OD1 1 ATOM 693 O OD2 . ASP B 2 51 E 21.840 3.934 102.013 1.00 110.93 ? 60 ASP H OD2 1 ATOM 694 N N . LYS B 2 52 F 22.500 5.671 97.562 1.00 68.08 ? 60 LYS H N 1 ATOM 695 C CA . LYS B 2 52 F 22.347 7.010 97.009 1.00 68.08 ? 60 LYS H CA 1 ATOM 696 C C . LYS B 2 52 F 21.544 7.092 95.718 1.00 68.08 ? 60 LYS H C 1 ATOM 697 O O . LYS B 2 52 F 21.840 6.403 94.734 1.00 16.95 ? 60 LYS H O 1 ATOM 698 C CB . LYS B 2 52 F 23.711 7.670 96.779 1.00 16.95 ? 60 LYS H CB 1 ATOM 699 C CG . LYS B 2 52 F 24.276 8.433 97.960 1.00 16.95 ? 60 LYS H CG 1 ATOM 700 C CD . LYS B 2 52 F 25.514 9.210 97.526 1.00 16.95 ? 60 LYS H CD 1 ATOM 701 C CE . LYS B 2 52 F 26.192 9.957 98.676 1.00 16.95 ? 60 LYS H CE 1 ATOM 702 N NZ . LYS B 2 52 F 25.373 11.070 99.225 1.00 16.95 ? 60 LYS H NZ 1 ATOM 703 N N . ASN B 2 53 G 20.524 7.947 95.755 1.00 84.14 ? 60 ASN H N 1 ATOM 704 C CA . ASN B 2 53 G 19.649 8.240 94.620 1.00 84.14 ? 60 ASN H CA 1 ATOM 705 C C . ASN B 2 53 G 18.730 9.364 95.028 1.00 84.14 ? 60 ASN H C 1 ATOM 706 O O . ASN B 2 53 G 17.633 9.138 95.539 1.00 32.06 ? 60 ASN H O 1 ATOM 707 C CB . ASN B 2 53 G 18.818 7.052 94.158 1.00 32.06 ? 60 ASN H CB 1 ATOM 708 C CG . ASN B 2 53 G 18.379 7.204 92.719 1.00 32.06 ? 60 ASN H CG 1 ATOM 709 O OD1 . ASN B 2 53 G 19.177 6.959 91.812 1.00 32.06 ? 60 ASN H OD1 1 ATOM 710 N ND2 . ASN B 2 53 G 17.144 7.655 92.493 1.00 32.06 ? 60 ASN H ND2 1 ATOM 711 N N . PHE B 2 54 H 19.244 10.578 94.894 1.00 27.60 ? 60 PHE H N 1 ATOM 712 C CA . PHE B 2 54 H 18.497 11.771 95.230 1.00 27.60 ? 60 PHE H CA 1 ATOM 713 C C . PHE B 2 54 H 17.541 12.154 94.112 1.00 27.60 ? 60 PHE H C 1 ATOM 714 O O . PHE B 2 54 H 17.654 11.677 92.972 1.00 32.85 ? 60 PHE H O 1 ATOM 715 C CB . PHE B 2 54 H 19.451 12.930 95.509 1.00 32.85 ? 60 PHE H CB 1 ATOM 716 C CG . PHE B 2 54 H 20.316 12.711 96.702 1.00 32.85 ? 60 PHE H CG 1 ATOM 717 C CD1 . PHE B 2 54 H 21.360 11.789 96.660 1.00 32.85 ? 60 PHE H CD1 1 ATOM 718 C CD2 . PHE B 2 54 H 20.073 13.401 97.888 1.00 32.85 ? 60 PHE H CD2 1 ATOM 719 C CE1 . PHE B 2 54 H 22.152 11.553 97.788 1.00 32.85 ? 60 PHE H CE1 1 ATOM 720 C CE2 . PHE B 2 54 H 20.859 13.174 99.027 1.00 32.85 ? 60 PHE H CE2 1 ATOM 721 C CZ . PHE B 2 54 H 21.900 12.249 98.977 1.00 32.85 ? 60 PHE H CZ 1 ATOM 722 N N . THR B 2 55 I 16.566 12.979 94.473 1.00 51.00 ? 60 THR H N 1 ATOM 723 C CA . THR B 2 55 I 15.580 13.484 93.533 1.00 51.00 ? 60 THR H CA 1 ATOM 724 C C . THR B 2 55 I 15.897 14.962 93.413 1.00 51.00 ? 60 THR H C 1 ATOM 725 O O . THR B 2 55 I 16.802 15.471 94.092 1.00 28.35 ? 60 THR H O 1 ATOM 726 C CB . THR B 2 55 I 14.114 13.340 94.072 1.00 28.35 ? 60 THR H CB 1 ATOM 727 O OG1 . THR B 2 55 I 13.995 13.945 95.370 1.00 28.35 ? 60 THR H OG1 1 ATOM 728 C CG2 . THR B 2 55 I 13.695 11.882 94.150 1.00 28.35 ? 60 THR H CG2 1 ATOM 729 N N . VAL B 2 56 ? 15.125 15.657 92.586 1.00 31.72 ? 61 VAL H N 1 ATOM 730 C CA . VAL B 2 56 ? 15.305 17.093 92.412 1.00 31.72 ? 61 VAL H CA 1 ATOM 731 C C . VAL B 2 56 ? 14.708 17.767 93.662 1.00 31.72 ? 61 VAL H C 1 ATOM 732 O O . VAL B 2 56 ? 15.051 18.900 94.003 1.00 2.00 ? 61 VAL H O 1 ATOM 733 C CB . VAL B 2 56 ? 14.595 17.581 91.115 1.00 2.00 ? 61 VAL H CB 1 ATOM 734 C CG1 . VAL B 2 56 ? 14.962 19.016 90.806 1.00 2.00 ? 61 VAL H CG1 1 ATOM 735 C CG2 . VAL B 2 56 ? 14.974 16.690 89.949 1.00 2.00 ? 61 VAL H CG2 1 ATOM 736 N N . ASP B 2 57 ? 13.861 17.021 94.373 1.00 52.75 ? 62 ASP H N 1 ATOM 737 C CA . ASP B 2 57 ? 13.224 17.518 95.589 1.00 52.75 ? 62 ASP H CA 1 ATOM 738 C C . ASP B 2 57 ? 14.126 17.401 96.813 1.00 52.75 ? 62 ASP H C 1 ATOM 739 O O . ASP B 2 57 ? 13.811 17.924 97.883 1.00 42.53 ? 62 ASP H O 1 ATOM 740 C CB . ASP B 2 57 ? 11.895 16.809 95.829 1.00 42.53 ? 62 ASP H CB 1 ATOM 741 C CG . ASP B 2 57 ? 10.874 17.120 94.756 1.00 42.53 ? 62 ASP H CG 1 ATOM 742 O OD1 . ASP B 2 57 ? 10.873 18.256 94.222 1.00 42.53 ? 62 ASP H OD1 1 ATOM 743 O OD2 . ASP B 2 57 ? 10.071 16.218 94.447 1.00 42.53 ? 62 ASP H OD2 1 ATOM 744 N N . ASP B 2 58 ? 15.239 16.697 96.644 1.00 43.40 ? 63 ASP H N 1 ATOM 745 C CA . ASP B 2 58 ? 16.207 16.512 97.712 1.00 43.40 ? 63 ASP H CA 1 ATOM 746 C C . ASP B 2 58 ? 17.149 17.690 97.806 1.00 43.40 ? 63 ASP H C 1 ATOM 747 O O . ASP B 2 58 ? 17.443 18.178 98.902 1.00 62.83 ? 63 ASP H O 1 ATOM 748 C CB . ASP B 2 58 ? 17.072 15.287 97.427 1.00 62.83 ? 63 ASP H CB 1 ATOM 749 C CG . ASP B 2 58 ? 16.410 14.002 97.822 1.00 62.83 ? 63 ASP H CG 1 ATOM 750 O OD1 . ASP B 2 58 ? 15.187 13.871 97.613 1.00 62.83 ? 63 ASP H OD1 1 ATOM 751 O OD2 . ASP B 2 58 ? 17.121 13.114 98.340 1.00 62.83 ? 63 ASP H OD2 1 ATOM 752 N N . LEU B 2 59 ? 17.625 18.120 96.639 1.00 28.13 ? 64 LEU H N 1 ATOM 753 C CA . LEU B 2 59 ? 18.614 19.184 96.519 1.00 28.13 ? 64 LEU H CA 1 ATOM 754 C C . LEU B 2 59 ? 18.326 20.674 96.646 1.00 28.13 ? 64 LEU H C 1 ATOM 755 O O . LEU B 2 59 ? 17.245 21.180 96.338 1.00 12.26 ? 64 LEU H O 1 ATOM 756 C CB . LEU B 2 59 ? 19.462 18.941 95.271 1.00 12.26 ? 64 LEU H CB 1 ATOM 757 C CG . LEU B 2 59 ? 20.387 17.730 95.311 1.00 12.26 ? 64 LEU H CG 1 ATOM 758 C CD1 . LEU B 2 59 ? 21.285 17.742 94.083 1.00 12.26 ? 64 LEU H CD1 1 ATOM 759 C CD2 . LEU B 2 59 ? 21.225 17.782 96.579 1.00 12.26 ? 64 LEU H CD2 1 ATOM 760 N N . LEU B 2 60 ? 19.393 21.367 97.016 1.00 29.04 ? 65 LEU H N 1 ATOM 761 C CA . LEU B 2 60 ? 19.407 22.799 97.209 1.00 29.04 ? 65 LEU H CA 1 ATOM 762 C C . LEU B 2 60 ? 20.826 23.209 96.827 1.00 29.04 ? 65 LEU H C 1 ATOM 763 O O . LEU B 2 60 ? 21.803 22.648 97.332 1.00 27.33 ? 65 LEU H O 1 ATOM 764 C CB . LEU B 2 60 ? 19.155 23.114 98.680 1.00 27.33 ? 65 LEU H CB 1 ATOM 765 C CG . LEU B 2 60 ? 18.616 24.511 98.952 1.00 27.33 ? 65 LEU H CG 1 ATOM 766 C CD1 . LEU B 2 60 ? 17.181 24.597 98.423 1.00 27.33 ? 65 LEU H CD1 1 ATOM 767 C CD2 . LEU B 2 60 ? 18.680 24.799 100.443 1.00 27.33 ? 65 LEU H CD2 1 ATOM 768 N N . VAL B 2 61 ? 20.933 24.157 95.907 1.00 2.00 ? 66 VAL H N 1 ATOM 769 C CA . VAL B 2 61 ? 22.222 24.644 95.435 1.00 2.00 ? 66 VAL H CA 1 ATOM 770 C C . VAL B 2 61 ? 22.650 25.954 96.100 1.00 2.00 ? 66 VAL H C 1 ATOM 771 O O . VAL B 2 61 ? 21.906 26.934 96.085 1.00 10.70 ? 66 VAL H O 1 ATOM 772 C CB . VAL B 2 61 ? 22.160 24.837 93.914 1.00 10.70 ? 66 VAL H CB 1 ATOM 773 C CG1 . VAL B 2 61 ? 23.272 25.734 93.429 1.00 10.70 ? 66 VAL H CG1 1 ATOM 774 C CG2 . VAL B 2 61 ? 22.223 23.487 93.233 1.00 10.70 ? 66 VAL H CG2 1 ATOM 775 N N . ARG B 2 62 ? 23.836 25.958 96.702 1.00 2.00 ? 67 ARG H N 1 ATOM 776 C CA . ARG B 2 62 ? 24.358 27.161 97.335 1.00 2.00 ? 67 ARG H CA 1 ATOM 777 C C . ARG B 2 62 ? 25.575 27.665 96.550 1.00 2.00 ? 67 ARG H C 1 ATOM 778 O O . ARG B 2 62 ? 26.587 26.961 96.421 1.00 2.00 ? 67 ARG H O 1 ATOM 779 C CB . ARG B 2 62 ? 24.711 26.896 98.803 1.00 2.00 ? 67 ARG H CB 1 ATOM 780 C CG . ARG B 2 62 ? 23.518 26.511 99.693 1.00 2.00 ? 67 ARG H CG 1 ATOM 781 C CD . ARG B 2 62 ? 23.264 27.530 100.810 1.00 2.00 ? 67 ARG H CD 1 ATOM 782 N NE . ARG B 2 62 ? 22.932 26.889 102.087 1.00 2.00 ? 67 ARG H NE 1 ATOM 783 C CZ . ARG B 2 62 ? 23.339 27.324 103.284 1.00 2.00 ? 67 ARG H CZ 1 ATOM 784 N NH1 . ARG B 2 62 ? 24.092 28.407 103.389 1.00 2.00 ? 67 ARG H NH1 1 ATOM 785 N NH2 . ARG B 2 62 ? 22.992 26.678 104.390 1.00 2.00 ? 67 ARG H NH2 1 ATOM 786 N N . ILE B 2 63 ? 25.449 28.861 95.980 1.00 21.43 ? 68 ILE H N 1 ATOM 787 C CA . ILE B 2 63 ? 26.523 29.468 95.198 1.00 21.43 ? 68 ILE H CA 1 ATOM 788 C C . ILE B 2 63 ? 27.088 30.717 95.890 1.00 21.43 ? 68 ILE H C 1 ATOM 789 O O . ILE B 2 63 ? 26.376 31.408 96.614 1.00 23.64 ? 68 ILE H O 1 ATOM 790 C CB . ILE B 2 63 ? 26.029 29.888 93.807 1.00 23.64 ? 68 ILE H CB 1 ATOM 791 C CG1 . ILE B 2 63 ? 25.306 28.730 93.121 1.00 23.64 ? 68 ILE H CG1 1 ATOM 792 C CG2 . ILE B 2 63 ? 27.206 30.311 92.962 1.00 23.64 ? 68 ILE H CG2 1 ATOM 793 C CD1 . ILE B 2 63 ? 24.517 29.146 91.890 1.00 23.64 ? 68 ILE H CD1 1 ATOM 794 N N . GLY B 2 64 ? 28.375 30.984 95.673 1.00 27.77 ? 69 GLY H N 1 ATOM 795 C CA . GLY B 2 64 ? 29.024 32.160 96.241 1.00 27.77 ? 69 GLY H CA 1 ATOM 796 C C . GLY B 2 64 ? 29.274 32.171 97.739 1.00 27.77 ? 69 GLY H C 1 ATOM 797 O O . GLY B 2 64 ? 29.488 33.236 98.334 1.00 2.00 ? 69 GLY H O 1 ATOM 798 N N . LYS B 2 65 ? 29.267 30.984 98.340 1.00 2.00 ? 70 LYS H N 1 ATOM 799 C CA . LYS B 2 65 ? 29.479 30.825 99.774 1.00 2.00 ? 70 LYS H CA 1 ATOM 800 C C . LYS B 2 65 ? 30.959 30.646 100.130 1.00 2.00 ? 70 LYS H C 1 ATOM 801 O O . LYS B 2 65 ? 31.694 29.986 99.416 1.00 2.00 ? 70 LYS H O 1 ATOM 802 C CB . LYS B 2 65 ? 28.654 29.642 100.268 1.00 2.00 ? 70 LYS H CB 1 ATOM 803 C CG . LYS B 2 65 ? 28.592 29.476 101.767 1.00 2.00 ? 70 LYS H CG 1 ATOM 804 C CD . LYS B 2 65 ? 27.315 28.751 102.148 1.00 2.00 ? 70 LYS H CD 1 ATOM 805 C CE . LYS B 2 65 ? 27.476 28.029 103.451 1.00 2.00 ? 70 LYS H CE 1 ATOM 806 N NZ . LYS B 2 65 ? 28.005 28.930 104.509 1.00 2.00 ? 70 LYS H NZ 1 ATOM 807 N N . HIS B 2 66 ? 31.386 31.206 101.252 1.00 2.00 ? 71 HIS H N 1 ATOM 808 C CA . HIS B 2 66 ? 32.792 31.129 101.666 1.00 2.00 ? 71 HIS H CA 1 ATOM 809 C C . HIS B 2 66 ? 32.915 30.717 103.135 1.00 2.00 ? 71 HIS H C 1 ATOM 810 O O . HIS B 2 66 ? 34.003 30.716 103.712 1.00 2.00 ? 71 HIS H O 1 ATOM 811 C CB . HIS B 2 66 ? 33.475 32.487 101.373 1.00 2.00 ? 71 HIS H CB 1 ATOM 812 C CG . HIS B 2 66 ? 34.842 32.662 101.970 1.00 2.00 ? 71 HIS H CG 1 ATOM 813 N ND1 . HIS B 2 66 ? 35.961 32.016 101.491 1.00 2.00 ? 71 HIS H ND1 1 ATOM 814 C CD2 . HIS B 2 66 ? 35.277 33.467 102.971 1.00 2.00 ? 71 HIS H CD2 1 ATOM 815 C CE1 . HIS B 2 66 ? 37.024 32.412 102.170 1.00 2.00 ? 71 HIS H CE1 1 ATOM 816 N NE2 . HIS B 2 66 ? 36.635 33.293 103.073 1.00 2.00 ? 71 HIS H NE2 1 ATOM 817 N N . SER B 2 67 ? 31.772 30.418 103.742 1.00 6.86 ? 72 SER H N 1 ATOM 818 C CA . SER B 2 67 ? 31.706 29.947 105.121 1.00 6.86 ? 72 SER H CA 1 ATOM 819 C C . SER B 2 67 ? 31.172 28.534 104.921 1.00 6.86 ? 72 SER H C 1 ATOM 820 O O . SER B 2 67 ? 30.615 28.234 103.872 1.00 2.00 ? 72 SER H O 1 ATOM 821 C CB . SER B 2 67 ? 30.706 30.773 105.922 1.00 2.00 ? 72 SER H CB 1 ATOM 822 O OG . SER B 2 67 ? 31.197 31.048 107.223 1.00 2.00 ? 72 SER H OG 1 ATOM 823 N N . ARG B 2 68 ? 31.342 27.654 105.888 1.00 2.00 ? 73 ARG H N 1 ATOM 824 C CA . ARG B 2 68 ? 30.846 26.303 105.692 1.00 2.00 ? 73 ARG H CA 1 ATOM 825 C C . ARG B 2 68 ? 29.374 26.198 106.019 1.00 2.00 ? 73 ARG H C 1 ATOM 826 O O . ARG B 2 68 ? 28.583 25.669 105.244 1.00 51.62 ? 73 ARG H O 1 ATOM 827 C CB . ARG B 2 68 ? 31.603 25.317 106.578 1.00 51.62 ? 73 ARG H CB 1 ATOM 828 C CG . ARG B 2 68 ? 31.412 23.871 106.160 1.00 51.62 ? 73 ARG H CG 1 ATOM 829 C CD . ARG B 2 68 ? 32.070 22.941 107.140 1.00 51.62 ? 73 ARG H CD 1 ATOM 830 N NE . ARG B 2 68 ? 31.297 22.863 108.371 1.00 51.62 ? 73 ARG H NE 1 ATOM 831 C CZ . ARG B 2 68 ? 30.271 22.036 108.553 1.00 51.62 ? 73 ARG H CZ 1 ATOM 832 N NH1 . ARG B 2 68 ? 29.895 21.199 107.590 1.00 51.62 ? 73 ARG H NH1 1 ATOM 833 N NH2 . ARG B 2 68 ? 29.628 22.034 109.711 1.00 51.62 ? 73 ARG H NH2 1 ATOM 834 N N . THR B 2 69 ? 29.026 26.724 107.186 1.00 2.00 ? 74 THR H N 1 ATOM 835 C CA . THR B 2 69 ? 27.672 26.673 107.717 1.00 2.00 ? 74 THR H CA 1 ATOM 836 C C . THR B 2 69 ? 26.871 27.965 107.613 1.00 2.00 ? 74 THR H C 1 ATOM 837 O O . THR B 2 69 ? 25.657 27.961 107.401 1.00 2.00 ? 74 THR H O 1 ATOM 838 C CB . THR B 2 69 ? 27.746 26.334 109.206 1.00 2.00 ? 74 THR H CB 1 ATOM 839 O OG1 . THR B 2 69 ? 28.836 27.075 109.786 1.00 2.00 ? 74 THR H OG1 1 ATOM 840 C CG2 . THR B 2 69 ? 27.947 24.834 109.417 1.00 2.00 ? 74 THR H CG2 1 ATOM 841 N N . ARG B 2 70 ? 27.558 29.068 107.850 1.00 2.00 ? 75 ARG H N 1 ATOM 842 C CA . ARG B 2 70 ? 26.945 30.384 107.870 1.00 2.00 ? 75 ARG H CA 1 ATOM 843 C C . ARG B 2 70 ? 26.154 30.787 106.644 1.00 2.00 ? 75 ARG H C 1 ATOM 844 O O . ARG B 2 70 ? 26.715 30.877 105.549 1.00 41.27 ? 75 ARG H O 1 ATOM 845 C CB . ARG B 2 70 ? 28.033 31.425 108.133 1.00 41.27 ? 75 ARG H CB 1 ATOM 846 C CG . ARG B 2 70 ? 27.540 32.739 108.679 1.00 41.27 ? 75 ARG H CG 1 ATOM 847 C CD . ARG B 2 70 ? 28.671 33.419 109.405 1.00 41.27 ? 75 ARG H CD 1 ATOM 848 N NE . ARG B 2 70 ? 29.387 32.440 110.220 1.00 41.27 ? 75 ARG H NE 1 ATOM 849 C CZ . ARG B 2 70 ? 28.890 31.829 111.295 1.00 41.27 ? 75 ARG H CZ 1 ATOM 850 N NH1 . ARG B 2 70 ? 27.673 32.116 111.742 1.00 41.27 ? 75 ARG H NH1 1 ATOM 851 N NH2 . ARG B 2 70 ? 29.634 30.946 111.945 1.00 41.27 ? 75 ARG H NH2 1 ATOM 852 N N . TYR B 2 71 ? 24.866 31.080 106.851 1.00 2.00 ? 76 TYR H N 1 ATOM 853 C CA . TYR B 2 71 ? 23.997 31.536 105.767 1.00 2.00 ? 76 TYR H CA 1 ATOM 854 C C . TYR B 2 71 ? 24.389 32.978 105.457 1.00 2.00 ? 76 TYR H C 1 ATOM 855 O O . TYR B 2 71 ? 24.015 33.896 106.173 1.00 2.00 ? 76 TYR H O 1 ATOM 856 C CB . TYR B 2 71 ? 22.536 31.449 106.187 1.00 2.00 ? 76 TYR H CB 1 ATOM 857 C CG . TYR B 2 71 ? 21.599 32.279 105.337 1.00 2.00 ? 76 TYR H CG 1 ATOM 858 C CD1 . TYR B 2 71 ? 21.224 31.876 104.061 1.00 2.00 ? 76 TYR H CD1 1 ATOM 859 C CD2 . TYR B 2 71 ? 21.086 33.475 105.825 1.00 2.00 ? 76 TYR H CD2 1 ATOM 860 C CE1 . TYR B 2 71 ? 20.360 32.651 103.298 1.00 2.00 ? 76 TYR H CE1 1 ATOM 861 C CE2 . TYR B 2 71 ? 20.232 34.253 105.078 1.00 2.00 ? 76 TYR H CE2 1 ATOM 862 C CZ . TYR B 2 71 ? 19.870 33.846 103.818 1.00 2.00 ? 76 TYR H CZ 1 ATOM 863 O OH . TYR B 2 71 ? 19.037 34.662 103.088 1.00 2.00 ? 76 TYR H OH 1 ATOM 864 N N . GLU B 2 72 ? 25.190 33.178 104.420 1.00 2.00 ? 77 GLU H N 1 ATOM 865 C CA . GLU B 2 72 ? 25.657 34.517 104.086 1.00 2.00 ? 77 GLU H CA 1 ATOM 866 C C . GLU B 2 72 ? 24.601 35.370 103.434 1.00 2.00 ? 77 GLU H C 1 ATOM 867 O O . GLU B 2 72 ? 24.616 35.585 102.226 1.00 2.00 ? 77 GLU H O 1 ATOM 868 C CB . GLU B 2 72 ? 26.924 34.444 103.242 1.00 2.00 ? 77 GLU H CB 1 ATOM 869 C CG . GLU B 2 72 ? 28.155 34.135 104.080 1.00 2.00 ? 77 GLU H CG 1 ATOM 870 C CD . GLU B 2 72 ? 29.140 33.232 103.389 1.00 2.00 ? 77 GLU H CD 1 ATOM 871 O OE1 . GLU B 2 72 ? 28.799 32.678 102.333 1.00 2.00 ? 77 GLU H OE1 1 ATOM 872 O OE2 . GLU B 2 72 ? 30.256 33.066 103.909 1.00 2.00 ? 77 GLU H OE2 1 ATOM 873 N N . ARG B 2 73 A 23.719 35.887 104.284 1.00 89.99 ? 77 ARG H N 1 ATOM 874 C CA . ARG B 2 73 A 22.594 36.749 103.919 1.00 89.99 ? 77 ARG H CA 1 ATOM 875 C C . ARG B 2 73 A 22.795 37.613 102.669 1.00 89.99 ? 77 ARG H C 1 ATOM 876 O O . ARG B 2 73 A 21.958 37.595 101.762 1.00 59.04 ? 77 ARG H O 1 ATOM 877 C CB . ARG B 2 73 A 22.245 37.655 105.114 1.00 59.04 ? 77 ARG H CB 1 ATOM 878 C CG . ARG B 2 73 A 20.987 38.489 104.942 1.00 59.04 ? 77 ARG H CG 1 ATOM 879 C CD . ARG B 2 73 A 19.793 37.837 105.624 1.00 59.04 ? 77 ARG H CD 1 ATOM 880 N NE . ARG B 2 73 A 19.823 38.003 107.078 1.00 59.04 ? 77 ARG H NE 1 ATOM 881 C CZ . ARG B 2 73 A 19.275 37.158 107.951 1.00 59.04 ? 77 ARG H CZ 1 ATOM 882 N NH1 . ARG B 2 73 A 18.670 36.052 107.533 1.00 59.04 ? 77 ARG H NH1 1 ATOM 883 N NH2 . ARG B 2 73 A 19.351 37.408 109.252 1.00 59.04 ? 77 ARG H NH2 1 ATOM 884 N N . LYS B 2 74 ? 23.916 38.332 102.608 1.00 2.00 ? 78 LYS H N 1 ATOM 885 C CA . LYS B 2 74 ? 24.179 39.229 101.490 1.00 2.00 ? 78 LYS H CA 1 ATOM 886 C C . LYS B 2 74 ? 25.137 38.847 100.370 1.00 2.00 ? 78 LYS H C 1 ATOM 887 O O . LYS B 2 74 ? 25.399 39.672 99.494 1.00 36.00 ? 78 LYS H O 1 ATOM 888 C CB . LYS B 2 74 ? 24.557 40.622 102.020 1.00 36.00 ? 78 LYS H CB 1 ATOM 889 C CG . LYS B 2 74 ? 23.398 41.629 102.004 1.00 36.00 ? 78 LYS H CG 1 ATOM 890 C CD . LYS B 2 74 ? 22.755 41.716 100.608 1.00 36.00 ? 78 LYS H CD 1 ATOM 891 C CE . LYS B 2 74 ? 21.488 42.563 100.596 1.00 36.00 ? 78 LYS H CE 1 ATOM 892 N NZ . LYS B 2 74 ? 20.810 42.538 99.266 1.00 36.00 ? 78 LYS H NZ 1 ATOM 893 N N . VAL B 2 75 ? 25.654 37.625 100.357 1.00 2.00 ? 79 VAL H N 1 ATOM 894 C CA . VAL B 2 75 ? 26.588 37.255 99.286 1.00 2.00 ? 79 VAL H CA 1 ATOM 895 C C . VAL B 2 75 ? 26.388 35.885 98.624 1.00 2.00 ? 79 VAL H C 1 ATOM 896 O O . VAL B 2 75 ? 26.866 35.667 97.509 1.00 2.00 ? 79 VAL H O 1 ATOM 897 C CB . VAL B 2 75 ? 28.082 37.400 99.741 1.00 2.00 ? 79 VAL H CB 1 ATOM 898 C CG1 . VAL B 2 75 ? 28.437 38.864 99.970 1.00 2.00 ? 79 VAL H CG1 1 ATOM 899 C CG2 . VAL B 2 75 ? 28.344 36.605 101.009 1.00 2.00 ? 79 VAL H CG2 1 ATOM 900 N N . GLU B 2 76 ? 25.699 34.974 99.307 1.00 2.00 ? 80 GLU H N 1 ATOM 901 C CA . GLU B 2 76 ? 25.458 33.639 98.772 1.00 2.00 ? 80 GLU H CA 1 ATOM 902 C C . GLU B 2 76 ? 24.056 33.512 98.170 1.00 2.00 ? 80 GLU H C 1 ATOM 903 O O . GLU B 2 76 ? 23.064 33.905 98.779 1.00 21.35 ? 80 GLU H O 1 ATOM 904 C CB . GLU B 2 76 ? 25.661 32.573 99.855 1.00 21.35 ? 80 GLU H CB 1 ATOM 905 C CG . GLU B 2 76 ? 24.685 32.682 101.027 1.00 21.35 ? 80 GLU H CG 1 ATOM 906 C CD . GLU B 2 76 ? 24.048 31.354 101.438 1.00 21.35 ? 80 GLU H CD 1 ATOM 907 O OE1 . GLU B 2 76 ? 23.767 30.504 100.563 1.00 21.35 ? 80 GLU H OE1 1 ATOM 908 O OE2 . GLU B 2 76 ? 23.799 31.177 102.646 1.00 21.35 ? 80 GLU H OE2 1 ATOM 909 N N . LYS B 2 77 ? 23.980 32.964 96.965 1.00 26.89 ? 81 LYS H N 1 ATOM 910 C CA . LYS B 2 77 ? 22.705 32.779 96.283 1.00 26.89 ? 81 LYS H CA 1 ATOM 911 C C . LYS B 2 77 ? 22.282 31.319 96.331 1.00 26.89 ? 81 LYS H C 1 ATOM 912 O O . LYS B 2 77 ? 23.041 30.421 95.962 1.00 32.20 ? 81 LYS H O 1 ATOM 913 C CB . LYS B 2 77 ? 22.813 33.218 94.820 1.00 32.20 ? 81 LYS H CB 1 ATOM 914 C CG . LYS B 2 77 ? 23.393 34.606 94.638 1.00 32.20 ? 81 LYS H CG 1 ATOM 915 C CD . LYS B 2 77 ? 22.913 35.259 93.357 1.00 32.20 ? 81 LYS H CD 1 ATOM 916 C CE . LYS B 2 77 ? 22.586 36.717 93.627 1.00 32.20 ? 81 LYS H CE 1 ATOM 917 N NZ . LYS B 2 77 ? 21.592 36.858 94.743 1.00 32.20 ? 81 LYS H NZ 1 ATOM 918 N N . ILE B 2 78 ? 21.084 31.088 96.845 1.00 38.23 ? 82 ILE H N 1 ATOM 919 C CA . ILE B 2 78 ? 20.539 29.747 96.925 1.00 38.23 ? 82 ILE H CA 1 ATOM 920 C C . ILE B 2 78 ? 19.590 29.604 95.734 1.00 38.23 ? 82 ILE H C 1 ATOM 921 O O . ILE B 2 78 ? 18.905 30.564 95.341 1.00 21.28 ? 82 ILE H O 1 ATOM 922 C CB . ILE B 2 78 ? 19.787 29.530 98.243 1.00 21.28 ? 82 ILE H CB 1 ATOM 923 C CG1 . ILE B 2 78 ? 20.725 29.816 99.418 1.00 21.28 ? 82 ILE H CG1 1 ATOM 924 C CG2 . ILE B 2 78 ? 19.259 28.108 98.310 1.00 21.28 ? 82 ILE H CG2 1 ATOM 925 C CD1 . ILE B 2 78 ? 20.132 29.539 100.789 1.00 21.28 ? 82 ILE H CD1 1 ATOM 926 N N . SER B 2 79 ? 19.613 28.430 95.112 1.00 43.32 ? 83 SER H N 1 ATOM 927 C CA . SER B 2 79 ? 18.762 28.158 93.967 1.00 43.32 ? 83 SER H CA 1 ATOM 928 C C . SER B 2 79 ? 18.219 26.751 94.048 1.00 43.32 ? 83 SER H C 1 ATOM 929 O O . SER B 2 79 ? 18.638 25.947 94.884 1.00 28.58 ? 83 SER H O 1 ATOM 930 C CB . SER B 2 79 ? 19.522 28.318 92.651 1.00 28.58 ? 83 SER H CB 1 ATOM 931 O OG . SER B 2 79 ? 18.624 28.211 91.554 1.00 28.58 ? 83 SER H OG 1 ATOM 932 N N . MET B 2 80 ? 17.266 26.468 93.177 1.00 44.39 ? 84 MET H N 1 ATOM 933 C CA . MET B 2 80 ? 16.657 25.159 93.127 1.00 44.39 ? 84 MET H CA 1 ATOM 934 C C . MET B 2 80 ? 16.843 24.582 91.737 1.00 44.39 ? 84 MET H C 1 ATOM 935 O O . MET B 2 80 ? 16.832 25.307 90.743 1.00 40.99 ? 84 MET H O 1 ATOM 936 C CB . MET B 2 80 ? 15.171 25.242 93.463 1.00 40.99 ? 84 MET H CB 1 ATOM 937 C CG . MET B 2 80 ? 14.876 25.525 94.925 1.00 40.99 ? 84 MET H CG 1 ATOM 938 S SD . MET B 2 80 ? 13.110 25.432 95.226 1.00 40.99 ? 84 MET H SD 1 ATOM 939 C CE . MET B 2 80 ? 12.795 23.648 94.965 1.00 40.99 ? 84 MET H CE 1 ATOM 940 N N . LEU B 2 81 ? 17.018 23.269 91.683 1.00 30.92 ? 85 LEU H N 1 ATOM 941 C CA . LEU B 2 81 ? 17.238 22.562 90.434 1.00 30.92 ? 85 LEU H CA 1 ATOM 942 C C . LEU B 2 81 ? 15.922 22.311 89.728 1.00 30.92 ? 85 LEU H C 1 ATOM 943 O O . LEU B 2 81 ? 14.853 22.515 90.293 1.00 2.00 ? 85 LEU H O 1 ATOM 944 C CB . LEU B 2 81 ? 17.901 21.208 90.696 1.00 2.00 ? 85 LEU H CB 1 ATOM 945 C CG . LEU B 2 81 ? 18.970 21.025 91.770 1.00 2.00 ? 85 LEU H CG 1 ATOM 946 C CD1 . LEU B 2 81 ? 18.384 21.257 93.152 1.00 2.00 ? 85 LEU H CD1 1 ATOM 947 C CD2 . LEU B 2 81 ? 19.507 19.605 91.675 1.00 2.00 ? 85 LEU H CD2 1 ATOM 948 N N . ASP B 2 82 ? 16.034 21.870 88.483 1.00 25.05 ? 86 ASP H N 1 ATOM 949 C CA . ASP B 2 82 ? 14.904 21.533 87.640 1.00 25.05 ? 86 ASP H CA 1 ATOM 950 C C . ASP B 2 82 ? 15.090 20.072 87.287 1.00 25.05 ? 86 ASP H C 1 ATOM 951 O O . ASP B 2 82 ? 14.437 19.191 87.845 1.00 63.33 ? 86 ASP H O 1 ATOM 952 C CB . ASP B 2 82 ? 14.922 22.360 86.355 1.00 63.33 ? 86 ASP H CB 1 ATOM 953 C CG . ASP B 2 82 ? 13.882 23.461 86.355 1.00 63.33 ? 86 ASP H CG 1 ATOM 954 O OD1 . ASP B 2 82 ? 12.816 23.291 86.994 1.00 63.33 ? 86 ASP H OD1 1 ATOM 955 O OD2 . ASP B 2 82 ? 14.127 24.499 85.703 1.00 63.33 ? 86 ASP H OD2 1 ATOM 956 N N . LYS B 2 83 ? 16.008 19.821 86.363 1.00 46.93 ? 87 LYS H N 1 ATOM 957 C CA . LYS B 2 83 ? 16.298 18.466 85.932 1.00 46.93 ? 87 LYS H CA 1 ATOM 958 C C . LYS B 2 83 ? 17.690 18.109 86.443 1.00 46.93 ? 87 LYS H C 1 ATOM 959 O O . LYS B 2 83 ? 18.453 18.979 86.884 1.00 73.49 ? 87 LYS H O 1 ATOM 960 C CB . LYS B 2 83 ? 16.307 18.384 84.404 1.00 73.49 ? 87 LYS H CB 1 ATOM 961 C CG . LYS B 2 83 ? 15.534 19.488 83.686 1.00 73.49 ? 87 LYS H CG 1 ATOM 962 C CD . LYS B 2 83 ? 14.017 19.333 83.787 1.00 73.49 ? 87 LYS H CD 1 ATOM 963 C CE . LYS B 2 83 ? 13.311 20.327 82.867 1.00 73.49 ? 87 LYS H CE 1 ATOM 964 N NZ . LYS B 2 83 ? 13.762 20.194 81.442 1.00 73.49 ? 87 LYS H NZ 1 ATOM 965 N N . ILE B 2 84 ? 18.023 16.829 86.338 1.00 2.00 ? 88 ILE H N 1 ATOM 966 C CA . ILE B 2 84 ? 19.319 16.308 86.758 1.00 2.00 ? 88 ILE H CA 1 ATOM 967 C C . ILE B 2 84 ? 19.723 15.326 85.663 1.00 2.00 ? 88 ILE H C 1 ATOM 968 O O . ILE B 2 84 ? 19.052 14.314 85.438 1.00 2.00 ? 88 ILE H O 1 ATOM 969 C CB . ILE B 2 84 ? 19.207 15.539 88.123 1.00 2.00 ? 88 ILE H CB 1 ATOM 970 C CG1 . ILE B 2 84 ? 18.712 16.476 89.230 1.00 2.00 ? 88 ILE H CG1 1 ATOM 971 C CG2 . ILE B 2 84 ? 20.548 14.934 88.517 1.00 2.00 ? 88 ILE H CG2 1 ATOM 972 C CD1 . ILE B 2 84 ? 18.511 15.799 90.560 1.00 2.00 ? 88 ILE H CD1 1 ATOM 973 N N . TYR B 2 85 ? 20.784 15.651 84.945 1.00 2.00 ? 89 TYR H N 1 ATOM 974 C CA . TYR B 2 85 ? 21.241 14.790 83.870 1.00 2.00 ? 89 TYR H CA 1 ATOM 975 C C . TYR B 2 85 ? 22.463 14.013 84.302 1.00 2.00 ? 89 TYR H C 1 ATOM 976 O O . TYR B 2 85 ? 23.502 14.588 84.623 1.00 48.69 ? 89 TYR H O 1 ATOM 977 C CB . TYR B 2 85 ? 21.547 15.613 82.618 1.00 48.69 ? 89 TYR H CB 1 ATOM 978 C CG . TYR B 2 85 ? 20.392 16.468 82.153 1.00 48.69 ? 89 TYR H CG 1 ATOM 979 C CD1 . TYR B 2 85 ? 19.351 15.918 81.413 1.00 48.69 ? 89 TYR H CD1 1 ATOM 980 C CD2 . TYR B 2 85 ? 20.338 17.823 82.459 1.00 48.69 ? 89 TYR H CD2 1 ATOM 981 C CE1 . TYR B 2 85 ? 18.290 16.689 80.988 1.00 48.69 ? 89 TYR H CE1 1 ATOM 982 C CE2 . TYR B 2 85 ? 19.281 18.602 82.039 1.00 48.69 ? 89 TYR H CE2 1 ATOM 983 C CZ . TYR B 2 85 ? 18.259 18.029 81.302 1.00 48.69 ? 89 TYR H CZ 1 ATOM 984 O OH . TYR B 2 85 ? 17.207 18.799 80.866 1.00 48.69 ? 89 TYR H OH 1 ATOM 985 N N . ILE B 2 86 ? 22.322 12.700 84.354 1.00 26.27 ? 90 ILE H N 1 ATOM 986 C CA . ILE B 2 86 ? 23.423 11.838 84.741 1.00 26.27 ? 90 ILE H CA 1 ATOM 987 C C . ILE B 2 86 ? 23.845 11.055 83.507 1.00 26.27 ? 90 ILE H C 1 ATOM 988 O O . ILE B 2 86 ? 23.000 10.561 82.760 1.00 33.55 ? 90 ILE H O 1 ATOM 989 C CB . ILE B 2 86 ? 22.984 10.882 85.854 1.00 33.55 ? 90 ILE H CB 1 ATOM 990 C CG1 . ILE B 2 86 ? 22.463 11.695 87.043 1.00 33.55 ? 90 ILE H CG1 1 ATOM 991 C CG2 . ILE B 2 86 ? 24.136 9.974 86.259 1.00 33.55 ? 90 ILE H CG2 1 ATOM 992 C CD1 . ILE B 2 86 ? 21.854 10.862 88.157 1.00 33.55 ? 90 ILE H CD1 1 ATOM 993 N N . HIS B 2 87 ? 25.145 10.969 83.265 1.00 2.00 ? 91 HIS H N 1 ATOM 994 C CA . HIS B 2 87 ? 25.637 10.241 82.106 1.00 2.00 ? 91 HIS H CA 1 ATOM 995 C C . HIS B 2 87 ? 25.063 8.831 82.040 1.00 2.00 ? 91 HIS H C 1 ATOM 996 O O . HIS B 2 87 ? 25.078 8.100 83.024 1.00 2.00 ? 91 HIS H O 1 ATOM 997 C CB . HIS B 2 87 ? 27.156 10.159 82.137 1.00 2.00 ? 91 HIS H CB 1 ATOM 998 C CG . HIS B 2 87 ? 27.765 9.925 80.793 1.00 2.00 ? 91 HIS H CG 1 ATOM 999 N ND1 . HIS B 2 87 ? 27.611 8.745 80.102 1.00 2.00 ? 91 HIS H ND1 1 ATOM 1000 C CD2 . HIS B 2 87 ? 28.514 10.730 80.004 1.00 2.00 ? 91 HIS H CD2 1 ATOM 1001 C CE1 . HIS B 2 87 ? 28.239 8.831 78.943 1.00 2.00 ? 91 HIS H CE1 1 ATOM 1002 N NE2 . HIS B 2 87 ? 28.794 10.025 78.858 1.00 2.00 ? 91 HIS H NE2 1 ATOM 1003 N N . PRO B 2 88 ? 24.594 8.416 80.856 1.00 23.11 ? 92 PRO H N 1 ATOM 1004 C CA . PRO B 2 88 ? 24.013 7.083 80.634 1.00 23.11 ? 92 PRO H CA 1 ATOM 1005 C C . PRO B 2 88 ? 24.946 5.914 81.004 1.00 23.11 ? 92 PRO H C 1 ATOM 1006 O O . PRO B 2 88 ? 24.614 5.075 81.839 1.00 22.27 ? 92 PRO H O 1 ATOM 1007 C CB . PRO B 2 88 ? 23.691 7.100 79.130 1.00 22.27 ? 92 PRO H CB 1 ATOM 1008 C CG . PRO B 2 88 ? 24.662 8.120 78.559 1.00 22.27 ? 92 PRO H CG 1 ATOM 1009 C CD . PRO B 2 88 ? 24.596 9.197 79.607 1.00 22.27 ? 92 PRO H CD 1 ATOM 1010 N N . ARG B 2 89 ? 26.116 5.873 80.368 1.00 67.07 ? 93 ARG H N 1 ATOM 1011 C CA . ARG B 2 89 ? 27.105 4.827 80.615 1.00 67.07 ? 93 ARG H CA 1 ATOM 1012 C C . ARG B 2 89 ? 27.998 5.153 81.813 1.00 67.07 ? 93 ARG H C 1 ATOM 1013 O O . ARG B 2 89 ? 29.223 5.188 81.689 1.00 70.55 ? 93 ARG H O 1 ATOM 1014 C CB . ARG B 2 89 ? 27.972 4.616 79.369 1.00 70.55 ? 93 ARG H CB 1 ATOM 1015 C CG . ARG B 2 89 ? 27.228 4.092 78.155 1.00 70.55 ? 93 ARG H CG 1 ATOM 1016 C CD . ARG B 2 89 ? 26.912 2.606 78.282 1.00 70.55 ? 93 ARG H CD 1 ATOM 1017 N NE . ARG B 2 89 ? 25.538 2.333 78.713 1.00 70.55 ? 93 ARG H NE 1 ATOM 1018 C CZ . ARG B 2 89 ? 24.538 2.030 77.888 1.00 70.55 ? 93 ARG H CZ 1 ATOM 1019 N NH1 . ARG B 2 89 ? 24.742 1.981 76.576 1.00 70.55 ? 93 ARG H NH1 1 ATOM 1020 N NH2 . ARG B 2 89 ? 23.327 1.788 78.373 1.00 70.55 ? 93 ARG H NH2 1 ATOM 1021 N N . TYR B 2 90 ? 27.381 5.482 82.941 1.00 12.83 ? 94 TYR H N 1 ATOM 1022 C CA . TYR B 2 90 ? 28.134 5.776 84.152 1.00 12.83 ? 94 TYR H CA 1 ATOM 1023 C C . TYR B 2 90 ? 28.360 4.426 84.845 1.00 12.83 ? 94 TYR H C 1 ATOM 1024 O O . TYR B 2 90 ? 27.419 3.657 85.068 1.00 2.00 ? 94 TYR H O 1 ATOM 1025 C CB . TYR B 2 90 ? 27.372 6.812 85.003 1.00 2.00 ? 94 TYR H CB 1 ATOM 1026 C CG . TYR B 2 90 ? 27.655 6.845 86.499 1.00 2.00 ? 94 TYR H CG 1 ATOM 1027 C CD1 . TYR B 2 90 ? 28.877 6.439 87.026 1.00 2.00 ? 94 TYR H CD1 1 ATOM 1028 C CD2 . TYR B 2 90 ? 26.663 7.247 87.393 1.00 2.00 ? 94 TYR H CD2 1 ATOM 1029 C CE1 . TYR B 2 90 ? 29.095 6.423 88.400 1.00 2.00 ? 94 TYR H CE1 1 ATOM 1030 C CE2 . TYR B 2 90 ? 26.878 7.236 88.756 1.00 2.00 ? 94 TYR H CE2 1 ATOM 1031 C CZ . TYR B 2 90 ? 28.089 6.821 89.252 1.00 2.00 ? 94 TYR H CZ 1 ATOM 1032 O OH . TYR B 2 90 ? 28.296 6.793 90.602 1.00 2.00 ? 94 TYR H OH 1 ATOM 1033 N N . ASN B 2 91 ? 29.627 4.129 85.131 1.00 37.77 ? 95 ASN H N 1 ATOM 1034 C CA . ASN B 2 91 ? 30.053 2.861 85.736 1.00 37.77 ? 95 ASN H CA 1 ATOM 1035 C C . ASN B 2 91 ? 30.153 2.882 87.270 1.00 37.77 ? 95 ASN H C 1 ATOM 1036 O O . ASN B 2 91 ? 31.242 2.770 87.833 1.00 24.10 ? 95 ASN H O 1 ATOM 1037 C CB . ASN B 2 91 ? 31.407 2.484 85.127 1.00 24.10 ? 95 ASN H CB 1 ATOM 1038 C CG . ASN B 2 91 ? 31.754 1.034 85.318 1.00 24.10 ? 95 ASN H CG 1 ATOM 1039 O OD1 . ASN B 2 91 ? 31.377 0.415 86.318 1.00 24.10 ? 95 ASN H OD1 1 ATOM 1040 N ND2 . ASN B 2 91 ? 32.481 0.476 84.354 1.00 24.10 ? 95 ASN H ND2 1 ATOM 1041 N N . TRP B 2 92 ? 29.015 2.946 87.949 1.00 52.09 ? 96 TRP H N 1 ATOM 1042 C CA . TRP B 2 92 ? 29.021 2.989 89.405 1.00 52.09 ? 96 TRP H CA 1 ATOM 1043 C C . TRP B 2 92 ? 29.342 1.668 90.113 1.00 52.09 ? 96 TRP H C 1 ATOM 1044 O O . TRP B 2 92 ? 29.309 1.611 91.345 1.00 45.77 ? 96 TRP H O 1 ATOM 1045 C CB . TRP B 2 92 ? 27.701 3.577 89.949 1.00 45.77 ? 96 TRP H CB 1 ATOM 1046 C CG . TRP B 2 92 ? 26.443 2.784 89.643 1.00 45.77 ? 96 TRP H CG 1 ATOM 1047 C CD1 . TRP B 2 92 ? 25.512 3.062 88.684 1.00 45.77 ? 96 TRP H CD1 1 ATOM 1048 C CD2 . TRP B 2 92 ? 25.990 1.588 90.305 1.00 45.77 ? 96 TRP H CD2 1 ATOM 1049 N NE1 . TRP B 2 92 ? 24.514 2.116 88.699 1.00 45.77 ? 96 TRP H NE1 1 ATOM 1050 C CE2 . TRP B 2 92 ? 24.781 1.201 89.683 1.00 45.77 ? 96 TRP H CE2 1 ATOM 1051 C CE3 . TRP B 2 92 ? 26.485 0.808 91.362 1.00 45.77 ? 96 TRP H CE3 1 ATOM 1052 C CZ2 . TRP B 2 92 ? 24.061 0.064 90.082 1.00 45.77 ? 96 TRP H CZ2 1 ATOM 1053 C CZ3 . TRP B 2 92 ? 25.770 -0.322 91.760 1.00 45.77 ? 96 TRP H CZ3 1 ATOM 1054 C CH2 . TRP B 2 92 ? 24.571 -0.681 91.118 1.00 45.77 ? 96 TRP H CH2 1 ATOM 1055 N N . LYS B 2 93 ? 29.693 0.623 89.363 1.00 53.20 ? 97 LYS H N 1 ATOM 1056 C CA . LYS B 2 93 ? 29.968 -0.665 90.002 1.00 53.20 ? 97 LYS H CA 1 ATOM 1057 C C . LYS B 2 93 ? 31.303 -1.344 89.689 1.00 53.20 ? 97 LYS H C 1 ATOM 1058 O O . LYS B 2 93 ? 31.709 -2.263 90.402 1.00 78.87 ? 97 LYS H O 1 ATOM 1059 C CB . LYS B 2 93 ? 28.819 -1.641 89.719 1.00 78.87 ? 97 LYS H CB 1 ATOM 1060 C CG . LYS B 2 93 ? 28.788 -2.152 88.294 1.00 78.87 ? 97 LYS H CG 1 ATOM 1061 C CD . LYS B 2 93 ? 27.510 -2.900 87.979 1.00 78.87 ? 97 LYS H CD 1 ATOM 1062 C CE . LYS B 2 93 ? 27.640 -3.586 86.627 1.00 78.87 ? 97 LYS H CE 1 ATOM 1063 N NZ . LYS B 2 93 ? 26.331 -3.827 85.953 1.00 78.87 ? 97 LYS H NZ 1 ATOM 1064 N N . GLU B 2 94 A 31.987 -0.904 88.638 1.00 82.11 ? 97 GLU H N 1 ATOM 1065 C CA . GLU B 2 94 A 33.260 -1.525 88.271 1.00 82.11 ? 97 GLU H CA 1 ATOM 1066 C C . GLU B 2 94 A 34.490 -0.607 88.365 1.00 82.11 ? 97 GLU H C 1 ATOM 1067 O O . GLU B 2 94 A 35.621 -1.100 88.505 1.00 25.82 ? 97 GLU H O 1 ATOM 1068 C CB . GLU B 2 94 A 33.127 -2.215 86.890 1.00 25.82 ? 97 GLU H CB 1 ATOM 1069 C CG . GLU B 2 94 A 34.235 -1.956 85.854 1.00 25.82 ? 97 GLU H CG 1 ATOM 1070 C CD . GLU B 2 94 A 35.417 -2.925 85.917 1.00 25.82 ? 97 GLU H CD 1 ATOM 1071 O OE1 . GLU B 2 94 A 35.491 -3.776 86.830 1.00 25.82 ? 97 GLU H OE1 1 ATOM 1072 O OE2 . GLU B 2 94 A 36.283 -2.830 85.022 1.00 25.82 ? 97 GLU H OE2 1 ATOM 1073 N N . ASN B 2 95 ? 34.272 0.713 88.336 1.00 22.38 ? 98 ASN H N 1 ATOM 1074 C CA . ASN B 2 95 ? 35.372 1.687 88.420 1.00 22.38 ? 98 ASN H CA 1 ATOM 1075 C C . ASN B 2 95 ? 34.962 3.152 88.475 1.00 22.38 ? 98 ASN H C 1 ATOM 1076 O O . ASN B 2 95 ? 35.795 4.026 88.252 1.00 2.00 ? 98 ASN H O 1 ATOM 1077 C CB . ASN B 2 95 ? 36.377 1.489 87.263 1.00 2.00 ? 98 ASN H CB 1 ATOM 1078 C CG . ASN B 2 95 ? 35.709 1.467 85.895 1.00 2.00 ? 98 ASN H CG 1 ATOM 1079 O OD1 . ASN B 2 95 ? 34.675 2.113 85.686 1.00 2.00 ? 98 ASN H OD1 1 ATOM 1080 N ND2 . ASN B 2 95 ? 36.274 0.691 84.966 1.00 2.00 ? 98 ASN H ND2 1 ATOM 1081 N N . LEU B 2 96 ? 33.695 3.412 88.800 1.00 49.79 ? 99 LEU H N 1 ATOM 1082 C CA . LEU B 2 96 ? 33.152 4.776 88.887 1.00 49.79 ? 99 LEU H CA 1 ATOM 1083 C C . LEU B 2 96 ? 33.476 5.581 87.633 1.00 49.79 ? 99 LEU H C 1 ATOM 1084 O O . LEU B 2 96 ? 33.746 6.785 87.709 1.00 9.38 ? 99 LEU H O 1 ATOM 1085 C CB . LEU B 2 96 ? 33.696 5.509 90.121 1.00 9.38 ? 99 LEU H CB 1 ATOM 1086 C CG . LEU B 2 96 ? 32.975 5.477 91.472 1.00 9.38 ? 99 LEU H CG 1 ATOM 1087 C CD1 . LEU B 2 96 ? 33.985 5.840 92.536 1.00 9.38 ? 99 LEU H CD1 1 ATOM 1088 C CD2 . LEU B 2 96 ? 31.814 6.454 91.517 1.00 9.38 ? 99 LEU H CD2 1 ATOM 1089 N N . ASP B 2 97 ? 33.452 4.911 86.484 1.00 13.84 ? 100 ASP H N 1 ATOM 1090 C CA . ASP B 2 97 ? 33.754 5.561 85.214 1.00 13.84 ? 100 ASP H CA 1 ATOM 1091 C C . ASP B 2 97 ? 32.652 6.538 84.800 1.00 13.84 ? 100 ASP H C 1 ATOM 1092 O O . ASP B 2 97 ? 31.510 6.427 85.261 1.00 2.00 ? 100 ASP H O 1 ATOM 1093 C CB . ASP B 2 97 ? 33.974 4.511 84.129 1.00 2.00 ? 100 ASP H CB 1 ATOM 1094 C CG . ASP B 2 97 ? 34.797 5.030 82.974 1.00 2.00 ? 100 ASP H CG 1 ATOM 1095 O OD1 . ASP B 2 97 ? 35.665 5.906 83.191 1.00 2.00 ? 100 ASP H OD1 1 ATOM 1096 O OD2 . ASP B 2 97 ? 34.576 4.551 81.842 1.00 2.00 ? 100 ASP H OD2 1 ATOM 1097 N N . ARG B 2 98 ? 33.018 7.498 83.948 1.00 20.21 ? 101 ARG H N 1 ATOM 1098 C CA . ARG B 2 98 ? 32.112 8.538 83.441 1.00 20.21 ? 101 ARG H CA 1 ATOM 1099 C C . ARG B 2 98 ? 31.285 9.166 84.559 1.00 20.21 ? 101 ARG H C 1 ATOM 1100 O O . ARG B 2 98 ? 30.066 9.396 84.432 1.00 2.00 ? 101 ARG H O 1 ATOM 1101 C CB . ARG B 2 98 ? 31.220 7.989 82.332 1.00 2.00 ? 101 ARG H CB 1 ATOM 1102 C CG . ARG B 2 98 ? 31.958 7.678 81.055 1.00 2.00 ? 101 ARG H CG 1 ATOM 1103 C CD . ARG B 2 98 ? 30.988 7.211 79.979 1.00 2.00 ? 101 ARG H CD 1 ATOM 1104 N NE . ARG B 2 98 ? 31.649 7.093 78.684 1.00 2.00 ? 101 ARG H NE 1 ATOM 1105 C CZ . ARG B 2 98 ? 32.144 5.960 78.197 1.00 2.00 ? 101 ARG H CZ 1 ATOM 1106 N NH1 . ARG B 2 98 ? 32.020 4.828 78.886 1.00 2.00 ? 101 ARG H NH1 1 ATOM 1107 N NH2 . ARG B 2 98 ? 32.744 5.958 77.009 1.00 2.00 ? 101 ARG H NH2 1 ATOM 1108 N N . ASP B 2 99 ? 32.005 9.489 85.632 1.00 17.11 ? 102 ASP H N 1 ATOM 1109 C CA . ASP B 2 99 ? 31.451 10.074 86.837 1.00 17.11 ? 102 ASP H CA 1 ATOM 1110 C C . ASP B 2 99 ? 31.267 11.587 86.724 1.00 17.11 ? 102 ASP H C 1 ATOM 1111 O O . ASP B 2 99 ? 31.946 12.355 87.404 1.00 2.03 ? 102 ASP H O 1 ATOM 1112 C CB . ASP B 2 99 ? 32.370 9.720 87.999 1.00 2.03 ? 102 ASP H CB 1 ATOM 1113 C CG . ASP B 2 99 ? 31.729 9.942 89.334 1.00 2.03 ? 102 ASP H CG 1 ATOM 1114 O OD1 . ASP B 2 99 ? 30.566 9.535 89.519 1.00 2.03 ? 102 ASP H OD1 1 ATOM 1115 O OD2 . ASP B 2 99 ? 32.405 10.514 90.205 1.00 2.03 ? 102 ASP H OD2 1 ATOM 1116 N N . ILE B 2 100 ? 30.291 11.991 85.909 1.00 28.95 ? 103 ILE H N 1 ATOM 1117 C CA . ILE B 2 100 ? 29.968 13.401 85.659 1.00 28.95 ? 103 ILE H CA 1 ATOM 1118 C C . ILE B 2 100 ? 28.443 13.631 85.580 1.00 28.95 ? 103 ILE H C 1 ATOM 1119 O O . ILE B 2 100 ? 27.697 12.776 85.095 1.00 2.00 ? 103 ILE H O 1 ATOM 1120 C CB . ILE B 2 100 ? 30.684 13.902 84.358 1.00 2.00 ? 103 ILE H CB 1 ATOM 1121 C CG1 . ILE B 2 100 ? 30.269 15.340 84.031 1.00 2.00 ? 103 ILE H CG1 1 ATOM 1122 C CG2 . ILE B 2 100 ? 30.424 12.937 83.193 1.00 2.00 ? 103 ILE H CG2 1 ATOM 1123 C CD1 . ILE B 2 100 ? 31.176 16.039 83.053 1.00 2.00 ? 103 ILE H CD1 1 ATOM 1124 N N . ALA B 2 101 ? 27.983 14.765 86.095 1.00 2.00 ? 104 ALA H N 1 ATOM 1125 C CA . ALA B 2 101 ? 26.568 15.076 86.088 1.00 2.00 ? 104 ALA H CA 1 ATOM 1126 C C . ALA B 2 101 ? 26.328 16.552 85.923 1.00 2.00 ? 104 ALA H C 1 ATOM 1127 O O . ALA B 2 101 ? 27.156 17.369 86.313 1.00 12.15 ? 104 ALA H O 1 ATOM 1128 C CB . ALA B 2 101 ? 25.923 14.592 87.360 1.00 12.15 ? 104 ALA H CB 1 ATOM 1129 N N . LEU B 2 102 ? 25.159 16.885 85.389 1.00 2.00 ? 105 LEU H N 1 ATOM 1130 C CA . LEU B 2 102 ? 24.771 18.268 85.149 1.00 2.00 ? 105 LEU H CA 1 ATOM 1131 C C . LEU B 2 102 ? 23.383 18.554 85.740 1.00 2.00 ? 105 LEU H C 1 ATOM 1132 O O . LEU B 2 102 ? 22.435 17.798 85.529 1.00 15.21 ? 105 LEU H O 1 ATOM 1133 C CB . LEU B 2 102 ? 24.747 18.533 83.639 1.00 15.21 ? 105 LEU H CB 1 ATOM 1134 C CG . LEU B 2 102 ? 25.106 19.930 83.124 1.00 15.21 ? 105 LEU H CG 1 ATOM 1135 C CD1 . LEU B 2 102 ? 26.614 20.117 83.185 1.00 15.21 ? 105 LEU H CD1 1 ATOM 1136 C CD2 . LEU B 2 102 ? 24.622 20.087 81.694 1.00 15.21 ? 105 LEU H CD2 1 ATOM 1137 N N . LEU B 2 103 ? 23.274 19.632 86.502 1.00 19.73 ? 106 LEU H N 1 ATOM 1138 C CA . LEU B 2 103 ? 22.005 20.025 87.100 1.00 19.73 ? 106 LEU H CA 1 ATOM 1139 C C . LEU B 2 103 ? 21.561 21.323 86.433 1.00 19.73 ? 106 LEU H C 1 ATOM 1140 O O . LEU B 2 103 ? 22.384 22.226 86.204 1.00 2.00 ? 106 LEU H O 1 ATOM 1141 C CB . LEU B 2 103 ? 22.166 20.276 88.605 1.00 2.00 ? 106 LEU H CB 1 ATOM 1142 C CG . LEU B 2 103 ? 23.096 19.397 89.445 1.00 2.00 ? 106 LEU H CG 1 ATOM 1143 C CD1 . LEU B 2 103 ? 23.316 20.081 90.762 1.00 2.00 ? 106 LEU H CD1 1 ATOM 1144 C CD2 . LEU B 2 103 ? 22.531 18.018 89.656 1.00 2.00 ? 106 LEU H CD2 1 ATOM 1145 N N . LYS B 2 104 ? 20.288 21.399 86.051 1.00 54.90 ? 107 LYS H N 1 ATOM 1146 C CA . LYS B 2 104 ? 19.784 22.630 85.447 1.00 54.90 ? 107 LYS H CA 1 ATOM 1147 C C . LYS B 2 104 ? 19.098 23.429 86.542 1.00 54.90 ? 107 LYS H C 1 ATOM 1148 O O . LYS B 2 104 ? 18.343 22.881 87.348 1.00 18.53 ? 107 LYS H O 1 ATOM 1149 C CB . LYS B 2 104 ? 18.776 22.372 84.330 1.00 18.53 ? 107 LYS H CB 1 ATOM 1150 C CG . LYS B 2 104 ? 18.488 23.645 83.531 1.00 18.53 ? 107 LYS H CG 1 ATOM 1151 C CD . LYS B 2 104 ? 17.012 23.838 83.239 1.00 18.53 ? 107 LYS H CD 1 ATOM 1152 C CE . LYS B 2 104 ? 16.430 22.656 82.481 1.00 18.53 ? 107 LYS H CE 1 ATOM 1153 N NZ . LYS B 2 104 ? 17.210 22.294 81.258 1.00 18.53 ? 107 LYS H NZ 1 ATOM 1154 N N . LEU B 2 105 ? 19.374 24.719 86.592 1.00 17.27 ? 108 LEU H N 1 ATOM 1155 C CA . LEU B 2 105 ? 18.744 25.532 87.598 1.00 17.27 ? 108 LEU H CA 1 ATOM 1156 C C . LEU B 2 105 ? 17.347 25.934 87.126 1.00 17.27 ? 108 LEU H C 1 ATOM 1157 O O . LEU B 2 105 ? 17.095 26.124 85.929 1.00 2.00 ? 108 LEU H O 1 ATOM 1158 C CB . LEU B 2 105 ? 19.593 26.768 87.917 1.00 2.00 ? 108 LEU H CB 1 ATOM 1159 C CG . LEU B 2 105 ? 21.000 26.623 88.510 1.00 2.00 ? 108 LEU H CG 1 ATOM 1160 C CD1 . LEU B 2 105 ? 21.520 28.011 88.797 1.00 2.00 ? 108 LEU H CD1 1 ATOM 1161 C CD2 . LEU B 2 105 ? 20.999 25.796 89.788 1.00 2.00 ? 108 LEU H CD2 1 ATOM 1162 N N . LYS B 2 106 ? 16.430 26.034 88.076 1.00 15.86 ? 109 LYS H N 1 ATOM 1163 C CA . LYS B 2 106 ? 15.067 26.446 87.784 1.00 15.86 ? 109 LYS H CA 1 ATOM 1164 C C . LYS B 2 106 ? 15.053 27.968 87.809 1.00 15.86 ? 109 LYS H C 1 ATOM 1165 O O . LYS B 2 106 ? 14.009 28.593 87.956 1.00 2.00 ? 109 LYS H O 1 ATOM 1166 C CB . LYS B 2 106 ? 14.110 25.872 88.841 1.00 2.00 ? 109 LYS H CB 1 ATOM 1167 C CG . LYS B 2 106 ? 12.623 26.081 88.546 1.00 2.00 ? 109 LYS H CG 1 ATOM 1168 C CD . LYS B 2 106 ? 11.760 25.053 89.267 1.00 2.00 ? 109 LYS H CD 1 ATOM 1169 C CE . LYS B 2 106 ? 11.952 25.083 90.785 1.00 2.00 ? 109 LYS H CE 1 ATOM 1170 N NZ . LYS B 2 106 ? 11.326 26.264 91.442 1.00 2.00 ? 109 LYS H NZ 1 ATOM 1171 N N . ARG B 2 107 ? 16.226 28.560 87.639 1.00 20.77 ? 110 ARG H N 1 ATOM 1172 C CA . ARG B 2 107 ? 16.363 30.002 87.687 1.00 20.77 ? 110 ARG H CA 1 ATOM 1173 C C . ARG B 2 107 ? 17.794 30.446 87.397 1.00 20.77 ? 110 ARG H C 1 ATOM 1174 O O . ARG B 2 107 ? 18.738 29.968 88.039 1.00 67.25 ? 110 ARG H O 1 ATOM 1175 C CB . ARG B 2 107 ? 15.951 30.505 89.084 1.00 67.25 ? 110 ARG H CB 1 ATOM 1176 C CG . ARG B 2 107 ? 16.538 31.853 89.508 1.00 67.25 ? 110 ARG H CG 1 ATOM 1177 C CD . ARG B 2 107 ? 17.480 31.693 90.701 1.00 67.25 ? 110 ARG H CD 1 ATOM 1178 N NE . ARG B 2 107 ? 18.049 32.973 91.115 1.00 67.25 ? 110 ARG H NE 1 ATOM 1179 C CZ . ARG B 2 107 ? 18.399 33.276 92.362 1.00 67.25 ? 110 ARG H CZ 1 ATOM 1180 N NH1 . ARG B 2 107 ? 18.248 32.388 93.338 1.00 67.25 ? 110 ARG H NH1 1 ATOM 1181 N NH2 . ARG B 2 107 ? 18.907 34.471 92.634 1.00 67.25 ? 110 ARG H NH2 1 ATOM 1182 N N . PRO B 2 108 ? 17.988 31.248 86.336 1.00 32.32 ? 111 PRO H N 1 ATOM 1183 C CA . PRO B 2 108 ? 19.353 31.705 86.065 1.00 32.32 ? 111 PRO H CA 1 ATOM 1184 C C . PRO B 2 108 ? 19.694 32.728 87.161 1.00 32.32 ? 111 PRO H C 1 ATOM 1185 O O . PRO B 2 108 ? 18.981 33.725 87.340 1.00 2.00 ? 111 PRO H O 1 ATOM 1186 C CB . PRO B 2 108 ? 19.248 32.341 84.673 1.00 2.00 ? 111 PRO H CB 1 ATOM 1187 C CG . PRO B 2 108 ? 17.799 32.674 84.532 1.00 2.00 ? 111 PRO H CG 1 ATOM 1188 C CD . PRO B 2 108 ? 17.107 31.511 85.188 1.00 2.00 ? 111 PRO H CD 1 ATOM 1189 N N . ILE B 2 109 ? 20.714 32.405 87.959 1.00 38.13 ? 112 ILE H N 1 ATOM 1190 C CA . ILE B 2 109 ? 21.153 33.249 89.075 1.00 38.13 ? 112 ILE H CA 1 ATOM 1191 C C . ILE B 2 109 ? 21.753 34.616 88.750 1.00 38.13 ? 112 ILE H C 1 ATOM 1192 O O . ILE B 2 109 ? 22.309 34.847 87.674 1.00 19.63 ? 112 ILE H O 1 ATOM 1193 C CB . ILE B 2 109 ? 22.113 32.493 90.056 1.00 19.63 ? 112 ILE H CB 1 ATOM 1194 C CG1 . ILE B 2 109 ? 22.963 31.446 89.328 1.00 19.63 ? 112 ILE H CG1 1 ATOM 1195 C CG2 . ILE B 2 109 ? 21.314 31.817 91.148 1.00 19.63 ? 112 ILE H CG2 1 ATOM 1196 C CD1 . ILE B 2 109 ? 23.958 31.998 88.355 1.00 19.63 ? 112 ILE H CD1 1 ATOM 1197 N N . GLU B 2 110 ? 21.658 35.513 89.722 1.00 11.70 ? 113 GLU H N 1 ATOM 1198 C CA . GLU B 2 110 ? 22.164 36.865 89.575 1.00 11.70 ? 113 GLU H CA 1 ATOM 1199 C C . GLU B 2 110 ? 23.677 36.891 89.818 1.00 11.70 ? 113 GLU H C 1 ATOM 1200 O O . GLU B 2 110 ? 24.120 37.062 90.953 1.00 18.10 ? 113 GLU H O 1 ATOM 1201 C CB . GLU B 2 110 ? 21.436 37.782 90.567 1.00 18.10 ? 113 GLU H CB 1 ATOM 1202 C CG . GLU B 2 110 ? 21.174 39.192 90.064 1.00 18.10 ? 113 GLU H CG 1 ATOM 1203 C CD . GLU B 2 110 ? 22.450 39.959 89.804 1.00 18.10 ? 113 GLU H CD 1 ATOM 1204 O OE1 . GLU B 2 110 ? 23.250 40.092 90.763 1.00 18.10 ? 113 GLU H OE1 1 ATOM 1205 O OE2 . GLU B 2 110 ? 22.645 40.414 88.648 1.00 18.10 ? 113 GLU H OE2 1 ATOM 1206 N N . LEU B 2 111 ? 24.453 36.708 88.749 1.00 2.00 ? 114 LEU H N 1 ATOM 1207 C CA . LEU B 2 111 ? 25.914 36.697 88.819 1.00 2.00 ? 114 LEU H CA 1 ATOM 1208 C C . LEU B 2 111 ? 26.514 37.918 89.506 1.00 2.00 ? 114 LEU H C 1 ATOM 1209 O O . LEU B 2 111 ? 26.424 39.036 88.999 1.00 2.00 ? 114 LEU H O 1 ATOM 1210 C CB . LEU B 2 111 ? 26.514 36.594 87.429 1.00 2.00 ? 114 LEU H CB 1 ATOM 1211 C CG . LEU B 2 111 ? 26.805 35.228 86.839 1.00 2.00 ? 114 LEU H CG 1 ATOM 1212 C CD1 . LEU B 2 111 ? 25.546 34.410 86.814 1.00 2.00 ? 114 LEU H CD1 1 ATOM 1213 C CD2 . LEU B 2 111 ? 27.350 35.417 85.430 1.00 2.00 ? 114 LEU H CD2 1 ATOM 1214 N N . SER B 2 112 ? 27.210 37.675 90.610 1.00 2.00 ? 115 SER H N 1 ATOM 1215 C CA . SER B 2 112 ? 27.836 38.725 91.399 1.00 2.00 ? 115 SER H CA 1 ATOM 1216 C C . SER B 2 112 ? 29.350 38.595 91.375 1.00 2.00 ? 115 SER H C 1 ATOM 1217 O O . SER B 2 112 ? 29.898 37.763 90.658 1.00 2.00 ? 115 SER H O 1 ATOM 1218 C CB . SER B 2 112 ? 27.337 38.632 92.843 1.00 2.00 ? 115 SER H CB 1 ATOM 1219 O OG . SER B 2 112 ? 25.917 38.658 92.894 1.00 2.00 ? 115 SER H OG 1 ATOM 1220 N N . ASP B 2 113 ? 30.024 39.398 92.189 1.00 2.00 ? 116 ASP H N 1 ATOM 1221 C CA . ASP B 2 113 ? 31.485 39.353 92.276 1.00 2.00 ? 116 ASP H CA 1 ATOM 1222 C C . ASP B 2 113 ? 31.947 37.986 92.794 1.00 2.00 ? 116 ASP H C 1 ATOM 1223 O O . ASP B 2 113 ? 33.125 37.631 92.677 1.00 21.63 ? 116 ASP H O 1 ATOM 1224 C CB . ASP B 2 113 ? 32.017 40.432 93.239 1.00 21.63 ? 116 ASP H CB 1 ATOM 1225 C CG . ASP B 2 113 ? 31.840 41.852 92.714 1.00 21.63 ? 116 ASP H CG 1 ATOM 1226 O OD1 . ASP B 2 113 ? 31.160 42.042 91.683 1.00 21.63 ? 116 ASP H OD1 1 ATOM 1227 O OD2 . ASP B 2 113 ? 32.381 42.789 93.344 1.00 21.63 ? 116 ASP H OD2 1 ATOM 1228 N N . TYR B 2 114 ? 31.011 37.235 93.375 1.00 2.00 ? 117 TYR H N 1 ATOM 1229 C CA . TYR B 2 114 ? 31.301 35.920 93.944 1.00 2.00 ? 117 TYR H CA 1 ATOM 1230 C C . TYR B 2 114 ? 30.721 34.752 93.149 1.00 2.00 ? 117 TYR H C 1 ATOM 1231 O O . TYR B 2 114 ? 31.161 33.620 93.293 1.00 2.00 ? 117 TYR H O 1 ATOM 1232 C CB . TYR B 2 114 ? 30.814 35.876 95.393 1.00 2.00 ? 117 TYR H CB 1 ATOM 1233 C CG . TYR B 2 114 ? 31.224 37.102 96.180 1.00 2.00 ? 117 TYR H CG 1 ATOM 1234 C CD1 . TYR B 2 114 ? 32.516 37.221 96.692 1.00 2.00 ? 117 TYR H CD1 1 ATOM 1235 C CD2 . TYR B 2 114 ? 30.335 38.169 96.366 1.00 2.00 ? 117 TYR H CD2 1 ATOM 1236 C CE1 . TYR B 2 114 ? 32.918 38.368 97.364 1.00 2.00 ? 117 TYR H CE1 1 ATOM 1237 C CE2 . TYR B 2 114 ? 30.729 39.324 97.040 1.00 2.00 ? 117 TYR H CE2 1 ATOM 1238 C CZ . TYR B 2 114 ? 32.025 39.416 97.535 1.00 2.00 ? 117 TYR H CZ 1 ATOM 1239 O OH . TYR B 2 114 ? 32.443 40.549 98.195 1.00 2.00 ? 117 TYR H OH 1 ATOM 1240 N N . ILE B 2 115 ? 29.696 35.020 92.355 1.00 2.00 ? 118 ILE H N 1 ATOM 1241 C CA . ILE B 2 115 ? 29.096 33.987 91.539 1.00 2.00 ? 118 ILE H CA 1 ATOM 1242 C C . ILE B 2 115 ? 29.568 34.298 90.122 1.00 2.00 ? 118 ILE H C 1 ATOM 1243 O O . ILE B 2 115 ? 29.029 35.184 89.468 1.00 2.00 ? 118 ILE H O 1 ATOM 1244 C CB . ILE B 2 115 ? 27.554 34.045 91.603 1.00 2.00 ? 118 ILE H CB 1 ATOM 1245 C CG1 . ILE B 2 115 ? 27.047 33.738 93.011 1.00 2.00 ? 118 ILE H CG1 1 ATOM 1246 C CG2 . ILE B 2 115 ? 26.946 33.080 90.631 1.00 2.00 ? 118 ILE H CG2 1 ATOM 1247 C CD1 . ILE B 2 115 ? 26.880 34.964 93.887 1.00 2.00 ? 118 ILE H CD1 1 ATOM 1248 N N . HIS B 2 116 ? 30.601 33.608 89.659 1.00 2.00 ? 119 HIS H N 1 ATOM 1249 C CA . HIS B 2 116 ? 31.122 33.849 88.321 1.00 2.00 ? 119 HIS H CA 1 ATOM 1250 C C . HIS B 2 116 ? 31.712 32.556 87.799 1.00 2.00 ? 119 HIS H C 1 ATOM 1251 O O . HIS B 2 116 ? 32.759 32.142 88.266 1.00 35.22 ? 119 HIS H O 1 ATOM 1252 C CB . HIS B 2 116 ? 32.210 34.920 88.394 1.00 35.22 ? 119 HIS H CB 1 ATOM 1253 C CG . HIS B 2 116 ? 32.568 35.526 87.072 1.00 35.22 ? 119 HIS H CG 1 ATOM 1254 N ND1 . HIS B 2 116 ? 31.649 36.175 86.275 1.00 35.22 ? 119 HIS H ND1 1 ATOM 1255 C CD2 . HIS B 2 116 ? 33.755 35.616 86.425 1.00 35.22 ? 119 HIS H CD2 1 ATOM 1256 C CE1 . HIS B 2 116 ? 32.256 36.642 85.196 1.00 35.22 ? 119 HIS H CE1 1 ATOM 1257 N NE2 . HIS B 2 116 ? 33.533 36.317 85.263 1.00 35.22 ? 119 HIS H NE2 1 ATOM 1258 N N . PRO B 2 117 ? 31.054 31.911 86.812 1.00 27.00 ? 120 PRO H N 1 ATOM 1259 C CA . PRO B 2 117 ? 31.430 30.645 86.156 1.00 27.00 ? 120 PRO H CA 1 ATOM 1260 C C . PRO B 2 117 ? 32.860 30.399 85.636 1.00 27.00 ? 120 PRO H C 1 ATOM 1261 O O . PRO B 2 117 ? 33.647 31.327 85.366 1.00 12.87 ? 120 PRO H O 1 ATOM 1262 C CB . PRO B 2 117 ? 30.385 30.505 85.042 1.00 12.87 ? 120 PRO H CB 1 ATOM 1263 C CG . PRO B 2 117 ? 29.903 31.902 84.810 1.00 12.87 ? 120 PRO H CG 1 ATOM 1264 C CD . PRO B 2 117 ? 29.803 32.415 86.226 1.00 12.87 ? 120 PRO H CD 1 ATOM 1265 N N . VAL B 2 118 ? 33.166 29.114 85.488 1.00 2.00 ? 121 VAL H N 1 ATOM 1266 C CA . VAL B 2 118 ? 34.464 28.649 85.022 1.00 2.00 ? 121 VAL H CA 1 ATOM 1267 C C . VAL B 2 118 ? 34.375 28.353 83.521 1.00 2.00 ? 121 VAL H C 1 ATOM 1268 O O . VAL B 2 118 ? 33.281 28.299 82.970 1.00 12.08 ? 121 VAL H O 1 ATOM 1269 C CB . VAL B 2 118 ? 34.854 27.344 85.797 1.00 12.08 ? 121 VAL H CB 1 ATOM 1270 C CG1 . VAL B 2 118 ? 33.959 26.168 85.382 1.00 12.08 ? 121 VAL H CG1 1 ATOM 1271 C CG2 . VAL B 2 118 ? 36.319 27.011 85.616 1.00 12.08 ? 121 VAL H CG2 1 ATOM 1272 N N . CYS B 2 119 ? 35.516 28.195 82.857 1.00 2.00 ? 122 CYS H N 1 ATOM 1273 C CA . CYS B 2 119 ? 35.538 27.872 81.434 1.00 2.00 ? 122 CYS H CA 1 ATOM 1274 C C . CYS B 2 119 ? 35.778 26.376 81.254 1.00 2.00 ? 122 CYS H C 1 ATOM 1275 O O . CYS B 2 119 ? 36.359 25.736 82.124 1.00 2.00 ? 122 CYS H O 1 ATOM 1276 C CB . CYS B 2 119 ? 36.661 28.635 80.741 1.00 2.00 ? 122 CYS H CB 1 ATOM 1277 S SG . CYS B 2 119 ? 36.548 30.453 80.822 1.00 2.00 ? 122 CYS H SG 1 ATOM 1278 N N . LEU B 2 120 ? 35.290 25.811 80.152 1.00 2.00 ? 123 LEU H N 1 ATOM 1279 C CA . LEU B 2 120 ? 35.488 24.390 79.840 1.00 2.00 ? 123 LEU H CA 1 ATOM 1280 C C . LEU B 2 120 ? 36.684 24.333 78.888 1.00 2.00 ? 123 LEU H C 1 ATOM 1281 O O . LEU B 2 120 ? 36.994 25.332 78.242 1.00 24.52 ? 123 LEU H O 1 ATOM 1282 C CB . LEU B 2 120 ? 34.212 23.782 79.230 1.00 24.52 ? 123 LEU H CB 1 ATOM 1283 C CG . LEU B 2 120 ? 33.121 23.350 80.234 1.00 24.52 ? 123 LEU H CG 1 ATOM 1284 C CD1 . LEU B 2 120 ? 31.729 23.507 79.659 1.00 24.52 ? 123 LEU H CD1 1 ATOM 1285 C CD2 . LEU B 2 120 ? 33.346 21.919 80.666 1.00 24.52 ? 123 LEU H CD2 1 ATOM 1286 N N . PRO B 2 121 ? 37.367 23.178 78.781 1.00 22.18 ? 124 PRO H N 1 ATOM 1287 C CA . PRO B 2 121 ? 38.540 23.054 77.899 1.00 22.18 ? 124 PRO H CA 1 ATOM 1288 C C . PRO B 2 121 ? 38.306 23.096 76.381 1.00 22.18 ? 124 PRO H C 1 ATOM 1289 O O . PRO B 2 121 ? 37.302 22.586 75.871 1.00 25.06 ? 124 PRO H O 1 ATOM 1290 C CB . PRO B 2 121 ? 39.143 21.689 78.295 1.00 25.06 ? 124 PRO H CB 1 ATOM 1291 C CG . PRO B 2 121 ? 38.372 21.243 79.529 1.00 25.06 ? 124 PRO H CG 1 ATOM 1292 C CD . PRO B 2 121 ? 37.023 21.874 79.369 1.00 25.06 ? 124 PRO H CD 1 ATOM 1293 N N . ASP B 2 122 ? 39.239 23.717 75.665 1.00 2.00 ? 125 ASP H N 1 ATOM 1294 C CA . ASP B 2 122 ? 39.172 23.752 74.210 1.00 2.00 ? 125 ASP H CA 1 ATOM 1295 C C . ASP B 2 122 ? 40.338 22.881 73.770 1.00 2.00 ? 125 ASP H C 1 ATOM 1296 O O . ASP B 2 122 ? 41.340 22.802 74.487 1.00 2.00 ? 125 ASP H O 1 ATOM 1297 C CB . ASP B 2 122 ? 39.277 25.178 73.660 1.00 2.00 ? 125 ASP H CB 1 ATOM 1298 C CG . ASP B 2 122 ? 40.536 25.898 74.093 1.00 2.00 ? 125 ASP H CG 1 ATOM 1299 O OD1 . ASP B 2 122 ? 41.578 25.742 73.423 1.00 2.00 ? 125 ASP H OD1 1 ATOM 1300 O OD2 . ASP B 2 122 ? 40.466 26.657 75.083 1.00 2.00 ? 125 ASP H OD2 1 ATOM 1301 N N . LYS B 2 123 ? 40.201 22.214 72.626 1.00 2.00 ? 126 LYS H N 1 ATOM 1302 C CA . LYS B 2 123 ? 41.229 21.302 72.123 1.00 2.00 ? 126 LYS H CA 1 ATOM 1303 C C . LYS B 2 123 ? 42.643 21.713 72.462 1.00 2.00 ? 126 LYS H C 1 ATOM 1304 O O . LYS B 2 123 ? 43.447 20.888 72.904 1.00 6.50 ? 126 LYS H O 1 ATOM 1305 C CB . LYS B 2 123 ? 41.135 21.113 70.617 1.00 6.50 ? 126 LYS H CB 1 ATOM 1306 C CG . LYS B 2 123 ? 41.928 19.904 70.140 1.00 6.50 ? 126 LYS H CG 1 ATOM 1307 C CD . LYS B 2 123 ? 42.579 20.111 68.773 1.00 6.50 ? 126 LYS H CD 1 ATOM 1308 C CE . LYS B 2 123 ? 43.952 20.774 68.895 1.00 6.50 ? 126 LYS H CE 1 ATOM 1309 N NZ . LYS B 2 123 ? 44.609 20.916 67.570 1.00 6.50 ? 126 LYS H NZ 1 ATOM 1310 N N . GLN B 2 124 ? 42.925 22.998 72.279 1.00 2.00 ? 127 GLN H N 1 ATOM 1311 C CA . GLN B 2 124 ? 44.244 23.569 72.536 1.00 2.00 ? 127 GLN H CA 1 ATOM 1312 C C . GLN B 2 124 ? 44.622 23.643 74.015 1.00 2.00 ? 127 GLN H C 1 ATOM 1313 O O . GLN B 2 124 ? 45.734 23.293 74.398 1.00 24.55 ? 127 GLN H O 1 ATOM 1314 C CB . GLN B 2 124 ? 44.352 24.958 71.904 1.00 24.55 ? 127 GLN H CB 1 ATOM 1315 C CG . GLN B 2 124 ? 44.376 24.951 70.373 1.00 24.55 ? 127 GLN H CG 1 ATOM 1316 C CD . GLN B 2 124 ? 43.098 24.409 69.735 1.00 24.55 ? 127 GLN H CD 1 ATOM 1317 O OE1 . GLN B 2 124 ? 41.999 24.531 70.288 1.00 24.55 ? 127 GLN H OE1 1 ATOM 1318 N NE2 . GLN B 2 124 ? 43.240 23.812 68.557 1.00 24.55 ? 127 GLN H NE2 1 ATOM 1319 N N . THR B 2 125 ? 43.700 24.114 74.842 1.00 9.54 ? 128 THR H N 1 ATOM 1320 C CA . THR B 2 125 ? 43.950 24.230 76.273 1.00 9.54 ? 128 THR H CA 1 ATOM 1321 C C . THR B 2 125 ? 44.105 22.857 76.921 1.00 9.54 ? 128 THR H C 1 ATOM 1322 O O . THR B 2 125 ? 44.945 22.663 77.806 1.00 13.65 ? 128 THR H O 1 ATOM 1323 C CB . THR B 2 125 ? 42.811 25.015 76.962 1.00 13.65 ? 128 THR H CB 1 ATOM 1324 O OG1 . THR B 2 125 ? 42.783 26.352 76.439 1.00 13.65 ? 128 THR H OG1 1 ATOM 1325 C CG2 . THR B 2 125 ? 42.998 25.056 78.483 1.00 13.65 ? 128 THR H CG2 1 ATOM 1326 N N . ALA B 2 126 ? 43.283 21.909 76.481 1.00 12.59 ? 129 ALA H N 1 ATOM 1327 C CA . ALA B 2 126 ? 43.334 20.557 77.012 1.00 12.59 ? 129 ALA H CA 1 ATOM 1328 C C . ALA B 2 126 ? 44.717 20.025 76.709 1.00 12.59 ? 129 ALA H C 1 ATOM 1329 O O . ALA B 2 126 ? 45.422 19.591 77.604 1.00 2.00 ? 129 ALA H O 1 ATOM 1330 C CB . ALA B 2 126 ? 42.268 19.694 76.362 1.00 2.00 ? 129 ALA H CB 1 ATOM 1331 N N . ALA B 2 127 A 45.144 20.226 75.467 1.00 19.30 ? 129 ALA H N 1 ATOM 1332 C CA . ALA B 2 127 A 46.450 19.770 74.977 1.00 19.30 ? 129 ALA H CA 1 ATOM 1333 C C . ALA B 2 127 A 47.665 20.446 75.593 1.00 19.30 ? 129 ALA H C 1 ATOM 1334 O O . ALA B 2 127 A 48.642 19.780 75.941 1.00 36.18 ? 129 ALA H O 1 ATOM 1335 C CB . ALA B 2 127 A 46.509 19.915 73.448 1.00 36.18 ? 129 ALA H CB 1 ATOM 1336 N N . LYS B 2 128 B 47.627 21.771 75.651 1.00 13.90 ? 129 LYS H N 1 ATOM 1337 C CA . LYS B 2 128 B 48.718 22.554 76.203 1.00 13.90 ? 129 LYS H CA 1 ATOM 1338 C C . LYS B 2 128 B 48.864 22.432 77.719 1.00 13.90 ? 129 LYS H C 1 ATOM 1339 O O . LYS B 2 128 B 49.951 22.141 78.224 1.00 23.31 ? 129 LYS H O 1 ATOM 1340 C CB . LYS B 2 128 B 48.532 24.017 75.829 1.00 23.31 ? 129 LYS H CB 1 ATOM 1341 C CG . LYS B 2 128 B 48.453 24.259 74.337 1.00 23.31 ? 129 LYS H CG 1 ATOM 1342 C CD . LYS B 2 128 B 48.495 25.749 74.014 1.00 23.31 ? 129 LYS H CD 1 ATOM 1343 C CE . LYS B 2 128 B 49.596 26.055 72.994 1.00 23.31 ? 129 LYS H CE 1 ATOM 1344 N NZ . LYS B 2 128 B 49.868 27.513 72.826 1.00 23.31 ? 129 LYS H NZ 1 ATOM 1345 N N . LEU B 2 129 C 47.763 22.625 78.438 1.00 4.21 ? 129 LEU H N 1 ATOM 1346 C CA . LEU B 2 129 C 47.768 22.583 79.895 1.00 4.21 ? 129 LEU H CA 1 ATOM 1347 C C . LEU B 2 129 C 47.847 21.229 80.562 1.00 4.21 ? 129 LEU H C 1 ATOM 1348 O O . LEU B 2 129 C 48.584 21.077 81.530 1.00 2.00 ? 129 LEU H O 1 ATOM 1349 C CB . LEU B 2 129 C 46.553 23.330 80.456 1.00 2.00 ? 129 LEU H CB 1 ATOM 1350 C CG . LEU B 2 129 C 46.484 24.853 80.460 1.00 2.00 ? 129 LEU H CG 1 ATOM 1351 C CD1 . LEU B 2 129 C 47.514 25.382 81.404 1.00 2.00 ? 129 LEU H CD1 1 ATOM 1352 C CD2 . LEU B 2 129 C 46.684 25.410 79.072 1.00 2.00 ? 129 LEU H CD2 1 ATOM 1353 N N . LEU B 2 130 ? 47.082 20.252 80.074 1.00 2.00 ? 130 LEU H N 1 ATOM 1354 C CA . LEU B 2 130 ? 47.054 18.936 80.710 1.00 2.00 ? 130 LEU H CA 1 ATOM 1355 C C . LEU B 2 130 ? 48.298 18.105 80.552 1.00 2.00 ? 130 LEU H C 1 ATOM 1356 O O . LEU B 2 130 ? 48.307 17.096 79.865 1.00 2.00 ? 130 LEU H O 1 ATOM 1357 C CB . LEU B 2 130 ? 45.804 18.153 80.325 1.00 2.00 ? 130 LEU H CB 1 ATOM 1358 C CG . LEU B 2 130 ? 44.982 17.720 81.548 1.00 2.00 ? 130 LEU H CG 1 ATOM 1359 C CD1 . LEU B 2 130 ? 43.498 17.942 81.292 1.00 2.00 ? 130 LEU H CD1 1 ATOM 1360 C CD2 . LEU B 2 130 ? 45.262 16.249 81.914 1.00 2.00 ? 130 LEU H CD2 1 ATOM 1361 N N . HIS B 2 131 ? 49.353 18.534 81.226 1.00 2.00 ? 131 HIS H N 1 ATOM 1362 C CA . HIS B 2 131 ? 50.614 17.829 81.179 1.00 2.00 ? 131 HIS H CA 1 ATOM 1363 C C . HIS B 2 131 ? 51.023 17.362 82.562 1.00 2.00 ? 131 HIS H C 1 ATOM 1364 O O . HIS B 2 131 ? 50.809 18.057 83.561 1.00 2.00 ? 131 HIS H O 1 ATOM 1365 C CB . HIS B 2 131 ? 51.713 18.704 80.569 1.00 2.00 ? 131 HIS H CB 1 ATOM 1366 C CG . HIS B 2 131 ? 51.670 18.770 79.074 1.00 2.00 ? 131 HIS H CG 1 ATOM 1367 N ND1 . HIS B 2 131 ? 51.328 19.914 78.386 1.00 2.00 ? 131 HIS H ND1 1 ATOM 1368 C CD2 . HIS B 2 131 ? 51.924 17.829 78.133 1.00 2.00 ? 131 HIS H CD2 1 ATOM 1369 C CE1 . HIS B 2 131 ? 51.373 19.679 77.087 1.00 2.00 ? 131 HIS H CE1 1 ATOM 1370 N NE2 . HIS B 2 131 ? 51.733 18.420 76.908 1.00 2.00 ? 131 HIS H NE2 1 ATOM 1371 N N . ALA B 2 132 ? 51.568 16.149 82.598 1.00 2.00 ? 132 ALA H N 1 ATOM 1372 C CA . ALA B 2 132 ? 52.039 15.537 83.821 1.00 2.00 ? 132 ALA H CA 1 ATOM 1373 C C . ALA B 2 132 ? 53.042 16.492 84.454 1.00 2.00 ? 132 ALA H C 1 ATOM 1374 O O . ALA B 2 132 ? 54.015 16.904 83.820 1.00 2.00 ? 132 ALA H O 1 ATOM 1375 C CB . ALA B 2 132 ? 52.686 14.192 83.509 1.00 2.00 ? 132 ALA H CB 1 ATOM 1376 N N . GLY B 2 133 ? 52.740 16.901 85.679 1.00 2.00 ? 133 GLY H N 1 ATOM 1377 C CA . GLY B 2 133 ? 53.601 17.816 86.393 1.00 2.00 ? 133 GLY H CA 1 ATOM 1378 C C . GLY B 2 133 ? 52.893 19.131 86.622 1.00 2.00 ? 133 GLY H C 1 ATOM 1379 O O . GLY B 2 133 ? 53.046 19.761 87.677 1.00 43.68 ? 133 GLY H O 1 ATOM 1380 N N . PHE B 2 134 ? 52.077 19.524 85.653 1.00 2.00 ? 134 PHE H N 1 ATOM 1381 C CA . PHE B 2 134 ? 51.336 20.775 85.730 1.00 2.00 ? 134 PHE H CA 1 ATOM 1382 C C . PHE B 2 134 ? 50.306 20.772 86.855 1.00 2.00 ? 134 PHE H C 1 ATOM 1383 O O . PHE B 2 134 ? 49.420 19.917 86.908 1.00 2.00 ? 134 PHE H O 1 ATOM 1384 C CB . PHE B 2 134 ? 50.698 21.072 84.378 1.00 2.00 ? 134 PHE H CB 1 ATOM 1385 C CG . PHE B 2 134 ? 51.699 21.354 83.288 1.00 2.00 ? 134 PHE H CG 1 ATOM 1386 C CD1 . PHE B 2 134 ? 53.061 21.203 83.521 1.00 2.00 ? 134 PHE H CD1 1 ATOM 1387 C CD2 . PHE B 2 134 ? 51.281 21.777 82.033 1.00 2.00 ? 134 PHE H CD2 1 ATOM 1388 C CE1 . PHE B 2 134 ? 53.984 21.465 82.527 1.00 2.00 ? 134 PHE H CE1 1 ATOM 1389 C CE2 . PHE B 2 134 ? 52.204 22.042 81.026 1.00 2.00 ? 134 PHE H CE2 1 ATOM 1390 C CZ . PHE B 2 134 ? 53.555 21.885 81.276 1.00 2.00 ? 134 PHE H CZ 1 ATOM 1391 N N . LYS B 2 135 ? 50.457 21.712 87.782 1.00 2.00 ? 135 LYS H N 1 ATOM 1392 C CA . LYS B 2 135 ? 49.573 21.793 88.937 1.00 2.00 ? 135 LYS H CA 1 ATOM 1393 C C . LYS B 2 135 ? 48.158 22.266 88.654 1.00 2.00 ? 135 LYS H C 1 ATOM 1394 O O . LYS B 2 135 ? 47.922 23.090 87.767 1.00 2.00 ? 135 LYS H O 1 ATOM 1395 C CB . LYS B 2 135 ? 50.183 22.675 90.032 1.00 2.00 ? 135 LYS H CB 1 ATOM 1396 C CG . LYS B 2 135 ? 51.459 22.156 90.716 1.00 2.00 ? 135 LYS H CG 1 ATOM 1397 C CD . LYS B 2 135 ? 51.868 23.155 91.821 1.00 2.00 ? 135 LYS H CD 1 ATOM 1398 C CE . LYS B 2 135 ? 53.292 22.988 92.331 1.00 2.00 ? 135 LYS H CE 1 ATOM 1399 N NZ . LYS B 2 135 ? 53.486 21.885 93.315 1.00 2.00 ? 135 LYS H NZ 1 ATOM 1400 N N . GLY B 2 136 ? 47.233 21.768 89.467 1.00 2.00 ? 136 GLY H N 1 ATOM 1401 C CA . GLY B 2 136 ? 45.842 22.136 89.347 1.00 2.00 ? 136 GLY H CA 1 ATOM 1402 C C . GLY B 2 136 ? 45.295 22.406 90.728 1.00 2.00 ? 136 GLY H C 1 ATOM 1403 O O . GLY B 2 136 ? 45.542 21.642 91.653 1.00 2.66 ? 136 GLY H O 1 ATOM 1404 N N . ARG B 2 137 ? 44.592 23.522 90.865 1.00 2.00 ? 137 ARG H N 1 ATOM 1405 C CA . ARG B 2 137 ? 44.003 23.942 92.119 1.00 2.00 ? 137 ARG H CA 1 ATOM 1406 C C . ARG B 2 137 ? 42.674 23.267 92.356 1.00 2.00 ? 137 ARG H C 1 ATOM 1407 O O . ARG B 2 137 ? 41.836 23.232 91.460 1.00 2.00 ? 137 ARG H O 1 ATOM 1408 C CB . ARG B 2 137 ? 43.789 25.455 92.094 1.00 2.00 ? 137 ARG H CB 1 ATOM 1409 C CG . ARG B 2 137 ? 43.304 26.047 93.407 1.00 2.00 ? 137 ARG H CG 1 ATOM 1410 C CD . ARG B 2 137 ? 42.730 27.459 93.244 1.00 2.00 ? 137 ARG H CD 1 ATOM 1411 N NE . ARG B 2 137 ? 43.625 28.386 92.550 1.00 2.00 ? 137 ARG H NE 1 ATOM 1412 C CZ . ARG B 2 137 ? 44.646 29.033 93.109 1.00 2.00 ? 137 ARG H CZ 1 ATOM 1413 N NH1 . ARG B 2 137 ? 44.945 28.859 94.388 1.00 2.00 ? 137 ARG H NH1 1 ATOM 1414 N NH2 . ARG B 2 137 ? 45.382 29.854 92.376 1.00 2.00 ? 137 ARG H NH2 1 ATOM 1415 N N . VAL B 2 138 ? 42.495 22.714 93.553 1.00 2.00 ? 138 VAL H N 1 ATOM 1416 C CA . VAL B 2 138 ? 41.240 22.073 93.944 1.00 2.00 ? 138 VAL H CA 1 ATOM 1417 C C . VAL B 2 138 ? 40.734 22.683 95.244 1.00 2.00 ? 138 VAL H C 1 ATOM 1418 O O . VAL B 2 138 ? 41.487 22.835 96.196 1.00 2.00 ? 138 VAL H O 1 ATOM 1419 C CB . VAL B 2 138 ? 41.313 20.500 93.994 1.00 2.00 ? 138 VAL H CB 1 ATOM 1420 C CG1 . VAL B 2 138 ? 42.673 20.011 94.435 1.00 2.00 ? 138 VAL H CG1 1 ATOM 1421 C CG2 . VAL B 2 138 ? 40.200 19.940 94.882 1.00 2.00 ? 138 VAL H CG2 1 ATOM 1422 N N . THR B 2 139 ? 39.469 23.086 95.242 1.00 2.00 ? 139 THR H N 1 ATOM 1423 C CA . THR B 2 139 ? 38.821 23.724 96.384 1.00 2.00 ? 139 THR H CA 1 ATOM 1424 C C . THR B 2 139 ? 37.712 22.857 96.967 1.00 2.00 ? 139 THR H C 1 ATOM 1425 O O . THR B 2 139 ? 37.170 22.007 96.280 1.00 2.00 ? 139 THR H O 1 ATOM 1426 C CB . THR B 2 139 ? 38.184 25.071 95.956 1.00 2.00 ? 139 THR H CB 1 ATOM 1427 O OG1 . THR B 2 139 ? 38.190 25.189 94.523 1.00 2.00 ? 139 THR H OG1 1 ATOM 1428 C CG2 . THR B 2 139 ? 38.933 26.228 96.562 1.00 2.00 ? 139 THR H CG2 1 ATOM 1429 N N . GLY B 2 140 ? 37.352 23.102 98.222 1.00 27.94 ? 140 GLY H N 1 ATOM 1430 C CA . GLY B 2 140 ? 36.279 22.343 98.850 1.00 27.94 ? 140 GLY H CA 1 ATOM 1431 C C . GLY B 2 140 ? 36.219 22.348 100.375 1.00 27.94 ? 140 GLY H C 1 ATOM 1432 O O . GLY B 2 140 ? 37.252 22.257 101.051 1.00 64.35 ? 140 GLY H O 1 ATOM 1433 N N . TRP B 2 141 ? 35.003 22.363 100.916 1.00 2.00 ? 141 TRP H N 1 ATOM 1434 C CA . TRP B 2 141 ? 34.789 22.381 102.361 1.00 2.00 ? 141 TRP H CA 1 ATOM 1435 C C . TRP B 2 141 ? 34.841 21.018 103.039 1.00 2.00 ? 141 TRP H C 1 ATOM 1436 O O . TRP B 2 141 ? 34.429 20.880 104.191 1.00 2.00 ? 141 TRP H O 1 ATOM 1437 C CB . TRP B 2 141 ? 33.441 22.997 102.679 1.00 2.00 ? 141 TRP H CB 1 ATOM 1438 C CG . TRP B 2 141 ? 33.347 24.405 102.363 1.00 2.00 ? 141 TRP H CG 1 ATOM 1439 C CD1 . TRP B 2 141 ? 33.799 25.433 103.119 1.00 2.00 ? 141 TRP H CD1 1 ATOM 1440 C CD2 . TRP B 2 141 ? 32.659 24.980 101.255 1.00 2.00 ? 141 TRP H CD2 1 ATOM 1441 N NE1 . TRP B 2 141 ? 33.414 26.625 102.566 1.00 2.00 ? 141 TRP H NE1 1 ATOM 1442 C CE2 . TRP B 2 141 ? 32.711 26.379 101.420 1.00 2.00 ? 141 TRP H CE2 1 ATOM 1443 C CE3 . TRP B 2 141 ? 31.997 24.453 100.141 1.00 2.00 ? 141 TRP H CE3 1 ATOM 1444 C CZ2 . TRP B 2 141 ? 32.118 27.267 100.512 1.00 2.00 ? 141 TRP H CZ2 1 ATOM 1445 C CZ3 . TRP B 2 141 ? 31.404 25.340 99.234 1.00 2.00 ? 141 TRP H CZ3 1 ATOM 1446 C CH2 . TRP B 2 141 ? 31.469 26.732 99.430 1.00 2.00 ? 141 TRP H CH2 1 ATOM 1447 N N . GLY B 2 142 ? 35.309 20.007 102.328 1.00 2.00 ? 142 GLY H N 1 ATOM 1448 C CA . GLY B 2 142 ? 35.360 18.692 102.923 1.00 2.00 ? 142 GLY H CA 1 ATOM 1449 C C . GLY B 2 142 ? 36.466 18.476 103.926 1.00 2.00 ? 142 GLY H C 1 ATOM 1450 O O . GLY B 2 142 ? 37.339 19.333 104.118 1.00 2.00 ? 142 GLY H O 1 ATOM 1451 N N . ASN B 2 143 ? 36.457 17.262 104.471 1.00 24.93 ? 143 ASN H N 1 ATOM 1452 C CA . ASN B 2 143 ? 37.387 16.771 105.480 1.00 24.93 ? 143 ASN H CA 1 ATOM 1453 C C . ASN B 2 143 ? 38.831 17.214 105.333 1.00 24.93 ? 143 ASN H C 1 ATOM 1454 O O . ASN B 2 143 ? 39.391 17.210 104.232 1.00 2.00 ? 143 ASN H O 1 ATOM 1455 C CB . ASN B 2 143 ? 37.316 15.247 105.545 1.00 2.00 ? 143 ASN H CB 1 ATOM 1456 C CG . ASN B 2 143 ? 36.033 14.749 106.169 1.00 2.00 ? 143 ASN H CG 1 ATOM 1457 O OD1 . ASN B 2 143 ? 35.178 15.528 106.587 1.00 2.00 ? 143 ASN H OD1 1 ATOM 1458 N ND2 . ASN B 2 143 ? 35.901 13.439 106.253 1.00 2.00 ? 143 ASN H ND2 1 ATOM 1459 N N . ARG B 2 144 ? 39.411 17.624 106.458 1.00 2.00 ? 144 ARG H N 1 ATOM 1460 C CA . ARG B 2 144 ? 40.800 18.059 106.522 1.00 2.00 ? 144 ARG H CA 1 ATOM 1461 C C . ARG B 2 144 ? 41.691 16.901 106.947 1.00 2.00 ? 144 ARG H C 1 ATOM 1462 O O . ARG B 2 144 ? 42.916 17.033 106.973 1.00 46.56 ? 144 ARG H O 1 ATOM 1463 C CB . ARG B 2 144 ? 40.970 19.234 107.496 1.00 46.56 ? 144 ARG H CB 1 ATOM 1464 C CG . ARG B 2 144 ? 40.126 20.458 107.158 1.00 46.56 ? 144 ARG H CG 1 ATOM 1465 C CD . ARG B 2 144 ? 40.551 21.712 107.926 1.00 46.56 ? 144 ARG H CD 1 ATOM 1466 N NE . ARG B 2 144 ? 40.567 21.550 109.382 1.00 46.56 ? 144 ARG H NE 1 ATOM 1467 C CZ . ARG B 2 144 ? 40.111 22.456 110.248 1.00 46.56 ? 144 ARG H CZ 1 ATOM 1468 N NH1 . ARG B 2 144 ? 39.545 23.579 109.823 1.00 46.56 ? 144 ARG H NH1 1 ATOM 1469 N NH2 . ARG B 2 144 ? 40.190 22.223 111.549 1.00 46.56 ? 144 ARG H NH2 1 ATOM 1470 N N . ARG B 2 145 ? 41.059 15.788 107.317 1.00 2.00 ? 145 ARG H N 1 ATOM 1471 C CA . ARG B 2 145 ? 41.747 14.568 107.733 1.00 2.00 ? 145 ARG H CA 1 ATOM 1472 C C . ARG B 2 145 ? 40.742 13.454 107.574 1.00 2.00 ? 145 ARG H C 1 ATOM 1473 O O . ARG B 2 145 ? 39.614 13.543 108.052 1.00 44.30 ? 145 ARG H O 1 ATOM 1474 C CB . ARG B 2 145 ? 42.200 14.641 109.203 1.00 44.30 ? 145 ARG H CB 1 ATOM 1475 C CG . ARG B 2 145 ? 43.268 13.597 109.600 1.00 44.30 ? 145 ARG H CG 1 ATOM 1476 C CD . ARG B 2 145 ? 42.709 12.182 109.842 1.00 44.30 ? 145 ARG H CD 1 ATOM 1477 N NE . ARG B 2 145 ? 43.758 11.154 109.843 1.00 44.30 ? 145 ARG H NE 1 ATOM 1478 C CZ . ARG B 2 145 ? 43.676 9.973 110.461 1.00 44.30 ? 145 ARG H CZ 1 ATOM 1479 N NH1 . ARG B 2 145 ? 42.597 9.642 111.167 1.00 44.30 ? 145 ARG H NH1 1 ATOM 1480 N NH2 . ARG B 2 145 ? 44.691 9.117 110.385 1.00 44.30 ? 145 ARG H NH2 1 ATOM 1481 N N . GLU B 2 146 ? 41.155 12.449 106.826 1.00 2.00 ? 146 GLU H N 1 ATOM 1482 C CA . GLU B 2 146 ? 40.392 11.249 106.541 1.00 2.00 ? 146 GLU H CA 1 ATOM 1483 C C . GLU B 2 146 ? 39.628 10.679 107.761 1.00 2.00 ? 146 GLU H C 1 ATOM 1484 O O . GLU B 2 146 ? 40.226 10.350 108.785 1.00 24.24 ? 146 GLU H O 1 ATOM 1485 C CB . GLU B 2 146 ? 41.409 10.241 106.004 1.00 24.24 ? 146 GLU H CB 1 ATOM 1486 C CG . GLU B 2 146 ? 40.964 8.831 105.723 1.00 24.24 ? 146 GLU H CG 1 ATOM 1487 C CD . GLU B 2 146 ? 42.166 7.981 105.385 1.00 24.24 ? 146 GLU H CD 1 ATOM 1488 O OE1 . GLU B 2 146 ? 42.787 8.210 104.324 1.00 24.24 ? 146 GLU H OE1 1 ATOM 1489 O OE2 . GLU B 2 146 ? 42.532 7.122 106.210 1.00 24.24 ? 146 GLU H OE2 1 ATOM 1490 N N . THR B 2 147 ? 38.307 10.578 107.656 1.00 62.53 ? 147 THR H N 1 ATOM 1491 C CA . THR B 2 147 ? 37.510 10.029 108.754 1.00 62.53 ? 147 THR H CA 1 ATOM 1492 C C . THR B 2 147 ? 36.487 9.029 108.253 1.00 62.53 ? 147 THR H C 1 ATOM 1493 O O . THR B 2 147 ? 35.919 9.189 107.170 1.00 60.77 ? 147 THR H O 1 ATOM 1494 C CB . THR B 2 147 ? 36.735 11.109 109.548 1.00 60.77 ? 147 THR H CB 1 ATOM 1495 O OG1 . THR B 2 147 ? 35.869 11.827 108.662 1.00 60.77 ? 147 THR H OG1 1 ATOM 1496 C CG2 . THR B 2 147 ? 37.680 12.069 110.254 1.00 60.77 ? 147 THR H CG2 1 ATOM 1497 N N . TRP B 2 148 ? 36.263 7.999 109.063 1.00 110.55 ? 148 TRP H N 1 ATOM 1498 C CA . TRP B 2 148 ? 35.304 6.937 108.768 1.00 110.55 ? 148 TRP H CA 1 ATOM 1499 C C . TRP B 2 148 ? 34.012 7.428 109.413 1.00 110.55 ? 148 TRP H C 1 ATOM 1500 O O . TRP B 2 148 ? 33.212 8.104 108.761 1.00 134.00 ? 148 TRP H O 1 ATOM 1501 C CB . TRP B 2 148 ? 35.804 5.630 109.389 1.00 134.00 ? 148 TRP H CB 1 ATOM 1502 C CG . TRP B 2 148 ? 37.296 5.526 109.274 1.00 134.00 ? 148 TRP H CG 1 ATOM 1503 C CD1 . TRP B 2 148 ? 38.216 5.874 110.224 1.00 134.00 ? 148 TRP H CD1 1 ATOM 1504 C CD2 . TRP B 2 148 ? 38.045 5.159 108.106 1.00 134.00 ? 148 TRP H CD2 1 ATOM 1505 N NE1 . TRP B 2 148 ? 39.488 5.762 109.717 1.00 134.00 ? 148 TRP H NE1 1 ATOM 1506 C CE2 . TRP B 2 148 ? 39.415 5.323 108.421 1.00 134.00 ? 148 TRP H CE2 1 ATOM 1507 C CE3 . TRP B 2 148 ? 37.694 4.714 106.823 1.00 134.00 ? 148 TRP H CE3 1 ATOM 1508 C CZ2 . TRP B 2 148 ? 40.435 5.056 107.495 1.00 134.00 ? 148 TRP H CZ2 1 ATOM 1509 C CZ3 . TRP B 2 148 ? 38.711 4.449 105.903 1.00 134.00 ? 148 TRP H CZ3 1 ATOM 1510 C CH2 . TRP B 2 148 ? 40.065 4.622 106.246 1.00 134.00 ? 148 TRP H CH2 1 ATOM 1511 N N . THR B 2 149 ? 33.808 7.117 110.690 1.00 95.48 ? 149 THR H N 1 ATOM 1512 C CA . THR B 2 149 ? 32.631 7.624 111.386 1.00 95.48 ? 149 THR H CA 1 ATOM 1513 C C . THR B 2 149 ? 33.045 9.073 111.670 1.00 95.48 ? 149 THR H C 1 ATOM 1514 O O . THR B 2 149 ? 33.726 9.378 112.645 1.00 75.84 ? 149 THR H O 1 ATOM 1515 C CB . THR B 2 149 ? 32.332 6.828 112.669 1.00 75.84 ? 149 THR H CB 1 ATOM 1516 O OG1 . THR B 2 149 ? 32.041 5.468 112.320 1.00 75.84 ? 149 THR H OG1 1 ATOM 1517 C CG2 . THR B 2 149 ? 31.127 7.416 113.393 1.00 75.84 ? 149 THR H CG2 1 ATOM 1518 N N . THR B 2 150 A 32.754 9.900 110.676 1.00 83.21 ? 149 THR H N 1 ATOM 1519 C CA . THR B 2 150 A 33.068 11.321 110.597 1.00 83.21 ? 149 THR H CA 1 ATOM 1520 C C . THR B 2 150 A 32.671 12.299 111.709 1.00 83.21 ? 149 THR H C 1 ATOM 1521 O O . THR B 2 150 A 32.427 11.928 112.853 1.00 96.55 ? 149 THR H O 1 ATOM 1522 C CB . THR B 2 150 A 32.463 11.864 109.302 1.00 96.55 ? 149 THR H CB 1 ATOM 1523 O OG1 . THR B 2 150 A 31.050 11.639 109.329 1.00 96.55 ? 149 THR H OG1 1 ATOM 1524 C CG2 . THR B 2 150 A 33.047 11.161 108.093 1.00 96.55 ? 149 THR H CG2 1 ATOM 1525 N N . SER B 2 151 B 32.630 13.569 111.305 1.00 54.69 ? 149 SER H N 1 ATOM 1526 C CA . SER B 2 151 B 32.265 14.721 112.118 1.00 54.69 ? 149 SER H CA 1 ATOM 1527 C C . SER B 2 151 B 33.277 15.413 113.040 1.00 54.69 ? 149 SER H C 1 ATOM 1528 O O . SER B 2 151 B 34.324 14.869 113.401 1.00 51.40 ? 149 SER H O 1 ATOM 1529 C CB . SER B 2 151 B 30.897 14.535 112.773 1.00 51.40 ? 149 SER H CB 1 ATOM 1530 O OG . SER B 2 151 B 29.876 14.784 111.813 1.00 51.40 ? 149 SER H OG 1 ATOM 1531 N N . VAL B 2 152 C 32.947 16.673 113.315 1.00 90.33 ? 149 VAL H N 1 ATOM 1532 C CA . VAL B 2 152 C 33.724 17.637 114.090 1.00 90.33 ? 149 VAL H CA 1 ATOM 1533 C C . VAL B 2 152 C 34.479 17.371 115.397 1.00 90.33 ? 149 VAL H C 1 ATOM 1534 O O . VAL B 2 152 C 33.920 17.059 116.447 1.00 120.77 ? 149 VAL H O 1 ATOM 1535 C CB . VAL B 2 152 C 32.921 18.966 114.237 1.00 120.77 ? 149 VAL H CB 1 ATOM 1536 C CG1 . VAL B 2 152 C 33.689 19.990 115.085 1.00 120.77 ? 149 VAL H CG1 1 ATOM 1537 C CG2 . VAL B 2 152 C 32.622 19.543 112.850 1.00 120.77 ? 149 VAL H CG2 1 ATOM 1538 N N . ALA B 2 153 D 35.763 17.680 115.287 1.00 72.15 ? 149 ALA H N 1 ATOM 1539 C CA . ALA B 2 153 D 36.791 17.643 116.325 1.00 72.15 ? 149 ALA H CA 1 ATOM 1540 C C . ALA B 2 153 D 37.815 18.527 115.611 1.00 72.15 ? 149 ALA H C 1 ATOM 1541 O O . ALA B 2 153 D 39.010 18.491 115.890 1.00 62.92 ? 149 ALA H O 1 ATOM 1542 C CB . ALA B 2 153 D 37.336 16.232 116.499 1.00 62.92 ? 149 ALA H CB 1 ATOM 1543 N N . GLU B 2 154 E 37.265 19.340 114.704 1.00 20.18 ? 149 GLU H N 1 ATOM 1544 C CA . GLU B 2 154 E 37.938 20.265 113.802 1.00 20.18 ? 149 GLU H CA 1 ATOM 1545 C C . GLU B 2 154 E 38.454 19.524 112.577 1.00 20.18 ? 149 GLU H C 1 ATOM 1546 O O . GLU B 2 154 E 39.584 19.704 112.143 1.00 41.98 ? 149 GLU H O 1 ATOM 1547 C CB . GLU B 2 154 E 39.024 21.106 114.481 1.00 41.98 ? 149 GLU H CB 1 ATOM 1548 C CG . GLU B 2 154 E 38.505 22.110 115.522 1.00 41.98 ? 149 GLU H CG 1 ATOM 1549 C CD . GLU B 2 154 E 37.433 23.093 115.027 1.00 41.98 ? 149 GLU H CD 1 ATOM 1550 O OE1 . GLU B 2 154 E 36.332 22.655 114.629 1.00 41.98 ? 149 GLU H OE1 1 ATOM 1551 O OE2 . GLU B 2 154 E 37.668 24.321 115.098 1.00 41.98 ? 149 GLU H OE2 1 ATOM 1552 N N . VAL B 2 155 ? 37.622 18.621 112.074 1.00 14.17 ? 150 VAL H N 1 ATOM 1553 C CA . VAL B 2 155 ? 37.963 17.870 110.878 1.00 14.17 ? 150 VAL H CA 1 ATOM 1554 C C . VAL B 2 155 ? 37.442 18.718 109.723 1.00 14.17 ? 150 VAL H C 1 ATOM 1555 O O . VAL B 2 155 ? 38.149 18.950 108.751 1.00 22.54 ? 150 VAL H O 1 ATOM 1556 C CB . VAL B 2 155 ? 37.325 16.448 110.851 1.00 22.54 ? 150 VAL H CB 1 ATOM 1557 C CG1 . VAL B 2 155 ? 37.898 15.590 111.967 1.00 22.54 ? 150 VAL H CG1 1 ATOM 1558 C CG2 . VAL B 2 155 ? 35.822 16.524 110.987 1.00 22.54 ? 150 VAL H CG2 1 ATOM 1559 N N . GLN B 2 156 ? 36.211 19.202 109.845 1.00 2.00 ? 151 GLN H N 1 ATOM 1560 C CA . GLN B 2 156 ? 35.631 20.032 108.805 1.00 2.00 ? 151 GLN H CA 1 ATOM 1561 C C . GLN B 2 156 ? 36.113 21.464 108.972 1.00 2.00 ? 151 GLN H C 1 ATOM 1562 O O . GLN B 2 156 ? 36.318 21.927 110.101 1.00 44.21 ? 151 GLN H O 1 ATOM 1563 C CB . GLN B 2 156 ? 34.107 19.926 108.800 1.00 44.21 ? 151 GLN H CB 1 ATOM 1564 C CG . GLN B 2 156 ? 33.574 18.549 108.324 1.00 44.21 ? 151 GLN H CG 1 ATOM 1565 C CD . GLN B 2 156 ? 33.120 18.491 106.842 1.00 44.21 ? 151 GLN H CD 1 ATOM 1566 O OE1 . GLN B 2 156 ? 33.154 17.425 106.224 1.00 44.21 ? 151 GLN H OE1 1 ATOM 1567 N NE2 . GLN B 2 156 ? 32.642 19.614 106.302 1.00 44.21 ? 151 GLN H NE2 1 ATOM 1568 N N . PRO B 2 157 ? 36.394 22.150 107.846 1.00 2.00 ? 152 PRO H N 1 ATOM 1569 C CA . PRO B 2 157 ? 36.881 23.532 107.780 1.00 2.00 ? 152 PRO H CA 1 ATOM 1570 C C . PRO B 2 157 ? 35.823 24.638 107.805 1.00 2.00 ? 152 PRO H C 1 ATOM 1571 O O . PRO B 2 157 ? 34.727 24.479 107.270 1.00 2.00 ? 152 PRO H O 1 ATOM 1572 C CB . PRO B 2 157 ? 37.666 23.532 106.477 1.00 2.00 ? 152 PRO H CB 1 ATOM 1573 C CG . PRO B 2 157 ? 36.829 22.675 105.619 1.00 2.00 ? 152 PRO H CG 1 ATOM 1574 C CD . PRO B 2 157 ? 36.454 21.523 106.513 1.00 2.00 ? 152 PRO H CD 1 ATOM 1575 N N . SER B 2 158 ? 36.198 25.767 108.407 1.00 2.00 ? 153 SER H N 1 ATOM 1576 C CA . SER B 2 158 ? 35.350 26.955 108.547 1.00 2.00 ? 153 SER H CA 1 ATOM 1577 C C . SER B 2 158 ? 35.010 27.626 107.202 1.00 2.00 ? 153 SER H C 1 ATOM 1578 O O . SER B 2 158 ? 33.845 27.897 106.895 1.00 23.00 ? 153 SER H O 1 ATOM 1579 C CB . SER B 2 158 ? 36.060 27.977 109.431 1.00 23.00 ? 153 SER H CB 1 ATOM 1580 O OG . SER B 2 158 ? 36.864 27.329 110.402 1.00 23.00 ? 153 SER H OG 1 ATOM 1581 N N . VAL B 2 159 ? 36.047 27.970 106.447 1.00 19.35 ? 154 VAL H N 1 ATOM 1582 C CA . VAL B 2 159 ? 35.882 28.599 105.143 1.00 19.35 ? 154 VAL H CA 1 ATOM 1583 C C . VAL B 2 159 ? 36.530 27.747 104.045 1.00 19.35 ? 154 VAL H C 1 ATOM 1584 O O . VAL B 2 159 ? 37.201 26.763 104.351 1.00 2.00 ? 154 VAL H O 1 ATOM 1585 C CB . VAL B 2 159 ? 36.464 30.010 105.141 1.00 2.00 ? 154 VAL H CB 1 ATOM 1586 C CG1 . VAL B 2 159 ? 35.703 30.856 106.117 1.00 2.00 ? 154 VAL H CG1 1 ATOM 1587 C CG2 . VAL B 2 159 ? 37.925 29.981 105.509 1.00 2.00 ? 154 VAL H CG2 1 ATOM 1588 N N . LEU B 2 160 ? 36.324 28.113 102.779 1.00 2.00 ? 155 LEU H N 1 ATOM 1589 C CA . LEU B 2 160 ? 36.871 27.341 101.663 1.00 2.00 ? 155 LEU H CA 1 ATOM 1590 C C . LEU B 2 160 ? 38.345 26.992 101.824 1.00 2.00 ? 155 LEU H C 1 ATOM 1591 O O . LEU B 2 160 ? 39.150 27.805 102.301 1.00 2.00 ? 155 LEU H O 1 ATOM 1592 C CB . LEU B 2 160 ? 36.676 28.054 100.325 1.00 2.00 ? 155 LEU H CB 1 ATOM 1593 C CG . LEU B 2 160 ? 35.613 27.577 99.332 1.00 2.00 ? 155 LEU H CG 1 ATOM 1594 C CD1 . LEU B 2 160 ? 35.823 28.340 98.043 1.00 2.00 ? 155 LEU H CD1 1 ATOM 1595 C CD2 . LEU B 2 160 ? 35.690 26.091 99.071 1.00 2.00 ? 155 LEU H CD2 1 ATOM 1596 N N . GLN B 2 161 ? 38.678 25.790 101.356 1.00 23.29 ? 156 GLN H N 1 ATOM 1597 C CA . GLN B 2 161 ? 40.021 25.229 101.425 1.00 23.29 ? 156 GLN H CA 1 ATOM 1598 C C . GLN B 2 161 ? 40.597 25.080 100.023 1.00 23.29 ? 156 GLN H C 1 ATOM 1599 O O . GLN B 2 161 ? 39.955 24.518 99.145 1.00 2.00 ? 156 GLN H O 1 ATOM 1600 C CB . GLN B 2 161 ? 39.937 23.847 102.069 1.00 2.00 ? 156 GLN H CB 1 ATOM 1601 C CG . GLN B 2 161 ? 41.043 23.544 103.043 1.00 2.00 ? 156 GLN H CG 1 ATOM 1602 C CD . GLN B 2 161 ? 41.042 24.491 104.209 1.00 2.00 ? 156 GLN H CD 1 ATOM 1603 O OE1 . GLN B 2 161 ? 40.000 24.786 104.794 1.00 2.00 ? 156 GLN H OE1 1 ATOM 1604 N NE2 . GLN B 2 161 ? 42.220 24.975 104.560 1.00 2.00 ? 156 GLN H NE2 1 ATOM 1605 N N . VAL B 2 162 ? 41.821 25.543 99.827 1.00 2.00 ? 157 VAL H N 1 ATOM 1606 C CA . VAL B 2 162 ? 42.453 25.481 98.524 1.00 2.00 ? 157 VAL H CA 1 ATOM 1607 C C . VAL B 2 162 ? 43.758 24.723 98.608 1.00 2.00 ? 157 VAL H C 1 ATOM 1608 O O . VAL B 2 162 ? 44.490 24.846 99.586 1.00 2.00 ? 157 VAL H O 1 ATOM 1609 C CB . VAL B 2 162 ? 42.759 26.895 98.007 1.00 2.00 ? 157 VAL H CB 1 ATOM 1610 C CG1 . VAL B 2 162 ? 43.583 26.829 96.746 1.00 2.00 ? 157 VAL H CG1 1 ATOM 1611 C CG2 . VAL B 2 162 ? 41.482 27.659 97.766 1.00 2.00 ? 157 VAL H CG2 1 ATOM 1612 N N . VAL B 2 163 ? 44.077 23.986 97.556 1.00 2.00 ? 158 VAL H N 1 ATOM 1613 C CA . VAL B 2 163 ? 45.309 23.220 97.501 1.00 2.00 ? 158 VAL H CA 1 ATOM 1614 C C . VAL B 2 163 ? 45.634 23.027 96.023 1.00 2.00 ? 158 VAL H C 1 ATOM 1615 O O . VAL B 2 163 ? 44.730 22.852 95.214 1.00 2.00 ? 158 VAL H O 1 ATOM 1616 C CB . VAL B 2 163 ? 45.147 21.855 98.241 1.00 2.00 ? 158 VAL H CB 1 ATOM 1617 C CG1 . VAL B 2 163 ? 44.124 20.969 97.549 1.00 2.00 ? 158 VAL H CG1 1 ATOM 1618 C CG2 . VAL B 2 163 ? 46.480 21.147 98.379 1.00 2.00 ? 158 VAL H CG2 1 ATOM 1619 N N . ASN B 2 164 ? 46.903 23.169 95.656 1.00 2.00 ? 159 ASN H N 1 ATOM 1620 C CA . ASN B 2 164 ? 47.316 22.992 94.274 1.00 2.00 ? 159 ASN H CA 1 ATOM 1621 C C . ASN B 2 164 ? 48.122 21.726 94.209 1.00 2.00 ? 159 ASN H C 1 ATOM 1622 O O . ASN B 2 164 ? 49.192 21.635 94.803 1.00 2.00 ? 159 ASN H O 1 ATOM 1623 C CB . ASN B 2 164 ? 48.159 24.165 93.796 1.00 2.00 ? 159 ASN H CB 1 ATOM 1624 C CG . ASN B 2 164 ? 47.359 25.458 93.653 1.00 2.00 ? 159 ASN H CG 1 ATOM 1625 O OD1 . ASN B 2 164 ? 46.332 25.676 94.309 1.00 2.00 ? 159 ASN H OD1 1 ATOM 1626 N ND2 . ASN B 2 164 ? 47.857 26.341 92.810 1.00 2.00 ? 159 ASN H ND2 1 ATOM 1627 N N . LEU B 2 165 ? 47.593 20.747 93.487 1.00 2.00 ? 160 LEU H N 1 ATOM 1628 C CA . LEU B 2 165 ? 48.218 19.441 93.335 1.00 2.00 ? 160 LEU H CA 1 ATOM 1629 C C . LEU B 2 165 ? 48.670 19.286 91.908 1.00 2.00 ? 160 LEU H C 1 ATOM 1630 O O . LEU B 2 165 ? 47.945 19.669 90.995 1.00 2.00 ? 160 LEU H O 1 ATOM 1631 C CB . LEU B 2 165 ? 47.188 18.341 93.617 1.00 2.00 ? 160 LEU H CB 1 ATOM 1632 C CG . LEU B 2 165 ? 46.323 18.412 94.873 1.00 2.00 ? 160 LEU H CG 1 ATOM 1633 C CD1 . LEU B 2 165 ? 45.179 17.462 94.749 1.00 2.00 ? 160 LEU H CD1 1 ATOM 1634 C CD2 . LEU B 2 165 ? 47.151 18.119 96.107 1.00 2.00 ? 160 LEU H CD2 1 ATOM 1635 N N . PRO B 2 166 ? 49.884 18.762 91.692 1.00 2.00 ? 161 PRO H N 1 ATOM 1636 C CA . PRO B 2 166 ? 50.444 18.542 90.358 1.00 2.00 ? 161 PRO H CA 1 ATOM 1637 C C . PRO B 2 166 ? 49.814 17.290 89.760 1.00 2.00 ? 161 PRO H C 1 ATOM 1638 O O . PRO B 2 166 ? 49.294 16.460 90.501 1.00 2.00 ? 161 PRO H O 1 ATOM 1639 C CB . PRO B 2 166 ? 51.916 18.335 90.652 1.00 2.00 ? 161 PRO H CB 1 ATOM 1640 C CG . PRO B 2 166 ? 51.890 17.658 91.952 1.00 2.00 ? 161 PRO H CG 1 ATOM 1641 C CD . PRO B 2 166 ? 50.901 18.490 92.714 1.00 2.00 ? 161 PRO H CD 1 ATOM 1642 N N . LEU B 2 167 ? 49.804 17.187 88.431 1.00 2.00 ? 162 LEU H N 1 ATOM 1643 C CA . LEU B 2 167 ? 49.235 16.022 87.737 1.00 2.00 ? 162 LEU H CA 1 ATOM 1644 C C . LEU B 2 167 ? 50.251 14.866 87.687 1.00 2.00 ? 162 LEU H C 1 ATOM 1645 O O . LEU B 2 167 ? 51.467 15.089 87.632 1.00 2.00 ? 162 LEU H O 1 ATOM 1646 C CB . LEU B 2 167 ? 48.781 16.408 86.327 1.00 2.00 ? 162 LEU H CB 1 ATOM 1647 C CG . LEU B 2 167 ? 47.621 17.400 86.310 1.00 2.00 ? 162 LEU H CG 1 ATOM 1648 C CD1 . LEU B 2 167 ? 47.473 18.059 84.954 1.00 2.00 ? 162 LEU H CD1 1 ATOM 1649 C CD2 . LEU B 2 167 ? 46.359 16.685 86.719 1.00 2.00 ? 162 LEU H CD2 1 ATOM 1650 N N . VAL B 2 168 ? 49.746 13.637 87.713 1.00 2.00 ? 163 VAL H N 1 ATOM 1651 C CA . VAL B 2 168 ? 50.588 12.437 87.696 1.00 2.00 ? 163 VAL H CA 1 ATOM 1652 C C . VAL B 2 168 ? 50.564 11.703 86.346 1.00 2.00 ? 163 VAL H C 1 ATOM 1653 O O . VAL B 2 168 ? 49.542 11.696 85.651 1.00 2.00 ? 163 VAL H O 1 ATOM 1654 C CB . VAL B 2 168 ? 50.119 11.456 88.823 1.00 2.00 ? 163 VAL H CB 1 ATOM 1655 C CG1 . VAL B 2 168 ? 50.814 10.103 88.736 1.00 2.00 ? 163 VAL H CG1 1 ATOM 1656 C CG2 . VAL B 2 168 ? 50.355 12.074 90.178 1.00 2.00 ? 163 VAL H CG2 1 ATOM 1657 N N . GLU B 2 169 ? 51.697 11.112 85.962 1.00 2.00 ? 164 GLU H N 1 ATOM 1658 C CA . GLU B 2 169 ? 51.766 10.356 84.711 1.00 2.00 ? 164 GLU H CA 1 ATOM 1659 C C . GLU B 2 169 ? 50.810 9.174 84.824 1.00 2.00 ? 164 GLU H C 1 ATOM 1660 O O . GLU B 2 169 ? 50.817 8.457 85.822 1.00 2.00 ? 164 GLU H O 1 ATOM 1661 C CB . GLU B 2 169 ? 53.181 9.842 84.443 1.00 2.00 ? 164 GLU H CB 1 ATOM 1662 C CG . GLU B 2 169 ? 54.200 10.912 84.047 1.00 2.00 ? 164 GLU H CG 1 ATOM 1663 C CD . GLU B 2 169 ? 54.912 11.548 85.239 1.00 2.00 ? 164 GLU H CD 1 ATOM 1664 O OE1 . GLU B 2 169 ? 54.911 10.963 86.355 1.00 2.00 ? 164 GLU H OE1 1 ATOM 1665 O OE2 . GLU B 2 169 ? 55.499 12.635 85.040 1.00 2.00 ? 164 GLU H OE2 1 ATOM 1666 N N . ARG B 2 170 ? 50.024 8.945 83.776 1.00 15.97 ? 165 ARG H N 1 ATOM 1667 C CA . ARG B 2 170 ? 49.035 7.878 83.785 1.00 15.97 ? 165 ARG H CA 1 ATOM 1668 C C . ARG B 2 170 ? 49.538 6.502 84.199 1.00 15.97 ? 165 ARG H C 1 ATOM 1669 O O . ARG B 2 170 ? 48.885 5.815 84.994 1.00 30.20 ? 165 ARG H O 1 ATOM 1670 C CB . ARG B 2 170 ? 48.250 7.812 82.474 1.00 30.20 ? 165 ARG H CB 1 ATOM 1671 C CG . ARG B 2 170 ? 46.752 7.766 82.738 1.00 30.20 ? 165 ARG H CG 1 ATOM 1672 C CD . ARG B 2 170 ? 45.936 7.367 81.529 1.00 30.20 ? 165 ARG H CD 1 ATOM 1673 N NE . ARG B 2 170 ? 44.515 7.602 81.776 1.00 30.20 ? 165 ARG H NE 1 ATOM 1674 C CZ . ARG B 2 170 ? 43.953 8.807 81.759 1.00 30.20 ? 165 ARG H CZ 1 ATOM 1675 N NH1 . ARG B 2 170 ? 44.683 9.886 81.479 1.00 30.20 ? 165 ARG H NH1 1 ATOM 1676 N NH2 . ARG B 2 170 ? 42.655 8.931 81.995 1.00 30.20 ? 165 ARG H NH2 1 ATOM 1677 N N . PRO B 2 171 ? 50.697 6.074 83.679 1.00 2.00 ? 166 PRO H N 1 ATOM 1678 C CA . PRO B 2 171 ? 51.215 4.757 84.065 1.00 2.00 ? 166 PRO H CA 1 ATOM 1679 C C . PRO B 2 171 ? 51.400 4.647 85.579 1.00 2.00 ? 166 PRO H C 1 ATOM 1680 O O . PRO B 2 171 ? 51.433 3.553 86.129 1.00 21.24 ? 166 PRO H O 1 ATOM 1681 C CB . PRO B 2 171 ? 52.566 4.706 83.351 1.00 21.24 ? 166 PRO H CB 1 ATOM 1682 C CG . PRO B 2 171 ? 52.918 6.152 83.119 1.00 21.24 ? 166 PRO H CG 1 ATOM 1683 C CD . PRO B 2 171 ? 51.602 6.726 82.723 1.00 21.24 ? 166 PRO H CD 1 ATOM 1684 N N . VAL B 2 172 ? 51.551 5.795 86.238 1.00 35.54 ? 167 VAL H N 1 ATOM 1685 C CA . VAL B 2 172 ? 51.735 5.852 87.686 1.00 35.54 ? 167 VAL H CA 1 ATOM 1686 C C . VAL B 2 172 ? 50.374 5.811 88.390 1.00 35.54 ? 167 VAL H C 1 ATOM 1687 O O . VAL B 2 172 ? 50.268 5.260 89.485 1.00 16.94 ? 167 VAL H O 1 ATOM 1688 C CB . VAL B 2 172 ? 52.549 7.115 88.119 1.00 16.94 ? 167 VAL H CB 1 ATOM 1689 C CG1 . VAL B 2 172 ? 52.826 7.079 89.603 1.00 16.94 ? 167 VAL H CG1 1 ATOM 1690 C CG2 . VAL B 2 172 ? 53.872 7.187 87.375 1.00 16.94 ? 167 VAL H CG2 1 ATOM 1691 N N . CYS B 2 173 ? 49.336 6.387 87.780 1.00 2.00 ? 168 CYS H N 1 ATOM 1692 C CA . CYS B 2 173 ? 48.004 6.337 88.391 1.00 2.00 ? 168 CYS H CA 1 ATOM 1693 C C . CYS B 2 173 ? 47.532 4.881 88.330 1.00 2.00 ? 168 CYS H C 1 ATOM 1694 O O . CYS B 2 173 ? 47.019 4.352 89.307 1.00 2.00 ? 168 CYS H O 1 ATOM 1695 C CB . CYS B 2 173 ? 46.988 7.236 87.663 1.00 2.00 ? 168 CYS H CB 1 ATOM 1696 S SG . CYS B 2 173 ? 47.355 9.025 87.563 1.00 2.00 ? 168 CYS H SG 1 ATOM 1697 N N . LYS B 2 174 ? 47.726 4.242 87.172 1.00 17.03 ? 169 LYS H N 1 ATOM 1698 C CA . LYS B 2 174 ? 47.348 2.836 86.942 1.00 17.03 ? 169 LYS H CA 1 ATOM 1699 C C . LYS B 2 174 ? 48.064 1.940 87.961 1.00 17.03 ? 169 LYS H C 1 ATOM 1700 O O . LYS B 2 174 ? 47.489 0.995 88.510 1.00 22.84 ? 169 LYS H O 1 ATOM 1701 C CB . LYS B 2 174 ? 47.768 2.408 85.528 1.00 22.84 ? 169 LYS H CB 1 ATOM 1702 C CG . LYS B 2 174 ? 46.629 2.058 84.569 1.00 22.84 ? 169 LYS H CG 1 ATOM 1703 C CD . LYS B 2 174 ? 45.976 3.299 83.959 1.00 22.84 ? 169 LYS H CD 1 ATOM 1704 C CE . LYS B 2 174 ? 45.065 2.922 82.790 1.00 22.84 ? 169 LYS H CE 1 ATOM 1705 N NZ . LYS B 2 174 ? 44.489 4.102 82.071 1.00 22.84 ? 169 LYS H NZ 1 ATOM 1706 N N . ALA B 2 175 ? 49.357 2.198 88.122 1.00 6.47 ? 170 ALA H N 1 ATOM 1707 C CA . ALA B 2 175 ? 50.187 1.493 89.078 1.00 6.47 ? 170 ALA H CA 1 ATOM 1708 C C . ALA B 2 175 ? 50.131 2.379 90.333 1.00 6.47 ? 170 ALA H C 1 ATOM 1709 O O . ALA B 2 175 ? 51.072 3.121 90.633 1.00 2.00 ? 170 ALA H O 1 ATOM 1710 C CB . ALA B 2 175 ? 51.608 1.384 88.555 1.00 2.00 ? 170 ALA H CB 1 ATOM 1711 N N . SER B 2 176 ? 48.961 2.375 90.973 1.00 13.06 ? 171 SER H N 1 ATOM 1712 C CA . SER B 2 176 ? 48.659 3.132 92.198 1.00 13.06 ? 171 SER H CA 1 ATOM 1713 C C . SER B 2 176 ? 47.485 2.421 92.859 1.00 13.06 ? 171 SER H C 1 ATOM 1714 O O . SER B 2 176 ? 47.371 2.365 94.082 1.00 6.78 ? 171 SER H O 1 ATOM 1715 C CB . SER B 2 176 ? 48.256 4.592 91.867 1.00 6.78 ? 171 SER H CB 1 ATOM 1716 O OG . SER B 2 176 ? 47.481 5.235 92.890 1.00 6.78 ? 171 SER H OG 1 ATOM 1717 N N . THR B 2 177 ? 46.619 1.861 92.026 1.00 37.60 ? 172 THR H N 1 ATOM 1718 C CA . THR B 2 177 ? 45.455 1.146 92.503 1.00 37.60 ? 172 THR H CA 1 ATOM 1719 C C . THR B 2 177 ? 45.384 -0.211 91.811 1.00 37.60 ? 172 THR H C 1 ATOM 1720 O O . THR B 2 177 ? 46.379 -0.697 91.254 1.00 33.10 ? 172 THR H O 1 ATOM 1721 C CB . THR B 2 177 ? 44.175 1.931 92.203 1.00 33.10 ? 172 THR H CB 1 ATOM 1722 O OG1 . THR B 2 177 ? 44.154 2.296 90.818 1.00 33.10 ? 172 THR H OG1 1 ATOM 1723 C CG2 . THR B 2 177 ? 44.100 3.185 93.070 1.00 33.10 ? 172 THR H CG2 1 ATOM 1724 N N . ARG B 2 178 ? 44.226 -0.852 91.922 1.00 2.00 ? 173 ARG H N 1 ATOM 1725 C CA . ARG B 2 178 ? 43.996 -2.136 91.283 1.00 2.00 ? 173 ARG H CA 1 ATOM 1726 C C . ARG B 2 178 ? 42.735 -2.002 90.438 1.00 2.00 ? 173 ARG H C 1 ATOM 1727 O O . ARG B 2 178 ? 42.421 -2.856 89.607 1.00 2.00 ? 173 ARG H O 1 ATOM 1728 C CB . ARG B 2 178 ? 43.892 -3.256 92.326 1.00 2.00 ? 173 ARG H CB 1 ATOM 1729 C CG . ARG B 2 178 ? 45.154 -3.342 93.165 1.00 2.00 ? 173 ARG H CG 1 ATOM 1730 C CD . ARG B 2 178 ? 45.346 -4.636 93.924 1.00 2.00 ? 173 ARG H CD 1 ATOM 1731 N NE . ARG B 2 178 ? 46.565 -4.525 94.721 1.00 2.00 ? 173 ARG H NE 1 ATOM 1732 C CZ . ARG B 2 178 ? 47.397 -5.526 94.985 1.00 2.00 ? 173 ARG H CZ 1 ATOM 1733 N NH1 . ARG B 2 178 ? 47.144 -6.751 94.540 1.00 2.00 ? 173 ARG H NH1 1 ATOM 1734 N NH2 . ARG B 2 178 ? 48.483 -5.301 95.709 1.00 2.00 ? 173 ARG H NH2 1 ATOM 1735 N N . ILE B 2 179 ? 42.068 -0.867 90.614 1.00 2.00 ? 174 ILE H N 1 ATOM 1736 C CA . ILE B 2 179 ? 40.840 -0.531 89.909 1.00 2.00 ? 174 ILE H CA 1 ATOM 1737 C C . ILE B 2 179 ? 41.119 -0.183 88.442 1.00 2.00 ? 174 ILE H C 1 ATOM 1738 O O . ILE B 2 179 ? 42.049 0.570 88.144 1.00 2.00 ? 174 ILE H O 1 ATOM 1739 C CB . ILE B 2 179 ? 40.147 0.668 90.579 1.00 2.00 ? 174 ILE H CB 1 ATOM 1740 C CG1 . ILE B 2 179 ? 39.633 0.285 91.968 1.00 2.00 ? 174 ILE H CG1 1 ATOM 1741 C CG2 . ILE B 2 179 ? 39.025 1.168 89.717 1.00 2.00 ? 174 ILE H CG2 1 ATOM 1742 C CD1 . ILE B 2 179 ? 40.699 0.258 93.060 1.00 2.00 ? 174 ILE H CD1 1 ATOM 1743 N N . ARG B 2 180 ? 40.303 -0.718 87.535 1.00 9.58 ? 175 ARG H N 1 ATOM 1744 C CA . ARG B 2 180 ? 40.470 -0.458 86.109 1.00 9.58 ? 175 ARG H CA 1 ATOM 1745 C C . ARG B 2 180 ? 40.358 1.027 85.791 1.00 9.58 ? 175 ARG H C 1 ATOM 1746 O O . ARG B 2 180 ? 39.252 1.576 85.724 1.00 30.90 ? 175 ARG H O 1 ATOM 1747 C CB . ARG B 2 180 ? 39.432 -1.219 85.281 1.00 30.90 ? 175 ARG H CB 1 ATOM 1748 C CG . ARG B 2 180 ? 39.451 -0.863 83.787 1.00 30.90 ? 175 ARG H CG 1 ATOM 1749 C CD . ARG B 2 180 ? 38.247 -1.413 83.049 1.00 30.90 ? 175 ARG H CD 1 ATOM 1750 N NE . ARG B 2 180 ? 38.656 -2.103 81.833 1.00 30.90 ? 175 ARG H NE 1 ATOM 1751 C CZ . ARG B 2 180 ? 38.425 -3.390 81.587 1.00 30.90 ? 175 ARG H CZ 1 ATOM 1752 N NH1 . ARG B 2 180 ? 37.768 -4.142 82.465 1.00 30.90 ? 175 ARG H NH1 1 ATOM 1753 N NH2 . ARG B 2 180 ? 38.845 -3.926 80.452 1.00 30.90 ? 175 ARG H NH2 1 ATOM 1754 N N . ILE B 2 181 ? 41.506 1.664 85.573 1.00 37.79 ? 176 ILE H N 1 ATOM 1755 C CA . ILE B 2 181 ? 41.545 3.087 85.249 1.00 37.79 ? 176 ILE H CA 1 ATOM 1756 C C . ILE B 2 181 ? 41.367 3.286 83.734 1.00 37.79 ? 176 ILE H C 1 ATOM 1757 O O . ILE B 2 181 ? 42.026 2.628 82.919 1.00 2.00 ? 176 ILE H O 1 ATOM 1758 C CB . ILE B 2 181 ? 42.876 3.740 85.746 1.00 2.00 ? 176 ILE H CB 1 ATOM 1759 C CG1 . ILE B 2 181 ? 43.111 3.398 87.220 1.00 2.00 ? 176 ILE H CG1 1 ATOM 1760 C CG2 . ILE B 2 181 ? 42.829 5.257 85.585 1.00 2.00 ? 176 ILE H CG2 1 ATOM 1761 C CD1 . ILE B 2 181 ? 41.914 3.724 88.146 1.00 2.00 ? 176 ILE H CD1 1 ATOM 1762 N N . THR B 2 182 ? 40.421 4.141 83.364 1.00 2.00 ? 177 THR H N 1 ATOM 1763 C CA . THR B 2 182 ? 40.157 4.423 81.964 1.00 2.00 ? 177 THR H CA 1 ATOM 1764 C C . THR B 2 182 ? 40.772 5.734 81.513 1.00 2.00 ? 177 THR H C 1 ATOM 1765 O O . THR B 2 182 ? 41.539 6.363 82.243 1.00 2.00 ? 177 THR H O 1 ATOM 1766 C CB . THR B 2 182 ? 38.655 4.469 81.683 1.00 2.00 ? 177 THR H CB 1 ATOM 1767 O OG1 . THR B 2 182 ? 37.965 4.882 82.861 1.00 2.00 ? 177 THR H OG1 1 ATOM 1768 C CG2 . THR B 2 182 ? 38.147 3.111 81.238 1.00 2.00 ? 177 THR H CG2 1 ATOM 1769 N N . ASP B 2 183 ? 40.448 6.136 80.290 1.00 2.00 ? 178 ASP H N 1 ATOM 1770 C CA . ASP B 2 183 ? 40.944 7.394 79.767 1.00 2.00 ? 178 ASP H CA 1 ATOM 1771 C C . ASP B 2 183 ? 39.810 8.408 79.887 1.00 2.00 ? 178 ASP H C 1 ATOM 1772 O O . ASP B 2 183 ? 39.686 9.366 79.119 1.00 19.42 ? 178 ASP H O 1 ATOM 1773 C CB . ASP B 2 183 ? 41.531 7.263 78.340 1.00 19.42 ? 178 ASP H CB 1 ATOM 1774 C CG . ASP B 2 183 ? 40.748 6.318 77.437 1.00 19.42 ? 178 ASP H CG 1 ATOM 1775 O OD1 . ASP B 2 183 ? 40.814 5.087 77.651 1.00 19.42 ? 178 ASP H OD1 1 ATOM 1776 O OD2 . ASP B 2 183 ? 40.115 6.809 76.472 1.00 19.42 ? 178 ASP H OD2 1 ATOM 1777 N N . ASN B 2 184 ? 38.977 8.162 80.891 1.00 13.20 ? 179 ASN H N 1 ATOM 1778 C CA . ASN B 2 184 ? 37.842 9.016 81.217 1.00 13.20 ? 179 ASN H CA 1 ATOM 1779 C C . ASN B 2 184 ? 38.026 9.566 82.636 1.00 13.20 ? 179 ASN H C 1 ATOM 1780 O O . ASN B 2 184 ? 37.088 10.090 83.239 1.00 2.00 ? 179 ASN H O 1 ATOM 1781 C CB . ASN B 2 184 ? 36.530 8.224 81.111 1.00 2.00 ? 179 ASN H CB 1 ATOM 1782 C CG . ASN B 2 184 ? 35.767 8.504 79.814 1.00 2.00 ? 179 ASN H CG 1 ATOM 1783 O OD1 . ASN B 2 184 ? 34.581 8.186 79.700 1.00 2.00 ? 179 ASN H OD1 1 ATOM 1784 N ND2 . ASN B 2 184 ? 36.445 9.103 78.836 1.00 2.00 ? 179 ASN H ND2 1 ATOM 1785 N N . MET B 2 185 ? 39.244 9.412 83.162 1.00 2.00 ? 180 MET H N 1 ATOM 1786 C CA . MET B 2 185 ? 39.625 9.887 84.498 1.00 2.00 ? 180 MET H CA 1 ATOM 1787 C C . MET B 2 185 ? 41.142 9.863 84.640 1.00 2.00 ? 180 MET H C 1 ATOM 1788 O O . MET B 2 185 ? 41.785 8.894 84.230 1.00 2.00 ? 180 MET H O 1 ATOM 1789 C CB . MET B 2 185 ? 38.961 9.048 85.620 1.00 2.00 ? 180 MET H CB 1 ATOM 1790 C CG . MET B 2 185 ? 39.569 7.667 85.917 1.00 2.00 ? 180 MET H CG 1 ATOM 1791 S SD . MET B 2 185 ? 38.442 6.228 85.797 1.00 2.00 ? 180 MET H SD 1 ATOM 1792 C CE . MET B 2 185 ? 37.445 6.441 87.189 1.00 2.00 ? 180 MET H CE 1 ATOM 1793 N N . PHE B 2 186 ? 41.704 10.980 85.108 1.00 2.00 ? 181 PHE H N 1 ATOM 1794 C CA . PHE B 2 186 ? 43.144 11.112 85.337 1.00 2.00 ? 181 PHE H CA 1 ATOM 1795 C C . PHE B 2 186 ? 43.347 11.252 86.829 1.00 2.00 ? 181 PHE H C 1 ATOM 1796 O O . PHE B 2 186 ? 42.366 11.278 87.568 1.00 2.00 ? 181 PHE H O 1 ATOM 1797 C CB . PHE B 2 186 ? 43.721 12.327 84.610 1.00 2.00 ? 181 PHE H CB 1 ATOM 1798 C CG . PHE B 2 186 ? 43.053 13.638 84.948 1.00 2.00 ? 181 PHE H CG 1 ATOM 1799 C CD1 . PHE B 2 186 ? 41.929 14.070 84.244 1.00 2.00 ? 181 PHE H CD1 1 ATOM 1800 C CD2 . PHE B 2 186 ? 43.592 14.483 85.911 1.00 2.00 ? 181 PHE H CD2 1 ATOM 1801 C CE1 . PHE B 2 186 ? 41.355 15.326 84.489 1.00 2.00 ? 181 PHE H CE1 1 ATOM 1802 C CE2 . PHE B 2 186 ? 43.022 15.739 86.160 1.00 2.00 ? 181 PHE H CE2 1 ATOM 1803 C CZ . PHE B 2 186 ? 41.903 16.155 85.443 1.00 2.00 ? 181 PHE H CZ 1 ATOM 1804 N N . CYS B 2 187 ? 44.597 11.283 87.289 1.00 23.25 ? 182 CYS H N 1 ATOM 1805 C CA . CYS B 2 187 ? 44.864 11.449 88.725 1.00 23.25 ? 182 CYS H CA 1 ATOM 1806 C C . CYS B 2 187 ? 45.934 12.499 89.009 1.00 23.25 ? 182 CYS H C 1 ATOM 1807 O O . CYS B 2 187 ? 46.789 12.791 88.159 1.00 2.00 ? 182 CYS H O 1 ATOM 1808 C CB . CYS B 2 187 ? 45.232 10.128 89.398 1.00 2.00 ? 182 CYS H CB 1 ATOM 1809 S SG . CYS B 2 187 ? 47.006 9.757 89.433 1.00 2.00 ? 182 CYS H SG 1 ATOM 1810 N N . ALA B 2 188 ? 45.886 13.055 90.215 1.00 20.48 ? 183 ALA H N 1 ATOM 1811 C CA . ALA B 2 188 ? 46.820 14.099 90.613 1.00 20.48 ? 183 ALA H CA 1 ATOM 1812 C C . ALA B 2 188 ? 47.322 13.936 92.048 1.00 20.48 ? 183 ALA H C 1 ATOM 1813 O O . ALA B 2 188 ? 46.614 13.405 92.908 1.00 2.00 ? 183 ALA H O 1 ATOM 1814 C CB . ALA B 2 188 ? 46.144 15.472 90.432 1.00 2.00 ? 183 ALA H CB 1 ATOM 1815 N N . GLY B 2 189 ? 48.533 14.414 92.300 1.00 2.00 ? 184 GLY H N 1 ATOM 1816 C CA . GLY B 2 189 ? 49.098 14.325 93.628 1.00 2.00 ? 184 GLY H CA 1 ATOM 1817 C C . GLY B 2 189 ? 50.616 14.257 93.641 1.00 2.00 ? 184 GLY H C 1 ATOM 1818 O O . GLY B 2 189 ? 51.244 13.931 92.631 1.00 19.83 ? 184 GLY H O 1 ATOM 1819 N N . TYR B 2 190 A 51.220 14.611 94.772 1.00 2.00 ? 184 TYR H N 1 ATOM 1820 C CA . TYR B 2 190 A 52.667 14.553 94.898 1.00 2.00 ? 184 TYR H CA 1 ATOM 1821 C C . TYR B 2 190 A 53.049 13.089 95.072 1.00 2.00 ? 184 TYR H C 1 ATOM 1822 O O . TYR B 2 190 A 52.302 12.307 95.677 1.00 2.00 ? 184 TYR H O 1 ATOM 1823 C CB . TYR B 2 190 A 53.153 15.385 96.103 1.00 2.00 ? 184 TYR H CB 1 ATOM 1824 C CG . TYR B 2 190 A 52.910 16.881 95.975 1.00 2.00 ? 184 TYR H CG 1 ATOM 1825 C CD1 . TYR B 2 190 A 53.671 17.661 95.119 1.00 2.00 ? 184 TYR H CD1 1 ATOM 1826 C CD2 . TYR B 2 190 A 51.864 17.496 96.659 1.00 2.00 ? 184 TYR H CD2 1 ATOM 1827 C CE1 . TYR B 2 190 A 53.396 19.010 94.934 1.00 2.00 ? 184 TYR H CE1 1 ATOM 1828 C CE2 . TYR B 2 190 A 51.575 18.848 96.484 1.00 2.00 ? 184 TYR H CE2 1 ATOM 1829 C CZ . TYR B 2 190 A 52.340 19.599 95.614 1.00 2.00 ? 184 TYR H CZ 1 ATOM 1830 O OH . TYR B 2 190 A 51.999 20.920 95.397 1.00 2.00 ? 184 TYR H OH 1 ATOM 1831 N N . LYS B 2 191 ? 54.166 12.692 94.472 1.00 2.00 ? 185 LYS H N 1 ATOM 1832 C CA . LYS B 2 191 ? 54.635 11.317 94.596 1.00 2.00 ? 185 LYS H CA 1 ATOM 1833 C C . LYS B 2 191 ? 55.130 11.138 96.025 1.00 2.00 ? 185 LYS H C 1 ATOM 1834 O O . LYS B 2 191 ? 55.248 12.117 96.762 1.00 33.24 ? 185 LYS H O 1 ATOM 1835 C CB . LYS B 2 191 ? 55.787 11.059 93.627 1.00 33.24 ? 185 LYS H CB 1 ATOM 1836 C CG . LYS B 2 191 ? 55.477 11.417 92.184 1.00 33.24 ? 185 LYS H CG 1 ATOM 1837 C CD . LYS B 2 191 ? 54.303 10.638 91.615 1.00 33.24 ? 185 LYS H CD 1 ATOM 1838 C CE . LYS B 2 191 ? 53.921 11.205 90.264 1.00 33.24 ? 185 LYS H CE 1 ATOM 1839 N NZ . LYS B 2 191 ? 53.719 12.697 90.316 1.00 33.24 ? 185 LYS H NZ 1 ATOM 1840 N N . PRO B 2 192 ? 55.334 9.886 96.473 1.00 36.58 ? 186 PRO H N 1 ATOM 1841 C CA . PRO B 2 192 ? 55.831 9.670 97.841 1.00 36.58 ? 186 PRO H CA 1 ATOM 1842 C C . PRO B 2 192 ? 57.165 10.425 98.032 1.00 36.58 ? 186 PRO H C 1 ATOM 1843 O O . PRO B 2 192 ? 57.314 11.246 98.958 1.00 2.00 ? 186 PRO H O 1 ATOM 1844 C CB . PRO B 2 192 ? 55.987 8.145 97.912 1.00 2.00 ? 186 PRO H CB 1 ATOM 1845 C CG . PRO B 2 192 ? 56.022 7.710 96.453 1.00 2.00 ? 186 PRO H CG 1 ATOM 1846 C CD . PRO B 2 192 ? 55.006 8.605 95.835 1.00 2.00 ? 186 PRO H CD 1 ATOM 1847 N N . GLY B 2 193 A 58.138 10.102 97.177 1.00 2.00 ? 186 GLY H N 1 ATOM 1848 C CA . GLY B 2 193 A 59.398 10.813 97.200 1.00 2.00 ? 186 GLY H CA 1 ATOM 1849 C C . GLY B 2 193 A 58.998 12.031 96.385 1.00 2.00 ? 186 GLY H C 1 ATOM 1850 O O . GLY B 2 193 A 58.721 11.921 95.178 1.00 26.11 ? 186 GLY H O 1 ATOM 1851 N N . GLU B 2 194 B 58.784 13.133 97.102 1.00 24.97 ? 186 GLU H N 1 ATOM 1852 C CA . GLU B 2 194 B 58.371 14.437 96.565 1.00 24.97 ? 186 GLU H CA 1 ATOM 1853 C C . GLU B 2 194 B 58.361 15.273 97.840 1.00 24.97 ? 186 GLU H C 1 ATOM 1854 O O . GLU B 2 194 B 58.180 14.728 98.934 1.00 2.00 ? 186 GLU H O 1 ATOM 1855 C CB . GLU B 2 194 B 56.942 14.367 96.007 1.00 2.00 ? 186 GLU H CB 1 ATOM 1856 C CG . GLU B 2 194 B 56.509 15.577 95.184 1.00 2.00 ? 186 GLU H CG 1 ATOM 1857 C CD . GLU B 2 194 B 56.401 15.281 93.697 1.00 2.00 ? 186 GLU H CD 1 ATOM 1858 O OE1 . GLU B 2 194 B 57.027 14.310 93.229 1.00 2.00 ? 186 GLU H OE1 1 ATOM 1859 O OE2 . GLU B 2 194 B 55.692 16.020 92.989 1.00 2.00 ? 186 GLU H OE2 1 ATOM 1860 N N . GLY B 2 195 C 58.506 16.585 97.727 1.00 11.24 ? 186 GLY H N 1 ATOM 1861 C CA . GLY B 2 195 C 58.537 17.375 98.943 1.00 11.24 ? 186 GLY H CA 1 ATOM 1862 C C . GLY B 2 195 C 57.306 18.123 99.405 1.00 11.24 ? 186 GLY H C 1 ATOM 1863 O O . GLY B 2 195 C 57.449 19.149 100.062 1.00 74.73 ? 186 GLY H O 1 ATOM 1864 N N . LYS B 2 196 D 56.113 17.586 99.191 1.00 31.70 ? 186 LYS H N 1 ATOM 1865 C CA . LYS B 2 196 D 54.910 18.314 99.578 1.00 31.70 ? 186 LYS H CA 1 ATOM 1866 C C . LYS B 2 196 D 53.754 17.333 99.744 1.00 31.70 ? 186 LYS H C 1 ATOM 1867 O O . LYS B 2 196 D 53.812 16.231 99.211 1.00 61.54 ? 186 LYS H O 1 ATOM 1868 C CB . LYS B 2 196 D 54.601 19.315 98.455 1.00 61.54 ? 186 LYS H CB 1 ATOM 1869 C CG . LYS B 2 196 D 53.994 20.650 98.867 1.00 61.54 ? 186 LYS H CG 1 ATOM 1870 C CD . LYS B 2 196 D 54.433 21.741 97.880 1.00 61.54 ? 186 LYS H CD 1 ATOM 1871 C CE . LYS B 2 196 D 53.478 22.946 97.832 1.00 61.54 ? 186 LYS H CE 1 ATOM 1872 N NZ . LYS B 2 196 D 53.416 23.786 99.072 1.00 61.54 ? 186 LYS H NZ 1 ATOM 1873 N N . ARG B 2 197 ? 52.740 17.703 100.525 1.00 20.75 ? 187 ARG H N 1 ATOM 1874 C CA . ARG B 2 197 ? 51.560 16.851 100.708 1.00 20.75 ? 187 ARG H CA 1 ATOM 1875 C C . ARG B 2 197 ? 50.310 17.577 100.181 1.00 20.75 ? 187 ARG H C 1 ATOM 1876 O O . ARG B 2 197 ? 50.414 18.558 99.431 1.00 2.00 ? 187 ARG H O 1 ATOM 1877 C CB . ARG B 2 197 ? 51.358 16.470 102.182 1.00 2.00 ? 187 ARG H CB 1 ATOM 1878 C CG . ARG B 2 197 ? 52.511 15.724 102.815 1.00 2.00 ? 187 ARG H CG 1 ATOM 1879 C CD . ARG B 2 197 ? 52.049 14.834 103.972 1.00 2.00 ? 187 ARG H CD 1 ATOM 1880 N NE . ARG B 2 197 ? 51.422 13.571 103.545 1.00 2.00 ? 187 ARG H NE 1 ATOM 1881 C CZ . ARG B 2 197 ? 52.084 12.450 103.236 1.00 2.00 ? 187 ARG H CZ 1 ATOM 1882 N NH1 . ARG B 2 197 ? 53.408 12.414 103.295 1.00 2.00 ? 187 ARG H NH1 1 ATOM 1883 N NH2 . ARG B 2 197 ? 51.423 11.358 102.864 1.00 2.00 ? 187 ARG H NH2 1 ATOM 1884 N N . GLY B 2 198 ? 49.137 17.099 100.592 1.00 2.00 ? 188 GLY H N 1 ATOM 1885 C CA . GLY B 2 198 ? 47.879 17.702 100.177 1.00 2.00 ? 188 GLY H CA 1 ATOM 1886 C C . GLY B 2 198 ? 47.004 16.738 99.404 1.00 2.00 ? 188 GLY H C 1 ATOM 1887 O O . GLY B 2 198 ? 47.496 15.721 98.940 1.00 2.00 ? 188 GLY H O 1 ATOM 1888 N N . ASP B 2 199 ? 45.708 17.028 99.305 1.00 2.00 ? 189 ASP H N 1 ATOM 1889 C CA . ASP B 2 199 ? 44.760 16.197 98.554 1.00 2.00 ? 189 ASP H CA 1 ATOM 1890 C C . ASP B 2 199 ? 43.313 16.534 98.902 1.00 2.00 ? 189 ASP H C 1 ATOM 1891 O O . ASP B 2 199 ? 43.036 17.186 99.904 1.00 2.00 ? 189 ASP H O 1 ATOM 1892 C CB . ASP B 2 199 ? 45.010 14.693 98.790 1.00 2.00 ? 189 ASP H CB 1 ATOM 1893 C CG . ASP B 2 199 ? 44.336 13.795 97.740 1.00 2.00 ? 189 ASP H CG 1 ATOM 1894 O OD1 . ASP B 2 199 ? 44.156 14.217 96.564 1.00 2.00 ? 189 ASP H OD1 1 ATOM 1895 O OD2 . ASP B 2 199 ? 43.996 12.645 98.107 1.00 2.00 ? 189 ASP H OD2 1 ATOM 1896 N N . ALA B 2 200 ? 42.398 16.115 98.038 1.00 2.00 ? 190 ALA H N 1 ATOM 1897 C CA . ALA B 2 200 ? 40.974 16.324 98.252 1.00 2.00 ? 190 ALA H CA 1 ATOM 1898 C C . ALA B 2 200 ? 40.468 15.161 99.094 1.00 2.00 ? 190 ALA H C 1 ATOM 1899 O O . ALA B 2 200 ? 40.907 14.019 98.935 1.00 2.00 ? 190 ALA H O 1 ATOM 1900 C CB . ALA B 2 200 ? 40.230 16.364 96.924 1.00 2.00 ? 190 ALA H CB 1 ATOM 1901 N N . CYS B 2 201 ? 39.518 15.443 99.968 1.00 9.98 ? 191 CYS H N 1 ATOM 1902 C CA . CYS B 2 201 ? 38.984 14.412 100.833 1.00 9.98 ? 191 CYS H CA 1 ATOM 1903 C C . CYS B 2 201 ? 37.457 14.342 100.725 1.00 9.98 ? 191 CYS H C 1 ATOM 1904 O O . CYS B 2 201 ? 36.871 14.829 99.741 1.00 31.21 ? 191 CYS H O 1 ATOM 1905 C CB . CYS B 2 201 ? 39.432 14.700 102.267 1.00 31.21 ? 191 CYS H CB 1 ATOM 1906 S SG . CYS B 2 201 ? 39.328 13.303 103.422 1.00 31.21 ? 191 CYS H SG 1 ATOM 1907 N N . GLU B 2 202 ? 36.816 13.739 101.729 1.00 36.01 ? 192 GLU H N 1 ATOM 1908 C CA . GLU B 2 202 ? 35.361 13.613 101.747 1.00 36.01 ? 192 GLU H CA 1 ATOM 1909 C C . GLU B 2 202 ? 34.668 14.950 101.973 1.00 36.01 ? 192 GLU H C 1 ATOM 1910 O O . GLU B 2 202 ? 34.931 15.637 102.958 1.00 29.31 ? 192 GLU H O 1 ATOM 1911 C CB . GLU B 2 202 ? 34.901 12.601 102.802 1.00 29.31 ? 192 GLU H CB 1 ATOM 1912 C CG . GLU B 2 202 ? 35.190 11.150 102.440 1.00 29.31 ? 192 GLU H CG 1 ATOM 1913 C CD . GLU B 2 202 ? 34.363 10.160 103.253 1.00 29.31 ? 192 GLU H CD 1 ATOM 1914 O OE1 . GLU B 2 202 ? 33.118 10.314 103.288 1.00 29.31 ? 192 GLU H OE1 1 ATOM 1915 O OE2 . GLU B 2 202 ? 34.959 9.222 103.838 1.00 29.31 ? 192 GLU H OE2 1 ATOM 1916 N N . GLY B 2 203 ? 33.784 15.305 101.043 1.00 18.09 ? 193 GLY H N 1 ATOM 1917 C CA . GLY B 2 203 ? 33.059 16.560 101.128 1.00 18.09 ? 193 GLY H CA 1 ATOM 1918 C C . GLY B 2 203 ? 33.418 17.481 99.980 1.00 18.09 ? 193 GLY H C 1 ATOM 1919 O O . GLY B 2 203 ? 32.650 18.371 99.623 1.00 2.00 ? 193 GLY H O 1 ATOM 1920 N N . ASP B 2 204 ? 34.604 17.260 99.417 1.00 29.65 ? 194 ASP H N 1 ATOM 1921 C CA . ASP B 2 204 ? 35.125 18.043 98.296 1.00 29.65 ? 194 ASP H CA 1 ATOM 1922 C C . ASP B 2 204 ? 34.650 17.472 96.968 1.00 29.65 ? 194 ASP H C 1 ATOM 1923 O O . ASP B 2 204 ? 34.695 18.152 95.940 1.00 2.00 ? 194 ASP H O 1 ATOM 1924 C CB . ASP B 2 204 ? 36.647 18.035 98.328 1.00 2.00 ? 194 ASP H CB 1 ATOM 1925 C CG . ASP B 2 204 ? 37.191 18.524 99.638 1.00 2.00 ? 194 ASP H CG 1 ATOM 1926 O OD1 . ASP B 2 204 ? 37.269 17.728 100.592 1.00 2.00 ? 194 ASP H OD1 1 ATOM 1927 O OD2 . ASP B 2 204 ? 37.527 19.713 99.723 1.00 2.00 ? 194 ASP H OD2 1 ATOM 1928 N N . SER B 2 205 ? 34.209 16.212 97.019 1.00 22.94 ? 195 SER H N 1 ATOM 1929 C CA . SER B 2 205 ? 33.712 15.459 95.868 1.00 22.94 ? 195 SER H CA 1 ATOM 1930 C C . SER B 2 205 ? 32.742 16.296 95.057 1.00 22.94 ? 195 SER H C 1 ATOM 1931 O O . SER B 2 205 ? 31.943 17.031 95.624 1.00 26.78 ? 195 SER H O 1 ATOM 1932 C CB . SER B 2 205 ? 33.054 14.175 96.358 1.00 26.78 ? 195 SER H CB 1 ATOM 1933 O OG . SER B 2 205 ? 33.924 13.480 97.240 1.00 26.78 ? 195 SER H OG 1 ATOM 1934 N N . GLY B 2 206 ? 32.826 16.208 93.735 1.00 2.00 ? 196 GLY H N 1 ATOM 1935 C CA . GLY B 2 206 ? 31.969 17.016 92.886 1.00 2.00 ? 196 GLY H CA 1 ATOM 1936 C C . GLY B 2 206 ? 32.717 18.284 92.506 1.00 2.00 ? 196 GLY H C 1 ATOM 1937 O O . GLY B 2 206 ? 32.651 18.739 91.368 1.00 2.00 ? 196 GLY H O 1 ATOM 1938 N N . GLY B 2 207 ? 33.491 18.802 93.459 1.00 2.00 ? 197 GLY H N 1 ATOM 1939 C CA . GLY B 2 207 ? 34.274 20.013 93.274 1.00 2.00 ? 197 GLY H CA 1 ATOM 1940 C C . GLY B 2 207 ? 35.150 20.091 92.038 1.00 2.00 ? 197 GLY H C 1 ATOM 1941 O O . GLY B 2 207 ? 35.597 19.072 91.520 1.00 2.00 ? 197 GLY H O 1 ATOM 1942 N N . PRO B 2 208 ? 35.457 21.313 91.571 1.00 2.00 ? 198 PRO H N 1 ATOM 1943 C CA . PRO B 2 208 ? 36.287 21.502 90.380 1.00 2.00 ? 198 PRO H CA 1 ATOM 1944 C C . PRO B 2 208 ? 37.800 21.454 90.555 1.00 2.00 ? 198 PRO H C 1 ATOM 1945 O O . PRO B 2 208 ? 38.352 21.942 91.543 1.00 2.00 ? 198 PRO H O 1 ATOM 1946 C CB . PRO B 2 208 ? 35.865 22.894 89.910 1.00 2.00 ? 198 PRO H CB 1 ATOM 1947 C CG . PRO B 2 208 ? 35.703 23.634 91.211 1.00 2.00 ? 198 PRO H CG 1 ATOM 1948 C CD . PRO B 2 208 ? 34.967 22.616 92.079 1.00 2.00 ? 198 PRO H CD 1 ATOM 1949 N N . PHE B 2 209 ? 38.460 20.837 89.587 1.00 4.40 ? 199 PHE H N 1 ATOM 1950 C CA . PHE B 2 209 ? 39.912 20.793 89.544 1.00 4.40 ? 199 PHE H CA 1 ATOM 1951 C C . PHE B 2 209 ? 40.068 21.763 88.388 1.00 4.40 ? 199 PHE H C 1 ATOM 1952 O O . PHE B 2 209 ? 39.617 21.477 87.276 1.00 2.00 ? 199 PHE H O 1 ATOM 1953 C CB . PHE B 2 209 ? 40.419 19.415 89.139 1.00 2.00 ? 199 PHE H CB 1 ATOM 1954 C CG . PHE B 2 209 ? 41.890 19.366 88.917 1.00 2.00 ? 199 PHE H CG 1 ATOM 1955 C CD1 . PHE B 2 209 ? 42.447 19.881 87.763 1.00 2.00 ? 199 PHE H CD1 1 ATOM 1956 C CD2 . PHE B 2 209 ? 42.725 18.793 89.859 1.00 2.00 ? 199 PHE H CD2 1 ATOM 1957 C CE1 . PHE B 2 209 ? 43.807 19.829 87.550 1.00 2.00 ? 199 PHE H CE1 1 ATOM 1958 C CE2 . PHE B 2 209 ? 44.104 18.736 89.651 1.00 2.00 ? 199 PHE H CE2 1 ATOM 1959 C CZ . PHE B 2 209 ? 44.638 19.252 88.496 1.00 2.00 ? 199 PHE H CZ 1 ATOM 1960 N N . VAL B 2 210 ? 40.576 22.952 88.669 1.00 2.00 ? 200 VAL H N 1 ATOM 1961 C CA . VAL B 2 210 ? 40.735 23.967 87.642 1.00 2.00 ? 200 VAL H CA 1 ATOM 1962 C C . VAL B 2 210 ? 42.200 24.186 87.318 1.00 2.00 ? 200 VAL H C 1 ATOM 1963 O O . VAL B 2 210 ? 43.075 23.649 87.982 1.00 2.00 ? 200 VAL H O 1 ATOM 1964 C CB . VAL B 2 210 ? 40.134 25.305 88.121 1.00 2.00 ? 200 VAL H CB 1 ATOM 1965 C CG1 . VAL B 2 210 ? 38.671 25.130 88.439 1.00 2.00 ? 200 VAL H CG1 1 ATOM 1966 C CG2 . VAL B 2 210 ? 40.855 25.800 89.361 1.00 2.00 ? 200 VAL H CG2 1 ATOM 1967 N N . MET B 2 211 ? 42.477 24.963 86.287 1.00 2.00 ? 201 MET H N 1 ATOM 1968 C CA . MET B 2 211 ? 43.856 25.292 85.940 1.00 2.00 ? 201 MET H CA 1 ATOM 1969 C C . MET B 2 211 ? 43.807 26.672 85.291 1.00 2.00 ? 201 MET H C 1 ATOM 1970 O O . MET B 2 211 ? 42.814 27.020 84.643 1.00 2.00 ? 201 MET H O 1 ATOM 1971 C CB . MET B 2 211 ? 44.443 24.272 84.964 1.00 2.00 ? 201 MET H CB 1 ATOM 1972 C CG . MET B 2 211 ? 44.511 22.852 85.493 1.00 2.00 ? 201 MET H CG 1 ATOM 1973 S SD . MET B 2 211 ? 45.436 21.781 84.402 1.00 2.00 ? 201 MET H SD 1 ATOM 1974 C CE . MET B 2 211 ? 47.063 22.139 84.958 1.00 2.00 ? 201 MET H CE 1 ATOM 1975 N N . LYS B 2 212 ? 44.811 27.501 85.538 1.00 2.00 ? 202 LYS H N 1 ATOM 1976 C CA . LYS B 2 212 ? 44.814 28.816 84.921 1.00 2.00 ? 202 LYS H CA 1 ATOM 1977 C C . LYS B 2 212 ? 45.687 28.768 83.672 1.00 2.00 ? 202 LYS H C 1 ATOM 1978 O O . LYS B 2 212 ? 46.838 28.306 83.717 1.00 2.00 ? 202 LYS H O 1 ATOM 1979 C CB . LYS B 2 212 ? 45.327 29.874 85.893 1.00 2.00 ? 202 LYS H CB 1 ATOM 1980 C CG . LYS B 2 212 ? 45.166 31.298 85.373 1.00 2.00 ? 202 LYS H CG 1 ATOM 1981 C CD . LYS B 2 212 ? 45.520 32.351 86.412 1.00 2.00 ? 202 LYS H CD 1 ATOM 1982 C CE . LYS B 2 212 ? 45.277 33.739 85.856 1.00 2.00 ? 202 LYS H CE 1 ATOM 1983 N NZ . LYS B 2 212 ? 45.647 34.805 86.823 1.00 2.00 ? 202 LYS H NZ 1 ATOM 1984 N N . SER B 2 213 ? 45.113 29.171 82.542 1.00 20.55 ? 203 SER H N 1 ATOM 1985 C CA . SER B 2 213 ? 45.848 29.170 81.284 1.00 20.55 ? 203 SER H CA 1 ATOM 1986 C C . SER B 2 213 ? 46.908 30.267 81.290 1.00 20.55 ? 203 SER H C 1 ATOM 1987 O O . SER B 2 213 ? 46.691 31.353 81.836 1.00 8.25 ? 203 SER H O 1 ATOM 1988 C CB . SER B 2 213 ? 44.891 29.372 80.102 1.00 8.25 ? 203 SER H CB 1 ATOM 1989 O OG . SER B 2 213 ? 45.556 29.158 78.865 1.00 8.25 ? 203 SER H OG 1 ATOM 1990 N N . PRO B 2 214 ? 48.110 29.951 80.814 1.00 2.00 ? 204 PRO H N 1 ATOM 1991 C CA . PRO B 2 214 ? 49.152 30.972 80.794 1.00 2.00 ? 204 PRO H CA 1 ATOM 1992 C C . PRO B 2 214 ? 49.112 31.765 79.475 1.00 2.00 ? 204 PRO H C 1 ATOM 1993 O O . PRO B 2 214 ? 49.532 32.918 79.426 1.00 11.86 ? 204 PRO H O 1 ATOM 1994 C CB . PRO B 2 214 ? 50.430 30.153 80.972 1.00 11.86 ? 204 PRO H CB 1 ATOM 1995 C CG . PRO B 2 214 ? 50.110 28.878 80.276 1.00 11.86 ? 204 PRO H CG 1 ATOM 1996 C CD . PRO B 2 214 ? 48.698 28.601 80.730 1.00 11.86 ? 204 PRO H CD 1 ATOM 1997 N N . TYR B 2 215 A 48.589 31.147 78.421 1.00 12.24 ? 204 TYR H N 1 ATOM 1998 C CA . TYR B 2 215 A 48.492 31.787 77.104 1.00 12.24 ? 204 TYR H CA 1 ATOM 1999 C C . TYR B 2 215 A 47.331 32.762 77.186 1.00 12.24 ? 204 TYR H C 1 ATOM 2000 O O . TYR B 2 215 A 47.428 33.927 76.810 1.00 13.69 ? 204 TYR H O 1 ATOM 2001 C CB . TYR B 2 215 A 48.240 30.731 76.028 1.00 13.69 ? 204 TYR H CB 1 ATOM 2002 C CG . TYR B 2 215 A 49.027 29.456 76.262 1.00 13.69 ? 204 TYR H CG 1 ATOM 2003 C CD1 . TYR B 2 215 A 48.522 28.449 77.093 1.00 13.69 ? 204 TYR H CD1 1 ATOM 2004 C CD2 . TYR B 2 215 A 50.265 29.253 75.660 1.00 13.69 ? 204 TYR H CD2 1 ATOM 2005 C CE1 . TYR B 2 215 A 49.225 27.278 77.319 1.00 13.69 ? 204 TYR H CE1 1 ATOM 2006 C CE2 . TYR B 2 215 A 50.980 28.079 75.877 1.00 13.69 ? 204 TYR H CE2 1 ATOM 2007 C CZ . TYR B 2 215 A 50.452 27.090 76.708 1.00 13.69 ? 204 TYR H CZ 1 ATOM 2008 O OH . TYR B 2 215 A 51.130 25.898 76.901 1.00 13.69 ? 204 TYR H OH 1 ATOM 2009 N N . ASN B 2 216 B 46.206 32.226 77.619 1.00 22.72 ? 204 ASN H N 1 ATOM 2010 C CA . ASN B 2 216 B 45.001 32.993 77.861 1.00 22.72 ? 204 ASN H CA 1 ATOM 2011 C C . ASN B 2 216 B 45.225 33.289 79.359 1.00 22.72 ? 204 ASN H C 1 ATOM 2012 O O . ASN B 2 216 B 46.174 32.765 79.948 1.00 24.92 ? 204 ASN H O 1 ATOM 2013 C CB . ASN B 2 216 B 43.823 32.049 77.666 1.00 24.92 ? 204 ASN H CB 1 ATOM 2014 C CG . ASN B 2 216 B 42.496 32.729 77.781 1.00 24.92 ? 204 ASN H CG 1 ATOM 2015 O OD1 . ASN B 2 216 B 42.360 33.785 78.406 1.00 24.92 ? 204 ASN H OD1 1 ATOM 2016 N ND2 . ASN B 2 216 B 41.487 32.111 77.192 1.00 24.92 ? 204 ASN H ND2 1 ATOM 2017 N N . ASN B 2 217 ? 44.388 34.102 79.990 1.00 8.96 ? 205 ASN H N 1 ATOM 2018 C CA . ASN B 2 217 ? 44.590 34.407 81.410 1.00 8.96 ? 205 ASN H CA 1 ATOM 2019 C C . ASN B 2 217 ? 43.322 34.073 82.196 1.00 8.96 ? 205 ASN H C 1 ATOM 2020 O O . ASN B 2 217 ? 43.026 34.660 83.235 1.00 15.47 ? 205 ASN H O 1 ATOM 2021 C CB . ASN B 2 217 ? 44.928 35.885 81.550 1.00 15.47 ? 205 ASN H CB 1 ATOM 2022 C CG . ASN B 2 217 ? 45.833 36.158 82.705 1.00 15.47 ? 205 ASN H CG 1 ATOM 2023 O OD1 . ASN B 2 217 ? 45.430 36.757 83.701 1.00 15.47 ? 205 ASN H OD1 1 ATOM 2024 N ND2 . ASN B 2 217 ? 47.084 35.733 82.580 1.00 15.47 ? 205 ASN H ND2 1 ATOM 2025 N N . ARG B 2 218 ? 42.557 33.132 81.669 1.00 2.00 ? 206 ARG H N 1 ATOM 2026 C CA . ARG B 2 218 ? 41.336 32.733 82.313 1.00 2.00 ? 206 ARG H CA 1 ATOM 2027 C C . ARG B 2 218 ? 41.463 31.306 82.889 1.00 2.00 ? 206 ARG H C 1 ATOM 2028 O O . ARG B 2 218 ? 42.476 30.616 82.667 1.00 2.00 ? 206 ARG H O 1 ATOM 2029 C CB . ARG B 2 218 ? 40.161 32.940 81.334 1.00 2.00 ? 206 ARG H CB 1 ATOM 2030 C CG . ARG B 2 218 ? 39.712 31.755 80.496 1.00 2.00 ? 206 ARG H CG 1 ATOM 2031 C CD . ARG B 2 218 ? 39.238 32.147 79.091 1.00 2.00 ? 206 ARG H CD 1 ATOM 2032 N NE . ARG B 2 218 ? 38.264 33.242 78.992 1.00 2.00 ? 206 ARG H NE 1 ATOM 2033 C CZ . ARG B 2 218 ? 38.582 34.535 78.923 1.00 2.00 ? 206 ARG H CZ 1 ATOM 2034 N NH1 . ARG B 2 218 ? 39.847 34.922 79.043 1.00 2.00 ? 206 ARG H NH1 1 ATOM 2035 N NH2 . ARG B 2 218 ? 37.632 35.449 78.811 1.00 2.00 ? 206 ARG H NH2 1 ATOM 2036 N N . TRP B 2 219 ? 40.484 30.905 83.698 1.00 7.10 ? 207 TRP H N 1 ATOM 2037 C CA . TRP B 2 219 ? 40.499 29.594 84.323 1.00 7.10 ? 207 TRP H CA 1 ATOM 2038 C C . TRP B 2 219 ? 39.719 28.549 83.553 1.00 7.10 ? 207 TRP H C 1 ATOM 2039 O O . TRP B 2 219 ? 38.695 28.849 82.943 1.00 2.00 ? 207 TRP H O 1 ATOM 2040 C CB . TRP B 2 219 ? 40.022 29.701 85.762 1.00 2.00 ? 207 TRP H CB 1 ATOM 2041 C CG . TRP B 2 219 ? 41.004 30.451 86.621 1.00 2.00 ? 207 TRP H CG 1 ATOM 2042 C CD1 . TRP B 2 219 ? 41.217 31.803 86.641 1.00 2.00 ? 207 TRP H CD1 1 ATOM 2043 C CD2 . TRP B 2 219 ? 41.897 29.891 87.589 1.00 2.00 ? 207 TRP H CD2 1 ATOM 2044 N NE1 . TRP B 2 219 ? 42.179 32.118 87.565 1.00 2.00 ? 207 TRP H NE1 1 ATOM 2045 C CE2 . TRP B 2 219 ? 42.616 30.964 88.163 1.00 2.00 ? 207 TRP H CE2 1 ATOM 2046 C CE3 . TRP B 2 219 ? 42.158 28.591 88.032 1.00 2.00 ? 207 TRP H CE3 1 ATOM 2047 C CZ2 . TRP B 2 219 ? 43.582 30.770 89.158 1.00 2.00 ? 207 TRP H CZ2 1 ATOM 2048 C CZ3 . TRP B 2 219 ? 43.116 28.401 89.019 1.00 2.00 ? 207 TRP H CZ3 1 ATOM 2049 C CH2 . TRP B 2 219 ? 43.815 29.485 89.569 1.00 2.00 ? 207 TRP H CH2 1 ATOM 2050 N N . TYR B 2 220 ? 40.215 27.316 83.594 1.00 21.74 ? 208 TYR H N 1 ATOM 2051 C CA . TYR B 2 220 ? 39.604 26.193 82.887 1.00 21.74 ? 208 TYR H CA 1 ATOM 2052 C C . TYR B 2 220 ? 39.422 24.953 83.750 1.00 21.74 ? 208 TYR H C 1 ATOM 2053 O O . TYR B 2 220 ? 40.388 24.437 84.324 1.00 2.00 ? 208 TYR H O 1 ATOM 2054 C CB . TYR B 2 220 ? 40.449 25.821 81.662 1.00 2.00 ? 208 TYR H CB 1 ATOM 2055 C CG . TYR B 2 220 ? 40.292 26.787 80.520 1.00 2.00 ? 208 TYR H CG 1 ATOM 2056 C CD1 . TYR B 2 220 ? 39.192 26.709 79.683 1.00 2.00 ? 208 TYR H CD1 1 ATOM 2057 C CD2 . TYR B 2 220 ? 41.226 27.794 80.293 1.00 2.00 ? 208 TYR H CD2 1 ATOM 2058 C CE1 . TYR B 2 220 ? 39.015 27.604 78.646 1.00 2.00 ? 208 TYR H CE1 1 ATOM 2059 C CE2 . TYR B 2 220 ? 41.060 28.702 79.252 1.00 2.00 ? 208 TYR H CE2 1 ATOM 2060 C CZ . TYR B 2 220 ? 39.946 28.598 78.433 1.00 2.00 ? 208 TYR H CZ 1 ATOM 2061 O OH . TYR B 2 220 ? 39.749 29.488 77.401 1.00 2.00 ? 208 TYR H OH 1 ATOM 2062 N N . GLN B 2 221 ? 38.179 24.495 83.862 1.00 2.00 ? 209 GLN H N 1 ATOM 2063 C CA . GLN B 2 221 ? 37.900 23.297 84.632 1.00 2.00 ? 209 GLN H CA 1 ATOM 2064 C C . GLN B 2 221 ? 38.459 22.141 83.834 1.00 2.00 ? 209 GLN H C 1 ATOM 2065 O O . GLN B 2 221 ? 38.040 21.892 82.711 1.00 2.00 ? 209 GLN H O 1 ATOM 2066 C CB . GLN B 2 221 ? 36.404 23.098 84.875 1.00 2.00 ? 209 GLN H CB 1 ATOM 2067 C CG . GLN B 2 221 ? 36.092 21.829 85.679 1.00 2.00 ? 209 GLN H CG 1 ATOM 2068 C CD . GLN B 2 221 ? 34.864 21.963 86.570 1.00 2.00 ? 209 GLN H CD 1 ATOM 2069 O OE1 . GLN B 2 221 ? 34.010 22.819 86.362 1.00 2.00 ? 209 GLN H OE1 1 ATOM 2070 N NE2 . GLN B 2 221 ? 34.791 21.128 87.584 1.00 2.00 ? 209 GLN H NE2 1 ATOM 2071 N N . MET B 2 222 ? 39.438 21.468 84.413 1.00 2.00 ? 210 MET H N 1 ATOM 2072 C CA . MET B 2 222 ? 40.093 20.347 83.768 1.00 2.00 ? 210 MET H CA 1 ATOM 2073 C C . MET B 2 222 ? 39.599 19.021 84.332 1.00 2.00 ? 210 MET H C 1 ATOM 2074 O O . MET B 2 222 ? 39.817 17.962 83.721 1.00 2.00 ? 210 MET H O 1 ATOM 2075 C CB . MET B 2 222 ? 41.618 20.466 83.932 1.00 2.00 ? 210 MET H CB 1 ATOM 2076 C CG . MET B 2 222 ? 42.389 20.732 82.644 1.00 2.00 ? 210 MET H CG 1 ATOM 2077 S SD . MET B 2 222 ? 41.857 22.201 81.751 1.00 2.00 ? 210 MET H SD 1 ATOM 2078 C CE . MET B 2 222 ? 43.281 23.167 81.893 1.00 2.00 ? 210 MET H CE 1 ATOM 2079 N N . GLY B 2 223 ? 38.910 19.078 85.472 1.00 2.00 ? 211 GLY H N 1 ATOM 2080 C CA . GLY B 2 223 ? 38.404 17.861 86.082 1.00 2.00 ? 211 GLY H CA 1 ATOM 2081 C C . GLY B 2 223 ? 37.445 18.108 87.224 1.00 2.00 ? 211 GLY H C 1 ATOM 2082 O O . GLY B 2 223 ? 37.237 19.259 87.625 1.00 2.00 ? 211 GLY H O 1 ATOM 2083 N N . ILE B 2 224 ? 36.790 17.045 87.687 1.00 2.00 ? 212 ILE H N 1 ATOM 2084 C CA . ILE B 2 224 ? 35.869 17.141 88.819 1.00 2.00 ? 212 ILE H CA 1 ATOM 2085 C C . ILE B 2 224 ? 36.189 16.016 89.801 1.00 2.00 ? 212 ILE H C 1 ATOM 2086 O O . ILE B 2 224 ? 36.314 14.858 89.409 1.00 15.33 ? 212 ILE H O 1 ATOM 2087 C CB . ILE B 2 224 ? 34.370 17.100 88.405 1.00 15.33 ? 212 ILE H CB 1 ATOM 2088 C CG1 . ILE B 2 224 ? 33.925 15.684 88.073 1.00 15.33 ? 212 ILE H CG1 1 ATOM 2089 C CG2 . ILE B 2 224 ? 34.118 18.008 87.207 1.00 15.33 ? 212 ILE H CG2 1 ATOM 2090 C CD1 . ILE B 2 224 ? 32.543 15.632 87.476 1.00 15.33 ? 212 ILE H CD1 1 ATOM 2091 N N . VAL B 2 225 ? 36.445 16.402 91.048 1.00 2.00 ? 213 VAL H N 1 ATOM 2092 C CA . VAL B 2 225 ? 36.783 15.496 92.150 1.00 2.00 ? 213 VAL H CA 1 ATOM 2093 C C . VAL B 2 225 ? 35.897 14.226 92.214 1.00 2.00 ? 213 VAL H C 1 ATOM 2094 O O . VAL B 2 225 ? 34.807 14.244 92.810 1.00 2.00 ? 213 VAL H O 1 ATOM 2095 C CB . VAL B 2 225 ? 36.663 16.265 93.494 1.00 2.00 ? 213 VAL H CB 1 ATOM 2096 C CG1 . VAL B 2 225 ? 37.052 15.389 94.642 1.00 2.00 ? 213 VAL H CG1 1 ATOM 2097 C CG2 . VAL B 2 225 ? 37.510 17.525 93.469 1.00 2.00 ? 213 VAL H CG2 1 ATOM 2098 N N . SER B 2 226 ? 36.351 13.127 91.616 1.00 2.00 ? 214 SER H N 1 ATOM 2099 C CA . SER B 2 226 ? 35.553 11.907 91.638 1.00 2.00 ? 214 SER H CA 1 ATOM 2100 C C . SER B 2 226 ? 35.805 11.008 92.816 1.00 2.00 ? 214 SER H C 1 ATOM 2101 O O . SER B 2 226 ? 34.935 10.879 93.677 1.00 2.00 ? 214 SER H O 1 ATOM 2102 C CB . SER B 2 226 ? 35.642 11.108 90.328 1.00 2.00 ? 214 SER H CB 1 ATOM 2103 O OG . SER B 2 226 ? 36.894 11.247 89.678 1.00 2.00 ? 214 SER H OG 1 ATOM 2104 N N . TRP B 2 227 ? 36.985 10.397 92.873 1.00 2.00 ? 215 TRP H N 1 ATOM 2105 C CA . TRP B 2 227 ? 37.307 9.486 93.959 1.00 2.00 ? 215 TRP H CA 1 ATOM 2106 C C . TRP B 2 227 ? 38.794 9.279 94.198 1.00 2.00 ? 215 TRP H C 1 ATOM 2107 O O . TRP B 2 227 ? 39.626 9.448 93.298 1.00 2.00 ? 215 TRP H O 1 ATOM 2108 C CB . TRP B 2 227 ? 36.682 8.113 93.693 1.00 2.00 ? 215 TRP H CB 1 ATOM 2109 C CG . TRP B 2 227 ? 37.316 7.379 92.543 1.00 2.00 ? 215 TRP H CG 1 ATOM 2110 C CD1 . TRP B 2 227 ? 37.043 7.553 91.224 1.00 2.00 ? 215 TRP H CD1 1 ATOM 2111 C CD2 . TRP B 2 227 ? 38.324 6.350 92.613 1.00 2.00 ? 215 TRP H CD2 1 ATOM 2112 N NE1 . TRP B 2 227 ? 37.807 6.700 90.464 1.00 2.00 ? 215 TRP H NE1 1 ATOM 2113 C CE2 . TRP B 2 227 ? 38.600 5.950 91.287 1.00 2.00 ? 215 TRP H CE2 1 ATOM 2114 C CE3 . TRP B 2 227 ? 39.015 5.730 93.664 1.00 2.00 ? 215 TRP H CE3 1 ATOM 2115 C CZ2 . TRP B 2 227 ? 39.537 4.953 90.978 1.00 2.00 ? 215 TRP H CZ2 1 ATOM 2116 C CZ3 . TRP B 2 227 ? 39.952 4.736 93.357 1.00 2.00 ? 215 TRP H CZ3 1 ATOM 2117 C CH2 . TRP B 2 227 ? 40.200 4.359 92.022 1.00 2.00 ? 215 TRP H CH2 1 ATOM 2118 N N . GLY B 2 228 ? 39.094 8.829 95.411 1.00 2.00 ? 216 GLY H N 1 ATOM 2119 C CA . GLY B 2 228 ? 40.450 8.512 95.809 1.00 2.00 ? 216 GLY H CA 1 ATOM 2120 C C . GLY B 2 228 ? 40.375 7.345 96.774 1.00 2.00 ? 216 GLY H C 1 ATOM 2121 O O . GLY B 2 228 ? 39.284 6.935 97.182 1.00 48.37 ? 216 GLY H O 1 ATOM 2122 N N . GLU B 2 229 ? 41.521 6.802 97.156 1.00 2.00 ? 217 GLU H N 1 ATOM 2123 C CA . GLU B 2 229 ? 41.561 5.678 98.091 1.00 2.00 ? 217 GLU H CA 1 ATOM 2124 C C . GLU B 2 229 ? 42.125 6.156 99.429 1.00 2.00 ? 217 GLU H C 1 ATOM 2125 O O . GLU B 2 229 ? 43.236 5.792 99.802 1.00 12.00 ? 217 GLU H O 1 ATOM 2126 C CB . GLU B 2 229 ? 42.449 4.596 97.497 1.00 12.00 ? 217 GLU H CB 1 ATOM 2127 C CG . GLU B 2 229 ? 41.999 3.201 97.734 1.00 12.00 ? 217 GLU H CG 1 ATOM 2128 C CD . GLU B 2 229 ? 42.473 2.300 96.635 1.00 12.00 ? 217 GLU H CD 1 ATOM 2129 O OE1 . GLU B 2 229 ? 43.689 2.008 96.600 1.00 12.00 ? 217 GLU H OE1 1 ATOM 2130 O OE2 . GLU B 2 229 ? 41.640 1.912 95.786 1.00 12.00 ? 217 GLU H OE2 1 ATOM 2131 N N . GLY B 2 230 ? 41.342 6.955 100.149 1.00 2.00 ? 219 GLY H N 1 ATOM 2132 C CA . GLY B 2 230 ? 41.794 7.516 101.410 1.00 2.00 ? 219 GLY H CA 1 ATOM 2133 C C . GLY B 2 230 ? 42.387 8.874 101.101 1.00 2.00 ? 219 GLY H C 1 ATOM 2134 O O . GLY B 2 230 ? 42.944 9.072 100.021 1.00 67.77 ? 219 GLY H O 1 ATOM 2135 N N . CYS B 2 231 ? 42.288 9.818 102.025 1.00 2.00 ? 220 CYS H N 1 ATOM 2136 C CA . CYS B 2 231 ? 42.821 11.159 101.778 1.00 2.00 ? 220 CYS H CA 1 ATOM 2137 C C . CYS B 2 231 ? 44.276 11.377 102.201 1.00 2.00 ? 220 CYS H C 1 ATOM 2138 O O . CYS B 2 231 ? 44.600 11.251 103.382 1.00 2.00 ? 220 CYS H O 1 ATOM 2139 C CB . CYS B 2 231 ? 41.954 12.176 102.492 1.00 2.00 ? 220 CYS H CB 1 ATOM 2140 S SG . CYS B 2 231 ? 40.191 11.776 102.402 1.00 2.00 ? 220 CYS H SG 1 ATOM 2141 N N . ASP B 2 232 ? 45.139 11.691 101.229 1.00 2.00 ? 221 ASP H N 1 ATOM 2142 C CA . ASP B 2 232 ? 46.571 11.976 101.456 1.00 2.00 ? 221 ASP H CA 1 ATOM 2143 C C . ASP B 2 232 ? 47.423 10.800 101.954 1.00 2.00 ? 221 ASP H C 1 ATOM 2144 O O . ASP B 2 232 ? 48.283 10.958 102.828 1.00 2.00 ? 221 ASP H O 1 ATOM 2145 C CB . ASP B 2 232 ? 46.696 13.186 102.396 1.00 2.00 ? 221 ASP H CB 1 ATOM 2146 C CG . ASP B 2 232 ? 48.035 13.875 102.300 1.00 2.00 ? 221 ASP H CG 1 ATOM 2147 O OD1 . ASP B 2 232 ? 48.641 13.853 101.209 1.00 2.00 ? 221 ASP H OD1 1 ATOM 2148 O OD2 . ASP B 2 232 ? 48.475 14.455 103.320 1.00 2.00 ? 221 ASP H OD2 1 ATOM 2149 N N . ARG B 2 233 A 47.195 9.630 101.360 1.00 14.57 ? 221 ARG H N 1 ATOM 2150 C CA . ARG B 2 233 A 47.907 8.403 101.715 1.00 14.57 ? 221 ARG H CA 1 ATOM 2151 C C . ARG B 2 233 A 49.113 8.211 100.793 1.00 14.57 ? 221 ARG H C 1 ATOM 2152 O O . ARG B 2 233 A 48.959 8.171 99.573 1.00 2.00 ? 221 ARG H O 1 ATOM 2153 C CB . ARG B 2 233 A 46.936 7.233 101.618 1.00 2.00 ? 221 ARG H CB 1 ATOM 2154 C CG . ARG B 2 233 A 45.757 7.408 102.559 1.00 2.00 ? 221 ARG H CG 1 ATOM 2155 C CD . ARG B 2 233 A 44.608 6.445 102.285 1.00 2.00 ? 221 ARG H CD 1 ATOM 2156 N NE . ARG B 2 233 A 44.825 5.063 102.715 1.00 2.00 ? 221 ARG H NE 1 ATOM 2157 C CZ . ARG B 2 233 A 43.913 4.322 103.339 1.00 2.00 ? 221 ARG H CZ 1 ATOM 2158 N NH1 . ARG B 2 233 A 42.717 4.812 103.628 1.00 2.00 ? 221 ARG H NH1 1 ATOM 2159 N NH2 . ARG B 2 233 A 44.180 3.069 103.642 1.00 2.00 ? 221 ARG H NH2 1 ATOM 2160 N N . ASP B 2 234 ? 50.312 8.107 101.368 1.00 22.18 ? 222 ASP H N 1 ATOM 2161 C CA . ASP B 2 234 ? 51.529 7.957 100.558 1.00 22.18 ? 222 ASP H CA 1 ATOM 2162 C C . ASP B 2 234 ? 51.492 6.802 99.574 1.00 22.18 ? 222 ASP H C 1 ATOM 2163 O O . ASP B 2 234 ? 51.433 5.642 99.976 1.00 2.00 ? 222 ASP H O 1 ATOM 2164 C CB . ASP B 2 234 ? 52.783 7.847 101.431 1.00 2.00 ? 222 ASP H CB 1 ATOM 2165 C CG . ASP B 2 234 ? 53.806 8.936 101.130 1.00 2.00 ? 222 ASP H CG 1 ATOM 2166 O OD1 . ASP B 2 234 ? 53.438 9.941 100.475 1.00 2.00 ? 222 ASP H OD1 1 ATOM 2167 O OD2 . ASP B 2 234 ? 54.975 8.792 101.561 1.00 2.00 ? 222 ASP H OD2 1 ATOM 2168 N N . GLY B 2 235 ? 51.553 7.140 98.287 1.00 2.00 ? 223 GLY H N 1 ATOM 2169 C CA . GLY B 2 235 ? 51.522 6.137 97.237 1.00 2.00 ? 223 GLY H CA 1 ATOM 2170 C C . GLY B 2 235 ? 50.157 5.974 96.581 1.00 2.00 ? 223 GLY H C 1 ATOM 2171 O O . GLY B 2 235 ? 49.982 5.129 95.701 1.00 2.00 ? 223 GLY H O 1 ATOM 2172 N N . LYS B 2 236 ? 49.188 6.764 97.037 1.00 17.64 ? 224 LYS H N 1 ATOM 2173 C CA . LYS B 2 236 ? 47.823 6.762 96.500 1.00 17.64 ? 224 LYS H CA 1 ATOM 2174 C C . LYS B 2 236 ? 47.471 8.183 96.067 1.00 17.64 ? 224 LYS H C 1 ATOM 2175 O O . LYS B 2 236 ? 47.669 9.138 96.818 1.00 25.00 ? 224 LYS H O 1 ATOM 2176 C CB . LYS B 2 236 ? 46.805 6.301 97.553 1.00 25.00 ? 224 LYS H CB 1 ATOM 2177 C CG . LYS B 2 236 ? 47.024 4.887 98.057 1.00 25.00 ? 224 LYS H CG 1 ATOM 2178 C CD . LYS B 2 236 ? 46.897 3.869 96.932 1.00 25.00 ? 224 LYS H CD 1 ATOM 2179 C CE . LYS B 2 236 ? 47.456 2.519 97.343 1.00 25.00 ? 224 LYS H CE 1 ATOM 2180 N NZ . LYS B 2 236 ? 46.757 1.970 98.537 1.00 25.00 ? 224 LYS H NZ 1 ATOM 2181 N N . TYR B 2 237 ? 46.955 8.332 94.856 1.00 50.67 ? 225 TYR H N 1 ATOM 2182 C CA . TYR B 2 237 ? 46.603 9.660 94.369 1.00 50.67 ? 225 TYR H CA 1 ATOM 2183 C C . TYR B 2 237 ? 45.096 9.846 94.175 1.00 50.67 ? 225 TYR H C 1 ATOM 2184 O O . TYR B 2 237 ? 44.322 8.889 94.271 1.00 2.00 ? 225 TYR H O 1 ATOM 2185 C CB . TYR B 2 237 ? 47.362 9.972 93.085 1.00 2.00 ? 225 TYR H CB 1 ATOM 2186 C CG . TYR B 2 237 ? 48.802 9.548 93.149 1.00 2.00 ? 225 TYR H CG 1 ATOM 2187 C CD1 . TYR B 2 237 ? 49.175 8.256 92.779 1.00 2.00 ? 225 TYR H CD1 1 ATOM 2188 C CD2 . TYR B 2 237 ? 49.793 10.427 93.557 1.00 2.00 ? 225 TYR H CD2 1 ATOM 2189 C CE1 . TYR B 2 237 ? 50.498 7.851 92.807 1.00 2.00 ? 225 TYR H CE1 1 ATOM 2190 C CE2 . TYR B 2 237 ? 51.124 10.032 93.587 1.00 2.00 ? 225 TYR H CE2 1 ATOM 2191 C CZ . TYR B 2 237 ? 51.465 8.741 93.209 1.00 2.00 ? 225 TYR H CZ 1 ATOM 2192 O OH . TYR B 2 237 ? 52.768 8.328 93.232 1.00 2.00 ? 225 TYR H OH 1 ATOM 2193 N N . GLY B 2 238 ? 44.687 11.091 93.946 1.00 2.00 ? 226 GLY H N 1 ATOM 2194 C CA . GLY B 2 238 ? 43.283 11.382 93.766 1.00 2.00 ? 226 GLY H CA 1 ATOM 2195 C C . GLY B 2 238 ? 42.911 11.305 92.314 1.00 2.00 ? 226 GLY H C 1 ATOM 2196 O O . GLY B 2 238 ? 43.664 11.770 91.463 1.00 7.40 ? 226 GLY H O 1 ATOM 2197 N N . PHE B 2 239 ? 41.772 10.688 92.030 1.00 2.00 ? 227 PHE H N 1 ATOM 2198 C CA . PHE B 2 239 ? 41.291 10.564 90.665 1.00 2.00 ? 227 PHE H CA 1 ATOM 2199 C C . PHE B 2 239 ? 40.236 11.611 90.394 1.00 2.00 ? 227 PHE H C 1 ATOM 2200 O O . PHE B 2 239 ? 39.432 11.927 91.265 1.00 2.00 ? 227 PHE H O 1 ATOM 2201 C CB . PHE B 2 239 ? 40.734 9.167 90.417 1.00 2.00 ? 227 PHE H CB 1 ATOM 2202 C CG . PHE B 2 239 ? 41.794 8.110 90.352 1.00 2.00 ? 227 PHE H CG 1 ATOM 2203 C CD1 . PHE B 2 239 ? 42.500 7.897 89.180 1.00 2.00 ? 227 PHE H CD1 1 ATOM 2204 C CD2 . PHE B 2 239 ? 42.107 7.346 91.476 1.00 2.00 ? 227 PHE H CD2 1 ATOM 2205 C CE1 . PHE B 2 239 ? 43.508 6.935 89.134 1.00 2.00 ? 227 PHE H CE1 1 ATOM 2206 C CE2 . PHE B 2 239 ? 43.116 6.379 91.434 1.00 2.00 ? 227 PHE H CE2 1 ATOM 2207 C CZ . PHE B 2 239 ? 43.815 6.175 90.269 1.00 2.00 ? 227 PHE H CZ 1 ATOM 2208 N N . TYR B 2 240 ? 40.278 12.184 89.199 1.00 2.00 ? 228 TYR H N 1 ATOM 2209 C CA . TYR B 2 240 ? 39.328 13.207 88.796 1.00 2.00 ? 228 TYR H CA 1 ATOM 2210 C C . TYR B 2 240 ? 38.723 12.843 87.442 1.00 2.00 ? 228 TYR H C 1 ATOM 2211 O O . TYR B 2 240 ? 39.367 12.168 86.622 1.00 2.00 ? 228 TYR H O 1 ATOM 2212 C CB . TYR B 2 240 ? 40.031 14.562 88.712 1.00 2.00 ? 228 TYR H CB 1 ATOM 2213 C CG . TYR B 2 240 ? 40.677 14.989 90.008 1.00 2.00 ? 228 TYR H CG 1 ATOM 2214 C CD1 . TYR B 2 240 ? 41.939 14.511 90.372 1.00 2.00 ? 228 TYR H CD1 1 ATOM 2215 C CD2 . TYR B 2 240 ? 40.020 15.854 90.884 1.00 2.00 ? 228 TYR H CD2 1 ATOM 2216 C CE1 . TYR B 2 240 ? 42.525 14.882 91.578 1.00 2.00 ? 228 TYR H CE1 1 ATOM 2217 C CE2 . TYR B 2 240 ? 40.597 16.229 92.087 1.00 2.00 ? 228 TYR H CE2 1 ATOM 2218 C CZ . TYR B 2 240 ? 41.844 15.738 92.428 1.00 2.00 ? 228 TYR H CZ 1 ATOM 2219 O OH . TYR B 2 240 ? 42.392 16.081 93.634 1.00 2.00 ? 228 TYR H OH 1 ATOM 2220 N N . THR B 2 241 ? 37.483 13.266 87.215 1.00 2.00 ? 229 THR H N 1 ATOM 2221 C CA . THR B 2 241 ? 36.814 12.987 85.949 1.00 2.00 ? 229 THR H CA 1 ATOM 2222 C C . THR B 2 241 ? 37.445 13.862 84.876 1.00 2.00 ? 229 THR H C 1 ATOM 2223 O O . THR B 2 241 ? 37.556 15.080 85.044 1.00 2.00 ? 229 THR H O 1 ATOM 2224 C CB . THR B 2 241 ? 35.307 13.313 86.002 1.00 2.00 ? 229 THR H CB 1 ATOM 2225 O OG1 . THR B 2 241 ? 34.771 12.873 87.251 1.00 2.00 ? 229 THR H OG1 1 ATOM 2226 C CG2 . THR B 2 241 ? 34.562 12.600 84.884 1.00 2.00 ? 229 THR H CG2 1 ATOM 2227 N N . HIS B 2 242 ? 37.893 13.240 83.794 1.00 2.00 ? 230 HIS H N 1 ATOM 2228 C CA . HIS B 2 242 ? 38.494 13.977 82.705 1.00 2.00 ? 230 HIS H CA 1 ATOM 2229 C C . HIS B 2 242 ? 37.372 14.763 82.023 1.00 2.00 ? 230 HIS H C 1 ATOM 2230 O O . HIS B 2 242 ? 36.614 14.206 81.218 1.00 2.00 ? 230 HIS H O 1 ATOM 2231 C CB . HIS B 2 242 ? 39.135 12.987 81.731 1.00 2.00 ? 230 HIS H CB 1 ATOM 2232 C CG . HIS B 2 242 ? 40.246 13.569 80.909 1.00 2.00 ? 230 HIS H CG 1 ATOM 2233 N ND1 . HIS B 2 242 ? 40.146 14.785 80.264 1.00 2.00 ? 230 HIS H ND1 1 ATOM 2234 C CD2 . HIS B 2 242 ? 41.484 13.097 80.630 1.00 2.00 ? 230 HIS H CD2 1 ATOM 2235 C CE1 . HIS B 2 242 ? 41.273 15.036 79.624 1.00 2.00 ? 230 HIS H CE1 1 ATOM 2236 N NE2 . HIS B 2 242 ? 42.101 14.027 79.831 1.00 2.00 ? 230 HIS H NE2 1 ATOM 2237 N N . VAL B 2 243 ? 37.285 16.060 82.324 1.00 2.00 ? 231 VAL H N 1 ATOM 2238 C CA . VAL B 2 243 ? 36.243 16.930 81.755 1.00 2.00 ? 231 VAL H CA 1 ATOM 2239 C C . VAL B 2 243 ? 36.259 17.046 80.236 1.00 2.00 ? 231 VAL H C 1 ATOM 2240 O O . VAL B 2 243 ? 35.206 16.965 79.607 1.00 2.00 ? 231 VAL H O 1 ATOM 2241 C CB . VAL B 2 243 ? 36.281 18.353 82.374 1.00 2.00 ? 231 VAL H CB 1 ATOM 2242 C CG1 . VAL B 2 243 ? 35.447 19.310 81.566 1.00 2.00 ? 231 VAL H CG1 1 ATOM 2243 C CG2 . VAL B 2 243 ? 35.743 18.325 83.785 1.00 2.00 ? 231 VAL H CG2 1 ATOM 2244 N N . PHE B 2 244 ? 37.443 17.222 79.650 1.00 2.00 ? 232 PHE H N 1 ATOM 2245 C CA . PHE B 2 244 ? 37.546 17.347 78.200 1.00 2.00 ? 232 PHE H CA 1 ATOM 2246 C C . PHE B 2 244 ? 37.181 16.059 77.457 1.00 2.00 ? 232 PHE H C 1 ATOM 2247 O O . PHE B 2 244 ? 36.466 16.096 76.449 1.00 42.10 ? 232 PHE H O 1 ATOM 2248 C CB . PHE B 2 244 ? 38.931 17.824 77.777 1.00 42.10 ? 232 PHE H CB 1 ATOM 2249 C CG . PHE B 2 244 ? 39.031 18.143 76.314 1.00 42.10 ? 232 PHE H CG 1 ATOM 2250 C CD1 . PHE B 2 244 ? 38.493 19.321 75.817 1.00 42.10 ? 232 PHE H CD1 1 ATOM 2251 C CD2 . PHE B 2 244 ? 39.632 17.249 75.430 1.00 42.10 ? 232 PHE H CD2 1 ATOM 2252 C CE1 . PHE B 2 244 ? 38.544 19.607 74.463 1.00 42.10 ? 232 PHE H CE1 1 ATOM 2253 C CE2 . PHE B 2 244 ? 39.692 17.521 74.072 1.00 42.10 ? 232 PHE H CE2 1 ATOM 2254 C CZ . PHE B 2 244 ? 39.147 18.703 73.586 1.00 42.10 ? 232 PHE H CZ 1 ATOM 2255 N N . ARG B 2 245 ? 37.663 14.924 77.953 1.00 2.00 ? 233 ARG H N 1 ATOM 2256 C CA . ARG B 2 245 ? 37.364 13.643 77.324 1.00 2.00 ? 233 ARG H CA 1 ATOM 2257 C C . ARG B 2 245 ? 35.878 13.292 77.336 1.00 2.00 ? 233 ARG H C 1 ATOM 2258 O O . ARG B 2 245 ? 35.456 12.383 76.624 1.00 48.92 ? 233 ARG H O 1 ATOM 2259 C CB . ARG B 2 245 ? 38.166 12.520 77.977 1.00 48.92 ? 233 ARG H CB 1 ATOM 2260 C CG . ARG B 2 245 ? 39.519 12.268 77.332 1.00 48.92 ? 233 ARG H CG 1 ATOM 2261 C CD . ARG B 2 245 ? 39.367 11.555 75.998 1.00 48.92 ? 233 ARG H CD 1 ATOM 2262 N NE . ARG B 2 245 ? 38.810 10.214 76.165 1.00 48.92 ? 233 ARG H NE 1 ATOM 2263 C CZ . ARG B 2 245 ? 37.635 9.818 75.681 1.00 48.92 ? 233 ARG H CZ 1 ATOM 2264 N NH1 . ARG B 2 245 ? 36.875 10.653 74.985 1.00 48.92 ? 233 ARG H NH1 1 ATOM 2265 N NH2 . ARG B 2 245 ? 37.219 8.578 75.892 1.00 48.92 ? 233 ARG H NH2 1 ATOM 2266 N N . LEU B 2 246 ? 35.097 13.996 78.155 1.00 30.23 ? 234 LEU H N 1 ATOM 2267 C CA . LEU B 2 246 ? 33.643 13.780 78.249 1.00 30.23 ? 234 LEU H CA 1 ATOM 2268 C C . LEU B 2 246 ? 32.858 15.027 77.846 1.00 30.23 ? 234 LEU H C 1 ATOM 2269 O O . LEU B 2 246 ? 31.642 15.091 78.042 1.00 2.00 ? 234 LEU H O 1 ATOM 2270 C CB . LEU B 2 246 ? 33.243 13.380 79.678 1.00 2.00 ? 234 LEU H CB 1 ATOM 2271 C CG . LEU B 2 246 ? 33.523 11.947 80.140 1.00 2.00 ? 234 LEU H CG 1 ATOM 2272 C CD1 . LEU B 2 246 ? 33.176 11.775 81.609 1.00 2.00 ? 234 LEU H CD1 1 ATOM 2273 C CD2 . LEU B 2 246 ? 32.716 10.987 79.287 1.00 2.00 ? 234 LEU H CD2 1 ATOM 2274 N N . LYS B 2 247 ? 33.534 15.977 77.204 1.00 27.62 ? 235 LYS H N 1 ATOM 2275 C CA . LYS B 2 247 ? 32.900 17.238 76.836 1.00 27.62 ? 235 LYS H CA 1 ATOM 2276 C C . LYS B 2 247 ? 31.724 17.132 75.881 1.00 27.62 ? 235 LYS H C 1 ATOM 2277 O O . LYS B 2 247 ? 30.704 17.809 76.063 1.00 20.50 ? 235 LYS H O 1 ATOM 2278 C CB . LYS B 2 247 ? 33.926 18.248 76.314 1.00 20.50 ? 235 LYS H CB 1 ATOM 2279 C CG . LYS B 2 247 ? 33.696 19.648 76.869 1.00 20.50 ? 235 LYS H CG 1 ATOM 2280 C CD . LYS B 2 247 ? 34.540 20.677 76.156 1.00 20.50 ? 235 LYS H CD 1 ATOM 2281 C CE . LYS B 2 247 ? 34.167 20.770 74.680 1.00 20.50 ? 235 LYS H CE 1 ATOM 2282 N NZ . LYS B 2 247 ? 34.800 21.958 74.028 1.00 20.50 ? 235 LYS H NZ 1 ATOM 2283 N N . LYS B 2 248 ? 31.855 16.272 74.876 1.00 47.52 ? 236 LYS H N 1 ATOM 2284 C CA . LYS B 2 248 ? 30.793 16.085 73.893 1.00 47.52 ? 236 LYS H CA 1 ATOM 2285 C C . LYS B 2 248 ? 29.455 15.884 74.622 1.00 47.52 ? 236 LYS H C 1 ATOM 2286 O O . LYS B 2 248 ? 28.489 16.580 74.316 1.00 27.49 ? 236 LYS H O 1 ATOM 2287 C CB . LYS B 2 248 ? 31.117 14.890 72.972 1.00 27.49 ? 236 LYS H CB 1 ATOM 2288 C CG . LYS B 2 248 ? 30.737 15.079 71.498 1.00 27.49 ? 236 LYS H CG 1 ATOM 2289 C CD . LYS B 2 248 ? 31.370 13.999 70.622 1.00 27.49 ? 236 LYS H CD 1 ATOM 2290 C CE . LYS B 2 248 ? 31.238 14.308 69.125 1.00 27.49 ? 236 LYS H CE 1 ATOM 2291 N NZ . LYS B 2 248 ? 29.984 13.817 68.475 1.00 27.49 ? 236 LYS H NZ 1 ATOM 2292 N N . TRP B 2 249 ? 29.439 15.016 75.643 1.00 2.00 ? 237 TRP H N 1 ATOM 2293 C CA . TRP B 2 249 ? 28.222 14.744 76.405 1.00 2.00 ? 237 TRP H CA 1 ATOM 2294 C C . TRP B 2 249 ? 27.678 15.999 77.058 1.00 2.00 ? 237 TRP H C 1 ATOM 2295 O O . TRP B 2 249 ? 26.474 16.096 77.293 1.00 37.41 ? 237 TRP H O 1 ATOM 2296 C CB . TRP B 2 249 ? 28.441 13.696 77.491 1.00 37.41 ? 237 TRP H CB 1 ATOM 2297 C CG . TRP B 2 249 ? 27.133 13.225 78.119 1.00 37.41 ? 237 TRP H CG 1 ATOM 2298 C CD1 . TRP B 2 249 ? 26.336 12.205 77.672 1.00 37.41 ? 237 TRP H CD1 1 ATOM 2299 C CD2 . TRP B 2 249 ? 26.475 13.757 79.290 1.00 37.41 ? 237 TRP H CD2 1 ATOM 2300 N NE1 . TRP B 2 249 ? 25.233 12.065 78.484 1.00 37.41 ? 237 TRP H NE1 1 ATOM 2301 C CE2 . TRP B 2 249 ? 25.289 13.000 79.483 1.00 37.41 ? 237 TRP H CE2 1 ATOM 2302 C CE3 . TRP B 2 249 ? 26.768 14.794 80.189 1.00 37.41 ? 237 TRP H CE3 1 ATOM 2303 C CZ2 . TRP B 2 249 ? 24.395 13.249 80.544 1.00 37.41 ? 237 TRP H CZ2 1 ATOM 2304 C CZ3 . TRP B 2 249 ? 25.875 15.044 81.246 1.00 37.41 ? 237 TRP H CZ3 1 ATOM 2305 C CH2 . TRP B 2 249 ? 24.705 14.269 81.409 1.00 37.41 ? 237 TRP H CH2 1 ATOM 2306 N N . ILE B 2 250 ? 28.563 16.936 77.397 1.00 24.59 ? 238 ILE H N 1 ATOM 2307 C CA . ILE B 2 250 ? 28.129 18.195 78.006 1.00 24.59 ? 238 ILE H CA 1 ATOM 2308 C C . ILE B 2 250 ? 27.414 19.015 76.930 1.00 24.59 ? 238 ILE H C 1 ATOM 2309 O O . ILE B 2 250 ? 26.312 19.517 77.142 1.00 13.89 ? 238 ILE H O 1 ATOM 2310 C CB . ILE B 2 250 ? 29.314 19.041 78.556 1.00 13.89 ? 238 ILE H CB 1 ATOM 2311 C CG1 . ILE B 2 250 ? 30.149 18.233 79.552 1.00 13.89 ? 238 ILE H CG1 1 ATOM 2312 C CG2 . ILE B 2 250 ? 28.781 20.288 79.251 1.00 13.89 ? 238 ILE H CG2 1 ATOM 2313 C CD1 . ILE B 2 250 ? 31.243 19.033 80.246 1.00 13.89 ? 238 ILE H CD1 1 ATOM 2314 N N . GLN B 2 251 ? 28.031 19.114 75.759 1.00 2.00 ? 239 GLN H N 1 ATOM 2315 C CA . GLN B 2 251 ? 27.452 19.867 74.658 1.00 2.00 ? 239 GLN H CA 1 ATOM 2316 C C . GLN B 2 251 ? 26.105 19.250 74.300 1.00 2.00 ? 239 GLN H C 1 ATOM 2317 O O . GLN B 2 251 ? 25.093 19.932 74.273 1.00 24.37 ? 239 GLN H O 1 ATOM 2318 C CB . GLN B 2 251 ? 28.367 19.822 73.418 1.00 24.37 ? 239 GLN H CB 1 ATOM 2319 C CG . GLN B 2 251 ? 29.875 20.053 73.650 1.00 24.37 ? 239 GLN H CG 1 ATOM 2320 C CD . GLN B 2 251 ? 30.223 21.437 74.204 1.00 24.37 ? 239 GLN H CD 1 ATOM 2321 O OE1 . GLN B 2 251 ? 30.611 21.568 75.363 1.00 24.37 ? 239 GLN H OE1 1 ATOM 2322 N NE2 . GLN B 2 251 ? 30.114 22.463 73.370 1.00 24.37 ? 239 GLN H NE2 1 ATOM 2323 N N . LYS B 2 252 ? 26.112 17.942 74.069 1.00 22.66 ? 240 LYS H N 1 ATOM 2324 C CA . LYS B 2 252 ? 24.932 17.166 73.685 1.00 22.66 ? 240 LYS H CA 1 ATOM 2325 C C . LYS B 2 252 ? 23.758 17.255 74.669 1.00 22.66 ? 240 LYS H C 1 ATOM 2326 O O . LYS B 2 252 ? 22.610 16.959 74.309 1.00 5.95 ? 240 LYS H O 1 ATOM 2327 C CB . LYS B 2 252 ? 25.341 15.701 73.484 1.00 5.95 ? 240 LYS H CB 1 ATOM 2328 C CG . LYS B 2 252 ? 24.279 14.793 72.879 1.00 5.95 ? 240 LYS H CG 1 ATOM 2329 C CD . LYS B 2 252 ? 24.435 13.398 73.437 1.00 5.95 ? 240 LYS H CD 1 ATOM 2330 C CE . LYS B 2 252 ? 23.454 12.413 72.828 1.00 5.95 ? 240 LYS H CE 1 ATOM 2331 N NZ . LYS B 2 252 ? 23.483 11.090 73.549 1.00 5.95 ? 240 LYS H NZ 1 ATOM 2332 N N . VAL B 2 253 ? 24.052 17.636 75.909 1.00 13.95 ? 241 VAL H N 1 ATOM 2333 C CA . VAL B 2 253 ? 23.029 17.764 76.947 1.00 13.95 ? 241 VAL H CA 1 ATOM 2334 C C . VAL B 2 253 ? 22.578 19.216 77.125 1.00 13.95 ? 241 VAL H C 1 ATOM 2335 O O . VAL B 2 253 ? 21.408 19.469 77.413 1.00 15.56 ? 241 VAL H O 1 ATOM 2336 C CB . VAL B 2 253 ? 23.527 17.190 78.311 1.00 15.56 ? 241 VAL H CB 1 ATOM 2337 C CG1 . VAL B 2 253 ? 22.532 17.485 79.433 1.00 15.56 ? 241 VAL H CG1 1 ATOM 2338 C CG2 . VAL B 2 253 ? 23.720 15.708 78.197 1.00 15.56 ? 241 VAL H CG2 1 ATOM 2339 N N . ILE B 2 254 ? 23.507 20.157 76.971 1.00 24.27 ? 242 ILE H N 1 ATOM 2340 C CA . ILE B 2 254 ? 23.192 21.572 77.111 1.00 24.27 ? 242 ILE H CA 1 ATOM 2341 C C . ILE B 2 254 ? 22.644 22.141 75.794 1.00 24.27 ? 242 ILE H C 1 ATOM 2342 O O . ILE B 2 254 ? 21.767 23.011 75.799 1.00 38.79 ? 242 ILE H O 1 ATOM 2343 C CB . ILE B 2 254 ? 24.434 22.409 77.549 1.00 38.79 ? 242 ILE H CB 1 ATOM 2344 C CG1 . ILE B 2 254 ? 25.037 21.843 78.828 1.00 38.79 ? 242 ILE H CG1 1 ATOM 2345 C CG2 . ILE B 2 254 ? 24.046 23.861 77.831 1.00 38.79 ? 242 ILE H CG2 1 ATOM 2346 C CD1 . ILE B 2 254 ? 26.236 22.635 79.318 1.00 38.79 ? 242 ILE H CD1 1 ATOM 2347 N N . ASP B 2 255 ? 23.165 21.642 74.675 1.00 80.99 ? 243 ASP H N 1 ATOM 2348 C CA . ASP B 2 255 ? 22.772 22.085 73.337 1.00 80.99 ? 243 ASP H CA 1 ATOM 2349 C C . ASP B 2 255 ? 23.107 23.560 73.087 1.00 80.99 ? 243 ASP H C 1 ATOM 2350 O O . ASP B 2 255 ? 22.347 24.309 72.462 1.00 36.35 ? 243 ASP H O 1 ATOM 2351 C CB . ASP B 2 255 ? 21.295 21.776 73.061 1.00 36.35 ? 243 ASP H CB 1 ATOM 2352 C CG . ASP B 2 255 ? 21.044 20.293 72.846 1.00 36.35 ? 243 ASP H CG 1 ATOM 2353 O OD1 . ASP B 2 255 ? 21.906 19.628 72.233 1.00 36.35 ? 243 ASP H OD1 1 ATOM 2354 O OD2 . ASP B 2 255 ? 19.986 19.795 73.286 1.00 36.35 ? 243 ASP H OD2 1 ATOM 2355 N N . ARG B 2 256 ? 24.275 23.948 73.588 1.00 64.51 ? 244 ARG H N 1 ATOM 2356 C CA . ARG B 2 256 ? 24.825 25.293 73.446 1.00 64.51 ? 244 ARG H CA 1 ATOM 2357 C C . ARG B 2 256 ? 25.875 25.058 72.356 1.00 64.51 ? 244 ARG H C 1 ATOM 2358 O O . ARG B 2 256 ? 27.072 24.925 72.634 1.00 98.56 ? 244 ARG H O 1 ATOM 2359 C CB . ARG B 2 256 ? 25.477 25.688 74.772 1.00 98.56 ? 244 ARG H CB 1 ATOM 2360 C CG . ARG B 2 256 ? 26.163 27.034 74.812 1.00 98.56 ? 244 ARG H CG 1 ATOM 2361 C CD . ARG B 2 256 ? 26.926 27.165 76.124 1.00 98.56 ? 244 ARG H CD 1 ATOM 2362 N NE . ARG B 2 256 ? 27.854 26.047 76.316 1.00 98.56 ? 244 ARG H NE 1 ATOM 2363 C CZ . ARG B 2 256 ? 28.368 25.680 77.488 1.00 98.56 ? 244 ARG H CZ 1 ATOM 2364 N NH1 . ARG B 2 256 ? 28.055 26.336 78.600 1.00 98.56 ? 244 ARG H NH1 1 ATOM 2365 N NH2 . ARG B 2 256 ? 29.199 24.648 77.549 1.00 98.56 ? 244 ARG H NH2 1 ATOM 2366 N N . LEU B 2 257 ? 25.394 24.939 71.122 1.00 71.07 ? 245 LEU H N 1 ATOM 2367 C CA . LEU B 2 257 ? 26.246 24.617 69.988 1.00 71.07 ? 245 LEU H CA 1 ATOM 2368 C C . LEU B 2 257 ? 26.353 25.675 68.886 1.00 71.07 ? 245 LEU H C 1 ATOM 2369 O O . LEU B 2 257 ? 26.089 26.859 69.108 1.00 31.00 ? 245 LEU H O 1 ATOM 2370 C CB . LEU B 2 257 ? 25.771 23.281 69.400 1.00 31.00 ? 245 LEU H CB 1 ATOM 2371 C CG . LEU B 2 257 ? 25.016 22.354 70.373 1.00 31.00 ? 245 LEU H CG 1 ATOM 2372 C CD1 . LEU B 2 257 ? 24.096 21.441 69.609 1.00 31.00 ? 245 LEU H CD1 1 ATOM 2373 C CD2 . LEU B 2 257 ? 25.959 21.567 71.282 1.00 31.00 ? 245 LEU H CD2 1 ATOM 2374 N N . GLY B 2 258 ? 26.729 25.203 67.696 1.00 94.73 ? 246 GLY H N 1 ATOM 2375 C CA . GLY B 2 258 ? 26.924 26.024 66.506 1.00 94.73 ? 246 GLY H CA 1 ATOM 2376 C C . GLY B 2 258 ? 26.186 27.333 66.255 1.00 94.73 ? 246 GLY H C 1 ATOM 2377 O O . GLY B 2 258 ? 24.979 27.351 65.971 1.00 17.03 ? 246 GLY H O 1 ATOM 2378 N N . SER B 2 259 ? 26.949 28.423 66.289 1.00 29.86 ? 247 SER H N 1 ATOM 2379 C CA . SER B 2 259 ? 26.435 29.765 66.041 1.00 29.86 ? 247 SER H CA 1 ATOM 2380 C C . SER B 2 259 ? 27.579 30.786 66.015 1.00 29.86 ? 247 SER H C 1 ATOM 2381 O O . SER B 2 259 ? 28.763 30.376 65.924 1.00 2.00 ? 247 SER H O 1 ATOM 2382 C CB . SER B 2 259 ? 25.386 30.138 67.092 1.00 2.00 ? 247 SER H CB 1 ATOM 2383 O OG . SER B 2 259 ? 24.733 31.365 66.794 1.00 2.00 ? 247 SER H OG 1 ATOM 2384 O OXT . SER B 2 259 ? 27.278 31.994 66.037 1.00 2.00 ? 247 SER H OXT 1 ATOM 2385 N N . HIS C 3 1 ? 28.885 15.451 104.688 1.00 67.99 ? 51 HIS I N 1 ATOM 2386 C CA . HIS C 3 1 ? 28.334 14.071 104.810 1.00 67.99 ? 51 HIS I CA 1 ATOM 2387 C C . HIS C 3 1 ? 27.664 13.716 106.134 1.00 67.99 ? 51 HIS I C 1 ATOM 2388 O O . HIS C 3 1 ? 27.001 12.685 106.229 1.00 104.55 ? 51 HIS I O 1 ATOM 2389 C CB . HIS C 3 1 ? 29.405 13.033 104.480 1.00 104.55 ? 51 HIS I CB 1 ATOM 2390 C CG . HIS C 3 1 ? 29.357 12.568 103.060 1.00 104.55 ? 51 HIS I CG 1 ATOM 2391 N ND1 . HIS C 3 1 ? 28.877 11.328 102.700 1.00 104.55 ? 51 HIS I ND1 1 ATOM 2392 C CD2 . HIS C 3 1 ? 29.688 13.195 101.907 1.00 104.55 ? 51 HIS I CD2 1 ATOM 2393 C CE1 . HIS C 3 1 ? 28.912 11.210 101.384 1.00 104.55 ? 51 HIS I CE1 1 ATOM 2394 N NE2 . HIS C 3 1 ? 29.399 12.328 100.879 1.00 104.55 ? 51 HIS I NE2 1 ATOM 2395 N N . ASN C 3 2 ? 27.881 14.530 107.162 1.00 97.06 ? 52 ASN I N 1 ATOM 2396 C CA . ASN C 3 2 ? 27.276 14.301 108.477 1.00 97.06 ? 52 ASN I CA 1 ATOM 2397 C C . ASN C 3 2 ? 26.797 15.637 109.048 1.00 97.06 ? 52 ASN I C 1 ATOM 2398 O O . ASN C 3 2 ? 26.341 16.494 108.275 1.00 43.23 ? 52 ASN I O 1 ATOM 2399 C CB . ASN C 3 2 ? 28.253 13.585 109.417 1.00 43.23 ? 52 ASN I CB 1 ATOM 2400 C CG . ASN C 3 2 ? 28.252 12.077 109.217 1.00 43.23 ? 52 ASN I CG 1 ATOM 2401 O OD1 . ASN C 3 2 ? 27.696 11.335 110.019 1.00 43.23 ? 52 ASN I OD1 1 ATOM 2402 N ND2 . ASN C 3 2 ? 28.884 11.618 108.143 1.00 43.23 ? 52 ASN I ND2 1 ATOM 2403 N N . ASP C 3 3 ? 26.912 15.859 110.357 1.00 75.52 ? 53 ASP I N 1 ATOM 2404 C CA . ASP C 3 3 ? 26.435 17.133 110.871 1.00 75.52 ? 53 ASP I CA 1 ATOM 2405 C C . ASP C 3 3 ? 27.048 17.805 112.082 1.00 75.52 ? 53 ASP I C 1 ATOM 2406 O O . ASP C 3 3 ? 27.179 17.247 113.176 1.00 60.56 ? 53 ASP I O 1 ATOM 2407 C CB . ASP C 3 3 ? 24.905 17.135 111.013 1.00 60.56 ? 53 ASP I CB 1 ATOM 2408 C CG . ASP C 3 3 ? 24.318 18.551 111.064 1.00 60.56 ? 53 ASP I CG 1 ATOM 2409 O OD1 . ASP C 3 3 ? 24.690 19.408 110.234 1.00 60.56 ? 53 ASP I OD1 1 ATOM 2410 O OD2 . ASP C 3 3 ? 23.472 18.810 111.934 1.00 60.56 ? 53 ASP I OD2 1 ATOM 2411 N N . GLY C 3 4 ? 27.366 19.063 111.829 1.00 89.67 ? 54 GLY I N 1 ATOM 2412 C CA . GLY C 3 4 ? 27.908 19.982 112.804 1.00 89.67 ? 54 GLY I CA 1 ATOM 2413 C C . GLY C 3 4 ? 27.045 21.116 112.335 1.00 89.67 ? 54 GLY I C 1 ATOM 2414 O O . GLY C 3 4 ? 27.382 21.772 111.357 1.00 50.53 ? 54 GLY I O 1 ATOM 2415 N N . ASP C 3 5 ? 25.820 21.117 112.859 1.00 43.29 ? 55 ASP I N 1 ATOM 2416 C CA . ASP C 3 5 ? 24.771 22.076 112.533 1.00 43.29 ? 55 ASP I CA 1 ATOM 2417 C C . ASP C 3 5 ? 25.159 23.230 111.610 1.00 43.29 ? 55 ASP I C 1 ATOM 2418 O O . ASP C 3 5 ? 26.216 23.846 111.710 1.00 2.00 ? 55 ASP I O 1 ATOM 2419 C CB . ASP C 3 5 ? 24.060 22.583 113.806 1.00 2.00 ? 55 ASP I CB 1 ATOM 2420 C CG . ASP C 3 5 ? 23.635 21.457 114.722 1.00 2.00 ? 55 ASP I CG 1 ATOM 2421 O OD1 . ASP C 3 5 ? 23.541 20.290 114.294 1.00 2.00 ? 55 ASP I OD1 1 ATOM 2422 O OD2 . ASP C 3 5 ? 23.422 21.720 115.924 1.00 2.00 ? 55 ASP I OD2 1 ATOM 2423 N N . PHE C 3 6 ? 24.196 23.509 110.753 1.00 34.34 ? 56 PHE I N 1 ATOM 2424 C CA . PHE C 3 6 ? 24.240 24.481 109.721 1.00 34.34 ? 56 PHE I CA 1 ATOM 2425 C C . PHE C 3 6 ? 23.200 25.515 110.105 1.00 34.34 ? 56 PHE I C 1 ATOM 2426 O O . PHE C 3 6 ? 22.065 25.167 110.429 1.00 28.12 ? 56 PHE I O 1 ATOM 2427 C CB . PHE C 3 6 ? 23.862 23.783 108.431 1.00 28.12 ? 56 PHE I CB 1 ATOM 2428 C CG . PHE C 3 6 ? 24.992 23.126 107.765 1.00 28.12 ? 56 PHE I CG 1 ATOM 2429 C CD1 . PHE C 3 6 ? 25.482 21.879 108.177 1.00 28.12 ? 56 PHE I CD1 1 ATOM 2430 C CD2 . PHE C 3 6 ? 25.568 23.740 106.676 1.00 28.12 ? 56 PHE I CD2 1 ATOM 2431 C CE1 . PHE C 3 6 ? 26.535 21.276 107.493 1.00 28.12 ? 56 PHE I CE1 1 ATOM 2432 C CE2 . PHE C 3 6 ? 26.601 23.167 105.990 1.00 28.12 ? 56 PHE I CE2 1 ATOM 2433 C CZ . PHE C 3 6 ? 27.094 21.925 106.384 1.00 28.12 ? 56 PHE I CZ 1 ATOM 2434 N N . GLU C 3 7 ? 23.504 26.766 109.793 1.00 33.88 ? 57 GLU I N 1 ATOM 2435 C CA . GLU C 3 7 ? 22.634 27.891 110.128 1.00 33.88 ? 57 GLU I CA 1 ATOM 2436 C C . GLU C 3 7 ? 21.354 28.065 109.239 1.00 33.88 ? 57 GLU I C 1 ATOM 2437 O O . GLU C 3 7 ? 21.258 27.632 108.073 1.00 50.72 ? 57 GLU I O 1 ATOM 2438 C CB . GLU C 3 7 ? 23.478 29.161 110.101 1.00 50.72 ? 57 GLU I CB 1 ATOM 2439 C CG . GLU C 3 7 ? 23.157 30.166 111.175 1.00 50.72 ? 57 GLU I CG 1 ATOM 2440 C CD . GLU C 3 7 ? 23.653 31.512 110.770 1.00 50.72 ? 57 GLU I CD 1 ATOM 2441 O OE1 . GLU C 3 7 ? 23.268 31.970 109.669 1.00 50.72 ? 57 GLU I OE1 1 ATOM 2442 O OE2 . GLU C 3 7 ? 24.413 32.148 111.534 1.00 50.72 ? 57 GLU I OE2 1 ATOM 2443 N N . GLU C 3 8 ? 20.367 28.739 109.816 1.00 26.25 ? 58 GLU I N 1 ATOM 2444 C CA . GLU C 3 8 ? 19.052 28.980 109.217 1.00 26.25 ? 58 GLU I CA 1 ATOM 2445 C C . GLU C 3 8 ? 19.001 29.450 107.767 1.00 26.25 ? 58 GLU I C 1 ATOM 2446 O O . GLU C 3 8 ? 19.822 30.262 107.318 1.00 48.05 ? 58 GLU I O 1 ATOM 2447 C CB . GLU C 3 8 ? 18.299 30.009 110.047 1.00 48.05 ? 58 GLU I CB 1 ATOM 2448 C CG . GLU C 3 8 ? 18.818 31.432 109.880 1.00 48.05 ? 58 GLU I CG 1 ATOM 2449 C CD . GLU C 3 8 ? 19.240 32.067 111.156 1.00 48.05 ? 58 GLU I CD 1 ATOM 2450 O OE1 . GLU C 3 8 ? 20.363 31.767 111.623 1.00 48.05 ? 58 GLU I OE1 1 ATOM 2451 O OE2 . GLU C 3 8 ? 18.466 32.906 111.683 1.00 48.05 ? 58 GLU I OE2 1 ATOM 2452 N N . ILE C 3 9 ? 18.033 28.933 107.018 1.00 48.60 ? 59 ILE I N 1 ATOM 2453 C CA . ILE C 3 9 ? 17.793 29.288 105.615 1.00 48.60 ? 59 ILE I CA 1 ATOM 2454 C C . ILE C 3 9 ? 16.292 29.548 105.442 1.00 48.60 ? 59 ILE I C 1 ATOM 2455 O O . ILE C 3 9 ? 15.467 28.905 106.110 1.00 2.00 ? 59 ILE I O 1 ATOM 2456 C CB . ILE C 3 9 ? 18.230 28.147 104.594 1.00 2.00 ? 59 ILE I CB 1 ATOM 2457 C CG1 . ILE C 3 9 ? 17.191 27.022 104.542 1.00 2.00 ? 59 ILE I CG1 1 ATOM 2458 C CG2 . ILE C 3 9 ? 19.593 27.568 104.948 1.00 2.00 ? 59 ILE I CG2 1 ATOM 2459 C CD1 . ILE C 3 9 ? 17.392 26.041 103.445 1.00 2.00 ? 59 ILE I CD1 1 ATOM 2460 N N . PRO C 3 10 ? 15.924 30.508 104.576 1.00 74.13 ? 60 PRO I N 1 ATOM 2461 C CA . PRO C 3 10 ? 14.522 30.865 104.303 1.00 74.13 ? 60 PRO I CA 1 ATOM 2462 C C . PRO C 3 10 ? 13.664 29.651 103.899 1.00 74.13 ? 60 PRO I C 1 ATOM 2463 O O . PRO C 3 10 ? 13.657 29.239 102.738 1.00 32.38 ? 60 PRO I O 1 ATOM 2464 C CB . PRO C 3 10 ? 14.667 31.885 103.166 1.00 32.38 ? 60 PRO I CB 1 ATOM 2465 C CG . PRO C 3 10 ? 15.921 32.590 103.532 1.00 32.38 ? 60 PRO I CG 1 ATOM 2466 C CD . PRO C 3 10 ? 16.845 31.434 103.896 1.00 32.38 ? 60 PRO I CD 1 ATOM 2467 N N . GLU C 3 11 ? 12.854 29.160 104.829 1.00 25.04 ? 61 GLU I N 1 ATOM 2468 C CA . GLU C 3 11 ? 12.070 27.951 104.593 1.00 25.04 ? 61 GLU I CA 1 ATOM 2469 C C . GLU C 3 11 ? 11.018 27.772 103.496 1.00 25.04 ? 61 GLU I C 1 ATOM 2470 O O . GLU C 3 11 ? 10.173 26.885 103.614 1.00 83.78 ? 61 GLU I O 1 ATOM 2471 C CB . GLU C 3 11 ? 11.592 27.339 105.917 1.00 83.78 ? 61 GLU I CB 1 ATOM 2472 C CG . GLU C 3 11 ? 10.901 28.287 106.890 1.00 83.78 ? 61 GLU I CG 1 ATOM 2473 C CD . GLU C 3 11 ? 10.445 27.586 108.172 1.00 83.78 ? 61 GLU I CD 1 ATOM 2474 O OE1 . GLU C 3 11 ? 10.702 26.367 108.326 1.00 83.78 ? 61 GLU I OE1 1 ATOM 2475 O OE2 . GLU C 3 11 ? 9.824 28.260 109.024 1.00 83.78 ? 61 GLU I OE2 1 ATOM 2476 N N . GLU C 3 12 ? 11.063 28.568 102.425 1.00 80.67 ? 62 GLU I N 1 ATOM 2477 C CA . GLU C 3 12 ? 10.129 28.343 101.307 1.00 80.67 ? 62 GLU I CA 1 ATOM 2478 C C . GLU C 3 12 ? 10.925 27.515 100.294 1.00 80.67 ? 62 GLU I C 1 ATOM 2479 O O . GLU C 3 12 ? 10.695 27.560 99.085 1.00 60.25 ? 62 GLU I O 1 ATOM 2480 C CB . GLU C 3 12 ? 9.595 29.624 100.651 1.00 60.25 ? 62 GLU I CB 1 ATOM 2481 C CG . GLU C 3 12 ? 9.907 30.905 101.355 1.00 60.25 ? 62 GLU I CG 1 ATOM 2482 C CD . GLU C 3 12 ? 11.371 31.225 101.295 1.00 60.25 ? 62 GLU I CD 1 ATOM 2483 O OE1 . GLU C 3 12 ? 11.956 31.162 100.191 1.00 60.25 ? 62 GLU I OE1 1 ATOM 2484 O OE2 . GLU C 3 12 ? 11.935 31.513 102.364 1.00 60.25 ? 62 GLU I OE2 1 ATOM 2485 N N . TYR C 3 13 ? 11.964 26.877 100.823 1.00 47.00 ? 63 TYR I N 1 ATOM 2486 C CA . TYR C 3 13 ? 12.852 25.988 100.092 1.00 47.00 ? 63 TYR I CA 1 ATOM 2487 C C . TYR C 3 13 ? 12.455 24.630 100.665 1.00 47.00 ? 63 TYR I C 1 ATOM 2488 O O . TYR C 3 13 ? 12.426 23.617 99.965 1.00 53.78 ? 63 TYR I O 1 ATOM 2489 C CB . TYR C 3 13 ? 14.316 26.259 100.482 1.00 53.78 ? 63 TYR I CB 1 ATOM 2490 C CG . TYR C 3 13 ? 14.791 27.699 100.350 1.00 53.78 ? 63 TYR I CG 1 ATOM 2491 C CD1 . TYR C 3 13 ? 14.125 28.616 99.529 1.00 53.78 ? 63 TYR I CD1 1 ATOM 2492 C CD2 . TYR C 3 13 ? 15.920 28.143 101.042 1.00 53.78 ? 63 TYR I CD2 1 ATOM 2493 C CE1 . TYR C 3 13 ? 14.574 29.936 99.402 1.00 53.78 ? 63 TYR I CE1 1 ATOM 2494 C CE2 . TYR C 3 13 ? 16.374 29.462 100.923 1.00 53.78 ? 63 TYR I CE2 1 ATOM 2495 C CZ . TYR C 3 13 ? 15.698 30.355 100.101 1.00 53.78 ? 63 TYR I CZ 1 ATOM 2496 O OH . TYR C 3 13 ? 16.142 31.659 99.976 1.00 53.78 ? 63 TYR I OH 1 ATOM 2497 N N . LEU C 3 14 ? 12.165 24.651 101.968 1.00 78.63 ? 64 LEU I N 1 ATOM 2498 C CA . LEU C 3 14 ? 11.766 23.482 102.751 1.00 78.63 ? 64 LEU I CA 1 ATOM 2499 C C . LEU C 3 14 ? 10.271 23.172 102.662 1.00 78.63 ? 64 LEU I C 1 ATOM 2500 O O . LEU C 3 14 ? 9.838 22.056 102.962 1.00 94.18 ? 64 LEU I O 1 ATOM 2501 C CB . LEU C 3 14 ? 12.143 23.686 104.221 1.00 94.18 ? 64 LEU I CB 1 ATOM 2502 C CG . LEU C 3 14 ? 13.588 24.082 104.538 1.00 94.18 ? 64 LEU I CG 1 ATOM 2503 C CD1 . LEU C 3 14 ? 13.744 24.195 106.047 1.00 94.18 ? 64 LEU I CD1 1 ATOM 2504 C CD2 . LEU C 3 14 ? 14.576 23.067 103.968 1.00 94.18 ? 64 LEU I CD2 1 ATOM 2505 N N . GLN C 3 15 ? 9.484 24.198 102.374 1.00 46.05 ? 65 GLN I N 1 ATOM 2506 C CA . GLN C 3 15 ? 8.043 24.059 102.213 1.00 46.05 ? 65 GLN I CA 1 ATOM 2507 C C . GLN C 3 15 ? 7.652 25.035 101.101 1.00 46.05 ? 65 GLN I C 1 ATOM 2508 O O . GLN C 3 15 ? 8.382 25.022 100.082 1.00 76.09 ? 65 GLN I O 1 ATOM 2509 C CB . GLN C 3 15 ? 7.287 24.327 103.528 1.00 76.09 ? 65 GLN I CB 1 ATOM 2510 C CG . GLN C 3 15 ? 5.737 24.199 103.457 1.00 76.09 ? 65 GLN I CG 1 ATOM 2511 C CD . GLN C 3 15 ? 5.204 22.805 103.082 1.00 76.09 ? 65 GLN I CD 1 ATOM 2512 O OE1 . GLN C 3 15 ? 3.996 22.567 103.145 1.00 76.09 ? 65 GLN I OE1 1 ATOM 2513 N NE2 . GLN C 3 15 ? 6.092 21.884 102.711 1.00 76.09 ? 65 GLN I NE2 1 ATOM 2514 O OXT . GLN C 3 15 ? 6.676 25.807 101.247 1.00 76.09 ? 65 GLN I OXT 1 ATOM 2515 N N . THR D 1 14 H 77.216 1.323 59.212 1.00 97.59 ? 1 THR M N 1 ATOM 2516 C CA . THR D 1 14 H 76.173 0.297 58.927 1.00 97.59 ? 1 THR M CA 1 ATOM 2517 C C . THR D 1 14 H 75.731 -0.397 60.205 1.00 97.59 ? 1 THR M C 1 ATOM 2518 O O . THR D 1 14 H 76.372 -0.257 61.251 1.00 28.27 ? 1 THR M O 1 ATOM 2519 C CB . THR D 1 14 H 76.692 -0.799 57.954 1.00 28.27 ? 1 THR M CB 1 ATOM 2520 O OG1 . THR D 1 14 H 75.643 -1.742 57.697 1.00 28.27 ? 1 THR M OG1 1 ATOM 2521 C CG2 . THR D 1 14 H 77.890 -1.550 58.555 1.00 28.27 ? 1 THR M CG2 1 ATOM 2522 N N . PHE D 1 15 G 74.620 -1.122 60.109 1.00 77.69 ? 1 PHE M N 1 ATOM 2523 C CA . PHE D 1 15 G 74.096 -1.890 61.229 1.00 77.69 ? 1 PHE M CA 1 ATOM 2524 C C . PHE D 1 15 G 74.187 -3.369 60.890 1.00 77.69 ? 1 PHE M C 1 ATOM 2525 O O . PHE D 1 15 G 73.342 -4.178 61.276 1.00 76.54 ? 1 PHE M O 1 ATOM 2526 C CB . PHE D 1 15 G 72.670 -1.469 61.582 1.00 76.54 ? 1 PHE M CB 1 ATOM 2527 C CG . PHE D 1 15 G 72.619 -0.311 62.528 1.00 76.54 ? 1 PHE M CG 1 ATOM 2528 C CD1 . PHE D 1 15 G 72.991 -0.478 63.863 1.00 76.54 ? 1 PHE M CD1 1 ATOM 2529 C CD2 . PHE D 1 15 G 72.272 0.961 62.078 1.00 76.54 ? 1 PHE M CD2 1 ATOM 2530 C CE1 . PHE D 1 15 G 73.026 0.604 64.739 1.00 76.54 ? 1 PHE M CE1 1 ATOM 2531 C CE2 . PHE D 1 15 G 72.301 2.054 62.942 1.00 76.54 ? 1 PHE M CE2 1 ATOM 2532 C CZ . PHE D 1 15 G 72.682 1.874 64.278 1.00 76.54 ? 1 PHE M CZ 1 ATOM 2533 N N . GLY D 1 16 F 75.236 -3.695 60.139 1.00 115.90 ? 1 GLY M N 1 ATOM 2534 C CA . GLY D 1 16 F 75.498 -5.064 59.743 1.00 115.90 ? 1 GLY M CA 1 ATOM 2535 C C . GLY D 1 16 F 76.405 -5.698 60.779 1.00 115.90 ? 1 GLY M C 1 ATOM 2536 O O . GLY D 1 16 F 77.109 -6.671 60.501 1.00 55.74 ? 1 GLY M O 1 ATOM 2537 N N . ALA D 1 17 E 76.459 -5.070 61.949 1.00 76.31 ? 1 ALA M N 1 ATOM 2538 C CA . ALA D 1 17 E 77.253 -5.563 63.058 1.00 76.31 ? 1 ALA M CA 1 ATOM 2539 C C . ALA D 1 17 E 76.377 -6.607 63.750 1.00 76.31 ? 1 ALA M C 1 ATOM 2540 O O . ALA D 1 17 E 75.382 -6.274 64.398 1.00 43.12 ? 1 ALA M O 1 ATOM 2541 C CB . ALA D 1 17 E 77.597 -4.427 64.009 1.00 43.12 ? 1 ALA M CB 1 ATOM 2542 N N . GLY D 1 18 D 76.705 -7.869 63.512 1.00 46.63 ? 1 GLY M N 1 ATOM 2543 C CA . GLY D 1 18 D 75.975 -8.982 64.089 1.00 46.63 ? 1 GLY M CA 1 ATOM 2544 C C . GLY D 1 18 D 76.792 -10.203 63.751 1.00 46.63 ? 1 GLY M C 1 ATOM 2545 O O . GLY D 1 18 D 77.931 -10.068 63.305 1.00 47.43 ? 1 GLY M O 1 ATOM 2546 N N . GLU D 1 19 C 76.221 -11.391 63.893 1.00 43.23 ? 1 GLU M N 1 ATOM 2547 C CA . GLU D 1 19 C 76.977 -12.600 63.587 1.00 43.23 ? 1 GLU M CA 1 ATOM 2548 C C . GLU D 1 19 C 76.279 -13.644 62.731 1.00 43.23 ? 1 GLU M C 1 ATOM 2549 O O . GLU D 1 19 C 76.367 -14.838 63.021 1.00 49.96 ? 1 GLU M O 1 ATOM 2550 C CB . GLU D 1 19 C 77.515 -13.240 64.870 1.00 49.96 ? 1 GLU M CB 1 ATOM 2551 C CG . GLU D 1 19 C 78.957 -12.867 65.173 1.00 49.96 ? 1 GLU M CG 1 ATOM 2552 C CD . GLU D 1 19 C 79.924 -13.332 64.091 1.00 49.96 ? 1 GLU M CD 1 ATOM 2553 O OE1 . GLU D 1 19 C 79.984 -12.700 63.012 1.00 49.96 ? 1 GLU M OE1 1 ATOM 2554 O OE2 . GLU D 1 19 C 80.628 -14.337 64.326 1.00 49.96 ? 1 GLU M OE2 1 ATOM 2555 N N . ALA D 1 20 B 75.631 -13.186 61.659 1.00 20.16 ? 1 ALA M N 1 ATOM 2556 C CA . ALA D 1 20 B 74.910 -14.041 60.714 1.00 20.16 ? 1 ALA M CA 1 ATOM 2557 C C . ALA D 1 20 B 73.782 -14.824 61.369 1.00 20.16 ? 1 ALA M C 1 ATOM 2558 O O . ALA D 1 20 B 72.618 -14.642 61.024 1.00 14.20 ? 1 ALA M O 1 ATOM 2559 C CB . ALA D 1 20 B 75.874 -14.987 59.994 1.00 14.20 ? 1 ALA M CB 1 ATOM 2560 N N . ASP D 1 21 A 74.141 -15.706 62.300 1.00 23.72 ? 1 ASP M N 1 ATOM 2561 C CA . ASP D 1 21 A 73.181 -16.525 63.025 1.00 23.72 ? 1 ASP M CA 1 ATOM 2562 C C . ASP D 1 21 A 73.280 -16.380 64.541 1.00 23.72 ? 1 ASP M C 1 ATOM 2563 O O . ASP D 1 21 A 73.755 -17.268 65.244 1.00 2.00 ? 1 ASP M O 1 ATOM 2564 C CB . ASP D 1 21 A 73.281 -18.007 62.609 1.00 2.00 ? 1 ASP M CB 1 ATOM 2565 C CG . ASP D 1 21 A 74.661 -18.620 62.886 1.00 2.00 ? 1 ASP M CG 1 ATOM 2566 O OD1 . ASP D 1 21 A 75.686 -17.905 62.784 1.00 2.00 ? 1 ASP M OD1 1 ATOM 2567 O OD2 . ASP D 1 21 A 74.718 -19.830 63.211 1.00 2.00 ? 1 ASP M OD2 1 ATOM 2568 N N . CYS D 1 22 ? 72.861 -15.230 65.040 1.00 9.44 ? 1 CYS M N 1 ATOM 2569 C CA . CYS D 1 22 ? 72.851 -14.981 66.473 1.00 9.44 ? 1 CYS M CA 1 ATOM 2570 C C . CYS D 1 22 ? 71.363 -14.981 66.864 1.00 9.44 ? 1 CYS M C 1 ATOM 2571 O O . CYS D 1 22 ? 70.518 -14.492 66.106 1.00 2.00 ? 1 CYS M O 1 ATOM 2572 C CB . CYS D 1 22 ? 73.462 -13.609 66.765 1.00 2.00 ? 1 CYS M CB 1 ATOM 2573 S SG . CYS D 1 22 ? 72.565 -12.210 65.999 1.00 2.00 ? 1 CYS M SG 1 ATOM 2574 N N . GLY D 1 23 ? 71.031 -15.581 68.002 1.00 2.00 ? 2 GLY M N 1 ATOM 2575 C CA . GLY D 1 23 ? 69.644 -15.610 68.428 1.00 2.00 ? 2 GLY M CA 1 ATOM 2576 C C . GLY D 1 23 ? 68.788 -16.692 67.795 1.00 2.00 ? 2 GLY M C 1 ATOM 2577 O O . GLY D 1 23 ? 67.596 -16.783 68.085 1.00 32.22 ? 2 GLY M O 1 ATOM 2578 N N . LEU D 1 24 ? 69.372 -17.492 66.909 1.00 22.90 ? 3 LEU M N 1 ATOM 2579 C CA . LEU D 1 24 ? 68.639 -18.579 66.262 1.00 22.90 ? 3 LEU M CA 1 ATOM 2580 C C . LEU D 1 24 ? 69.114 -19.886 66.874 1.00 22.90 ? 3 LEU M C 1 ATOM 2581 O O . LEU D 1 24 ? 70.139 -20.438 66.474 1.00 2.00 ? 3 LEU M O 1 ATOM 2582 C CB . LEU D 1 24 ? 68.851 -18.555 64.747 1.00 2.00 ? 3 LEU M CB 1 ATOM 2583 C CG . LEU D 1 24 ? 68.131 -17.415 64.021 1.00 2.00 ? 3 LEU M CG 1 ATOM 2584 C CD1 . LEU D 1 24 ? 68.756 -17.197 62.676 1.00 2.00 ? 3 LEU M CD1 1 ATOM 2585 C CD2 . LEU D 1 24 ? 66.647 -17.709 63.882 1.00 2.00 ? 3 LEU M CD2 1 ATOM 2586 N N . ARG D 1 25 ? 68.418 -20.332 67.912 1.00 2.00 ? 4 ARG M N 1 ATOM 2587 C CA . ARG D 1 25 ? 68.801 -21.561 68.586 1.00 2.00 ? 4 ARG M CA 1 ATOM 2588 C C . ARG D 1 25 ? 68.573 -22.812 67.758 1.00 2.00 ? 4 ARG M C 1 ATOM 2589 O O . ARG D 1 25 ? 67.475 -23.051 67.257 1.00 24.48 ? 4 ARG M O 1 ATOM 2590 C CB . ARG D 1 25 ? 68.175 -21.684 69.988 1.00 24.48 ? 4 ARG M CB 1 ATOM 2591 C CG . ARG D 1 25 ? 66.695 -21.396 70.098 1.00 24.48 ? 4 ARG M CG 1 ATOM 2592 C CD . ARG D 1 25 ? 66.392 -20.000 70.669 1.00 24.48 ? 4 ARG M CD 1 ATOM 2593 N NE . ARG D 1 25 ? 64.944 -19.836 70.742 1.00 24.48 ? 4 ARG M NE 1 ATOM 2594 C CZ . ARG D 1 25 ? 64.200 -20.118 71.809 1.00 24.48 ? 4 ARG M CZ 1 ATOM 2595 N NH1 . ARG D 1 25 ? 64.766 -20.460 72.961 1.00 24.48 ? 4 ARG M NH1 1 ATOM 2596 N NH2 . ARG D 1 25 ? 62.886 -19.968 71.747 1.00 24.48 ? 4 ARG M NH2 1 ATOM 2597 N N . PRO D 1 26 ? 69.619 -23.628 67.604 1.00 2.00 ? 5 PRO M N 1 ATOM 2598 C CA . PRO D 1 26 ? 69.648 -24.889 66.849 1.00 2.00 ? 5 PRO M CA 1 ATOM 2599 C C . PRO D 1 26 ? 68.681 -26.011 67.277 1.00 2.00 ? 5 PRO M C 1 ATOM 2600 O O . PRO D 1 26 ? 68.500 -27.000 66.563 1.00 2.00 ? 5 PRO M O 1 ATOM 2601 C CB . PRO D 1 26 ? 71.110 -25.311 66.950 1.00 2.00 ? 5 PRO M CB 1 ATOM 2602 C CG . PRO D 1 26 ? 71.822 -24.000 67.082 1.00 2.00 ? 5 PRO M CG 1 ATOM 2603 C CD . PRO D 1 26 ? 70.966 -23.278 68.075 1.00 2.00 ? 5 PRO M CD 1 ATOM 2604 N N . LEU D 1 27 ? 68.084 -25.849 68.452 1.00 2.00 ? 6 LEU M N 1 ATOM 2605 C CA . LEU D 1 27 ? 67.122 -26.801 69.004 1.00 2.00 ? 6 LEU M CA 1 ATOM 2606 C C . LEU D 1 27 ? 65.690 -26.285 68.775 1.00 2.00 ? 6 LEU M C 1 ATOM 2607 O O . LEU D 1 27 ? 64.714 -26.960 69.099 1.00 2.00 ? 6 LEU M O 1 ATOM 2608 C CB . LEU D 1 27 ? 67.350 -26.931 70.520 1.00 2.00 ? 6 LEU M CB 1 ATOM 2609 C CG . LEU D 1 27 ? 67.961 -28.173 71.182 1.00 2.00 ? 6 LEU M CG 1 ATOM 2610 C CD1 . LEU D 1 27 ? 67.073 -29.398 70.909 1.00 2.00 ? 6 LEU M CD1 1 ATOM 2611 C CD2 . LEU D 1 27 ? 69.406 -28.383 70.727 1.00 2.00 ? 6 LEU M CD2 1 ATOM 2612 N N . PHE D 1 28 ? 65.570 -25.071 68.248 1.00 2.00 ? 7 PHE M N 1 ATOM 2613 C CA . PHE D 1 28 ? 64.261 -24.472 68.034 1.00 2.00 ? 7 PHE M CA 1 ATOM 2614 C C . PHE D 1 28 ? 64.115 -23.749 66.697 1.00 2.00 ? 7 PHE M C 1 ATOM 2615 O O . PHE D 1 28 ? 63.473 -24.250 65.782 1.00 2.00 ? 7 PHE M O 1 ATOM 2616 C CB . PHE D 1 28 ? 63.921 -23.492 69.180 1.00 2.00 ? 7 PHE M CB 1 ATOM 2617 C CG . PHE D 1 28 ? 63.713 -24.153 70.533 1.00 2.00 ? 7 PHE M CG 1 ATOM 2618 C CD1 . PHE D 1 28 ? 62.453 -24.600 70.920 1.00 2.00 ? 7 PHE M CD1 1 ATOM 2619 C CD2 . PHE D 1 28 ? 64.775 -24.316 71.422 1.00 2.00 ? 7 PHE M CD2 1 ATOM 2620 C CE1 . PHE D 1 28 ? 62.256 -25.195 72.165 1.00 2.00 ? 7 PHE M CE1 1 ATOM 2621 C CE2 . PHE D 1 28 ? 64.578 -24.914 72.672 1.00 2.00 ? 7 PHE M CE2 1 ATOM 2622 C CZ . PHE D 1 28 ? 63.320 -25.351 73.038 1.00 2.00 ? 7 PHE M CZ 1 ATOM 2623 N N . GLU D 1 29 ? 64.707 -22.564 66.598 1.00 2.00 ? 8 GLU M N 1 ATOM 2624 C CA . GLU D 1 29 ? 64.629 -21.747 65.390 1.00 2.00 ? 8 GLU M CA 1 ATOM 2625 C C . GLU D 1 29 ? 65.154 -22.520 64.194 1.00 2.00 ? 8 GLU M C 1 ATOM 2626 O O . GLU D 1 29 ? 64.455 -22.681 63.199 1.00 2.00 ? 8 GLU M O 1 ATOM 2627 C CB . GLU D 1 29 ? 65.420 -20.447 65.568 1.00 2.00 ? 8 GLU M CB 1 ATOM 2628 C CG . GLU D 1 29 ? 65.231 -19.748 66.926 1.00 2.00 ? 8 GLU M CG 1 ATOM 2629 C CD . GLU D 1 29 ? 63.807 -19.262 67.188 1.00 2.00 ? 8 GLU M CD 1 ATOM 2630 O OE1 . GLU D 1 29 ? 63.389 -18.287 66.535 1.00 2.00 ? 8 GLU M OE1 1 ATOM 2631 O OE2 . GLU D 1 29 ? 63.111 -19.830 68.065 1.00 2.00 ? 8 GLU M OE2 1 ATOM 2632 N N . LYS D 1 30 ? 66.377 -23.024 64.282 1.00 15.64 ? 9 LYS M N 1 ATOM 2633 C CA . LYS D 1 30 ? 66.903 -23.778 63.156 1.00 15.64 ? 9 LYS M CA 1 ATOM 2634 C C . LYS D 1 30 ? 66.576 -25.253 63.288 1.00 15.64 ? 9 LYS M C 1 ATOM 2635 O O . LYS D 1 30 ? 67.441 -26.129 63.186 1.00 2.00 ? 9 LYS M O 1 ATOM 2636 C CB . LYS D 1 30 ? 68.398 -23.493 62.876 1.00 2.00 ? 9 LYS M CB 1 ATOM 2637 C CG . LYS D 1 30 ? 69.282 -23.413 64.085 1.00 2.00 ? 9 LYS M CG 1 ATOM 2638 C CD . LYS D 1 30 ? 70.195 -22.209 64.034 1.00 2.00 ? 9 LYS M CD 1 ATOM 2639 C CE . LYS D 1 30 ? 71.250 -22.317 62.948 1.00 2.00 ? 9 LYS M CE 1 ATOM 2640 N NZ . LYS D 1 30 ? 72.191 -21.158 62.989 1.00 2.00 ? 9 LYS M NZ 1 ATOM 2641 N N . LYS D 1 31 ? 65.294 -25.499 63.528 1.00 29.63 ? 10 LYS M N 1 ATOM 2642 C CA . LYS D 1 31 ? 64.746 -26.843 63.655 1.00 29.63 ? 10 LYS M CA 1 ATOM 2643 C C . LYS D 1 31 ? 63.225 -26.739 63.452 1.00 29.63 ? 10 LYS M C 1 ATOM 2644 O O . LYS D 1 31 ? 62.504 -27.743 63.458 1.00 2.00 ? 10 LYS M O 1 ATOM 2645 C CB . LYS D 1 31 ? 65.112 -27.469 65.014 1.00 2.00 ? 10 LYS M CB 1 ATOM 2646 C CG . LYS D 1 31 ? 64.927 -28.960 65.013 1.00 2.00 ? 10 LYS M CG 1 ATOM 2647 C CD . LYS D 1 31 ? 65.514 -29.671 66.205 1.00 2.00 ? 10 LYS M CD 1 ATOM 2648 C CE . LYS D 1 31 ? 65.086 -31.157 66.165 1.00 2.00 ? 10 LYS M CE 1 ATOM 2649 N NZ . LYS D 1 31 ? 65.953 -32.121 66.922 1.00 2.00 ? 10 LYS M NZ 1 ATOM 2650 N N . GLN D 1 32 ? 62.771 -25.515 63.186 1.00 2.00 ? 11 GLN M N 1 ATOM 2651 C CA . GLN D 1 32 ? 61.360 -25.208 62.977 1.00 2.00 ? 11 GLN M CA 1 ATOM 2652 C C . GLN D 1 32 ? 60.494 -25.553 64.200 1.00 2.00 ? 11 GLN M C 1 ATOM 2653 O O . GLN D 1 32 ? 59.279 -25.772 64.092 1.00 64.71 ? 11 GLN M O 1 ATOM 2654 C CB . GLN D 1 32 ? 60.836 -25.904 61.712 1.00 64.71 ? 11 GLN M CB 1 ATOM 2655 C CG . GLN D 1 32 ? 61.621 -25.592 60.436 1.00 64.71 ? 11 GLN M CG 1 ATOM 2656 C CD . GLN D 1 32 ? 60.829 -25.888 59.163 1.00 64.71 ? 11 GLN M CD 1 ATOM 2657 O OE1 . GLN D 1 32 ? 59.980 -25.093 58.753 1.00 64.71 ? 11 GLN M OE1 1 ATOM 2658 N NE2 . GLN D 1 32 ? 61.105 -27.030 58.535 1.00 64.71 ? 11 GLN M NE2 1 ATOM 2659 N N . VAL D 1 33 ? 61.131 -25.590 65.365 1.00 23.60 ? 12 VAL M N 1 ATOM 2660 C CA . VAL D 1 33 ? 60.454 -25.890 66.623 1.00 23.60 ? 12 VAL M CA 1 ATOM 2661 C C . VAL D 1 33 ? 60.368 -24.592 67.437 1.00 23.60 ? 12 VAL M C 1 ATOM 2662 O O . VAL D 1 33 ? 61.250 -23.722 67.366 1.00 2.00 ? 12 VAL M O 1 ATOM 2663 C CB . VAL D 1 33 ? 61.200 -27.026 67.396 1.00 2.00 ? 12 VAL M CB 1 ATOM 2664 C CG1 . VAL D 1 33 ? 60.727 -27.131 68.826 1.00 2.00 ? 12 VAL M CG1 1 ATOM 2665 C CG2 . VAL D 1 33 ? 60.972 -28.358 66.688 1.00 2.00 ? 12 VAL M CG2 1 ATOM 2666 N N . GLN D 1 34 ? 59.237 -24.438 68.118 1.00 17.90 ? 13 GLN M N 1 ATOM 2667 C CA . GLN D 1 34 ? 58.919 -23.279 68.945 1.00 17.90 ? 13 GLN M CA 1 ATOM 2668 C C . GLN D 1 34 ? 58.949 -23.745 70.403 1.00 17.90 ? 13 GLN M C 1 ATOM 2669 O O . GLN D 1 34 ? 59.040 -24.948 70.658 1.00 10.15 ? 13 GLN M O 1 ATOM 2670 C CB . GLN D 1 34 ? 57.504 -22.830 68.592 1.00 10.15 ? 13 GLN M CB 1 ATOM 2671 C CG . GLN D 1 34 ? 57.355 -21.387 68.225 1.00 10.15 ? 13 GLN M CG 1 ATOM 2672 C CD . GLN D 1 34 ? 55.893 -20.991 68.085 1.00 10.15 ? 13 GLN M CD 1 ATOM 2673 O OE1 . GLN D 1 34 ? 55.468 -20.504 67.030 1.00 10.15 ? 13 GLN M OE1 1 ATOM 2674 N NE2 . GLN D 1 34 ? 55.112 -21.198 69.154 1.00 10.15 ? 13 GLN M NE2 1 ATOM 2675 N N . ASP D 1 35 ? 58.859 -22.826 71.365 1.00 2.00 ? 14 ASP M N 1 ATOM 2676 C CA . ASP D 1 35 ? 58.847 -23.273 72.745 1.00 2.00 ? 14 ASP M CA 1 ATOM 2677 C C . ASP D 1 35 ? 57.529 -23.086 73.490 1.00 2.00 ? 14 ASP M C 1 ATOM 2678 O O . ASP D 1 35 ? 56.645 -22.331 73.075 1.00 2.00 ? 14 ASP M O 1 ATOM 2679 C CB . ASP D 1 35 ? 60.032 -22.739 73.541 1.00 2.00 ? 14 ASP M CB 1 ATOM 2680 C CG . ASP D 1 35 ? 59.978 -21.266 73.756 1.00 2.00 ? 14 ASP M CG 1 ATOM 2681 O OD1 . ASP D 1 35 ? 60.382 -20.525 72.839 1.00 2.00 ? 14 ASP M OD1 1 ATOM 2682 O OD2 . ASP D 1 35 ? 59.567 -20.853 74.862 1.00 2.00 ? 14 ASP M OD2 1 ATOM 2683 N N . GLN D 1 36 A 57.428 -23.822 74.593 1.00 24.98 ? 14 GLN M N 1 ATOM 2684 C CA . GLN D 1 36 A 56.275 -23.876 75.490 1.00 24.98 ? 14 GLN M CA 1 ATOM 2685 C C . GLN D 1 36 A 55.894 -22.543 76.150 1.00 24.98 ? 14 GLN M C 1 ATOM 2686 O O . GLN D 1 36 A 54.842 -22.437 76.787 1.00 12.32 ? 14 GLN M O 1 ATOM 2687 C CB . GLN D 1 36 A 56.559 -24.985 76.534 1.00 12.32 ? 14 GLN M CB 1 ATOM 2688 C CG . GLN D 1 36 A 55.904 -24.866 77.907 1.00 12.32 ? 14 GLN M CG 1 ATOM 2689 C CD . GLN D 1 36 A 56.833 -25.296 79.065 1.00 12.32 ? 14 GLN M CD 1 ATOM 2690 O OE1 . GLN D 1 36 A 56.388 -25.911 80.034 1.00 12.32 ? 14 GLN M OE1 1 ATOM 2691 N NE2 . GLN D 1 36 A 58.116 -24.941 78.976 1.00 12.32 ? 14 GLN M NE2 1 ATOM 2692 N N . THR D 1 37 B 56.716 -21.516 75.947 1.00 2.00 ? 14 THR M N 1 ATOM 2693 C CA . THR D 1 37 B 56.461 -20.211 76.545 1.00 2.00 ? 14 THR M CA 1 ATOM 2694 C C . THR D 1 37 B 56.841 -19.074 75.615 1.00 2.00 ? 14 THR M C 1 ATOM 2695 O O . THR D 1 37 B 57.093 -17.957 76.063 1.00 31.82 ? 14 THR M O 1 ATOM 2696 C CB . THR D 1 37 B 57.276 -20.066 77.825 1.00 31.82 ? 14 THR M CB 1 ATOM 2697 O OG1 . THR D 1 37 B 57.843 -21.341 78.163 1.00 31.82 ? 14 THR M OG1 1 ATOM 2698 C CG2 . THR D 1 37 B 56.394 -19.557 78.961 1.00 31.82 ? 14 THR M CG2 1 ATOM 2699 N N . GLU D 1 38 C 56.833 -19.346 74.315 1.00 2.00 ? 14 GLU M N 1 ATOM 2700 C CA . GLU D 1 38 C 57.208 -18.349 73.312 1.00 2.00 ? 14 GLU M CA 1 ATOM 2701 C C . GLU D 1 38 C 56.045 -17.488 72.871 1.00 2.00 ? 14 GLU M C 1 ATOM 2702 O O . GLU D 1 38 C 56.163 -16.272 72.765 1.00 2.00 ? 14 GLU M O 1 ATOM 2703 C CB . GLU D 1 38 C 57.793 -19.028 72.083 1.00 2.00 ? 14 GLU M CB 1 ATOM 2704 C CG . GLU D 1 38 C 58.733 -18.140 71.335 1.00 2.00 ? 14 GLU M CG 1 ATOM 2705 C CD . GLU D 1 38 C 59.261 -18.777 70.087 1.00 2.00 ? 14 GLU M CD 1 ATOM 2706 O OE1 . GLU D 1 38 C 59.649 -19.963 70.123 1.00 2.00 ? 14 GLU M OE1 1 ATOM 2707 O OE2 . GLU D 1 38 C 59.296 -18.071 69.064 1.00 2.00 ? 14 GLU M OE2 1 ATOM 2708 N N . LYS D 1 39 D 54.921 -18.136 72.601 1.00 2.00 ? 14 LYS M N 1 ATOM 2709 C CA . LYS D 1 39 D 53.724 -17.449 72.161 1.00 2.00 ? 14 LYS M CA 1 ATOM 2710 C C . LYS D 1 39 D 53.396 -16.300 73.100 1.00 2.00 ? 14 LYS M C 1 ATOM 2711 O O . LYS D 1 39 D 52.905 -15.260 72.674 1.00 39.49 ? 14 LYS M O 1 ATOM 2712 C CB . LYS D 1 39 D 52.564 -18.443 72.074 1.00 39.49 ? 14 LYS M CB 1 ATOM 2713 C CG . LYS D 1 39 D 52.843 -19.602 71.116 1.00 39.49 ? 14 LYS M CG 1 ATOM 2714 C CD . LYS D 1 39 D 51.639 -20.506 70.968 1.00 39.49 ? 14 LYS M CD 1 ATOM 2715 C CE . LYS D 1 39 D 51.965 -21.733 70.125 1.00 39.49 ? 14 LYS M CE 1 ATOM 2716 N NZ . LYS D 1 39 D 50.852 -22.737 70.138 1.00 39.49 ? 14 LYS M NZ 1 ATOM 2717 N N . GLU D 1 40 E 53.767 -16.469 74.363 1.00 4.38 ? 14 GLU M N 1 ATOM 2718 C CA . GLU D 1 40 E 53.544 -15.473 75.409 1.00 4.38 ? 14 GLU M CA 1 ATOM 2719 C C . GLU D 1 40 E 54.151 -14.112 75.053 1.00 4.38 ? 14 GLU M C 1 ATOM 2720 O O . GLU D 1 40 E 53.576 -13.061 75.328 1.00 2.00 ? 14 GLU M O 1 ATOM 2721 C CB . GLU D 1 40 E 54.162 -15.995 76.700 1.00 2.00 ? 14 GLU M CB 1 ATOM 2722 C CG . GLU D 1 40 E 53.533 -15.448 77.948 1.00 2.00 ? 14 GLU M CG 1 ATOM 2723 C CD . GLU D 1 40 E 53.733 -16.373 79.116 1.00 2.00 ? 14 GLU M CD 1 ATOM 2724 O OE1 . GLU D 1 40 E 53.011 -17.393 79.182 1.00 2.00 ? 14 GLU M OE1 1 ATOM 2725 O OE2 . GLU D 1 40 E 54.617 -16.094 79.952 1.00 2.00 ? 14 GLU M OE2 1 ATOM 2726 N N . LEU D 1 41 F 55.327 -14.152 74.450 1.00 2.00 ? 14 LEU M N 1 ATOM 2727 C CA . LEU D 1 41 F 56.013 -12.946 74.038 1.00 2.00 ? 14 LEU M CA 1 ATOM 2728 C C . LEU D 1 41 F 55.350 -12.337 72.799 1.00 2.00 ? 14 LEU M C 1 ATOM 2729 O O . LEU D 1 41 F 55.035 -11.148 72.797 1.00 2.00 ? 14 LEU M O 1 ATOM 2730 C CB . LEU D 1 41 F 57.490 -13.255 73.793 1.00 2.00 ? 14 LEU M CB 1 ATOM 2731 C CG . LEU D 1 41 F 58.159 -13.835 75.047 1.00 2.00 ? 14 LEU M CG 1 ATOM 2732 C CD1 . LEU D 1 41 F 59.379 -14.625 74.697 1.00 2.00 ? 14 LEU M CD1 1 ATOM 2733 C CD2 . LEU D 1 41 F 58.496 -12.738 76.026 1.00 2.00 ? 14 LEU M CD2 1 ATOM 2734 N N . PHE D 1 42 G 55.095 -13.147 71.767 1.00 9.31 ? 14 PHE M N 1 ATOM 2735 C CA . PHE D 1 42 G 54.443 -12.662 70.541 1.00 9.31 ? 14 PHE M CA 1 ATOM 2736 C C . PHE D 1 42 G 53.026 -12.151 70.769 1.00 9.31 ? 14 PHE M C 1 ATOM 2737 O O . PHE D 1 42 G 52.561 -11.270 70.048 1.00 12.24 ? 14 PHE M O 1 ATOM 2738 C CB . PHE D 1 42 G 54.429 -13.740 69.461 1.00 12.24 ? 14 PHE M CB 1 ATOM 2739 C CG . PHE D 1 42 G 55.717 -13.841 68.687 1.00 12.24 ? 14 PHE M CG 1 ATOM 2740 C CD1 . PHE D 1 42 G 56.944 -13.934 69.348 1.00 12.24 ? 14 PHE M CD1 1 ATOM 2741 C CD2 . PHE D 1 42 G 55.704 -13.844 67.290 1.00 12.24 ? 14 PHE M CD2 1 ATOM 2742 C CE1 . PHE D 1 42 G 58.141 -14.028 68.627 1.00 12.24 ? 14 PHE M CE1 1 ATOM 2743 C CE2 . PHE D 1 42 G 56.895 -13.939 66.557 1.00 12.24 ? 14 PHE M CE2 1 ATOM 2744 C CZ . PHE D 1 42 G 58.114 -14.032 67.226 1.00 12.24 ? 14 PHE M CZ 1 ATOM 2745 N N . GLU D 1 43 H 52.334 -12.702 71.759 1.00 2.00 ? 14 GLU M N 1 ATOM 2746 C CA . GLU D 1 43 H 50.985 -12.254 72.072 1.00 2.00 ? 14 GLU M CA 1 ATOM 2747 C C . GLU D 1 43 H 51.030 -10.855 72.660 1.00 2.00 ? 14 GLU M C 1 ATOM 2748 O O . GLU D 1 43 H 50.170 -10.035 72.353 1.00 19.66 ? 14 GLU M O 1 ATOM 2749 C CB . GLU D 1 43 H 50.318 -13.189 73.081 1.00 19.66 ? 14 GLU M CB 1 ATOM 2750 C CG . GLU D 1 43 H 50.066 -14.589 72.565 1.00 19.66 ? 14 GLU M CG 1 ATOM 2751 C CD . GLU D 1 43 H 48.636 -15.054 72.758 1.00 19.66 ? 14 GLU M CD 1 ATOM 2752 O OE1 . GLU D 1 43 H 47.750 -14.199 72.975 1.00 19.66 ? 14 GLU M OE1 1 ATOM 2753 O OE2 . GLU D 1 43 H 48.396 -16.279 72.677 1.00 19.66 ? 14 GLU M OE2 1 ATOM 2754 N N . SER D 1 44 I 52.061 -10.584 73.471 1.00 32.90 ? 14 SER M N 1 ATOM 2755 C CA . SER D 1 44 I 52.246 -9.295 74.164 1.00 32.90 ? 14 SER M CA 1 ATOM 2756 C C . SER D 1 44 I 52.560 -8.087 73.292 1.00 32.90 ? 14 SER M C 1 ATOM 2757 O O . SER D 1 44 I 52.671 -6.972 73.794 1.00 15.63 ? 14 SER M O 1 ATOM 2758 C CB . SER D 1 44 I 53.287 -9.406 75.290 1.00 15.63 ? 14 SER M CB 1 ATOM 2759 O OG . SER D 1 44 I 54.617 -9.387 74.796 1.00 15.63 ? 14 SER M OG 1 ATOM 2760 N N . TYR D 1 45 J 52.751 -8.313 72.001 1.00 14.41 ? 14 TYR M N 1 ATOM 2761 C CA . TYR D 1 45 J 53.003 -7.220 71.073 1.00 14.41 ? 14 TYR M CA 1 ATOM 2762 C C . TYR D 1 45 J 51.629 -6.773 70.556 1.00 14.41 ? 14 TYR M C 1 ATOM 2763 O O . TYR D 1 45 J 51.463 -5.670 70.040 1.00 2.00 ? 14 TYR M O 1 ATOM 2764 C CB . TYR D 1 45 J 53.880 -7.701 69.903 1.00 2.00 ? 14 TYR M CB 1 ATOM 2765 C CG . TYR D 1 45 J 55.273 -8.096 70.309 1.00 2.00 ? 14 TYR M CG 1 ATOM 2766 C CD1 . TYR D 1 45 J 56.247 -7.134 70.550 1.00 2.00 ? 14 TYR M CD1 1 ATOM 2767 C CD2 . TYR D 1 45 J 55.606 -9.419 70.495 1.00 2.00 ? 14 TYR M CD2 1 ATOM 2768 C CE1 . TYR D 1 45 J 57.528 -7.485 70.977 1.00 2.00 ? 14 TYR M CE1 1 ATOM 2769 C CE2 . TYR D 1 45 J 56.879 -9.782 70.923 1.00 2.00 ? 14 TYR M CE2 1 ATOM 2770 C CZ . TYR D 1 45 J 57.837 -8.809 71.167 1.00 2.00 ? 14 TYR M CZ 1 ATOM 2771 O OH . TYR D 1 45 J 59.085 -9.165 71.630 1.00 2.00 ? 14 TYR M OH 1 ATOM 2772 N N . ILE D 1 46 K 50.654 -7.660 70.718 1.00 2.00 ? 14 ILE M N 1 ATOM 2773 C CA . ILE D 1 46 K 49.284 -7.459 70.274 1.00 2.00 ? 14 ILE M CA 1 ATOM 2774 C C . ILE D 1 46 K 48.424 -6.657 71.257 1.00 2.00 ? 14 ILE M C 1 ATOM 2775 O O . ILE D 1 46 K 47.535 -5.895 70.853 1.00 2.07 ? 14 ILE M O 1 ATOM 2776 C CB . ILE D 1 46 K 48.648 -8.846 69.984 1.00 2.07 ? 14 ILE M CB 1 ATOM 2777 C CG1 . ILE D 1 46 K 48.755 -9.175 68.495 1.00 2.07 ? 14 ILE M CG1 1 ATOM 2778 C CG2 . ILE D 1 46 K 47.214 -8.922 70.478 1.00 2.07 ? 14 ILE M CG2 1 ATOM 2779 C CD1 . ILE D 1 46 K 50.141 -9.067 67.947 1.00 2.07 ? 14 ILE M CD1 1 ATOM 2780 N N . GLU D 1 47 L 48.660 -6.872 72.545 1.00 31.83 ? 14 GLU M N 1 ATOM 2781 C CA . GLU D 1 47 L 47.908 -6.188 73.585 1.00 31.83 ? 14 GLU M CA 1 ATOM 2782 C C . GLU D 1 47 L 48.439 -4.777 73.826 1.00 31.83 ? 14 GLU M C 1 ATOM 2783 O O . GLU D 1 47 L 49.134 -4.213 72.983 1.00 106.84 ? 14 GLU M O 1 ATOM 2784 C CB . GLU D 1 47 L 47.939 -7.013 74.876 1.00 106.84 ? 14 GLU M CB 1 ATOM 2785 C CG . GLU D 1 47 L 49.343 -7.397 75.328 1.00 106.84 ? 14 GLU M CG 1 ATOM 2786 C CD . GLU D 1 47 L 49.355 -8.292 76.553 1.00 106.84 ? 14 GLU M CD 1 ATOM 2787 O OE1 . GLU D 1 47 L 48.791 -9.409 76.489 1.00 106.84 ? 14 GLU M OE1 1 ATOM 2788 O OE2 . GLU D 1 47 L 49.945 -7.880 77.575 1.00 106.84 ? 14 GLU M OE2 1 ATOM 2789 N N . GLY D 1 48 M 48.099 -4.206 74.977 1.00 114.86 ? 14 GLY M N 1 ATOM 2790 C CA . GLY D 1 48 M 48.552 -2.864 75.305 1.00 114.86 ? 14 GLY M CA 1 ATOM 2791 C C . GLY D 1 48 M 48.378 -2.535 76.776 1.00 114.86 ? 14 GLY M C 1 ATOM 2792 O O . GLY D 1 48 M 48.232 -1.365 77.148 1.00 107.72 ? 14 GLY M O 1 ATOM 2793 N N . ARG D 1 49 ? 48.376 -3.575 77.603 1.00 33.97 ? 15 ARG M N 1 ATOM 2794 C CA . ARG D 1 49 ? 48.225 -3.446 79.048 1.00 33.97 ? 15 ARG M CA 1 ATOM 2795 C C . ARG D 1 49 ? 48.510 -4.824 79.622 1.00 33.97 ? 15 ARG M C 1 ATOM 2796 O O . ARG D 1 49 ? 49.164 -4.899 80.682 1.00 83.28 ? 15 ARG M O 1 ATOM 2797 C CB . ARG D 1 49 ? 46.795 -3.023 79.404 1.00 83.28 ? 15 ARG M CB 1 ATOM 2798 C CG . ARG D 1 49 ? 46.619 -2.407 80.796 1.00 83.28 ? 15 ARG M CG 1 ATOM 2799 C CD . ARG D 1 49 ? 45.147 -2.064 81.047 1.00 83.28 ? 15 ARG M CD 1 ATOM 2800 N NE . ARG D 1 49 ? 44.945 -1.212 82.220 1.00 83.28 ? 15 ARG M NE 1 ATOM 2801 C CZ . ARG D 1 49 ? 43.812 -1.143 82.916 1.00 83.28 ? 15 ARG M CZ 1 ATOM 2802 N NH1 . ARG D 1 49 ? 42.770 -1.894 82.577 1.00 83.28 ? 15 ARG M NH1 1 ATOM 2803 N NH2 . ARG D 1 49 ? 43.725 -0.332 83.967 1.00 83.28 ? 15 ARG M NH2 1 ATOM 2804 O OXT . ARG D 1 49 ? 48.098 -5.811 78.973 1.00 83.28 ? 15 ARG M OXT 1 ATOM 2805 N N . ILE E 4 1 ? 64.842 -18.050 90.125 1.00 39.60 ? 16 ILE F N 1 ATOM 2806 C CA . ILE E 4 1 ? 63.725 -17.224 89.583 1.00 39.60 ? 16 ILE F CA 1 ATOM 2807 C C . ILE E 4 1 ? 62.403 -17.490 90.329 1.00 39.60 ? 16 ILE F C 1 ATOM 2808 O O . ILE E 4 1 ? 62.073 -18.629 90.665 1.00 2.00 ? 16 ILE F O 1 ATOM 2809 C CB . ILE E 4 1 ? 63.609 -17.416 88.045 1.00 2.00 ? 16 ILE F CB 1 ATOM 2810 C CG1 . ILE E 4 1 ? 64.034 -16.130 87.347 1.00 2.00 ? 16 ILE F CG1 1 ATOM 2811 C CG2 . ILE E 4 1 ? 62.229 -17.821 87.633 1.00 2.00 ? 16 ILE F CG2 1 ATOM 2812 C CD1 . ILE E 4 1 ? 64.204 -16.271 85.862 1.00 2.00 ? 16 ILE F CD1 1 ATOM 2813 N N . VAL E 4 2 ? 61.688 -16.422 90.642 1.00 2.00 ? 17 VAL F N 1 ATOM 2814 C CA . VAL E 4 2 ? 60.439 -16.536 91.358 1.00 2.00 ? 17 VAL F CA 1 ATOM 2815 C C . VAL E 4 2 ? 59.335 -16.766 90.351 1.00 2.00 ? 17 VAL F C 1 ATOM 2816 O O . VAL E 4 2 ? 59.290 -16.093 89.333 1.00 2.00 ? 17 VAL F O 1 ATOM 2817 C CB . VAL E 4 2 ? 60.118 -15.243 92.114 1.00 2.00 ? 17 VAL F CB 1 ATOM 2818 C CG1 . VAL E 4 2 ? 59.272 -15.558 93.324 1.00 2.00 ? 17 VAL F CG1 1 ATOM 2819 C CG2 . VAL E 4 2 ? 61.387 -14.519 92.519 1.00 2.00 ? 17 VAL F CG2 1 ATOM 2820 N N . GLU E 4 3 ? 58.463 -17.729 90.632 1.00 2.00 ? 18 GLU F N 1 ATOM 2821 C CA . GLU E 4 3 ? 57.318 -18.060 89.771 1.00 2.00 ? 18 GLU F CA 1 ATOM 2822 C C . GLU E 4 3 ? 57.622 -18.383 88.301 1.00 2.00 ? 18 GLU F C 1 ATOM 2823 O O . GLU E 4 3 ? 56.951 -17.870 87.395 1.00 38.85 ? 18 GLU F O 1 ATOM 2824 C CB . GLU E 4 3 ? 56.278 -16.936 89.823 1.00 38.85 ? 18 GLU F CB 1 ATOM 2825 C CG . GLU E 4 3 ? 55.838 -16.544 91.215 1.00 38.85 ? 18 GLU F CG 1 ATOM 2826 C CD . GLU E 4 3 ? 54.929 -17.561 91.860 1.00 38.85 ? 18 GLU F CD 1 ATOM 2827 O OE1 . GLU E 4 3 ? 54.970 -18.755 91.483 1.00 38.85 ? 18 GLU F OE1 1 ATOM 2828 O OE2 . GLU E 4 3 ? 54.163 -17.154 92.758 1.00 38.85 ? 18 GLU F OE2 1 ATOM 2829 N N . GLY E 4 4 ? 58.565 -19.286 88.059 1.00 28.09 ? 19 GLY F N 1 ATOM 2830 C CA . GLY E 4 4 ? 58.898 -19.602 86.684 1.00 28.09 ? 19 GLY F CA 1 ATOM 2831 C C . GLY E 4 4 ? 59.047 -21.075 86.398 1.00 28.09 ? 19 GLY F C 1 ATOM 2832 O O . GLY E 4 4 ? 59.620 -21.808 87.206 1.00 44.30 ? 19 GLY F O 1 ATOM 2833 N N . GLN E 4 5 ? 58.558 -21.497 85.231 1.00 25.54 ? 20 GLN F N 1 ATOM 2834 C CA . GLN E 4 5 ? 58.599 -22.895 84.806 1.00 25.54 ? 20 GLN F CA 1 ATOM 2835 C C . GLN E 4 5 ? 59.956 -23.390 84.324 1.00 25.54 ? 20 GLN F C 1 ATOM 2836 O O . GLN E 4 5 ? 60.826 -22.600 83.957 1.00 20.69 ? 20 GLN F O 1 ATOM 2837 C CB . GLN E 4 5 ? 57.510 -23.179 83.756 1.00 20.69 ? 20 GLN F CB 1 ATOM 2838 C CG . GLN E 4 5 ? 57.585 -22.379 82.446 1.00 20.69 ? 20 GLN F CG 1 ATOM 2839 C CD . GLN E 4 5 ? 56.225 -22.277 81.734 1.00 20.69 ? 20 GLN F CD 1 ATOM 2840 O OE1 . GLN E 4 5 ? 55.865 -21.223 81.205 1.00 20.69 ? 20 GLN F OE1 1 ATOM 2841 N NE2 . GLN E 4 5 ? 55.462 -23.365 81.742 1.00 20.69 ? 20 GLN F NE2 1 ATOM 2842 N N . ASP E 4 6 ? 60.132 -24.708 84.364 1.00 28.70 ? 21 ASP F N 1 ATOM 2843 C CA . ASP E 4 6 ? 61.372 -25.364 83.941 1.00 28.70 ? 21 ASP F CA 1 ATOM 2844 C C . ASP E 4 6 ? 61.763 -25.032 82.518 1.00 28.70 ? 21 ASP F C 1 ATOM 2845 O O . ASP E 4 6 ? 60.949 -25.147 81.600 1.00 40.33 ? 21 ASP F O 1 ATOM 2846 C CB . ASP E 4 6 ? 61.245 -26.889 84.037 1.00 40.33 ? 21 ASP F CB 1 ATOM 2847 C CG . ASP E 4 6 ? 61.159 -27.381 85.457 1.00 40.33 ? 21 ASP F CG 1 ATOM 2848 O OD1 . ASP E 4 6 ? 62.185 -27.331 86.165 1.00 40.33 ? 21 ASP F OD1 1 ATOM 2849 O OD2 . ASP E 4 6 ? 60.068 -27.830 85.860 1.00 40.33 ? 21 ASP F OD2 1 ATOM 2850 N N . ALA E 4 7 ? 63.009 -24.631 82.329 1.00 2.00 ? 22 ALA F N 1 ATOM 2851 C CA . ALA E 4 7 ? 63.476 -24.316 80.995 1.00 2.00 ? 22 ALA F CA 1 ATOM 2852 C C . ALA E 4 7 ? 63.576 -25.635 80.243 1.00 2.00 ? 22 ALA F C 1 ATOM 2853 O O . ALA E 4 7 ? 63.841 -26.695 80.827 1.00 2.00 ? 22 ALA F O 1 ATOM 2854 C CB . ALA E 4 7 ? 64.843 -23.616 81.044 1.00 2.00 ? 22 ALA F CB 1 ATOM 2855 N N . GLU E 4 8 ? 63.311 -25.570 78.949 1.00 13.32 ? 23 GLU F N 1 ATOM 2856 C CA . GLU E 4 8 ? 63.385 -26.746 78.106 1.00 13.32 ? 23 GLU F CA 1 ATOM 2857 C C . GLU E 4 8 ? 64.847 -27.051 77.814 1.00 13.32 ? 23 GLU F C 1 ATOM 2858 O O . GLU E 4 8 ? 65.740 -26.246 78.105 1.00 2.00 ? 23 GLU F O 1 ATOM 2859 C CB . GLU E 4 8 ? 62.598 -26.506 76.809 1.00 2.00 ? 23 GLU F CB 1 ATOM 2860 C CG . GLU E 4 8 ? 61.089 -26.462 77.021 1.00 2.00 ? 23 GLU F CG 1 ATOM 2861 C CD . GLU E 4 8 ? 60.393 -25.442 76.147 1.00 2.00 ? 23 GLU F CD 1 ATOM 2862 O OE1 . GLU E 4 8 ? 60.297 -24.278 76.582 1.00 2.00 ? 23 GLU F OE1 1 ATOM 2863 O OE2 . GLU E 4 8 ? 59.923 -25.802 75.042 1.00 2.00 ? 23 GLU F OE2 1 ATOM 2864 N N . VAL E 4 9 ? 65.099 -28.251 77.318 1.00 2.00 ? 24 VAL F N 1 ATOM 2865 C CA . VAL E 4 9 ? 66.448 -28.648 76.959 1.00 2.00 ? 24 VAL F CA 1 ATOM 2866 C C . VAL E 4 9 ? 66.780 -27.753 75.767 1.00 2.00 ? 24 VAL F C 1 ATOM 2867 O O . VAL E 4 9 ? 66.033 -27.736 74.784 1.00 18.75 ? 24 VAL F O 1 ATOM 2868 C CB . VAL E 4 9 ? 66.460 -30.127 76.524 1.00 18.75 ? 24 VAL F CB 1 ATOM 2869 C CG1 . VAL E 4 9 ? 67.881 -30.601 76.248 1.00 18.75 ? 24 VAL F CG1 1 ATOM 2870 C CG2 . VAL E 4 9 ? 65.787 -30.986 77.584 1.00 18.75 ? 24 VAL F CG2 1 ATOM 2871 N N . GLY E 4 10 ? 67.827 -26.942 75.895 1.00 2.00 ? 25 GLY F N 1 ATOM 2872 C CA . GLY E 4 10 ? 68.213 -26.064 74.803 1.00 2.00 ? 25 GLY F CA 1 ATOM 2873 C C . GLY E 4 10 ? 67.318 -24.849 74.585 1.00 2.00 ? 25 GLY F C 1 ATOM 2874 O O . GLY E 4 10 ? 67.365 -24.231 73.510 1.00 36.01 ? 25 GLY F O 1 ATOM 2875 N N . LEU E 4 11 ? 66.524 -24.494 75.597 1.00 20.11 ? 26 LEU F N 1 ATOM 2876 C CA . LEU E 4 11 ? 65.632 -23.322 75.538 1.00 20.11 ? 26 LEU F CA 1 ATOM 2877 C C . LEU E 4 11 ? 66.397 -21.988 75.623 1.00 20.11 ? 26 LEU F C 1 ATOM 2878 O O . LEU E 4 11 ? 65.857 -20.909 75.332 1.00 2.00 ? 26 LEU F O 1 ATOM 2879 C CB . LEU E 4 11 ? 64.619 -23.373 76.686 1.00 2.00 ? 26 LEU F CB 1 ATOM 2880 C CG . LEU E 4 11 ? 63.582 -22.250 76.695 1.00 2.00 ? 26 LEU F CG 1 ATOM 2881 C CD1 . LEU E 4 11 ? 62.736 -22.383 75.444 1.00 2.00 ? 26 LEU F CD1 1 ATOM 2882 C CD2 . LEU E 4 11 ? 62.720 -22.288 77.948 1.00 2.00 ? 26 LEU F CD2 1 ATOM 2883 N N . SER E 4 12 ? 67.645 -22.066 76.070 1.00 2.00 ? 27 SER F N 1 ATOM 2884 C CA . SER E 4 12 ? 68.490 -20.897 76.191 1.00 2.00 ? 27 SER F CA 1 ATOM 2885 C C . SER E 4 12 ? 69.917 -21.388 76.010 1.00 2.00 ? 27 SER F C 1 ATOM 2886 O O . SER E 4 12 ? 70.419 -22.118 76.857 1.00 17.03 ? 27 SER F O 1 ATOM 2887 C CB . SER E 4 12 ? 68.304 -20.276 77.573 1.00 17.03 ? 27 SER F CB 1 ATOM 2888 O OG . SER E 4 12 ? 66.923 -20.161 77.873 1.00 17.03 ? 27 SER F OG 1 ATOM 2889 N N . PRO E 4 13 ? 70.512 -21.135 74.828 1.00 2.00 ? 28 PRO F N 1 ATOM 2890 C CA . PRO E 4 13 ? 71.874 -21.500 74.409 1.00 2.00 ? 28 PRO F CA 1 ATOM 2891 C C . PRO E 4 13 ? 72.998 -20.582 74.899 1.00 2.00 ? 28 PRO F C 1 ATOM 2892 O O . PRO E 4 13 ? 74.131 -21.025 75.067 1.00 17.39 ? 28 PRO F O 1 ATOM 2893 C CB . PRO E 4 13 ? 71.785 -21.459 72.889 1.00 17.39 ? 28 PRO F CB 1 ATOM 2894 C CG . PRO E 4 13 ? 70.353 -21.766 72.631 1.00 17.39 ? 28 PRO F CG 1 ATOM 2895 C CD . PRO E 4 13 ? 69.681 -20.897 73.636 1.00 17.39 ? 28 PRO F CD 1 ATOM 2896 N N . TRP E 4 14 ? 72.691 -19.308 75.111 1.00 23.80 ? 29 TRP F N 1 ATOM 2897 C CA . TRP E 4 14 ? 73.699 -18.337 75.570 1.00 23.80 ? 29 TRP F CA 1 ATOM 2898 C C . TRP E 4 14 ? 73.981 -18.326 77.071 1.00 23.80 ? 29 TRP F C 1 ATOM 2899 O O . TRP E 4 14 ? 74.915 -17.663 77.544 1.00 2.00 ? 29 TRP F O 1 ATOM 2900 C CB . TRP E 4 14 ? 73.321 -16.931 75.128 1.00 2.00 ? 29 TRP F CB 1 ATOM 2901 C CG . TRP E 4 14 ? 71.859 -16.739 75.021 1.00 2.00 ? 29 TRP F CG 1 ATOM 2902 C CD1 . TRP E 4 14 ? 71.048 -16.149 75.929 1.00 2.00 ? 29 TRP F CD1 1 ATOM 2903 C CD2 . TRP E 4 14 ? 71.032 -17.091 73.901 1.00 2.00 ? 29 TRP F CD2 1 ATOM 2904 N NE1 . TRP E 4 14 ? 69.763 -16.090 75.445 1.00 2.00 ? 29 TRP F NE1 1 ATOM 2905 C CE2 . TRP E 4 14 ? 69.727 -16.662 74.201 1.00 2.00 ? 29 TRP F CE2 1 ATOM 2906 C CE3 . TRP E 4 14 ? 71.269 -17.727 72.677 1.00 2.00 ? 29 TRP F CE3 1 ATOM 2907 C CZ2 . TRP E 4 14 ? 68.661 -16.842 73.318 1.00 2.00 ? 29 TRP F CZ2 1 ATOM 2908 C CZ3 . TRP E 4 14 ? 70.216 -17.909 71.805 1.00 2.00 ? 29 TRP F CZ3 1 ATOM 2909 C CH2 . TRP E 4 14 ? 68.926 -17.468 72.129 1.00 2.00 ? 29 TRP F CH2 1 ATOM 2910 N N . GLN E 4 15 ? 73.137 -19.041 77.804 1.00 48.20 ? 30 GLN F N 1 ATOM 2911 C CA . GLN E 4 15 ? 73.216 -19.156 79.249 1.00 48.20 ? 30 GLN F CA 1 ATOM 2912 C C . GLN E 4 15 ? 74.603 -19.565 79.741 1.00 48.20 ? 30 GLN F C 1 ATOM 2913 O O . GLN E 4 15 ? 75.110 -20.639 79.398 1.00 2.00 ? 30 GLN F O 1 ATOM 2914 C CB . GLN E 4 15 ? 72.183 -20.181 79.726 1.00 2.00 ? 30 GLN F CB 1 ATOM 2915 C CG . GLN E 4 15 ? 71.778 -20.030 81.171 1.00 2.00 ? 30 GLN F CG 1 ATOM 2916 C CD . GLN E 4 15 ? 71.092 -18.708 81.447 1.00 2.00 ? 30 GLN F CD 1 ATOM 2917 O OE1 . GLN E 4 15 ? 70.625 -18.031 80.539 1.00 2.00 ? 30 GLN F OE1 1 ATOM 2918 N NE2 . GLN E 4 15 ? 71.029 -18.336 82.708 1.00 2.00 ? 30 GLN F NE2 1 ATOM 2919 N N . VAL E 4 16 ? 75.198 -18.692 80.548 1.00 44.68 ? 31 VAL F N 1 ATOM 2920 C CA . VAL E 4 16 ? 76.510 -18.904 81.149 1.00 44.68 ? 31 VAL F CA 1 ATOM 2921 C C . VAL E 4 16 ? 76.317 -18.809 82.655 1.00 44.68 ? 31 VAL F C 1 ATOM 2922 O O . VAL E 4 16 ? 75.415 -18.117 83.130 1.00 2.00 ? 31 VAL F O 1 ATOM 2923 C CB . VAL E 4 16 ? 77.503 -17.808 80.723 1.00 2.00 ? 31 VAL F CB 1 ATOM 2924 C CG1 . VAL E 4 16 ? 78.824 -17.972 81.440 1.00 2.00 ? 31 VAL F CG1 1 ATOM 2925 C CG2 . VAL E 4 16 ? 77.689 -17.829 79.223 1.00 2.00 ? 31 VAL F CG2 1 ATOM 2926 N N . MET E 4 17 ? 77.157 -19.516 83.398 1.00 42.82 ? 32 MET F N 1 ATOM 2927 C CA . MET E 4 17 ? 77.104 -19.519 84.855 1.00 42.82 ? 32 MET F CA 1 ATOM 2928 C C . MET E 4 17 ? 78.491 -19.151 85.362 1.00 42.82 ? 32 MET F C 1 ATOM 2929 O O . MET E 4 17 ? 79.452 -19.861 85.066 1.00 62.15 ? 32 MET F O 1 ATOM 2930 C CB . MET E 4 17 ? 76.733 -20.927 85.353 1.00 62.15 ? 32 MET F CB 1 ATOM 2931 C CG . MET E 4 17 ? 76.976 -21.184 86.845 1.00 62.15 ? 32 MET F CG 1 ATOM 2932 S SD . MET E 4 17 ? 76.855 -22.949 87.310 1.00 62.15 ? 32 MET F SD 1 ATOM 2933 C CE . MET E 4 17 ? 75.082 -23.147 87.642 1.00 62.15 ? 32 MET F CE 1 ATOM 2934 N N . LEU E 4 18 ? 78.625 -18.000 86.016 1.00 7.55 ? 33 LEU F N 1 ATOM 2935 C CA . LEU E 4 18 ? 79.917 -17.613 86.570 1.00 7.55 ? 33 LEU F CA 1 ATOM 2936 C C . LEU E 4 18 ? 80.065 -18.459 87.817 1.00 7.55 ? 33 LEU F C 1 ATOM 2937 O O . LEU E 4 18 ? 79.421 -18.206 88.838 1.00 15.89 ? 33 LEU F O 1 ATOM 2938 C CB . LEU E 4 18 ? 79.968 -16.134 86.951 1.00 15.89 ? 33 LEU F CB 1 ATOM 2939 C CG . LEU E 4 18 ? 79.907 -15.050 85.880 1.00 15.89 ? 33 LEU F CG 1 ATOM 2940 C CD1 . LEU E 4 18 ? 80.552 -13.793 86.456 1.00 15.89 ? 33 LEU F CD1 1 ATOM 2941 C CD2 . LEU E 4 18 ? 80.639 -15.495 84.632 1.00 15.89 ? 33 LEU F CD2 1 ATOM 2942 N N . PHE E 4 19 ? 80.868 -19.504 87.711 1.00 33.29 ? 34 PHE F N 1 ATOM 2943 C CA . PHE E 4 19 ? 81.072 -20.407 88.820 1.00 33.29 ? 34 PHE F CA 1 ATOM 2944 C C . PHE E 4 19 ? 82.370 -20.099 89.550 1.00 33.29 ? 34 PHE F C 1 ATOM 2945 O O . PHE E 4 19 ? 83.438 -20.005 88.930 1.00 2.00 ? 34 PHE F O 1 ATOM 2946 C CB . PHE E 4 19 ? 81.082 -21.842 88.315 1.00 2.00 ? 34 PHE F CB 1 ATOM 2947 C CG . PHE E 4 19 ? 80.781 -22.834 89.369 1.00 2.00 ? 34 PHE F CG 1 ATOM 2948 C CD1 . PHE E 4 19 ? 79.479 -22.983 89.833 1.00 2.00 ? 34 PHE F CD1 1 ATOM 2949 C CD2 . PHE E 4 19 ? 81.795 -23.597 89.931 1.00 2.00 ? 34 PHE F CD2 1 ATOM 2950 C CE1 . PHE E 4 19 ? 79.183 -23.878 90.849 1.00 2.00 ? 34 PHE F CE1 1 ATOM 2951 C CE2 . PHE E 4 19 ? 81.519 -24.498 90.948 1.00 2.00 ? 34 PHE F CE2 1 ATOM 2952 C CZ . PHE E 4 19 ? 80.208 -24.642 91.414 1.00 2.00 ? 34 PHE F CZ 1 ATOM 2953 N N . ARG E 4 20 ? 82.282 -19.904 90.862 1.00 70.47 ? 35 ARG F N 1 ATOM 2954 C CA . ARG E 4 20 ? 83.485 -19.624 91.623 1.00 70.47 ? 35 ARG F CA 1 ATOM 2955 C C . ARG E 4 20 ? 84.244 -20.906 91.947 1.00 70.47 ? 35 ARG F C 1 ATOM 2956 O O . ARG E 4 20 ? 83.661 -21.917 92.362 1.00 54.23 ? 35 ARG F O 1 ATOM 2957 C CB . ARG E 4 20 ? 83.205 -18.768 92.871 1.00 54.23 ? 35 ARG F CB 1 ATOM 2958 C CG . ARG E 4 20 ? 82.415 -19.433 93.960 1.00 54.23 ? 35 ARG F CG 1 ATOM 2959 C CD . ARG E 4 20 ? 82.851 -18.933 95.325 1.00 54.23 ? 35 ARG F CD 1 ATOM 2960 N NE . ARG E 4 20 ? 82.126 -17.757 95.787 1.00 54.23 ? 35 ARG F NE 1 ATOM 2961 C CZ . ARG E 4 20 ? 82.643 -16.832 96.591 1.00 54.23 ? 35 ARG F CZ 1 ATOM 2962 N NH1 . ARG E 4 20 ? 83.913 -16.917 96.975 1.00 54.23 ? 35 ARG F NH1 1 ATOM 2963 N NH2 . ARG E 4 20 ? 81.905 -15.797 96.979 1.00 54.23 ? 35 ARG F NH2 1 ATOM 2964 N N . LYS E 4 21 ? 85.533 -20.859 91.621 1.00 93.56 ? 36 LYS F N 1 ATOM 2965 C CA . LYS E 4 21 ? 86.494 -21.939 91.811 1.00 93.56 ? 36 LYS F CA 1 ATOM 2966 C C . LYS E 4 21 ? 86.433 -22.502 93.225 1.00 93.56 ? 36 LYS F C 1 ATOM 2967 O O . LYS E 4 21 ? 85.801 -23.531 93.469 1.00 28.70 ? 36 LYS F O 1 ATOM 2968 C CB . LYS E 4 21 ? 87.883 -21.369 91.554 1.00 28.70 ? 36 LYS F CB 1 ATOM 2969 C CG . LYS E 4 21 ? 88.748 -22.194 90.667 1.00 28.70 ? 36 LYS F CG 1 ATOM 2970 C CD . LYS E 4 21 ? 89.829 -21.322 90.080 1.00 28.70 ? 36 LYS F CD 1 ATOM 2971 C CE . LYS E 4 21 ? 89.209 -20.198 89.263 1.00 28.70 ? 36 LYS F CE 1 ATOM 2972 N NZ . LYS E 4 21 ? 90.223 -19.426 88.487 1.00 28.70 ? 36 LYS F NZ 1 ATOM 2973 N N . SER E 4 22 A 87.110 -21.821 94.145 1.00 46.06 ? 36 SER F N 1 ATOM 2974 C CA . SER E 4 22 A 87.153 -22.232 95.539 1.00 46.06 ? 36 SER F CA 1 ATOM 2975 C C . SER E 4 22 A 86.673 -21.070 96.404 1.00 46.06 ? 36 SER F C 1 ATOM 2976 O O . SER E 4 22 A 87.182 -19.949 96.294 1.00 62.95 ? 36 SER F O 1 ATOM 2977 C CB . SER E 4 22 A 88.583 -22.628 95.937 1.00 62.95 ? 36 SER F CB 1 ATOM 2978 O OG . SER E 4 22 A 88.617 -23.284 97.196 1.00 62.95 ? 36 SER F OG 1 ATOM 2979 N N . PRO E 4 23 ? 85.589 -21.291 97.164 1.00 34.38 ? 37 PRO F N 1 ATOM 2980 C CA . PRO E 4 23 ? 84.914 -22.591 97.148 1.00 34.38 ? 37 PRO F CA 1 ATOM 2981 C C . PRO E 4 23 ? 84.056 -22.680 95.875 1.00 34.38 ? 37 PRO F C 1 ATOM 2982 O O . PRO E 4 23 ? 83.761 -21.667 95.252 1.00 18.61 ? 37 PRO F O 1 ATOM 2983 C CB . PRO E 4 23 ? 84.054 -22.530 98.410 1.00 18.61 ? 37 PRO F CB 1 ATOM 2984 C CG . PRO E 4 23 ? 83.672 -21.073 98.478 1.00 18.61 ? 37 PRO F CG 1 ATOM 2985 C CD . PRO E 4 23 ? 84.981 -20.387 98.160 1.00 18.61 ? 37 PRO F CD 1 ATOM 2986 N N . GLN E 4 24 ? 83.728 -23.887 95.443 1.00 2.00 ? 38 GLN F N 1 ATOM 2987 C CA . GLN E 4 24 ? 82.892 -24.050 94.266 1.00 2.00 ? 38 GLN F CA 1 ATOM 2988 C C . GLN E 4 24 ? 81.494 -23.501 94.607 1.00 2.00 ? 38 GLN F C 1 ATOM 2989 O O . GLN E 4 24 ? 80.824 -24.016 95.512 1.00 59.05 ? 38 GLN F O 1 ATOM 2990 C CB . GLN E 4 24 ? 82.852 -25.533 93.862 1.00 59.05 ? 38 GLN F CB 1 ATOM 2991 C CG . GLN E 4 24 ? 82.216 -26.507 94.880 1.00 59.05 ? 38 GLN F CG 1 ATOM 2992 C CD . GLN E 4 24 ? 82.919 -26.550 96.241 1.00 59.05 ? 38 GLN F CD 1 ATOM 2993 O OE1 . GLN E 4 24 ? 84.144 -26.457 96.329 1.00 59.05 ? 38 GLN F OE1 1 ATOM 2994 N NE2 . GLN E 4 24 ? 82.138 -26.697 97.305 1.00 59.05 ? 38 GLN F NE2 1 ATOM 2995 N N . GLU E 4 25 ? 81.061 -22.449 93.911 1.00 28.86 ? 39 GLU F N 1 ATOM 2996 C CA . GLU E 4 25 ? 79.752 -21.842 94.197 1.00 28.86 ? 39 GLU F CA 1 ATOM 2997 C C . GLU E 4 25 ? 79.192 -20.953 93.066 1.00 28.86 ? 39 GLU F C 1 ATOM 2998 O O . GLU E 4 25 ? 79.923 -20.181 92.429 1.00 62.95 ? 39 GLU F O 1 ATOM 2999 C CB . GLU E 4 25 ? 79.851 -21.031 95.499 1.00 62.95 ? 39 GLU F CB 1 ATOM 3000 C CG . GLU E 4 25 ? 78.638 -20.175 95.856 1.00 62.95 ? 39 GLU F CG 1 ATOM 3001 C CD . GLU E 4 25 ? 79.008 -18.970 96.715 1.00 62.95 ? 39 GLU F CD 1 ATOM 3002 O OE1 . GLU E 4 25 ? 79.897 -19.098 97.585 1.00 62.95 ? 39 GLU F OE1 1 ATOM 3003 O OE2 . GLU E 4 25 ? 78.418 -17.887 96.511 1.00 62.95 ? 39 GLU F OE2 1 ATOM 3004 N N . LEU E 4 26 ? 77.880 -21.051 92.849 1.00 57.07 ? 40 LEU F N 1 ATOM 3005 C CA . LEU E 4 26 ? 77.189 -20.280 91.815 1.00 57.07 ? 40 LEU F CA 1 ATOM 3006 C C . LEU E 4 26 ? 77.130 -18.793 92.148 1.00 57.07 ? 40 LEU F C 1 ATOM 3007 O O . LEU E 4 26 ? 76.260 -18.333 92.904 1.00 15.27 ? 40 LEU F O 1 ATOM 3008 C CB . LEU E 4 26 ? 75.775 -20.823 91.588 1.00 15.27 ? 40 LEU F CB 1 ATOM 3009 C CG . LEU E 4 26 ? 74.867 -19.986 90.677 1.00 15.27 ? 40 LEU F CG 1 ATOM 3010 C CD1 . LEU E 4 26 ? 75.588 -19.654 89.378 1.00 15.27 ? 40 LEU F CD1 1 ATOM 3011 C CD2 . LEU E 4 26 ? 73.553 -20.716 90.414 1.00 15.27 ? 40 LEU F CD2 1 ATOM 3012 N N . LEU E 4 27 ? 78.038 -18.056 91.514 1.00 62.36 ? 41 LEU F N 1 ATOM 3013 C CA . LEU E 4 27 ? 78.185 -16.617 91.684 1.00 62.36 ? 41 LEU F CA 1 ATOM 3014 C C . LEU E 4 27 ? 77.090 -15.782 90.986 1.00 62.36 ? 41 LEU F C 1 ATOM 3015 O O . LEU E 4 27 ? 76.356 -15.033 91.641 1.00 4.55 ? 41 LEU F O 1 ATOM 3016 C CB . LEU E 4 27 ? 79.578 -16.219 91.187 1.00 4.55 ? 41 LEU F CB 1 ATOM 3017 C CG . LEU E 4 27 ? 80.409 -15.228 91.996 1.00 4.55 ? 41 LEU F CG 1 ATOM 3018 C CD1 . LEU E 4 27 ? 81.843 -15.288 91.511 1.00 4.55 ? 41 LEU F CD1 1 ATOM 3019 C CD2 . LEU E 4 27 ? 79.840 -13.821 91.863 1.00 4.55 ? 41 LEU F CD2 1 ATOM 3020 N N . CYS E 4 28 ? 76.993 -15.908 89.664 1.00 38.88 ? 42 CYS F N 1 ATOM 3021 C CA . CYS E 4 28 ? 76.007 -15.166 88.869 1.00 38.88 ? 42 CYS F CA 1 ATOM 3022 C C . CYS E 4 28 ? 75.780 -15.833 87.521 1.00 38.88 ? 42 CYS F C 1 ATOM 3023 O O . CYS E 4 28 ? 76.544 -16.703 87.115 1.00 36.54 ? 42 CYS F O 1 ATOM 3024 C CB . CYS E 4 28 ? 76.502 -13.742 88.585 1.00 36.54 ? 42 CYS F CB 1 ATOM 3025 S SG . CYS E 4 28 ? 76.363 -12.511 89.921 1.00 36.54 ? 42 CYS F SG 1 ATOM 3026 N N . GLY E 4 29 ? 74.713 -15.437 86.844 1.00 27.94 ? 43 GLY F N 1 ATOM 3027 C CA . GLY E 4 29 ? 74.441 -15.963 85.524 1.00 27.94 ? 43 GLY F CA 1 ATOM 3028 C C . GLY E 4 29 ? 75.317 -15.171 84.573 1.00 27.94 ? 43 GLY F C 1 ATOM 3029 O O . GLY E 4 29 ? 76.139 -14.365 85.025 1.00 38.52 ? 43 GLY F O 1 ATOM 3030 N N . ALA E 4 30 ? 75.149 -15.395 83.271 1.00 31.43 ? 44 ALA F N 1 ATOM 3031 C CA . ALA E 4 30 ? 75.913 -14.693 82.237 1.00 31.43 ? 44 ALA F CA 1 ATOM 3032 C C . ALA E 4 30 ? 75.369 -15.001 80.836 1.00 31.43 ? 44 ALA F C 1 ATOM 3033 O O . ALA E 4 30 ? 74.416 -15.773 80.678 1.00 34.13 ? 44 ALA F O 1 ATOM 3034 C CB . ALA E 4 30 ? 77.382 -15.072 82.329 1.00 34.13 ? 44 ALA F CB 1 ATOM 3035 N N . SER E 4 31 ? 75.964 -14.387 79.821 1.00 14.73 ? 45 SER F N 1 ATOM 3036 C CA . SER E 4 31 ? 75.551 -14.609 78.440 1.00 14.73 ? 45 SER F CA 1 ATOM 3037 C C . SER E 4 31 ? 76.784 -14.795 77.547 1.00 14.73 ? 45 SER F C 1 ATOM 3038 O O . SER E 4 31 ? 77.899 -14.480 77.948 1.00 11.58 ? 45 SER F O 1 ATOM 3039 C CB . SER E 4 31 ? 74.670 -13.452 77.938 1.00 11.58 ? 45 SER F CB 1 ATOM 3040 O OG . SER E 4 31 ? 75.271 -12.188 78.152 1.00 11.58 ? 45 SER F OG 1 ATOM 3041 N N . LEU E 4 32 ? 76.584 -15.351 76.358 1.00 2.00 ? 46 LEU F N 1 ATOM 3042 C CA . LEU E 4 32 ? 77.668 -15.579 75.404 1.00 2.00 ? 46 LEU F CA 1 ATOM 3043 C C . LEU E 4 32 ? 77.339 -14.802 74.150 1.00 2.00 ? 46 LEU F C 1 ATOM 3044 O O . LEU E 4 32 ? 76.585 -15.291 73.317 1.00 18.86 ? 46 LEU F O 1 ATOM 3045 C CB . LEU E 4 32 ? 77.759 -17.074 75.069 1.00 18.86 ? 46 LEU F CB 1 ATOM 3046 C CG . LEU E 4 32 ? 78.869 -17.643 74.171 1.00 18.86 ? 46 LEU F CG 1 ATOM 3047 C CD1 . LEU E 4 32 ? 79.065 -19.095 74.541 1.00 18.86 ? 46 LEU F CD1 1 ATOM 3048 C CD2 . LEU E 4 32 ? 78.567 -17.517 72.684 1.00 18.86 ? 46 LEU F CD2 1 ATOM 3049 N N . ILE E 4 33 ? 77.851 -13.583 74.028 1.00 2.00 ? 47 ILE F N 1 ATOM 3050 C CA . ILE E 4 33 ? 77.547 -12.760 72.849 1.00 2.00 ? 47 ILE F CA 1 ATOM 3051 C C . ILE E 4 33 ? 78.474 -13.008 71.661 1.00 2.00 ? 47 ILE F C 1 ATOM 3052 O O . ILE E 4 33 ? 78.455 -12.258 70.679 1.00 13.43 ? 47 ILE F O 1 ATOM 3053 C CB . ILE E 4 33 ? 77.519 -11.237 73.191 1.00 13.43 ? 47 ILE F CB 1 ATOM 3054 C CG1 . ILE E 4 33 ? 78.806 -10.828 73.924 1.00 13.43 ? 47 ILE F CG1 1 ATOM 3055 C CG2 . ILE E 4 33 ? 76.280 -10.902 74.020 1.00 13.43 ? 47 ILE F CG2 1 ATOM 3056 C CD1 . ILE E 4 33 ? 79.298 -9.428 73.590 1.00 13.43 ? 47 ILE F CD1 1 ATOM 3057 N N . SER E 4 34 ? 79.313 -14.033 71.784 1.00 13.32 ? 48 SER F N 1 ATOM 3058 C CA . SER E 4 34 ? 80.253 -14.431 70.739 1.00 13.32 ? 48 SER F CA 1 ATOM 3059 C C . SER E 4 34 ? 81.069 -15.603 71.276 1.00 13.32 ? 48 SER F C 1 ATOM 3060 O O . SER E 4 34 ? 80.971 -15.954 72.448 1.00 34.40 ? 48 SER F O 1 ATOM 3061 C CB . SER E 4 34 ? 81.166 -13.274 70.314 1.00 34.40 ? 48 SER F CB 1 ATOM 3062 O OG . SER E 4 34 ? 82.123 -12.976 71.311 1.00 34.40 ? 48 SER F OG 1 ATOM 3063 N N . ASP E 4 35 ? 81.880 -16.195 70.411 1.00 60.79 ? 49 ASP F N 1 ATOM 3064 C CA . ASP E 4 35 ? 82.713 -17.339 70.762 1.00 60.79 ? 49 ASP F CA 1 ATOM 3065 C C . ASP E 4 35 ? 83.838 -17.017 71.742 1.00 60.79 ? 49 ASP F C 1 ATOM 3066 O O . ASP E 4 35 ? 84.559 -17.917 72.177 1.00 57.24 ? 49 ASP F O 1 ATOM 3067 C CB . ASP E 4 35 ? 83.293 -17.954 69.482 1.00 57.24 ? 49 ASP F CB 1 ATOM 3068 C CG . ASP E 4 35 ? 83.978 -16.922 68.584 1.00 57.24 ? 49 ASP F CG 1 ATOM 3069 O OD1 . ASP E 4 35 ? 83.345 -15.909 68.210 1.00 57.24 ? 49 ASP F OD1 1 ATOM 3070 O OD2 . ASP E 4 35 ? 85.157 -17.137 68.238 1.00 57.24 ? 49 ASP F OD2 1 ATOM 3071 N N . ARG E 4 36 ? 83.992 -15.736 72.069 1.00 25.31 ? 50 ARG F N 1 ATOM 3072 C CA . ARG E 4 36 ? 85.037 -15.290 72.989 1.00 25.31 ? 50 ARG F CA 1 ATOM 3073 C C . ARG E 4 36 ? 84.464 -14.559 74.195 1.00 25.31 ? 50 ARG F C 1 ATOM 3074 O O . ARG E 4 36 ? 84.894 -14.773 75.324 1.00 58.22 ? 50 ARG F O 1 ATOM 3075 C CB . ARG E 4 36 ? 85.979 -14.304 72.285 1.00 58.22 ? 50 ARG F CB 1 ATOM 3076 C CG . ARG E 4 36 ? 86.624 -14.782 70.988 1.00 58.22 ? 50 ARG F CG 1 ATOM 3077 C CD . ARG E 4 36 ? 86.091 -14.004 69.774 1.00 58.22 ? 50 ARG F CD 1 ATOM 3078 N NE . ARG E 4 36 ? 87.113 -13.732 68.754 1.00 58.22 ? 50 ARG F NE 1 ATOM 3079 C CZ . ARG E 4 36 ? 87.821 -14.659 68.107 1.00 58.22 ? 50 ARG F CZ 1 ATOM 3080 N NH1 . ARG E 4 36 ? 87.642 -15.947 68.363 1.00 58.22 ? 50 ARG F NH1 1 ATOM 3081 N NH2 . ARG E 4 36 ? 88.719 -14.295 67.200 1.00 58.22 ? 50 ARG F NH2 1 ATOM 3082 N N . TRP E 4 37 ? 83.508 -13.674 73.934 1.00 21.36 ? 51 TRP F N 1 ATOM 3083 C CA . TRP E 4 37 ? 82.907 -12.840 74.967 1.00 21.36 ? 51 TRP F CA 1 ATOM 3084 C C . TRP E 4 37 ? 81.679 -13.334 75.716 1.00 21.36 ? 51 TRP F C 1 ATOM 3085 O O . TRP E 4 37 ? 80.710 -13.811 75.126 1.00 36.65 ? 51 TRP F O 1 ATOM 3086 C CB . TRP E 4 37 ? 82.605 -11.458 74.393 1.00 36.65 ? 51 TRP F CB 1 ATOM 3087 C CG . TRP E 4 37 ? 83.798 -10.767 73.802 1.00 36.65 ? 51 TRP F CG 1 ATOM 3088 C CD1 . TRP E 4 37 ? 84.031 -10.530 72.481 1.00 36.65 ? 51 TRP F CD1 1 ATOM 3089 C CD2 . TRP E 4 37 ? 84.900 -10.190 74.515 1.00 36.65 ? 51 TRP F CD2 1 ATOM 3090 N NE1 . TRP E 4 37 ? 85.202 -9.836 72.322 1.00 36.65 ? 51 TRP F NE1 1 ATOM 3091 C CE2 . TRP E 4 37 ? 85.759 -9.613 73.552 1.00 36.65 ? 51 TRP F CE2 1 ATOM 3092 C CE3 . TRP E 4 37 ? 85.242 -10.098 75.867 1.00 36.65 ? 51 TRP F CE3 1 ATOM 3093 C CZ2 . TRP E 4 37 ? 86.945 -8.952 73.901 1.00 36.65 ? 51 TRP F CZ2 1 ATOM 3094 C CZ3 . TRP E 4 37 ? 86.423 -9.439 76.216 1.00 36.65 ? 51 TRP F CZ3 1 ATOM 3095 C CH2 . TRP E 4 37 ? 87.259 -8.876 75.233 1.00 36.65 ? 51 TRP F CH2 1 ATOM 3096 N N . VAL E 4 38 ? 81.705 -13.106 77.023 1.00 32.49 ? 52 VAL F N 1 ATOM 3097 C CA . VAL E 4 38 ? 80.622 -13.468 77.926 1.00 32.49 ? 52 VAL F CA 1 ATOM 3098 C C . VAL E 4 38 ? 80.214 -12.184 78.642 1.00 32.49 ? 52 VAL F C 1 ATOM 3099 O O . VAL E 4 38 ? 81.057 -11.511 79.235 1.00 33.10 ? 52 VAL F O 1 ATOM 3100 C CB . VAL E 4 38 ? 81.078 -14.572 78.931 1.00 33.10 ? 52 VAL F CB 1 ATOM 3101 C CG1 . VAL E 4 38 ? 80.111 -14.697 80.086 1.00 33.10 ? 52 VAL F CG1 1 ATOM 3102 C CG2 . VAL E 4 38 ? 81.164 -15.909 78.219 1.00 33.10 ? 52 VAL F CG2 1 ATOM 3103 N N . LEU E 4 39 ? 78.936 -11.826 78.545 1.00 30.93 ? 53 LEU F N 1 ATOM 3104 C CA . LEU E 4 39 ? 78.418 -10.589 79.141 1.00 30.93 ? 53 LEU F CA 1 ATOM 3105 C C . LEU E 4 39 ? 77.665 -10.762 80.465 1.00 30.93 ? 53 LEU F C 1 ATOM 3106 O O . LEU E 4 39 ? 76.714 -11.549 80.566 1.00 2.00 ? 53 LEU F O 1 ATOM 3107 C CB . LEU E 4 39 ? 77.552 -9.872 78.105 1.00 2.00 ? 53 LEU F CB 1 ATOM 3108 C CG . LEU E 4 39 ? 77.071 -8.442 78.321 1.00 2.00 ? 53 LEU F CG 1 ATOM 3109 C CD1 . LEU E 4 39 ? 78.225 -7.515 78.644 1.00 2.00 ? 53 LEU F CD1 1 ATOM 3110 C CD2 . LEU E 4 39 ? 76.344 -7.989 77.063 1.00 2.00 ? 53 LEU F CD2 1 ATOM 3111 N N . THR E 4 40 ? 78.081 -9.984 81.460 1.00 23.55 ? 54 THR F N 1 ATOM 3112 C CA . THR E 4 40 ? 77.497 -10.028 82.797 1.00 23.55 ? 54 THR F CA 1 ATOM 3113 C C . THR E 4 40 ? 77.277 -8.641 83.384 1.00 23.55 ? 54 THR F C 1 ATOM 3114 O O . THR E 4 40 ? 77.509 -7.621 82.721 1.00 20.14 ? 54 THR F O 1 ATOM 3115 C CB . THR E 4 40 ? 78.429 -10.747 83.764 1.00 20.14 ? 54 THR F CB 1 ATOM 3116 O OG1 . THR E 4 40 ? 79.789 -10.510 83.376 1.00 20.14 ? 54 THR F OG1 1 ATOM 3117 C CG2 . THR E 4 40 ? 78.129 -12.220 83.807 1.00 20.14 ? 54 THR F CG2 1 ATOM 3118 N N . ALA E 4 41 ? 76.852 -8.628 84.649 1.00 52.92 ? 55 ALA F N 1 ATOM 3119 C CA . ALA E 4 41 ? 76.621 -7.401 85.412 1.00 52.92 ? 55 ALA F CA 1 ATOM 3120 C C . ALA E 4 41 ? 77.867 -7.151 86.254 1.00 52.92 ? 55 ALA F C 1 ATOM 3121 O O . ALA E 4 41 ? 78.330 -8.048 86.972 1.00 2.00 ? 55 ALA F O 1 ATOM 3122 C CB . ALA E 4 41 ? 75.393 -7.553 86.316 1.00 2.00 ? 55 ALA F CB 1 ATOM 3123 N N . ALA E 4 42 ? 78.402 -5.938 86.162 1.00 28.93 ? 56 ALA F N 1 ATOM 3124 C CA . ALA E 4 42 ? 79.594 -5.540 86.913 1.00 28.93 ? 56 ALA F CA 1 ATOM 3125 C C . ALA E 4 42 ? 79.635 -6.091 88.349 1.00 28.93 ? 56 ALA F C 1 ATOM 3126 O O . ALA E 4 42 ? 80.512 -6.883 88.683 1.00 2.00 ? 56 ALA F O 1 ATOM 3127 C CB . ALA E 4 42 ? 79.725 -4.019 86.928 1.00 2.00 ? 56 ALA F CB 1 ATOM 3128 N N . HIS E 4 43 ? 78.625 -5.740 89.149 1.00 52.14 ? 57 HIS F N 1 ATOM 3129 C CA . HIS E 4 43 ? 78.494 -6.145 90.554 1.00 52.14 ? 57 HIS F CA 1 ATOM 3130 C C . HIS E 4 43 ? 78.716 -7.613 90.906 1.00 52.14 ? 57 HIS F C 1 ATOM 3131 O O . HIS E 4 43 ? 78.567 -7.995 92.070 1.00 2.00 ? 57 HIS F O 1 ATOM 3132 C CB . HIS E 4 43 ? 77.134 -5.705 91.117 1.00 2.00 ? 57 HIS F CB 1 ATOM 3133 C CG . HIS E 4 43 ? 75.999 -6.628 90.781 1.00 2.00 ? 57 HIS F CG 1 ATOM 3134 N ND1 . HIS E 4 43 ? 75.058 -6.335 89.817 1.00 2.00 ? 57 HIS F ND1 1 ATOM 3135 C CD2 . HIS E 4 43 ? 75.642 -7.831 91.293 1.00 2.00 ? 57 HIS F CD2 1 ATOM 3136 C CE1 . HIS E 4 43 ? 74.175 -7.312 89.747 1.00 2.00 ? 57 HIS F CE1 1 ATOM 3137 N NE2 . HIS E 4 43 ? 74.508 -8.235 90.634 1.00 2.00 ? 57 HIS F NE2 1 ATOM 3138 N N . CYS E 4 44 ? 78.920 -8.459 89.905 1.00 37.93 ? 58 CYS F N 1 ATOM 3139 C CA . CYS E 4 44 ? 79.176 -9.871 90.176 1.00 37.93 ? 58 CYS F CA 1 ATOM 3140 C C . CYS E 4 44 ? 80.695 -10.046 90.364 1.00 37.93 ? 58 CYS F C 1 ATOM 3141 O O . CYS E 4 44 ? 81.205 -11.026 90.929 1.00 25.83 ? 58 CYS F O 1 ATOM 3142 C CB . CYS E 4 44 ? 78.645 -10.722 89.027 1.00 25.83 ? 58 CYS F CB 1 ATOM 3143 S SG . CYS E 4 44 ? 76.831 -10.763 88.977 1.00 25.83 ? 58 CYS F SG 1 ATOM 3144 N N . LEU E 4 45 ? 81.409 -9.052 89.876 1.00 49.85 ? 59 LEU F N 1 ATOM 3145 C CA . LEU E 4 45 ? 82.840 -9.022 89.969 1.00 49.85 ? 59 LEU F CA 1 ATOM 3146 C C . LEU E 4 45 ? 83.186 -7.982 91.020 1.00 49.85 ? 59 LEU F C 1 ATOM 3147 O O . LEU E 4 45 ? 83.728 -8.316 92.076 1.00 8.76 ? 59 LEU F O 1 ATOM 3148 C CB . LEU E 4 45 ? 83.443 -8.679 88.597 1.00 8.76 ? 59 LEU F CB 1 ATOM 3149 C CG . LEU E 4 45 ? 83.371 -9.791 87.531 1.00 8.76 ? 59 LEU F CG 1 ATOM 3150 C CD1 . LEU E 4 45 ? 83.970 -11.072 88.105 1.00 8.76 ? 59 LEU F CD1 1 ATOM 3151 C CD2 . LEU E 4 45 ? 81.943 -10.058 87.049 1.00 8.76 ? 59 LEU F CD2 1 ATOM 3152 N N . LEU E 4 46 ? 82.754 -6.749 90.773 1.00 22.27 ? 60 LEU F N 1 ATOM 3153 C CA . LEU E 4 46 ? 83.021 -5.632 91.672 1.00 22.27 ? 60 LEU F CA 1 ATOM 3154 C C . LEU E 4 46 ? 81.826 -5.125 92.505 1.00 22.27 ? 60 LEU F C 1 ATOM 3155 O O . LEU E 4 46 ? 80.779 -4.720 91.970 1.00 11.92 ? 60 LEU F O 1 ATOM 3156 C CB . LEU E 4 46 ? 83.625 -4.478 90.873 1.00 11.92 ? 60 LEU F CB 1 ATOM 3157 C CG . LEU E 4 46 ? 84.192 -3.293 91.653 1.00 11.92 ? 60 LEU F CG 1 ATOM 3158 C CD1 . LEU E 4 46 ? 85.137 -3.743 92.800 1.00 11.92 ? 60 LEU F CD1 1 ATOM 3159 C CD2 . LEU E 4 46 ? 84.901 -2.394 90.652 1.00 11.92 ? 60 LEU F CD2 1 ATOM 3160 N N . TYR E 4 47 A 82.004 -5.155 93.823 1.00 66.48 ? 60 TYR F N 1 ATOM 3161 C CA . TYR E 4 47 A 81.003 -4.670 94.765 1.00 66.48 ? 60 TYR F CA 1 ATOM 3162 C C . TYR E 4 47 A 81.606 -4.515 96.159 1.00 66.48 ? 60 TYR F C 1 ATOM 3163 O O . TYR E 4 47 A 81.408 -5.364 97.036 1.00 33.10 ? 60 TYR F O 1 ATOM 3164 C CB . TYR E 4 47 A 79.780 -5.584 94.823 1.00 33.10 ? 60 TYR F CB 1 ATOM 3165 C CG . TYR E 4 47 A 78.615 -4.971 95.571 1.00 33.10 ? 60 TYR F CG 1 ATOM 3166 C CD1 . TYR E 4 47 A 78.048 -3.767 95.156 1.00 33.10 ? 60 TYR F CD1 1 ATOM 3167 C CD2 . TYR E 4 47 A 78.063 -5.607 96.677 1.00 33.10 ? 60 TYR F CD2 1 ATOM 3168 C CE1 . TYR E 4 47 A 76.951 -3.213 95.823 1.00 33.10 ? 60 TYR F CE1 1 ATOM 3169 C CE2 . TYR E 4 47 A 76.969 -5.063 97.352 1.00 33.10 ? 60 TYR F CE2 1 ATOM 3170 C CZ . TYR E 4 47 A 76.414 -3.866 96.923 1.00 33.10 ? 60 TYR F CZ 1 ATOM 3171 O OH . TYR E 4 47 A 75.323 -3.341 97.591 1.00 33.10 ? 60 TYR F OH 1 ATOM 3172 N N . PRO E 4 48 B 82.294 -3.374 96.394 1.00 66.88 ? 60 PRO F N 1 ATOM 3173 C CA . PRO E 4 48 B 82.972 -2.995 97.640 1.00 66.88 ? 60 PRO F CA 1 ATOM 3174 C C . PRO E 4 48 B 82.170 -3.257 98.929 1.00 66.88 ? 60 PRO F C 1 ATOM 3175 O O . PRO E 4 48 B 82.747 -3.683 99.930 1.00 46.21 ? 60 PRO F O 1 ATOM 3176 C CB . PRO E 4 48 B 83.240 -1.505 97.427 1.00 46.21 ? 60 PRO F CB 1 ATOM 3177 C CG . PRO E 4 48 B 83.452 -1.421 95.945 1.00 46.21 ? 60 PRO F CG 1 ATOM 3178 C CD . PRO E 4 48 B 82.327 -2.265 95.427 1.00 46.21 ? 60 PRO F CD 1 ATOM 3179 N N . PRO E 4 49 C 80.850 -2.963 98.941 1.00 39.89 ? 60 PRO F N 1 ATOM 3180 C CA . PRO E 4 49 C 80.077 -3.225 100.162 1.00 39.89 ? 60 PRO F CA 1 ATOM 3181 C C . PRO E 4 49 C 80.095 -4.699 100.605 1.00 39.89 ? 60 PRO F C 1 ATOM 3182 O O . PRO E 4 49 C 80.157 -5.007 101.797 1.00 2.00 ? 60 PRO F O 1 ATOM 3183 C CB . PRO E 4 49 C 78.675 -2.767 99.770 1.00 2.00 ? 60 PRO F CB 1 ATOM 3184 C CG . PRO E 4 49 C 78.966 -1.605 98.888 1.00 2.00 ? 60 PRO F CG 1 ATOM 3185 C CD . PRO E 4 49 C 80.051 -2.149 98.003 1.00 2.00 ? 60 PRO F CD 1 ATOM 3186 N N . TRP E 4 50 D 80.019 -5.614 99.648 1.00 59.54 ? 60 TRP F N 1 ATOM 3187 C CA . TRP E 4 50 D 80.056 -7.031 99.987 1.00 59.54 ? 60 TRP F CA 1 ATOM 3188 C C . TRP E 4 50 D 81.461 -7.563 99.750 1.00 59.54 ? 60 TRP F C 1 ATOM 3189 O O . TRP E 4 50 D 81.662 -8.752 99.484 1.00 94.99 ? 60 TRP F O 1 ATOM 3190 C CB . TRP E 4 50 D 79.008 -7.810 99.187 1.00 94.99 ? 60 TRP F CB 1 ATOM 3191 C CG . TRP E 4 50 D 77.591 -7.503 99.615 1.00 94.99 ? 60 TRP F CG 1 ATOM 3192 C CD1 . TRP E 4 50 D 77.186 -6.524 100.486 1.00 94.99 ? 60 TRP F CD1 1 ATOM 3193 C CD2 . TRP E 4 50 D 76.401 -8.181 99.196 1.00 94.99 ? 60 TRP F CD2 1 ATOM 3194 N NE1 . TRP E 4 50 D 75.822 -6.552 100.630 1.00 94.99 ? 60 TRP F NE1 1 ATOM 3195 C CE2 . TRP E 4 50 D 75.314 -7.558 99.852 1.00 94.99 ? 60 TRP F CE2 1 ATOM 3196 C CE3 . TRP E 4 50 D 76.146 -9.253 98.332 1.00 94.99 ? 60 TRP F CE3 1 ATOM 3197 C CZ2 . TRP E 4 50 D 73.994 -7.974 99.669 1.00 94.99 ? 60 TRP F CZ2 1 ATOM 3198 C CZ3 . TRP E 4 50 D 74.832 -9.666 98.151 1.00 94.99 ? 60 TRP F CZ3 1 ATOM 3199 C CH2 . TRP E 4 50 D 73.774 -9.026 98.818 1.00 94.99 ? 60 TRP F CH2 1 ATOM 3200 N N . ASP E 4 51 E 82.422 -6.643 99.847 1.00 78.36 ? 60 ASP F N 1 ATOM 3201 C CA . ASP E 4 51 E 83.850 -6.913 99.674 1.00 78.36 ? 60 ASP F CA 1 ATOM 3202 C C . ASP E 4 51 E 84.172 -7.652 98.374 1.00 78.36 ? 60 ASP F C 1 ATOM 3203 O O . ASP E 4 51 E 85.155 -8.392 98.293 1.00 62.11 ? 60 ASP F O 1 ATOM 3204 C CB . ASP E 4 51 E 84.391 -7.686 100.882 1.00 62.11 ? 60 ASP F CB 1 ATOM 3205 C CG . ASP E 4 51 E 83.996 -7.052 102.199 1.00 62.11 ? 60 ASP F CG 1 ATOM 3206 O OD1 . ASP E 4 51 E 84.493 -5.943 102.498 1.00 62.11 ? 60 ASP F OD1 1 ATOM 3207 O OD2 . ASP E 4 51 E 83.175 -7.659 102.924 1.00 62.11 ? 60 ASP F OD2 1 ATOM 3208 N N . LYS E 4 52 F 83.353 -7.433 97.350 1.00 48.07 ? 60 LYS F N 1 ATOM 3209 C CA . LYS E 4 52 F 83.574 -8.084 96.073 1.00 48.07 ? 60 LYS F CA 1 ATOM 3210 C C . LYS E 4 52 F 84.636 -7.415 95.198 1.00 48.07 ? 60 LYS F C 1 ATOM 3211 O O . LYS E 4 52 F 84.622 -6.193 94.978 1.00 25.54 ? 60 LYS F O 1 ATOM 3212 C CB . LYS E 4 52 F 82.274 -8.195 95.279 1.00 25.54 ? 60 LYS F CB 1 ATOM 3213 C CG . LYS E 4 52 F 81.377 -9.332 95.698 1.00 25.54 ? 60 LYS F CG 1 ATOM 3214 C CD . LYS E 4 52 F 80.244 -9.515 94.700 1.00 25.54 ? 60 LYS F CD 1 ATOM 3215 C CE . LYS E 4 52 F 79.257 -10.568 95.169 1.00 25.54 ? 60 LYS F CE 1 ATOM 3216 N NZ . LYS E 4 52 F 78.618 -10.203 96.474 1.00 25.54 ? 60 LYS F NZ 1 ATOM 3217 N N . ASN E 4 53 G 85.574 -8.245 94.751 1.00 42.57 ? 60 ASN F N 1 ATOM 3218 C CA . ASN E 4 53 G 86.652 -7.876 93.841 1.00 42.57 ? 60 ASN F CA 1 ATOM 3219 C C . ASN E 4 53 G 87.339 -9.169 93.425 1.00 42.57 ? 60 ASN F C 1 ATOM 3220 O O . ASN E 4 53 G 88.383 -9.546 93.968 1.00 67.34 ? 60 ASN F O 1 ATOM 3221 C CB . ASN E 4 53 G 87.680 -6.910 94.449 1.00 67.34 ? 60 ASN F CB 1 ATOM 3222 C CG . ASN E 4 53 G 88.714 -6.417 93.406 1.00 67.34 ? 60 ASN F CG 1 ATOM 3223 O OD1 . ASN E 4 53 G 88.710 -6.872 92.258 1.00 67.34 ? 60 ASN F OD1 1 ATOM 3224 N ND2 . ASN E 4 53 G 89.594 -5.496 93.798 1.00 67.34 ? 60 ASN F ND2 1 ATOM 3225 N N . PHE E 4 54 H 86.688 -9.890 92.519 1.00 32.45 ? 60 PHE F N 1 ATOM 3226 C CA . PHE E 4 54 H 87.212 -11.146 92.011 1.00 32.45 ? 60 PHE F CA 1 ATOM 3227 C C . PHE E 4 54 H 88.251 -10.906 90.928 1.00 32.45 ? 60 PHE F C 1 ATOM 3228 O O . PHE E 4 54 H 88.146 -9.959 90.143 1.00 42.06 ? 60 PHE F O 1 ATOM 3229 C CB . PHE E 4 54 H 86.095 -11.969 91.382 1.00 42.06 ? 60 PHE F CB 1 ATOM 3230 C CG . PHE E 4 54 H 85.130 -12.554 92.364 1.00 42.06 ? 60 PHE F CG 1 ATOM 3231 C CD1 . PHE E 4 54 H 85.512 -13.605 93.193 1.00 42.06 ? 60 PHE F CD1 1 ATOM 3232 C CD2 . PHE E 4 54 H 83.815 -12.109 92.406 1.00 42.06 ? 60 PHE F CD2 1 ATOM 3233 C CE1 . PHE E 4 54 H 84.595 -14.213 94.048 1.00 42.06 ? 60 PHE F CE1 1 ATOM 3234 C CE2 . PHE E 4 54 H 82.890 -12.708 93.258 1.00 42.06 ? 60 PHE F CE2 1 ATOM 3235 C CZ . PHE E 4 54 H 83.282 -13.766 94.079 1.00 42.06 ? 60 PHE F CZ 1 ATOM 3236 N N . THR E 4 55 I 89.256 -11.769 90.887 1.00 36.69 ? 60 THR F N 1 ATOM 3237 C CA . THR E 4 55 I 90.273 -11.683 89.852 1.00 36.69 ? 60 THR F CA 1 ATOM 3238 C C . THR E 4 55 I 90.098 -12.923 88.976 1.00 36.69 ? 60 THR F C 1 ATOM 3239 O O . THR E 4 55 I 89.574 -13.939 89.432 1.00 19.69 ? 60 THR F O 1 ATOM 3240 C CB . THR E 4 55 I 91.715 -11.630 90.421 1.00 19.69 ? 60 THR F CB 1 ATOM 3241 O OG1 . THR E 4 55 I 92.669 -11.772 89.351 1.00 19.69 ? 60 THR F OG1 1 ATOM 3242 C CG2 . THR E 4 55 I 91.930 -12.723 91.456 1.00 19.69 ? 60 THR F CG2 1 ATOM 3243 N N . VAL E 4 56 ? 90.527 -12.812 87.719 1.00 38.27 ? 61 VAL F N 1 ATOM 3244 C CA . VAL E 4 56 ? 90.471 -13.886 86.726 1.00 38.27 ? 61 VAL F CA 1 ATOM 3245 C C . VAL E 4 56 ? 90.737 -15.239 87.404 1.00 38.27 ? 61 VAL F C 1 ATOM 3246 O O . VAL E 4 56 ? 90.042 -16.227 87.175 1.00 2.00 ? 61 VAL F O 1 ATOM 3247 C CB . VAL E 4 56 ? 91.553 -13.634 85.636 1.00 2.00 ? 61 VAL F CB 1 ATOM 3248 C CG1 . VAL E 4 56 ? 91.466 -14.653 84.528 1.00 2.00 ? 61 VAL F CG1 1 ATOM 3249 C CG2 . VAL E 4 56 ? 91.421 -12.228 85.091 1.00 2.00 ? 61 VAL F CG2 1 ATOM 3250 N N . ASP E 4 57 ? 91.669 -15.202 88.347 1.00 12.70 ? 62 ASP F N 1 ATOM 3251 C CA . ASP E 4 57 ? 92.113 -16.356 89.109 1.00 12.70 ? 62 ASP F CA 1 ATOM 3252 C C . ASP E 4 57 ? 91.038 -16.952 90.008 1.00 12.70 ? 62 ASP F C 1 ATOM 3253 O O . ASP E 4 57 ? 91.291 -17.925 90.716 1.00 84.23 ? 62 ASP F O 1 ATOM 3254 C CB . ASP E 4 57 ? 93.308 -15.949 89.985 1.00 84.23 ? 62 ASP F CB 1 ATOM 3255 C CG . ASP E 4 57 ? 94.139 -14.822 89.371 1.00 84.23 ? 62 ASP F CG 1 ATOM 3256 O OD1 . ASP E 4 57 ? 94.450 -14.878 88.157 1.00 84.23 ? 62 ASP F OD1 1 ATOM 3257 O OD2 . ASP E 4 57 ? 94.473 -13.869 90.108 1.00 84.23 ? 62 ASP F OD2 1 ATOM 3258 N N . ASP E 4 58 ? 89.856 -16.349 90.012 1.00 62.09 ? 63 ASP F N 1 ATOM 3259 C CA . ASP E 4 58 ? 88.751 -16.828 90.839 1.00 62.09 ? 63 ASP F CA 1 ATOM 3260 C C . ASP E 4 58 ? 87.540 -17.268 90.008 1.00 62.09 ? 63 ASP F C 1 ATOM 3261 O O . ASP E 4 58 ? 86.529 -17.705 90.579 1.00 26.42 ? 63 ASP F O 1 ATOM 3262 C CB . ASP E 4 58 ? 88.301 -15.744 91.826 1.00 26.42 ? 63 ASP F CB 1 ATOM 3263 C CG . ASP E 4 58 ? 89.456 -15.087 92.564 1.00 26.42 ? 63 ASP F CG 1 ATOM 3264 O OD1 . ASP E 4 58 ? 90.547 -15.688 92.677 1.00 26.42 ? 63 ASP F OD1 1 ATOM 3265 O OD2 . ASP E 4 58 ? 89.264 -13.952 93.048 1.00 26.42 ? 63 ASP F OD2 1 ATOM 3266 N N . LEU E 4 59 ? 87.646 -17.216 88.676 1.00 36.34 ? 64 LEU F N 1 ATOM 3267 C CA . LEU E 4 59 ? 86.504 -17.577 87.847 1.00 36.34 ? 64 LEU F CA 1 ATOM 3268 C C . LEU E 4 59 ? 86.501 -18.609 86.701 1.00 36.34 ? 64 LEU F C 1 ATOM 3269 O O . LEU E 4 59 ? 87.314 -18.585 85.767 1.00 2.00 ? 64 LEU F O 1 ATOM 3270 C CB . LEU E 4 59 ? 85.785 -16.310 87.421 1.00 2.00 ? 64 LEU F CB 1 ATOM 3271 C CG . LEU E 4 59 ? 84.836 -15.925 88.554 1.00 2.00 ? 64 LEU F CG 1 ATOM 3272 C CD1 . LEU E 4 59 ? 84.653 -14.422 88.633 1.00 2.00 ? 64 LEU F CD1 1 ATOM 3273 C CD2 . LEU E 4 59 ? 83.517 -16.675 88.379 1.00 2.00 ? 64 LEU F CD2 1 ATOM 3274 N N . LEU E 4 60 ? 85.523 -19.507 86.817 1.00 22.37 ? 65 LEU F N 1 ATOM 3275 C CA . LEU E 4 60 ? 85.247 -20.575 85.868 1.00 22.37 ? 65 LEU F CA 1 ATOM 3276 C C . LEU E 4 60 ? 83.944 -20.166 85.194 1.00 22.37 ? 65 LEU F C 1 ATOM 3277 O O . LEU E 4 60 ? 83.042 -19.633 85.847 1.00 33.49 ? 65 LEU F O 1 ATOM 3278 C CB . LEU E 4 60 ? 84.958 -21.887 86.602 1.00 33.49 ? 65 LEU F CB 1 ATOM 3279 C CG . LEU E 4 60 ? 85.994 -22.611 87.457 1.00 33.49 ? 65 LEU F CG 1 ATOM 3280 C CD1 . LEU E 4 60 ? 85.298 -23.539 88.451 1.00 33.49 ? 65 LEU F CD1 1 ATOM 3281 C CD2 . LEU E 4 60 ? 86.930 -23.393 86.557 1.00 33.49 ? 65 LEU F CD2 1 ATOM 3282 N N . VAL E 4 61 ? 83.827 -20.446 83.905 1.00 32.63 ? 66 VAL F N 1 ATOM 3283 C CA . VAL E 4 61 ? 82.622 -20.117 83.153 1.00 32.63 ? 66 VAL F CA 1 ATOM 3284 C C . VAL E 4 61 ? 81.992 -21.411 82.635 1.00 32.63 ? 66 VAL F C 1 ATOM 3285 O O . VAL E 4 61 ? 82.656 -22.205 81.962 1.00 53.45 ? 66 VAL F O 1 ATOM 3286 C CB . VAL E 4 61 ? 82.945 -19.138 81.982 1.00 53.45 ? 66 VAL F CB 1 ATOM 3287 C CG1 . VAL E 4 61 ? 82.011 -19.354 80.809 1.00 53.45 ? 66 VAL F CG1 1 ATOM 3288 C CG2 . VAL E 4 61 ? 82.828 -17.703 82.461 1.00 53.45 ? 66 VAL F CG2 1 ATOM 3289 N N . ARG E 4 62 ? 80.731 -21.646 82.984 1.00 24.16 ? 67 ARG F N 1 ATOM 3290 C CA . ARG E 4 62 ? 80.047 -22.854 82.534 1.00 24.16 ? 67 ARG F CA 1 ATOM 3291 C C . ARG E 4 62 ? 78.969 -22.588 81.493 1.00 24.16 ? 67 ARG F C 1 ATOM 3292 O O . ARG E 4 62 ? 77.859 -22.167 81.820 1.00 47.68 ? 67 ARG F O 1 ATOM 3293 C CB . ARG E 4 62 ? 79.469 -23.642 83.711 1.00 47.68 ? 67 ARG F CB 1 ATOM 3294 C CG . ARG E 4 62 ? 80.400 -24.730 84.218 1.00 47.68 ? 67 ARG F CG 1 ATOM 3295 C CD . ARG E 4 62 ? 81.268 -24.281 85.390 1.00 47.68 ? 67 ARG F CD 1 ATOM 3296 N NE . ARG E 4 62 ? 80.753 -24.738 86.686 1.00 47.68 ? 67 ARG F NE 1 ATOM 3297 C CZ . ARG E 4 62 ? 80.508 -26.009 87.011 1.00 47.68 ? 67 ARG F CZ 1 ATOM 3298 N NH1 . ARG E 4 62 ? 80.690 -26.988 86.133 1.00 47.68 ? 67 ARG F NH1 1 ATOM 3299 N NH2 . ARG E 4 62 ? 80.052 -26.304 88.218 1.00 47.68 ? 67 ARG F NH2 1 ATOM 3300 N N . ILE E 4 63 ? 79.305 -22.862 80.238 1.00 15.22 ? 68 ILE F N 1 ATOM 3301 C CA . ILE E 4 63 ? 78.402 -22.653 79.112 1.00 15.22 ? 68 ILE F CA 1 ATOM 3302 C C . ILE E 4 63 ? 77.659 -23.925 78.684 1.00 15.22 ? 68 ILE F C 1 ATOM 3303 O O . ILE E 4 63 ? 78.248 -25.008 78.632 1.00 13.54 ? 68 ILE F O 1 ATOM 3304 C CB . ILE E 4 63 ? 79.182 -22.148 77.885 1.00 13.54 ? 68 ILE F CB 1 ATOM 3305 C CG1 . ILE E 4 63 ? 80.393 -21.328 78.321 1.00 13.54 ? 68 ILE F CG1 1 ATOM 3306 C CG2 . ILE E 4 63 ? 78.293 -21.299 77.015 1.00 13.54 ? 68 ILE F CG2 1 ATOM 3307 C CD1 . ILE E 4 63 ? 81.729 -21.977 77.997 1.00 13.54 ? 68 ILE F CD1 1 ATOM 3308 N N . GLY E 4 64 ? 76.379 -23.783 78.352 1.00 26.13 ? 69 GLY F N 1 ATOM 3309 C CA . GLY E 4 64 ? 75.585 -24.921 77.907 1.00 26.13 ? 69 GLY F CA 1 ATOM 3310 C C . GLY E 4 64 ? 75.138 -25.901 78.976 1.00 26.13 ? 69 GLY F C 1 ATOM 3311 O O . GLY E 4 64 ? 74.895 -27.075 78.680 1.00 2.00 ? 69 GLY F O 1 ATOM 3312 N N . LYS E 4 65 ? 75.020 -25.424 80.213 1.00 39.09 ? 70 LYS F N 1 ATOM 3313 C CA . LYS E 4 65 ? 74.595 -26.264 81.332 1.00 39.09 ? 70 LYS F CA 1 ATOM 3314 C C . LYS E 4 65 ? 73.068 -26.177 81.506 1.00 39.09 ? 70 LYS F C 1 ATOM 3315 O O . LYS E 4 65 ? 72.430 -25.256 80.996 1.00 2.00 ? 70 LYS F O 1 ATOM 3316 C CB . LYS E 4 65 ? 75.316 -25.804 82.606 1.00 2.00 ? 70 LYS F CB 1 ATOM 3317 C CG . LYS E 4 65 ? 75.241 -26.766 83.777 1.00 2.00 ? 70 LYS F CG 1 ATOM 3318 C CD . LYS E 4 65 ? 75.549 -26.042 85.072 1.00 2.00 ? 70 LYS F CD 1 ATOM 3319 C CE . LYS E 4 65 ? 76.697 -26.677 85.820 1.00 2.00 ? 70 LYS F CE 1 ATOM 3320 N NZ . LYS E 4 65 ? 77.977 -26.539 85.085 1.00 2.00 ? 70 LYS F NZ 1 ATOM 3321 N N . HIS E 4 66 ? 72.481 -27.149 82.195 1.00 2.00 ? 71 HIS F N 1 ATOM 3322 C CA . HIS E 4 66 ? 71.043 -27.155 82.427 1.00 2.00 ? 71 HIS F CA 1 ATOM 3323 C C . HIS E 4 66 ? 70.770 -27.530 83.880 1.00 2.00 ? 71 HIS F C 1 ATOM 3324 O O . HIS E 4 66 ? 69.901 -26.940 84.520 1.00 32.65 ? 71 HIS F O 1 ATOM 3325 C CB . HIS E 4 66 ? 70.345 -28.126 81.481 1.00 32.65 ? 71 HIS F CB 1 ATOM 3326 C CG . HIS E 4 66 ? 68.852 -28.069 81.557 1.00 32.65 ? 71 HIS F CG 1 ATOM 3327 N ND1 . HIS E 4 66 ? 68.119 -27.028 81.025 1.00 32.65 ? 71 HIS F ND1 1 ATOM 3328 C CD2 . HIS E 4 66 ? 67.954 -28.914 82.118 1.00 32.65 ? 71 HIS F CD2 1 ATOM 3329 C CE1 . HIS E 4 66 ? 66.835 -27.233 81.258 1.00 32.65 ? 71 HIS F CE1 1 ATOM 3330 N NE2 . HIS E 4 66 ? 66.708 -28.369 81.919 1.00 32.65 ? 71 HIS F NE2 1 ATOM 3331 N N . SER E 4 67 ? 71.496 -28.523 84.389 1.00 20.34 ? 72 SER F N 1 ATOM 3332 C CA . SER E 4 67 ? 71.353 -28.958 85.779 1.00 20.34 ? 72 SER F CA 1 ATOM 3333 C C . SER E 4 67 ? 72.225 -28.084 86.663 1.00 20.34 ? 72 SER F C 1 ATOM 3334 O O . SER E 4 67 ? 73.440 -28.030 86.482 1.00 13.45 ? 72 SER F O 1 ATOM 3335 C CB . SER E 4 67 ? 71.775 -30.413 85.935 1.00 13.45 ? 72 SER F CB 1 ATOM 3336 O OG . SER E 4 67 ? 70.916 -31.266 85.206 1.00 13.45 ? 72 SER F OG 1 ATOM 3337 N N . ARG E 4 68 ? 71.604 -27.457 87.653 1.00 32.07 ? 73 ARG F N 1 ATOM 3338 C CA . ARG E 4 68 ? 72.284 -26.536 88.558 1.00 32.07 ? 73 ARG F CA 1 ATOM 3339 C C . ARG E 4 68 ? 73.587 -26.968 89.229 1.00 32.07 ? 73 ARG F C 1 ATOM 3340 O O . ARG E 4 68 ? 74.498 -26.153 89.401 1.00 52.39 ? 73 ARG F O 1 ATOM 3341 C CB . ARG E 4 68 ? 71.311 -26.062 89.631 1.00 52.39 ? 73 ARG F CB 1 ATOM 3342 C CG . ARG E 4 68 ? 71.778 -24.828 90.358 1.00 52.39 ? 73 ARG F CG 1 ATOM 3343 C CD . ARG E 4 68 ? 70.817 -24.494 91.445 1.00 52.39 ? 73 ARG F CD 1 ATOM 3344 N NE . ARG E 4 68 ? 70.726 -25.614 92.367 1.00 52.39 ? 73 ARG F NE 1 ATOM 3345 C CZ . ARG E 4 68 ? 71.439 -25.720 93.479 1.00 52.39 ? 73 ARG F CZ 1 ATOM 3346 N NH1 . ARG E 4 68 ? 72.275 -24.746 93.830 1.00 52.39 ? 73 ARG F NH1 1 ATOM 3347 N NH2 . ARG E 4 68 ? 71.292 -26.788 94.251 1.00 52.39 ? 73 ARG F NH2 1 ATOM 3348 N N . THR E 4 69 ? 73.670 -28.237 89.614 1.00 70.83 ? 74 THR F N 1 ATOM 3349 C CA . THR E 4 69 ? 74.846 -28.750 90.314 1.00 70.83 ? 74 THR F CA 1 ATOM 3350 C C . THR E 4 69 ? 75.684 -29.773 89.548 1.00 70.83 ? 74 THR F C 1 ATOM 3351 O O . THR E 4 69 ? 76.925 -29.745 89.610 1.00 23.83 ? 74 THR F O 1 ATOM 3352 C CB . THR E 4 69 ? 74.414 -29.394 91.666 1.00 23.83 ? 74 THR F CB 1 ATOM 3353 O OG1 . THR E 4 69 ? 73.430 -30.408 91.420 1.00 23.83 ? 74 THR F OG1 1 ATOM 3354 C CG2 . THR E 4 69 ? 73.806 -28.349 92.599 1.00 23.83 ? 74 THR F CG2 1 ATOM 3355 N N . ARG E 4 70 ? 75.005 -30.669 88.832 1.00 64.36 ? 75 ARG F N 1 ATOM 3356 C CA . ARG E 4 70 ? 75.682 -31.732 88.104 1.00 64.36 ? 75 ARG F CA 1 ATOM 3357 C C . ARG E 4 70 ? 76.539 -31.384 86.894 1.00 64.36 ? 75 ARG F C 1 ATOM 3358 O O . ARG E 4 70 ? 76.151 -30.613 86.015 1.00 62.39 ? 75 ARG F O 1 ATOM 3359 C CB . ARG E 4 70 ? 74.730 -32.901 87.811 1.00 62.39 ? 75 ARG F CB 1 ATOM 3360 C CG . ARG E 4 70 ? 74.272 -33.058 86.377 1.00 62.39 ? 75 ARG F CG 1 ATOM 3361 C CD . ARG E 4 70 ? 73.681 -34.446 86.189 1.00 62.39 ? 75 ARG F CD 1 ATOM 3362 N NE . ARG E 4 70 ? 72.896 -34.589 84.963 1.00 62.39 ? 75 ARG F NE 1 ATOM 3363 C CZ . ARG E 4 70 ? 71.569 -34.705 84.935 1.00 62.39 ? 75 ARG F CZ 1 ATOM 3364 N NH1 . ARG E 4 70 ? 70.869 -34.667 86.064 1.00 62.39 ? 75 ARG F NH1 1 ATOM 3365 N NH2 . ARG E 4 70 ? 70.937 -34.839 83.774 1.00 62.39 ? 75 ARG F NH2 1 ATOM 3366 N N . TYR E 4 71 ? 77.739 -31.950 86.902 1.00 81.19 ? 76 TYR F N 1 ATOM 3367 C CA . TYR E 4 71 ? 78.716 -31.781 85.842 1.00 81.19 ? 76 TYR F CA 1 ATOM 3368 C C . TYR E 4 71 ? 78.233 -32.637 84.668 1.00 81.19 ? 76 TYR F C 1 ATOM 3369 O O . TYR E 4 71 ? 78.353 -33.870 84.677 1.00 51.23 ? 76 TYR F O 1 ATOM 3370 C CB . TYR E 4 71 ? 80.093 -32.224 86.364 1.00 51.23 ? 76 TYR F CB 1 ATOM 3371 C CG . TYR E 4 71 ? 81.090 -32.734 85.347 1.00 51.23 ? 76 TYR F CG 1 ATOM 3372 C CD1 . TYR E 4 71 ? 81.655 -31.886 84.399 1.00 51.23 ? 76 TYR F CD1 1 ATOM 3373 C CD2 . TYR E 4 71 ? 81.509 -34.067 85.373 1.00 51.23 ? 76 TYR F CD2 1 ATOM 3374 C CE1 . TYR E 4 71 ? 82.618 -32.351 83.502 1.00 51.23 ? 76 TYR F CE1 1 ATOM 3375 C CE2 . TYR E 4 71 ? 82.468 -34.543 84.484 1.00 51.23 ? 76 TYR F CE2 1 ATOM 3376 C CZ . TYR E 4 71 ? 83.021 -33.681 83.551 1.00 51.23 ? 76 TYR F CZ 1 ATOM 3377 O OH . TYR E 4 71 ? 83.985 -34.146 82.681 1.00 51.23 ? 76 TYR F OH 1 ATOM 3378 N N . GLU E 4 72 ? 77.608 -31.972 83.699 1.00 100.48 ? 77 GLU F N 1 ATOM 3379 C CA . GLU E 4 72 ? 77.081 -32.625 82.503 1.00 100.48 ? 77 GLU F CA 1 ATOM 3380 C C . GLU E 4 72 ? 78.191 -32.964 81.500 1.00 100.48 ? 77 GLU F C 1 ATOM 3381 O O . GLU E 4 72 ? 78.339 -32.333 80.444 1.00 42.04 ? 77 GLU F O 1 ATOM 3382 C CB . GLU E 4 72 ? 75.951 -31.781 81.896 1.00 42.04 ? 77 GLU F CB 1 ATOM 3383 C CG . GLU E 4 72 ? 74.654 -31.851 82.727 1.00 42.04 ? 77 GLU F CG 1 ATOM 3384 C CD . GLU E 4 72 ? 73.660 -30.749 82.404 1.00 42.04 ? 77 GLU F CD 1 ATOM 3385 O OE1 . GLU E 4 72 ? 73.901 -29.601 82.828 1.00 42.04 ? 77 GLU F OE1 1 ATOM 3386 O OE2 . GLU E 4 72 ? 72.633 -31.033 81.746 1.00 42.04 ? 77 GLU F OE2 1 ATOM 3387 N N . ARG E 4 73 A 78.931 -34.009 81.871 1.00 16.81 ? 77 ARG F N 1 ATOM 3388 C CA . ARG E 4 73 A 80.070 -34.576 81.159 1.00 16.81 ? 77 ARG F CA 1 ATOM 3389 C C . ARG E 4 73 A 80.105 -34.450 79.644 1.00 16.81 ? 77 ARG F C 1 ATOM 3390 O O . ARG E 4 73 A 81.176 -34.439 79.050 1.00 57.04 ? 77 ARG F O 1 ATOM 3391 C CB . ARG E 4 73 A 80.179 -36.057 81.533 1.00 57.04 ? 77 ARG F CB 1 ATOM 3392 C CG . ARG E 4 73 A 81.345 -36.817 80.905 1.00 57.04 ? 77 ARG F CG 1 ATOM 3393 C CD . ARG E 4 73 A 81.048 -38.320 80.793 1.00 57.04 ? 77 ARG F CD 1 ATOM 3394 N NE . ARG E 4 73 A 80.402 -38.677 79.524 1.00 57.04 ? 77 ARG F NE 1 ATOM 3395 C CZ . ARG E 4 73 A 79.436 -39.586 79.392 1.00 57.04 ? 77 ARG F CZ 1 ATOM 3396 N NH1 . ARG E 4 73 A 78.971 -40.236 80.453 1.00 57.04 ? 77 ARG F NH1 1 ATOM 3397 N NH2 . ARG E 4 73 A 78.923 -39.838 78.191 1.00 57.04 ? 77 ARG F NH2 1 ATOM 3398 N N . LYS E 4 74 ? 78.944 -34.389 79.012 1.00 15.82 ? 78 LYS F N 1 ATOM 3399 C CA . LYS E 4 74 ? 78.911 -34.319 77.562 1.00 15.82 ? 78 LYS F CA 1 ATOM 3400 C C . LYS E 4 74 ? 78.555 -32.972 76.947 1.00 15.82 ? 78 LYS F C 1 ATOM 3401 O O . LYS E 4 74 ? 79.219 -32.500 76.021 1.00 39.44 ? 78 LYS F O 1 ATOM 3402 C CB . LYS E 4 74 ? 77.935 -35.364 77.023 1.00 39.44 ? 78 LYS F CB 1 ATOM 3403 C CG . LYS E 4 74 ? 78.207 -36.775 77.488 1.00 39.44 ? 78 LYS F CG 1 ATOM 3404 C CD . LYS E 4 74 ? 76.895 -37.511 77.693 1.00 39.44 ? 78 LYS F CD 1 ATOM 3405 C CE . LYS E 4 74 ? 75.980 -36.726 78.627 1.00 39.44 ? 78 LYS F CE 1 ATOM 3406 N NZ . LYS E 4 74 ? 76.684 -36.329 79.888 1.00 39.44 ? 78 LYS F NZ 1 ATOM 3407 N N . VAL E 4 75 ? 77.510 -32.351 77.470 1.00 9.06 ? 79 VAL F N 1 ATOM 3408 C CA . VAL E 4 75 ? 77.019 -31.111 76.900 1.00 9.06 ? 79 VAL F CA 1 ATOM 3409 C C . VAL E 4 75 ? 77.492 -29.742 77.396 1.00 9.06 ? 79 VAL F C 1 ATOM 3410 O O . VAL E 4 75 ? 77.484 -28.776 76.622 1.00 20.84 ? 79 VAL F O 1 ATOM 3411 C CB . VAL E 4 75 ? 75.496 -31.162 76.852 1.00 20.84 ? 79 VAL F CB 1 ATOM 3412 C CG1 . VAL E 4 75 ? 75.071 -32.340 75.996 1.00 20.84 ? 79 VAL F CG1 1 ATOM 3413 C CG2 . VAL E 4 75 ? 74.930 -31.338 78.246 1.00 20.84 ? 79 VAL F CG2 1 ATOM 3414 N N . GLU E 4 76 ? 77.909 -29.657 78.660 1.00 63.69 ? 80 GLU F N 1 ATOM 3415 C CA . GLU E 4 76 ? 78.370 -28.391 79.247 1.00 63.69 ? 80 GLU F CA 1 ATOM 3416 C C . GLU E 4 76 ? 79.887 -28.139 79.158 1.00 63.69 ? 80 GLU F C 1 ATOM 3417 O O . GLU E 4 76 ? 80.684 -28.897 79.718 1.00 50.91 ? 80 GLU F O 1 ATOM 3418 C CB . GLU E 4 76 ? 77.910 -28.300 80.707 1.00 50.91 ? 80 GLU F CB 1 ATOM 3419 C CG . GLU E 4 76 ? 78.453 -29.389 81.615 1.00 50.91 ? 80 GLU F CG 1 ATOM 3420 C CD . GLU E 4 76 ? 78.715 -28.885 83.021 1.00 50.91 ? 80 GLU F CD 1 ATOM 3421 O OE1 . GLU E 4 76 ? 79.783 -28.271 83.257 1.00 50.91 ? 80 GLU F OE1 1 ATOM 3422 O OE2 . GLU E 4 76 ? 77.845 -29.093 83.891 1.00 50.91 ? 80 GLU F OE2 1 ATOM 3423 N N . LYS E 4 77 ? 80.284 -27.048 78.511 1.00 25.16 ? 81 LYS F N 1 ATOM 3424 C CA . LYS E 4 77 ? 81.708 -26.738 78.354 1.00 25.16 ? 81 LYS F CA 1 ATOM 3425 C C . LYS E 4 77 ? 82.277 -25.687 79.311 1.00 25.16 ? 81 LYS F C 1 ATOM 3426 O O . LYS E 4 77 ? 81.933 -24.508 79.217 1.00 57.14 ? 81 LYS F O 1 ATOM 3427 C CB . LYS E 4 77 ? 82.005 -26.327 76.910 1.00 57.14 ? 81 LYS F CB 1 ATOM 3428 C CG . LYS E 4 77 ? 81.750 -27.419 75.881 1.00 57.14 ? 81 LYS F CG 1 ATOM 3429 C CD . LYS E 4 77 ? 82.673 -28.606 76.084 1.00 57.14 ? 81 LYS F CD 1 ATOM 3430 C CE . LYS E 4 77 ? 82.427 -29.679 75.035 1.00 57.14 ? 81 LYS F CE 1 ATOM 3431 N NZ . LYS E 4 77 ? 81.086 -30.321 75.166 1.00 57.14 ? 81 LYS F NZ 1 ATOM 3432 N N . ILE E 4 78 ? 83.186 -26.102 80.194 1.00 72.49 ? 82 ILE F N 1 ATOM 3433 C CA . ILE E 4 78 ? 83.808 -25.175 81.151 1.00 72.49 ? 82 ILE F CA 1 ATOM 3434 C C . ILE E 4 78 ? 85.025 -24.464 80.577 1.00 72.49 ? 82 ILE F C 1 ATOM 3435 O O . ILE E 4 78 ? 86.054 -25.091 80.304 1.00 23.51 ? 82 ILE F O 1 ATOM 3436 C CB . ILE E 4 78 ? 84.316 -25.865 82.437 1.00 23.51 ? 82 ILE F CB 1 ATOM 3437 C CG1 . ILE E 4 78 ? 83.348 -26.948 82.907 1.00 23.51 ? 82 ILE F CG1 1 ATOM 3438 C CG2 . ILE E 4 78 ? 84.559 -24.819 83.516 1.00 23.51 ? 82 ILE F CG2 1 ATOM 3439 C CD1 . ILE E 4 78 ? 83.835 -28.358 82.613 1.00 23.51 ? 82 ILE F CD1 1 ATOM 3440 N N . SER E 4 79 ? 84.924 -23.152 80.433 1.00 46.84 ? 83 SER F N 1 ATOM 3441 C CA . SER E 4 79 ? 86.032 -22.381 79.908 1.00 46.84 ? 83 SER F CA 1 ATOM 3442 C C . SER E 4 79 ? 86.726 -21.649 81.043 1.00 46.84 ? 83 SER F C 1 ATOM 3443 O O . SER E 4 79 ? 86.472 -21.912 82.226 1.00 44.85 ? 83 SER F O 1 ATOM 3444 C CB . SER E 4 79 ? 85.519 -21.381 78.874 1.00 44.85 ? 83 SER F CB 1 ATOM 3445 O OG . SER E 4 79 ? 86.202 -21.540 77.647 1.00 44.85 ? 83 SER F OG 1 ATOM 3446 N N . MET E 4 80 ? 87.656 -20.781 80.666 1.00 38.23 ? 84 MET F N 1 ATOM 3447 C CA . MET E 4 80 ? 88.395 -19.955 81.605 1.00 38.23 ? 84 MET F CA 1 ATOM 3448 C C . MET E 4 80 ? 88.460 -18.598 80.942 1.00 38.23 ? 84 MET F C 1 ATOM 3449 O O . MET E 4 80 ? 88.302 -18.490 79.718 1.00 41.56 ? 84 MET F O 1 ATOM 3450 C CB . MET E 4 80 ? 89.794 -20.515 81.890 1.00 41.56 ? 84 MET F CB 1 ATOM 3451 C CG . MET E 4 80 ? 89.836 -21.457 83.098 1.00 41.56 ? 84 MET F CG 1 ATOM 3452 S SD . MET E 4 80 ? 89.215 -20.678 84.632 1.00 41.56 ? 84 MET F SD 1 ATOM 3453 C CE . MET E 4 80 ? 89.880 -21.811 85.844 1.00 41.56 ? 84 MET F CE 1 ATOM 3454 N N . LEU E 4 81 ? 88.613 -17.562 81.756 1.00 20.33 ? 85 LEU F N 1 ATOM 3455 C CA . LEU E 4 81 ? 88.668 -16.206 81.247 1.00 20.33 ? 85 LEU F CA 1 ATOM 3456 C C . LEU E 4 81 ? 90.091 -15.710 81.156 1.00 20.33 ? 85 LEU F C 1 ATOM 3457 O O . LEU E 4 81 ? 91.004 -16.301 81.725 1.00 70.28 ? 85 LEU F O 1 ATOM 3458 C CB . LEU E 4 81 ? 87.835 -15.269 82.124 1.00 70.28 ? 85 LEU F CB 1 ATOM 3459 C CG . LEU E 4 81 ? 86.355 -15.621 82.336 1.00 70.28 ? 85 LEU F CG 1 ATOM 3460 C CD1 . LEU E 4 81 ? 85.691 -15.907 80.989 1.00 70.28 ? 85 LEU F CD1 1 ATOM 3461 C CD2 . LEU E 4 81 ? 86.207 -16.822 83.278 1.00 70.28 ? 85 LEU F CD2 1 ATOM 3462 N N . ASP E 4 82 ? 90.274 -14.636 80.411 1.00 2.00 ? 86 ASP F N 1 ATOM 3463 C CA . ASP E 4 82 ? 91.575 -14.035 80.233 1.00 2.00 ? 86 ASP F CA 1 ATOM 3464 C C . ASP E 4 82 ? 91.244 -12.578 79.993 1.00 2.00 ? 86 ASP F C 1 ATOM 3465 O O . ASP E 4 82 ? 90.940 -12.194 78.872 1.00 67.53 ? 86 ASP F O 1 ATOM 3466 C CB . ASP E 4 82 ? 92.259 -14.642 79.008 1.00 67.53 ? 86 ASP F CB 1 ATOM 3467 C CG . ASP E 4 82 ? 93.713 -14.228 78.881 1.00 67.53 ? 86 ASP F CG 1 ATOM 3468 O OD1 . ASP E 4 82 ? 94.572 -14.936 79.451 1.00 67.53 ? 86 ASP F OD1 1 ATOM 3469 O OD2 . ASP E 4 82 ? 93.995 -13.207 78.208 1.00 67.53 ? 86 ASP F OD2 1 ATOM 3470 N N . LYS E 4 83 ? 91.257 -11.790 81.064 1.00 23.14 ? 87 LYS F N 1 ATOM 3471 C CA . LYS E 4 83 ? 90.931 -10.363 81.024 1.00 23.14 ? 87 LYS F CA 1 ATOM 3472 C C . LYS E 4 83 ? 89.435 -10.087 81.111 1.00 23.14 ? 87 LYS F C 1 ATOM 3473 O O . LYS E 4 83 ? 88.646 -10.641 80.348 1.00 43.92 ? 87 LYS F O 1 ATOM 3474 C CB . LYS E 4 83 ? 91.477 -9.674 79.764 1.00 43.92 ? 87 LYS F CB 1 ATOM 3475 C CG . LYS E 4 83 ? 92.812 -8.975 79.905 1.00 43.92 ? 87 LYS F CG 1 ATOM 3476 C CD . LYS E 4 83 ? 92.888 -7.840 78.876 1.00 43.92 ? 87 LYS F CD 1 ATOM 3477 C CE . LYS E 4 83 ? 94.229 -7.100 78.873 1.00 43.92 ? 87 LYS F CE 1 ATOM 3478 N NZ . LYS E 4 83 ? 95.332 -7.904 78.262 1.00 43.92 ? 87 LYS F NZ 1 ATOM 3479 N N . ILE E 4 84 ? 89.043 -9.286 82.096 1.00 33.12 ? 88 ILE F N 1 ATOM 3480 C CA . ILE E 4 84 ? 87.650 -8.888 82.242 1.00 33.12 ? 88 ILE F CA 1 ATOM 3481 C C . ILE E 4 84 ? 87.629 -7.374 82.051 1.00 33.12 ? 88 ILE F C 1 ATOM 3482 O O . ILE E 4 84 ? 88.624 -6.693 82.311 1.00 33.13 ? 88 ILE F O 1 ATOM 3483 C CB . ILE E 4 84 ? 87.002 -9.328 83.581 1.00 33.13 ? 88 ILE F CB 1 ATOM 3484 C CG1 . ILE E 4 84 ? 87.715 -8.691 84.770 1.00 33.13 ? 88 ILE F CG1 1 ATOM 3485 C CG2 . ILE E 4 84 ? 87.006 -10.858 83.684 1.00 33.13 ? 88 ILE F CG2 1 ATOM 3486 C CD1 . ILE E 4 84 ? 87.111 -9.053 86.104 1.00 33.13 ? 88 ILE F CD1 1 ATOM 3487 N N . TYR E 4 85 ? 86.530 -6.865 81.512 1.00 54.49 ? 89 TYR F N 1 ATOM 3488 C CA . TYR E 4 85 ? 86.394 -5.441 81.249 1.00 54.49 ? 89 TYR F CA 1 ATOM 3489 C C . TYR E 4 85 ? 85.196 -4.839 81.951 1.00 54.49 ? 89 TYR F C 1 ATOM 3490 O O . TYR E 4 85 ? 84.056 -5.014 81.512 1.00 38.59 ? 89 TYR F O 1 ATOM 3491 C CB . TYR E 4 85 ? 86.241 -5.190 79.744 1.00 38.59 ? 89 TYR F CB 1 ATOM 3492 C CG . TYR E 4 85 ? 87.524 -5.236 78.952 1.00 38.59 ? 89 TYR F CG 1 ATOM 3493 C CD1 . TYR E 4 85 ? 88.354 -4.116 78.885 1.00 38.59 ? 89 TYR F CD1 1 ATOM 3494 C CD2 . TYR E 4 85 ? 87.888 -6.378 78.228 1.00 38.59 ? 89 TYR F CD2 1 ATOM 3495 C CE1 . TYR E 4 85 ? 89.522 -4.122 78.109 1.00 38.59 ? 89 TYR F CE1 1 ATOM 3496 C CE2 . TYR E 4 85 ? 89.054 -6.401 77.448 1.00 38.59 ? 89 TYR F CE2 1 ATOM 3497 C CZ . TYR E 4 85 ? 89.868 -5.264 77.390 1.00 38.59 ? 89 TYR F CZ 1 ATOM 3498 O OH . TYR E 4 85 ? 91.009 -5.243 76.606 1.00 38.59 ? 89 TYR F OH 1 ATOM 3499 N N . ILE E 4 86 ? 85.456 -4.132 83.044 1.00 67.29 ? 90 ILE F N 1 ATOM 3500 C CA . ILE E 4 86 ? 84.396 -3.465 83.791 1.00 67.29 ? 90 ILE F CA 1 ATOM 3501 C C . ILE E 4 86 ? 84.281 -1.988 83.359 1.00 67.29 ? 90 ILE F C 1 ATOM 3502 O O . ILE E 4 86 ? 85.279 -1.284 83.174 1.00 10.53 ? 90 ILE F O 1 ATOM 3503 C CB . ILE E 4 86 ? 84.615 -3.603 85.316 1.00 10.53 ? 90 ILE F CB 1 ATOM 3504 C CG1 . ILE E 4 86 ? 84.582 -5.094 85.693 1.00 10.53 ? 90 ILE F CG1 1 ATOM 3505 C CG2 . ILE E 4 86 ? 83.590 -2.767 86.084 1.00 10.53 ? 90 ILE F CG2 1 ATOM 3506 C CD1 . ILE E 4 86 ? 84.432 -5.391 87.177 1.00 10.53 ? 90 ILE F CD1 1 ATOM 3507 N N . HIS E 4 87 ? 83.054 -1.553 83.121 1.00 8.80 ? 91 HIS F N 1 ATOM 3508 C CA . HIS E 4 87 ? 82.794 -0.189 82.696 1.00 8.80 ? 91 HIS F CA 1 ATOM 3509 C C . HIS E 4 87 ? 83.470 0.786 83.648 1.00 8.80 ? 91 HIS F C 1 ATOM 3510 O O . HIS E 4 87 ? 83.436 0.596 84.861 1.00 34.53 ? 91 HIS F O 1 ATOM 3511 C CB . HIS E 4 87 ? 81.285 0.049 82.689 1.00 34.53 ? 91 HIS F CB 1 ATOM 3512 C CG . HIS E 4 87 ? 80.841 1.147 81.775 1.00 34.53 ? 91 HIS F CG 1 ATOM 3513 N ND1 . HIS E 4 87 ? 79.526 1.537 81.670 1.00 34.53 ? 91 HIS F ND1 1 ATOM 3514 C CD2 . HIS E 4 87 ? 81.537 1.942 80.923 1.00 34.53 ? 91 HIS F CD2 1 ATOM 3515 C CE1 . HIS E 4 87 ? 79.428 2.527 80.800 1.00 34.53 ? 91 HIS F CE1 1 ATOM 3516 N NE2 . HIS E 4 87 ? 80.637 2.792 80.333 1.00 34.53 ? 91 HIS F NE2 1 ATOM 3517 N N . PRO E 4 88 ? 84.145 1.812 83.107 1.00 59.33 ? 92 PRO F N 1 ATOM 3518 C CA . PRO E 4 88 ? 84.824 2.807 83.946 1.00 59.33 ? 92 PRO F CA 1 ATOM 3519 C C . PRO E 4 88 ? 83.877 3.521 84.904 1.00 59.33 ? 92 PRO F C 1 ATOM 3520 O O . PRO E 4 88 ? 83.983 3.365 86.120 1.00 56.70 ? 92 PRO F O 1 ATOM 3521 C CB . PRO E 4 88 ? 85.420 3.786 82.918 1.00 56.70 ? 92 PRO F CB 1 ATOM 3522 C CG . PRO E 4 88 ? 84.588 3.563 81.671 1.00 56.70 ? 92 PRO F CG 1 ATOM 3523 C CD . PRO E 4 88 ? 84.439 2.060 81.687 1.00 56.70 ? 92 PRO F CD 1 ATOM 3524 N N . ARG E 4 89 ? 82.941 4.283 84.342 1.00 45.48 ? 93 ARG F N 1 ATOM 3525 C CA . ARG E 4 89 ? 81.974 5.039 85.130 1.00 45.48 ? 93 ARG F CA 1 ATOM 3526 C C . ARG E 4 89 ? 80.816 4.199 85.684 1.00 45.48 ? 93 ARG F C 1 ATOM 3527 O O . ARG E 4 89 ? 79.638 4.424 85.390 1.00 66.35 ? 93 ARG F O 1 ATOM 3528 C CB . ARG E 4 89 ? 81.484 6.253 84.336 1.00 66.35 ? 93 ARG F CB 1 ATOM 3529 C CG . ARG E 4 89 ? 82.634 7.157 83.887 1.00 66.35 ? 93 ARG F CG 1 ATOM 3530 C CD . ARG E 4 89 ? 82.170 8.552 83.478 1.00 66.35 ? 93 ARG F CD 1 ATOM 3531 N NE . ARG E 4 89 ? 81.438 8.584 82.211 1.00 66.35 ? 93 ARG F NE 1 ATOM 3532 C CZ . ARG E 4 89 ? 81.858 9.217 81.117 1.00 66.35 ? 93 ARG F CZ 1 ATOM 3533 N NH1 . ARG E 4 89 ? 83.020 9.860 81.113 1.00 66.35 ? 93 ARG F NH1 1 ATOM 3534 N NH2 . ARG E 4 89 ? 81.122 9.198 80.015 1.00 66.35 ? 93 ARG F NH2 1 ATOM 3535 N N . TYR E 4 90 ? 81.199 3.196 86.463 1.00 62.64 ? 94 TYR F N 1 ATOM 3536 C CA . TYR E 4 90 ? 80.294 2.279 87.137 1.00 62.64 ? 94 TYR F CA 1 ATOM 3537 C C . TYR E 4 90 ? 79.946 3.014 88.434 1.00 62.64 ? 94 TYR F C 1 ATOM 3538 O O . TYR E 4 90 ? 80.832 3.539 89.122 1.00 2.00 ? 94 TYR F O 1 ATOM 3539 C CB . TYR E 4 90 ? 81.072 0.993 87.443 1.00 2.00 ? 94 TYR F CB 1 ATOM 3540 C CG . TYR E 4 90 ? 80.397 -0.042 88.312 1.00 2.00 ? 94 TYR F CG 1 ATOM 3541 C CD1 . TYR E 4 90 ? 79.100 -0.465 88.053 1.00 2.00 ? 94 TYR F CD1 1 ATOM 3542 C CD2 . TYR E 4 90 ? 81.103 -0.680 89.339 1.00 2.00 ? 94 TYR F CD2 1 ATOM 3543 C CE1 . TYR E 4 90 ? 78.524 -1.511 88.787 1.00 2.00 ? 94 TYR F CE1 1 ATOM 3544 C CE2 . TYR E 4 90 ? 80.537 -1.726 90.076 1.00 2.00 ? 94 TYR F CE2 1 ATOM 3545 C CZ . TYR E 4 90 ? 79.250 -2.137 89.788 1.00 2.00 ? 94 TYR F CZ 1 ATOM 3546 O OH . TYR E 4 90 ? 78.698 -3.204 90.453 1.00 2.00 ? 94 TYR F OH 1 ATOM 3547 N N . ASN E 4 91 ? 78.663 3.102 88.752 1.00 14.06 ? 95 ASN F N 1 ATOM 3548 C CA . ASN E 4 91 ? 78.261 3.777 89.974 1.00 14.06 ? 95 ASN F CA 1 ATOM 3549 C C . ASN E 4 91 ? 77.888 2.739 91.021 1.00 14.06 ? 95 ASN F C 1 ATOM 3550 O O . ASN E 4 91 ? 76.722 2.543 91.321 1.00 67.13 ? 95 ASN F O 1 ATOM 3551 C CB . ASN E 4 91 ? 77.086 4.712 89.692 1.00 67.13 ? 95 ASN F CB 1 ATOM 3552 C CG . ASN E 4 91 ? 76.733 5.580 90.879 1.00 67.13 ? 95 ASN F CG 1 ATOM 3553 O OD1 . ASN E 4 91 ? 77.117 5.286 92.013 1.00 67.13 ? 95 ASN F OD1 1 ATOM 3554 N ND2 . ASN E 4 91 ? 75.999 6.661 90.630 1.00 67.13 ? 95 ASN F ND2 1 ATOM 3555 N N . TRP E 4 92 ? 78.894 2.089 91.587 1.00 2.00 ? 96 TRP F N 1 ATOM 3556 C CA . TRP E 4 92 ? 78.686 1.048 92.589 1.00 2.00 ? 96 TRP F CA 1 ATOM 3557 C C . TRP E 4 92 ? 78.011 1.563 93.844 1.00 2.00 ? 96 TRP F C 1 ATOM 3558 O O . TRP E 4 92 ? 77.218 0.856 94.469 1.00 80.84 ? 96 TRP F O 1 ATOM 3559 C CB . TRP E 4 92 ? 80.032 0.409 92.969 1.00 80.84 ? 96 TRP F CB 1 ATOM 3560 C CG . TRP E 4 92 ? 81.113 1.420 93.270 1.00 80.84 ? 96 TRP F CG 1 ATOM 3561 C CD1 . TRP E 4 92 ? 81.969 1.997 92.370 1.00 80.84 ? 96 TRP F CD1 1 ATOM 3562 C CD2 . TRP E 4 92 ? 81.401 2.027 94.541 1.00 80.84 ? 96 TRP F CD2 1 ATOM 3563 N NE1 . TRP E 4 92 ? 82.758 2.932 92.996 1.00 80.84 ? 96 TRP F NE1 1 ATOM 3564 C CE2 . TRP E 4 92 ? 82.432 2.972 94.326 1.00 80.84 ? 96 TRP F CE2 1 ATOM 3565 C CE3 . TRP E 4 92 ? 80.884 1.869 95.835 1.00 80.84 ? 96 TRP F CE3 1 ATOM 3566 C CZ2 . TRP E 4 92 ? 82.955 3.761 95.361 1.00 80.84 ? 96 TRP F CZ2 1 ATOM 3567 C CZ3 . TRP E 4 92 ? 81.403 2.651 96.861 1.00 80.84 ? 96 TRP F CZ3 1 ATOM 3568 C CH2 . TRP E 4 92 ? 82.429 3.587 96.617 1.00 80.84 ? 96 TRP F CH2 1 ATOM 3569 N N . LYS E 4 93 ? 78.329 2.799 94.206 1.00 34.75 ? 97 LYS F N 1 ATOM 3570 C CA . LYS E 4 93 ? 77.789 3.389 95.415 1.00 34.75 ? 97 LYS F CA 1 ATOM 3571 C C . LYS E 4 93 ? 76.369 3.933 95.346 1.00 34.75 ? 97 LYS F C 1 ATOM 3572 O O . LYS E 4 93 ? 75.455 3.382 95.958 1.00 33.49 ? 97 LYS F O 1 ATOM 3573 C CB . LYS E 4 93 ? 78.745 4.465 95.959 1.00 33.49 ? 97 LYS F CB 1 ATOM 3574 C CG . LYS E 4 93 ? 79.016 5.643 95.032 1.00 33.49 ? 97 LYS F CG 1 ATOM 3575 C CD . LYS E 4 93 ? 78.789 6.964 95.769 1.00 33.49 ? 97 LYS F CD 1 ATOM 3576 C CE . LYS E 4 93 ? 78.871 8.181 94.839 1.00 33.49 ? 97 LYS F CE 1 ATOM 3577 N NZ . LYS E 4 93 ? 78.573 9.475 95.548 1.00 33.49 ? 97 LYS F NZ 1 ATOM 3578 N N . GLU E 4 94 A 76.179 4.986 94.564 1.00 17.34 ? 97 GLU F N 1 ATOM 3579 C CA . GLU E 4 94 A 74.893 5.651 94.479 1.00 17.34 ? 97 GLU F CA 1 ATOM 3580 C C . GLU E 4 94 A 73.708 4.911 93.885 1.00 17.34 ? 97 GLU F C 1 ATOM 3581 O O . GLU E 4 94 A 72.612 5.006 94.432 1.00 34.08 ? 97 GLU F O 1 ATOM 3582 C CB . GLU E 4 94 A 75.059 7.018 93.809 1.00 34.08 ? 97 GLU F CB 1 ATOM 3583 C CG . GLU E 4 94 A 73.998 8.038 94.180 1.00 34.08 ? 97 GLU F CG 1 ATOM 3584 C CD . GLU E 4 94 A 72.829 8.077 93.208 1.00 34.08 ? 97 GLU F CD 1 ATOM 3585 O OE1 . GLU E 4 94 A 73.059 8.460 92.035 1.00 34.08 ? 97 GLU F OE1 1 ATOM 3586 O OE2 . GLU E 4 94 A 71.685 7.748 93.622 1.00 34.08 ? 97 GLU F OE2 1 ATOM 3587 N N . ASN E 4 95 ? 73.900 4.143 92.816 1.00 2.00 ? 98 ASN F N 1 ATOM 3588 C CA . ASN E 4 95 ? 72.744 3.490 92.192 1.00 2.00 ? 98 ASN F CA 1 ATOM 3589 C C . ASN E 4 95 ? 73.021 2.288 91.292 1.00 2.00 ? 98 ASN F C 1 ATOM 3590 O O . ASN E 4 95 ? 72.157 1.907 90.494 1.00 2.00 ? 98 ASN F O 1 ATOM 3591 C CB . ASN E 4 95 ? 71.985 4.534 91.364 1.00 2.00 ? 98 ASN F CB 1 ATOM 3592 C CG . ASN E 4 95 ? 72.894 5.266 90.401 1.00 2.00 ? 98 ASN F CG 1 ATOM 3593 O OD1 . ASN E 4 95 ? 73.885 4.710 89.945 1.00 2.00 ? 98 ASN F OD1 1 ATOM 3594 N ND2 . ASN E 4 95 ? 72.601 6.525 90.132 1.00 2.00 ? 98 ASN F ND2 1 ATOM 3595 N N . LEU E 4 96 ? 74.216 1.711 91.394 1.00 35.94 ? 99 LEU F N 1 ATOM 3596 C CA . LEU E 4 96 ? 74.613 0.558 90.572 1.00 35.94 ? 99 LEU F CA 1 ATOM 3597 C C . LEU E 4 96 ? 74.577 0.850 89.053 1.00 35.94 ? 99 LEU F C 1 ATOM 3598 O O . LEU E 4 96 ? 74.583 -0.073 88.236 1.00 2.00 ? 99 LEU F O 1 ATOM 3599 C CB . LEU E 4 96 ? 73.748 -0.665 90.918 1.00 2.00 ? 99 LEU F CB 1 ATOM 3600 C CG . LEU E 4 96 ? 74.448 -1.954 91.366 1.00 2.00 ? 99 LEU F CG 1 ATOM 3601 C CD1 . LEU E 4 96 ? 75.474 -1.673 92.455 1.00 2.00 ? 99 LEU F CD1 1 ATOM 3602 C CD2 . LEU E 4 96 ? 73.409 -2.955 91.853 1.00 2.00 ? 99 LEU F CD2 1 ATOM 3603 N N . ASP E 4 97 ? 74.589 2.135 88.694 1.00 2.00 ? 100 ASP F N 1 ATOM 3604 C CA . ASP E 4 97 ? 74.550 2.585 87.301 1.00 2.00 ? 100 ASP F CA 1 ATOM 3605 C C . ASP E 4 97 ? 75.662 1.915 86.475 1.00 2.00 ? 100 ASP F C 1 ATOM 3606 O O . ASP E 4 97 ? 76.688 1.493 87.025 1.00 2.00 ? 100 ASP F O 1 ATOM 3607 C CB . ASP E 4 97 ? 74.699 4.116 87.248 1.00 2.00 ? 100 ASP F CB 1 ATOM 3608 C CG . ASP E 4 97 ? 74.220 4.742 85.930 1.00 2.00 ? 100 ASP F CG 1 ATOM 3609 O OD1 . ASP E 4 97 ? 74.304 4.118 84.860 1.00 2.00 ? 100 ASP F OD1 1 ATOM 3610 O OD2 . ASP E 4 97 ? 73.791 5.909 85.962 1.00 2.00 ? 100 ASP F OD2 1 ATOM 3611 N N . ARG E 4 98 ? 75.430 1.804 85.164 1.00 2.00 ? 101 ARG F N 1 ATOM 3612 C CA . ARG E 4 98 ? 76.365 1.199 84.226 1.00 2.00 ? 101 ARG F CA 1 ATOM 3613 C C . ARG E 4 98 ? 76.900 -0.160 84.685 1.00 2.00 ? 101 ARG F C 1 ATOM 3614 O O . ARG E 4 98 ? 78.058 -0.509 84.451 1.00 12.20 ? 101 ARG F O 1 ATOM 3615 C CB . ARG E 4 98 ? 77.487 2.179 83.930 1.00 12.20 ? 101 ARG F CB 1 ATOM 3616 C CG . ARG E 4 98 ? 77.063 3.277 82.980 1.00 12.20 ? 101 ARG F CG 1 ATOM 3617 C CD . ARG E 4 98 ? 77.129 4.659 83.585 1.00 12.20 ? 101 ARG F CD 1 ATOM 3618 N NE . ARG E 4 98 ? 77.143 5.669 82.533 1.00 12.20 ? 101 ARG F NE 1 ATOM 3619 C CZ . ARG E 4 98 ? 77.543 6.922 82.707 1.00 12.20 ? 101 ARG F CZ 1 ATOM 3620 N NH1 . ARG E 4 98 ? 77.952 7.327 83.899 1.00 12.20 ? 101 ARG F NH1 1 ATOM 3621 N NH2 . ARG E 4 98 ? 77.526 7.776 81.691 1.00 12.20 ? 101 ARG F NH2 1 ATOM 3622 N N . ASP E 4 99 ? 75.987 -0.952 85.238 1.00 25.93 ? 102 ASP F N 1 ATOM 3623 C CA . ASP E 4 99 ? 76.236 -2.285 85.783 1.00 25.93 ? 102 ASP F CA 1 ATOM 3624 C C . ASP E 4 99 ? 76.513 -3.404 84.752 1.00 25.93 ? 102 ASP F C 1 ATOM 3625 O O . ASP E 4 99 ? 75.932 -4.487 84.830 1.00 14.86 ? 102 ASP F O 1 ATOM 3626 C CB . ASP E 4 99 ? 75.038 -2.663 86.687 1.00 14.86 ? 102 ASP F CB 1 ATOM 3627 C CG . ASP E 4 99 ? 75.281 -3.918 87.531 1.00 14.86 ? 102 ASP F CG 1 ATOM 3628 O OD1 . ASP E 4 99 ? 76.442 -4.255 87.818 1.00 14.86 ? 102 ASP F OD1 1 ATOM 3629 O OD2 . ASP E 4 99 ? 74.303 -4.587 87.908 1.00 14.86 ? 102 ASP F OD2 1 ATOM 3630 N N . ILE E 4 100 ? 77.392 -3.152 83.789 1.00 18.77 ? 103 ILE F N 1 ATOM 3631 C CA . ILE E 4 100 ? 77.728 -4.178 82.798 1.00 18.77 ? 103 ILE F CA 1 ATOM 3632 C C . ILE E 4 100 ? 79.198 -4.604 82.871 1.00 18.77 ? 103 ILE F C 1 ATOM 3633 O O . ILE E 4 100 ? 80.054 -3.876 83.406 1.00 15.11 ? 103 ILE F O 1 ATOM 3634 C CB . ILE E 4 100 ? 77.399 -3.753 81.332 1.00 15.11 ? 103 ILE F CB 1 ATOM 3635 C CG1 . ILE E 4 100 ? 77.758 -2.289 81.079 1.00 15.11 ? 103 ILE F CG1 1 ATOM 3636 C CG2 . ILE E 4 100 ? 75.949 -4.035 81.008 1.00 15.11 ? 103 ILE F CG2 1 ATOM 3637 C CD1 . ILE E 4 100 ? 77.715 -1.925 79.617 1.00 15.11 ? 103 ILE F CD1 1 ATOM 3638 N N . ALA E 4 101 ? 79.488 -5.780 82.320 1.00 21.51 ? 104 ALA F N 1 ATOM 3639 C CA . ALA E 4 101 ? 80.846 -6.311 82.315 1.00 21.51 ? 104 ALA F CA 1 ATOM 3640 C C . ALA E 4 101 ? 81.058 -7.449 81.317 1.00 21.51 ? 104 ALA F C 1 ATOM 3641 O O . ALA E 4 101 ? 80.276 -8.403 81.248 1.00 9.68 ? 104 ALA F O 1 ATOM 3642 C CB . ALA E 4 101 ? 81.235 -6.771 83.714 1.00 9.68 ? 104 ALA F CB 1 ATOM 3643 N N . LEU E 4 102 ? 82.138 -7.333 80.557 1.00 27.29 ? 105 LEU F N 1 ATOM 3644 C CA . LEU E 4 102 ? 82.517 -8.324 79.566 1.00 27.29 ? 105 LEU F CA 1 ATOM 3645 C C . LEU E 4 102 ? 83.631 -9.231 80.088 1.00 27.29 ? 105 LEU F C 1 ATOM 3646 O O . LEU E 4 102 ? 84.427 -8.827 80.936 1.00 23.46 ? 105 LEU F O 1 ATOM 3647 C CB . LEU E 4 102 ? 82.988 -7.610 78.302 1.00 23.46 ? 105 LEU F CB 1 ATOM 3648 C CG . LEU E 4 102 ? 81.860 -7.107 77.411 1.00 23.46 ? 105 LEU F CG 1 ATOM 3649 C CD1 . LEU E 4 102 ? 82.224 -5.801 76.746 1.00 23.46 ? 105 LEU F CD1 1 ATOM 3650 C CD2 . LEU E 4 102 ? 81.541 -8.179 76.382 1.00 23.46 ? 105 LEU F CD2 1 ATOM 3651 N N . LEU E 4 103 ? 83.684 -10.459 79.587 1.00 26.42 ? 106 LEU F N 1 ATOM 3652 C CA . LEU E 4 103 ? 84.719 -11.411 79.988 1.00 26.42 ? 106 LEU F CA 1 ATOM 3653 C C . LEU E 4 103 ? 85.236 -12.090 78.731 1.00 26.42 ? 106 LEU F C 1 ATOM 3654 O O . LEU E 4 103 ? 84.469 -12.731 78.007 1.00 2.00 ? 106 LEU F O 1 ATOM 3655 C CB . LEU E 4 103 ? 84.164 -12.504 80.906 1.00 2.00 ? 106 LEU F CB 1 ATOM 3656 C CG . LEU E 4 103 ? 83.081 -12.198 81.929 1.00 2.00 ? 106 LEU F CG 1 ATOM 3657 C CD1 . LEU E 4 103 ? 82.714 -13.498 82.609 1.00 2.00 ? 106 LEU F CD1 1 ATOM 3658 C CD2 . LEU E 4 103 ? 83.542 -11.153 82.930 1.00 2.00 ? 106 LEU F CD2 1 ATOM 3659 N N . LYS E 4 104 ? 86.512 -11.890 78.436 1.00 17.26 ? 107 LYS F N 1 ATOM 3660 C CA . LYS E 4 104 ? 87.125 -12.515 77.281 1.00 17.26 ? 107 LYS F CA 1 ATOM 3661 C C . LYS E 4 104 ? 87.394 -13.957 77.658 1.00 17.26 ? 107 LYS F C 1 ATOM 3662 O O . LYS E 4 104 ? 87.667 -14.255 78.825 1.00 45.26 ? 107 LYS F O 1 ATOM 3663 C CB . LYS E 4 104 ? 88.436 -11.811 76.930 1.00 45.26 ? 107 LYS F CB 1 ATOM 3664 C CG . LYS E 4 104 ? 89.251 -12.455 75.803 1.00 45.26 ? 107 LYS F CG 1 ATOM 3665 C CD . LYS E 4 104 ? 88.571 -12.360 74.447 1.00 45.26 ? 107 LYS F CD 1 ATOM 3666 C CE . LYS E 4 104 ? 89.485 -12.875 73.336 1.00 45.26 ? 107 LYS F CE 1 ATOM 3667 N NZ . LYS E 4 104 ? 89.748 -14.341 73.400 1.00 45.26 ? 107 LYS F NZ 1 ATOM 3668 N N . LEU E 4 105 ? 87.252 -14.854 76.688 1.00 37.72 ? 108 LEU F N 1 ATOM 3669 C CA . LEU E 4 105 ? 87.508 -16.273 76.914 1.00 37.72 ? 108 LEU F CA 1 ATOM 3670 C C . LEU E 4 105 ? 88.943 -16.585 76.530 1.00 37.72 ? 108 LEU F C 1 ATOM 3671 O O . LEU E 4 105 ? 89.441 -16.099 75.514 1.00 12.15 ? 108 LEU F O 1 ATOM 3672 C CB . LEU E 4 105 ? 86.563 -17.147 76.080 1.00 12.15 ? 108 LEU F CB 1 ATOM 3673 C CG . LEU E 4 105 ? 85.128 -17.353 76.569 1.00 12.15 ? 108 LEU F CG 1 ATOM 3674 C CD1 . LEU E 4 105 ? 84.427 -18.327 75.633 1.00 12.15 ? 108 LEU F CD1 1 ATOM 3675 C CD2 . LEU E 4 105 ? 85.115 -17.879 78.009 1.00 12.15 ? 108 LEU F CD2 1 ATOM 3676 N N . LYS E 4 106 ? 89.612 -17.386 77.347 1.00 8.64 ? 109 LYS F N 1 ATOM 3677 C CA . LYS E 4 106 ? 90.990 -17.750 77.067 1.00 8.64 ? 109 LYS F CA 1 ATOM 3678 C C . LYS E 4 106 ? 91.005 -18.626 75.821 1.00 8.64 ? 109 LYS F C 1 ATOM 3679 O O . LYS E 4 106 ? 91.957 -18.598 75.040 1.00 47.93 ? 109 LYS F O 1 ATOM 3680 C CB . LYS E 4 106 ? 91.584 -18.510 78.256 1.00 47.93 ? 109 LYS F CB 1 ATOM 3681 C CG . LYS E 4 106 ? 93.097 -18.621 78.214 1.00 47.93 ? 109 LYS F CG 1 ATOM 3682 C CD . LYS E 4 106 ? 93.669 -19.134 79.527 1.00 47.93 ? 109 LYS F CD 1 ATOM 3683 C CE . LYS E 4 106 ? 95.197 -19.027 79.546 1.00 47.93 ? 109 LYS F CE 1 ATOM 3684 N NZ . LYS E 4 106 ? 95.885 -19.849 78.500 1.00 47.93 ? 109 LYS F NZ 1 ATOM 3685 N N . ARG E 4 107 ? 89.919 -19.368 75.621 1.00 38.12 ? 110 ARG F N 1 ATOM 3686 C CA . ARG E 4 107 ? 89.791 -20.271 74.481 1.00 38.12 ? 110 ARG F CA 1 ATOM 3687 C C . ARG E 4 107 ? 88.459 -20.102 73.764 1.00 38.12 ? 110 ARG F C 1 ATOM 3688 O O . ARG E 4 107 ? 87.413 -20.084 74.408 1.00 74.38 ? 110 ARG F O 1 ATOM 3689 C CB . ARG E 4 107 ? 89.843 -21.729 74.971 1.00 74.38 ? 110 ARG F CB 1 ATOM 3690 C CG . ARG E 4 107 ? 91.012 -22.112 75.876 1.00 74.38 ? 110 ARG F CG 1 ATOM 3691 C CD . ARG E 4 107 ? 92.209 -22.583 75.063 1.00 74.38 ? 110 ARG F CD 1 ATOM 3692 N NE . ARG E 4 107 ? 91.847 -23.666 74.148 1.00 74.38 ? 110 ARG F NE 1 ATOM 3693 C CZ . ARG E 4 107 ? 92.192 -24.939 74.312 1.00 74.38 ? 110 ARG F CZ 1 ATOM 3694 N NH1 . ARG E 4 107 ? 92.928 -25.302 75.353 1.00 74.38 ? 110 ARG F NH1 1 ATOM 3695 N NH2 . ARG E 4 107 ? 91.810 -25.850 73.427 1.00 74.38 ? 110 ARG F NH2 1 ATOM 3696 N N . PRO E 4 108 ? 88.474 -19.905 72.439 1.00 15.67 ? 111 PRO F N 1 ATOM 3697 C CA . PRO E 4 108 ? 87.181 -19.766 71.763 1.00 15.67 ? 111 PRO F CA 1 ATOM 3698 C C . PRO E 4 108 ? 86.529 -21.146 71.877 1.00 15.67 ? 111 PRO F C 1 ATOM 3699 O O . PRO E 4 108 ? 87.132 -22.160 71.514 1.00 46.66 ? 111 PRO F O 1 ATOM 3700 C CB . PRO E 4 108 ? 87.589 -19.432 70.330 1.00 46.66 ? 111 PRO F CB 1 ATOM 3701 C CG . PRO E 4 108 ? 88.835 -18.623 70.538 1.00 46.66 ? 111 PRO F CG 1 ATOM 3702 C CD . PRO E 4 108 ? 89.569 -19.470 71.559 1.00 46.66 ? 111 PRO F CD 1 ATOM 3703 N N . ILE E 4 109 ? 85.346 -21.176 72.478 1.00 33.28 ? 112 ILE F N 1 ATOM 3704 C CA . ILE E 4 109 ? 84.603 -22.404 72.712 1.00 33.28 ? 112 ILE F CA 1 ATOM 3705 C C . ILE E 4 109 ? 84.050 -23.136 71.490 1.00 33.28 ? 112 ILE F C 1 ATOM 3706 O O . ILE E 4 109 ? 83.868 -22.550 70.417 1.00 42.16 ? 112 ILE F O 1 ATOM 3707 C CB . ILE E 4 109 ? 83.468 -22.171 73.743 1.00 42.16 ? 112 ILE F CB 1 ATOM 3708 C CG1 . ILE E 4 109 ? 82.911 -20.734 73.658 1.00 42.16 ? 112 ILE F CG1 1 ATOM 3709 C CG2 . ILE E 4 109 ? 83.990 -22.449 75.145 1.00 42.16 ? 112 ILE F CG2 1 ATOM 3710 C CD1 . ILE E 4 109 ? 82.298 -20.343 72.325 1.00 42.16 ? 112 ILE F CD1 1 ATOM 3711 N N . GLU E 4 110 ? 83.789 -24.430 71.673 1.00 14.28 ? 113 GLU F N 1 ATOM 3712 C CA . GLU E 4 110 ? 83.241 -25.267 70.619 1.00 14.28 ? 113 GLU F CA 1 ATOM 3713 C C . GLU E 4 110 ? 81.713 -25.213 70.676 1.00 14.28 ? 113 GLU F C 1 ATOM 3714 O O . GLU E 4 110 ? 81.068 -25.978 71.402 1.00 51.97 ? 113 GLU F O 1 ATOM 3715 C CB . GLU E 4 110 ? 83.749 -26.707 70.755 1.00 51.97 ? 113 GLU F CB 1 ATOM 3716 C CG . GLU E 4 110 ? 83.453 -27.600 69.536 1.00 51.97 ? 113 GLU F CG 1 ATOM 3717 C CD . GLU E 4 110 ? 84.092 -27.097 68.235 1.00 51.97 ? 113 GLU F CD 1 ATOM 3718 O OE1 . GLU E 4 110 ? 85.215 -26.549 68.283 1.00 51.97 ? 113 GLU F OE1 1 ATOM 3719 O OE2 . GLU E 4 110 ? 83.474 -27.262 67.157 1.00 51.97 ? 113 GLU F OE2 1 ATOM 3720 N N . LEU E 4 111 ? 81.168 -24.259 69.922 1.00 45.50 ? 114 LEU F N 1 ATOM 3721 C CA . LEU E 4 111 ? 79.736 -23.988 69.796 1.00 45.50 ? 114 LEU F CA 1 ATOM 3722 C C . LEU E 4 111 ? 78.870 -25.208 69.449 1.00 45.50 ? 114 LEU F C 1 ATOM 3723 O O . LEU E 4 111 ? 78.920 -25.733 68.335 1.00 2.00 ? 114 LEU F O 1 ATOM 3724 C CB . LEU E 4 111 ? 79.551 -22.923 68.726 1.00 2.00 ? 114 LEU F CB 1 ATOM 3725 C CG . LEU E 4 111 ? 78.961 -21.586 69.127 1.00 2.00 ? 114 LEU F CG 1 ATOM 3726 C CD1 . LEU E 4 111 ? 79.956 -20.475 68.836 1.00 2.00 ? 114 LEU F CD1 1 ATOM 3727 C CD2 . LEU E 4 111 ? 77.672 -21.381 68.341 1.00 2.00 ? 114 LEU F CD2 1 ATOM 3728 N N . SER E 4 112 ? 78.024 -25.615 70.385 1.00 24.83 ? 115 SER F N 1 ATOM 3729 C CA . SER E 4 112 ? 77.172 -26.771 70.168 1.00 24.83 ? 115 SER F CA 1 ATOM 3730 C C . SER E 4 112 ? 75.711 -26.375 70.052 1.00 24.83 ? 115 SER F C 1 ATOM 3731 O O . SER E 4 112 ? 75.364 -25.196 70.083 1.00 34.74 ? 115 SER F O 1 ATOM 3732 C CB . SER E 4 112 ? 77.354 -27.778 71.320 1.00 34.74 ? 115 SER F CB 1 ATOM 3733 O OG . SER E 4 112 ? 76.884 -27.271 72.563 1.00 34.74 ? 115 SER F OG 1 ATOM 3734 N N . ASP E 4 113 ? 74.855 -27.389 70.009 1.00 31.92 ? 116 ASP F N 1 ATOM 3735 C CA . ASP E 4 113 ? 73.418 -27.200 69.931 1.00 31.92 ? 116 ASP F CA 1 ATOM 3736 C C . ASP E 4 113 ? 72.910 -26.675 71.261 1.00 31.92 ? 116 ASP F C 1 ATOM 3737 O O . ASP E 4 113 ? 71.705 -26.580 71.471 1.00 76.74 ? 116 ASP F O 1 ATOM 3738 C CB . ASP E 4 113 ? 72.725 -28.532 69.635 1.00 76.74 ? 116 ASP F CB 1 ATOM 3739 C CG . ASP E 4 113 ? 72.927 -29.000 68.209 1.00 76.74 ? 116 ASP F CG 1 ATOM 3740 O OD1 . ASP E 4 113 ? 73.672 -28.345 67.451 1.00 76.74 ? 116 ASP F OD1 1 ATOM 3741 O OD2 . ASP E 4 113 ? 72.324 -30.029 67.843 1.00 76.74 ? 116 ASP F OD2 1 ATOM 3742 N N . TYR E 4 114 ? 73.832 -26.368 72.166 1.00 25.09 ? 117 TYR F N 1 ATOM 3743 C CA . TYR E 4 114 ? 73.489 -25.873 73.496 1.00 25.09 ? 117 TYR F CA 1 ATOM 3744 C C . TYR E 4 114 ? 74.273 -24.609 73.847 1.00 25.09 ? 117 TYR F C 1 ATOM 3745 O O . TYR E 4 114 ? 73.898 -23.860 74.752 1.00 2.00 ? 117 TYR F O 1 ATOM 3746 C CB . TYR E 4 114 ? 73.751 -26.977 74.527 1.00 2.00 ? 117 TYR F CB 1 ATOM 3747 C CG . TYR E 4 114 ? 72.993 -28.244 74.212 1.00 2.00 ? 117 TYR F CG 1 ATOM 3748 C CD1 . TYR E 4 114 ? 73.538 -29.211 73.392 1.00 2.00 ? 117 TYR F CD1 1 ATOM 3749 C CD2 . TYR E 4 114 ? 71.712 -28.451 74.706 1.00 2.00 ? 117 TYR F CD2 1 ATOM 3750 C CE1 . TYR E 4 114 ? 72.828 -30.356 73.068 1.00 2.00 ? 117 TYR F CE1 1 ATOM 3751 C CE2 . TYR E 4 114 ? 70.994 -29.589 74.390 1.00 2.00 ? 117 TYR F CE2 1 ATOM 3752 C CZ . TYR E 4 114 ? 71.556 -30.539 73.573 1.00 2.00 ? 117 TYR F CZ 1 ATOM 3753 O OH . TYR E 4 114 ? 70.853 -31.687 73.277 1.00 2.00 ? 117 TYR F OH 1 ATOM 3754 N N . ILE E 4 115 ? 75.373 -24.399 73.129 1.00 12.12 ? 118 ILE F N 1 ATOM 3755 C CA . ILE E 4 115 ? 76.240 -23.245 73.328 1.00 12.12 ? 118 ILE F CA 1 ATOM 3756 C C . ILE E 4 115 ? 76.128 -22.413 72.074 1.00 12.12 ? 118 ILE F C 1 ATOM 3757 O O . ILE E 4 115 ? 76.871 -22.612 71.119 1.00 2.00 ? 118 ILE F O 1 ATOM 3758 C CB . ILE E 4 115 ? 77.736 -23.652 73.504 1.00 2.00 ? 118 ILE F CB 1 ATOM 3759 C CG1 . ILE E 4 115 ? 77.905 -24.620 74.688 1.00 2.00 ? 118 ILE F CG1 1 ATOM 3760 C CG2 . ILE E 4 115 ? 78.610 -22.397 73.645 1.00 2.00 ? 118 ILE F CG2 1 ATOM 3761 C CD1 . ILE E 4 115 ? 79.323 -25.080 74.921 1.00 2.00 ? 118 ILE F CD1 1 ATOM 3762 N N . HIS E 4 116 ? 75.151 -21.525 72.055 1.00 35.62 ? 119 HIS F N 1 ATOM 3763 C CA . HIS E 4 116 ? 74.941 -20.666 70.906 1.00 35.62 ? 119 HIS F CA 1 ATOM 3764 C C . HIS E 4 116 ? 74.707 -19.266 71.454 1.00 35.62 ? 119 HIS F C 1 ATOM 3765 O O . HIS E 4 116 ? 74.008 -19.098 72.451 1.00 23.52 ? 119 HIS F O 1 ATOM 3766 C CB . HIS E 4 116 ? 73.734 -21.150 70.112 1.00 23.52 ? 119 HIS F CB 1 ATOM 3767 C CG . HIS E 4 116 ? 73.666 -20.602 68.724 1.00 23.52 ? 119 HIS F CG 1 ATOM 3768 N ND1 . HIS E 4 116 ? 74.331 -21.180 67.667 1.00 23.52 ? 119 HIS F ND1 1 ATOM 3769 C CD2 . HIS E 4 116 ? 72.981 -19.551 68.213 1.00 23.52 ? 119 HIS F CD2 1 ATOM 3770 C CE1 . HIS E 4 116 ? 74.054 -20.514 66.561 1.00 23.52 ? 119 HIS F CE1 1 ATOM 3771 N NE2 . HIS E 4 116 ? 73.238 -19.521 66.866 1.00 23.52 ? 119 HIS F NE2 1 ATOM 3772 N N . PRO E 4 117 ? 75.314 -18.250 70.825 1.00 2.00 ? 120 PRO F N 1 ATOM 3773 C CA . PRO E 4 117 ? 75.195 -16.850 71.235 1.00 2.00 ? 120 PRO F CA 1 ATOM 3774 C C . PRO E 4 117 ? 73.861 -16.172 70.983 1.00 2.00 ? 120 PRO F C 1 ATOM 3775 O O . PRO E 4 117 ? 73.018 -16.679 70.243 1.00 20.05 ? 120 PRO F O 1 ATOM 3776 C CB . PRO E 4 117 ? 76.309 -16.175 70.430 1.00 20.05 ? 120 PRO F CB 1 ATOM 3777 C CG . PRO E 4 117 ? 76.357 -16.976 69.189 1.00 20.05 ? 120 PRO F CG 1 ATOM 3778 C CD . PRO E 4 117 ? 76.274 -18.384 69.717 1.00 20.05 ? 120 PRO F CD 1 ATOM 3779 N N . VAL E 4 118 ? 73.699 -15.013 71.613 1.00 2.00 ? 121 VAL F N 1 ATOM 3780 C CA . VAL E 4 118 ? 72.511 -14.169 71.494 1.00 2.00 ? 121 VAL F CA 1 ATOM 3781 C C . VAL E 4 118 ? 72.943 -12.911 70.701 1.00 2.00 ? 121 VAL F C 1 ATOM 3782 O O . VAL E 4 118 ? 74.147 -12.687 70.495 1.00 2.00 ? 121 VAL F O 1 ATOM 3783 C CB . VAL E 4 118 ? 71.955 -13.785 72.907 1.00 2.00 ? 121 VAL F CB 1 ATOM 3784 C CG1 . VAL E 4 118 ? 72.879 -12.812 73.637 1.00 2.00 ? 121 VAL F CG1 1 ATOM 3785 C CG2 . VAL E 4 118 ? 70.559 -13.240 72.790 1.00 2.00 ? 121 VAL F CG2 1 ATOM 3786 N N . CYS E 4 119 ? 71.982 -12.141 70.190 1.00 19.20 ? 122 CYS F N 1 ATOM 3787 C CA . CYS E 4 119 ? 72.321 -10.929 69.432 1.00 19.20 ? 122 CYS F CA 1 ATOM 3788 C C . CYS E 4 119 ? 72.344 -9.723 70.353 1.00 19.20 ? 122 CYS F C 1 ATOM 3789 O O . CYS E 4 119 ? 72.018 -9.823 71.539 1.00 2.00 ? 122 CYS F O 1 ATOM 3790 C CB . CYS E 4 119 ? 71.303 -10.623 68.317 1.00 2.00 ? 122 CYS F CB 1 ATOM 3791 S SG . CYS E 4 119 ? 70.902 -11.952 67.153 1.00 2.00 ? 122 CYS F SG 1 ATOM 3792 N N . LEU E 4 120 ? 72.753 -8.588 69.802 1.00 2.00 ? 123 LEU F N 1 ATOM 3793 C CA . LEU E 4 120 ? 72.746 -7.330 70.529 1.00 2.00 ? 123 LEU F CA 1 ATOM 3794 C C . LEU E 4 120 ? 71.716 -6.464 69.782 1.00 2.00 ? 123 LEU F C 1 ATOM 3795 O O . LEU E 4 120 ? 71.468 -6.660 68.583 1.00 2.00 ? 123 LEU F O 1 ATOM 3796 C CB . LEU E 4 120 ? 74.143 -6.708 70.596 1.00 2.00 ? 123 LEU F CB 1 ATOM 3797 C CG . LEU E 4 120 ? 75.066 -7.536 71.501 1.00 2.00 ? 123 LEU F CG 1 ATOM 3798 C CD1 . LEU E 4 120 ? 76.468 -6.950 71.552 1.00 2.00 ? 123 LEU F CD1 1 ATOM 3799 C CD2 . LEU E 4 120 ? 74.471 -7.619 72.897 1.00 2.00 ? 123 LEU F CD2 1 ATOM 3800 N N . PRO E 4 121 ? 71.084 -5.507 70.475 1.00 6.99 ? 124 PRO F N 1 ATOM 3801 C CA . PRO E 4 121 ? 70.082 -4.697 69.778 1.00 6.99 ? 124 PRO F CA 1 ATOM 3802 C C . PRO E 4 121 ? 70.504 -3.653 68.729 1.00 6.99 ? 124 PRO F C 1 ATOM 3803 O O . PRO E 4 121 ? 71.484 -2.930 68.892 1.00 2.00 ? 124 PRO F O 1 ATOM 3804 C CB . PRO E 4 121 ? 69.280 -4.106 70.936 1.00 2.00 ? 124 PRO F CB 1 ATOM 3805 C CG . PRO E 4 121 ? 70.349 -3.872 71.976 1.00 2.00 ? 124 PRO F CG 1 ATOM 3806 C CD . PRO E 4 121 ? 71.271 -5.060 71.872 1.00 2.00 ? 124 PRO F CD 1 ATOM 3807 N N . ASP E 4 122 ? 69.760 -3.613 67.627 1.00 2.00 ? 125 ASP F N 1 ATOM 3808 C CA . ASP E 4 122 ? 70.013 -2.643 66.563 1.00 2.00 ? 125 ASP F CA 1 ATOM 3809 C C . ASP E 4 122 ? 69.475 -1.311 67.097 1.00 2.00 ? 125 ASP F C 1 ATOM 3810 O O . ASP E 4 122 ? 69.076 -1.194 68.258 1.00 19.82 ? 125 ASP F O 1 ATOM 3811 C CB . ASP E 4 122 ? 69.194 -2.969 65.290 1.00 19.82 ? 125 ASP F CB 1 ATOM 3812 C CG . ASP E 4 122 ? 69.698 -4.179 64.525 1.00 19.82 ? 125 ASP F CG 1 ATOM 3813 O OD1 . ASP E 4 122 ? 69.240 -5.318 64.784 1.00 19.82 ? 125 ASP F OD1 1 ATOM 3814 O OD2 . ASP E 4 122 ? 70.510 -3.970 63.603 1.00 19.82 ? 125 ASP F OD2 1 ATOM 3815 N N . LYS E 4 123 ? 69.346 -0.359 66.180 1.00 43.44 ? 126 LYS F N 1 ATOM 3816 C CA . LYS E 4 123 ? 68.808 0.971 66.451 1.00 43.44 ? 126 LYS F CA 1 ATOM 3817 C C . LYS E 4 123 ? 67.474 0.966 65.703 1.00 43.44 ? 126 LYS F C 1 ATOM 3818 O O . LYS E 4 123 ? 67.016 1.982 65.188 1.00 27.84 ? 126 LYS F O 1 ATOM 3819 C CB . LYS E 4 123 ? 69.754 2.029 65.860 1.00 27.84 ? 126 LYS F CB 1 ATOM 3820 C CG . LYS E 4 123 ? 69.390 3.486 66.118 1.00 27.84 ? 126 LYS F CG 1 ATOM 3821 C CD . LYS E 4 123 ? 70.203 4.398 65.207 1.00 27.84 ? 126 LYS F CD 1 ATOM 3822 C CE . LYS E 4 123 ? 69.738 5.841 65.297 1.00 27.84 ? 126 LYS F CE 1 ATOM 3823 N NZ . LYS E 4 123 ? 70.383 6.731 64.289 1.00 27.84 ? 126 LYS F NZ 1 ATOM 3824 N N . GLN E 4 124 ? 66.894 -0.226 65.612 1.00 11.88 ? 127 GLN F N 1 ATOM 3825 C CA . GLN E 4 124 ? 65.628 -0.458 64.933 1.00 11.88 ? 127 GLN F CA 1 ATOM 3826 C C . GLN E 4 124 ? 64.909 -1.468 65.800 1.00 11.88 ? 127 GLN F C 1 ATOM 3827 O O . GLN E 4 124 ? 63.700 -1.374 66.009 1.00 41.92 ? 127 GLN F O 1 ATOM 3828 C CB . GLN E 4 124 ? 65.882 -1.045 63.538 1.00 41.92 ? 127 GLN F CB 1 ATOM 3829 C CG . GLN E 4 124 ? 64.632 -1.238 62.662 1.00 41.92 ? 127 GLN F CG 1 ATOM 3830 C CD . GLN E 4 124 ? 63.985 0.076 62.195 1.00 41.92 ? 127 GLN F CD 1 ATOM 3831 O OE1 . GLN E 4 124 ? 64.671 1.009 61.769 1.00 41.92 ? 127 GLN F OE1 1 ATOM 3832 N NE2 . GLN E 4 124 ? 62.654 0.133 62.247 1.00 41.92 ? 127 GLN F NE2 1 ATOM 3833 N N . THR E 4 125 ? 65.679 -2.411 66.342 1.00 16.33 ? 128 THR F N 1 ATOM 3834 C CA . THR E 4 125 ? 65.134 -3.449 67.212 1.00 16.33 ? 128 THR F CA 1 ATOM 3835 C C . THR E 4 125 ? 64.929 -2.844 68.588 1.00 16.33 ? 128 THR F C 1 ATOM 3836 O O . THR E 4 125 ? 63.869 -3.006 69.188 1.00 10.28 ? 128 THR F O 1 ATOM 3837 C CB . THR E 4 125 ? 66.085 -4.646 67.338 1.00 10.28 ? 128 THR F CB 1 ATOM 3838 O OG1 . THR E 4 125 ? 67.047 -4.598 66.281 1.00 10.28 ? 128 THR F OG1 1 ATOM 3839 C CG2 . THR E 4 125 ? 65.309 -5.958 67.240 1.00 10.28 ? 128 THR F CG2 1 ATOM 3840 N N . ALA E 4 126 ? 65.915 -2.087 69.057 1.00 2.00 ? 129 ALA F N 1 ATOM 3841 C CA . ALA E 4 126 ? 65.816 -1.451 70.361 1.00 2.00 ? 129 ALA F CA 1 ATOM 3842 C C . ALA E 4 126 ? 65.019 -0.153 70.287 1.00 2.00 ? 129 ALA F C 1 ATOM 3843 O O . ALA E 4 126 ? 65.367 0.847 70.919 1.00 12.96 ? 129 ALA F O 1 ATOM 3844 C CB . ALA E 4 126 ? 67.186 -1.192 70.908 1.00 12.96 ? 129 ALA F CB 1 ATOM 3845 N N . ALA E 4 127 A 63.937 -0.192 69.520 1.00 2.00 ? 129 ALA F N 1 ATOM 3846 C CA . ALA E 4 127 A 63.059 0.953 69.319 1.00 2.00 ? 129 ALA F CA 1 ATOM 3847 C C . ALA E 4 127 A 61.677 0.434 68.935 1.00 2.00 ? 129 ALA F C 1 ATOM 3848 O O . ALA E 4 127 A 60.667 1.116 69.090 1.00 20.73 ? 129 ALA F O 1 ATOM 3849 C CB . ALA E 4 127 A 63.613 1.855 68.226 1.00 20.73 ? 129 ALA F CB 1 ATOM 3850 N N . LYS E 4 128 B 61.648 -0.783 68.419 1.00 2.00 ? 129 LYS F N 1 ATOM 3851 C CA . LYS E 4 128 B 60.411 -1.425 68.020 1.00 2.00 ? 129 LYS F CA 1 ATOM 3852 C C . LYS E 4 128 B 60.018 -2.441 69.093 1.00 2.00 ? 129 LYS F C 1 ATOM 3853 O O . LYS E 4 128 B 58.831 -2.683 69.356 1.00 46.73 ? 129 LYS F O 1 ATOM 3854 C CB . LYS E 4 128 B 60.600 -2.127 66.669 1.00 46.73 ? 129 LYS F CB 1 ATOM 3855 C CG . LYS E 4 128 B 60.640 -1.208 65.445 1.00 46.73 ? 129 LYS F CG 1 ATOM 3856 C CD . LYS E 4 128 B 59.251 -0.664 65.069 1.00 46.73 ? 129 LYS F CD 1 ATOM 3857 C CE . LYS E 4 128 B 58.811 0.501 65.962 1.00 46.73 ? 129 LYS F CE 1 ATOM 3858 N NZ . LYS E 4 128 B 57.452 0.292 66.547 1.00 46.73 ? 129 LYS F NZ 1 ATOM 3859 N N . LEU E 4 129 C 61.046 -2.988 69.737 1.00 54.02 ? 129 LEU F N 1 ATOM 3860 C CA . LEU E 4 129 C 60.903 -3.996 70.780 1.00 54.02 ? 129 LEU F CA 1 ATOM 3861 C C . LEU E 4 129 C 60.846 -3.432 72.204 1.00 54.02 ? 129 LEU F C 1 ATOM 3862 O O . LEU E 4 129 C 60.134 -3.967 73.059 1.00 2.00 ? 129 LEU F O 1 ATOM 3863 C CB . LEU E 4 129 C 62.038 -5.013 70.668 1.00 2.00 ? 129 LEU F CB 1 ATOM 3864 C CG . LEU E 4 129 C 61.733 -6.333 69.977 1.00 2.00 ? 129 LEU F CG 1 ATOM 3865 C CD1 . LEU E 4 129 C 61.038 -6.110 68.649 1.00 2.00 ? 129 LEU F CD1 1 ATOM 3866 C CD2 . LEU E 4 129 C 63.025 -7.111 69.817 1.00 2.00 ? 129 LEU F CD2 1 ATOM 3867 N N . LEU E 4 130 ? 61.610 -2.383 72.485 1.00 2.00 ? 130 LEU F N 1 ATOM 3868 C CA . LEU E 4 130 ? 61.569 -1.810 73.821 1.00 2.00 ? 130 LEU F CA 1 ATOM 3869 C C . LEU E 4 130 ? 60.356 -0.891 73.962 1.00 2.00 ? 130 LEU F C 1 ATOM 3870 O O . LEU E 4 130 ? 60.404 0.301 73.664 1.00 2.00 ? 130 LEU F O 1 ATOM 3871 C CB . LEU E 4 130 ? 62.853 -1.054 74.132 1.00 2.00 ? 130 LEU F CB 1 ATOM 3872 C CG . LEU E 4 130 ? 64.113 -1.895 74.291 1.00 2.00 ? 130 LEU F CG 1 ATOM 3873 C CD1 . LEU E 4 130 ? 65.311 -1.001 74.265 1.00 2.00 ? 130 LEU F CD1 1 ATOM 3874 C CD2 . LEU E 4 130 ? 64.081 -2.697 75.574 1.00 2.00 ? 130 LEU F CD2 1 ATOM 3875 N N . HIS E 4 131 ? 59.240 -1.486 74.340 1.00 2.00 ? 131 HIS F N 1 ATOM 3876 C CA . HIS E 4 131 ? 58.007 -0.761 74.534 1.00 2.00 ? 131 HIS F CA 1 ATOM 3877 C C . HIS E 4 131 ? 57.337 -1.275 75.777 1.00 2.00 ? 131 HIS F C 1 ATOM 3878 O O . HIS E 4 131 ? 57.216 -2.485 75.989 1.00 20.81 ? 131 HIS F O 1 ATOM 3879 C CB . HIS E 4 131 ? 57.072 -0.951 73.359 1.00 20.81 ? 131 HIS F CB 1 ATOM 3880 C CG . HIS E 4 131 ? 57.359 -0.050 72.208 1.00 20.81 ? 131 HIS F CG 1 ATOM 3881 N ND1 . HIS E 4 131 ? 57.330 -0.484 70.901 1.00 20.81 ? 131 HIS F ND1 1 ATOM 3882 C CD2 . HIS E 4 131 ? 57.674 1.267 72.163 1.00 20.81 ? 131 HIS F CD2 1 ATOM 3883 C CE1 . HIS E 4 131 ? 57.616 0.524 70.099 1.00 20.81 ? 131 HIS F CE1 1 ATOM 3884 N NE2 . HIS E 4 131 ? 57.828 1.598 70.841 1.00 20.81 ? 131 HIS F NE2 1 ATOM 3885 N N . ALA E 4 132 ? 56.904 -0.343 76.609 1.00 2.00 ? 132 ALA F N 1 ATOM 3886 C CA . ALA E 4 132 ? 56.247 -0.698 77.847 1.00 2.00 ? 132 ALA F CA 1 ATOM 3887 C C . ALA E 4 132 ? 55.202 -1.750 77.526 1.00 2.00 ? 132 ALA F C 1 ATOM 3888 O O . ALA E 4 132 ? 54.555 -1.698 76.479 1.00 2.00 ? 132 ALA F O 1 ATOM 3889 C CB . ALA E 4 132 ? 55.602 0.523 78.464 1.00 2.00 ? 132 ALA F CB 1 ATOM 3890 N N . GLY E 4 133 ? 55.151 -2.776 78.359 1.00 2.00 ? 133 GLY F N 1 ATOM 3891 C CA . GLY E 4 133 ? 54.176 -3.826 78.170 1.00 2.00 ? 133 GLY F CA 1 ATOM 3892 C C . GLY E 4 133 ? 54.700 -5.040 77.455 1.00 2.00 ? 133 GLY F C 1 ATOM 3893 O O . GLY E 4 133 ? 54.194 -6.140 77.698 1.00 2.00 ? 133 GLY F O 1 ATOM 3894 N N . PHE E 4 134 ? 55.675 -4.843 76.563 1.00 2.00 ? 134 PHE F N 1 ATOM 3895 C CA . PHE E 4 134 ? 56.266 -5.956 75.811 1.00 2.00 ? 134 PHE F CA 1 ATOM 3896 C C . PHE E 4 134 ? 57.050 -6.837 76.780 1.00 2.00 ? 134 PHE F C 1 ATOM 3897 O O . PHE E 4 134 ? 57.830 -6.355 77.605 1.00 2.00 ? 134 PHE F O 1 ATOM 3898 C CB . PHE E 4 134 ? 57.174 -5.464 74.667 1.00 2.00 ? 134 PHE F CB 1 ATOM 3899 C CG . PHE E 4 134 ? 56.430 -4.830 73.506 1.00 2.00 ? 134 PHE F CG 1 ATOM 3900 C CD1 . PHE E 4 134 ? 55.042 -4.856 73.438 1.00 2.00 ? 134 PHE F CD1 1 ATOM 3901 C CD2 . PHE E 4 134 ? 57.130 -4.171 72.495 1.00 2.00 ? 134 PHE F CD2 1 ATOM 3902 C CE1 . PHE E 4 134 ? 54.367 -4.233 72.392 1.00 2.00 ? 134 PHE F CE1 1 ATOM 3903 C CE2 . PHE E 4 134 ? 56.463 -3.549 71.446 1.00 2.00 ? 134 PHE F CE2 1 ATOM 3904 C CZ . PHE E 4 134 ? 55.078 -3.579 71.400 1.00 2.00 ? 134 PHE F CZ 1 ATOM 3905 N N . LYS E 4 135 ? 56.783 -8.128 76.726 1.00 2.00 ? 135 LYS F N 1 ATOM 3906 C CA . LYS E 4 135 ? 57.447 -9.036 77.622 1.00 2.00 ? 135 LYS F CA 1 ATOM 3907 C C . LYS E 4 135 ? 58.863 -9.422 77.187 1.00 2.00 ? 135 LYS F C 1 ATOM 3908 O O . LYS E 4 135 ? 59.261 -9.223 76.036 1.00 2.00 ? 135 LYS F O 1 ATOM 3909 C CB . LYS E 4 135 ? 56.571 -10.261 77.855 1.00 2.00 ? 135 LYS F CB 1 ATOM 3910 C CG . LYS E 4 135 ? 55.330 -9.937 78.658 1.00 2.00 ? 135 LYS F CG 1 ATOM 3911 C CD . LYS E 4 135 ? 54.309 -11.058 78.578 1.00 2.00 ? 135 LYS F CD 1 ATOM 3912 C CE . LYS E 4 135 ? 53.114 -10.803 79.485 1.00 2.00 ? 135 LYS F CE 1 ATOM 3913 N NZ . LYS E 4 135 ? 52.049 -11.821 79.242 1.00 2.00 ? 135 LYS F NZ 1 ATOM 3914 N N . GLY E 4 136 ? 59.630 -9.912 78.156 1.00 2.00 ? 136 GLY F N 1 ATOM 3915 C CA . GLY E 4 136 ? 60.996 -10.345 77.938 1.00 2.00 ? 136 GLY F CA 1 ATOM 3916 C C . GLY E 4 136 ? 61.081 -11.723 78.550 1.00 2.00 ? 136 GLY F C 1 ATOM 3917 O O . GLY E 4 136 ? 60.089 -12.213 79.098 1.00 8.59 ? 136 GLY F O 1 ATOM 3918 N N . ARG E 4 137 ? 62.225 -12.377 78.443 1.00 2.00 ? 137 ARG F N 1 ATOM 3919 C CA . ARG E 4 137 ? 62.350 -13.706 79.019 1.00 2.00 ? 137 ARG F CA 1 ATOM 3920 C C . ARG E 4 137 ? 63.574 -13.705 79.940 1.00 2.00 ? 137 ARG F C 1 ATOM 3921 O O . ARG E 4 137 ? 64.659 -13.284 79.537 1.00 2.00 ? 137 ARG F O 1 ATOM 3922 C CB . ARG E 4 137 ? 62.494 -14.770 77.915 1.00 2.00 ? 137 ARG F CB 1 ATOM 3923 C CG . ARG E 4 137 ? 61.965 -16.157 78.328 1.00 2.00 ? 137 ARG F CG 1 ATOM 3924 C CD . ARG E 4 137 ? 62.609 -17.333 77.569 1.00 2.00 ? 137 ARG F CD 1 ATOM 3925 N NE . ARG E 4 137 ? 62.146 -17.500 76.191 1.00 2.00 ? 137 ARG F NE 1 ATOM 3926 C CZ . ARG E 4 137 ? 60.956 -17.989 75.851 1.00 2.00 ? 137 ARG F CZ 1 ATOM 3927 N NH1 . ARG E 4 137 ? 60.084 -18.344 76.791 1.00 2.00 ? 137 ARG F NH1 1 ATOM 3928 N NH2 . ARG E 4 137 ? 60.631 -18.105 74.567 1.00 2.00 ? 137 ARG F NH2 1 ATOM 3929 N N . VAL E 4 138 ? 63.380 -14.084 81.197 1.00 2.00 ? 138 VAL F N 1 ATOM 3930 C CA . VAL E 4 138 ? 64.475 -14.115 82.152 1.00 2.00 ? 138 VAL F CA 1 ATOM 3931 C C . VAL E 4 138 ? 64.659 -15.582 82.529 1.00 2.00 ? 138 VAL F C 1 ATOM 3932 O O . VAL E 4 138 ? 63.687 -16.289 82.822 1.00 2.00 ? 138 VAL F O 1 ATOM 3933 C CB . VAL E 4 138 ? 64.183 -13.262 83.444 1.00 2.00 ? 138 VAL F CB 1 ATOM 3934 C CG1 . VAL E 4 138 ? 65.415 -13.183 84.336 1.00 2.00 ? 138 VAL F CG1 1 ATOM 3935 C CG2 . VAL E 4 138 ? 63.779 -11.868 83.088 1.00 2.00 ? 138 VAL F CG2 1 ATOM 3936 N N . THR E 4 139 ? 65.915 -16.021 82.496 1.00 19.07 ? 139 THR F N 1 ATOM 3937 C CA . THR E 4 139 ? 66.317 -17.388 82.796 1.00 19.07 ? 139 THR F CA 1 ATOM 3938 C C . THR E 4 139 ? 67.431 -17.362 83.829 1.00 19.07 ? 139 THR F C 1 ATOM 3939 O O . THR E 4 139 ? 68.280 -16.470 83.795 1.00 23.55 ? 139 THR F O 1 ATOM 3940 C CB . THR E 4 139 ? 66.919 -18.050 81.544 1.00 23.55 ? 139 THR F CB 1 ATOM 3941 O OG1 . THR E 4 139 ? 68.118 -17.354 81.172 1.00 23.55 ? 139 THR F OG1 1 ATOM 3942 C CG2 . THR E 4 139 ? 65.942 -17.988 80.372 1.00 23.55 ? 139 THR F CG2 1 ATOM 3943 N N . GLY E 4 140 ? 67.488 -18.371 84.692 1.00 31.87 ? 140 GLY F N 1 ATOM 3944 C CA . GLY E 4 140 ? 68.546 -18.407 85.690 1.00 31.87 ? 140 GLY F CA 1 ATOM 3945 C C . GLY E 4 140 ? 68.326 -19.380 86.829 1.00 31.87 ? 140 GLY F C 1 ATOM 3946 O O . GLY E 4 140 ? 67.176 -19.700 87.178 1.00 2.00 ? 140 GLY F O 1 ATOM 3947 N N . TRP E 4 141 ? 69.428 -19.935 87.333 1.00 21.40 ? 141 TRP F N 1 ATOM 3948 C CA . TRP E 4 141 ? 69.359 -20.837 88.481 1.00 21.40 ? 141 TRP F CA 1 ATOM 3949 C C . TRP E 4 141 ? 69.567 -19.816 89.580 1.00 21.40 ? 141 TRP F C 1 ATOM 3950 O O . TRP E 4 141 ? 70.545 -19.061 89.548 1.00 23.11 ? 141 TRP F O 1 ATOM 3951 C CB . TRP E 4 141 ? 70.522 -21.836 88.535 1.00 23.11 ? 141 TRP F CB 1 ATOM 3952 C CG . TRP E 4 141 ? 70.653 -22.758 87.378 1.00 23.11 ? 141 TRP F CG 1 ATOM 3953 C CD1 . TRP E 4 141 ? 70.086 -23.991 87.235 1.00 23.11 ? 141 TRP F CD1 1 ATOM 3954 C CD2 . TRP E 4 141 ? 71.427 -22.530 86.196 1.00 23.11 ? 141 TRP F CD2 1 ATOM 3955 N NE1 . TRP E 4 141 ? 70.461 -24.547 86.036 1.00 23.11 ? 141 TRP F NE1 1 ATOM 3956 C CE2 . TRP E 4 141 ? 71.282 -23.670 85.378 1.00 23.11 ? 141 TRP F CE2 1 ATOM 3957 C CE3 . TRP E 4 141 ? 72.226 -21.469 85.747 1.00 23.11 ? 141 TRP F CE3 1 ATOM 3958 C CZ2 . TRP E 4 141 ? 71.903 -23.778 84.135 1.00 23.11 ? 141 TRP F CZ2 1 ATOM 3959 C CZ3 . TRP E 4 141 ? 72.846 -21.576 84.511 1.00 23.11 ? 141 TRP F CZ3 1 ATOM 3960 C CH2 . TRP E 4 141 ? 72.680 -22.722 83.719 1.00 23.11 ? 141 TRP F CH2 1 ATOM 3961 N N . GLY E 4 142 ? 68.626 -19.735 90.510 1.00 2.00 ? 142 GLY F N 1 ATOM 3962 C CA . GLY E 4 142 ? 68.763 -18.765 91.577 1.00 2.00 ? 142 GLY F CA 1 ATOM 3963 C C . GLY E 4 142 ? 67.474 -18.639 92.347 1.00 2.00 ? 142 GLY F C 1 ATOM 3964 O O . GLY E 4 142 ? 66.394 -18.875 91.802 1.00 2.00 ? 142 GLY F O 1 ATOM 3965 N N . ASN E 4 143 ? 67.618 -18.285 93.617 1.00 2.00 ? 143 ASN F N 1 ATOM 3966 C CA . ASN E 4 143 ? 66.523 -18.076 94.563 1.00 2.00 ? 143 ASN F CA 1 ATOM 3967 C C . ASN E 4 143 ? 65.118 -18.187 94.021 1.00 2.00 ? 143 ASN F C 1 ATOM 3968 O O . ASN E 4 143 ? 64.733 -17.417 93.126 1.00 8.14 ? 143 ASN F O 1 ATOM 3969 C CB . ASN E 4 143 ? 66.636 -16.680 95.209 1.00 8.14 ? 143 ASN F CB 1 ATOM 3970 C CG . ASN E 4 143 ? 67.492 -16.659 96.472 1.00 8.14 ? 143 ASN F CG 1 ATOM 3971 O OD1 . ASN E 4 143 ? 68.646 -17.101 96.464 1.00 8.14 ? 143 ASN F OD1 1 ATOM 3972 N ND2 . ASN E 4 143 ? 66.945 -16.084 97.550 1.00 8.14 ? 143 ASN F ND2 1 ATOM 3973 N N . ARG E 4 144 ? 64.349 -19.109 94.596 1.00 20.37 ? 144 ARG F N 1 ATOM 3974 C CA . ARG E 4 144 ? 62.953 -19.311 94.207 1.00 20.37 ? 144 ARG F CA 1 ATOM 3975 C C . ARG E 4 144 ? 62.043 -18.473 95.098 1.00 20.37 ? 144 ARG F C 1 ATOM 3976 O O . ARG E 4 144 ? 60.856 -18.347 94.822 1.00 39.01 ? 144 ARG F O 1 ATOM 3977 C CB . ARG E 4 144 ? 62.542 -20.780 94.326 1.00 39.01 ? 144 ARG F CB 1 ATOM 3978 C CG . ARG E 4 144 ? 63.029 -21.662 93.196 1.00 39.01 ? 144 ARG F CG 1 ATOM 3979 C CD . ARG E 4 144 ? 62.303 -22.998 93.204 1.00 39.01 ? 144 ARG F CD 1 ATOM 3980 N NE . ARG E 4 144 ? 60.867 -22.833 93.005 1.00 39.01 ? 144 ARG F NE 1 ATOM 3981 C CZ . ARG E 4 144 ? 59.980 -23.811 93.144 1.00 39.01 ? 144 ARG F CZ 1 ATOM 3982 N NH1 . ARG E 4 144 ? 60.383 -25.025 93.487 1.00 39.01 ? 144 ARG F NH1 1 ATOM 3983 N NH2 . ARG E 4 144 ? 58.689 -23.578 92.944 1.00 39.01 ? 144 ARG F NH2 1 ATOM 3984 N N . ARG E 4 145 ? 62.597 -17.931 96.183 1.00 45.47 ? 145 ARG F N 1 ATOM 3985 C CA . ARG E 4 145 ? 61.824 -17.096 97.102 1.00 45.47 ? 145 ARG F CA 1 ATOM 3986 C C . ARG E 4 145 ? 62.694 -16.017 97.775 1.00 45.47 ? 145 ARG F C 1 ATOM 3987 O O . ARG E 4 145 ? 63.847 -15.806 97.377 1.00 62.47 ? 145 ARG F O 1 ATOM 3988 C CB . ARG E 4 145 ? 61.098 -17.954 98.158 1.00 62.47 ? 145 ARG F CB 1 ATOM 3989 C CG . ARG E 4 145 ? 61.953 -18.374 99.368 1.00 62.47 ? 145 ARG F CG 1 ATOM 3990 C CD . ARG E 4 145 ? 61.202 -19.324 100.311 1.00 62.47 ? 145 ARG F CD 1 ATOM 3991 N NE . ARG E 4 145 ? 61.154 -20.690 99.789 1.00 62.47 ? 145 ARG F NE 1 ATOM 3992 C CZ . ARG E 4 145 ? 60.100 -21.495 99.876 1.00 62.47 ? 145 ARG F CZ 1 ATOM 3993 N NH1 . ARG E 4 145 ? 58.990 -21.078 100.459 1.00 62.47 ? 145 ARG F NH1 1 ATOM 3994 N NH2 . ARG E 4 145 ? 60.153 -22.720 99.370 1.00 62.47 ? 145 ARG F NH2 1 ATOM 3995 N N . GLU E 4 146 ? 62.138 -15.358 98.797 1.00 68.17 ? 146 GLU F N 1 ATOM 3996 C CA . GLU E 4 146 ? 62.812 -14.289 99.559 1.00 68.17 ? 146 GLU F CA 1 ATOM 3997 C C . GLU E 4 146 ? 63.841 -14.760 100.599 1.00 68.17 ? 146 GLU F C 1 ATOM 3998 O O . GLU E 4 146 ? 64.985 -14.296 100.594 1.00 20.76 ? 146 GLU F O 1 ATOM 3999 C CB . GLU E 4 146 ? 61.767 -13.413 100.242 1.00 20.76 ? 146 GLU F CB 1 ATOM 4000 C CG . GLU E 4 146 ? 61.253 -12.292 99.380 1.00 20.76 ? 146 GLU F CG 1 ATOM 4001 C CD . GLU E 4 146 ? 61.816 -10.966 99.811 1.00 20.76 ? 146 GLU F CD 1 ATOM 4002 O OE1 . GLU E 4 146 ? 61.319 -10.421 100.810 1.00 20.76 ? 146 GLU F OE1 1 ATOM 4003 O OE2 . GLU E 4 146 ? 62.768 -10.483 99.176 1.00 20.76 ? 146 GLU F OE2 1 ATOM 4004 N N . THR E 4 147 ? 63.391 -15.613 101.523 1.00 46.01 ? 147 THR F N 1 ATOM 4005 C CA . THR E 4 147 ? 64.211 -16.234 102.580 1.00 46.01 ? 147 THR F CA 1 ATOM 4006 C C . THR E 4 147 ? 64.202 -15.701 104.049 1.00 46.01 ? 147 THR F C 1 ATOM 4007 O O . THR E 4 147 ? 63.141 -15.530 104.650 1.00 19.74 ? 147 THR F O 1 ATOM 4008 C CB . THR E 4 147 ? 65.667 -16.555 102.060 1.00 19.74 ? 147 THR F CB 1 ATOM 4009 O OG1 . THR E 4 147 ? 65.586 -17.116 100.742 1.00 19.74 ? 147 THR F OG1 1 ATOM 4010 C CG2 . THR E 4 147 ? 66.367 -17.588 102.956 1.00 19.74 ? 147 THR F CG2 1 ATOM 4011 N N . TRP E 4 148 ? 65.388 -15.486 104.614 1.00 41.52 ? 148 TRP F N 1 ATOM 4012 C CA . TRP E 4 148 ? 65.604 -15.077 106.007 1.00 41.52 ? 148 TRP F CA 1 ATOM 4013 C C . TRP E 4 148 ? 64.735 -14.042 106.716 1.00 41.52 ? 148 TRP F C 1 ATOM 4014 O O . TRP E 4 148 ? 64.906 -12.830 106.568 1.00 96.89 ? 148 TRP F O 1 ATOM 4015 C CB . TRP E 4 148 ? 67.090 -14.760 106.231 1.00 96.89 ? 148 TRP F CB 1 ATOM 4016 C CG . TRP E 4 148 ? 67.522 -14.720 107.677 1.00 96.89 ? 148 TRP F CG 1 ATOM 4017 C CD1 . TRP E 4 148 ? 68.431 -13.866 108.230 1.00 96.89 ? 148 TRP F CD1 1 ATOM 4018 C CD2 . TRP E 4 148 ? 67.066 -15.570 108.745 1.00 96.89 ? 148 TRP F CD2 1 ATOM 4019 N NE1 . TRP E 4 148 ? 68.570 -14.126 109.572 1.00 96.89 ? 148 TRP F NE1 1 ATOM 4020 C CE2 . TRP E 4 148 ? 67.746 -15.165 109.917 1.00 96.89 ? 148 TRP F CE2 1 ATOM 4021 C CE3 . TRP E 4 148 ? 66.151 -16.632 108.828 1.00 96.89 ? 148 TRP F CE3 1 ATOM 4022 C CZ2 . TRP E 4 148 ? 67.539 -15.783 111.160 1.00 96.89 ? 148 TRP F CZ2 1 ATOM 4023 C CZ3 . TRP E 4 148 ? 65.946 -17.247 110.065 1.00 96.89 ? 148 TRP F CZ3 1 ATOM 4024 C CH2 . TRP E 4 148 ? 66.639 -16.818 111.213 1.00 96.89 ? 148 TRP F CH2 1 ATOM 4025 N N . THR E 4 149 ? 63.916 -14.569 107.617 1.00 64.95 ? 149 THR F N 1 ATOM 4026 C CA . THR E 4 149 ? 62.997 -13.807 108.454 1.00 64.95 ? 149 THR F CA 1 ATOM 4027 C C . THR E 4 149 ? 62.695 -14.757 109.613 1.00 64.95 ? 149 THR F C 1 ATOM 4028 O O . THR E 4 149 ? 62.635 -15.974 109.416 1.00 47.54 ? 149 THR F O 1 ATOM 4029 C CB . THR E 4 149 ? 61.662 -13.507 107.720 1.00 47.54 ? 149 THR F CB 1 ATOM 4030 O OG1 . THR E 4 149 ? 61.928 -12.964 106.418 1.00 47.54 ? 149 THR F OG1 1 ATOM 4031 C CG2 . THR E 4 149 ? 60.819 -12.513 108.524 1.00 47.54 ? 149 THR F CG2 1 ATOM 4032 N N . THR E 4 150 A 62.564 -14.220 110.820 1.00 79.31 ? 149 THR F N 1 ATOM 4033 C CA . THR E 4 150 A 62.264 -15.060 111.976 1.00 79.31 ? 149 THR F CA 1 ATOM 4034 C C . THR E 4 150 A 61.220 -14.414 112.887 1.00 79.31 ? 149 THR F C 1 ATOM 4035 O O . THR E 4 150 A 60.283 -15.135 113.287 1.00 97.72 ? 149 THR F O 1 ATOM 4036 C CB . THR E 4 150 A 63.557 -15.426 112.767 1.00 97.72 ? 149 THR F CB 1 ATOM 4037 O OG1 . THR E 4 150 A 63.257 -16.393 113.785 1.00 97.72 ? 149 THR F OG1 1 ATOM 4038 C CG2 . THR E 4 150 A 64.193 -14.186 113.394 1.00 97.72 ? 149 THR F CG2 1 ATOM 4039 O OXT . THR E 4 150 A 61.309 -13.190 113.139 1.00 97.72 ? 149 THR F OXT 1 ATOM 4040 N N . SER F 5 1 B 51.325 -25.030 97.531 1.00 87.86 ? 149 SER G N 1 ATOM 4041 C CA . SER F 5 1 B 52.255 -25.410 96.434 1.00 87.86 ? 149 SER G CA 1 ATOM 4042 C C . SER F 5 1 B 53.520 -26.016 97.031 1.00 87.86 ? 149 SER G C 1 ATOM 4043 O O . SER F 5 1 B 53.822 -25.786 98.204 1.00 41.72 ? 149 SER G O 1 ATOM 4044 C CB . SER F 5 1 B 52.616 -24.174 95.606 1.00 41.72 ? 149 SER G CB 1 ATOM 4045 O OG . SER F 5 1 B 51.446 -23.468 95.234 1.00 41.72 ? 149 SER G OG 1 ATOM 4046 N N . VAL F 5 2 C 54.206 -26.841 96.240 1.00 77.21 ? 149 VAL G N 1 ATOM 4047 C CA . VAL F 5 2 C 55.456 -27.487 96.654 1.00 77.21 ? 149 VAL G CA 1 ATOM 4048 C C . VAL F 5 2 C 56.623 -26.588 96.233 1.00 77.21 ? 149 VAL G C 1 ATOM 4049 O O . VAL F 5 2 C 56.508 -25.852 95.249 1.00 74.72 ? 149 VAL G O 1 ATOM 4050 C CB . VAL F 5 2 C 55.621 -28.903 96.009 1.00 74.72 ? 149 VAL G CB 1 ATOM 4051 C CG1 . VAL F 5 2 C 54.559 -29.866 96.553 1.00 74.72 ? 149 VAL G CG1 1 ATOM 4052 C CG2 . VAL F 5 2 C 55.533 -28.822 94.485 1.00 74.72 ? 149 VAL G CG2 1 ATOM 4053 N N . ALA F 5 3 D 57.731 -26.626 96.970 1.00 76.95 ? 149 ALA G N 1 ATOM 4054 C CA . ALA F 5 3 D 58.876 -25.784 96.628 1.00 76.95 ? 149 ALA G CA 1 ATOM 4055 C C . ALA F 5 3 D 60.194 -26.154 97.306 1.00 76.95 ? 149 ALA G C 1 ATOM 4056 O O . ALA F 5 3 D 60.284 -27.148 98.028 1.00 49.41 ? 149 ALA G O 1 ATOM 4057 C CB . ALA F 5 3 D 58.543 -24.307 96.898 1.00 49.41 ? 149 ALA G CB 1 ATOM 4058 N N . GLU F 5 4 E 61.211 -25.341 97.018 1.00 79.09 ? 149 GLU G N 1 ATOM 4059 C CA . GLU F 5 4 E 62.574 -25.456 97.544 1.00 79.09 ? 149 GLU G CA 1 ATOM 4060 C C . GLU F 5 4 E 63.236 -24.137 97.140 1.00 79.09 ? 149 GLU G C 1 ATOM 4061 O O . GLU F 5 4 E 62.826 -23.534 96.151 1.00 73.42 ? 149 GLU G O 1 ATOM 4062 C CB . GLU F 5 4 E 63.310 -26.634 96.901 1.00 73.42 ? 149 GLU G CB 1 ATOM 4063 C CG . GLU F 5 4 E 64.595 -27.035 97.619 1.00 73.42 ? 149 GLU G CG 1 ATOM 4064 C CD . GLU F 5 4 E 65.136 -28.375 97.145 1.00 73.42 ? 149 GLU G CD 1 ATOM 4065 O OE1 . GLU F 5 4 E 64.378 -29.370 97.152 1.00 73.42 ? 149 GLU G OE1 1 ATOM 4066 O OE2 . GLU F 5 4 E 66.323 -28.438 96.766 1.00 73.42 ? 149 GLU G OE2 1 ATOM 4067 N N . VAL F 5 5 ? 64.233 -23.675 97.891 1.00 53.02 ? 150 VAL G N 1 ATOM 4068 C CA . VAL F 5 5 ? 64.879 -22.400 97.559 1.00 53.02 ? 150 VAL G CA 1 ATOM 4069 C C . VAL F 5 5 ? 65.745 -22.400 96.294 1.00 53.02 ? 150 VAL G C 1 ATOM 4070 O O . VAL F 5 5 ? 65.739 -21.421 95.539 1.00 64.62 ? 150 VAL G O 1 ATOM 4071 C CB . VAL F 5 5 ? 65.647 -21.791 98.768 1.00 64.62 ? 150 VAL G CB 1 ATOM 4072 C CG1 . VAL F 5 5 ? 66.283 -20.443 98.389 1.00 64.62 ? 150 VAL G CG1 1 ATOM 4073 C CG2 . VAL F 5 5 ? 64.690 -21.591 99.941 1.00 64.62 ? 150 VAL G CG2 1 ATOM 4074 N N . GLN F 5 6 ? 66.535 -23.445 96.089 1.00 21.16 ? 151 GLN G N 1 ATOM 4075 C CA . GLN F 5 6 ? 67.340 -23.523 94.871 1.00 21.16 ? 151 GLN G CA 1 ATOM 4076 C C . GLN F 5 6 ? 66.647 -24.440 93.842 1.00 21.16 ? 151 GLN G C 1 ATOM 4077 O O . GLN F 5 6 ? 66.011 -25.445 94.191 1.00 12.53 ? 151 GLN G O 1 ATOM 4078 C CB . GLN F 5 6 ? 68.758 -24.021 95.163 1.00 12.53 ? 151 GLN G CB 1 ATOM 4079 C CG . GLN F 5 6 ? 69.781 -22.906 95.324 1.00 12.53 ? 151 GLN G CG 1 ATOM 4080 C CD . GLN F 5 6 ? 69.908 -22.426 96.755 1.00 12.53 ? 151 GLN G CD 1 ATOM 4081 O OE1 . GLN F 5 6 ? 70.219 -23.208 97.654 1.00 12.53 ? 151 GLN G OE1 1 ATOM 4082 N NE2 . GLN F 5 6 ? 69.689 -21.133 96.974 1.00 12.53 ? 151 GLN G NE2 1 ATOM 4083 N N . PRO F 5 7 ? 66.725 -24.077 92.557 1.00 30.68 ? 152 PRO G N 1 ATOM 4084 C CA . PRO F 5 7 ? 66.092 -24.890 91.517 1.00 30.68 ? 152 PRO G CA 1 ATOM 4085 C C . PRO F 5 7 ? 66.948 -26.111 91.195 1.00 30.68 ? 152 PRO G C 1 ATOM 4086 O O . PRO F 5 7 ? 68.074 -26.215 91.672 1.00 75.27 ? 152 PRO G O 1 ATOM 4087 C CB . PRO F 5 7 ? 66.052 -23.924 90.341 1.00 75.27 ? 152 PRO G CB 1 ATOM 4088 C CG . PRO F 5 7 ? 67.371 -23.194 90.495 1.00 75.27 ? 152 PRO G CG 1 ATOM 4089 C CD . PRO F 5 7 ? 67.398 -22.897 91.977 1.00 75.27 ? 152 PRO G CD 1 ATOM 4090 N N . SER F 5 8 ? 66.410 -27.047 90.420 1.00 28.53 ? 153 SER G N 1 ATOM 4091 C CA . SER F 5 8 ? 67.181 -28.223 90.026 1.00 28.53 ? 153 SER G CA 1 ATOM 4092 C C . SER F 5 8 ? 67.779 -27.926 88.654 1.00 28.53 ? 153 SER G C 1 ATOM 4093 O O . SER F 5 8 ? 68.972 -28.151 88.405 1.00 50.37 ? 153 SER G O 1 ATOM 4094 C CB . SER F 5 8 ? 66.285 -29.461 89.959 1.00 50.37 ? 153 SER G CB 1 ATOM 4095 O OG . SER F 5 8 ? 65.196 -29.255 89.074 1.00 50.37 ? 153 SER G OG 1 ATOM 4096 N N . VAL F 5 9 ? 66.944 -27.389 87.773 1.00 37.19 ? 154 VAL G N 1 ATOM 4097 C CA . VAL F 5 9 ? 67.361 -27.037 86.424 1.00 37.19 ? 154 VAL G CA 1 ATOM 4098 C C . VAL F 5 9 ? 67.051 -25.561 86.155 1.00 37.19 ? 154 VAL G C 1 ATOM 4099 O O . VAL F 5 9 ? 66.430 -24.897 86.978 1.00 2.00 ? 154 VAL G O 1 ATOM 4100 C CB . VAL F 5 9 ? 66.673 -27.956 85.385 1.00 2.00 ? 154 VAL G CB 1 ATOM 4101 C CG1 . VAL F 5 9 ? 67.157 -29.382 85.574 1.00 2.00 ? 154 VAL G CG1 1 ATOM 4102 C CG2 . VAL F 5 9 ? 65.151 -27.894 85.527 1.00 2.00 ? 154 VAL G CG2 1 ATOM 4103 N N . LEU F 5 10 ? 67.545 -25.038 85.040 1.00 2.00 ? 155 LEU G N 1 ATOM 4104 C CA . LEU F 5 10 ? 67.298 -23.652 84.665 1.00 2.00 ? 155 LEU G CA 1 ATOM 4105 C C . LEU F 5 10 ? 65.815 -23.342 84.768 1.00 2.00 ? 155 LEU G C 1 ATOM 4106 O O . LEU F 5 10 ? 64.973 -24.223 84.556 1.00 28.34 ? 155 LEU G O 1 ATOM 4107 C CB . LEU F 5 10 ? 67.729 -23.421 83.222 1.00 28.34 ? 155 LEU G CB 1 ATOM 4108 C CG . LEU F 5 10 ? 68.768 -22.350 82.924 1.00 28.34 ? 155 LEU G CG 1 ATOM 4109 C CD1 . LEU F 5 10 ? 68.851 -22.156 81.420 1.00 28.34 ? 155 LEU G CD1 1 ATOM 4110 C CD2 . LEU F 5 10 ? 68.379 -21.059 83.594 1.00 28.34 ? 155 LEU G CD2 1 ATOM 4111 N N . GLN F 5 11 ? 65.500 -22.088 85.073 1.00 18.93 ? 156 GLN G N 1 ATOM 4112 C CA . GLN F 5 11 ? 64.109 -21.658 85.175 1.00 18.93 ? 156 GLN G CA 1 ATOM 4113 C C . GLN F 5 11 ? 63.887 -20.472 84.250 1.00 18.93 ? 156 GLN G C 1 ATOM 4114 O O . GLN F 5 11 ? 64.825 -19.725 83.947 1.00 2.00 ? 156 GLN G O 1 ATOM 4115 C CB . GLN F 5 11 ? 63.739 -21.288 86.616 1.00 2.00 ? 156 GLN G CB 1 ATOM 4116 C CG . GLN F 5 11 ? 63.853 -22.430 87.641 1.00 2.00 ? 156 GLN G CG 1 ATOM 4117 C CD . GLN F 5 11 ? 62.921 -23.600 87.359 1.00 2.00 ? 156 GLN G CD 1 ATOM 4118 O OE1 . GLN F 5 11 ? 63.350 -24.634 86.845 1.00 2.00 ? 156 GLN G OE1 1 ATOM 4119 N NE2 . GLN F 5 11 ? 61.647 -23.454 87.718 1.00 2.00 ? 156 GLN G NE2 1 ATOM 4120 N N . VAL F 5 12 ? 62.673 -20.355 83.729 1.00 2.00 ? 157 VAL G N 1 ATOM 4121 C CA . VAL F 5 12 ? 62.332 -19.241 82.853 1.00 2.00 ? 157 VAL G CA 1 ATOM 4122 C C . VAL F 5 12 ? 61.160 -18.480 83.413 1.00 2.00 ? 157 VAL G C 1 ATOM 4123 O O . VAL F 5 12 ? 60.398 -19.009 84.221 1.00 2.00 ? 157 VAL G O 1 ATOM 4124 C CB . VAL F 5 12 ? 61.945 -19.672 81.417 1.00 2.00 ? 157 VAL G CB 1 ATOM 4125 C CG1 . VAL F 5 12 ? 63.172 -19.764 80.534 1.00 2.00 ? 157 VAL G CG1 1 ATOM 4126 C CG2 . VAL F 5 12 ? 61.209 -20.982 81.434 1.00 2.00 ? 157 VAL G CG2 1 ATOM 4127 N N . VAL F 5 13 ? 61.049 -17.220 83.008 1.00 2.00 ? 158 VAL G N 1 ATOM 4128 C CA . VAL F 5 13 ? 59.942 -16.367 83.420 1.00 2.00 ? 158 VAL G CA 1 ATOM 4129 C C . VAL F 5 13 ? 59.837 -15.177 82.465 1.00 2.00 ? 158 VAL G C 1 ATOM 4130 O O . VAL F 5 13 ? 60.849 -14.602 82.076 1.00 2.00 ? 158 VAL G O 1 ATOM 4131 C CB . VAL F 5 13 ? 60.073 -15.904 84.885 1.00 2.00 ? 158 VAL G CB 1 ATOM 4132 C CG1 . VAL F 5 13 ? 61.131 -14.815 85.039 1.00 2.00 ? 158 VAL G CG1 1 ATOM 4133 C CG2 . VAL F 5 13 ? 58.731 -15.451 85.385 1.00 2.00 ? 158 VAL G CG2 1 ATOM 4134 N N . ASN F 5 14 ? 58.621 -14.899 82.000 1.00 2.00 ? 159 ASN G N 1 ATOM 4135 C CA . ASN F 5 14 ? 58.378 -13.795 81.076 1.00 2.00 ? 159 ASN G CA 1 ATOM 4136 C C . ASN F 5 14 ? 57.774 -12.635 81.864 1.00 2.00 ? 159 ASN G C 1 ATOM 4137 O O . ASN F 5 14 ? 56.703 -12.744 82.452 1.00 2.00 ? 159 ASN G O 1 ATOM 4138 C CB . ASN F 5 14 ? 57.422 -14.208 79.952 1.00 2.00 ? 159 ASN G CB 1 ATOM 4139 C CG . ASN F 5 14 ? 57.924 -15.394 79.142 1.00 2.00 ? 159 ASN G CG 1 ATOM 4140 O OD1 . ASN F 5 14 ? 58.597 -16.286 79.651 1.00 2.00 ? 159 ASN G OD1 1 ATOM 4141 N ND2 . ASN F 5 14 ? 57.545 -15.433 77.877 1.00 2.00 ? 159 ASN G ND2 1 ATOM 4142 N N . LEU F 5 15 ? 58.490 -11.526 81.887 1.00 2.00 ? 160 LEU G N 1 ATOM 4143 C CA . LEU F 5 15 ? 58.064 -10.341 82.609 1.00 2.00 ? 160 LEU G CA 1 ATOM 4144 C C . LEU F 5 15 ? 57.826 -9.236 81.599 1.00 2.00 ? 160 LEU G C 1 ATOM 4145 O O . LEU F 5 15 ? 58.571 -9.118 80.634 1.00 2.00 ? 160 LEU G O 1 ATOM 4146 C CB . LEU F 5 15 ? 59.180 -9.890 83.552 1.00 2.00 ? 160 LEU G CB 1 ATOM 4147 C CG . LEU F 5 15 ? 59.849 -10.979 84.388 1.00 2.00 ? 160 LEU G CG 1 ATOM 4148 C CD1 . LEU F 5 15 ? 61.052 -10.408 85.084 1.00 2.00 ? 160 LEU G CD1 1 ATOM 4149 C CD2 . LEU F 5 15 ? 58.864 -11.572 85.379 1.00 2.00 ? 160 LEU G CD2 1 ATOM 4150 N N . PRO F 5 16 ? 56.773 -8.430 81.791 1.00 2.00 ? 161 PRO G N 1 ATOM 4151 C CA . PRO F 5 16 ? 56.437 -7.325 80.897 1.00 2.00 ? 161 PRO G CA 1 ATOM 4152 C C . PRO F 5 16 ? 57.307 -6.129 81.277 1.00 2.00 ? 161 PRO G C 1 ATOM 4153 O O . PRO F 5 16 ? 57.689 -5.986 82.437 1.00 14.07 ? 161 PRO G O 1 ATOM 4154 C CB . PRO F 5 16 ? 54.985 -7.025 81.263 1.00 14.07 ? 161 PRO G CB 1 ATOM 4155 C CG . PRO F 5 16 ? 54.511 -8.247 81.983 1.00 14.07 ? 161 PRO G CG 1 ATOM 4156 C CD . PRO F 5 16 ? 55.709 -8.613 82.782 1.00 14.07 ? 161 PRO G CD 1 ATOM 4157 N N . LEU F 5 17 ? 57.620 -5.279 80.306 1.00 2.00 ? 162 LEU G N 1 ATOM 4158 C CA . LEU F 5 17 ? 58.432 -4.093 80.553 1.00 2.00 ? 162 LEU G CA 1 ATOM 4159 C C . LEU F 5 17 ? 57.547 -2.984 81.119 1.00 2.00 ? 162 LEU G C 1 ATOM 4160 O O . LEU F 5 17 ? 56.439 -2.766 80.638 1.00 2.00 ? 162 LEU G O 1 ATOM 4161 C CB . LEU F 5 17 ? 59.081 -3.628 79.246 1.00 2.00 ? 162 LEU G CB 1 ATOM 4162 C CG . LEU F 5 17 ? 60.057 -4.555 78.517 1.00 2.00 ? 162 LEU G CG 1 ATOM 4163 C CD1 . LEU F 5 17 ? 60.351 -4.015 77.129 1.00 2.00 ? 162 LEU G CD1 1 ATOM 4164 C CD2 . LEU F 5 17 ? 61.333 -4.684 79.303 1.00 2.00 ? 162 LEU G CD2 1 ATOM 4165 N N . VAL F 5 18 ? 58.030 -2.277 82.134 1.00 15.17 ? 163 VAL G N 1 ATOM 4166 C CA . VAL F 5 18 ? 57.238 -1.212 82.754 1.00 15.17 ? 163 VAL G CA 1 ATOM 4167 C C . VAL F 5 18 ? 57.498 0.144 82.090 1.00 15.17 ? 163 VAL G C 1 ATOM 4168 O O . VAL F 5 18 ? 58.415 0.281 81.269 1.00 2.00 ? 163 VAL G O 1 ATOM 4169 C CB . VAL F 5 18 ? 57.555 -1.077 84.251 1.00 2.00 ? 163 VAL G CB 1 ATOM 4170 C CG1 . VAL F 5 18 ? 56.511 -0.255 84.914 1.00 2.00 ? 163 VAL G CG1 1 ATOM 4171 C CG2 . VAL F 5 18 ? 57.650 -2.436 84.907 1.00 2.00 ? 163 VAL G CG2 1 ATOM 4172 N N . GLU F 5 19 ? 56.638 1.117 82.388 1.00 2.00 ? 164 GLU G N 1 ATOM 4173 C CA . GLU F 5 19 ? 56.791 2.471 81.878 1.00 2.00 ? 164 GLU G CA 1 ATOM 4174 C C . GLU F 5 19 ? 57.812 3.110 82.814 1.00 2.00 ? 164 GLU G C 1 ATOM 4175 O O . GLU F 5 19 ? 57.745 2.898 84.018 1.00 2.00 ? 164 GLU G O 1 ATOM 4176 C CB . GLU F 5 19 ? 55.466 3.232 81.956 1.00 2.00 ? 164 GLU G CB 1 ATOM 4177 C CG . GLU F 5 19 ? 54.370 2.715 81.056 1.00 2.00 ? 164 GLU G CG 1 ATOM 4178 C CD . GLU F 5 19 ? 53.588 1.573 81.660 1.00 2.00 ? 164 GLU G CD 1 ATOM 4179 O OE1 . GLU F 5 19 ? 52.708 1.835 82.495 1.00 2.00 ? 164 GLU G OE1 1 ATOM 4180 O OE2 . GLU F 5 19 ? 53.828 0.409 81.287 1.00 2.00 ? 164 GLU G OE2 1 ATOM 4181 N N . ARG F 5 20 ? 58.712 3.935 82.293 1.00 2.00 ? 165 ARG G N 1 ATOM 4182 C CA . ARG F 5 20 ? 59.743 4.535 83.147 1.00 2.00 ? 165 ARG G CA 1 ATOM 4183 C C . ARG F 5 20 ? 59.270 5.283 84.389 1.00 2.00 ? 165 ARG G C 1 ATOM 4184 O O . ARG F 5 20 ? 59.892 5.155 85.447 1.00 2.00 ? 165 ARG G O 1 ATOM 4185 C CB . ARG F 5 20 ? 60.734 5.389 82.344 1.00 2.00 ? 165 ARG G CB 1 ATOM 4186 C CG . ARG F 5 20 ? 61.877 5.931 83.191 1.00 2.00 ? 165 ARG G CG 1 ATOM 4187 C CD . ARG F 5 20 ? 63.067 6.385 82.365 1.00 2.00 ? 165 ARG G CD 1 ATOM 4188 N NE . ARG F 5 20 ? 63.749 5.271 81.704 1.00 2.00 ? 165 ARG G NE 1 ATOM 4189 C CZ . ARG F 5 20 ? 64.642 4.468 82.285 1.00 2.00 ? 165 ARG G CZ 1 ATOM 4190 N NH1 . ARG F 5 20 ? 64.965 4.629 83.563 1.00 2.00 ? 165 ARG G NH1 1 ATOM 4191 N NH2 . ARG F 5 20 ? 65.208 3.490 81.589 1.00 2.00 ? 165 ARG G NH2 1 ATOM 4192 N N . PRO F 5 21 ? 58.200 6.097 84.279 1.00 2.00 ? 166 PRO G N 1 ATOM 4193 C CA . PRO F 5 21 ? 57.722 6.818 85.462 1.00 2.00 ? 166 PRO G CA 1 ATOM 4194 C C . PRO F 5 21 ? 57.375 5.873 86.612 1.00 2.00 ? 166 PRO G C 1 ATOM 4195 O O . PRO F 5 21 ? 57.748 6.135 87.750 1.00 17.42 ? 166 PRO G O 1 ATOM 4196 C CB . PRO F 5 21 ? 56.500 7.579 84.946 1.00 17.42 ? 166 PRO G CB 1 ATOM 4197 C CG . PRO F 5 21 ? 56.117 6.868 83.695 1.00 17.42 ? 166 PRO G CG 1 ATOM 4198 C CD . PRO F 5 21 ? 57.444 6.519 83.093 1.00 17.42 ? 166 PRO G CD 1 ATOM 4199 N N . VAL F 5 22 ? 56.726 4.750 86.333 1.00 2.00 ? 167 VAL G N 1 ATOM 4200 C CA . VAL F 5 22 ? 56.413 3.837 87.428 1.00 2.00 ? 167 VAL G CA 1 ATOM 4201 C C . VAL F 5 22 ? 57.632 3.104 88.015 1.00 2.00 ? 167 VAL G C 1 ATOM 4202 O O . VAL F 5 22 ? 57.583 2.643 89.151 1.00 2.00 ? 167 VAL G O 1 ATOM 4203 C CB . VAL F 5 22 ? 55.181 2.877 87.149 1.00 2.00 ? 167 VAL G CB 1 ATOM 4204 C CG1 . VAL F 5 22 ? 54.654 3.036 85.742 1.00 2.00 ? 167 VAL G CG1 1 ATOM 4205 C CG2 . VAL F 5 22 ? 55.512 1.446 87.462 1.00 2.00 ? 167 VAL G CG2 1 ATOM 4206 N N . CYS F 5 23 ? 58.732 3.024 87.276 1.00 2.00 ? 168 CYS G N 1 ATOM 4207 C CA . CYS F 5 23 ? 59.910 2.365 87.820 1.00 2.00 ? 168 CYS G CA 1 ATOM 4208 C C . CYS F 5 23 ? 60.452 3.330 88.829 1.00 2.00 ? 168 CYS G C 1 ATOM 4209 O O . CYS F 5 23 ? 60.686 2.963 89.974 1.00 2.00 ? 168 CYS G O 1 ATOM 4210 C CB . CYS F 5 23 ? 60.997 2.129 86.777 1.00 2.00 ? 168 CYS G CB 1 ATOM 4211 S SG . CYS F 5 23 ? 60.700 0.831 85.548 1.00 2.00 ? 168 CYS G SG 1 ATOM 4212 N N . LYS F 5 24 ? 60.649 4.571 88.382 1.00 2.00 ? 169 LYS G N 1 ATOM 4213 C CA . LYS F 5 24 ? 61.177 5.653 89.216 1.00 2.00 ? 169 LYS G CA 1 ATOM 4214 C C . LYS F 5 24 ? 60.306 5.838 90.444 1.00 2.00 ? 169 LYS G C 1 ATOM 4215 O O . LYS F 5 24 ? 60.815 6.005 91.545 1.00 2.00 ? 169 LYS G O 1 ATOM 4216 C CB . LYS F 5 24 ? 61.230 6.970 88.438 1.00 2.00 ? 169 LYS G CB 1 ATOM 4217 C CG . LYS F 5 24 ? 62.049 6.931 87.155 1.00 2.00 ? 169 LYS G CG 1 ATOM 4218 C CD . LYS F 5 24 ? 62.370 8.348 86.682 1.00 2.00 ? 169 LYS G CD 1 ATOM 4219 C CE . LYS F 5 24 ? 63.072 8.370 85.327 1.00 2.00 ? 169 LYS G CE 1 ATOM 4220 N NZ . LYS F 5 24 ? 64.322 7.557 85.274 1.00 2.00 ? 169 LYS G NZ 1 ATOM 4221 N N . ALA F 5 25 ? 58.995 5.768 90.247 1.00 2.00 ? 170 ALA G N 1 ATOM 4222 C CA . ALA F 5 25 ? 58.033 5.924 91.325 1.00 2.00 ? 170 ALA G CA 1 ATOM 4223 C C . ALA F 5 25 ? 58.017 4.795 92.351 1.00 2.00 ? 170 ALA G C 1 ATOM 4224 O O . ALA F 5 25 ? 57.410 4.952 93.417 1.00 34.60 ? 170 ALA G O 1 ATOM 4225 C CB . ALA F 5 25 ? 56.639 6.116 90.757 1.00 34.60 ? 170 ALA G CB 1 ATOM 4226 N N . SER F 5 26 ? 58.612 3.645 92.023 1.00 34.60 ? 171 SER G N 1 ATOM 4227 C CA . SER F 5 26 ? 58.636 2.524 92.967 1.00 34.60 ? 171 SER G CA 1 ATOM 4228 C C . SER F 5 26 ? 59.767 2.635 93.989 1.00 34.60 ? 171 SER G C 1 ATOM 4229 O O . SER F 5 26 ? 59.525 2.580 95.198 1.00 2.00 ? 171 SER G O 1 ATOM 4230 C CB . SER F 5 26 ? 58.641 1.159 92.263 1.00 2.00 ? 171 SER G CB 1 ATOM 4231 O OG . SER F 5 26 ? 59.735 1.023 91.383 1.00 2.00 ? 171 SER G OG 1 ATOM 4232 N N . THR F 5 27 ? 60.982 2.871 93.514 1.00 2.00 ? 172 THR G N 1 ATOM 4233 C CA . THR F 5 27 ? 62.129 2.971 94.404 1.00 2.00 ? 172 THR G CA 1 ATOM 4234 C C . THR F 5 27 ? 62.514 4.413 94.767 1.00 2.00 ? 172 THR G C 1 ATOM 4235 O O . THR F 5 27 ? 61.952 5.369 94.234 1.00 13.48 ? 172 THR G O 1 ATOM 4236 C CB . THR F 5 27 ? 63.335 2.196 93.792 1.00 13.48 ? 172 THR G CB 1 ATOM 4237 O OG1 . THR F 5 27 ? 64.462 2.250 94.674 1.00 13.48 ? 172 THR G OG1 1 ATOM 4238 C CG2 . THR F 5 27 ? 63.722 2.774 92.454 1.00 13.48 ? 172 THR G CG2 1 ATOM 4239 N N . ARG F 5 28 ? 63.442 4.564 95.711 1.00 2.00 ? 173 ARG G N 1 ATOM 4240 C CA . ARG F 5 28 ? 63.902 5.890 96.125 1.00 2.00 ? 173 ARG G CA 1 ATOM 4241 C C . ARG F 5 28 ? 65.284 6.111 95.542 1.00 2.00 ? 173 ARG G C 1 ATOM 4242 O O . ARG F 5 28 ? 65.901 7.157 95.752 1.00 40.93 ? 173 ARG G O 1 ATOM 4243 C CB . ARG F 5 28 ? 64.029 5.972 97.645 1.00 40.93 ? 173 ARG G CB 1 ATOM 4244 C CG . ARG F 5 28 ? 62.988 5.193 98.396 1.00 40.93 ? 173 ARG G CG 1 ATOM 4245 C CD . ARG F 5 28 ? 63.383 5.027 99.849 1.00 40.93 ? 173 ARG G CD 1 ATOM 4246 N NE . ARG F 5 28 ? 62.967 3.714 100.333 1.00 40.93 ? 173 ARG G NE 1 ATOM 4247 C CZ . ARG F 5 28 ? 63.767 2.656 100.425 1.00 40.93 ? 173 ARG G CZ 1 ATOM 4248 N NH1 . ARG F 5 28 ? 65.057 2.756 100.126 1.00 40.93 ? 173 ARG G NH1 1 ATOM 4249 N NH2 . ARG F 5 28 ? 63.279 1.506 100.864 1.00 40.93 ? 173 ARG G NH2 1 ATOM 4250 N N . ILE F 5 29 ? 65.791 5.095 94.857 1.00 2.00 ? 174 ILE G N 1 ATOM 4251 C CA . ILE F 5 29 ? 67.114 5.164 94.269 1.00 2.00 ? 174 ILE G CA 1 ATOM 4252 C C . ILE F 5 29 ? 67.096 5.952 92.974 1.00 2.00 ? 174 ILE G C 1 ATOM 4253 O O . ILE F 5 29 ? 66.112 5.901 92.231 1.00 2.00 ? 174 ILE G O 1 ATOM 4254 C CB . ILE F 5 29 ? 67.673 3.759 94.049 1.00 2.00 ? 174 ILE G CB 1 ATOM 4255 C CG1 . ILE F 5 29 ? 67.554 2.979 95.367 1.00 2.00 ? 174 ILE G CG1 1 ATOM 4256 C CG2 . ILE F 5 29 ? 69.120 3.853 93.574 1.00 2.00 ? 174 ILE G CG2 1 ATOM 4257 C CD1 . ILE F 5 29 ? 67.876 1.513 95.298 1.00 2.00 ? 174 ILE G CD1 1 ATOM 4258 N N . ARG F 5 30 ? 68.160 6.709 92.716 1.00 47.95 ? 175 ARG G N 1 ATOM 4259 C CA . ARG F 5 30 ? 68.203 7.504 91.499 1.00 47.95 ? 175 ARG G CA 1 ATOM 4260 C C . ARG F 5 30 ? 68.367 6.627 90.270 1.00 47.95 ? 175 ARG G C 1 ATOM 4261 O O . ARG F 5 30 ? 69.446 6.107 89.990 1.00 70.36 ? 175 ARG G O 1 ATOM 4262 C CB . ARG F 5 30 ? 69.288 8.577 91.551 1.00 70.36 ? 175 ARG G CB 1 ATOM 4263 C CG . ARG F 5 30 ? 68.732 9.972 91.305 1.00 70.36 ? 175 ARG G CG 1 ATOM 4264 C CD . ARG F 5 30 ? 69.769 10.899 90.701 1.00 70.36 ? 175 ARG G CD 1 ATOM 4265 N NE . ARG F 5 30 ? 69.888 10.754 89.248 1.00 70.36 ? 175 ARG G NE 1 ATOM 4266 C CZ . ARG F 5 30 ? 71.007 10.410 88.615 1.00 70.36 ? 175 ARG G CZ 1 ATOM 4267 N NH1 . ARG F 5 30 ? 72.108 10.135 89.304 1.00 70.36 ? 175 ARG G NH1 1 ATOM 4268 N NH2 . ARG F 5 30 ? 71.021 10.317 87.291 1.00 70.36 ? 175 ARG G NH2 1 ATOM 4269 N N . ILE F 5 31 ? 67.256 6.435 89.573 1.00 34.12 ? 176 ILE G N 1 ATOM 4270 C CA . ILE F 5 31 ? 67.224 5.629 88.368 1.00 34.12 ? 176 ILE G CA 1 ATOM 4271 C C . ILE F 5 31 ? 67.823 6.427 87.210 1.00 34.12 ? 176 ILE G C 1 ATOM 4272 O O . ILE F 5 31 ? 67.778 7.654 87.195 1.00 10.46 ? 176 ILE G O 1 ATOM 4273 C CB . ILE F 5 31 ? 65.768 5.187 88.060 1.00 10.46 ? 176 ILE G CB 1 ATOM 4274 C CG1 . ILE F 5 31 ? 65.183 4.468 89.277 1.00 10.46 ? 176 ILE G CG1 1 ATOM 4275 C CG2 . ILE F 5 31 ? 65.712 4.292 86.835 1.00 10.46 ? 176 ILE G CG2 1 ATOM 4276 C CD1 . ILE F 5 31 ? 66.127 3.470 89.922 1.00 10.46 ? 176 ILE G CD1 1 ATOM 4277 N N . THR F 5 32 ? 68.426 5.731 86.260 1.00 11.43 ? 177 THR G N 1 ATOM 4278 C CA . THR F 5 32 ? 69.011 6.404 85.120 1.00 11.43 ? 177 THR G CA 1 ATOM 4279 C C . THR F 5 32 ? 68.547 5.751 83.836 1.00 11.43 ? 177 THR G C 1 ATOM 4280 O O . THR F 5 32 ? 68.173 4.582 83.828 1.00 11.28 ? 177 THR G O 1 ATOM 4281 C CB . THR F 5 32 ? 70.554 6.373 85.176 1.00 11.28 ? 177 THR G CB 1 ATOM 4282 O OG1 . THR F 5 32 ? 71.019 5.040 85.463 1.00 11.28 ? 177 THR G OG1 1 ATOM 4283 C CG2 . THR F 5 32 ? 71.054 7.351 86.223 1.00 11.28 ? 177 THR G CG2 1 ATOM 4284 N N . ASP F 5 33 ? 68.712 6.483 82.738 1.00 10.66 ? 178 ASP G N 1 ATOM 4285 C CA . ASP F 5 33 ? 68.329 6.048 81.393 1.00 10.66 ? 178 ASP G CA 1 ATOM 4286 C C . ASP F 5 33 ? 69.152 4.824 80.953 1.00 10.66 ? 178 ASP G C 1 ATOM 4287 O O . ASP F 5 33 ? 68.956 4.250 79.883 1.00 28.91 ? 178 ASP G O 1 ATOM 4288 C CB . ASP F 5 33 ? 68.561 7.203 80.403 1.00 28.91 ? 178 ASP G CB 1 ATOM 4289 C CG . ASP F 5 33 ? 68.023 8.558 80.907 1.00 28.91 ? 178 ASP G CG 1 ATOM 4290 O OD1 . ASP F 5 33 ? 67.600 8.669 82.080 1.00 28.91 ? 178 ASP G OD1 1 ATOM 4291 O OD2 . ASP F 5 33 ? 68.038 9.530 80.117 1.00 28.91 ? 178 ASP G OD2 1 ATOM 4292 N N . ASN F 5 34 ? 70.070 4.440 81.823 1.00 2.00 ? 179 ASN G N 1 ATOM 4293 C CA . ASN F 5 34 ? 70.992 3.333 81.635 1.00 2.00 ? 179 ASN G CA 1 ATOM 4294 C C . ASN F 5 34 ? 70.394 1.996 82.051 1.00 2.00 ? 179 ASN G C 1 ATOM 4295 O O . ASN F 5 34 ? 70.980 0.941 81.795 1.00 2.00 ? 179 ASN G O 1 ATOM 4296 C CB . ASN F 5 34 ? 72.185 3.605 82.536 1.00 2.00 ? 179 ASN G CB 1 ATOM 4297 C CG . ASN F 5 34 ? 73.481 3.387 81.857 1.00 2.00 ? 179 ASN G CG 1 ATOM 4298 O OD1 . ASN F 5 34 ? 74.243 2.503 82.247 1.00 2.00 ? 179 ASN G OD1 1 ATOM 4299 N ND2 . ASN F 5 34 ? 73.785 4.226 80.867 1.00 2.00 ? 179 ASN G ND2 1 ATOM 4300 N N . MET F 5 35 ? 69.266 2.061 82.756 1.00 2.02 ? 180 MET G N 1 ATOM 4301 C CA . MET F 5 35 ? 68.578 0.880 83.286 1.00 2.02 ? 180 MET G CA 1 ATOM 4302 C C . MET F 5 35 ? 67.067 1.013 83.176 1.00 2.02 ? 180 MET G C 1 ATOM 4303 O O . MET F 5 35 ? 66.513 2.100 83.331 1.00 2.00 ? 180 MET G O 1 ATOM 4304 C CB . MET F 5 35 ? 68.922 0.690 84.778 1.00 2.00 ? 180 MET G CB 1 ATOM 4305 C CG . MET F 5 35 ? 68.324 1.772 85.719 1.00 2.00 ? 180 MET G CG 1 ATOM 4306 S SD . MET F 5 35 ? 68.798 1.699 87.474 1.00 2.00 ? 180 MET G SD 1 ATOM 4307 C CE . MET F 5 35 ? 69.934 3.063 87.601 1.00 2.00 ? 180 MET G CE 1 ATOM 4308 N N . PHE F 5 36 ? 66.402 -0.084 82.863 1.00 2.00 ? 181 PHE G N 1 ATOM 4309 C CA . PHE F 5 36 ? 64.954 -0.054 82.802 1.00 2.00 ? 181 PHE G CA 1 ATOM 4310 C C . PHE F 5 36 ? 64.528 -1.028 83.872 1.00 2.00 ? 181 PHE G C 1 ATOM 4311 O O . PHE F 5 36 ? 65.368 -1.497 84.656 1.00 2.00 ? 181 PHE G O 1 ATOM 4312 C CB . PHE F 5 36 ? 64.407 -0.443 81.411 1.00 2.00 ? 181 PHE G CB 1 ATOM 4313 C CG . PHE F 5 36 ? 64.747 -1.837 80.967 1.00 2.00 ? 181 PHE G CG 1 ATOM 4314 C CD1 . PHE F 5 36 ? 64.015 -2.922 81.414 1.00 2.00 ? 181 PHE G CD1 1 ATOM 4315 C CD2 . PHE F 5 36 ? 65.797 -2.058 80.094 1.00 2.00 ? 181 PHE G CD2 1 ATOM 4316 C CE1 . PHE F 5 36 ? 64.321 -4.200 80.994 1.00 2.00 ? 181 PHE G CE1 1 ATOM 4317 C CE2 . PHE F 5 36 ? 66.112 -3.338 79.664 1.00 2.00 ? 181 PHE G CE2 1 ATOM 4318 C CZ . PHE F 5 36 ? 65.378 -4.406 80.117 1.00 2.00 ? 181 PHE G CZ 1 ATOM 4319 N N . CYS F 5 37 ? 63.240 -1.328 83.917 1.00 2.00 ? 182 CYS G N 1 ATOM 4320 C CA . CYS F 5 37 ? 62.734 -2.255 84.904 1.00 2.00 ? 182 CYS G CA 1 ATOM 4321 C C . CYS F 5 37 ? 61.500 -2.946 84.365 1.00 2.00 ? 182 CYS G C 1 ATOM 4322 O O . CYS F 5 37 ? 60.772 -2.372 83.542 1.00 2.00 ? 182 CYS G O 1 ATOM 4323 C CB . CYS F 5 37 ? 62.472 -1.540 86.239 1.00 2.00 ? 182 CYS G CB 1 ATOM 4324 S SG . CYS F 5 37 ? 60.803 -0.903 86.575 1.00 2.00 ? 182 CYS G SG 1 ATOM 4325 N N . ALA F 5 38 ? 61.312 -4.205 84.760 1.00 2.00 ? 183 ALA G N 1 ATOM 4326 C CA . ALA F 5 38 ? 60.171 -4.982 84.299 1.00 2.00 ? 183 ALA G CA 1 ATOM 4327 C C . ALA F 5 38 ? 59.522 -5.833 85.372 1.00 2.00 ? 183 ALA G C 1 ATOM 4328 O O . ALA F 5 38 ? 60.205 -6.464 86.186 1.00 2.00 ? 183 ALA G O 1 ATOM 4329 C CB . ALA F 5 38 ? 60.577 -5.848 83.150 1.00 2.00 ? 183 ALA G CB 1 ATOM 4330 N N . GLY F 5 39 ? 58.195 -5.836 85.364 1.00 2.00 ? 184 GLY G N 1 ATOM 4331 C CA . GLY F 5 39 ? 57.437 -6.621 86.311 1.00 2.00 ? 184 GLY G CA 1 ATOM 4332 C C . GLY F 5 39 ? 55.968 -6.333 86.132 1.00 2.00 ? 184 GLY G C 1 ATOM 4333 O O . GLY F 5 39 ? 55.623 -5.395 85.422 1.00 2.00 ? 184 GLY G O 1 ATOM 4334 N N . TYR F 5 40 A 55.111 -7.173 86.718 1.00 2.00 ? 184 TYR G N 1 ATOM 4335 C CA . TYR F 5 40 A 53.660 -6.996 86.642 1.00 2.00 ? 184 TYR G CA 1 ATOM 4336 C C . TYR F 5 40 A 53.220 -6.014 87.706 1.00 2.00 ? 184 TYR G C 1 ATOM 4337 O O . TYR F 5 40 A 53.670 -6.057 88.845 1.00 2.00 ? 184 TYR G O 1 ATOM 4338 C CB . TYR F 5 40 A 52.915 -8.303 86.855 1.00 2.00 ? 184 TYR G CB 1 ATOM 4339 C CG . TYR F 5 40 A 53.205 -9.354 85.827 1.00 2.00 ? 184 TYR G CG 1 ATOM 4340 C CD1 . TYR F 5 40 A 54.248 -10.256 86.010 1.00 2.00 ? 184 TYR G CD1 1 ATOM 4341 C CD2 . TYR F 5 40 A 52.412 -9.484 84.702 1.00 2.00 ? 184 TYR G CD2 1 ATOM 4342 C CE1 . TYR F 5 40 A 54.491 -11.266 85.102 1.00 2.00 ? 184 TYR G CE1 1 ATOM 4343 C CE2 . TYR F 5 40 A 52.642 -10.487 83.785 1.00 2.00 ? 184 TYR G CE2 1 ATOM 4344 C CZ . TYR F 5 40 A 53.685 -11.382 83.989 1.00 2.00 ? 184 TYR G CZ 1 ATOM 4345 O OH . TYR F 5 40 A 53.914 -12.397 83.081 1.00 2.00 ? 184 TYR G OH 1 ATOM 4346 N N . LYS F 5 41 ? 52.339 -5.115 87.322 1.00 2.00 ? 185 LYS G N 1 ATOM 4347 C CA . LYS F 5 41 ? 51.837 -4.107 88.226 1.00 2.00 ? 185 LYS G CA 1 ATOM 4348 C C . LYS F 5 41 ? 51.001 -4.788 89.306 1.00 2.00 ? 185 LYS G C 1 ATOM 4349 O O . LYS F 5 41 ? 50.390 -5.821 89.041 1.00 9.14 ? 185 LYS G O 1 ATOM 4350 C CB . LYS F 5 41 ? 51.063 -3.097 87.385 1.00 9.14 ? 185 LYS G CB 1 ATOM 4351 C CG . LYS F 5 41 ? 51.926 -2.652 86.183 1.00 9.14 ? 185 LYS G CG 1 ATOM 4352 C CD . LYS F 5 41 ? 51.189 -1.776 85.202 1.00 9.14 ? 185 LYS G CD 1 ATOM 4353 C CE . LYS F 5 41 ? 51.762 -0.361 85.135 1.00 9.14 ? 185 LYS G CE 1 ATOM 4354 N NZ . LYS F 5 41 ? 51.032 0.448 84.101 1.00 9.14 ? 185 LYS G NZ 1 ATOM 4355 N N . PRO F 5 42 ? 50.974 -4.232 90.538 1.00 23.98 ? 186 PRO G N 1 ATOM 4356 C CA . PRO F 5 42 ? 50.209 -4.823 91.650 1.00 23.98 ? 186 PRO G CA 1 ATOM 4357 C C . PRO F 5 42 ? 48.849 -5.402 91.264 1.00 23.98 ? 186 PRO G C 1 ATOM 4358 O O . PRO F 5 42 ? 48.585 -6.582 91.499 1.00 2.00 ? 186 PRO G O 1 ATOM 4359 C CB . PRO F 5 42 ? 50.071 -3.657 92.632 1.00 2.00 ? 186 PRO G CB 1 ATOM 4360 C CG . PRO F 5 42 ? 51.340 -2.923 92.443 1.00 2.00 ? 186 PRO G CG 1 ATOM 4361 C CD . PRO F 5 42 ? 51.505 -2.913 90.929 1.00 2.00 ? 186 PRO G CD 1 ATOM 4362 N N . GLY F 5 43 A 48.019 -4.588 90.621 1.00 17.72 ? 186 GLY G N 1 ATOM 4363 C CA . GLY F 5 43 A 46.698 -5.038 90.227 1.00 17.72 ? 186 GLY G CA 1 ATOM 4364 C C . GLY F 5 43 A 46.599 -5.979 89.032 1.00 17.72 ? 186 GLY G C 1 ATOM 4365 O O . GLY F 5 43 A 45.527 -6.525 88.766 1.00 3.70 ? 186 GLY G O 1 ATOM 4366 N N . GLU F 5 44 B 47.719 -6.237 88.361 1.00 36.54 ? 186 GLU G N 1 ATOM 4367 C CA . GLU F 5 44 B 47.725 -7.069 87.159 1.00 36.54 ? 186 GLU G CA 1 ATOM 4368 C C . GLU F 5 44 B 47.006 -8.415 87.047 1.00 36.54 ? 186 GLU G C 1 ATOM 4369 O O . GLU F 5 44 B 45.825 -8.450 86.684 1.00 19.91 ? 186 GLU G O 1 ATOM 4370 C CB . GLU F 5 44 B 49.123 -7.144 86.558 1.00 19.91 ? 186 GLU G CB 1 ATOM 4371 C CG . GLU F 5 44 B 49.449 -5.904 85.771 1.00 19.91 ? 186 GLU G CG 1 ATOM 4372 C CD . GLU F 5 44 B 50.466 -6.141 84.687 1.00 19.91 ? 186 GLU G CD 1 ATOM 4373 O OE1 . GLU F 5 44 B 50.519 -7.266 84.150 1.00 19.91 ? 186 GLU G OE1 1 ATOM 4374 O OE2 . GLU F 5 44 B 51.210 -5.192 84.356 1.00 19.91 ? 186 GLU G OE2 1 ATOM 4375 N N . GLY F 5 45 C 47.730 -9.518 87.222 1.00 2.00 ? 186 GLY G N 1 ATOM 4376 C CA . GLY F 5 45 C 47.100 -10.823 87.110 1.00 2.00 ? 186 GLY G CA 1 ATOM 4377 C C . GLY F 5 45 C 48.078 -11.943 87.370 1.00 2.00 ? 186 GLY G C 1 ATOM 4378 O O . GLY F 5 45 C 47.711 -13.005 87.876 1.00 7.34 ? 186 GLY G O 1 ATOM 4379 N N . LYS F 5 46 D 49.333 -11.703 87.021 1.00 2.00 ? 186 LYS G N 1 ATOM 4380 C CA . LYS F 5 46 D 50.372 -12.699 87.214 1.00 2.00 ? 186 LYS G CA 1 ATOM 4381 C C . LYS F 5 46 D 51.539 -12.159 88.041 1.00 2.00 ? 186 LYS G C 1 ATOM 4382 O O . LYS F 5 46 D 51.664 -10.962 88.258 1.00 2.00 ? 186 LYS G O 1 ATOM 4383 C CB . LYS F 5 46 D 50.845 -13.248 85.865 1.00 2.00 ? 186 LYS G CB 1 ATOM 4384 C CG . LYS F 5 46 D 49.718 -13.788 84.953 1.00 2.00 ? 186 LYS G CG 1 ATOM 4385 C CD . LYS F 5 46 D 49.451 -15.285 85.138 1.00 2.00 ? 186 LYS G CD 1 ATOM 4386 C CE . LYS F 5 46 D 48.284 -15.595 86.087 1.00 2.00 ? 186 LYS G CE 1 ATOM 4387 N NZ . LYS F 5 46 D 46.924 -15.385 85.494 1.00 2.00 ? 186 LYS G NZ 1 ATOM 4388 N N . ARG F 5 47 ? 52.368 -13.077 88.514 1.00 2.00 ? 187 ARG G N 1 ATOM 4389 C CA . ARG F 5 47 ? 53.505 -12.788 89.368 1.00 2.00 ? 187 ARG G CA 1 ATOM 4390 C C . ARG F 5 47 ? 54.808 -13.217 88.667 1.00 2.00 ? 187 ARG G C 1 ATOM 4391 O O . ARG F 5 47 ? 54.823 -13.416 87.451 1.00 2.00 ? 187 ARG G O 1 ATOM 4392 C CB . ARG F 5 47 ? 53.288 -13.552 90.681 1.00 2.00 ? 187 ARG G CB 1 ATOM 4393 C CG . ARG F 5 47 ? 54.092 -13.057 91.845 1.00 2.00 ? 187 ARG G CG 1 ATOM 4394 C CD . ARG F 5 47 ? 53.596 -13.600 93.162 1.00 2.00 ? 187 ARG G CD 1 ATOM 4395 N NE . ARG F 5 47 ? 52.293 -13.040 93.514 1.00 2.00 ? 187 ARG G NE 1 ATOM 4396 C CZ . ARG F 5 47 ? 52.070 -11.760 93.812 1.00 2.00 ? 187 ARG G CZ 1 ATOM 4397 N NH1 . ARG F 5 47 ? 53.059 -10.874 93.801 1.00 2.00 ? 187 ARG G NH1 1 ATOM 4398 N NH2 . ARG F 5 47 ? 50.844 -11.363 94.121 1.00 2.00 ? 187 ARG G NH2 1 ATOM 4399 N N . GLY F 5 48 ? 55.894 -13.360 89.419 1.00 2.00 ? 188 GLY G N 1 ATOM 4400 C CA . GLY F 5 48 ? 57.148 -13.765 88.817 1.00 2.00 ? 188 GLY G CA 1 ATOM 4401 C C . GLY F 5 48 ? 58.175 -12.652 88.799 1.00 2.00 ? 188 GLY G C 1 ATOM 4402 O O . GLY F 5 48 ? 57.837 -11.476 88.615 1.00 13.22 ? 188 GLY G O 1 ATOM 4403 N N . ASP F 5 49 ? 59.437 -13.022 88.982 1.00 2.00 ? 189 ASP G N 1 ATOM 4404 C CA . ASP F 5 49 ? 60.533 -12.064 88.998 1.00 2.00 ? 189 ASP G CA 1 ATOM 4405 C C . ASP F 5 49 ? 61.866 -12.795 89.107 1.00 2.00 ? 189 ASP G C 1 ATOM 4406 O O . ASP F 5 49 ? 61.903 -13.987 89.399 1.00 2.00 ? 189 ASP G O 1 ATOM 4407 C CB . ASP F 5 49 ? 60.368 -11.129 90.198 1.00 2.00 ? 189 ASP G CB 1 ATOM 4408 C CG . ASP F 5 49 ? 61.370 -10.006 90.206 1.00 2.00 ? 189 ASP G CG 1 ATOM 4409 O OD1 . ASP F 5 49 ? 61.558 -9.354 89.155 1.00 2.00 ? 189 ASP G OD1 1 ATOM 4410 O OD2 . ASP F 5 49 ? 61.968 -9.768 91.271 1.00 2.00 ? 189 ASP G OD2 1 ATOM 4411 N N . ALA F 5 50 ? 62.954 -12.090 88.819 1.00 2.00 ? 190 ALA G N 1 ATOM 4412 C CA . ALA F 5 50 ? 64.290 -12.659 88.930 1.00 2.00 ? 190 ALA G CA 1 ATOM 4413 C C . ALA F 5 50 ? 64.643 -12.554 90.401 1.00 2.00 ? 190 ALA G C 1 ATOM 4414 O O . ALA F 5 50 ? 64.026 -11.781 91.128 1.00 50.27 ? 190 ALA G O 1 ATOM 4415 C CB . ALA F 5 50 ? 65.279 -11.863 88.098 1.00 50.27 ? 190 ALA G CB 1 ATOM 4416 N N . CYS F 5 51 ? 65.633 -13.314 90.843 1.00 32.99 ? 191 CYS G N 1 ATOM 4417 C CA . CYS F 5 51 ? 66.013 -13.276 92.246 1.00 32.99 ? 191 CYS G CA 1 ATOM 4418 C C . CYS F 5 51 ? 67.503 -13.520 92.405 1.00 32.99 ? 191 CYS G C 1 ATOM 4419 O O . CYS F 5 51 ? 68.245 -13.494 91.420 1.00 19.17 ? 191 CYS G O 1 ATOM 4420 C CB . CYS F 5 51 ? 65.231 -14.337 93.026 1.00 19.17 ? 191 CYS G CB 1 ATOM 4421 S SG . CYS F 5 51 ? 65.232 -14.013 94.815 1.00 19.17 ? 191 CYS G SG 1 ATOM 4422 N N . GLU F 5 52 ? 67.927 -13.781 93.641 1.00 2.00 ? 192 GLU G N 1 ATOM 4423 C CA . GLU F 5 52 ? 69.322 -14.053 93.930 1.00 2.00 ? 192 GLU G CA 1 ATOM 4424 C C . GLU F 5 52 ? 69.762 -15.215 93.052 1.00 2.00 ? 192 GLU G C 1 ATOM 4425 O O . GLU F 5 52 ? 69.031 -16.186 92.881 1.00 33.15 ? 192 GLU G O 1 ATOM 4426 C CB . GLU F 5 52 ? 69.507 -14.444 95.392 1.00 33.15 ? 192 GLU G CB 1 ATOM 4427 C CG . GLU F 5 52 ? 69.228 -13.353 96.403 1.00 33.15 ? 192 GLU G CG 1 ATOM 4428 C CD . GLU F 5 52 ? 69.386 -13.849 97.832 1.00 33.15 ? 192 GLU G CD 1 ATOM 4429 O OE1 . GLU F 5 52 ? 70.496 -14.320 98.182 1.00 33.15 ? 192 GLU G OE1 1 ATOM 4430 O OE2 . GLU F 5 52 ? 68.394 -13.777 98.596 1.00 33.15 ? 192 GLU G OE2 1 ATOM 4431 N N . GLY F 5 53 ? 70.978 -15.116 92.533 1.00 40.11 ? 193 GLY G N 1 ATOM 4432 C CA . GLY F 5 53 ? 71.505 -16.137 91.655 1.00 40.11 ? 193 GLY G CA 1 ATOM 4433 C C . GLY F 5 53 ? 71.408 -15.594 90.242 1.00 40.11 ? 193 GLY G C 1 ATOM 4434 O O . GLY F 5 53 ? 72.421 -15.250 89.627 1.00 18.47 ? 193 GLY G O 1 ATOM 4435 N N . ASP F 5 54 ? 70.178 -15.371 89.792 1.00 2.00 ? 194 ASP G N 1 ATOM 4436 C CA . ASP F 5 54 ? 69.903 -14.874 88.448 1.00 2.00 ? 194 ASP G CA 1 ATOM 4437 C C . ASP F 5 54 ? 70.653 -13.605 87.996 1.00 2.00 ? 194 ASP G C 1 ATOM 4438 O O . ASP F 5 54 ? 70.531 -13.187 86.839 1.00 10.94 ? 194 ASP G O 1 ATOM 4439 C CB . ASP F 5 54 ? 68.404 -14.639 88.304 1.00 10.94 ? 194 ASP G CB 1 ATOM 4440 C CG . ASP F 5 54 ? 67.584 -15.749 88.905 1.00 10.94 ? 194 ASP G CG 1 ATOM 4441 O OD1 . ASP F 5 54 ? 67.288 -16.730 88.202 1.00 10.94 ? 194 ASP G OD1 1 ATOM 4442 O OD2 . ASP F 5 54 ? 67.230 -15.637 90.090 1.00 10.94 ? 194 ASP G OD2 1 ATOM 4443 N N . SER F 5 55 ? 71.393 -12.974 88.902 1.00 36.38 ? 195 SER G N 1 ATOM 4444 C CA . SER F 5 55 ? 72.144 -11.760 88.575 1.00 36.38 ? 195 SER G CA 1 ATOM 4445 C C . SER F 5 55 ? 73.164 -12.056 87.484 1.00 36.38 ? 195 SER G C 1 ATOM 4446 O O . SER F 5 55 ? 73.745 -13.134 87.450 1.00 17.68 ? 195 SER G O 1 ATOM 4447 C CB . SER F 5 55 ? 72.869 -11.215 89.817 1.00 17.68 ? 195 SER G CB 1 ATOM 4448 O OG . SER F 5 55 ? 72.069 -10.291 90.539 1.00 17.68 ? 195 SER G OG 1 ATOM 4449 N N . GLY F 5 56 ? 73.378 -11.093 86.596 1.00 20.11 ? 196 GLY G N 1 ATOM 4450 C CA . GLY F 5 56 ? 74.333 -11.275 85.518 1.00 20.11 ? 196 GLY G CA 1 ATOM 4451 C C . GLY F 5 56 ? 73.739 -12.027 84.348 1.00 20.11 ? 196 GLY G C 1 ATOM 4452 O O . GLY F 5 56 ? 74.370 -12.181 83.297 1.00 8.39 ? 196 GLY G O 1 ATOM 4453 N N . GLY F 5 57 ? 72.515 -12.502 84.541 1.00 21.30 ? 197 GLY G N 1 ATOM 4454 C CA . GLY F 5 57 ? 71.831 -13.224 83.493 1.00 21.30 ? 197 GLY G CA 1 ATOM 4455 C C . GLY F 5 57 ? 71.351 -12.289 82.399 1.00 21.30 ? 197 GLY G C 1 ATOM 4456 O O . GLY F 5 57 ? 71.605 -11.074 82.417 1.00 2.00 ? 197 GLY G O 1 ATOM 4457 N N . PRO F 5 58 ? 70.672 -12.851 81.400 1.00 2.00 ? 198 PRO G N 1 ATOM 4458 C CA . PRO F 5 58 ? 70.140 -12.085 80.278 1.00 2.00 ? 198 PRO G CA 1 ATOM 4459 C C . PRO F 5 58 ? 68.660 -11.754 80.497 1.00 2.00 ? 198 PRO G C 1 ATOM 4460 O O . PRO F 5 58 ? 68.002 -12.316 81.370 1.00 2.00 ? 198 PRO G O 1 ATOM 4461 C CB . PRO F 5 58 ? 70.276 -13.073 79.109 1.00 2.00 ? 198 PRO G CB 1 ATOM 4462 C CG . PRO F 5 58 ? 71.092 -14.259 79.674 1.00 2.00 ? 198 PRO G CG 1 ATOM 4463 C CD . PRO F 5 58 ? 70.667 -14.287 81.086 1.00 2.00 ? 198 PRO G CD 1 ATOM 4464 N N . PHE F 5 59 ? 68.167 -10.787 79.743 1.00 2.00 ? 199 PHE G N 1 ATOM 4465 C CA . PHE F 5 59 ? 66.757 -10.415 79.739 1.00 2.00 ? 199 PHE G CA 1 ATOM 4466 C C . PHE F 5 59 ? 66.647 -10.262 78.236 1.00 2.00 ? 199 PHE G C 1 ATOM 4467 O O . PHE F 5 59 ? 67.132 -9.271 77.658 1.00 2.00 ? 199 PHE G O 1 ATOM 4468 C CB . PHE F 5 59 ? 66.473 -9.078 80.441 1.00 2.00 ? 199 PHE G CB 1 ATOM 4469 C CG . PHE F 5 59 ? 65.022 -8.632 80.349 1.00 2.00 ? 199 PHE G CG 1 ATOM 4470 C CD1 . PHE F 5 59 ? 64.039 -9.235 81.128 1.00 2.00 ? 199 PHE G CD1 1 ATOM 4471 C CD2 . PHE F 5 59 ? 64.639 -7.609 79.477 1.00 2.00 ? 199 PHE G CD2 1 ATOM 4472 C CE1 . PHE F 5 59 ? 62.692 -8.824 81.040 1.00 2.00 ? 199 PHE G CE1 1 ATOM 4473 C CE2 . PHE F 5 59 ? 63.305 -7.195 79.384 1.00 2.00 ? 199 PHE G CE2 1 ATOM 4474 C CZ . PHE F 5 59 ? 62.333 -7.802 80.165 1.00 2.00 ? 199 PHE G CZ 1 ATOM 4475 N N . VAL F 5 60 ? 66.171 -11.329 77.602 1.00 11.26 ? 200 VAL G N 1 ATOM 4476 C CA . VAL F 5 60 ? 66.030 -11.372 76.152 1.00 11.26 ? 200 VAL G CA 1 ATOM 4477 C C . VAL F 5 60 ? 64.596 -11.191 75.647 1.00 11.26 ? 200 VAL G C 1 ATOM 4478 O O . VAL F 5 60 ? 63.621 -11.325 76.392 1.00 2.00 ? 200 VAL G O 1 ATOM 4479 C CB . VAL F 5 60 ? 66.615 -12.700 75.573 1.00 2.00 ? 200 VAL G CB 1 ATOM 4480 C CG1 . VAL F 5 60 ? 68.020 -12.951 76.132 1.00 2.00 ? 200 VAL G CG1 1 ATOM 4481 C CG2 . VAL F 5 60 ? 65.684 -13.884 75.867 1.00 2.00 ? 200 VAL G CG2 1 ATOM 4482 N N . MET F 5 61 ? 64.498 -10.869 74.368 1.00 2.00 ? 201 MET G N 1 ATOM 4483 C CA . MET F 5 61 ? 63.228 -10.681 73.701 1.00 2.00 ? 201 MET G CA 1 ATOM 4484 C C . MET F 5 61 ? 63.381 -11.300 72.332 1.00 2.00 ? 201 MET G C 1 ATOM 4485 O O . MET F 5 61 ? 64.496 -11.366 71.820 1.00 2.00 ? 201 MET G O 1 ATOM 4486 C CB . MET F 5 61 ? 62.944 -9.194 73.504 1.00 2.00 ? 201 MET G CB 1 ATOM 4487 C CG . MET F 5 61 ? 62.633 -8.418 74.751 1.00 2.00 ? 201 MET G CG 1 ATOM 4488 S SD . MET F 5 61 ? 62.338 -6.703 74.330 1.00 2.00 ? 201 MET G SD 1 ATOM 4489 C CE . MET F 5 61 ? 60.577 -6.709 74.074 1.00 2.00 ? 201 MET G CE 1 ATOM 4490 N N . LYS F 5 62 ? 62.306 -11.853 71.780 1.00 19.48 ? 202 LYS G N 1 ATOM 4491 C CA . LYS F 5 62 ? 62.387 -12.388 70.424 1.00 19.48 ? 202 LYS G CA 1 ATOM 4492 C C . LYS F 5 62 ? 61.787 -11.328 69.504 1.00 19.48 ? 202 LYS G C 1 ATOM 4493 O O . LYS F 5 62 ? 60.817 -10.660 69.881 1.00 2.00 ? 202 LYS G O 1 ATOM 4494 C CB . LYS F 5 62 ? 61.633 -13.699 70.242 1.00 2.00 ? 202 LYS G CB 1 ATOM 4495 C CG . LYS F 5 62 ? 61.777 -14.183 68.817 1.00 2.00 ? 202 LYS G CG 1 ATOM 4496 C CD . LYS F 5 62 ? 61.320 -15.589 68.609 1.00 2.00 ? 202 LYS G CD 1 ATOM 4497 C CE . LYS F 5 62 ? 61.354 -15.885 67.145 1.00 2.00 ? 202 LYS G CE 1 ATOM 4498 N NZ . LYS F 5 62 ? 60.810 -17.198 66.808 1.00 2.00 ? 202 LYS G NZ 1 ATOM 4499 N N . SER F 5 63 ? 62.380 -11.137 68.326 1.00 2.05 ? 203 SER G N 1 ATOM 4500 C CA . SER F 5 63 ? 61.867 -10.142 67.405 1.00 2.05 ? 203 SER G CA 1 ATOM 4501 C C . SER F 5 63 ? 60.821 -10.776 66.490 1.00 2.05 ? 203 SER G C 1 ATOM 4502 O O . SER F 5 63 ? 61.018 -11.872 65.977 1.00 2.00 ? 203 SER G O 1 ATOM 4503 C CB . SER F 5 63 ? 62.996 -9.509 66.592 1.00 2.00 ? 203 SER G CB 1 ATOM 4504 O OG . SER F 5 63 ? 62.563 -8.301 65.970 1.00 2.00 ? 203 SER G OG 1 ATOM 4505 N N . PRO F 5 64 ? 59.654 -10.126 66.347 1.00 5.13 ? 204 PRO G N 1 ATOM 4506 C CA . PRO F 5 64 ? 58.580 -10.628 65.496 1.00 5.13 ? 204 PRO G CA 1 ATOM 4507 C C . PRO F 5 64 ? 58.816 -10.300 64.029 1.00 5.13 ? 204 PRO G C 1 ATOM 4508 O O . PRO F 5 64 ? 58.156 -10.868 63.145 1.00 2.00 ? 204 PRO G O 1 ATOM 4509 C CB . PRO F 5 64 ? 57.376 -9.865 66.019 1.00 2.00 ? 204 PRO G CB 1 ATOM 4510 C CG . PRO F 5 64 ? 57.950 -8.561 66.346 1.00 2.00 ? 204 PRO G CG 1 ATOM 4511 C CD . PRO F 5 64 ? 59.179 -8.962 67.115 1.00 2.00 ? 204 PRO G CD 1 ATOM 4512 N N . TYR F 5 65 A 59.731 -9.355 63.797 1.00 8.73 ? 204 TYR G N 1 ATOM 4513 C CA . TYR F 5 65 A 60.081 -8.893 62.456 1.00 8.73 ? 204 TYR G CA 1 ATOM 4514 C C . TYR F 5 65 A 61.264 -9.637 61.862 1.00 8.73 ? 204 TYR G C 1 ATOM 4515 O O . TYR F 5 65 A 61.547 -9.474 60.674 1.00 30.81 ? 204 TYR G O 1 ATOM 4516 C CB . TYR F 5 65 A 60.439 -7.402 62.448 1.00 30.81 ? 204 TYR G CB 1 ATOM 4517 C CG . TYR F 5 65 A 59.734 -6.520 63.462 1.00 30.81 ? 204 TYR G CG 1 ATOM 4518 C CD1 . TYR F 5 65 A 58.343 -6.463 63.545 1.00 30.81 ? 204 TYR G CD1 1 ATOM 4519 C CD2 . TYR F 5 65 A 60.476 -5.710 64.319 1.00 30.81 ? 204 TYR G CD2 1 ATOM 4520 C CE1 . TYR F 5 65 A 57.714 -5.617 64.459 1.00 30.81 ? 204 TYR G CE1 1 ATOM 4521 C CE2 . TYR F 5 65 A 59.863 -4.863 65.228 1.00 30.81 ? 204 TYR G CE2 1 ATOM 4522 C CZ . TYR F 5 65 A 58.485 -4.814 65.301 1.00 30.81 ? 204 TYR G CZ 1 ATOM 4523 O OH . TYR F 5 65 A 57.901 -3.952 66.217 1.00 30.81 ? 204 TYR G OH 1 ATOM 4524 N N . ASN F 5 66 B 61.976 -10.416 62.676 1.00 11.17 ? 204 ASN G N 1 ATOM 4525 C CA . ASN F 5 66 B 63.140 -11.158 62.184 1.00 11.17 ? 204 ASN G CA 1 ATOM 4526 C C . ASN F 5 66 B 63.558 -12.345 63.045 1.00 11.17 ? 204 ASN G C 1 ATOM 4527 O O . ASN F 5 66 B 64.742 -12.638 63.187 1.00 21.76 ? 204 ASN G O 1 ATOM 4528 C CB . ASN F 5 66 B 64.335 -10.225 61.955 1.00 21.76 ? 204 ASN G CB 1 ATOM 4529 C CG . ASN F 5 66 B 64.736 -9.477 63.198 1.00 21.76 ? 204 ASN G CG 1 ATOM 4530 O OD1 . ASN F 5 66 B 63.914 -8.809 63.819 1.00 21.76 ? 204 ASN G OD1 1 ATOM 4531 N ND2 . ASN F 5 66 B 66.004 -9.567 63.561 1.00 21.76 ? 204 ASN G ND2 1 ATOM 4532 N N . ASN F 5 67 ? 62.553 -13.029 63.582 1.00 13.28 ? 205 ASN G N 1 ATOM 4533 C CA . ASN F 5 67 ? 62.663 -14.216 64.450 1.00 13.28 ? 205 ASN G CA 1 ATOM 4534 C C . ASN F 5 67 ? 63.871 -14.640 65.283 1.00 13.28 ? 205 ASN G C 1 ATOM 4535 O O . ASN F 5 67 ? 63.880 -15.753 65.790 1.00 2.00 ? 205 ASN G O 1 ATOM 4536 C CB . ASN F 5 67 ? 62.081 -15.443 63.748 1.00 2.00 ? 205 ASN G CB 1 ATOM 4537 C CG . ASN F 5 67 ? 60.567 -15.434 63.742 1.00 2.00 ? 205 ASN G CG 1 ATOM 4538 O OD1 . ASN F 5 67 ? 59.943 -14.452 63.326 1.00 2.00 ? 205 ASN G OD1 1 ATOM 4539 N ND2 . ASN F 5 67 ? 59.963 -16.512 64.235 1.00 2.00 ? 205 ASN G ND2 1 ATOM 4540 N N . ARG F 5 68 ? 64.831 -13.751 65.508 1.00 2.00 ? 206 ARG G N 1 ATOM 4541 C CA . ARG F 5 68 ? 66.023 -14.088 66.295 1.00 2.00 ? 206 ARG G CA 1 ATOM 4542 C C . ARG F 5 68 ? 65.985 -13.392 67.651 1.00 2.00 ? 206 ARG G C 1 ATOM 4543 O O . ARG F 5 68 ? 65.401 -12.308 67.792 1.00 2.00 ? 206 ARG G O 1 ATOM 4544 C CB . ARG F 5 68 ? 67.281 -13.663 65.547 1.00 2.00 ? 206 ARG G CB 1 ATOM 4545 C CG . ARG F 5 68 ? 67.300 -12.174 65.197 1.00 2.00 ? 206 ARG G CG 1 ATOM 4546 C CD . ARG F 5 68 ? 67.901 -11.944 63.836 1.00 2.00 ? 206 ARG G CD 1 ATOM 4547 N NE . ARG F 5 68 ? 69.143 -12.686 63.687 1.00 2.00 ? 206 ARG G NE 1 ATOM 4548 C CZ . ARG F 5 68 ? 69.542 -13.255 62.559 1.00 2.00 ? 206 ARG G CZ 1 ATOM 4549 N NH1 . ARG F 5 68 ? 68.803 -13.156 61.461 1.00 2.00 ? 206 ARG G NH1 1 ATOM 4550 N NH2 . ARG F 5 68 ? 70.688 -13.913 62.535 1.00 2.00 ? 206 ARG G NH2 1 ATOM 4551 N N . TRP F 5 69 ? 66.653 -13.988 68.633 1.00 2.00 ? 207 TRP G N 1 ATOM 4552 C CA . TRP F 5 69 ? 66.678 -13.443 69.987 1.00 2.00 ? 207 TRP G CA 1 ATOM 4553 C C . TRP F 5 69 ? 67.682 -12.343 70.277 1.00 2.00 ? 207 TRP G C 1 ATOM 4554 O O . TRP F 5 69 ? 68.882 -12.505 70.068 1.00 2.00 ? 207 TRP G O 1 ATOM 4555 C CB . TRP F 5 69 ? 66.849 -14.570 71.005 1.00 2.00 ? 207 TRP G CB 1 ATOM 4556 C CG . TRP F 5 69 ? 65.654 -15.444 71.076 1.00 2.00 ? 207 TRP G CG 1 ATOM 4557 C CD1 . TRP F 5 69 ? 65.395 -16.531 70.310 1.00 2.00 ? 207 TRP G CD1 1 ATOM 4558 C CD2 . TRP F 5 69 ? 64.512 -15.261 71.920 1.00 2.00 ? 207 TRP G CD2 1 ATOM 4559 N NE1 . TRP F 5 69 ? 64.159 -17.033 70.610 1.00 2.00 ? 207 TRP G NE1 1 ATOM 4560 C CE2 . TRP F 5 69 ? 63.593 -16.273 71.594 1.00 2.00 ? 207 TRP G CE2 1 ATOM 4561 C CE3 . TRP F 5 69 ? 64.174 -14.336 72.911 1.00 2.00 ? 207 TRP G CE3 1 ATOM 4562 C CZ2 . TRP F 5 69 ? 62.357 -16.392 72.230 1.00 2.00 ? 207 TRP G CZ2 1 ATOM 4563 C CZ3 . TRP F 5 69 ? 62.945 -14.454 73.539 1.00 2.00 ? 207 TRP G CZ3 1 ATOM 4564 C CH2 . TRP F 5 69 ? 62.051 -15.476 73.190 1.00 2.00 ? 207 TRP G CH2 1 ATOM 4565 N N . TYR F 5 70 ? 67.179 -11.245 70.826 1.00 2.00 ? 208 TYR G N 1 ATOM 4566 C CA . TYR F 5 70 ? 67.999 -10.093 71.171 1.00 2.00 ? 208 TYR G CA 1 ATOM 4567 C C . TYR F 5 70 ? 68.103 -9.927 72.669 1.00 2.00 ? 208 TYR G C 1 ATOM 4568 O O . TYR F 5 70 ? 67.121 -10.111 73.388 1.00 2.00 ? 208 TYR G O 1 ATOM 4569 C CB . TYR F 5 70 ? 67.409 -8.810 70.578 1.00 2.00 ? 208 TYR G CB 1 ATOM 4570 C CG . TYR F 5 70 ? 67.575 -8.676 69.081 1.00 2.00 ? 208 TYR G CG 1 ATOM 4571 C CD1 . TYR F 5 70 ? 66.803 -9.429 68.199 1.00 2.00 ? 208 TYR G CD1 1 ATOM 4572 C CD2 . TYR F 5 70 ? 68.505 -7.789 68.549 1.00 2.00 ? 208 TYR G CD2 1 ATOM 4573 C CE1 . TYR F 5 70 ? 66.958 -9.299 66.821 1.00 2.00 ? 208 TYR G CE1 1 ATOM 4574 C CE2 . TYR F 5 70 ? 68.666 -7.650 67.174 1.00 2.00 ? 208 TYR G CE2 1 ATOM 4575 C CZ . TYR F 5 70 ? 67.892 -8.406 66.314 1.00 2.00 ? 208 TYR G CZ 1 ATOM 4576 O OH . TYR F 5 70 ? 68.053 -8.262 64.952 1.00 2.00 ? 208 TYR G OH 1 ATOM 4577 N N . GLN F 5 71 ? 69.313 -9.616 73.126 1.00 2.00 ? 209 GLN G N 1 ATOM 4578 C CA . GLN F 5 71 ? 69.591 -9.382 74.538 1.00 2.00 ? 209 GLN G CA 1 ATOM 4579 C C . GLN F 5 71 ? 69.244 -7.938 74.716 1.00 2.00 ? 209 GLN G C 1 ATOM 4580 O O . GLN F 5 71 ? 69.899 -7.087 74.127 1.00 2.00 ? 209 GLN G O 1 ATOM 4581 C CB . GLN F 5 71 ? 71.071 -9.514 74.836 1.00 2.00 ? 209 GLN G CB 1 ATOM 4582 C CG . GLN F 5 71 ? 71.402 -9.229 76.277 1.00 2.00 ? 209 GLN G CG 1 ATOM 4583 C CD . GLN F 5 71 ? 71.716 -10.480 77.066 1.00 2.00 ? 209 GLN G CD 1 ATOM 4584 O OE1 . GLN F 5 71 ? 72.096 -10.411 78.236 1.00 2.00 ? 209 GLN G OE1 1 ATOM 4585 N NE2 . GLN F 5 71 ? 71.586 -11.636 76.426 1.00 2.00 ? 209 GLN G NE2 1 ATOM 4586 N N . MET F 5 72 ? 68.217 -7.664 75.512 1.00 13.84 ? 210 MET G N 1 ATOM 4587 C CA . MET F 5 72 ? 67.780 -6.301 75.745 1.00 13.84 ? 210 MET G CA 1 ATOM 4588 C C . MET F 5 72 ? 68.306 -5.785 77.070 1.00 13.84 ? 210 MET G C 1 ATOM 4589 O O . MET F 5 72 ? 68.562 -4.580 77.223 1.00 2.00 ? 210 MET G O 1 ATOM 4590 C CB . MET F 5 72 ? 66.254 -6.222 75.683 1.00 2.00 ? 210 MET G CB 1 ATOM 4591 C CG . MET F 5 72 ? 65.686 -6.573 74.310 1.00 2.00 ? 210 MET G CG 1 ATOM 4592 S SD . MET F 5 72 ? 66.133 -5.417 72.975 1.00 2.00 ? 210 MET G SD 1 ATOM 4593 C CE . MET F 5 72 ? 64.546 -4.837 72.600 1.00 2.00 ? 210 MET G CE 1 ATOM 4594 N N . GLY F 5 73 ? 68.530 -6.698 78.006 1.00 2.00 ? 211 GLY G N 1 ATOM 4595 C CA . GLY F 5 73 ? 69.033 -6.268 79.290 1.00 2.00 ? 211 GLY G CA 1 ATOM 4596 C C . GLY F 5 73 ? 69.703 -7.363 80.073 1.00 2.00 ? 211 GLY G C 1 ATOM 4597 O O . GLY F 5 73 ? 69.581 -8.539 79.713 1.00 2.00 ? 211 GLY G O 1 ATOM 4598 N N . ILE F 5 74 ? 70.440 -6.958 81.112 1.00 2.00 ? 212 ILE G N 1 ATOM 4599 C CA . ILE F 5 74 ? 71.150 -7.867 82.016 1.00 2.00 ? 212 ILE G CA 1 ATOM 4600 C C . ILE F 5 74 ? 70.529 -7.700 83.399 1.00 2.00 ? 212 ILE G C 1 ATOM 4601 O O . ILE F 5 74 ? 70.245 -6.574 83.814 1.00 39.91 ? 212 ILE G O 1 ATOM 4602 C CB . ILE F 5 74 ? 72.656 -7.513 82.113 1.00 39.91 ? 212 ILE G CB 1 ATOM 4603 C CG1 . ILE F 5 74 ? 73.381 -7.882 80.815 1.00 39.91 ? 212 ILE G CG1 1 ATOM 4604 C CG2 . ILE F 5 74 ? 73.297 -8.235 83.292 1.00 39.91 ? 212 ILE G CG2 1 ATOM 4605 C CD1 . ILE F 5 74 ? 74.877 -7.648 80.861 1.00 39.91 ? 212 ILE G CD1 1 ATOM 4606 N N . VAL F 5 75 ? 70.311 -8.805 84.108 1.00 2.00 ? 213 VAL G N 1 ATOM 4607 C CA . VAL F 5 75 ? 69.714 -8.751 85.441 1.00 2.00 ? 213 VAL G CA 1 ATOM 4608 C C . VAL F 5 75 ? 70.623 -7.990 86.409 1.00 2.00 ? 213 VAL G C 1 ATOM 4609 O O . VAL F 5 75 ? 71.639 -8.512 86.877 1.00 7.99 ? 213 VAL G O 1 ATOM 4610 C CB . VAL F 5 75 ? 69.424 -10.168 85.983 1.00 7.99 ? 213 VAL G CB 1 ATOM 4611 C CG1 . VAL F 5 75 ? 68.661 -10.087 87.294 1.00 7.99 ? 213 VAL G CG1 1 ATOM 4612 C CG2 . VAL F 5 75 ? 68.624 -10.958 84.974 1.00 7.99 ? 213 VAL G CG2 1 ATOM 4613 N N . SER F 5 76 ? 70.252 -6.750 86.703 1.00 2.00 ? 214 SER G N 1 ATOM 4614 C CA . SER F 5 76 ? 71.055 -5.914 87.588 1.00 2.00 ? 214 SER G CA 1 ATOM 4615 C C . SER F 5 76 ? 70.683 -5.970 89.059 1.00 2.00 ? 214 SER G C 1 ATOM 4616 O O . SER F 5 76 ? 71.382 -6.595 89.850 1.00 9.94 ? 214 SER G O 1 ATOM 4617 C CB . SER F 5 76 ? 71.037 -4.455 87.117 1.00 9.94 ? 214 SER G CB 1 ATOM 4618 O OG . SER F 5 76 ? 71.790 -3.629 87.986 1.00 9.94 ? 214 SER G OG 1 ATOM 4619 N N . TRP F 5 77 ? 69.611 -5.286 89.432 1.00 2.00 ? 215 TRP G N 1 ATOM 4620 C CA . TRP F 5 77 ? 69.209 -5.253 90.820 1.00 2.00 ? 215 TRP G CA 1 ATOM 4621 C C . TRP F 5 77 ? 67.722 -5.124 90.998 1.00 2.00 ? 215 TRP G C 1 ATOM 4622 O O . TRP F 5 77 ? 66.997 -4.698 90.103 1.00 2.00 ? 215 TRP G O 1 ATOM 4623 C CB . TRP F 5 77 ? 69.849 -4.057 91.496 1.00 2.00 ? 215 TRP G CB 1 ATOM 4624 C CG . TRP F 5 77 ? 69.318 -2.776 90.990 1.00 2.00 ? 215 TRP G CG 1 ATOM 4625 C CD1 . TRP F 5 77 ? 69.671 -2.141 89.840 1.00 2.00 ? 215 TRP G CD1 1 ATOM 4626 C CD2 . TRP F 5 77 ? 68.337 -1.948 91.624 1.00 2.00 ? 215 TRP G CD2 1 ATOM 4627 N NE1 . TRP F 5 77 ? 68.978 -0.963 89.719 1.00 2.00 ? 215 TRP G NE1 1 ATOM 4628 C CE2 . TRP F 5 77 ? 68.152 -0.820 90.803 1.00 2.00 ? 215 TRP G CE2 1 ATOM 4629 C CE3 . TRP F 5 77 ? 67.598 -2.048 92.808 1.00 2.00 ? 215 TRP G CE3 1 ATOM 4630 C CZ2 . TRP F 5 77 ? 67.258 0.203 91.126 1.00 2.00 ? 215 TRP G CZ2 1 ATOM 4631 C CZ3 . TRP F 5 77 ? 66.706 -1.027 93.126 1.00 2.00 ? 215 TRP G CZ3 1 ATOM 4632 C CH2 . TRP F 5 77 ? 66.548 0.081 92.286 1.00 2.00 ? 215 TRP G CH2 1 ATOM 4633 N N . GLY F 5 78 ? 67.298 -5.376 92.220 1.00 8.55 ? 216 GLY G N 1 ATOM 4634 C CA . GLY F 5 78 ? 65.897 -5.286 92.551 1.00 8.55 ? 216 GLY G CA 1 ATOM 4635 C C . GLY F 5 78 ? 65.815 -5.195 94.054 1.00 8.55 ? 216 GLY G C 1 ATOM 4636 O O . GLY F 5 78 ? 66.821 -5.383 94.756 1.00 20.32 ? 216 GLY G O 1 ATOM 4637 N N . GLU F 5 79 ? 64.637 -4.867 94.556 1.00 18.38 ? 217 GLU G N 1 ATOM 4638 C CA . GLU F 5 79 ? 64.465 -4.775 95.988 1.00 18.38 ? 217 GLU G CA 1 ATOM 4639 C C . GLU F 5 79 ? 63.513 -5.856 96.460 1.00 18.38 ? 217 GLU G C 1 ATOM 4640 O O . GLU F 5 79 ? 62.295 -5.684 96.500 1.00 22.34 ? 217 GLU G O 1 ATOM 4641 C CB . GLU F 5 79 ? 64.006 -3.381 96.390 1.00 22.34 ? 217 GLU G CB 1 ATOM 4642 C CG . GLU F 5 79 ? 65.028 -2.346 96.036 1.00 22.34 ? 217 GLU G CG 1 ATOM 4643 C CD . GLU F 5 79 ? 64.806 -1.071 96.767 1.00 22.34 ? 217 GLU G CD 1 ATOM 4644 O OE1 . GLU F 5 79 ? 63.856 -0.350 96.394 1.00 22.34 ? 217 GLU G OE1 1 ATOM 4645 O OE2 . GLU F 5 79 ? 65.585 -0.799 97.712 1.00 22.34 ? 217 GLU G OE2 1 ATOM 4646 N N . GLY F 5 80 ? 64.094 -7.004 96.762 1.00 2.00 ? 219 GLY G N 1 ATOM 4647 C CA . GLY F 5 80 ? 63.314 -8.121 97.227 1.00 2.00 ? 219 GLY G CA 1 ATOM 4648 C C . GLY F 5 80 ? 62.527 -8.762 96.111 1.00 2.00 ? 219 GLY G C 1 ATOM 4649 O O . GLY F 5 80 ? 61.603 -8.171 95.553 1.00 25.21 ? 219 GLY G O 1 ATOM 4650 N N . CYS F 5 81 ? 62.892 -9.998 95.808 1.00 11.04 ? 220 CYS G N 1 ATOM 4651 C CA . CYS F 5 81 ? 62.252 -10.783 94.759 1.00 11.04 ? 220 CYS G CA 1 ATOM 4652 C C . CYS F 5 81 ? 60.741 -10.982 94.877 1.00 11.04 ? 220 CYS G C 1 ATOM 4653 O O . CYS F 5 81 ? 60.269 -11.682 95.774 1.00 2.00 ? 220 CYS G O 1 ATOM 4654 C CB . CYS F 5 81 ? 62.912 -12.150 94.684 1.00 2.00 ? 220 CYS G CB 1 ATOM 4655 S SG . CYS F 5 81 ? 64.715 -12.057 94.836 1.00 2.00 ? 220 CYS G SG 1 ATOM 4656 N N . ASP F 5 82 ? 60.006 -10.389 93.939 1.00 2.00 ? 221 ASP G N 1 ATOM 4657 C CA . ASP F 5 82 ? 58.555 -10.508 93.868 1.00 2.00 ? 221 ASP G CA 1 ATOM 4658 C C . ASP F 5 82 ? 57.729 -9.748 94.911 1.00 2.00 ? 221 ASP G C 1 ATOM 4659 O O . ASP F 5 82 ? 56.657 -10.203 95.316 1.00 2.00 ? 221 ASP G O 1 ATOM 4660 C CB . ASP F 5 82 ? 58.160 -11.982 93.878 1.00 2.00 ? 221 ASP G CB 1 ATOM 4661 C CG . ASP F 5 82 ? 57.214 -12.347 92.756 1.00 2.00 ? 221 ASP G CG 1 ATOM 4662 O OD1 . ASP F 5 82 ? 56.745 -11.460 92.003 1.00 2.00 ? 221 ASP G OD1 1 ATOM 4663 O OD2 . ASP F 5 82 ? 56.931 -13.551 92.631 1.00 2.00 ? 221 ASP G OD2 1 ATOM 4664 N N . ARG F 5 83 A 58.210 -8.590 95.341 1.00 34.30 ? 221 ARG G N 1 ATOM 4665 C CA . ARG F 5 83 A 57.468 -7.785 96.311 1.00 34.30 ? 221 ARG G CA 1 ATOM 4666 C C . ARG F 5 83 A 56.446 -6.891 95.585 1.00 34.30 ? 221 ARG G C 1 ATOM 4667 O O . ARG F 5 83 A 56.808 -6.117 94.690 1.00 17.31 ? 221 ARG G O 1 ATOM 4668 C CB . ARG F 5 83 A 58.436 -6.922 97.133 1.00 17.31 ? 221 ARG G CB 1 ATOM 4669 C CG . ARG F 5 83 A 59.411 -7.720 97.968 1.00 17.31 ? 221 ARG G CG 1 ATOM 4670 C CD . ARG F 5 83 A 58.725 -8.302 99.190 1.00 17.31 ? 221 ARG G CD 1 ATOM 4671 N NE . ARG F 5 83 A 58.732 -7.387 100.333 1.00 17.31 ? 221 ARG G NE 1 ATOM 4672 C CZ . ARG F 5 83 A 59.752 -7.253 101.185 1.00 17.31 ? 221 ARG G CZ 1 ATOM 4673 N NH1 . ARG F 5 83 A 60.877 -7.942 101.019 1.00 17.31 ? 221 ARG G NH1 1 ATOM 4674 N NH2 . ARG F 5 83 A 59.664 -6.403 102.197 1.00 17.31 ? 221 ARG G NH2 1 ATOM 4675 N N . ASP F 5 84 ? 55.171 -7.016 95.950 1.00 4.02 ? 222 ASP G N 1 ATOM 4676 C CA . ASP F 5 84 ? 54.110 -6.221 95.331 1.00 4.02 ? 222 ASP G CA 1 ATOM 4677 C C . ASP F 5 84 ? 54.494 -4.751 95.298 1.00 4.02 ? 222 ASP G C 1 ATOM 4678 O O . ASP F 5 84 ? 54.853 -4.179 96.327 1.00 2.00 ? 222 ASP G O 1 ATOM 4679 C CB . ASP F 5 84 ? 52.797 -6.358 96.112 1.00 2.00 ? 222 ASP G CB 1 ATOM 4680 C CG . ASP F 5 84 ? 52.082 -7.668 95.852 1.00 2.00 ? 222 ASP G CG 1 ATOM 4681 O OD1 . ASP F 5 84 ? 52.760 -8.692 95.607 1.00 2.00 ? 222 ASP G OD1 1 ATOM 4682 O OD2 . ASP F 5 84 ? 50.831 -7.667 95.916 1.00 2.00 ? 222 ASP G OD2 1 ATOM 4683 N N . GLY F 5 85 ? 54.406 -4.144 94.118 1.00 2.00 ? 223 GLY G N 1 ATOM 4684 C CA . GLY F 5 85 ? 54.741 -2.736 93.983 1.00 2.00 ? 223 GLY G CA 1 ATOM 4685 C C . GLY F 5 85 ? 56.171 -2.469 93.572 1.00 2.00 ? 223 GLY G C 1 ATOM 4686 O O . GLY F 5 85 ? 56.479 -1.379 93.086 1.00 2.00 ? 223 GLY G O 1 ATOM 4687 N N . LYS F 5 86 ? 57.051 -3.438 93.810 1.00 2.00 ? 224 LYS G N 1 ATOM 4688 C CA . LYS F 5 86 ? 58.451 -3.301 93.461 1.00 2.00 ? 224 LYS G CA 1 ATOM 4689 C C . LYS F 5 86 ? 58.663 -3.946 92.110 1.00 2.00 ? 224 LYS G C 1 ATOM 4690 O O . LYS F 5 86 ? 57.877 -4.793 91.690 1.00 2.00 ? 224 LYS G O 1 ATOM 4691 C CB . LYS F 5 86 ? 59.332 -3.976 94.505 1.00 2.00 ? 224 LYS G CB 1 ATOM 4692 C CG . LYS F 5 86 ? 59.066 -3.509 95.915 1.00 2.00 ? 224 LYS G CG 1 ATOM 4693 C CD . LYS F 5 86 ? 59.195 -1.996 96.082 1.00 2.00 ? 224 LYS G CD 1 ATOM 4694 C CE . LYS F 5 86 ? 60.652 -1.540 96.118 1.00 2.00 ? 224 LYS G CE 1 ATOM 4695 N NZ . LYS F 5 86 ? 61.295 -1.436 94.779 1.00 2.00 ? 224 LYS G NZ 1 ATOM 4696 N N . TYR F 5 87 ? 59.712 -3.517 91.417 1.00 2.00 ? 225 TYR G N 1 ATOM 4697 C CA . TYR F 5 87 ? 60.042 -4.058 90.110 1.00 2.00 ? 225 TYR G CA 1 ATOM 4698 C C . TYR F 5 87 ? 61.509 -4.449 90.047 1.00 2.00 ? 225 TYR G C 1 ATOM 4699 O O . TYR F 5 87 ? 62.278 -4.139 90.958 1.00 2.00 ? 225 TYR G O 1 ATOM 4700 C CB . TYR F 5 87 ? 59.721 -3.030 89.035 1.00 2.00 ? 225 TYR G CB 1 ATOM 4701 C CG . TYR F 5 87 ? 58.247 -2.708 88.949 1.00 2.00 ? 225 TYR G CG 1 ATOM 4702 C CD1 . TYR F 5 87 ? 57.359 -3.592 88.346 1.00 2.00 ? 225 TYR G CD1 1 ATOM 4703 C CD2 . TYR F 5 87 ? 57.738 -1.530 89.483 1.00 2.00 ? 225 TYR G CD2 1 ATOM 4704 C CE1 . TYR F 5 87 ? 56.012 -3.313 88.279 1.00 2.00 ? 225 TYR G CE1 1 ATOM 4705 C CE2 . TYR F 5 87 ? 56.392 -1.249 89.416 1.00 2.00 ? 225 TYR G CE2 1 ATOM 4706 C CZ . TYR F 5 87 ? 55.540 -2.144 88.813 1.00 2.00 ? 225 TYR G CZ 1 ATOM 4707 O OH . TYR F 5 87 ? 54.212 -1.860 88.731 1.00 2.00 ? 225 TYR G OH 1 ATOM 4708 N N . GLY F 5 88 ? 61.880 -5.165 88.991 1.00 2.00 ? 226 GLY G N 1 ATOM 4709 C CA . GLY F 5 88 ? 63.254 -5.596 88.816 1.00 2.00 ? 226 GLY G CA 1 ATOM 4710 C C . GLY F 5 88 ? 63.914 -4.759 87.744 1.00 2.00 ? 226 GLY G C 1 ATOM 4711 O O . GLY F 5 88 ? 63.380 -4.654 86.637 1.00 2.00 ? 226 GLY G O 1 ATOM 4712 N N . PHE F 5 89 ? 65.045 -4.142 88.089 1.00 2.00 ? 227 PHE G N 1 ATOM 4713 C CA . PHE F 5 89 ? 65.824 -3.300 87.177 1.00 2.00 ? 227 PHE G CA 1 ATOM 4714 C C . PHE F 5 89 ? 66.904 -4.041 86.371 1.00 2.00 ? 227 PHE G C 1 ATOM 4715 O O . PHE F 5 89 ? 67.724 -4.770 86.934 1.00 2.00 ? 227 PHE G O 1 ATOM 4716 C CB . PHE F 5 89 ? 66.459 -2.164 87.959 1.00 2.00 ? 227 PHE G CB 1 ATOM 4717 C CG . PHE F 5 89 ? 65.519 -1.046 88.254 1.00 2.00 ? 227 PHE G CG 1 ATOM 4718 C CD1 . PHE F 5 89 ? 64.500 -1.209 89.176 1.00 2.00 ? 227 PHE G CD1 1 ATOM 4719 C CD2 . PHE F 5 89 ? 65.643 0.179 87.589 1.00 2.00 ? 227 PHE G CD2 1 ATOM 4720 C CE1 . PHE F 5 89 ? 63.610 -0.163 89.429 1.00 2.00 ? 227 PHE G CE1 1 ATOM 4721 C CE2 . PHE F 5 89 ? 64.770 1.216 87.834 1.00 2.00 ? 227 PHE G CE2 1 ATOM 4722 C CZ . PHE F 5 89 ? 63.750 1.051 88.753 1.00 2.00 ? 227 PHE G CZ 1 ATOM 4723 N N . TYR F 5 90 ? 66.922 -3.838 85.057 1.00 2.00 ? 228 TYR G N 1 ATOM 4724 C CA . TYR F 5 90 ? 67.899 -4.507 84.191 1.00 2.00 ? 228 TYR G CA 1 ATOM 4725 C C . TYR F 5 90 ? 68.733 -3.518 83.409 1.00 2.00 ? 228 TYR G C 1 ATOM 4726 O O . TYR F 5 90 ? 68.197 -2.598 82.787 1.00 2.00 ? 228 TYR G O 1 ATOM 4727 C CB . TYR F 5 90 ? 67.207 -5.414 83.170 1.00 2.00 ? 228 TYR G CB 1 ATOM 4728 C CG . TYR F 5 90 ? 66.337 -6.503 83.747 1.00 2.00 ? 228 TYR G CG 1 ATOM 4729 C CD1 . TYR F 5 90 ? 65.107 -6.208 84.350 1.00 2.00 ? 228 TYR G CD1 1 ATOM 4730 C CD2 . TYR F 5 90 ? 66.718 -7.834 83.654 1.00 2.00 ? 228 TYR G CD2 1 ATOM 4731 C CE1 . TYR F 5 90 ? 64.289 -7.213 84.837 1.00 2.00 ? 228 TYR G CE1 1 ATOM 4732 C CE2 . TYR F 5 90 ? 65.907 -8.847 84.137 1.00 2.00 ? 228 TYR G CE2 1 ATOM 4733 C CZ . TYR F 5 90 ? 64.699 -8.533 84.724 1.00 2.00 ? 228 TYR G CZ 1 ATOM 4734 O OH . TYR F 5 90 ? 63.912 -9.556 85.185 1.00 2.00 ? 228 TYR G OH 1 ATOM 4735 N N . THR F 5 91 ? 70.038 -3.739 83.387 1.00 2.00 ? 229 THR G N 1 ATOM 4736 C CA . THR F 5 91 ? 70.944 -2.858 82.658 1.00 2.00 ? 229 THR G CA 1 ATOM 4737 C C . THR F 5 91 ? 70.550 -2.736 81.180 1.00 2.00 ? 229 THR G C 1 ATOM 4738 O O . THR F 5 91 ? 70.515 -3.728 80.456 1.00 46.08 ? 229 THR G O 1 ATOM 4739 C CB . THR F 5 91 ? 72.416 -3.344 82.771 1.00 46.08 ? 229 THR G CB 1 ATOM 4740 O OG1 . THR F 5 91 ? 72.489 -4.505 83.614 1.00 46.08 ? 229 THR G OG1 1 ATOM 4741 C CG2 . THR F 5 91 ? 73.284 -2.246 83.374 1.00 46.08 ? 229 THR G CG2 1 ATOM 4742 N N . HIS F 5 92 ? 70.219 -1.524 80.756 1.00 2.00 ? 230 HIS G N 1 ATOM 4743 C CA . HIS F 5 92 ? 69.823 -1.249 79.378 1.00 2.00 ? 230 HIS G CA 1 ATOM 4744 C C . HIS F 5 92 ? 71.021 -1.460 78.446 1.00 2.00 ? 230 HIS G C 1 ATOM 4745 O O . HIS F 5 92 ? 71.867 -0.557 78.308 1.00 2.00 ? 230 HIS G O 1 ATOM 4746 C CB . HIS F 5 92 ? 69.345 0.202 79.284 1.00 2.00 ? 230 HIS G CB 1 ATOM 4747 C CG . HIS F 5 92 ? 68.577 0.525 78.037 1.00 2.00 ? 230 HIS G CG 1 ATOM 4748 N ND1 . HIS F 5 92 ? 68.517 -0.324 76.952 1.00 2.00 ? 230 HIS G ND1 1 ATOM 4749 C CD2 . HIS F 5 92 ? 67.835 1.607 77.710 1.00 2.00 ? 230 HIS G CD2 1 ATOM 4750 C CE1 . HIS F 5 92 ? 67.771 0.224 76.012 1.00 2.00 ? 230 HIS G CE1 1 ATOM 4751 N NE2 . HIS F 5 92 ? 67.346 1.397 76.445 1.00 2.00 ? 230 HIS G NE2 1 ATOM 4752 N N . VAL F 5 93 ? 71.050 -2.603 77.748 1.00 2.00 ? 231 VAL G N 1 ATOM 4753 C CA . VAL F 5 93 ? 72.169 -2.935 76.845 1.00 2.00 ? 231 VAL G CA 1 ATOM 4754 C C . VAL F 5 93 ? 72.307 -2.036 75.607 1.00 2.00 ? 231 VAL G C 1 ATOM 4755 O O . VAL F 5 93 ? 73.420 -1.651 75.229 1.00 2.00 ? 231 VAL G O 1 ATOM 4756 C CB . VAL F 5 93 ? 72.206 -4.458 76.465 1.00 2.00 ? 231 VAL G CB 1 ATOM 4757 C CG1 . VAL F 5 93 ? 73.187 -4.722 75.321 1.00 2.00 ? 231 VAL G CG1 1 ATOM 4758 C CG2 . VAL F 5 93 ? 72.646 -5.274 77.672 1.00 2.00 ? 231 VAL G CG2 1 ATOM 4759 N N . PHE F 5 94 ? 71.185 -1.647 75.010 1.00 8.48 ? 232 PHE G N 1 ATOM 4760 C CA . PHE F 5 94 ? 71.245 -0.788 73.838 1.00 8.48 ? 232 PHE G CA 1 ATOM 4761 C C . PHE F 5 94 ? 71.915 0.538 74.177 1.00 8.48 ? 232 PHE G C 1 ATOM 4762 O O . PHE F 5 94 ? 72.778 1.016 73.436 1.00 2.00 ? 232 PHE G O 1 ATOM 4763 C CB . PHE F 5 94 ? 69.851 -0.523 73.263 1.00 2.00 ? 232 PHE G CB 1 ATOM 4764 C CG . PHE F 5 94 ? 69.850 0.472 72.136 1.00 2.00 ? 232 PHE G CG 1 ATOM 4765 C CD1 . PHE F 5 94 ? 70.827 0.406 71.132 1.00 2.00 ? 232 PHE G CD1 1 ATOM 4766 C CD2 . PHE F 5 94 ? 68.933 1.525 72.115 1.00 2.00 ? 232 PHE G CD2 1 ATOM 4767 C CE1 . PHE F 5 94 ? 70.900 1.376 70.131 1.00 2.00 ? 232 PHE G CE1 1 ATOM 4768 C CE2 . PHE F 5 94 ? 68.996 2.502 71.116 1.00 2.00 ? 232 PHE G CE2 1 ATOM 4769 C CZ . PHE F 5 94 ? 69.986 2.430 70.121 1.00 2.00 ? 232 PHE G CZ 1 ATOM 4770 N N . ARG F 5 95 ? 71.517 1.129 75.298 1.00 2.00 ? 233 ARG G N 1 ATOM 4771 C CA . ARG F 5 95 ? 72.092 2.397 75.713 1.00 2.00 ? 233 ARG G CA 1 ATOM 4772 C C . ARG F 5 95 ? 73.452 2.292 76.381 1.00 2.00 ? 233 ARG G C 1 ATOM 4773 O O . ARG F 5 95 ? 73.926 3.246 76.998 1.00 32.88 ? 233 ARG G O 1 ATOM 4774 C CB . ARG F 5 95 ? 71.113 3.196 76.553 1.00 32.88 ? 233 ARG G CB 1 ATOM 4775 C CG . ARG F 5 95 ? 70.082 3.856 75.695 1.00 32.88 ? 233 ARG G CG 1 ATOM 4776 C CD . ARG F 5 95 ? 69.515 5.082 76.362 1.00 32.88 ? 233 ARG G CD 1 ATOM 4777 N NE . ARG F 5 95 ? 68.263 4.806 77.055 1.00 32.88 ? 233 ARG G NE 1 ATOM 4778 C CZ . ARG F 5 95 ? 67.380 5.741 77.375 1.00 32.88 ? 233 ARG G CZ 1 ATOM 4779 N NH1 . ARG F 5 95 ? 67.624 7.010 77.074 1.00 32.88 ? 233 ARG G NH1 1 ATOM 4780 N NH2 . ARG F 5 95 ? 66.263 5.411 78.004 1.00 32.88 ? 233 ARG G NH2 1 ATOM 4781 N N . LEU F 5 96 ? 74.090 1.141 76.217 1.00 20.60 ? 234 LEU G N 1 ATOM 4782 C CA . LEU F 5 96 ? 75.426 0.892 76.749 1.00 20.60 ? 234 LEU G CA 1 ATOM 4783 C C . LEU F 5 96 ? 76.280 0.263 75.657 1.00 20.60 ? 234 LEU G C 1 ATOM 4784 O O . LEU F 5 96 ? 77.493 0.122 75.808 1.00 13.56 ? 234 LEU G O 1 ATOM 4785 C CB . LEU F 5 96 ? 75.347 -0.061 77.929 1.00 13.56 ? 234 LEU G CB 1 ATOM 4786 C CG . LEU F 5 96 ? 75.015 0.657 79.225 1.00 13.56 ? 234 LEU G CG 1 ATOM 4787 C CD1 . LEU F 5 96 ? 74.578 -0.327 80.291 1.00 13.56 ? 234 LEU G CD1 1 ATOM 4788 C CD2 . LEU F 5 96 ? 76.232 1.443 79.661 1.00 13.56 ? 234 LEU G CD2 1 ATOM 4789 N N . LYS F 5 97 ? 75.632 -0.046 74.535 1.00 14.22 ? 235 LYS G N 1 ATOM 4790 C CA . LYS F 5 97 ? 76.233 -0.691 73.370 1.00 14.22 ? 235 LYS G CA 1 ATOM 4791 C C . LYS F 5 97 ? 77.544 -0.143 72.806 1.00 14.22 ? 235 LYS G C 1 ATOM 4792 O O . LYS F 5 97 ? 78.399 -0.930 72.369 1.00 38.34 ? 235 LYS G O 1 ATOM 4793 C CB . LYS F 5 97 ? 75.201 -0.782 72.244 1.00 38.34 ? 235 LYS G CB 1 ATOM 4794 C CG . LYS F 5 97 ? 75.641 -1.639 71.064 1.00 38.34 ? 235 LYS G CG 1 ATOM 4795 C CD . LYS F 5 97 ? 74.656 -1.550 69.910 1.00 38.34 ? 235 LYS G CD 1 ATOM 4796 C CE . LYS F 5 97 ? 74.962 -2.594 68.854 1.00 38.34 ? 235 LYS G CE 1 ATOM 4797 N NZ . LYS F 5 97 ? 74.878 -3.978 69.411 1.00 38.34 ? 235 LYS G NZ 1 ATOM 4798 N N . LYS F 5 98 ? 77.702 1.182 72.779 1.00 2.00 ? 236 LYS G N 1 ATOM 4799 C CA . LYS F 5 98 ? 78.932 1.764 72.242 1.00 2.00 ? 236 LYS G CA 1 ATOM 4800 C C . LYS F 5 98 ? 80.140 1.321 73.031 1.00 2.00 ? 236 LYS G C 1 ATOM 4801 O O . LYS F 5 98 ? 81.195 1.048 72.466 1.00 27.14 ? 236 LYS G O 1 ATOM 4802 C CB . LYS F 5 98 ? 78.876 3.283 72.180 1.00 27.14 ? 236 LYS G CB 1 ATOM 4803 C CG . LYS F 5 98 ? 78.074 3.808 70.994 1.00 27.14 ? 236 LYS G CG 1 ATOM 4804 C CD . LYS F 5 98 ? 78.645 3.350 69.651 1.00 27.14 ? 236 LYS G CD 1 ATOM 4805 C CE . LYS F 5 98 ? 77.714 3.740 68.503 1.00 27.14 ? 236 LYS G CE 1 ATOM 4806 N NZ . LYS F 5 98 ? 78.129 3.197 67.178 1.00 27.14 ? 236 LYS G NZ 1 ATOM 4807 N N . TRP F 5 99 ? 79.975 1.207 74.340 1.00 13.68 ? 237 TRP G N 1 ATOM 4808 C CA . TRP F 5 99 ? 81.069 0.759 75.171 1.00 13.68 ? 237 TRP G CA 1 ATOM 4809 C C . TRP F 5 99 ? 81.440 -0.666 74.785 1.00 13.68 ? 237 TRP G C 1 ATOM 4810 O O . TRP F 5 99 ? 82.624 -0.961 74.653 1.00 2.00 ? 237 TRP G O 1 ATOM 4811 C CB . TRP F 5 99 ? 80.706 0.827 76.649 1.00 2.00 ? 237 TRP G CB 1 ATOM 4812 C CG . TRP F 5 99 ? 81.871 0.522 77.477 1.00 2.00 ? 237 TRP G CG 1 ATOM 4813 C CD1 . TRP F 5 99 ? 82.956 1.314 77.664 1.00 2.00 ? 237 TRP G CD1 1 ATOM 4814 C CD2 . TRP F 5 99 ? 82.132 -0.702 78.174 1.00 2.00 ? 237 TRP G CD2 1 ATOM 4815 N NE1 . TRP F 5 99 ? 83.887 0.660 78.428 1.00 2.00 ? 237 TRP G NE1 1 ATOM 4816 C CE2 . TRP F 5 99 ? 83.406 -0.581 78.757 1.00 2.00 ? 237 TRP G CE2 1 ATOM 4817 C CE3 . TRP F 5 99 ? 81.416 -1.885 78.360 1.00 2.00 ? 237 TRP G CE3 1 ATOM 4818 C CZ2 . TRP F 5 99 ? 83.986 -1.607 79.520 1.00 2.00 ? 237 TRP G CZ2 1 ATOM 4819 C CZ3 . TRP F 5 99 ? 81.989 -2.900 79.115 1.00 2.00 ? 237 TRP G CZ3 1 ATOM 4820 C CH2 . TRP F 5 99 ? 83.262 -2.754 79.685 1.00 2.00 ? 237 TRP G CH2 1 ATOM 4821 N N . ILE F 5 100 ? 80.431 -1.521 74.570 1.00 35.51 ? 238 ILE G N 1 ATOM 4822 C CA . ILE F 5 100 ? 80.625 -2.934 74.183 1.00 35.51 ? 238 ILE G CA 1 ATOM 4823 C C . ILE F 5 100 ? 81.474 -3.000 72.908 1.00 35.51 ? 238 ILE G C 1 ATOM 4824 O O . ILE F 5 100 ? 82.419 -3.795 72.804 1.00 2.00 ? 238 ILE G O 1 ATOM 4825 C CB . ILE F 5 100 ? 79.275 -3.669 73.897 1.00 2.00 ? 238 ILE G CB 1 ATOM 4826 C CG1 . ILE F 5 100 ? 78.201 -3.241 74.891 1.00 2.00 ? 238 ILE G CG1 1 ATOM 4827 C CG2 . ILE F 5 100 ? 79.445 -5.184 74.044 1.00 2.00 ? 238 ILE G CG2 1 ATOM 4828 C CD1 . ILE F 5 100 ? 76.822 -3.772 74.540 1.00 2.00 ? 238 ILE G CD1 1 ATOM 4829 N N . GLN F 5 101 ? 81.123 -2.162 71.937 1.00 37.68 ? 239 GLN G N 1 ATOM 4830 C CA . GLN F 5 101 ? 81.869 -2.104 70.691 1.00 37.68 ? 239 GLN G CA 1 ATOM 4831 C C . GLN F 5 101 ? 83.278 -1.576 70.957 1.00 37.68 ? 239 GLN G C 1 ATOM 4832 O O . GLN F 5 101 ? 84.264 -2.234 70.630 1.00 24.55 ? 239 GLN G O 1 ATOM 4833 C CB . GLN F 5 101 ? 81.129 -1.245 69.673 1.00 24.55 ? 239 GLN G CB 1 ATOM 4834 C CG . GLN F 5 101 ? 80.241 -2.071 68.768 1.00 24.55 ? 239 GLN G CG 1 ATOM 4835 C CD . GLN F 5 101 ? 78.950 -1.380 68.420 1.00 24.55 ? 239 GLN G CD 1 ATOM 4836 O OE1 . GLN F 5 101 ? 78.798 -0.173 68.610 1.00 24.55 ? 239 GLN G OE1 1 ATOM 4837 N NE2 . GLN F 5 101 ? 77.997 -2.150 67.919 1.00 24.55 ? 239 GLN G NE2 1 ATOM 4838 N N . LYS F 5 102 ? 83.366 -0.440 71.637 1.00 2.00 ? 240 LYS G N 1 ATOM 4839 C CA . LYS F 5 102 ? 84.643 0.178 71.978 1.00 2.00 ? 240 LYS G CA 1 ATOM 4840 C C . LYS F 5 102 ? 85.591 -0.795 72.694 1.00 2.00 ? 240 LYS G C 1 ATOM 4841 O O . LYS F 5 102 ? 86.812 -0.679 72.573 1.00 43.91 ? 240 LYS G O 1 ATOM 4842 C CB . LYS F 5 102 ? 84.399 1.427 72.843 1.00 43.91 ? 240 LYS G CB 1 ATOM 4843 C CG . LYS F 5 102 ? 85.633 2.294 73.118 1.00 43.91 ? 240 LYS G CG 1 ATOM 4844 C CD . LYS F 5 102 ? 85.269 3.633 73.788 1.00 43.91 ? 240 LYS G CD 1 ATOM 4845 C CE . LYS F 5 102 ? 84.894 3.499 75.276 1.00 43.91 ? 240 LYS G CE 1 ATOM 4846 N NZ . LYS F 5 102 ? 86.069 3.311 76.192 1.00 43.91 ? 240 LYS G NZ 1 ATOM 4847 N N . VAL F 5 103 ? 85.037 -1.762 73.419 1.00 31.93 ? 241 VAL G N 1 ATOM 4848 C CA . VAL F 5 103 ? 85.868 -2.732 74.124 1.00 31.93 ? 241 VAL G CA 1 ATOM 4849 C C . VAL F 5 103 ? 85.967 -4.106 73.474 1.00 31.93 ? 241 VAL G C 1 ATOM 4850 O O . VAL F 5 103 ? 86.669 -4.977 73.982 1.00 65.91 ? 241 VAL G O 1 ATOM 4851 C CB . VAL F 5 103 ? 85.504 -2.858 75.621 1.00 65.91 ? 241 VAL G CB 1 ATOM 4852 C CG1 . VAL F 5 103 ? 85.763 -1.540 76.321 1.00 65.91 ? 241 VAL G CG1 1 ATOM 4853 C CG2 . VAL F 5 103 ? 84.071 -3.279 75.793 1.00 65.91 ? 241 VAL G CG2 1 ATOM 4854 N N . ILE F 5 104 ? 85.262 -4.310 72.365 1.00 73.58 ? 242 ILE G N 1 ATOM 4855 C CA . ILE F 5 104 ? 85.349 -5.582 71.638 1.00 73.58 ? 242 ILE G CA 1 ATOM 4856 C C . ILE F 5 104 ? 86.161 -5.315 70.355 1.00 73.58 ? 242 ILE G C 1 ATOM 4857 O O . ILE F 5 104 ? 86.734 -6.223 69.747 1.00 52.95 ? 242 ILE G O 1 ATOM 4858 C CB . ILE F 5 104 ? 83.946 -6.186 71.327 1.00 52.95 ? 242 ILE G CB 1 ATOM 4859 C CG1 . ILE F 5 104 ? 83.274 -6.621 72.634 1.00 52.95 ? 242 ILE G CG1 1 ATOM 4860 C CG2 . ILE F 5 104 ? 84.074 -7.402 70.407 1.00 52.95 ? 242 ILE G CG2 1 ATOM 4861 C CD1 . ILE F 5 104 ? 81.998 -7.402 72.449 1.00 52.95 ? 242 ILE G CD1 1 ATOM 4862 N N . ASP F 5 105 ? 86.239 -4.037 69.999 1.00 50.31 ? 243 ASP G N 1 ATOM 4863 C CA . ASP F 5 105 ? 86.990 -3.559 68.844 1.00 50.31 ? 243 ASP G CA 1 ATOM 4864 C C . ASP F 5 105 ? 88.469 -3.675 69.214 1.00 50.31 ? 243 ASP G C 1 ATOM 4865 O O . ASP F 5 105 ? 89.331 -3.820 68.348 1.00 73.55 ? 243 ASP G O 1 ATOM 4866 C CB . ASP F 5 105 ? 86.621 -2.087 68.604 1.00 73.55 ? 243 ASP G CB 1 ATOM 4867 C CG . ASP F 5 105 ? 87.483 -1.412 67.550 1.00 73.55 ? 243 ASP G CG 1 ATOM 4868 O OD1 . ASP F 5 105 ? 87.278 -1.674 66.347 1.00 73.55 ? 243 ASP G OD1 1 ATOM 4869 O OD2 . ASP F 5 105 ? 88.342 -0.588 67.926 1.00 73.55 ? 243 ASP G OD2 1 ATOM 4870 N N . ARG F 5 106 ? 88.707 -3.679 70.526 1.00 85.25 ? 244 ARG G N 1 ATOM 4871 C CA . ARG F 5 106 ? 90.014 -3.744 71.189 1.00 85.25 ? 244 ARG G CA 1 ATOM 4872 C C . ARG F 5 106 ? 90.491 -2.315 71.436 1.00 85.25 ? 244 ARG G C 1 ATOM 4873 O O . ARG F 5 106 ? 90.630 -1.518 70.512 1.00 69.73 ? 244 ARG G O 1 ATOM 4874 C CB . ARG F 5 106 ? 91.059 -4.616 70.450 1.00 69.73 ? 244 ARG G CB 1 ATOM 4875 C CG . ARG F 5 106 ? 91.990 -3.914 69.464 1.00 69.73 ? 244 ARG G CG 1 ATOM 4876 C CD . ARG F 5 106 ? 93.392 -4.508 69.525 1.00 69.73 ? 244 ARG G CD 1 ATOM 4877 N NE . ARG F 5 106 ? 94.105 -4.084 70.731 1.00 69.73 ? 244 ARG G NE 1 ATOM 4878 C CZ . ARG F 5 106 ? 95.398 -4.300 70.956 1.00 69.73 ? 244 ARG G CZ 1 ATOM 4879 N NH1 . ARG F 5 106 ? 96.133 -4.957 70.063 1.00 69.73 ? 244 ARG G NH1 1 ATOM 4880 N NH2 . ARG F 5 106 ? 95.959 -3.867 72.081 1.00 69.73 ? 244 ARG G NH2 1 ATOM 4881 N N . LEU F 5 107 ? 90.640 -1.974 72.708 1.00 37.41 ? 245 LEU G N 1 ATOM 4882 C CA . LEU F 5 107 ? 91.045 -0.633 73.073 1.00 37.41 ? 245 LEU G CA 1 ATOM 4883 C C . LEU F 5 107 ? 92.477 -0.560 73.598 1.00 37.41 ? 245 LEU G C 1 ATOM 4884 O O . LEU F 5 107 ? 93.410 -0.354 72.822 1.00 70.24 ? 245 LEU G O 1 ATOM 4885 C CB . LEU F 5 107 ? 90.046 -0.066 74.081 1.00 70.24 ? 245 LEU G CB 1 ATOM 4886 C CG . LEU F 5 107 ? 89.940 1.452 74.190 1.00 70.24 ? 245 LEU G CG 1 ATOM 4887 C CD1 . LEU F 5 107 ? 89.821 2.081 72.810 1.00 70.24 ? 245 LEU G CD1 1 ATOM 4888 C CD2 . LEU F 5 107 ? 88.731 1.799 75.038 1.00 70.24 ? 245 LEU G CD2 1 ATOM 4889 N N . GLY F 5 108 ? 92.655 -0.751 74.902 1.00 90.12 ? 246 GLY G N 1 ATOM 4890 C CA . GLY F 5 108 ? 93.987 -0.683 75.482 1.00 90.12 ? 246 GLY G CA 1 ATOM 4891 C C . GLY F 5 108 ? 94.336 -1.840 76.397 1.00 90.12 ? 246 GLY G C 1 ATOM 4892 O O . GLY F 5 108 ? 93.730 -2.004 77.460 1.00 91.05 ? 246 GLY G O 1 ATOM 4893 N N . SER F 5 109 ? 95.303 -2.647 75.973 1.00 131.65 ? 247 SER G N 1 ATOM 4894 C CA . SER F 5 109 ? 95.758 -3.803 76.741 1.00 131.65 ? 247 SER G CA 1 ATOM 4895 C C . SER F 5 109 ? 97.236 -3.630 77.114 1.00 131.65 ? 247 SER G C 1 ATOM 4896 O O . SER F 5 109 ? 97.635 -4.086 78.207 1.00 106.06 ? 247 SER G O 1 ATOM 4897 C CB . SER F 5 109 ? 95.572 -5.089 75.923 1.00 106.06 ? 247 SER G CB 1 ATOM 4898 O OG . SER F 5 109 ? 94.240 -5.217 75.442 1.00 106.06 ? 247 SER G OG 1 ATOM 4899 O OXT . SER F 5 109 ? 97.979 -3.035 76.304 1.00 106.06 ? 247 SER G OXT 1 ATOM 4900 N N . HIS G 3 1 ? 76.291 -19.508 104.052 1.00 49.81 ? 51 HIS J N 1 ATOM 4901 C CA . HIS G 3 1 ? 75.329 -19.143 102.967 1.00 49.81 ? 51 HIS J CA 1 ATOM 4902 C C . HIS G 3 1 ? 75.385 -20.230 101.880 1.00 49.81 ? 51 HIS J C 1 ATOM 4903 O O . HIS G 3 1 ? 75.988 -20.054 100.819 1.00 49.08 ? 51 HIS J O 1 ATOM 4904 C CB . HIS G 3 1 ? 75.695 -17.764 102.408 1.00 49.08 ? 51 HIS J CB 1 ATOM 4905 C CG . HIS G 3 1 ? 74.569 -17.065 101.714 1.00 49.08 ? 51 HIS J CG 1 ATOM 4906 N ND1 . HIS G 3 1 ? 74.737 -16.388 100.526 1.00 49.08 ? 51 HIS J ND1 1 ATOM 4907 C CD2 . HIS G 3 1 ? 73.265 -16.917 102.049 1.00 49.08 ? 51 HIS J CD2 1 ATOM 4908 C CE1 . HIS G 3 1 ? 73.587 -15.853 100.156 1.00 49.08 ? 51 HIS J CE1 1 ATOM 4909 N NE2 . HIS G 3 1 ? 72.677 -16.159 101.063 1.00 49.08 ? 51 HIS J NE2 1 ATOM 4910 N N . ASN G 3 2 ? 74.798 -21.377 102.214 1.00 70.40 ? 52 ASN J N 1 ATOM 4911 C CA . ASN G 3 2 ? 74.743 -22.555 101.346 1.00 70.40 ? 52 ASN J CA 1 ATOM 4912 C C . ASN G 3 2 ? 74.081 -22.326 99.991 1.00 70.40 ? 52 ASN J C 1 ATOM 4913 O O . ASN G 3 2 ? 73.308 -21.378 99.815 1.00 62.93 ? 52 ASN J O 1 ATOM 4914 C CB . ASN G 3 2 ? 74.002 -23.696 102.058 1.00 62.93 ? 52 ASN J CB 1 ATOM 4915 C CG . ASN G 3 2 ? 74.938 -24.758 102.603 1.00 62.93 ? 52 ASN J CG 1 ATOM 4916 O OD1 . ASN G 3 2 ? 75.989 -25.030 102.026 1.00 62.93 ? 52 ASN J OD1 1 ATOM 4917 N ND2 . ASN G 3 2 ? 74.549 -25.381 103.710 1.00 62.93 ? 52 ASN J ND2 1 ATOM 4918 N N . ASP G 3 3 ? 74.388 -23.227 99.056 1.00 117.20 ? 53 ASP J N 1 ATOM 4919 C CA . ASP G 3 3 ? 73.850 -23.222 97.692 1.00 117.20 ? 53 ASP J CA 1 ATOM 4920 C C . ASP G 3 3 ? 74.424 -24.376 96.872 1.00 117.20 ? 53 ASP J C 1 ATOM 4921 O O . ASP G 3 3 ? 75.608 -24.379 96.536 1.00 91.96 ? 53 ASP J O 1 ATOM 4922 C CB . ASP G 3 3 ? 74.150 -21.903 96.953 1.00 91.96 ? 53 ASP J CB 1 ATOM 4923 C CG . ASP G 3 3 ? 73.518 -21.851 95.552 1.00 91.96 ? 53 ASP J CG 1 ATOM 4924 O OD1 . ASP G 3 3 ? 74.028 -22.507 94.615 1.00 91.96 ? 53 ASP J OD1 1 ATOM 4925 O OD2 . ASP G 3 3 ? 72.504 -21.143 95.387 1.00 91.96 ? 53 ASP J OD2 1 ATOM 4926 N N . GLY G 3 4 ? 73.583 -25.359 96.577 1.00 68.39 ? 54 GLY J N 1 ATOM 4927 C CA . GLY G 3 4 ? 73.997 -26.480 95.752 1.00 68.39 ? 54 GLY J CA 1 ATOM 4928 C C . GLY G 3 4 ? 74.989 -27.533 96.199 1.00 68.39 ? 54 GLY J C 1 ATOM 4929 O O . GLY G 3 4 ? 76.042 -27.257 96.769 1.00 62.35 ? 54 GLY J O 1 ATOM 4930 N N . ASP G 3 5 ? 74.641 -28.770 95.869 1.00 91.16 ? 55 ASP J N 1 ATOM 4931 C CA . ASP G 3 5 ? 75.463 -29.935 96.163 1.00 91.16 ? 55 ASP J CA 1 ATOM 4932 C C . ASP G 3 5 ? 76.266 -30.106 94.876 1.00 91.16 ? 55 ASP J C 1 ATOM 4933 O O . ASP G 3 5 ? 76.078 -31.078 94.133 1.00 63.54 ? 55 ASP J O 1 ATOM 4934 C CB . ASP G 3 5 ? 74.568 -31.163 96.385 1.00 63.54 ? 55 ASP J CB 1 ATOM 4935 C CG . ASP G 3 5 ? 73.357 -30.857 97.256 1.00 63.54 ? 55 ASP J CG 1 ATOM 4936 O OD1 . ASP G 3 5 ? 72.476 -30.083 96.813 1.00 63.54 ? 55 ASP J OD1 1 ATOM 4937 O OD2 . ASP G 3 5 ? 73.284 -31.399 98.380 1.00 63.54 ? 55 ASP J OD2 1 ATOM 4938 N N . PHE G 3 6 ? 77.090 -29.103 94.578 1.00 78.46 ? 56 PHE J N 1 ATOM 4939 C CA . PHE G 3 6 ? 77.889 -29.100 93.360 1.00 78.46 ? 56 PHE J CA 1 ATOM 4940 C C . PHE G 3 6 ? 78.738 -30.335 93.152 1.00 78.46 ? 56 PHE J C 1 ATOM 4941 O O . PHE G 3 6 ? 79.311 -30.893 94.094 1.00 80.23 ? 56 PHE J O 1 ATOM 4942 C CB . PHE G 3 6 ? 78.667 -27.792 93.211 1.00 80.23 ? 56 PHE J CB 1 ATOM 4943 C CG . PHE G 3 6 ? 77.770 -26.587 93.072 1.00 80.23 ? 56 PHE J CG 1 ATOM 4944 C CD1 . PHE G 3 6 ? 76.890 -26.477 91.996 1.00 80.23 ? 56 PHE J CD1 1 ATOM 4945 C CD2 . PHE G 3 6 ? 77.770 -25.581 94.034 1.00 80.23 ? 56 PHE J CD2 1 ATOM 4946 C CE1 . PHE G 3 6 ? 76.020 -25.386 91.883 1.00 80.23 ? 56 PHE J CE1 1 ATOM 4947 C CE2 . PHE G 3 6 ? 76.903 -24.486 93.928 1.00 80.23 ? 56 PHE J CE2 1 ATOM 4948 C CZ . PHE G 3 6 ? 76.027 -24.391 92.850 1.00 80.23 ? 56 PHE J CZ 1 ATOM 4949 N N . GLU G 3 7 ? 78.734 -30.791 91.906 1.00 73.58 ? 57 GLU J N 1 ATOM 4950 C CA . GLU G 3 7 ? 79.440 -31.992 91.498 1.00 73.58 ? 57 GLU J CA 1 ATOM 4951 C C . GLU G 3 7 ? 80.883 -31.783 91.028 1.00 73.58 ? 57 GLU J C 1 ATOM 4952 O O . GLU G 3 7 ? 81.317 -30.661 90.738 1.00 57.06 ? 57 GLU J O 1 ATOM 4953 C CB . GLU G 3 7 ? 78.636 -32.664 90.393 1.00 57.06 ? 57 GLU J CB 1 ATOM 4954 C CG . GLU G 3 7 ? 78.995 -34.091 90.137 1.00 57.06 ? 57 GLU J CG 1 ATOM 4955 C CD . GLU G 3 7 ? 78.371 -34.595 88.873 1.00 57.06 ? 57 GLU J CD 1 ATOM 4956 O OE1 . GLU G 3 7 ? 77.143 -34.839 88.868 1.00 57.06 ? 57 GLU J OE1 1 ATOM 4957 O OE2 . GLU G 3 7 ? 79.111 -34.730 87.878 1.00 57.06 ? 57 GLU J OE2 1 ATOM 4958 N N . GLU G 3 8 ? 81.604 -32.897 90.949 1.00 76.85 ? 58 GLU J N 1 ATOM 4959 C CA . GLU G 3 8 ? 82.996 -32.943 90.519 1.00 76.85 ? 58 GLU J CA 1 ATOM 4960 C C . GLU G 3 8 ? 83.258 -32.168 89.235 1.00 76.85 ? 58 GLU J C 1 ATOM 4961 O O . GLU G 3 8 ? 82.389 -32.037 88.372 1.00 97.81 ? 58 GLU J O 1 ATOM 4962 C CB . GLU G 3 8 ? 83.424 -34.401 90.297 1.00 97.81 ? 58 GLU J CB 1 ATOM 4963 C CG . GLU G 3 8 ? 82.583 -35.156 89.250 1.00 97.81 ? 58 GLU J CG 1 ATOM 4964 C CD . GLU G 3 8 ? 83.374 -35.608 88.025 1.00 97.81 ? 58 GLU J CD 1 ATOM 4965 O OE1 . GLU G 3 8 ? 84.377 -34.954 87.657 1.00 97.81 ? 58 GLU J OE1 1 ATOM 4966 O OE2 . GLU G 3 8 ? 82.972 -36.622 87.417 1.00 97.81 ? 58 GLU J OE2 1 ATOM 4967 N N . ILE G 3 9 ? 84.502 -31.738 89.091 1.00 106.04 ? 59 ILE J N 1 ATOM 4968 C CA . ILE G 3 9 ? 84.935 -30.995 87.926 1.00 106.04 ? 59 ILE J CA 1 ATOM 4969 C C . ILE G 3 9 ? 86.445 -31.218 87.819 1.00 106.04 ? 59 ILE J C 1 ATOM 4970 O O . ILE G 3 9 ? 87.161 -31.180 88.827 1.00 91.82 ? 59 ILE J O 1 ATOM 4971 C CB . ILE G 3 9 ? 84.583 -29.482 88.076 1.00 91.82 ? 59 ILE J CB 1 ATOM 4972 C CG1 . ILE G 3 9 ? 84.454 -28.834 86.699 1.00 91.82 ? 59 ILE J CG1 1 ATOM 4973 C CG2 . ILE G 3 9 ? 85.607 -28.750 88.948 1.00 91.82 ? 59 ILE J CG2 1 ATOM 4974 C CD1 . ILE G 3 9 ? 83.313 -29.394 85.891 1.00 91.82 ? 59 ILE J CD1 1 ATOM 4975 N N . PRO G 3 10 ? 86.928 -31.586 86.622 1.00 103.96 ? 60 PRO J N 1 ATOM 4976 C CA . PRO G 3 10 ? 88.357 -31.823 86.405 1.00 103.96 ? 60 PRO J CA 1 ATOM 4977 C C . PRO G 3 10 ? 89.195 -30.739 87.088 1.00 103.96 ? 60 PRO J C 1 ATOM 4978 O O . PRO G 3 10 ? 89.003 -29.545 86.849 1.00 104.20 ? 60 PRO J O 1 ATOM 4979 C CB . PRO G 3 10 ? 88.465 -31.784 84.888 1.00 104.20 ? 60 PRO J CB 1 ATOM 4980 C CG . PRO G 3 10 ? 87.212 -32.502 84.491 1.00 104.20 ? 60 PRO J CG 1 ATOM 4981 C CD . PRO G 3 10 ? 86.162 -31.867 85.393 1.00 104.20 ? 60 PRO J CD 1 ATOM 4982 N N . GLU G 3 11 ? 90.112 -31.170 87.949 1.00 66.50 ? 61 GLU J N 1 ATOM 4983 C CA . GLU G 3 11 ? 90.968 -30.258 88.706 1.00 66.50 ? 61 GLU J CA 1 ATOM 4984 C C . GLU G 3 11 ? 92.111 -29.496 88.014 1.00 66.50 ? 61 GLU J C 1 ATOM 4985 O O . GLU G 3 11 ? 92.924 -28.880 88.691 1.00 71.66 ? 61 GLU J O 1 ATOM 4986 C CB . GLU G 3 11 ? 91.482 -30.928 90.000 1.00 71.66 ? 61 GLU J CB 1 ATOM 4987 C CG . GLU G 3 11 ? 91.555 -32.473 90.010 1.00 71.66 ? 61 GLU J CG 1 ATOM 4988 C CD . GLU G 3 11 ? 92.801 -33.053 89.342 1.00 71.66 ? 61 GLU J CD 1 ATOM 4989 O OE1 . GLU G 3 11 ? 93.914 -32.510 89.547 1.00 71.66 ? 61 GLU J OE1 1 ATOM 4990 O OE2 . GLU G 3 11 ? 92.663 -34.075 88.631 1.00 71.66 ? 61 GLU J OE2 1 ATOM 4991 N N . GLU G 3 12 ? 92.194 -29.537 86.685 1.00 50.00 ? 62 GLU J N 1 ATOM 4992 C CA . GLU G 3 12 ? 93.239 -28.790 85.966 1.00 50.00 ? 62 GLU J CA 1 ATOM 4993 C C . GLU G 3 12 ? 92.952 -27.304 86.187 1.00 50.00 ? 62 GLU J C 1 ATOM 4994 O O . GLU G 3 12 ? 93.859 -26.501 86.420 1.00 81.90 ? 62 GLU J O 1 ATOM 4995 C CB . GLU G 3 12 ? 93.197 -29.131 84.461 1.00 81.90 ? 62 GLU J CB 1 ATOM 4996 C CG . GLU G 3 12 ? 93.569 -27.991 83.477 1.00 81.90 ? 62 GLU J CG 1 ATOM 4997 C CD . GLU G 3 12 ? 95.051 -27.593 83.484 1.00 81.90 ? 62 GLU J CD 1 ATOM 4998 O OE1 . GLU G 3 12 ? 95.890 -28.325 84.054 1.00 81.90 ? 62 GLU J OE1 1 ATOM 4999 O OE2 . GLU G 3 12 ? 95.381 -26.535 82.902 1.00 81.90 ? 62 GLU J OE2 1 ATOM 5000 N N . TYR G 3 13 ? 91.661 -26.980 86.143 1.00 100.02 ? 63 TYR J N 1 ATOM 5001 C CA . TYR G 3 13 ? 91.136 -25.632 86.338 1.00 100.02 ? 63 TYR J CA 1 ATOM 5002 C C . TYR G 3 13 ? 91.369 -25.164 87.777 1.00 100.02 ? 63 TYR J C 1 ATOM 5003 O O . TYR G 3 13 ? 91.429 -23.965 88.059 1.00 51.54 ? 63 TYR J O 1 ATOM 5004 C CB . TYR G 3 13 ? 89.637 -25.632 86.046 1.00 51.54 ? 63 TYR J CB 1 ATOM 5005 C CG . TYR G 3 13 ? 89.242 -26.355 84.773 1.00 51.54 ? 63 TYR J CG 1 ATOM 5006 C CD1 . TYR G 3 13 ? 89.893 -26.089 83.571 1.00 51.54 ? 63 TYR J CD1 1 ATOM 5007 C CD2 . TYR G 3 13 ? 88.171 -27.263 84.760 1.00 51.54 ? 63 TYR J CD2 1 ATOM 5008 C CE1 . TYR G 3 13 ? 89.485 -26.694 82.381 1.00 51.54 ? 63 TYR J CE1 1 ATOM 5009 C CE2 . TYR G 3 13 ? 87.756 -27.877 83.575 1.00 51.54 ? 63 TYR J CE2 1 ATOM 5010 C CZ . TYR G 3 13 ? 88.419 -27.577 82.388 1.00 51.54 ? 63 TYR J CZ 1 ATOM 5011 O OH . TYR G 3 13 ? 88.001 -28.112 81.193 1.00 51.54 ? 63 TYR J OH 1 ATOM 5012 N N . LEU G 3 14 ? 91.452 -26.132 88.683 1.00 75.36 ? 64 LEU J N 1 ATOM 5013 C CA . LEU G 3 14 ? 91.681 -25.876 90.095 1.00 75.36 ? 64 LEU J CA 1 ATOM 5014 C C . LEU G 3 14 ? 92.942 -26.674 90.439 1.00 75.36 ? 64 LEU J C 1 ATOM 5015 O O . LEU G 3 14 ? 92.876 -27.735 91.075 1.00 68.63 ? 64 LEU J O 1 ATOM 5016 C CB . LEU G 3 14 ? 90.464 -26.355 90.889 1.00 68.63 ? 64 LEU J CB 1 ATOM 5017 C CG . LEU G 3 14 ? 90.313 -25.945 92.354 1.00 68.63 ? 64 LEU J CG 1 ATOM 5018 C CD1 . LEU G 3 14 ? 90.477 -24.444 92.506 1.00 68.63 ? 64 LEU J CD1 1 ATOM 5019 C CD2 . LEU G 3 14 ? 88.951 -26.394 92.869 1.00 68.63 ? 64 LEU J CD2 1 ATOM 5020 N N . GLN G 3 15 ? 94.067 -26.205 89.901 1.00 95.25 ? 65 GLN J N 1 ATOM 5021 C CA . GLN G 3 15 ? 95.366 -26.841 90.102 1.00 95.25 ? 65 GLN J CA 1 ATOM 5022 C C . GLN G 3 15 ? 96.100 -26.278 91.333 1.00 95.25 ? 65 GLN J C 1 ATOM 5023 O O . GLN G 3 15 ? 95.731 -26.676 92.458 1.00 48.01 ? 65 GLN J O 1 ATOM 5024 C CB . GLN G 3 15 ? 96.224 -26.720 88.832 1.00 48.01 ? 65 GLN J CB 1 ATOM 5025 C CG . GLN G 3 15 ? 97.326 -27.768 88.714 1.00 48.01 ? 65 GLN J CG 1 ATOM 5026 C CD . GLN G 3 15 ? 96.778 -29.179 88.603 1.00 48.01 ? 65 GLN J CD 1 ATOM 5027 O OE1 . GLN G 3 15 ? 96.916 -29.987 89.521 1.00 48.01 ? 65 GLN J OE1 1 ATOM 5028 N NE2 . GLN G 3 15 ? 96.162 -29.489 87.469 1.00 48.01 ? 65 GLN J NE2 1 ATOM 5029 O OXT . GLN G 3 15 ? 97.020 -25.442 91.176 1.00 48.01 ? 65 GLN J OXT 1 HETATM 5030 C C1 . NAG H 6 . ? 16.478 7.354 91.235 1.00 5.72 ? 401 NAG H C1 1 HETATM 5031 C C2 . NAG H 6 . ? 15.209 8.208 91.066 1.00 5.72 ? 401 NAG H C2 1 HETATM 5032 C C3 . NAG H 6 . ? 14.593 8.009 89.671 1.00 5.72 ? 401 NAG H C3 1 HETATM 5033 C C4 . NAG H 6 . ? 15.647 8.110 88.568 1.00 5.72 ? 401 NAG H C4 1 HETATM 5034 C C5 . NAG H 6 . ? 16.795 7.172 88.893 1.00 5.72 ? 401 NAG H C5 1 HETATM 5035 C C6 . NAG H 6 . ? 17.900 7.152 87.851 1.00 5.72 ? 401 NAG H C6 1 HETATM 5036 C C7 . NAG H 6 . ? 14.249 8.391 93.281 1.00 5.72 ? 401 NAG H C7 1 HETATM 5037 C C8 . NAG H 6 . ? 13.178 7.919 94.248 1.00 5.72 ? 401 NAG H C8 1 HETATM 5038 N N2 . NAG H 6 . ? 14.229 7.834 92.073 1.00 5.72 ? 401 NAG H N2 1 HETATM 5039 O O3 . NAG H 6 . ? 13.586 8.985 89.447 1.00 5.72 ? 401 NAG H O3 1 HETATM 5040 O O4 . NAG H 6 . ? 15.071 7.727 87.307 1.00 5.72 ? 401 NAG H O4 1 HETATM 5041 O O5 . NAG H 6 . ? 17.377 7.566 90.139 1.00 5.72 ? 401 NAG H O5 1 HETATM 5042 O O6 . NAG H 6 . ? 18.772 6.043 88.040 1.00 5.72 ? 401 NAG H O6 1 HETATM 5043 O O7 . NAG H 6 . ? 15.088 9.226 93.614 1.00 5.72 ? 401 NAG H O7 1 HETATM 5044 C C1 . NAG I 6 . ? 14.489 8.693 86.494 1.00 5.72 ? 402 NAG H C1 1 HETATM 5045 C C2 . NAG I 6 . ? 15.579 9.582 85.846 1.00 5.72 ? 402 NAG H C2 1 HETATM 5046 C C3 . NAG I 6 . ? 14.938 10.479 84.787 1.00 5.72 ? 402 NAG H C3 1 HETATM 5047 C C4 . NAG I 6 . ? 14.182 9.629 83.781 1.00 5.72 ? 402 NAG H C4 1 HETATM 5048 C C5 . NAG I 6 . ? 13.126 8.811 84.511 1.00 5.72 ? 402 NAG H C5 1 HETATM 5049 C C6 . NAG I 6 . ? 12.354 7.895 83.571 1.00 5.72 ? 402 NAG H C6 1 HETATM 5050 C C7 . NAG I 6 . ? 17.523 10.658 86.847 1.00 5.72 ? 402 NAG H C7 1 HETATM 5051 C C8 . NAG I 6 . ? 18.030 11.525 87.982 1.00 5.72 ? 402 NAG H C8 1 HETATM 5052 N N2 . NAG I 6 . ? 16.213 10.410 86.862 1.00 5.72 ? 402 NAG H N2 1 HETATM 5053 O O3 . NAG I 6 . ? 15.928 11.246 84.116 1.00 5.72 ? 402 NAG H O3 1 HETATM 5054 O O4 . NAG I 6 . ? 13.565 10.471 82.819 1.00 5.72 ? 402 NAG H O4 1 HETATM 5055 O O5 . NAG I 6 . ? 13.753 7.969 85.496 1.00 5.72 ? 402 NAG H O5 1 HETATM 5056 O O6 . NAG I 6 . ? 13.226 7.063 82.812 1.00 5.72 ? 402 NAG H O6 1 HETATM 5057 O O7 . NAG I 6 . ? 18.280 10.239 85.973 1.00 5.72 ? 402 NAG H O7 1 HETATM 5058 C C1 . NAG J 6 . ? 89.195 -4.109 93.988 1.00 8.01 ? 501 NAG F C1 1 HETATM 5059 C C2 . NAG J 6 . ? 90.263 -3.371 94.790 1.00 8.01 ? 501 NAG F C2 1 HETATM 5060 C C3 . NAG J 6 . ? 89.830 -1.929 95.009 1.00 8.01 ? 501 NAG F C3 1 HETATM 5061 C C4 . NAG J 6 . ? 89.542 -1.270 93.657 1.00 8.01 ? 501 NAG F C4 1 HETATM 5062 C C5 . NAG J 6 . ? 88.494 -2.094 92.908 1.00 8.01 ? 501 NAG F C5 1 HETATM 5063 C C6 . NAG J 6 . ? 88.145 -1.539 91.537 1.00 8.01 ? 501 NAG F C6 1 HETATM 5064 C C7 . NAG J 6 . ? 91.440 -4.914 96.214 1.00 8.01 ? 501 NAG F C7 1 HETATM 5065 C C8 . NAG J 6 . ? 91.586 -5.520 97.600 1.00 8.01 ? 501 NAG F C8 1 HETATM 5066 N N2 . NAG J 6 . ? 90.474 -4.013 96.073 1.00 8.01 ? 501 NAG F N2 1 HETATM 5067 O O3 . NAG J 6 . ? 90.856 -1.224 95.694 1.00 8.01 ? 501 NAG F O3 1 HETATM 5068 O O4 . NAG J 6 . ? 89.065 0.053 93.857 1.00 8.01 ? 501 NAG F O4 1 HETATM 5069 O O5 . NAG J 6 . ? 88.974 -3.447 92.730 1.00 8.01 ? 501 NAG F O5 1 HETATM 5070 O O6 . NAG J 6 . ? 87.190 -0.487 91.636 1.00 8.01 ? 501 NAG F O6 1 HETATM 5071 O O7 . NAG J 6 . ? 92.156 -5.271 95.276 1.00 8.01 ? 501 NAG F O7 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 THR 1 1 ? ? ? L U n A 1 2 SER 2 1 ? ? ? L T n A 1 3 GLU 3 1 ? ? ? L S n A 1 4 ASP 4 1 ? ? ? L R n A 1 5 HIS 5 1 ? ? ? L Q n A 1 6 PHE 6 1 ? ? ? L P n A 1 7 GLN 7 1 ? ? ? L O n A 1 8 PRO 8 1 ? ? ? L N n A 1 9 PHE 9 1 ? ? ? L M n A 1 10 PHE 10 1 ? ? ? L L n A 1 11 ASN 11 1 ? ? ? L K n A 1 12 GLU 12 1 ? ? ? L J n A 1 13 LYS 13 1 ? ? ? L I n A 1 14 THR 14 1 1 THR THR L H n A 1 15 PHE 15 1 1 PHE PHE L G n A 1 16 GLY 16 1 1 GLY GLY L F n A 1 17 ALA 17 1 1 ALA ALA L E n A 1 18 GLY 18 1 1 GLY GLY L D n A 1 19 GLU 19 1 1 GLU GLU L C n A 1 20 ALA 20 1 1 ALA ALA L B n A 1 21 ASP 21 1 1 ASP ASP L A n A 1 22 CYS 22 1 1 CYS CYS L . n A 1 23 GLY 23 2 2 GLY GLY L . n A 1 24 LEU 24 3 3 LEU LEU L . n A 1 25 ARG 25 4 4 ARG ARG L . n A 1 26 PRO 26 5 5 PRO PRO L . n A 1 27 LEU 27 6 6 LEU LEU L . n A 1 28 PHE 28 7 7 PHE PHE L . n A 1 29 GLU 29 8 8 GLU GLU L . n A 1 30 LYS 30 9 9 LYS LYS L . n A 1 31 LYS 31 10 10 LYS LYS L . n A 1 32 GLN 32 11 11 GLN GLN L . n A 1 33 VAL 33 12 12 VAL VAL L . n A 1 34 GLN 34 13 13 GLN GLN L . n A 1 35 ASP 35 14 14 ASP ASP L . n A 1 36 GLN 36 14 14 GLN GLN L A n A 1 37 THR 37 14 14 THR THR L B n A 1 38 GLU 38 14 14 GLU GLU L C n A 1 39 LYS 39 14 14 LYS LYS L D n A 1 40 GLU 40 14 14 GLU GLU L E n A 1 41 LEU 41 14 14 LEU LEU L F n A 1 42 PHE 42 14 14 PHE PHE L G n A 1 43 GLU 43 14 14 GLU GLU L H n A 1 44 SER 44 14 14 SER SER L I n A 1 45 TYR 45 14 14 TYR TYR L J n A 1 46 ILE 46 14 14 ILE ILE L K n A 1 47 GLU 47 14 14 GLU GLU L L n A 1 48 GLY 48 14 14 GLY GLY L M n A 1 49 ARG 49 15 15 ARG ARG L . n B 2 1 ILE 1 16 16 ILE ILE H . n B 2 2 VAL 2 17 17 VAL VAL H . n B 2 3 GLU 3 18 18 GLU GLU H . n B 2 4 GLY 4 19 19 GLY GLY H . n B 2 5 GLN 5 20 20 GLN GLN H . n B 2 6 ASP 6 21 21 ASP ASP H . n B 2 7 ALA 7 22 22 ALA ALA H . n B 2 8 GLU 8 23 23 GLU GLU H . n B 2 9 VAL 9 24 24 VAL VAL H . n B 2 10 GLY 10 25 25 GLY GLY H . n B 2 11 LEU 11 26 26 LEU LEU H . n B 2 12 SER 12 27 27 SER SER H . n B 2 13 PRO 13 28 28 PRO PRO H . n B 2 14 TRP 14 29 29 TRP TRP H . n B 2 15 GLN 15 30 30 GLN GLN H . n B 2 16 VAL 16 31 31 VAL VAL H . n B 2 17 MET 17 32 32 MET MET H . n B 2 18 LEU 18 33 33 LEU LEU H . n B 2 19 PHE 19 34 34 PHE PHE H . n B 2 20 ARG 20 35 35 ARG ARG H . n B 2 21 LYS 21 36 36 LYS LYS H . n B 2 22 SER 22 36 36 SER SER H A n B 2 23 PRO 23 37 37 PRO PRO H . n B 2 24 GLN 24 38 38 GLN GLN H . n B 2 25 GLU 25 39 39 GLU GLU H . n B 2 26 LEU 26 40 40 LEU LEU H . n B 2 27 LEU 27 41 41 LEU LEU H . n B 2 28 CYS 28 42 42 CYS CYS H . n B 2 29 GLY 29 43 43 GLY GLY H . n B 2 30 ALA 30 44 44 ALA ALA H . n B 2 31 SER 31 45 45 SER SER H . n B 2 32 LEU 32 46 46 LEU LEU H . n B 2 33 ILE 33 47 47 ILE ILE H . n B 2 34 SER 34 48 48 SER SER H . n B 2 35 ASP 35 49 49 ASP ASP H . n B 2 36 ARG 36 50 50 ARG ARG H . n B 2 37 TRP 37 51 51 TRP TRP H . n B 2 38 VAL 38 52 52 VAL VAL H . n B 2 39 LEU 39 53 53 LEU LEU H . n B 2 40 THR 40 54 54 THR THR H . n B 2 41 ALA 41 55 55 ALA ALA H . n B 2 42 ALA 42 56 56 ALA ALA H . n B 2 43 HIS 43 57 57 HIS HIS H . n B 2 44 CYS 44 58 58 CYS CYS H . n B 2 45 LEU 45 59 59 LEU LEU H . n B 2 46 LEU 46 60 60 LEU LEU H . n B 2 47 TYR 47 60 60 TYR TYR H A n B 2 48 PRO 48 60 60 PRO PRO H B n B 2 49 PRO 49 60 60 PRO PRO H C n B 2 50 TRP 50 60 60 TRP TRP H D n B 2 51 ASP 51 60 60 ASP ASP H E n B 2 52 LYS 52 60 60 LYS LYS H F n B 2 53 ASN 53 60 60 ASN ASN H G n B 2 54 PHE 54 60 60 PHE PHE H H n B 2 55 THR 55 60 60 THR THR H I n B 2 56 VAL 56 61 61 VAL VAL H . n B 2 57 ASP 57 62 62 ASP ASP H . n B 2 58 ASP 58 63 63 ASP ASP H . n B 2 59 LEU 59 64 64 LEU LEU H . n B 2 60 LEU 60 65 65 LEU LEU H . n B 2 61 VAL 61 66 66 VAL VAL H . n B 2 62 ARG 62 67 67 ARG ARG H . n B 2 63 ILE 63 68 68 ILE ILE H . n B 2 64 GLY 64 69 69 GLY GLY H . n B 2 65 LYS 65 70 70 LYS LYS H . n B 2 66 HIS 66 71 71 HIS HIS H . n B 2 67 SER 67 72 72 SER SER H . n B 2 68 ARG 68 73 73 ARG ARG H . n B 2 69 THR 69 74 74 THR THR H . n B 2 70 ARG 70 75 75 ARG ARG H . n B 2 71 TYR 71 76 76 TYR TYR H . n B 2 72 GLU 72 77 77 GLU GLU H . n B 2 73 ARG 73 77 77 ARG ARG H A n B 2 74 LYS 74 78 78 LYS LYS H . n B 2 75 VAL 75 79 79 VAL VAL H . n B 2 76 GLU 76 80 80 GLU GLU H . n B 2 77 LYS 77 81 81 LYS LYS H . n B 2 78 ILE 78 82 82 ILE ILE H . n B 2 79 SER 79 83 83 SER SER H . n B 2 80 MET 80 84 84 MET MET H . n B 2 81 LEU 81 85 85 LEU LEU H . n B 2 82 ASP 82 86 86 ASP ASP H . n B 2 83 LYS 83 87 87 LYS LYS H . n B 2 84 ILE 84 88 88 ILE ILE H . n B 2 85 TYR 85 89 89 TYR TYR H . n B 2 86 ILE 86 90 90 ILE ILE H . n B 2 87 HIS 87 91 91 HIS HIS H . n B 2 88 PRO 88 92 92 PRO PRO H . n B 2 89 ARG 89 93 93 ARG ARG H . n B 2 90 TYR 90 94 94 TYR TYR H . n B 2 91 ASN 91 95 95 ASN ASN H . n B 2 92 TRP 92 96 96 TRP TRP H . n B 2 93 LYS 93 97 97 LYS LYS H . n B 2 94 GLU 94 97 97 GLU GLU H A n B 2 95 ASN 95 98 98 ASN ASN H . n B 2 96 LEU 96 99 99 LEU LEU H . n B 2 97 ASP 97 100 100 ASP ASP H . n B 2 98 ARG 98 101 101 ARG ARG H . n B 2 99 ASP 99 102 102 ASP ASP H . n B 2 100 ILE 100 103 103 ILE ILE H . n B 2 101 ALA 101 104 104 ALA ALA H . n B 2 102 LEU 102 105 105 LEU LEU H . n B 2 103 LEU 103 106 106 LEU LEU H . n B 2 104 LYS 104 107 107 LYS LYS H . n B 2 105 LEU 105 108 108 LEU LEU H . n B 2 106 LYS 106 109 109 LYS LYS H . n B 2 107 ARG 107 110 110 ARG ARG H . n B 2 108 PRO 108 111 111 PRO PRO H . n B 2 109 ILE 109 112 112 ILE ILE H . n B 2 110 GLU 110 113 113 GLU GLU H . n B 2 111 LEU 111 114 114 LEU LEU H . n B 2 112 SER 112 115 115 SER SER H . n B 2 113 ASP 113 116 116 ASP ASP H . n B 2 114 TYR 114 117 117 TYR TYR H . n B 2 115 ILE 115 118 118 ILE ILE H . n B 2 116 HIS 116 119 119 HIS HIS H . n B 2 117 PRO 117 120 120 PRO PRO H . n B 2 118 VAL 118 121 121 VAL VAL H . n B 2 119 CYS 119 122 122 CYS CYS H . n B 2 120 LEU 120 123 123 LEU LEU H . n B 2 121 PRO 121 124 124 PRO PRO H . n B 2 122 ASP 122 125 125 ASP ASP H . n B 2 123 LYS 123 126 126 LYS LYS H . n B 2 124 GLN 124 127 127 GLN GLN H . n B 2 125 THR 125 128 128 THR THR H . n B 2 126 ALA 126 129 129 ALA ALA H . n B 2 127 ALA 127 129 129 ALA ALA H A n B 2 128 LYS 128 129 129 LYS LYS H B n B 2 129 LEU 129 129 129 LEU LEU H C n B 2 130 LEU 130 130 130 LEU LEU H . n B 2 131 HIS 131 131 131 HIS HIS H . n B 2 132 ALA 132 132 132 ALA ALA H . n B 2 133 GLY 133 133 133 GLY GLY H . n B 2 134 PHE 134 134 134 PHE PHE H . n B 2 135 LYS 135 135 135 LYS LYS H . n B 2 136 GLY 136 136 136 GLY GLY H . n B 2 137 ARG 137 137 137 ARG ARG H . n B 2 138 VAL 138 138 138 VAL VAL H . n B 2 139 THR 139 139 139 THR THR H . n B 2 140 GLY 140 140 140 GLY GLY H . n B 2 141 TRP 141 141 141 TRP TRP H . n B 2 142 GLY 142 142 142 GLY GLY H . n B 2 143 ASN 143 143 143 ASN ASN H . n B 2 144 ARG 144 144 144 ARG ARG H . n B 2 145 ARG 145 145 145 ARG ARG H . n B 2 146 GLU 146 146 146 GLU GLU H . n B 2 147 THR 147 147 147 THR THR H . n B 2 148 TRP 148 148 148 TRP TRP H . n B 2 149 THR 149 149 149 THR THR H . n B 2 150 THR 150 149 149 THR THR H A n B 2 151 SER 151 149 149 SER SER H B n B 2 152 VAL 152 149 149 VAL VAL H C n B 2 153 ALA 153 149 149 ALA ALA H D n B 2 154 GLU 154 149 149 GLU GLU H E n B 2 155 VAL 155 150 150 VAL VAL H . n B 2 156 GLN 156 151 151 GLN GLN H . n B 2 157 PRO 157 152 152 PRO PRO H . n B 2 158 SER 158 153 153 SER SER H . n B 2 159 VAL 159 154 154 VAL VAL H . n B 2 160 LEU 160 155 155 LEU LEU H . n B 2 161 GLN 161 156 156 GLN GLN H . n B 2 162 VAL 162 157 157 VAL VAL H . n B 2 163 VAL 163 158 158 VAL VAL H . n B 2 164 ASN 164 159 159 ASN ASN H . n B 2 165 LEU 165 160 160 LEU LEU H . n B 2 166 PRO 166 161 161 PRO PRO H . n B 2 167 LEU 167 162 162 LEU LEU H . n B 2 168 VAL 168 163 163 VAL VAL H . n B 2 169 GLU 169 164 164 GLU GLU H . n B 2 170 ARG 170 165 165 ARG ARG H . n B 2 171 PRO 171 166 166 PRO PRO H . n B 2 172 VAL 172 167 167 VAL VAL H . n B 2 173 CYS 173 168 168 CYS CYS H . n B 2 174 LYS 174 169 169 LYS LYS H . n B 2 175 ALA 175 170 170 ALA ALA H . n B 2 176 SER 176 171 171 SER SER H . n B 2 177 THR 177 172 172 THR THR H . n B 2 178 ARG 178 173 173 ARG ARG H . n B 2 179 ILE 179 174 174 ILE ILE H . n B 2 180 ARG 180 175 175 ARG ARG H . n B 2 181 ILE 181 176 176 ILE ILE H . n B 2 182 THR 182 177 177 THR THR H . n B 2 183 ASP 183 178 178 ASP ASP H . n B 2 184 ASN 184 179 179 ASN ASN H . n B 2 185 MET 185 180 180 MET MET H . n B 2 186 PHE 186 181 181 PHE PHE H . n B 2 187 CYS 187 182 182 CYS CYS H . n B 2 188 ALA 188 183 183 ALA ALA H . n B 2 189 GLY 189 184 184 GLY GLY H . n B 2 190 TYR 190 184 184 TYR TYR H A n B 2 191 LYS 191 185 185 LYS LYS H . n B 2 192 PRO 192 186 186 PRO PRO H . n B 2 193 GLY 193 186 186 GLY GLY H A n B 2 194 GLU 194 186 186 GLU GLU H B n B 2 195 GLY 195 186 186 GLY GLY H C n B 2 196 LYS 196 186 186 LYS LYS H D n B 2 197 ARG 197 187 187 ARG ARG H . n B 2 198 GLY 198 188 188 GLY GLY H . n B 2 199 ASP 199 189 189 ASP ASP H . n B 2 200 ALA 200 190 190 ALA ALA H . n B 2 201 CYS 201 191 191 CYS CYS H . n B 2 202 GLU 202 192 192 GLU GLU H . n B 2 203 GLY 203 193 193 GLY GLY H . n B 2 204 ASP 204 194 194 ASP ASP H . n B 2 205 SER 205 195 195 SER SER H . n B 2 206 GLY 206 196 196 GLY GLY H . n B 2 207 GLY 207 197 197 GLY GLY H . n B 2 208 PRO 208 198 198 PRO PRO H . n B 2 209 PHE 209 199 199 PHE PHE H . n B 2 210 VAL 210 200 200 VAL VAL H . n B 2 211 MET 211 201 201 MET MET H . n B 2 212 LYS 212 202 202 LYS LYS H . n B 2 213 SER 213 203 203 SER SER H . n B 2 214 PRO 214 204 204 PRO PRO H . n B 2 215 TYR 215 204 204 TYR TYR H A n B 2 216 ASN 216 204 204 ASN ASN H B n B 2 217 ASN 217 205 205 ASN ASN H . n B 2 218 ARG 218 206 206 ARG ARG H . n B 2 219 TRP 219 207 207 TRP TRP H . n B 2 220 TYR 220 208 208 TYR TYR H . n B 2 221 GLN 221 209 209 GLN GLN H . n B 2 222 MET 222 210 210 MET MET H . n B 2 223 GLY 223 211 211 GLY GLY H . n B 2 224 ILE 224 212 212 ILE ILE H . n B 2 225 VAL 225 213 213 VAL VAL H . n B 2 226 SER 226 214 214 SER SER H . n B 2 227 TRP 227 215 215 TRP TRP H . n B 2 228 GLY 228 216 216 GLY GLY H . n B 2 229 GLU 229 217 217 GLU GLU H . n B 2 230 GLY 230 219 219 GLY GLY H . n B 2 231 CYS 231 220 220 CYS CYS H . n B 2 232 ASP 232 221 221 ASP ASP H . n B 2 233 ARG 233 221 221 ARG ARG H A n B 2 234 ASP 234 222 222 ASP ASP H . n B 2 235 GLY 235 223 223 GLY GLY H . n B 2 236 LYS 236 224 224 LYS LYS H . n B 2 237 TYR 237 225 225 TYR TYR H . n B 2 238 GLY 238 226 226 GLY GLY H . n B 2 239 PHE 239 227 227 PHE PHE H . n B 2 240 TYR 240 228 228 TYR TYR H . n B 2 241 THR 241 229 229 THR THR H . n B 2 242 HIS 242 230 230 HIS HIS H . n B 2 243 VAL 243 231 231 VAL VAL H . n B 2 244 PHE 244 232 232 PHE PHE H . n B 2 245 ARG 245 233 233 ARG ARG H . n B 2 246 LEU 246 234 234 LEU LEU H . n B 2 247 LYS 247 235 235 LYS LYS H . n B 2 248 LYS 248 236 236 LYS LYS H . n B 2 249 TRP 249 237 237 TRP TRP H . n B 2 250 ILE 250 238 238 ILE ILE H . n B 2 251 GLN 251 239 239 GLN GLN H . n B 2 252 LYS 252 240 240 LYS LYS H . n B 2 253 VAL 253 241 241 VAL VAL H . n B 2 254 ILE 254 242 242 ILE ILE H . n B 2 255 ASP 255 243 243 ASP ASP H . n B 2 256 ARG 256 244 244 ARG ARG H . n B 2 257 LEU 257 245 245 LEU LEU H . n B 2 258 GLY 258 246 246 GLY GLY H . n B 2 259 SER 259 247 247 SER SER H . n C 3 1 HIS 1 51 51 HIS HIS I . n C 3 2 ASN 2 52 52 ASN ASN I . n C 3 3 ASP 3 53 53 ASP ASP I . n C 3 4 GLY 4 54 54 GLY GLY I . n C 3 5 ASP 5 55 55 ASP ASP I . n C 3 6 PHE 6 56 56 PHE PHE I . n C 3 7 GLU 7 57 57 GLU GLU I . n C 3 8 GLU 8 58 58 GLU GLU I . n C 3 9 ILE 9 59 59 ILE ILE I . n C 3 10 PRO 10 60 60 PRO PRO I . n C 3 11 GLU 11 61 61 GLU GLU I . n C 3 12 GLU 12 62 62 GLU GLU I . n C 3 13 TYR 13 63 63 TYR TYR I . n C 3 14 LEU 14 64 64 LEU LEU I . n C 3 15 GLN 15 65 65 GLN GLN I . n D 1 1 THR 1 1 ? ? ? M U n D 1 2 SER 2 1 ? ? ? M T n D 1 3 GLU 3 1 ? ? ? M S n D 1 4 ASP 4 1 ? ? ? M R n D 1 5 HIS 5 1 ? ? ? M Q n D 1 6 PHE 6 1 ? ? ? M P n D 1 7 GLN 7 1 ? ? ? M O n D 1 8 PRO 8 1 ? ? ? M N n D 1 9 PHE 9 1 ? ? ? M M n D 1 10 PHE 10 1 ? ? ? M L n D 1 11 ASN 11 1 ? ? ? M K n D 1 12 GLU 12 1 ? ? ? M J n D 1 13 LYS 13 1 ? ? ? M I n D 1 14 THR 14 1 1 THR THR M H n D 1 15 PHE 15 1 1 PHE PHE M G n D 1 16 GLY 16 1 1 GLY GLY M F n D 1 17 ALA 17 1 1 ALA ALA M E n D 1 18 GLY 18 1 1 GLY GLY M D n D 1 19 GLU 19 1 1 GLU GLU M C n D 1 20 ALA 20 1 1 ALA ALA M B n D 1 21 ASP 21 1 1 ASP ASP M A n D 1 22 CYS 22 1 1 CYS CYS M . n D 1 23 GLY 23 2 2 GLY GLY M . n D 1 24 LEU 24 3 3 LEU LEU M . n D 1 25 ARG 25 4 4 ARG ARG M . n D 1 26 PRO 26 5 5 PRO PRO M . n D 1 27 LEU 27 6 6 LEU LEU M . n D 1 28 PHE 28 7 7 PHE PHE M . n D 1 29 GLU 29 8 8 GLU GLU M . n D 1 30 LYS 30 9 9 LYS LYS M . n D 1 31 LYS 31 10 10 LYS LYS M . n D 1 32 GLN 32 11 11 GLN GLN M . n D 1 33 VAL 33 12 12 VAL VAL M . n D 1 34 GLN 34 13 13 GLN GLN M . n D 1 35 ASP 35 14 14 ASP ASP M . n D 1 36 GLN 36 14 14 GLN GLN M A n D 1 37 THR 37 14 14 THR THR M B n D 1 38 GLU 38 14 14 GLU GLU M C n D 1 39 LYS 39 14 14 LYS LYS M D n D 1 40 GLU 40 14 14 GLU GLU M E n D 1 41 LEU 41 14 14 LEU LEU M F n D 1 42 PHE 42 14 14 PHE PHE M G n D 1 43 GLU 43 14 14 GLU GLU M H n D 1 44 SER 44 14 14 SER SER M I n D 1 45 TYR 45 14 14 TYR TYR M J n D 1 46 ILE 46 14 14 ILE ILE M K n D 1 47 GLU 47 14 14 GLU GLU M L n D 1 48 GLY 48 14 14 GLY GLY M M n D 1 49 ARG 49 15 15 ARG ARG M . n E 4 1 ILE 1 16 16 ILE ILE F . n E 4 2 VAL 2 17 17 VAL VAL F . n E 4 3 GLU 3 18 18 GLU GLU F . n E 4 4 GLY 4 19 19 GLY GLY F . n E 4 5 GLN 5 20 20 GLN GLN F . n E 4 6 ASP 6 21 21 ASP ASP F . n E 4 7 ALA 7 22 22 ALA ALA F . n E 4 8 GLU 8 23 23 GLU GLU F . n E 4 9 VAL 9 24 24 VAL VAL F . n E 4 10 GLY 10 25 25 GLY GLY F . n E 4 11 LEU 11 26 26 LEU LEU F . n E 4 12 SER 12 27 27 SER SER F . n E 4 13 PRO 13 28 28 PRO PRO F . n E 4 14 TRP 14 29 29 TRP TRP F . n E 4 15 GLN 15 30 30 GLN GLN F . n E 4 16 VAL 16 31 31 VAL VAL F . n E 4 17 MET 17 32 32 MET MET F . n E 4 18 LEU 18 33 33 LEU LEU F . n E 4 19 PHE 19 34 34 PHE PHE F . n E 4 20 ARG 20 35 35 ARG ARG F . n E 4 21 LYS 21 36 36 LYS LYS F . n E 4 22 SER 22 36 36 SER SER F A n E 4 23 PRO 23 37 37 PRO PRO F . n E 4 24 GLN 24 38 38 GLN GLN F . n E 4 25 GLU 25 39 39 GLU GLU F . n E 4 26 LEU 26 40 40 LEU LEU F . n E 4 27 LEU 27 41 41 LEU LEU F . n E 4 28 CYS 28 42 42 CYS CYS F . n E 4 29 GLY 29 43 43 GLY GLY F . n E 4 30 ALA 30 44 44 ALA ALA F . n E 4 31 SER 31 45 45 SER SER F . n E 4 32 LEU 32 46 46 LEU LEU F . n E 4 33 ILE 33 47 47 ILE ILE F . n E 4 34 SER 34 48 48 SER SER F . n E 4 35 ASP 35 49 49 ASP ASP F . n E 4 36 ARG 36 50 50 ARG ARG F . n E 4 37 TRP 37 51 51 TRP TRP F . n E 4 38 VAL 38 52 52 VAL VAL F . n E 4 39 LEU 39 53 53 LEU LEU F . n E 4 40 THR 40 54 54 THR THR F . n E 4 41 ALA 41 55 55 ALA ALA F . n E 4 42 ALA 42 56 56 ALA ALA F . n E 4 43 HIS 43 57 57 HIS HIS F . n E 4 44 CYS 44 58 58 CYS CYS F . n E 4 45 LEU 45 59 59 LEU LEU F . n E 4 46 LEU 46 60 60 LEU LEU F . n E 4 47 TYR 47 60 60 TYR TYR F A n E 4 48 PRO 48 60 60 PRO PRO F B n E 4 49 PRO 49 60 60 PRO PRO F C n E 4 50 TRP 50 60 60 TRP TRP F D n E 4 51 ASP 51 60 60 ASP ASP F E n E 4 52 LYS 52 60 60 LYS LYS F F n E 4 53 ASN 53 60 60 ASN ASN F G n E 4 54 PHE 54 60 60 PHE PHE F H n E 4 55 THR 55 60 60 THR THR F I n E 4 56 VAL 56 61 61 VAL VAL F . n E 4 57 ASP 57 62 62 ASP ASP F . n E 4 58 ASP 58 63 63 ASP ASP F . n E 4 59 LEU 59 64 64 LEU LEU F . n E 4 60 LEU 60 65 65 LEU LEU F . n E 4 61 VAL 61 66 66 VAL VAL F . n E 4 62 ARG 62 67 67 ARG ARG F . n E 4 63 ILE 63 68 68 ILE ILE F . n E 4 64 GLY 64 69 69 GLY GLY F . n E 4 65 LYS 65 70 70 LYS LYS F . n E 4 66 HIS 66 71 71 HIS HIS F . n E 4 67 SER 67 72 72 SER SER F . n E 4 68 ARG 68 73 73 ARG ARG F . n E 4 69 THR 69 74 74 THR THR F . n E 4 70 ARG 70 75 75 ARG ARG F . n E 4 71 TYR 71 76 76 TYR TYR F . n E 4 72 GLU 72 77 77 GLU GLU F . n E 4 73 ARG 73 77 77 ARG ARG F A n E 4 74 LYS 74 78 78 LYS LYS F . n E 4 75 VAL 75 79 79 VAL VAL F . n E 4 76 GLU 76 80 80 GLU GLU F . n E 4 77 LYS 77 81 81 LYS LYS F . n E 4 78 ILE 78 82 82 ILE ILE F . n E 4 79 SER 79 83 83 SER SER F . n E 4 80 MET 80 84 84 MET MET F . n E 4 81 LEU 81 85 85 LEU LEU F . n E 4 82 ASP 82 86 86 ASP ASP F . n E 4 83 LYS 83 87 87 LYS LYS F . n E 4 84 ILE 84 88 88 ILE ILE F . n E 4 85 TYR 85 89 89 TYR TYR F . n E 4 86 ILE 86 90 90 ILE ILE F . n E 4 87 HIS 87 91 91 HIS HIS F . n E 4 88 PRO 88 92 92 PRO PRO F . n E 4 89 ARG 89 93 93 ARG ARG F . n E 4 90 TYR 90 94 94 TYR TYR F . n E 4 91 ASN 91 95 95 ASN ASN F . n E 4 92 TRP 92 96 96 TRP TRP F . n E 4 93 LYS 93 97 97 LYS LYS F . n E 4 94 GLU 94 97 97 GLU GLU F A n E 4 95 ASN 95 98 98 ASN ASN F . n E 4 96 LEU 96 99 99 LEU LEU F . n E 4 97 ASP 97 100 100 ASP ASP F . n E 4 98 ARG 98 101 101 ARG ARG F . n E 4 99 ASP 99 102 102 ASP ASP F . n E 4 100 ILE 100 103 103 ILE ILE F . n E 4 101 ALA 101 104 104 ALA ALA F . n E 4 102 LEU 102 105 105 LEU LEU F . n E 4 103 LEU 103 106 106 LEU LEU F . n E 4 104 LYS 104 107 107 LYS LYS F . n E 4 105 LEU 105 108 108 LEU LEU F . n E 4 106 LYS 106 109 109 LYS LYS F . n E 4 107 ARG 107 110 110 ARG ARG F . n E 4 108 PRO 108 111 111 PRO PRO F . n E 4 109 ILE 109 112 112 ILE ILE F . n E 4 110 GLU 110 113 113 GLU GLU F . n E 4 111 LEU 111 114 114 LEU LEU F . n E 4 112 SER 112 115 115 SER SER F . n E 4 113 ASP 113 116 116 ASP ASP F . n E 4 114 TYR 114 117 117 TYR TYR F . n E 4 115 ILE 115 118 118 ILE ILE F . n E 4 116 HIS 116 119 119 HIS HIS F . n E 4 117 PRO 117 120 120 PRO PRO F . n E 4 118 VAL 118 121 121 VAL VAL F . n E 4 119 CYS 119 122 122 CYS CYS F . n E 4 120 LEU 120 123 123 LEU LEU F . n E 4 121 PRO 121 124 124 PRO PRO F . n E 4 122 ASP 122 125 125 ASP ASP F . n E 4 123 LYS 123 126 126 LYS LYS F . n E 4 124 GLN 124 127 127 GLN GLN F . n E 4 125 THR 125 128 128 THR THR F . n E 4 126 ALA 126 129 129 ALA ALA F . n E 4 127 ALA 127 129 129 ALA ALA F A n E 4 128 LYS 128 129 129 LYS LYS F B n E 4 129 LEU 129 129 129 LEU LEU F C n E 4 130 LEU 130 130 130 LEU LEU F . n E 4 131 HIS 131 131 131 HIS HIS F . n E 4 132 ALA 132 132 132 ALA ALA F . n E 4 133 GLY 133 133 133 GLY GLY F . n E 4 134 PHE 134 134 134 PHE PHE F . n E 4 135 LYS 135 135 135 LYS LYS F . n E 4 136 GLY 136 136 136 GLY GLY F . n E 4 137 ARG 137 137 137 ARG ARG F . n E 4 138 VAL 138 138 138 VAL VAL F . n E 4 139 THR 139 139 139 THR THR F . n E 4 140 GLY 140 140 140 GLY GLY F . n E 4 141 TRP 141 141 141 TRP TRP F . n E 4 142 GLY 142 142 142 GLY GLY F . n E 4 143 ASN 143 143 143 ASN ASN F . n E 4 144 ARG 144 144 144 ARG ARG F . n E 4 145 ARG 145 145 145 ARG ARG F . n E 4 146 GLU 146 146 146 GLU GLU F . n E 4 147 THR 147 147 147 THR THR F . n E 4 148 TRP 148 148 148 TRP TRP F . n E 4 149 THR 149 149 149 THR THR F . n E 4 150 THR 150 149 149 THR THR F A n F 5 1 SER 1 149 149 SER SER G B n F 5 2 VAL 2 149 149 VAL VAL G C n F 5 3 ALA 3 149 149 ALA ALA G D n F 5 4 GLU 4 149 149 GLU GLU G E n F 5 5 VAL 5 150 150 VAL VAL G . n F 5 6 GLN 6 151 151 GLN GLN G . n F 5 7 PRO 7 152 152 PRO PRO G . n F 5 8 SER 8 153 153 SER SER G . n F 5 9 VAL 9 154 154 VAL VAL G . n F 5 10 LEU 10 155 155 LEU LEU G . n F 5 11 GLN 11 156 156 GLN GLN G . n F 5 12 VAL 12 157 157 VAL VAL G . n F 5 13 VAL 13 158 158 VAL VAL G . n F 5 14 ASN 14 159 159 ASN ASN G . n F 5 15 LEU 15 160 160 LEU LEU G . n F 5 16 PRO 16 161 161 PRO PRO G . n F 5 17 LEU 17 162 162 LEU LEU G . n F 5 18 VAL 18 163 163 VAL VAL G . n F 5 19 GLU 19 164 164 GLU GLU G . n F 5 20 ARG 20 165 165 ARG ARG G . n F 5 21 PRO 21 166 166 PRO PRO G . n F 5 22 VAL 22 167 167 VAL VAL G . n F 5 23 CYS 23 168 168 CYS CYS G . n F 5 24 LYS 24 169 169 LYS LYS G . n F 5 25 ALA 25 170 170 ALA ALA G . n F 5 26 SER 26 171 171 SER SER G . n F 5 27 THR 27 172 172 THR THR G . n F 5 28 ARG 28 173 173 ARG ARG G . n F 5 29 ILE 29 174 174 ILE ILE G . n F 5 30 ARG 30 175 175 ARG ARG G . n F 5 31 ILE 31 176 176 ILE ILE G . n F 5 32 THR 32 177 177 THR THR G . n F 5 33 ASP 33 178 178 ASP ASP G . n F 5 34 ASN 34 179 179 ASN ASN G . n F 5 35 MET 35 180 180 MET MET G . n F 5 36 PHE 36 181 181 PHE PHE G . n F 5 37 CYS 37 182 182 CYS CYS G . n F 5 38 ALA 38 183 183 ALA ALA G . n F 5 39 GLY 39 184 184 GLY GLY G . n F 5 40 TYR 40 184 184 TYR TYR G A n F 5 41 LYS 41 185 185 LYS LYS G . n F 5 42 PRO 42 186 186 PRO PRO G . n F 5 43 GLY 43 186 186 GLY GLY G A n F 5 44 GLU 44 186 186 GLU GLU G B n F 5 45 GLY 45 186 186 GLY GLY G C n F 5 46 LYS 46 186 186 LYS LYS G D n F 5 47 ARG 47 187 187 ARG ARG G . n F 5 48 GLY 48 188 188 GLY GLY G . n F 5 49 ASP 49 189 189 ASP ASP G . n F 5 50 ALA 50 190 190 ALA ALA G . n F 5 51 CYS 51 191 191 CYS CYS G . n F 5 52 GLU 52 192 192 GLU GLU G . n F 5 53 GLY 53 193 193 GLY GLY G . n F 5 54 ASP 54 194 194 ASP ASP G . n F 5 55 SER 55 195 195 SER SER G . n F 5 56 GLY 56 196 196 GLY GLY G . n F 5 57 GLY 57 197 197 GLY GLY G . n F 5 58 PRO 58 198 198 PRO PRO G . n F 5 59 PHE 59 199 199 PHE PHE G . n F 5 60 VAL 60 200 200 VAL VAL G . n F 5 61 MET 61 201 201 MET MET G . n F 5 62 LYS 62 202 202 LYS LYS G . n F 5 63 SER 63 203 203 SER SER G . n F 5 64 PRO 64 204 204 PRO PRO G . n F 5 65 TYR 65 204 204 TYR TYR G A n F 5 66 ASN 66 204 204 ASN ASN G B n F 5 67 ASN 67 205 205 ASN ASN G . n F 5 68 ARG 68 206 206 ARG ARG G . n F 5 69 TRP 69 207 207 TRP TRP G . n F 5 70 TYR 70 208 208 TYR TYR G . n F 5 71 GLN 71 209 209 GLN GLN G . n F 5 72 MET 72 210 210 MET MET G . n F 5 73 GLY 73 211 211 GLY GLY G . n F 5 74 ILE 74 212 212 ILE ILE G . n F 5 75 VAL 75 213 213 VAL VAL G . n F 5 76 SER 76 214 214 SER SER G . n F 5 77 TRP 77 215 215 TRP TRP G . n F 5 78 GLY 78 216 216 GLY GLY G . n F 5 79 GLU 79 217 217 GLU GLU G . n F 5 80 GLY 80 219 219 GLY GLY G . n F 5 81 CYS 81 220 220 CYS CYS G . n F 5 82 ASP 82 221 221 ASP ASP G . n F 5 83 ARG 83 221 221 ARG ARG G A n F 5 84 ASP 84 222 222 ASP ASP G . n F 5 85 GLY 85 223 223 GLY GLY G . n F 5 86 LYS 86 224 224 LYS LYS G . n F 5 87 TYR 87 225 225 TYR TYR G . n F 5 88 GLY 88 226 226 GLY GLY G . n F 5 89 PHE 89 227 227 PHE PHE G . n F 5 90 TYR 90 228 228 TYR TYR G . n F 5 91 THR 91 229 229 THR THR G . n F 5 92 HIS 92 230 230 HIS HIS G . n F 5 93 VAL 93 231 231 VAL VAL G . n F 5 94 PHE 94 232 232 PHE PHE G . n F 5 95 ARG 95 233 233 ARG ARG G . n F 5 96 LEU 96 234 234 LEU LEU G . n F 5 97 LYS 97 235 235 LYS LYS G . n F 5 98 LYS 98 236 236 LYS LYS G . n F 5 99 TRP 99 237 237 TRP TRP G . n F 5 100 ILE 100 238 238 ILE ILE G . n F 5 101 GLN 101 239 239 GLN GLN G . n F 5 102 LYS 102 240 240 LYS LYS G . n F 5 103 VAL 103 241 241 VAL VAL G . n F 5 104 ILE 104 242 242 ILE ILE G . n F 5 105 ASP 105 243 243 ASP ASP G . n F 5 106 ARG 106 244 244 ARG ARG G . n F 5 107 LEU 107 245 245 LEU LEU G . n F 5 108 GLY 108 246 246 GLY GLY G . n F 5 109 SER 109 247 247 SER SER G . n G 3 1 HIS 1 51 51 HIS HIS J . n G 3 2 ASN 2 52 52 ASN ASN J . n G 3 3 ASP 3 53 53 ASP ASP J . n G 3 4 GLY 4 54 54 GLY GLY J . n G 3 5 ASP 5 55 55 ASP ASP J . n G 3 6 PHE 6 56 56 PHE PHE J . n G 3 7 GLU 7 57 57 GLU GLU J . n G 3 8 GLU 8 58 58 GLU GLU J . n G 3 9 ILE 9 59 59 ILE ILE J . n G 3 10 PRO 10 60 60 PRO PRO J . n G 3 11 GLU 11 61 61 GLU GLU J . n G 3 12 GLU 12 62 62 GLU GLU J . n G 3 13 TYR 13 63 63 TYR TYR J . n G 3 14 LEU 14 64 64 LEU LEU J . n G 3 15 GLN 15 65 65 GLN GLN J . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code H 6 NAG 1 401 401 NAG NAG H . I 6 NAG 2 402 402 NAG NAG H . J 6 NAG 1 501 501 NAG NAG F . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 B ASN 53 H ASN 60 G ASN 'GLYCOSYLATION SITE' 2 E ASN 53 F ASN 60 G ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA trimeric 3 2 author_and_software_defined_assembly PISA tetrameric 4 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,C,H,I 2 1 D,E,F,G,J # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 4630 ? 1 MORE -13 ? 1 'SSA (A^2)' 14280 ? 2 'ABSA (A^2)' 10830 ? 2 MORE -65 ? 2 'SSA (A^2)' 15390 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 1997-04-21 2 'Structure model' 1 1 2008-03-24 3 'Structure model' 1 2 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal XENGEN 'data collection' . ? 1 XENGEN 'data reduction' . ? 2 X-PLOR 'model building' 3.1 ? 3 X-PLOR refinement 3.1 ? 4 XENGEN 'data scaling' . ? 5 X-PLOR phasing 3.1 ? 6 # _pdbx_entry_details.entry_id 1VIT _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ;CHYMOTRYPSINOGEN NUMBERING (RATHER THAN SEQUENTIAL) SYSTEM IS USED FOR THROMBIN, BASED ON THE TOPOLOGICAL ALIGNMENT WITH THE STRUCTURE OF CHYMOTRYPSINOGEN (H. BRANDSTETTER ET AL., 1992, J. MOL. BIOL., V. 226, 1085). THE NUMBERING FOR THE PEPTIDE CORRESPONDS TO THE C-TERMINAL RESIDUES OF HIRUDIN. ; # _pdbx_validate_rmsd_angle.id 1 _pdbx_validate_rmsd_angle.PDB_model_num 1 _pdbx_validate_rmsd_angle.auth_atom_id_1 N _pdbx_validate_rmsd_angle.auth_asym_id_1 I _pdbx_validate_rmsd_angle.auth_comp_id_1 GLY _pdbx_validate_rmsd_angle.auth_seq_id_1 54 _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? _pdbx_validate_rmsd_angle.label_alt_id_1 ? _pdbx_validate_rmsd_angle.auth_atom_id_2 CA _pdbx_validate_rmsd_angle.auth_asym_id_2 I _pdbx_validate_rmsd_angle.auth_comp_id_2 GLY _pdbx_validate_rmsd_angle.auth_seq_id_2 54 _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? _pdbx_validate_rmsd_angle.label_alt_id_2 ? _pdbx_validate_rmsd_angle.auth_atom_id_3 C _pdbx_validate_rmsd_angle.auth_asym_id_3 I _pdbx_validate_rmsd_angle.auth_comp_id_3 GLY _pdbx_validate_rmsd_angle.auth_seq_id_3 54 _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? _pdbx_validate_rmsd_angle.label_alt_id_3 ? _pdbx_validate_rmsd_angle.angle_value 93.10 _pdbx_validate_rmsd_angle.angle_target_value 113.10 _pdbx_validate_rmsd_angle.angle_deviation -20.00 _pdbx_validate_rmsd_angle.angle_standard_deviation 2.50 _pdbx_validate_rmsd_angle.linker_flag N # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 GLU L 1 C ? -8.32 -60.84 2 1 ALA L 1 B ? -151.79 34.65 3 1 PHE L 7 ? ? -137.24 -86.38 4 1 GLN L 11 ? ? 56.90 7.13 5 1 ILE L 14 K ? 64.75 -58.68 6 1 GLU L 14 L ? -59.41 108.81 7 1 PRO H 28 ? ? -59.80 -4.16 8 1 ALA H 56 ? ? -48.44 -19.28 9 1 ASP H 60 E ? 49.36 19.07 10 1 ASN H 60 G ? -173.72 83.53 11 1 ARG H 77 A ? -29.15 -50.28 12 1 ASP H 86 ? ? -120.22 -76.46 13 1 ASN H 98 ? ? -175.77 17.41 14 1 ARG H 110 ? ? -177.26 119.85 15 1 PRO H 120 ? ? -48.23 158.77 16 1 ASN H 143 ? ? -38.13 134.81 17 1 TRP H 148 ? ? -91.46 -87.86 18 1 THR H 149 A ? -53.26 -159.26 19 1 SER H 149 B ? 82.90 157.12 20 1 ALA H 149 D ? -162.57 23.63 21 1 GLU H 149 E ? 82.02 41.78 22 1 SER H 171 ? ? -157.58 -33.23 23 1 ARG H 175 ? ? -59.83 102.61 24 1 ARG H 187 ? ? -117.65 -162.73 25 1 ASP H 189 ? ? 164.83 162.31 26 1 CYS H 191 ? ? -126.48 -160.61 27 1 VAL H 213 ? ? -44.03 94.48 28 1 GLU H 217 ? ? -109.70 70.81 29 1 ARG H 244 ? ? -103.14 76.48 30 1 LEU H 245 ? ? -116.87 -157.72 31 1 ASN I 52 ? ? -138.37 -143.11 32 1 ASP I 55 ? ? -5.47 140.88 33 1 PRO I 60 ? ? -53.56 103.17 34 1 GLU I 61 ? ? -60.46 21.60 35 1 ALA M 1 B ? 60.34 -63.53 36 1 PHE M 7 ? ? -137.60 -75.47 37 1 LYS M 9 ? ? -90.31 50.88 38 1 LYS M 10 ? ? -161.25 1.52 39 1 THR M 14 B ? -142.86 25.23 40 1 LYS F 36 ? ? -49.35 -82.26 41 1 SER F 48 ? ? 177.84 172.98 42 1 HIS F 57 ? ? -47.08 -4.79 43 1 TYR F 60 A ? -166.23 82.23 44 1 ASN F 60 G ? -170.94 76.83 45 1 VAL F 61 ? ? -36.08 -38.67 46 1 HIS F 71 ? ? -136.20 -42.40 47 1 ARG F 77 A ? -29.21 -28.64 48 1 LYS F 87 ? ? 84.45 123.83 49 1 ASN F 95 ? ? -103.61 74.60 50 1 ASN F 98 ? ? -160.37 16.44 51 1 LEU F 99 ? ? 59.67 18.93 52 1 ASP F 102 ? ? -71.94 47.56 53 1 ASP F 125 ? ? -75.59 -166.24 54 1 GLN F 127 ? ? -141.16 -37.96 55 1 ALA F 129 ? ? -82.24 41.28 56 1 ALA F 129 A ? -155.47 -22.51 57 1 ASN F 143 ? ? -4.16 121.23 58 1 THR F 147 ? ? 100.82 -130.67 59 1 TRP F 148 ? ? -40.84 107.09 60 1 GLU G 186 B ? -46.65 -98.34 61 1 ARG G 187 ? ? -118.33 -162.48 62 1 ASP G 194 ? ? -51.70 -6.64 63 1 ASN G 204 B ? -159.72 37.32 64 1 ASN G 205 ? ? 21.87 15.71 65 1 SER G 214 ? ? -91.91 -77.52 66 1 ASP G 221 ? ? 73.18 33.00 67 1 ARG G 244 ? ? 91.89 116.96 68 1 LEU G 245 ? ? -108.18 -88.06 69 1 ASP J 53 ? ? 178.99 109.43 70 1 GLU J 58 ? ? -48.18 154.58 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 L THR 1 U A THR 1 2 1 Y 1 L SER 1 T A SER 2 3 1 Y 1 L GLU 1 S A GLU 3 4 1 Y 1 L ASP 1 R A ASP 4 5 1 Y 1 L HIS 1 Q A HIS 5 6 1 Y 1 L PHE 1 P A PHE 6 7 1 Y 1 L GLN 1 O A GLN 7 8 1 Y 1 L PRO 1 N A PRO 8 9 1 Y 1 L PHE 1 M A PHE 9 10 1 Y 1 L PHE 1 L A PHE 10 11 1 Y 1 L ASN 1 K A ASN 11 12 1 Y 1 L GLU 1 J A GLU 12 13 1 Y 1 L LYS 1 I A LYS 13 14 1 Y 1 M THR 1 U D THR 1 15 1 Y 1 M SER 1 T D SER 2 16 1 Y 1 M GLU 1 S D GLU 3 17 1 Y 1 M ASP 1 R D ASP 4 18 1 Y 1 M HIS 1 Q D HIS 5 19 1 Y 1 M PHE 1 P D PHE 6 20 1 Y 1 M GLN 1 O D GLN 7 21 1 Y 1 M PRO 1 N D PRO 8 22 1 Y 1 M PHE 1 M D PHE 9 23 1 Y 1 M PHE 1 L D PHE 10 24 1 Y 1 M ASN 1 K D ASN 11 25 1 Y 1 M GLU 1 J D GLU 12 26 1 Y 1 M LYS 1 I D LYS 13 # _pdbx_entity_nonpoly.entity_id 6 _pdbx_entity_nonpoly.name N-ACETYL-D-GLUCOSAMINE _pdbx_entity_nonpoly.comp_id NAG #