data_4y1t-assembly-1_atom_site # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbe_label_seq_id _atom_site.orig_label_asym_id _atom_site.orig_auth_asym_id ATOM 1 N N . GLN A 1 1 ? -2.926 -37.773 -7.538 1.0 51.0 ? 410 GLN A N 1 1 . A ATOM 2 C CA . GLN A 1 1 ? -2.684 -36.422 -7.045 1.0 59.88 ? 410 GLN A CA 1 1 . A ATOM 3 C C . GLN A 1 1 ? -3.984 -35.628 -6.943 1.0 51.94 ? 410 GLN A C 1 1 . A ATOM 4 O O . GLN A 1 1 ? -4.912 -35.838 -7.724 1.0 46.42 ? 410 GLN A O 1 1 . A ATOM 5 C CB . GLN A 1 1 ? -1.696 -35.691 -7.951 1.0 41.83 ? 410 GLN A CB 1 1 . A ATOM 6 C CG . GLN A 1 1 ? -1.234 -34.357 -7.396 1.0 49.63 ? 410 GLN A CG 1 1 . A ATOM 7 C CD . GLN A 1 1 ? -1.228 -33.267 -8.440 1.0 44.23 ? 410 GLN A CD 1 1 . A ATOM 8 O OE1 . GLN A 1 1 ? -1.554 -33.506 -9.605 1.0 39.31 ? 410 GLN A OE1 1 1 . A ATOM 9 N NE2 . GLN A 1 1 ? -0.856 -32.058 -8.032 1.0 34.46 ? 410 GLN A NE2 1 1 . A ATOM 10 N N . ARG A 1 2 ? -4.039 -34.711 -5.980 1.0 33.44 ? 411 ARG A N 1 2 . A ATOM 11 C CA . ARG A 1 2 ? -5.246 -33.933 -5.727 1.0 45.39 ? 411 ARG A CA 1 2 . A ATOM 12 C C . ARG A 1 2 ? -5.233 -32.596 -6.463 1.0 32.36 ? 411 ARG A C 1 2 . A ATOM 13 O O . ARG A 1 2 ? -4.188 -32.137 -6.924 1.0 34.18 ? 411 ARG A O 1 2 . A ATOM 14 C CB . ARG A 1 2 ? -5.417 -33.700 -4.223 1.0 43.4 ? 411 ARG A CB 1 2 . A ATOM 15 N N . GLY A 1 3 ? -6.407 -31.980 -6.576 1.0 34.17 ? 412 GLY A N 1 3 . A ATOM 16 C CA . GLY A 1 3 ? -6.535 -30.670 -7.189 1.0 27.27 ? 412 GLY A CA 1 3 . A ATOM 17 C C . GLY A 1 3 ? -6.860 -30.701 -8.670 1.0 24.08 ? 412 GLY A C 1 3 . A ATOM 18 O O . GLY A 1 3 ? -6.998 -29.651 -9.299 1.0 32.36 ? 412 GLY A O 1 3 . A ATOM 19 N N . LEU A 1 4 ? -6.989 -31.900 -9.230 1.0 22.63 ? 413 LEU A N 1 4 . A ATOM 20 C CA . LEU A 1 4 ? -7.225 -32.053 -10.665 1.0 16.82 ? 413 LEU A CA 1 4 . A ATOM 21 C C . LEU A 1 4 ? -8.704 -32.059 -11.019 1.0 18.71 ? 413 LEU A C 1 4 . A ATOM 22 O O . LEU A 1 4 ? -9.524 -32.657 -10.321 1.0 24.12 ? 413 LEU A O 1 4 . A ATOM 23 C CB . LEU A 1 4 ? -6.572 -33.336 -11.184 1.0 22.42 ? 413 LEU A CB 1 4 . A ATOM 24 C CG . LEU A 1 4 ? -5.050 -33.318 -11.313 1.0 25.89 ? 413 LEU A CG 1 4 . A ATOM 25 C CD1 . LEU A 1 4 ? -4.550 -34.656 -11.821 1.0 23.0 ? 413 LEU A CD1 1 4 . A ATOM 26 C CD2 . LEU A 1 4 ? -4.611 -32.190 -12.235 1.0 20.86 ? 413 LEU A CD2 1 4 . A ATOM 27 N N . ALA A 1 5 ? -9.036 -31.394 -12.118 1.0 21.44 ? 414 ALA A N 1 5 . A ATOM 28 C CA . ALA A 1 5 ? -10.408 -31.349 -12.599 1.0 15.63 ? 414 ALA A CA 1 5 . A ATOM 29 C C . ALA A 1 5 ? -10.449 -31.147 -14.108 1.0 17.07 ? 414 ALA A C 1 5 . A ATOM 30 O O . ALA A 1 5 ? -9.578 -30.493 -14.684 1.0 17.5 ? 414 ALA A O 1 5 . A ATOM 31 C CB . ALA A 1 5 ? -11.179 -30.247 -11.897 1.0 14.4 ? 414 ALA A CB 1 5 . A ATOM 32 N N . HIS A 1 6 ? -11.462 -31.723 -14.743 1.0 16.81 ? 415 HIS A N 1 6 . A ATOM 33 C CA . HIS A 1 6 ? -11.704 -31.509 -16.162 1.0 15.31 ? 415 HIS A CA 1 6 . A ATOM 34 C C . HIS A 1 6 ? -12.456 -30.197 -16.346 1.0 13.3 ? 415 HIS A C 1 6 . A ATOM 35 O O . HIS A 1 6 ? -13.565 -30.044 -15.844 1.0 14.87 ? 415 HIS A O 1 6 . A ATOM 36 C CB . HIS A 1 6 ? -12.498 -32.674 -16.751 1.0 10.7 ? 415 HIS A CB 1 6 . A ATOM 37 C CG . HIS A 1 6 ? -12.679 -32.599 -18.233 1.0 17.78 ? 415 HIS A CG 1 6 . A ATOM 38 N ND1 . HIS A 1 6 ? -13.729 -33.208 -18.886 1.0 30.4 ? 415 HIS A ND1 1 6 . A ATOM 39 C CD2 . HIS A 1 6 ? -11.939 -31.996 -19.194 1.0 20.94 ? 415 HIS A CD2 1 6 . A ATOM 40 C CE1 . HIS A 1 6 ? -13.632 -32.978 -20.182 1.0 32.65 ? 415 HIS A CE1 1 6 . A ATOM 41 N NE2 . HIS A 1 6 ? -12.553 -32.247 -20.396 1.0 22.39 ? 415 HIS A NE2 1 6 . A ATOM 42 N N . LEU A 1 7 ? -11.848 -29.248 -17.052 1.0 14.78 ? 416 LEU A N 1 7 . A ATOM 43 C CA . LEU A 1 7 ? -12.453 -27.931 -17.235 1.0 14.17 ? 416 LEU A CA 1 7 . A ATOM 44 C C . LEU A 1 7 ? -12.916 -27.704 -18.669 1.0 14.97 ? 416 LEU A C 1 7 . A ATOM 45 O O . LEU A 1 7 ? -12.141 -27.846 -19.614 1.0 18.06 ? 416 LEU A O 1 7 . A ATOM 46 C CB . LEU A 1 7 ? -11.473 -26.826 -16.832 1.0 16.52 ? 416 LEU A CB 1 7 . A ATOM 47 C CG . LEU A 1 7 ? -11.969 -25.384 -16.988 1.0 11.81 ? 416 LEU A CG 1 7 . A ATOM 48 C CD1 . LEU A 1 7 ? -13.152 -25.115 -16.070 1.0 11.44 ? 416 LEU A CD1 1 7 . A ATOM 49 C CD2 . LEU A 1 7 ? -10.848 -24.393 -16.723 1.0 10.43 ? 416 LEU A CD2 1 7 . A ATOM 50 N N . VAL A 1 8 ? -14.189 -27.356 -18.817 1.0 10.91 ? 417 VAL A N 1 8 . A ATOM 51 C CA . VAL A 1 8 ? -14.756 -27.001 -20.110 1.0 11.21 ? 417 VAL A CA 1 8 . A ATOM 52 C C . VAL A 1 8 ? -15.513 -25.682 -19.980 1.0 18.93 ? 417 VAL A C 1 8 . A ATOM 53 O O . VAL A 1 8 ? -16.329 -25.520 -19.073 1.0 15.69 ? 417 VAL A O 1 8 . A ATOM 54 C CB . VAL A 1 8 ? -15.706 -28.096 -20.640 1.0 15.85 ? 417 VAL A CB 1 8 . A ATOM 55 C CG1 . VAL A 1 8 ? -16.261 -27.705 -22.000 1.0 19.76 ? 417 VAL A CG1 1 8 . A ATOM 56 C CG2 . VAL A 1 8 ? -14.991 -29.436 -20.721 1.0 15.66 ? 417 VAL A CG2 1 8 . A ATOM 57 N N . VAL A 1 9 ? -15.231 -24.737 -20.874 1.0 16.0 ? 418 VAL A N 1 9 . A ATOM 58 C CA . VAL A 1 9 ? -15.907 -23.440 -20.857 1.0 18.1 ? 418 VAL A CA 1 9 . A ATOM 59 C C . VAL A 1 9 ? -16.705 -23.235 -22.141 1.0 18.78 ? 418 VAL A C 1 9 . A ATOM 60 O O . VAL A 1 9 ? -16.181 -23.423 -23.237 1.0 24.67 ? 418 VAL A O 1 9 . A ATOM 61 C CB . VAL A 1 9 ? -14.909 -22.279 -20.689 1.0 20.49 ? 418 VAL A CB 1 9 . A ATOM 62 C CG1 . VAL A 1 9 ? -15.653 -20.988 -20.398 1.0 20.4 ? 418 VAL A CG1 1 9 . A ATOM 63 C CG2 . VAL A 1 9 ? -13.921 -22.582 -19.571 1.0 13.57 ? 418 VAL A CG2 1 9 . A ATOM 64 N N . SER A 1 10 ? -17.970 -22.848 -22.011 1.0 21.72 ? 419 SER A N 1 10 . A ATOM 65 C CA . SER A 1 10 ? -18.846 -22.769 -23.179 1.0 25.08 ? 419 SER A CA 1 10 . A ATOM 66 C C . SER A 1 10 ? -19.965 -21.741 -23.042 1.0 17.61 ? 419 SER A C 1 10 . A ATOM 67 O O . SER A 1 10 ? -20.004 -20.967 -22.084 1.0 17.36 ? 419 SER A O 1 10 . A ATOM 68 C CB . SER A 1 10 ? -19.463 -24.141 -23.459 1.0 29.8 ? 419 SER A CB 1 10 . A ATOM 69 O OG . SER A 1 10 ? -20.282 -24.555 -22.378 1.0 23.43 ? 419 SER A OG 1 10 . A ATOM 70 N N . ASN A 1 11 ? -20.868 -21.751 -24.021 1.0 19.85 ? 420 ASN A N 1 11 . A ATOM 71 C CA . ASN A 1 11 ? -22.047 -20.889 -24.037 1.0 24.3 ? 420 ASN A CA 1 11 . A ATOM 72 C C . ASN A 1 11 ? -21.689 -19.401 -23.967 1.0 21.99 ? 420 ASN A C 1 11 . A ATOM 73 O O . ASN A 1 11 ? -22.213 -18.665 -23.134 1.0 18.93 ? 420 ASN A O 1 11 . A ATOM 74 C CB . ASN A 1 11 ? -22.987 -21.268 -22.887 1.0 25.12 ? 420 ASN A CB 1 11 . A ATOM 75 C CG . ASN A 1 11 ? -24.433 -20.910 -23.169 1.0 30.13 ? 420 ASN A CG 1 11 . A ATOM 76 O OD1 . ASN A 1 11 ? -24.805 -20.615 -24.306 1.0 42.2 ? 420 ASN A OD1 1 11 . A ATOM 77 N ND2 . ASN A 1 11 ? -25.261 -20.938 -22.130 1.0 28.62 ? 420 ASN A ND2 1 11 . A ATOM 78 N N . PHE A 1 12 ? -20.796 -18.969 -24.854 1.0 28.43 ? 421 PHE A N 1 12 . A ATOM 79 C CA . PHE A 1 12 ? -20.340 -17.580 -24.881 1.0 25.13 ? 421 PHE A CA 1 12 . A ATOM 80 C C . PHE A 1 12 ? -21.326 -16.654 -25.583 1.0 18.76 ? 421 PHE A C 1 12 . A ATOM 81 O O . PHE A 1 12 ? -21.807 -16.957 -26.676 1.0 18.91 ? 421 PHE A O 1 12 . A ATOM 82 C CB . PHE A 1 12 ? -18.980 -17.471 -25.570 1.0 21.61 ? 421 PHE A CB 1 12 . A ATOM 83 C CG . PHE A 1 12 ? -17.884 -18.220 -24.878 1.0 14.74 ? 421 PHE A CG 1 12 . A ATOM 84 C CD1 . PHE A 1 12 ? -17.333 -17.740 -23.702 1.0 11.97 ? 421 PHE A CD1 1 12 . A ATOM 85 C CD2 . PHE A 1 12 ? -17.389 -19.395 -25.415 1.0 12.06 ? 421 PHE A CD2 1 12 . A ATOM 86 C CE1 . PHE A 1 12 ? -16.317 -18.423 -23.070 1.0 14.03 ? 421 PHE A CE1 1 12 . A ATOM 87 C CE2 . PHE A 1 12 ? -16.374 -20.082 -24.788 1.0 12.59 ? 421 PHE A CE2 1 12 . A ATOM 88 C CZ . PHE A 1 12 ? -15.837 -19.596 -23.614 1.0 16.01 ? 421 PHE A CZ 1 12 . A ATOM 89 N N . ARG A 1 13 ? -21.602 -15.516 -24.957 1.0 15.46 ? 422 ARG A N 1 13 . A ATOM 90 C CA . ARG A 1 13 ? -22.511 -14.523 -25.518 1.0 21.57 ? 422 ARG A CA 1 13 . A ATOM 91 C C . ARG A 1 13 ? -22.308 -13.173 -24.839 1.0 14.49 ? 422 ARG A C 1 13 . A ATOM 92 O O . ARG A 1 13 ? -22.103 -13.102 -23.626 1.0 13.72 ? 422 ARG A O 1 13 . A ATOM 93 C CB . ARG A 1 13 ? -23.965 -14.983 -25.374 1.0 14.32 ? 422 ARG A CB 1 13 . A ATOM 94 C CG . ARG A 1 13 ? -24.387 -15.248 -23.940 1.0 15.84 ? 422 ARG A CG 1 13 . A ATOM 95 C CD . ARG A 1 13 ? -25.496 -16.277 -23.865 1.0 23.84 ? 422 ARG A CD 1 13 . A ATOM 96 N NE . ARG A 1 13 ? -26.052 -16.382 -22.519 1.0 35.53 ? 422 ARG A NE 1 13 . A ATOM 97 C CZ . ARG A 1 13 ? -25.567 -17.167 -21.562 1.0 25.45 ? 422 ARG A CZ 1 13 . A ATOM 98 N NH1 . ARG A 1 13 ? -24.506 -17.926 -21.795 1.0 27.53 ? 422 ARG A NH1 1 13 . A ATOM 99 N NH2 . ARG A 1 13 ? -26.146 -17.191 -20.369 1.0 24.61 ? 422 ARG A NH2 1 13 . A ATOM 100 N N . ALA A 1 14 ? -22.350 -12.103 -25.625 1.0 15.98 ? 423 ALA A N 1 14 . A ATOM 101 C CA . ALA A 1 14 ? -22.222 -10.756 -25.080 1.0 21.81 ? 423 ALA A CA 1 14 . A ATOM 102 C C . ALA A 1 14 ? -23.376 -9.884 -25.552 1.0 21.14 ? 423 ALA A C 1 14 . A ATOM 103 O O . ALA A 1 14 ? -24.107 -10.254 -26.474 1.0 18.66 ? 423 ALA A O 1 14 . A ATOM 104 C CB . ALA A 1 14 ? -20.889 -10.140 -25.473 1.0 14.66 ? 423 ALA A CB 1 14 . A ATOM 105 N N . GLU A 1 15 ? -23.541 -8.729 -24.918 1.0 18.32 ? 424 GLU A N 1 15 . A ATOM 106 C CA . GLU A 1 15 ? -24.630 -7.825 -25.267 1.0 23.48 ? 424 GLU A CA 1 15 . A ATOM 107 C C . GLU A 1 15 ? -24.284 -6.370 -24.960 1.0 20.98 ? 424 GLU A C 1 15 . A ATOM 108 O O . GLU A 1 15 ? -23.555 -6.083 -24.008 1.0 19.55 ? 424 GLU A O 1 15 . A ATOM 109 C CB . GLU A 1 15 ? -25.910 -8.230 -24.529 1.0 24.58 ? 424 GLU A CB 1 15 . A ATOM 110 C CG . GLU A 1 15 ? -25.777 -8.230 -23.015 1.0 36.37 ? 424 GLU A CG 1 15 . A ATOM 111 C CD . GLU A 1 15 ? -26.960 -8.875 -22.315 1.0 52.06 ? 424 GLU A CD 1 15 . A ATOM 112 O OE1 . GLU A 1 15 ? -27.317 -8.416 -21.210 1.0 57.1 ? 424 GLU A OE1 1 15 . A ATOM 113 O OE2 . GLU A 1 15 ? -27.526 -9.847 -22.862 1.0 54.07 ? 424 GLU A OE2 1 15 . A ATOM 114 N N . HIS A 1 16 ? -24.811 -5.468 -25.787 1.0 17.48 ? 425 HIS A N 1 16 . A ATOM 115 C CA . HIS A 1 16 ? -24.647 -4.026 -25.614 1.0 15.24 ? 425 HIS A CA 1 16 . A ATOM 116 C C . HIS A 1 16 ? -23.182 -3.595 -25.643 1.0 17.92 ? 425 HIS A C 1 16 . A ATOM 117 O O . HIS A 1 16 ? -22.758 -2.743 -24.863 1.0 25.86 ? 425 HIS A O 1 16 . A ATOM 118 C CB . HIS A 1 16 ? -25.306 -3.569 -24.309 1.0 13.38 ? 425 HIS A CB 1 16 . A ATOM 119 C CG . HIS A 1 16 ? -26.738 -3.986 -24.180 1.0 22.83 ? 425 HIS A CG 1 16 . A ATOM 120 N ND1 . HIS A 1 16 ? -27.156 -4.958 -23.294 1.0 26.05 ? 425 HIS A ND1 1 16 . A ATOM 121 C CD2 . HIS A 1 16 ? -27.850 -3.574 -24.835 1.0 23.15 ? 425 HIS A CD2 1 16 . A ATOM 122 C CE1 . HIS A 1 16 ? -28.461 -5.118 -23.402 1.0 27.66 ? 425 HIS A CE1 1 16 . A ATOM 123 N NE2 . HIS A 1 16 ? -28.907 -4.292 -24.332 1.0 30.2 ? 425 HIS A NE2 1 16 . A ATOM 124 N N . LEU A 1 17 ? -22.415 -4.184 -26.554 1.0 16.98 ? 426 LEU A N 1 17 . A ATOM 125 C CA . LEU A 1 17 ? -21.014 -3.824 -26.726 1.0 9.64 ? 426 LEU A CA 1 17 . A ATOM 126 C C . LEU A 1 17 ? -20.868 -2.557 -27.556 1.0 10.79 ? 426 LEU A C 1 17 . A ATOM 127 O O . LEU A 1 17 ? -21.737 -2.228 -28.361 1.0 17.35 ? 426 LEU A O 1 17 . A ATOM 128 C CB . LEU A 1 17 ? -20.245 -4.966 -27.392 1.0 13.48 ? 426 LEU A CB 1 17 . A ATOM 129 C CG . LEU A 1 17 ? -20.199 -6.307 -26.659 1.0 15.89 ? 426 LEU A CG 1 17 . A ATOM 130 C CD1 . LEU A 1 17 ? -19.349 -7.292 -27.438 1.0 9.71 ? 426 LEU A CD1 1 17 . A ATOM 131 C CD2 . LEU A 1 17 ? -19.672 -6.140 -25.239 1.0 15.05 ? 426 LEU A CD2 1 17 . A ATOM 132 N N . ALA A 1 18 ? -19.756 -1.855 -27.365 1.0 21.89 ? 427 ALA A N 1 18 . A ATOM 133 C CA . ALA A 1 18 ? -19.475 -0.637 -28.117 1.0 17.45 ? 427 ALA A CA 1 18 . A ATOM 134 C C . ALA A 1 18 ? -17.973 -0.469 -28.342 1.0 19.66 ? 427 ALA A C 1 18 . A ATOM 135 O O . ALA A 1 18 ? -17.330 0.361 -27.702 1.0 27.18 ? 427 ALA A O 1 18 . A ATOM 136 C CB . ALA A 1 18 ? -20.041 0.571 -27.396 1.0 13.44 ? 427 ALA A CB 1 18 . A ATOM 137 N N . GLY A 1 19 ? -17.422 -1.262 -29.256 1.0 16.98 ? 428 GLY A N 1 19 . A ATOM 138 C CA . GLY A 1 19 ? -15.997 -1.241 -29.530 1.0 11.88 ? 428 GLY A CA 1 19 . A ATOM 139 C C . GLY A 1 19 ? -15.599 -0.311 -30.659 1.0 14.51 ? 428 GLY A C 1 19 . A ATOM 140 O O . GLY A 1 19 ? -14.429 0.045 -30.798 1.0 20.56 ? 428 GLY A O 1 19 . A ATOM 141 N N . ASP A 1 20 ? -16.572 0.079 -31.473 1.0 14.35 ? 429 ASP A N 1 20 . A ATOM 142 C CA . ASP A 1 20 ? -16.317 1.005 -32.569 1.0 13.23 ? 429 ASP A CA 1 20 . A ATOM 143 C C . ASP A 1 20 ? -17.161 2.265 -32.411 1.0 16.07 ? 429 ASP A C 1 20 . A ATOM 144 O O . ASP A 1 20 ? -18.127 2.281 -31.649 1.0 13.48 ? 429 ASP A O 1 20 . A ATOM 145 C CB . ASP A 1 20 ? -16.598 0.339 -33.917 1.0 9.1 ? 429 ASP A CB 1 20 . A ATOM 146 C CG . ASP A 1 20 ? -15.560 -0.706 -34.279 1.0 12.64 ? 429 ASP A CG 1 20 . A ATOM 147 O OD1 . ASP A 1 20 ? -14.448 -0.663 -33.716 1.0 12.92 ? 429 ASP A OD1 1 20 . A ATOM 148 O OD2 . ASP A 1 20 ? -15.852 -1.566 -35.136 1.0 14.85 ? 429 ASP A OD2 1 20 . A ATOM 149 N N . ALA A 1 21 ? -16.793 3.318 -33.134 1.0 15.91 ? 430 ALA A N 1 21 . A ATOM 150 C CA . ALA A 1 21 ? -17.496 4.590 -33.031 1.0 9.79 ? 430 ALA A CA 1 21 . A ATOM 151 C C . ALA A 1 21 ? -18.496 4.782 -34.166 1.0 15.28 ? 430 ALA A C 1 21 . A ATOM 152 O O . ALA A 1 21 ? -19.505 5.467 -34.001 1.0 15.59 ? 430 ALA A O 1 21 . A ATOM 153 C CB . ALA A 1 21 ? -16.502 5.742 -33.009 1.0 10.89 ? 430 ALA A CB 1 21 . A ATOM 154 N N . THR A 1 22 ? -18.216 4.174 -35.316 1.0 16.28 ? 431 THR A N 1 22 . A ATOM 155 C CA . THR A 1 22 ? -19.044 4.377 -36.501 1.0 9.64 ? 431 THR A CA 1 22 . A ATOM 156 C C . THR A 1 22 ? -19.759 3.105 -36.954 1.0 13.29 ? 431 THR A C 1 22 . A ATOM 157 O O . THR A 1 22 ? -20.684 3.164 -37.764 1.0 10.67 ? 431 THR A O 1 22 . A ATOM 158 C CB . THR A 1 22 ? -18.208 4.916 -37.674 1.0 15.19 ? 431 THR A CB 1 22 . A ATOM 159 O OG1 . THR A 1 22 ? -17.251 3.929 -38.081 1.0 15.73 ? 431 THR A OG1 1 22 . A ATOM 160 C CG2 . THR A 1 22 ? -17.481 6.190 -37.263 1.0 12.75 ? 431 THR A CG2 1 22 . A ATOM 161 N N . THR A 1 23 ? -19.325 1.956 -36.443 1.0 13.31 ? 432 THR A N 1 23 . A ATOM 162 C CA . THR A 1 23 ? -20.002 0.695 -36.736 1.0 10.71 ? 432 THR A CA 1 23 . A ATOM 163 C C . THR A 1 23 ? -20.234 -0.112 -35.468 1.0 11.12 ? 432 THR A C 1 23 . A ATOM 164 O O . THR A 1 23 ? -19.834 0.293 -34.376 1.0 10.04 ? 432 THR A O 1 23 . A ATOM 165 C CB . THR A 1 23 ? -19.211 -0.173 -37.737 1.0 12.56 ? 432 THR A CB 1 23 . A ATOM 166 O OG1 . THR A 1 23 ? -17.902 -0.439 -37.219 1.0 13.08 ? 432 THR A OG1 1 23 . A ATOM 167 C CG2 . THR A 1 23 ? -19.096 0.528 -39.086 1.0 12.73 ? 432 THR A CG2 1 23 . A ATOM 168 N N . ALA A 1 24 ? -20.893 -1.255 -35.621 1.0 14.29 ? 433 ALA A N 1 24 . A ATOM 169 C CA . ALA A 1 24 ? -21.135 -2.151 -34.500 1.0 14.3 ? 433 ALA A CA 1 24 . A ATOM 170 C C . ALA A 1 24 ? -19.850 -2.884 -34.120 1.0 16.07 ? 433 ALA A C 1 24 . A ATOM 171 O O . ALA A 1 24 ? -18.883 -2.900 -34.881 1.0 16.71 ? 433 ALA A O 1 24 . A ATOM 172 C CB . ALA A 1 24 ? -22.239 -3.137 -34.836 1.0 8.41 ? 433 ALA A CB 1 24 . A ATOM 173 N N . THR A 1 25 ? -19.851 -3.491 -32.940 1.0 9.76 ? 434 THR A N 1 25 . A ATOM 174 C CA . THR A 1 25 ? -18.655 -4.108 -32.390 1.0 9.77 ? 434 THR A CA 1 25 . A ATOM 175 C C . THR A 1 25 ? -18.227 -5.348 -33.177 1.0 12.69 ? 434 THR A C 1 25 . A ATOM 176 O O . THR A 1 25 ? -19.060 -6.088 -33.699 1.0 10.97 ? 434 THR A O 1 25 . A ATOM 177 C CB . THR A 1 25 ? -18.876 -4.481 -30.913 1.0 15.04 ? 434 THR A CB 1 25 . A ATOM 178 O OG1 . THR A 1 25 ? -19.439 -3.357 -30.223 1.0 16.53 ? 434 THR A OG1 1 25 . A ATOM 179 C CG2 . THR A 1 25 ? -17.567 -4.874 -30.244 1.0 10.39 ? 434 THR A CG2 1 25 . A ATOM 180 N N . ASP A 1 26 ? -16.916 -5.550 -33.269 1.0 13.49 ? 435 ASP A N 1 26 . A ATOM 181 C CA . ASP A 1 26 ? -16.342 -6.725 -33.911 1.0 9.7 ? 435 ASP A CA 1 26 . A ATOM 182 C C . ASP A 1 26 ? -15.641 -7.574 -32.859 1.0 10.77 ? 435 ASP A C 1 26 . A ATOM 183 O O . ASP A 1 26 ? -14.414 -7.586 -32.772 1.0 11.35 ? 435 ASP A O 1 26 . A ATOM 184 C CB . ASP A 1 26 ? -15.366 -6.309 -35.006 1.0 11.1 ? 435 ASP A CB 1 26 . A ATOM 185 C CG . ASP A 1 26 ? -15.919 -5.206 -35.881 1.0 14.73 ? 435 ASP A CG 1 26 . A ATOM 186 O OD1 . ASP A 1 26 ? -17.056 -5.356 -36.374 1.0 12.45 ? 435 ASP A OD1 1 26 . A ATOM 187 O OD2 . ASP A 1 26 ? -15.227 -4.181 -36.061 1.0 17.53 ? 435 ASP A OD2 1 26 . A ATOM 188 N N . ALA A 1 27 ? -16.433 -8.290 -32.068 1.0 10.84 ? 436 ALA A N 1 27 . A ATOM 189 C CA . ALA A 1 27 ? -15.937 -8.914 -30.849 1.0 8.39 ? 436 ALA A CA 1 27 . A ATOM 190 C C . ALA A 1 27 ? -15.331 -10.296 -31.050 1.0 12.1 ? 436 ALA A C 1 27 . A ATOM 191 O O . ALA A 1 27 ? -15.757 -11.070 -31.907 1.0 14.57 ? 436 ALA A O 1 27 . A ATOM 192 C CB . ALA A 1 27 ? -17.054 -8.993 -29.825 1.0 9.23 ? 436 ALA A CB 1 27 . A ATOM 193 N N . TYR A 1 28 ? -14.317 -10.583 -30.244 1.0 10.85 ? 437 TYR A N 1 28 . A ATOM 194 C CA . TYR A 1 28 ? -13.788 -11.928 -30.099 1.0 12.08 ? 437 TYR A CA 1 28 . A ATOM 195 C C . TYR A 1 28 ? -13.297 -12.086 -28.667 1.0 12.72 ? 437 TYR A C 1 28 . A ATOM 196 O O . TYR A 1 28 ? -13.052 -11.096 -27.979 1.0 14.18 ? 437 TYR A O 1 28 . A ATOM 197 C CB . TYR A 1 28 ? -12.670 -12.203 -31.107 1.0 14.01 ? 437 TYR A CB 1 28 . A ATOM 198 C CG . TYR A 1 28 ? -11.396 -11.414 -30.894 1.0 17.48 ? 437 TYR A CG 1 28 . A ATOM 199 C CD1 . TYR A 1 28 ? -11.222 -10.161 -31.474 1.0 20.96 ? 437 TYR A CD1 1 28 . A ATOM 200 C CD2 . TYR A 1 28 ? -10.355 -11.935 -30.139 1.0 10.77 ? 437 TYR A CD2 1 28 . A ATOM 201 C CE1 . TYR A 1 28 ? -10.049 -9.444 -31.290 1.0 15.37 ? 437 TYR A CE1 1 28 . A ATOM 202 C CE2 . TYR A 1 28 ? -9.181 -11.226 -29.950 1.0 11.58 ? 437 TYR A CE2 1 28 . A ATOM 203 C CZ . TYR A 1 28 ? -9.034 -9.983 -30.528 1.0 11.58 ? 437 TYR A CZ 1 28 . A ATOM 204 O OH . TYR A 1 28 ? -7.866 -9.282 -30.340 1.0 11.86 ? 437 TYR A OH 1 28 . A ATOM 205 N N . LEU A 1 29 ? -13.167 -13.325 -28.210 1.0 15.58 ? 438 LEU A N 1 29 . A ATOM 206 C CA . LEU A 1 29 ? -12.777 -13.563 -26.827 1.0 15.16 ? 438 LEU A CA 1 29 . A ATOM 207 C C . LEU A 1 29 ? -11.410 -14.217 -26.700 1.0 13.57 ? 438 LEU A C 1 29 . A ATOM 208 O O . LEU A 1 29 ? -10.962 -14.943 -27.586 1.0 16.83 ? 438 LEU A O 1 29 . A ATOM 209 C CB . LEU A 1 29 ? -13.815 -14.438 -26.125 1.0 16.47 ? 438 LEU A CB 1 29 . A ATOM 210 C CG . LEU A 1 29 ? -15.259 -13.945 -26.107 1.0 21.81 ? 438 LEU A CG 1 29 . A ATOM 211 C CD1 . LEU A 1 29 ? -16.111 -14.910 -25.307 1.0 13.48 ? 438 LEU A CD1 1 29 . A ATOM 212 C CD2 . LEU A 1 29 ? -15.353 -12.536 -25.539 1.0 19.73 ? 438 LEU A CD2 1 29 . A ATOM 213 N N . LYS A 1 30 ? -10.753 -13.943 -25.581 1.0 17.3 ? 439 LYS A N 1 30 . A ATOM 214 C CA . LYS A 1 30 ? -9.576 -14.691 -25.172 1.0 14.07 ? 439 LYS A CA 1 30 . A ATOM 215 C C . LYS A 1 30 ? -9.866 -15.293 -23.806 1.0 17.28 ? 439 LYS A C 1 30 . A ATOM 216 O O . LYS A 1 30 ? -10.277 -14.581 -22.890 1.0 28.81 ? 439 LYS A O 1 30 . A ATOM 217 C CB . LYS A 1 30 ? -8.337 -13.799 -25.110 1.0 16.97 ? 439 LYS A CB 1 30 . A ATOM 218 C CG . LYS A 1 30 ? -7.917 -13.181 -26.432 1.0 10.84 ? 439 LYS A CG 1 30 . A ATOM 219 C CD . LYS A 1 30 ? -6.642 -12.373 -26.243 1.0 16.75 ? 439 LYS A CD 1 30 . A ATOM 220 C CE . LYS A 1 30 ? -6.241 -11.638 -27.506 1.0 28.89 ? 439 LYS A CE 1 30 . A ATOM 221 N NZ . LYS A 1 30 ? -5.087 -10.732 -27.258 1.0 18.58 ? 439 LYS A NZ 1 30 . A ATOM 222 N N . VAL A 1 31 ? -9.673 -16.600 -23.668 1.0 16.99 ? 440 VAL A N 1 31 . A ATOM 223 C CA . VAL A 1 31 ? -9.945 -17.263 -22.398 1.0 18.99 ? 440 VAL A CA 1 31 . A ATOM 224 C C . VAL A 1 31 ? -8.678 -17.903 -21.837 1.0 21.73 ? 440 VAL A C 1 31 . A ATOM 225 O O . VAL A 1 31 ? -8.050 -18.736 -22.491 1.0 21.4 ? 440 VAL A O 1 31 . A ATOM 226 C CB . VAL A 1 31 ? -11.042 -18.330 -22.544 1.0 16.49 ? 440 VAL A CB 1 31 . A ATOM 227 C CG1 . VAL A 1 31 ? -11.340 -18.968 -21.198 1.0 15.13 ? 440 VAL A CG1 1 31 . A ATOM 228 C CG2 . VAL A 1 31 ? -12.302 -17.712 -23.135 1.0 15.76 ? 440 VAL A CG2 1 31 . A ATOM 229 N N . PHE A 1 32 ? -8.311 -17.508 -20.622 1.0 16.94 ? 441 PHE A N 1 32 . A ATOM 230 C CA . PHE A 1 32 ? -7.051 -17.932 -20.020 1.0 13.31 ? 441 PHE A CA 1 32 . A ATOM 231 C C . PHE A 1 32 ? -7.242 -18.859 -18.825 1.0 13.74 ? 441 PHE A C 1 32 . A ATOM 232 O O . PHE A 1 32 ? -8.094 -18.614 -17.971 1.0 17.75 ? 441 PHE A O 1 32 . A ATOM 233 C CB . PHE A 1 32 ? -6.240 -16.714 -19.570 1.0 11.5 ? 441 PHE A CB 1 32 . A ATOM 234 C CG . PHE A 1 32 ? -5.855 -15.781 -20.683 1.0 15.78 ? 441 PHE A CG 1 32 . A ATOM 235 C CD1 . PHE A 1 32 ? -6.740 -14.817 -21.138 1.0 20.3 ? 441 PHE A CD1 1 32 . A ATOM 236 C CD2 . PHE A 1 32 ? -4.593 -15.842 -21.251 1.0 18.15 ? 441 PHE A CD2 1 32 . A ATOM 237 C CE1 . PHE A 1 32 ? -6.380 -13.946 -22.153 1.0 23.17 ? 441 PHE A CE1 1 32 . A ATOM 238 C CE2 . PHE A 1 32 ? -4.226 -14.973 -22.261 1.0 22.49 ? 441 PHE A CE2 1 32 . A ATOM 239 C CZ . PHE A 1 32 ? -5.120 -14.025 -22.715 1.0 19.81 ? 441 PHE A CZ 1 32 . A ATOM 240 N N . PHE A 1 33 ? -6.439 -19.919 -18.774 1.0 14.52 ? 442 PHE A N 1 33 . A ATOM 241 C CA . PHE A 1 33 ? -6.279 -20.716 -17.561 1.0 9.3 ? 442 PHE A CA 1 33 . A ATOM 242 C C . PHE A 1 33 ? -5.063 -21.632 -17.653 1.0 15.29 ? 442 PHE A C 1 33 . A ATOM 243 O O . PHE A 1 33 ? -4.844 -22.288 -18.672 1.0 16.25 ? 442 PHE A O 1 33 . A ATOM 244 C CB . PHE A 1 33 ? -7.523 -21.556 -17.267 1.0 13.26 ? 442 PHE A CB 1 33 . A ATOM 245 C CG . PHE A 1 33 ? -7.571 -22.070 -15.857 1.0 14.94 ? 442 PHE A CG 1 33 . A ATOM 246 C CD1 . PHE A 1 33 ? -6.975 -23.274 -15.522 1.0 11.69 ? 442 PHE A CD1 1 33 . A ATOM 247 C CD2 . PHE A 1 33 ? -8.187 -21.333 -14.858 1.0 17.91 ? 442 PHE A CD2 1 33 . A ATOM 248 C CE1 . PHE A 1 33 ? -7.003 -23.739 -14.219 1.0 12.7 ? 442 PHE A CE1 1 33 . A ATOM 249 C CE2 . PHE A 1 33 ? -8.220 -21.795 -13.554 1.0 14.05 ? 442 PHE A CE2 1 33 . A ATOM 250 C CZ . PHE A 1 33 ? -7.627 -22.998 -13.236 1.0 11.71 ? 442 PHE A CZ 1 33 . A ATOM 251 N N . GLY A 1 34 ? -4.277 -21.661 -16.578 1.0 15.25 ? 443 GLY A N 1 34 . A ATOM 252 C CA . GLY A 1 34 ? -3.150 -22.571 -16.445 1.0 20.4 ? 443 GLY A CA 1 34 . A ATOM 253 C C . GLY A 1 34 ? -2.149 -22.587 -17.586 1.0 21.99 ? 443 GLY A C 1 34 . A ATOM 254 O O . GLY A 1 34 ? -1.602 -23.639 -17.925 1.0 25.97 ? 443 GLY A O 1 34 . A ATOM 255 N N . GLY A 1 35 ? -1.903 -21.426 -18.183 1.0 13.12 ? 444 GLY A N 1 35 . A ATOM 256 C CA . GLY A 1 35 ? -0.968 -21.335 -19.290 1.0 10.38 ? 444 GLY A CA 1 35 . A ATOM 257 C C . GLY A 1 35 ? -1.620 -21.583 -20.636 1.0 15.57 ? 444 GLY A C 1 35 . A ATOM 258 O O . GLY A 1 35 ? -1.000 -21.380 -21.680 1.0 22.22 ? 444 GLY A O 1 35 . A ATOM 259 N N . GLN A 1 36 ? -2.873 -22.028 -20.614 1.0 14.97 ? 445 GLN A N 1 36 . A ATOM 260 C CA . GLN A 1 36 ? -3.629 -22.235 -21.843 1.0 16.87 ? 445 GLN A CA 1 36 . A ATOM 261 C C . GLN A 1 36 ? -4.370 -20.964 -22.240 1.0 21.34 ? 445 GLN A C 1 36 . A ATOM 262 O O . GLN A 1 36 ? -4.909 -20.259 -21.385 1.0 14.52 ? 445 GLN A O 1 36 . A ATOM 263 C CB . GLN A 1 36 ? -4.620 -23.385 -21.682 1.0 17.14 ? 445 GLN A CB 1 36 . A ATOM 264 C CG . GLN A 1 36 ? -3.992 -24.701 -21.275 1.0 15.14 ? 445 GLN A CG 1 36 . A ATOM 265 C CD . GLN A 1 36 ? -5.012 -25.820 -21.185 1.0 22.82 ? 445 GLN A CD 1 36 . A ATOM 266 O OE1 . GLN A 1 36 ? -5.699 -26.131 -22.160 1.0 12.63 ? 445 GLN A OE1 1 36 . A ATOM 267 N NE2 . GLN A 1 36 ? -5.123 -26.426 -20.006 1.0 15.46 ? 445 GLN A NE2 1 36 . A ATOM 268 N N . GLU A 1 37 ? -4.400 -20.679 -23.539 1.0 20.28 ? 446 GLU A N 1 37 . A ATOM 269 C CA . GLU A 1 37 ? -5.074 -19.488 -24.043 1.0 17.02 ? 446 GLU A CA 1 37 . A ATOM 270 C C . GLU A 1 37 ? -5.902 -19.793 -25.290 1.0 16.53 ? 446 GLU A C 1 37 . A ATOM 271 O O . GLU A 1 37 ? -5.360 -19.963 -26.382 1.0 14.96 ? 446 GLU A O 1 37 . A ATOM 272 C CB . GLU A 1 37 ? -4.056 -18.386 -24.345 1.0 7.64 ? 446 GLU A CB 1 37 . A ATOM 273 C CG . GLU A 1 37 ? -4.665 -17.127 -24.939 1.0 17.79 ? 446 GLU A CG 1 37 . A ATOM 274 C CD . GLU A 1 37 ? -3.624 -16.080 -25.296 1.0 48.48 ? 446 GLU A CD 1 37 . A ATOM 275 O OE1 . GLU A 1 37 ? -2.446 -16.253 -24.915 1.0 64.54 ? 446 GLU A OE1 1 37 . A ATOM 276 O OE2 . GLU A 1 37 ? -3.984 -15.084 -25.958 1.0 50.38 ? 446 GLU A OE2 1 37 . A ATOM 277 N N . PHE A 1 38 ? -7.219 -19.863 -25.118 1.0 20.36 ? 447 PHE A N 1 38 . A ATOM 278 C CA . PHE A 1 38 ? -8.132 -20.095 -26.235 1.0 20.47 ? 447 PHE A CA 1 38 . A ATOM 279 C C . PHE A 1 38 ? -8.617 -18.776 -26.823 1.0 20.45 ? 447 PHE A C 1 38 . A ATOM 280 O O . PHE A 1 38 ? -8.705 -17.769 -26.123 1.0 23.52 ? 447 PHE A O 1 38 . A ATOM 281 C CB . PHE A 1 38 ? -9.338 -20.926 -25.796 1.0 17.28 ? 447 PHE A CB 1 38 . A ATOM 282 C CG . PHE A 1 38 ? -9.032 -22.376 -25.547 1.0 15.76 ? 447 PHE A CG 1 38 . A ATOM 283 C CD1 . PHE A 1 38 ? -8.484 -22.785 -24.344 1.0 12.65 ? 447 PHE A CD1 1 38 . A ATOM 284 C CD2 . PHE A 1 38 ? -9.321 -23.331 -26.506 1.0 14.21 ? 447 PHE A CD2 1 38 . A ATOM 285 C CE1 . PHE A 1 38 ? -8.216 -24.119 -24.106 1.0 15.35 ? 447 PHE A CE1 1 38 . A ATOM 286 C CE2 . PHE A 1 38 ? -9.053 -24.667 -26.276 1.0 19.16 ? 447 PHE A CE2 1 38 . A ATOM 287 C CZ . PHE A 1 38 ? -8.500 -25.062 -25.075 1.0 14.81 ? 447 PHE A CZ 1 38 . A ATOM 288 N N . ARG A 1 39 ? -8.947 -18.793 -28.108 1.0 19.02 ? 448 ARG A N 1 39 . A ATOM 289 C CA . ARG A 1 39 ? -9.429 -17.602 -28.791 1.0 19.4 ? 448 ARG A CA 1 39 . A ATOM 290 C C . ARG A 1 39 ? -10.594 -17.946 -29.715 1.0 23.01 ? 448 ARG A C 1 39 . A ATOM 291 O O . ARG A 1 39 ? -10.527 -18.906 -30.479 1.0 27.53 ? 448 ARG A O 1 39 . A ATOM 292 C CB . ARG A 1 39 ? -8.293 -16.950 -29.582 1.0 17.29 ? 448 ARG A CB 1 39 . A ATOM 293 C CG . ARG A 1 39 ? -8.714 -15.749 -30.409 1.0 27.77 ? 448 ARG A CG 1 39 . A ATOM 294 C CD . ARG A 1 39 ? -7.629 -15.362 -31.402 1.0 30.55 ? 448 ARG A CD 1 39 . A ATOM 295 N NE . ARG A 1 39 ? -6.482 -14.723 -30.765 1.0 34.39 ? 448 ARG A NE 1 39 . A ATOM 296 C CZ . ARG A 1 39 ? -6.136 -13.454 -30.959 1.0 43.27 ? 448 ARG A CZ 1 39 . A ATOM 297 N NH1 . ARG A 1 39 ? -6.848 -12.691 -31.780 1.0 40.34 ? 448 ARG A NH1 1 39 . A ATOM 298 N NH2 . ARG A 1 39 ? -5.075 -12.948 -30.344 1.0 28.41 ? 448 ARG A NH2 1 39 . A ATOM 299 N N . THR A 1 40 ? -11.666 -17.167 -29.634 1.0 16.27 ? 449 THR A N 1 40 . A ATOM 300 C CA . THR A 1 40 ? -12.799 -17.350 -30.531 1.0 12.94 ? 449 THR A CA 1 40 . A ATOM 301 C C . THR A 1 40 ? -12.561 -16.622 -31.842 1.0 17.06 ? 449 THR A C 1 40 . A ATOM 302 O O . THR A 1 40 ? -11.651 -15.799 -31.950 1.0 18.18 ? 449 THR A O 1 40 . A ATOM 303 C CB . THR A 1 40 ? -14.111 -16.826 -29.922 1.0 16.23 ? 449 THR A CB 1 40 . A ATOM 304 O OG1 . THR A 1 40 ? -14.078 -15.393 -29.876 1.0 12.9 ? 449 THR A OG1 1 40 . A ATOM 305 C CG2 . THR A 1 40 ? -14.316 -17.384 -28.520 1.0 12.31 ? 449 THR A CG2 1 40 . A ATOM 306 N N . GLY A 1 41 ? -13.387 -16.925 -32.836 1.0 14.98 ? 450 GLY A N 1 41 . A ATOM 307 C CA . GLY A 1 41 ? -13.382 -16.165 -34.070 1.0 7.05 ? 450 GLY A CA 1 41 . A ATOM 308 C C . GLY A 1 41 ? -14.017 -14.805 -33.843 1.0 14.5 ? 450 GLY A C 1 41 . A ATOM 309 O O . GLY A 1 41 ? -14.577 -14.539 -32.778 1.0 16.85 ? 450 GLY A O 1 41 . A ATOM 310 N N . VAL A 1 42 ? -13.932 -13.938 -34.842 1.0 15.37 ? 451 VAL A N 1 42 . A ATOM 311 C CA . VAL A 1 42 ? -14.510 -12.606 -34.737 1.0 17.64 ? 451 VAL A CA 1 42 . A ATOM 312 C C . VAL A 1 42 ? -15.937 -12.587 -35.275 1.0 17.37 ? 451 VAL A C 1 42 . A ATOM 313 O O . VAL A 1 42 ? -16.206 -13.098 -36.360 1.0 18.58 ? 451 VAL A O 1 42 . A ATOM 314 C CB . VAL A 1 42 ? -13.663 -11.564 -35.496 1.0 14.03 ? 451 VAL A CB 1 42 . A ATOM 315 C CG1 . VAL A 1 42 ? -14.353 -10.210 -35.501 1.0 12.17 ? 451 VAL A CG1 1 42 . A ATOM 316 C CG2 . VAL A 1 42 ? -12.276 -11.459 -34.880 1.0 14.25 ? 451 VAL A CG2 1 42 . A ATOM 317 N N . VAL A 1 43 ? -16.853 -12.016 -34.501 1.0 14.27 ? 452 VAL A N 1 43 . A ATOM 318 C CA . VAL A 1 43 ? -18.204 -11.770 -34.984 1.0 11.93 ? 452 VAL A CA 1 43 . A ATOM 319 C C . VAL A 1 43 ? -18.278 -10.339 -35.488 1.0 13.79 ? 452 VAL A C 1 43 . A ATOM 320 O O . VAL A 1 43 ? -18.354 -9.398 -34.698 1.0 18.17 ? 452 VAL A O 1 43 . A ATOM 321 C CB . VAL A 1 43 ? -19.260 -11.990 -33.894 1.0 12.75 ? 452 VAL A CB 1 43 . A ATOM 322 C CG1 . VAL A 1 43 ? -20.647 -11.708 -34.449 1.0 8.6 ? 452 VAL A CG1 1 43 . A ATOM 323 C CG2 . VAL A 1 43 ? -19.171 -13.410 -33.351 1.0 9.47 ? 452 VAL A CG2 1 43 . A ATOM 324 N N . TRP A 1 44 ? -18.240 -10.171 -36.803 1.0 10.42 ? 453 TRP A N 1 44 . A ATOM 325 C CA . TRP A 1 44 ? -18.117 -8.837 -37.372 1.0 17.11 ? 453 TRP A CA 1 44 . A ATOM 326 C C . TRP A 1 44 ? -19.415 -8.044 -37.293 1.0 17.9 ? 453 TRP A C 1 44 . A ATOM 327 O O . TRP A 1 44 ? -20.487 -8.534 -37.656 1.0 21.8 ? 453 TRP A O 1 44 . A ATOM 328 C CB . TRP A 1 44 ? -17.628 -8.919 -38.820 1.0 13.32 ? 453 TRP A CB 1 44 . A ATOM 329 C CG . TRP A 1 44 ? -16.195 -9.330 -38.906 1.0 15.85 ? 453 TRP A CG 1 44 . A ATOM 330 C CD1 . TRP A 1 44 ? -15.715 -10.588 -39.114 1.0 15.88 ? 453 TRP A CD1 1 44 . A ATOM 331 C CD2 . TRP A 1 44 ? -15.050 -8.481 -38.760 1.0 21.25 ? 453 TRP A CD2 1 44 . A ATOM 332 N NE1 . TRP A 1 44 ? -14.342 -10.576 -39.115 1.0 17.88 ? 453 TRP A NE1 1 44 . A ATOM 333 C CE2 . TRP A 1 44 ? -13.908 -9.295 -38.900 1.0 14.33 ? 453 TRP A CE2 1 44 . A ATOM 334 C CE3 . TRP A 1 44 ? -14.879 -7.112 -38.529 1.0 22.56 ? 453 TRP A CE3 1 44 . A ATOM 335 C CZ2 . TRP A 1 44 ? -12.614 -8.786 -38.815 1.0 16.26 ? 453 TRP A CZ2 1 44 . A ATOM 336 C CZ3 . TRP A 1 44 ? -13.593 -6.608 -38.445 1.0 18.06 ? 453 TRP A CZ3 1 44 . A ATOM 337 C CH2 . TRP A 1 44 ? -12.477 -7.444 -38.588 1.0 24.66 ? 453 TRP A CH2 1 44 . A ATOM 338 N N . ASN A 1 45 ? -19.292 -6.819 -36.790 1.0 15.27 ? 454 ASN A N 1 45 . A ATOM 339 C CA . ASN A 1 45 ? -20.374 -5.841 -36.769 1.0 12.33 ? 454 ASN A CA 1 45 . A ATOM 340 C C . ASN A 1 45 ? -21.661 -6.342 -36.131 1.0 12.31 ? 454 ASN A C 1 45 . A ATOM 341 O O . ASN A 1 45 ? -22.725 -6.329 -36.749 1.0 13.32 ? 454 ASN A O 1 45 . A ATOM 342 C CB . ASN A 1 45 ? -20.647 -5.353 -38.189 1.0 8.73 ? 454 ASN A CB 1 45 . A ATOM 343 C CG . ASN A 1 45 ? -19.542 -4.458 -38.707 1.0 13.47 ? 454 ASN A CG 1 45 . A ATOM 344 O OD1 . ASN A 1 45 ? -19.108 -3.535 -38.018 1.0 14.16 ? 454 ASN A OD1 1 45 . A ATOM 345 N ND2 . ASN A 1 45 ? -19.062 -4.739 -39.912 1.0 20.92 ? 454 ASN A ND2 1 45 . A ATOM 346 N N . ASN A 1 46 ? -21.547 -6.780 -34.883 1.0 10.81 ? 455 ASN A N 1 46 . A ATOM 347 C CA . ASN A 1 46 ? -22.711 -7.114 -34.079 1.0 12.83 ? 455 ASN A CA 1 46 . A ATOM 348 C C . ASN A 1 46 ? -22.453 -6.779 -32.615 1.0 15.34 ? 455 ASN A C 1 46 . A ATOM 349 O O . ASN A 1 46 ? -21.425 -7.168 -32.057 1.0 17.5 ? 455 ASN A O 1 46 . A ATOM 350 C CB . ASN A 1 46 ? -23.074 -8.591 -34.230 1.0 21.38 ? 455 ASN A CB 1 46 . A ATOM 351 C CG . ASN A 1 46 ? -24.514 -8.875 -33.848 1.0 21.21 ? 455 ASN A CG 1 46 . A ATOM 352 O OD1 . ASN A 1 46 ? -24.847 -8.995 -32.669 1.0 15.0 ? 455 ASN A OD1 1 46 . A ATOM 353 N ND2 . ASN A 1 46 ? -25.379 -8.975 -34.849 1.0 24.43 ? 455 ASN A ND2 1 46 . A ATOM 354 N N . ASN A 1 47 ? -23.379 -6.053 -31.998 1.0 9.7 ? 456 ASN A N 1 47 . A ATOM 355 C CA . ASN A 1 47 ? -23.217 -5.649 -30.606 1.0 13.42 ? 456 ASN A CA 1 47 . A ATOM 356 C C . ASN A 1 47 ? -23.710 -6.707 -29.626 1.0 15.73 ? 456 ASN A C 1 47 . A ATOM 357 O O . ASN A 1 47 ? -23.443 -6.623 -28.428 1.0 16.9 ? 456 ASN A O 1 47 . A ATOM 358 C CB . ASN A 1 47 ? -23.934 -4.326 -30.351 1.0 14.88 ? 456 ASN A CB 1 47 . A ATOM 359 C CG . ASN A 1 47 ? -23.335 -3.186 -31.143 1.0 13.98 ? 456 ASN A CG 1 47 . A ATOM 360 O OD1 . ASN A 1 47 ? -22.127 -3.148 -31.378 1.0 14.14 ? 456 ASN A OD1 1 47 . A ATOM 361 N ND2 . ASN A 1 47 ? -24.178 -2.255 -31.569 1.0 16.01 ? 456 ASN A ND2 1 47 . A ATOM 362 N N . ASN A 1 48 ? -24.419 -7.708 -30.141 1.0 19.48 ? 457 ASN A N 1 48 . A ATOM 363 C CA . ASN A 1 48 ? -24.847 -8.840 -29.324 1.0 20.75 ? 457 ASN A CA 1 48 . A ATOM 364 C C . ASN A 1 48 ? -24.334 -10.168 -29.873 1.0 19.14 ? 457 ASN A C 1 48 . A ATOM 365 O O . ASN A 1 48 ? -25.126 -11.017 -30.283 1.0 15.94 ? 457 ASN A O 1 48 . A ATOM 366 C CB . ASN A 1 48 ? -26.372 -8.882 -29.223 1.0 20.84 ? 457 ASN A CB 1 48 . A ATOM 367 C CG . ASN A 1 48 ? -26.963 -7.555 -28.808 1.0 16.66 ? 457 ASN A CG 1 48 . A ATOM 368 O OD1 . ASN A 1 48 ? -26.811 -7.127 -27.665 1.0 18.48 ? 457 ASN A OD1 1 48 . A ATOM 369 N ND2 . ASN A 1 48 ? -27.651 -6.897 -29.733 1.0 21.69 ? 457 ASN A ND2 1 48 . A ATOM 370 N N . PRO A 1 49 ? -23.004 -10.358 -29.873 1.0 15.06 ? 458 PRO A N 1 49 . A ATOM 371 C CA . PRO A 1 49 ? -22.425 -11.554 -30.490 1.0 16.6 ? 458 PRO A CA 1 49 . A ATOM 372 C C . PRO A 1 49 ? -22.631 -12.821 -29.670 1.0 16.6 ? 458 PRO A C 1 49 . A ATOM 373 O O . PRO A 1 49 ? -22.727 -12.766 -28.443 1.0 18.13 ? 458 PRO A O 1 49 . A ATOM 374 C CB . PRO A 1 49 ? -20.938 -11.208 -30.578 1.0 14.34 ? 458 PRO A CB 1 49 . A ATOM 375 C CG . PRO A 1 49 ? -20.710 -10.306 -29.418 1.0 13.04 ? 458 PRO A CG 1 49 . A ATOM 376 C CD . PRO A 1 49 ? -21.967 -9.492 -29.282 1.0 15.59 ? 458 PRO A CD 1 49 . A ATOM 377 N N . ARG A 1 50 ? -22.700 -13.953 -30.363 1.0 20.38 ? 459 ARG A N 1 50 . A ATOM 378 C CA . ARG A 1 50 ? -22.736 -15.261 -29.723 1.0 19.76 ? 459 ARG A CA 1 50 . A ATOM 379 C C . ARG A 1 50 ? -21.694 -16.173 -30.358 1.0 16.46 ? 459 ARG A C 1 50 . A ATOM 380 O O . ARG A 1 50 ? -21.518 -16.171 -31.577 1.0 20.83 ? 459 ARG A O 1 50 . A ATOM 381 C CB . ARG A 1 50 ? -24.123 -15.893 -29.839 1.0 20.3 ? 459 ARG A CB 1 50 . A ATOM 382 C CG . ARG A 1 50 ? -25.230 -15.131 -29.143 1.0 24.09 ? 459 ARG A CG 1 50 . A ATOM 383 C CD . ARG A 1 50 ? -26.558 -15.841 -29.335 1.0 34.19 ? 459 ARG A CD 1 50 . A ATOM 384 N NE . ARG A 1 50 ? -27.680 -15.083 -28.792 1.0 47.49 ? 459 ARG A NE 1 50 . A ATOM 385 C CZ . ARG A 1 50 ? -28.181 -15.265 -27.575 1.0 39.63 ? 459 ARG A CZ 1 50 . A ATOM 386 N NH1 . ARG A 1 50 ? -27.655 -16.180 -26.771 1.0 41.18 ? 459 ARG A NH1 1 50 . A ATOM 387 N NH2 . ARG A 1 50 ? -29.207 -14.532 -27.162 1.0 37.73 ? 459 ARG A NH2 1 50 . A ATOM 388 N N . TRP A 1 51 ? -21.000 -16.947 -29.532 1.0 21.45 ? 460 TRP A N 1 51 . A ATOM 389 C CA . TRP A 1 51 ? -20.007 -17.888 -30.032 1.0 23.14 ? 460 TRP A CA 1 51 . A ATOM 390 C C . TRP A 1 51 ? -20.409 -19.317 -29.697 1.0 30.73 ? 460 TRP A C 1 51 . A ATOM 391 O O . TRP A 1 51 ? -20.872 -19.601 -28.592 1.0 33.49 ? 460 TRP A O 1 51 . A ATOM 392 C CB . TRP A 1 51 ? -18.626 -17.578 -29.455 1.0 15.45 ? 460 TRP A CB 1 51 . A ATOM 393 C CG . TRP A 1 51 ? -18.091 -16.239 -29.852 1.0 17.83 ? 460 TRP A CG 1 51 . A ATOM 394 C CD1 . TRP A 1 51 ? -17.371 -15.942 -30.974 1.0 17.1 ? 460 TRP A CD1 1 51 . A ATOM 395 C CD2 . TRP A 1 51 ? -18.228 -15.010 -29.126 1.0 11.49 ? 460 TRP A CD2 1 51 . A ATOM 396 N NE1 . TRP A 1 51 ? -17.052 -14.605 -30.992 1.0 14.16 ? 460 TRP A NE1 1 51 . A ATOM 397 C CE2 . TRP A 1 51 ? -17.567 -14.010 -29.869 1.0 11.53 ? 460 TRP A CE2 1 51 . A ATOM 398 C CE3 . TRP A 1 51 ? -18.846 -14.659 -27.923 1.0 10.52 ? 460 TRP A CE3 1 51 . A ATOM 399 C CZ2 . TRP A 1 51 ? -17.507 -12.682 -29.447 1.0 11.89 ? 460 TRP A CZ2 1 51 . A ATOM 400 C CZ3 . TRP A 1 51 ? -18.787 -13.339 -27.505 1.0 13.58 ? 460 TRP A CZ3 1 51 . A ATOM 401 C CH2 . TRP A 1 51 ? -18.120 -12.368 -28.264 1.0 17.13 ? 460 TRP A CH2 1 51 . A ATOM 402 N N . THR A 1 52 ? -20.224 -20.213 -30.659 1.0 32.17 ? 461 THR A N 1 52 . A ATOM 403 C CA . THR A 1 52 ? -20.614 -21.607 -30.494 1.0 45.68 ? 461 THR A CA 1 52 . A ATOM 404 C C . THR A 1 52 ? -19.482 -22.456 -29.925 1.0 38.28 ? 461 THR A C 1 52 . A ATOM 405 O O . THR A 1 52 ? -19.638 -23.661 -29.728 1.0 37.05 ? 461 THR A O 1 52 . A ATOM 406 C CB . THR A 1 52 ? -21.064 -22.212 -31.830 1.0 54.78 ? 461 THR A CB 1 52 . A ATOM 407 O OG1 . THR A 1 52 ? -19.999 -22.101 -32.783 1.0 44.64 ? 461 THR A OG1 1 52 . A ATOM 408 C CG2 . THR A 1 52 ? -22.286 -21.478 -32.359 1.0 56.28 ? 461 THR A CG2 1 52 . A ATOM 409 N N . ASP A 1 53 ? -18.348 -21.820 -29.656 1.0 41.35 ? 462 ASP A N 1 53 . A ATOM 410 C CA . ASP A 1 53 ? -17.154 -22.530 -29.214 1.0 24.56 ? 462 ASP A CA 1 53 . A ATOM 411 C C . ASP A 1 53 ? -17.325 -23.212 -27.865 1.0 24.38 ? 462 ASP A C 1 53 . A ATOM 412 O O . ASP A 1 53 ? -17.913 -22.653 -26.940 1.0 35.62 ? 462 ASP A O 1 53 . A ATOM 413 C CB . ASP A 1 53 ? -15.962 -21.572 -29.146 1.0 27.25 ? 462 ASP A CB 1 53 . A ATOM 414 C CG . ASP A 1 53 ? -15.640 -20.950 -30.487 1.0 44.18 ? 462 ASP A CG 1 53 . A ATOM 415 O OD1 . ASP A 1 53 ? -16.236 -21.374 -31.499 1.0 77.0 ? 462 ASP A OD1 1 53 . A ATOM 416 O OD2 . ASP A 1 53 ? -14.781 -20.047 -30.532 1.0 48.52 ? 462 ASP A OD2 1 53 . A ATOM 417 N N . LYS A 1 54 ? -16.806 -24.431 -27.770 1.0 35.4 ? 463 LYS A N 1 54 . A ATOM 418 C CA . LYS A 1 54 ? -16.701 -25.134 -26.501 1.0 25.34 ? 463 LYS A CA 1 54 . A ATOM 419 C C . LYS A 1 54 ? -15.236 -25.465 -26.254 1.0 21.99 ? 463 LYS A C 1 54 . A ATOM 420 O O . LYS A 1 54 ? -14.655 -26.304 -26.940 1.0 33.42 ? 463 LYS A O 1 54 . A ATOM 421 C CB . LYS A 1 54 ? -17.552 -26.406 -26.496 1.0 28.56 ? 463 LYS A CB 1 54 . A ATOM 422 C CG . LYS A 1 54 ? -19.025 -26.171 -26.785 1.0 38.18 ? 463 LYS A CG 1 54 . A ATOM 423 C CD . LYS A 1 54 ? -19.866 -27.382 -26.406 1.0 48.06 ? 463 LYS A CD 1 54 . A ATOM 424 C CE . LYS A 1 54 ? -19.799 -27.647 -24.908 1.0 45.53 ? 463 LYS A CE 1 54 . A ATOM 425 N NZ . LYS A 1 54 ? -20.750 -28.710 -24.479 1.0 59.53 ? 463 LYS A NZ 1 54 . A ATOM 426 N N . MET A 1 55 ? -14.642 -24.795 -25.275 1.0 22.11 ? 464 MET A N 1 55 . A ATOM 427 C CA . MET A 1 55 ? -13.213 -24.918 -25.016 1.0 17.38 ? 464 MET A CA 1 55 . A ATOM 428 C C . MET A 1 55 ? -12.887 -26.001 -23.997 1.0 17.01 ? 464 MET A C 1 55 . A ATOM 429 O O . MET A 1 55 ? -13.235 -25.890 -22.820 1.0 17.91 ? 464 MET A O 1 55 . A ATOM 430 C CB . MET A 1 55 ? -12.660 -23.580 -24.541 1.0 14.44 ? 464 MET A CB 1 55 . A ATOM 431 C CG . MET A 1 55 ? -12.865 -22.469 -25.539 1.0 15.56 ? 464 MET A CG 1 55 . A ATOM 432 S SD . MET A 1 55 ? -12.746 -20.854 -24.770 1.0 25.95 ? 464 MET A SD 1 55 . A ATOM 433 C CE . MET A 1 55 ? -12.897 -19.801 -26.208 1.0 25.94 ? 464 MET A CE 1 55 . A ATOM 434 N N . ASP A 1 56 ? -12.206 -27.042 -24.461 1.0 11.24 ? 465 ASP A N 1 56 . A ATOM 435 C CA . ASP A 1 56 ? -11.792 -28.142 -23.601 1.0 11.56 ? 465 ASP A CA 1 56 . A ATOM 436 C C . ASP A 1 56 ? -10.373 -27.917 -23.084 1.0 12.22 ? 465 ASP A C 1 56 . A ATOM 437 O O . ASP A 1 56 ? -9.399 -28.103 -23.812 1.0 14.46 ? 465 ASP A O 1 56 . A ATOM 438 C CB . ASP A 1 56 ? -11.887 -29.469 -24.360 1.0 15.87 ? 465 ASP A CB 1 56 . A ATOM 439 C CG . ASP A 1 56 ? -11.487 -30.663 -23.515 1.0 24.12 ? 465 ASP A CG 1 56 . A ATOM 440 O OD1 . ASP A 1 56 ? -11.541 -30.566 -22.271 1.0 20.02 ? 465 ASP A OD1 1 56 . A ATOM 441 O OD2 . ASP A 1 56 ? -11.130 -31.707 -24.102 1.0 25.78 ? 465 ASP A OD2 1 56 . A ATOM 442 N N . PHE A 1 57 ? -10.264 -27.508 -21.825 1.0 9.93 ? 466 PHE A N 1 57 . A ATOM 443 C CA . PHE A 1 57 ? -8.965 -27.298 -21.194 1.0 13.09 ? 466 PHE A CA 1 57 . A ATOM 444 C C . PHE A 1 57 ? -8.369 -28.612 -20.698 1.0 13.92 ? 466 PHE A C 1 57 . A ATOM 445 O O . PHE A 1 57 ? -7.219 -28.649 -20.256 1.0 14.3 ? 466 PHE A O 1 57 . A ATOM 446 C CB . PHE A 1 57 ? -9.085 -26.315 -20.026 1.0 12.94 ? 466 PHE A CB 1 57 . A ATOM 447 C CG . PHE A 1 57 ? -9.266 -24.882 -20.446 1.0 18.5 ? 466 PHE A CG 1 57 . A ATOM 448 C CD1 . PHE A 1 57 ? -10.490 -24.431 -20.916 1.0 11.08 ? 466 PHE A CD1 1 57 . A ATOM 449 C CD2 . PHE A 1 57 ? -8.216 -23.979 -20.349 1.0 18.98 ? 466 PHE A CD2 1 57 . A ATOM 450 C CE1 . PHE A 1 57 ? -10.660 -23.112 -21.294 1.0 13.84 ? 466 PHE A CE1 1 57 . A ATOM 451 C CE2 . PHE A 1 57 ? -8.380 -22.656 -20.725 1.0 13.15 ? 466 PHE A CE2 1 57 . A ATOM 452 C CZ . PHE A 1 57 ? -9.606 -22.222 -21.198 1.0 9.96 ? 466 PHE A CZ 1 57 . A ATOM 453 N N . GLU A 1 58 ? -9.161 -29.681 -20.776 1.0 17.38 ? 467 GLU A N 1 58 . A ATOM 454 C CA . GLU A 1 58 ? -8.784 -30.996 -20.261 1.0 14.51 ? 467 GLU A CA 1 58 . A ATOM 455 C C . GLU A 1 58 ? -8.504 -30.919 -18.760 1.0 20.12 ? 467 GLU A C 1 58 . A ATOM 456 O O . GLU A 1 58 ? -9.137 -30.141 -18.046 1.0 16.48 ? 467 GLU A O 1 58 . A ATOM 457 C CB . GLU A 1 58 ? -7.572 -31.558 -21.014 1.0 20.62 ? 467 GLU A CB 1 58 . A ATOM 458 C CG . GLU A 1 58 ? -7.767 -31.644 -22.527 1.0 16.64 ? 467 GLU A CG 1 58 . A ATOM 459 C CD . GLU A 1 58 ? -6.611 -32.334 -23.239 1.0 24.46 ? 467 GLU A CD 1 58 . A ATOM 460 O OE1 . GLU A 1 58 ? -5.624 -32.712 -22.570 1.0 22.72 ? 467 GLU A OE1 1 58 . A ATOM 461 O OE2 . GLU A 1 58 ? -6.693 -32.504 -24.472 1.0 16.5 ? 467 GLU A OE2 1 58 . A ATOM 462 N N . ASN A 1 59 ? -7.561 -31.724 -18.283 1.0 19.81 ? 468 ASN A N 1 59 . A ATOM 463 C CA . ASN A 1 59 ? -7.266 -31.777 -16.854 1.0 17.8 ? 468 ASN A CA 1 59 . A ATOM 464 C C . ASN A 1 59 ? -6.334 -30.652 -16.419 1.0 17.89 ? 468 ASN A C 1 59 . A ATOM 465 O O . ASN A 1 59 ? -5.236 -30.501 -16.952 1.0 20.92 ? 468 ASN A O 1 59 . A ATOM 466 C CB . ASN A 1 59 ? -6.661 -33.132 -16.486 1.0 12.97 ? 468 ASN A CB 1 59 . A ATOM 467 C CG . ASN A 1 59 ? -7.591 -34.290 -16.801 1.0 21.23 ? 468 ASN A CG 1 59 . A ATOM 468 O OD1 . ASN A 1 59 ? -8.813 -34.149 -16.757 1.0 27.45 ? 468 ASN A OD1 1 59 . A ATOM 469 N ND2 . ASN A 1 59 ? -7.015 -35.441 -17.130 1.0 26.23 ? 468 ASN A ND2 1 59 . A ATOM 470 N N . VAL A 1 60 ? -6.783 -29.862 -15.449 1.0 16.16 ? 469 VAL A N 1 60 . A ATOM 471 C CA . VAL A 1 60 ? -6.008 -28.729 -14.961 1.0 16.9 ? 469 VAL A CA 1 60 . A ATOM 472 C C . VAL A 1 60 ? -5.965 -28.692 -13.437 1.0 19.74 ? 469 VAL A C 1 60 . A ATOM 473 O O . VAL A 1 60 ? -6.783 -29.319 -12.765 1.0 19.28 ? 469 VAL A O 1 60 . A ATOM 474 C CB . VAL A 1 60 ? -6.580 -27.388 -15.468 1.0 19.75 ? 469 VAL A CB 1 60 . A ATOM 475 C CG1 . VAL A 1 60 ? -6.545 -27.328 -16.991 1.0 16.66 ? 469 VAL A CG1 1 60 . A ATOM 476 C CG2 . VAL A 1 60 ? -7.997 -27.181 -14.947 1.0 13.22 ? 469 VAL A CG2 1 60 . A ATOM 477 N N . LEU A 1 61 ? -5.000 -27.955 -12.898 1.0 28.4 ? 470 LEU A N 1 61 . A ATOM 478 C CA . LEU A 1 61 ? -4.916 -27.737 -11.460 1.0 21.58 ? 470 LEU A CA 1 61 . A ATOM 479 C C . LEU A 1 61 ? -5.881 -26.631 -11.061 1.0 25.03 ? 470 LEU A C 1 61 . A ATOM 480 O O . LEU A 1 61 ? -5.586 -25.448 -11.215 1.0 22.73 ? 470 LEU A O 1 61 . A ATOM 481 C CB . LEU A 1 61 ? -3.487 -27.384 -11.047 1.0 28.95 ? 470 LEU A CB 1 61 . A ATOM 482 C CG . LEU A 1 61 ? -2.458 -28.506 -11.180 1.0 24.76 ? 470 LEU A CG 1 61 . A ATOM 483 C CD1 . LEU A 1 61 ? -1.047 -27.960 -11.043 1.0 34.39 ? 470 LEU A CD1 1 61 . A ATOM 484 C CD2 . LEU A 1 61 ? -2.718 -29.583 -10.142 1.0 20.42 ? 470 LEU A CD2 1 61 . A ATOM 485 N N . LEU A 1 62 ? -7.038 -27.026 -10.548 1.0 26.68 ? 471 LEU A N 1 62 . A ATOM 486 C CA . LEU A 1 62 ? -8.107 -26.082 -10.263 1.0 20.87 ? 471 LEU A CA 1 62 . A ATOM 487 C C . LEU A 1 62 ? -7.770 -25.159 -9.095 1.0 31.66 ? 471 LEU A C 1 62 . A ATOM 488 O O . LEU A 1 62 ? -8.230 -24.017 -9.045 1.0 38.87 ? 471 LEU A O 1 62 . A ATOM 489 C CB . LEU A 1 62 ? -9.406 -26.837 -9.978 1.0 28.35 ? 471 LEU A CB 1 62 . A ATOM 490 C CG . LEU A 1 62 ? -10.701 -26.060 -10.206 1.0 24.59 ? 471 LEU A CG 1 62 . A ATOM 491 C CD1 . LEU A 1 62 ? -10.818 -25.644 -11.664 1.0 19.45 ? 471 LEU A CD1 1 62 . A ATOM 492 C CD2 . LEU A 1 62 ? -11.898 -26.895 -9.786 1.0 26.24 ? 471 LEU A CD2 1 62 . A ATOM 493 N N . SER A 1 63 ? -6.958 -25.651 -8.166 1.0 29.14 ? 472 SER A N 1 63 . A ATOM 494 C CA . SER A 1 63 ? -6.665 -24.911 -6.940 1.0 42.97 ? 472 SER A CA 1 63 . A ATOM 495 C C . SER A 1 63 ? -5.556 -23.869 -7.098 1.0 43.51 ? 472 SER A C 1 63 . A ATOM 496 O O . SER A 1 63 ? -5.594 -22.820 -6.457 1.0 48.34 ? 472 SER A O 1 63 . A ATOM 497 C CB . SER A 1 63 ? -6.289 -25.884 -5.821 1.0 32.71 ? 472 SER A CB 1 63 . A ATOM 498 O OG . SER A 1 63 ? -5.136 -26.629 -6.169 1.0 52.02 ? 472 SER A OG 1 63 . A ATOM 499 N N . THR A 1 64 ? -4.572 -24.157 -7.945 1.0 39.11 ? 473 THR A N 1 64 . A ATOM 500 C CA . THR A 1 64 ? -3.399 -23.294 -8.061 1.0 34.65 ? 473 THR A CA 1 64 . A ATOM 501 C C . THR A 1 64 ? -3.182 -22.761 -9.473 1.0 36.24 ? 473 THR A C 1 64 . A ATOM 502 O O . THR A 1 64 ? -2.297 -21.935 -9.700 1.0 32.66 ? 473 THR A O 1 64 . A ATOM 503 C CB . THR A 1 64 ? -2.118 -24.034 -7.631 1.0 48.18 ? 473 THR A CB 1 64 . A ATOM 504 O OG1 . THR A 1 64 ? -1.838 -25.085 -8.565 1.0 47.27 ? 473 THR A OG1 1 64 . A ATOM 505 C CG2 . THR A 1 64 ? -2.276 -24.621 -6.233 1.0 46.24 ? 473 THR A CG2 1 64 . A ATOM 506 N N . GLY A 1 65 ? -3.993 -23.224 -10.418 1.0 34.73 ? 474 GLY A N 1 65 . A ATOM 507 C CA . GLY A 1 65 ? -3.813 -22.874 -11.816 1.0 32.08 ? 474 GLY A CA 1 65 . A ATOM 508 C C . GLY A 1 65 ? -4.195 -21.451 -12.182 1.0 32.66 ? 474 GLY A C 1 65 . A ATOM 509 O O . GLY A 1 65 ? -4.528 -21.170 -13.335 1.0 24.59 ? 474 GLY A O 1 65 . A ATOM 510 N N . GLY A 1 66 ? -4.139 -20.550 -11.206 1.0 55.18 ? 475 GLY A N 1 66 . A ATOM 511 C CA . GLY A 1 66 ? -4.489 -19.160 -11.428 1.0 38.4 ? 475 GLY A CA 1 66 . A ATOM 512 C C . GLY A 1 66 ? -5.980 -18.989 -11.625 1.0 35.18 ? 475 GLY A C 1 66 . A ATOM 513 O O . GLY A 1 66 ? -6.740 -19.951 -11.503 1.0 38.88 ? 475 GLY A O 1 66 . A ATOM 514 N N . PRO A 1 67 ? -6.413 -17.756 -11.923 1.0 30.91 ? 476 PRO A N 1 67 . A ATOM 515 C CA . PRO A 1 67 ? -7.830 -17.475 -12.171 1.0 22.51 ? 476 PRO A CA 1 67 . A ATOM 516 C C . PRO A 1 67 ? -8.255 -17.800 -13.600 1.0 19.82 ? 476 PRO A C 1 67 . A ATOM 517 O O . PRO A 1 67 ? -7.437 -17.748 -14.516 1.0 23.91 ? 476 PRO A O 1 67 . A ATOM 518 C CB . PRO A 1 67 ? -7.930 -15.972 -11.910 1.0 21.56 ? 476 PRO A CB 1 67 . A ATOM 519 C CG . PRO A 1 67 ? -6.586 -15.451 -12.308 1.0 16.05 ? 476 PRO A CG 1 67 . A ATOM 520 C CD . PRO A 1 67 ? -5.596 -16.529 -11.930 1.0 16.11 ? 476 PRO A CD 1 67 . A ATOM 521 N N . LEU A 1 68 ? -9.524 -18.143 -13.783 1.0 23.37 ? 477 LEU A N 1 68 . A ATOM 522 C CA . LEU A 1 68 ? -10.090 -18.227 -15.120 1.0 15.97 ? 477 LEU A CA 1 68 . A ATOM 523 C C . LEU A 1 68 ? -10.351 -16.811 -15.605 1.0 19.94 ? 477 LEU A C 1 68 . A ATOM 524 O O . LEU A 1 68 ? -11.166 -16.093 -15.026 1.0 16.72 ? 477 LEU A O 1 68 . A ATOM 525 C CB . LEU A 1 68 ? -11.376 -19.051 -15.127 1.0 18.45 ? 477 LEU A CB 1 68 . A ATOM 526 C CG . LEU A 1 68 ? -12.141 -19.125 -16.449 1.0 15.99 ? 477 LEU A CG 1 68 . A ATOM 527 C CD1 . LEU A 1 68 ? -11.250 -19.659 -17.559 1.0 15.27 ? 477 LEU A CD1 1 68 . A ATOM 528 C CD2 . LEU A 1 68 ? -13.375 -19.998 -16.289 1.0 17.21 ? 477 LEU A CD2 1 68 . A ATOM 529 N N . ARG A 1 69 ? -9.645 -16.400 -16.652 1.0 14.36 ? 478 ARG A N 1 69 . A ATOM 530 C CA . ARG A 1 69 ? -9.756 -15.030 -17.132 1.0 13.41 ? 478 ARG A CA 1 69 . A ATOM 531 C C . ARG A 1 69 ? -10.336 -14.956 -18.536 1.0 15.54 ? 478 ARG A C 1 69 . A ATOM 532 O O . ARG A 1 69 ? -9.832 -15.585 -19.466 1.0 16.49 ? 478 ARG A O 1 69 . A ATOM 533 C CB . ARG A 1 69 ? -8.394 -14.340 -17.097 1.0 19.94 ? 478 ARG A CB 1 69 . A ATOM 534 C CG . ARG A 1 69 ? -8.405 -12.935 -17.680 1.0 22.3 ? 478 ARG A CG 1 69 . A ATOM 535 C CD . ARG A 1 69 ? -7.102 -12.219 -17.394 1.0 29.79 ? 478 ARG A CD 1 69 . A ATOM 536 N NE . ARG A 1 69 ? -6.942 -11.943 -15.970 1.0 39.39 ? 478 ARG A NE 1 69 . A ATOM 537 C CZ . ARG A 1 69 ? -5.790 -11.610 -15.400 1.0 37.12 ? 478 ARG A CZ 1 69 . A ATOM 538 N NH1 . ARG A 1 69 ? -4.686 -11.521 -16.131 1.0 35.59 ? 478 ARG A NH1 1 69 . A ATOM 539 N NH2 . ARG A 1 69 ? -5.739 -11.376 -14.096 1.0 30.41 ? 478 ARG A NH2 1 69 . A ATOM 540 N N . VAL A 1 70 ? -11.402 -14.179 -18.679 1.0 14.32 ? 479 VAL A N 1 70 . A ATOM 541 C CA . VAL A 1 70 ? -12.013 -13.962 -19.979 1.0 16.06 ? 479 VAL A CA 1 70 . A ATOM 542 C C . VAL A 1 70 ? -11.854 -12.509 -20.402 1.0 19.7 ? 479 VAL A C 1 70 . A ATOM 543 O O . VAL A 1 70 ? -12.301 -11.596 -19.707 1.0 20.38 ? 479 VAL A O 1 70 . A ATOM 544 C CB . VAL A 1 70 ? -13.505 -14.336 -19.975 1.0 10.74 ? 479 VAL A CB 1 70 . A ATOM 545 C CG1 . VAL A 1 70 ? -14.142 -13.987 -21.307 1.0 8.49 ? 479 VAL A CG1 1 70 . A ATOM 546 C CG2 . VAL A 1 70 ? -13.676 -15.817 -19.666 1.0 13.92 ? 479 VAL A CG2 1 70 . A ATOM 547 N N . GLN A 1 71 ? -11.198 -12.301 -21.538 1.0 21.55 ? 480 GLN A N 1 71 . A ATOM 548 C CA . GLN A 1 71 ? -11.031 -10.966 -22.094 1.0 16.41 ? 480 GLN A CA 1 71 . A ATOM 549 C C . GLN A 1 71 ? -11.957 -10.765 -23.282 1.0 14.85 ? 480 GLN A C 1 71 . A ATOM 550 O O . GLN A 1 71 ? -12.041 -11.620 -24.164 1.0 16.62 ? 480 GLN A O 1 71 . A ATOM 551 C CB . GLN A 1 71 ? -9.582 -10.728 -22.520 1.0 17.6 ? 480 GLN A CB 1 71 . A ATOM 552 C CG . GLN A 1 71 ? -8.636 -10.369 -21.388 1.0 15.66 ? 480 GLN A CG 1 71 . A ATOM 553 C CD . GLN A 1 71 ? -7.232 -10.072 -21.887 1.0 23.61 ? 480 GLN A CD 1 71 . A ATOM 554 O OE1 . GLN A 1 71 ? -6.869 -10.435 -23.008 1.0 18.39 ? 480 GLN A OE1 1 71 . A ATOM 555 N NE2 . GLN A 1 71 ? -6.437 -9.405 -21.059 1.0 20.44 ? 480 GLN A NE2 1 71 . A ATOM 556 N N . VAL A 1 72 ? -12.653 -9.633 -23.298 1.0 14.37 ? 481 VAL A N 1 72 . A ATOM 557 C CA . VAL A 1 72 ? -13.510 -9.279 -24.422 1.0 18.28 ? 481 VAL A CA 1 72 . A ATOM 558 C C . VAL A 1 72 ? -12.830 -8.215 -25.276 1.0 19.85 ? 481 VAL A C 1 72 . A ATOM 559 O O . VAL A 1 72 ? -12.574 -7.106 -24.811 1.0 19.36 ? 481 VAL A O 1 72 . A ATOM 560 C CB . VAL A 1 72 ? -14.880 -8.762 -23.954 1.0 17.61 ? 481 VAL A CB 1 72 . A ATOM 561 C CG1 . VAL A 1 72 ? -15.788 -8.520 -25.150 1.0 11.92 ? 481 VAL A CG1 1 72 . A ATOM 562 C CG2 . VAL A 1 72 ? -15.513 -9.748 -22.989 1.0 24.58 ? 481 VAL A CG2 1 72 . A ATOM 563 N N . TRP A 1 73 ? -12.536 -8.562 -26.525 1.0 14.18 ? 482 TRP A N 1 73 . A ATOM 564 C CA . TRP A 1 73 ? -11.822 -7.663 -27.423 1.0 12.1 ? 482 TRP A CA 1 73 . A ATOM 565 C C . TRP A 1 73 ? -12.670 -7.257 -28.616 1.0 13.64 ? 482 TRP A C 1 73 . A ATOM 566 O O . TRP A 1 73 ? -13.491 -8.032 -29.095 1.0 16.18 ? 482 TRP A O 1 73 . A ATOM 567 C CB . TRP A 1 73 ? -10.533 -8.317 -27.930 1.0 15.64 ? 482 TRP A CB 1 73 . A ATOM 568 C CG . TRP A 1 73 ? -9.463 -8.468 -26.898 1.0 14.37 ? 482 TRP A CG 1 73 . A ATOM 569 C CD1 . TRP A 1 73 ? -9.377 -9.435 -25.940 1.0 17.51 ? 482 TRP A CD1 1 73 . A ATOM 570 C CD2 . TRP A 1 73 ? -8.312 -7.633 -26.730 1.0 19.72 ? 482 TRP A CD2 1 73 . A ATOM 571 N NE1 . TRP A 1 73 ? -8.247 -9.249 -25.180 1.0 23.9 ? 482 TRP A NE1 1 73 . A ATOM 572 C CE2 . TRP A 1 73 ? -7.575 -8.148 -25.645 1.0 19.72 ? 482 TRP A CE2 1 73 . A ATOM 573 C CE3 . TRP A 1 73 ? -7.834 -6.496 -27.390 1.0 18.08 ? 482 TRP A CE3 1 73 . A ATOM 574 C CZ2 . TRP A 1 73 ? -6.389 -7.568 -25.204 1.0 13.36 ? 482 TRP A CZ2 1 73 . A ATOM 575 C CZ3 . TRP A 1 73 ? -6.657 -5.922 -26.952 1.0 21.14 ? 482 TRP A CZ3 1 73 . A ATOM 576 C CH2 . TRP A 1 73 ? -5.947 -6.459 -25.869 1.0 21.77 ? 482 TRP A CH2 1 73 . A ATOM 577 N N . ASP A 1 74 ? -12.463 -6.035 -29.092 1.0 15.94 ? 483 ASP A N 1 74 . A ATOM 578 C CA . ASP A 1 74 ? -12.995 -5.625 -30.382 1.0 10.88 ? 483 ASP A CA 1 74 . A ATOM 579 C C . ASP A 1 74 ? -11.864 -5.653 -31.399 1.0 19.41 ? 483 ASP A C 1 74 . A ATOM 580 O O . ASP A 1 74 ? -10.742 -5.246 -31.103 1.0 12.39 ? 483 ASP A O 1 74 . A ATOM 581 C CB . ASP A 1 74 ? -13.623 -4.232 -30.317 1.0 12.41 ? 483 ASP A CB 1 74 . A ATOM 582 C CG . ASP A 1 74 ? -13.789 -3.604 -31.694 1.0 15.69 ? 483 ASP A CG 1 74 . A ATOM 583 O OD1 . ASP A 1 74 ? -14.706 -4.020 -32.434 1.0 12.88 ? 483 ASP A OD1 1 74 . A ATOM 584 O OD2 . ASP A 1 74 ? -13.002 -2.696 -32.038 1.0 14.13 ? 483 ASP A OD2 1 74 . A ATOM 585 N N . ALA A 1 75 ? -12.156 -6.141 -32.597 1.0 19.52 ? 484 ALA A N 1 75 . A ATOM 586 C CA . ALA A 1 75 ? -11.135 -6.249 -33.624 1.0 11.71 ? 484 ALA A CA 1 75 . A ATOM 587 C C . ALA A 1 75 ? -11.151 -5.032 -34.534 1.0 14.49 ? 484 ALA A C 1 75 . A ATOM 588 O O . ALA A 1 75 ? -12.131 -4.781 -35.235 1.0 22.57 ? 484 ALA A O 1 75 . A ATOM 589 C CB . ALA A 1 75 ? -11.327 -7.524 -34.434 1.0 12.64 ? 484 ALA A CB 1 75 . A ATOM 590 N N . ASP A 1 76 ? -10.068 -4.264 -34.502 1.0 15.19 ? 485 ASP A N 1 76 . A ATOM 591 C CA . ASP A 1 76 ? -9.857 -3.214 -35.486 1.0 19.65 ? 485 ASP A CA 1 76 . A ATOM 592 C C . ASP A 1 76 ? -8.874 -3.723 -36.531 1.0 30.85 ? 485 ASP A C 1 76 . A ATOM 593 O O . ASP A 1 76 ? -7.673 -3.818 -36.271 1.0 29.79 ? 485 ASP A O 1 76 . A ATOM 594 C CB . ASP A 1 76 ? -9.350 -1.931 -34.829 1.0 10.33 ? 485 ASP A CB 1 76 . A ATOM 595 C CG . ASP A 1 76 ? -10.441 -1.191 -34.077 1.0 21.72 ? 485 ASP A CG 1 76 . A ATOM 596 O OD1 . ASP A 1 76 ? -11.630 -1.397 -34.399 1.0 14.33 ? 485 ASP A OD1 1 76 . A ATOM 597 O OD2 . ASP A 1 76 ? -10.114 -0.396 -33.171 1.0 24.26 ? 485 ASP A OD2 1 76 . A ATOM 598 N N . ALA A 1 77 ? -9.397 -4.059 -37.709 1.0 42.65 ? 486 ALA A N 1 77 . A ATOM 599 C CA . ALA A 1 77 ? -8.609 -4.674 -38.777 1.0 53.81 ? 486 ALA A CA 1 77 . A ATOM 600 C C . ALA A 1 77 ? -7.414 -3.811 -39.175 1.0 53.92 ? 486 ALA A C 1 77 . A ATOM 601 O O . ALA A 1 77 ? -6.454 -4.299 -39.771 1.0 61.66 ? 486 ALA A O 1 77 . A ATOM 602 C CB . ALA A 1 77 ? -9.488 -4.953 -39.986 1.0 52.02 ? 486 ALA A CB 1 77 . A ATOM 603 N N . GLY A 1 78 ? -7.483 -2.527 -38.843 1.0 36.88 ? 487 GLY A N 1 78 . A ATOM 604 C CA . GLY A 1 78 ? -6.322 -1.663 -38.912 1.0 57.3 ? 487 GLY A CA 1 78 . A ATOM 605 C C . GLY A 1 78 ? -5.438 -1.878 -37.695 1.0 46.54 ? 487 GLY A C 1 78 . A ATOM 606 O O . GLY A 1 78 ? -5.367 -1.025 -36.809 1.0 50.85 ? 487 GLY A O 1 78 . A ATOM 607 N N . ALA A 1 79 ? -4.788 -3.040 -37.653 1.0 62.08 ? 488 ALA A N 1 79 . A ATOM 608 C CA . ALA A 1 79 ? -3.816 -3.398 -36.614 1.0 71.55 ? 488 ALA A CA 1 79 . A ATOM 609 C C . ALA A 1 79 ? -4.398 -3.472 -35.198 1.0 61.81 ? 488 ALA A C 1 79 . A ATOM 610 O O . ALA A 1 79 ? -5.046 -4.455 -34.841 1.0 44.73 ? 488 ALA A O 1 79 . A ATOM 611 C CB . ALA A 1 79 ? -2.639 -2.425 -36.641 1.0 65.8 ? 488 ALA A CB 1 79 . A ATOM 612 N N . ASP A 1 80 ? -4.155 -2.430 -34.403 1.0 50.29 ? 489 ASP A N 1 80 . A ATOM 613 C CA . ASP A 1 80 ? -4.365 -2.472 -32.955 1.0 45.15 ? 489 ASP A CA 1 80 . A ATOM 614 C C . ASP A 1 80 ? -5.826 -2.576 -32.489 1.0 34.71 ? 489 ASP A C 1 80 . A ATOM 615 O O . ASP A 1 80 ? -6.656 -1.716 -32.769 1.0 25.18 ? 489 ASP A O 1 80 . A ATOM 616 C CB . ASP A 1 80 ? -3.702 -1.248 -32.315 1.0 49.6 ? 489 ASP A CB 1 80 . A ATOM 617 C CG . ASP A 1 80 ? -2.230 -1.114 -32.681 1.0 62.54 ? 489 ASP A CG 1 80 . A ATOM 618 O OD1 . ASP A 1 80 ? -1.756 -1.868 -33.556 1.0 66.6 ? 489 ASP A OD1 1 80 . A ATOM 619 O OD2 . ASP A 1 80 ? -1.543 -0.268 -32.062 1.0 64.74 ? 489 ASP A OD2 1 80 . A ATOM 620 N N . ASP A 1 81 ? -6.112 -3.641 -31.746 1.0 31.99 ? 490 ASP A N 1 81 . A ATOM 621 C CA . ASP A 1 81 ? -7.457 -3.922 -31.257 1.0 21.35 ? 490 ASP A CA 1 81 . A ATOM 622 C C . ASP A 1 81 ? -7.758 -3.243 -29.916 1.0 22.44 ? 490 ASP A C 1 81 . A ATOM 623 O O . ASP A 1 81 ? -6.873 -2.657 -29.296 1.0 23.94 ? 490 ASP A O 1 81 . A ATOM 624 C CB . ASP A 1 81 ? -7.659 -5.433 -31.132 1.0 12.32 ? 490 ASP A CB 1 81 . A ATOM 625 C CG . ASP A 1 81 ? -7.545 -6.149 -32.466 1.0 18.24 ? 490 ASP A CG 1 81 . A ATOM 626 O OD1 . ASP A 1 81 ? -7.575 -5.470 -33.515 1.0 21.51 ? 490 ASP A OD1 1 81 . A ATOM 627 O OD2 . ASP A 1 81 ? -7.440 -7.394 -32.470 1.0 15.57 ? 490 ASP A OD2 1 81 . A ATOM 628 N N . ASP A 1 82 ? -9.010 -3.328 -29.472 1.0 19.21 ? 491 ASP A N 1 82 . A ATOM 629 C CA . ASP A 1 82 ? -9.433 -2.666 -28.241 1.0 18.47 ? 491 ASP A CA 1 82 . A ATOM 630 C C . ASP A 1 82 ? -9.883 -3.656 -27.169 1.0 21.11 ? 491 ASP A C 1 82 . A ATOM 631 O O . ASP A 1 82 ? -10.696 -4.545 -27.436 1.0 12.24 ? 491 ASP A O 1 82 . A ATOM 632 C CB . ASP A 1 82 ? -10.571 -1.687 -28.530 1.0 15.21 ? 491 ASP A CB 1 82 . A ATOM 633 C CG . ASP A 1 82 ? -10.259 -0.744 -29.673 1.0 24.48 ? 491 ASP A CG 1 82 . A ATOM 634 O OD1 . ASP A 1 82 ? -9.073 -0.410 -29.873 1.0 32.26 ? 491 ASP A OD1 1 82 . A ATOM 635 O OD2 . ASP A 1 82 ? -11.207 -0.338 -30.376 1.0 26.53 ? 491 ASP A OD2 1 82 . A ATOM 636 N N . LEU A 1 83 ? -9.359 -3.494 -25.958 1.0 16.46 ? 492 LEU A N 1 83 . A ATOM 637 C CA . LEU A 1 83 ? -9.786 -4.311 -24.827 1.0 14.15 ? 492 LEU A CA 1 83 . A ATOM 638 C C . LEU A 1 83 ? -11.025 -3.705 -24.186 1.0 14.38 ? 492 LEU A C 1 83 . A ATOM 639 O O . LEU A 1 83 ? -10.945 -2.690 -23.495 1.0 21.69 ? 492 LEU A O 1 83 . A ATOM 640 C CB . LEU A 1 83 ? -8.668 -4.448 -23.792 1.0 19.58 ? 492 LEU A CB 1 83 . A ATOM 641 C CG . LEU A 1 83 ? -9.027 -5.233 -22.527 1.0 17.47 ? 492 LEU A CG 1 83 . A ATOM 642 C CD1 . LEU A 1 83 ? -9.474 -6.646 -22.875 1.0 13.25 ? 492 LEU A CD1 1 83 . A ATOM 643 C CD2 . LEU A 1 83 ? -7.857 -5.265 -21.555 1.0 8.4 ? 492 LEU A CD2 1 83 . A ATOM 644 N N . LEU A 1 84 ? -12.171 -4.335 -24.417 1.0 12.09 ? 493 LEU A N 1 84 . A ATOM 645 C CA . LEU A 1 84 ? -13.441 -3.805 -23.941 1.0 15.06 ? 493 LEU A CA 1 84 . A ATOM 646 C C . LEU A 1 84 ? -13.650 -4.061 -22.451 1.0 18.48 ? 493 LEU A C 1 84 . A ATOM 647 O O . LEU A 1 84 ? -14.409 -3.354 -21.791 1.0 25.36 ? 493 LEU A O 1 84 . A ATOM 648 C CB . LEU A 1 84 ? -14.594 -4.406 -24.745 1.0 11.39 ? 493 LEU A CB 1 84 . A ATOM 649 C CG . LEU A 1 84 ? -14.501 -4.216 -26.262 1.0 14.62 ? 493 LEU A CG 1 84 . A ATOM 650 C CD1 . LEU A 1 84 ? -15.740 -4.766 -26.955 1.0 15.4 ? 493 LEU A CD1 1 84 . A ATOM 651 C CD2 . LEU A 1 84 ? -14.289 -2.749 -26.610 1.0 9.5 ? 493 LEU A CD2 1 84 . A ATOM 652 N N . GLY A 1 85 ? -12.973 -5.071 -21.922 1.0 15.79 ? 494 GLY A N 1 85 . A ATOM 653 C CA . GLY A 1 85 ? -13.127 -5.431 -20.527 1.0 19.72 ? 494 GLY A CA 1 85 . A ATOM 654 C C . GLY A 1 85 ? -12.624 -6.831 -20.252 1.0 19.45 ? 494 GLY A C 1 85 . A ATOM 655 O O . GLY A 1 85 ? -12.458 -7.631 -21.172 1.0 16.38 ? 494 GLY A O 1 85 . A ATOM 656 N N . SER A 1 86 ? -12.382 -7.127 -18.979 1.0 22.64 ? 495 SER A N 1 86 . A ATOM 657 C CA . SER A 1 86 ? -11.833 -8.416 -18.588 1.0 21.27 ? 495 SER A CA 1 86 . A ATOM 658 C C . SER A 1 86 ? -12.530 -8.955 -17.343 1.0 22.44 ? 495 SER A C 1 86 . A ATOM 659 O O . SER A 1 86 ? -12.918 -8.195 -16.458 1.0 27.28 ? 495 SER A O 1 86 . A ATOM 660 C CB . SER A 1 86 ? -10.328 -8.302 -18.346 1.0 20.87 ? 495 SER A CB 1 86 . A ATOM 661 O OG . SER A 1 86 ? -9.736 -9.580 -18.203 1.0 40.33 ? 495 SER A OG 1 86 . A ATOM 662 N N . CYS A 1 87 ? -12.684 -10.272 -17.286 1.0 31.54 ? 496 CYS A N 1 87 . A ATOM 663 C CA . CYS A 1 87 ? -13.361 -10.920 -16.171 1.0 33.9 ? 496 CYS A CA 1 87 . A ATOM 664 C C . CYS A 1 87 ? -12.486 -11.977 -15.511 1.0 29.67 ? 496 CYS A C 1 87 . A ATOM 665 O O . CYS A 1 87 ? -11.888 -12.809 -16.190 1.0 29.51 ? 496 CYS A O 1 87 . A ATOM 666 C CB . CYS A 1 87 ? -14.668 -11.557 -16.642 1.0 31.55 ? 496 CYS A CB 1 87 . A ATOM 667 S SG . CYS A 1 87 ? -15.351 -12.753 -15.479 1.0 68.53 ? 496 CYS A SG 1 87 . A ATOM 668 N N . ASP A 1 88 ? -12.420 -11.942 -14.184 1.0 35.33 ? 497 ASP A N 1 88 . A ATOM 669 C CA . ASP A 1 88 ? -11.673 -12.941 -13.426 1.0 29.09 ? 497 ASP A CA 1 88 . A ATOM 670 C C . ASP A 1 88 ? -12.587 -13.719 -12.486 1.0 20.84 ? 497 ASP A C 1 88 . A ATOM 671 O O . ASP A 1 88 ? -13.380 -13.134 -11.749 1.0 27.37 ? 497 ASP A O 1 88 . A ATOM 672 C CB . ASP A 1 88 ? -10.547 -12.286 -12.622 1.0 32.59 ? 497 ASP A CB 1 88 . A ATOM 673 C CG . ASP A 1 88 ? -9.357 -11.907 -13.480 1.0 39.57 ? 497 ASP A CG 1 88 . A ATOM 674 O OD1 . ASP A 1 88 ? -9.557 -11.546 -14.659 1.0 46.89 ? 497 ASP A OD1 1 88 . A ATOM 675 O OD2 . ASP A 1 88 ? -8.218 -11.967 -12.970 1.0 39.78 ? 497 ASP A OD2 1 88 . A ATOM 676 N N . ARG A 1 89 ? -12.473 -15.041 -12.522 1.0 18.32 ? 498 ARG A N 1 89 . A ATOM 677 C CA . ARG A 1 89 ? -13.193 -15.904 -11.593 1.0 22.01 ? 498 ARG A CA 1 89 . A ATOM 678 C C . ARG A 1 89 ? -12.266 -16.993 -11.073 1.0 23.92 ? 498 ARG A C 1 89 . A ATOM 679 O O . ARG A 1 89 ? -11.409 -17.485 -11.806 1.0 20.97 ? 498 ARG A O 1 89 . A ATOM 680 C CB . ARG A 1 89 ? -14.417 -16.539 -12.261 1.0 23.31 ? 498 ARG A CB 1 89 . A ATOM 681 C CG . ARG A 1 89 ? -15.507 -15.563 -12.672 1.0 23.04 ? 498 ARG A CG 1 89 . A ATOM 682 C CD . ARG A 1 89 ? -16.181 -14.942 -11.466 1.0 20.25 ? 498 ARG A CD 1 89 . A ATOM 683 N NE . ARG A 1 89 ? -17.303 -14.091 -11.849 1.0 29.5 ? 498 ARG A NE 1 89 . A ATOM 684 C CZ . ARG A 1 89 ? -17.190 -12.805 -12.167 1.0 34.62 ? 498 ARG A CZ 1 89 . A ATOM 685 N NH1 . ARG A 1 89 ? -16.000 -12.218 -12.150 1.0 20.88 ? 498 ARG A NH1 1 89 . A ATOM 686 N NH2 . ARG A 1 89 ? -18.265 -12.104 -12.503 1.0 17.31 ? 498 ARG A NH2 1 89 . A ATOM 687 N N . SER A 1 90 ? -12.432 -17.359 -9.805 1.0 22.74 ? 499 SER A N 1 90 . A ATOM 688 C CA . SER A 1 90 ? -11.745 -18.522 -9.256 1.0 27.31 ? 499 SER A CA 1 90 . A ATOM 689 C C . SER A 1 90 ? -12.665 -19.730 -9.356 1.0 29.06 ? 499 SER A C 1 90 . A ATOM 690 O O . SER A 1 90 ? -13.602 -19.861 -8.568 1.0 31.44 ? 499 SER A O 1 90 . A ATOM 691 C CB . SER A 1 90 ? -11.325 -18.284 -7.806 1.0 27.42 ? 499 SER A CB 1 90 . A ATOM 692 O OG . SER A 1 90 ? -10.352 -17.258 -7.716 1.0 34.95 ? 499 SER A OG 1 90 . A ATOM 693 N N . PRO A 1 91 ? -12.402 -20.613 -10.332 1.0 26.3 ? 500 PRO A N 1 91 . A ATOM 694 C CA . PRO A 1 91 ? -13.284 -21.742 -10.649 1.0 27.64 ? 500 PRO A CA 1 91 . A ATOM 695 C C . PRO A 1 91 ? -13.490 -22.688 -9.470 1.0 31.03 ? 500 PRO A C 1 91 . A ATOM 696 O O . PRO A 1 91 ? -12.551 -22.966 -8.725 1.0 30.31 ? 500 PRO A O 1 91 . A ATOM 697 C CB . PRO A 1 91 ? -12.548 -22.461 -11.789 1.0 23.26 ? 500 PRO A CB 1 91 . A ATOM 698 C CG . PRO A 1 91 ? -11.592 -21.459 -12.334 1.0 19.58 ? 500 PRO A CG 1 91 . A ATOM 699 C CD . PRO A 1 91 ? -11.190 -20.615 -11.168 1.0 26.61 ? 500 PRO A CD 1 91 . A ATOM 700 N N . HIS A 1 92 ? -14.719 -23.165 -9.308 1.0 31.92 ? 501 HIS A N 1 92 . A ATOM 701 C CA . HIS A 1 92 ? -15.026 -24.180 -8.311 1.0 27.62 ? 501 HIS A CA 1 92 . A ATOM 702 C C . HIS A 1 92 ? -15.626 -25.396 -9.002 1.0 21.86 ? 501 HIS A C 1 92 . A ATOM 703 O O . HIS A 1 92 ? -16.130 -25.291 -10.117 1.0 26.96 ? 501 HIS A O 1 92 . A ATOM 704 C CB . HIS A 1 92 ? -15.981 -23.631 -7.250 1.0 32.24 ? 501 HIS A CB 1 92 . A ATOM 705 C CG . HIS A 1 92 ? -15.390 -22.536 -6.419 1.0 53.13 ? 501 HIS A CG 1 92 . A ATOM 706 N ND1 . HIS A 1 92 ? -15.491 -21.204 -6.759 1.0 58.89 ? 501 HIS A ND1 1 92 . A ATOM 707 C CD2 . HIS A 1 92 ? -14.679 -22.577 -5.267 1.0 46.83 ? 501 HIS A CD2 1 92 . A ATOM 708 C CE1 . HIS A 1 92 ? -14.873 -20.471 -5.849 1.0 55.32 ? 501 HIS A CE1 1 92 . A ATOM 709 N NE2 . HIS A 1 92 ? -14.371 -21.280 -4.934 1.0 59.78 ? 501 HIS A NE2 1 92 . A ATOM 710 N N . SER A 1 93 ? -15.562 -26.548 -8.346 1.0 27.34 ? 502 SER A N 1 93 . A ATOM 711 C CA . SER A 1 93 ? -16.092 -27.775 -8.927 1.0 28.06 ? 502 SER A CA 1 93 . A ATOM 712 C C . SER A 1 93 ? -17.582 -27.635 -9.223 1.0 22.54 ? 502 SER A C 1 93 . A ATOM 713 O O . SER A 1 93 ? -18.312 -26.980 -8.480 1.0 25.33 ? 502 SER A O 1 93 . A ATOM 714 C CB . SER A 1 93 ? -15.848 -28.963 -7.996 1.0 19.65 ? 502 SER A CB 1 93 . A ATOM 715 O OG . SER A 1 93 ? -16.549 -28.801 -6.777 1.0 26.22 ? 502 SER A OG 1 93 . A ATOM 716 N N . GLY A 1 94 ? -18.023 -28.241 -10.319 1.0 19.7 ? 503 GLY A N 1 94 . A ATOM 717 C CA . GLY A 1 94 ? -19.424 -28.206 -10.694 1.0 17.76 ? 503 GLY A CA 1 94 . A ATOM 718 C C . GLY A 1 94 ? -19.699 -27.337 -11.907 1.0 22.69 ? 503 GLY A C 1 94 . A ATOM 719 O O . GLY A 1 94 ? -18.779 -26.835 -12.551 1.0 14.88 ? 503 GLY A O 1 94 . A ATOM 720 N N . PHE A 1 95 ? -20.979 -27.167 -12.222 1.0 21.78 ? 504 PHE A N 1 95 . A ATOM 721 C CA . PHE A 1 95 ? -21.390 -26.335 -13.344 1.0 22.9 ? 504 PHE A CA 1 95 . A ATOM 722 C C . PHE A 1 95 ? -21.758 -24.944 -12.846 1.0 17.92 ? 504 PHE A C 1 95 . A ATOM 723 O O . PHE A 1 95 ? -22.533 -24.799 -11.902 1.0 20.4 ? 504 PHE A O 1 95 . A ATOM 724 C CB . PHE A 1 95 ? -22.570 -26.972 -14.083 1.0 20.4 ? 504 PHE A CB 1 95 . A ATOM 725 C CG . PHE A 1 95 ? -22.992 -26.222 -15.315 1.0 18.59 ? 504 PHE A CG 1 95 . A ATOM 726 C CD1 . PHE A 1 95 ? -22.391 -26.478 -16.536 1.0 22.99 ? 504 PHE A CD1 1 95 . A ATOM 727 C CD2 . PHE A 1 95 ? -23.994 -25.265 -15.253 1.0 19.79 ? 504 PHE A CD2 1 95 . A ATOM 728 C CE1 . PHE A 1 95 ? -22.778 -25.790 -17.674 1.0 19.09 ? 504 PHE A CE1 1 95 . A ATOM 729 C CE2 . PHE A 1 95 ? -24.384 -24.575 -16.385 1.0 21.36 ? 504 PHE A CE2 1 95 . A ATOM 730 C CZ . PHE A 1 95 ? -23.775 -24.839 -17.598 1.0 12.46 ? 504 PHE A CZ 1 95 . A ATOM 731 N N . HIS A 1 96 ? -21.202 -23.920 -13.482 1.0 17.7 ? 505 HIS A N 1 96 . A ATOM 732 C CA . HIS A 1 96 ? -21.443 -22.551 -13.046 1.0 19.05 ? 505 HIS A CA 1 96 . A ATOM 733 C C . HIS A 1 96 ? -21.744 -21.611 -14.204 1.0 21.02 ? 505 HIS A C 1 96 . A ATOM 734 O O . HIS A 1 96 ? -21.105 -21.666 -15.255 1.0 22.47 ? 505 HIS A O 1 96 . A ATOM 735 C CB . HIS A 1 96 ? -20.241 -22.030 -12.260 1.0 13.32 ? 505 HIS A CB 1 96 . A ATOM 736 C CG . HIS A 1 96 ? -19.908 -22.855 -11.060 1.0 19.87 ? 505 HIS A CG 1 96 . A ATOM 737 N ND1 . HIS A 1 96 ? -20.401 -22.576 -9.804 1.0 27.06 ? 505 HIS A ND1 1 96 . A ATOM 738 C CD2 . HIS A 1 96 ? -19.142 -23.964 -10.925 1.0 22.44 ? 505 HIS A CD2 1 96 . A ATOM 739 C CE1 . HIS A 1 96 ? -19.947 -23.471 -8.946 1.0 36.06 ? 505 HIS A CE1 1 96 . A ATOM 740 N NE2 . HIS A 1 96 ? -19.180 -24.325 -9.601 1.0 28.16 ? 505 HIS A NE2 1 96 . A ATOM 741 N N . GLU A 1 97 ? -22.731 -20.750 -13.998 1.0 14.08 ? 506 GLU A N 1 97 . A ATOM 742 C CA . GLU A 1 97 ? -23.046 -19.706 -14.957 1.0 23.61 ? 506 GLU A CA 1 97 . A ATOM 743 C C . GLU A 1 97 ? -22.434 -18.391 -14.483 1.0 17.0 ? 506 GLU A C 1 97 . A ATOM 744 O O . GLU A 1 97 ? -22.598 -18.000 -13.328 1.0 25.13 ? 506 GLU A O 1 97 . A ATOM 745 C CB . GLU A 1 97 ? -24.559 -19.590 -15.143 1.0 17.59 ? 506 GLU A CB 1 97 . A ATOM 746 C CG . GLU A 1 97 ? -25.179 -20.859 -15.719 1.0 19.84 ? 506 GLU A CG 1 97 . A ATOM 747 C CD . GLU A 1 97 ? -26.686 -20.793 -15.827 1.0 34.3 ? 506 GLU A CD 1 97 . A ATOM 748 O OE1 . GLU A 1 97 ? -27.280 -19.816 -15.324 1.0 60.31 ? 506 GLU A OE1 1 97 . A ATOM 749 O OE2 . GLU A 1 97 ? -27.278 -21.723 -16.415 1.0 46.93 ? 506 GLU A OE2 1 97 . A ATOM 750 N N . VAL A 1 98 ? -21.707 -17.727 -15.374 1.0 20.85 ? 507 VAL A N 1 98 . A ATOM 751 C CA . VAL A 1 98 ? -20.973 -16.520 -15.016 1.0 18.99 ? 507 VAL A CA 1 98 . A ATOM 752 C C . VAL A 1 98 ? -21.468 -15.313 -15.804 1.0 22.75 ? 507 VAL A C 1 98 . A ATOM 753 O O . VAL A 1 98 ? -21.725 -15.404 -17.008 1.0 20.14 ? 507 VAL A O 1 98 . A ATOM 754 C CB . VAL A 1 98 ? -19.456 -16.695 -15.258 1.0 19.19 ? 507 VAL A CB 1 98 . A ATOM 755 C CG1 . VAL A 1 98 ? -18.695 -15.450 -14.835 1.0 22.96 ? 507 VAL A CG1 1 98 . A ATOM 756 C CG2 . VAL A 1 98 ? -18.937 -17.912 -14.515 1.0 11.93 ? 507 VAL A CG2 1 98 . A ATOM 757 N N . THR A 1 99 ? -21.608 -14.185 -15.115 1.0 21.06 ? 508 THR A N 1 99 . A ATOM 758 C CA . THR A 1 99 ? -21.940 -12.926 -15.765 1.0 22.66 ? 508 THR A CA 1 99 . A ATOM 759 C C . THR A 1 99 ? -20.923 -11.851 -15.393 1.0 20.62 ? 508 THR A C 1 99 . A ATOM 760 O O . THR A 1 99 ? -20.830 -11.447 -14.235 1.0 25.65 ? 508 THR A O 1 99 . A ATOM 761 C CB . THR A 1 99 ? -23.352 -12.447 -15.391 1.0 20.58 ? 508 THR A CB 1 99 . A ATOM 762 O OG1 . THR A 1 99 ? -24.314 -13.425 -15.804 1.0 31.18 ? 508 THR A OG1 1 99 . A ATOM 763 C CG2 . THR A 1 99 ? -23.660 -11.118 -16.071 1.0 19.47 ? 508 THR A CG2 1 99 . A ATOM 764 N N . CYS A 1 100 ? -20.154 -11.401 -16.379 1.0 21.78 ? 509 CYS A N 1 100 . A ATOM 765 C CA . CYS A 1 100 ? -19.168 -10.348 -16.160 1.0 32.67 ? 509 CYS A CA 1 100 . A ATOM 766 C C . CYS A 1 100 ? -19.683 -9.010 -16.664 1.0 27.57 ? 509 CYS A C 1 100 . A ATOM 767 O O . CYS A 1 100 ? -19.940 -8.846 -17.855 1.0 19.93 ? 509 CYS A O 1 100 . A ATOM 768 C CB . CYS A 1 100 ? -17.847 -10.679 -16.855 1.0 34.5 ? 509 CYS A CB 1 100 . A ATOM 769 S SG . CYS A 1 100 ? -17.104 -12.239 -16.360 1.0 61.6 ? 509 CYS A SG 1 100 . A ATOM 770 N N . GLU A 1 101 ? -19.826 -8.055 -15.753 1.0 34.42 ? 510 GLU A N 1 101 . A ATOM 771 C CA . GLU A 1 101 ? -20.240 -6.711 -16.124 1.0 28.64 ? 510 GLU A CA 1 101 . A ATOM 772 C C . GLU A 1 101 ? -19.037 -5.896 -16.576 1.0 22.65 ? 510 GLU A C 1 101 . A ATOM 773 O O . GLU A 1 101 ? -18.244 -5.438 -15.753 1.0 38.36 ? 510 GLU A O 1 101 . A ATOM 774 C CB . GLU A 1 101 ? -20.940 -6.017 -14.954 1.0 30.66 ? 510 GLU A CB 1 101 . A ATOM 775 C CG . GLU A 1 101 ? -21.783 -4.819 -15.356 1.0 34.09 ? 510 GLU A CG 1 101 . A ATOM 776 C CD . GLU A 1 101 ? -22.967 -5.208 -16.222 1.0 59.15 ? 510 GLU A CD 1 101 . A ATOM 777 O OE1 . GLU A 1 101 ? -23.541 -6.294 -15.990 1.0 48.13 ? 510 GLU A OE1 1 101 . A ATOM 778 O OE2 . GLU A 1 101 ? -23.323 -4.429 -17.133 1.0 63.55 ? 510 GLU A OE2 1 101 . A ATOM 779 N N . LEU A 1 102 ? -18.897 -5.726 -17.886 1.0 26.97 ? 511 LEU A N 1 102 . A ATOM 780 C CA . LEU A 1 102 ? -17.823 -4.909 -18.439 1.0 21.34 ? 511 LEU A CA 1 102 . A ATOM 781 C C . LEU A 1 102 ? -18.112 -3.437 -18.168 1.0 28.51 ? 511 LEU A C 1 102 . A ATOM 782 O O . LEU A 1 102 ? -19.193 -3.094 -17.681 1.0 29.99 ? 511 LEU A O 1 102 . A ATOM 783 C CB . LEU A 1 102 ? -17.671 -5.159 -19.939 1.0 21.24 ? 511 LEU A CB 1 102 . A ATOM 784 C CG . LEU A 1 102 ? -17.595 -6.621 -20.388 1.0 28.81 ? 511 LEU A CG 1 102 . A ATOM 785 C CD1 . LEU A 1 102 ? -17.478 -6.714 -21.901 1.0 24.35 ? 511 LEU A CD1 1 102 . A ATOM 786 C CD2 . LEU A 1 102 ? -16.435 -7.339 -19.716 1.0 29.25 ? 511 LEU A CD2 1 102 . A ATOM 787 N N . ASN A 1 103 ? -17.154 -2.567 -18.480 1.0 30.76 ? 512 ASN A N 1 103 . A ATOM 788 C CA . ASN A 1 103 ? -17.345 -1.133 -18.272 1.0 44.94 ? 512 ASN A CA 1 103 . A ATOM 789 C C . ASN A 1 103 ? -18.535 -0.633 -19.083 1.0 41.41 ? 512 ASN A C 1 103 . A ATOM 790 O O . ASN A 1 103 ? -19.268 0.259 -18.651 1.0 48.56 ? 512 ASN A O 1 103 . A ATOM 791 C CB . ASN A 1 103 ? -16.080 -0.352 -18.635 1.0 47.83 ? 512 ASN A CB 1 103 . A ATOM 792 C CG . ASN A 1 103 ? -15.738 -0.438 -20.110 1.0 69.18 ? 512 ASN A CG 1 103 . A ATOM 793 O OD1 . ASN A 1 103 ? -16.163 -1.361 -20.807 1.0 61.85 ? 512 ASN A OD1 1 103 . A ATOM 794 N ND2 . ASN A 1 103 ? -14.967 0.529 -20.595 1.0 68.44 ? 512 ASN A ND2 1 103 . A ATOM 795 N N . HIS A 1 104 ? -18.722 -1.231 -20.256 1.0 32.92 ? 513 HIS A N 1 104 . A ATOM 796 C CA . HIS A 1 104 ? -19.897 -0.990 -21.079 1.0 41.85 ? 513 HIS A CA 1 104 . A ATOM 797 C C . HIS A 1 104 ? -20.320 -2.294 -21.748 1.0 29.71 ? 513 HIS A C 1 104 . A ATOM 798 O O . HIS A 1 104 ? -19.592 -2.847 -22.569 1.0 26.84 ? 513 HIS A O 1 104 . A ATOM 799 C CB . HIS A 1 104 ? -19.620 0.097 -22.118 1.0 29.09 ? 513 HIS A CB 1 104 . A ATOM 800 C CG . HIS A 1 104 ? -19.267 1.420 -21.516 1.0 41.92 ? 513 HIS A CG 1 104 . A ATOM 801 N ND1 . HIS A 1 104 ? -17.964 1.847 -21.368 1.0 34.99 ? 513 HIS A ND1 1 104 . A ATOM 802 C CD2 . HIS A 1 104 ? -20.044 2.401 -20.999 1.0 37.56 ? 513 HIS A CD2 1 104 . A ATOM 803 C CE1 . HIS A 1 104 ? -17.956 3.038 -20.798 1.0 42.0 ? 513 HIS A CE1 1 104 . A ATOM 804 N NE2 . HIS A 1 104 ? -19.206 3.397 -20.563 1.0 34.36 ? 513 HIS A NE2 1 104 . A ATOM 805 N N . GLY A 1 105 ? -21.499 -2.783 -21.382 1.0 31.29 ? 514 GLY A N 1 105 . A ATOM 806 C CA . GLY A 1 105 ? -21.973 -4.067 -21.864 1.0 29.55 ? 514 GLY A CA 1 105 . A ATOM 807 C C . GLY A 1 105 ? -21.577 -5.177 -20.911 1.0 27.71 ? 514 GLY A C 1 105 . A ATOM 808 O O . GLY A 1 105 ? -20.956 -4.925 -19.877 1.0 28.85 ? 514 GLY A O 1 105 . A ATOM 809 N N . ARG A 1 106 ? -21.939 -6.410 -21.246 1.0 23.1 ? 515 ARG A N 1 106 . A ATOM 810 C CA . ARG A 1 106 ? -21.575 -7.543 -20.405 1.0 29.78 ? 515 ARG A CA 1 106 . A ATOM 811 C C . ARG A 1 106 ? -21.332 -8.799 -21.228 1.0 15.95 ? 515 ARG A C 1 106 . A ATOM 812 O O . ARG A 1 106 ? -21.779 -8.904 -22.372 1.0 14.87 ? 515 ARG A O 1 106 . A ATOM 813 C CB . ARG A 1 106 ? -22.657 -7.804 -19.350 1.0 21.24 ? 515 ARG A CB 1 106 . A ATOM 814 C CG . ARG A 1 106 ? -24.028 -8.130 -19.913 1.0 22.33 ? 515 ARG A CG 1 106 . A ATOM 815 C CD . ARG A 1 106 ? -25.009 -8.519 -18.811 1.0 34.2 ? 515 ARG A CD 1 106 . A ATOM 816 N NE . ARG A 1 106 ? -25.180 -7.463 -17.816 1.0 32.98 ? 515 ARG A NE 1 106 . A ATOM 817 N N . VAL A 1 107 ? -20.606 -9.745 -20.643 1.0 18.39 ? 516 VAL A N 1 107 . A ATOM 818 C CA . VAL A 1 107 ? -20.365 -11.026 -21.292 1.0 23.59 ? 516 VAL A CA 1 107 . A ATOM 819 C C . VAL A 1 107 ? -20.851 -12.156 -20.390 1.0 20.18 ? 516 VAL A C 1 107 . A ATOM 820 O O . VAL A 1 107 ? -20.682 -12.115 -19.168 1.0 19.92 ? 516 VAL A O 1 107 . A ATOM 821 C CB . VAL A 1 107 ? -18.866 -11.224 -21.650 1.0 13.3 ? 516 VAL A CB 1 107 . A ATOM 822 C CG1 . VAL A 1 107 ? -17.997 -11.215 -20.404 1.0 16.25 ? 516 VAL A CG1 1 107 . A ATOM 823 C CG2 . VAL A 1 107 ? -18.663 -12.505 -22.442 1.0 15.45 ? 516 VAL A CG2 1 107 . A ATOM 824 N N . LYS A 1 108 ? -21.484 -13.152 -20.996 1.0 16.96 ? 517 LYS A N 1 108 . A ATOM 825 C CA . LYS A 1 108 ? -21.971 -14.301 -20.253 1.0 20.42 ? 517 LYS A CA 1 108 . A ATOM 826 C C . LYS A 1 108 ? -21.387 -15.584 -20.817 1.0 21.16 ? 517 LYS A C 1 108 . A ATOM 827 O O . LYS A 1 108 ? -21.203 -15.717 -22.027 1.0 21.3 ? 517 LYS A O 1 108 . A ATOM 828 C CB . LYS A 1 108 ? -23.500 -14.359 -20.284 1.0 32.71 ? 517 LYS A CB 1 108 . A ATOM 829 C CG . LYS A 1 108 ? -24.183 -13.187 -19.599 1.0 32.02 ? 517 LYS A CG 1 108 . A ATOM 830 C CD . LYS A 1 108 ? -25.694 -13.327 -19.649 1.0 34.58 ? 517 LYS A CD 1 108 . A ATOM 831 C CE . LYS A 1 108 ? -26.376 -12.223 -18.857 1.0 47.63 ? 517 LYS A CE 1 108 . A ATOM 832 N NZ . LYS A 1 108 ? -27.855 -12.392 -18.834 1.0 50.08 ? 517 LYS A NZ 1 108 . A ATOM 833 N N . PHE A 1 109 ? -21.088 -16.525 -19.929 1.0 21.31 ? 518 PHE A N 1 109 . A ATOM 834 C CA . PHE A 1 109 ? -20.626 -17.842 -20.337 1.0 14.29 ? 518 PHE A CA 1 109 . A ATOM 835 C C . PHE A 1 109 ? -20.860 -18.839 -19.220 1.0 16.21 ? 518 PHE A C 1 109 . A ATOM 836 O O . PHE A 1 109 ? -21.294 -18.477 -18.125 1.0 13.51 ? 518 PHE A O 1 109 . A ATOM 837 C CB . PHE A 1 109 ? -19.143 -17.814 -20.724 1.0 12.77 ? 518 PHE A CB 1 109 . A ATOM 838 C CG . PHE A 1 109 ? -18.228 -17.404 -19.603 1.0 14.32 ? 518 PHE A CG 1 109 . A ATOM 839 C CD1 . PHE A 1 109 ? -17.930 -16.066 -19.388 1.0 19.44 ? 518 PHE A CD1 1 109 . A ATOM 840 C CD2 . PHE A 1 109 ? -17.659 -18.353 -18.770 1.0 10.72 ? 518 PHE A CD2 1 109 . A ATOM 841 C CE1 . PHE A 1 109 ? -17.089 -15.684 -18.361 1.0 13.0 ? 518 PHE A CE1 1 109 . A ATOM 842 C CE2 . PHE A 1 109 ? -16.817 -17.977 -17.741 1.0 14.08 ? 518 PHE A CE2 1 109 . A ATOM 843 C CZ . PHE A 1 109 ? -16.532 -16.640 -17.536 1.0 15.19 ? 518 PHE A CZ 1 109 . A ATOM 844 N N . SER A 1 110 ? -20.570 -20.100 -19.505 1.0 13.3 ? 519 SER A N 1 110 . A ATOM 845 C CA . SER A 1 110 ? -20.650 -21.141 -18.497 1.0 15.24 ? 519 SER A CA 1 110 . A ATOM 846 C C . SER A 1 110 ? -19.352 -21.929 -18.474 1.0 19.51 ? 519 SER A C 1 110 . A ATOM 847 O O . SER A 1 110 ? -18.655 -22.024 -19.487 1.0 18.31 ? 519 SER A O 1 110 . A ATOM 848 C CB . SER A 1 110 ? -21.832 -22.073 -18.773 1.0 22.02 ? 519 SER A CB 1 110 . A ATOM 849 O OG . SER A 1 110 ? -23.057 -21.364 -18.772 1.0 43.8 ? 519 SER A OG 1 110 . A ATOM 850 N N . TYR A 1 111 ? -19.018 -22.487 -17.318 1.0 11.88 ? 520 TYR A N 1 111 . A ATOM 851 C CA . TYR A 1 111 ? -17.921 -23.437 -17.263 1.0 16.25 ? 520 TYR A CA 1 111 . A ATOM 852 C C . TYR A 1 111 ? -18.304 -24.650 -16.430 1.0 19.44 ? 520 TYR A C 1 111 . A ATOM 853 O O . TYR A 1 111 ? -19.157 -24.575 -15.544 1.0 19.51 ? 520 TYR A O 1 111 . A ATOM 854 C CB . TYR A 1 111 ? -16.642 -22.783 -16.719 1.0 17.11 ? 520 TYR A CB 1 111 . A ATOM 855 C CG . TYR A 1 111 ? -16.649 -22.442 -15.244 1.0 16.8 ? 520 TYR A CG 1 111 . A ATOM 856 C CD1 . TYR A 1 111 ? -16.315 -23.395 -14.286 1.0 18.02 ? 520 TYR A CD1 1 111 . A ATOM 857 C CD2 . TYR A 1 111 ? -16.948 -21.156 -14.811 1.0 17.75 ? 520 TYR A CD2 1 111 . A ATOM 858 C CE1 . TYR A 1 111 ? -16.310 -23.085 -12.939 1.0 19.99 ? 520 TYR A CE1 1 111 . A ATOM 859 C CE2 . TYR A 1 111 ? -16.941 -20.834 -13.466 1.0 14.13 ? 520 TYR A CE2 1 111 . A ATOM 860 C CZ . TYR A 1 111 ? -16.622 -21.803 -12.534 1.0 26.08 ? 520 TYR A CZ 1 111 . A ATOM 861 O OH . TYR A 1 111 ? -16.612 -21.491 -11.193 1.0 25.6 ? 520 TYR A OH 1 111 . A ATOM 862 N N . HIS A 1 112 ? -17.674 -25.776 -16.734 1.0 20.48 ? 521 HIS A N 1 112 . A ATOM 863 C CA . HIS A 1 112 ? -17.881 -26.987 -15.963 1.0 16.5 ? 521 HIS A CA 1 112 . A ATOM 864 C C . HIS A 1 112 ? -16.539 -27.521 -15.488 1.0 14.25 ? 521 HIS A C 1 112 . A ATOM 865 O O . HIS A 1 112 ? -15.687 -27.889 -16.294 1.0 14.82 ? 521 HIS A O 1 112 . A ATOM 866 C CB . HIS A 1 112 ? -18.619 -28.041 -16.792 1.0 16.29 ? 521 HIS A CB 1 112 . A ATOM 867 C CG . HIS A 1 112 ? -18.995 -29.263 -16.013 1.0 24.69 ? 521 HIS A CG 1 112 . A ATOM 868 N ND1 . HIS A 1 112 ? -19.325 -30.459 -16.616 1.0 25.63 ? 521 HIS A ND1 1 112 . A ATOM 869 C CD2 . HIS A 1 112 ? -19.093 -29.476 -14.680 1.0 22.96 ? 521 HIS A CD2 1 112 . A ATOM 870 C CE1 . HIS A 1 112 ? -19.608 -31.354 -15.688 1.0 24.99 ? 521 HIS A CE1 1 112 . A ATOM 871 N NE2 . HIS A 1 112 ? -19.474 -30.783 -14.503 1.0 26.67 ? 521 HIS A NE2 1 112 . A ATOM 872 N N . ALA A 1 113 ? -16.347 -27.541 -14.175 1.0 17.99 ? 522 ALA A N 1 113 . A ATOM 873 C CA . ALA A 1 113 ? -15.141 -28.111 -13.594 1.0 14.65 ? 522 ALA A CA 1 113 . A ATOM 874 C C . ALA A 1 113 ? -15.477 -29.417 -12.887 1.0 15.37 ? 522 ALA A C 1 113 . A ATOM 875 O O . ALA A 1 113 ? -15.887 -29.418 -11.725 1.0 18.54 ? 522 ALA A O 1 113 . A ATOM 876 C CB . ALA A 1 113 ? -14.492 -27.130 -12.633 1.0 12.78 ? 522 ALA A CB 1 113 . A ATOM 877 N N . LYS A 1 114 ? -15.315 -30.526 -13.601 1.0 10.49 ? 523 LYS A N 1 114 . A ATOM 878 C CA . LYS A 1 114 ? -15.618 -31.840 -13.048 1.0 18.12 ? 523 LYS A CA 1 114 . A ATOM 879 C C . LYS A 1 114 ? -14.390 -32.459 -12.393 1.0 19.24 ? 523 LYS A C 1 114 . A ATOM 880 O O . LYS A 1 114 ? -13.392 -32.727 -13.061 1.0 21.7 ? 523 LYS A O 1 114 . A ATOM 881 C CB . LYS A 1 114 ? -16.155 -32.770 -14.138 1.0 15.66 ? 523 LYS A CB 1 114 . A ATOM 882 C CG . LYS A 1 114 ? -16.504 -34.165 -13.645 1.0 16.42 ? 523 LYS A CG 1 114 . A ATOM 883 C CD . LYS A 1 114 ? -17.007 -35.045 -14.779 1.0 35.69 ? 523 LYS A CD 1 114 . A ATOM 884 C CE . LYS A 1 114 ? -15.971 -35.173 -15.889 1.0 51.74 ? 523 LYS A CE 1 114 . A ATOM 885 N NZ . LYS A 1 114 ? -14.680 -35.735 -15.396 1.0 47.14 ? 523 LYS A NZ 1 114 . A ATOM 886 N N . CYS A 1 115 ? -14.467 -32.675 -11.083 1.0 19.8 ? 524 CYS A N 1 115 . A ATOM 887 C CA . CYS A 1 115 ? -13.397 -33.345 -10.351 1.0 24.76 ? 524 CYS A CA 1 115 . A ATOM 888 C C . CYS A 1 115 ? -13.096 -34.719 -10.932 1.0 24.87 ? 524 CYS A C 1 115 . A ATOM 889 O O . CYS A 1 115 ? -14.008 -35.461 -11.305 1.0 28.81 ? 524 CYS A O 1 115 . A ATOM 890 C CB . CYS A 1 115 ? -13.755 -33.489 -8.869 1.0 21.74 ? 524 CYS A CB 1 115 . A ATOM 891 S SG . CYS A 1 115 ? -13.654 -31.967 -7.911 1.0 40.58 ? 524 CYS A SG 1 115 . A ATOM 892 N N . LEU A 1 116 ? -11.812 -35.049 -11.016 1.0 24.22 ? 525 LEU A N 1 116 . A ATOM 893 C CA . LEU A 1 116 ? -11.393 -36.390 -11.398 1.0 26.73 ? 525 LEU A CA 1 116 . A ATOM 894 C C . LEU A 1 116 ? -11.926 -37.399 -10.385 1.0 37.53 ? 525 LEU A C 1 116 . A ATOM 895 O O . LEU A 1 116 ? -12.125 -37.058 -9.219 1.0 35.25 ? 525 LEU A O 1 116 . A ATOM 896 C CB . LEU A 1 116 ? -9.869 -36.474 -11.491 1.0 26.51 ? 525 LEU A CB 1 116 . A ATOM 897 C CG . LEU A 1 116 ? -9.237 -36.337 -12.878 1.0 34.9 ? 525 LEU A CG 1 116 . A ATOM 898 C CD1 . LEU A 1 116 ? -9.615 -35.019 -13.543 1.0 26.84 ? 525 LEU A CD1 1 116 . A ATOM 899 C CD2 . LEU A 1 116 ? -7.729 -36.470 -12.775 1.0 28.73 ? 525 LEU A CD2 1 116 . A ATOM 900 N N . PRO A 1 117 ? -12.181 -38.638 -10.831 1.0 44.99 ? 526 PRO A N 1 117 . A ATOM 901 C CA . PRO A 1 117 ? -12.640 -39.708 -9.937 1.0 46.58 ? 526 PRO A CA 1 117 . A ATOM 902 C C . PRO A 1 117 ? -11.754 -39.860 -8.700 1.0 43.35 ? 526 PRO A C 1 117 . A ATOM 903 O O . PRO A 1 117 ? -10.545 -39.634 -8.787 1.0 43.73 ? 526 PRO A O 1 117 . A ATOM 904 C CB . PRO A 1 117 ? -12.566 -40.951 -10.823 1.0 56.97 ? 526 PRO A CB 1 117 . A ATOM 905 C CG . PRO A 1 117 ? -12.805 -40.426 -12.198 1.0 46.34 ? 526 PRO A CG 1 117 . A ATOM 906 C CD . PRO A 1 117 ? -12.146 -39.074 -12.239 1.0 35.94 ? 526 PRO A CD 1 117 . A ATOM 907 N N . HIS A 1 118 ? -12.366 -40.223 -7.574 1.0 37.55 ? 527 HIS A N 1 118 . A ATOM 908 C CA . HIS A 1 118 ? -11.688 -40.335 -6.279 1.0 51.3 ? 527 HIS A CA 1 118 . A ATOM 909 C C . HIS A 1 118 ? -11.186 -38.979 -5.779 1.0 51.46 ? 527 HIS A C 1 118 . A ATOM 910 O O . HIS A 1 118 ? -10.308 -38.913 -4.917 1.0 60.75 ? 527 HIS A O 1 118 . A ATOM 911 C CB . HIS A 1 118 ? -10.527 -41.334 -6.348 1.0 41.26 ? 527 HIS A CB 1 118 . A ATOM 912 N N . LEU A 1 119 ? -11.750 -37.904 -6.322 1.0 41.59 ? 528 LEU A N 1 119 . A ATOM 913 C CA . LEU A 1 119 ? -11.479 -36.554 -5.836 1.0 32.06 ? 528 LEU A CA 1 119 . A ATOM 914 C C . LEU A 1 119 ? -12.788 -35.804 -5.632 1.0 30.97 ? 528 LEU A C 1 119 . A ATOM 915 O O . LEU A 1 119 ? -13.755 -36.017 -6.363 1.0 37.68 ? 528 LEU A O 1 119 . A ATOM 916 C CB . LEU A 1 119 ? -10.581 -35.784 -6.805 1.0 29.13 ? 528 LEU A CB 1 119 . A ATOM 917 C CG . LEU A 1 119 ? -9.130 -36.236 -6.960 1.0 40.95 ? 528 LEU A CG 1 119 . A ATOM 918 C CD1 . LEU A 1 119 ? -8.424 -35.376 -7.997 1.0 38.81 ? 528 LEU A CD1 1 119 . A ATOM 919 C CD2 . LEU A 1 119 ? -8.403 -36.172 -5.626 1.0 39.68 ? 528 LEU A CD2 1 119 . A ATOM 920 N N . THR A 1 120 ? -12.819 -34.926 -4.637 1.0 24.57 ? 529 THR A N 1 120 . A ATOM 921 C CA . THR A 1 120 ? -14.022 -34.158 -4.348 1.0 29.4 ? 529 THR A CA 1 120 . A ATOM 922 C C . THR A 1 120 ? -13.683 -32.851 -3.638 1.0 33.11 ? 529 THR A C 1 120 . A ATOM 923 O O . THR A 1 120 ? -12.542 -32.631 -3.231 1.0 28.36 ? 529 THR A O 1 120 . A ATOM 924 C CB . THR A 1 120 ? -15.013 -34.965 -3.486 1.0 27.79 ? 529 THR A CB 1 120 . A ATOM 925 O OG1 . THR A 1 120 ? -16.199 -34.193 -3.268 1.0 53.21 ? 529 THR A OG1 1 120 . A ATOM 926 C CG2 . THR A 1 120 ? -14.392 -35.317 -2.145 1.0 29.38 ? 529 THR A CG2 1 120 . A ATOM 927 N N . GLY A 1 121 ? -14.680 -31.984 -3.496 1.0 23.51 ? 530 GLY A N 1 121 . A ATOM 928 C CA . GLY A 1 121 ? -14.479 -30.702 -2.849 1.0 26.19 ? 530 GLY A CA 1 121 . A ATOM 929 C C . GLY A 1 121 ? -14.605 -29.540 -3.814 1.0 27.81 ? 530 GLY A C 1 121 . A ATOM 930 O O . GLY A 1 121 ? -14.772 -29.736 -5.018 1.0 31.46 ? 530 GLY A O 1 121 . A ATOM 931 N N . GLY A 1 122 ? -14.517 -28.326 -3.279 1.0 26.3 ? 531 GLY A N 1 122 . A ATOM 932 C CA . GLY A 1 122 ? -14.662 -27.117 -4.069 1.0 26.25 ? 531 GLY A CA 1 122 . A ATOM 933 C C . GLY A 1 122 ? -13.598 -26.952 -5.136 1.0 33.09 ? 531 GLY A C 1 122 . A ATOM 934 O O . GLY A 1 122 ? -13.884 -26.468 -6.232 1.0 31.46 ? 531 GLY A O 1 122 . A ATOM 935 N N . THR A 1 123 ? -12.368 -27.343 -4.815 1.0 27.99 ? 532 THR A N 1 123 . A ATOM 936 C CA . THR A 1 123 ? -11.277 -27.307 -5.783 1.0 32.78 ? 532 THR A CA 1 123 . A ATOM 937 C C . THR A 1 123 ? -10.615 -28.674 -5.895 1.0 33.54 ? 532 THR A C 1 123 . A ATOM 938 O O . THR A 1 123 ? -9.425 -28.775 -6.204 1.0 29.07 ? 532 THR A O 1 123 . A ATOM 939 C CB . THR A 1 123 ? -10.211 -26.260 -5.415 1.0 34.14 ? 532 THR A CB 1 123 . A ATOM 940 O OG1 . THR A 1 123 ? -9.653 -26.575 -4.134 1.0 39.11 ? 532 THR A OG1 1 123 . A ATOM 941 C CG2 . THR A 1 123 ? -10.820 -24.862 -5.379 1.0 15.05 ? 532 THR A CG2 1 123 . A ATOM 942 N N . CYS A 1 124 ? -11.396 -29.716 -5.618 1.0 23.52 ? 533 CYS A N 1 124 . A ATOM 943 C CA . CYS A 1 124 ? -10.968 -31.101 -5.799 1.0 29.16 ? 533 CYS A CA 1 124 . A ATOM 944 C C . CYS A 1 124 ? -9.727 -31.469 -4.985 1.0 32.24 ? 533 CYS A C 1 124 . A ATOM 945 O O . CYS A 1 124 ? -8.856 -32.196 -5.463 1.0 30.62 ? 533 CYS A O 1 124 . A ATOM 946 C CB . CYS A 1 124 ? -10.713 -31.373 -7.282 1.0 34.93 ? 533 CYS A CB 1 124 . A ATOM 947 S SG . CYS A 1 124 ? -12.044 -30.809 -8.365 1.0 41.03 ? 533 CYS A SG 1 124 . A ATOM 948 N N . LEU A 1 125 ? -9.653 -30.973 -3.753 1.0 35.63 ? 534 LEU A N 1 125 . A ATOM 949 C CA . LEU A 1 125 ? -8.518 -31.261 -2.882 1.0 35.82 ? 534 LEU A CA 1 125 . A ATOM 950 C C . LEU A 1 125 ? -8.792 -32.456 -1.971 1.0 36.47 ? 534 LEU A C 1 125 . A ATOM 951 O O . LEU A 1 125 ? -7.872 -33.170 -1.575 1.0 43.13 ? 534 LEU A O 1 125 . A ATOM 952 C CB . LEU A 1 125 ? -8.165 -30.030 -2.045 1.0 22.87 ? 534 LEU A CB 1 125 . A ATOM 953 C CG . LEU A 1 125 ? -7.592 -28.848 -2.830 1.0 24.53 ? 534 LEU A CG 1 125 . A ATOM 954 C CD1 . LEU A 1 125 ? -7.397 -27.634 -1.937 1.0 19.72 ? 534 LEU A CD1 1 125 . A ATOM 955 C CD2 . LEU A 1 125 ? -6.282 -29.242 -3.491 1.0 23.27 ? 534 LEU A CD2 1 125 . A ATOM 956 N N . GLU A 1 126 ? -10.063 -32.672 -1.647 1.0 38.83 ? 535 GLU A N 1 126 . A ATOM 957 C CA . GLU A 1 126 ? -10.456 -33.780 -0.786 1.0 33.86 ? 535 GLU A CA 1 126 . A ATOM 958 C C . GLU A 1 126 ? -10.374 -35.112 -1.522 1.0 39.14 ? 535 GLU A C 1 126 . A ATOM 959 O O . GLU A 1 126 ? -9.989 -36.132 -0.949 1.0 42.88 ? 535 GLU A O 1 126 . A ATOM 960 C CB . GLU A 1 126 ? -11.874 -33.564 -0.253 1.0 38.19 ? 535 GLU A CB 1 126 . A ATOM 961 C CG . GLU A 1 126 ? -12.081 -32.234 0.456 1.0 39.99 ? 535 GLU A CG 1 126 . A ATOM 962 C CD . GLU A 1 126 ? -11.392 -32.181 1.805 1.0 44.05 ? 535 GLU A CD 1 126 . A ATOM 963 O OE1 . GLU A 1 126 ? -11.018 -33.254 2.325 1.0 46.27 ? 535 GLU A OE1 1 126 . A ATOM 964 O OE2 . GLU A 1 126 ? -11.222 -31.068 2.346 1.0 39.87 ? 535 GLU A OE2 1 126 . A HETATM 965 CA CA . CA B 2 . ? -13.699 -2.809 -34.548 1.0 14.03 2 601 CA B CA 1 601 . A HETATM 966 CA CA . CA C 2 . ? -8.304 0.500 -31.968 1.0 23.14 2 602 CA C CA 1 602 . A HETATM 967 CA CA . CA D 2 . ? -17.280 -2.807 -36.625 1.0 12.55 2 603 CA D CA 1 603 . A HETATM 968 CA CA . CA E 2 . ? -12.566 -0.289 -32.293 1.0 10.7 2 604 CA E CA 1 604 . A HETATM 969 CA CA . CA F 2 . ? -6.082 -6.520 -35.570 1.0 51.4 2 605 CA F CA 1 605 . A HETATM 970 O O . HOH G 3 . ? -3.763 -31.796 -21.103 1.0 17.88 ? 701 HOH G O 1 701 . A HETATM 971 O O . HOH G 3 . ? -22.813 1.886 -38.447 1.0 13.82 ? 702 HOH G O 1 702 . A HETATM 972 O O . HOH G 3 . ? -8.996 -29.126 -26.222 1.0 12.5 ? 703 HOH G O 1 703 . A HETATM 973 O O . HOH G 3 . ? -16.119 1.993 -36.668 1.0 17.8 ? 704 HOH G O 1 704 . A HETATM 974 O O . HOH G 3 . ? -9.232 -31.889 -26.137 1.0 10.96 ? 705 HOH G O 1 705 . A HETATM 975 O O . HOH G 3 . ? -12.199 -27.525 -27.545 1.0 18.82 ? 706 HOH G O 1 706 . A HETATM 976 O O . HOH G 3 . ? -14.731 -28.467 -28.757 1.0 27.55 ? 707 HOH G O 1 707 . A HETATM 977 O O . HOH G 3 . ? -22.509 -0.004 -24.087 0.5 26.8 ? 708 HOH G O 1 708 . A HETATM 978 O O . HOH G 3 . ? -24.508 -8.271 -37.883 1.0 17.58 ? 709 HOH G O 1 709 . A HETATM 979 O O . HOH G 3 . ? -20.932 0.363 -16.302 0.5 25.02 ? 710 HOH G O 1 710 . A HETATM 980 O O . HOH G 3 . ? -23.007 -28.130 -10.410 1.0 21.33 ? 711 HOH G O 1 711 . A HETATM 981 O O . HOH G 3 . ? -23.662 -13.632 -33.067 1.0 22.07 ? 712 HOH G O 1 712 . A HETATM 982 O O . HOH G 3 . ? -9.746 -14.453 -33.662 1.0 27.71 ? 713 HOH G O 1 713 . A HETATM 983 O O . HOH G 3 . ? -7.525 -9.042 -34.863 1.0 27.58 ? 714 HOH G O 1 714 . A HETATM 984 O O . HOH G 3 . ? -20.255 -6.885 -41.491 1.0 18.24 ? 715 HOH G O 1 715 . A HETATM 985 O O . HOH G 3 . ? -20.890 5.650 -39.359 1.0 19.08 ? 716 HOH G O 1 716 . A HETATM 986 O O . HOH G 3 . ? -19.627 -0.690 -31.546 1.0 17.12 ? 717 HOH G O 1 717 . A HETATM 987 O O . HOH G 3 . ? -10.024 2.226 -31.744 1.0 23.78 ? 718 HOH G O 1 718 . A HETATM 988 O O . HOH G 3 . ? -8.496 -35.446 1.602 1.0 35.48 ? 719 HOH G O 1 719 . A HETATM 989 O O . HOH G 3 . ? -19.461 -31.856 -11.661 1.0 8.42 ? 720 HOH G O 1 720 . A HETATM 990 O O . HOH G 3 . ? -22.504 0.000 -30.362 0.5 14.36 ? 721 HOH G O 1 721 . A HETATM 991 O O . HOH G 3 . ? -8.837 -21.515 -29.643 1.0 24.53 ? 722 HOH G O 1 722 . A HETATM 992 O O . HOH G 3 . ? -12.581 1.924 -33.876 1.0 31.08 ? 723 HOH G O 1 723 . A HETATM 993 O O . HOH G 3 . ? -5.005 -33.639 -19.574 1.0 16.52 ? 724 HOH G O 1 724 . A HETATM 994 O O . HOH G 3 . ? -22.313 -1.209 -17.386 1.0 35.16 ? 725 HOH G O 1 725 . A HETATM 995 O O . HOH G 3 . ? -6.720 -35.530 -20.584 1.0 20.81 ? 726 HOH G O 1 726 . A HETATM 996 O O . HOH G 3 . ? -16.540 0.242 -24.319 1.0 40.32 ? 727 HOH G O 1 727 . A HETATM 997 O O . HOH G 3 . ? -6.447 -20.387 -30.078 1.0 32.75 ? 728 HOH G O 1 728 . A HETATM 998 O O . HOH G 3 . ? -16.284 -26.411 -30.694 1.0 31.74 ? 729 HOH G O 1 729 . A HETATM 999 O O . HOH G 3 . ? -21.147 -1.851 -40.948 1.0 17.41 ? 730 HOH G O 1 730 . A HETATM 1000 O O . HOH G 3 . ? -6.754 -37.805 -20.187 1.0 35.97 ? 731 HOH G O 1 731 . A HETATM 1001 O O . HOH G 3 . ? -29.876 -3.662 -28.970 1.0 16.61 ? 732 HOH G O 1 732 . A HETATM 1002 O O . HOH G 3 . ? -9.344 -35.829 -20.778 1.0 27.63 ? 733 HOH G O 1 733 . A HETATM 1003 O O . HOH G 3 . ? -4.637 -29.820 -19.559 1.0 24.98 ? 734 HOH G O 1 734 . A HETATM 1004 O O . HOH G 3 . ? -24.272 -16.977 -17.612 1.0 25.23 ? 735 HOH G O 1 735 . A HETATM 1005 O O . HOH G 3 . ? -3.154 -26.904 -14.720 1.0 20.42 ? 736 HOH G O 1 736 . A HETATM 1006 O O . HOH G 3 . ? -19.493 -25.660 -19.775 1.0 22.82 ? 737 HOH G O 1 737 . A HETATM 1007 O O . HOH G 3 . ? -4.091 -10.228 -23.960 1.0 27.4 ? 738 HOH G O 1 738 . A HETATM 1008 O O . HOH G 3 . ? -23.649 -18.966 -26.727 1.0 30.32 ? 739 HOH G O 1 739 . A HETATM 1009 O O . HOH G 3 . ? -3.491 -25.860 -17.838 1.0 18.3 ? 740 HOH G O 1 740 . A HETATM 1010 O O . HOH G 3 . ? -3.569 -13.314 -19.031 1.0 26.59 ? 741 HOH G O 1 741 . A HETATM 1011 O O . HOH G 3 . ? -18.931 -8.888 -32.484 1.0 12.66 ? 742 HOH G O 1 742 . A HETATM 1012 O O . HOH G 3 . ? -18.466 -2.360 -24.990 1.0 28.42 ? 743 HOH G O 1 743 . A HETATM 1013 O O . HOH G 3 . ? -18.614 -12.072 -38.668 1.0 30.99 ? 744 HOH G O 1 744 . A HETATM 1014 O O . HOH G 3 . ? -3.437 -14.850 -16.953 1.0 36.37 ? 745 HOH G O 1 745 . A HETATM 1015 O O . HOH G 3 . ? -3.545 -10.926 -19.126 1.0 24.76 ? 746 HOH G O 1 746 . A HETATM 1016 O O . HOH G 3 . ? -14.394 -15.515 -8.102 1.0 24.84 ? 747 HOH G O 1 747 . A HETATM 1017 O O . HOH G 3 . ? -17.106 -32.299 -9.777 1.0 23.17 ? 748 HOH G O 1 748 . A HETATM 1018 O O . HOH G 3 . ? -17.319 -9.377 -12.727 1.0 30.6 ? 749 HOH G O 1 749 . A HETATM 1019 O O . HOH G 3 . ? -4.576 -8.918 -29.221 1.0 31.54 ? 750 HOH G O 1 750 . A HETATM 1020 O O . HOH G 3 . ? -3.681 -7.670 -22.254 1.0 22.54 ? 751 HOH G O 1 751 . A HETATM 1021 O O . HOH G 3 . ? -12.460 2.064 -31.587 1.0 20.33 ? 752 HOH G O 1 752 . A HETATM 1022 O O . HOH G 3 . ? -9.966 -21.814 -8.028 1.0 31.91 ? 753 HOH G O 1 753 . A HETATM 1023 O O . HOH G 3 . ? -20.534 -14.335 -12.049 1.0 14.53 ? 754 HOH G O 1 754 . A HETATM 1024 O O . HOH G 3 . ? -13.411 4.365 -33.499 1.0 21.23 ? 755 HOH G O 1 755 . A HETATM 1025 O O . HOH G 3 . ? -15.823 -18.291 -8.157 1.0 37.84 ? 756 HOH G O 1 756 . A HETATM 1026 O O . HOH G 3 . ? -15.309 -18.766 -33.126 1.0 18.6 ? 757 HOH G O 1 757 . A HETATM 1027 O O . HOH G 3 . ? -7.711 -39.264 -8.401 1.0 29.45 ? 758 HOH G O 1 758 . A HETATM 1028 O O . HOH G 3 . ? -6.953 -1.663 -25.763 1.0 20.77 ? 759 HOH G O 1 759 . A HETATM 1029 O O . HOH G 3 . ? -10.975 -38.190 -1.448 1.0 28.37 ? 760 HOH G O 1 760 . A HETATM 1030 O O . HOH G 3 . ? -8.064 -7.557 -36.610 1.0 37.61 ? 761 HOH G O 1 761 . A HETATM 1031 O O . HOH G 3 . ? -14.078 -9.618 -12.686 1.0 33.13 ? 762 HOH G O 1 762 . A HETATM 1032 O O . HOH G 3 . ? -1.466 -12.709 -23.792 1.0 44.82 ? 763 HOH G O 1 763 . A #