data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 THR 0 3 THR 0 4 ASP 0 5 ASP 0 6 ALA 0 7 LEU 0 8 ILE 0 9 GLN 0 10 MET 0 11 PHE 0 12 TYR 0 13 ASP 0 14 ILE 0 15 ASP 0 16 VAL 0 17 ASP 0 18 LYS 0 19 SER 0 20 GLY 0 21 ALA 0 22 VAL 0 23 ASP 0 24 CYS 0 25 ASP 0 26 GLU 0 27 LEU 0 28 ARG 0 29 GLU 0 30 TYR 0 31 LEU 0 32 ILE 0 33 LYS 0 34 LYS 0 35 GLU 0 36 PHE 0 37 GLY 0 38 GLU 0 39 CYS 0 40 PHE 0 41 ILE 0 42 THR 0 43 ARG 0 44 PHE 0 45 LEU 0 46 ARG 0 47 THR 0 48 PHE 0 49 ASP 0 50 SER 0 51 ASN 0 52 ARG 0 53 ASP 0 54 GLY 0 55 MET 0 56 ILE 0 57 THR 0 58 PHE 0 59 GLU 0 60 GLU 0 61 TYR 0 62 GLN 0 63 THR 0 64 GLY 0 65 ILE 0 66 HIS 0 67 LYS 0 68 ILE 0 69 SER 0 70 HIS 0 71 LEU 0 72 ARG 0 73 LYS 0 74 LYS 0 75 TYR 0 76 PHE 0 77 ASN 0 78 TYR 0 79 TYR 0 80 HIS 0 81 ILE 0 82 LEU 0 83 LYS 0 84 LYS 0 85 LEU 0 86 ASP 0 87 LYS 0 88 ASP 0 89 LYS 0 90 ASN 0 91 GLY 0 92 TYR 0 93 ILE 0 94 THR 0 95 THR 0 96 HIS 0 97 GLU 0 98 ILE 0 99 TYR 0 100 ASP 0 101 VAL 0 102 LEU 0 103 TYR 0 104 GLU 0 105 SER 0 106 GLY 0 107 ASN 0 108 LYS 0 109 ASN 0 110 TYR 0 111 PHE 0 112 SER 0 113 SER 0 114 LYS 0 115 ASP 0 116 LEU 0 117 GLN 0 118 ALA 0 119 PHE 0 120 ILE 0 121 ARG 0 122 LYS 0 123 TYR 0 124 ASP 0 125 GLN 0 126 ASP 0 127 GLY 0 128 ASP 0 129 GLY 0 130 LYS 0 131 LEU 0 132 ASN 0 133 TYR 0 134 HIS 0 135 GLU 0 136 PHE 0 137 LEU 0 138 ASP 0 139 TYR 0 140 LEU 0 141 LEU 0 142 GLU 0 143 GLN 0 144 PRO 0 145 THR 0 146 SER 0 147 GLU 0 148 GLY 0 149 CYS 0 150 PRO 0 151 ARG 0 152 THR 0 153 LEU 0 154 ASN 0 155 ILE 0 156 SER 0 157 LYS # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # 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.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 0 1 . 24.492 10.805 9.943 1.00 47.48 1 A 1 ATOM 2 C CA . MET A 0 1 . 23.770 10.283 8.768 1.00 47.48 1 A 1 ATOM 3 C C . MET A 0 1 . 22.444 10.994 8.701 1.00 47.48 1 A 1 ATOM 4 C CB . MET A 0 1 . 23.549 8.768 8.850 1.00 47.48 1 A 1 ATOM 5 O O . MET A 0 1 . 21.715 10.986 9.689 1.00 47.48 1 A 1 ATOM 6 C CG . MET A 0 1 . 24.837 8.004 8.538 1.00 47.48 1 A 1 ATOM 7 S SD . MET A 0 1 . 24.707 6.219 8.796 1.00 47.48 1 A 1 ATOM 8 C CE . MET A 0 1 . 23.780 5.727 7.311 1.00 47.48 1 A 1 ATOM 9 N N . THR A 0 2 . 22.186 11.675 7.596 1.00 59.16 2 A 1 ATOM 10 C CA . THR A 0 2 . 20.869 12.241 7.303 1.00 59.16 2 A 1 ATOM 11 C C . THR A 0 2 . 19.901 11.122 6.907 1.00 59.16 2 A 1 ATOM 12 C CB . THR A 0 2 . 20.968 13.309 6.203 1.00 59.16 2 A 1 ATOM 13 O O . THR A 0 2 . 20.322 10.002 6.605 1.00 59.16 2 A 1 ATOM 14 C CG2 . THR A 0 2 . 21.903 14.457 6.585 1.00 59.16 2 A 1 ATOM 15 O OG1 . THR A 0 2 . 21.419 12.734 5.005 1.00 59.16 2 A 1 ATOM 16 N N . THR A 0 3 . 18.595 11.402 6.934 1.00 56.95 3 A 1 ATOM 17 C CA . THR A 0 3 . 17.580 10.477 6.400 1.00 56.95 3 A 1 ATOM 18 C C . THR A 0 3 . 17.890 10.133 4.944 1.00 56.95 3 A 1 ATOM 19 C CB . THR A 0 3 . 16.179 11.100 6.492 1.00 56.95 3 A 1 ATOM 20 O O . THR A 0 3 . 17.753 8.978 4.557 1.00 56.95 3 A 1 ATOM 21 C CG2 . THR A 0 3 . 15.055 10.113 6.182 1.00 56.95 3 A 1 ATOM 22 O OG1 . THR A 0 3 . 15.944 11.566 7.806 1.00 56.95 3 A 1 ATOM 23 N N . ASP A 0 4 . 18.388 11.105 4.178 1.00 60.99 4 A 1 ATOM 24 C CA . ASP A 0 4 . 18.728 10.943 2.768 1.00 60.99 4 A 1 ATOM 25 C C . ASP A 0 4 . 19.923 9.998 2.580 1.00 60.99 4 A 1 ATOM 26 C CB . ASP A 0 4 . 18.968 12.324 2.136 1.00 60.99 4 A 1 ATOM 27 O O . ASP A 0 4 . 19.841 9.096 1.752 1.00 60.99 4 A 1 ATOM 28 C CG . ASP A 0 4 . 17.774 13.275 2.321 1.00 60.99 4 A 1 ATOM 29 O OD1 . ASP A 0 4 . 16.620 12.784 2.360 1.00 60.99 4 A 1 ATOM 30 O OD2 . ASP A 0 4 . 18.021 14.483 2.525 1.00 60.99 4 A 1 ATOM 31 N N . ASP A 0 5 . 20.971 10.098 3.413 1.00 67.51 5 A 1 ATOM 32 C CA . ASP A 0 5 . 22.125 9.178 3.366 1.00 67.51 5 A 1 ATOM 33 C C . ASP A 0 5 . 21.701 7.716 3.563 1.00 67.51 5 A 1 ATOM 34 C CB . ASP A 0 5 . 23.152 9.494 4.466 1.00 67.51 5 A 1 ATOM 35 O O . ASP A 0 5 . 22.165 6.825 2.857 1.00 67.51 5 A 1 ATOM 36 C CG . ASP A 0 5 . 23.865 10.833 4.319 1.00 67.51 5 A 1 ATOM 37 O OD1 . ASP A 0 5 . 24.490 11.064 3.269 1.00 67.51 5 A 1 ATOM 38 O OD2 . ASP A 0 5 . 23.819 11.596 5.323 1.00 67.51 5 A 1 ATOM 39 N N . ALA A 0 6 . 20.803 7.456 4.520 1.00 66.68 6 A 1 ATOM 40 C CA . ALA A 0 6 . 20.310 6.104 4.772 1.00 66.68 6 A 1 ATOM 41 C C . ALA A 0 6 . 19.478 5.568 3.595 1.00 66.68 6 A 1 ATOM 42 C CB . ALA A 0 6 . 19.506 6.108 6.079 1.00 66.68 6 A 1 ATOM 43 O O . ALA A 0 6 . 19.521 4.376 3.309 1.00 66.68 6 A 1 ATOM 44 N N . LEU A 0 7 . 18.730 6.433 2.906 1.00 63.85 7 A 1 ATOM 45 C CA . LEU A 0 7 . 17.911 6.061 1.749 1.00 63.85 7 A 1 ATOM 46 C C . LEU A 0 7 . 18.757 5.850 0.490 1.00 63.85 7 A 1 ATOM 47 C CB . LEU A 0 7 . 16.844 7.140 1.511 1.00 63.85 7 A 1 ATOM 48 O O . LEU A 0 7 . 18.491 4.918 -0.264 1.00 63.85 7 A 1 ATOM 49 C CG . LEU A 0 7 . 15.795 7.302 2.631 1.00 63.85 7 A 1 ATOM 50 C CD1 . LEU A 0 7 . 14.994 8.571 2.381 1.00 63.85 7 A 1 ATOM 51 C CD2 . LEU A 0 7 . 14.776 6.167 2.728 1.00 63.85 7 A 1 ATOM 52 N N . ILE A 0 8 . 19.784 6.673 0.280 1.00 70.08 8 A 1 ATOM 53 C CA . ILE A 0 8 . 20.770 6.484 -0.789 1.00 70.08 8 A 1 ATOM 54 C C . ILE A 0 8 . 21.517 5.169 -0.565 1.00 70.08 8 A 1 ATOM 55 C CB . ILE A 0 8 . 21.728 7.694 -0.846 1.00 70.08 8 A 1 ATOM 56 O O . ILE A 0 8 . 21.671 4.390 -1.499 1.00 70.08 8 A 1 ATOM 57 C CG1 . ILE A 0 8 . 20.978 8.957 -1.325 1.00 70.08 8 A 1 ATOM 58 C CG2 . ILE A 0 8 . 22.916 7.407 -1.780 1.00 70.08 8 A 1 ATOM 59 C CD1 . ILE A 0 8 . 21.751 10.257 -1.065 1.00 70.08 8 A 1 ATOM 60 N N . GLN A 0 9 . 21.904 4.877 0.680 1.00 74.02 9 A 1 ATOM 61 C CA . GLN A 0 9 . 22.519 3.596 1.013 1.00 74.02 9 A 1 ATOM 62 C C . GLN A 0 9 . 21.585 2.426 0.696 1.00 74.02 9 A 1 ATOM 63 C CB . GLN A 0 9 . 22.942 3.590 2.489 1.00 74.02 9 A 1 ATOM 64 O O . GLN A 0 9 . 22.037 1.434 0.142 1.00 74.02 9 A 1 ATOM 65 C CG . GLN A 0 9 . 23.807 2.367 2.826 1.00 74.02 9 A 1 ATOM 66 C CD . GLN A 0 9 . 25.103 2.331 2.024 1.00 74.02 9 A 1 ATOM 67 N NE2 . GLN A 0 9 . 25.525 1.171 1.578 1.00 74.02 9 A 1 ATOM 68 O OE1 . GLN A 0 9 . 25.752 3.343 1.795 1.00 74.02 9 A 1 ATOM 69 N N . MET A 0 10 . 20.283 2.558 0.971 1.00 72.67 10 A 1 ATOM 70 C CA . MET A 0 10 . 19.327 1.517 0.593 1.00 72.67 10 A 1 ATOM 71 C C . MET A 0 10 . 19.272 1.292 -0.917 1.00 72.67 10 A 1 ATOM 72 C CB . MET A 0 10 . 17.920 1.806 1.118 1.00 72.67 10 A 1 ATOM 73 O O . MET A 0 10 . 19.191 0.141 -1.308 1.00 72.67 10 A 1 ATOM 74 C CG . MET A 0 10 . 17.819 1.580 2.628 1.00 72.67 10 A 1 ATOM 75 S SD . MET A 0 10 . 16.131 1.593 3.299 1.00 72.67 10 A 1 ATOM 76 C CE . MET A 0 10 . 15.623 3.220 2.747 1.00 72.67 10 A 1 ATOM 77 N N . PHE A 0 11 . 19.354 2.331 -1.755 1.00 74.21 11 A 1 ATOM 78 C CA . PHE A 0 11 . 19.397 2.147 -3.212 1.00 74.21 11 A 1 ATOM 79 C C . PHE A 0 11 . 20.587 1.281 -3.628 1.00 74.21 11 A 1 ATOM 80 C CB . PHE A 0 11 . 19.451 3.508 -3.907 1.00 74.21 11 A 1 ATOM 81 O O . PHE A 0 11 . 20.406 0.297 -4.332 1.00 74.21 11 A 1 ATOM 82 C CG . PHE A 0 11 . 19.366 3.443 -5.417 1.00 74.21 11 A 1 ATOM 83 C CD1 . PHE A 0 11 . 20.543 3.373 -6.187 1.00 74.21 11 A 1 ATOM 84 C CD2 . PHE A 0 11 . 18.111 3.442 -6.056 1.00 74.21 11 A 1 ATOM 85 C CE1 . PHE A 0 11 . 20.463 3.318 -7.589 1.00 74.21 11 A 1 ATOM 86 C CE2 . PHE A 0 11 . 18.033 3.407 -7.459 1.00 74.21 11 A 1 ATOM 87 C CZ . PHE A 0 11 . 19.210 3.350 -8.223 1.00 74.21 11 A 1 ATOM 88 N N . TYR A 0 12 . 21.778 1.579 -3.105 1.00 80.70 12 A 1 ATOM 89 C CA . TYR A 0 12 . 22.974 0.773 -3.362 1.00 80.70 12 A 1 ATOM 90 C C . TYR A 0 12 . 22.921 -0.632 -2.749 1.00 80.70 12 A 1 ATOM 91 C CB . TYR A 0 12 . 24.201 1.512 -2.820 1.00 80.70 12 A 1 ATOM 92 O O . TYR A 0 12 . 23.600 -1.531 -3.232 1.00 80.70 12 A 1 ATOM 93 C CG . TYR A 0 12 . 24.550 2.780 -3.570 1.00 80.70 12 A 1 ATOM 94 C CD1 . TYR A 0 12 . 24.895 2.707 -4.933 1.00 80.70 12 A 1 ATOM 95 C CD2 . TYR A 0 12 . 24.563 4.021 -2.906 1.00 80.70 12 A 1 ATOM 96 C CE1 . TYR A 0 12 . 25.257 3.872 -5.634 1.00 80.70 12 A 1 ATOM 97 C CE2 . TYR A 0 12 . 24.927 5.188 -3.604 1.00 80.70 12 A 1 ATOM 98 O OH . TYR A 0 12 . 25.625 6.242 -5.640 1.00 80.70 12 A 1 ATOM 99 C CZ . TYR A 0 12 . 25.271 5.114 -4.970 1.00 80.70 12 A 1 ATOM 100 N N . ASP A 0 13 . 22.153 -0.826 -1.675 1.00 80.36 13 A 1 ATOM 101 C CA . ASP A 0 13 . 21.927 -2.150 -1.091 1.00 80.36 13 A 1 ATOM 102 C C . ASP A 0 13 . 20.915 -2.980 -1.911 1.00 80.36 13 A 1 ATOM 103 C CB . ASP A 0 13 . 21.415 -2.024 0.357 1.00 80.36 13 A 1 ATOM 104 O O . ASP A 0 13 . 20.871 -4.203 -1.751 1.00 80.36 13 A 1 ATOM 105 C CG . ASP A 0 13 . 22.371 -1.445 1.415 1.00 80.36 13 A 1 ATOM 106 O OD1 . ASP A 0 13 . 23.595 -1.281 1.186 1.00 80.36 13 A 1 ATOM 107 O OD2 . ASP A 0 13 . 21.852 -1.226 2.540 1.00 80.36 13 A 1 ATOM 108 N N . ILE A 0 14 . 20.076 -2.321 -2.720 1.00 81.06 14 A 1 ATOM 109 C CA . ILE A 0 14 . 19.063 -2.943 -3.584 1.00 81.06 14 A 1 ATOM 110 C C . ILE A 0 14 . 19.635 -3.257 -4.969 1.00 81.06 14 A 1 ATOM 111 C CB . ILE A 0 14 . 17.810 -2.047 -3.709 1.00 81.06 14 A 1 ATOM 112 O O . ILE A 0 14 . 19.358 -4.338 -5.468 1.00 81.06 14 A 1 ATOM 113 C CG1 . ILE A 0 14 . 17.085 -1.832 -2.367 1.00 81.06 14 A 1 ATOM 114 C CG2 . ILE A 0 14 . 16.795 -2.707 -4.656 1.00 81.06 14 A 1 ATOM 115 C CD1 . ILE A 0 14 . 16.234 -0.558 -2.315 1.00 81.06 14 A 1 ATOM 116 N N . ASP A 0 15 . 20.413 -2.339 -5.548 1.00 84.96 15 A 1 ATOM 117 C CA . ASP A 0 15 . 21.119 -2.479 -6.833 1.00 84.96 15 A 1 ATOM 118 C C . ASP A 0 15 . 22.240 -3.529 -6.691 1.00 84.96 15 A 1 ATOM 119 C CB . ASP A 0 15 . 21.625 -1.076 -7.235 1.00 84.96 15 A 1 ATOM 120 O O . ASP A 0 15 . 23.406 -3.218 -6.410 1.00 84.96 15 A 1 ATOM 121 C CG . ASP A 0 15 . 22.423 -1.016 -8.542 1.00 84.96 15 A 1 ATOM 122 O OD1 . ASP A 0 15 . 22.443 -1.998 -9.299 1.00 84.96 15 A 1 ATOM 123 O OD2 . ASP A 0 15 . 23.119 0.009 -8.760 1.00 84.96 15 A 1 ATOM 124 N N . VAL A 0 16 . 21.858 -4.808 -6.765 1.00 80.28 16 A 1 ATOM 125 C CA . VAL A 0 16 . 22.748 -5.950 -6.509 1.00 80.28 16 A 1 ATOM 126 C C . VAL A 0 16 . 23.753 -6.076 -7.644 1.00 80.28 16 A 1 ATOM 127 C CB . VAL A 0 16 . 21.952 -7.267 -6.349 1.00 80.28 16 A 1 ATOM 128 O O . VAL A 0 16 . 24.924 -6.404 -7.398 1.00 80.28 16 A 1 ATOM 129 C CG1 . VAL A 0 16 . 22.869 -8.499 -6.233 1.00 80.28 16 A 1 ATOM 130 C CG2 . VAL A 0 16 . 21.095 -7.267 -5.076 1.00 80.28 16 A 1 ATOM 131 N N . ASP A 0 17 . 23.307 -5.831 -8.874 1.00 84.97 17 A 1 ATOM 132 C CA . ASP A 0 17 . 24.141 -5.928 -10.067 1.00 84.97 17 A 1 ATOM 133 C C . ASP A 0 17 . 25.027 -4.689 -10.305 1.00 84.97 17 A 1 ATOM 134 C CB . ASP A 0 17 . 23.286 -6.359 -11.269 1.00 84.97 17 A 1 ATOM 135 O O . ASP A 0 17 . 26.002 -4.771 -11.062 1.00 84.97 17 A 1 ATOM 136 C CG . ASP A 0 17 . 22.539 -5.239 -12.001 1.00 84.97 17 A 1 ATOM 137 O OD1 . ASP A 0 17 . 22.495 -4.104 -11.487 1.00 84.97 17 A 1 ATOM 138 O OD2 . ASP A 0 17 . 22.165 -5.509 -13.164 1.00 84.97 17 A 1 ATOM 139 N N . LYS A 0 18 . 24.785 -3.597 -9.565 1.00 81.90 18 A 1 ATOM 140 C CA . LYS A 0 18 . 25.507 -2.314 -9.631 1.00 81.90 18 A 1 ATOM 141 C C . LYS A 0 18 . 25.377 -1.643 -10.990 1.00 81.90 18 A 1 ATOM 142 C CB . LYS A 0 18 . 26.956 -2.432 -9.163 1.00 81.90 18 A 1 ATOM 143 O O . LYS A 0 18 . 26.320 -0.985 -11.451 1.00 81.90 18 A 1 ATOM 144 C CG . LYS A 0 18 . 27.051 -3.023 -7.762 1.00 81.90 18 A 1 ATOM 145 C CD . LYS A 0 18 . 28.522 -3.095 -7.379 1.00 81.90 18 A 1 ATOM 146 C CE . LYS A 0 18 . 28.589 -3.718 -5.994 1.00 81.90 18 A 1 ATOM 147 N NZ . LYS A 0 18 . 29.994 -3.846 -5.561 1.00 81.90 18 A 1 ATOM 148 N N . SER A 0 19 . 24.236 -1.816 -11.640 1.00 84.99 19 A 1 ATOM 149 C CA . SER A 0 19 . 23.922 -1.162 -12.905 1.00 84.99 19 A 1 ATOM 150 C C . SER A 0 19 . 23.712 0.348 -12.742 1.00 84.99 19 A 1 ATOM 151 C CB . SER A 0 19 . 22.694 -1.820 -13.531 1.00 84.99 19 A 1 ATOM 152 O O . SER A 0 19 . 23.801 1.088 -13.726 1.00 84.99 19 A 1 ATOM 153 O OG . SER A 0 19 . 21.567 -1.602 -12.723 1.00 84.99 19 A 1 ATOM 154 N N . GLY A 0 20 . 23.496 0.833 -11.512 1.00 81.19 20 A 1 ATOM 155 C CA . GLY A 0 20 . 23.140 2.222 -11.218 1.00 81.19 20 A 1 ATOM 156 C C . GLY A 0 20 . 21.646 2.511 -11.388 1.00 81.19 20 A 1 ATOM 157 O O . GLY A 0 20 . 21.220 3.660 -11.233 1.00 81.19 20 A 1 ATOM 158 N N . ALA A 0 21 . 20.857 1.485 -11.697 1.00 83.65 21 A 1 ATOM 159 C CA . ALA A 0 21 . 19.406 1.492 -11.704 1.00 83.65 21 A 1 ATOM 160 C C . ALA A 0 21 . 18.926 0.305 -10.868 1.00 83.65 21 A 1 ATOM 161 C CB . ALA A 0 21 . 18.900 1.434 -13.148 1.00 83.65 21 A 1 ATOM 162 O O . ALA A 0 21 . 19.600 -0.709 -10.791 1.00 83.65 21 A 1 ATOM 163 N N . VAL A 0 22 . 17.771 0.449 -10.232 1.00 83.19 22 A 1 ATOM 164 C CA . VAL A 0 22 . 17.140 -0.656 -9.513 1.00 83.19 22 A 1 ATOM 165 C C . VAL A 0 22 . 16.008 -1.173 -10.372 1.00 83.19 22 A 1 ATOM 166 C CB . VAL A 0 22 . 16.672 -0.191 -8.131 1.00 83.19 22 A 1 ATOM 167 O O . VAL A 0 22 . 15.061 -0.429 -10.644 1.00 83.19 22 A 1 ATOM 168 C CG1 . VAL A 0 22 . 15.699 -1.176 -7.492 1.00 83.19 22 A 1 ATOM 169 C CG2 . VAL A 0 22 . 17.868 -0.022 -7.190 1.00 83.19 22 A 1 ATOM 170 N N . ASP A 0 23 . 16.077 -2.425 -10.796 1.00 85.45 23 A 1 ATOM 171 C CA . ASP A 0 23 . 14.967 -3.013 -11.537 1.00 85.45 23 A 1 ATOM 172 C C . ASP A 0 23 . 13.797 -3.396 -10.611 1.00 85.45 23 A 1 ATOM 173 C CB . ASP A 0 23 . 15.452 -4.109 -12.496 1.00 85.45 23 A 1 ATOM 174 O O . ASP A 0 23 . 13.881 -3.402 -9.373 1.00 85.45 23 A 1 ATOM 175 C CG . ASP A 0 23 . 15.806 -5.435 -11.838 1.00 85.45 23 A 1 ATOM 176 O OD1 . ASP A 0 23 . 14.929 -5.954 -11.112 1.00 85.45 23 A 1 ATOM 177 O OD2 . ASP A 0 23 . 16.878 -5.983 -12.160 1.00 85.45 23 A 1 ATOM 178 N N . CYS A 0 24 . 12.639 -3.660 -11.219 1.00 80.43 24 A 1 ATOM 179 C CA . CYS A 0 24 . 11.439 -4.000 -10.464 1.00 80.43 24 A 1 ATOM 180 C C . CYS A 0 24 . 11.587 -5.265 -9.610 1.00 80.43 24 A 1 ATOM 181 C CB . CYS A 0 24 . 10.258 -4.168 -11.427 1.00 80.43 24 A 1 ATOM 182 O O . CYS A 0 24 . 10.980 -5.341 -8.536 1.00 80.43 24 A 1 ATOM 183 S SG . CYS A 0 24 . 9.633 -2.555 -11.972 1.00 80.43 24 A 1 ATOM 184 N N . ASP A 0 25 . 12.355 -6.246 -10.075 1.00 84.52 25 A 1 ATOM 185 C CA . ASP A 0 25 . 12.567 -7.507 -9.377 1.00 84.52 25 A 1 ATOM 186 C C . ASP A 0 25 . 13.558 -7.319 -8.216 1.00 84.52 25 A 1 ATOM 187 C CB . ASP A 0 25 . 12.985 -8.603 -10.374 1.00 84.52 25 A 1 ATOM 188 O O . ASP A 0 25 . 13.303 -7.820 -7.121 1.00 84.52 25 A 1 ATOM 189 C CG . ASP A 0 25 . 11.852 -8.996 -11.339 1.00 84.52 25 A 1 ATOM 190 O OD1 . ASP A 0 25 . 10.688 -9.114 -10.873 1.00 84.52 25 A 1 ATOM 191 O OD2 . ASP A 0 25 . 12.134 -9.251 -12.532 1.00 84.52 25 A 1 ATOM 192 N N . GLU A 0 26 . 14.604 -6.506 -8.376 1.00 84.23 26 A 1 ATOM 193 C CA . GLU A 0 26 . 15.537 -6.140 -7.302 1.00 84.23 26 A 1 ATOM 194 C C . GLU A 0 26 . 14.840 -5.418 -6.145 1.00 84.23 26 A 1 ATOM 195 C CB . GLU A 0 26 . 16.640 -5.229 -7.845 1.00 84.23 26 A 1 ATOM 196 O O . GLU A 0 26 . 14.958 -5.825 -4.979 1.00 84.23 26 A 1 ATOM 197 C CG . GLU A 0 26 . 17.676 -5.967 -8.697 1.00 84.23 26 A 1 ATOM 198 C CD . GLU A 0 26 . 18.798 -5.006 -9.105 1.00 84.23 26 A 1 ATOM 199 O OE1 . GLU A 0 26 . 19.976 -5.418 -8.937 1.00 84.23 26 A 1 ATOM 200 O OE2 . GLU A 0 26 . 18.459 -3.840 -9.424 1.00 84.23 26 A 1 ATOM 201 N N . LEU A 0 27 . 14.055 -4.371 -6.439 1.00 79.68 27 A 1 ATOM 202 C CA . LEU A 0 27 . 13.306 -3.672 -5.390 1.00 79.68 27 A 1 ATOM 203 C C . LEU A 0 27 . 12.275 -4.594 -4.744 1.00 79.68 27 A 1 ATOM 204 C CB . LEU A 0 27 . 12.633 -2.403 -5.936 1.00 79.68 27 A 1 ATOM 205 O O . LEU A 0 27 . 12.055 -4.523 -3.530 1.00 79.68 27 A 1 ATOM 206 C CG . LEU A 0 27 . 11.890 -1.580 -4.862 1.00 79.68 27 A 1 ATOM 207 C CD1 . LEU A 0 27 . 12.831 -1.045 -3.782 1.00 79.68 27 A 1 ATOM 208 C CD2 . LEU A 0 27 . 11.194 -0.363 -5.465 1.00 79.68 27 A 1 ATOM 209 N N . ARG A 0 28 . 11.639 -5.460 -5.535 1.00 82.38 28 A 1 ATOM 210 C CA . ARG A 0 28 . 10.682 -6.441 -5.031 1.00 82.38 28 A 1 ATOM 211 C C . ARG A 0 28 . 11.334 -7.407 -4.062 1.00 82.38 28 A 1 ATOM 212 C CB . ARG A 0 28 . 10.017 -7.142 -6.215 1.00 82.38 28 A 1 ATOM 213 O O . ARG A 0 28 . 10.881 -7.486 -2.925 1.00 82.38 28 A 1 ATOM 214 C CG . ARG A 0 28 . 9.168 -8.356 -5.833 1.00 82.38 28 A 1 ATOM 215 C CD . ARG A 0 28 . 8.400 -8.799 -7.069 1.00 82.38 28 A 1 ATOM 216 N NE . ARG A 0 28 . 7.323 -9.735 -6.721 1.00 82.38 28 A 1 ATOM 217 N NH1 . ARG A 0 28 . 6.441 -9.879 -8.824 1.00 82.38 28 A 1 ATOM 218 N NH2 . ARG A 0 28 . 5.533 -11.028 -7.128 1.00 82.38 28 A 1 ATOM 219 C CZ . ARG A 0 28 . 6.432 -10.202 -7.560 1.00 82.38 28 A 1 ATOM 220 N N . GLU A 0 29 . 12.407 -8.075 -4.457 1.00 83.13 29 A 1 ATOM 221 C CA . GLU A 0 29 . 13.134 -9.021 -3.609 1.00 83.13 29 A 1 ATOM 222 C C . GLU A 0 29 . 13.626 -8.354 -2.320 1.00 83.13 29 A 1 ATOM 223 C CB . GLU A 0 29 . 14.322 -9.594 -4.397 1.00 83.13 29 A 1 ATOM 224 O O . GLU A 0 29 . 13.467 -8.899 -1.221 1.00 83.13 29 A 1 ATOM 225 C CG . GLU A 0 29 . 13.894 -10.654 -5.424 1.00 83.13 29 A 1 ATOM 226 C CD . GLU A 0 29 . 13.338 -11.906 -4.733 1.00 83.13 29 A 1 ATOM 227 O OE1 . GLU A 0 29 . 12.133 -12.196 -4.909 1.00 83.13 29 A 1 ATOM 228 O OE2 . GLU A 0 29 . 14.104 -12.542 -3.969 1.00 83.13 29 A 1 ATOM 229 N N . TYR A 0 30 . 14.143 -7.125 -2.417 1.00 81.09 30 A 1 ATOM 230 C CA . TYR A 0 30 . 14.532 -6.358 -1.240 1.00 81.09 30 A 1 ATOM 231 C C . TYR A 0 30 . 13.351 -6.101 -0.301 1.00 81.09 30 A 1 ATOM 232 C CB . TYR A 0 30 . 15.160 -5.033 -1.662 1.00 81.09 30 A 1 ATOM 233 O O . TYR A 0 30 . 13.460 -6.313 0.909 1.00 81.09 30 A 1 ATOM 234 C CG . TYR A 0 30 . 15.590 -4.196 -0.472 1.00 81.09 30 A 1 ATOM 235 C CD1 . TYR A 0 30 . 14.721 -3.229 0.074 1.00 81.09 30 A 1 ATOM 236 C CD2 . TYR A 0 30 . 16.897 -4.334 0.030 1.00 81.09 30 A 1 ATOM 237 C CE1 . TYR A 0 30 . 15.154 -2.412 1.136 1.00 81.09 30 A 1 ATOM 238 C CE2 . TYR A 0 30 . 17.346 -3.498 1.066 1.00 81.09 30 A 1 ATOM 239 O OH . TYR A 0 30 . 16.926 -1.739 2.619 1.00 81.09 30 A 1 ATOM 240 C CZ . TYR A 0 30 . 16.474 -2.537 1.617 1.00 81.09 30 A 1 ATOM 241 N N . LEU A 0 31 . 12.212 -5.649 -0.829 1.00 75.98 31 A 1 ATOM 242 C CA . LEU A 0 31 . 11.040 -5.338 -0.017 1.00 75.98 31 A 1 ATOM 243 C C . LEU A 0 31 . 10.385 -6.601 0.566 1.00 75.98 31 A 1 ATOM 244 C CB . LEU A 0 31 . 10.054 -4.497 -0.836 1.00 75.98 31 A 1 ATOM 245 O O . LEU A 0 31 . 9.993 -6.570 1.733 1.00 75.98 31 A 1 ATOM 246 C CG . LEU A 0 31 . 10.482 -3.047 -1.128 1.00 75.98 31 A 1 ATOM 247 C CD1 . LEU A 0 31 . 9.434 -2.384 -2.025 1.00 75.98 31 A 1 ATOM 248 C CD2 . LEU A 0 31 . 10.596 -2.204 0.146 1.00 75.98 31 A 1 ATOM 249 N N . ILE A 0 32 . 10.346 -7.719 -0.167 1.00 77.25 32 A 1 ATOM 250 C CA . ILE A 0 32 . 9.914 -9.028 0.358 1.00 77.25 32 A 1 ATOM 251 C C . ILE A 0 32 . 10.802 -9.418 1.541 1.00 77.25 32 A 1 ATOM 252 C CB . ILE A 0 32 . 9.964 -10.124 -0.739 1.00 77.25 32 A 1 ATOM 253 O O . ILE A 0 32 . 10.308 -9.783 2.608 1.00 77.25 32 A 1 ATOM 254 C CG1 . ILE A 0 32 . 8.903 -9.875 -1.827 1.00 77.25 32 A 1 ATOM 255 C CG2 . ILE A 0 32 . 9.746 -11.528 -0.138 1.00 77.25 32 A 1 ATOM 256 C CD1 . ILE A 0 32 . 9.023 -10.787 -3.050 1.00 77.25 32 A 1 ATOM 257 N N . LYS A 0 33 . 12.124 -9.267 1.397 1.00 77.90 33 A 1 ATOM 258 C CA . LYS A 0 33 . 13.098 -9.549 2.462 1.00 77.90 33 A 1 ATOM 259 C C . LYS A 0 33 . 12.949 -8.624 3.674 1.00 77.90 33 A 1 ATOM 260 C CB . LYS A 0 33 . 14.494 -9.466 1.839 1.00 77.90 33 A 1 ATOM 261 O O . LYS A 0 33 . 13.334 -8.998 4.780 1.00 77.90 33 A 1 ATOM 262 C CG . LYS A 0 33 . 15.610 -9.892 2.798 1.00 77.90 33 A 1 ATOM 263 C CD . LYS A 0 33 . 16.938 -9.835 2.045 1.00 77.90 33 A 1 ATOM 264 C CE . LYS A 0 33 . 18.097 -10.281 2.935 1.00 77.90 33 A 1 ATOM 265 N NZ . LYS A 0 33 . 19.362 -10.241 2.161 1.00 77.90 33 A 1 ATOM 266 N N . LYS A 0 34 . 12.394 -7.425 3.488 1.00 71.10 34 A 1 ATOM 267 C CA . LYS A 0 34 . 12.015 -6.493 4.565 1.00 71.10 34 A 1 ATOM 268 C C . LYS A 0 34 . 10.602 -6.745 5.111 1.00 71.10 34 A 1 ATOM 269 C CB . LYS A 0 34 . 12.199 -5.045 4.085 1.00 71.10 34 A 1 ATOM 270 O O . LYS A 0 34 . 10.085 -5.898 5.834 1.00 71.10 34 A 1 ATOM 271 C CG . LYS A 0 34 . 13.636 -4.627 3.772 1.00 71.10 34 A 1 ATOM 272 C CD . LYS A 0 34 . 14.575 -4.681 4.976 1.00 71.10 34 A 1 ATOM 273 C CE . LYS A 0 34 . 15.918 -4.146 4.481 1.00 71.10 34 A 1 ATOM 274 N NZ . LYS A 0 34 . 16.962 -4.187 5.528 1.00 71.10 34 A 1 ATOM 275 N N . GLU A 0 35 . 10.007 -7.892 4.782 1.00 69.20 35 A 1 ATOM 276 C CA . GLU A 0 35 . 8.678 -8.328 5.223 1.00 69.20 35 A 1 ATOM 277 C C . GLU A 0 35 . 7.541 -7.405 4.753 1.00 69.20 35 A 1 ATOM 278 C CB . GLU A 0 35 . 8.651 -8.611 6.739 1.00 69.20 35 A 1 ATOM 279 O O . GLU A 0 35 . 6.478 -7.330 5.374 1.00 69.20 35 A 1 ATOM 280 C CG . GLU A 0 35 . 9.716 -9.617 7.202 1.00 69.20 35 A 1 ATOM 281 C CD . GLU A 0 35 . 9.634 -9.837 8.720 1.00 69.20 35 A 1 ATOM 282 O OE1 . GLU A 0 35 . 9.293 -10.968 9.136 1.00 69.20 35 A 1 ATOM 283 O OE2 . GLU A 0 35 . 9.919 -8.872 9.469 1.00 69.20 35 A 1 ATOM 284 N N . PHE A 0 36 . 7.736 -6.700 3.633 1.00 66.73 36 A 1 ATOM 285 C CA . PHE A 0 36 . 6.632 -6.025 2.958 1.00 66.73 36 A 1 ATOM 286 C C . PHE A 0 36 . 5.851 -7.019 2.093 1.00 66.73 36 A 1 ATOM 287 C CB . PHE A 0 36 . 7.113 -4.823 2.145 1.00 66.73 36 A 1 ATOM 288 O O . PHE A 0 36 . 6.419 -7.888 1.437 1.00 66.73 36 A 1 ATOM 289 C CG . PHE A 0 36 . 7.655 -3.677 2.979 1.00 66.73 36 A 1 ATOM 290 C CD1 . PHE A 0 36 . 6.786 -2.708 3.513 1.00 66.73 36 A 1 ATOM 291 C CD2 . PHE A 0 36 . 9.033 -3.572 3.217 1.00 66.73 36 A 1 ATOM 292 C CE1 . PHE A 0 36 . 7.297 -1.649 4.286 1.00 66.73 36 A 1 ATOM 293 C CE2 . PHE A 0 36 . 9.549 -2.518 3.990 1.00 66.73 36 A 1 ATOM 294 C CZ . PHE A 0 36 . 8.679 -1.557 4.531 1.00 66.73 36 A 1 ATOM 295 N N . GLY A 0 37 . 4.525 -6.876 2.079 1.00 65.39 37 A 1 ATOM 296 C CA . GLY A 0 37 . 3.646 -7.717 1.268 1.00 65.39 37 A 1 ATOM 297 C C . GLY A 0 37 . 3.647 -7.331 -0.213 1.00 65.39 37 A 1 ATOM 298 O O . GLY A 0 37 . 3.777 -6.160 -0.563 1.00 65.39 37 A 1 ATOM 299 N N . GLU A 0 38 . 3.405 -8.309 -1.083 1.00 71.07 38 A 1 ATOM 300 C CA . GLU A 0 38 . 3.398 -8.172 -2.550 1.00 71.07 38 A 1 ATOM 301 C C . GLU A 0 38 . 2.537 -7.020 -3.091 1.00 71.07 38 A 1 ATOM 302 C CB . GLU A 0 38 . 2.882 -9.501 -3.127 1.00 71.07 38 A 1 ATOM 303 O O . GLU A 0 38 . 2.942 -6.282 -3.993 1.00 71.07 38 A 1 ATOM 304 C CG . GLU A 0 38 . 3.990 -10.561 -3.157 1.00 71.07 38 A 1 ATOM 305 C CD . GLU A 0 38 . 5.066 -10.226 -4.195 1.00 71.07 38 A 1 ATOM 306 O OE1 . GLU A 0 38 . 6.009 -11.020 -4.363 1.00 71.07 38 A 1 ATOM 307 O OE2 . GLU A 0 38 . 4.913 -9.237 -4.938 1.00 71.07 38 A 1 ATOM 308 N N . CYS A 0 39 . 1.363 -6.797 -2.500 1.00 66.17 39 A 1 ATOM 309 C CA . CYS A 0 39 . 0.491 -5.690 -2.887 1.00 66.17 39 A 1 ATOM 310 C C . CYS A 0 39 . 1.133 -4.315 -2.623 1.00 66.17 39 A 1 ATOM 311 C CB . CYS A 0 39 . -0.837 -5.827 -2.135 1.00 66.17 39 A 1 ATOM 312 O O . CYS A 0 39 . 0.974 -3.401 -3.436 1.00 66.17 39 A 1 ATOM 313 S SG . CYS A 0 39 . -1.765 -7.252 -2.759 1.00 66.17 39 A 1 ATOM 314 N N . PHE A 0 40 . 1.876 -4.160 -1.517 1.00 66.37 40 A 1 ATOM 315 C CA . PHE A 0 40 . 2.630 -2.934 -1.240 1.00 66.37 40 A 1 ATOM 316 C C . PHE A 0 40 . 3.729 -2.748 -2.270 1.00 66.37 40 A 1 ATOM 317 C CB . PHE A 0 40 . 3.266 -2.959 0.157 1.00 66.37 40 A 1 ATOM 318 O O . PHE A 0 40 . 3.851 -1.668 -2.835 1.00 66.37 40 A 1 ATOM 319 C CG . PHE A 0 40 . 4.184 -1.783 0.429 1.00 66.37 40 A 1 ATOM 320 C CD1 . PHE A 0 40 . 5.582 -1.933 0.358 1.00 66.37 40 A 1 ATOM 321 C CD2 . PHE A 0 40 . 3.638 -0.522 0.718 1.00 66.37 40 A 1 ATOM 322 C CE1 . PHE A 0 40 . 6.425 -0.846 0.645 1.00 66.37 40 A 1 ATOM 323 C CE2 . PHE A 0 40 . 4.478 0.566 1.013 1.00 66.37 40 A 1 ATOM 324 C CZ . PHE A 0 40 . 5.874 0.399 0.990 1.00 66.37 40 A 1 ATOM 325 N N . ILE A 0 41 . 4.490 -3.806 -2.532 1.00 72.70 41 A 1 ATOM 326 C CA . ILE A 0 41 . 5.630 -3.786 -3.445 1.00 72.70 41 A 1 ATOM 327 C C . ILE A 0 41 . 5.190 -3.377 -4.841 1.00 72.70 41 A 1 ATOM 328 C CB . ILE A 0 41 . 6.287 -5.170 -3.459 1.00 72.70 41 A 1 ATOM 329 O O . ILE A 0 41 . 5.711 -2.413 -5.391 1.00 72.70 41 A 1 ATOM 330 C CG1 . ILE A 0 41 . 6.821 -5.461 -2.045 1.00 72.70 41 A 1 ATOM 331 C CG2 . ILE A 0 41 . 7.390 -5.204 -4.521 1.00 72.70 41 A 1 ATOM 332 C CD1 . ILE A 0 41 . 7.446 -6.839 -1.902 1.00 72.70 41 A 1 ATOM 333 N N . THR A 0 42 . 4.160 -4.037 -5.365 1.00 74.38 42 A 1 ATOM 334 C CA . THR A 0 42 . 3.582 -3.728 -6.677 1.00 74.38 42 A 1 ATOM 335 C C . THR A 0 42 . 3.171 -2.257 -6.774 1.00 74.38 42 A 1 ATOM 336 C CB . THR A 0 42 . 2.351 -4.614 -6.918 1.00 74.38 42 A 1 ATOM 337 O O . THR A 0 42 . 3.361 -1.604 -7.803 1.00 74.38 42 A 1 ATOM 338 C CG2 . THR A 0 42 . 1.725 -4.373 -8.292 1.00 74.38 42 A 1 ATOM 339 O OG1 . THR A 0 42 . 2.697 -5.977 -6.875 1.00 74.38 42 A 1 ATOM 340 N N . ARG A 0 43 . 2.610 -1.697 -5.696 1.00 69.26 43 A 1 ATOM 341 C CA . ARG A 0 43 . 2.198 -0.290 -5.665 1.00 69.26 43 A 1 ATOM 342 C C . ARG A 0 43 . 3.378 0.664 -5.492 1.00 69.26 43 A 1 ATOM 343 C CB . ARG A 0 43 . 1.141 -0.109 -4.567 1.00 69.26 43 A 1 ATOM 344 O O . ARG A 0 43 . 3.360 1.756 -6.060 1.00 69.26 43 A 1 ATOM 345 C CG . ARG A 0 43 . 0.426 1.249 -4.629 1.00 69.26 43 A 1 ATOM 346 C CD . ARG A 0 43 . -0.258 1.475 -5.988 1.00 69.26 43 A 1 ATOM 347 N NE . ARG A 0 43 . -1.218 2.590 -5.934 1.00 69.26 43 A 1 ATOM 348 N NH1 . ARG A 0 43 . -2.733 1.838 -7.497 1.00 69.26 43 A 1 ATOM 349 N NH2 . ARG A 0 43 . -3.275 3.540 -6.209 1.00 69.26 43 A 1 ATOM 350 C CZ . ARG A 0 43 . -2.383 2.665 -6.558 1.00 69.26 43 A 1 ATOM 351 N N . PHE A 0 44 . 4.379 0.262 -4.721 1.00 71.89 44 A 1 ATOM 352 C CA . PHE A 0 44 . 5.595 1.022 -4.488 1.00 71.89 44 A 1 ATOM 353 C C . PHE A 0 44 . 6.386 1.145 -5.789 1.00 71.89 44 A 1 ATOM 354 C CB . PHE A 0 44 . 6.394 0.368 -3.356 1.00 71.89 44 A 1 ATOM 355 O O . PHE A 0 44 . 6.639 2.265 -6.213 1.00 71.89 44 A 1 ATOM 356 C CG . PHE A 0 44 . 7.401 1.299 -2.727 1.00 71.89 44 A 1 ATOM 357 C CD1 . PHE A 0 44 . 8.744 1.261 -3.132 1.00 71.89 44 A 1 ATOM 358 C CD2 . PHE A 0 44 . 6.992 2.194 -1.721 1.00 71.89 44 A 1 ATOM 359 C CE1 . PHE A 0 44 . 9.690 2.088 -2.504 1.00 71.89 44 A 1 ATOM 360 C CE2 . PHE A 0 44 . 7.935 3.026 -1.095 1.00 71.89 44 A 1 ATOM 361 C CZ . PHE A 0 44 . 9.286 2.954 -1.475 1.00 71.89 44 A 1 ATOM 362 N N . LEU A 0 45 . 6.621 0.030 -6.487 1.00 75.50 45 A 1 ATOM 363 C CA . LEU A 0 45 . 7.233 -0.026 -7.818 1.00 75.50 45 A 1 ATOM 364 C C . LEU A 0 45 . 6.590 0.966 -8.788 1.00 75.50 45 A 1 ATOM 365 C CB . LEU A 0 45 . 7.101 -1.465 -8.351 1.00 75.50 45 A 1 ATOM 366 O O . LEU A 0 45 . 7.257 1.859 -9.297 1.00 75.50 45 A 1 ATOM 367 C CG . LEU A 0 45 . 8.089 -2.450 -7.709 1.00 75.50 45 A 1 ATOM 368 C CD1 . LEU A 0 45 . 7.745 -3.875 -8.139 1.00 75.50 45 A 1 ATOM 369 C CD2 . LEU A 0 45 . 9.497 -2.146 -8.181 1.00 75.50 45 A 1 ATOM 370 N N . ARG A 0 46 . 5.258 0.919 -8.912 1.00 74.47 46 A 1 ATOM 371 C CA . ARG A 0 46 . 4.482 1.854 -9.748 1.00 74.47 46 A 1 ATOM 372 C C . ARG A 0 46 . 4.615 3.332 -9.374 1.00 74.47 46 A 1 ATOM 373 C CB . ARG A 0 46 . 3.000 1.474 -9.675 1.00 74.47 46 A 1 ATOM 374 O O . ARG A 0 46 . 4.208 4.187 -10.153 1.00 74.47 46 A 1 ATOM 375 C CG . ARG A 0 46 . 2.669 0.291 -10.581 1.00 74.47 46 A 1 ATOM 376 C CD . ARG A 0 46 . 1.163 0.040 -10.507 1.00 74.47 46 A 1 ATOM 377 N NE . ARG A 0 46 . 0.728 -0.893 -11.559 1.00 74.47 46 A 1 ATOM 378 N NH1 . ARG A 0 46 . -1.385 -0.049 -11.903 1.00 74.47 46 A 1 ATOM 379 N NH2 . ARG A 0 46 . -0.689 -1.816 -13.074 1.00 74.47 46 A 1 ATOM 380 C CZ . ARG A 0 46 . -0.441 -0.911 -12.172 1.00 74.47 46 A 1 ATOM 381 N N . THR A 0 47 . 5.061 3.643 -8.161 1.00 70.14 47 A 1 ATOM 382 C CA . THR A 0 47 . 5.215 5.029 -7.699 1.00 70.14 47 A 1 ATOM 383 C C . THR A 0 47 . 6.572 5.616 -8.086 1.00 70.14 47 A 1 ATOM 384 C CB . THR A 0 47 . 5.010 5.119 -6.182 1.00 70.14 47 A 1 ATOM 385 O O . THR A 0 47 . 6.668 6.833 -8.265 1.00 70.14 47 A 1 ATOM 386 C CG2 . THR A 0 47 . 4.983 6.567 -5.701 1.00 70.14 47 A 1 ATOM 387 O OG1 . THR A 0 47 . 3.768 4.555 -5.805 1.00 70.14 47 A 1 ATOM 388 N N . PHE A 0 48 . 7.600 4.769 -8.193 1.00 71.10 48 A 1 ATOM 389 C CA . PHE A 0 48 . 8.953 5.151 -8.607 1.00 71.10 48 A 1 ATOM 390 C C . PHE A 0 48 . 9.078 5.171 -10.118 1.00 71.10 48 A 1 ATOM 391 C CB . PHE A 0 48 . 9.984 4.198 -7.986 1.00 71.10 48 A 1 ATOM 392 O O . PHE A 0 48 . 9.473 6.195 -10.670 1.00 71.10 48 A 1 ATOM 393 C CG . PHE A 0 48 . 10.171 4.532 -6.537 1.00 71.10 48 A 1 ATOM 394 C CD1 . PHE A 0 48 . 10.988 5.618 -6.195 1.00 71.10 48 A 1 ATOM 395 C CD2 . PHE A 0 48 . 9.321 3.949 -5.589 1.00 71.10 48 A 1 ATOM 396 C CE1 . PHE A 0 48 . 10.805 6.240 -4.959 1.00 71.10 48 A 1 ATOM 397 C CE2 . PHE A 0 48 . 9.049 4.635 -4.406 1.00 71.10 48 A 1 ATOM 398 C CZ . PHE A 0 48 . 9.710 5.844 -4.177 1.00 71.10 48 A 1 ATOM 399 N N . ASP A 0 49 . 8.643 4.082 -10.745 1.00 77.06 49 A 1 ATOM 400 C CA . ASP A 0 49 . 8.669 3.851 -12.184 1.00 77.06 49 A 1 ATOM 401 C C . ASP A 0 49 . 7.603 4.715 -12.885 1.00 77.06 49 A 1 ATOM 402 C CB . ASP A 0 49 . 8.502 2.339 -12.390 1.00 77.06 49 A 1 ATOM 403 O O . ASP A 0 49 . 6.484 4.292 -13.204 1.00 77.06 49 A 1 ATOM 404 C CG . ASP A 0 49 . 8.565 1.938 -13.855 1.00 77.06 49 A 1 ATOM 405 O OD1 . ASP A 0 49 . 8.987 2.772 -14.672 1.00 77.06 49 A 1 ATOM 406 O OD2 . ASP A 0 49 . 8.039 0.852 -14.187 1.00 77.06 49 A 1 ATOM 407 N N . SER A 0 50 . 7.911 6.008 -13.009 1.00 70.38 50 A 1 ATOM 408 C CA . SER A 0 50 . 6.989 7.020 -13.532 1.00 70.38 50 A 1 ATOM 409 C C . SER A 0 50 . 6.894 6.942 -15.051 1.00 70.38 50 A 1 ATOM 410 C CB . SER A 0 50 . 7.445 8.421 -13.116 1.00 70.38 50 A 1 ATOM 411 O O . SER A 0 50 . 5.830 7.227 -15.613 1.00 70.38 50 A 1 ATOM 412 O OG . SER A 0 50 . 7.392 8.562 -11.705 1.00 70.38 50 A 1 ATOM 413 N N . ASN A 0 51 . 7.990 6.561 -15.709 1.00 78.64 51 A 1 ATOM 414 C CA . ASN A 0 51 . 8.043 6.336 -17.149 1.00 78.64 51 A 1 ATOM 415 C C . ASN A 0 51 . 7.528 4.933 -17.552 1.00 78.64 51 A 1 ATOM 416 C CB . ASN A 0 51 . 9.470 6.660 -17.640 1.00 78.64 51 A 1 ATOM 417 O O . ASN A 0 51 . 7.183 4.747 -18.721 1.00 78.64 51 A 1 ATOM 418 C CG . ASN A 0 51 . 10.501 5.648 -17.176 1.00 78.64 51 A 1 ATOM 419 N ND2 . ASN A 0 51 . 11.732 5.768 -17.598 1.00 78.64 51 A 1 ATOM 420 O OD1 . ASN A 0 51 . 10.164 4.707 -16.499 1.00 78.64 51 A 1 ATOM 421 N N . ARG A 0 52 . 7.352 4.012 -16.590 1.00 71.57 52 A 1 ATOM 422 C CA . ARG A 0 52 . 6.866 2.633 -16.772 1.00 71.57 52 A 1 ATOM 423 C C . ARG A 0 52 . 7.783 1.782 -17.637 1.00 71.57 52 A 1 ATOM 424 C CB . ARG A 0 52 . 5.406 2.570 -17.200 1.00 71.57 52 A 1 ATOM 425 O O . ARG A 0 52 . 7.290 0.948 -18.404 1.00 71.57 52 A 1 ATOM 426 C CG . ARG A 0 52 . 4.496 3.288 -16.211 1.00 71.57 52 A 1 ATOM 427 C CD . ARG A 0 52 . 3.074 3.052 -16.702 1.00 71.57 52 A 1 ATOM 428 N NE . ARG A 0 52 . 2.104 3.783 -15.879 1.00 71.57 52 A 1 ATOM 429 N NH1 . ARG A 0 52 . 0.247 3.061 -17.000 1.00 71.57 52 A 1 ATOM 430 N NH2 . ARG A 0 52 . 0.036 4.516 -15.310 1.00 71.57 52 A 1 ATOM 431 C CZ . ARG A 0 52 . 0.802 3.783 -16.064 1.00 71.57 52 A 1 ATOM 432 N N . ASP A 0 53 . 9.085 2.021 -17.564 1.00 82.87 53 A 1 ATOM 433 C CA . ASP A 0 53 . 10.069 1.216 -18.283 1.00 82.87 53 A 1 ATOM 434 C C . ASP A 0 53 . 10.514 -0.027 -17.491 1.00 82.87 53 A 1 ATOM 435 C CB . ASP A 0 53 . 11.216 2.099 -18.798 1.00 82.87 53 A 1 ATOM 436 O O . ASP A 0 53 . 11.197 -0.890 -18.045 1.00 82.87 53 A 1 ATOM 437 C CG . ASP A 0 53 . 12.186 2.600 -17.729 1.00 82.87 53 A 1 ATOM 438 O OD1 . ASP A 0 53 . 12.047 2.176 -16.571 1.00 82.87 53 A 1 ATOM 439 O OD2 . ASP A 0 53 . 13.082 3.390 -18.111 1.00 82.87 53 A 1 ATOM 440 N N . GLY A 0 54 . 10.050 -0.172 -16.244 1.00 76.92 54 A 1 ATOM 441 C CA . GLY A 0 54 . 10.385 -1.284 -15.357 1.00 76.92 54 A 1 ATOM 442 C C . GLY A 0 54 . 11.715 -1.112 -14.621 1.00 76.92 54 A 1 ATOM 443 O O . GLY A 0 54 . 12.095 -2.000 -13.855 1.00 76.92 54 A 1 ATOM 444 N N . MET A 0 55 . 12.395 0.015 -14.819 1.00 82.01 55 A 1 ATOM 445 C CA . MET A 0 55 . 13.645 0.383 -14.172 1.00 82.01 55 A 1 ATOM 446 C C . MET A 0 55 . 13.423 1.621 -13.309 1.00 82.01 55 A 1 ATOM 447 C CB . MET A 0 55 . 14.729 0.650 -15.226 1.00 82.01 55 A 1 ATOM 448 O O . MET A 0 55 . 12.682 2.533 -13.649 1.00 82.01 55 A 1 ATOM 449 C CG . MET A 0 55 . 15.062 -0.574 -16.084 1.00 82.01 55 A 1 ATOM 450 S SD . MET A 0 55 . 15.820 -1.916 -15.139 1.00 82.01 55 A 1 ATOM 451 C CE . MET A 0 55 . 16.573 -2.897 -16.457 1.00 82.01 55 A 1 ATOM 452 N N . ILE A 0 56 . 14.077 1.666 -12.156 1.00 81.54 56 A 1 ATOM 453 C CA . ILE A 0 56 . 14.065 2.833 -11.281 1.00 81.54 56 A 1 ATOM 454 C C . ILE A 0 56 . 15.452 3.437 -11.346 1.00 81.54 56 A 1 ATOM 455 C CB . ILE A 0 56 . 13.599 2.472 -9.861 1.00 81.54 56 A 1 ATOM 456 O O . ILE A 0 56 . 16.391 2.997 -10.676 1.00 81.54 56 A 1 ATOM 457 C CG1 . ILE A 0 56 . 12.169 1.887 -9.916 1.00 81.54 56 A 1 ATOM 458 C CG2 . ILE A 0 56 . 13.648 3.736 -8.977 1.00 81.54 56 A 1 ATOM 459 C CD1 . ILE A 0 56 . 11.750 1.201 -8.619 1.00 81.54 56 A 1 ATOM 460 N N . THR A 0 57 . 15.580 4.467 -12.171 1.00 82.45 57 A 1 ATOM 461 C CA . THR A 0 57 . 16.820 5.236 -12.253 1.00 82.45 57 A 1 ATOM 462 C C . THR A 0 57 . 17.087 5.966 -10.937 1.00 82.45 57 A 1 ATOM 463 C CB . THR A 0 57 . 16.780 6.231 -13.416 1.00 82.45 57 A 1 ATOM 464 O O . THR A 0 57 . 16.173 6.267 -10.164 1.00 82.45 57 A 1 ATOM 465 C CG2 . THR A 0 57 . 16.601 5.539 -14.766 1.00 82.45 57 A 1 ATOM 466 O OG1 . THR A 0 57 . 15.724 7.143 -13.233 1.00 82.45 57 A 1 ATOM 467 N N . PHE A 0 58 . 18.348 6.314 -10.674 1.00 78.88 58 A 1 ATOM 468 C CA . PHE A 0 58 . 18.695 7.109 -9.493 1.00 78.88 58 A 1 ATOM 469 C C . PHE A 0 58 . 17.913 8.437 -9.426 1.00 78.88 58 A 1 ATOM 470 C CB . PHE A 0 58 . 20.205 7.363 -9.500 1.00 78.88 58 A 1 ATOM 471 O O . PHE A 0 58 . 17.520 8.878 -8.348 1.00 78.88 58 A 1 ATOM 472 C CG . PHE A 0 58 . 20.692 8.110 -8.276 1.00 78.88 58 A 1 ATOM 473 C CD1 . PHE A 0 58 . 21.080 9.459 -8.372 1.00 78.88 58 A 1 ATOM 474 C CD2 . PHE A 0 58 . 20.747 7.453 -7.033 1.00 78.88 58 A 1 ATOM 475 C CE1 . PHE A 0 58 . 21.548 10.137 -7.234 1.00 78.88 58 A 1 ATOM 476 C CE2 . PHE A 0 58 . 21.193 8.140 -5.890 1.00 78.88 58 A 1 ATOM 477 C CZ . PHE A 0 58 . 21.598 9.483 -5.991 1.00 78.88 58 A 1 ATOM 478 N N . GLU A 0 59 . 17.621 9.048 -10.573 1.00 80.49 59 A 1 ATOM 479 C CA . GLU A 0 59 . 16.864 10.301 -10.681 1.00 80.49 59 A 1 ATOM 480 C C . GLU A 0 59 . 15.383 10.116 -10.308 1.00 80.49 59 A 1 ATOM 481 C CB . GLU A 0 59 . 17.004 10.820 -12.119 1.00 80.49 59 A 1 ATOM 482 O O . GLU A 0 59 . 14.807 10.930 -9.572 1.00 80.49 59 A 1 ATOM 483 C CG . GLU A 0 59 . 18.447 11.284 -12.407 1.00 80.49 59 A 1 ATOM 484 C CD . GLU A 0 59 . 18.824 11.328 -13.896 1.00 80.49 59 A 1 ATOM 485 O OE1 . GLU A 0 59 . 19.966 11.765 -14.169 1.00 80.49 59 A 1 ATOM 486 O OE2 . GLU A 0 59 . 17.992 10.951 -14.748 1.00 80.49 59 A 1 ATOM 487 N N . GLU A 0 60 . 14.766 9.018 -10.749 1.00 79.30 60 A 1 ATOM 488 C CA . GLU A 0 60 . 13.414 8.628 -10.334 1.00 79.30 60 A 1 ATOM 489 C C . GLU A 0 60 . 13.366 8.254 -8.860 1.00 79.30 60 A 1 ATOM 490 C CB . GLU A 0 60 . 12.933 7.436 -11.153 1.00 79.30 60 A 1 ATOM 491 O O . GLU A 0 60 . 12.442 8.663 -8.151 1.00 79.30 60 A 1 ATOM 492 C CG . GLU A 0 60 . 12.576 7.887 -12.568 1.00 79.30 60 A 1 ATOM 493 C CD . GLU A 0 60 . 12.339 6.679 -13.461 1.00 79.30 60 A 1 ATOM 494 O OE1 . GLU A 0 60 . 11.252 6.678 -14.090 1.00 79.30 60 A 1 ATOM 495 O OE2 . GLU A 0 60 . 13.278 5.846 -13.481 1.00 79.30 60 A 1 ATOM 496 N N . TYR A 0 61 . 14.389 7.552 -8.372 1.00 75.99 61 A 1 ATOM 497 C CA . TYR A 0 61 . 14.539 7.249 -6.959 1.00 75.99 61 A 1 ATOM 498 C C . TYR A 0 61 . 14.610 8.535 -6.136 1.00 75.99 61 A 1 ATOM 499 C CB . TYR A 0 61 . 15.742 6.334 -6.725 1.00 75.99 61 A 1 ATOM 500 O O . TYR A 0 61 . 13.796 8.715 -5.236 1.00 75.99 61 A 1 ATOM 501 C CG . TYR A 0 61 . 15.830 5.860 -5.290 1.00 75.99 61 A 1 ATOM 502 C CD1 . TYR A 0 61 . 16.869 6.315 -4.460 1.00 75.99 61 A 1 ATOM 503 C CD2 . TYR A 0 61 . 14.875 4.955 -4.789 1.00 75.99 61 A 1 ATOM 504 C CE1 . TYR A 0 61 . 16.941 5.880 -3.123 1.00 75.99 61 A 1 ATOM 505 C CE2 . TYR A 0 61 . 14.941 4.525 -3.450 1.00 75.99 61 A 1 ATOM 506 O OH . TYR A 0 61 . 16.062 4.549 -1.330 1.00 75.99 61 A 1 ATOM 507 C CZ . TYR A 0 61 . 15.976 4.988 -2.614 1.00 75.99 61 A 1 ATOM 508 N N . GLN A 0 62 . 15.477 9.490 -6.480 1.00 76.11 62 A 1 ATOM 509 C CA . GLN A 0 62 . 15.577 10.781 -5.787 1.00 76.11 62 A 1 ATOM 510 C C . GLN A 0 62 . 14.265 11.576 -5.825 1.00 76.11 62 A 1 ATOM 511 C CB . GLN A 0 62 . 16.706 11.614 -6.405 1.00 76.11 62 A 1 ATOM 512 O O . GLN A 0 62 . 13.815 12.095 -4.799 1.00 76.11 62 A 1 ATOM 513 C CG . GLN A 0 62 . 18.096 11.123 -5.979 1.00 76.11 62 A 1 ATOM 514 C CD . GLN A 0 62 . 19.177 12.072 -6.481 1.00 76.11 62 A 1 ATOM 515 N NE2 . GLN A 0 62 . 20.001 12.605 -5.606 1.00 76.11 62 A 1 ATOM 516 O OE1 . GLN A 0 62 . 19.283 12.405 -7.647 1.00 76.11 62 A 1 ATOM 517 N N . THR A 0 63 . 13.604 11.627 -6.983 1.00 74.28 63 A 1 ATOM 518 C CA . THR A 0 63 . 12.319 12.330 -7.140 1.00 74.28 63 A 1 ATOM 519 C C . THR A 0 63 . 11.207 11.655 -6.335 1.00 74.28 63 A 1 ATOM 520 C CB . THR A 0 63 . 11.926 12.390 -8.622 1.00 74.28 63 A 1 ATOM 521 O O . THR A 0 63 . 10.341 12.311 -5.744 1.00 74.28 63 A 1 ATOM 522 C CG2 . THR A 0 63 . 10.649 13.204 -8.844 1.00 74.28 63 A 1 ATOM 523 O OG1 . THR A 0 63 . 12.938 13.033 -9.355 1.00 74.28 63 A 1 ATOM 524 N N . GLY A 0 64 . 11.220 10.326 -6.293 1.00 69.69 64 A 1 ATOM 525 C CA . GLY A 0 64 . 10.268 9.520 -5.554 1.00 69.69 64 A 1 ATOM 526 C C . GLY A 0 64 . 10.570 9.449 -4.056 1.00 69.69 64 A 1 ATOM 527 O O . GLY A 0 64 . 9.631 9.301 -3.285 1.00 69.69 64 A 1 ATOM 528 N N . ILE A 0 65 . 11.816 9.618 -3.597 1.00 68.49 65 A 1 ATOM 529 C CA . ILE A 0 65 . 12.226 9.520 -2.180 1.00 68.49 65 A 1 ATOM 530 C C . ILE A 0 65 . 11.445 10.490 -1.298 1.00 68.49 65 A 1 ATOM 531 C CB . ILE A 0 65 . 13.747 9.749 -2.026 1.00 68.49 65 A 1 ATOM 532 O O . ILE A 0 65 . 10.956 10.117 -0.225 1.00 68.49 65 A 1 ATOM 533 C CG1 . ILE A 0 65 . 14.560 8.457 -2.224 1.00 68.49 65 A 1 ATOM 534 C CG2 . ILE A 0 65 . 14.105 10.306 -0.630 1.00 68.49 65 A 1 ATOM 535 C CD1 . ILE A 0 65 . 16.026 8.796 -2.534 1.00 68.49 65 A 1 ATOM 536 N N . HIS A 0 66 . 11.275 11.733 -1.745 1.00 66.07 66 A 1 ATOM 537 C CA . HIS A 0 66 . 10.466 12.694 -0.999 1.00 66.07 66 A 1 ATOM 538 C C . HIS A 0 66 . 9.012 12.216 -0.886 1.00 66.07 66 A 1 ATOM 539 C CB . HIS A 0 66 . 10.587 14.077 -1.640 1.00 66.07 66 A 1 ATOM 540 O O . HIS A 0 66 . 8.378 12.392 0.157 1.00 66.07 66 A 1 ATOM 541 C CG . HIS A 0 66 . 11.958 14.672 -1.444 1.00 66.07 66 A 1 ATOM 542 C CD2 . HIS A 0 66 . 12.899 14.903 -2.412 1.00 66.07 66 A 1 ATOM 543 N ND1 . HIS A 0 66 . 12.516 15.050 -0.240 1.00 66.07 66 A 1 ATOM 544 C CE1 . HIS A 0 66 . 13.761 15.495 -0.477 1.00 66.07 66 A 1 ATOM 545 N NE2 . HIS A 0 66 . 14.025 15.446 -1.789 1.00 66.07 66 A 1 ATOM 546 N N . LYS A 0 67 . 8.511 11.499 -1.901 1.00 66.61 67 A 1 ATOM 547 C CA . LYS A 0 67 . 7.229 10.789 -1.838 1.00 66.61 67 A 1 ATOM 548 C C . LYS A 0 67 . 7.313 9.578 -0.894 1.00 66.61 67 A 1 ATOM 549 C CB . LYS A 0 67 . 6.709 10.410 -3.243 1.00 66.61 67 A 1 ATOM 550 O O . LYS A 0 67 . 6.371 9.398 -0.127 1.00 66.61 67 A 1 ATOM 551 C CG . LYS A 0 67 . 6.783 11.541 -4.292 1.00 66.61 67 A 1 ATOM 552 C CD . LYS A 0 67 . 6.325 11.036 -5.670 1.00 66.61 67 A 1 ATOM 553 C CE . LYS A 0 67 . 6.550 12.090 -6.765 1.00 66.61 67 A 1 ATOM 554 N NZ . LYS A 0 67 . 6.364 11.507 -8.124 1.00 66.61 67 A 1 ATOM 555 N N . ILE A 0 68 . 8.422 8.815 -0.843 1.00 61.80 68 A 1 ATOM 556 C CA . ILE A 0 68 . 8.640 7.692 0.105 1.00 61.80 68 A 1 ATOM 557 C C . ILE A 0 68 . 8.457 8.158 1.527 1.00 61.80 68 A 1 ATOM 558 C CB . ILE A 0 68 . 10.038 7.007 0.084 1.00 61.80 68 A 1 ATOM 559 O O . ILE A 0 68 . 7.763 7.490 2.272 1.00 61.80 68 A 1 ATOM 560 C CG1 . ILE A 0 68 . 10.357 6.453 -1.290 1.00 61.80 68 A 1 ATOM 561 C CG2 . ILE A 0 68 . 10.111 5.846 1.103 1.00 61.80 68 A 1 ATOM 562 C CD1 . ILE A 0 68 . 11.737 5.809 -1.485 1.00 61.80 68 A 1 ATOM 563 N N . SER A 0 69 . 9.070 9.263 1.947 1.00 61.98 69 A 1 ATOM 564 C CA . SER A 0 69 . 8.984 9.673 3.357 1.00 61.98 69 A 1 ATOM 565 C C . SER A 0 69 . 7.529 9.851 3.800 1.00 61.98 69 A 1 ATOM 566 C CB . SER A 0 69 . 9.785 10.951 3.590 1.00 61.98 69 A 1 ATOM 567 O O . SER A 0 69 . 7.122 9.360 4.859 1.00 61.98 69 A 1 ATOM 568 O OG . SER A 0 69 . 11.156 10.620 3.647 1.00 61.98 69 A 1 ATOM 569 N N . HIS A 0 70 . 6.708 10.458 2.942 1.00 65.39 70 A 1 ATOM 570 C CA . HIS A 0 70 . 5.271 10.559 3.169 1.00 65.39 70 A 1 ATOM 571 C C . HIS A 0 70 . 4.565 9.205 3.045 1.00 65.39 70 A 1 ATOM 572 C CB . HIS A 0 70 . 4.681 11.609 2.224 1.00 65.39 70 A 1 ATOM 573 O O . HIS A 0 70 . 3.751 8.879 3.907 1.00 65.39 70 A 1 ATOM 574 C CG . HIS A 0 70 . 5.147 12.998 2.572 1.00 65.39 70 A 1 ATOM 575 C CD2 . HIS A 0 70 . 5.967 13.804 1.828 1.00 65.39 70 A 1 ATOM 576 N ND1 . HIS A 0 70 . 4.841 13.686 3.726 1.00 65.39 70 A 1 ATOM 577 C CE1 . HIS A 0 70 . 5.464 14.875 3.680 1.00 65.39 70 A 1 ATOM 578 N NE2 . HIS A 0 70 . 6.159 14.990 2.543 1.00 65.39 70 A 1 ATOM 579 N N . LEU A 0 71 . 4.894 8.391 2.040 1.00 58.52 71 A 1 ATOM 580 C CA . LEU A 0 71 . 4.296 7.073 1.812 1.00 58.52 71 A 1 ATOM 581 C C . LEU A 0 71 . 4.618 6.084 2.922 1.00 58.52 71 A 1 ATOM 582 C CB . LEU A 0 71 . 4.769 6.502 0.469 1.00 58.52 71 A 1 ATOM 583 O O . LEU A 0 71 . 3.722 5.393 3.365 1.00 58.52 71 A 1 ATOM 584 C CG . LEU A 0 71 . 4.152 7.217 -0.739 1.00 58.52 71 A 1 ATOM 585 C CD1 . LEU A 0 71 . 4.935 6.871 -1.997 1.00 58.52 71 A 1 ATOM 586 C CD2 . LEU A 0 71 . 2.685 6.832 -0.942 1.00 58.52 71 A 1 ATOM 587 N N . ARG A 0 72 . 5.845 6.051 3.434 1.00 61.82 72 A 1 ATOM 588 C CA . ARG A 0 72 . 6.290 5.228 4.557 1.00 61.82 72 A 1 ATOM 589 C C . ARG A 0 72 . 5.576 5.641 5.832 1.00 61.82 72 A 1 ATOM 590 C CB . ARG A 0 72 . 7.818 5.333 4.693 1.00 61.82 72 A 1 ATOM 591 O O . ARG A 0 72 . 5.123 4.770 6.562 1.00 61.82 72 A 1 ATOM 592 C CG . ARG A 0 72 . 8.343 4.506 5.876 1.00 61.82 72 A 1 ATOM 593 C CD . ARG A 0 72 . 9.864 4.628 6.017 1.00 61.82 72 A 1 ATOM 594 N NE . ARG A 0 72 . 10.268 4.494 7.430 1.00 61.82 72 A 1 ATOM 595 N NH1 . ARG A 0 72 . 12.539 4.429 7.102 1.00 61.82 72 A 1 ATOM 596 N NH2 . ARG A 0 72 . 11.721 4.450 9.178 1.00 61.82 72 A 1 ATOM 597 C CZ . ARG A 0 72 . 11.504 4.458 7.893 1.00 61.82 72 A 1 ATOM 598 N N . LYS A 0 73 . 5.429 6.943 6.108 1.00 64.47 73 A 1 ATOM 599 C CA . LYS A 0 73 . 4.642 7.409 7.264 1.00 64.47 73 A 1 ATOM 600 C C . LYS A 0 73 . 3.164 7.038 7.112 1.00 64.47 73 A 1 ATOM 601 C CB . LYS A 0 73 . 4.853 8.918 7.464 1.00 64.47 73 A 1 ATOM 602 O O . LYS A 0 73 . 2.562 6.532 8.057 1.00 64.47 73 A 1 ATOM 603 C CG . LYS A 0 73 . 4.216 9.406 8.777 1.00 64.47 73 A 1 ATOM 604 C CD . LYS A 0 73 . 4.506 10.893 9.028 1.00 64.47 73 A 1 ATOM 605 C CE . LYS A 0 73 . 3.886 11.330 10.364 1.00 64.47 73 A 1 ATOM 606 N NZ . LYS A 0 73 . 4.129 12.768 10.654 1.00 64.47 73 A 1 ATOM 607 N N . LYS A 0 74 . 2.600 7.240 5.917 1.00 62.45 74 A 1 ATOM 608 C CA . LYS A 0 74 . 1.220 6.874 5.565 1.00 62.45 74 A 1 ATOM 609 C C . LYS A 0 74 . 1.006 5.361 5.680 1.00 62.45 74 A 1 ATOM 610 C CB . LYS A 0 74 . 0.919 7.420 4.155 1.00 62.45 74 A 1 ATOM 611 O O . LYS A 0 74 . 0.015 4.942 6.262 1.00 62.45 74 A 1 ATOM 612 C CG . LYS A 0 74 . -0.573 7.546 3.830 1.00 62.45 74 A 1 ATOM 613 C CD . LYS A 0 74 . -0.779 8.172 2.437 1.00 62.45 74 A 1 ATOM 614 C CE . LYS A 0 74 . -2.212 8.693 2.260 1.00 62.45 74 A 1 ATOM 615 N NZ . LYS A 0 74 . -2.452 9.339 0.939 1.00 62.45 74 A 1 ATOM 616 N N . TYR A 0 75 . 1.977 4.573 5.226 1.00 62.91 75 A 1 ATOM 617 C CA . TYR A 0 75 . 2.002 3.115 5.257 1.00 62.91 75 A 1 ATOM 618 C C . TYR A 0 75 . 2.170 2.570 6.670 1.00 62.91 75 A 1 ATOM 619 C CB . TYR A 0 75 . 3.127 2.560 4.382 1.00 62.91 75 A 1 ATOM 620 O O . TYR A 0 75 . 1.487 1.635 7.051 1.00 62.91 75 A 1 ATOM 621 C CG . TYR A 0 75 . 3.042 1.055 4.291 1.00 62.91 75 A 1 ATOM 622 C CD1 . TYR A 0 75 . 3.809 0.222 5.131 1.00 62.91 75 A 1 ATOM 623 C CD2 . TYR A 0 75 . 2.111 0.495 3.404 1.00 62.91 75 A 1 ATOM 624 C CE1 . TYR A 0 75 . 3.654 -1.178 5.067 1.00 62.91 75 A 1 ATOM 625 C CE2 . TYR A 0 75 . 1.962 -0.896 3.336 1.00 62.91 75 A 1 ATOM 626 O OH . TYR A 0 75 . 2.567 -3.090 4.094 1.00 62.91 75 A 1 ATOM 627 C CZ . TYR A 0 75 . 2.732 -1.742 4.159 1.00 62.91 75 A 1 ATOM 628 N N . PHE A 0 76 . 3.049 3.160 7.478 1.00 65.42 76 A 1 ATOM 629 C CA . PHE A 0 76 . 3.209 2.769 8.873 1.00 65.42 76 A 1 ATOM 630 C C . PHE A 0 76 . 1.912 3.018 9.644 1.00 65.42 76 A 1 ATOM 631 C CB . PHE A 0 76 . 4.387 3.533 9.479 1.00 65.42 76 A 1 ATOM 632 O O . PHE A 0 76 . 1.394 2.109 10.287 1.00 65.42 76 A 1 ATOM 633 C CG . PHE A 0 76 . 4.655 3.157 10.919 1.00 65.42 76 A 1 ATOM 634 C CD1 . PHE A 0 76 . 4.164 3.957 11.968 1.00 65.42 76 A 1 ATOM 635 C CD2 . PHE A 0 76 . 5.378 1.985 11.207 1.00 65.42 76 A 1 ATOM 636 C CE1 . PHE A 0 76 . 4.425 3.601 13.302 1.00 65.42 76 A 1 ATOM 637 C CE2 . PHE A 0 76 . 5.639 1.631 12.540 1.00 65.42 76 A 1 ATOM 638 C CZ . PHE A 0 76 . 5.176 2.447 13.586 1.00 65.42 76 A 1 ATOM 639 N N . ASN A 0 77 . 1.332 4.217 9.506 1.00 63.70 77 A 1 ATOM 640 C CA . ASN A 0 77 . 0.017 4.513 10.074 1.00 63.70 77 A 1 ATOM 641 C C . ASN A 0 77 . -1.039 3.521 9.560 1.00 63.70 77 A 1 ATOM 642 C CB . ASN A 0 77 . -0.344 5.972 9.753 1.00 63.70 77 A 1 ATOM 643 O O . ASN A 0 77 . -1.848 3.030 10.333 1.00 63.70 77 A 1 ATOM 644 C CG . ASN A 0 77 . -1.558 6.447 10.536 1.00 63.70 77 A 1 ATOM 645 N ND2 . ASN A 0 77 . -2.576 6.944 9.877 1.00 63.70 77 A 1 ATOM 646 O OD1 . ASN A 0 77 . -1.593 6.417 11.755 1.00 63.70 77 A 1 ATOM 647 N N . TYR A 0 78 . -0.977 3.154 8.282 1.00 66.32 78 A 1 ATOM 648 C CA . TYR A 0 78 . -1.845 2.162 7.658 1.00 66.32 78 A 1 ATOM 649 C C . TYR A 0 78 . -1.682 0.739 8.194 1.00 66.32 78 A 1 ATOM 650 C CB . TYR A 0 78 . -1.607 2.201 6.161 1.00 66.32 78 A 1 ATOM 651 O O . TYR A 0 78 . -2.684 0.113 8.502 1.00 66.32 78 A 1 ATOM 652 C CG . TYR A 0 78 . -1.979 0.946 5.420 1.00 66.32 78 A 1 ATOM 653 C CD1 . TYR A 0 78 . -0.997 -0.020 5.116 1.00 66.32 78 A 1 ATOM 654 C CD2 . TYR A 0 78 . -3.316 0.762 5.037 1.00 66.32 78 A 1 ATOM 655 C CE1 . TYR A 0 78 . -1.350 -1.136 4.341 1.00 66.32 78 A 1 ATOM 656 C CE2 . TYR A 0 78 . -3.657 -0.342 4.247 1.00 66.32 78 A 1 ATOM 657 O OH . TYR A 0 78 . -2.996 -2.202 2.974 1.00 66.32 78 A 1 ATOM 658 C CZ . TYR A 0 78 . -2.669 -1.251 3.863 1.00 66.32 78 A 1 ATOM 659 N N . TYR A 0 79 . -0.462 0.227 8.350 1.00 65.64 79 A 1 ATOM 660 C CA . TYR A 0 79 . -0.224 -1.104 8.904 1.00 65.64 79 A 1 ATOM 661 C C . TYR A 0 79 . -0.796 -1.192 10.322 1.00 65.64 79 A 1 ATOM 662 C CB . TYR A 0 79 . 1.281 -1.397 8.887 1.00 65.64 79 A 1 ATOM 663 O O . TYR A 0 79 . -1.410 -2.188 10.699 1.00 65.64 79 A 1 ATOM 664 C CG . TYR A 0 79 . 1.636 -2.731 9.514 1.00 65.64 79 A 1 ATOM 665 C CD1 . TYR A 0 79 . 2.248 -2.779 10.783 1.00 65.64 79 A 1 ATOM 666 C CD2 . TYR A 0 79 . 1.325 -3.926 8.838 1.00 65.64 79 A 1 ATOM 667 C CE1 . TYR A 0 79 . 2.576 -4.020 11.360 1.00 65.64 79 A 1 ATOM 668 C CE2 . TYR A 0 79 . 1.621 -5.170 9.428 1.00 65.64 79 A 1 ATOM 669 O OH . TYR A 0 79 . 2.584 -6.416 11.237 1.00 65.64 79 A 1 ATOM 670 C CZ . TYR A 0 79 . 2.258 -5.218 10.683 1.00 65.64 79 A 1 ATOM 671 N N . HIS A 0 80 . -0.684 -0.102 11.085 1.00 68.00 80 A 1 ATOM 672 C CA . HIS A 0 80 . -1.343 0.025 12.379 1.00 68.00 80 A 1 ATOM 673 C C . HIS A 0 80 . -2.871 0.099 12.277 1.00 68.00 80 A 1 ATOM 674 C CB . HIS A 0 80 . -0.765 1.236 13.117 1.00 68.00 80 A 1 ATOM 675 O O . HIS A 0 80 . -3.547 -0.515 13.096 1.00 68.00 80 A 1 ATOM 676 C CG . HIS A 0 80 . 0.574 0.920 13.721 1.00 68.00 80 A 1 ATOM 677 C CD2 . HIS A 0 80 . 1.801 1.384 13.335 1.00 68.00 80 A 1 ATOM 678 N ND1 . HIS A 0 80 . 0.777 0.069 14.781 1.00 68.00 80 A 1 ATOM 679 C CE1 . HIS A 0 80 . 2.094 0.017 15.028 1.00 68.00 80 A 1 ATOM 680 N NE2 . HIS A 0 80 . 2.755 0.796 14.169 1.00 68.00 80 A 1 ATOM 681 N N . ILE A 0 81 . -3.413 0.817 11.292 1.00 68.69 81 A 1 ATOM 682 C CA . ILE A 0 81 . -4.854 0.914 11.029 1.00 68.69 81 A 1 ATOM 683 C C . ILE A 0 81 . -5.432 -0.451 10.660 1.00 68.69 81 A 1 ATOM 684 C CB . ILE A 0 81 . -5.122 1.977 9.936 1.00 68.69 81 A 1 ATOM 685 O O . ILE A 0 81 . -6.368 -0.895 11.312 1.00 68.69 81 A 1 ATOM 686 C CG1 . ILE A 0 81 . -4.972 3.388 10.535 1.00 68.69 81 A 1 ATOM 687 C CG2 . ILE A 0 81 . -6.467 1.798 9.203 1.00 68.69 81 A 1 ATOM 688 C CD1 . ILE A 0 81 . -4.891 4.530 9.520 1.00 68.69 81 A 1 ATOM 689 N N . LEU A 0 82 . -4.845 -1.139 9.681 1.00 69.03 82 A 1 ATOM 690 C CA . LEU A 0 82 . -5.261 -2.474 9.265 1.00 69.03 82 A 1 ATOM 691 C C . LEU A 0 82 . -5.224 -3.446 10.430 1.00 69.03 82 A 1 ATOM 692 C CB . LEU A 0 82 . -4.327 -3.030 8.189 1.00 69.03 82 A 1 ATOM 693 O O . LEU A 0 82 . -6.209 -4.112 10.690 1.00 69.03 82 A 1 ATOM 694 C CG . LEU A 0 82 . -4.450 -2.456 6.775 1.00 69.03 82 A 1 ATOM 695 C CD1 . LEU A 0 82 . -3.642 -3.389 5.880 1.00 69.03 82 A 1 ATOM 696 C CD2 . LEU A 0 82 . -5.877 -2.405 6.247 1.00 69.03 82 A 1 ATOM 697 N N . LYS A 0 83 . -4.119 -3.485 11.180 1.00 72.39 83 A 1 ATOM 698 C CA . LYS A 0 83 . -3.981 -4.396 12.320 1.00 72.39 83 A 1 ATOM 699 C C . LYS A 0 83 . -4.985 -4.111 13.441 1.00 72.39 83 A 1 ATOM 700 C CB . LYS A 0 83 . -2.531 -4.320 12.803 1.00 72.39 83 A 1 ATOM 701 O O . LYS A 0 83 . -5.264 -5.001 14.239 1.00 72.39 83 A 1 ATOM 702 C CG . LYS A 0 83 . -2.218 -5.373 13.868 1.00 72.39 83 A 1 ATOM 703 C CD . LYS A 0 83 . -0.728 -5.345 14.203 1.00 72.39 83 A 1 ATOM 704 C CE . LYS A 0 83 . -0.437 -6.429 15.241 1.00 72.39 83 A 1 ATOM 705 N NZ . LYS A 0 83 . 1.013 -6.494 15.541 1.00 72.39 83 A 1 ATOM 706 N N . LYS A 0 84 . -5.479 -2.873 13.544 1.00 74.19 84 A 1 ATOM 707 C CA . LYS A 0 84 . -6.572 -2.516 14.456 1.00 74.19 84 A 1 ATOM 708 C C . LYS A 0 84 . -7.933 -2.937 13.886 1.00 74.19 84 A 1 ATOM 709 C CB . LYS A 0 84 . -6.551 -1.009 14.774 1.00 74.19 84 A 1 ATOM 710 O O . LYS A 0 84 . -8.753 -3.426 14.651 1.00 74.19 84 A 1 ATOM 711 C CG . LYS A 0 84 . -5.469 -0.570 15.782 1.00 74.19 84 A 1 ATOM 712 C CD . LYS A 0 84 . -5.589 0.948 16.026 1.00 74.19 84 A 1 ATOM 713 C CE . LYS A 0 84 . -4.565 1.521 17.021 1.00 74.19 84 A 1 ATOM 714 N NZ . LYS A 0 84 . -4.856 2.954 17.344 1.00 74.19 84 A 1 ATOM 715 N N . LEU A 0 85 . -8.161 -2.713 12.589 1.00 78.47 85 A 1 ATOM 716 C CA . LEU A 0 85 . -9.429 -2.962 11.893 1.00 78.47 85 A 1 ATOM 717 C C . LEU A 0 85 . -9.694 -4.452 11.653 1.00 78.47 85 A 1 ATOM 718 C CB . LEU A 0 85 . -9.454 -2.179 10.562 1.00 78.47 85 A 1 ATOM 719 O O . LEU A 0 85 . -10.733 -4.940 12.071 1.00 78.47 85 A 1 ATOM 720 C CG . LEU A 0 85 . -9.603 -0.651 10.684 1.00 78.47 85 A 1 ATOM 721 C CD1 . LEU A 0 85 . -9.574 -0.001 9.300 1.00 78.47 85 A 1 ATOM 722 C CD2 . LEU A 0 85 . -10.931 -0.264 11.315 1.00 78.47 85 A 1 ATOM 723 N N . ASP A 0 86 . -8.762 -5.148 11.009 1.00 79.88 86 A 1 ATOM 724 C CA . ASP A 0 86 . -8.835 -6.570 10.658 1.00 79.88 86 A 1 ATOM 725 C C . ASP A 0 86 . -8.625 -7.425 11.921 1.00 79.88 86 A 1 ATOM 726 C CB . ASP A 0 86 . -7.811 -6.838 9.538 1.00 79.88 86 A 1 ATOM 727 O O . ASP A 0 86 . -7.513 -7.864 12.252 1.00 79.88 86 A 1 ATOM 728 C CG . ASP A 0 86 . -7.820 -8.276 9.017 1.00 79.88 86 A 1 ATOM 729 O OD1 . ASP A 0 86 . -8.701 -9.055 9.414 1.00 79.88 86 A 1 ATOM 730 O OD2 . ASP A 0 86 . -6.876 -8.641 8.275 1.00 79.88 86 A 1 ATOM 731 N N . LYS A 0 87 . -9.700 -7.562 12.706 1.00 75.85 87 A 1 ATOM 732 C CA . LYS A 0 87 . -9.685 -8.234 14.014 1.00 75.85 87 A 1 ATOM 733 C C . LYS A 0 87 . -9.545 -9.741 13.851 1.00 75.85 87 A 1 ATOM 734 C CB . LYS A 0 87 . -10.970 -7.921 14.796 1.00 75.85 87 A 1 ATOM 735 O O . LYS A 0 87 . -8.885 -10.382 14.677 1.00 75.85 87 A 1 ATOM 736 C CG . LYS A 0 87 . -11.007 -6.512 15.406 1.00 75.85 87 A 1 ATOM 737 C CD . LYS A 0 87 . -12.274 -6.369 16.262 1.00 75.85 87 A 1 ATOM 738 C CE . LYS A 0 87 . -12.334 -5.027 16.995 1.00 75.85 87 A 1 ATOM 739 N NZ . LYS A 0 87 . -13.481 -4.999 17.937 1.00 75.85 87 A 1 ATOM 740 N N . ASP A 0 88 . -10.178 -10.301 12.824 1.00 81.64 88 A 1 ATOM 741 C CA . ASP A 0 88 . -10.147 -11.735 12.543 1.00 81.64 88 A 1 ATOM 742 C C . ASP A 0 88 . -8.927 -12.161 11.703 1.00 81.64 88 A 1 ATOM 743 C CB . ASP A 0 88 . -11.506 -12.193 11.987 1.00 81.64 88 A 1 ATOM 744 O O . ASP A 0 88 . -8.616 -13.354 11.645 1.00 81.64 88 A 1 ATOM 745 C CG . ASP A 0 88 . -11.778 -11.810 10.534 1.00 81.64 88 A 1 ATOM 746 O OD1 . ASP A 0 88 . -10.901 -11.183 9.919 1.00 81.64 88 A 1 ATOM 747 O OD2 . ASP A 0 88 . -12.817 -12.271 10.006 1.00 81.64 88 A 1 ATOM 748 N N . LYS A 0 89 . -8.168 -11.191 11.171 1.00 75.26 89 A 1 ATOM 749 C CA . LYS A 0 89 . -6.944 -11.370 10.374 1.00 75.26 89 A 1 ATOM 750 C C . LYS A 0 89 . -7.200 -12.116 9.071 1.00 75.26 89 A 1 ATOM 751 C CB . LYS A 0 89 . -5.800 -11.962 11.196 1.00 75.26 89 A 1 ATOM 752 O O . LYS A 0 89 . -6.340 -12.881 8.620 1.00 75.26 89 A 1 ATOM 753 C CG . LYS A 0 89 . -5.495 -11.135 12.443 1.00 75.26 89 A 1 ATOM 754 C CD . LYS A 0 89 . -4.386 -11.846 13.209 1.00 75.26 89 A 1 ATOM 755 C CE . LYS A 0 89 . -4.133 -11.096 14.509 1.00 75.26 89 A 1 ATOM 756 N NZ . LYS A 0 89 . -3.220 -11.882 15.366 1.00 75.26 89 A 1 ATOM 757 N N . ASN A 0 90 . -8.378 -11.934 8.484 1.00 81.43 90 A 1 ATOM 758 C CA . ASN A 0 90 . -8.745 -12.574 7.226 1.00 81.43 90 A 1 ATOM 759 C C . ASN A 0 90 . -8.259 -11.786 5.990 1.00 81.43 90 A 1 ATOM 760 C CB . ASN A 0 90 . -10.254 -12.887 7.255 1.00 81.43 90 A 1 ATOM 761 O O . ASN A 0 90 . -8.367 -12.296 4.872 1.00 81.43 90 A 1 ATOM 762 C CG . ASN A 0 90 . -11.141 -11.667 7.074 1.00 81.43 90 A 1 ATOM 763 N ND2 . ASN A 0 90 . -12.412 -11.736 7.354 1.00 81.43 90 A 1 ATOM 764 O OD1 . ASN A 0 90 . -10.742 -10.647 6.567 1.00 81.43 90 A 1 ATOM 765 N N . GLY A 0 91 . -7.705 -10.579 6.175 1.00 75.33 91 A 1 ATOM 766 C CA . GLY A 0 91 . -7.209 -9.711 5.103 1.00 75.33 91 A 1 ATOM 767 C C . GLY A 0 91 . -8.265 -8.803 4.464 1.00 75.33 91 A 1 ATOM 768 O O . GLY A 0 91 . -7.967 -8.123 3.478 1.00 75.33 91 A 1 ATOM 769 N N . TYR A 0 92 . -9.475 -8.776 5.015 1.00 83.76 92 A 1 ATOM 770 C CA . TYR A 0 92 . -10.588 -7.942 4.592 1.00 83.76 92 A 1 ATOM 771 C C . TYR A 0 92 . -11.091 -7.101 5.760 1.00 83.76 92 A 1 ATOM 772 C CB . TYR A 0 92 . -11.741 -8.786 4.044 1.00 83.76 92 A 1 ATOM 773 O O . TYR A 0 92 . -11.054 -7.512 6.910 1.00 83.76 92 A 1 ATOM 774 C CG . TYR A 0 92 . -11.393 -9.714 2.898 1.00 83.76 92 A 1 ATOM 775 C CD1 . TYR A 0 92 . -11.566 -9.288 1.568 1.00 83.76 92 A 1 ATOM 776 C CD2 . TYR A 0 92 . -10.911 -11.010 3.160 1.00 83.76 92 A 1 ATOM 777 C CE1 . TYR A 0 92 . -11.246 -10.152 0.504 1.00 83.76 92 A 1 ATOM 778 C CE2 . TYR A 0 92 . -10.554 -11.863 2.101 1.00 83.76 92 A 1 ATOM 779 O OH . TYR A 0 92 . -10.364 -12.252 -0.253 1.00 83.76 92 A 1 ATOM 780 C CZ . TYR A 0 92 . -10.708 -11.428 0.768 1.00 83.76 92 A 1 ATOM 781 N N . ILE A 0 93 . -11.603 -5.918 5.445 1.00 83.56 93 A 1 ATOM 782 C CA . ILE A 0 93 . -12.191 -5.004 6.413 1.00 83.56 93 A 1 ATOM 783 C C . ILE A 0 93 . -13.670 -4.863 6.099 1.00 83.56 93 A 1 ATOM 784 C CB . ILE A 0 93 . -11.451 -3.658 6.405 1.00 83.56 93 A 1 ATOM 785 O O . ILE A 0 93 . -14.070 -4.308 5.074 1.00 83.56 93 A 1 ATOM 786 C CG1 . ILE A 0 93 . -9.999 -3.844 6.880 1.00 83.56 93 A 1 ATOM 787 C CG2 . ILE A 0 93 . -12.185 -2.670 7.329 1.00 83.56 93 A 1 ATOM 788 C CD1 . ILE A 0 93 . -9.122 -2.619 6.629 1.00 83.56 93 A 1 ATOM 789 N N . THR A 0 94 . -14.497 -5.331 7.016 1.00 85.64 94 A 1 ATOM 790 C CA . THR A 0 94 . -15.952 -5.227 6.938 1.00 85.64 94 A 1 ATOM 791 C C . THR A 0 94 . -16.465 -3.935 7.578 1.00 85.64 94 A 1 ATOM 792 C CB . THR A 0 94 . -16.606 -6.447 7.593 1.00 85.64 94 A 1 ATOM 793 O O . THR A 0 94 . -15.799 -3.297 8.397 1.00 85.64 94 A 1 ATOM 794 C CG2 . THR A 0 94 . -16.144 -7.772 6.986 1.00 85.64 94 A 1 ATOM 795 O OG1 . THR A 0 94 . -16.320 -6.458 8.971 1.00 85.64 94 A 1 ATOM 796 N N . THR A 0 95 . -17.714 -3.547 7.282 1.00 83.71 95 A 1 ATOM 797 C CA . THR A 0 95 . -18.339 -2.400 7.972 1.00 83.71 95 A 1 ATOM 798 C C . THR A 0 95 . -18.419 -2.611 9.482 1.00 83.71 95 A 1 ATOM 799 C CB . THR A 0 95 . -19.771 -2.112 7.494 1.00 83.71 95 A 1 ATOM 800 O O . THR A 0 95 . -18.419 -1.637 10.230 1.00 83.71 95 A 1 ATOM 801 C CG2 . THR A 0 95 . -19.853 -1.596 6.064 1.00 83.71 95 A 1 ATOM 802 O OG1 . THR A 0 95 . -20.585 -3.265 7.563 1.00 83.71 95 A 1 ATOM 803 N N . HIS A 0 96 . -18.527 -3.869 9.923 1.00 84.46 96 A 1 ATOM 804 C CA . HIS A 0 96 . -18.622 -4.215 11.337 1.00 84.46 96 A 1 ATOM 805 C C . HIS A 0 96 . -17.295 -3.957 12.050 1.00 84.46 96 A 1 ATOM 806 C CB . HIS A 0 96 . -19.067 -5.675 11.472 1.00 84.46 96 A 1 ATOM 807 O O . HIS A 0 96 . -17.282 -3.313 13.088 1.00 84.46 96 A 1 ATOM 808 C CG . HIS A 0 96 . -19.569 -5.999 12.854 1.00 84.46 96 A 1 ATOM 809 C CD2 . HIS A 0 96 . -18.958 -6.784 13.796 1.00 84.46 96 A 1 ATOM 810 N ND1 . HIS A 0 96 . -20.752 -5.555 13.401 1.00 84.46 96 A 1 ATOM 811 C CE1 . HIS A 0 96 . -20.852 -6.063 14.639 1.00 84.46 96 A 1 ATOM 812 N NE2 . HIS A 0 96 . -19.805 -6.848 14.909 1.00 84.46 96 A 1 ATOM 813 N N . GLU A 0 97 . -16.180 -4.344 11.438 1.00 85.38 97 A 1 ATOM 814 C CA . GLU A 0 97 . -14.835 -4.092 11.962 1.00 85.38 97 A 1 ATOM 815 C C . GLU A 0 97 . -14.491 -2.605 12.042 1.00 85.38 97 A 1 ATOM 816 C CB . GLU A 0 97 . -13.851 -4.796 11.041 1.00 85.38 97 A 1 ATOM 817 O O . GLU A 0 97 . -13.956 -2.137 13.049 1.00 85.38 97 A 1 ATOM 818 C CG . GLU A 0 97 . -13.842 -6.291 11.369 1.00 85.38 97 A 1 ATOM 819 C CD . GLU A 0 97 . -13.103 -7.069 10.297 1.00 85.38 97 A 1 ATOM 820 O OE1 . GLU A 0 97 . -12.245 -7.880 10.698 1.00 85.38 97 A 1 ATOM 821 O OE2 . GLU A 0 97 . -13.487 -6.847 9.121 1.00 85.38 97 A 1 ATOM 822 N N . ILE A 0 98 . -14.863 -1.825 11.021 1.00 79.84 98 A 1 ATOM 823 C CA . ILE A 0 98 . -14.698 -0.365 11.073 1.00 79.84 98 A 1 ATOM 824 C C . ILE A 0 98 . -15.545 0.222 12.199 1.00 79.84 98 A 1 ATOM 825 C CB . ILE A 0 98 . -15.016 0.309 9.720 1.00 79.84 98 A 1 ATOM 826 O O . ILE A 0 98 . -15.061 1.056 12.964 1.00 79.84 98 A 1 ATOM 827 C CG1 . ILE A 0 98 . -14.133 -0.252 8.589 1.00 79.84 98 A 1 ATOM 828 C CG2 . ILE A 0 98 . -14.789 1.828 9.846 1.00 79.84 98 A 1 ATOM 829 C CD1 . ILE A 0 98 . -14.543 0.217 7.186 1.00 79.84 98 A 1 ATOM 830 N N . TYR A 0 99 . -16.801 -0.212 12.317 1.00 81.78 99 A 1 ATOM 831 C CA . TYR A 0 99 . -17.695 0.251 13.372 1.00 81.78 99 A 1 ATOM 832 C C . TYR A 0 99 . -17.141 -0.069 14.763 1.00 81.78 99 A 1 ATOM 833 C CB . TYR A 0 99 . -19.076 -0.376 13.176 1.00 81.78 99 A 1 ATOM 834 O O . TYR A 0 99 . -17.114 0.804 15.627 1.00 81.78 99 A 1 ATOM 835 C CG . TYR A 0 99 . -20.079 0.108 14.195 1.00 81.78 99 A 1 ATOM 836 C CD1 . TYR A 0 99 . -20.287 -0.627 15.378 1.00 81.78 99 A 1 ATOM 837 C CD2 . TYR A 0 99 . -20.758 1.323 13.981 1.00 81.78 99 A 1 ATOM 838 C CE1 . TYR A 0 99 . -21.189 -0.152 16.346 1.00 81.78 99 A 1 ATOM 839 C CE2 . TYR A 0 99 . -21.661 1.800 14.948 1.00 81.78 99 A 1 ATOM 840 O OH . TYR A 0 99 . -22.754 1.513 17.064 1.00 81.78 99 A 1 ATOM 841 C CZ . TYR A 0 99 . -21.880 1.060 16.128 1.00 81.78 99 A 1 ATOM 842 N N . ASP A 0 100 . -16.645 -1.284 14.953 1.00 82.53 100 A 1 ATOM 843 C CA . ASP A 0 100 . -16.038 -1.764 16.186 1.00 82.53 100 A 1 ATOM 844 C C . ASP A 0 100 . -14.837 -0.919 16.613 1.00 82.53 100 A 1 ATOM 845 C CB . ASP A 0 100 . -15.582 -3.202 15.942 1.00 82.53 100 A 1 ATOM 846 O O . ASP A 0 100 . -14.759 -0.470 17.756 1.00 82.53 100 A 1 ATOM 847 C CG . ASP A 0 100 . -16.582 -4.260 16.387 1.00 82.53 100 A 1 ATOM 848 O OD1 . ASP A 0 100 . -17.778 -3.936 16.572 1.00 82.53 100 A 1 ATOM 849 O OD2 . ASP A 0 100 . -16.058 -5.367 16.653 1.00 82.53 100 A 1 ATOM 850 N N . VAL A 0 101 . -13.913 -0.641 15.694 1.00 77.83 101 A 1 ATOM 851 C CA . VAL A 0 101 . -12.740 0.180 16.018 1.00 77.83 101 A 1 ATOM 852 C C . VAL A 0 101 . -13.119 1.639 16.238 1.00 77.83 101 A 1 ATOM 853 C CB . VAL A 0 101 . -11.671 0.041 14.935 1.00 77.83 101 A 1 ATOM 854 O O . VAL A 0 101 . -12.559 2.295 17.116 1.00 77.83 101 A 1 ATOM 855 C CG1 . VAL A 0 101 . -10.474 0.972 15.169 1.00 77.83 101 A 1 ATOM 856 C CG2 . VAL A 0 101 . -11.145 -1.394 14.944 1.00 77.83 101 A 1 ATOM 857 N N . LEU A 0 102 . -14.095 2.172 15.499 1.00 72.84 102 A 1 ATOM 858 C CA . LEU A 0 102 . -14.628 3.512 15.762 1.00 72.84 102 A 1 ATOM 859 C C . LEU A 0 102 . -15.324 3.589 17.125 1.00 72.84 102 A 1 ATOM 860 C CB . LEU A 0 102 . -15.603 3.911 14.646 1.00 72.84 102 A 1 ATOM 861 O O . LEU A 0 102 . -15.223 4.615 17.807 1.00 72.84 102 A 1 ATOM 862 C CG . LEU A 0 102 . -14.933 4.238 13.301 1.00 72.84 102 A 1 ATOM 863 C CD1 . LEU A 0 102 . -16.032 4.453 12.265 1.00 72.84 102 A 1 ATOM 864 C CD2 . LEU A 0 102 . -14.091 5.515 13.368 1.00 72.84 102 A 1 ATOM 865 N N . TYR A 0 103 . -15.994 2.513 17.533 1.00 77.05 103 A 1 ATOM 866 C CA . TYR A 0 103 . -16.613 2.377 18.842 1.00 77.05 103 A 1 ATOM 867 C C . TYR A 0 103 . -15.553 2.373 19.950 1.00 77.05 103 A 1 ATOM 868 C CB . TYR A 0 103 . -17.499 1.123 18.857 1.00 77.05 103 A 1 ATOM 869 O O . TYR A 0 103 . -15.648 3.171 20.885 1.00 77.05 103 A 1 ATOM 870 C CG . TYR A 0 103 . -18.277 0.960 20.140 1.00 77.05 103 A 1 ATOM 871 C CD1 . TYR A 0 103 . -17.741 0.201 21.197 1.00 77.05 103 A 1 ATOM 872 C CD2 . TYR A 0 103 . -19.531 1.583 20.274 1.00 77.05 103 A 1 ATOM 873 C CE1 . TYR A 0 103 . -18.457 0.071 22.402 1.00 77.05 103 A 1 ATOM 874 C CE2 . TYR A 0 103 . -20.249 1.458 21.477 1.00 77.05 103 A 1 ATOM 875 O OH . TYR A 0 103 . -20.406 0.594 23.703 1.00 77.05 103 A 1 ATOM 876 C CZ . TYR A 0 103 . -19.711 0.704 22.541 1.00 77.05 103 A 1 ATOM 877 N N . GLU A 0 104 . -14.501 1.566 19.801 1.00 74.25 104 A 1 ATOM 878 C CA . GLU A 0 104 . -13.367 1.486 20.734 1.00 74.25 104 A 1 ATOM 879 C C . GLU A 0 104 . -12.558 2.792 20.801 1.00 74.25 104 A 1 ATOM 880 C CB . GLU A 0 104 . -12.455 0.322 20.318 1.00 74.25 104 A 1 ATOM 881 O O . GLU A 0 104 . -12.130 3.209 21.875 1.00 74.25 104 A 1 ATOM 882 C CG . GLU A 0 104 . -13.083 -1.050 20.616 1.00 74.25 104 A 1 ATOM 883 C CD . GLU A 0 104 . -12.279 -2.225 20.033 1.00 74.25 104 A 1 ATOM 884 O OE1 . GLU A 0 104 . -12.840 -3.347 19.992 1.00 74.25 104 A 1 ATOM 885 O OE2 . GLU A 0 104 . -11.115 -2.024 19.625 1.00 74.25 104 A 1 ATOM 886 N N . SER A 0 105 . -12.404 3.492 19.674 1.00 68.89 105 A 1 ATOM 887 C CA . SER A 0 105 . -11.686 4.772 19.576 1.00 68.89 105 A 1 ATOM 888 C C . SER A 0 105 . -12.473 5.963 20.161 1.00 68.89 105 A 1 ATOM 889 C CB . SER A 0 105 . -11.311 4.995 18.102 1.00 68.89 105 A 1 ATOM 890 O O . SER A 0 105 . -11.957 7.079 20.246 1.00 68.89 105 A 1 ATOM 891 O OG . SER A 0 105 . -10.443 6.098 17.917 1.00 68.89 105 A 1 ATOM 892 N N . GLY A 0 106 . -13.733 5.763 20.569 1.00 67.56 106 A 1 ATOM 893 C CA . GLY A 0 106 . -14.609 6.827 21.078 1.00 67.56 106 A 1 ATOM 894 C C . GLY A 0 106 . -15.215 7.717 19.984 1.00 67.56 106 A 1 ATOM 895 O O . GLY A 0 106 . -15.897 8.696 20.288 1.00 67.56 106 A 1 ATOM 896 N N . ASN A 0 107 . -15.029 7.356 18.712 1.00 63.45 107 A 1 ATOM 897 C CA . ASN A 0 107 . -15.541 8.062 17.535 1.00 63.45 107 A 1 ATOM 898 C C . ASN A 0 107 . -16.927 7.558 17.078 1.00 63.45 107 A 1 ATOM 899 C CB . ASN A 0 107 . -14.479 8.020 16.422 1.00 63.45 107 A 1 ATOM 900 O O . ASN A 0 107 . -17.362 7.834 15.960 1.00 63.45 107 A 1 ATOM 901 C CG . ASN A 0 107 . -13.320 8.963 16.695 1.00 63.45 107 A 1 ATOM 902 N ND2 . ASN A 0 107 . -12.102 8.482 16.653 1.00 63.45 107 A 1 ATOM 903 O OD1 . ASN A 0 107 . -13.499 10.146 16.943 1.00 63.45 107 A 1 ATOM 904 N N . LYS A 0 108 . -17.657 6.864 17.957 1.00 60.82 108 A 1 ATOM 905 C CA . LYS A 0 108 . -18.961 6.232 17.683 1.00 60.82 108 A 1 ATOM 906 C C . LYS A 0 108 . -20.028 7.139 17.050 1.00 60.82 108 A 1 ATOM 907 C CB . LYS A 0 108 . -19.492 5.612 18.987 1.00 60.82 108 A 1 ATOM 908 O O . LYS A 0 108 . -20.923 6.645 16.380 1.00 60.82 108 A 1 ATOM 909 C CG . LYS A 0 108 . -19.804 6.654 20.076 1.00 60.82 108 A 1 ATOM 910 C CD . LYS A 0 108 . -20.382 5.989 21.326 1.00 60.82 108 A 1 ATOM 911 C CE . LYS A 0 108 . -20.785 7.063 22.340 1.00 60.82 108 A 1 ATOM 912 N NZ . LYS A 0 108 . -21.308 6.441 23.581 1.00 60.82 108 A 1 ATOM 913 N N . ASN A 0 109 . -19.957 8.453 17.271 1.00 59.61 109 A 1 ATOM 914 C CA . ASN A 0 109 . -20.979 9.399 16.815 1.00 59.61 109 A 1 ATOM 915 C C . ASN A 0 109 . -20.679 10.015 15.437 1.00 59.61 109 A 1 ATOM 916 C CB . ASN A 0 109 . -21.175 10.484 17.888 1.00 59.61 109 A 1 ATOM 917 O O . ASN A 0 109 . -21.479 10.815 14.959 1.00 59.61 109 A 1 ATOM 918 C CG . ASN A 0 109 . -21.803 9.988 19.179 1.00 59.61 109 A 1 ATOM 919 N ND2 . ASN A 0 109 . -21.677 10.753 20.236 1.00 59.61 109 A 1 ATOM 920 O OD1 . ASN A 0 109 . -22.415 8.940 19.286 1.00 59.61 109 A 1 ATOM 921 N N . TYR A 0 110 . -19.540 9.691 14.815 1.00 64.85 110 A 1 ATOM 922 C CA . TYR A 0 110 . -19.124 10.338 13.565 1.00 64.85 110 A 1 ATOM 923 C C . TYR A 0 110 . -19.574 9.598 12.304 1.00 64.85 110 A 1 ATOM 924 C CB . TYR A 0 110 . -17.609 10.563 13.577 1.00 64.85 110 A 1 ATOM 925 O O . TYR A 0 110 . -19.658 10.221 11.249 1.00 64.85 110 A 1 ATOM 926 C CG . TYR A 0 110 . -17.176 11.599 14.596 1.00 64.85 110 A 1 ATOM 927 C CD1 . TYR A 0 110 . -17.318 12.970 14.312 1.00 64.85 110 A 1 ATOM 928 C CD2 . TYR A 0 110 . -16.643 11.194 15.830 1.00 64.85 110 A 1 ATOM 929 C CE1 . TYR A 0 110 . -16.925 13.930 15.265 1.00 64.85 110 A 1 ATOM 930 C CE2 . TYR A 0 110 . -16.248 12.143 16.788 1.00 64.85 110 A 1 ATOM 931 O OH . TYR A 0 110 . -16.000 14.442 17.419 1.00 64.85 110 A 1 ATOM 932 C CZ . TYR A 0 110 . -16.388 13.518 16.503 1.00 64.85 110 A 1 ATOM 933 N N . PHE A 0 111 . -19.885 8.302 12.403 1.00 70.56 111 A 1 ATOM 934 C CA . PHE A 0 111 . -20.243 7.479 11.249 1.00 70.56 111 A 1 ATOM 935 C C . PHE A 0 111 . -21.440 6.585 11.566 1.00 70.56 111 A 1 ATOM 936 C CB . PHE A 0 111 . -19.024 6.655 10.811 1.00 70.56 111 A 1 ATOM 937 O O . PHE A 0 111 . -21.390 5.757 12.475 1.00 70.56 111 A 1 ATOM 938 C CG . PHE A 0 111 . -17.860 7.492 10.311 1.00 70.56 111 A 1 ATOM 939 C CD1 . PHE A 0 111 . -17.818 7.891 8.962 1.00 70.56 111 A 1 ATOM 940 C CD2 . PHE A 0 111 . -16.834 7.896 11.188 1.00 70.56 111 A 1 ATOM 941 C CE1 . PHE A 0 111 . -16.755 8.682 8.491 1.00 70.56 111 A 1 ATOM 942 C CE2 . PHE A 0 111 . -15.774 8.693 10.718 1.00 70.56 111 A 1 ATOM 943 C CZ . PHE A 0 111 . -15.733 9.084 9.368 1.00 70.56 111 A 1 ATOM 944 N N . SER A 0 112 . -22.522 6.735 10.801 1.00 78.35 112 A 1 ATOM 945 C CA . SER A 0 112 . -23.632 5.784 10.816 1.00 78.35 112 A 1 ATOM 946 C C . SER A 0 112 . -23.276 4.518 10.031 1.00 78.35 112 A 1 ATOM 947 C CB . SER A 0 112 . -24.910 6.438 10.277 1.00 78.35 112 A 1 ATOM 948 O O . SER A 0 112 . -22.377 4.518 9.189 1.00 78.35 112 A 1 ATOM 949 O OG . SER A 0 112 . -24.840 6.649 8.882 1.00 78.35 112 A 1 ATOM 950 N N . SER A 0 113 . -24.032 3.435 10.234 1.00 79.51 113 A 1 ATOM 951 C CA . SER A 0 113 . -23.895 2.218 9.419 1.00 79.51 113 A 1 ATOM 952 C C . SER A 0 113 . -24.039 2.501 7.918 1.00 79.51 113 A 1 ATOM 953 C CB . SER A 0 113 . -24.943 1.186 9.843 1.00 79.51 113 A 1 ATOM 954 O O . SER A 0 113 . -23.345 1.894 7.105 1.00 79.51 113 A 1 ATOM 955 O OG . SER A 0 113 . -26.249 1.736 9.758 1.00 79.51 113 A 1 ATOM 956 N N . LYS A 0 114 . -24.890 3.466 7.547 1.00 83.10 114 A 1 ATOM 957 C CA . LYS A 0 114 . -25.072 3.906 6.161 1.00 83.10 114 A 1 ATOM 958 C C . LYS A 0 114 . -23.841 4.638 5.623 1.00 83.10 114 A 1 ATOM 959 C CB . LYS A 0 114 . -26.337 4.770 6.080 1.00 83.10 114 A 1 ATOM 960 O O . LYS A 0 114 . -23.489 4.431 4.465 1.00 83.10 114 A 1 ATOM 961 C CG . LYS A 0 114 . -26.746 5.039 4.627 1.00 83.10 114 A 1 ATOM 962 C CD . LYS A 0 114 . -28.029 5.873 4.577 1.00 83.10 114 A 1 ATOM 963 C CE . LYS A 0 114 . -28.412 6.123 3.116 1.00 83.10 114 A 1 ATOM 964 N NZ . LYS A 0 114 . -29.628 6.967 3.013 1.00 83.10 114 A 1 ATOM 965 N N . ASP A 0 115 . -23.175 5.443 6.450 1.00 82.71 115 A 1 ATOM 966 C CA . ASP A 0 115 . -21.934 6.127 6.066 1.00 82.71 115 A 1 ATOM 967 C C . ASP A 0 115 . -20.797 5.124 5.850 1.00 82.71 115 A 1 ATOM 968 C CB . ASP A 0 115 . -21.518 7.170 7.115 1.00 82.71 115 A 1 ATOM 969 O O . ASP A 0 115 . -20.066 5.233 4.870 1.00 82.71 115 A 1 ATOM 970 C CG . ASP A 0 115 . -22.591 8.231 7.344 1.00 82.71 115 A 1 ATOM 971 O OD1 . ASP A 0 115 . -23.096 8.795 6.351 1.00 82.71 115 A 1 ATOM 972 O OD2 . ASP A 0 115 . -22.959 8.418 8.528 1.00 82.71 115 A 1 ATOM 973 N N . LEU A 0 116 . -20.690 4.104 6.711 1.00 82.11 116 A 1 ATOM 974 C CA . LEU A 0 116 . -19.694 3.038 6.564 1.00 82.11 116 A 1 ATOM 975 C C . LEU A 0 116 . -19.957 2.160 5.337 1.00 82.11 116 A 1 ATOM 976 C CB . LEU A 0 116 . -19.641 2.182 7.839 1.00 82.11 116 A 1 ATOM 977 O O . LEU A 0 116 . -19.025 1.819 4.618 1.00 82.11 116 A 1 ATOM 978 C CG . LEU A 0 116 . -19.161 2.937 9.091 1.00 82.11 116 A 1 ATOM 979 C CD1 . LEU A 0 116 . -19.099 1.967 10.267 1.00 82.11 116 A 1 ATOM 980 C CD2 . LEU A 0 116 . -17.783 3.565 8.891 1.00 82.11 116 A 1 ATOM 981 N N . GLN A 0 117 . -21.219 1.838 5.046 1.00 84.48 117 A 1 ATOM 982 C CA . GLN A 0 117 . -21.566 1.129 3.811 1.00 84.48 117 A 1 ATOM 983 C C . GLN A 0 117 . -21.251 1.960 2.568 1.00 84.48 117 A 1 ATOM 984 C CB . GLN A 0 117 . -23.052 0.761 3.803 1.00 84.48 117 A 1 ATOM 985 O O . GLN A 0 117 . -20.743 1.420 1.591 1.00 84.48 117 A 1 ATOM 986 C CG . GLN A 0 117 . -23.351 -0.439 4.706 1.00 84.48 117 A 1 ATOM 987 C CD . GLN A 0 117 . -24.834 -0.782 4.738 1.00 84.48 117 A 1 ATOM 988 N NE2 . GLN A 0 117 . -25.271 -1.520 5.732 1.00 84.48 117 A 1 ATOM 989 O OE1 . GLN A 0 117 . -25.624 -0.416 3.880 1.00 84.48 117 A 1 ATOM 990 N N . ALA A 0 118 . -21.537 3.265 2.588 1.00 84.49 118 A 1 ATOM 991 C CA . ALA A 0 118 . -21.184 4.159 1.489 1.00 84.49 118 A 1 ATOM 992 C C . ALA A 0 118 . -19.662 4.283 1.326 1.00 84.49 118 A 1 ATOM 993 C CB . ALA A 0 118 . -21.836 5.523 1.738 1.00 84.49 118 A 1 ATOM 994 O O . ALA A 0 118 . -19.176 4.366 0.202 1.00 84.49 118 A 1 ATOM 995 N N . PHE A 0 119 . -18.922 4.267 2.437 1.00 81.33 119 A 1 ATOM 996 C CA . PHE A 0 119 . -17.467 4.254 2.442 1.00 81.33 119 A 1 ATOM 997 C C . PHE A 0 119 . -16.908 2.989 1.788 1.00 81.33 119 A 1 ATOM 998 C CB . PHE A 0 119 . -16.958 4.422 3.879 1.00 81.33 119 A 1 ATOM 999 O O . PHE A 0 119 . -16.125 3.111 0.851 1.00 81.33 119 A 1 ATOM 1000 C CG . PHE A 0 119 . -15.468 4.222 3.984 1.00 81.33 119 A 1 ATOM 1001 C CD1 . PHE A 0 119 . -14.935 3.023 4.497 1.00 81.33 119 A 1 ATOM 1002 C CD2 . PHE A 0 119 . -14.616 5.201 3.458 1.00 81.33 119 A 1 ATOM 1003 C CE1 . PHE A 0 119 . -13.546 2.807 4.480 1.00 81.33 119 A 1 ATOM 1004 C CE2 . PHE A 0 119 . -13.238 4.971 3.431 1.00 81.33 119 A 1 ATOM 1005 C CZ . PHE A 0 119 . -12.695 3.781 3.937 1.00 81.33 119 A 1 ATOM 1006 N N . ILE A 0 120 . -17.346 1.802 2.222 1.00 84.23 120 A 1 ATOM 1007 C CA . ILE A 0 120 . -16.891 0.540 1.626 1.00 84.23 120 A 1 ATOM 1008 C C . ILE A 0 120 . -17.244 0.498 0.145 1.00 84.23 120 A 1 ATOM 1009 C CB . ILE A 0 120 . -17.410 -0.685 2.407 1.00 84.23 120 A 1 ATOM 1010 O O . ILE A 0 120 . -16.347 0.400 -0.674 1.00 84.23 120 A 1 ATOM 1011 C CG1 . ILE A 0 120 . -16.707 -0.697 3.786 1.00 84.23 120 A 1 ATOM 1012 C CG2 . ILE A 0 120 . -17.187 -1.980 1.605 1.00 84.23 120 A 1 ATOM 1013 C CD1 . ILE A 0 120 . -16.767 -2.019 4.548 1.00 84.23 120 A 1 ATOM 1014 N N . ARG A 0 121 . -18.507 0.733 -0.225 1.00 85.56 121 A 1 ATOM 1015 C CA . ARG A 0 121 . -18.956 0.715 -1.631 1.00 85.56 121 A 1 ATOM 1016 C C . ARG A 0 121 . -18.211 1.672 -2.560 1.00 85.56 121 A 1 ATOM 1017 C CB . ARG A 0 121 . -20.438 1.075 -1.692 1.00 85.56 121 A 1 ATOM 1018 O O . ARG A 0 121 . -18.292 1.520 -3.771 1.00 85.56 121 A 1 ATOM 1019 C CG . ARG A 0 121 . -21.321 -0.062 -1.186 1.00 85.56 121 A 1 ATOM 1020 C CD . ARG A 0 121 . -22.759 0.447 -1.183 1.00 85.56 121 A 1 ATOM 1021 N NE . ARG A 0 121 . -23.677 -0.581 -0.673 1.00 85.56 121 A 1 ATOM 1022 N NH1 . ARG A 0 121 . -25.485 -0.079 -1.995 1.00 85.56 121 A 1 ATOM 1023 N NH2 . ARG A 0 121 . -25.612 -1.749 -0.517 1.00 85.56 121 A 1 ATOM 1024 C CZ . ARG A 0 121 . -24.917 -0.794 -1.062 1.00 85.56 121 A 1 ATOM 1025 N N . LYS A 0 122 . -17.571 2.712 -2.021 1.00 84.09 122 A 1 ATOM 1026 C CA . LYS A 0 122 . -16.777 3.646 -2.822 1.00 84.09 122 A 1 ATOM 1027 C C . LYS A 0 122 . -15.454 3.021 -3.278 1.00 84.09 122 A 1 ATOM 1028 C CB . LYS A 0 122 . -16.561 4.937 -2.018 1.00 84.09 122 A 1 ATOM 1029 O O . LYS A 0 122 . -14.954 3.399 -4.333 1.00 84.09 122 A 1 ATOM 1030 C CG . LYS A 0 122 . -15.864 5.993 -2.879 1.00 84.09 122 A 1 ATOM 1031 C CD . LYS A 0 122 . -15.588 7.298 -2.137 1.00 84.09 122 A 1 ATOM 1032 C CE . LYS A 0 122 . -14.792 8.163 -3.121 1.00 84.09 122 A 1 ATOM 1033 N NZ . LYS A 0 122 . -13.878 9.107 -2.447 1.00 84.09 122 A 1 ATOM 1034 N N . TYR A 0 123 . -14.892 2.131 -2.468 1.00 81.71 123 A 1 ATOM 1035 C CA . TYR A 0 123 . -13.559 1.561 -2.660 1.00 81.71 123 A 1 ATOM 1036 C C . TYR A 0 123 . -13.567 0.069 -2.971 1.00 81.71 123 A 1 ATOM 1037 C CB . TYR A 0 123 . -12.720 1.881 -1.420 1.00 81.71 123 A 1 ATOM 1038 O O . TYR A 0 123 . -12.597 -0.408 -3.537 1.00 81.71 123 A 1 ATOM 1039 C CG . TYR A 0 123 . -12.441 3.358 -1.319 1.00 81.71 123 A 1 ATOM 1040 C CD1 . TYR A 0 123 . -11.571 3.923 -2.260 1.00 81.71 123 A 1 ATOM 1041 C CD2 . TYR A 0 123 . -13.086 4.168 -0.364 1.00 81.71 123 A 1 ATOM 1042 C CE1 . TYR A 0 123 . -11.368 5.304 -2.278 1.00 81.71 123 A 1 ATOM 1043 C CE2 . TYR A 0 123 . -12.865 5.559 -0.363 1.00 81.71 123 A 1 ATOM 1044 O OH . TYR A 0 123 . -11.781 7.471 -1.383 1.00 81.71 123 A 1 ATOM 1045 C CZ . TYR A 0 123 . -12.011 6.129 -1.336 1.00 81.71 123 A 1 ATOM 1046 N N . ASP A 0 124 . -14.658 -0.613 -2.645 1.00 86.75 124 A 1 ATOM 1047 C CA . ASP A 0 124 . -14.995 -1.984 -3.011 1.00 86.75 124 A 1 ATOM 1048 C C . ASP A 0 124 . -15.134 -2.085 -4.541 1.00 86.75 124 A 1 ATOM 1049 C CB . ASP A 0 124 . -16.286 -2.299 -2.239 1.00 86.75 124 A 1 ATOM 1050 O O . ASP A 0 124 . -16.154 -1.705 -5.126 1.00 86.75 124 A 1 ATOM 1051 C CG . ASP A 0 124 . -16.892 -3.661 -2.522 1.00 86.75 124 A 1 ATOM 1052 O OD1 . ASP A 0 124 . -16.221 -4.479 -3.162 1.00 86.75 124 A 1 ATOM 1053 O OD2 . ASP A 0 124 . -18.082 -3.833 -2.149 1.00 86.75 124 A 1 ATOM 1054 N N . GLN A 0 125 . -14.040 -2.476 -5.196 1.00 82.84 125 A 1 ATOM 1055 C CA . GLN A 0 125 . -13.918 -2.577 -6.649 1.00 82.84 125 A 1 ATOM 1056 C C . GLN A 0 125 . -14.454 -3.914 -7.154 1.00 82.84 125 A 1 ATOM 1057 C CB . GLN A 0 125 . -12.445 -2.435 -7.078 1.00 82.84 125 A 1 ATOM 1058 O O . GLN A 0 125 . -14.964 -3.969 -8.278 1.00 82.84 125 A 1 ATOM 1059 C CG . GLN A 0 125 . -11.912 -1.001 -6.966 1.00 82.84 125 A 1 ATOM 1060 C CD . GLN A 0 125 . -10.448 -0.854 -7.381 1.00 82.84 125 A 1 ATOM 1061 N NE2 . GLN A 0 125 . -9.887 0.322 -7.195 1.00 82.84 125 A 1 ATOM 1062 O OE1 . GLN A 0 125 . -9.790 -1.753 -7.880 1.00 82.84 125 A 1 ATOM 1063 N N . ASP A 0 126 . -14.322 -4.979 -6.361 1.00 86.36 126 A 1 ATOM 1064 C CA . ASP A 0 126 . -14.827 -6.305 -6.720 1.00 86.36 126 A 1 ATOM 1065 C C . ASP A 0 126 . -16.317 -6.508 -6.372 1.00 86.36 126 A 1 ATOM 1066 C CB . ASP A 0 126 . -13.876 -7.398 -6.200 1.00 86.36 126 A 1 ATOM 1067 O O . ASP A 0 126 . -16.975 -7.375 -6.956 1.00 86.36 126 A 1 ATOM 1068 C CG . ASP A 0 126 . -13.814 -7.573 -4.680 1.00 86.36 126 A 1 ATOM 1069 O OD1 . ASP A 0 126 . -14.790 -7.176 -4.020 1.00 86.36 126 A 1 ATOM 1070 O OD2 . ASP A 0 126 . -12.829 -8.213 -4.234 1.00 86.36 126 A 1 ATOM 1071 N N . GLY A 0 127 . -16.885 -5.636 -5.537 1.00 83.72 127 A 1 ATOM 1072 C CA . GLY A 0 127 . -18.299 -5.594 -5.180 1.00 83.72 127 A 1 ATOM 1073 C C . GLY A 0 127 . -18.693 -6.616 -4.115 1.00 83.72 127 A 1 ATOM 1074 O O . GLY A 0 127 . -19.877 -6.972 -4.034 1.00 83.72 127 A 1 ATOM 1075 N N . ASP A 0 128 . -17.743 -7.128 -3.333 1.00 87.18 128 A 1 ATOM 1076 C CA . ASP A 0 128 . -17.981 -8.164 -2.327 1.00 87.18 128 A 1 ATOM 1077 C C . ASP A 0 128 . -18.514 -7.624 -0.982 1.00 87.18 128 A 1 ATOM 1078 C CB . ASP A 0 128 . -16.739 -9.060 -2.210 1.00 87.18 128 A 1 ATOM 1079 O O . ASP A 0 128 . -18.922 -8.395 -0.103 1.00 87.18 128 A 1 ATOM 1080 C CG . ASP A 0 128 . -15.583 -8.495 -1.379 1.00 87.18 128 A 1 ATOM 1081 O OD1 . ASP A 0 128 . -15.724 -7.380 -0.832 1.00 87.18 128 A 1 ATOM 1082 O OD2 . ASP A 0 128 . -14.697 -9.324 -1.049 1.00 87.18 128 A 1 ATOM 1083 N N . GLY A 0 129 . -18.601 -6.299 -0.838 1.00 85.01 129 A 1 ATOM 1084 C CA . GLY A 0 129 . -19.143 -5.611 0.330 1.00 85.01 129 A 1 ATOM 1085 C C . GLY A 0 129 . -18.170 -5.482 1.502 1.00 85.01 129 A 1 ATOM 1086 O O . GLY A 0 129 . -18.591 -5.079 2.596 1.00 85.01 129 A 1 ATOM 1087 N N . LYS A 0 130 . -16.892 -5.801 1.306 1.00 86.39 130 A 1 ATOM 1088 C CA . LYS A 0 130 . -15.792 -5.598 2.256 1.00 86.39 130 A 1 ATOM 1089 C C . LYS A 0 130 . -14.636 -4.913 1.519 1.00 86.39 130 A 1 ATOM 1090 C CB . LYS A 0 130 . -15.445 -6.933 2.955 1.00 86.39 130 A 1 ATOM 1091 O O . LYS A 0 130 . -14.692 -4.698 0.322 1.00 86.39 130 A 1 ATOM 1092 C CG . LYS A 0 130 . -15.217 -8.095 1.982 1.00 86.39 130 A 1 ATOM 1093 C CD . LYS A 0 130 . -14.998 -9.466 2.624 1.00 86.39 130 A 1 ATOM 1094 C CE . LYS A 0 130 . -14.604 -10.393 1.476 1.00 86.39 130 A 1 ATOM 1095 N NZ . LYS A 0 130 . -13.965 -11.644 1.912 1.00 86.39 130 A 1 ATOM 1096 N N . LEU A 0 131 . -13.641 -4.432 2.259 1.00 84.19 131 A 1 ATOM 1097 C CA . LEU A 0 131 . -12.449 -3.831 1.661 1.00 84.19 131 A 1 ATOM 1098 C C . LEU A 0 131 . -11.280 -4.772 1.837 1.00 84.19 131 A 1 ATOM 1099 C CB . LEU A 0 131 . -12.148 -2.449 2.257 1.00 84.19 131 A 1 ATOM 1100 O O . LEU A 0 131 . -10.821 -4.986 2.960 1.00 84.19 131 A 1 ATOM 1101 C CG . LEU A 0 131 . -13.202 -1.388 1.927 1.00 84.19 131 A 1 ATOM 1102 C CD1 . LEU A 0 131 . -12.824 -0.073 2.612 1.00 84.19 131 A 1 ATOM 1103 C CD2 . LEU A 0 131 . -13.323 -1.114 0.433 1.00 84.19 131 A 1 ATOM 1104 N N . ASN A 0 132 . -10.769 -5.306 0.742 1.00 81.37 132 A 1 ATOM 1105 C CA . ASN A 0 132 . -9.497 -6.001 0.772 1.00 81.37 132 A 1 ATOM 1106 C C . ASN A 0 132 . -8.332 -4.997 0.935 1.00 81.37 132 A 1 ATOM 1107 C CB . ASN A 0 132 . -9.423 -6.941 -0.445 1.00 81.37 132 A 1 ATOM 1108 O O . ASN A 0 132 . -8.477 -3.769 0.859 1.00 81.37 132 A 1 ATOM 1109 C CG . ASN A 0 132 . -9.311 -6.213 -1.768 1.00 81.37 132 A 1 ATOM 1110 N ND2 . ASN A 0 132 . -10.076 -6.591 -2.765 1.00 81.37 132 A 1 ATOM 1111 O OD1 . ASN A 0 132 . -8.466 -5.339 -1.912 1.00 81.37 132 A 1 ATOM 1112 N N . TYR A 0 133 . -7.134 -5.529 1.170 1.00 72.96 133 A 1 ATOM 1113 C CA . TYR A 0 133 . -5.911 -4.739 1.334 1.00 72.96 133 A 1 ATOM 1114 C C . TYR A 0 133 . -5.672 -3.737 0.187 1.00 72.96 133 A 1 ATOM 1115 C CB . TYR A 0 133 . -4.748 -5.735 1.444 1.00 72.96 133 A 1 ATOM 1116 O O . TYR A 0 133 . -5.229 -2.614 0.436 1.00 72.96 133 A 1 ATOM 1117 C CG . TYR A 0 133 . -3.375 -5.124 1.632 1.00 72.96 133 A 1 ATOM 1118 C CD1 . TYR A 0 133 . -2.654 -4.659 0.517 1.00 72.96 133 A 1 ATOM 1119 C CD2 . TYR A 0 133 . -2.795 -5.080 2.914 1.00 72.96 133 A 1 ATOM 1120 C CE1 . TYR A 0 133 . -1.374 -4.109 0.690 1.00 72.96 133 A 1 ATOM 1121 C CE2 . TYR A 0 133 . -1.506 -4.537 3.091 1.00 72.96 133 A 1 ATOM 1122 O OH . TYR A 0 133 . 0.405 -3.458 2.116 1.00 72.96 133 A 1 ATOM 1123 C CZ . TYR A 0 133 . -0.817 -4.016 1.976 1.00 72.96 133 A 1 ATOM 1124 N N . HIS A 0 134 . -5.958 -4.132 -1.058 1.00 73.77 134 A 1 ATOM 1125 C CA . HIS A 0 134 . -5.740 -3.314 -2.253 1.00 73.77 134 A 1 ATOM 1126 C C . HIS A 0 134 . -6.705 -2.123 -2.310 1.00 73.77 134 A 1 ATOM 1127 C CB . HIS A 0 134 . -5.878 -4.210 -3.493 1.00 73.77 134 A 1 ATOM 1128 O O . HIS A 0 134 . -6.284 -0.986 -2.516 1.00 73.77 134 A 1 ATOM 1129 C CG . HIS A 0 134 . -5.602 -3.495 -4.783 1.00 73.77 134 A 1 ATOM 1130 C CD2 . HIS A 0 134 . -6.521 -3.033 -5.692 1.00 73.77 134 A 1 ATOM 1131 N ND1 . HIS A 0 134 . -4.353 -3.215 -5.281 1.00 73.77 134 A 1 ATOM 1132 C CE1 . HIS A 0 134 . -4.512 -2.602 -6.463 1.00 73.77 134 A 1 ATOM 1133 N NE2 . HIS A 0 134 . -5.807 -2.479 -6.763 1.00 73.77 134 A 1 ATOM 1134 N N . GLU A 0 135 . -7.980 -2.363 -2.035 1.00 81.46 135 A 1 ATOM 1135 C CA . GLU A 0 135 . -9.038 -1.350 -2.066 1.00 81.46 135 A 1 ATOM 1136 C C . GLU A 0 135 . -8.874 -0.314 -0.953 1.00 81.46 135 A 1 ATOM 1137 C CB . GLU A 0 135 . -10.363 -2.077 -1.885 1.00 81.46 135 A 1 ATOM 1138 O O . GLU A 0 135 . -8.999 0.896 -1.169 1.00 81.46 135 A 1 ATOM 1139 C CG . GLU A 0 135 . -10.664 -2.964 -3.100 1.00 81.46 135 A 1 ATOM 1140 C CD . GLU A 0 135 . -11.806 -3.930 -2.827 1.00 81.46 135 A 1 ATOM 1141 O OE1 . GLU A 0 135 . -12.439 -4.297 -3.838 1.00 81.46 135 A 1 ATOM 1142 O OE2 . GLU A 0 135 . -11.942 -4.328 -1.647 1.00 81.46 135 A 1 ATOM 1143 N N . PHE A 0 136 . -8.499 -0.766 0.248 1.00 73.00 136 A 1 ATOM 1144 C CA . PHE A 0 136 . -8.198 0.149 1.346 1.00 73.00 136 A 1 ATOM 1145 C C . PHE A 0 136 . -6.941 0.994 1.065 1.00 73.00 136 A 1 ATOM 1146 C CB . PHE A 0 136 . -8.074 -0.637 2.655 1.00 73.00 136 A 1 ATOM 1147 O O . PHE A 0 136 . -6.862 2.153 1.489 1.00 73.00 136 A 1 ATOM 1148 C CG . PHE A 0 136 . -8.187 0.248 3.884 1.00 73.00 136 A 1 ATOM 1149 C CD1 . PHE A 0 136 . -7.066 0.935 4.382 1.00 73.00 136 A 1 ATOM 1150 C CD2 . PHE A 0 136 . -9.434 0.423 4.507 1.00 73.00 136 A 1 ATOM 1151 C CE1 . PHE A 0 136 . -7.170 1.739 5.529 1.00 73.00 136 A 1 ATOM 1152 C CE2 . PHE A 0 136 . -9.551 1.256 5.634 1.00 73.00 136 A 1 ATOM 1153 C CZ . PHE A 0 136 . -8.417 1.901 6.155 1.00 73.00 136 A 1 ATOM 1154 N N . LEU A 0 137 . -5.954 0.456 0.333 1.00 69.23 137 A 1 ATOM 1155 C CA . LEU A 0 137 . -4.800 1.240 -0.124 1.00 69.23 137 A 1 ATOM 1156 C C . LEU A 0 137 . -5.202 2.336 -1.111 1.00 69.23 137 A 1 ATOM 1157 C CB . LEU A 0 137 . -3.731 0.351 -0.781 1.00 69.23 137 A 1 ATOM 1158 O O . LEU A 0 137 . -4.660 3.440 -1.028 1.00 69.23 137 A 1 ATOM 1159 C CG . LEU A 0 137 . -2.793 -0.385 0.176 1.00 69.23 137 A 1 ATOM 1160 C CD1 . LEU A 0 137 . -1.806 -1.195 -0.661 1.00 69.23 137 A 1 ATOM 1161 C CD2 . LEU A 0 137 . -1.984 0.567 1.063 1.00 69.23 137 A 1 ATOM 1162 N N . ASP A 0 138 . -6.140 2.066 -2.016 1.00 71.91 138 A 1 ATOM 1163 C CA . ASP A 0 138 . -6.641 3.078 -2.946 1.00 71.91 138 A 1 ATOM 1164 C C . ASP A 0 138 . -7.353 4.216 -2.201 1.00 71.91 138 A 1 ATOM 1165 C CB . ASP A 0 138 . -7.527 2.430 -4.020 1.00 71.91 138 A 1 ATOM 1166 O O . ASP A 0 138 . -7.032 5.384 -2.445 1.00 71.91 138 A 1 ATOM 1167 C CG . ASP A 0 138 . -6.739 1.793 -5.178 1.00 71.91 138 A 1 ATOM 1168 O OD1 . ASP A 0 138 . -5.550 2.168 -5.402 1.00 71.91 138 A 1 ATOM 1169 O OD2 . ASP A 0 138 . -7.369 1.029 -5.936 1.00 71.91 138 A 1 ATOM 1170 N N . TYR A 0 139 . -8.194 3.907 -1.200 1.00 71.81 139 A 1 ATOM 1171 C CA . TYR A 0 139 . -8.755 4.924 -0.292 1.00 71.81 139 A 1 ATOM 1172 C C . TYR A 0 139 . -7.677 5.807 0.313 1.00 71.81 139 A 1 ATOM 1173 C CB . TYR A 0 139 . -9.545 4.281 0.862 1.00 71.81 139 A 1 ATOM 1174 O O . TYR A 0 139 . -7.770 7.040 0.287 1.00 71.81 139 A 1 ATOM 1175 C CG . TYR A 0 139 . -9.795 5.225 2.036 1.00 71.81 139 A 1 ATOM 1176 C CD1 . TYR A 0 139 . -9.267 4.950 3.314 1.00 71.81 139 A 1 ATOM 1177 C CD2 . TYR A 0 139 . -10.501 6.423 1.831 1.00 71.81 139 A 1 ATOM 1178 C CE1 . TYR A 0 139 . -9.501 5.840 4.385 1.00 71.81 139 A 1 ATOM 1179 C CE2 . TYR A 0 139 . -10.766 7.297 2.898 1.00 71.81 139 A 1 ATOM 1180 O OH . TYR A 0 139 . -10.559 7.859 5.197 1.00 71.81 139 A 1 ATOM 1181 C CZ . TYR A 0 139 . -10.274 7.003 4.181 1.00 71.81 139 A 1 ATOM 1182 N N . LEU A 0 140 . -6.656 5.165 0.876 1.00 62.43 140 A 1 ATOM 1183 C CA . LEU A 0 140 . -5.587 5.854 1.560 1.00 62.43 140 A 1 ATOM 1184 C C . LEU A 0 140 . -4.863 6.781 0.588 1.00 62.43 140 A 1 ATOM 1185 C CB . LEU A 0 140 . -4.672 4.797 2.191 1.00 62.43 140 A 1 ATOM 1186 O O . LEU A 0 140 . -4.673 7.949 0.914 1.00 62.43 140 A 1 ATOM 1187 C CG . LEU A 0 140 . -3.524 5.371 3.025 1.00 62.43 140 A 1 ATOM 1188 C CD1 . LEU A 0 140 . -4.024 6.090 4.285 1.00 62.43 140 A 1 ATOM 1189 C CD2 . LEU A 0 140 . -2.578 4.240 3.398 1.00 62.43 140 A 1 ATOM 1190 N N . LEU A 0 141 . -4.478 6.303 -0.596 1.00 63.14 141 A 1 ATOM 1191 C CA . LEU A 0 141 . -3.744 7.082 -1.595 1.00 63.14 141 A 1 ATOM 1192 C C . LEU A 0 141 . -4.545 8.264 -2.142 1.00 63.14 141 A 1 ATOM 1193 C CB . LEU A 0 141 . -3.271 6.153 -2.719 1.00 63.14 141 A 1 ATOM 1194 O O . LEU A 0 141 . -3.946 9.316 -2.355 1.00 63.14 141 A 1 ATOM 1195 C CG . LEU A 0 141 . -2.147 5.201 -2.269 1.00 63.14 141 A 1 ATOM 1196 C CD1 . LEU A 0 141 . -1.866 4.215 -3.390 1.00 63.14 141 A 1 ATOM 1197 C CD2 . LEU A 0 141 . -0.835 5.929 -1.959 1.00 63.14 141 A 1 ATOM 1198 N N . GLU A 0 142 . -5.867 8.136 -2.257 1.00 68.56 142 A 1 ATOM 1199 C CA . GLU A 0 142 . -6.749 9.250 -2.612 1.00 68.56 142 A 1 ATOM 1200 C C . GLU A 0 142 . -6.862 10.323 -1.523 1.00 68.56 142 A 1 ATOM 1201 C CB . GLU A 0 142 . -8.161 8.742 -2.908 1.00 68.56 142 A 1 ATOM 1202 O O . GLU A 0 142 . -7.203 11.463 -1.841 1.00 68.56 142 A 1 ATOM 1203 C CG . GLU A 0 142 . -8.327 8.084 -4.282 1.00 68.56 142 A 1 ATOM 1204 C CD . GLU A 0 142 . -9.818 8.057 -4.652 1.00 68.56 142 A 1 ATOM 1205 O OE1 . GLU A 0 142 . -10.136 8.322 -5.829 1.00 68.56 142 A 1 ATOM 1206 O OE2 . GLU A 0 142 . -10.664 7.912 -3.729 1.00 68.56 142 A 1 ATOM 1207 N N . GLN A 0 143 . -6.591 10.008 -0.247 1.00 61.48 143 A 1 ATOM 1208 C CA . GLN A 0 143 . -6.666 11.031 0.796 1.00 61.48 143 A 1 ATOM 1209 C C . GLN A 0 143 . -5.574 12.089 0.580 1.00 61.48 143 A 1 ATOM 1210 C CB . GLN A 0 143 . -6.592 10.465 2.226 1.00 61.48 143 A 1 ATOM 1211 O O . GLN A 0 143 . -4.379 11.748 0.655 1.00 61.48 143 A 1 ATOM 1212 C CG . GLN A 0 143 . -7.756 9.547 2.622 1.00 61.48 143 A 1 ATOM 1213 C CD . GLN A 0 143 . -9.109 10.117 2.219 1.00 61.48 143 A 1 ATOM 1214 N NE2 . GLN A 0 143 . -9.734 9.571 1.203 1.00 61.48 143 A 1 ATOM 1215 O OE1 . GLN A 0 143 . -9.593 11.093 2.768 1.00 61.48 143 A 1 ATOM 1216 N N . PRO A 0 144 . -5.949 13.369 0.363 1.00 52.17 144 A 1 ATOM 1217 C CA . PRO A 0 144 . -4.980 14.448 0.328 1.00 52.17 144 A 1 ATOM 1218 C C . PRO A 0 144 . -4.285 14.532 1.688 1.00 52.17 144 A 1 ATOM 1219 C CB . PRO A 0 144 . -5.766 15.713 -0.039 1.00 52.17 144 A 1 ATOM 1220 O O . PRO A 0 144 . -4.899 14.354 2.738 1.00 52.17 144 A 1 ATOM 1221 C CG . PRO A 0 144 . -7.182 15.416 0.450 1.00 52.17 144 A 1 ATOM 1222 C CD . PRO A 0 144 . -7.305 13.905 0.275 1.00 52.17 144 A 1 ATOM 1223 N N . THR A 0 145 . -2.986 14.827 1.676 1.00 49.74 145 A 1 ATOM 1224 C CA . THR A 0 145 . -2.160 15.000 2.884 1.00 49.74 145 A 1 ATOM 1225 C C . THR A 0 145 . -2.570 16.204 3.735 1.00 49.74 145 A 1 ATOM 1226 C CB . THR A 0 145 . -0.681 15.147 2.501 1.00 49.74 145 A 1 ATOM 1227 O O . THR A 0 145 . -1.990 16.429 4.794 1.00 49.74 145 A 1 ATOM 1228 C CG2 . THR A 0 145 . -0.099 13.841 1.960 1.00 49.74 145 A 1 ATOM 1229 O OG1 . THR A 0 145 . -0.555 16.113 1.482 1.00 49.74 145 A 1 ATOM 1230 N N . SER A 0 146 . -3.565 16.980 3.303 1.00 43.46 146 A 1 ATOM 1231 C CA . SER A 0 146 . -4.140 18.050 4.099 1.00 43.46 146 A 1 ATOM 1232 C C . SER A 0 146 . -4.906 17.455 5.279 1.00 43.46 146 A 1 ATOM 1233 C CB . SER A 0 146 . -5.047 18.928 3.227 1.00 43.46 146 A 1 ATOM 1234 O O . SER A 0 146 . -5.976 16.872 5.098 1.00 43.46 146 A 1 ATOM 1235 O OG . SER A 0 146 . -6.066 18.151 2.627 1.00 43.46 146 A 1 ATOM 1236 N N . GLU A 0 147 . -4.407 17.686 6.492 1.00 47.42 147 A 1 ATOM 1237 C CA . GLU A 0 147 . -5.032 17.358 7.787 1.00 47.42 147 A 1 ATOM 1238 C C . GLU A 0 147 . -6.440 17.973 7.993 1.00 47.42 147 A 1 ATOM 1239 C CB . GLU A 0 147 . -4.080 17.804 8.919 1.00 47.42 147 A 1 ATOM 1240 O O . GLU A 0 147 . -7.027 17.863 9.064 1.00 47.42 147 A 1 ATOM 1241 C CG . GLU A 0 147 . -2.717 17.093 8.880 1.00 47.42 147 A 1 ATOM 1242 C CD . GLU A 0 147 . -1.853 17.438 10.103 1.00 47.42 147 A 1 ATOM 1243 O OE1 . GLU A 0 147 . -1.458 16.490 10.822 1.00 47.42 147 A 1 ATOM 1244 O OE2 . GLU A 0 147 . -1.565 18.641 10.286 1.00 47.42 147 A 1 ATOM 1245 N N . GLY A 0 148 . -7.009 18.617 6.971 1.00 39.11 148 A 1 ATOM 1246 C CA . GLY A 0 148 . -8.275 19.338 7.009 1.00 39.11 148 A 1 ATOM 1247 C C . GLY A 0 148 . -9.481 18.607 6.421 1.00 39.11 148 A 1 ATOM 1248 O O . GLY A 0 148 . -10.507 19.257 6.243 1.00 39.11 148 A 1 ATOM 1249 N N . CYS A 0 149 . -9.415 17.309 6.090 1.00 36.49 149 A 1 ATOM 1250 C CA . CYS A 0 149 . -10.620 16.596 5.652 1.00 36.49 149 A 1 ATOM 1251 C C . CYS A 0 149 . -11.357 15.977 6.859 1.00 36.49 149 A 1 ATOM 1252 C CB . CYS A 0 149 . -10.313 15.581 4.543 1.00 36.49 149 A 1 ATOM 1253 O O . CYS A 0 149 . -10.900 14.969 7.399 1.00 36.49 149 A 1 ATOM 1254 S SG . CYS A 0 149 . -11.775 15.483 3.461 1.00 36.49 149 A 1 ATOM 1255 N N . PRO A 0 150 . -12.517 16.515 7.289 1.00 39.78 150 A 1 ATOM 1256 C CA . PRO A 0 150 . -13.241 16.023 8.468 1.00 39.78 150 A 1 ATOM 1257 C C . PRO A 0 150 . -13.848 14.619 8.298 1.00 39.78 150 A 1 ATOM 1258 C CB . PRO A 0 150 . -14.314 17.084 8.750 1.00 39.78 150 A 1 ATOM 1259 O O . PRO A 0 150 . -14.439 14.099 9.237 1.00 39.78 150 A 1 ATOM 1260 C CG . PRO A 0 150 . -14.571 17.711 7.383 1.00 39.78 150 A 1 ATOM 1261 C CD . PRO A 0 150 . -13.191 17.684 6.742 1.00 39.78 150 A 1 ATOM 1262 N N . ARG A 0 151 . -13.735 14.005 7.111 1.00 45.44 151 A 1 ATOM 1263 C CA . ARG A 0 151 . -14.258 12.662 6.805 1.00 45.44 151 A 1 ATOM 1264 C C . ARG A 0 151 . -13.182 11.580 6.699 1.00 45.44 151 A 1 ATOM 1265 C CB . ARG A 0 151 . -15.141 12.700 5.550 1.00 45.44 151 A 1 ATOM 1266 O O . ARG A 0 151 . -13.495 10.460 6.304 1.00 45.44 151 A 1 ATOM 1267 C CG . ARG A 0 151 . -16.443 13.468 5.791 1.00 45.44 151 A 1 ATOM 1268 C CD . ARG A 0 151 . -17.398 13.231 4.617 1.00 45.44 151 A 1 ATOM 1269 N NE . ARG A 0 151 . -18.702 13.880 4.845 1.00 45.44 151 A 1 ATOM 1270 N NH1 . ARG A 0 151 . -18.197 15.947 3.980 1.00 45.44 151 A 1 ATOM 1271 N NH2 . ARG A 0 151 . -20.228 15.560 4.824 1.00 45.44 151 A 1 ATOM 1272 C CZ . ARG A 0 151 . -19.033 15.122 4.548 1.00 45.44 151 A 1 ATOM 1273 N N . THR A 0 152 . -11.929 11.881 7.030 1.00 52.18 152 A 1 ATOM 1274 C CA . THR A 0 152 . -10.895 10.844 7.085 1.00 52.18 152 A 1 ATOM 1275 C C . THR A 0 152 . -11.156 9.932 8.282 1.00 52.18 152 A 1 ATOM 1276 C CB . THR A 0 152 . -9.489 11.455 7.133 1.00 52.18 152 A 1 ATOM 1277 O O . THR A 0 152 . -11.408 10.426 9.383 1.00 52.18 152 A 1 ATOM 1278 C CG2 . THR A 0 152 . -8.393 10.403 6.966 1.00 52.18 152 A 1 ATOM 1279 O OG1 . THR A 0 152 . -9.349 12.354 6.060 1.00 52.18 152 A 1 ATOM 1280 N N . LEU A 0 153 . -11.081 8.611 8.089 1.00 54.00 153 A 1 ATOM 1281 C CA . LEU A 0 153 . -11.085 7.628 9.175 1.00 54.00 153 A 1 ATOM 1282 C C . LEU A 0 153 . -9.835 7.838 10.043 1.00 54.00 153 A 1 ATOM 1283 C CB . LEU A 0 153 . -11.140 6.199 8.592 1.00 54.00 153 A 1 ATOM 1284 O O . LEU A 0 153 . -8.791 7.224 9.837 1.00 54.00 153 A 1 ATOM 1285 C CG . LEU A 0 153 . -12.520 5.750 8.080 1.00 54.00 153 A 1 ATOM 1286 C CD1 . LEU A 0 153 . -12.368 4.444 7.305 1.00 54.00 153 A 1 ATOM 1287 C CD2 . LEU A 0 153 . -13.504 5.497 9.227 1.00 54.00 153 A 1 ATOM 1288 N N . ASN A 0 154 . -9.919 8.761 11.000 1.00 55.06 154 A 1 ATOM 1289 C CA . ASN A 0 154 . -8.835 9.070 11.921 1.00 55.06 154 A 1 ATOM 1290 C C . ASN A 0 154 . -8.911 8.141 13.139 1.00 55.06 154 A 1 ATOM 1291 C CB . ASN A 0 154 . -8.852 10.569 12.260 1.00 55.06 154 A 1 ATOM 1292 O O . ASN A 0 154 . -9.402 8.516 14.202 1.00 55.06 154 A 1 ATOM 1293 C CG . ASN A 0 154 . -7.586 11.002 12.984 1.00 55.06 154 A 1 ATOM 1294 N ND2 . ASN A 0 154 . -7.342 12.289 13.060 1.00 55.06 154 A 1 ATOM 1295 O OD1 . ASN A 0 154 . -6.789 10.210 13.458 1.00 55.06 154 A 1 ATOM 1296 N N . ILE A 0 155 . -8.439 6.906 12.965 1.00 53.36 155 A 1 ATOM 1297 C CA . ILE A 0 155 . -8.341 5.906 14.042 1.00 53.36 155 A 1 ATOM 1298 C C . ILE A 0 155 . -6.943 5.882 14.696 1.00 53.36 155 A 1 ATOM 1299 C CB . ILE A 0 155 . -8.834 4.526 13.570 1.00 53.36 155 A 1 ATOM 1300 O O . ILE A 0 155 . -6.565 4.922 15.372 1.00 53.36 155 A 1 ATOM 1301 C CG1 . ILE A 0 155 . -7.868 3.928 12.545 1.00 53.36 155 A 1 ATOM 1302 C CG2 . ILE A 0 155 . -10.268 4.588 13.014 1.00 53.36 155 A 1 ATOM 1303 C CD1 . ILE A 0 155 . -8.235 2.491 12.192 1.00 53.36 155 A 1 ATOM 1304 N N . SER A 0 156 . -6.153 6.943 14.491 1.00 50.06 156 A 1 ATOM 1305 C CA . SER A 0 156 . -4.782 7.069 15.002 1.00 50.06 156 A 1 ATOM 1306 C C . SER A 0 156 . -4.696 7.389 16.503 1.00 50.06 156 A 1 ATOM 1307 C CB . SER A 0 156 . -3.996 8.108 14.185 1.00 50.06 156 A 1 ATOM 1308 O O . SER A 0 156 . -3.590 7.610 16.990 1.00 50.06 156 A 1 ATOM 1309 O OG . SER A 0 156 . -3.884 7.713 12.825 1.00 50.06 156 A 1 ATOM 1310 N N . LYS A 0 157 . -5.812 7.412 17.245 1.00 42.58 157 A 1 ATOM 1311 C CA . LYS A 0 157 . -5.773 7.520 18.713 1.00 42.58 157 A 1 ATOM 1312 C C . LYS A 0 157 . -5.416 6.197 19.389 1.00 42.58 157 A 1 ATOM 1313 C CB . LYS A 0 157 . -7.052 8.148 19.282 1.00 42.58 157 A 1 ATOM 1314 O O . LYS A 0 157 . -5.743 5.116 18.836 1.00 42.58 157 A 1 ATOM 1315 C CG . LYS A 0 157 . -7.090 9.662 19.027 1.00 42.58 157 A 1 ATOM 1316 C CD . LYS A 0 157 . -8.226 10.307 19.826 1.00 42.58 157 A 1 ATOM 1317 C CE . LYS A 0 157 . -8.229 11.822 19.607 1.00 42.58 157 A 1 ATOM 1318 N NZ . LYS A 0 157 . -9.265 12.475 20.443 1.00 42.58 157 A 1 ATOM 1319 O OXT . LYS A 0 157 . -4.780 6.318 20.450 1.00 42.58 157 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 72.55 # loop_ _atom_type.symbol C N O S #