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 SER 0 4 SER 0 5 ALA 0 6 ALA 0 7 GLN 0 8 ALA 0 9 ARG 0 10 ARG 0 11 ARG 0 12 GLN 0 13 GLN 0 14 GLN 0 15 ILE 0 16 ARG 0 17 LEU 0 18 ALA 0 19 GLN 0 20 LYS 0 21 CYS 0 22 PHE 0 23 SER 0 24 CYS 0 25 GLY 0 26 GLY 0 27 LEU 0 28 GLY 0 29 HIS 0 30 PHE 0 31 ALA 0 32 ARG 0 33 ASP 0 34 CYS 0 35 LEU 0 36 THR 0 37 PRO 0 38 HIS 0 39 GLN 0 40 ARG 0 41 PRO 0 42 ASP 0 43 ALA 0 44 ASP 0 45 GLY 0 46 PRO 0 47 PRO 0 48 ARG 0 49 ALA 0 50 ASP 0 51 VAL 0 52 ARG 0 53 ARG 0 54 ARG 0 55 ASP 0 56 GLY 0 57 GLY 0 58 GLY 0 59 GLY 0 60 SER 0 61 GLY 0 62 GLY 0 63 GLY 0 64 GLY 0 65 SER 0 66 ARG 0 67 ARG 0 68 GLY 0 69 ARG 0 70 THR 0 71 PHE 0 72 ALA 0 73 VAL 0 74 ALA 0 75 THR 0 76 LEU 0 77 GLN 0 78 MET 0 79 SER 0 80 PRO 0 81 MET 0 82 SER 0 83 GLY 0 84 THR 0 85 THR 0 86 GLU 0 87 THR 0 88 LEU 0 89 MET 0 90 GLY 0 91 LYS 0 92 ARG 0 93 PRO 0 94 GLN 0 95 ARG 0 96 ARG 0 97 PRO 0 98 THR 0 99 PRO 0 100 PRO 0 101 THR 0 102 ASP 0 103 ALA 0 104 ASN 0 105 LYS 0 106 ALA 0 107 LEU 0 108 PRO 0 109 SER 0 110 ILE 0 111 ARG 0 112 LEU 0 113 ARG 0 114 ILE 0 115 ASP 0 116 SER 0 117 ILE 0 118 PRO 0 119 ARG 0 120 ASN 0 121 VAL 0 122 LEU 0 123 VAL 0 124 GLN 0 125 CYS 0 126 PHE 0 127 SER 0 128 SER 0 129 GLY 0 130 ARG 0 131 PRO 0 132 PHE 0 133 GLY 0 134 PRO 0 135 PRO # 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 . 1.672 -3.374 26.627 1.00 59.44 1 A 1 ATOM 2 C CA . MET A 0 1 . 1.472 -4.203 25.417 1.00 59.44 1 A 1 ATOM 3 C C . MET A 0 1 . 0.950 -3.302 24.304 1.00 59.44 1 A 1 ATOM 4 C CB . MET A 0 1 . 0.471 -5.336 25.705 1.00 59.44 1 A 1 ATOM 5 O O . MET A 0 1 . -0.148 -2.784 24.444 1.00 59.44 1 A 1 ATOM 6 C CG . MET A 0 1 . 1.006 -6.344 26.729 1.00 59.44 1 A 1 ATOM 7 S SD . MET A 0 1 . -0.201 -7.618 27.152 1.00 59.44 1 A 1 ATOM 8 C CE . MET A 0 1 . 0.883 -8.851 27.925 1.00 59.44 1 A 1 ATOM 9 N N . THR A 0 2 . 1.728 -3.011 23.259 1.00 60.19 2 A 1 ATOM 10 C CA . THR A 0 2 . 1.217 -2.236 22.113 1.00 60.19 2 A 1 ATOM 11 C C . THR A 0 2 . 0.313 -3.132 21.263 1.00 60.19 2 A 1 ATOM 12 C CB . THR A 0 2 . 2.355 -1.630 21.272 1.00 60.19 2 A 1 ATOM 13 O O . THR A 0 2 . 0.684 -4.249 20.916 1.00 60.19 2 A 1 ATOM 14 C CG2 . THR A 0 2 . 3.009 -0.442 21.978 1.00 60.19 2 A 1 ATOM 15 O OG1 . THR A 0 2 . 3.375 -2.576 21.063 1.00 60.19 2 A 1 ATOM 16 N N . SER A 0 3 . -0.902 -2.675 20.958 1.00 74.29 3 A 1 ATOM 17 C CA . SER A 0 3 . -1.898 -3.460 20.219 1.00 74.29 3 A 1 ATOM 18 C C . SER A 0 3 . -1.405 -3.785 18.802 1.00 74.29 3 A 1 ATOM 19 C CB . SER A 0 3 . -3.236 -2.702 20.169 1.00 74.29 3 A 1 ATOM 20 O O . SER A 0 3 . -0.854 -2.913 18.126 1.00 74.29 3 A 1 ATOM 21 O OG . SER A 0 3 . -3.476 -2.031 21.393 1.00 74.29 3 A 1 ATOM 22 N N . SER A 0 4 . -1.648 -5.004 18.308 1.00 75.08 4 A 1 ATOM 23 C CA . SER A 0 4 . -1.212 -5.464 16.971 1.00 75.08 4 A 1 ATOM 24 C C . SER A 0 4 . -1.633 -4.519 15.834 1.00 75.08 4 A 1 ATOM 25 C CB . SER A 0 4 . -1.779 -6.862 16.698 1.00 75.08 4 A 1 ATOM 26 O O . SER A 0 4 . -0.886 -4.306 14.878 1.00 75.08 4 A 1 ATOM 27 O OG . SER A 0 4 . -3.194 -6.808 16.638 1.00 75.08 4 A 1 ATOM 28 N N . ALA A 0 5 . -2.786 -3.859 15.975 1.00 78.12 5 A 1 ATOM 29 C CA . ALA A 0 5 . -3.267 -2.845 15.044 1.00 78.12 5 A 1 ATOM 30 C C . ALA A 0 5 . -2.315 -1.640 14.913 1.00 78.12 5 A 1 ATOM 31 C CB . ALA A 0 5 . -4.658 -2.400 15.510 1.00 78.12 5 A 1 ATOM 32 O O . ALA A 0 5 . -2.151 -1.101 13.817 1.00 78.12 5 A 1 ATOM 33 N N . ALA A 0 6 . -1.659 -1.220 16.000 1.00 79.18 6 A 1 ATOM 34 C CA . ALA A 0 6 . -0.681 -0.135 15.969 1.00 79.18 6 A 1 ATOM 35 C C . ALA A 0 6 . 0.590 -0.557 15.218 1.00 79.18 6 A 1 ATOM 36 C CB . ALA A 0 6 . -0.376 0.307 17.406 1.00 79.18 6 A 1 ATOM 37 O O . ALA A 0 6 . 1.123 0.216 14.421 1.00 79.18 6 A 1 ATOM 38 N N . GLN A 0 7 . 1.043 -1.800 15.409 1.00 83.86 7 A 1 ATOM 39 C CA . GLN A 0 7 . 2.196 -2.337 14.686 1.00 83.86 7 A 1 ATOM 40 C C . GLN A 0 7 . 1.899 -2.504 13.189 1.00 83.86 7 A 1 ATOM 41 C CB . GLN A 0 7 . 2.632 -3.657 15.333 1.00 83.86 7 A 1 ATOM 42 O O . GLN A 0 7 . 2.730 -2.140 12.357 1.00 83.86 7 A 1 ATOM 43 C CG . GLN A 0 7 . 4.036 -4.072 14.866 1.00 83.86 7 A 1 ATOM 44 C CD . GLN A 0 7 . 4.521 -5.337 15.564 1.00 83.86 7 A 1 ATOM 45 N NE2 . GLN A 0 7 . 5.812 -5.515 15.740 1.00 83.86 7 A 1 ATOM 46 O OE1 . GLN A 0 7 . 3.750 -6.194 15.949 1.00 83.86 7 A 1 ATOM 47 N N . ALA A 0 8 . 0.698 -2.967 12.832 1.00 83.86 8 A 1 ATOM 48 C CA . ALA A 0 8 . 0.264 -3.084 11.442 1.00 83.86 8 A 1 ATOM 49 C C . ALA A 0 8 . 0.236 -1.722 10.729 1.00 83.86 8 A 1 ATOM 50 C CB . ALA A 0 8 . -1.111 -3.760 11.419 1.00 83.86 8 A 1 ATOM 51 O O . ALA A 0 8 . 0.752 -1.597 9.619 1.00 83.86 8 A 1 ATOM 52 N N . ARG A 0 9 . -0.290 -0.678 11.385 1.00 84.46 9 A 1 ATOM 53 C CA . ARG A 0 9 . -0.288 0.690 10.837 1.00 84.46 9 A 1 ATOM 54 C C . ARG A 0 9 . 1.126 1.228 10.650 1.00 84.46 9 A 1 ATOM 55 C CB . ARG A 0 9 . -1.095 1.630 11.738 1.00 84.46 9 A 1 ATOM 56 O O . ARG A 0 9 . 1.412 1.781 9.595 1.00 84.46 9 A 1 ATOM 57 C CG . ARG A 0 9 . -2.599 1.348 11.656 1.00 84.46 9 A 1 ATOM 58 C CD . ARG A 0 9 . -3.333 2.192 12.701 1.00 84.46 9 A 1 ATOM 59 N NE . ARG A 0 9 . -4.734 1.759 12.855 1.00 84.46 9 A 1 ATOM 60 N NH1 . ARG A 0 9 . -5.799 3.619 12.012 1.00 84.46 9 A 1 ATOM 61 N NH2 . ARG A 0 9 . -6.998 1.950 12.873 1.00 84.46 9 A 1 ATOM 62 C CZ . ARG A 0 9 . -5.829 2.443 12.576 1.00 84.46 9 A 1 ATOM 63 N N . ARG A 0 10 . 2.023 1.018 11.621 1.00 84.08 10 A 1 ATOM 64 C CA . ARG A 0 10 . 3.436 1.421 11.504 1.00 84.08 10 A 1 ATOM 65 C C . ARG A 0 10 . 4.131 0.718 10.344 1.00 84.08 10 A 1 ATOM 66 C CB . ARG A 0 10 . 4.192 1.152 12.810 1.00 84.08 10 A 1 ATOM 67 O O . ARG A 0 10 . 4.818 1.377 9.578 1.00 84.08 10 A 1 ATOM 68 C CG . ARG A 0 10 . 3.830 2.169 13.897 1.00 84.08 10 A 1 ATOM 69 C CD . ARG A 0 10 . 4.587 1.840 15.187 1.00 84.08 10 A 1 ATOM 70 N NE . ARG A 0 10 . 4.208 2.754 16.284 1.00 84.08 10 A 1 ATOM 71 N NH1 . ARG A 0 10 . 6.271 3.695 16.722 1.00 84.08 10 A 1 ATOM 72 N NH2 . ARG A 0 10 . 4.508 4.284 17.944 1.00 84.08 10 A 1 ATOM 73 C CZ . ARG A 0 10 . 4.997 3.567 16.971 1.00 84.08 10 A 1 ATOM 74 N N . ARG A 0 11 . 3.897 -0.586 10.162 1.00 84.94 11 A 1 ATOM 75 C CA . ARG A 0 11 . 4.415 -1.331 9.005 1.00 84.94 11 A 1 ATOM 76 C C . ARG A 0 11 . 3.871 -0.779 7.691 1.00 84.94 11 A 1 ATOM 77 C CB . ARG A 0 11 . 4.103 -2.826 9.139 1.00 84.94 11 A 1 ATOM 78 O O . ARG A 0 11 . 4.644 -0.545 6.776 1.00 84.94 11 A 1 ATOM 79 C CG . ARG A 0 11 . 5.008 -3.513 10.170 1.00 84.94 11 A 1 ATOM 80 C CD . ARG A 0 11 . 4.670 -5.007 10.233 1.00 84.94 11 A 1 ATOM 81 N NE . ARG A 0 11 . 5.624 -5.747 11.082 1.00 84.94 11 A 1 ATOM 82 N NH1 . ARG A 0 11 . 5.449 -7.799 10.047 1.00 84.94 11 A 1 ATOM 83 N NH2 . ARG A 0 11 . 6.826 -7.556 11.778 1.00 84.94 11 A 1 ATOM 84 C CZ . ARG A 0 11 . 5.958 -7.024 10.965 1.00 84.94 11 A 1 ATOM 85 N N . GLN A 0 12 . 2.569 -0.505 7.597 1.00 80.94 12 A 1 ATOM 86 C CA . GLN A 0 12 . 1.987 0.098 6.392 1.00 80.94 12 A 1 ATOM 87 C C . GLN A 0 12 . 2.546 1.497 6.111 1.00 80.94 12 A 1 ATOM 88 C CB . GLN A 0 12 . 0.463 0.170 6.520 1.00 80.94 12 A 1 ATOM 89 O O . GLN A 0 12 . 2.820 1.819 4.959 1.00 80.94 12 A 1 ATOM 90 C CG . GLN A 0 12 . -0.197 -1.206 6.369 1.00 80.94 12 A 1 ATOM 91 C CD . GLN A 0 12 . -1.714 -1.142 6.519 1.00 80.94 12 A 1 ATOM 92 N NE2 . GLN A 0 12 . -2.400 -2.252 6.365 1.00 80.94 12 A 1 ATOM 93 O OE1 . GLN A 0 12 . -2.314 -0.108 6.770 1.00 80.94 12 A 1 ATOM 94 N N . GLN A 0 13 . 2.747 2.315 7.144 1.00 82.14 13 A 1 ATOM 95 C CA . GLN A 0 13 . 3.382 3.625 7.010 1.00 82.14 13 A 1 ATOM 96 C C . GLN A 0 13 . 4.835 3.491 6.551 1.00 82.14 13 A 1 ATOM 97 C CB . GLN A 0 13 . 3.296 4.385 8.338 1.00 82.14 13 A 1 ATOM 98 O O . GLN A 0 13 . 5.220 4.154 5.597 1.00 82.14 13 A 1 ATOM 99 C CG . GLN A 0 13 . 1.880 4.917 8.605 1.00 82.14 13 A 1 ATOM 100 C CD . GLN A 0 13 . 1.735 5.535 9.993 1.00 82.14 13 A 1 ATOM 101 N NE2 . GLN A 0 13 . 0.673 6.267 10.245 1.00 82.14 13 A 1 ATOM 102 O OE1 . GLN A 0 13 . 2.544 5.359 10.887 1.00 82.14 13 A 1 ATOM 103 N N . GLN A 0 14 . 5.614 2.585 7.146 1.00 82.16 14 A 1 ATOM 104 C CA . GLN A 0 14 . 6.985 2.300 6.715 1.00 82.16 14 A 1 ATOM 105 C C . GLN A 0 14 . 7.035 1.819 5.264 1.00 82.16 14 A 1 ATOM 106 C CB . GLN A 0 14 . 7.619 1.252 7.636 1.00 82.16 14 A 1 ATOM 107 O O . GLN A 0 14 . 7.867 2.298 4.506 1.00 82.16 14 A 1 ATOM 108 C CG . GLN A 0 14 . 8.045 1.854 8.981 1.00 82.16 14 A 1 ATOM 109 C CD . GLN A 0 14 . 8.590 0.807 9.947 1.00 82.16 14 A 1 ATOM 110 N NE2 . GLN A 0 14 . 9.233 1.222 11.016 1.00 82.16 14 A 1 ATOM 111 O OE1 . GLN A 0 14 . 8.433 -0.393 9.789 1.00 82.16 14 A 1 ATOM 112 N N . ILE A 0 15 . 6.114 0.945 4.847 1.00 82.20 15 A 1 ATOM 113 C CA . ILE A 0 15 . 6.015 0.505 3.451 1.00 82.20 15 A 1 ATOM 114 C C . ILE A 0 15 . 5.715 1.701 2.543 1.00 82.20 15 A 1 ATOM 115 C CB . ILE A 0 15 . 4.979 -0.630 3.291 1.00 82.20 15 A 1 ATOM 116 O O . ILE A 0 15 . 6.376 1.852 1.529 1.00 82.20 15 A 1 ATOM 117 C CG1 . ILE A 0 15 . 5.463 -1.914 4.005 1.00 82.20 15 A 1 ATOM 118 C CG2 . ILE A 0 15 . 4.728 -0.951 1.804 1.00 82.20 15 A 1 ATOM 119 C CD1 . ILE A 0 15 . 4.339 -2.927 4.267 1.00 82.20 15 A 1 ATOM 120 N N . ARG A 0 16 . 4.782 2.591 2.902 1.00 80.37 16 A 1 ATOM 121 C CA . ARG A 0 16 . 4.494 3.795 2.098 1.00 80.37 16 A 1 ATOM 122 C C . ARG A 0 16 . 5.686 4.746 1.987 1.00 80.37 16 A 1 ATOM 123 C CB . ARG A 0 16 . 3.293 4.553 2.671 1.00 80.37 16 A 1 ATOM 124 O O . ARG A 0 16 . 5.880 5.330 0.931 1.00 80.37 16 A 1 ATOM 125 C CG . ARG A 0 16 . 1.983 3.828 2.366 1.00 80.37 16 A 1 ATOM 126 C CD . ARG A 0 16 . 0.808 4.672 2.856 1.00 80.37 16 A 1 ATOM 127 N NE . ARG A 0 16 . -0.480 4.000 2.610 1.00 80.37 16 A 1 ATOM 128 N NH1 . ARG A 0 16 . -1.817 5.791 3.128 1.00 80.37 16 A 1 ATOM 129 N NH2 . ARG A 0 16 . -2.748 3.872 2.465 1.00 80.37 16 A 1 ATOM 130 C CZ . ARG A 0 16 . -1.671 4.555 2.737 1.00 80.37 16 A 1 ATOM 131 N N . LEU A 0 17 . 6.465 4.893 3.058 1.00 78.19 17 A 1 ATOM 132 C CA . LEU A 0 17 . 7.658 5.744 3.080 1.00 78.19 17 A 1 ATOM 133 C C . LEU A 0 17 . 8.832 5.125 2.310 1.00 78.19 17 A 1 ATOM 134 C CB . LEU A 0 17 . 8.038 6.039 4.541 1.00 78.19 17 A 1 ATOM 135 O O . LEU A 0 17 . 9.585 5.850 1.670 1.00 78.19 17 A 1 ATOM 136 C CG . LEU A 0 17 . 7.015 6.894 5.315 1.00 78.19 17 A 1 ATOM 137 C CD1 . LEU A 0 17 . 7.416 6.958 6.789 1.00 78.19 17 A 1 ATOM 138 C CD2 . LEU A 0 17 . 6.902 8.317 4.772 1.00 78.19 17 A 1 ATOM 139 N N . ALA A 0 18 . 8.971 3.798 2.345 1.00 79.86 18 A 1 ATOM 140 C CA . ALA A 0 18 . 10.027 3.065 1.647 1.00 79.86 18 A 1 ATOM 141 C C . ALA A 0 18 . 9.696 2.763 0.174 1.00 79.86 18 A 1 ATOM 142 C CB . ALA A 0 18 . 10.298 1.774 2.428 1.00 79.86 18 A 1 ATOM 143 O O . ALA A 0 18 . 10.592 2.477 -0.618 1.00 79.86 18 A 1 ATOM 144 N N . GLN A 0 19 . 8.418 2.786 -0.208 1.00 83.20 19 A 1 ATOM 145 C CA . GLN A 0 19 . 7.991 2.570 -1.588 1.00 83.20 19 A 1 ATOM 146 C C . GLN A 0 19 . 8.251 3.823 -2.428 1.00 83.20 19 A 1 ATOM 147 C CB . GLN A 0 19 . 6.514 2.150 -1.637 1.00 83.20 19 A 1 ATOM 148 O O . GLN A 0 19 . 7.823 4.926 -2.082 1.00 83.20 19 A 1 ATOM 149 C CG . GLN A 0 19 . 6.301 0.683 -1.216 1.00 83.20 19 A 1 ATOM 150 C CD . GLN A 0 19 . 6.547 -0.315 -2.338 1.00 83.20 19 A 1 ATOM 151 N NE2 . GLN A 0 19 . 7.371 -1.319 -2.127 1.00 83.20 19 A 1 ATOM 152 O OE1 . GLN A 0 19 . 5.979 -0.233 -3.412 1.00 83.20 19 A 1 ATOM 153 N N . LYS A 0 20 . 8.927 3.625 -3.563 1.00 86.83 20 A 1 ATOM 154 C CA . LYS A 0 20 . 9.078 4.643 -4.603 1.00 86.83 20 A 1 ATOM 155 C C . LYS A 0 20 . 7.854 4.677 -5.507 1.00 86.83 20 A 1 ATOM 156 C CB . LYS A 0 20 . 10.400 4.473 -5.372 1.00 86.83 20 A 1 ATOM 157 O O . LYS A 0 20 . 7.268 3.648 -5.844 1.00 86.83 20 A 1 ATOM 158 C CG . LYS A 0 20 . 10.464 3.205 -6.242 1.00 86.83 20 A 1 ATOM 159 C CD . LYS A 0 20 . 11.821 3.102 -6.949 1.00 86.83 20 A 1 ATOM 160 C CE . LYS A 0 20 . 11.866 1.857 -7.842 1.00 86.83 20 A 1 ATOM 161 N NZ . LYS A 0 20 . 13.182 1.724 -8.518 1.00 86.83 20 A 1 ATOM 162 N N . CYS A 0 21 . 7.495 5.871 -5.935 1.00 86.02 21 A 1 ATOM 163 C CA . CYS A 0 21 . 6.468 6.116 -6.917 1.00 86.02 21 A 1 ATOM 164 C C . CYS A 0 21 . 6.918 5.565 -8.274 1.00 86.02 21 A 1 ATOM 165 C CB . CYS A 0 21 . 6.217 7.622 -6.950 1.00 86.02 21 A 1 ATOM 166 O O . CYS A 0 21 . 7.979 5.920 -8.781 1.00 86.02 21 A 1 ATOM 167 S SG . CYS A 0 21 . 4.984 8.015 -8.211 1.00 86.02 21 A 1 ATOM 168 N N . PHE A 0 22 . 6.091 4.724 -8.894 1.00 83.45 22 A 1 ATOM 169 C CA . PHE A 0 22 . 6.364 4.168 -10.224 1.00 83.45 22 A 1 ATOM 170 C C . PHE A 0 22 . 6.173 5.173 -11.371 1.00 83.45 22 A 1 ATOM 171 C CB . PHE A 0 22 . 5.490 2.925 -10.443 1.00 83.45 22 A 1 ATOM 172 O O . PHE A 0 22 . 6.499 4.846 -12.505 1.00 83.45 22 A 1 ATOM 173 C CG . PHE A 0 22 . 5.836 1.766 -9.534 1.00 83.45 22 A 1 ATOM 174 C CD1 . PHE A 0 22 . 6.876 0.890 -9.895 1.00 83.45 22 A 1 ATOM 175 C CD2 . PHE A 0 22 . 5.131 1.560 -8.333 1.00 83.45 22 A 1 ATOM 176 C CE1 . PHE A 0 22 . 7.207 -0.193 -9.062 1.00 83.45 22 A 1 ATOM 177 C CE2 . PHE A 0 22 . 5.470 0.482 -7.495 1.00 83.45 22 A 1 ATOM 178 C CZ . PHE A 0 22 . 6.505 -0.395 -7.862 1.00 83.45 22 A 1 ATOM 179 N N . SER A 0 23 . 5.628 6.363 -11.093 1.00 83.43 23 A 1 ATOM 180 C CA . SER A 0 23 . 5.455 7.421 -12.094 1.00 83.43 23 A 1 ATOM 181 C C . SER A 0 23 . 6.638 8.390 -12.073 1.00 83.43 23 A 1 ATOM 182 C CB . SER A 0 23 . 4.098 8.106 -11.914 1.00 83.43 23 A 1 ATOM 183 O O . SER A 0 23 . 7.336 8.486 -13.070 1.00 83.43 23 A 1 ATOM 184 O OG . SER A 0 23 . 3.843 9.055 -12.924 1.00 83.43 23 A 1 ATOM 185 N N . CYS A 0 24 . 6.932 9.039 -10.939 1.00 85.19 24 A 1 ATOM 186 C CA . CYS A 0 24 . 8.000 10.048 -10.851 1.00 85.19 24 A 1 ATOM 187 C C . CYS A 0 24 . 9.296 9.579 -10.162 1.00 85.19 24 A 1 ATOM 188 C CB . CYS A 0 24 . 7.427 11.289 -10.155 1.00 85.19 24 A 1 ATOM 189 O O . CYS A 0 24 . 10.267 10.325 -10.115 1.00 85.19 24 A 1 ATOM 190 S SG . CYS A 0 24 . 7.187 10.965 -8.382 1.00 85.19 24 A 1 ATOM 191 N N . GLY A 0 25 . 9.315 8.387 -9.556 1.00 84.46 25 A 1 ATOM 192 C CA . GLY A 0 25 . 10.454 7.898 -8.768 1.00 84.46 25 A 1 ATOM 193 C C . GLY A 0 25 . 10.561 8.450 -7.337 1.00 84.46 25 A 1 ATOM 194 O O . GLY A 0 25 . 11.390 7.961 -6.574 1.00 84.46 25 A 1 ATOM 195 N N . GLY A 0 26 . 9.726 9.415 -6.933 1.00 83.14 26 A 1 ATOM 196 C CA . GLY A 0 26 . 9.738 9.997 -5.583 1.00 83.14 26 A 1 ATOM 197 C C . GLY A 0 26 . 9.277 9.033 -4.481 1.00 83.14 26 A 1 ATOM 198 O O . GLY A 0 26 . 8.550 8.083 -4.744 1.00 83.14 26 A 1 ATOM 199 N N . LEU A 0 27 . 9.678 9.271 -3.231 1.00 86.18 27 A 1 ATOM 200 C CA . LEU A 0 27 . 9.304 8.438 -2.076 1.00 86.18 27 A 1 ATOM 201 C C . LEU A 0 27 . 8.047 8.970 -1.366 1.00 86.18 27 A 1 ATOM 202 C CB . LEU A 0 27 . 10.505 8.318 -1.116 1.00 86.18 27 A 1 ATOM 203 O O . LEU A 0 27 . 7.651 10.124 -1.540 1.00 86.18 27 A 1 ATOM 204 C CG . LEU A 0 27 . 11.748 7.628 -1.715 1.00 86.18 27 A 1 ATOM 205 C CD1 . LEU A 0 27 . 12.906 7.693 -0.721 1.00 86.18 27 A 1 ATOM 206 C CD2 . LEU A 0 27 . 11.495 6.155 -2.040 1.00 86.18 27 A 1 ATOM 207 N N . GLY A 0 28 . 7.408 8.126 -0.552 1.00 84.03 28 A 1 ATOM 208 C CA . GLY A 0 28 . 6.312 8.538 0.335 1.00 84.03 28 A 1 ATOM 209 C C . GLY A 0 28 . 4.914 8.563 -0.291 1.00 84.03 28 A 1 ATOM 210 O O . GLY A 0 28 . 3.950 8.876 0.407 1.00 84.03 28 A 1 ATOM 211 N N . HIS A 0 29 . 4.774 8.213 -1.571 1.00 88.02 29 A 1 ATOM 212 C CA . HIS A 0 29 . 3.488 8.138 -2.269 1.00 88.02 29 A 1 ATOM 213 C C . HIS A 0 29 . 3.503 7.066 -3.368 1.00 88.02 29 A 1 ATOM 214 C CB . HIS A 0 29 . 3.122 9.518 -2.835 1.00 88.02 29 A 1 ATOM 215 O O . HIS A 0 29 . 4.556 6.675 -3.872 1.00 88.02 29 A 1 ATOM 216 C CG . HIS A 0 29 . 4.042 9.990 -3.929 1.00 88.02 29 A 1 ATOM 217 C CD2 . HIS A 0 29 . 3.775 9.964 -5.269 1.00 88.02 29 A 1 ATOM 218 N ND1 . HIS A 0 29 . 5.301 10.528 -3.773 1.00 88.02 29 A 1 ATOM 219 C CE1 . HIS A 0 29 . 5.772 10.831 -4.992 1.00 88.02 29 A 1 ATOM 220 N NE2 . HIS A 0 29 . 4.877 10.504 -5.938 1.00 88.02 29 A 1 ATOM 221 N N . PHE A 0 30 . 2.320 6.588 -3.759 1.00 84.36 30 A 1 ATOM 222 C CA . PHE A 0 30 . 2.169 5.673 -4.893 1.00 84.36 30 A 1 ATOM 223 C C . PHE A 0 30 . 1.931 6.446 -6.193 1.00 84.36 30 A 1 ATOM 224 C CB . PHE A 0 30 . 1.027 4.686 -4.615 1.00 84.36 30 A 1 ATOM 225 O O . PHE A 0 30 . 1.479 7.586 -6.169 1.00 84.36 30 A 1 ATOM 226 C CG . PHE A 0 30 . 1.307 3.739 -3.466 1.00 84.36 30 A 1 ATOM 227 C CD1 . PHE A 0 30 . 2.243 2.698 -3.621 1.00 84.36 30 A 1 ATOM 228 C CD2 . PHE A 0 30 . 0.640 3.900 -2.238 1.00 84.36 30 A 1 ATOM 229 C CE1 . PHE A 0 30 . 2.516 1.824 -2.555 1.00 84.36 30 A 1 ATOM 230 C CE2 . PHE A 0 30 . 0.899 3.014 -1.177 1.00 84.36 30 A 1 ATOM 231 C CZ . PHE A 0 30 . 1.843 1.981 -1.331 1.00 84.36 30 A 1 ATOM 232 N N . ALA A 0 31 . 2.120 5.789 -7.343 1.00 83.43 31 A 1 ATOM 233 C CA . ALA A 0 31 . 1.830 6.372 -8.660 1.00 83.43 31 A 1 ATOM 234 C C . ALA A 0 31 . 0.389 6.901 -8.807 1.00 83.43 31 A 1 ATOM 235 C CB . ALA A 0 31 . 2.143 5.314 -9.724 1.00 83.43 31 A 1 ATOM 236 O O . ALA A 0 31 . 0.140 7.780 -9.622 1.00 83.43 31 A 1 ATOM 237 N N . ARG A 0 32 . -0.552 6.397 -7.995 1.00 82.12 32 A 1 ATOM 238 C CA . ARG A 0 32 . -1.948 6.862 -7.958 1.00 82.12 32 A 1 ATOM 239 C C . ARG A 0 32 . -2.128 8.226 -7.288 1.00 82.12 32 A 1 ATOM 240 C CB . ARG A 0 32 . -2.829 5.834 -7.236 1.00 82.12 32 A 1 ATOM 241 O O . ARG A 0 32 . -3.088 8.912 -7.610 1.00 82.12 32 A 1 ATOM 242 C CG . ARG A 0 32 . -2.793 4.450 -7.902 1.00 82.12 32 A 1 ATOM 243 C CD . ARG A 0 32 . -3.838 3.512 -7.290 1.00 82.12 32 A 1 ATOM 244 N NE . ARG A 0 32 . -5.205 3.911 -7.673 1.00 82.12 32 A 1 ATOM 245 N NH1 . ARG A 0 32 . -6.340 2.316 -6.479 1.00 82.12 32 A 1 ATOM 246 N NH2 . ARG A 0 32 . -7.473 3.761 -7.753 1.00 82.12 32 A 1 ATOM 247 C CZ . ARG A 0 32 . -6.330 3.330 -7.300 1.00 82.12 32 A 1 ATOM 248 N N . ASP A 0 33 . -1.223 8.586 -6.380 1.00 83.92 33 A 1 ATOM 249 C CA . ASP A 0 33 . -1.266 9.810 -5.570 1.00 83.92 33 A 1 ATOM 250 C C . ASP A 0 33 . -0.170 10.806 -5.996 1.00 83.92 33 A 1 ATOM 251 C CB . ASP A 0 33 . -1.131 9.448 -4.079 1.00 83.92 33 A 1 ATOM 252 O O . ASP A 0 33 . 0.172 11.733 -5.264 1.00 83.92 33 A 1 ATOM 253 C CG . ASP A 0 33 . -2.174 8.441 -3.584 1.00 83.92 33 A 1 ATOM 254 O OD1 . ASP A 0 33 . -3.384 8.670 -3.797 1.00 83.92 33 A 1 ATOM 255 O OD2 . ASP A 0 33 . -1.750 7.416 -2.992 1.00 83.92 33 A 1 ATOM 256 N N . CYS A 0 34 . 0.449 10.583 -7.157 1.00 84.87 34 A 1 ATOM 257 C CA . CYS A 0 34 . 1.551 11.402 -7.628 1.00 84.87 34 A 1 ATOM 258 C C . CYS A 0 34 . 1.041 12.757 -8.131 1.00 84.87 34 A 1 ATOM 259 C CB . CYS A 0 34 . 2.310 10.618 -8.699 1.00 84.87 34 A 1 ATOM 260 O O . CYS A 0 34 . 0.231 12.808 -9.055 1.00 84.87 34 A 1 ATOM 261 S SG . CYS A 0 34 . 3.925 11.391 -8.905 1.00 84.87 34 A 1 ATOM 262 N N . LEU A 0 35 . 1.531 13.853 -7.541 1.00 81.71 35 A 1 ATOM 263 C CA . LEU A 0 35 . 1.190 15.214 -7.978 1.00 81.71 35 A 1 ATOM 264 C C . LEU A 0 35 . 1.739 15.532 -9.375 1.00 81.71 35 A 1 ATOM 265 C CB . LEU A 0 35 . 1.711 16.250 -6.969 1.00 81.71 35 A 1 ATOM 266 O O . LEU A 0 35 . 1.200 16.387 -10.072 1.00 81.71 35 A 1 ATOM 267 C CG . LEU A 0 35 . 0.972 16.219 -5.616 1.00 81.71 35 A 1 ATOM 268 C CD1 . LEU A 0 35 . 1.843 15.600 -4.520 1.00 81.71 35 A 1 ATOM 269 C CD2 . LEU A 0 35 . 0.590 17.633 -5.180 1.00 81.71 35 A 1 ATOM 270 N N . THR A 0 36 . 2.795 14.831 -9.783 1.00 75.39 36 A 1 ATOM 271 C CA . THR A 0 36 . 3.373 14.905 -11.120 1.00 75.39 36 A 1 ATOM 272 C C . THR A 0 36 . 3.161 13.565 -11.816 1.00 75.39 36 A 1 ATOM 273 C CB . THR A 0 36 . 4.861 15.291 -11.061 1.00 75.39 36 A 1 ATOM 274 O O . THR A 0 36 . 3.961 12.650 -11.627 1.00 75.39 36 A 1 ATOM 275 C CG2 . THR A 0 36 . 5.030 16.741 -10.609 1.00 75.39 36 A 1 ATOM 276 O OG1 . THR A 0 36 . 5.596 14.513 -10.140 1.00 75.39 36 A 1 ATOM 277 N N . PRO A 0 37 . 2.098 13.387 -12.620 1.00 66.08 37 A 1 ATOM 278 C CA . PRO A 0 37 . 1.977 12.200 -13.453 1.00 66.08 37 A 1 ATOM 279 C C . PRO A 0 37 . 3.098 12.247 -14.494 1.00 66.08 37 A 1 ATOM 280 C CB . PRO A 0 37 . 0.566 12.260 -14.046 1.00 66.08 37 A 1 ATOM 281 O O . PRO A 0 37 . 2.944 12.815 -15.574 1.00 66.08 37 A 1 ATOM 282 C CG . PRO A 0 37 . 0.258 13.757 -14.087 1.00 66.08 37 A 1 ATOM 283 C CD . PRO A 0 37 . 1.003 14.314 -12.874 1.00 66.08 37 A 1 ATOM 284 N N . HIS A 0 38 . 4.264 11.704 -14.148 1.00 61.85 38 A 1 ATOM 285 C CA . HIS A 0 38 . 5.355 11.605 -15.089 1.00 61.85 38 A 1 ATOM 286 C C . HIS A 0 38 . 4.961 10.544 -16.104 1.00 61.85 38 A 1 ATOM 287 C CB . HIS A 0 38 . 6.716 11.363 -14.432 1.00 61.85 38 A 1 ATOM 288 O O . HIS A 0 38 . 4.620 9.401 -15.762 1.00 61.85 38 A 1 ATOM 289 C CG . HIS A 0 38 . 7.775 12.247 -15.036 1.00 61.85 38 A 1 ATOM 290 C CD2 . HIS A 0 38 . 8.352 13.340 -14.447 1.00 61.85 38 A 1 ATOM 291 N ND1 . HIS A 0 38 . 8.290 12.152 -16.311 1.00 61.85 38 A 1 ATOM 292 C CE1 . HIS A 0 38 . 9.159 13.164 -16.482 1.00 61.85 38 A 1 ATOM 293 N NE2 . HIS A 0 38 . 9.221 13.918 -15.373 1.00 61.85 38 A 1 ATOM 294 N N . GLN A 0 39 . 4.933 11.008 -17.349 1.00 58.74 39 A 1 ATOM 295 C CA . GLN A 0 39 . 4.690 10.229 -18.542 1.00 58.74 39 A 1 ATOM 296 C C . GLN A 0 39 . 5.587 9.004 -18.495 1.00 58.74 39 A 1 ATOM 297 C CB . GLN A 0 39 . 4.977 11.095 -19.775 1.00 58.74 39 A 1 ATOM 298 O O . GLN A 0 39 . 6.721 9.083 -18.023 1.00 58.74 39 A 1 ATOM 299 C CG . GLN A 0 39 . 4.006 12.287 -19.859 1.00 58.74 39 A 1 ATOM 300 C CD . GLN A 0 39 . 4.324 13.235 -21.008 1.00 58.74 39 A 1 ATOM 301 N NE2 . GLN A 0 39 . 3.627 14.343 -21.118 1.00 58.74 39 A 1 ATOM 302 O OE1 . GLN A 0 39 . 5.190 13.007 -21.829 1.00 58.74 39 A 1 ATOM 303 N N . ARG A 0 40 . 4.997 7.886 -18.914 1.00 53.50 40 A 1 ATOM 304 C CA . ARG A 0 40 . 5.595 6.565 -19.085 1.00 53.50 40 A 1 ATOM 305 C C . ARG A 0 40 . 7.132 6.620 -19.144 1.00 53.50 40 A 1 ATOM 306 C CB . ARG A 0 40 . 5.095 6.022 -20.426 1.00 53.50 40 A 1 ATOM 307 O O . ARG A 0 40 . 7.640 7.428 -19.920 1.00 53.50 40 A 1 ATOM 308 C CG . ARG A 0 40 . 3.575 5.823 -20.504 1.00 53.50 40 A 1 ATOM 309 C CD . ARG A 0 40 . 3.161 5.623 -21.964 1.00 53.50 40 A 1 ATOM 310 N NE . ARG A 0 40 . 2.158 4.552 -22.101 1.00 53.50 40 A 1 ATOM 311 N NH1 . ARG A 0 40 . 3.477 3.084 -23.299 1.00 53.50 40 A 1 ATOM 312 N NH2 . ARG A 0 40 . 1.344 2.589 -22.907 1.00 53.50 40 A 1 ATOM 313 C CZ . ARG A 0 40 . 2.337 3.424 -22.767 1.00 53.50 40 A 1 ATOM 314 N N . PRO A 0 41 . 7.865 5.725 -18.458 1.00 56.88 41 A 1 ATOM 315 C CA . PRO A 0 41 . 9.327 5.594 -18.581 1.00 56.88 41 A 1 ATOM 316 C C . PRO A 0 41 . 9.824 5.210 -20.001 1.00 56.88 41 A 1 ATOM 317 C CB . PRO A 0 41 . 9.723 4.584 -17.492 1.00 56.88 41 A 1 ATOM 318 O O . PRO A 0 41 . 10.927 4.704 -20.160 1.00 56.88 41 A 1 ATOM 319 C CG . PRO A 0 41 . 8.471 3.731 -17.313 1.00 56.88 41 A 1 ATOM 320 C CD . PRO A 0 41 . 7.339 4.725 -17.541 1.00 56.88 41 A 1 ATOM 321 N N . ASP A 0 42 . 9.017 5.468 -21.029 1.00 54.81 42 A 1 ATOM 322 C CA . ASP A 0 42 . 9.250 5.265 -22.450 1.00 54.81 42 A 1 ATOM 323 C C . ASP A 0 42 . 9.669 6.568 -23.180 1.00 54.81 42 A 1 ATOM 324 C CB . ASP A 0 42 . 7.956 4.709 -23.085 1.00 54.81 42 A 1 ATOM 325 O O . ASP A 0 42 . 9.836 6.530 -24.393 1.00 54.81 42 A 1 ATOM 326 C CG . ASP A 0 42 . 7.366 3.440 -22.448 1.00 54.81 42 A 1 ATOM 327 O OD1 . ASP A 0 42 . 8.115 2.475 -22.187 1.00 54.81 42 A 1 ATOM 328 O OD2 . ASP A 0 42 . 6.113 3.413 -22.282 1.00 54.81 42 A 1 ATOM 329 N N . ALA A 0 43 . 9.811 7.724 -22.507 1.00 56.55 43 A 1 ATOM 330 C CA . ALA A 0 43 . 10.151 8.987 -23.191 1.00 56.55 43 A 1 ATOM 331 C C . ALA A 0 43 . 11.632 9.104 -23.623 1.00 56.55 43 A 1 ATOM 332 C CB . ALA A 0 43 . 9.699 10.173 -22.331 1.00 56.55 43 A 1 ATOM 333 O O . ALA A 0 43 . 11.928 9.874 -24.530 1.00 56.55 43 A 1 ATOM 334 N N . ASP A 0 44 . 12.529 8.294 -23.049 1.00 59.01 44 A 1 ATOM 335 C CA . ASP A 0 44 . 13.963 8.241 -23.401 1.00 59.01 44 A 1 ATOM 336 C C . ASP A 0 44 . 14.410 6.843 -23.881 1.00 59.01 44 A 1 ATOM 337 C CB . ASP A 0 44 . 14.804 8.731 -22.213 1.00 59.01 44 A 1 ATOM 338 O O . ASP A 0 44 . 15.600 6.551 -23.998 1.00 59.01 44 A 1 ATOM 339 C CG . ASP A 0 44 . 14.595 10.221 -21.945 1.00 59.01 44 A 1 ATOM 340 O OD1 . ASP A 0 44 . 15.177 11.029 -22.701 1.00 59.01 44 A 1 ATOM 341 O OD2 . ASP A 0 44 . 13.872 10.529 -20.968 1.00 59.01 44 A 1 ATOM 342 N N . GLY A 0 45 . 13.456 5.944 -24.147 1.00 56.82 45 A 1 ATOM 343 C CA . GLY A 0 45 . 13.720 4.621 -24.710 1.00 56.82 45 A 1 ATOM 344 C C . GLY A 0 45 . 13.386 4.601 -26.202 1.00 56.82 45 A 1 ATOM 345 O O . GLY A 0 45 . 12.313 5.081 -26.570 1.00 56.82 45 A 1 ATOM 346 N N . PRO A 0 46 . 14.243 4.043 -27.082 1.00 59.80 46 A 1 ATOM 347 C CA . PRO A 0 46 . 13.911 3.934 -28.497 1.00 59.80 46 A 1 ATOM 348 C C . PRO A 0 46 . 12.580 3.182 -28.656 1.00 59.80 46 A 1 ATOM 349 C CB . PRO A 0 46 . 15.087 3.204 -29.156 1.00 59.80 46 A 1 ATOM 350 O O . PRO A 0 46 . 12.324 2.231 -27.904 1.00 59.80 46 A 1 ATOM 351 C CG . PRO A 0 46 . 15.714 2.424 -28.000 1.00 59.80 46 A 1 ATOM 352 C CD . PRO A 0 46 . 15.470 3.324 -26.789 1.00 59.80 46 A 1 ATOM 353 N N . PRO A 0 47 . 11.719 3.585 -29.613 1.00 59.39 47 A 1 ATOM 354 C CA . PRO A 0 47 . 10.480 2.870 -29.875 1.00 59.39 47 A 1 ATOM 355 C C . PRO A 0 47 . 10.827 1.401 -30.093 1.00 59.39 47 A 1 ATOM 356 C CB . PRO A 0 47 . 9.869 3.526 -31.120 1.00 59.39 47 A 1 ATOM 357 O O . PRO A 0 47 . 11.774 1.091 -30.817 1.00 59.39 47 A 1 ATOM 358 C CG . PRO A 0 47 . 11.071 4.158 -31.823 1.00 59.39 47 A 1 ATOM 359 C CD . PRO A 0 47 . 11.975 4.560 -30.660 1.00 59.39 47 A 1 ATOM 360 N N . ARG A 0 48 . 10.090 0.491 -29.444 1.00 50.88 48 A 1 ATOM 361 C CA . ARG A 0 48 . 10.195 -0.941 -29.737 1.00 50.88 48 A 1 ATOM 362 C C . ARG A 0 48 . 9.795 -1.148 -31.197 1.00 50.88 48 A 1 ATOM 363 C CB . ARG A 0 48 . 9.343 -1.784 -28.774 1.00 50.88 48 A 1 ATOM 364 O O . ARG A 0 48 . 8.617 -1.314 -31.501 1.00 50.88 48 A 1 ATOM 365 C CG . ARG A 0 48 . 9.943 -1.830 -27.363 1.00 50.88 48 A 1 ATOM 366 C CD . ARG A 0 48 . 9.224 -2.886 -26.516 1.00 50.88 48 A 1 ATOM 367 N NE . ARG A 0 48 . 9.867 -3.041 -25.200 1.00 50.88 48 A 1 ATOM 368 N NH1 . ARG A 0 48 . 8.395 -4.567 -24.319 1.00 50.88 48 A 1 ATOM 369 N NH2 . ARG A 0 48 . 10.141 -3.882 -23.104 1.00 50.88 48 A 1 ATOM 370 C CZ . ARG A 0 48 . 9.466 -3.827 -24.217 1.00 50.88 48 A 1 ATOM 371 N N . ALA A 0 49 . 10.784 -1.067 -32.079 1.00 57.12 49 A 1 ATOM 372 C CA . ALA A 0 49 . 10.691 -1.438 -33.470 1.00 57.12 49 A 1 ATOM 373 C C . ALA A 0 49 . 10.385 -2.940 -33.533 1.00 57.12 49 A 1 ATOM 374 C CB . ALA A 0 49 . 11.999 -1.056 -34.175 1.00 57.12 49 A 1 ATOM 375 O O . ALA A 0 49 . 11.081 -3.751 -32.926 1.00 57.12 49 A 1 ATOM 376 N N . ASP A 0 50 . 9.290 -3.251 -34.221 1.00 59.22 50 A 1 ATOM 377 C CA . ASP A 0 50 . 9.044 -4.490 -34.953 1.00 59.22 50 A 1 ATOM 378 C C . ASP A 0 50 . 9.363 -5.828 -34.276 1.00 59.22 50 A 1 ATOM 379 C CB . ASP A 0 50 . 9.812 -4.389 -36.282 1.00 59.22 50 A 1 ATOM 380 O O . ASP A 0 50 . 10.481 -6.301 -34.391 1.00 59.22 50 A 1 ATOM 381 C CG . ASP A 0 50 . 9.156 -3.360 -37.183 1.00 59.22 50 A 1 ATOM 382 O OD1 . ASP A 0 50 . 8.092 -3.728 -37.732 1.00 59.22 50 A 1 ATOM 383 O OD2 . ASP A 0 50 . 9.654 -2.216 -37.231 1.00 59.22 50 A 1 ATOM 384 N N . VAL A 0 51 . 8.343 -6.548 -33.779 1.00 55.83 51 A 1 ATOM 385 C CA . VAL A 0 51 . 8.171 -7.982 -34.114 1.00 55.83 51 A 1 ATOM 386 C C . VAL A 0 51 . 6.677 -8.363 -34.085 1.00 55.83 51 A 1 ATOM 387 C CB . VAL A 0 51 . 9.000 -8.983 -33.254 1.00 55.83 51 A 1 ATOM 388 O O . VAL A 0 51 . 6.100 -8.634 -33.038 1.00 55.83 51 A 1 ATOM 389 C CG1 . VAL A 0 51 . 8.809 -10.422 -33.768 1.00 55.83 51 A 1 ATOM 390 C CG2 . VAL A 0 51 . 10.526 -8.822 -33.262 1.00 55.83 51 A 1 ATOM 391 N N . ARG A 0 52 . 6.096 -8.446 -35.292 1.00 49.71 52 A 1 ATOM 392 C CA . ARG A 0 52 . 4.976 -9.312 -35.731 1.00 49.71 52 A 1 ATOM 393 C C . ARG A 0 52 . 3.595 -9.106 -35.077 1.00 49.71 52 A 1 ATOM 394 C CB . ARG A 0 52 . 5.410 -10.791 -35.660 1.00 49.71 52 A 1 ATOM 395 O O . ARG A 0 52 . 3.280 -9.650 -34.021 1.00 49.71 52 A 1 ATOM 396 C CG . ARG A 0 52 . 6.697 -11.140 -36.434 1.00 49.71 52 A 1 ATOM 397 C CD . ARG A 0 52 . 6.482 -11.384 -37.929 1.00 49.71 52 A 1 ATOM 398 N NE . ARG A 0 52 . 7.768 -11.657 -38.602 1.00 49.71 52 A 1 ATOM 399 N NH1 . ARG A 0 52 . 6.941 -12.134 -40.691 1.00 49.71 52 A 1 ATOM 400 N NH2 . ARG A 0 52 . 9.145 -12.130 -40.356 1.00 49.71 52 A 1 ATOM 401 C CZ . ARG A 0 52 . 7.944 -11.973 -39.874 1.00 49.71 52 A 1 ATOM 402 N N . ARG A 0 53 . 2.713 -8.455 -35.852 1.00 50.16 53 A 1 ATOM 403 C CA . ARG A 0 53 . 1.252 -8.649 -35.827 1.00 50.16 53 A 1 ATOM 404 C C . ARG A 0 53 . 0.924 -10.140 -35.688 1.00 50.16 53 A 1 ATOM 405 C CB . ARG A 0 53 . 0.626 -8.177 -37.157 1.00 50.16 53 A 1 ATOM 406 O O . ARG A 0 53 . 1.259 -10.923 -36.574 1.00 50.16 53 A 1 ATOM 407 C CG . ARG A 0 53 . 0.525 -6.660 -37.358 1.00 50.16 53 A 1 ATOM 408 C CD . ARG A 0 53 . -0.269 -6.399 -38.648 1.00 50.16 53 A 1 ATOM 409 N NE . ARG A 0 53 . -0.463 -4.961 -38.912 1.00 50.16 53 A 1 ATOM 410 N NH1 . ARG A 0 53 . -2.136 -5.195 -40.473 1.00 50.16 53 A 1 ATOM 411 N NH2 . ARG A 0 53 . -1.402 -3.157 -39.942 1.00 50.16 53 A 1 ATOM 412 C CZ . ARG A 0 53 . -1.329 -4.447 -39.771 1.00 50.16 53 A 1 ATOM 413 N N . ARG A 0 54 . 0.253 -10.513 -34.601 1.00 54.93 54 A 1 ATOM 414 C CA . ARG A 0 54 . -0.498 -11.762 -34.518 1.00 54.93 54 A 1 ATOM 415 C C . ARG A 0 54 . -1.953 -11.388 -34.315 1.00 54.93 54 A 1 ATOM 416 C CB . ARG A 0 54 . 0.081 -12.692 -33.438 1.00 54.93 54 A 1 ATOM 417 O O . ARG A 0 54 . -2.351 -10.999 -33.221 1.00 54.93 54 A 1 ATOM 418 C CG . ARG A 0 54 . -0.381 -14.139 -33.669 1.00 54.93 54 A 1 ATOM 419 C CD . ARG A 0 54 . 0.284 -15.101 -32.676 1.00 54.93 54 A 1 ATOM 420 N NE . ARG A 0 54 . 0.319 -16.478 -33.208 1.00 54.93 54 A 1 ATOM 421 N NH1 . ARG A 0 54 . 0.972 -17.553 -31.288 1.00 54.93 54 A 1 ATOM 422 N NH2 . ARG A 0 54 . 0.761 -18.713 -33.182 1.00 54.93 54 A 1 ATOM 423 C CZ . ARG A 0 54 . 0.682 -17.570 -32.559 1.00 54.93 54 A 1 ATOM 424 N N . ASP A 0 55 . -2.694 -11.444 -35.412 1.00 57.31 55 A 1 ATOM 425 C CA . ASP A 0 55 . -4.147 -11.449 -35.452 1.00 57.31 55 A 1 ATOM 426 C C . ASP A 0 55 . -4.667 -12.436 -34.396 1.00 57.31 55 A 1 ATOM 427 C CB . ASP A 0 55 . -4.575 -11.852 -36.874 1.00 57.31 55 A 1 ATOM 428 O O . ASP A 0 55 . -4.374 -13.631 -34.435 1.00 57.31 55 A 1 ATOM 429 C CG . ASP A 0 55 . -3.983 -10.892 -37.911 1.00 57.31 55 A 1 ATOM 430 O OD1 . ASP A 0 55 . -4.645 -9.872 -38.197 1.00 57.31 55 A 1 ATOM 431 O OD2 . ASP A 0 55 . -2.820 -11.127 -38.315 1.00 57.31 55 A 1 ATOM 432 N N . GLY A 0 56 . -5.358 -11.925 -33.380 1.00 52.62 56 A 1 ATOM 433 C CA . GLY A 0 56 . -5.801 -12.730 -32.247 1.00 52.62 56 A 1 ATOM 434 C C . GLY A 0 56 . -6.662 -11.899 -31.314 1.00 52.62 56 A 1 ATOM 435 O O . GLY A 0 56 . -6.154 -11.090 -30.545 1.00 52.62 56 A 1 ATOM 436 N N . GLY A 0 57 . -7.974 -12.063 -31.457 1.00 54.63 57 A 1 ATOM 437 C CA . GLY A 0 57 . -9.001 -11.233 -30.846 1.00 54.63 57 A 1 ATOM 438 C C . GLY A 0 57 . -8.982 -11.166 -29.317 1.00 54.63 57 A 1 ATOM 439 O O . GLY A 0 57 . -8.661 -12.123 -28.618 1.00 54.63 57 A 1 ATOM 440 N N . GLY A 0 58 . -9.423 -10.014 -28.815 1.00 54.14 58 A 1 ATOM 441 C CA . GLY A 0 58 . -9.746 -9.764 -27.415 1.00 54.14 58 A 1 ATOM 442 C C . GLY A 0 58 . -10.929 -8.807 -27.343 1.00 54.14 58 A 1 ATOM 443 O O . GLY A 0 58 . -10.757 -7.614 -27.122 1.00 54.14 58 A 1 ATOM 444 N N . GLY A 0 59 . -12.131 -9.324 -27.603 1.00 54.23 59 A 1 ATOM 445 C CA . GLY A 0 59 . -13.380 -8.632 -27.303 1.00 54.23 59 A 1 ATOM 446 C C . GLY A 0 59 . -13.792 -8.884 -25.852 1.00 54.23 59 A 1 ATOM 447 O O . GLY A 0 59 . -13.780 -10.031 -25.414 1.00 54.23 59 A 1 ATOM 448 N N . SER A 0 60 . -14.135 -7.818 -25.124 1.00 60.00 60 A 1 ATOM 449 C CA . SER A 0 60 . -15.057 -7.741 -23.964 1.00 60.00 60 A 1 ATOM 450 C C . SER A 0 60 . -14.721 -6.454 -23.213 1.00 60.00 60 A 1 ATOM 451 C CB . SER A 0 60 . -14.931 -8.912 -22.981 1.00 60.00 60 A 1 ATOM 452 O O . SER A 0 60 . -13.673 -6.350 -22.592 1.00 60.00 60 A 1 ATOM 453 O OG . SER A 0 60 . -15.645 -10.015 -23.493 1.00 60.00 60 A 1 ATOM 454 N N . GLY A 0 61 . -15.463 -5.368 -23.385 1.00 55.91 61 A 1 ATOM 455 C CA . GLY A 0 61 . -16.764 -5.104 -22.763 1.00 55.91 61 A 1 ATOM 456 C C . GLY A 0 61 . -16.672 -3.645 -22.280 1.00 55.91 61 A 1 ATOM 457 O O . GLY A 0 61 . -15.627 -3.229 -21.800 1.00 55.91 61 A 1 ATOM 458 N N . GLY A 0 62 . -17.619 -2.744 -22.510 1.00 54.48 62 A 1 ATOM 459 C CA . GLY A 0 62 . -19.051 -2.903 -22.317 1.00 54.48 62 A 1 ATOM 460 C C . GLY A 0 62 . -19.424 -2.240 -20.988 1.00 54.48 62 A 1 ATOM 461 O O . GLY A 0 62 . -19.306 -2.863 -19.941 1.00 54.48 62 A 1 ATOM 462 N N . GLY A 0 63 . -19.872 -0.981 -21.043 1.00 55.41 63 A 1 ATOM 463 C CA . GLY A 0 63 . -20.442 -0.236 -19.912 1.00 55.41 63 A 1 ATOM 464 C C . GLY A 0 63 . -19.500 0.834 -19.345 1.00 55.41 63 A 1 ATOM 465 O O . GLY A 0 63 . -18.344 0.583 -19.060 1.00 55.41 63 A 1 ATOM 466 N N . GLY A 0 64 . -19.900 2.078 -19.136 1.00 56.71 64 A 1 ATOM 467 C CA . GLY A 0 64 . -21.215 2.676 -19.230 1.00 56.71 64 A 1 ATOM 468 C C . GLY A 0 64 . -21.117 4.099 -18.688 1.00 56.71 64 A 1 ATOM 469 O O . GLY A 0 64 . -20.519 4.349 -17.645 1.00 56.71 64 A 1 ATOM 470 N N . SER A 0 65 . -21.702 5.013 -19.452 1.00 60.54 65 A 1 ATOM 471 C CA . SER A 0 65 . -22.079 6.384 -19.121 1.00 60.54 65 A 1 ATOM 472 C C . SER A 0 65 . -22.169 6.710 -17.625 1.00 60.54 65 A 1 ATOM 473 C CB . SER A 0 65 . -23.469 6.571 -19.741 1.00 60.54 65 A 1 ATOM 474 O O . SER A 0 65 . -22.983 6.133 -16.906 1.00 60.54 65 A 1 ATOM 475 O OG . SER A 0 65 . -23.906 7.912 -19.672 1.00 60.54 65 A 1 ATOM 476 N N . ARG A 0 66 . -21.436 7.740 -17.189 1.00 62.03 66 A 1 ATOM 477 C CA . ARG A 0 66 . -21.919 8.679 -16.166 1.00 62.03 66 A 1 ATOM 478 C C . ARG A 0 66 . -21.218 10.037 -16.297 1.00 62.03 66 A 1 ATOM 479 C CB . ARG A 0 66 . -21.869 8.057 -14.749 1.00 62.03 66 A 1 ATOM 480 O O . ARG A 0 66 . -20.256 10.344 -15.612 1.00 62.03 66 A 1 ATOM 481 C CG . ARG A 0 66 . -23.296 7.765 -14.242 1.00 62.03 66 A 1 ATOM 482 C CD . ARG A 0 66 . -23.355 7.129 -12.850 1.00 62.03 66 A 1 ATOM 483 N NE . ARG A 0 66 . -23.119 5.669 -12.864 1.00 62.03 66 A 1 ATOM 484 N NH1 . ARG A 0 66 . -24.844 5.029 -11.469 1.00 62.03 66 A 1 ATOM 485 N NH2 . ARG A 0 66 . -23.395 3.506 -12.190 1.00 62.03 66 A 1 ATOM 486 C CZ . ARG A 0 66 . -23.784 4.749 -12.179 1.00 62.03 66 A 1 ATOM 487 N N . ARG A 0 67 . -21.752 10.817 -17.242 1.00 58.87 67 A 1 ATOM 488 C CA . ARG A 0 67 . -21.991 12.271 -17.195 1.00 58.87 67 A 1 ATOM 489 C C . ARG A 0 67 . -21.129 13.049 -16.185 1.00 58.87 67 A 1 ATOM 490 C CB . ARG A 0 67 . -23.490 12.510 -16.896 1.00 58.87 67 A 1 ATOM 491 O O . ARG A 0 67 . -21.485 13.134 -15.011 1.00 58.87 67 A 1 ATOM 492 C CG . ARG A 0 67 . -24.461 11.754 -17.823 1.00 58.87 67 A 1 ATOM 493 C CD . ARG A 0 67 . -25.924 12.087 -17.489 1.00 58.87 67 A 1 ATOM 494 N NE . ARG A 0 67 . -26.786 10.885 -17.544 1.00 58.87 67 A 1 ATOM 495 N NH1 . ARG A 0 67 . -28.534 11.708 -18.805 1.00 58.87 67 A 1 ATOM 496 N NH2 . ARG A 0 67 . -28.647 9.645 -17.977 1.00 58.87 67 A 1 ATOM 497 C CZ . ARG A 0 67 . -27.978 10.757 -18.106 1.00 58.87 67 A 1 ATOM 498 N N . GLY A 0 68 . -20.098 13.731 -16.680 1.00 57.40 68 A 1 ATOM 499 C CA . GLY A 0 68 . -19.628 14.962 -16.053 1.00 57.40 68 A 1 ATOM 500 C C . GLY A 0 68 . -20.743 16.001 -16.152 1.00 57.40 68 A 1 ATOM 501 O O . GLY A 0 68 . -20.963 16.576 -17.213 1.00 57.40 68 A 1 ATOM 502 N N . ARG A 0 69 . -21.510 16.179 -15.075 1.00 62.12 69 A 1 ATOM 503 C CA . ARG A 0 69 . -22.360 17.358 -14.900 1.00 62.12 69 A 1 ATOM 504 C C . ARG A 0 69 . -21.515 18.397 -14.182 1.00 62.12 69 A 1 ATOM 505 C CB . ARG A 0 69 . -23.648 17.038 -14.125 1.00 62.12 69 A 1 ATOM 506 O O . ARG A 0 69 . -21.130 18.193 -13.034 1.00 62.12 69 A 1 ATOM 507 C CG . ARG A 0 69 . -24.695 16.347 -15.010 1.00 62.12 69 A 1 ATOM 508 C CD . ARG A 0 69 . -25.976 16.094 -14.205 1.00 62.12 69 A 1 ATOM 509 N NE . ARG A 0 69 . -26.993 15.369 -14.996 1.00 62.12 69 A 1 ATOM 510 N NH1 . ARG A 0 69 . -28.403 14.852 -13.254 1.00 62.12 69 A 1 ATOM 511 N NH2 . ARG A 0 69 . -28.930 14.205 -15.317 1.00 62.12 69 A 1 ATOM 512 C CZ . ARG A 0 69 . -28.095 14.810 -14.520 1.00 62.12 69 A 1 ATOM 513 N N . THR A 0 70 . -21.218 19.482 -14.880 1.00 62.95 70 A 1 ATOM 514 C CA . THR A 0 70 . -20.823 20.746 -14.270 1.00 62.95 70 A 1 ATOM 515 C C . THR A 0 70 . -21.906 21.164 -13.273 1.00 62.95 70 A 1 ATOM 516 C CB . THR A 0 70 . -20.641 21.812 -15.367 1.00 62.95 70 A 1 ATOM 517 O O . THR A 0 70 . -23.103 21.045 -13.548 1.00 62.95 70 A 1 ATOM 518 C CG2 . THR A 0 70 . -19.322 21.610 -16.113 1.00 62.95 70 A 1 ATOM 519 O OG1 . THR A 0 70 . -21.660 21.699 -16.339 1.00 62.95 70 A 1 ATOM 520 N N . PHE A 0 71 . -21.499 21.603 -12.084 1.00 61.35 71 A 1 ATOM 521 C CA . PHE A 0 71 . -22.413 22.190 -11.110 1.00 61.35 71 A 1 ATOM 522 C C . PHE A 0 71 . -22.825 23.575 -11.624 1.00 61.35 71 A 1 ATOM 523 C CB . PHE A 0 71 . -21.745 22.257 -9.724 1.00 61.35 71 A 1 ATOM 524 O O . PHE A 0 71 . -22.140 24.559 -11.375 1.00 61.35 71 A 1 ATOM 525 C CG . PHE A 0 71 . -21.479 20.912 -9.070 1.00 61.35 71 A 1 ATOM 526 C CD1 . PHE A 0 71 . -22.460 20.317 -8.255 1.00 61.35 71 A 1 ATOM 527 C CD2 . PHE A 0 71 . -20.240 20.267 -9.249 1.00 61.35 71 A 1 ATOM 528 C CE1 . PHE A 0 71 . -22.206 19.085 -7.624 1.00 61.35 71 A 1 ATOM 529 C CE2 . PHE A 0 71 . -19.987 19.034 -8.623 1.00 61.35 71 A 1 ATOM 530 C CZ . PHE A 0 71 . -20.969 18.443 -7.809 1.00 61.35 71 A 1 ATOM 531 N N . ALA A 0 72 . -23.916 23.650 -12.384 1.00 58.15 72 A 1 ATOM 532 C CA . ALA A 0 72 . -24.623 24.905 -12.599 1.00 58.15 72 A 1 ATOM 533 C C . ALA A 0 72 . -25.610 25.084 -11.440 1.00 58.15 72 A 1 ATOM 534 C CB . ALA A 0 72 . -25.300 24.897 -13.974 1.00 58.15 72 A 1 ATOM 535 O O . ALA A 0 72 . -26.488 24.244 -11.228 1.00 58.15 72 A 1 ATOM 536 N N . VAL A 0 73 . -25.437 26.153 -10.664 1.00 56.75 73 A 1 ATOM 537 C CA . VAL A 0 73 . -26.413 26.565 -9.652 1.00 56.75 73 A 1 ATOM 538 C C . VAL A 0 73 . -27.588 27.174 -10.420 1.00 56.75 73 A 1 ATOM 539 C CB . VAL A 0 73 . -25.808 27.482 -8.550 1.00 56.75 73 A 1 ATOM 540 O O . VAL A 0 73 . -27.421 28.159 -11.133 1.00 56.75 73 A 1 ATOM 541 C CG1 . VAL A 0 73 . -24.300 27.251 -8.352 1.00 56.75 73 A 1 ATOM 542 C CG2 . VAL A 0 73 . -26.011 28.993 -8.720 1.00 56.75 73 A 1 ATOM 543 N N . ALA A 0 74 . -28.758 26.549 -10.354 1.00 55.13 74 A 1 ATOM 544 C CA . ALA A 0 74 . -29.980 27.087 -10.936 1.00 55.13 74 A 1 ATOM 545 C C . ALA A 0 74 . -31.010 27.218 -9.816 1.00 55.13 74 A 1 ATOM 546 C CB . ALA A 0 74 . -30.443 26.209 -12.105 1.00 55.13 74 A 1 ATOM 547 O O . ALA A 0 74 . -31.570 26.229 -9.341 1.00 55.13 74 A 1 ATOM 548 N N . THR A 0 75 . -31.211 28.451 -9.366 1.00 57.05 75 A 1 ATOM 549 C CA . THR A 0 75 . -32.275 28.829 -8.439 1.00 57.05 75 A 1 ATOM 550 C C . THR A 0 75 . -33.589 28.808 -9.216 1.00 57.05 75 A 1 ATOM 551 C CB . THR A 0 75 . -32.002 30.228 -7.854 1.00 57.05 75 A 1 ATOM 552 O O . THR A 0 75 . -33.828 29.674 -10.051 1.00 57.05 75 A 1 ATOM 553 C CG2 . THR A 0 75 . -32.802 30.476 -6.578 1.00 57.05 75 A 1 ATOM 554 O OG1 . THR A 0 75 . -30.639 30.361 -7.514 1.00 57.05 75 A 1 ATOM 555 N N . LEU A 0 76 . -34.421 27.793 -8.994 1.00 59.53 76 A 1 ATOM 556 C CA . LEU A 0 76 . -35.726 27.645 -9.639 1.00 59.53 76 A 1 ATOM 557 C C . LEU A 0 76 . -36.816 27.731 -8.561 1.00 59.53 76 A 1 ATOM 558 C CB . LEU A 0 76 . -35.717 26.351 -10.477 1.00 59.53 76 A 1 ATOM 559 O O . LEU A 0 76 . -37.038 26.801 -7.790 1.00 59.53 76 A 1 ATOM 560 C CG . LEU A 0 76 . -35.094 26.537 -11.883 1.00 59.53 76 A 1 ATOM 561 C CD1 . LEU A 0 76 . -34.757 25.172 -12.481 1.00 59.53 76 A 1 ATOM 562 C CD2 . LEU A 0 76 . -35.946 27.274 -12.926 1.00 59.53 76 A 1 ATOM 563 N N . GLN A 0 77 . -37.431 28.911 -8.495 1.00 55.75 77 A 1 ATOM 564 C CA . GLN A 0 77 . -38.549 29.310 -7.642 1.00 55.75 77 A 1 ATOM 565 C C . GLN A 0 77 . -39.870 28.914 -8.319 1.00 55.75 77 A 1 ATOM 566 C CB . GLN A 0 77 . -38.423 30.845 -7.488 1.00 55.75 77 A 1 ATOM 567 O O . GLN A 0 77 . -40.183 29.482 -9.359 1.00 55.75 77 A 1 ATOM 568 C CG . GLN A 0 77 . -39.612 31.578 -6.844 1.00 55.75 77 A 1 ATOM 569 C CD . GLN A 0 77 . -39.409 33.095 -6.851 1.00 55.75 77 A 1 ATOM 570 N NE2 . GLN A 0 77 . -40.445 33.876 -7.067 1.00 55.75 77 A 1 ATOM 571 O OE1 . GLN A 0 77 . -38.321 33.609 -6.660 1.00 55.75 77 A 1 ATOM 572 N N . MET A 0 78 . -40.662 27.999 -7.740 1.00 53.49 78 A 1 ATOM 573 C CA . MET A 0 78 . -42.038 27.723 -8.200 1.00 53.49 78 A 1 ATOM 574 C C . MET A 0 78 . -43.002 27.476 -7.030 1.00 53.49 78 A 1 ATOM 575 C CB . MET A 0 78 . -42.163 26.541 -9.183 1.00 53.49 78 A 1 ATOM 576 O O . MET A 0 78 . -42.655 26.821 -6.049 1.00 53.49 78 A 1 ATOM 577 C CG . MET A 0 78 . -40.909 26.065 -9.906 1.00 53.49 78 A 1 ATOM 578 S SD . MET A 0 78 . -40.320 27.118 -11.240 1.00 53.49 78 A 1 ATOM 579 C CE . MET A 0 78 . -38.977 26.068 -11.777 1.00 53.49 78 A 1 ATOM 580 N N . SER A 0 79 . -44.204 28.020 -7.201 1.00 54.59 79 A 1 ATOM 581 C CA . SER A 0 79 . -45.310 28.299 -6.275 1.00 54.59 79 A 1 ATOM 582 C C . SER A 0 79 . -46.112 27.087 -5.746 1.00 54.59 79 A 1 ATOM 583 C CB . SER A 0 79 . -46.263 29.207 -7.070 1.00 54.59 79 A 1 ATOM 584 O O . SER A 0 79 . -46.060 26.011 -6.341 1.00 54.59 79 A 1 ATOM 585 O OG . SER A 0 79 . -45.552 30.294 -7.644 1.00 54.59 79 A 1 ATOM 586 N N . PRO A 0 80 . -46.907 27.253 -4.663 1.00 55.19 80 A 1 ATOM 587 C CA . PRO A 0 80 . -47.729 26.189 -4.085 1.00 55.19 80 A 1 ATOM 588 C C . PRO A 0 80 . -49.068 26.034 -4.828 1.00 55.19 80 A 1 ATOM 589 C CB . PRO A 0 80 . -47.932 26.606 -2.624 1.00 55.19 80 A 1 ATOM 590 O O . PRO A 0 80 . -49.745 27.023 -5.102 1.00 55.19 80 A 1 ATOM 591 C CG . PRO A 0 80 . -47.980 28.133 -2.696 1.00 55.19 80 A 1 ATOM 592 C CD . PRO A 0 80 . -47.053 28.469 -3.866 1.00 55.19 80 A 1 ATOM 593 N N . MET A 0 81 . -49.484 24.794 -5.103 1.00 57.15 81 A 1 ATOM 594 C CA . MET A 0 81 . -50.863 24.471 -5.489 1.00 57.15 81 A 1 ATOM 595 C C . MET A 0 81 . -51.571 23.753 -4.339 1.00 57.15 81 A 1 ATOM 596 C CB . MET A 0 81 . -50.932 23.658 -6.791 1.00 57.15 81 A 1 ATOM 597 O O . MET A 0 81 . -51.200 22.650 -3.942 1.00 57.15 81 A 1 ATOM 598 C CG . MET A 0 81 . -50.743 24.550 -8.025 1.00 57.15 81 A 1 ATOM 599 S SD . MET A 0 81 . -50.967 23.707 -9.618 1.00 57.15 81 A 1 ATOM 600 C CE . MET A 0 81 . -52.764 23.438 -9.629 1.00 57.15 81 A 1 ATOM 601 N N . SER A 0 82 . -52.588 24.430 -3.816 1.00 47.54 82 A 1 ATOM 602 C CA . SER A 0 82 . -53.628 23.910 -2.934 1.00 47.54 82 A 1 ATOM 603 C C . SER A 0 82 . -54.567 22.967 -3.688 1.00 47.54 82 A 1 ATOM 604 C CB . SER A 0 82 . -54.481 25.089 -2.440 1.00 47.54 82 A 1 ATOM 605 O O . SER A 0 82 . -54.899 23.236 -4.841 1.00 47.54 82 A 1 ATOM 606 O OG . SER A 0 82 . -53.689 26.044 -1.760 1.00 47.54 82 A 1 ATOM 607 N N . GLY A 0 83 . -55.113 21.968 -2.993 1.00 53.63 83 A 1 ATOM 608 C CA . GLY A 0 83 . -56.468 21.494 -3.283 1.00 53.63 83 A 1 ATOM 609 C C . GLY A 0 83 . -56.684 19.985 -3.246 1.00 53.63 83 A 1 ATOM 610 O O . GLY A 0 83 . -55.978 19.237 -3.908 1.00 53.63 83 A 1 ATOM 611 N N . THR A 0 84 . -57.749 19.624 -2.519 1.00 59.71 84 A 1 ATOM 612 C CA . THR A 0 84 . -58.547 18.378 -2.529 1.00 59.71 84 A 1 ATOM 613 C C . THR A 0 84 . -57.879 17.151 -1.891 1.00 59.71 84 A 1 ATOM 614 C CB . THR A 0 84 . -59.164 18.120 -3.918 1.00 59.71 84 A 1 ATOM 615 O O . THR A 0 84 . -56.942 16.599 -2.452 1.00 59.71 84 A 1 ATOM 616 C CG2 . THR A 0 84 . -59.935 19.348 -4.422 1.00 59.71 84 A 1 ATOM 617 O OG1 . THR A 0 84 . -58.202 17.842 -4.904 1.00 59.71 84 A 1 ATOM 618 N N . THR A 0 85 . -58.107 16.854 -0.600 1.00 54.52 85 A 1 ATOM 619 C CA . THR A 0 85 . -59.260 16.153 0.040 1.00 54.52 85 A 1 ATOM 620 C C . THR A 0 85 . -59.478 14.724 -0.456 1.00 54.52 85 A 1 ATOM 621 C CB . THR A 0 85 . -60.604 16.908 0.136 1.00 54.52 85 A 1 ATOM 622 O O . THR A 0 85 . -59.140 14.415 -1.587 1.00 54.52 85 A 1 ATOM 623 C CG2 . THR A 0 85 . -60.479 18.209 0.928 1.00 54.52 85 A 1 ATOM 624 O OG1 . THR A 0 85 . -61.154 17.197 -1.122 1.00 54.52 85 A 1 ATOM 625 N N . GLU A 0 86 . -60.106 13.907 0.402 1.00 53.72 86 A 1 ATOM 626 C CA . GLU A 0 86 . -60.533 12.504 0.218 1.00 53.72 86 A 1 ATOM 627 C C . GLU A 0 86 . -59.529 11.486 0.814 1.00 53.72 86 A 1 ATOM 628 C CB . GLU A 0 86 . -60.986 12.193 -1.221 1.00 53.72 86 A 1 ATOM 629 O O . GLU A 0 86 . -58.504 11.161 0.230 1.00 53.72 86 A 1 ATOM 630 C CG . GLU A 0 86 . -61.968 13.213 -1.845 1.00 53.72 86 A 1 ATOM 631 C CD . GLU A 0 86 . -63.409 12.941 -1.440 1.00 53.72 86 A 1 ATOM 632 O OE1 . GLU A 0 86 . -63.803 13.437 -0.359 1.00 53.72 86 A 1 ATOM 633 O OE2 . GLU A 0 86 . -64.080 12.204 -2.190 1.00 53.72 86 A 1 ATOM 634 N N . THR A 0 87 . -59.609 11.181 2.112 1.00 52.12 87 A 1 ATOM 635 C CA . THR A 0 87 . -60.485 10.181 2.764 1.00 52.12 87 A 1 ATOM 636 C C . THR A 0 87 . -59.861 8.778 2.784 1.00 52.12 87 A 1 ATOM 637 C CB . THR A 0 87 . -61.961 10.164 2.299 1.00 52.12 87 A 1 ATOM 638 O O . THR A 0 87 . -59.462 8.224 1.769 1.00 52.12 87 A 1 ATOM 639 C CG2 . THR A 0 87 . -62.851 9.200 3.089 1.00 52.12 87 A 1 ATOM 640 O OG1 . THR A 0 87 . -62.539 11.416 2.561 1.00 52.12 87 A 1 ATOM 641 N N . LEU A 0 88 . -59.903 8.193 3.986 1.00 58.32 88 A 1 ATOM 642 C CA . LEU A 0 88 . -59.828 6.766 4.309 1.00 58.32 88 A 1 ATOM 643 C C . LEU A 0 88 . -58.453 6.131 4.606 1.00 58.32 88 A 1 ATOM 644 C CB . LEU A 0 88 . -60.684 5.917 3.338 1.00 58.32 88 A 1 ATOM 645 O O . LEU A 0 88 . -57.579 5.986 3.765 1.00 58.32 88 A 1 ATOM 646 C CG . LEU A 0 88 . -61.737 5.035 4.023 1.00 58.32 88 A 1 ATOM 647 C CD1 . LEU A 0 88 . -62.874 5.831 4.672 1.00 58.32 88 A 1 ATOM 648 C CD2 . LEU A 0 88 . -62.347 4.082 3.001 1.00 58.32 88 A 1 ATOM 649 N N . MET A 0 89 . -58.395 5.595 5.830 1.00 48.69 89 A 1 ATOM 650 C CA . MET A 0 89 . -57.635 4.416 6.256 1.00 48.69 89 A 1 ATOM 651 C C . MET A 0 89 . -56.103 4.500 6.325 1.00 48.69 89 A 1 ATOM 652 C CB . MET A 0 89 . -58.097 3.176 5.465 1.00 48.69 89 A 1 ATOM 653 O O . MET A 0 89 . -55.377 4.354 5.354 1.00 48.69 89 A 1 ATOM 654 C CG . MET A 0 89 . -59.419 2.622 6.001 1.00 48.69 89 A 1 ATOM 655 S SD . MET A 0 89 . -60.270 1.546 4.820 1.00 48.69 89 A 1 ATOM 656 C CE . MET A 0 89 . -60.368 0.003 5.759 1.00 48.69 89 A 1 ATOM 657 N N . GLY A 0 90 . -55.623 4.412 7.567 1.00 49.51 90 A 1 ATOM 658 C CA . GLY A 0 90 . -54.768 3.273 7.890 1.00 49.51 90 A 1 ATOM 659 C C . GLY A 0 90 . -53.292 3.574 8.127 1.00 49.51 90 A 1 ATOM 660 O O . GLY A 0 90 . -52.498 3.690 7.210 1.00 49.51 90 A 1 ATOM 661 N N . LYS A 0 91 . -52.933 3.496 9.411 1.00 56.39 91 A 1 ATOM 662 C CA . LYS A 0 91 . -51.716 2.848 9.928 1.00 56.39 91 A 1 ATOM 663 C C . LYS A 0 91 . -50.361 3.451 9.509 1.00 56.39 91 A 1 ATOM 664 C CB . LYS A 0 91 . -51.801 1.328 9.687 1.00 56.39 91 A 1 ATOM 665 O O . LYS A 0 91 . -49.813 3.244 8.435 1.00 56.39 91 A 1 ATOM 666 C CG . LYS A 0 91 . -52.993 0.703 10.441 1.00 56.39 91 A 1 ATOM 667 C CD . LYS A 0 91 . -53.118 -0.807 10.209 1.00 56.39 91 A 1 ATOM 668 C CE . LYS A 0 91 . -54.337 -1.345 10.975 1.00 56.39 91 A 1 ATOM 669 N NZ . LYS A 0 91 . -54.462 -2.821 10.865 1.00 56.39 91 A 1 ATOM 670 N N . ARG A 0 92 . -49.780 4.108 10.516 1.00 53.54 92 A 1 ATOM 671 C CA . ARG A 0 92 . -48.366 4.457 10.721 1.00 53.54 92 A 1 ATOM 672 C C . ARG A 0 92 . -47.358 3.348 10.333 1.00 53.54 92 A 1 ATOM 673 C CB . ARG A 0 92 . -48.230 4.831 12.210 1.00 53.54 92 A 1 ATOM 674 O O . ARG A 0 92 . -47.706 2.171 10.284 1.00 53.54 92 A 1 ATOM 675 C CG . ARG A 0 92 . -48.338 6.346 12.438 1.00 53.54 92 A 1 ATOM 676 C CD . ARG A 0 92 . -48.162 6.644 13.931 1.00 53.54 92 A 1 ATOM 677 N NE . ARG A 0 92 . -47.569 7.977 14.163 1.00 53.54 92 A 1 ATOM 678 N NH1 . ARG A 0 92 . -45.969 7.363 15.709 1.00 53.54 92 A 1 ATOM 679 N NH2 . ARG A 0 92 . -46.148 9.494 15.096 1.00 53.54 92 A 1 ATOM 680 C CZ . ARG A 0 92 . -46.569 8.267 14.982 1.00 53.54 92 A 1 ATOM 681 N N . PRO A 0 93 . -46.085 3.726 10.109 1.00 44.79 93 A 1 ATOM 682 C CA . PRO A 0 93 . -45.370 3.431 8.877 1.00 44.79 93 A 1 ATOM 683 C C . PRO A 0 93 . -44.273 2.385 9.076 1.00 44.79 93 A 1 ATOM 684 C CB . PRO A 0 93 . -44.758 4.782 8.492 1.00 44.79 93 A 1 ATOM 685 O O . PRO A 0 93 . -43.640 2.318 10.125 1.00 44.79 93 A 1 ATOM 686 C CG . PRO A 0 93 . -44.334 5.357 9.843 1.00 44.79 93 A 1 ATOM 687 C CD . PRO A 0 93 . -45.384 4.806 10.798 1.00 44.79 93 A 1 ATOM 688 N N . GLN A 0 94 . -43.964 1.638 8.021 1.00 50.59 94 A 1 ATOM 689 C CA . GLN A 0 94 . -42.708 0.903 7.925 1.00 50.59 94 A 1 ATOM 690 C C . GLN A 0 94 . -42.139 1.137 6.529 1.00 50.59 94 A 1 ATOM 691 C CB . GLN A 0 94 . -42.914 -0.590 8.243 1.00 50.59 94 A 1 ATOM 692 O O . GLN A 0 94 . -42.569 0.528 5.551 1.00 50.59 94 A 1 ATOM 693 C CG . GLN A 0 94 . -43.275 -0.883 9.714 1.00 50.59 94 A 1 ATOM 694 C CD . GLN A 0 94 . -42.148 -0.622 10.716 1.00 50.59 94 A 1 ATOM 695 N NE2 . GLN A 0 94 . -42.387 -0.832 11.992 1.00 50.59 94 A 1 ATOM 696 O OE1 . GLN A 0 94 . -41.030 -0.268 10.378 1.00 50.59 94 A 1 ATOM 697 N N . ARG A 0 95 . -41.158 2.041 6.427 1.00 54.17 95 A 1 ATOM 698 C CA . ARG A 0 95 . -40.228 2.033 5.296 1.00 54.17 95 A 1 ATOM 699 C C . ARG A 0 95 . -39.570 0.657 5.298 1.00 54.17 95 A 1 ATOM 700 C CB . ARG A 0 95 . -39.150 3.125 5.444 1.00 54.17 95 A 1 ATOM 701 O O . ARG A 0 95 . -38.712 0.396 6.132 1.00 54.17 95 A 1 ATOM 702 C CG . ARG A 0 95 . -39.522 4.469 4.808 1.00 54.17 95 A 1 ATOM 703 C CD . ARG A 0 95 . -38.313 5.413 4.898 1.00 54.17 95 A 1 ATOM 704 N NE . ARG A 0 95 . -38.526 6.663 4.143 1.00 54.17 95 A 1 ATOM 705 N NH1 . ARG A 0 95 . -36.318 7.152 3.710 1.00 54.17 95 A 1 ATOM 706 N NH2 . ARG A 0 95 . -37.917 8.513 2.961 1.00 54.17 95 A 1 ATOM 707 C CZ . ARG A 0 95 . -37.590 7.432 3.611 1.00 54.17 95 A 1 ATOM 708 N N . ARG A 0 96 . -39.972 -0.208 4.374 1.00 53.20 96 A 1 ATOM 709 C CA . ARG A 0 96 . -39.199 -1.377 3.962 1.00 53.20 96 A 1 ATOM 710 C C . ARG A 0 96 . -38.242 -0.899 2.871 1.00 53.20 96 A 1 ATOM 711 C CB . ARG A 0 96 . -40.152 -2.486 3.465 1.00 53.20 96 A 1 ATOM 712 O O . ARG A 0 96 . -38.706 -0.593 1.776 1.00 53.20 96 A 1 ATOM 713 C CG . ARG A 0 96 . -40.114 -3.729 4.361 1.00 53.20 96 A 1 ATOM 714 C CD . ARG A 0 96 . -41.131 -4.763 3.860 1.00 53.20 96 A 1 ATOM 715 N NE . ARG A 0 96 . -41.008 -6.046 4.582 1.00 53.20 96 A 1 ATOM 716 N NH1 . ARG A 0 96 . -40.738 -7.449 2.769 1.00 53.20 96 A 1 ATOM 717 N NH2 . ARG A 0 96 . -40.755 -8.299 4.825 1.00 53.20 96 A 1 ATOM 718 C CZ . ARG A 0 96 . -40.834 -7.250 4.055 1.00 53.20 96 A 1 ATOM 719 N N . PRO A 0 97 . -36.928 -0.795 3.124 1.00 57.13 97 A 1 ATOM 720 C CA . PRO A 0 97 . -35.968 -0.789 2.038 1.00 57.13 97 A 1 ATOM 721 C C . PRO A 0 97 . -36.003 -2.193 1.435 1.00 57.13 97 A 1 ATOM 722 C CB . PRO A 0 97 . -34.609 -0.432 2.656 1.00 57.13 97 A 1 ATOM 723 O O . PRO A 0 97 . -35.749 -3.181 2.125 1.00 57.13 97 A 1 ATOM 724 C CG . PRO A 0 97 . -34.916 -0.124 4.124 1.00 57.13 97 A 1 ATOM 725 C CD . PRO A 0 97 . -36.219 -0.869 4.385 1.00 57.13 97 A 1 ATOM 726 N N . THR A 0 98 . -36.386 -2.289 0.169 1.00 56.18 98 A 1 ATOM 727 C CA . THR A 0 98 . -36.265 -3.517 -0.616 1.00 56.18 98 A 1 ATOM 728 C C . THR A 0 98 . -34.800 -3.964 -0.618 1.00 56.18 98 A 1 ATOM 729 C CB . THR A 0 98 . -36.733 -3.266 -2.057 1.00 56.18 98 A 1 ATOM 730 O O . THR A 0 98 . -33.928 -3.129 -0.883 1.00 56.18 98 A 1 ATOM 731 C CG2 . THR A 0 98 . -38.255 -3.140 -2.122 1.00 56.18 98 A 1 ATOM 732 O OG1 . THR A 0 98 . -36.190 -2.049 -2.525 1.00 56.18 98 A 1 ATOM 733 N N . PRO A 0 99 . -34.496 -5.239 -0.314 1.00 62.92 99 A 1 ATOM 734 C CA . PRO A 0 99 . -33.137 -5.739 -0.447 1.00 62.92 99 A 1 ATOM 735 C C . PRO A 0 99 . -32.727 -5.643 -1.923 1.00 62.92 99 A 1 ATOM 736 C CB . PRO A 0 99 . -33.176 -7.188 0.053 1.00 62.92 99 A 1 ATOM 737 O O . PRO A 0 99 . -33.524 -6.021 -2.784 1.00 62.92 99 A 1 ATOM 738 C CG . PRO A 0 99 . -34.621 -7.617 -0.202 1.00 62.92 99 A 1 ATOM 739 C CD . PRO A 0 99 . -35.416 -6.326 -0.011 1.00 62.92 99 A 1 ATOM 740 N N . PRO A 0 100 . -31.520 -5.150 -2.250 1.00 55.24 100 A 1 ATOM 741 C CA . PRO A 0 100 . -30.973 -5.357 -3.577 1.00 55.24 100 A 1 ATOM 742 C C . PRO A 0 100 . -30.744 -6.863 -3.751 1.00 55.24 100 A 1 ATOM 743 C CB . PRO A 0 100 . -29.700 -4.509 -3.641 1.00 55.24 100 A 1 ATOM 744 O O . PRO A 0 100 . -29.813 -7.444 -3.195 1.00 55.24 100 A 1 ATOM 745 C CG . PRO A 0 100 . -29.252 -4.415 -2.183 1.00 55.24 100 A 1 ATOM 746 C CD . PRO A 0 100 . -30.553 -4.498 -1.382 1.00 55.24 100 A 1 ATOM 747 N N . THR A 0 101 . -31.648 -7.505 -4.485 1.00 52.92 101 A 1 ATOM 748 C CA . THR A 0 101 . -31.362 -8.717 -5.246 1.00 52.92 101 A 1 ATOM 749 C C . THR A 0 101 . -30.221 -8.380 -6.191 1.00 52.92 101 A 1 ATOM 750 C CB . THR A 0 101 . -32.588 -9.115 -6.094 1.00 52.92 101 A 1 ATOM 751 O O . THR A 0 101 . -30.444 -7.602 -7.103 1.00 52.92 101 A 1 ATOM 752 C CG2 . THR A 0 101 . -33.648 -9.834 -5.264 1.00 52.92 101 A 1 ATOM 753 O OG1 . THR A 0 101 . -33.196 -7.965 -6.647 1.00 52.92 101 A 1 ATOM 754 N N . ASP A 0 102 . -29.009 -8.852 -5.907 1.00 50.65 102 A 1 ATOM 755 C CA . ASP A 0 102 . -28.015 -9.273 -6.905 1.00 50.65 102 A 1 ATOM 756 C C . ASP A 0 102 . -26.680 -9.599 -6.217 1.00 50.65 102 A 1 ATOM 757 C CB . ASP A 0 102 . -27.812 -8.280 -8.075 1.00 50.65 102 A 1 ATOM 758 O O . ASP A 0 102 . -25.906 -8.732 -5.816 1.00 50.65 102 A 1 ATOM 759 C CG . ASP A 0 102 . -28.711 -8.643 -9.271 1.00 50.65 102 A 1 ATOM 760 O OD1 . ASP A 0 102 . -28.652 -9.832 -9.662 1.00 50.65 102 A 1 ATOM 761 O OD2 . ASP A 0 102 . -29.408 -7.750 -9.800 1.00 50.65 102 A 1 ATOM 762 N N . ALA A 0 103 . -26.459 -10.902 -6.036 1.00 52.16 103 A 1 ATOM 763 C CA . ALA A 0 103 . -25.232 -11.627 -6.375 1.00 52.16 103 A 1 ATOM 764 C C . ALA A 0 103 . -23.842 -11.028 -6.048 1.00 52.16 103 A 1 ATOM 765 C CB . ALA A 0 103 . -25.361 -12.076 -7.836 1.00 52.16 103 A 1 ATOM 766 O O . ALA A 0 103 . -22.859 -11.366 -6.704 1.00 52.16 103 A 1 ATOM 767 N N . ASN A 0 104 . -23.693 -10.239 -4.987 1.00 54.67 104 A 1 ATOM 768 C CA . ASN A 0 104 . -22.396 -10.040 -4.347 1.00 54.67 104 A 1 ATOM 769 C C . ASN A 0 104 . -22.567 -10.202 -2.838 1.00 54.67 104 A 1 ATOM 770 C CB . ASN A 0 104 . -21.786 -8.700 -4.789 1.00 54.67 104 A 1 ATOM 771 O O . ASN A 0 104 . -23.360 -9.491 -2.226 1.00 54.67 104 A 1 ATOM 772 C CG . ASN A 0 104 . -20.285 -8.644 -4.558 1.00 54.67 104 A 1 ATOM 773 N ND2 . ASN A 0 104 . -19.588 -7.795 -5.276 1.00 54.67 104 A 1 ATOM 774 O OD1 . ASN A 0 104 . -19.717 -9.363 -3.752 1.00 54.67 104 A 1 ATOM 775 N N . LYS A 0 105 . -21.862 -11.180 -2.259 1.00 51.75 105 A 1 ATOM 776 C CA . LYS A 0 105 . -21.828 -11.530 -0.830 1.00 51.75 105 A 1 ATOM 777 C C . LYS A 0 105 . -21.316 -10.350 0.010 1.00 51.75 105 A 1 ATOM 778 C CB . LYS A 0 105 . -20.918 -12.760 -0.634 1.00 51.75 105 A 1 ATOM 779 O O . LYS A 0 105 . -20.210 -10.386 0.546 1.00 51.75 105 A 1 ATOM 780 C CG . LYS A 0 105 . -21.472 -14.091 -1.157 1.00 51.75 105 A 1 ATOM 781 C CD . LYS A 0 105 . -20.434 -15.200 -0.919 1.00 51.75 105 A 1 ATOM 782 C CE . LYS A 0 105 . -20.995 -16.581 -1.277 1.00 51.75 105 A 1 ATOM 783 N NZ . LYS A 0 105 . -20.110 -17.674 -0.799 1.00 51.75 105 A 1 ATOM 784 N N . ALA A 0 106 . -22.101 -9.285 0.115 1.00 59.66 106 A 1 ATOM 785 C CA . ALA A 0 106 . -21.792 -8.139 0.943 1.00 59.66 106 A 1 ATOM 786 C C . ALA A 0 106 . -21.976 -8.568 2.401 1.00 59.66 106 A 1 ATOM 787 C CB . ALA A 0 106 . -22.665 -6.952 0.519 1.00 59.66 106 A 1 ATOM 788 O O . ALA A 0 106 . -23.093 -8.638 2.911 1.00 59.66 106 A 1 ATOM 789 N N . LEU A 0 107 . -20.857 -8.916 3.042 1.00 63.23 107 A 1 ATOM 790 C CA . LEU A 0 107 . -20.764 -9.144 4.482 1.00 63.23 107 A 1 ATOM 791 C C . LEU A 0 107 . -21.534 -8.036 5.224 1.00 63.23 107 A 1 ATOM 792 C CB . LEU A 0 107 . -19.276 -9.137 4.881 1.00 63.23 107 A 1 ATOM 793 O O . LEU A 0 107 . -21.432 -6.868 4.821 1.00 63.23 107 A 1 ATOM 794 C CG . LEU A 0 107 . -18.495 -10.374 4.403 1.00 63.23 107 A 1 ATOM 795 C CD1 . LEU A 0 107 . -16.993 -10.105 4.465 1.00 63.23 107 A 1 ATOM 796 C CD2 . LEU A 0 107 . -18.799 -11.595 5.272 1.00 63.23 107 A 1 ATOM 797 N N . PRO A 0 108 . -22.302 -8.372 6.281 1.00 74.03 108 A 1 ATOM 798 C CA . PRO A 0 108 . -23.093 -7.380 6.994 1.00 74.03 108 A 1 ATOM 799 C C . PRO A 0 108 . -22.155 -6.273 7.454 1.00 74.03 108 A 1 ATOM 800 C CB . PRO A 0 108 . -23.786 -8.117 8.144 1.00 74.03 108 A 1 ATOM 801 O O . PRO A 0 108 . -21.127 -6.536 8.069 1.00 74.03 108 A 1 ATOM 802 C CG . PRO A 0 108 . -22.934 -9.365 8.349 1.00 74.03 108 A 1 ATOM 803 C CD . PRO A 0 108 . -22.343 -9.653 6.970 1.00 74.03 108 A 1 ATOM 804 N N . SER A 0 109 . -22.461 -5.034 7.085 1.00 77.10 109 A 1 ATOM 805 C CA . SER A 0 109 . -21.614 -3.889 7.392 1.00 77.10 109 A 1 ATOM 806 C C . SER A 0 109 . -22.433 -2.788 8.038 1.00 77.10 109 A 1 ATOM 807 C CB . SER A 0 109 . -20.828 -3.416 6.166 1.00 77.10 109 A 1 ATOM 808 O O . SER A 0 109 . -23.577 -2.540 7.662 1.00 77.10 109 A 1 ATOM 809 O OG . SER A 0 109 . -21.664 -2.997 5.109 1.00 77.10 109 A 1 ATOM 810 N N . ILE A 0 110 . -21.852 -2.142 9.043 1.00 80.80 110 A 1 ATOM 811 C CA . ILE A 0 110 . -22.462 -1.029 9.766 1.00 80.80 110 A 1 ATOM 812 C C . ILE A 0 110 . -21.652 0.229 9.464 1.00 80.80 110 A 1 ATOM 813 C CB . ILE A 0 110 . -22.593 -1.343 11.275 1.00 80.80 110 A 1 ATOM 814 O O . ILE A 0 110 . -20.418 0.219 9.474 1.00 80.80 110 A 1 ATOM 815 C CG1 . ILE A 0 110 . -23.523 -2.561 11.493 1.00 80.80 110 A 1 ATOM 816 C CG2 . ILE A 0 110 . -23.157 -0.128 12.038 1.00 80.80 110 A 1 ATOM 817 C CD1 . ILE A 0 110 . -23.608 -3.036 12.950 1.00 80.80 110 A 1 ATOM 818 N N . ARG A 0 111 . -22.353 1.335 9.199 1.00 81.44 111 A 1 ATOM 819 C CA . ARG A 0 111 . -21.748 2.668 9.110 1.00 81.44 111 A 1 ATOM 820 C C . ARG A 0 111 . -21.536 3.213 10.512 1.00 81.44 111 A 1 ATOM 821 C CB . ARG A 0 111 . -22.632 3.614 8.288 1.00 81.44 111 A 1 ATOM 822 O O . ARG A 0 111 . -22.502 3.539 11.193 1.00 81.44 111 A 1 ATOM 823 C CG . ARG A 0 111 . -22.464 3.335 6.797 1.00 81.44 111 A 1 ATOM 824 C CD . ARG A 0 111 . -23.329 4.256 5.940 1.00 81.44 111 A 1 ATOM 825 N NE . ARG A 0 111 . -23.380 3.774 4.548 1.00 81.44 111 A 1 ATOM 826 N NH1 . ARG A 0 111 . -23.468 5.798 3.460 1.00 81.44 111 A 1 ATOM 827 N NH2 . ARG A 0 111 . -23.698 3.906 2.301 1.00 81.44 111 A 1 ATOM 828 C CZ . ARG A 0 111 . -23.513 4.494 3.449 1.00 81.44 111 A 1 ATOM 829 N N . LEU A 0 112 . -20.281 3.346 10.918 1.00 84.00 112 A 1 ATOM 830 C CA . LEU A 0 112 . -19.896 3.945 12.193 1.00 84.00 112 A 1 ATOM 831 C C . LEU A 0 112 . -19.123 5.237 11.932 1.00 84.00 112 A 1 ATOM 832 C CB . LEU A 0 112 . -19.098 2.924 13.022 1.00 84.00 112 A 1 ATOM 833 O O . LEU A 0 112 . -18.327 5.320 10.998 1.00 84.00 112 A 1 ATOM 834 C CG . LEU A 0 112 . -19.986 1.761 13.521 1.00 84.00 112 A 1 ATOM 835 C CD1 . LEU A 0 112 . -19.390 0.410 13.142 1.00 84.00 112 A 1 ATOM 836 C CD2 . LEU A 0 112 . -20.176 1.807 15.035 1.00 84.00 112 A 1 ATOM 837 N N . ARG A 0 113 . -19.352 6.264 12.752 1.00 85.13 113 A 1 ATOM 838 C CA . ARG A 0 113 . -18.511 7.466 12.768 1.00 85.13 113 A 1 ATOM 839 C C . ARG A 0 113 . -17.376 7.224 13.755 1.00 85.13 113 A 1 ATOM 840 C CB . ARG A 0 113 . -19.336 8.709 13.134 1.00 85.13 113 A 1 ATOM 841 O O . ARG A 0 113 . -17.634 7.071 14.941 1.00 85.13 113 A 1 ATOM 842 C CG . ARG A 0 113 . -20.284 9.132 12.002 1.00 85.13 113 A 1 ATOM 843 C CD . ARG A 0 113 . -21.030 10.413 12.397 1.00 85.13 113 A 1 ATOM 844 N NE . ARG A 0 113 . -21.844 10.946 11.286 1.00 85.13 113 A 1 ATOM 845 N NH1 . ARG A 0 113 . -22.785 12.699 12.439 1.00 85.13 113 A 1 ATOM 846 N NH2 . ARG A 0 113 . -23.260 12.429 10.281 1.00 85.13 113 A 1 ATOM 847 C CZ . ARG A 0 113 . -22.623 12.016 11.341 1.00 85.13 113 A 1 ATOM 848 N N . ILE A 0 114 . -16.144 7.171 13.261 1.00 82.27 114 A 1 ATOM 849 C CA . ILE A 0 114 . -14.939 7.063 14.091 1.00 82.27 114 A 1 ATOM 850 C C . ILE A 0 114 . -14.130 8.332 13.825 1.00 82.27 114 A 1 ATOM 851 C CB . ILE A 0 114 . -14.149 5.767 13.786 1.00 82.27 114 A 1 ATOM 852 O O . ILE A 0 114 . -13.784 8.590 12.672 1.00 82.27 114 A 1 ATOM 853 C CG1 . ILE A 0 114 . -15.040 4.502 13.832 1.00 82.27 114 A 1 ATOM 854 C CG2 . ILE A 0 114 . -12.990 5.635 14.791 1.00 82.27 114 A 1 ATOM 855 C CD1 . ILE A 0 114 . -14.319 3.186 13.501 1.00 82.27 114 A 1 ATOM 856 N N . ASP A 0 115 . -13.882 9.136 14.860 1.00 81.76 115 A 1 ATOM 857 C CA . ASP A 0 115 . -13.183 10.430 14.760 1.00 81.76 115 A 1 ATOM 858 C C . ASP A 0 115 . -13.869 11.418 13.792 1.00 81.76 115 A 1 ATOM 859 C CB . ASP A 0 115 . -11.692 10.219 14.427 1.00 81.76 115 A 1 ATOM 860 O O . ASP A 0 115 . -13.223 12.026 12.943 1.00 81.76 115 A 1 ATOM 861 C CG . ASP A 0 115 . -11.045 9.098 15.237 1.00 81.76 115 A 1 ATOM 862 O OD1 . ASP A 0 115 . -11.136 9.165 16.480 1.00 81.76 115 A 1 ATOM 863 O OD2 . ASP A 0 115 . -10.527 8.146 14.589 1.00 81.76 115 A 1 ATOM 864 N N . SER A 0 116 . -15.203 11.523 13.841 1.00 75.98 116 A 1 ATOM 865 C CA . SER A 0 116 . -16.025 12.328 12.908 1.00 75.98 116 A 1 ATOM 866 C C . SER A 0 116 . -15.997 11.881 11.435 1.00 75.98 116 A 1 ATOM 867 C CB . SER A 0 116 . -15.708 13.826 13.044 1.00 75.98 116 A 1 ATOM 868 O O . SER A 0 116 . -16.712 12.449 10.609 1.00 75.98 116 A 1 ATOM 869 O OG . SER A 0 116 . -15.905 14.223 14.387 1.00 75.98 116 A 1 ATOM 870 N N . ILE A 0 117 . -15.264 10.815 11.096 1.00 82.62 117 A 1 ATOM 871 C CA . ILE A 0 117 . -15.189 10.257 9.743 1.00 82.62 117 A 1 ATOM 872 C C . ILE A 0 117 . -16.136 9.048 9.642 1.00 82.62 117 A 1 ATOM 873 C CB . ILE A 0 117 . -13.733 9.893 9.375 1.00 82.62 117 A 1 ATOM 874 O O . ILE A 0 117 . -15.985 8.082 10.398 1.00 82.62 117 A 1 ATOM 875 C CG1 . ILE A 0 117 . -12.814 11.137 9.458 1.00 82.62 117 A 1 ATOM 876 C CG2 . ILE A 0 117 . -13.675 9.293 7.954 1.00 82.62 117 A 1 ATOM 877 C CD1 . ILE A 0 117 . -11.318 10.809 9.397 1.00 82.62 117 A 1 ATOM 878 N N . PRO A 0 118 . -17.114 9.043 8.717 1.00 83.83 118 A 1 ATOM 879 C CA . PRO A 0 118 . -17.950 7.871 8.480 1.00 83.83 118 A 1 ATOM 880 C C . PRO A 0 118 . -17.124 6.744 7.840 1.00 83.83 118 A 1 ATOM 881 C CB . PRO A 0 118 . -19.087 8.367 7.581 1.00 83.83 118 A 1 ATOM 882 O O . PRO A 0 118 . -16.545 6.913 6.768 1.00 83.83 118 A 1 ATOM 883 C CG . PRO A 0 118 . -18.465 9.537 6.818 1.00 83.83 118 A 1 ATOM 884 C CD . PRO A 0 118 . -17.469 10.128 7.813 1.00 83.83 118 A 1 ATOM 885 N N . ARG A 0 119 . -17.085 5.576 8.487 1.00 84.64 119 A 1 ATOM 886 C CA . ARG A 0 119 . -16.422 4.354 8.009 1.00 84.64 119 A 1 ATOM 887 C C . ARG A 0 119 . -17.440 3.211 7.927 1.00 84.64 119 A 1 ATOM 888 C CB . ARG A 0 119 . -15.228 4.003 8.924 1.00 84.64 119 A 1 ATOM 889 O O . ARG A 0 119 . -18.305 3.083 8.791 1.00 84.64 119 A 1 ATOM 890 C CG . ARG A 0 119 . -14.115 5.074 8.917 1.00 84.64 119 A 1 ATOM 891 C CD . ARG A 0 119 . -12.923 4.665 9.802 1.00 84.64 119 A 1 ATOM 892 N NE . ARG A 0 119 . -11.895 5.730 9.880 1.00 84.64 119 A 1 ATOM 893 N NH1 . ARG A 0 119 . -11.188 5.428 12.066 1.00 84.64 119 A 1 ATOM 894 N NH2 . ARG A 0 119 . -10.428 7.149 10.927 1.00 84.64 119 A 1 ATOM 895 C CZ . ARG A 0 119 . -11.179 6.086 10.942 1.00 84.64 119 A 1 ATOM 896 N N . ASN A 0 120 . -17.336 2.373 6.896 1.00 82.55 120 A 1 ATOM 897 C CA . ASN A 0 120 . -18.076 1.110 6.823 1.00 82.55 120 A 1 ATOM 898 C C . ASN A 0 120 . -17.252 0.030 7.529 1.00 82.55 120 A 1 ATOM 899 C CB . ASN A 0 120 . -18.347 0.724 5.358 1.00 82.55 120 A 1 ATOM 900 O O . ASN A 0 120 . -16.110 -0.215 7.141 1.00 82.55 120 A 1 ATOM 901 C CG . ASN A 0 120 . -19.338 1.636 4.663 1.00 82.55 120 A 1 ATOM 902 N ND2 . ASN A 0 120 . -18.996 2.169 3.514 1.00 82.55 120 A 1 ATOM 903 O OD1 . ASN A 0 120 . -20.435 1.886 5.127 1.00 82.55 120 A 1 ATOM 904 N N . VAL A 0 121 . -17.816 -0.600 8.555 1.00 83.00 121 A 1 ATOM 905 C CA . VAL A 0 121 . -17.176 -1.690 9.299 1.00 83.00 121 A 1 ATOM 906 C C . VAL A 0 121 . -17.917 -2.981 8.993 1.00 83.00 121 A 1 ATOM 907 C CB . VAL A 0 121 . -17.152 -1.406 10.811 1.00 83.00 121 A 1 ATOM 908 O O . VAL A 0 121 . -19.141 -3.010 9.066 1.00 83.00 121 A 1 ATOM 909 C CG1 . VAL A 0 121 . -16.379 -2.490 11.571 1.00 83.00 121 A 1 ATOM 910 C CG2 . VAL A 0 121 . -16.483 -0.053 11.108 1.00 83.00 121 A 1 ATOM 911 N N . LEU A 0 122 . -17.183 -4.037 8.647 1.00 84.34 122 A 1 ATOM 912 C CA . LEU A 0 122 . -17.744 -5.374 8.470 1.00 84.34 122 A 1 ATOM 913 C C . LEU A 0 122 . -18.021 -5.990 9.845 1.00 84.34 122 A 1 ATOM 914 C CB . LEU A 0 122 . -16.781 -6.251 7.650 1.00 84.34 122 A 1 ATOM 915 O O . LEU A 0 122 . -17.148 -6.018 10.709 1.00 84.34 122 A 1 ATOM 916 C CG . LEU A 0 122 . -16.443 -5.716 6.247 1.00 84.34 122 A 1 ATOM 917 C CD1 . LEU A 0 122 . -15.481 -6.668 5.544 1.00 84.34 122 A 1 ATOM 918 C CD2 . LEU A 0 122 . -17.690 -5.526 5.386 1.00 84.34 122 A 1 ATOM 919 N N . VAL A 0 123 . -19.236 -6.482 10.039 1.00 81.80 123 A 1 ATOM 920 C CA . VAL A 0 123 . -19.661 -7.231 11.216 1.00 81.80 123 A 1 ATOM 921 C C . VAL A 0 123 . -19.411 -8.705 10.933 1.00 81.80 123 A 1 ATOM 922 C CB . VAL A 0 123 . -21.143 -6.968 11.539 1.00 81.80 123 A 1 ATOM 923 O O . VAL A 0 123 . -20.015 -9.288 10.038 1.00 81.80 123 A 1 ATOM 924 C CG1 . VAL A 0 123 . -21.573 -7.703 12.815 1.00 81.80 123 A 1 ATOM 925 C CG2 . VAL A 0 123 . -21.409 -5.474 11.747 1.00 81.80 123 A 1 ATOM 926 N N . GLN A 0 124 . -18.523 -9.328 11.698 1.00 79.61 124 A 1 ATOM 927 C CA . GLN A 0 124 . -18.328 -10.772 11.656 1.00 79.61 124 A 1 ATOM 928 C C . GLN A 0 124 . -18.944 -11.372 12.917 1.00 79.61 124 A 1 ATOM 929 C CB . GLN A 0 124 . -16.839 -11.078 11.454 1.00 79.61 124 A 1 ATOM 930 O O . GLN A 0 124 . -18.412 -11.211 14.012 1.00 79.61 124 A 1 ATOM 931 C CG . GLN A 0 124 . -16.583 -12.577 11.226 1.00 79.61 124 A 1 ATOM 932 C CD . GLN A 0 124 . -15.200 -12.866 10.644 1.00 79.61 124 A 1 ATOM 933 N NE2 . GLN A 0 124 . -14.784 -14.112 10.618 1.00 79.61 124 A 1 ATOM 934 O OE1 . GLN A 0 124 . -14.478 -11.999 10.181 1.00 79.61 124 A 1 ATOM 935 N N . CYS A 0 125 . -20.089 -12.037 12.769 1.00 77.12 125 A 1 ATOM 936 C CA . CYS A 0 125 . -20.643 -12.860 13.836 1.00 77.12 125 A 1 ATOM 937 C C . CYS A 0 125 . -19.873 -14.185 13.839 1.00 77.12 125 A 1 ATOM 938 C CB . CYS A 0 125 . -22.151 -13.035 13.605 1.00 77.12 125 A 1 ATOM 939 O O . CYS A 0 125 . -19.984 -14.967 12.896 1.00 77.12 125 A 1 ATOM 940 S SG . CYS A 0 125 . -22.917 -13.804 15.059 1.00 77.12 125 A 1 ATOM 941 N N . PHE A 0 126 . -19.044 -14.418 14.854 1.00 74.00 126 A 1 ATOM 942 C CA . PHE A 0 126 . -18.468 -15.733 15.104 1.00 74.00 126 A 1 ATOM 943 C C . PHE A 0 126 . -19.400 -16.471 16.070 1.00 74.00 126 A 1 ATOM 944 C CB . PHE A 0 126 . -17.017 -15.601 15.603 1.00 74.00 126 A 1 ATOM 945 O O . PHE A 0 126 . -19.597 -16.041 17.203 1.00 74.00 126 A 1 ATOM 946 C CG . PHE A 0 126 . -16.816 -14.686 16.799 1.00 74.00 126 A 1 ATOM 947 C CD1 . PHE A 0 126 . -16.579 -13.311 16.606 1.00 74.00 126 A 1 ATOM 948 C CD2 . PHE A 0 126 . -16.888 -15.202 18.107 1.00 74.00 126 A 1 ATOM 949 C CE1 . PHE A 0 126 . -16.432 -12.458 17.715 1.00 74.00 126 A 1 ATOM 950 C CE2 . PHE A 0 126 . -16.750 -14.348 19.215 1.00 74.00 126 A 1 ATOM 951 C CZ . PHE A 0 126 . -16.522 -12.975 19.019 1.00 74.00 126 A 1 ATOM 952 N N . SER A 0 127 . -20.011 -17.570 15.631 1.00 69.46 127 A 1 ATOM 953 C CA . SER A 0 127 . -20.743 -18.449 16.541 1.00 69.46 127 A 1 ATOM 954 C C . SER A 0 127 . -19.754 -19.417 17.184 1.00 69.46 127 A 1 ATOM 955 C CB . SER A 0 127 . -21.874 -19.194 15.819 1.00 69.46 127 A 1 ATOM 956 O O . SER A 0 127 . -19.246 -20.320 16.520 1.00 69.46 127 A 1 ATOM 957 O OG . SER A 0 127 . -21.367 -20.092 14.854 1.00 69.46 127 A 1 ATOM 958 N N . SER A 0 128 . -19.496 -19.282 18.480 1.00 65.56 128 A 1 ATOM 959 C CA . SER A 0 128 . -18.884 -20.352 19.271 1.00 65.56 128 A 1 ATOM 960 C C . SER A 0 128 . -19.961 -21.371 19.660 1.00 65.56 128 A 1 ATOM 961 C CB . SER A 0 128 . -18.147 -19.768 20.479 1.00 65.56 128 A 1 ATOM 962 O O . SER A 0 128 . -20.317 -21.502 20.828 1.00 65.56 128 A 1 ATOM 963 O OG . SER A 0 128 . -19.040 -19.016 21.274 1.00 65.56 128 A 1 ATOM 964 N N . GLY A 0 129 . -20.546 -22.046 18.670 1.00 59.26 129 A 1 ATOM 965 C CA . GLY A 0 129 . -21.460 -23.157 18.914 1.00 59.26 129 A 1 ATOM 966 C C . GLY A 0 129 . -20.651 -24.406 19.239 1.00 59.26 129 A 1 ATOM 967 O O . GLY A 0 129 . -20.084 -25.016 18.338 1.00 59.26 129 A 1 ATOM 968 N N . ARG A 0 130 . -20.575 -24.791 20.517 1.00 61.87 130 A 1 ATOM 969 C CA . ARG A 0 130 . -20.285 -26.190 20.857 1.00 61.87 130 A 1 ATOM 970 C C . ARG A 0 130 . -21.558 -26.984 20.544 1.00 61.87 130 A 1 ATOM 971 C CB . ARG A 0 130 . -19.893 -26.347 22.336 1.00 61.87 130 A 1 ATOM 972 O O . ARG A 0 130 . -22.627 -26.516 20.937 1.00 61.87 130 A 1 ATOM 973 C CG . ARG A 0 130 . -18.567 -25.651 22.674 1.00 61.87 130 A 1 ATOM 974 C CD . ARG A 0 130 . -18.211 -25.861 24.152 1.00 61.87 130 A 1 ATOM 975 N NE . ARG A 0 130 . -16.982 -25.130 24.526 1.00 61.87 130 A 1 ATOM 976 N NH1 . ARG A 0 130 . -15.477 -26.868 24.381 1.00 61.87 130 A 1 ATOM 977 N NH2 . ARG A 0 130 . -14.772 -24.844 24.993 1.00 61.87 130 A 1 ATOM 978 C CZ . ARG A 0 130 . -15.756 -25.618 24.629 1.00 61.87 130 A 1 ATOM 979 N N . PRO A 0 131 . -21.495 -28.136 19.858 1.00 65.65 131 A 1 ATOM 980 C CA . PRO A 0 131 . -22.658 -29.007 19.783 1.00 65.65 131 A 1 ATOM 981 C C . PRO A 0 131 . -22.994 -29.461 21.210 1.00 65.65 131 A 1 ATOM 982 C CB . PRO A 0 131 . -22.254 -30.150 18.845 1.00 65.65 131 A 1 ATOM 983 O O . PRO A 0 131 . -22.183 -30.119 21.857 1.00 65.65 131 A 1 ATOM 984 C CG . PRO A 0 131 . -20.730 -30.210 18.968 1.00 65.65 131 A 1 ATOM 985 C CD . PRO A 0 131 . -20.327 -28.763 19.256 1.00 65.65 131 A 1 ATOM 986 N N . PHE A 0 132 . -24.156 -29.059 21.727 1.00 62.74 132 A 1 ATOM 987 C CA . PHE A 0 132 . -24.738 -29.686 22.909 1.00 62.74 132 A 1 ATOM 988 C C . PHE A 0 132 . -25.436 -30.953 22.408 1.00 62.74 132 A 1 ATOM 989 C CB . PHE A 0 132 . -25.666 -28.699 23.639 1.00 62.74 132 A 1 ATOM 990 O O . PHE A 0 132 . -26.435 -30.869 21.693 1.00 62.74 132 A 1 ATOM 991 C CG . PHE A 0 132 . -25.990 -29.096 25.070 1.00 62.74 132 A 1 ATOM 992 C CD1 . PHE A 0 132 . -27.137 -29.858 25.358 1.00 62.74 132 A 1 ATOM 993 C CD2 . PHE A 0 132 . -25.132 -28.709 26.120 1.00 62.74 132 A 1 ATOM 994 C CE1 . PHE A 0 132 . -27.427 -30.226 26.685 1.00 62.74 132 A 1 ATOM 995 C CE2 . PHE A 0 132 . -25.422 -29.078 27.446 1.00 62.74 132 A 1 ATOM 996 C CZ . PHE A 0 132 . -26.571 -29.836 27.729 1.00 62.74 132 A 1 ATOM 997 N N . GLY A 0 133 . -24.822 -32.108 22.666 1.00 73.25 133 A 1 ATOM 998 C CA . GLY A 0 133 . -25.435 -33.409 22.414 1.00 73.25 133 A 1 ATOM 999 C C . GLY A 0 133 . -26.602 -33.663 23.378 1.00 73.25 133 A 1 ATOM 1000 O O . GLY A 0 133 . -26.714 -32.964 24.387 1.00 73.25 133 A 1 ATOM 1001 N N . PRO A 0 134 . -27.491 -34.618 23.061 1.00 73.54 134 A 1 ATOM 1002 C CA . PRO A 0 134 . -28.571 -35.021 23.963 1.00 73.54 134 A 1 ATOM 1003 C C . PRO A 0 134 . -28.025 -35.570 25.302 1.00 73.54 134 A 1 ATOM 1004 C CB . PRO A 0 134 . -29.379 -36.056 23.171 1.00 73.54 134 A 1 ATOM 1005 O O . PRO A 0 134 . -26.842 -35.916 25.356 1.00 73.54 134 A 1 ATOM 1006 C CG . PRO A 0 134 . -28.356 -36.656 22.210 1.00 73.54 134 A 1 ATOM 1007 C CD . PRO A 0 134 . -27.434 -35.483 21.895 1.00 73.54 134 A 1 ATOM 1008 N N . PRO A 0 135 . -28.858 -35.597 26.366 1.00 72.40 135 A 1 ATOM 1009 C CA . PRO A 0 135 . -28.461 -36.023 27.713 1.00 72.40 135 A 1 ATOM 1010 C C . PRO A 0 135 . -27.963 -37.469 27.785 1.00 72.40 135 A 1 ATOM 1011 C CB . PRO A 0 135 . -29.702 -35.832 28.594 1.00 72.40 135 A 1 ATOM 1012 O O . PRO A 0 135 . -28.402 -38.294 26.949 1.00 72.40 135 A 1 ATOM 1013 C CG . PRO A 0 135 . -30.848 -36.005 27.603 1.00 72.40 135 A 1 ATOM 1014 C CD . PRO A 0 135 . -30.291 -35.336 26.349 1.00 72.40 135 A 1 ATOM 1015 O OXT . PRO A 0 135 . -27.191 -37.712 28.736 1.00 72.40 135 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 67.40 # loop_ _atom_type.symbol C N O S #