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 PHE 0 3 PRO 0 4 VAL 0 5 PHE 0 6 HIS 0 7 SER 0 8 PHE 0 9 HIS 0 10 PRO 0 11 SER 0 12 GLN 0 13 LYS 0 14 ILE 0 15 ILE 0 16 ASP 0 17 ASP 0 18 LEU 0 19 SER 0 20 LEU 0 21 LEU 0 22 PHE 0 23 ARG 0 24 LEU 0 25 PRO 0 26 CYS 0 27 GLY 0 28 CYS 0 29 ASN 0 30 LEU 0 31 ILE 0 32 TYR 0 33 ARG 0 34 PHE 0 35 PRO 0 36 ASP 0 37 LYS 0 38 SER 0 39 SER 0 40 LEU 0 41 ILE 0 42 SER 0 43 CYS 0 44 LEU 0 45 THR 0 46 SER 0 47 TYR 0 48 PRO 0 49 VAL 0 50 ILE 0 51 VAL 0 52 ASN 0 53 ILE 0 54 ASN 0 55 GLN 0 56 ASP 0 57 PRO 0 58 ARG 0 59 LEU 0 60 LEU 0 61 SER 0 62 SER 0 63 LEU 0 64 GLU 0 65 SER 0 66 VAL 0 67 PRO 0 68 ALA 0 69 TRP 0 70 ILE 0 71 GLU 0 72 VAL 0 73 ARG 0 74 HIS 0 75 SER 0 76 ARG 0 77 ASN 0 78 ILE 0 79 SER 0 80 LEU 0 81 SER 0 82 PHE 0 83 TRP 0 84 PHE 0 85 ILE 0 86 MET 0 87 THR 0 88 VAL 0 89 LEU 0 90 TRP 0 91 MET 0 92 LEU 0 93 VAL 0 94 CYS 0 95 CYS 0 96 SER 0 97 VAL 0 98 GLY 0 99 PHE 0 100 ILE 0 101 ALA 0 102 GLU 0 103 SER 0 104 TYR 0 105 PHE 0 106 VAL 0 107 GLN 0 108 LEU 0 109 THR 0 110 LEU 0 111 PHE 0 112 PHE 0 113 SER 0 114 ALA 0 115 VAL 0 116 ILE 0 117 PHE 0 118 ILE 0 119 TYR 0 120 MET 0 121 HIS 0 122 LEU 0 123 ARG 0 124 ASN 0 125 THR 0 126 VAL 0 127 THR 0 128 GLU 0 129 GLY 0 130 ALA 0 131 TRP 0 132 ARG 0 133 MET 0 134 CYS 0 135 LEU # 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 . 22.082 -22.076 -9.020 1.00 33.70 1 A 1 ATOM 2 C CA . MET A 0 1 . 20.742 -21.631 -8.591 1.00 33.70 1 A 1 ATOM 3 C C . MET A 0 1 . 20.493 -20.296 -9.273 1.00 33.70 1 A 1 ATOM 4 C CB . MET A 0 1 . 20.698 -21.564 -7.052 1.00 33.70 1 A 1 ATOM 5 O O . MET A 0 1 . 21.005 -19.289 -8.812 1.00 33.70 1 A 1 ATOM 6 C CG . MET A 0 1 . 19.301 -21.413 -6.442 1.00 33.70 1 A 1 ATOM 7 S SD . MET A 0 1 . 19.310 -21.847 -4.681 1.00 33.70 1 A 1 ATOM 8 C CE . MET A 0 1 . 17.551 -21.696 -4.269 1.00 33.70 1 A 1 ATOM 9 N N . PHE A 0 2 . 19.874 -20.305 -10.455 1.00 26.99 2 A 1 ATOM 10 C CA . PHE A 0 2 . 19.549 -19.058 -11.149 1.00 26.99 2 A 1 ATOM 11 C C . PHE A 0 2 . 18.468 -18.340 -10.336 1.00 26.99 2 A 1 ATOM 12 C CB . PHE A 0 2 . 19.051 -19.352 -12.574 1.00 26.99 2 A 1 ATOM 13 O O . PHE A 0 2 . 17.464 -18.986 -10.019 1.00 26.99 2 A 1 ATOM 14 C CG . PHE A 0 2 . 20.147 -19.769 -13.535 1.00 26.99 2 A 1 ATOM 15 C CD1 . PHE A 0 2 . 20.881 -18.782 -14.220 1.00 26.99 2 A 1 ATOM 16 C CD2 . PHE A 0 2 . 20.440 -21.131 -13.749 1.00 26.99 2 A 1 ATOM 17 C CE1 . PHE A 0 2 . 21.906 -19.152 -15.107 1.00 26.99 2 A 1 ATOM 18 C CE2 . PHE A 0 2 . 21.472 -21.499 -14.632 1.00 26.99 2 A 1 ATOM 19 C CZ . PHE A 0 2 . 22.205 -20.510 -15.310 1.00 26.99 2 A 1 ATOM 20 N N . PRO A 0 3 . 18.628 -17.056 -9.974 1.00 33.57 3 A 1 ATOM 21 C CA . PRO A 0 3 . 17.482 -16.290 -9.536 1.00 33.57 3 A 1 ATOM 22 C C . PRO A 0 3 . 16.561 -16.200 -10.749 1.00 33.57 3 A 1 ATOM 23 C CB . PRO A 0 3 . 18.024 -14.948 -9.045 1.00 33.57 3 A 1 ATOM 24 O O . PRO A 0 3 . 16.895 -15.594 -11.766 1.00 33.57 3 A 1 ATOM 25 C CG . PRO A 0 3 . 19.316 -14.770 -9.841 1.00 33.57 3 A 1 ATOM 26 C CD . PRO A 0 3 . 19.792 -16.196 -10.133 1.00 33.57 3 A 1 ATOM 27 N N . VAL A 0 4 . 15.428 -16.893 -10.659 1.00 26.68 4 A 1 ATOM 28 C CA . VAL A 0 4 . 14.284 -16.692 -11.536 1.00 26.68 4 A 1 ATOM 29 C C . VAL A 0 4 . 13.904 -15.232 -11.346 1.00 26.68 4 A 1 ATOM 30 C CB . VAL A 0 4 . 13.138 -17.662 -11.168 1.00 26.68 4 A 1 ATOM 31 O O . VAL A 0 4 . 13.191 -14.875 -10.409 1.00 26.68 4 A 1 ATOM 32 C CG1 . VAL A 0 4 . 11.863 -17.412 -11.985 1.00 26.68 4 A 1 ATOM 33 C CG2 . VAL A 0 4 . 13.572 -19.116 -11.407 1.00 26.68 4 A 1 ATOM 34 N N . PHE A 0 5 . 14.447 -14.364 -12.196 1.00 32.65 5 A 1 ATOM 35 C CA . PHE A 0 5 . 13.858 -13.066 -12.432 1.00 32.65 5 A 1 ATOM 36 C C . PHE A 0 5 . 12.490 -13.396 -12.996 1.00 32.65 5 A 1 ATOM 37 C CB . PHE A 0 5 . 14.717 -12.224 -13.383 1.00 32.65 5 A 1 ATOM 38 O O . PHE A 0 5 . 12.345 -13.714 -14.176 1.00 32.65 5 A 1 ATOM 39 C CG . PHE A 0 5 . 16.013 -11.754 -12.756 1.00 32.65 5 A 1 ATOM 40 C CD1 . PHE A 0 5 . 16.020 -10.623 -11.916 1.00 32.65 5 A 1 ATOM 41 C CD2 . PHE A 0 5 . 17.210 -12.453 -12.995 1.00 32.65 5 A 1 ATOM 42 C CE1 . PHE A 0 5 . 17.220 -10.195 -11.319 1.00 32.65 5 A 1 ATOM 43 C CE2 . PHE A 0 5 . 18.410 -12.020 -12.405 1.00 32.65 5 A 1 ATOM 44 C CZ . PHE A 0 5 . 18.415 -10.893 -11.565 1.00 32.65 5 A 1 ATOM 45 N N . HIS A 0 6 . 11.497 -13.431 -12.105 1.00 28.90 6 A 1 ATOM 46 C CA . HIS A 0 6 . 10.114 -13.344 -12.504 1.00 28.90 6 A 1 ATOM 47 C C . HIS A 0 6 . 10.077 -12.278 -13.585 1.00 28.90 6 A 1 ATOM 48 C CB . HIS A 0 6 . 9.239 -12.951 -11.307 1.00 28.90 6 A 1 ATOM 49 O O . HIS A 0 6 . 10.572 -11.166 -13.377 1.00 28.90 6 A 1 ATOM 50 C CG . HIS A 0 6 . 8.843 -14.128 -10.458 1.00 28.90 6 A 1 ATOM 51 C CD2 . HIS A 0 6 . 9.431 -14.549 -9.296 1.00 28.90 6 A 1 ATOM 52 N ND1 . HIS A 0 6 . 7.806 -14.992 -10.728 1.00 28.90 6 A 1 ATOM 53 C CE1 . HIS A 0 6 . 7.767 -15.911 -9.750 1.00 28.90 6 A 1 ATOM 54 N NE2 . HIS A 0 6 . 8.733 -15.677 -8.851 1.00 28.90 6 A 1 ATOM 55 N N . SER A 0 7 . 9.547 -12.654 -14.742 1.00 31.75 7 A 1 ATOM 56 C CA . SER A 0 7 . 9.057 -11.739 -15.751 1.00 31.75 7 A 1 ATOM 57 C C . SER A 0 7 . 7.972 -10.892 -15.088 1.00 31.75 7 A 1 ATOM 58 C CB . SER A 0 7 . 8.530 -12.554 -16.937 1.00 31.75 7 A 1 ATOM 59 O O . SER A 0 7 . 6.773 -11.099 -15.266 1.00 31.75 7 A 1 ATOM 60 O OG . SER A 0 7 . 7.574 -13.492 -16.473 1.00 31.75 7 A 1 ATOM 61 N N . PHE A 0 8 . 8.395 -9.977 -14.223 1.00 36.84 8 A 1 ATOM 62 C CA . PHE A 0 8 . 7.623 -8.827 -13.858 1.00 36.84 8 A 1 ATOM 63 C C . PHE A 0 8 . 7.430 -8.147 -15.198 1.00 36.84 8 A 1 ATOM 64 C CB . PHE A 0 8 . 8.387 -7.974 -12.829 1.00 36.84 8 A 1 ATOM 65 O O . PHE A 0 8 . 8.397 -7.746 -15.833 1.00 36.84 8 A 1 ATOM 66 C CG . PHE A 0 8 . 8.302 -8.519 -11.413 1.00 36.84 8 A 1 ATOM 67 C CD1 . PHE A 0 8 . 7.144 -8.278 -10.648 1.00 36.84 8 A 1 ATOM 68 C CD2 . PHE A 0 8 . 9.346 -9.289 -10.864 1.00 36.84 8 A 1 ATOM 69 C CE1 . PHE A 0 8 . 7.019 -8.825 -9.358 1.00 36.84 8 A 1 ATOM 70 C CE2 . PHE A 0 8 . 9.230 -9.813 -9.563 1.00 36.84 8 A 1 ATOM 71 C CZ . PHE A 0 8 . 8.064 -9.589 -8.813 1.00 36.84 8 A 1 ATOM 72 N N . HIS A 0 9 . 6.196 -8.121 -15.679 1.00 35.34 9 A 1 ATOM 73 C CA . HIS A 0 9 . 5.775 -7.081 -16.589 1.00 35.34 9 A 1 ATOM 74 C C . HIS A 0 9 . 5.616 -5.840 -15.708 1.00 35.34 9 A 1 ATOM 75 C CB . HIS A 0 9 . 4.451 -7.488 -17.266 1.00 35.34 9 A 1 ATOM 76 O O . HIS A 0 9 . 4.531 -5.652 -15.145 1.00 35.34 9 A 1 ATOM 77 C CG . HIS A 0 9 . 4.621 -8.209 -18.576 1.00 35.34 9 A 1 ATOM 78 C CD2 . HIS A 0 9 . 4.260 -9.497 -18.869 1.00 35.34 9 A 1 ATOM 79 N ND1 . HIS A 0 9 . 5.079 -7.641 -19.743 1.00 35.34 9 A 1 ATOM 80 C CE1 . HIS A 0 9 . 5.001 -8.564 -20.715 1.00 35.34 9 A 1 ATOM 81 N NE2 . HIS A 0 9 . 4.505 -9.711 -20.228 1.00 35.34 9 A 1 ATOM 82 N N . PRO A 0 10 . 6.646 -4.987 -15.502 1.00 44.63 10 A 1 ATOM 83 C CA . PRO A 0 10 . 6.321 -3.628 -15.138 1.00 44.63 10 A 1 ATOM 84 C C . PRO A 0 10 . 5.413 -3.140 -16.265 1.00 44.63 10 A 1 ATOM 85 C CB . PRO A 0 10 . 7.645 -2.870 -15.053 1.00 44.63 10 A 1 ATOM 86 O O . PRO A 0 10 . 5.725 -3.300 -17.446 1.00 44.63 10 A 1 ATOM 87 C CG . PRO A 0 10 . 8.539 -3.606 -16.048 1.00 44.63 10 A 1 ATOM 88 C CD . PRO A 0 10 . 8.035 -5.037 -15.949 1.00 44.63 10 A 1 ATOM 89 N N . SER A 0 11 . 4.254 -2.595 -15.912 1.00 46.63 11 A 1 ATOM 90 C CA . SER A 0 11 . 3.514 -1.779 -16.867 1.00 46.63 11 A 1 ATOM 91 C C . SER A 0 11 . 4.390 -0.561 -17.130 1.00 46.63 11 A 1 ATOM 92 C CB . SER A 0 11 . 2.107 -1.420 -16.372 1.00 46.63 11 A 1 ATOM 93 O O . SER A 0 11 . 4.361 0.420 -16.390 1.00 46.63 11 A 1 ATOM 94 O OG . SER A 0 11 . 2.062 -1.118 -14.987 1.00 46.63 11 A 1 ATOM 95 N N . GLN A 0 12 . 5.273 -0.689 -18.115 1.00 49.55 12 A 1 ATOM 96 C CA . GLN A 0 12 . 6.117 0.389 -18.574 1.00 49.55 12 A 1 ATOM 97 C C . GLN A 0 12 . 5.189 1.382 -19.253 1.00 49.55 12 A 1 ATOM 98 C CB . GLN A 0 12 . 7.198 -0.169 -19.502 1.00 49.55 12 A 1 ATOM 99 O O . GLN A 0 12 . 4.579 1.085 -20.281 1.00 49.55 12 A 1 ATOM 100 C CG . GLN A 0 12 . 8.220 0.902 -19.911 1.00 49.55 12 A 1 ATOM 101 C CD . GLN A 0 12 . 9.308 0.327 -20.811 1.00 49.55 12 A 1 ATOM 102 N NE2 . GLN A 0 12 . 10.328 1.083 -21.133 1.00 49.55 12 A 1 ATOM 103 O OE1 . GLN A 0 12 . 9.272 -0.809 -21.244 1.00 49.55 12 A 1 ATOM 104 N N . LYS A 0 13 . 5.023 2.545 -18.634 1.00 51.94 13 A 1 ATOM 105 C CA . LYS A 0 13 . 4.264 3.643 -19.220 1.00 51.94 13 A 1 ATOM 106 C C . LYS A 0 13 . 5.241 4.776 -19.481 1.00 51.94 13 A 1 ATOM 107 C CB . LYS A 0 13 . 3.078 4.007 -18.313 1.00 51.94 13 A 1 ATOM 108 O O . LYS A 0 13 . 5.901 5.249 -18.562 1.00 51.94 13 A 1 ATOM 109 C CG . LYS A 0 13 . 2.134 4.986 -19.024 1.00 51.94 13 A 1 ATOM 110 C CD . LYS A 0 13 . 0.893 5.306 -18.182 1.00 51.94 13 A 1 ATOM 111 C CE . LYS A 0 13 . 0.040 6.318 -18.958 1.00 51.94 13 A 1 ATOM 112 N NZ . LYS A 0 13 . -1.168 6.738 -18.205 1.00 51.94 13 A 1 ATOM 113 N N . ILE A 0 14 . 5.344 5.195 -20.735 1.00 55.52 14 A 1 ATOM 114 C CA . ILE A 0 14 . 6.038 6.434 -21.088 1.00 55.52 14 A 1 ATOM 115 C C . ILE A 0 14 . 5.166 7.566 -20.531 1.00 55.52 14 A 1 ATOM 116 C CB . ILE A 0 14 . 6.255 6.501 -22.618 1.00 55.52 14 A 1 ATOM 117 O O . ILE A 0 14 . 3.991 7.656 -20.896 1.00 55.52 14 A 1 ATOM 118 C CG1 . ILE A 0 14 . 7.089 5.287 -23.105 1.00 55.52 14 A 1 ATOM 119 C CG2 . ILE A 0 14 . 6.953 7.818 -22.989 1.00 55.52 14 A 1 ATOM 120 C CD1 . ILE A 0 14 . 7.185 5.159 -24.630 1.00 55.52 14 A 1 ATOM 121 N N . ILE A 0 15 . 5.677 8.336 -19.563 1.00 53.14 15 A 1 ATOM 122 C CA . ILE A 0 15 . 4.934 9.486 -19.010 1.00 53.14 15 A 1 ATOM 123 C C . ILE A 0 15 . 5.156 10.698 -19.913 1.00 53.14 15 A 1 ATOM 124 C CB . ILE A 0 15 . 5.319 9.852 -17.560 1.00 53.14 15 A 1 ATOM 125 O O . ILE A 0 15 . 4.191 11.374 -20.249 1.00 53.14 15 A 1 ATOM 126 C CG1 . ILE A 0 15 . 5.536 8.640 -16.646 1.00 53.14 15 A 1 ATOM 127 C CG2 . ILE A 0 15 . 4.265 10.799 -16.954 1.00 53.14 15 A 1 ATOM 128 C CD1 . ILE A 0 15 . 6.011 9.087 -15.252 1.00 53.14 15 A 1 ATOM 129 N N . ASP A 0 16 . 6.408 10.902 -20.337 1.00 53.21 16 A 1 ATOM 130 C CA . ASP A 0 16 . 6.871 11.973 -21.221 1.00 53.21 16 A 1 ATOM 131 C C . ASP A 0 16 . 7.927 11.415 -22.197 1.00 53.21 16 A 1 ATOM 132 C CB . ASP A 0 16 . 7.499 13.117 -20.400 1.00 53.21 16 A 1 ATOM 133 O O . ASP A 0 16 . 8.547 10.391 -21.907 1.00 53.21 16 A 1 ATOM 134 C CG . ASP A 0 16 . 6.706 13.532 -19.156 1.00 53.21 16 A 1 ATOM 135 O OD1 . ASP A 0 16 . 5.567 14.016 -19.309 1.00 53.21 16 A 1 ATOM 136 O OD2 . ASP A 0 16 . 7.285 13.386 -18.044 1.00 53.21 16 A 1 ATOM 137 N N . ASP A 0 17 . 8.206 12.114 -23.306 1.00 62.66 17 A 1 ATOM 138 C CA . ASP A 0 17 . 9.165 11.711 -24.362 1.00 62.66 17 A 1 ATOM 139 C C . ASP A 0 17 . 10.604 11.389 -23.879 1.00 62.66 17 A 1 ATOM 140 C CB . ASP A 0 17 . 9.235 12.826 -25.429 1.00 62.66 17 A 1 ATOM 141 O O . ASP A 0 17 . 11.422 10.904 -24.661 1.00 62.66 17 A 1 ATOM 142 C CG . ASP A 0 17 . 8.050 12.859 -26.400 1.00 62.66 17 A 1 ATOM 143 O OD1 . ASP A 0 17 . 7.575 11.768 -26.786 1.00 62.66 17 A 1 ATOM 144 O OD2 . ASP A 0 17 . 7.692 13.978 -26.823 1.00 62.66 17 A 1 ATOM 145 N N . LEU A 0 18 . 10.928 11.654 -22.606 1.00 58.14 18 A 1 ATOM 146 C CA . LEU A 0 18 . 12.226 11.387 -21.969 1.00 58.14 18 A 1 ATOM 147 C C . LEU A 0 18 . 12.128 10.600 -20.644 1.00 58.14 18 A 1 ATOM 148 C CB . LEU A 0 18 . 12.984 12.713 -21.755 1.00 58.14 18 A 1 ATOM 149 O O . LEU A 0 18 . 13.153 10.384 -19.988 1.00 58.14 18 A 1 ATOM 150 C CG . LEU A 0 18 . 13.410 13.430 -23.052 1.00 58.14 18 A 1 ATOM 151 C CD1 . LEU A 0 18 . 12.420 14.526 -23.460 1.00 58.14 18 A 1 ATOM 152 C CD2 . LEU A 0 18 . 14.773 14.093 -22.860 1.00 58.14 18 A 1 ATOM 153 N N . SER A 0 19 . 10.929 10.195 -20.204 1.00 61.09 19 A 1 ATOM 154 C CA . SER A 0 19 . 10.712 9.591 -18.882 1.00 61.09 19 A 1 ATOM 155 C C . SER A 0 19 . 10.039 8.213 -18.953 1.00 61.09 19 A 1 ATOM 156 C CB . SER A 0 19 . 9.990 10.575 -17.945 1.00 61.09 19 A 1 ATOM 157 O O . SER A 0 19 . 8.946 8.038 -19.499 1.00 61.09 19 A 1 ATOM 158 O OG . SER A 0 19 . 8.647 10.799 -18.319 1.00 61.09 19 A 1 ATOM 159 N N . LEU A 0 20 . 10.690 7.209 -18.358 1.00 61.11 20 A 1 ATOM 160 C CA . LEU A 0 20 . 10.139 5.865 -18.190 1.00 61.11 20 A 1 ATOM 161 C C . LEU A 0 20 . 9.569 5.702 -16.786 1.00 61.11 20 A 1 ATOM 162 C CB . LEU A 0 20 . 11.211 4.792 -18.454 1.00 61.11 20 A 1 ATOM 163 O O . LEU A 0 20 . 10.305 5.816 -15.807 1.00 61.11 20 A 1 ATOM 164 C CG . LEU A 0 20 . 11.683 4.691 -19.907 1.00 61.11 20 A 1 ATOM 165 C CD1 . LEU A 0 20 . 12.730 3.585 -20.037 1.00 61.11 20 A 1 ATOM 166 C CD2 . LEU A 0 20 . 10.511 4.383 -20.845 1.00 61.11 20 A 1 ATOM 167 N N . LEU A 0 21 . 8.277 5.376 -16.693 1.00 58.95 21 A 1 ATOM 168 C CA . LEU A 0 21 . 7.658 4.927 -15.450 1.00 58.95 21 A 1 ATOM 169 C C . LEU A 0 21 . 7.672 3.411 -15.374 1.00 58.95 21 A 1 ATOM 170 C CB . LEU A 0 21 . 6.221 5.438 -15.349 1.00 58.95 21 A 1 ATOM 171 O O . LEU A 0 21 . 7.032 2.729 -16.178 1.00 58.95 21 A 1 ATOM 172 C CG . LEU A 0 21 . 5.564 5.245 -13.970 1.00 58.95 21 A 1 ATOM 173 C CD1 . LEU A 0 21 . 4.992 6.550 -13.412 1.00 58.95 21 A 1 ATOM 174 C CD2 . LEU A 0 21 . 4.397 4.265 -14.080 1.00 58.95 21 A 1 ATOM 175 N N . PHE A 0 22 . 8.317 2.901 -14.338 1.00 61.84 22 A 1 ATOM 176 C CA . PHE A 0 22 . 8.188 1.524 -13.907 1.00 61.84 22 A 1 ATOM 177 C C . PHE A 0 22 . 7.292 1.477 -12.683 1.00 61.84 22 A 1 ATOM 178 C CB . PHE A 0 22 . 9.562 0.918 -13.637 1.00 61.84 22 A 1 ATOM 179 O O . PHE A 0 22 . 7.567 2.096 -11.655 1.00 61.84 22 A 1 ATOM 180 C CG . PHE A 0 22 . 10.398 0.810 -14.887 1.00 61.84 22 A 1 ATOM 181 C CD1 . PHE A 0 22 . 10.353 -0.360 -15.661 1.00 61.84 22 A 1 ATOM 182 C CD2 . PHE A 0 22 . 11.196 1.891 -15.297 1.00 61.84 22 A 1 ATOM 183 C CE1 . PHE A 0 22 . 11.105 -0.457 -16.842 1.00 61.84 22 A 1 ATOM 184 C CE2 . PHE A 0 22 . 11.971 1.786 -16.465 1.00 61.84 22 A 1 ATOM 185 C CZ . PHE A 0 22 . 11.922 0.614 -17.239 1.00 61.84 22 A 1 ATOM 186 N N . ARG A 0 23 . 6.209 0.713 -12.788 1.00 52.26 23 A 1 ATOM 187 C CA . ARG A 0 23 . 5.350 0.426 -11.646 1.00 52.26 23 A 1 ATOM 188 C C . ARG A 0 23 . 5.870 -0.822 -10.948 1.00 52.26 23 A 1 ATOM 189 C CB . ARG A 0 23 . 3.903 0.329 -12.131 1.00 52.26 23 A 1 ATOM 190 O O . ARG A 0 23 . 5.778 -1.920 -11.495 1.00 52.26 23 A 1 ATOM 191 C CG . ARG A 0 23 . 2.939 0.695 -11.002 1.00 52.26 23 A 1 ATOM 192 C CD . ARG A 0 23 . 1.533 0.843 -11.580 1.00 52.26 23 A 1 ATOM 193 N NE . ARG A 0 23 . 0.644 1.545 -10.642 1.00 52.26 23 A 1 ATOM 194 N NH1 . ARG A 0 23 . -1.266 1.355 -11.894 1.00 52.26 23 A 1 ATOM 195 N NH2 . ARG A 0 23 . -1.324 2.449 -9.947 1.00 52.26 23 A 1 ATOM 196 C CZ . ARG A 0 23 . -0.640 1.777 -10.829 1.00 52.26 23 A 1 ATOM 197 N N . LEU A 0 24 . 6.449 -0.649 -9.765 1.00 59.45 24 A 1 ATOM 198 C CA . LEU A 0 24 . 6.977 -1.760 -8.983 1.00 59.45 24 A 1 ATOM 199 C C . LEU A 0 24 . 5.829 -2.526 -8.300 1.00 59.45 24 A 1 ATOM 200 C CB . LEU A 0 24 . 8.027 -1.275 -7.966 1.00 59.45 24 A 1 ATOM 201 O O . LEU A 0 24 . 4.808 -1.925 -7.951 1.00 59.45 24 A 1 ATOM 202 C CG . LEU A 0 24 . 9.423 -1.032 -8.567 1.00 59.45 24 A 1 ATOM 203 C CD1 . LEU A 0 24 . 9.529 0.337 -9.227 1.00 59.45 24 A 1 ATOM 204 C CD2 . LEU A 0 24 . 10.488 -1.110 -7.474 1.00 59.45 24 A 1 ATOM 205 N N . PRO A 0 25 . 5.999 -3.833 -8.024 1.00 49.89 25 A 1 ATOM 206 C CA . PRO A 0 25 . 4.998 -4.655 -7.331 1.00 49.89 25 A 1 ATOM 207 C C . PRO A 0 25 . 4.655 -4.160 -5.915 1.00 49.89 25 A 1 ATOM 208 C CB . PRO A 0 25 . 5.599 -6.065 -7.300 1.00 49.89 25 A 1 ATOM 209 O O . PRO A 0 25 . 3.625 -4.534 -5.360 1.00 49.89 25 A 1 ATOM 210 C CG . PRO A 0 25 . 7.106 -5.825 -7.391 1.00 49.89 25 A 1 ATOM 211 C CD . PRO A 0 25 . 7.184 -4.625 -8.324 1.00 49.89 25 A 1 ATOM 212 N N . CYS A 0 26 . 5.486 -3.291 -5.333 1.00 51.84 26 A 1 ATOM 213 C CA . CYS A 0 26 . 5.228 -2.603 -4.068 1.00 51.84 26 A 1 ATOM 214 C C . CYS A 0 26 . 4.286 -1.384 -4.197 1.00 51.84 26 A 1 ATOM 215 C CB . CYS A 0 26 . 6.583 -2.243 -3.437 1.00 51.84 26 A 1 ATOM 216 O O . CYS A 0 26 . 4.043 -0.702 -3.207 1.00 51.84 26 A 1 ATOM 217 S SG . CYS A 0 26 . 7.541 -1.172 -4.550 1.00 51.84 26 A 1 ATOM 218 N N . GLY A 0 27 . 3.764 -1.079 -5.393 1.00 50.04 27 A 1 ATOM 219 C CA . GLY A 0 27 . 2.879 0.068 -5.647 1.00 50.04 27 A 1 ATOM 220 C C . GLY A 0 27 . 3.605 1.397 -5.891 1.00 50.04 27 A 1 ATOM 221 O O . GLY A 0 27 . 2.954 2.422 -6.085 1.00 50.04 27 A 1 ATOM 222 N N . CYS A 0 28 . 4.940 1.387 -5.905 1.00 49.39 28 A 1 ATOM 223 C CA . CYS A 0 28 . 5.765 2.563 -6.175 1.00 49.39 28 A 1 ATOM 224 C C . CYS A 0 28 . 5.916 2.818 -7.677 1.00 49.39 28 A 1 ATOM 225 C CB . CYS A 0 28 . 7.141 2.384 -5.529 1.00 49.39 28 A 1 ATOM 226 O O . CYS A 0 28 . 5.930 1.877 -8.473 1.00 49.39 28 A 1 ATOM 227 S SG . CYS A 0 28 . 6.950 2.164 -3.744 1.00 49.39 28 A 1 ATOM 228 N N . ASN A 0 29 . 6.110 4.086 -8.041 1.00 57.22 29 A 1 ATOM 229 C CA . ASN A 0 29 . 6.464 4.487 -9.395 1.00 57.22 29 A 1 ATOM 230 C C . ASN A 0 29 . 7.944 4.888 -9.410 1.00 57.22 29 A 1 ATOM 231 C CB . ASN A 0 29 . 5.548 5.638 -9.831 1.00 57.22 29 A 1 ATOM 232 O O . ASN A 0 29 . 8.332 5.882 -8.796 1.00 57.22 29 A 1 ATOM 233 C CG . ASN A 0 29 . 4.083 5.251 -9.949 1.00 57.22 29 A 1 ATOM 234 N ND2 . ASN A 0 29 . 3.197 6.195 -9.734 1.00 57.22 29 A 1 ATOM 235 O OD1 . ASN A 0 29 . 3.695 4.132 -10.241 1.00 57.22 29 A 1 ATOM 236 N N . LEU A 0 30 . 8.771 4.115 -10.098 1.00 59.65 30 A 1 ATOM 237 C CA . LEU A 0 30 . 10.156 4.466 -10.381 1.00 59.65 30 A 1 ATOM 238 C C . LEU A 0 30 . 10.186 5.224 -11.703 1.00 59.65 30 A 1 ATOM 239 C CB . LEU A 0 30 . 10.968 3.171 -10.402 1.00 59.65 30 A 1 ATOM 240 O O . LEU A 0 30 . 9.730 4.701 -12.719 1.00 59.65 30 A 1 ATOM 241 C CG . LEU A 0 30 . 12.452 3.299 -10.769 1.00 59.65 30 A 1 ATOM 242 C CD1 . LEU A 0 30 . 13.224 3.964 -9.638 1.00 59.65 30 A 1 ATOM 243 C CD2 . LEU A 0 30 . 13.018 1.893 -10.938 1.00 59.65 30 A 1 ATOM 244 N N . ILE A 0 31 . 10.679 6.456 -11.674 1.00 62.97 31 A 1 ATOM 245 C CA . ILE A 0 31 . 10.774 7.305 -12.855 1.00 62.97 31 A 1 ATOM 246 C C . ILE A 0 31 . 12.249 7.410 -13.231 1.00 62.97 31 A 1 ATOM 247 C CB . ILE A 0 31 . 10.096 8.673 -12.633 1.00 62.97 31 A 1 ATOM 248 O O . ILE A 0 31 . 13.039 8.036 -12.523 1.00 62.97 31 A 1 ATOM 249 C CG1 . ILE A 0 31 . 8.639 8.487 -12.143 1.00 62.97 31 A 1 ATOM 250 C CG2 . ILE A 0 31 . 10.137 9.479 -13.946 1.00 62.97 31 A 1 ATOM 251 C CD1 . ILE A 0 31 . 7.894 9.794 -11.856 1.00 62.97 31 A 1 ATOM 252 N N . TYR A 0 32 . 12.614 6.806 -14.357 1.00 61.84 32 A 1 ATOM 253 C CA . TYR A 0 32 . 13.908 7.044 -14.989 1.00 61.84 32 A 1 ATOM 254 C C . TYR A 0 32 . 13.769 8.208 -15.959 1.00 61.84 32 A 1 ATOM 255 C CB . TYR A 0 32 . 14.402 5.789 -15.710 1.00 61.84 32 A 1 ATOM 256 O O . TYR A 0 32 . 12.971 8.131 -16.895 1.00 61.84 32 A 1 ATOM 257 C CG . TYR A 0 32 . 15.019 4.769 -14.783 1.00 61.84 32 A 1 ATOM 258 C CD1 . TYR A 0 32 . 16.366 4.897 -14.400 1.00 61.84 32 A 1 ATOM 259 C CD2 . TYR A 0 32 . 14.260 3.678 -14.332 1.00 61.84 32 A 1 ATOM 260 C CE1 . TYR A 0 32 . 16.951 3.942 -13.546 1.00 61.84 32 A 1 ATOM 261 C CE2 . TYR A 0 32 . 14.854 2.702 -13.516 1.00 61.84 32 A 1 ATOM 262 O OH . TYR A 0 32 . 16.733 1.929 -12.250 1.00 61.84 32 A 1 ATOM 263 C CZ . TYR A 0 32 . 16.188 2.849 -13.088 1.00 61.84 32 A 1 ATOM 264 N N . ARG A 0 33 . 14.537 9.281 -15.747 1.00 61.60 33 A 1 ATOM 265 C CA . ARG A 0 33 . 14.651 10.378 -16.711 1.00 61.60 33 A 1 ATOM 266 C C . ARG A 0 33 . 15.990 10.303 -17.428 1.00 61.60 33 A 1 ATOM 267 C CB . ARG A 0 33 . 14.429 11.737 -16.036 1.00 61.60 33 A 1 ATOM 268 O O . ARG A 0 33 . 17.047 10.256 -16.798 1.00 61.60 33 A 1 ATOM 269 C CG . ARG A 0 33 . 12.928 12.013 -15.889 1.00 61.60 33 A 1 ATOM 270 C CD . ARG A 0 33 . 12.690 13.418 -15.338 1.00 61.60 33 A 1 ATOM 271 N NE . ARG A 0 33 . 11.261 13.783 -15.360 1.00 61.60 33 A 1 ATOM 272 N NH1 . ARG A 0 33 . 11.483 15.895 -14.495 1.00 61.60 33 A 1 ATOM 273 N NH2 . ARG A 0 33 . 9.477 15.180 -15.177 1.00 61.60 33 A 1 ATOM 274 C CZ . ARG A 0 33 . 10.748 14.945 -15.005 1.00 61.60 33 A 1 ATOM 275 N N . PHE A 0 34 . 15.920 10.307 -18.751 1.00 62.66 34 A 1 ATOM 276 C CA . PHE A 0 34 . 17.091 10.364 -19.612 1.00 62.66 34 A 1 ATOM 277 C C . PHE A 0 34 . 17.401 11.825 -19.961 1.00 62.66 34 A 1 ATOM 278 C CB . PHE A 0 34 . 16.871 9.488 -20.850 1.00 62.66 34 A 1 ATOM 279 O O . PHE A 0 34 . 16.465 12.616 -20.094 1.00 62.66 34 A 1 ATOM 280 C CG . PHE A 0 34 . 16.794 8.015 -20.499 1.00 62.66 34 A 1 ATOM 281 C CD1 . PHE A 0 34 . 17.951 7.214 -20.533 1.00 62.66 34 A 1 ATOM 282 C CD2 . PHE A 0 34 . 15.575 7.458 -20.073 1.00 62.66 34 A 1 ATOM 283 C CE1 . PHE A 0 34 . 17.883 5.859 -20.165 1.00 62.66 34 A 1 ATOM 284 C CE2 . PHE A 0 34 . 15.510 6.108 -19.693 1.00 62.66 34 A 1 ATOM 285 C CZ . PHE A 0 34 . 16.661 5.304 -19.748 1.00 62.66 34 A 1 ATOM 286 N N . PRO A 0 35 . 18.687 12.196 -20.102 1.00 61.64 35 A 1 ATOM 287 C CA . PRO A 0 35 . 19.065 13.547 -20.515 1.00 61.64 35 A 1 ATOM 288 C C . PRO A 0 35 . 18.582 13.861 -21.937 1.00 61.64 35 A 1 ATOM 289 C CB . PRO A 0 35 . 20.595 13.590 -20.414 1.00 61.64 35 A 1 ATOM 290 O O . PRO A 0 35 . 18.114 14.963 -22.192 1.00 61.64 35 A 1 ATOM 291 C CG . PRO A 0 35 . 21.024 12.128 -20.548 1.00 61.64 35 A 1 ATOM 292 C CD . PRO A 0 35 . 19.862 11.351 -19.935 1.00 61.64 35 A 1 ATOM 293 N N . ASP A 0 36 . 18.630 12.861 -22.825 1.00 64.37 36 A 1 ATOM 294 C CA . ASP A 0 36 . 18.325 12.988 -24.247 1.00 64.37 36 A 1 ATOM 295 C C . ASP A 0 36 . 17.459 11.828 -24.754 1.00 64.37 36 A 1 ATOM 296 C CB . ASP A 0 36 . 19.629 13.035 -25.056 1.00 64.37 36 A 1 ATOM 297 O O . ASP A 0 36 . 17.538 10.691 -24.273 1.00 64.37 36 A 1 ATOM 298 C CG . ASP A 0 36 . 20.429 14.312 -24.809 1.00 64.37 36 A 1 ATOM 299 O OD1 . ASP A 0 36 . 19.831 15.394 -24.988 1.00 64.37 36 A 1 ATOM 300 O OD2 . ASP A 0 36 . 21.631 14.180 -24.493 1.00 64.37 36 A 1 ATOM 301 N N . LYS A 0 37 . 16.672 12.098 -25.804 1.00 66.46 37 A 1 ATOM 302 C CA . LYS A 0 37 . 15.822 11.102 -26.478 1.00 66.46 37 A 1 ATOM 303 C C . LYS A 0 37 . 16.628 9.945 -27.087 1.00 66.46 37 A 1 ATOM 304 C CB . LYS A 0 37 . 14.971 11.824 -27.537 1.00 66.46 37 A 1 ATOM 305 O O . LYS A 0 37 . 16.149 8.814 -27.109 1.00 66.46 37 A 1 ATOM 306 C CG . LYS A 0 37 . 13.946 10.898 -28.211 1.00 66.46 37 A 1 ATOM 307 C CD . LYS A 0 37 . 13.053 11.681 -29.180 1.00 66.46 37 A 1 ATOM 308 C CE . LYS A 0 37 . 12.030 10.738 -29.822 1.00 66.46 37 A 1 ATOM 309 N NZ . LYS A 0 37 . 11.032 11.487 -30.625 1.00 66.46 37 A 1 ATOM 310 N N . SER A 0 38 . 17.843 10.202 -27.571 1.00 67.18 38 A 1 ATOM 311 C CA . SER A 0 38 . 18.736 9.170 -28.124 1.00 67.18 38 A 1 ATOM 312 C C . SER A 0 38 . 19.142 8.138 -27.071 1.00 67.18 38 A 1 ATOM 313 C CB . SER A 0 38 . 19.996 9.824 -28.704 1.00 67.18 38 A 1 ATOM 314 O O . SER A 0 38 . 19.116 6.942 -27.354 1.00 67.18 38 A 1 ATOM 315 O OG . SER A 0 38 . 20.533 10.720 -27.751 1.00 67.18 38 A 1 ATOM 316 N N . SER A 0 39 . 19.441 8.588 -25.852 1.00 63.61 39 A 1 ATOM 317 C CA . SER A 0 39 . 19.784 7.733 -24.710 1.00 63.61 39 A 1 ATOM 318 C C . SER A 0 39 . 18.604 6.865 -24.269 1.00 63.61 39 A 1 ATOM 319 C CB . SER A 0 39 . 20.247 8.613 -23.545 1.00 63.61 39 A 1 ATOM 320 O O . SER A 0 39 . 18.773 5.682 -23.986 1.00 63.61 39 A 1 ATOM 321 O OG . SER A 0 39 . 21.343 9.405 -23.964 1.00 63.61 39 A 1 ATOM 322 N N . LEU A 0 40 . 17.386 7.422 -24.284 1.00 61.62 40 A 1 ATOM 323 C CA . LEU A 0 40 . 16.167 6.645 -24.045 1.00 61.62 40 A 1 ATOM 324 C C . LEU A 0 40 . 16.004 5.537 -25.096 1.00 61.62 40 A 1 ATOM 325 C CB . LEU A 0 40 . 14.952 7.594 -24.045 1.00 61.62 40 A 1 ATOM 326 O O . LEU A 0 40 . 15.747 4.386 -24.747 1.00 61.62 40 A 1 ATOM 327 C CG . LEU A 0 40 . 13.604 6.867 -23.886 1.00 61.62 40 A 1 ATOM 328 C CD1 . LEU A 0 40 . 13.412 6.329 -22.476 1.00 61.62 40 A 1 ATOM 329 C CD2 . LEU A 0 40 . 12.438 7.801 -24.187 1.00 61.62 40 A 1 ATOM 330 N N . ILE A 0 41 . 16.154 5.880 -26.380 1.00 64.26 41 A 1 ATOM 331 C CA . ILE A 0 41 . 16.020 4.915 -27.477 1.00 64.26 41 A 1 ATOM 332 C C . ILE A 0 41 . 17.090 3.830 -27.364 1.00 64.26 41 A 1 ATOM 333 C CB . ILE A 0 41 . 16.044 5.618 -28.853 1.00 64.26 41 A 1 ATOM 334 O O . ILE A 0 41 . 16.739 2.659 -27.468 1.00 64.26 41 A 1 ATOM 335 C CG1 . ILE A 0 41 . 14.774 6.483 -29.027 1.00 64.26 41 A 1 ATOM 336 C CG2 . ILE A 0 41 . 16.128 4.592 -30.003 1.00 64.26 41 A 1 ATOM 337 C CD1 . ILE A 0 41 . 14.851 7.465 -30.204 1.00 64.26 41 A 1 ATOM 338 N N . SER A 0 42 . 18.356 4.177 -27.100 1.00 62.01 42 A 1 ATOM 339 C CA . SER A 0 42 . 19.424 3.174 -26.981 1.00 62.01 42 A 1 ATOM 340 C C . SER A 0 42 . 19.126 2.180 -25.856 1.00 62.01 42 A 1 ATOM 341 C CB . SER A 0 42 . 20.816 3.804 -26.824 1.00 62.01 42 A 1 ATOM 342 O O . SER A 0 42 . 19.223 0.975 -26.081 1.00 62.01 42 A 1 ATOM 343 O OG . SER A 0 42 . 21.141 4.044 -25.471 1.00 62.01 42 A 1 ATOM 344 N N . CYS A 0 43 . 18.654 2.668 -24.703 1.00 58.24 43 A 1 ATOM 345 C CA . CYS A 0 43 . 18.266 1.845 -23.561 1.00 58.24 43 A 1 ATOM 346 C C . CYS A 0 43 . 17.061 0.939 -23.869 1.00 58.24 43 A 1 ATOM 347 C CB . CYS A 0 43 . 17.998 2.791 -22.383 1.00 58.24 43 A 1 ATOM 348 O O . CYS A 0 43 . 17.049 -0.232 -23.493 1.00 58.24 43 A 1 ATOM 349 S SG . CYS A 0 43 . 17.659 1.843 -20.871 1.00 58.24 43 A 1 ATOM 350 N N . LEU A 0 44 . 16.061 1.445 -24.596 1.00 58.44 44 A 1 ATOM 351 C CA . LEU A 0 44 . 14.921 0.635 -25.038 1.00 58.44 44 A 1 ATOM 352 C C . LEU A 0 44 . 15.329 -0.424 -26.068 1.00 58.44 44 A 1 ATOM 353 C CB . LEU A 0 44 . 13.832 1.549 -25.621 1.00 58.44 44 A 1 ATOM 354 O O . LEU A 0 44 . 14.814 -1.536 -26.028 1.00 58.44 44 A 1 ATOM 355 C CG . LEU A 0 44 . 13.085 2.392 -24.576 1.00 58.44 44 A 1 ATOM 356 C CD1 . LEU A 0 44 . 12.159 3.383 -25.283 1.00 58.44 44 A 1 ATOM 357 C CD2 . LEU A 0 44 . 12.229 1.531 -23.649 1.00 58.44 44 A 1 ATOM 358 N N . THR A 0 45 . 16.243 -0.094 -26.983 1.00 59.63 45 A 1 ATOM 359 C CA . THR A 0 45 . 16.706 -1.018 -28.031 1.00 59.63 45 A 1 ATOM 360 C C . THR A 0 45 . 17.735 -2.032 -27.542 1.00 59.63 45 A 1 ATOM 361 C CB . THR A 0 45 . 17.284 -0.275 -29.242 1.00 59.63 45 A 1 ATOM 362 O O . THR A 0 45 . 17.888 -3.079 -28.166 1.00 59.63 45 A 1 ATOM 363 C CG2 . THR A 0 45 . 16.221 0.539 -29.982 1.00 59.63 45 A 1 ATOM 364 O OG1 . THR A 0 45 . 18.340 0.588 -28.883 1.00 59.63 45 A 1 ATOM 365 N N . SER A 0 46 . 18.435 -1.753 -26.439 1.00 59.38 46 A 1 ATOM 366 C CA . SER A 0 46 . 19.399 -2.682 -25.849 1.00 59.38 46 A 1 ATOM 367 C C . SER A 0 46 . 18.735 -3.771 -25.006 1.00 59.38 46 A 1 ATOM 368 C CB . SER A 0 46 . 20.462 -1.923 -25.050 1.00 59.38 46 A 1 ATOM 369 O O . SER A 0 46 . 19.399 -4.747 -24.662 1.00 59.38 46 A 1 ATOM 370 O OG . SER A 0 46 . 19.909 -1.278 -23.922 1.00 59.38 46 A 1 ATOM 371 N N . TYR A 0 47 . 17.435 -3.653 -24.706 1.00 44.49 47 A 1 ATOM 372 C CA . TYR A 0 47 . 16.677 -4.670 -23.984 1.00 44.49 47 A 1 ATOM 373 C C . TYR A 0 47 . 15.705 -5.427 -24.916 1.00 44.49 47 A 1 ATOM 374 C CB . TYR A 0 47 . 15.983 -4.051 -22.766 1.00 44.49 47 A 1 ATOM 375 O O . TYR A 0 47 . 14.922 -4.791 -25.616 1.00 44.49 47 A 1 ATOM 376 C CG . TYR A 0 47 . 15.910 -5.015 -21.598 1.00 44.49 47 A 1 ATOM 377 C CD1 . TYR A 0 47 . 14.755 -5.789 -21.377 1.00 44.49 47 A 1 ATOM 378 C CD2 . TYR A 0 47 . 17.029 -5.161 -20.756 1.00 44.49 47 A 1 ATOM 379 C CE1 . TYR A 0 47 . 14.715 -6.697 -20.300 1.00 44.49 47 A 1 ATOM 380 C CE2 . TYR A 0 47 . 16.994 -6.065 -19.679 1.00 44.49 47 A 1 ATOM 381 O OH . TYR A 0 47 . 15.782 -7.698 -18.401 1.00 44.49 47 A 1 ATOM 382 C CZ . TYR A 0 47 . 15.830 -6.831 -19.446 1.00 44.49 47 A 1 ATOM 383 N N . PRO A 0 48 . 15.680 -6.775 -24.920 1.00 47.02 48 A 1 ATOM 384 C CA . PRO A 0 48 . 16.429 -7.674 -24.050 1.00 47.02 48 A 1 ATOM 385 C C . PRO A 0 48 . 17.897 -7.746 -24.471 1.00 47.02 48 A 1 ATOM 386 C CB . PRO A 0 48 . 15.723 -9.028 -24.177 1.00 47.02 48 A 1 ATOM 387 O O . PRO A 0 48 . 18.197 -7.999 -25.637 1.00 47.02 48 A 1 ATOM 388 C CG . PRO A 0 48 . 15.163 -9.010 -25.600 1.00 47.02 48 A 1 ATOM 389 C CD . PRO A 0 48 . 14.840 -7.535 -25.835 1.00 47.02 48 A 1 ATOM 390 N N . VAL A 0 49 . 18.808 -7.574 -23.507 1.00 46.77 49 A 1 ATOM 391 C CA . VAL A 0 49 . 20.227 -7.872 -23.714 1.00 46.77 49 A 1 ATOM 392 C C . VAL A 0 49 . 20.304 -9.373 -23.963 1.00 46.77 49 A 1 ATOM 393 C CB . VAL A 0 49 . 21.117 -7.447 -22.522 1.00 46.77 49 A 1 ATOM 394 O O . VAL A 0 49 . 20.369 -10.179 -23.034 1.00 46.77 49 A 1 ATOM 395 C CG1 . VAL A 0 49 . 22.600 -7.722 -22.814 1.00 46.77 49 A 1 ATOM 396 C CG2 . VAL A 0 49 . 21.006 -5.953 -22.200 1.00 46.77 49 A 1 ATOM 397 N N . ILE A 0 50 . 20.256 -9.772 -25.230 1.00 43.92 50 A 1 ATOM 398 C CA . ILE A 0 50 . 20.775 -11.060 -25.656 1.00 43.92 50 A 1 ATOM 399 C C . ILE A 0 50 . 22.269 -10.915 -25.404 1.00 43.92 50 A 1 ATOM 400 C CB . ILE A 0 50 . 20.425 -11.366 -27.130 1.00 43.92 50 A 1 ATOM 401 O O . ILE A 0 50 . 22.981 -10.324 -26.213 1.00 43.92 50 A 1 ATOM 402 C CG1 . ILE A 0 50 . 18.894 -11.338 -27.353 1.00 43.92 50 A 1 ATOM 403 C CG2 . ILE A 0 50 . 21.008 -12.739 -27.523 1.00 43.92 50 A 1 ATOM 404 C CD1 . ILE A 0 50 . 18.478 -11.442 -28.826 1.00 43.92 50 A 1 ATOM 405 N N . VAL A 0 51 . 22.718 -11.343 -24.220 1.00 44.11 51 A 1 ATOM 406 C CA . VAL A 0 51 . 24.133 -11.382 -23.856 1.00 44.11 51 A 1 ATOM 407 C C . VAL A 0 51 . 24.786 -12.352 -24.830 1.00 44.11 51 A 1 ATOM 408 C CB . VAL A 0 51 . 24.354 -11.813 -22.388 1.00 44.11 51 A 1 ATOM 409 O O . VAL A 0 51 . 24.858 -13.555 -24.591 1.00 44.11 51 A 1 ATOM 410 C CG1 . VAL A 0 51 . 25.849 -11.837 -22.032 1.00 44.11 51 A 1 ATOM 411 C CG2 . VAL A 0 51 . 23.674 -10.865 -21.393 1.00 44.11 51 A 1 ATOM 412 N N . ASN A 0 52 . 25.208 -11.841 -25.980 1.00 44.41 52 A 1 ATOM 413 C CA . ASN A 0 52 . 26.108 -12.560 -26.845 1.00 44.41 52 A 1 ATOM 414 C C . ASN A 0 52 . 27.468 -12.448 -26.156 1.00 44.41 52 A 1 ATOM 415 C CB . ASN A 0 52 . 26.040 -11.986 -28.270 1.00 44.41 52 A 1 ATOM 416 O O . ASN A 0 52 . 28.082 -11.384 -26.156 1.00 44.41 52 A 1 ATOM 417 C CG . ASN A 0 52 . 26.577 -12.961 -29.301 1.00 44.41 52 A 1 ATOM 418 N ND2 . ASN A 0 52 . 26.731 -12.531 -30.531 1.00 44.41 52 A 1 ATOM 419 O OD1 . ASN A 0 52 . 26.849 -14.118 -29.034 1.00 44.41 52 A 1 ATOM 420 N N . ILE A 0 53 . 27.885 -13.535 -25.505 1.00 52.13 53 A 1 ATOM 421 C CA . ILE A 0 53 . 29.039 -13.643 -24.587 1.00 52.13 53 A 1 ATOM 422 C C . ILE A 0 53 . 30.376 -13.202 -25.234 1.00 52.13 53 A 1 ATOM 423 C CB . ILE A 0 53 . 29.053 -15.095 -24.018 1.00 52.13 53 A 1 ATOM 424 O O . ILE A 0 53 . 31.385 -13.069 -24.553 1.00 52.13 53 A 1 ATOM 425 C CG1 . ILE A 0 53 . 27.785 -15.344 -23.157 1.00 52.13 53 A 1 ATOM 426 C CG2 . ILE A 0 53 . 30.303 -15.430 -23.182 1.00 52.13 53 A 1 ATOM 427 C CD1 . ILE A 0 53 . 27.518 -16.815 -22.807 1.00 52.13 53 A 1 ATOM 428 N N . ASN A 0 54 . 30.383 -12.894 -26.532 1.00 51.18 54 A 1 ATOM 429 C CA . ASN A 0 54 . 31.567 -12.532 -27.304 1.00 51.18 54 A 1 ATOM 430 C C . ASN A 0 54 . 31.694 -11.031 -27.634 1.00 51.18 54 A 1 ATOM 431 C CB . ASN A 0 54 . 31.592 -13.411 -28.565 1.00 51.18 54 A 1 ATOM 432 O O . ASN A 0 54 . 32.560 -10.679 -28.432 1.00 51.18 54 A 1 ATOM 433 C CG . ASN A 0 54 . 31.731 -14.893 -28.272 1.00 51.18 54 A 1 ATOM 434 N ND2 . ASN A 0 54 . 31.571 -15.722 -29.276 1.00 51.18 54 A 1 ATOM 435 O OD1 . ASN A 0 54 . 31.981 -15.348 -27.171 1.00 51.18 54 A 1 ATOM 436 N N . GLN A 0 55 . 30.855 -10.142 -27.088 1.00 45.42 55 A 1 ATOM 437 C CA . GLN A 0 55 . 31.041 -8.696 -27.280 1.00 45.42 55 A 1 ATOM 438 C C . GLN A 0 55 . 31.873 -8.068 -26.162 1.00 45.42 55 A 1 ATOM 439 C CB . GLN A 0 55 . 29.708 -7.974 -27.523 1.00 45.42 55 A 1 ATOM 440 O O . GLN A 0 55 . 31.598 -8.252 -24.977 1.00 45.42 55 A 1 ATOM 441 C CG . GLN A 0 55 . 29.387 -7.994 -29.027 1.00 45.42 55 A 1 ATOM 442 C CD . GLN A 0 55 . 28.073 -7.312 -29.384 1.00 45.42 55 A 1 ATOM 443 N NE2 . GLN A 0 55 . 27.826 -7.056 -30.651 1.00 45.42 55 A 1 ATOM 444 O OE1 . GLN A 0 55 . 27.233 -7.008 -28.560 1.00 45.42 55 A 1 ATOM 445 N N . ASP A 0 56 . 32.895 -7.314 -26.579 1.00 47.63 56 A 1 ATOM 446 C CA . ASP A 0 56 . 33.841 -6.618 -25.715 1.00 47.63 56 A 1 ATOM 447 C C . ASP A 0 56 . 33.129 -5.825 -24.603 1.00 47.63 56 A 1 ATOM 448 C CB . ASP A 0 56 . 34.693 -5.637 -26.542 1.00 47.63 56 A 1 ATOM 449 O O . ASP A 0 56 . 32.300 -4.956 -24.900 1.00 47.63 56 A 1 ATOM 450 C CG . ASP A 0 56 . 35.942 -6.274 -27.148 1.00 47.63 56 A 1 ATOM 451 O OD1 . ASP A 0 56 . 36.641 -6.977 -26.386 1.00 47.63 56 A 1 ATOM 452 O OD2 . ASP A 0 56 . 36.219 -5.978 -28.329 1.00 47.63 56 A 1 ATOM 453 N N . PRO A 0 57 . 33.506 -6.013 -23.324 1.00 50.29 57 A 1 ATOM 454 C CA . PRO A 0 57 . 32.900 -5.295 -22.200 1.00 50.29 57 A 1 ATOM 455 C C . PRO A 0 57 . 33.057 -3.768 -22.315 1.00 50.29 57 A 1 ATOM 456 C CB . PRO A 0 57 . 33.588 -5.860 -20.950 1.00 50.29 57 A 1 ATOM 457 O O . PRO A 0 57 . 32.259 -3.013 -21.763 1.00 50.29 57 A 1 ATOM 458 C CG . PRO A 0 57 . 34.914 -6.422 -21.464 1.00 50.29 57 A 1 ATOM 459 C CD . PRO A 0 57 . 34.564 -6.901 -22.866 1.00 50.29 57 A 1 ATOM 460 N N . ARG A 0 58 . 34.049 -3.295 -23.086 1.00 49.25 58 A 1 ATOM 461 C CA . ARG A 0 58 . 34.264 -1.865 -23.353 1.00 49.25 58 A 1 ATOM 462 C C . ARG A 0 58 . 33.161 -1.240 -24.210 1.00 49.25 58 A 1 ATOM 463 C CB . ARG A 0 58 . 35.637 -1.634 -23.996 1.00 49.25 58 A 1 ATOM 464 O O . ARG A 0 58 . 32.768 -0.110 -23.930 1.00 49.25 58 A 1 ATOM 465 C CG . ARG A 0 58 . 36.781 -1.858 -22.998 1.00 49.25 58 A 1 ATOM 466 C CD . ARG A 0 58 . 38.113 -1.463 -23.642 1.00 49.25 58 A 1 ATOM 467 N NE . ARG A 0 58 . 39.233 -1.586 -22.691 1.00 49.25 58 A 1 ATOM 468 N NH1 . ARG A 0 58 . 40.845 -0.637 -24.021 1.00 49.25 58 A 1 ATOM 469 N NH2 . ARG A 0 58 . 41.380 -1.351 -21.974 1.00 49.25 58 A 1 ATOM 470 C CZ . ARG A 0 58 . 40.475 -1.192 -22.899 1.00 49.25 58 A 1 ATOM 471 N N . LEU A 0 59 . 32.625 -1.954 -25.204 1.00 46.51 59 A 1 ATOM 472 C CA . LEU A 0 59 . 31.509 -1.439 -26.012 1.00 46.51 59 A 1 ATOM 473 C C . LEU A 0 59 . 30.240 -1.307 -25.165 1.00 46.51 59 A 1 ATOM 474 C CB . LEU A 0 59 . 31.283 -2.347 -27.237 1.00 46.51 59 A 1 ATOM 475 O O . LEU A 0 59 . 29.542 -0.297 -25.258 1.00 46.51 59 A 1 ATOM 476 C CG . LEU A 0 59 . 32.059 -1.857 -28.471 1.00 46.51 59 A 1 ATOM 477 C CD1 . LEU A 0 59 . 32.213 -2.982 -29.492 1.00 46.51 59 A 1 ATOM 478 C CD2 . LEU A 0 59 . 31.332 -0.690 -29.150 1.00 46.51 59 A 1 ATOM 479 N N . LEU A 0 60 . 30.009 -2.275 -24.276 1.00 49.02 60 A 1 ATOM 480 C CA . LEU A 0 60 . 28.868 -2.282 -23.362 1.00 49.02 60 A 1 ATOM 481 C C . LEU A 0 60 . 28.922 -1.116 -22.360 1.00 49.02 60 A 1 ATOM 482 C CB . LEU A 0 60 . 28.793 -3.671 -22.693 1.00 49.02 60 A 1 ATOM 483 O O . LEU A 0 60 . 27.908 -0.454 -22.161 1.00 49.02 60 A 1 ATOM 484 C CG . LEU A 0 60 . 27.359 -4.244 -22.648 1.00 49.02 60 A 1 ATOM 485 C CD1 . LEU A 0 60 . 27.359 -5.713 -23.076 1.00 49.02 60 A 1 ATOM 486 C CD2 . LEU A 0 60 . 26.757 -4.142 -21.248 1.00 49.02 60 A 1 ATOM 487 N N . SER A 0 61 . 30.110 -0.784 -21.834 1.00 46.58 61 A 1 ATOM 488 C CA . SER A 0 61 . 30.289 0.385 -20.951 1.00 46.58 61 A 1 ATOM 489 C C . SER A 0 61 . 30.048 1.731 -21.646 1.00 46.58 61 A 1 ATOM 490 C CB . SER A 0 61 . 31.682 0.372 -20.311 1.00 46.58 61 A 1 ATOM 491 O O . SER A 0 61 . 29.622 2.687 -21.010 1.00 46.58 61 A 1 ATOM 492 O OG . SER A 0 61 . 32.735 0.537 -21.253 1.00 46.58 61 A 1 ATOM 493 N N . SER A 0 62 . 30.274 1.823 -22.965 1.00 47.33 62 A 1 ATOM 494 C CA . SER A 0 62 . 30.016 3.067 -23.709 1.00 47.33 62 A 1 ATOM 495 C C . SER A 0 62 . 28.524 3.325 -23.946 1.00 47.33 62 A 1 ATOM 496 C CB . SER A 0 62 . 30.792 3.073 -25.028 1.00 47.33 62 A 1 ATOM 497 O O . SER A 0 62 . 28.121 4.465 -24.170 1.00 47.33 62 A 1 ATOM 498 O OG . SER A 0 62 . 30.193 2.258 -26.022 1.00 47.33 62 A 1 ATOM 499 N N . LEU A 0 63 . 27.703 2.269 -23.878 1.00 48.09 63 A 1 ATOM 500 C CA . LEU A 0 63 . 26.247 2.344 -23.999 1.00 48.09 63 A 1 ATOM 501 C C . LEU A 0 63 . 25.550 2.705 -22.685 1.00 48.09 63 A 1 ATOM 502 C CB . LEU A 0 63 . 25.702 1.003 -24.532 1.00 48.09 63 A 1 ATOM 503 O O . LEU A 0 63 . 24.334 2.899 -22.675 1.00 48.09 63 A 1 ATOM 504 C CG . LEU A 0 63 . 24.962 1.187 -25.865 1.00 48.09 63 A 1 ATOM 505 C CD1 . LEU A 0 63 . 25.955 1.130 -27.027 1.00 48.09 63 A 1 ATOM 506 C CD2 . LEU A 0 63 . 23.906 0.100 -26.058 1.00 48.09 63 A 1 ATOM 507 N N . GLU A 0 64 . 26.298 2.771 -21.585 1.00 45.72 64 A 1 ATOM 508 C CA . GLU A 0 64 . 25.782 3.077 -20.260 1.00 45.72 64 A 1 ATOM 509 C C . GLU A 0 64 . 25.496 4.582 -20.184 1.00 45.72 64 A 1 ATOM 510 C CB . GLU A 0 64 . 26.755 2.511 -19.208 1.00 45.72 64 A 1 ATOM 511 O O . GLU A 0 64 . 26.245 5.379 -19.621 1.00 45.72 64 A 1 ATOM 512 C CG . GLU A 0 64 . 26.046 2.080 -17.916 1.00 45.72 64 A 1 ATOM 513 C CD . GLU A 0 64 . 26.945 1.248 -16.979 1.00 45.72 64 A 1 ATOM 514 O OE1 . GLU A 0 64 . 26.405 0.784 -15.949 1.00 45.72 64 A 1 ATOM 515 O OE2 . GLU A 0 64 . 28.145 1.056 -17.290 1.00 45.72 64 A 1 ATOM 516 N N . SER A 0 65 . 24.411 5.006 -20.839 1.00 53.26 65 A 1 ATOM 517 C CA . SER A 0 65 . 23.894 6.358 -20.701 1.00 53.26 65 A 1 ATOM 518 C C . SER A 0 65 . 23.501 6.542 -19.240 1.00 53.26 65 A 1 ATOM 519 C CB . SER A 0 65 . 22.717 6.608 -21.651 1.00 53.26 65 A 1 ATOM 520 O O . SER A 0 65 . 22.454 6.051 -18.810 1.00 53.26 65 A 1 ATOM 521 O OG . SER A 0 65 . 21.625 5.755 -21.366 1.00 53.26 65 A 1 ATOM 522 N N . VAL A 0 66 . 24.365 7.204 -18.472 1.00 53.14 66 A 1 ATOM 523 C CA . VAL A 0 66 . 24.107 7.543 -17.074 1.00 53.14 66 A 1 ATOM 524 C C . VAL A 0 66 . 22.786 8.320 -17.041 1.00 53.14 66 A 1 ATOM 525 C CB . VAL A 0 66 . 25.267 8.365 -16.478 1.00 53.14 66 A 1 ATOM 526 O O . VAL A 0 66 . 22.701 9.386 -17.660 1.00 53.14 66 A 1 ATOM 527 C CG1 . VAL A 0 66 . 25.012 8.707 -15.004 1.00 53.14 66 A 1 ATOM 528 C CG2 . VAL A 0 66 . 26.590 7.588 -16.555 1.00 53.14 66 A 1 ATOM 529 N N . PRO A 0 67 . 21.721 7.792 -16.408 1.00 50.75 67 A 1 ATOM 530 C CA . PRO A 0 67 . 20.469 8.526 -16.315 1.00 50.75 67 A 1 ATOM 531 C C . PRO A 0 67 . 20.737 9.843 -15.583 1.00 50.75 67 A 1 ATOM 532 C CB . PRO A 0 67 . 19.492 7.604 -15.582 1.00 50.75 67 A 1 ATOM 533 O O . PRO A 0 67 . 21.443 9.862 -14.576 1.00 50.75 67 A 1 ATOM 534 C CG . PRO A 0 67 . 20.403 6.668 -14.786 1.00 50.75 67 A 1 ATOM 535 C CD . PRO A 0 67 . 21.648 6.545 -15.662 1.00 50.75 67 A 1 ATOM 536 N N . ALA A 0 68 . 20.179 10.943 -16.096 1.00 53.59 68 A 1 ATOM 537 C CA . ALA A 0 68 . 20.450 12.284 -15.578 1.00 53.59 68 A 1 ATOM 538 C C . ALA A 0 68 . 20.085 12.393 -14.089 1.00 53.59 68 A 1 ATOM 539 C CB . ALA A 0 68 . 19.671 13.292 -16.431 1.00 53.59 68 A 1 ATOM 540 O O . ALA A 0 68 . 20.775 13.062 -13.323 1.00 53.59 68 A 1 ATOM 541 N N . TRP A 0 69 . 19.016 11.702 -13.683 1.00 46.09 69 A 1 ATOM 542 C CA . TRP A 0 69 . 18.679 11.403 -12.296 1.00 46.09 69 A 1 ATOM 543 C C . TRP A 0 69 . 17.590 10.319 -12.239 1.00 46.09 69 A 1 ATOM 544 C CB . TRP A 0 69 . 18.213 12.677 -11.573 1.00 46.09 69 A 1 ATOM 545 O O . TRP A 0 69 . 16.765 10.181 -13.147 1.00 46.09 69 A 1 ATOM 546 C CG . TRP A 0 69 . 17.046 13.370 -12.201 1.00 46.09 69 A 1 ATOM 547 C CD1 . TRP A 0 69 . 15.754 13.113 -11.913 1.00 46.09 69 A 1 ATOM 548 C CD2 . TRP A 0 69 . 17.033 14.403 -13.235 1.00 46.09 69 A 1 ATOM 549 C CE2 . TRP A 0 69 . 15.673 14.712 -13.538 1.00 46.09 69 A 1 ATOM 550 C CE3 . TRP A 0 69 . 18.026 15.116 -13.943 1.00 46.09 69 A 1 ATOM 551 N NE1 . TRP A 0 69 . 14.939 13.925 -12.670 1.00 46.09 69 A 1 ATOM 552 C CH2 . TRP A 0 69 . 16.337 16.322 -15.226 1.00 46.09 69 A 1 ATOM 553 C CZ2 . TRP A 0 69 . 15.322 15.658 -14.517 1.00 46.09 69 A 1 ATOM 554 C CZ3 . TRP A 0 69 . 17.684 16.055 -14.933 1.00 46.09 69 A 1 ATOM 555 N N . ILE A 0 70 . 17.574 9.553 -11.147 1.00 56.20 70 A 1 ATOM 556 C CA . ILE A 0 70 . 16.558 8.535 -10.856 1.00 56.20 70 A 1 ATOM 557 C C . ILE A 0 70 . 15.617 9.124 -9.807 1.00 56.20 70 A 1 ATOM 558 C CB . ILE A 0 70 . 17.221 7.218 -10.387 1.00 56.20 70 A 1 ATOM 559 O O . ILE A 0 70 . 16.039 9.412 -8.688 1.00 56.20 70 A 1 ATOM 560 C CG1 . ILE A 0 70 . 18.201 6.689 -11.462 1.00 56.20 70 A 1 ATOM 561 C CG2 . ILE A 0 70 . 16.142 6.165 -10.066 1.00 56.20 70 A 1 ATOM 562 C CD1 . ILE A 0 70 . 19.055 5.501 -11.004 1.00 56.20 70 A 1 ATOM 563 N N . GLU A 0 71 . 14.345 9.322 -10.156 1.00 50.90 71 A 1 ATOM 564 C CA . GLU A 0 71 . 13.344 9.825 -9.214 1.00 50.90 71 A 1 ATOM 565 C C . GLU A 0 71 . 12.435 8.671 -8.780 1.00 50.90 71 A 1 ATOM 566 C CB . GLU A 0 71 . 12.587 11.032 -9.799 1.00 50.90 71 A 1 ATOM 567 O O . GLU A 0 71 . 11.549 8.214 -9.508 1.00 50.90 71 A 1 ATOM 568 C CG . GLU A 0 71 . 11.819 11.806 -8.711 1.00 50.90 71 A 1 ATOM 569 C CD . GLU A 0 71 . 11.007 13.000 -9.252 1.00 50.90 71 A 1 ATOM 570 O OE1 . GLU A 0 71 . 10.163 13.539 -8.497 1.00 50.90 71 A 1 ATOM 571 O OE2 . GLU A 0 71 . 11.112 13.356 -10.446 1.00 50.90 71 A 1 ATOM 572 N N . VAL A 0 72 . 12.647 8.180 -7.560 1.00 51.96 72 A 1 ATOM 573 C CA . VAL A 0 72 . 11.729 7.230 -6.930 1.00 51.96 72 A 1 ATOM 574 C C . VAL A 0 72 . 10.566 8.024 -6.348 1.00 51.96 72 A 1 ATOM 575 C CB . VAL A 0 72 . 12.423 6.377 -5.854 1.00 51.96 72 A 1 ATOM 576 O O . VAL A 0 72 . 10.618 8.494 -5.209 1.00 51.96 72 A 1 ATOM 577 C CG1 . VAL A 0 72 . 11.432 5.344 -5.301 1.00 51.96 72 A 1 ATOM 578 C CG2 . VAL A 0 72 . 13.641 5.626 -6.399 1.00 51.96 72 A 1 ATOM 579 N N . ARG A 0 73 . 9.479 8.173 -7.110 1.00 49.27 73 A 1 ATOM 580 C CA . ARG A 0 73 . 8.234 8.699 -6.543 1.00 49.27 73 A 1 ATOM 581 C C . ARG A 0 73 . 7.535 7.582 -5.794 1.00 49.27 73 A 1 ATOM 582 C CB . ARG A 0 73 . 7.351 9.384 -7.589 1.00 49.27 73 A 1 ATOM 583 O O . ARG A 0 73 . 6.776 6.783 -6.353 1.00 49.27 73 A 1 ATOM 584 C CG . ARG A 0 73 . 7.964 10.733 -7.978 1.00 49.27 73 A 1 ATOM 585 C CD . ARG A 0 73 . 6.946 11.620 -8.695 1.00 49.27 73 A 1 ATOM 586 N NE . ARG A 0 73 . 7.588 12.888 -9.034 1.00 49.27 73 A 1 ATOM 587 N NH1 . ARG A 0 73 . 5.927 13.960 -10.197 1.00 49.27 73 A 1 ATOM 588 N NH2 . ARG A 0 73 . 7.984 14.865 -9.967 1.00 49.27 73 A 1 ATOM 589 C CZ . ARG A 0 73 . 7.150 13.901 -9.734 1.00 49.27 73 A 1 ATOM 590 N N . HIS A 0 74 . 7.775 7.554 -4.488 1.00 48.94 74 A 1 ATOM 591 C CA . HIS A 0 74 . 6.973 6.757 -3.581 1.00 48.94 74 A 1 ATOM 592 C C . HIS A 0 74 . 5.551 7.330 -3.568 1.00 48.94 74 A 1 ATOM 593 C CB . HIS A 0 74 . 7.633 6.683 -2.199 1.00 48.94 74 A 1 ATOM 594 O O . HIS A 0 74 . 5.221 8.249 -2.820 1.00 48.94 74 A 1 ATOM 595 C CG . HIS A 0 74 . 7.074 5.553 -1.373 1.00 48.94 74 A 1 ATOM 596 C CD2 . HIS A 0 74 . 6.178 5.646 -0.347 1.00 48.94 74 A 1 ATOM 597 N ND1 . HIS A 0 74 . 7.358 4.219 -1.529 1.00 48.94 74 A 1 ATOM 598 C CE1 . HIS A 0 74 . 6.633 3.523 -0.638 1.00 48.94 74 A 1 ATOM 599 N NE2 . HIS A 0 74 . 5.888 4.356 0.106 1.00 48.94 74 A 1 ATOM 600 N N . SER A 0 75 . 4.705 6.793 -4.444 1.00 50.29 75 A 1 ATOM 601 C CA . SER A 0 75 . 3.257 6.908 -4.350 1.00 50.29 75 A 1 ATOM 602 C C . SER A 0 75 . 2.858 6.184 -3.066 1.00 50.29 75 A 1 ATOM 603 C CB . SER A 0 75 . 2.622 6.337 -5.628 1.00 50.29 75 A 1 ATOM 604 O O . SER A 0 75 . 2.572 4.986 -3.063 1.00 50.29 75 A 1 ATOM 605 O OG . SER A 0 75 . 1.347 5.786 -5.408 1.00 50.29 75 A 1 ATOM 606 N N . ARG A 0 76 . 2.935 6.904 -1.944 1.00 49.88 76 A 1 ATOM 607 C CA . ARG A 0 76 . 2.517 6.438 -0.627 1.00 49.88 76 A 1 ATOM 608 C C . ARG A 0 76 . 1.003 6.288 -0.689 1.00 49.88 76 A 1 ATOM 609 C CB . ARG A 0 76 . 3.001 7.445 0.435 1.00 49.88 76 A 1 ATOM 610 O O . ARG A 0 76 . 0.284 7.222 -0.356 1.00 49.88 76 A 1 ATOM 611 C CG . ARG A 0 76 . 3.131 6.804 1.822 1.00 49.88 76 A 1 ATOM 612 C CD . ARG A 0 76 . 3.679 7.829 2.823 1.00 49.88 76 A 1 ATOM 613 N NE . ARG A 0 76 . 4.121 7.184 4.075 1.00 49.88 76 A 1 ATOM 614 N NH1 . ARG A 0 76 . 5.014 9.049 5.077 1.00 49.88 76 A 1 ATOM 615 N NH2 . ARG A 0 76 . 5.134 7.077 6.113 1.00 49.88 76 A 1 ATOM 616 C CZ . ARG A 0 76 . 4.749 7.772 5.079 1.00 49.88 76 A 1 ATOM 617 N N . ASN A 0 77 . 0.522 5.152 -1.196 1.00 53.24 77 A 1 ATOM 618 C CA . ASN A 0 77 . -0.899 5.007 -1.497 1.00 53.24 77 A 1 ATOM 619 C C . ASN A 0 77 . -1.775 5.181 -0.254 1.00 53.24 77 A 1 ATOM 620 C CB . ASN A 0 77 . -1.173 3.695 -2.263 1.00 53.24 77 A 1 ATOM 621 O O . ASN A 0 77 . -2.915 5.565 -0.421 1.00 53.24 77 A 1 ATOM 622 C CG . ASN A 0 77 . -1.437 3.909 -3.747 1.00 53.24 77 A 1 ATOM 623 N ND2 . ASN A 0 77 . -1.526 2.846 -4.510 1.00 53.24 77 A 1 ATOM 624 O OD1 . ASN A 0 77 . -1.576 5.001 -4.262 1.00 53.24 77 A 1 ATOM 625 N N . ILE A 0 78 . -1.238 5.000 0.956 1.00 56.51 78 A 1 ATOM 626 C CA . ILE A 0 78 . -1.690 5.576 2.231 1.00 56.51 78 A 1 ATOM 627 C C . ILE A 0 78 . -0.490 5.460 3.193 1.00 56.51 78 A 1 ATOM 628 C CB . ILE A 0 78 . -2.956 4.836 2.742 1.00 56.51 78 A 1 ATOM 629 O O . ILE A 0 78 . 0.289 4.508 3.094 1.00 56.51 78 A 1 ATOM 630 C CG1 . ILE A 0 78 . -4.289 5.306 2.094 1.00 56.51 78 A 1 ATOM 631 C CG2 . ILE A 0 78 . -3.167 5.008 4.245 1.00 56.51 78 A 1 ATOM 632 C CD1 . ILE A 0 78 . -4.996 4.190 1.312 1.00 56.51 78 A 1 ATOM 633 N N . SER A 0 79 . -0.280 6.409 4.113 1.00 65.52 79 A 1 ATOM 634 C CA . SER A 0 79 . 0.810 6.285 5.090 1.00 65.52 79 A 1 ATOM 635 C C . SER A 0 79 . 0.573 5.080 6.013 1.00 65.52 79 A 1 ATOM 636 C CB . SER A 0 79 . 1.030 7.595 5.862 1.00 65.52 79 A 1 ATOM 637 O O . SER A 0 79 . -0.521 4.885 6.530 1.00 65.52 79 A 1 ATOM 638 O OG . SER A 0 79 . -0.056 7.885 6.711 1.00 65.52 79 A 1 ATOM 639 N N . LEU A 0 80 . 1.601 4.259 6.246 1.00 66.76 80 A 1 ATOM 640 C CA . LEU A 0 80 . 1.517 3.109 7.159 1.00 66.76 80 A 1 ATOM 641 C C . LEU A 0 80 . 0.993 3.509 8.550 1.00 66.76 80 A 1 ATOM 642 C CB . LEU A 0 80 . 2.915 2.470 7.213 1.00 66.76 80 A 1 ATOM 643 O O . LEU A 0 80 . 0.206 2.788 9.152 1.00 66.76 80 A 1 ATOM 644 C CG . LEU A 0 80 . 2.984 1.171 8.041 1.00 66.76 80 A 1 ATOM 645 C CD1 . LEU A 0 80 . 3.946 0.193 7.377 1.00 66.76 80 A 1 ATOM 646 C CD2 . LEU A 0 80 . 3.482 1.424 9.465 1.00 66.76 80 A 1 ATOM 647 N N . SER A 0 81 . 1.370 4.706 9.007 1.00 68.98 81 A 1 ATOM 648 C CA . SER A 0 81 . 0.854 5.318 10.234 1.00 68.98 81 A 1 ATOM 649 C C . SER A 0 81 . -0.663 5.547 10.193 1.00 68.98 81 A 1 ATOM 650 C CB . SER A 0 81 . 1.592 6.637 10.477 1.00 68.98 81 A 1 ATOM 651 O O . SER A 0 81 . -1.359 5.217 11.147 1.00 68.98 81 A 1 ATOM 652 O OG . SER A 0 81 . 1.133 7.234 11.665 1.00 68.98 81 A 1 ATOM 653 N N . PHE A 0 82 . -1.215 6.025 9.074 1.00 72.14 82 A 1 ATOM 654 C CA . PHE A 0 82 . -2.665 6.173 8.930 1.00 72.14 82 A 1 ATOM 655 C C . PHE A 0 82 . -3.387 4.823 9.010 1.00 72.14 82 A 1 ATOM 656 C CB . PHE A 0 82 . -2.965 6.890 7.614 1.00 72.14 82 A 1 ATOM 657 O O . PHE A 0 82 . -4.393 4.707 9.705 1.00 72.14 82 A 1 ATOM 658 C CG . PHE A 0 82 . -4.435 7.049 7.309 1.00 72.14 82 A 1 ATOM 659 C CD1 . PHE A 0 82 . -5.143 6.021 6.658 1.00 72.14 82 A 1 ATOM 660 C CD2 . PHE A 0 82 . -5.097 8.235 7.664 1.00 72.14 82 A 1 ATOM 661 C CE1 . PHE A 0 82 . -6.479 6.212 6.277 1.00 72.14 82 A 1 ATOM 662 C CE2 . PHE A 0 82 . -6.444 8.416 7.310 1.00 72.14 82 A 1 ATOM 663 C CZ . PHE A 0 82 . -7.122 7.420 6.587 1.00 72.14 82 A 1 ATOM 664 N N . TRP A 0 83 . -2.850 3.784 8.360 1.00 73.58 83 A 1 ATOM 665 C CA . TRP A 0 83 . -3.395 2.424 8.467 1.00 73.58 83 A 1 ATOM 666 C C . TRP A 0 83 . -3.352 1.893 9.902 1.00 73.58 83 A 1 ATOM 667 C CB . TRP A 0 83 . -2.650 1.478 7.515 1.00 73.58 83 A 1 ATOM 668 O O . TRP A 0 83 . -4.311 1.269 10.358 1.00 73.58 83 A 1 ATOM 669 C CG . TRP A 0 83 . -3.424 1.141 6.284 1.00 73.58 83 A 1 ATOM 670 C CD1 . TRP A 0 83 . -3.272 1.706 5.068 1.00 73.58 83 A 1 ATOM 671 C CD2 . TRP A 0 83 . -4.478 0.142 6.134 1.00 73.58 83 A 1 ATOM 672 C CE2 . TRP A 0 83 . -4.943 0.181 4.786 1.00 73.58 83 A 1 ATOM 673 C CE3 . TRP A 0 83 . -5.075 -0.800 6.998 1.00 73.58 83 A 1 ATOM 674 N NE1 . TRP A 0 83 . -4.192 1.170 4.187 1.00 73.58 83 A 1 ATOM 675 C CH2 . TRP A 0 83 . -6.519 -1.605 5.197 1.00 73.58 83 A 1 ATOM 676 C CZ2 . TRP A 0 83 . -5.951 -0.672 4.314 1.00 73.58 83 A 1 ATOM 677 C CZ3 . TRP A 0 83 . -6.082 -1.668 6.533 1.00 73.58 83 A 1 ATOM 678 N N . PHE A 0 84 . -2.268 2.174 10.629 1.00 75.26 84 A 1 ATOM 679 C CA . PHE A 0 84 . -2.139 1.822 12.040 1.00 75.26 84 A 1 ATOM 680 C C . PHE A 0 84 . -3.228 2.484 12.887 1.00 75.26 84 A 1 ATOM 681 C CB . PHE A 0 84 . -0.741 2.209 12.539 1.00 75.26 84 A 1 ATOM 682 O O . PHE A 0 84 . -3.944 1.797 13.611 1.00 75.26 84 A 1 ATOM 683 C CG . PHE A 0 84 . -0.480 1.778 13.965 1.00 75.26 84 A 1 ATOM 684 C CD1 . PHE A 0 84 . -0.435 2.700 15.025 1.00 75.26 84 A 1 ATOM 685 C CD2 . PHE A 0 84 . -0.314 0.416 14.233 1.00 75.26 84 A 1 ATOM 686 C CE1 . PHE A 0 84 . -0.193 2.244 16.335 1.00 75.26 84 A 1 ATOM 687 C CE2 . PHE A 0 84 . -0.051 -0.047 15.530 1.00 75.26 84 A 1 ATOM 688 C CZ . PHE A 0 84 . 0.011 0.874 16.586 1.00 75.26 84 A 1 ATOM 689 N N . ILE A 0 85 . -3.414 3.797 12.734 1.00 78.38 85 A 1 ATOM 690 C CA . ILE A 0 85 . -4.429 4.559 13.474 1.00 78.38 85 A 1 ATOM 691 C C . ILE A 0 85 . -5.836 4.036 13.164 1.00 78.38 85 A 1 ATOM 692 C CB . ILE A 0 85 . -4.290 6.067 13.167 1.00 78.38 85 A 1 ATOM 693 O O . ILE A 0 85 . -6.603 3.770 14.087 1.00 78.38 85 A 1 ATOM 694 C CG1 . ILE A 0 85 . -2.951 6.603 13.726 1.00 78.38 85 A 1 ATOM 695 C CG2 . ILE A 0 85 . -5.465 6.863 13.767 1.00 78.38 85 A 1 ATOM 696 C CD1 . ILE A 0 85 . -2.565 7.982 13.176 1.00 78.38 85 A 1 ATOM 697 N N . MET A 0 86 . -6.161 3.825 11.885 1.00 79.16 86 A 1 ATOM 698 C CA . MET A 0 86 . -7.465 3.285 11.484 1.00 79.16 86 A 1 ATOM 699 C C . MET A 0 86 . -7.721 1.894 12.067 1.00 79.16 86 A 1 ATOM 700 C CB . MET A 0 86 . -7.568 3.245 9.952 1.00 79.16 86 A 1 ATOM 701 O O . MET A 0 86 . -8.834 1.600 12.496 1.00 79.16 86 A 1 ATOM 702 C CG . MET A 0 86 . -7.777 4.636 9.345 1.00 79.16 86 A 1 ATOM 703 S SD . MET A 0 86 . -9.292 5.445 9.931 1.00 79.16 86 A 1 ATOM 704 C CE . MET A 0 86 . -9.471 6.765 8.715 1.00 79.16 86 A 1 ATOM 705 N N . THR A 0 87 . -6.684 1.060 12.150 1.00 76.40 87 A 1 ATOM 706 C CA . THR A 0 87 . -6.789 -0.271 12.759 1.00 76.40 87 A 1 ATOM 707 C C . THR A 0 87 . -7.043 -0.170 14.259 1.00 76.40 87 A 1 ATOM 708 C CB . THR A 0 87 . -5.537 -1.114 12.493 1.00 76.40 87 A 1 ATOM 709 O O . THR A 0 87 . -7.940 -0.836 14.761 1.00 76.40 87 A 1 ATOM 710 C CG2 . THR A 0 87 . -5.710 -2.553 12.981 1.00 76.40 87 A 1 ATOM 711 O OG1 . THR A 0 87 . -5.280 -1.175 11.107 1.00 76.40 87 A 1 ATOM 712 N N . VAL A 0 88 . -6.311 0.680 14.985 1.00 80.51 88 A 1 ATOM 713 C CA . VAL A 0 88 . -6.518 0.876 16.432 1.00 80.51 88 A 1 ATOM 714 C C . VAL A 0 88 . -7.930 1.386 16.722 1.00 80.51 88 A 1 ATOM 715 C CB . VAL A 0 88 . -5.458 1.833 17.011 1.00 80.51 88 A 1 ATOM 716 O O . VAL A 0 88 . -8.591 0.875 17.626 1.00 80.51 88 A 1 ATOM 717 C CG1 . VAL A 0 88 . -5.736 2.204 18.474 1.00 80.51 88 A 1 ATOM 718 C CG2 . VAL A 0 88 . -4.066 1.187 16.964 1.00 80.51 88 A 1 ATOM 719 N N . LEU A 0 89 . -8.421 2.341 15.927 1.00 82.41 89 A 1 ATOM 720 C CA . LEU A 0 89 . -9.795 2.832 16.038 1.00 82.41 89 A 1 ATOM 721 C C . LEU A 0 89 . -10.812 1.715 15.782 1.00 82.41 89 A 1 ATOM 722 C CB . LEU A 0 89 . -10.007 3.999 15.058 1.00 82.41 89 A 1 ATOM 723 O O . LEU A 0 89 . -11.757 1.563 16.553 1.00 82.41 89 A 1 ATOM 724 C CG . LEU A 0 89 . -9.280 5.299 15.444 1.00 82.41 89 A 1 ATOM 725 C CD1 . LEU A 0 89 . -9.425 6.313 14.309 1.00 82.41 89 A 1 ATOM 726 C CD2 . LEU A 0 89 . -9.851 5.923 16.720 1.00 82.41 89 A 1 ATOM 727 N N . TRP A 0 90 . -10.596 0.898 14.749 1.00 79.93 90 A 1 ATOM 728 C CA . TRP A 0 90 . -11.463 -0.241 14.450 1.00 79.93 90 A 1 ATOM 729 C C . TRP A 0 90 . -11.476 -1.278 15.578 1.00 79.93 90 A 1 ATOM 730 C CB . TRP A 0 90 . -11.030 -0.880 13.129 1.00 79.93 90 A 1 ATOM 731 O O . TRP A 0 90 . -12.543 -1.718 15.996 1.00 79.93 90 A 1 ATOM 732 C CG . TRP A 0 90 . -11.954 -1.961 12.680 1.00 79.93 90 A 1 ATOM 733 C CD1 . TRP A 0 90 . -11.750 -3.291 12.811 1.00 79.93 90 A 1 ATOM 734 C CD2 . TRP A 0 90 . -13.288 -1.811 12.113 1.00 79.93 90 A 1 ATOM 735 C CE2 . TRP A 0 90 . -13.837 -3.110 11.906 1.00 79.93 90 A 1 ATOM 736 C CE3 . TRP A 0 90 . -14.097 -0.703 11.777 1.00 79.93 90 A 1 ATOM 737 N NE1 . TRP A 0 90 . -12.855 -3.974 12.344 1.00 79.93 90 A 1 ATOM 738 C CH2 . TRP A 0 90 . -15.900 -2.183 11.049 1.00 79.93 90 A 1 ATOM 739 C CZ2 . TRP A 0 90 . -15.122 -3.305 11.381 1.00 79.93 90 A 1 ATOM 740 C CZ3 . TRP A 0 90 . -15.389 -0.887 11.249 1.00 79.93 90 A 1 ATOM 741 N N . MET A 0 91 . -10.307 -1.618 16.128 1.00 79.23 91 A 1 ATOM 742 C CA . MET A 0 91 . -10.188 -2.525 17.275 1.00 79.23 91 A 1 ATOM 743 C C . MET A 0 91 . -10.964 -1.998 18.482 1.00 79.23 91 A 1 ATOM 744 C CB . MET A 0 91 . -8.712 -2.714 17.661 1.00 79.23 91 A 1 ATOM 745 O O . MET A 0 91 . -11.667 -2.760 19.138 1.00 79.23 91 A 1 ATOM 746 C CG . MET A 0 91 . -7.918 -3.486 16.604 1.00 79.23 91 A 1 ATOM 747 S SD . MET A 0 91 . -8.435 -5.194 16.362 1.00 79.23 91 A 1 ATOM 748 C CE . MET A 0 91 . -7.603 -5.984 17.763 1.00 79.23 91 A 1 ATOM 749 N N . LEU A 0 92 . -10.886 -0.694 18.748 1.00 79.91 92 A 1 ATOM 750 C CA . LEU A 0 92 . -11.587 -0.062 19.862 1.00 79.91 92 A 1 ATOM 751 C C . LEU A 0 92 . -13.114 -0.113 19.687 1.00 79.91 92 A 1 ATOM 752 C CB . LEU A 0 92 . -11.021 1.359 20.015 1.00 79.91 92 A 1 ATOM 753 O O . LEU A 0 92 . -13.825 -0.414 20.646 1.00 79.91 92 A 1 ATOM 754 C CG . LEU A 0 92 . -11.410 2.035 21.342 1.00 79.91 92 A 1 ATOM 755 C CD1 . LEU A 0 92 . -10.221 2.825 21.891 1.00 79.91 92 A 1 ATOM 756 C CD2 . LEU A 0 92 . -12.583 3.001 21.164 1.00 79.91 92 A 1 ATOM 757 N N . VAL A 0 93 . -13.610 0.102 18.463 1.00 79.80 93 A 1 ATOM 758 C CA . VAL A 0 93 . -15.035 -0.052 18.119 1.00 79.80 93 A 1 ATOM 759 C C . VAL A 0 93 . -15.482 -1.510 18.235 1.00 79.80 93 A 1 ATOM 760 C CB . VAL A 0 93 . -15.321 0.494 16.705 1.00 79.80 93 A 1 ATOM 761 O O . VAL A 0 93 . -16.540 -1.791 18.791 1.00 79.80 93 A 1 ATOM 762 C CG1 . VAL A 0 93 . -16.762 0.222 16.249 1.00 79.80 93 A 1 ATOM 763 C CG2 . VAL A 0 93 . -15.116 2.014 16.656 1.00 79.80 93 A 1 ATOM 764 N N . CYS A 0 94 . -14.682 -2.466 17.763 1.00 78.30 94 A 1 ATOM 765 C CA . CYS A 0 94 . -15.001 -3.880 17.932 1.00 78.30 94 A 1 ATOM 766 C C . CYS A 0 94 . -15.067 -4.253 19.418 1.00 78.30 94 A 1 ATOM 767 C CB . CYS A 0 94 . -13.983 -4.733 17.167 1.00 78.30 94 A 1 ATOM 768 O O . CYS A 0 94 . -16.045 -4.865 19.835 1.00 78.30 94 A 1 ATOM 769 S SG . CYS A 0 94 . -14.316 -4.666 15.385 1.00 78.30 94 A 1 ATOM 770 N N . CYS A 0 95 . -14.090 -3.838 20.231 1.00 74.44 95 A 1 ATOM 771 C CA . CYS A 0 95 . -14.079 -4.093 21.673 1.00 74.44 95 A 1 ATOM 772 C C . CYS A 0 95 . -15.328 -3.550 22.381 1.00 74.44 95 A 1 ATOM 773 C CB . CYS A 0 95 . -12.821 -3.471 22.292 1.00 74.44 95 A 1 ATOM 774 O O . CYS A 0 95 . -15.899 -4.258 23.211 1.00 74.44 95 A 1 ATOM 775 S SG . CYS A 0 95 . -11.349 -4.446 21.873 1.00 74.44 95 A 1 ATOM 776 N N . SER A 0 96 . -15.780 -2.334 22.053 1.00 75.58 96 A 1 ATOM 777 C CA . SER A 0 96 . -16.990 -1.770 22.665 1.00 75.58 96 A 1 ATOM 778 C C . SER A 0 96 . -18.247 -2.550 22.274 1.00 75.58 96 A 1 ATOM 779 C CB . SER A 0 96 . -17.129 -0.280 22.343 1.00 75.58 96 A 1 ATOM 780 O O . SER A 0 96 . -19.070 -2.847 23.139 1.00 75.58 96 A 1 ATOM 781 O OG . SER A 0 96 . -17.263 -0.051 20.958 1.00 75.58 96 A 1 ATOM 782 N N . VAL A 0 97 . -18.362 -2.976 21.012 1.00 76.21 97 A 1 ATOM 783 C CA . VAL A 0 97 . -19.460 -3.846 20.555 1.00 76.21 97 A 1 ATOM 784 C C . VAL A 0 97 . -19.421 -5.211 21.253 1.00 76.21 97 A 1 ATOM 785 C CB . VAL A 0 97 . -19.433 -3.993 19.020 1.00 76.21 97 A 1 ATOM 786 O O . VAL A 0 97 . -20.465 -5.727 21.644 1.00 76.21 97 A 1 ATOM 787 C CG1 . VAL A 0 97 . -20.475 -4.996 18.505 1.00 76.21 97 A 1 ATOM 788 C CG2 . VAL A 0 97 . -19.732 -2.650 18.339 1.00 76.21 97 A 1 ATOM 789 N N . GLY A 0 98 . -18.237 -5.793 21.462 1.00 72.23 98 A 1 ATOM 790 C CA . GLY A 0 98 . -18.097 -7.098 22.124 1.00 72.23 98 A 1 ATOM 791 C C . GLY A 0 98 . -18.416 -7.072 23.601 1.00 72.23 98 A 1 ATOM 792 O O . GLY A 0 98 . -19.017 -8.020 24.097 1.00 72.23 98 A 1 ATOM 793 N N . PHE A 0 99 . -18.063 -5.978 24.277 1.00 71.15 99 A 1 ATOM 794 C CA . PHE A 0 99 . -18.456 -5.754 25.662 1.00 71.15 99 A 1 ATOM 795 C C . PHE A 0 99 . -19.981 -5.688 25.804 1.00 71.15 99 A 1 ATOM 796 C CB . PHE A 0 99 . -17.792 -4.469 26.166 1.00 71.15 99 A 1 ATOM 797 O O . PHE A 0 99 . -20.533 -6.279 26.722 1.00 71.15 99 A 1 ATOM 798 C CG . PHE A 0 99 . -18.042 -4.226 27.639 1.00 71.15 99 A 1 ATOM 799 C CD1 . PHE A 0 99 . -19.086 -3.377 28.055 1.00 71.15 99 A 1 ATOM 800 C CD2 . PHE A 0 99 . -17.261 -4.898 28.597 1.00 71.15 99 A 1 ATOM 801 C CE1 . PHE A 0 99 . -19.343 -3.200 29.426 1.00 71.15 99 A 1 ATOM 802 C CE2 . PHE A 0 99 . -17.519 -4.719 29.967 1.00 71.15 99 A 1 ATOM 803 C CZ . PHE A 0 99 . -18.560 -3.871 30.381 1.00 71.15 99 A 1 ATOM 804 N N . ILE A 0 100 . -20.668 -5.026 24.867 1.00 73.43 100 A 1 ATOM 805 C CA . ILE A 0 100 . -22.136 -4.935 24.877 1.00 73.43 100 A 1 ATOM 806 C C . ILE A 0 100 . -22.786 -6.286 24.544 1.00 73.43 100 A 1 ATOM 807 C CB . ILE A 0 100 . -22.601 -3.817 23.914 1.00 73.43 100 A 1 ATOM 808 O O . ILE A 0 100 . -23.817 -6.627 25.112 1.00 73.43 100 A 1 ATOM 809 C CG1 . ILE A 0 100 . -22.111 -2.435 24.411 1.00 73.43 100 A 1 ATOM 810 C CG2 . ILE A 0 100 . -24.137 -3.795 23.774 1.00 73.43 100 A 1 ATOM 811 C CD1 . ILE A 0 100 . -22.233 -1.323 23.361 1.00 73.43 100 A 1 ATOM 812 N N . ALA A 0 101 . -22.211 -7.046 23.612 1.00 73.95 101 A 1 ATOM 813 C CA . ALA A 0 101 . -22.829 -8.260 23.086 1.00 73.95 101 A 1 ATOM 814 C C . ALA A 0 101 . -22.458 -9.557 23.837 1.00 73.95 101 A 1 ATOM 815 C CB . ALA A 0 101 . -22.499 -8.330 21.587 1.00 73.95 101 A 1 ATOM 816 O O . ALA A 0 101 . -22.936 -10.611 23.426 1.00 73.95 101 A 1 ATOM 817 N N . GLU A 0 102 . -21.566 -9.512 24.841 1.00 73.46 102 A 1 ATOM 818 C CA . GLU A 0 102 . -20.962 -10.689 25.512 1.00 73.46 102 A 1 ATOM 819 C C . GLU A 0 102 . -20.525 -11.799 24.528 1.00 73.46 102 A 1 ATOM 820 C CB . GLU A 0 102 . -21.850 -11.231 26.650 1.00 73.46 102 A 1 ATOM 821 O O . GLU A 0 102 . -20.555 -12.994 24.823 1.00 73.46 102 A 1 ATOM 822 C CG . GLU A 0 102 . -21.923 -10.301 27.869 1.00 73.46 102 A 1 ATOM 823 C CD . GLU A 0 102 . -22.575 -10.991 29.083 1.00 73.46 102 A 1 ATOM 824 O OE1 . GLU A 0 102 . -22.210 -10.617 30.222 1.00 73.46 102 A 1 ATOM 825 O OE2 . GLU A 0 102 . -23.421 -11.892 28.878 1.00 73.46 102 A 1 ATOM 826 N N . SER A 0 103 . -20.145 -11.421 23.304 1.00 71.80 103 A 1 ATOM 827 C CA . SER A 0 103 . -20.061 -12.369 22.194 1.00 71.80 103 A 1 ATOM 828 C C . SER A 0 103 . -18.617 -12.709 21.833 1.00 71.80 103 A 1 ATOM 829 C CB . SER A 0 103 . -20.905 -11.925 20.993 1.00 71.80 103 A 1 ATOM 830 O O . SER A 0 103 . -17.817 -11.857 21.438 1.00 71.80 103 A 1 ATOM 831 O OG . SER A 0 103 . -20.400 -10.759 20.377 1.00 71.80 103 A 1 ATOM 832 N N . TYR A 0 104 . -18.303 -14.006 21.871 1.00 70.13 104 A 1 ATOM 833 C CA . TYR A 0 104 . -17.054 -14.592 21.359 1.00 70.13 104 A 1 ATOM 834 C C . TYR A 0 104 . -16.741 -14.186 19.908 1.00 70.13 104 A 1 ATOM 835 C CB . TYR A 0 104 . -17.176 -16.121 21.440 1.00 70.13 104 A 1 ATOM 836 O O . TYR A 0 104 . -15.583 -14.170 19.490 1.00 70.13 104 A 1 ATOM 837 C CG . TYR A 0 104 . -17.282 -16.657 22.852 1.00 70.13 104 A 1 ATOM 838 C CD1 . TYR A 0 104 . -16.108 -16.839 23.606 1.00 70.13 104 A 1 ATOM 839 C CD2 . TYR A 0 104 . -18.539 -16.963 23.413 1.00 70.13 104 A 1 ATOM 840 C CE1 . TYR A 0 104 . -16.183 -17.336 24.920 1.00 70.13 104 A 1 ATOM 841 C CE2 . TYR A 0 104 . -18.616 -17.452 24.731 1.00 70.13 104 A 1 ATOM 842 O OH . TYR A 0 104 . -17.522 -18.138 26.745 1.00 70.13 104 A 1 ATOM 843 C CZ . TYR A 0 104 . -17.441 -17.647 25.483 1.00 70.13 104 A 1 ATOM 844 N N . PHE A 0 105 . -17.766 -13.804 19.141 1.00 72.18 105 A 1 ATOM 845 C CA . PHE A 0 105 . -17.634 -13.315 17.772 1.00 72.18 105 A 1 ATOM 846 C C . PHE A 0 105 . -16.737 -12.073 17.667 1.00 72.18 105 A 1 ATOM 847 C CB . PHE A 0 105 . -19.038 -13.016 17.238 1.00 72.18 105 A 1 ATOM 848 O O . PHE A 0 105 . -15.969 -11.930 16.710 1.00 72.18 105 A 1 ATOM 849 C CG . PHE A 0 105 . -19.049 -12.780 15.745 1.00 72.18 105 A 1 ATOM 850 C CD1 . PHE A 0 105 . -19.063 -11.472 15.226 1.00 72.18 105 A 1 ATOM 851 C CD2 . PHE A 0 105 . -19.003 -13.883 14.872 1.00 72.18 105 A 1 ATOM 852 C CE1 . PHE A 0 105 . -19.035 -11.271 13.835 1.00 72.18 105 A 1 ATOM 853 C CE2 . PHE A 0 105 . -18.978 -13.680 13.482 1.00 72.18 105 A 1 ATOM 854 C CZ . PHE A 0 105 . -18.994 -12.374 12.964 1.00 72.18 105 A 1 ATOM 855 N N . VAL A 0 106 . -16.767 -11.195 18.674 1.00 72.86 106 A 1 ATOM 856 C CA . VAL A 0 106 . -15.902 -10.012 18.686 1.00 72.86 106 A 1 ATOM 857 C C . VAL A 0 106 . -14.448 -10.386 18.922 1.00 72.86 106 A 1 ATOM 858 C CB . VAL A 0 106 . -16.404 -8.969 19.689 1.00 72.86 106 A 1 ATOM 859 O O . VAL A 0 106 . -13.584 -9.887 18.206 1.00 72.86 106 A 1 ATOM 860 C CG1 . VAL A 0 106 . -15.384 -7.836 19.835 1.00 72.86 106 A 1 ATOM 861 C CG2 . VAL A 0 106 . -17.742 -8.437 19.153 1.00 72.86 106 A 1 ATOM 862 N N . GLN A 0 107 . -14.164 -11.301 19.850 1.00 72.74 107 A 1 ATOM 863 C CA . GLN A 0 107 . -12.796 -11.785 20.068 1.00 72.74 107 A 1 ATOM 864 C C . GLN A 0 107 . -12.215 -12.411 18.795 1.00 72.74 107 A 1 ATOM 865 C CB . GLN A 0 107 . -12.768 -12.809 21.207 1.00 72.74 107 A 1 ATOM 866 O O . GLN A 0 107 . -11.070 -12.134 18.438 1.00 72.74 107 A 1 ATOM 867 C CG . GLN A 0 107 . -13.012 -12.176 22.583 1.00 72.74 107 A 1 ATOM 868 C CD . GLN A 0 107 . -12.959 -13.209 23.705 1.00 72.74 107 A 1 ATOM 869 N NE2 . GLN A 0 107 . -12.919 -12.782 24.947 1.00 72.74 107 A 1 ATOM 870 O OE1 . GLN A 0 107 . -12.963 -14.410 23.499 1.00 72.74 107 A 1 ATOM 871 N N . LEU A 0 108 . -13.019 -13.192 18.069 1.00 74.96 108 A 1 ATOM 872 C CA . LEU A 0 108 . -12.612 -13.782 16.796 1.00 74.96 108 A 1 ATOM 873 C C . LEU A 0 108 . -12.317 -12.707 15.735 1.00 74.96 108 A 1 ATOM 874 C CB . LEU A 0 108 . -13.721 -14.747 16.348 1.00 74.96 108 A 1 ATOM 875 O O . LEU A 0 108 . -11.303 -12.778 15.042 1.00 74.96 108 A 1 ATOM 876 C CG . LEU A 0 108 . -13.321 -15.598 15.136 1.00 74.96 108 A 1 ATOM 877 C CD1 . LEU A 0 108 . -12.255 -16.639 15.492 1.00 74.96 108 A 1 ATOM 878 C CD2 . LEU A 0 108 . -14.546 -16.322 14.578 1.00 74.96 108 A 1 ATOM 879 N N . THR A 0 109 . -13.168 -11.684 15.639 1.00 76.71 109 A 1 ATOM 880 C CA . THR A 0 109 . -12.978 -10.569 14.697 1.00 76.71 109 A 1 ATOM 881 C C . THR A 0 109 . -11.701 -9.783 15.008 1.00 76.71 109 A 1 ATOM 882 C CB . THR A 0 109 . -14.195 -9.633 14.703 1.00 76.71 109 A 1 ATOM 883 O O . THR A 0 109 . -10.935 -9.487 14.092 1.00 76.71 109 A 1 ATOM 884 C CG2 . THR A 0 109 . -14.091 -8.543 13.635 1.00 76.71 109 A 1 ATOM 885 O OG1 . THR A 0 109 . -15.370 -10.359 14.417 1.00 76.71 109 A 1 ATOM 886 N N . LEU A 0 110 . -11.437 -9.509 16.292 1.00 76.28 110 A 1 ATOM 887 C CA . LEU A 0 110 . -10.209 -8.862 16.772 1.00 76.28 110 A 1 ATOM 888 C C . LEU A 0 110 . -8.954 -9.699 16.466 1.00 76.28 110 A 1 ATOM 889 C CB . LEU A 0 110 . -10.323 -8.637 18.292 1.00 76.28 110 A 1 ATOM 890 O O . LEU A 0 110 . -7.901 -9.152 16.140 1.00 76.28 110 A 1 ATOM 891 C CG . LEU A 0 110 . -11.349 -7.582 18.745 1.00 76.28 110 A 1 ATOM 892 C CD1 . LEU A 0 110 . -11.490 -7.641 20.264 1.00 76.28 110 A 1 ATOM 893 C CD2 . LEU A 0 110 . -10.969 -6.153 18.383 1.00 76.28 110 A 1 ATOM 894 N N . PHE A 0 111 . -9.052 -11.027 16.558 1.00 78.60 111 A 1 ATOM 895 C CA . PHE A 0 111 . -7.950 -11.920 16.207 1.00 78.60 111 A 1 ATOM 896 C C . PHE A 0 111 . -7.631 -11.856 14.708 1.00 78.60 111 A 1 ATOM 897 C CB . PHE A 0 111 . -8.282 -13.347 16.659 1.00 78.60 111 A 1 ATOM 898 O O . PHE A 0 111 . -6.478 -11.649 14.327 1.00 78.60 111 A 1 ATOM 899 C CG . PHE A 0 111 . -7.178 -14.336 16.355 1.00 78.60 111 A 1 ATOM 900 C CD1 . PHE A 0 111 . -7.259 -15.166 15.220 1.00 78.60 111 A 1 ATOM 901 C CD2 . PHE A 0 111 . -6.051 -14.403 17.194 1.00 78.60 111 A 1 ATOM 902 C CE1 . PHE A 0 111 . -6.216 -16.064 14.932 1.00 78.60 111 A 1 ATOM 903 C CE2 . PHE A 0 111 . -5.009 -15.301 16.905 1.00 78.60 111 A 1 ATOM 904 C CZ . PHE A 0 111 . -5.092 -16.133 15.774 1.00 78.60 111 A 1 ATOM 905 N N . PHE A 0 112 . -8.645 -11.965 13.844 1.00 78.79 112 A 1 ATOM 906 C CA . PHE A 0 112 . -8.438 -11.890 12.396 1.00 78.79 112 A 1 ATOM 907 C C . PHE A 0 112 . -7.919 -10.523 11.944 1.00 78.79 112 A 1 ATOM 908 C CB . PHE A 0 112 . -9.729 -12.252 11.652 1.00 78.79 112 A 1 ATOM 909 O O . PHE A 0 112 . -7.009 -10.467 11.113 1.00 78.79 112 A 1 ATOM 910 C CG . PHE A 0 112 . -10.013 -13.740 11.610 1.00 78.79 112 A 1 ATOM 911 C CD1 . PHE A 0 112 . -9.131 -14.601 10.929 1.00 78.79 112 A 1 ATOM 912 C CD2 . PHE A 0 112 . -11.171 -14.265 12.209 1.00 78.79 112 A 1 ATOM 913 C CE1 . PHE A 0 112 . -9.390 -15.982 10.872 1.00 78.79 112 A 1 ATOM 914 C CE2 . PHE A 0 112 . -11.436 -15.644 12.135 1.00 78.79 112 A 1 ATOM 915 C CZ . PHE A 0 112 . -10.542 -16.505 11.481 1.00 78.79 112 A 1 ATOM 916 N N . SER A 0 113 . -8.431 -9.422 12.500 1.00 80.01 113 A 1 ATOM 917 C CA . SER A 0 113 . -7.923 -8.083 12.180 1.00 80.01 113 A 1 ATOM 918 C C . SER A 0 113 . -6.467 -7.904 12.619 1.00 80.01 113 A 1 ATOM 919 C CB . SER A 0 113 . -8.799 -6.999 12.808 1.00 80.01 113 A 1 ATOM 920 O O . SER A 0 113 . -5.679 -7.350 11.853 1.00 80.01 113 A 1 ATOM 921 O OG . SER A 0 113 . -8.841 -7.198 14.197 1.00 80.01 113 A 1 ATOM 922 N N . ALA A 0 114 . -6.075 -8.420 13.789 1.00 80.58 114 A 1 ATOM 923 C CA . ALA A 0 114 . -4.686 -8.391 14.246 1.00 80.58 114 A 1 ATOM 924 C C . ALA A 0 114 . -3.754 -9.195 13.322 1.00 80.58 114 A 1 ATOM 925 C CB . ALA A 0 114 . -4.627 -8.903 15.689 1.00 80.58 114 A 1 ATOM 926 O O . ALA A 0 114 . -2.673 -8.716 12.976 1.00 80.58 114 A 1 ATOM 927 N N . VAL A 0 115 . -4.178 -10.377 12.860 1.00 81.18 115 A 1 ATOM 928 C CA . VAL A 0 115 . -3.402 -11.192 11.907 1.00 81.18 115 A 1 ATOM 929 C C . VAL A 0 115 . -3.234 -10.472 10.568 1.00 81.18 115 A 1 ATOM 930 C CB . VAL A 0 115 . -4.049 -12.578 11.712 1.00 81.18 115 A 1 ATOM 931 O O . VAL A 0 115 . -2.115 -10.376 10.061 1.00 81.18 115 A 1 ATOM 932 C CG1 . VAL A 0 115 . -3.384 -13.383 10.586 1.00 81.18 115 A 1 ATOM 933 C CG2 . VAL A 0 115 . -3.933 -13.416 12.992 1.00 81.18 115 A 1 ATOM 934 N N . ILE A 0 116 . -4.318 -9.920 10.011 1.00 79.68 116 A 1 ATOM 935 C CA . ILE A 0 116 . -4.267 -9.145 8.760 1.00 79.68 116 A 1 ATOM 936 C C . ILE A 0 116 . -3.356 -7.924 8.933 1.00 79.68 116 A 1 ATOM 937 C CB . ILE A 0 116 . -5.691 -8.737 8.315 1.00 79.68 116 A 1 ATOM 938 O O . ILE A 0 116 . -2.562 -7.613 8.044 1.00 79.68 116 A 1 ATOM 939 C CG1 . ILE A 0 116 . -6.505 -9.989 7.909 1.00 79.68 116 A 1 ATOM 940 C CG2 . ILE A 0 116 . -5.643 -7.747 7.132 1.00 79.68 116 A 1 ATOM 941 C CD1 . ILE A 0 116 . -8.009 -9.726 7.762 1.00 79.68 116 A 1 ATOM 942 N N . PHE A 0 117 . -3.424 -7.259 10.086 1.00 77.54 117 A 1 ATOM 943 C CA . PHE A 0 117 . -2.580 -6.114 10.395 1.00 77.54 117 A 1 ATOM 944 C C . PHE A 0 117 . -1.094 -6.487 10.443 1.00 77.54 117 A 1 ATOM 945 C CB . PHE A 0 117 . -3.039 -5.471 11.709 1.00 77.54 117 A 1 ATOM 946 O O . PHE A 0 117 . -0.290 -5.854 9.760 1.00 77.54 117 A 1 ATOM 947 C CG . PHE A 0 117 . -2.112 -4.351 12.111 1.00 77.54 117 A 1 ATOM 948 C CD1 . PHE A 0 117 . -1.055 -4.607 13.004 1.00 77.54 117 A 1 ATOM 949 C CD2 . PHE A 0 117 . -2.205 -3.109 11.458 1.00 77.54 117 A 1 ATOM 950 C CE1 . PHE A 0 117 . -0.044 -3.653 13.183 1.00 77.54 117 A 1 ATOM 951 C CE2 . PHE A 0 117 . -1.192 -2.154 11.636 1.00 77.54 117 A 1 ATOM 952 C CZ . PHE A 0 117 . -0.089 -2.454 12.458 1.00 77.54 117 A 1 ATOM 953 N N . ILE A 0 118 . -0.724 -7.528 11.197 1.00 79.59 118 A 1 ATOM 954 C CA . ILE A 0 118 . 0.665 -8.002 11.281 1.00 79.59 118 A 1 ATOM 955 C C . ILE A 0 118 . 1.167 -8.403 9.893 1.00 79.59 118 A 1 ATOM 956 C CB . ILE A 0 118 . 0.786 -9.166 12.292 1.00 79.59 118 A 1 ATOM 957 O O . ILE A 0 118 . 2.280 -8.036 9.517 1.00 79.59 118 A 1 ATOM 958 C CG1 . ILE A 0 118 . 0.557 -8.647 13.730 1.00 79.59 118 A 1 ATOM 959 C CG2 . ILE A 0 118 . 2.167 -9.845 12.198 1.00 79.59 118 A 1 ATOM 960 C CD1 . ILE A 0 118 . 0.356 -9.764 14.763 1.00 79.59 118 A 1 ATOM 961 N N . TYR A 0 119 . 0.340 -9.089 9.100 1.00 78.15 119 A 1 ATOM 962 C CA . TYR A 0 119 . 0.677 -9.456 7.727 1.00 78.15 119 A 1 ATOM 963 C C . TYR A 0 119 . 0.957 -8.226 6.851 1.00 78.15 119 A 1 ATOM 964 C CB . TYR A 0 119 . -0.460 -10.301 7.142 1.00 78.15 119 A 1 ATOM 965 O O . TYR A 0 119 . 1.985 -8.165 6.173 1.00 78.15 119 A 1 ATOM 966 C CG . TYR A 0 119 . -0.231 -10.668 5.693 1.00 78.15 119 A 1 ATOM 967 C CD1 . TYR A 0 119 . -0.818 -9.903 4.666 1.00 78.15 119 A 1 ATOM 968 C CD2 . TYR A 0 119 . 0.611 -11.750 5.376 1.00 78.15 119 A 1 ATOM 969 C CE1 . TYR A 0 119 . -0.560 -10.220 3.320 1.00 78.15 119 A 1 ATOM 970 C CE2 . TYR A 0 119 . 0.868 -12.074 4.031 1.00 78.15 119 A 1 ATOM 971 O OH . TYR A 0 119 . 0.535 -11.606 1.701 1.00 78.15 119 A 1 ATOM 972 C CZ . TYR A 0 119 . 0.283 -11.306 3.002 1.00 78.15 119 A 1 ATOM 973 N N . MET A 0 120 . 0.080 -7.221 6.889 1.00 74.60 120 A 1 ATOM 974 C CA . MET A 0 120 . 0.256 -5.976 6.136 1.00 74.60 120 A 1 ATOM 975 C C . MET A 0 120 . 1.473 -5.181 6.615 1.00 74.60 120 A 1 ATOM 976 C CB . MET A 0 120 . -1.017 -5.122 6.244 1.00 74.60 120 A 1 ATOM 977 O O . MET A 0 120 . 2.214 -4.641 5.794 1.00 74.60 120 A 1 ATOM 978 C CG . MET A 0 120 . -2.173 -5.705 5.420 1.00 74.60 120 A 1 ATOM 979 S SD . MET A 0 120 . -1.930 -5.706 3.618 1.00 74.60 120 A 1 ATOM 980 C CE . MET A 0 120 . -2.077 -3.930 3.285 1.00 74.60 120 A 1 ATOM 981 N N . HIS A 0 121 . 1.711 -5.135 7.927 1.00 74.38 121 A 1 ATOM 982 C CA . HIS A 0 121 . 2.871 -4.471 8.508 1.00 74.38 121 A 1 ATOM 983 C C . HIS A 0 121 . 4.168 -5.145 8.060 1.00 74.38 121 A 1 ATOM 984 C CB . HIS A 0 121 . 2.751 -4.430 10.035 1.00 74.38 121 A 1 ATOM 985 O O . HIS A 0 121 . 5.018 -4.473 7.488 1.00 74.38 121 A 1 ATOM 986 C CG . HIS A 0 121 . 3.813 -3.561 10.656 1.00 74.38 121 A 1 ATOM 987 C CD2 . HIS A 0 121 . 4.866 -3.962 11.434 1.00 74.38 121 A 1 ATOM 988 N ND1 . HIS A 0 121 . 3.918 -2.197 10.508 1.00 74.38 121 A 1 ATOM 989 C CE1 . HIS A 0 121 . 5.005 -1.786 11.180 1.00 74.38 121 A 1 ATOM 990 N NE2 . HIS A 0 121 . 5.607 -2.825 11.772 1.00 74.38 121 A 1 ATOM 991 N N . LEU A 0 122 . 4.275 -6.470 8.202 1.00 70.89 122 A 1 ATOM 992 C CA . LEU A 0 122 . 5.428 -7.244 7.735 1.00 70.89 122 A 1 ATOM 993 C C . LEU A 0 122 . 5.660 -7.064 6.239 1.00 70.89 122 A 1 ATOM 994 C CB . LEU A 0 122 . 5.211 -8.736 8.035 1.00 70.89 122 A 1 ATOM 995 O O . LEU A 0 122 . 6.791 -6.823 5.826 1.00 70.89 122 A 1 ATOM 996 C CG . LEU A 0 122 . 5.443 -9.122 9.503 1.00 70.89 122 A 1 ATOM 997 C CD1 . LEU A 0 122 . 4.933 -10.544 9.730 1.00 70.89 122 A 1 ATOM 998 C CD2 . LEU A 0 122 . 6.930 -9.086 9.867 1.00 70.89 122 A 1 ATOM 999 N N . ARG A 0 123 . 4.604 -7.132 5.420 1.00 70.52 123 A 1 ATOM 1000 C CA . ARG A 0 123 . 4.718 -6.907 3.976 1.00 70.52 123 A 1 ATOM 1001 C C . ARG A 0 123 . 5.315 -5.533 3.682 1.00 70.52 123 A 1 ATOM 1002 C CB . ARG A 0 123 . 3.341 -7.095 3.327 1.00 70.52 123 A 1 ATOM 1003 O O . ARG A 0 123 . 6.221 -5.431 2.861 1.00 70.52 123 A 1 ATOM 1004 C CG . ARG A 0 123 . 3.440 -7.066 1.799 1.00 70.52 123 A 1 ATOM 1005 C CD . ARG A 0 123 . 2.058 -7.277 1.180 1.00 70.52 123 A 1 ATOM 1006 N NE . ARG A 0 123 . 2.142 -7.302 -0.293 1.00 70.52 123 A 1 ATOM 1007 N NH1 . ARG A 0 123 . -0.051 -6.791 -0.726 1.00 70.52 123 A 1 ATOM 1008 N NH2 . ARG A 0 123 . 1.361 -7.129 -2.423 1.00 70.52 123 A 1 ATOM 1009 C CZ . ARG A 0 123 . 1.154 -7.075 -1.136 1.00 70.52 123 A 1 ATOM 1010 N N . ASN A 0 124 . 4.858 -4.501 4.385 1.00 65.21 124 A 1 ATOM 1011 C CA . ASN A 0 124 . 5.359 -3.145 4.204 1.00 65.21 124 A 1 ATOM 1012 C C . ASN A 0 124 . 6.794 -2.976 4.735 1.00 65.21 124 A 1 ATOM 1013 C CB . ASN A 0 124 . 4.380 -2.162 4.850 1.00 65.21 124 A 1 ATOM 1014 O O . ASN A 0 124 . 7.628 -2.405 4.036 1.00 65.21 124 A 1 ATOM 1015 C CG . ASN A 0 124 . 3.037 -2.088 4.142 1.00 65.21 124 A 1 ATOM 1016 N ND2 . ASN A 0 124 . 2.039 -1.535 4.793 1.00 65.21 124 A 1 ATOM 1017 O OD1 . ASN A 0 124 . 2.850 -2.486 3.004 1.00 65.21 124 A 1 ATOM 1018 N N . THR A 0 125 . 7.132 -3.524 5.904 1.00 64.68 125 A 1 ATOM 1019 C CA . THR A 0 125 . 8.495 -3.471 6.460 1.00 64.68 125 A 1 ATOM 1020 C C . THR A 0 125 . 9.488 -4.234 5.592 1.00 64.68 125 A 1 ATOM 1021 C CB . THR A 0 125 . 8.549 -4.063 7.875 1.00 64.68 125 A 1 ATOM 1022 O O . THR A 0 125 . 10.590 -3.748 5.363 1.00 64.68 125 A 1 ATOM 1023 C CG2 . THR A 0 125 . 9.884 -3.797 8.570 1.00 64.68 125 A 1 ATOM 1024 O OG1 . THR A 0 125 . 7.556 -3.496 8.689 1.00 64.68 125 A 1 ATOM 1025 N N . VAL A 0 126 . 9.110 -5.398 5.058 1.00 60.18 126 A 1 ATOM 1026 C CA . VAL A 0 126 . 9.938 -6.142 4.099 1.00 60.18 126 A 1 ATOM 1027 C C . VAL A 0 126 . 10.143 -5.316 2.836 1.00 60.18 126 A 1 ATOM 1028 C CB . VAL A 0 126 . 9.327 -7.519 3.777 1.00 60.18 126 A 1 ATOM 1029 O O . VAL A 0 126 . 11.262 -5.269 2.330 1.00 60.18 126 A 1 ATOM 1030 C CG1 . VAL A 0 126 . 10.033 -8.224 2.610 1.00 60.18 126 A 1 ATOM 1031 C CG2 . VAL A 0 126 . 9.437 -8.449 4.993 1.00 60.18 126 A 1 ATOM 1032 N N . THR A 0 127 . 9.116 -4.607 2.351 1.00 56.49 127 A 1 ATOM 1033 C CA . THR A 0 127 . 9.315 -3.699 1.217 1.00 56.49 127 A 1 ATOM 1034 C C . THR A 0 127 . 10.260 -2.550 1.567 1.00 56.49 127 A 1 ATOM 1035 C CB . THR A 0 127 . 8.015 -3.187 0.579 1.00 56.49 127 A 1 ATOM 1036 O O . THR A 0 127 . 11.216 -2.347 0.831 1.00 56.49 127 A 1 ATOM 1037 C CG2 . THR A 0 127 . 7.222 -4.307 -0.097 1.00 56.49 127 A 1 ATOM 1038 O OG1 . THR A 0 127 . 7.140 -2.522 1.450 1.00 56.49 127 A 1 ATOM 1039 N N . GLU A 0 128 . 10.075 -1.851 2.693 1.00 52.54 128 A 1 ATOM 1040 C CA . GLU A 0 128 . 10.961 -0.761 3.141 1.00 52.54 128 A 1 ATOM 1041 C C . GLU A 0 128 . 12.404 -1.239 3.396 1.00 52.54 128 A 1 ATOM 1042 C CB . GLU A 0 128 . 10.399 -0.119 4.425 1.00 52.54 128 A 1 ATOM 1043 O O . GLU A 0 128 . 13.363 -0.538 3.072 1.00 52.54 128 A 1 ATOM 1044 C CG . GLU A 0 128 . 9.135 0.735 4.197 1.00 52.54 128 A 1 ATOM 1045 C CD . GLU A 0 128 . 8.582 1.381 5.486 1.00 52.54 128 A 1 ATOM 1046 O OE1 . GLU A 0 128 . 7.559 2.103 5.385 1.00 52.54 128 A 1 ATOM 1047 O OE2 . GLU A 0 128 . 9.175 1.172 6.569 1.00 52.54 128 A 1 ATOM 1048 N N . GLY A 0 129 . 12.574 -2.446 3.937 1.00 47.32 129 A 1 ATOM 1049 C CA . GLY A 0 129 . 13.873 -3.075 4.169 1.00 47.32 129 A 1 ATOM 1050 C C . GLY A 0 129 . 14.570 -3.486 2.873 1.00 47.32 129 A 1 ATOM 1051 O O . GLY A 0 129 . 15.770 -3.257 2.735 1.00 47.32 129 A 1 ATOM 1052 N N . ALA A 0 130 . 13.826 -4.014 1.897 1.00 48.95 130 A 1 ATOM 1053 C CA . ALA A 0 130 . 14.356 -4.301 0.566 1.00 48.95 130 A 1 ATOM 1054 C C . ALA A 0 130 . 14.859 -3.022 -0.127 1.00 48.95 130 A 1 ATOM 1055 C CB . ALA A 0 130 . 13.279 -5.014 -0.260 1.00 48.95 130 A 1 ATOM 1056 O O . ALA A 0 130 . 15.908 -3.050 -0.763 1.00 48.95 130 A 1 ATOM 1057 N N . TRP A 0 131 . 14.182 -1.882 0.071 1.00 41.19 131 A 1 ATOM 1058 C CA . TRP A 0 131 . 14.662 -0.584 -0.419 1.00 41.19 131 A 1 ATOM 1059 C C . TRP A 0 131 . 16.008 -0.173 0.191 1.00 41.19 131 A 1 ATOM 1060 C CB . TRP A 0 131 . 13.616 0.515 -0.182 1.00 41.19 131 A 1 ATOM 1061 O O . TRP A 0 131 . 16.850 0.334 -0.543 1.00 41.19 131 A 1 ATOM 1062 C CG . TRP A 0 131 . 12.461 0.521 -1.133 1.00 41.19 131 A 1 ATOM 1063 C CD1 . TRP A 0 131 . 11.209 0.089 -0.879 1.00 41.19 131 A 1 ATOM 1064 C CD2 . TRP A 0 131 . 12.401 1.101 -2.465 1.00 41.19 131 A 1 ATOM 1065 C CE2 . TRP A 0 131 . 11.093 0.887 -2.996 1.00 41.19 131 A 1 ATOM 1066 C CE3 . TRP A 0 131 . 13.310 1.827 -3.259 1.00 41.19 131 A 1 ATOM 1067 N NE1 . TRP A 0 131 . 10.415 0.233 -1.996 1.00 41.19 131 A 1 ATOM 1068 C CH2 . TRP A 0 131 . 11.651 2.034 -5.043 1.00 41.19 131 A 1 ATOM 1069 C CZ2 . TRP A 0 131 . 10.711 1.339 -4.265 1.00 41.19 131 A 1 ATOM 1070 C CZ3 . TRP A 0 131 . 12.939 2.285 -4.536 1.00 41.19 131 A 1 ATOM 1071 N N . ARG A 0 132 . 16.249 -0.409 1.492 1.00 42.73 132 A 1 ATOM 1072 C CA . ARG A 0 132 . 17.546 -0.076 2.122 1.00 42.73 132 A 1 ATOM 1073 C C . ARG A 0 132 . 18.714 -0.923 1.622 1.00 42.73 132 A 1 ATOM 1074 C CB . ARG A 0 132 . 17.490 -0.186 3.653 1.00 42.73 132 A 1 ATOM 1075 O O . ARG A 0 132 . 19.842 -0.485 1.773 1.00 42.73 132 A 1 ATOM 1076 C CG . ARG A 0 132 . 16.756 0.980 4.321 1.00 42.73 132 A 1 ATOM 1077 C CD . ARG A 0 132 . 17.038 0.934 5.827 1.00 42.73 132 A 1 ATOM 1078 N NE . ARG A 0 132 . 16.277 1.961 6.562 1.00 42.73 132 A 1 ATOM 1079 N NH1 . ARG A 0 132 . 17.356 1.737 8.576 1.00 42.73 132 A 1 ATOM 1080 N NH2 . ARG A 0 132 . 15.664 3.181 8.381 1.00 42.73 132 A 1 ATOM 1081 C CZ . ARG A 0 132 . 16.437 2.287 7.830 1.00 42.73 132 A 1 ATOM 1082 N N . MET A 0 133 . 18.468 -2.121 1.089 1.00 42.75 133 A 1 ATOM 1083 C CA . MET A 0 133 . 19.539 -2.949 0.516 1.00 42.75 133 A 1 ATOM 1084 C C . MET A 0 133 . 19.829 -2.631 -0.955 1.00 42.75 133 A 1 ATOM 1085 C CB . MET A 0 133 . 19.216 -4.441 0.647 1.00 42.75 133 A 1 ATOM 1086 O O . MET A 0 133 . 20.892 -2.993 -1.447 1.00 42.75 133 A 1 ATOM 1087 C CG . MET A 0 133 . 19.170 -4.948 2.089 1.00 42.75 133 A 1 ATOM 1088 S SD . MET A 0 133 . 19.382 -6.751 2.172 1.00 42.75 133 A 1 ATOM 1089 C CE . MET A 0 133 . 18.354 -7.145 3.604 1.00 42.75 133 A 1 ATOM 1090 N N . CYS A 0 134 . 18.890 -2.011 -1.674 1.00 40.73 134 A 1 ATOM 1091 C CA . CYS A 0 134 . 19.067 -1.660 -3.087 1.00 40.73 134 A 1 ATOM 1092 C C . CYS A 0 134 . 19.701 -0.277 -3.315 1.00 40.73 134 A 1 ATOM 1093 C CB . CYS A 0 134 . 17.713 -1.758 -3.806 1.00 40.73 134 A 1 ATOM 1094 O O . CYS A 0 134 . 19.940 0.075 -4.469 1.00 40.73 134 A 1 ATOM 1095 S SG . CYS A 0 134 . 17.205 -3.491 -4.002 1.00 40.73 134 A 1 ATOM 1096 N N . LEU A 0 135 . 19.916 0.499 -2.251 1.00 36.35 135 A 1 ATOM 1097 C CA . LEU A 0 135 . 20.533 1.828 -2.257 1.00 36.35 135 A 1 ATOM 1098 C C . LEU A 0 135 . 21.948 1.718 -1.685 1.00 36.35 135 A 1 ATOM 1099 C CB . LEU A 0 135 . 19.609 2.783 -1.461 1.00 36.35 135 A 1 ATOM 1100 O O . LEU A 0 135 . 22.859 2.326 -2.283 1.00 36.35 135 A 1 ATOM 1101 C CG . LEU A 0 135 . 19.348 4.127 -2.153 1.00 36.35 135 A 1 ATOM 1102 C CD1 . LEU A 0 135 . 18.062 4.735 -1.589 1.00 36.35 135 A 1 ATOM 1103 C CD2 . LEU A 0 135 . 20.486 5.120 -1.938 1.00 36.35 135 A 1 ATOM 1104 O OXT . LEU A 0 135 . 22.056 1.034 -0.645 1.00 36.35 135 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 59.21 # loop_ _atom_type.symbol C N O S #