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 ASN 0 3 ILE 0 4 PHE 0 5 PHE 0 6 THR 0 7 PHE 0 8 MET 0 9 ASN 0 10 MET 0 11 ILE 0 12 PRO 0 13 TYR 0 14 LEU 0 15 HIS 0 16 SER 0 17 ASN 0 18 ASN 0 19 ASN 0 20 TYR 0 21 SER 0 22 ASN 0 23 ASN 0 24 ASN 0 25 ASN 0 26 ILE 0 27 ILE 0 28 ILE 0 29 ILE 0 30 THR 0 31 ILE 0 32 LEU 0 33 LEU 0 34 GLN 0 35 CYS 0 36 ILE 0 37 GLY 0 38 LEU 0 39 ILE 0 40 PHE 0 41 VAL 0 42 LYS 0 43 THR 0 44 GLU 0 45 SER 0 46 ILE 0 47 HIS 0 48 GLY 0 49 SER 0 50 TYR 0 51 GLU 0 52 LEU 0 53 ILE 0 54 GLY 0 55 LEU 0 56 THR 0 57 LYS 0 58 ASP 0 59 PRO 0 60 LYS 0 61 THR 0 62 PHE 0 63 ASN 0 64 GLY 0 65 LYS 0 66 LEU 0 67 CYS 0 68 GLY 0 69 THR 0 70 CYS 0 71 LEU 0 72 LYS 0 73 PHE 0 74 TYR 0 75 ASN 0 76 SER 0 77 ILE 0 78 MET 0 79 SER 0 80 LEU 0 81 PHE 0 82 LEU 0 83 ASP 0 84 TYR 0 85 GLY 0 86 LYS 0 87 LEU 0 88 GLU 0 89 SER 0 90 PHE 0 91 GLN 0 92 GLU 0 93 LYS 0 94 LEU 0 95 ILE 0 96 ASP 0 97 ILE 0 98 CYS 0 99 GLU 0 100 TYR 0 101 ILE 0 102 GLY 0 103 PRO 0 104 PHE 0 105 ARG 0 106 ASP 0 107 GLN 0 108 CYS 0 109 VAL 0 110 ALA 0 111 LEU 0 112 VAL 0 113 THR 0 114 PHE 0 115 THR 0 116 MET 0 117 PHE 0 118 LYS 0 119 ALA 0 120 ILE 0 121 ASN 0 122 LYS 0 123 SER 0 124 ILE 0 125 SER 0 126 LYS 0 127 ILE 0 128 ASP 0 129 PRO 0 130 SER 0 131 ILE 0 132 SER 0 133 CYS 0 134 GLU 0 135 GLY 0 136 TRP 0 137 TYR 0 138 LEU 0 139 CYS 0 140 TYR 0 141 ARG 0 142 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 . -3.423 -1.327 21.592 1.00 33.18 1 A 1 ATOM 2 C CA . MET A 0 1 . -3.727 -2.607 20.920 1.00 33.18 1 A 1 ATOM 3 C C . MET A 0 1 . -3.594 -2.362 19.430 1.00 33.18 1 A 1 ATOM 4 C CB . MET A 0 1 . -5.118 -3.112 21.334 1.00 33.18 1 A 1 ATOM 5 O O . MET A 0 1 . -4.187 -1.418 18.929 1.00 33.18 1 A 1 ATOM 6 C CG . MET A 0 1 . -5.254 -4.634 21.228 1.00 33.18 1 A 1 ATOM 7 S SD . MET A 0 1 . -6.299 -5.327 22.538 1.00 33.18 1 A 1 ATOM 8 C CE . MET A 0 1 . -7.980 -5.040 21.925 1.00 33.18 1 A 1 ATOM 9 N N . ASN A 0 2 . -2.660 -3.056 18.788 1.00 32.12 2 A 1 ATOM 10 C CA . ASN A 0 2 . -2.068 -2.640 17.520 1.00 32.12 2 A 1 ATOM 11 C C . ASN A 0 2 . -3.066 -2.824 16.365 1.00 32.12 2 A 1 ATOM 12 C CB . ASN A 0 2 . -0.755 -3.453 17.347 1.00 32.12 2 A 1 ATOM 13 O O . ASN A 0 2 . -3.306 -3.955 15.960 1.00 32.12 2 A 1 ATOM 14 C CG . ASN A 0 2 . 0.508 -2.609 17.432 1.00 32.12 2 A 1 ATOM 15 N ND2 . ASN A 0 2 . 1.606 -3.172 17.875 1.00 32.12 2 A 1 ATOM 16 O OD1 . ASN A 0 2 . 0.514 -1.434 17.122 1.00 32.12 2 A 1 ATOM 17 N N . ILE A 0 3 . -3.586 -1.722 15.805 1.00 42.56 3 A 1 ATOM 18 C CA . ILE A 0 3 . -4.331 -1.687 14.524 1.00 42.56 3 A 1 ATOM 19 C C . ILE A 0 3 . -3.601 -2.528 13.455 1.00 42.56 3 A 1 ATOM 20 C CB . ILE A 0 3 . -4.495 -0.200 14.099 1.00 42.56 3 A 1 ATOM 21 O O . ILE A 0 3 . -4.217 -3.223 12.654 1.00 42.56 3 A 1 ATOM 22 C CG1 . ILE A 0 3 . -5.515 0.504 15.028 1.00 42.56 3 A 1 ATOM 23 C CG2 . ILE A 0 3 . -4.924 -0.042 12.630 1.00 42.56 3 A 1 ATOM 24 C CD1 . ILE A 0 3 . -5.472 2.037 14.963 1.00 42.56 3 A 1 ATOM 25 N N . PHE A 0 4 . -2.269 -2.553 13.541 1.00 36.57 4 A 1 ATOM 26 C CA . PHE A 0 4 . -1.352 -3.418 12.806 1.00 36.57 4 A 1 ATOM 27 C C . PHE A 0 4 . -1.728 -4.918 12.790 1.00 36.57 4 A 1 ATOM 28 C CB . PHE A 0 4 . 0.024 -3.192 13.450 1.00 36.57 4 A 1 ATOM 29 O O . PHE A 0 4 . -1.694 -5.538 11.732 1.00 36.57 4 A 1 ATOM 30 C CG . PHE A 0 4 . 1.162 -3.897 12.762 1.00 36.57 4 A 1 ATOM 31 C CD1 . PHE A 0 4 . 1.596 -5.160 13.206 1.00 36.57 4 A 1 ATOM 32 C CD2 . PHE A 0 4 . 1.777 -3.289 11.656 1.00 36.57 4 A 1 ATOM 33 C CE1 . PHE A 0 4 . 2.647 -5.814 12.541 1.00 36.57 4 A 1 ATOM 34 C CE2 . PHE A 0 4 . 2.815 -3.958 10.986 1.00 36.57 4 A 1 ATOM 35 C CZ . PHE A 0 4 . 3.256 -5.211 11.430 1.00 36.57 4 A 1 ATOM 36 N N . PHE A 0 5 . -2.125 -5.509 13.923 1.00 33.08 5 A 1 ATOM 37 C CA . PHE A 0 5 . -2.462 -6.940 14.023 1.00 33.08 5 A 1 ATOM 38 C C . PHE A 0 5 . -3.791 -7.272 13.336 1.00 33.08 5 A 1 ATOM 39 C CB . PHE A 0 5 . -2.493 -7.362 15.505 1.00 33.08 5 A 1 ATOM 40 O O . PHE A 0 5 . -3.944 -8.323 12.719 1.00 33.08 5 A 1 ATOM 41 C CG . PHE A 0 5 . -1.448 -8.401 15.852 1.00 33.08 5 A 1 ATOM 42 C CD1 . PHE A 0 5 . -1.748 -9.770 15.731 1.00 33.08 5 A 1 ATOM 43 C CD2 . PHE A 0 5 . -0.166 -7.999 16.271 1.00 33.08 5 A 1 ATOM 44 C CE1 . PHE A 0 5 . -0.773 -10.735 16.040 1.00 33.08 5 A 1 ATOM 45 C CE2 . PHE A 0 5 . 0.810 -8.964 16.577 1.00 33.08 5 A 1 ATOM 46 C CZ . PHE A 0 5 . 0.505 -10.331 16.464 1.00 33.08 5 A 1 ATOM 47 N N . THR A 0 6 . -4.746 -6.349 13.409 1.00 41.91 6 A 1 ATOM 48 C CA . THR A 0 6 . -6.081 -6.505 12.834 1.00 41.91 6 A 1 ATOM 49 C C . THR A 0 6 . -6.040 -6.483 11.305 1.00 41.91 6 A 1 ATOM 50 C CB . THR A 0 6 . -6.984 -5.394 13.381 1.00 41.91 6 A 1 ATOM 51 O O . THR A 0 6 . -6.682 -7.306 10.658 1.00 41.91 6 A 1 ATOM 52 C CG2 . THR A 0 6 . -8.444 -5.724 13.191 1.00 41.91 6 A 1 ATOM 53 O OG1 . THR A 0 6 . -6.803 -5.244 14.773 1.00 41.91 6 A 1 ATOM 54 N N . PHE A 0 7 . -5.214 -5.610 10.719 1.00 46.86 7 A 1 ATOM 55 C CA . PHE A 0 7 . -4.995 -5.576 9.271 1.00 46.86 7 A 1 ATOM 56 C C . PHE A 0 7 . -4.174 -6.763 8.765 1.00 46.86 7 A 1 ATOM 57 C CB . PHE A 0 7 . -4.355 -4.244 8.864 1.00 46.86 7 A 1 ATOM 58 O O . PHE A 0 7 . -4.525 -7.327 7.732 1.00 46.86 7 A 1 ATOM 59 C CG . PHE A 0 7 . -5.382 -3.149 8.674 1.00 46.86 7 A 1 ATOM 60 C CD1 . PHE A 0 7 . -6.029 -3.000 7.433 1.00 46.86 7 A 1 ATOM 61 C CD2 . PHE A 0 7 . -5.738 -2.316 9.746 1.00 46.86 7 A 1 ATOM 62 C CE1 . PHE A 0 7 . -7.021 -2.019 7.268 1.00 46.86 7 A 1 ATOM 63 C CE2 . PHE A 0 7 . -6.738 -1.347 9.585 1.00 46.86 7 A 1 ATOM 64 C CZ . PHE A 0 7 . -7.378 -1.191 8.345 1.00 46.86 7 A 1 ATOM 65 N N . MET A 0 8 . -3.142 -7.198 9.500 1.00 36.21 8 A 1 ATOM 66 C CA . MET A 0 8 . -2.355 -8.391 9.145 1.00 36.21 8 A 1 ATOM 67 C C . MET A 0 8 . -3.226 -9.652 9.044 1.00 36.21 8 A 1 ATOM 68 C CB . MET A 0 8 . -1.223 -8.591 10.167 1.00 36.21 8 A 1 ATOM 69 O O . MET A 0 8 . -3.028 -10.463 8.143 1.00 36.21 8 A 1 ATOM 70 C CG . MET A 0 8 . -0.068 -7.610 9.932 1.00 36.21 8 A 1 ATOM 71 S SD . MET A 0 8 . 0.990 -8.049 8.524 1.00 36.21 8 A 1 ATOM 72 C CE . MET A 0 8 . 1.146 -6.435 7.717 1.00 36.21 8 A 1 ATOM 73 N N . ASN A 0 9 . -4.247 -9.771 9.898 1.00 38.04 9 A 1 ATOM 74 C CA . ASN A 0 9 . -5.205 -10.875 9.854 1.00 38.04 9 A 1 ATOM 75 C C . ASN A 0 9 . -6.231 -10.780 8.712 1.00 38.04 9 A 1 ATOM 76 C CB . ASN A 0 9 . -5.896 -10.980 11.221 1.00 38.04 9 A 1 ATOM 77 O O . ASN A 0 9 . -6.847 -11.791 8.401 1.00 38.04 9 A 1 ATOM 78 C CG . ASN A 0 9 . -4.994 -11.575 12.287 1.00 38.04 9 A 1 ATOM 79 N ND2 . ASN A 0 9 . -5.135 -11.155 13.521 1.00 38.04 9 A 1 ATOM 80 O OD1 . ASN A 0 9 . -4.173 -12.442 12.048 1.00 38.04 9 A 1 ATOM 81 N N . MET A 0 10 . -6.411 -9.621 8.065 1.00 46.12 10 A 1 ATOM 82 C CA . MET A 0 10 . -7.319 -9.460 6.915 1.00 46.12 10 A 1 ATOM 83 C C . MET A 0 10 . -6.663 -9.776 5.563 1.00 46.12 10 A 1 ATOM 84 C CB . MET A 0 10 . -7.902 -8.041 6.891 1.00 46.12 10 A 1 ATOM 85 O O . MET A 0 10 . -7.360 -10.096 4.599 1.00 46.12 10 A 1 ATOM 86 C CG . MET A 0 10 . -9.029 -7.877 7.909 1.00 46.12 10 A 1 ATOM 87 S SD . MET A 0 10 . -9.963 -6.348 7.670 1.00 46.12 10 A 1 ATOM 88 C CE . MET A 0 10 . -9.000 -5.205 8.686 1.00 46.12 10 A 1 ATOM 89 N N . ILE A 0 11 . -5.329 -9.730 5.483 1.00 44.26 11 A 1 ATOM 90 C CA . ILE A 0 11 . -4.563 -9.987 4.250 1.00 44.26 11 A 1 ATOM 91 C C . ILE A 0 11 . -4.872 -11.371 3.634 1.00 44.26 11 A 1 ATOM 92 C CB . ILE A 0 11 . -3.047 -9.758 4.492 1.00 44.26 11 A 1 ATOM 93 O O . ILE A 0 11 . -5.069 -11.430 2.418 1.00 44.26 11 A 1 ATOM 94 C CG1 . ILE A 0 11 . -2.779 -8.281 4.860 1.00 44.26 11 A 1 ATOM 95 C CG2 . ILE A 0 11 . -2.213 -10.142 3.254 1.00 44.26 11 A 1 ATOM 96 C CD1 . ILE A 0 11 . -1.352 -7.996 5.343 1.00 44.26 11 A 1 ATOM 97 N N . PRO A 0 12 . -4.995 -12.472 4.407 1.00 37.75 12 A 1 ATOM 98 C CA . PRO A 0 12 . -5.343 -13.783 3.852 1.00 37.75 12 A 1 ATOM 99 C C . PRO A 0 12 . -6.777 -13.848 3.304 1.00 37.75 12 A 1 ATOM 100 C CB . PRO A 0 12 . -5.143 -14.789 4.995 1.00 37.75 12 A 1 ATOM 101 O O . PRO A 0 12 . -7.018 -14.498 2.287 1.00 37.75 12 A 1 ATOM 102 C CG . PRO A 0 12 . -4.253 -14.059 5.998 1.00 37.75 12 A 1 ATOM 103 C CD . PRO A 0 12 . -4.675 -12.610 5.819 1.00 37.75 12 A 1 ATOM 104 N N . TYR A 0 13 . -7.724 -13.141 3.931 1.00 41.07 13 A 1 ATOM 105 C CA . TYR A 0 13 . -9.136 -13.151 3.527 1.00 41.07 13 A 1 ATOM 106 C C . TYR A 0 13 . -9.377 -12.382 2.222 1.00 41.07 13 A 1 ATOM 107 C CB . TYR A 0 13 . -10.008 -12.608 4.666 1.00 41.07 13 A 1 ATOM 108 O O . TYR A 0 13 . -10.193 -12.797 1.402 1.00 41.07 13 A 1 ATOM 109 C CG . TYR A 0 13 . -10.091 -13.547 5.854 1.00 41.07 13 A 1 ATOM 110 C CD1 . TYR A 0 13 . -11.024 -14.601 5.856 1.00 41.07 13 A 1 ATOM 111 C CD2 . TYR A 0 13 . -9.226 -13.380 6.947 1.00 41.07 13 A 1 ATOM 112 C CE1 . TYR A 0 13 . -11.091 -15.481 6.953 1.00 41.07 13 A 1 ATOM 113 C CE2 . TYR A 0 13 . -9.285 -14.255 8.048 1.00 41.07 13 A 1 ATOM 114 O OH . TYR A 0 13 . -10.295 -16.161 9.108 1.00 41.07 13 A 1 ATOM 115 C CZ . TYR A 0 13 . -10.224 -15.310 8.052 1.00 41.07 13 A 1 ATOM 116 N N . LEU A 0 14 . -8.610 -11.316 1.978 1.00 37.38 14 A 1 ATOM 117 C CA . LEU A 0 14 . -8.613 -10.592 0.702 1.00 37.38 14 A 1 ATOM 118 C C . LEU A 0 14 . -7.953 -11.390 -0.433 1.00 37.38 14 A 1 ATOM 119 C CB . LEU A 0 14 . -7.920 -9.236 0.919 1.00 37.38 14 A 1 ATOM 120 O O . LEU A 0 14 . -8.382 -11.287 -1.581 1.00 37.38 14 A 1 ATOM 121 C CG . LEU A 0 14 . -8.907 -8.172 1.438 1.00 37.38 14 A 1 ATOM 122 C CD1 . LEU A 0 14 . -8.216 -7.203 2.394 1.00 37.38 14 A 1 ATOM 123 C CD2 . LEU A 0 14 . -9.486 -7.369 0.269 1.00 37.38 14 A 1 ATOM 124 N N . HIS A 0 15 . -6.946 -12.212 -0.122 1.00 39.28 15 A 1 ATOM 125 C CA . HIS A 0 15 . -6.264 -13.057 -1.108 1.00 39.28 15 A 1 ATOM 126 C C . HIS A 0 15 . -7.124 -14.247 -1.567 1.00 39.28 15 A 1 ATOM 127 C CB . HIS A 0 15 . -4.924 -13.535 -0.522 1.00 39.28 15 A 1 ATOM 128 O O . HIS A 0 15 . -6.973 -14.718 -2.691 1.00 39.28 15 A 1 ATOM 129 C CG . HIS A 0 15 . -3.804 -13.531 -1.530 1.00 39.28 15 A 1 ATOM 130 C CD2 . HIS A 0 15 . -3.577 -14.440 -2.529 1.00 39.28 15 A 1 ATOM 131 N ND1 . HIS A 0 15 . -2.815 -12.578 -1.614 1.00 39.28 15 A 1 ATOM 132 C CE1 . HIS A 0 15 . -2.004 -12.907 -2.632 1.00 39.28 15 A 1 ATOM 133 N NE2 . HIS A 0 15 . -2.430 -14.032 -3.224 1.00 39.28 15 A 1 ATOM 134 N N . SER A 0 16 . -8.036 -14.725 -0.714 1.00 38.40 16 A 1 ATOM 135 C CA . SER A 0 16 . -8.816 -15.940 -0.971 1.00 38.40 16 A 1 ATOM 136 C C . SER A 0 16 . -10.070 -15.726 -1.828 1.00 38.40 16 A 1 ATOM 137 C CB . SER A 0 16 . -9.190 -16.592 0.364 1.00 38.40 16 A 1 ATOM 138 O O . SER A 0 16 . -10.605 -16.709 -2.333 1.00 38.40 16 A 1 ATOM 139 O OG . SER A 0 16 . -9.720 -17.884 0.145 1.00 38.40 16 A 1 ATOM 140 N N . ASN A 0 17 . -10.561 -14.490 -1.992 1.00 40.91 17 A 1 ATOM 141 C CA . ASN A 0 17 . -11.921 -14.261 -2.505 1.00 40.91 17 A 1 ATOM 142 C C . ASN A 0 17 . -12.011 -13.641 -3.910 1.00 40.91 17 A 1 ATOM 143 C CB . ASN A 0 17 . -12.745 -13.503 -1.438 1.00 40.91 17 A 1 ATOM 144 O O . ASN A 0 17 . -13.112 -13.405 -4.394 1.00 40.91 17 A 1 ATOM 145 C CG . ASN A 0 17 . -14.104 -14.134 -1.156 1.00 40.91 17 A 1 ATOM 146 N ND2 . ASN A 0 17 . -14.913 -13.492 -0.348 1.00 40.91 17 A 1 ATOM 147 O OD1 . ASN A 0 17 . -14.451 -15.214 -1.600 1.00 40.91 17 A 1 ATOM 148 N N . ASN A 0 18 . -10.888 -13.394 -4.595 1.00 38.84 18 A 1 ATOM 149 C CA . ASN A 0 18 . -10.900 -12.817 -5.943 1.00 38.84 18 A 1 ATOM 150 C C . ASN A 0 18 . -9.953 -13.554 -6.898 1.00 38.84 18 A 1 ATOM 151 C CB . ASN A 0 18 . -10.609 -11.306 -5.859 1.00 38.84 18 A 1 ATOM 152 O O . ASN A 0 18 . -8.741 -13.351 -6.882 1.00 38.84 18 A 1 ATOM 153 C CG . ASN A 0 18 . -11.849 -10.492 -5.525 1.00 38.84 18 A 1 ATOM 154 N ND2 . ASN A 0 18 . -11.715 -9.441 -4.752 1.00 38.84 18 A 1 ATOM 155 O OD1 . ASN A 0 18 . -12.940 -10.742 -6.002 1.00 38.84 18 A 1 ATOM 156 N N . ASN A 0 19 . -10.548 -14.327 -7.813 1.00 41.22 19 A 1 ATOM 157 C CA . ASN A 0 19 . -9.925 -14.981 -8.977 1.00 41.22 19 A 1 ATOM 158 C C . ASN A 0 19 . -9.413 -13.991 -10.056 1.00 41.22 19 A 1 ATOM 159 C CB . ASN A 0 19 . -10.940 -16.008 -9.546 1.00 41.22 19 A 1 ATOM 160 O O . ASN A 0 19 . -9.302 -14.328 -11.234 1.00 41.22 19 A 1 ATOM 161 C CG . ASN A 0 19 . -10.754 -17.411 -8.998 1.00 41.22 19 A 1 ATOM 162 N ND2 . ASN A 0 19 . -11.814 -18.170 -8.852 1.00 41.22 19 A 1 ATOM 163 O OD1 . ASN A 0 19 . -9.656 -17.859 -8.729 1.00 41.22 19 A 1 ATOM 164 N N . TYR A 0 20 . -9.099 -12.749 -9.682 1.00 43.68 20 A 1 ATOM 165 C CA . TYR A 0 20 . -8.633 -11.710 -10.595 1.00 43.68 20 A 1 ATOM 166 C C . TYR A 0 20 . -7.111 -11.570 -10.484 1.00 43.68 20 A 1 ATOM 167 C CB . TYR A 0 20 . -9.405 -10.400 -10.345 1.00 43.68 20 A 1 ATOM 168 O O . TYR A 0 20 . -6.619 -10.948 -9.554 1.00 43.68 20 A 1 ATOM 169 C CG . TYR A 0 20 . -10.087 -9.870 -11.591 1.00 43.68 20 A 1 ATOM 170 C CD1 . TYR A 0 20 . -9.423 -8.955 -12.430 1.00 43.68 20 A 1 ATOM 171 C CD2 . TYR A 0 20 . -11.382 -10.314 -11.921 1.00 43.68 20 A 1 ATOM 172 C CE1 . TYR A 0 20 . -10.063 -8.460 -13.585 1.00 43.68 20 A 1 ATOM 173 C CE2 . TYR A 0 20 . -12.021 -9.830 -13.078 1.00 43.68 20 A 1 ATOM 174 O OH . TYR A 0 20 . -11.994 -8.428 -15.018 1.00 43.68 20 A 1 ATOM 175 C CZ . TYR A 0 20 . -11.367 -8.898 -13.908 1.00 43.68 20 A 1 ATOM 176 N N . SER A 0 21 . -6.393 -12.173 -11.444 1.00 49.65 21 A 1 ATOM 177 C CA . SER A 0 21 . -4.965 -12.000 -11.782 1.00 49.65 21 A 1 ATOM 178 C C . SER A 0 21 . -4.048 -11.566 -10.627 1.00 49.65 21 A 1 ATOM 179 C CB . SER A 0 21 . -4.861 -10.995 -12.937 1.00 49.65 21 A 1 ATOM 180 O O . SER A 0 21 . -4.040 -10.393 -10.260 1.00 49.65 21 A 1 ATOM 181 O OG . SER A 0 21 . -3.547 -10.937 -13.462 1.00 49.65 21 A 1 ATOM 182 N N . ASN A 0 22 . -3.201 -12.480 -10.130 1.00 51.25 22 A 1 ATOM 183 C CA . ASN A 0 22 . -2.231 -12.288 -9.031 1.00 51.25 22 A 1 ATOM 184 C C . ASN A 0 22 . -1.538 -10.908 -8.986 1.00 51.25 22 A 1 ATOM 185 C CB . ASN A 0 22 . -1.162 -13.400 -9.139 1.00 51.25 22 A 1 ATOM 186 O O . ASN A 0 22 . -1.259 -10.393 -7.907 1.00 51.25 22 A 1 ATOM 187 C CG . ASN A 0 22 . -1.668 -14.774 -8.730 1.00 51.25 22 A 1 ATOM 188 N ND2 . ASN A 0 22 . -0.952 -15.828 -9.044 1.00 51.25 22 A 1 ATOM 189 O OD1 . ASN A 0 22 . -2.718 -14.923 -8.142 1.00 51.25 22 A 1 ATOM 190 N N . ASN A 0 23 . -1.305 -10.273 -10.137 1.00 46.08 23 A 1 ATOM 191 C CA . ASN A 0 23 . -0.691 -8.949 -10.234 1.00 46.08 23 A 1 ATOM 192 C C . ASN A 0 23 . -1.563 -7.813 -9.663 1.00 46.08 23 A 1 ATOM 193 C CB . ASN A 0 23 . -0.360 -8.689 -11.711 1.00 46.08 23 A 1 ATOM 194 O O . ASN A 0 23 . -1.033 -6.901 -9.035 1.00 46.08 23 A 1 ATOM 195 C CG . ASN A 0 23 . 0.614 -9.698 -12.294 1.00 46.08 23 A 1 ATOM 196 N ND2 . ASN A 0 23 . 0.630 -9.848 -13.596 1.00 46.08 23 A 1 ATOM 197 O OD1 . ASN A 0 23 . 1.363 -10.377 -11.619 1.00 46.08 23 A 1 ATOM 198 N N . ASN A 0 24 . -2.886 -7.858 -9.846 1.00 47.98 24 A 1 ATOM 199 C CA . ASN A 0 24 . -3.792 -6.828 -9.327 1.00 47.98 24 A 1 ATOM 200 C C . ASN A 0 24 . -3.917 -6.922 -7.803 1.00 47.98 24 A 1 ATOM 201 C CB . ASN A 0 24 . -5.169 -6.956 -10.000 1.00 47.98 24 A 1 ATOM 202 O O . ASN A 0 24 . -3.904 -5.897 -7.125 1.00 47.98 24 A 1 ATOM 203 C CG . ASN A 0 24 . -5.205 -6.454 -11.431 1.00 47.98 24 A 1 ATOM 204 N ND2 . ASN A 0 24 . -6.334 -6.596 -12.084 1.00 47.98 24 A 1 ATOM 205 O OD1 . ASN A 0 24 . -4.259 -5.922 -11.988 1.00 47.98 24 A 1 ATOM 206 N N . ASN A 0 25 . -3.967 -8.144 -7.266 1.00 49.20 25 A 1 ATOM 207 C CA . ASN A 0 25 . -4.015 -8.375 -5.823 1.00 49.20 25 A 1 ATOM 208 C C . ASN A 0 25 . -2.746 -7.862 -5.130 1.00 49.20 25 A 1 ATOM 209 C CB . ASN A 0 25 . -4.264 -9.872 -5.556 1.00 49.20 25 A 1 ATOM 210 O O . ASN A 0 25 . -2.843 -7.208 -4.095 1.00 49.20 25 A 1 ATOM 211 C CG . ASN A 0 25 . -5.684 -10.310 -5.892 1.00 49.20 25 A 1 ATOM 212 N ND2 . ASN A 0 25 . -5.927 -11.598 -5.962 1.00 49.20 25 A 1 ATOM 213 O OD1 . ASN A 0 25 . -6.581 -9.505 -6.081 1.00 49.20 25 A 1 ATOM 214 N N . ILE A 0 26 . -1.566 -8.074 -5.727 1.00 50.58 26 A 1 ATOM 215 C CA . ILE A 0 26 . -0.300 -7.544 -5.200 1.00 50.58 26 A 1 ATOM 216 C C . ILE A 0 26 . -0.335 -6.012 -5.141 1.00 50.58 26 A 1 ATOM 217 C CB . ILE A 0 26 . 0.896 -8.080 -6.020 1.00 50.58 26 A 1 ATOM 218 O O . ILE A 0 26 . -0.028 -5.448 -4.099 1.00 50.58 26 A 1 ATOM 219 C CG1 . ILE A 0 26 . 1.065 -9.595 -5.763 1.00 50.58 26 A 1 ATOM 220 C CG2 . ILE A 0 26 . 2.204 -7.347 -5.661 1.00 50.58 26 A 1 ATOM 221 C CD1 . ILE A 0 26 . 1.972 -10.297 -6.782 1.00 50.58 26 A 1 ATOM 222 N N . ILE A 0 27 . -0.778 -5.339 -6.207 1.00 52.94 27 A 1 ATOM 223 C CA . ILE A 0 27 . -0.832 -3.867 -6.264 1.00 52.94 27 A 1 ATOM 224 C C . ILE A 0 27 . -1.809 -3.296 -5.226 1.00 52.94 27 A 1 ATOM 225 C CB . ILE A 0 27 . -1.175 -3.416 -7.703 1.00 52.94 27 A 1 ATOM 226 O O . ILE A 0 27 . -1.478 -2.327 -4.540 1.00 52.94 27 A 1 ATOM 227 C CG1 . ILE A 0 27 . -0.008 -3.769 -8.653 1.00 52.94 27 A 1 ATOM 228 C CG2 . ILE A 0 27 . -1.461 -1.905 -7.774 1.00 52.94 27 A 1 ATOM 229 C CD1 . ILE A 0 27 . -0.363 -3.636 -10.137 1.00 52.94 27 A 1 ATOM 230 N N . ILE A 0 28 . -2.982 -3.917 -5.063 1.00 55.49 28 A 1 ATOM 231 C CA . ILE A 0 28 . -3.968 -3.528 -4.043 1.00 55.49 28 A 1 ATOM 232 C C . ILE A 0 28 . -3.364 -3.664 -2.640 1.00 55.49 28 A 1 ATOM 233 C CB . ILE A 0 28 . -5.263 -4.361 -4.201 1.00 55.49 28 A 1 ATOM 234 O O . ILE A 0 28 . -3.470 -2.739 -1.837 1.00 55.49 28 A 1 ATOM 235 C CG1 . ILE A 0 28 . -5.998 -3.970 -5.503 1.00 55.49 28 A 1 ATOM 236 C CG2 . ILE A 0 28 . -6.211 -4.162 -3.002 1.00 55.49 28 A 1 ATOM 237 C CD1 . ILE A 0 28 . -7.068 -4.976 -5.944 1.00 55.49 28 A 1 ATOM 238 N N . ILE A 0 29 . -2.683 -4.779 -2.356 1.00 55.77 29 A 1 ATOM 239 C CA . ILE A 0 29 . -2.019 -5.020 -1.068 1.00 55.77 29 A 1 ATOM 240 C C . ILE A 0 29 . -0.896 -4.001 -0.836 1.00 55.77 29 A 1 ATOM 241 C CB . ILE A 0 29 . -1.522 -6.484 -0.995 1.00 55.77 29 A 1 ATOM 242 O O . ILE A 0 29 . -0.821 -3.416 0.243 1.00 55.77 29 A 1 ATOM 243 C CG1 . ILE A 0 29 . -2.725 -7.453 -0.907 1.00 55.77 29 A 1 ATOM 244 C CG2 . ILE A 0 29 . -0.592 -6.704 0.213 1.00 55.77 29 A 1 ATOM 245 C CD1 . ILE A 0 29 . -2.361 -8.918 -1.188 1.00 55.77 29 A 1 ATOM 246 N N . THR A 0 30 . -0.058 -3.731 -1.840 1.00 53.78 30 A 1 ATOM 247 C CA . THR A 0 30 . 1.026 -2.740 -1.758 1.00 53.78 30 A 1 ATOM 248 C C . THR A 0 30 . 0.492 -1.341 -1.463 1.00 53.78 30 A 1 ATOM 249 C CB . THR A 0 30 . 1.843 -2.722 -3.061 1.00 53.78 30 A 1 ATOM 250 O O . THR A 0 30 . 1.058 -0.627 -0.637 1.00 53.78 30 A 1 ATOM 251 C CG2 . THR A 0 30 . 3.039 -1.773 -3.009 1.00 53.78 30 A 1 ATOM 252 O OG1 . THR A 0 30 . 2.388 -3.995 -3.309 1.00 53.78 30 A 1 ATOM 253 N N . ILE A 0 31 . -0.624 -0.948 -2.075 1.00 56.59 31 A 1 ATOM 254 C CA . ILE A 0 31 . -1.186 0.393 -1.890 1.00 56.59 31 A 1 ATOM 255 C C . ILE A 0 31 . -1.944 0.516 -0.571 1.00 56.59 31 A 1 ATOM 256 C CB . ILE A 0 31 . -1.967 0.803 -3.150 1.00 56.59 31 A 1 ATOM 257 O O . ILE A 0 31 . -1.835 1.544 0.094 1.00 56.59 31 A 1 ATOM 258 C CG1 . ILE A 0 31 . -0.866 1.132 -4.187 1.00 56.59 31 A 1 ATOM 259 C CG2 . ILE A 0 31 . -2.882 2.014 -2.889 1.00 56.59 31 A 1 ATOM 260 C CD1 . ILE A 0 31 . -1.310 1.284 -5.624 1.00 56.59 31 A 1 ATOM 261 N N . LEU A 0 32 . -2.595 -0.550 -0.105 1.00 57.40 32 A 1 ATOM 262 C CA . LEU A 0 32 . -3.109 -0.604 1.265 1.00 57.40 32 A 1 ATOM 263 C C . LEU A 0 32 . -1.971 -0.478 2.293 1.00 57.40 32 A 1 ATOM 264 C CB . LEU A 0 32 . -3.919 -1.898 1.454 1.00 57.40 32 A 1 ATOM 265 O O . LEU A 0 32 . -2.088 0.305 3.235 1.00 57.40 32 A 1 ATOM 266 C CG . LEU A 0 32 . -5.288 -1.888 0.746 1.00 57.40 32 A 1 ATOM 267 C CD1 . LEU A 0 32 . -5.889 -3.294 0.780 1.00 57.40 32 A 1 ATOM 268 C CD2 . LEU A 0 32 . -6.275 -0.929 1.419 1.00 57.40 32 A 1 ATOM 269 N N . LEU A 0 33 . -0.839 -1.161 2.083 1.00 53.67 33 A 1 ATOM 270 C CA . LEU A 0 33 . 0.354 -1.046 2.935 1.00 53.67 33 A 1 ATOM 271 C C . LEU A 0 33 . 0.940 0.377 2.933 1.00 53.67 33 A 1 ATOM 272 C CB . LEU A 0 33 . 1.403 -2.077 2.479 1.00 53.67 33 A 1 ATOM 273 O O . LEU A 0 33 . 1.327 0.883 3.989 1.00 53.67 33 A 1 ATOM 274 C CG . LEU A 0 33 . 1.070 -3.530 2.864 1.00 53.67 33 A 1 ATOM 275 C CD1 . LEU A 0 33 . 1.929 -4.480 2.033 1.00 53.67 33 A 1 ATOM 276 C CD2 . LEU A 0 33 . 1.358 -3.791 4.345 1.00 53.67 33 A 1 ATOM 277 N N . GLN A 0 34 . 0.943 1.056 1.781 1.00 54.16 34 A 1 ATOM 278 C CA . GLN A 0 34 . 1.339 2.463 1.676 1.00 54.16 34 A 1 ATOM 279 C C . GLN A 0 34 . 0.398 3.415 2.402 1.00 54.16 34 A 1 ATOM 280 C CB . GLN A 0 34 . 1.360 2.903 0.216 1.00 54.16 34 A 1 ATOM 281 O O . GLN A 0 34 . 0.859 4.308 3.113 1.00 54.16 34 A 1 ATOM 282 C CG . GLN A 0 34 . 2.626 2.446 -0.470 1.00 54.16 34 A 1 ATOM 283 C CD . GLN A 0 34 . 2.740 3.163 -1.795 1.00 54.16 34 A 1 ATOM 284 N NE2 . GLN A 0 34 . 3.735 4.004 -1.971 1.00 54.16 34 A 1 ATOM 285 O OE1 . GLN A 0 34 . 1.902 3.069 -2.669 1.00 54.16 34 A 1 ATOM 286 N N . CYS A 0 35 . -0.912 3.237 2.235 1.00 52.45 35 A 1 ATOM 287 C CA . CYS A 0 35 . -1.914 4.086 2.872 1.00 52.45 35 A 1 ATOM 288 C C . CYS A 0 35 . -1.880 3.974 4.404 1.00 52.45 35 A 1 ATOM 289 C CB . CYS A 0 35 . -3.296 3.727 2.308 1.00 52.45 35 A 1 ATOM 290 O O . CYS A 0 35 . -2.241 4.930 5.087 1.00 52.45 35 A 1 ATOM 291 S SG . CYS A 0 35 . -3.450 4.310 0.593 1.00 52.45 35 A 1 ATOM 292 N N . ILE A 0 36 . -1.405 2.846 4.942 1.00 53.84 36 A 1 ATOM 293 C CA . ILE A 0 36 . -1.269 2.594 6.385 1.00 53.84 36 A 1 ATOM 294 C C . ILE A 0 36 . 0.076 3.122 6.943 1.00 53.84 36 A 1 ATOM 295 C CB . ILE A 0 36 . -1.565 1.092 6.656 1.00 53.84 36 A 1 ATOM 296 O O . ILE A 0 36 . 0.298 3.107 8.151 1.00 53.84 36 A 1 ATOM 297 C CG1 . ILE A 0 36 . -3.030 0.757 6.265 1.00 53.84 36 A 1 ATOM 298 C CG2 . ILE A 0 36 . -1.358 0.684 8.128 1.00 53.84 36 A 1 ATOM 299 C CD1 . ILE A 0 36 . -3.326 -0.745 6.151 1.00 53.84 36 A 1 ATOM 300 N N . GLY A 0 37 . 0.978 3.649 6.102 1.00 46.01 37 A 1 ATOM 301 C CA . GLY A 0 37 . 2.279 4.168 6.548 1.00 46.01 37 A 1 ATOM 302 C C . GLY A 0 37 . 3.291 3.074 6.905 1.00 46.01 37 A 1 ATOM 303 O O . GLY A 0 37 . 4.318 3.359 7.522 1.00 46.01 37 A 1 ATOM 304 N N . LEU A 0 38 . 3.040 1.827 6.490 1.00 42.30 38 A 1 ATOM 305 C CA . LEU A 0 38 . 3.983 0.718 6.612 1.00 42.30 38 A 1 ATOM 306 C C . LEU A 0 38 . 5.024 0.787 5.492 1.00 42.30 38 A 1 ATOM 307 C CB . LEU A 0 38 . 3.225 -0.622 6.683 1.00 42.30 38 A 1 ATOM 308 O O . LEU A 0 38 . 5.070 -0.041 4.585 1.00 42.30 38 A 1 ATOM 309 C CG . LEU A 0 38 . 2.580 -0.873 8.054 1.00 42.30 38 A 1 ATOM 310 C CD1 . LEU A 0 38 . 1.618 -2.058 7.967 1.00 42.30 38 A 1 ATOM 311 C CD2 . LEU A 0 38 . 3.649 -1.163 9.113 1.00 42.30 38 A 1 ATOM 312 N N . ILE A 0 39 . 5.914 1.774 5.600 1.00 43.56 39 A 1 ATOM 313 C CA . ILE A 0 39 . 7.176 1.885 4.851 1.00 43.56 39 A 1 ATOM 314 C C . ILE A 0 39 . 8.172 0.835 5.396 1.00 43.56 39 A 1 ATOM 315 C CB . ILE A 0 39 . 7.721 3.342 4.902 1.00 43.56 39 A 1 ATOM 316 O O . ILE A 0 39 . 9.270 1.160 5.830 1.00 43.56 39 A 1 ATOM 317 C CG1 . ILE A 0 39 . 6.633 4.379 4.520 1.00 43.56 39 A 1 ATOM 318 C CG2 . ILE A 0 39 . 8.931 3.528 3.960 1.00 43.56 39 A 1 ATOM 319 C CD1 . ILE A 0 39 . 7.069 5.843 4.670 1.00 43.56 39 A 1 ATOM 320 N N . PHE A 0 40 . 7.758 -0.435 5.471 1.00 39.51 40 A 1 ATOM 321 C CA . PHE A 0 40 . 8.579 -1.526 6.015 1.00 39.51 40 A 1 ATOM 322 C C . PHE A 0 40 . 8.364 -2.889 5.341 1.00 39.51 40 A 1 ATOM 323 C CB . PHE A 0 40 . 8.459 -1.596 7.551 1.00 39.51 40 A 1 ATOM 324 O O . PHE A 0 40 . 8.901 -3.889 5.815 1.00 39.51 40 A 1 ATOM 325 C CG . PHE A 0 40 . 9.757 -1.240 8.256 1.00 39.51 40 A 1 ATOM 326 C CD1 . PHE A 0 40 . 10.766 -2.208 8.431 1.00 39.51 40 A 1 ATOM 327 C CD2 . PHE A 0 40 . 9.971 0.075 8.709 1.00 39.51 40 A 1 ATOM 328 C CE1 . PHE A 0 40 . 11.973 -1.863 9.069 1.00 39.51 40 A 1 ATOM 329 C CE2 . PHE A 0 40 . 11.176 0.420 9.345 1.00 39.51 40 A 1 ATOM 330 C CZ . PHE A 0 40 . 12.176 -0.550 9.528 1.00 39.51 40 A 1 ATOM 331 N N . VAL A 0 41 . 7.676 -2.958 4.192 1.00 40.45 41 A 1 ATOM 332 C CA . VAL A 0 41 . 8.012 -4.029 3.242 1.00 40.45 41 A 1 ATOM 333 C C . VAL A 0 41 . 9.316 -3.602 2.594 1.00 40.45 41 A 1 ATOM 334 C CB . VAL A 0 41 . 6.918 -4.351 2.213 1.00 40.45 41 A 1 ATOM 335 O O . VAL A 0 41 . 9.330 -2.781 1.682 1.00 40.45 41 A 1 ATOM 336 C CG1 . VAL A 0 41 . 7.360 -5.509 1.304 1.00 40.45 41 A 1 ATOM 337 C CG2 . VAL A 0 41 . 5.647 -4.798 2.939 1.00 40.45 41 A 1 ATOM 338 N N . LYS A 0 42 . 10.416 -4.099 3.165 1.00 36.83 42 A 1 ATOM 339 C CA . LYS A 0 42 . 11.777 -3.966 2.651 1.00 36.83 42 A 1 ATOM 340 C C . LYS A 0 42 . 11.728 -4.163 1.134 1.00 36.83 42 A 1 ATOM 341 C CB . LYS A 0 42 . 12.654 -5.027 3.355 1.00 36.83 42 A 1 ATOM 342 O O . LYS A 0 42 . 11.460 -5.264 0.661 1.00 36.83 42 A 1 ATOM 343 C CG . LYS A 0 42 . 13.941 -4.448 3.950 1.00 36.83 42 A 1 ATOM 344 C CD . LYS A 0 42 . 14.719 -5.562 4.661 1.00 36.83 42 A 1 ATOM 345 C CE . LYS A 0 42 . 16.046 -5.022 5.202 1.00 36.83 42 A 1 ATOM 346 N NZ . LYS A 0 42 . 17.086 -6.069 5.185 1.00 36.83 42 A 1 ATOM 347 N N . THR A 0 43 . 11.962 -3.088 0.387 1.00 39.11 43 A 1 ATOM 348 C CA . THR A 0 43 . 12.022 -3.054 -1.084 1.00 39.11 43 A 1 ATOM 349 C C . THR A 0 43 . 12.957 -4.125 -1.660 1.00 39.11 43 A 1 ATOM 350 C CB . THR A 0 43 . 12.495 -1.661 -1.532 1.00 39.11 43 A 1 ATOM 351 O O . THR A 0 43 . 12.807 -4.512 -2.812 1.00 39.11 43 A 1 ATOM 352 C CG2 . THR A 0 43 . 11.399 -0.607 -1.369 1.00 39.11 43 A 1 ATOM 353 O OG1 . THR A 0 43 . 13.575 -1.243 -0.721 1.00 39.11 43 A 1 ATOM 354 N N . GLU A 0 44 . 13.861 -4.663 -0.837 1.00 38.28 44 A 1 ATOM 355 C CA . GLU A 0 44 . 14.729 -5.813 -1.106 1.00 38.28 44 A 1 ATOM 356 C C . GLU A 0 44 . 13.983 -7.095 -1.516 1.00 38.28 44 A 1 ATOM 357 C CB . GLU A 0 44 . 15.542 -6.117 0.165 1.00 38.28 44 A 1 ATOM 358 O O . GLU A 0 44 . 14.433 -7.775 -2.437 1.00 38.28 44 A 1 ATOM 359 C CG . GLU A 0 44 . 16.525 -5.001 0.561 1.00 38.28 44 A 1 ATOM 360 C CD . GLU A 0 44 . 17.247 -5.290 1.890 1.00 38.28 44 A 1 ATOM 361 O OE1 . GLU A 0 44 . 17.870 -4.364 2.448 1.00 38.28 44 A 1 ATOM 362 O OE2 . GLU A 0 44 . 17.079 -6.385 2.480 1.00 38.28 44 A 1 ATOM 363 N N . SER A 0 45 . 12.852 -7.441 -0.879 1.00 39.55 45 A 1 ATOM 364 C CA . SER A 0 45 . 12.143 -8.693 -1.206 1.00 39.55 45 A 1 ATOM 365 C C . SER A 0 45 . 11.513 -8.633 -2.587 1.00 39.55 45 A 1 ATOM 366 C CB . SER A 0 45 . 11.066 -9.028 -0.170 1.00 39.55 45 A 1 ATOM 367 O O . SER A 0 45 . 11.486 -9.624 -3.315 1.00 39.55 45 A 1 ATOM 368 O OG . SER A 0 45 . 10.087 -8.010 -0.085 1.00 39.55 45 A 1 ATOM 369 N N . ILE A 0 46 . 11.054 -7.444 -2.961 1.00 44.40 46 A 1 ATOM 370 C CA . ILE A 0 46 . 10.484 -7.222 -4.270 1.00 44.40 46 A 1 ATOM 371 C C . ILE A 0 46 . 11.629 -7.095 -5.305 1.00 44.40 46 A 1 ATOM 372 C CB . ILE A 0 46 . 9.460 -6.070 -4.220 1.00 44.40 46 A 1 ATOM 373 O O . ILE A 0 46 . 11.502 -7.664 -6.391 1.00 44.40 46 A 1 ATOM 374 C CG1 . ILE A 0 46 . 8.696 -5.862 -2.891 1.00 44.40 46 A 1 ATOM 375 C CG2 . ILE A 0 46 . 8.401 -6.353 -5.305 1.00 44.40 46 A 1 ATOM 376 C CD1 . ILE A 0 46 . 7.712 -4.680 -2.924 1.00 44.40 46 A 1 ATOM 377 N N . HIS A 0 47 . 12.786 -6.504 -4.928 1.00 44.79 47 A 1 ATOM 378 C CA . HIS A 0 47 . 14.004 -6.388 -5.760 1.00 44.79 47 A 1 ATOM 379 C C . HIS A 0 47 . 14.465 -7.712 -6.364 1.00 44.79 47 A 1 ATOM 380 C CB . HIS A 0 47 . 15.136 -5.597 -5.096 1.00 44.79 47 A 1 ATOM 381 O O . HIS A 0 47 . 14.569 -7.838 -7.586 1.00 44.79 47 A 1 ATOM 382 C CG . HIS A 0 47 . 16.027 -4.939 -6.135 1.00 44.79 47 A 1 ATOM 383 C CD2 . HIS A 0 47 . 17.244 -5.385 -6.586 1.00 44.79 47 A 1 ATOM 384 N ND1 . HIS A 0 47 . 15.736 -3.789 -6.845 1.00 44.79 47 A 1 ATOM 385 C CE1 . HIS A 0 47 . 16.757 -3.544 -7.684 1.00 44.79 47 A 1 ATOM 386 N NE2 . HIS A 0 47 . 17.702 -4.479 -7.548 1.00 44.79 47 A 1 ATOM 387 N N . GLY A 0 48 . 14.643 -8.725 -5.514 1.00 44.26 48 A 1 ATOM 388 C CA . GLY A 0 48 . 15.083 -10.048 -5.961 1.00 44.26 48 A 1 ATOM 389 C C . GLY A 0 48 . 14.088 -10.728 -6.906 1.00 44.26 48 A 1 ATOM 390 O O . GLY A 0 48 . 14.487 -11.387 -7.866 1.00 44.26 48 A 1 ATOM 391 N N . SER A 0 49 . 12.781 -10.530 -6.699 1.00 48.29 49 A 1 ATOM 392 C CA . SER A 0 49 . 11.772 -11.065 -7.619 1.00 48.29 49 A 1 ATOM 393 C C . SER A 0 49 . 11.777 -10.382 -8.990 1.00 48.29 49 A 1 ATOM 394 C CB . SER A 0 49 . 10.371 -11.077 -6.999 1.00 48.29 49 A 1 ATOM 395 O O . SER A 0 49 . 11.486 -11.052 -9.980 1.00 48.29 49 A 1 ATOM 396 O OG . SER A 0 49 . 10.075 -9.945 -6.211 1.00 48.29 49 A 1 ATOM 397 N N . TYR A 0 50 . 12.145 -9.099 -9.103 1.00 50.52 50 A 1 ATOM 398 C CA . TYR A 0 50 . 12.221 -8.453 -10.420 1.00 50.52 50 A 1 ATOM 399 C C . TYR A 0 50 . 13.441 -8.900 -11.223 1.00 50.52 50 A 1 ATOM 400 C CB . TYR A 0 50 . 12.244 -6.928 -10.352 1.00 50.52 50 A 1 ATOM 401 O O . TYR A 0 50 . 13.321 -9.052 -12.436 1.00 50.52 50 A 1 ATOM 402 C CG . TYR A 0 50 . 11.530 -6.270 -9.203 1.00 50.52 50 A 1 ATOM 403 C CD1 . TYR A 0 50 . 10.129 -6.258 -9.097 1.00 50.52 50 A 1 ATOM 404 C CD2 . TYR A 0 50 . 12.304 -5.519 -8.322 1.00 50.52 50 A 1 ATOM 405 C CE1 . TYR A 0 50 . 9.516 -5.466 -8.107 1.00 50.52 50 A 1 ATOM 406 C CE2 . TYR A 0 50 . 11.703 -4.802 -7.276 1.00 50.52 50 A 1 ATOM 407 O OH . TYR A 0 50 . 9.776 -3.903 -6.281 1.00 50.52 50 A 1 ATOM 408 C CZ . TYR A 0 50 . 10.311 -4.765 -7.176 1.00 50.52 50 A 1 ATOM 409 N N . GLU A 0 51 . 14.587 -9.138 -10.578 1.00 49.49 51 A 1 ATOM 410 C CA . GLU A 0 51 . 15.769 -9.682 -11.262 1.00 49.49 51 A 1 ATOM 411 C C . GLU A 0 51 . 15.468 -11.070 -11.844 1.00 49.49 51 A 1 ATOM 412 C CB . GLU A 0 51 . 16.973 -9.747 -10.313 1.00 49.49 51 A 1 ATOM 413 O O . GLU A 0 51 . 15.751 -11.333 -13.012 1.00 49.49 51 A 1 ATOM 414 C CG . GLU A 0 51 . 17.584 -8.362 -10.050 1.00 49.49 51 A 1 ATOM 415 C CD . GLU A 0 51 . 18.897 -8.448 -9.255 1.00 49.49 51 A 1 ATOM 416 O OE1 . GLU A 0 51 . 19.776 -7.594 -9.501 1.00 49.49 51 A 1 ATOM 417 O OE2 . GLU A 0 51 . 19.016 -9.374 -8.419 1.00 49.49 51 A 1 ATOM 418 N N . LEU A 0 52 . 14.778 -11.924 -11.080 1.00 48.06 52 A 1 ATOM 419 C CA . LEU A 0 52 . 14.340 -13.246 -11.541 1.00 48.06 52 A 1 ATOM 420 C C . LEU A 0 52 . 13.339 -13.174 -12.708 1.00 48.06 52 A 1 ATOM 421 C CB . LEU A 0 52 . 13.754 -14.007 -10.338 1.00 48.06 52 A 1 ATOM 422 O O . LEU A 0 52 . 13.394 -13.999 -13.622 1.00 48.06 52 A 1 ATOM 423 C CG . LEU A 0 52 . 14.844 -14.613 -9.433 1.00 48.06 52 A 1 ATOM 424 C CD1 . LEU A 0 52 . 14.296 -14.873 -8.031 1.00 48.06 52 A 1 ATOM 425 C CD2 . LEU A 0 52 . 15.337 -15.950 -9.996 1.00 48.06 52 A 1 ATOM 426 N N . ILE A 0 53 . 12.435 -12.189 -12.725 1.00 48.77 53 A 1 ATOM 427 C CA . ILE A 0 53 . 11.454 -12.049 -13.813 1.00 48.77 53 A 1 ATOM 428 C C . ILE A 0 53 . 12.071 -11.377 -15.052 1.00 48.77 53 A 1 ATOM 429 C CB . ILE A 0 53 . 10.165 -11.355 -13.326 1.00 48.77 53 A 1 ATOM 430 O O . ILE A 0 53 . 11.764 -11.783 -16.175 1.00 48.77 53 A 1 ATOM 431 C CG1 . ILE A 0 53 . 9.472 -12.165 -12.203 1.00 48.77 53 A 1 ATOM 432 C CG2 . ILE A 0 53 . 9.193 -11.238 -14.516 1.00 48.77 53 A 1 ATOM 433 C CD1 . ILE A 0 53 . 8.476 -11.331 -11.383 1.00 48.77 53 A 1 ATOM 434 N N . GLY A 0 54 . 12.989 -10.425 -14.874 1.00 50.74 54 A 1 ATOM 435 C CA . GLY A 0 54 . 13.746 -9.790 -15.959 1.00 50.74 54 A 1 ATOM 436 C C . GLY A 0 54 . 14.661 -10.756 -16.719 1.00 50.74 54 A 1 ATOM 437 O O . GLY A 0 54 . 14.970 -10.514 -17.883 1.00 50.74 54 A 1 ATOM 438 N N . LEU A 0 55 . 15.035 -11.882 -16.103 1.00 52.40 55 A 1 ATOM 439 C CA . LEU A 0 55 . 15.769 -12.971 -16.758 1.00 52.40 55 A 1 ATOM 440 C C . LEU A 0 55 . 14.884 -13.861 -17.649 1.00 52.40 55 A 1 ATOM 441 C CB . LEU A 0 55 . 16.473 -13.808 -15.673 1.00 52.40 55 A 1 ATOM 442 O O . LEU A 0 55 . 15.400 -14.535 -18.536 1.00 52.40 55 A 1 ATOM 443 C CG . LEU A 0 55 . 17.682 -13.106 -15.024 1.00 52.40 55 A 1 ATOM 444 C CD1 . LEU A 0 55 . 18.088 -13.848 -13.751 1.00 52.40 55 A 1 ATOM 445 C CD2 . LEU A 0 55 . 18.890 -13.073 -15.963 1.00 52.40 55 A 1 ATOM 446 N N . THR A 0 56 . 13.560 -13.876 -17.444 1.00 56.94 56 A 1 ATOM 447 C CA . THR A 0 56 . 12.627 -14.744 -18.200 1.00 56.94 56 A 1 ATOM 448 C C . THR A 0 56 . 11.794 -14.000 -19.243 1.00 56.94 56 A 1 ATOM 449 C CB . THR A 0 56 . 11.699 -15.543 -17.271 1.00 56.94 56 A 1 ATOM 450 O O . THR A 0 56 . 11.197 -14.627 -20.120 1.00 56.94 56 A 1 ATOM 451 C CG2 . THR A 0 56 . 12.469 -16.463 -16.326 1.00 56.94 56 A 1 ATOM 452 O OG1 . THR A 0 56 . 10.900 -14.691 -16.481 1.00 56.94 56 A 1 ATOM 453 N N . LYS A 0 57 . 11.732 -12.666 -19.173 1.00 55.72 57 A 1 ATOM 454 C CA . LYS A 0 57 . 10.970 -11.806 -20.090 1.00 55.72 57 A 1 ATOM 455 C C . LYS A 0 57 . 11.743 -10.524 -20.368 1.00 55.72 57 A 1 ATOM 456 C CB . LYS A 0 57 . 9.598 -11.476 -19.476 1.00 55.72 57 A 1 ATOM 457 O O . LYS A 0 57 . 12.392 -10.010 -19.468 1.00 55.72 57 A 1 ATOM 458 C CG . LYS A 0 57 . 8.689 -12.711 -19.433 1.00 55.72 57 A 1 ATOM 459 C CD . LYS A 0 57 . 7.302 -12.388 -18.878 1.00 55.72 57 A 1 ATOM 460 C CE . LYS A 0 57 . 6.492 -13.688 -18.895 1.00 55.72 57 A 1 ATOM 461 N NZ . LYS A 0 57 . 5.200 -13.549 -18.184 1.00 55.72 57 A 1 ATOM 462 N N . ASP A 0 58 . 11.608 -9.981 -21.584 1.00 59.42 58 A 1 ATOM 463 C CA . ASP A 0 58 . 12.217 -8.698 -21.958 1.00 59.42 58 A 1 ATOM 464 C C . ASP A 0 58 . 11.914 -7.634 -20.877 1.00 59.42 58 A 1 ATOM 465 C CB . ASP A 0 58 . 11.721 -8.250 -23.343 1.00 59.42 58 A 1 ATOM 466 O O . ASP A 0 58 . 10.737 -7.299 -20.653 1.00 59.42 58 A 1 ATOM 467 C CG . ASP A 0 58 . 12.329 -6.904 -23.758 1.00 59.42 58 A 1 ATOM 468 O OD1 . ASP A 0 58 . 11.920 -5.882 -23.152 1.00 59.42 58 A 1 ATOM 469 O OD2 . ASP A 0 58 . 13.176 -6.890 -24.670 1.00 59.42 58 A 1 ATOM 470 N N . PRO A 0 59 . 12.944 -7.122 -20.176 1.00 55.82 59 A 1 ATOM 471 C CA . PRO A 0 59 . 12.761 -6.315 -18.976 1.00 55.82 59 A 1 ATOM 472 C C . PRO A 0 59 . 12.057 -4.992 -19.279 1.00 55.82 59 A 1 ATOM 473 C CB . PRO A 0 59 . 14.167 -6.119 -18.393 1.00 55.82 59 A 1 ATOM 474 O O . PRO A 0 59 . 11.309 -4.490 -18.444 1.00 55.82 59 A 1 ATOM 475 C CG . PRO A 0 59 . 15.105 -6.352 -19.576 1.00 55.82 59 A 1 ATOM 476 C CD . PRO A 0 59 . 14.357 -7.393 -20.397 1.00 55.82 59 A 1 ATOM 477 N N . LYS A 0 60 . 12.207 -4.440 -20.490 1.00 59.78 60 A 1 ATOM 478 C CA . LYS A 0 60 . 11.524 -3.202 -20.891 1.00 59.78 60 A 1 ATOM 479 C C . LYS A 0 60 . 10.033 -3.441 -21.091 1.00 59.78 60 A 1 ATOM 480 C CB . LYS A 0 60 . 12.146 -2.640 -22.174 1.00 59.78 60 A 1 ATOM 481 O O . LYS A 0 60 . 9.217 -2.624 -20.671 1.00 59.78 60 A 1 ATOM 482 C CG . LYS A 0 60 . 13.603 -2.208 -21.976 1.00 59.78 60 A 1 ATOM 483 C CD . LYS A 0 60 . 14.166 -1.659 -23.290 1.00 59.78 60 A 1 ATOM 484 C CE . LYS A 0 60 . 15.609 -1.193 -23.078 1.00 59.78 60 A 1 ATOM 485 N NZ . LYS A 0 60 . 16.219 -0.720 -24.345 1.00 59.78 60 A 1 ATOM 486 N N . THR A 0 61 . 9.667 -4.573 -21.684 1.00 61.30 61 A 1 ATOM 487 C CA . THR A 0 61 . 8.262 -4.930 -21.918 1.00 61.30 61 A 1 ATOM 488 C C . THR A 0 61 . 7.549 -5.289 -20.615 1.00 61.30 61 A 1 ATOM 489 C CB . THR A 0 61 . 8.158 -6.094 -22.908 1.00 61.30 61 A 1 ATOM 490 O O . THR A 0 61 . 6.399 -4.895 -20.405 1.00 61.30 61 A 1 ATOM 491 C CG2 . THR A 0 61 . 6.707 -6.348 -23.332 1.00 61.30 61 A 1 ATOM 492 O OG1 . THR A 0 61 . 8.871 -5.791 -24.082 1.00 61.30 61 A 1 ATOM 493 N N . PHE A 0 62 . 8.220 -6.023 -19.724 1.00 61.55 62 A 1 ATOM 494 C CA . PHE A 0 62 . 7.664 -6.391 -18.425 1.00 61.55 62 A 1 ATOM 495 C C . PHE A 0 62 . 7.513 -5.170 -17.508 1.00 61.55 62 A 1 ATOM 496 C CB . PHE A 0 62 . 8.517 -7.496 -17.796 1.00 61.55 62 A 1 ATOM 497 O O . PHE A 0 62 . 6.409 -4.917 -17.020 1.00 61.55 62 A 1 ATOM 498 C CG . PHE A 0 62 . 7.930 -8.015 -16.501 1.00 61.55 62 A 1 ATOM 499 C CD1 . PHE A 0 62 . 8.511 -7.658 -15.271 1.00 61.55 62 A 1 ATOM 500 C CD2 . PHE A 0 62 . 6.778 -8.826 -16.524 1.00 61.55 62 A 1 ATOM 501 C CE1 . PHE A 0 62 . 7.946 -8.118 -14.072 1.00 61.55 62 A 1 ATOM 502 C CE2 . PHE A 0 62 . 6.195 -9.260 -15.319 1.00 61.55 62 A 1 ATOM 503 C CZ . PHE A 0 62 . 6.774 -8.894 -14.092 1.00 61.55 62 A 1 ATOM 504 N N . ASN A 0 63 . 8.562 -4.350 -17.378 1.00 60.08 63 A 1 ATOM 505 C CA . ASN A 0 63 . 8.507 -3.111 -16.601 1.00 60.08 63 A 1 ATOM 506 C C . ASN A 0 63 . 7.522 -2.110 -17.207 1.00 60.08 63 A 1 ATOM 507 C CB . ASN A 0 63 . 9.913 -2.500 -16.474 1.00 60.08 63 A 1 ATOM 508 O O . ASN A 0 63 . 6.772 -1.484 -16.475 1.00 60.08 63 A 1 ATOM 509 C CG . ASN A 0 63 . 10.833 -3.338 -15.601 1.00 60.08 63 A 1 ATOM 510 N ND2 . ASN A 0 63 . 12.129 -3.174 -15.720 1.00 60.08 63 A 1 ATOM 511 O OD1 . ASN A 0 63 . 10.401 -4.145 -14.799 1.00 60.08 63 A 1 ATOM 512 N N . GLY A 0 64 . 7.431 -1.995 -18.535 1.00 65.53 64 A 1 ATOM 513 C CA . GLY A 0 64 . 6.434 -1.141 -19.186 1.00 65.53 64 A 1 ATOM 514 C C . GLY A 0 64 . 4.994 -1.558 -18.865 1.00 65.53 64 A 1 ATOM 515 O O . GLY A 0 64 . 4.145 -0.707 -18.597 1.00 65.53 64 A 1 ATOM 516 N N . LYS A 0 65 . 4.713 -2.869 -18.823 1.00 68.35 65 A 1 ATOM 517 C CA . LYS A 0 65 . 3.394 -3.393 -18.430 1.00 68.35 65 A 1 ATOM 518 C C . LYS A 0 65 . 3.101 -3.169 -16.949 1.00 68.35 65 A 1 ATOM 519 C CB . LYS A 0 65 . 3.275 -4.883 -18.780 1.00 68.35 65 A 1 ATOM 520 O O . LYS A 0 65 . 1.989 -2.753 -16.626 1.00 68.35 65 A 1 ATOM 521 C CG . LYS A 0 65 . 3.036 -5.097 -20.280 1.00 68.35 65 A 1 ATOM 522 C CD . LYS A 0 65 . 2.943 -6.592 -20.607 1.00 68.35 65 A 1 ATOM 523 C CE . LYS A 0 65 . 2.694 -6.766 -22.109 1.00 68.35 65 A 1 ATOM 524 N NZ . LYS A 0 65 . 2.580 -8.195 -22.497 1.00 68.35 65 A 1 ATOM 525 N N . LEU A 0 66 . 4.063 -3.421 -16.061 1.00 65.36 66 A 1 ATOM 526 C CA . LEU A 0 66 . 3.905 -3.172 -14.625 1.00 65.36 66 A 1 ATOM 527 C C . LEU A 0 66 . 3.732 -1.685 -14.330 1.00 65.36 66 A 1 ATOM 528 C CB . LEU A 0 66 . 5.113 -3.715 -13.851 1.00 65.36 66 A 1 ATOM 529 O O . LEU A 0 66 . 2.791 -1.315 -13.635 1.00 65.36 66 A 1 ATOM 530 C CG . LEU A 0 66 . 5.165 -5.242 -13.694 1.00 65.36 66 A 1 ATOM 531 C CD1 . LEU A 0 66 . 6.397 -5.572 -12.858 1.00 65.36 66 A 1 ATOM 532 C CD2 . LEU A 0 66 . 3.936 -5.808 -12.972 1.00 65.36 66 A 1 ATOM 533 N N . CYS A 0 67 . 4.556 -0.839 -14.940 1.00 70.15 67 A 1 ATOM 534 C CA . CYS A 0 67 . 4.467 0.610 -14.858 1.00 70.15 67 A 1 ATOM 535 C C . CYS A 0 67 . 3.100 1.099 -15.332 1.00 70.15 67 A 1 ATOM 536 C CB . CYS A 0 67 . 5.581 1.211 -15.718 1.00 70.15 67 A 1 ATOM 537 O O . CYS A 0 67 . 2.393 1.793 -14.607 1.00 70.15 67 A 1 ATOM 538 S SG . CYS A 0 67 . 5.708 3.008 -15.618 1.00 70.15 67 A 1 ATOM 539 N N . GLY A 0 68 . 2.666 0.651 -16.514 1.00 70.61 68 A 1 ATOM 540 C CA . GLY A 0 68 . 1.345 0.972 -17.043 1.00 70.61 68 A 1 ATOM 541 C C . GLY A 0 68 . 0.209 0.490 -16.138 1.00 70.61 68 A 1 ATOM 542 O O . GLY A 0 68 . -0.791 1.188 -16.000 1.00 70.61 68 A 1 ATOM 543 N N . THR A 0 69 . 0.356 -0.670 -15.492 1.00 69.71 69 A 1 ATOM 544 C CA . THR A 0 69 . -0.636 -1.194 -14.538 1.00 69.71 69 A 1 ATOM 545 C C . THR A 0 69 . -0.663 -0.359 -13.261 1.00 69.71 69 A 1 ATOM 546 C CB . THR A 0 69 . -0.381 -2.672 -14.201 1.00 69.71 69 A 1 ATOM 547 O O . THR A 0 69 . -1.739 0.020 -12.812 1.00 69.71 69 A 1 ATOM 548 C CG2 . THR A 0 69 . -1.520 -3.278 -13.383 1.00 69.71 69 A 1 ATOM 549 O OG1 . THR A 0 69 . -0.309 -3.425 -15.393 1.00 69.71 69 A 1 ATOM 550 N N . CYS A 0 70 . 0.503 -0.008 -12.723 1.00 66.95 70 A 1 ATOM 551 C CA . CYS A 0 70 . 0.644 0.831 -11.540 1.00 66.95 70 A 1 ATOM 552 C C . CYS A 0 70 . 0.036 2.224 -11.768 1.00 66.95 70 A 1 ATOM 553 C CB . CYS A 0 70 . 2.132 0.882 -11.180 1.00 66.95 70 A 1 ATOM 554 O O . CYS A 0 70 . -0.816 2.664 -10.998 1.00 66.95 70 A 1 ATOM 555 S SG . CYS A 0 70 . 2.483 1.853 -9.704 1.00 66.95 70 A 1 ATOM 556 N N . LEU A 0 71 . 0.371 2.874 -12.885 1.00 71.24 71 A 1 ATOM 557 C CA . LEU A 0 71 . -0.193 4.172 -13.260 1.00 71.24 71 A 1 ATOM 558 C C . LEU A 0 71 . -1.708 4.097 -13.480 1.00 71.24 71 A 1 ATOM 559 C CB . LEU A 0 71 . 0.507 4.680 -14.532 1.00 71.24 71 A 1 ATOM 560 O O . LEU A 0 71 . -2.450 4.934 -12.970 1.00 71.24 71 A 1 ATOM 561 C CG . LEU A 0 71 . 1.981 5.081 -14.341 1.00 71.24 71 A 1 ATOM 562 C CD1 . LEU A 0 71 . 2.576 5.433 -15.704 1.00 71.24 71 A 1 ATOM 563 C CD2 . LEU A 0 71 . 2.132 6.287 -13.418 1.00 71.24 71 A 1 ATOM 564 N N . LYS A 0 72 . -2.197 3.074 -14.198 1.00 72.54 72 A 1 ATOM 565 C CA . LYS A 0 72 . -3.643 2.846 -14.370 1.00 72.54 72 A 1 ATOM 566 C C . LYS A 0 72 . -4.348 2.656 -13.037 1.00 72.54 72 A 1 ATOM 567 C CB . LYS A 0 72 . -3.902 1.614 -15.243 1.00 72.54 72 A 1 ATOM 568 O O . LYS A 0 72 . -5.469 3.133 -12.877 1.00 72.54 72 A 1 ATOM 569 C CG . LYS A 0 72 . -3.801 1.946 -16.733 1.00 72.54 72 A 1 ATOM 570 C CD . LYS A 0 72 . -3.989 0.670 -17.557 1.00 72.54 72 A 1 ATOM 571 C CE . LYS A 0 72 . -3.962 1.016 -19.046 1.00 72.54 72 A 1 ATOM 572 N NZ . LYS A 0 72 . -4.232 -0.178 -19.881 1.00 72.54 72 A 1 ATOM 573 N N . PHE A 0 73 . -3.709 1.973 -12.097 1.00 68.25 73 A 1 ATOM 574 C CA . PHE A 0 73 . -4.268 1.738 -10.780 1.00 68.25 73 A 1 ATOM 575 C C . PHE A 0 73 . -4.364 3.031 -9.970 1.00 68.25 73 A 1 ATOM 576 C CB . PHE A 0 73 . -3.448 0.668 -10.071 1.00 68.25 73 A 1 ATOM 577 O O . PHE A 0 73 . -5.448 3.341 -9.485 1.00 68.25 73 A 1 ATOM 578 C CG . PHE A 0 73 . -4.071 0.275 -8.761 1.00 68.25 73 A 1 ATOM 579 C CD1 . PHE A 0 73 . -3.689 0.930 -7.586 1.00 68.25 73 A 1 ATOM 580 C CD2 . PHE A 0 73 . -5.057 -0.725 -8.717 1.00 68.25 73 A 1 ATOM 581 C CE1 . PHE A 0 73 . -4.228 0.515 -6.357 1.00 68.25 73 A 1 ATOM 582 C CE2 . PHE A 0 73 . -5.635 -1.090 -7.491 1.00 68.25 73 A 1 ATOM 583 C CZ . PHE A 0 73 . -5.204 -0.483 -6.304 1.00 68.25 73 A 1 ATOM 584 N N . TYR A 0 74 . -3.293 3.831 -9.903 1.00 66.67 74 A 1 ATOM 585 C CA . TYR A 0 74 . -3.347 5.151 -9.266 1.00 66.67 74 A 1 ATOM 586 C C . TYR A 0 74 . -4.404 6.046 -9.905 1.00 66.67 74 A 1 ATOM 587 C CB . TYR A 0 74 . -1.988 5.850 -9.323 1.00 66.67 74 A 1 ATOM 588 O O . TYR A 0 74 . -5.192 6.643 -9.184 1.00 66.67 74 A 1 ATOM 589 C CG . TYR A 0 74 . -1.053 5.446 -8.208 1.00 66.67 74 A 1 ATOM 590 C CD1 . TYR A 0 74 . -1.321 5.842 -6.882 1.00 66.67 74 A 1 ATOM 591 C CD2 . TYR A 0 74 . 0.084 4.674 -8.494 1.00 66.67 74 A 1 ATOM 592 C CE1 . TYR A 0 74 . -0.472 5.430 -5.834 1.00 66.67 74 A 1 ATOM 593 C CE2 . TYR A 0 74 . 0.949 4.289 -7.457 1.00 66.67 74 A 1 ATOM 594 O OH . TYR A 0 74 . 1.510 4.212 -5.160 1.00 66.67 74 A 1 ATOM 595 C CZ . TYR A 0 74 . 0.667 4.649 -6.128 1.00 66.67 74 A 1 ATOM 596 N N . ASN A 0 75 . -4.498 6.077 -11.234 1.00 69.67 75 A 1 ATOM 597 C CA . ASN A 0 75 . -5.534 6.844 -11.925 1.00 69.67 75 A 1 ATOM 598 C C . ASN A 0 75 . -6.947 6.337 -11.598 1.00 69.67 75 A 1 ATOM 599 C CB . ASN A 0 75 . -5.264 6.793 -13.436 1.00 69.67 75 A 1 ATOM 600 O O . ASN A 0 75 . -7.858 7.138 -11.398 1.00 69.67 75 A 1 ATOM 601 C CG . ASN A 0 75 . -4.074 7.640 -13.849 1.00 69.67 75 A 1 ATOM 602 N ND2 . ASN A 0 75 . -3.506 7.386 -15.004 1.00 69.67 75 A 1 ATOM 603 O OD1 . ASN A 0 75 . -3.653 8.559 -13.174 1.00 69.67 75 A 1 ATOM 604 N N . SER A 0 76 . -7.135 5.019 -11.501 1.00 67.93 76 A 1 ATOM 605 C CA . SER A 0 76 . -8.423 4.420 -11.128 1.00 67.93 76 A 1 ATOM 606 C C . SER A 0 76 . -8.798 4.774 -9.691 1.00 67.93 76 A 1 ATOM 607 C CB . SER A 0 76 . -8.399 2.897 -11.286 1.00 67.93 76 A 1 ATOM 608 O O . SER A 0 76 . -9.926 5.186 -9.436 1.00 67.93 76 A 1 ATOM 609 O OG . SER A 0 76 . -8.088 2.540 -12.618 1.00 67.93 76 A 1 ATOM 610 N N . ILE A 0 77 . -7.838 4.697 -8.769 1.00 64.68 77 A 1 ATOM 611 C CA . ILE A 0 77 . -7.985 5.137 -7.381 1.00 64.68 77 A 1 ATOM 612 C C . ILE A 0 77 . -8.332 6.620 -7.333 1.00 64.68 77 A 1 ATOM 613 C CB . ILE A 0 77 . -6.704 4.776 -6.593 1.00 64.68 77 A 1 ATOM 614 O O . ILE A 0 77 . -9.354 6.977 -6.766 1.00 64.68 77 A 1 ATOM 615 C CG1 . ILE A 0 77 . -6.836 3.301 -6.160 1.00 64.68 77 A 1 ATOM 616 C CG2 . ILE A 0 77 . -6.393 5.696 -5.397 1.00 64.68 77 A 1 ATOM 617 C CD1 . ILE A 0 77 . -5.794 2.860 -5.136 1.00 64.68 77 A 1 ATOM 618 N N . MET A 0 78 . -7.555 7.482 -7.985 1.00 67.19 78 A 1 ATOM 619 C CA . MET A 0 78 . -7.823 8.918 -8.036 1.00 67.19 78 A 1 ATOM 620 C C . MET A 0 78 . -9.233 9.194 -8.557 1.00 67.19 78 A 1 ATOM 621 C CB . MET A 0 78 . -6.781 9.614 -8.920 1.00 67.19 78 A 1 ATOM 622 O O . MET A 0 78 . -9.954 9.978 -7.955 1.00 67.19 78 A 1 ATOM 623 C CG . MET A 0 78 . -5.428 9.706 -8.213 1.00 67.19 78 A 1 ATOM 624 S SD . MET A 0 78 . -4.074 10.328 -9.240 1.00 67.19 78 A 1 ATOM 625 C CE . MET A 0 78 . -4.455 12.101 -9.230 1.00 67.19 78 A 1 ATOM 626 N N . SER A 0 79 . -9.670 8.490 -9.604 1.00 69.38 79 A 1 ATOM 627 C CA . SER A 0 79 . -11.036 8.619 -10.122 1.00 69.38 79 A 1 ATOM 628 C C . SER A 0 79 . -12.108 8.157 -9.129 1.00 69.38 79 A 1 ATOM 629 C CB . SER A 0 79 . -11.169 7.882 -11.458 1.00 69.38 79 A 1 ATOM 630 O O . SER A 0 79 . -13.185 8.739 -9.093 1.00 69.38 79 A 1 ATOM 631 O OG . SER A 0 79 . -11.340 6.482 -11.317 1.00 69.38 79 A 1 ATOM 632 N N . LEU A 0 80 . -11.820 7.143 -8.306 1.00 63.89 80 A 1 ATOM 633 C CA . LEU A 0 80 . -12.716 6.651 -7.259 1.00 63.89 80 A 1 ATOM 634 C C . LEU A 0 80 . -12.795 7.630 -6.082 1.00 63.89 80 A 1 ATOM 635 C CB . LEU A 0 80 . -12.249 5.239 -6.851 1.00 63.89 80 A 1 ATOM 636 O O . LEU A 0 80 . -13.872 7.819 -5.533 1.00 63.89 80 A 1 ATOM 637 C CG . LEU A 0 80 . -13.164 4.528 -5.833 1.00 63.89 80 A 1 ATOM 638 C CD1 . LEU A 0 80 . -13.139 3.018 -6.088 1.00 63.89 80 A 1 ATOM 639 C CD2 . LEU A 0 80 . -12.730 4.754 -4.382 1.00 63.89 80 A 1 ATOM 640 N N . PHE A 0 81 . -11.682 8.275 -5.722 1.00 65.90 81 A 1 ATOM 641 C CA . PHE A 0 81 . -11.634 9.261 -4.637 1.00 65.90 81 A 1 ATOM 642 C C . PHE A 0 81 . -12.170 10.641 -5.034 1.00 65.90 81 A 1 ATOM 643 C CB . PHE A 0 81 . -10.215 9.331 -4.048 1.00 65.90 81 A 1 ATOM 644 O O . PHE A 0 81 . -12.642 11.376 -4.171 1.00 65.90 81 A 1 ATOM 645 C CG . PHE A 0 81 . -9.907 8.153 -3.140 1.00 65.90 81 A 1 ATOM 646 C CD1 . PHE A 0 81 . -10.402 8.132 -1.826 1.00 65.90 81 A 1 ATOM 647 C CD2 . PHE A 0 81 . -9.180 7.048 -3.608 1.00 65.90 81 A 1 ATOM 648 C CE1 . PHE A 0 81 . -10.230 6.987 -1.027 1.00 65.90 81 A 1 ATOM 649 C CE2 . PHE A 0 81 . -9.030 5.894 -2.820 1.00 65.90 81 A 1 ATOM 650 C CZ . PHE A 0 81 . -9.582 5.854 -1.537 1.00 65.90 81 A 1 ATOM 651 N N . LEU A 0 82 . -12.127 10.992 -6.321 1.00 68.80 82 A 1 ATOM 652 C CA . LEU A 0 82 . -12.722 12.226 -6.847 1.00 68.80 82 A 1 ATOM 653 C C . LEU A 0 82 . -14.239 12.108 -7.074 1.00 68.80 82 A 1 ATOM 654 C CB . LEU A 0 82 . -11.997 12.609 -8.150 1.00 68.80 82 A 1 ATOM 655 O O . LEU A 0 82 . -14.936 13.120 -7.099 1.00 68.80 82 A 1 ATOM 656 C CG . LEU A 0 82 . -10.550 13.102 -7.951 1.00 68.80 82 A 1 ATOM 657 C CD1 . LEU A 0 82 . -9.857 13.222 -9.310 1.00 68.80 82 A 1 ATOM 658 C CD2 . LEU A 0 82 . -10.492 14.467 -7.264 1.00 68.80 82 A 1 ATOM 659 N N . ASP A 0 83 . -14.750 10.890 -7.241 1.00 73.29 83 A 1 ATOM 660 C CA . ASP A 0 83 . -16.165 10.598 -7.462 1.00 73.29 83 A 1 ATOM 661 C C . ASP A 0 83 . -16.849 10.267 -6.126 1.00 73.29 83 A 1 ATOM 662 C CB . ASP A 0 83 . -16.239 9.471 -8.500 1.00 73.29 83 A 1 ATOM 663 O O . ASP A 0 83 . -16.766 9.144 -5.627 1.00 73.29 83 A 1 ATOM 664 C CG . ASP A 0 83 . -17.639 9.124 -9.003 1.00 73.29 83 A 1 ATOM 665 O OD1 . ASP A 0 83 . -18.630 9.419 -8.298 1.00 73.29 83 A 1 ATOM 666 O OD2 . ASP A 0 83 . -17.674 8.498 -10.098 1.00 73.29 83 A 1 ATOM 667 N N . TYR A 0 84 . -17.524 11.259 -5.535 1.00 69.43 84 A 1 ATOM 668 C CA . TYR A 0 84 . -18.179 11.133 -4.226 1.00 69.43 84 A 1 ATOM 669 C C . TYR A 0 84 . -19.134 9.932 -4.131 1.00 69.43 84 A 1 ATOM 670 C CB . TYR A 0 84 . -18.941 12.428 -3.901 1.00 69.43 84 A 1 ATOM 671 O O . TYR A 0 84 . -19.165 9.273 -3.095 1.00 69.43 84 A 1 ATOM 672 C CG . TYR A 0 84 . -18.058 13.598 -3.508 1.00 69.43 84 A 1 ATOM 673 C CD1 . TYR A 0 84 . -17.594 13.699 -2.182 1.00 69.43 84 A 1 ATOM 674 C CD2 . TYR A 0 84 . -17.710 14.585 -4.451 1.00 69.43 84 A 1 ATOM 675 C CE1 . TYR A 0 84 . -16.787 14.785 -1.793 1.00 69.43 84 A 1 ATOM 676 C CE2 . TYR A 0 84 . -16.900 15.672 -4.068 1.00 69.43 84 A 1 ATOM 677 O OH . TYR A 0 84 . -15.664 16.826 -2.366 1.00 69.43 84 A 1 ATOM 678 C CZ . TYR A 0 84 . -16.439 15.774 -2.739 1.00 69.43 84 A 1 ATOM 679 N N . GLY A 0 85 . -19.863 9.600 -5.204 1.00 73.32 85 A 1 ATOM 680 C CA . GLY A 0 85 . -20.789 8.462 -5.197 1.00 73.32 85 A 1 ATOM 681 C C . GLY A 0 85 . -20.061 7.117 -5.153 1.00 73.32 85 A 1 ATOM 682 O O . GLY A 0 85 . -20.462 6.198 -4.437 1.00 73.32 85 A 1 ATOM 683 N N . LYS A 0 86 . -18.933 6.997 -5.864 1.00 71.40 86 A 1 ATOM 684 C CA . LYS A 0 86 . -18.084 5.798 -5.764 1.00 71.40 86 A 1 ATOM 685 C C . LYS A 0 86 . -17.411 5.700 -4.406 1.00 71.40 86 A 1 ATOM 686 C CB . LYS A 0 86 . -17.018 5.784 -6.853 1.00 71.40 86 A 1 ATOM 687 O O . LYS A 0 86 . -17.264 4.590 -3.896 1.00 71.40 86 A 1 ATOM 688 C CG . LYS A 0 86 . -17.636 5.561 -8.229 1.00 71.40 86 A 1 ATOM 689 C CD . LYS A 0 86 . -16.516 5.577 -9.265 1.00 71.40 86 A 1 ATOM 690 C CE . LYS A 0 86 . -17.130 5.503 -10.660 1.00 71.40 86 A 1 ATOM 691 N NZ . LYS A 0 86 . -16.408 6.421 -11.557 1.00 71.40 86 A 1 ATOM 692 N N . LEU A 0 87 . -17.027 6.835 -3.828 1.00 67.23 87 A 1 ATOM 693 C CA . LEU A 0 87 . -16.389 6.888 -2.523 1.00 67.23 87 A 1 ATOM 694 C C . LEU A 0 87 . -17.298 6.346 -1.418 1.00 67.23 87 A 1 ATOM 695 C CB . LEU A 0 87 . -15.973 8.339 -2.238 1.00 67.23 87 A 1 ATOM 696 O O . LEU A 0 87 . -16.856 5.509 -0.635 1.00 67.23 87 A 1 ATOM 697 C CG . LEU A 0 87 . -15.030 8.452 -1.035 1.00 67.23 87 A 1 ATOM 698 C CD1 . LEU A 0 87 . -13.719 7.740 -1.356 1.00 67.23 87 A 1 ATOM 699 C CD2 . LEU A 0 87 . -14.731 9.921 -0.739 1.00 67.23 87 A 1 ATOM 700 N N . GLU A 0 88 . -18.562 6.765 -1.401 1.00 71.03 88 A 1 ATOM 701 C CA . GLU A 0 88 . -19.571 6.274 -0.457 1.00 71.03 88 A 1 ATOM 702 C C . GLU A 0 88 . -19.773 4.760 -0.607 1.00 71.03 88 A 1 ATOM 703 C CB . GLU A 0 88 . -20.864 7.063 -0.690 1.00 71.03 88 A 1 ATOM 704 O O . GLU A 0 88 . -19.614 4.014 0.357 1.00 71.03 88 A 1 ATOM 705 C CG . GLU A 0 88 . -21.967 6.729 0.324 1.00 71.03 88 A 1 ATOM 706 C CD . GLU A 0 88 . -23.180 7.665 0.172 1.00 71.03 88 A 1 ATOM 707 O OE1 . GLU A 0 88 . -23.843 7.929 1.199 1.00 71.03 88 A 1 ATOM 708 O OE2 . GLU A 0 88 . -23.402 8.170 -0.955 1.00 71.03 88 A 1 ATOM 709 N N . SER A 0 89 . -19.953 4.275 -1.840 1.00 72.96 89 A 1 ATOM 710 C CA . SER A 0 89 . -20.089 2.832 -2.096 1.00 72.96 89 A 1 ATOM 711 C C . SER A 0 89 . -18.852 2.017 -1.684 1.00 72.96 89 A 1 ATOM 712 C CB . SER A 0 89 . -20.393 2.602 -3.580 1.00 72.96 89 A 1 ATOM 713 O O . SER A 0 89 . -18.940 0.837 -1.344 1.00 72.96 89 A 1 ATOM 714 O OG . SER A 0 89 . -19.233 2.716 -4.397 1.00 72.96 89 A 1 ATOM 715 N N . PHE A 0 90 . -17.665 2.626 -1.741 1.00 69.40 90 A 1 ATOM 716 C CA . PHE A 0 90 . -16.418 1.999 -1.318 1.00 69.40 90 A 1 ATOM 717 C C . PHE A 0 90 . -16.283 1.998 0.206 1.00 69.40 90 A 1 ATOM 718 C CB . PHE A 0 90 . -15.249 2.716 -2.001 1.00 69.40 90 A 1 ATOM 719 O O . PHE A 0 90 . -15.817 1.014 0.779 1.00 69.40 90 A 1 ATOM 720 C CG . PHE A 0 90 . -13.902 2.092 -1.707 1.00 69.40 90 A 1 ATOM 721 C CD1 . PHE A 0 90 . -13.003 2.722 -0.828 1.00 69.40 90 A 1 ATOM 722 C CD2 . PHE A 0 90 . -13.552 0.870 -2.309 1.00 69.40 90 A 1 ATOM 723 C CE1 . PHE A 0 90 . -11.754 2.136 -0.560 1.00 69.40 90 A 1 ATOM 724 C CE2 . PHE A 0 90 . -12.310 0.275 -2.029 1.00 69.40 90 A 1 ATOM 725 C CZ . PHE A 0 90 . -11.411 0.907 -1.152 1.00 69.40 90 A 1 ATOM 726 N N . GLN A 0 91 . -16.725 3.070 0.863 1.00 69.66 91 A 1 ATOM 727 C CA . GLN A 0 91 . -16.806 3.160 2.315 1.00 69.66 91 A 1 ATOM 728 C C . GLN A 0 91 . -17.730 2.088 2.889 1.00 69.66 91 A 1 ATOM 729 C CB . GLN A 0 91 . -17.268 4.572 2.704 1.00 69.66 91 A 1 ATOM 730 O O . GLN A 0 91 . -17.318 1.392 3.813 1.00 69.66 91 A 1 ATOM 731 C CG . GLN A 0 91 . -17.477 4.704 4.218 1.00 69.66 91 A 1 ATOM 732 C CD . GLN A 0 91 . -17.651 6.144 4.680 1.00 69.66 91 A 1 ATOM 733 N NE2 . GLN A 0 91 . -18.148 6.347 5.878 1.00 69.66 91 A 1 ATOM 734 O OE1 . GLN A 0 91 . -17.318 7.112 4.016 1.00 69.66 91 A 1 ATOM 735 N N . GLU A 0 92 . -18.927 1.917 2.328 1.00 76.02 92 A 1 ATOM 736 C CA . GLU A 0 92 . -19.877 0.883 2.757 1.00 76.02 92 A 1 ATOM 737 C C . GLU A 0 92 . -19.254 -0.511 2.669 1.00 76.02 92 A 1 ATOM 738 C CB . GLU A 0 92 . -21.144 0.954 1.902 1.00 76.02 92 A 1 ATOM 739 O O . GLU A 0 92 . -19.230 -1.238 3.655 1.00 76.02 92 A 1 ATOM 740 C CG . GLU A 0 92 . -21.981 2.200 2.226 1.00 76.02 92 A 1 ATOM 741 C CD . GLU A 0 92 . -23.263 2.280 1.385 1.00 76.02 92 A 1 ATOM 742 O OE1 . GLU A 0 92 . -24.181 3.007 1.820 1.00 76.02 92 A 1 ATOM 743 O OE2 . GLU A 0 92 . -23.318 1.624 0.316 1.00 76.02 92 A 1 ATOM 744 N N . LYS A 0 93 . -18.596 -0.838 1.551 1.00 73.37 93 A 1 ATOM 745 C CA . LYS A 0 93 . -17.895 -2.124 1.396 1.00 73.37 93 A 1 ATOM 746 C C . LYS A 0 93 . -16.787 -2.343 2.425 1.00 73.37 93 A 1 ATOM 747 C CB . LYS A 0 93 . -17.297 -2.216 -0.007 1.00 73.37 93 A 1 ATOM 748 O O . LYS A 0 93 . -16.555 -3.470 2.854 1.00 73.37 93 A 1 ATOM 749 C CG . LYS A 0 93 . -18.390 -2.437 -1.050 1.00 73.37 93 A 1 ATOM 750 C CD . LYS A 0 93 . -17.786 -2.363 -2.451 1.00 73.37 93 A 1 ATOM 751 C CE . LYS A 0 93 . -18.927 -2.518 -3.450 1.00 73.37 93 A 1 ATOM 752 N NZ . LYS A 0 93 . -18.443 -2.389 -4.841 1.00 73.37 93 A 1 ATOM 753 N N . LEU A 0 94 . -16.056 -1.292 2.795 1.00 69.80 94 A 1 ATOM 754 C CA . LEU A 0 94 . -15.033 -1.387 3.838 1.00 69.80 94 A 1 ATOM 755 C C . LEU A 0 94 . -15.656 -1.563 5.227 1.00 69.80 94 A 1 ATOM 756 C CB . LEU A 0 94 . -14.130 -0.147 3.797 1.00 69.80 94 A 1 ATOM 757 O O . LEU A 0 94 . -15.113 -2.308 6.040 1.00 69.80 94 A 1 ATOM 758 C CG . LEU A 0 94 . -13.116 -0.100 2.645 1.00 69.80 94 A 1 ATOM 759 C CD1 . LEU A 0 94 . -12.371 1.233 2.724 1.00 69.80 94 A 1 ATOM 760 C CD2 . LEU A 0 94 . -12.072 -1.218 2.735 1.00 69.80 94 A 1 ATOM 761 N N . ILE A 0 95 . -16.791 -0.913 5.489 1.00 75.91 95 A 1 ATOM 762 C CA . ILE A 0 95 . -17.572 -1.091 6.718 1.00 75.91 95 A 1 ATOM 763 C C . ILE A 0 95 . -18.126 -2.519 6.800 1.00 75.91 95 A 1 ATOM 764 C CB . ILE A 0 95 . -18.673 -0.008 6.808 1.00 75.91 95 A 1 ATOM 765 O O . ILE A 0 95 . -18.024 -3.133 7.859 1.00 75.91 95 A 1 ATOM 766 C CG1 . ILE A 0 95 . -18.019 1.369 7.075 1.00 75.91 95 A 1 ATOM 767 C CG2 . ILE A 0 95 . -19.710 -0.336 7.898 1.00 75.91 95 A 1 ATOM 768 C CD1 . ILE A 0 95 . -18.981 2.555 6.934 1.00 75.91 95 A 1 ATOM 769 N N . ASP A 0 96 . -18.596 -3.090 5.691 1.00 75.74 96 A 1 ATOM 770 C CA . ASP A 0 96 . -19.045 -4.486 5.631 1.00 75.74 96 A 1 ATOM 771 C C . ASP A 0 96 . -17.904 -5.449 5.983 1.00 75.74 96 A 1 ATOM 772 C CB . ASP A 0 96 . -19.564 -4.821 4.225 1.00 75.74 96 A 1 ATOM 773 O O . ASP A 0 96 . -18.082 -6.403 6.738 1.00 75.74 96 A 1 ATOM 774 C CG . ASP A 0 96 . -20.858 -4.110 3.826 1.00 75.74 96 A 1 ATOM 775 O OD1 . ASP A 0 96 . -21.549 -3.577 4.721 1.00 75.74 96 A 1 ATOM 776 O OD2 . ASP A 0 96 . -21.142 -4.149 2.605 1.00 75.74 96 A 1 ATOM 777 N N . ILE A 0 97 . -16.685 -5.172 5.503 1.00 69.66 97 A 1 ATOM 778 C CA . ILE A 0 97 . -15.493 -5.941 5.887 1.00 69.66 97 A 1 ATOM 779 C C . ILE A 0 97 . -15.222 -5.810 7.392 1.00 69.66 97 A 1 ATOM 780 C CB . ILE A 0 97 . -14.271 -5.547 5.030 1.00 69.66 97 A 1 ATOM 781 O O . ILE A 0 97 . -14.837 -6.795 8.025 1.00 69.66 97 A 1 ATOM 782 C CG1 . ILE A 0 97 . -14.489 -6.003 3.570 1.00 69.66 97 A 1 ATOM 783 C CG2 . ILE A 0 97 . -12.975 -6.182 5.576 1.00 69.66 97 A 1 ATOM 784 C CD1 . ILE A 0 97 . -13.519 -5.358 2.572 1.00 69.66 97 A 1 ATOM 785 N N . CYS A 0 98 . -15.459 -4.635 7.987 1.00 67.80 98 A 1 ATOM 786 C CA . CYS A 0 98 . -15.275 -4.422 9.422 1.00 67.80 98 A 1 ATOM 787 C C . CYS A 0 98 . -16.151 -5.336 10.292 1.00 67.80 98 A 1 ATOM 788 C CB . CYS A 0 98 . -15.513 -2.957 9.809 1.00 67.80 98 A 1 ATOM 789 O O . CYS A 0 98 . -15.773 -5.618 11.432 1.00 67.80 98 A 1 ATOM 790 S SG . CYS A 0 98 . -14.376 -1.716 9.140 1.00 67.80 98 A 1 ATOM 791 N N . GLU A 0 99 . -17.280 -5.833 9.782 1.00 75.16 99 A 1 ATOM 792 C CA . GLU A 0 99 . -18.147 -6.764 10.514 1.00 75.16 99 A 1 ATOM 793 C C . GLU A 0 99 . -17.476 -8.121 10.762 1.00 75.16 99 A 1 ATOM 794 C CB . GLU A 0 99 . -19.481 -6.955 9.781 1.00 75.16 99 A 1 ATOM 795 O O . GLU A 0 99 . -17.661 -8.725 11.819 1.00 75.16 99 A 1 ATOM 796 C CG . GLU A 0 99 . -20.179 -5.615 9.510 1.00 75.16 99 A 1 ATOM 797 C CD . GLU A 0 99 . -21.690 -5.769 9.338 1.00 75.16 99 A 1 ATOM 798 O OE1 . GLU A 0 99 . -22.382 -4.906 9.936 1.00 75.16 99 A 1 ATOM 799 O OE2 . GLU A 0 99 . -22.134 -6.786 8.763 1.00 75.16 99 A 1 ATOM 800 N N . TYR A 0 100 . -16.607 -8.560 9.849 1.00 72.39 100 A 1 ATOM 801 C CA . TYR A 0 100 . -15.883 -9.831 9.957 1.00 72.39 100 A 1 ATOM 802 C C . TYR A 0 100 . -14.721 -9.791 10.957 1.00 72.39 100 A 1 ATOM 803 C CB . TYR A 0 100 . -15.401 -10.259 8.568 1.00 72.39 100 A 1 ATOM 804 O O . TYR A 0 100 . -14.129 -10.821 11.275 1.00 72.39 100 A 1 ATOM 805 C CG . TYR A 0 100 . -16.538 -10.534 7.607 1.00 72.39 100 A 1 ATOM 806 C CD1 . TYR A 0 100 . -17.152 -11.801 7.586 1.00 72.39 100 A 1 ATOM 807 C CD2 . TYR A 0 100 . -17.018 -9.509 6.774 1.00 72.39 100 A 1 ATOM 808 C CE1 . TYR A 0 100 . -18.233 -12.043 6.718 1.00 72.39 100 A 1 ATOM 809 C CE2 . TYR A 0 100 . -18.106 -9.740 5.914 1.00 72.39 100 A 1 ATOM 810 O OH . TYR A 0 100 . -19.768 -11.245 5.060 1.00 72.39 100 A 1 ATOM 811 C CZ . TYR A 0 100 . -18.713 -11.013 5.882 1.00 72.39 100 A 1 ATOM 812 N N . ILE A 0 101 . -14.391 -8.613 11.488 1.00 62.89 101 A 1 ATOM 813 C CA . ILE A 0 101 . -13.251 -8.396 12.389 1.00 62.89 101 A 1 ATOM 814 C C . ILE A 0 101 . -13.650 -8.588 13.870 1.00 62.89 101 A 1 ATOM 815 C CB . ILE A 0 101 . -12.611 -7.032 12.078 1.00 62.89 101 A 1 ATOM 816 O O . ILE A 0 101 . -12.866 -8.355 14.796 1.00 62.89 101 A 1 ATOM 817 C CG1 . ILE A 0 101 . -12.429 -6.796 10.560 1.00 62.89 101 A 1 ATOM 818 C CG2 . ILE A 0 101 . -11.221 -6.888 12.705 1.00 62.89 101 A 1 ATOM 819 C CD1 . ILE A 0 101 . -11.851 -5.414 10.286 1.00 62.89 101 A 1 ATOM 820 N N . GLY A 0 102 . -14.879 -9.044 14.125 1.00 68.88 102 A 1 ATOM 821 C CA . GLY A 0 102 . -15.357 -9.413 15.456 1.00 68.88 102 A 1 ATOM 822 C C . GLY A 0 102 . -15.248 -8.255 16.461 1.00 68.88 102 A 1 ATOM 823 O O . GLY A 0 102 . -15.801 -7.184 16.213 1.00 68.88 102 A 1 ATOM 824 N N . PRO A 0 103 . -14.535 -8.414 17.595 1.00 75.58 103 A 1 ATOM 825 C CA . PRO A 0 103 . -14.519 -7.426 18.681 1.00 75.58 103 A 1 ATOM 826 C C . PRO A 0 103 . -13.873 -6.080 18.308 1.00 75.58 103 A 1 ATOM 827 C CB . PRO A 0 103 . -13.758 -8.111 19.821 1.00 75.58 103 A 1 ATOM 828 O O . PRO A 0 103 . -13.973 -5.119 19.065 1.00 75.58 103 A 1 ATOM 829 C CG . PRO A 0 103 . -12.810 -9.062 19.093 1.00 75.58 103 A 1 ATOM 830 C CD . PRO A 0 103 . -13.645 -9.524 17.902 1.00 75.58 103 A 1 ATOM 831 N N . PHE A 0 104 . -13.202 -5.992 17.156 1.00 70.30 104 A 1 ATOM 832 C CA . PHE A 0 104 . -12.588 -4.759 16.661 1.00 70.30 104 A 1 ATOM 833 C C . PHE A 0 104 . -13.475 -3.983 15.682 1.00 70.30 104 A 1 ATOM 834 C CB . PHE A 0 104 . -11.240 -5.097 16.024 1.00 70.30 104 A 1 ATOM 835 O O . PHE A 0 104 . -13.022 -2.966 15.153 1.00 70.30 104 A 1 ATOM 836 C CG . PHE A 0 104 . -10.242 -5.697 16.984 1.00 70.30 104 A 1 ATOM 837 C CD1 . PHE A 0 104 . -9.510 -4.847 17.822 1.00 70.30 104 A 1 ATOM 838 C CD2 . PHE A 0 104 . -10.022 -7.084 17.029 1.00 70.30 104 A 1 ATOM 839 C CE1 . PHE A 0 104 . -8.546 -5.367 18.694 1.00 70.30 104 A 1 ATOM 840 C CE2 . PHE A 0 104 . -9.073 -7.613 17.921 1.00 70.30 104 A 1 ATOM 841 C CZ . PHE A 0 104 . -8.333 -6.756 18.754 1.00 70.30 104 A 1 ATOM 842 N N . ARG A 0 105 . -14.713 -4.438 15.433 1.00 70.10 105 A 1 ATOM 843 C CA . ARG A 0 105 . -15.651 -3.825 14.479 1.00 70.10 105 A 1 ATOM 844 C C . ARG A 0 105 . -15.726 -2.310 14.641 1.00 70.10 105 A 1 ATOM 845 C CB . ARG A 0 105 . -17.030 -4.482 14.638 1.00 70.10 105 A 1 ATOM 846 O O . ARG A 0 105 . -15.438 -1.594 13.690 1.00 70.10 105 A 1 ATOM 847 C CG . ARG A 0 105 . -18.083 -3.920 13.668 1.00 70.10 105 A 1 ATOM 848 C CD . ARG A 0 105 . -19.427 -4.604 13.930 1.00 70.10 105 A 1 ATOM 849 N NE . ARG A 0 105 . -20.480 -4.150 12.997 1.00 70.10 105 A 1 ATOM 850 N NH1 . ARG A 0 105 . -22.129 -3.676 14.526 1.00 70.10 105 A 1 ATOM 851 N NH2 . ARG A 0 105 . -22.588 -3.612 12.344 1.00 70.10 105 A 1 ATOM 852 C CZ . ARG A 0 105 . -21.722 -3.813 13.293 1.00 70.10 105 A 1 ATOM 853 N N . ASP A 0 106 . -15.997 -1.820 15.849 1.00 74.97 106 A 1 ATOM 854 C CA . ASP A 0 106 . -16.178 -0.383 16.101 1.00 74.97 106 A 1 ATOM 855 C C . ASP A 0 106 . -14.914 0.432 15.793 1.00 74.97 106 A 1 ATOM 856 C CB . ASP A 0 106 . -16.583 -0.165 17.567 1.00 74.97 106 A 1 ATOM 857 O O . ASP A 0 106 . -14.979 1.534 15.252 1.00 74.97 106 A 1 ATOM 858 C CG . ASP A 0 106 . -17.900 -0.847 17.947 1.00 74.97 106 A 1 ATOM 859 O OD1 . ASP A 0 106 . -18.685 -1.173 17.028 1.00 74.97 106 A 1 ATOM 860 O OD2 . ASP A 0 106 . -18.074 -1.078 19.161 1.00 74.97 106 A 1 ATOM 861 N N . GLN A 0 107 . -13.741 -0.135 16.080 1.00 67.50 107 A 1 ATOM 862 C CA . GLN A 0 107 . -12.452 0.501 15.806 1.00 67.50 107 A 1 ATOM 863 C C . GLN A 0 107 . -12.147 0.505 14.307 1.00 67.50 107 A 1 ATOM 864 C CB . GLN A 0 107 . -11.346 -0.223 16.586 1.00 67.50 107 A 1 ATOM 865 O O . GLN A 0 107 . -11.612 1.487 13.797 1.00 67.50 107 A 1 ATOM 866 C CG . GLN A 0 107 . -11.538 -0.080 18.104 1.00 67.50 107 A 1 ATOM 867 C CD . GLN A 0 107 . -10.711 -1.078 18.900 1.00 67.50 107 A 1 ATOM 868 N NE2 . GLN A 0 107 . -11.115 -1.397 20.109 1.00 67.50 107 A 1 ATOM 869 O OE1 . GLN A 0 107 . -9.692 -1.587 18.469 1.00 67.50 107 A 1 ATOM 870 N N . CYS A 0 108 . -12.517 -0.560 13.593 1.00 67.61 108 A 1 ATOM 871 C CA . CYS A 0 108 . -12.405 -0.615 12.142 1.00 67.61 108 A 1 ATOM 872 C C . CYS A 0 108 . -13.345 0.390 11.473 1.00 67.61 108 A 1 ATOM 873 C CB . CYS A 0 108 . -12.670 -2.040 11.664 1.00 67.61 108 A 1 ATOM 874 O O . CYS A 0 108 . -12.890 1.186 10.656 1.00 67.61 108 A 1 ATOM 875 S SG . CYS A 0 108 . -12.553 -2.249 9.865 1.00 67.61 108 A 1 ATOM 876 N N . VAL A 0 109 . -14.619 0.427 11.873 1.00 75.41 109 A 1 ATOM 877 C CA . VAL A 0 109 . -15.608 1.367 11.328 1.00 75.41 109 A 1 ATOM 878 C C . VAL A 0 109 . -15.175 2.809 11.584 1.00 75.41 109 A 1 ATOM 879 C CB . VAL A 0 109 . -17.009 1.093 11.911 1.00 75.41 109 A 1 ATOM 880 O O . VAL A 0 109 . -15.201 3.630 10.665 1.00 75.41 109 A 1 ATOM 881 C CG1 . VAL A 0 109 . -18.030 2.150 11.469 1.00 75.41 109 A 1 ATOM 882 C CG2 . VAL A 0 109 . -17.529 -0.270 11.438 1.00 75.41 109 A 1 ATOM 883 N N . ALA A 0 110 . -14.700 3.121 12.794 1.00 74.55 110 A 1 ATOM 884 C CA . ALA A 0 110 . -14.170 4.442 13.118 1.00 74.55 110 A 1 ATOM 885 C C . ALA A 0 110 . -12.932 4.794 12.275 1.00 74.55 110 A 1 ATOM 886 C CB . ALA A 0 110 . -13.849 4.489 14.615 1.00 74.55 110 A 1 ATOM 887 O O . ALA A 0 110 . -12.797 5.927 11.804 1.00 74.55 110 A 1 ATOM 888 N N . LEU A 0 111 . -12.036 3.831 12.050 1.00 67.02 111 A 1 ATOM 889 C CA . LEU A 0 111 . -10.848 4.036 11.230 1.00 67.02 111 A 1 ATOM 890 C C . LEU A 0 111 . -11.217 4.301 9.767 1.00 67.02 111 A 1 ATOM 891 C CB . LEU A 0 111 . -9.916 2.825 11.372 1.00 67.02 111 A 1 ATOM 892 O O . LEU A 0 111 . -10.733 5.283 9.205 1.00 67.02 111 A 1 ATOM 893 C CG . LEU A 0 111 . -8.551 3.044 10.703 1.00 67.02 111 A 1 ATOM 894 C CD1 . LEU A 0 111 . -7.645 3.955 11.534 1.00 67.02 111 A 1 ATOM 895 C CD2 . LEU A 0 111 . -7.844 1.706 10.569 1.00 67.02 111 A 1 ATOM 896 N N . VAL A 0 112 . -12.083 3.475 9.175 1.00 69.48 112 A 1 ATOM 897 C CA . VAL A 0 112 . -12.566 3.626 7.794 1.00 69.48 112 A 1 ATOM 898 C C . VAL A 0 112 . -13.251 4.982 7.629 1.00 69.48 112 A 1 ATOM 899 C CB . VAL A 0 112 . -13.500 2.457 7.411 1.00 69.48 112 A 1 ATOM 900 O O . VAL A 0 112 . -12.853 5.763 6.770 1.00 69.48 112 A 1 ATOM 901 C CG1 . VAL A 0 112 . -14.205 2.681 6.070 1.00 69.48 112 A 1 ATOM 902 C CG2 . VAL A 0 112 . -12.701 1.152 7.297 1.00 69.48 112 A 1 ATOM 903 N N . THR A 0 113 . -14.199 5.302 8.511 1.00 73.01 113 A 1 ATOM 904 C CA . THR A 0 113 . -15.042 6.503 8.415 1.00 73.01 113 A 1 ATOM 905 C C . THR A 0 113 . -14.257 7.798 8.636 1.00 73.01 113 A 1 ATOM 906 C CB . THR A 0 113 . -16.202 6.415 9.421 1.00 73.01 113 A 1 ATOM 907 O O . THR A 0 113 . -14.376 8.736 7.852 1.00 73.01 113 A 1 ATOM 908 C CG2 . THR A 0 113 . -17.194 7.570 9.304 1.00 73.01 113 A 1 ATOM 909 O OG1 . THR A 0 113 . -16.924 5.223 9.215 1.00 73.01 113 A 1 ATOM 910 N N . PHE A 0 114 . -13.437 7.880 9.690 1.00 68.94 114 A 1 ATOM 911 C CA . PHE A 0 114 . -12.826 9.155 10.095 1.00 68.94 114 A 1 ATOM 912 C C . PHE A 0 114 . -11.371 9.321 9.662 1.00 68.94 114 A 1 ATOM 913 C CB . PHE A 0 114 . -12.951 9.323 11.614 1.00 68.94 114 A 1 ATOM 914 O O . PHE A 0 114 . -10.921 10.444 9.414 1.00 68.94 114 A 1 ATOM 915 C CG . PHE A 0 114 . -14.379 9.490 12.087 1.00 68.94 114 A 1 ATOM 916 C CD1 . PHE A 0 114 . -15.068 10.682 11.796 1.00 68.94 114 A 1 ATOM 917 C CD2 . PHE A 0 114 . -15.026 8.464 12.801 1.00 68.94 114 A 1 ATOM 918 C CE1 . PHE A 0 114 . -16.397 10.850 12.219 1.00 68.94 114 A 1 ATOM 919 C CE2 . PHE A 0 114 . -16.356 8.633 13.223 1.00 68.94 114 A 1 ATOM 920 C CZ . PHE A 0 114 . -17.041 9.826 12.933 1.00 68.94 114 A 1 ATOM 921 N N . THR A 0 115 . -10.611 8.228 9.599 1.00 65.80 115 A 1 ATOM 922 C CA . THR A 0 115 . -9.150 8.301 9.456 1.00 65.80 115 A 1 ATOM 923 C C . THR A 0 115 . -8.709 7.976 8.042 1.00 65.80 115 A 1 ATOM 924 C CB . THR A 0 115 . -8.447 7.385 10.462 1.00 65.80 115 A 1 ATOM 925 O O . THR A 0 115 . -7.934 8.730 7.460 1.00 65.80 115 A 1 ATOM 926 C CG2 . THR A 0 115 . -6.932 7.590 10.480 1.00 65.80 115 A 1 ATOM 927 O OG1 . THR A 0 115 . -8.909 7.664 11.764 1.00 65.80 115 A 1 ATOM 928 N N . MET A 0 116 . -9.218 6.885 7.473 1.00 63.16 116 A 1 ATOM 929 C CA . MET A 0 116 . -8.762 6.345 6.200 1.00 63.16 116 A 1 ATOM 930 C C . MET A 0 116 . -9.054 7.314 5.056 1.00 63.16 116 A 1 ATOM 931 C CB . MET A 0 116 . -9.389 4.962 5.997 1.00 63.16 116 A 1 ATOM 932 O O . MET A 0 116 . -8.126 7.703 4.358 1.00 63.16 116 A 1 ATOM 933 C CG . MET A 0 116 . -8.818 4.234 4.782 1.00 63.16 116 A 1 ATOM 934 S SD . MET A 0 116 . -9.320 2.498 4.696 1.00 63.16 116 A 1 ATOM 935 C CE . MET A 0 116 . -8.509 1.994 3.156 1.00 63.16 116 A 1 ATOM 936 N N . PHE A 0 117 . -10.283 7.815 4.915 1.00 64.95 117 A 1 ATOM 937 C CA . PHE A 0 117 . -10.612 8.768 3.846 1.00 64.95 117 A 1 ATOM 938 C C . PHE A 0 117 . -9.897 10.108 3.984 1.00 64.95 117 A 1 ATOM 939 C CB . PHE A 0 117 . -12.127 8.971 3.782 1.00 64.95 117 A 1 ATOM 940 O O . PHE A 0 117 . -9.388 10.648 3.003 1.00 64.95 117 A 1 ATOM 941 C CG . PHE A 0 117 . -12.802 7.746 3.225 1.00 64.95 117 A 1 ATOM 942 C CD1 . PHE A 0 117 . -12.535 7.372 1.902 1.00 64.95 117 A 1 ATOM 943 C CD2 . PHE A 0 117 . -13.602 6.930 4.036 1.00 64.95 117 A 1 ATOM 944 C CE1 . PHE A 0 117 . -13.026 6.158 1.396 1.00 64.95 117 A 1 ATOM 945 C CE2 . PHE A 0 117 . -14.091 5.716 3.531 1.00 64.95 117 A 1 ATOM 946 C CZ . PHE A 0 117 . -13.811 5.331 2.210 1.00 64.95 117 A 1 ATOM 947 N N . LYS A 0 118 . -9.785 10.629 5.209 1.00 65.95 118 A 1 ATOM 948 C CA . LYS A 0 118 . -9.052 11.873 5.468 1.00 65.95 118 A 1 ATOM 949 C C . LYS A 0 118 . -7.564 11.723 5.151 1.00 65.95 118 A 1 ATOM 950 C CB . LYS A 0 118 . -9.298 12.292 6.921 1.00 65.95 118 A 1 ATOM 951 O O . LYS A 0 118 . -6.969 12.624 4.558 1.00 65.95 118 A 1 ATOM 952 C CG . LYS A 0 118 . -8.742 13.692 7.209 1.00 65.95 118 A 1 ATOM 953 C CD . LYS A 0 118 . -9.113 14.107 8.635 1.00 65.95 118 A 1 ATOM 954 C CE . LYS A 0 118 . -8.626 15.528 8.933 1.00 65.95 118 A 1 ATOM 955 N NZ . LYS A 0 118 . -9.061 15.960 10.284 1.00 65.95 118 A 1 ATOM 956 N N . ALA A 0 119 . -6.968 10.591 5.526 1.00 62.36 119 A 1 ATOM 957 C CA . ALA A 0 119 . -5.586 10.266 5.206 1.00 62.36 119 A 1 ATOM 958 C C . ALA A 0 119 . -5.403 10.074 3.698 1.00 62.36 119 A 1 ATOM 959 C CB . ALA A 0 119 . -5.164 9.019 5.992 1.00 62.36 119 A 1 ATOM 960 O O . ALA A 0 119 . -4.473 10.637 3.131 1.00 62.36 119 A 1 ATOM 961 N N . ILE A 0 120 . -6.308 9.355 3.034 1.00 60.52 120 A 1 ATOM 962 C CA . ILE A 0 120 . -6.214 9.078 1.604 1.00 60.52 120 A 1 ATOM 963 C C . ILE A 0 120 . -6.410 10.349 0.775 1.00 60.52 120 A 1 ATOM 964 C CB . ILE A 0 120 . -7.152 7.931 1.188 1.00 60.52 120 A 1 ATOM 965 O O . ILE A 0 120 . -5.569 10.616 -0.070 1.00 60.52 120 A 1 ATOM 966 C CG1 . ILE A 0 120 . -6.702 6.586 1.800 1.00 60.52 120 A 1 ATOM 967 C CG2 . ILE A 0 120 . -7.092 7.812 -0.334 1.00 60.52 120 A 1 ATOM 968 C CD1 . ILE A 0 120 . -7.751 5.477 1.656 1.00 60.52 120 A 1 ATOM 969 N N . ASN A 0 121 . -7.403 11.199 1.047 1.00 60.98 121 A 1 ATOM 970 C CA . ASN A 0 121 . -7.571 12.465 0.316 1.00 60.98 121 A 1 ATOM 971 C C . ASN A 0 121 . -6.351 13.389 0.473 1.00 60.98 121 A 1 ATOM 972 C CB . ASN A 0 121 . -8.863 13.162 0.791 1.00 60.98 121 A 1 ATOM 973 O O . ASN A 0 121 . -5.897 14.029 -0.481 1.00 60.98 121 A 1 ATOM 974 C CG . ASN A 0 121 . -10.112 12.572 0.158 1.00 60.98 121 A 1 ATOM 975 N ND2 . ASN A 0 121 . -11.285 12.982 0.579 1.00 60.98 121 A 1 ATOM 976 O OD1 . ASN A 0 121 . -10.053 11.758 -0.742 1.00 60.98 121 A 1 ATOM 977 N N . LYS A 0 122 . -5.766 13.426 1.676 1.00 64.40 122 A 1 ATOM 978 C CA . LYS A 0 122 . -4.541 14.191 1.939 1.00 64.40 122 A 1 ATOM 979 C C . LYS A 0 122 . -3.314 13.586 1.252 1.00 64.40 122 A 1 ATOM 980 C CB . LYS A 0 122 . -4.351 14.295 3.455 1.00 64.40 122 A 1 ATOM 981 O O . LYS A 0 122 . -2.421 14.330 0.854 1.00 64.40 122 A 1 ATOM 982 C CG . LYS A 0 122 . -3.188 15.227 3.817 1.00 64.40 122 A 1 ATOM 983 C CD . LYS A 0 122 . -3.064 15.354 5.336 1.00 64.40 122 A 1 ATOM 984 C CE . LYS A 0 122 . -1.905 16.294 5.679 1.00 64.40 122 A 1 ATOM 985 N NZ . LYS A 0 122 . -1.719 16.410 7.147 1.00 64.40 122 A 1 ATOM 986 N N . SER A 0 123 . -3.254 12.263 1.138 1.00 62.21 123 A 1 ATOM 987 C CA . SER A 0 123 . -2.154 11.554 0.489 1.00 62.21 123 A 1 ATOM 988 C C . SER A 0 123 . -2.269 11.628 -1.030 1.00 62.21 123 A 1 ATOM 989 C CB . SER A 0 123 . -2.091 10.107 0.976 1.00 62.21 123 A 1 ATOM 990 O O . SER A 0 123 . -1.306 12.011 -1.673 1.00 62.21 123 A 1 ATOM 991 O OG . SER A 0 123 . -1.716 10.092 2.341 1.00 62.21 123 A 1 ATOM 992 N N . ILE A 0 124 . -3.441 11.365 -1.611 1.00 64.07 124 A 1 ATOM 993 C CA . ILE A 0 124 . -3.679 11.381 -3.062 1.00 64.07 124 A 1 ATOM 994 C C . ILE A 0 124 . -3.370 12.746 -3.670 1.00 64.07 124 A 1 ATOM 995 C CB . ILE A 0 124 . -5.121 10.933 -3.388 1.00 64.07 124 A 1 ATOM 996 O O . ILE A 0 124 . -2.734 12.807 -4.713 1.00 64.07 124 A 1 ATOM 997 C CG1 . ILE A 0 124 . -5.221 9.414 -3.151 1.00 64.07 124 A 1 ATOM 998 C CG2 . ILE A 0 124 . -5.484 11.265 -4.846 1.00 64.07 124 A 1 ATOM 999 C CD1 . ILE A 0 124 . -6.628 8.863 -3.368 1.00 64.07 124 A 1 ATOM 1000 N N . SER A 0 125 . -3.741 13.839 -3.000 1.00 66.57 125 A 1 ATOM 1001 C CA . SER A 0 125 . -3.407 15.195 -3.470 1.00 66.57 125 A 1 ATOM 1002 C C . SER A 0 125 . -1.900 15.483 -3.519 1.00 66.57 125 A 1 ATOM 1003 C CB . SER A 0 125 . -4.111 16.254 -2.616 1.00 66.57 125 A 1 ATOM 1004 O O . SER A 0 125 . -1.486 16.442 -4.165 1.00 66.57 125 A 1 ATOM 1005 O OG . SER A 0 125 . -3.913 16.034 -1.231 1.00 66.57 125 A 1 ATOM 1006 N N . LYS A 0 126 . -1.076 14.670 -2.848 1.00 67.60 126 A 1 ATOM 1007 C CA . LYS A 0 126 . 0.390 14.779 -2.823 1.00 67.60 126 A 1 ATOM 1008 C C . LYS A 0 126 . 1.106 13.635 -3.538 1.00 67.60 126 A 1 ATOM 1009 C CB . LYS A 0 126 . 0.863 14.836 -1.369 1.00 67.60 126 A 1 ATOM 1010 O O . LYS A 0 126 . 2.317 13.712 -3.724 1.00 67.60 126 A 1 ATOM 1011 C CG . LYS A 0 126 . 0.346 16.077 -0.641 1.00 67.60 126 A 1 ATOM 1012 C CD . LYS A 0 126 . 0.993 16.137 0.741 1.00 67.60 126 A 1 ATOM 1013 C CE . LYS A 0 126 . 0.541 17.410 1.447 1.00 67.60 126 A 1 ATOM 1014 N NZ . LYS A 0 126 . 1.421 17.695 2.603 1.00 67.60 126 A 1 ATOM 1015 N N . ILE A 0 127 . 0.393 12.564 -3.872 1.00 67.06 127 A 1 ATOM 1016 C CA . ILE A 0 127 . 0.950 11.389 -4.528 1.00 67.06 127 A 1 ATOM 1017 C C . ILE A 0 127 . 1.061 11.704 -6.014 1.00 67.06 127 A 1 ATOM 1018 C CB . ILE A 0 127 . 0.095 10.137 -4.222 1.00 67.06 127 A 1 ATOM 1019 O O . ILE A 0 127 . 0.058 11.867 -6.702 1.00 67.06 127 A 1 ATOM 1020 C CG1 . ILE A 0 127 . 0.425 9.607 -2.806 1.00 67.06 127 A 1 ATOM 1021 C CG2 . ILE A 0 127 . 0.326 9.012 -5.245 1.00 67.06 127 A 1 ATOM 1022 C CD1 . ILE A 0 127 . -0.620 8.629 -2.248 1.00 67.06 127 A 1 ATOM 1023 N N . ASP A 0 128 . 2.293 11.745 -6.505 1.00 71.03 128 A 1 ATOM 1024 C CA . ASP A 0 128 . 2.567 11.635 -7.930 1.00 71.03 128 A 1 ATOM 1025 C C . ASP A 0 128 . 2.603 10.133 -8.289 1.00 71.03 128 A 1 ATOM 1026 C CB . ASP A 0 128 . 3.865 12.378 -8.251 1.00 71.03 128 A 1 ATOM 1027 O O . ASP A 0 128 . 3.432 9.391 -7.734 1.00 71.03 128 A 1 ATOM 1028 C CG . ASP A 0 128 . 4.164 12.430 -9.751 1.00 71.03 128 A 1 ATOM 1029 O OD1 . ASP A 0 128 . 4.000 11.380 -10.418 1.00 71.03 128 A 1 ATOM 1030 O OD2 . ASP A 0 128 . 4.588 13.507 -10.213 1.00 71.03 128 A 1 ATOM 1031 N N . PRO A 0 129 . 1.699 9.650 -9.166 1.00 70.50 129 A 1 ATOM 1032 C CA . PRO A 0 129 . 1.671 8.256 -9.598 1.00 70.50 129 A 1 ATOM 1033 C C . PRO A 0 129 . 2.997 7.784 -10.196 1.00 70.50 129 A 1 ATOM 1034 C CB . PRO A 0 129 . 0.554 8.184 -10.646 1.00 70.50 129 A 1 ATOM 1035 O O . PRO A 0 129 . 3.398 6.651 -9.944 1.00 70.50 129 A 1 ATOM 1036 C CG . PRO A 0 129 . -0.399 9.295 -10.223 1.00 70.50 129 A 1 ATOM 1037 C CD . PRO A 0 129 . 0.569 10.369 -9.741 1.00 70.50 129 A 1 ATOM 1038 N N . SER A 0 130 . 3.702 8.636 -10.948 1.00 73.59 130 A 1 ATOM 1039 C CA . SER A 0 130 . 4.983 8.284 -11.566 1.00 73.59 130 A 1 ATOM 1040 C C . SER A 0 130 . 6.050 8.087 -10.501 1.00 73.59 130 A 1 ATOM 1041 C CB . SER A 0 130 . 5.428 9.357 -12.566 1.00 73.59 130 A 1 ATOM 1042 O O . SER A 0 130 . 6.671 7.028 -10.449 1.00 73.59 130 A 1 ATOM 1043 O OG . SER A 0 130 . 6.403 8.830 -13.452 1.00 73.59 130 A 1 ATOM 1044 N N . ILE A 0 131 . 6.191 9.053 -9.584 1.00 72.91 131 A 1 ATOM 1045 C CA . ILE A 0 131 . 7.171 8.979 -8.486 1.00 72.91 131 A 1 ATOM 1046 C C . ILE A 0 131 . 6.891 7.763 -7.601 1.00 72.91 131 A 1 ATOM 1047 C CB . ILE A 0 131 . 7.163 10.274 -7.641 1.00 72.91 131 A 1 ATOM 1048 O O . ILE A 0 131 . 7.812 7.061 -7.184 1.00 72.91 131 A 1 ATOM 1049 C CG1 . ILE A 0 131 . 7.503 11.497 -8.526 1.00 72.91 131 A 1 ATOM 1050 C CG2 . ILE A 0 131 . 8.144 10.172 -6.455 1.00 72.91 131 A 1 ATOM 1051 C CD1 . ILE A 0 131 . 7.508 12.847 -7.796 1.00 72.91 131 A 1 ATOM 1052 N N . SER A 0 132 . 5.616 7.483 -7.331 1.00 70.38 132 A 1 ATOM 1053 C CA . SER A 0 132 . 5.231 6.346 -6.498 1.00 70.38 132 A 1 ATOM 1054 C C . SER A 0 132 . 5.544 5.022 -7.187 1.00 70.38 132 A 1 ATOM 1055 C CB . SER A 0 132 . 3.760 6.425 -6.110 1.00 70.38 132 A 1 ATOM 1056 O O . SER A 0 132 . 6.205 4.173 -6.594 1.00 70.38 132 A 1 ATOM 1057 O OG . SER A 0 132 . 3.535 7.635 -5.421 1.00 70.38 132 A 1 ATOM 1058 N N . CYS A 0 133 . 5.148 4.851 -8.451 1.00 68.16 133 A 1 ATOM 1059 C CA . CYS A 0 133 . 5.445 3.638 -9.212 1.00 68.16 133 A 1 ATOM 1060 C C . CYS A 0 133 . 6.954 3.422 -9.423 1.00 68.16 133 A 1 ATOM 1061 C CB . CYS A 0 133 . 4.718 3.698 -10.557 1.00 68.16 133 A 1 ATOM 1062 O O . CYS A 0 133 . 7.418 2.282 -9.382 1.00 68.16 133 A 1 ATOM 1063 S SG . CYS A 0 133 . 2.912 3.678 -10.464 1.00 68.16 133 A 1 ATOM 1064 N N . GLU A 0 134 . 7.732 4.491 -9.606 1.00 69.38 134 A 1 ATOM 1065 C CA . GLU A 0 134 . 9.199 4.434 -9.631 1.00 69.38 134 A 1 ATOM 1066 C C . GLU A 0 134 . 9.781 4.037 -8.268 1.00 69.38 134 A 1 ATOM 1067 C CB . GLU A 0 134 . 9.768 5.795 -10.048 1.00 69.38 134 A 1 ATOM 1068 O O . GLU A 0 134 . 10.704 3.227 -8.207 1.00 69.38 134 A 1 ATOM 1069 C CG . GLU A 0 134 . 9.609 6.072 -11.550 1.00 69.38 134 A 1 ATOM 1070 C CD . GLU A 0 134 . 10.073 7.488 -11.921 1.00 69.38 134 A 1 ATOM 1071 O OE1 . GLU A 0 134 . 9.540 8.023 -12.921 1.00 69.38 134 A 1 ATOM 1072 O OE2 . GLU A 0 134 . 10.971 8.013 -11.222 1.00 69.38 134 A 1 ATOM 1073 N N . GLY A 0 135 . 9.222 4.545 -7.164 1.00 65.03 135 A 1 ATOM 1074 C CA . GLY A 0 135 . 9.632 4.190 -5.801 1.00 65.03 135 A 1 ATOM 1075 C C . GLY A 0 135 . 9.467 2.701 -5.476 1.00 65.03 135 A 1 ATOM 1076 O O . GLY A 0 135 . 10.252 2.152 -4.705 1.00 65.03 135 A 1 ATOM 1077 N N . TRP A 0 136 . 8.496 2.036 -6.109 1.00 62.78 136 A 1 ATOM 1078 C CA . TRP A 0 136 . 8.273 0.586 -6.012 1.00 62.78 136 A 1 ATOM 1079 C C . TRP A 0 136 . 9.020 -0.243 -7.054 1.00 62.78 136 A 1 ATOM 1080 C CB . TRP A 0 136 . 6.772 0.286 -6.078 1.00 62.78 136 A 1 ATOM 1081 O O . TRP A 0 136 . 8.760 -1.442 -7.156 1.00 62.78 136 A 1 ATOM 1082 C CG . TRP A 0 136 . 6.057 0.764 -4.879 1.00 62.78 136 A 1 ATOM 1083 C CD1 . TRP A 0 136 . 5.266 1.847 -4.834 1.00 62.78 136 A 1 ATOM 1084 C CD2 . TRP A 0 136 . 6.087 0.213 -3.530 1.00 62.78 136 A 1 ATOM 1085 C CE2 . TRP A 0 136 . 5.420 1.124 -2.673 1.00 62.78 136 A 1 ATOM 1086 C CE3 . TRP A 0 136 . 6.628 -0.946 -2.936 1.00 62.78 136 A 1 ATOM 1087 N NE1 . TRP A 0 136 . 4.916 2.068 -3.535 1.00 62.78 136 A 1 ATOM 1088 C CH2 . TRP A 0 136 . 5.896 -0.227 -0.721 1.00 62.78 136 A 1 ATOM 1089 C CZ2 . TRP A 0 136 . 5.386 0.949 -1.284 1.00 62.78 136 A 1 ATOM 1090 C CZ3 . TRP A 0 136 . 6.505 -1.180 -1.552 1.00 62.78 136 A 1 ATOM 1091 N N . TYR A 0 137 . 9.901 0.371 -7.850 1.00 62.94 137 A 1 ATOM 1092 C CA . TYR A 0 137 . 10.569 -0.280 -8.983 1.00 62.94 137 A 1 ATOM 1093 C C . TYR A 0 137 . 9.586 -0.901 -9.998 1.00 62.94 137 A 1 ATOM 1094 C CB . TYR A 0 137 . 11.632 -1.274 -8.480 1.00 62.94 137 A 1 ATOM 1095 O O . TYR A 0 137 . 9.939 -1.810 -10.745 1.00 62.94 137 A 1 ATOM 1096 C CG . TYR A 0 137 . 12.745 -0.649 -7.664 1.00 62.94 137 A 1 ATOM 1097 C CD1 . TYR A 0 137 . 13.912 -0.208 -8.314 1.00 62.94 137 A 1 ATOM 1098 C CD2 . TYR A 0 137 . 12.622 -0.514 -6.267 1.00 62.94 137 A 1 ATOM 1099 C CE1 . TYR A 0 137 . 14.958 0.370 -7.572 1.00 62.94 137 A 1 ATOM 1100 C CE2 . TYR A 0 137 . 13.665 0.068 -5.520 1.00 62.94 137 A 1 ATOM 1101 O OH . TYR A 0 137 . 15.848 1.073 -5.467 1.00 62.94 137 A 1 ATOM 1102 C CZ . TYR A 0 137 . 14.835 0.511 -6.176 1.00 62.94 137 A 1 ATOM 1103 N N . LEU A 0 138 . 8.340 -0.411 -10.047 1.00 64.03 138 A 1 ATOM 1104 C CA . LEU A 0 138 . 7.329 -0.844 -11.019 1.00 64.03 138 A 1 ATOM 1105 C C . LEU A 0 138 . 7.467 -0.082 -12.338 1.00 64.03 138 A 1 ATOM 1106 C CB . LEU A 0 138 . 5.919 -0.662 -10.429 1.00 64.03 138 A 1 ATOM 1107 O O . LEU A 0 138 . 7.096 -0.599 -13.389 1.00 64.03 138 A 1 ATOM 1108 C CG . LEU A 0 138 . 5.648 -1.508 -9.173 1.00 64.03 138 A 1 ATOM 1109 C CD1 . LEU A 0 138 . 4.279 -1.151 -8.595 1.00 64.03 138 A 1 ATOM 1110 C CD2 . LEU A 0 138 . 5.670 -3.009 -9.464 1.00 64.03 138 A 1 ATOM 1111 N N . CYS A 0 139 . 8.014 1.132 -12.278 1.00 65.40 139 A 1 ATOM 1112 C CA . CYS A 0 139 . 8.461 1.908 -13.426 1.00 65.40 139 A 1 ATOM 1113 C C . CYS A 0 139 . 9.987 2.003 -13.425 1.00 65.40 139 A 1 ATOM 1114 C CB . CYS A 0 139 . 7.806 3.293 -13.404 1.00 65.40 139 A 1 ATOM 1115 O O . CYS A 0 139 . 10.610 2.148 -12.373 1.00 65.40 139 A 1 ATOM 1116 S SG . CYS A 0 139 . 6.009 3.326 -13.639 1.00 65.40 139 A 1 ATOM 1117 N N . TYR A 0 140 . 10.590 1.934 -14.613 1.00 64.18 140 A 1 ATOM 1118 C CA . TYR A 0 140 . 12.023 2.163 -14.760 1.00 64.18 140 A 1 ATOM 1119 C C . TYR A 0 140 . 12.315 3.630 -14.434 1.00 64.18 140 A 1 ATOM 1120 C CB . TYR A 0 140 . 12.468 1.785 -16.181 1.00 64.18 140 A 1 ATOM 1121 O O . TYR A 0 140 . 11.791 4.519 -15.108 1.00 64.18 140 A 1 ATOM 1122 C CG . TYR A 0 140 . 13.961 1.555 -16.318 1.00 64.18 140 A 1 ATOM 1123 C CD1 . TYR A 0 140 . 14.821 2.611 -16.674 1.00 64.18 140 A 1 ATOM 1124 C CD2 . TYR A 0 140 . 14.491 0.276 -16.061 1.00 64.18 140 A 1 ATOM 1125 C CE1 . TYR A 0 140 . 16.209 2.392 -16.771 1.00 64.18 140 A 1 ATOM 1126 C CE2 . TYR A 0 140 . 15.875 0.047 -16.178 1.00 64.18 140 A 1 ATOM 1127 O OH . TYR A 0 140 . 18.074 0.884 -16.613 1.00 64.18 140 A 1 ATOM 1128 C CZ . TYR A 0 140 . 16.738 1.106 -16.527 1.00 64.18 140 A 1 ATOM 1129 N N . ARG A 0 141 . 13.140 3.879 -13.413 1.00 57.07 141 A 1 ATOM 1130 C CA . ARG A 0 141 . 13.672 5.217 -13.148 1.00 57.07 141 A 1 ATOM 1131 C C . ARG A 0 141 . 14.592 5.567 -14.322 1.00 57.07 141 A 1 ATOM 1132 C CB . ARG A 0 141 . 14.382 5.229 -11.782 1.00 57.07 141 A 1 ATOM 1133 O O . ARG A 0 141 . 15.523 4.810 -14.594 1.00 57.07 141 A 1 ATOM 1134 C CG . ARG A 0 141 . 14.720 6.660 -11.338 1.00 57.07 141 A 1 ATOM 1135 C CD . ARG A 0 141 . 15.574 6.701 -10.063 1.00 57.07 141 A 1 ATOM 1136 N NE . ARG A 0 141 . 14.778 6.587 -8.824 1.00 57.07 141 A 1 ATOM 1137 N NH1 . ARG A 0 141 . 16.550 6.380 -7.377 1.00 57.07 141 A 1 ATOM 1138 N NH2 . ARG A 0 141 . 14.472 6.486 -6.566 1.00 57.07 141 A 1 ATOM 1139 C CZ . ARG A 0 141 . 15.267 6.484 -7.599 1.00 57.07 141 A 1 ATOM 1140 N N . LYS A 0 142 . 14.268 6.628 -15.068 1.00 48.34 142 A 1 ATOM 1141 C CA . LYS A 0 142 . 15.143 7.127 -16.140 1.00 48.34 142 A 1 ATOM 1142 C C . LYS A 0 142 . 16.524 7.486 -15.603 1.00 48.34 142 A 1 ATOM 1143 C CB . LYS A 0 142 . 14.539 8.342 -16.853 1.00 48.34 142 A 1 ATOM 1144 O O . LYS A 0 142 . 16.592 7.976 -14.454 1.00 48.34 142 A 1 ATOM 1145 C CG . LYS A 0 142 . 13.536 7.949 -17.940 1.00 48.34 142 A 1 ATOM 1146 C CD . LYS A 0 142 . 13.102 9.215 -18.686 1.00 48.34 142 A 1 ATOM 1147 C CE . LYS A 0 142 . 12.124 8.877 -19.810 1.00 48.34 142 A 1 ATOM 1148 N NZ . LYS A 0 142 . 11.651 10.114 -20.477 1.00 48.34 142 A 1 ATOM 1149 O OXT . LYS A 0 142 . 17.451 7.294 -16.414 1.00 48.34 142 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 58.53 # loop_ _atom_type.symbol C N O S #