USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 842 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 514 ASN :FLIP amide:sc= 0.224 F(o=-2,f=1.4) USER MOD Set 1.2: A 534 THR OG1 : rot -56:sc= 1.14 USER MOD Set 2.1: A 507 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Set 2.2: A 511 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 474 LYS NZ :NH3+ -129:sc= 0.174 (180deg=-0.217) USER MOD Set 3.2: A 488 THR OG1 : rot 164:sc= 0.19 USER MOD Set 4.1: A 472 SER OG : rot -40:sc= 1.99 USER MOD Set 4.2: A 522 THR OG1 : rot -157:sc= 1.11 USER MOD Set 5.1: A 441 THR OG1 : rot 118:sc= 0.538 USER MOD Set 5.2: A 530 ASN : amide:sc= -2.89! C(o=-2.4!,f=-3.1!) USER MOD Single : A 435 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 445 LYS NZ :NH3+ 147:sc= -0.422 (180deg=-1.23) USER MOD Single : A 453 ASN :FLIP amide:sc= -0.647 F(o=-2.8,f=-0.65) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -146:sc= 0.717 USER MOD Single : A 461 HIS : +bothHN:sc= 1.01 K(o=1,f=-4.9!) USER MOD Single : A 463 LYS NZ :NH3+ -135:sc= -0.845 (180deg=-2.95!) USER MOD Single : A 464 ASN : amide:sc= -0.474 K(o=-0.47,f=-9.1!) USER MOD Single : A 473 THR OG1 : rot 98:sc= 0.0497 USER MOD Single : A 478 TYR OH : rot 29:sc= 1.05 USER MOD Single : A 480 ASN : amide:sc= -0.361 K(o=-0.36,f=-5.7!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc=-0.000985 X(o=-0.00099,f=0) USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ -137:sc= -0.0415 (180deg=-0.455) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 36:sc= 0.395 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 510 MET CE :methyl -122:sc= 0 (180deg=-0.621) USER MOD Single : A 516 THR OG1 : rot -139:sc= -0.027 USER MOD Single : A 521 ASN : amide:sc= -0.273 X(o=-0.27,f=-0.16) USER MOD Single : A 527 ASN : amide:sc= -1.48! C(o=-1.5!,f=-4.7!) USER MOD Single : A 529 ASN : amide:sc= -0.0685 X(o=-0.068,f=-0.093) USER MOD Single : A 531 ASN : amide:sc= -0.805 K(o=-0.81,f=-2) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -8.650 16.694 21.656 1.00 11.04 N ATOM 2 CA MET A 435 -9.076 16.298 20.287 1.00 22.11 C ATOM 3 C MET A 435 -8.279 15.087 19.785 1.00 15.11 C ATOM 4 O MET A 435 -7.049 15.087 19.819 1.00 54.34 O ATOM 5 CB MET A 435 -8.907 17.483 19.324 1.00 52.21 C ATOM 6 CG MET A 435 -9.228 17.152 17.872 1.00 71.53 C ATOM 7 SD MET A 435 -10.852 16.391 17.681 1.00 42.41 S ATOM 8 CE MET A 435 -10.908 16.152 15.904 1.00 10.34 C ATOM 0 HA MET A 435 -10.127 16.013 20.326 1.00 22.11 H new ATOM 0 HB2 MET A 435 -9.552 18.299 19.651 1.00 52.21 H new ATOM 0 HB3 MET A 435 -7.880 17.844 19.385 1.00 52.21 H new ATOM 0 HG2 MET A 435 -9.185 18.064 17.277 1.00 71.53 H new ATOM 0 HG3 MET A 435 -8.466 16.479 17.479 1.00 71.53 H new ATOM 0 HE1 MET A 435 -11.855 15.688 15.629 1.00 10.34 H new ATOM 0 HE2 MET A 435 -10.817 17.116 15.404 1.00 10.34 H new ATOM 0 HE3 MET A 435 -10.085 15.506 15.598 1.00 10.34 H new ATOM 20 N GLU A 436 -8.987 14.058 19.320 1.00 41.11 N ATOM 21 CA GLU A 436 -8.341 12.844 18.811 1.00 22.43 C ATOM 22 C GLU A 436 -8.021 12.972 17.316 1.00 31.34 C ATOM 23 O GLU A 436 -8.884 13.337 16.515 1.00 15.33 O ATOM 24 CB GLU A 436 -9.230 11.609 19.039 1.00 54.54 C ATOM 25 CG GLU A 436 -9.553 11.319 20.504 1.00 11.32 C ATOM 26 CD GLU A 436 -10.537 12.310 21.107 1.00 63.42 C ATOM 27 OE1 GLU A 436 -11.725 12.279 20.720 1.00 60.44 O ATOM 28 OE2 GLU A 436 -10.134 13.115 21.973 1.00 63.11 O ATOM 0 H GLU A 436 -10.006 14.039 19.284 1.00 41.11 H new ATOM 0 HA GLU A 436 -7.409 12.719 19.362 1.00 22.43 H new ATOM 0 HB2 GLU A 436 -10.165 11.745 18.495 1.00 54.54 H new ATOM 0 HB3 GLU A 436 -8.735 10.737 18.610 1.00 54.54 H new ATOM 0 HG2 GLU A 436 -9.964 10.313 20.587 1.00 11.32 H new ATOM 0 HG3 GLU A 436 -8.630 11.335 21.083 1.00 11.32 H new ATOM 35 N PHE A 437 -6.783 12.660 16.949 1.00 12.01 N ATOM 36 CA PHE A 437 -6.353 12.681 15.548 1.00 73.44 C ATOM 37 C PHE A 437 -6.037 11.254 15.065 1.00 73.34 C ATOM 38 O PHE A 437 -5.435 10.468 15.799 1.00 72.14 O ATOM 39 CB PHE A 437 -5.116 13.577 15.378 1.00 73.24 C ATOM 40 CG PHE A 437 -5.326 15.003 15.827 1.00 52.03 C ATOM 41 CD1 PHE A 437 -5.919 15.931 14.983 1.00 20.03 C ATOM 42 CD2 PHE A 437 -4.925 15.416 17.092 1.00 62.03 C ATOM 43 CE1 PHE A 437 -6.109 17.238 15.392 1.00 33.23 C ATOM 44 CE2 PHE A 437 -5.113 16.722 17.503 1.00 23.44 C ATOM 45 CZ PHE A 437 -5.705 17.633 16.652 1.00 52.24 C ATOM 0 H PHE A 437 -6.051 12.387 17.605 1.00 12.01 H new ATOM 0 HA PHE A 437 -7.165 13.087 14.946 1.00 73.44 H new ATOM 0 HB2 PHE A 437 -4.288 13.147 15.942 1.00 73.24 H new ATOM 0 HB3 PHE A 437 -4.821 13.577 14.329 1.00 73.24 H new ATOM 0 HD1 PHE A 437 -6.236 15.629 13.996 1.00 20.03 H new ATOM 0 HD2 PHE A 437 -4.461 14.708 17.762 1.00 62.03 H new ATOM 0 HE1 PHE A 437 -6.573 17.950 14.726 1.00 33.23 H new ATOM 0 HE2 PHE A 437 -4.797 17.029 18.489 1.00 23.44 H new ATOM 0 HZ PHE A 437 -5.852 18.654 16.971 1.00 52.24 H new ATOM 55 N PRO A 438 -6.462 10.893 13.841 1.00 24.55 N ATOM 56 CA PRO A 438 -6.205 9.557 13.273 1.00 72.12 C ATOM 57 C PRO A 438 -4.731 9.325 12.892 1.00 14.15 C ATOM 58 O PRO A 438 -3.895 10.226 12.976 1.00 55.41 O ATOM 59 CB PRO A 438 -7.099 9.519 12.030 1.00 42.43 C ATOM 60 CG PRO A 438 -7.271 10.947 11.640 1.00 1.32 C ATOM 61 CD PRO A 438 -7.234 11.746 12.917 1.00 43.11 C ATOM 0 HA PRO A 438 -6.419 8.771 13.997 1.00 72.12 H new ATOM 0 HB2 PRO A 438 -6.637 8.943 11.228 1.00 42.43 H new ATOM 0 HB3 PRO A 438 -8.059 9.050 12.247 1.00 42.43 H new ATOM 0 HG2 PRO A 438 -6.478 11.262 10.962 1.00 1.32 H new ATOM 0 HG3 PRO A 438 -8.216 11.095 11.117 1.00 1.32 H new ATOM 0 HD2 PRO A 438 -6.754 12.714 12.770 1.00 43.11 H new ATOM 0 HD3 PRO A 438 -8.237 11.942 13.296 1.00 43.11 H new ATOM 69 N ASP A 439 -4.424 8.093 12.496 1.00 44.14 N ATOM 70 CA ASP A 439 -3.071 7.715 12.081 1.00 12.20 C ATOM 71 C ASP A 439 -3.152 6.526 11.108 1.00 4.51 C ATOM 72 O ASP A 439 -3.139 5.364 11.520 1.00 44.30 O ATOM 73 CB ASP A 439 -2.220 7.370 13.320 1.00 55.00 C ATOM 74 CG ASP A 439 -0.731 7.249 13.016 1.00 43.45 C ATOM 75 OD1 ASP A 439 -0.014 8.272 13.087 1.00 42.41 O ATOM 76 OD2 ASP A 439 -0.260 6.128 12.730 1.00 4.04 O ATOM 0 H ASP A 439 -5.100 7.330 12.453 1.00 44.14 H new ATOM 0 HA ASP A 439 -2.592 8.549 11.568 1.00 12.20 H new ATOM 0 HB2 ASP A 439 -2.367 8.139 14.079 1.00 55.00 H new ATOM 0 HB3 ASP A 439 -2.574 6.431 13.745 1.00 55.00 H new ATOM 81 N LEU A 440 -3.303 6.832 9.825 1.00 64.00 N ATOM 82 CA LEU A 440 -3.496 5.815 8.786 1.00 5.24 C ATOM 83 C LEU A 440 -2.159 5.379 8.168 1.00 5.31 C ATOM 84 O LEU A 440 -1.506 6.152 7.468 1.00 62.41 O ATOM 85 CB LEU A 440 -4.416 6.367 7.682 1.00 72.14 C ATOM 86 CG LEU A 440 -5.764 6.935 8.164 1.00 31.15 C ATOM 87 CD1 LEU A 440 -6.522 7.583 7.006 1.00 43.24 C ATOM 88 CD2 LEU A 440 -6.610 5.847 8.818 1.00 11.33 C ATOM 0 H LEU A 440 -3.296 7.789 9.471 1.00 64.00 H new ATOM 0 HA LEU A 440 -3.955 4.943 9.252 1.00 5.24 H new ATOM 0 HB2 LEU A 440 -3.882 7.152 7.147 1.00 72.14 H new ATOM 0 HB3 LEU A 440 -4.613 5.570 6.965 1.00 72.14 H new ATOM 0 HG LEU A 440 -5.560 7.701 8.912 1.00 31.15 H new ATOM 0 HD11 LEU A 440 -7.471 7.978 7.368 1.00 43.24 H new ATOM 0 HD12 LEU A 440 -5.926 8.395 6.590 1.00 43.24 H new ATOM 0 HD13 LEU A 440 -6.710 6.839 6.232 1.00 43.24 H new ATOM 0 HD21 LEU A 440 -7.557 6.273 9.150 1.00 11.33 H new ATOM 0 HD22 LEU A 440 -6.802 5.053 8.097 1.00 11.33 H new ATOM 0 HD23 LEU A 440 -6.076 5.437 9.675 1.00 11.33 H new ATOM 100 N THR A 441 -1.757 4.137 8.418 1.00 70.14 N ATOM 101 CA THR A 441 -0.510 3.611 7.846 1.00 24.11 C ATOM 102 C THR A 441 -0.758 2.373 6.978 1.00 42.40 C ATOM 103 O THR A 441 -1.753 1.664 7.147 1.00 34.43 O ATOM 104 CB THR A 441 0.526 3.261 8.936 1.00 12.25 C ATOM 105 OG1 THR A 441 1.778 2.895 8.332 1.00 54.03 O ATOM 106 CG2 THR A 441 0.038 2.130 9.838 1.00 43.40 C ATOM 0 H THR A 441 -2.266 3.477 9.006 1.00 70.14 H new ATOM 0 HA THR A 441 -0.109 4.410 7.222 1.00 24.11 H new ATOM 0 HB THR A 441 0.664 4.148 9.554 1.00 12.25 H new ATOM 0 HG1 THR A 441 2.474 3.525 8.614 1.00 54.03 H new ATOM 0 HG21 THR A 441 0.795 1.913 10.592 1.00 43.40 H new ATOM 0 HG22 THR A 441 -0.888 2.430 10.329 1.00 43.40 H new ATOM 0 HG23 THR A 441 -0.142 1.238 9.238 1.00 43.40 H new ATOM 114 N VAL A 442 0.160 2.122 6.049 1.00 60.41 N ATOM 115 CA VAL A 442 0.048 0.988 5.127 1.00 70.22 C ATOM 116 C VAL A 442 1.320 0.121 5.157 1.00 43.53 C ATOM 117 O VAL A 442 2.419 0.624 5.388 1.00 60.42 O ATOM 118 CB VAL A 442 -0.208 1.473 3.675 1.00 4.53 C ATOM 119 CG1 VAL A 442 -1.496 2.290 3.592 1.00 71.32 C ATOM 120 CG2 VAL A 442 0.976 2.288 3.159 1.00 31.24 C ATOM 0 H VAL A 442 0.996 2.690 5.912 1.00 60.41 H new ATOM 0 HA VAL A 442 -0.800 0.387 5.457 1.00 70.22 H new ATOM 0 HB VAL A 442 -0.321 0.593 3.042 1.00 4.53 H new ATOM 0 HG11 VAL A 442 -1.653 2.618 2.565 1.00 71.32 H new ATOM 0 HG12 VAL A 442 -2.338 1.675 3.909 1.00 71.32 H new ATOM 0 HG13 VAL A 442 -1.417 3.161 4.243 1.00 71.32 H new ATOM 0 HG21 VAL A 442 0.774 2.617 2.140 1.00 31.24 H new ATOM 0 HG22 VAL A 442 1.125 3.158 3.799 1.00 31.24 H new ATOM 0 HG23 VAL A 442 1.875 1.671 3.170 1.00 31.24 H new ATOM 130 N GLU A 443 1.166 -1.180 4.932 1.00 44.30 N ATOM 131 CA GLU A 443 2.307 -2.112 4.896 1.00 30.13 C ATOM 132 C GLU A 443 2.379 -2.870 3.564 1.00 33.11 C ATOM 133 O GLU A 443 1.351 -3.180 2.967 1.00 23.54 O ATOM 134 CB GLU A 443 2.208 -3.138 6.033 1.00 54.23 C ATOM 135 CG GLU A 443 2.364 -2.562 7.436 1.00 41.42 C ATOM 136 CD GLU A 443 2.585 -3.655 8.472 1.00 40.14 C ATOM 137 OE1 GLU A 443 1.686 -4.498 8.654 1.00 24.42 O ATOM 138 OE2 GLU A 443 3.681 -3.711 9.068 1.00 53.21 O ATOM 0 H GLU A 443 0.261 -1.622 4.770 1.00 44.30 H new ATOM 0 HA GLU A 443 3.207 -1.509 5.013 1.00 30.13 H new ATOM 0 HB2 GLU A 443 1.242 -3.639 5.967 1.00 54.23 H new ATOM 0 HB3 GLU A 443 2.973 -3.900 5.882 1.00 54.23 H new ATOM 0 HG2 GLU A 443 3.205 -1.869 7.453 1.00 41.42 H new ATOM 0 HG3 GLU A 443 1.474 -1.989 7.695 1.00 41.42 H new ATOM 145 N ILE A 444 3.597 -3.179 3.115 1.00 3.03 N ATOM 146 CA ILE A 444 3.801 -4.003 1.914 1.00 53.05 C ATOM 147 C ILE A 444 4.679 -5.216 2.237 1.00 35.31 C ATOM 148 O ILE A 444 5.855 -5.073 2.576 1.00 15.32 O ATOM 149 CB ILE A 444 4.464 -3.206 0.760 1.00 40.22 C ATOM 150 CG1 ILE A 444 3.702 -1.903 0.480 1.00 21.51 C ATOM 151 CG2 ILE A 444 4.539 -4.064 -0.507 1.00 32.31 C ATOM 152 CD1 ILE A 444 4.345 -1.042 -0.587 1.00 61.50 C ATOM 0 H ILE A 444 4.460 -2.872 3.563 1.00 3.03 H new ATOM 0 HA ILE A 444 2.812 -4.327 1.589 1.00 53.05 H new ATOM 0 HB ILE A 444 5.477 -2.945 1.067 1.00 40.22 H new ATOM 0 HG12 ILE A 444 2.684 -2.146 0.175 1.00 21.51 H new ATOM 0 HG13 ILE A 444 3.629 -1.329 1.404 1.00 21.51 H new ATOM 0 HG21 ILE A 444 5.007 -3.491 -1.308 1.00 32.31 H new ATOM 0 HG22 ILE A 444 5.131 -4.957 -0.307 1.00 32.31 H new ATOM 0 HG23 ILE A 444 3.533 -4.355 -0.809 1.00 32.31 H new ATOM 0 HD11 ILE A 444 3.752 -0.139 -0.732 1.00 61.50 H new ATOM 0 HD12 ILE A 444 5.353 -0.769 -0.275 1.00 61.50 H new ATOM 0 HD13 ILE A 444 4.393 -1.598 -1.523 1.00 61.50 H new ATOM 164 N LYS A 445 4.104 -6.408 2.135 1.00 22.54 N ATOM 165 CA LYS A 445 4.834 -7.647 2.422 1.00 40.15 C ATOM 166 C LYS A 445 4.679 -8.668 1.284 1.00 42.14 C ATOM 167 O LYS A 445 3.593 -8.829 0.722 1.00 33.30 O ATOM 168 CB LYS A 445 4.349 -8.239 3.752 1.00 33.11 C ATOM 169 CG LYS A 445 4.738 -7.402 4.970 1.00 64.25 C ATOM 170 CD LYS A 445 4.251 -8.026 6.276 1.00 4.30 C ATOM 171 CE LYS A 445 4.776 -7.280 7.503 1.00 13.12 C ATOM 172 NZ LYS A 445 4.359 -5.851 7.525 1.00 25.25 N ATOM 0 H LYS A 445 3.133 -6.548 1.856 1.00 22.54 H new ATOM 0 HA LYS A 445 5.895 -7.409 2.503 1.00 40.15 H new ATOM 0 HB2 LYS A 445 3.264 -8.339 3.722 1.00 33.11 H new ATOM 0 HB3 LYS A 445 4.759 -9.243 3.865 1.00 33.11 H new ATOM 0 HG2 LYS A 445 5.822 -7.293 5.003 1.00 64.25 H new ATOM 0 HG3 LYS A 445 4.320 -6.400 4.869 1.00 64.25 H new ATOM 0 HD2 LYS A 445 3.161 -8.027 6.292 1.00 4.30 H new ATOM 0 HD3 LYS A 445 4.571 -9.067 6.321 1.00 4.30 H new ATOM 0 HE2 LYS A 445 4.416 -7.774 8.406 1.00 13.12 H new ATOM 0 HE3 LYS A 445 5.864 -7.338 7.521 1.00 13.12 H new ATOM 0 HZ1 LYS A 445 4.222 -5.544 8.509 1.00 25.25 H new ATOM 0 HZ2 LYS A 445 5.096 -5.267 7.080 1.00 25.25 H new ATOM 0 HZ3 LYS A 445 3.467 -5.741 7.001 1.00 25.25 H new ATOM 186 N GLY A 446 5.774 -9.354 0.953 1.00 1.33 N ATOM 187 CA GLY A 446 5.766 -10.313 -0.148 1.00 54.53 C ATOM 188 C GLY A 446 7.173 -10.702 -0.610 1.00 44.33 C ATOM 189 O GLY A 446 8.160 -10.349 0.039 1.00 70.33 O ATOM 0 H GLY A 446 6.671 -9.263 1.429 1.00 1.33 H new ATOM 0 HA2 GLY A 446 5.230 -11.210 0.162 1.00 54.53 H new ATOM 0 HA3 GLY A 446 5.217 -9.889 -0.989 1.00 54.53 H new ATOM 193 N PRO A 447 7.296 -11.441 -1.731 1.00 61.31 N ATOM 194 CA PRO A 447 8.605 -11.877 -2.256 1.00 53.44 C ATOM 195 C PRO A 447 9.452 -10.725 -2.836 1.00 21.23 C ATOM 196 O PRO A 447 8.952 -9.888 -3.590 1.00 45.23 O ATOM 197 CB PRO A 447 8.229 -12.874 -3.361 1.00 14.05 C ATOM 198 CG PRO A 447 6.857 -12.469 -3.792 1.00 74.30 C ATOM 199 CD PRO A 447 6.175 -11.928 -2.561 1.00 14.44 C ATOM 0 HA PRO A 447 9.227 -12.296 -1.465 1.00 53.44 H new ATOM 0 HB2 PRO A 447 8.934 -12.828 -4.191 1.00 14.05 H new ATOM 0 HB3 PRO A 447 8.240 -13.899 -2.989 1.00 14.05 H new ATOM 0 HG2 PRO A 447 6.902 -11.714 -4.576 1.00 74.30 H new ATOM 0 HG3 PRO A 447 6.310 -13.319 -4.199 1.00 74.30 H new ATOM 0 HD2 PRO A 447 5.480 -11.125 -2.807 1.00 14.44 H new ATOM 0 HD3 PRO A 447 5.602 -12.700 -2.048 1.00 14.44 H new ATOM 207 N ASP A 448 10.740 -10.706 -2.490 1.00 70.23 N ATOM 208 CA ASP A 448 11.662 -9.673 -2.982 1.00 33.35 C ATOM 209 C ASP A 448 12.134 -9.955 -4.423 1.00 70.41 C ATOM 210 O ASP A 448 12.075 -9.078 -5.283 1.00 1.42 O ATOM 211 CB ASP A 448 12.860 -9.543 -2.034 1.00 70.14 C ATOM 212 CG ASP A 448 13.453 -10.890 -1.658 1.00 53.05 C ATOM 213 OD1 ASP A 448 14.314 -11.398 -2.397 1.00 22.01 O ATOM 214 OD2 ASP A 448 13.045 -11.452 -0.619 1.00 15.14 O ATOM 0 H ASP A 448 11.171 -11.393 -1.871 1.00 70.23 H new ATOM 0 HA ASP A 448 11.119 -8.728 -3.004 1.00 33.35 H new ATOM 0 HB2 ASP A 448 13.628 -8.931 -2.506 1.00 70.14 H new ATOM 0 HB3 ASP A 448 12.548 -9.022 -1.129 1.00 70.14 H new ATOM 219 N VAL A 449 12.614 -11.171 -4.679 1.00 12.12 N ATOM 220 CA VAL A 449 13.075 -11.555 -6.020 1.00 70.23 C ATOM 221 C VAL A 449 12.123 -12.572 -6.664 1.00 62.52 C ATOM 222 O VAL A 449 11.790 -13.598 -6.065 1.00 53.04 O ATOM 223 CB VAL A 449 14.510 -12.146 -5.988 1.00 24.12 C ATOM 224 CG1 VAL A 449 14.951 -12.591 -7.384 1.00 22.52 C ATOM 225 CG2 VAL A 449 15.502 -11.136 -5.412 1.00 35.42 C ATOM 0 H VAL A 449 12.695 -11.909 -3.979 1.00 12.12 H new ATOM 0 HA VAL A 449 13.086 -10.644 -6.618 1.00 70.23 H new ATOM 0 HB VAL A 449 14.495 -13.022 -5.339 1.00 24.12 H new ATOM 0 HG11 VAL A 449 15.960 -13.001 -7.333 1.00 22.52 H new ATOM 0 HG12 VAL A 449 14.267 -13.354 -7.756 1.00 22.52 H new ATOM 0 HG13 VAL A 449 14.941 -11.735 -8.059 1.00 22.52 H new ATOM 0 HG21 VAL A 449 16.500 -11.573 -5.400 1.00 35.42 H new ATOM 0 HG22 VAL A 449 15.507 -10.238 -6.029 1.00 35.42 H new ATOM 0 HG23 VAL A 449 15.207 -10.876 -4.395 1.00 35.42 H new ATOM 235 N VAL A 450 11.690 -12.281 -7.890 1.00 32.10 N ATOM 236 CA VAL A 450 10.757 -13.148 -8.618 1.00 43.54 C ATOM 237 C VAL A 450 11.209 -13.377 -10.070 1.00 63.41 C ATOM 238 O VAL A 450 12.022 -12.624 -10.609 1.00 43.22 O ATOM 239 CB VAL A 450 9.321 -12.557 -8.621 1.00 50.11 C ATOM 240 CG1 VAL A 450 8.768 -12.464 -7.198 1.00 41.30 C ATOM 241 CG2 VAL A 450 9.297 -11.189 -9.306 1.00 22.02 C ATOM 0 H VAL A 450 11.971 -11.447 -8.405 1.00 32.10 H new ATOM 0 HA VAL A 450 10.751 -14.104 -8.095 1.00 43.54 H new ATOM 0 HB VAL A 450 8.679 -13.230 -9.189 1.00 50.11 H new ATOM 0 HG11 VAL A 450 7.761 -12.047 -7.225 1.00 41.30 H new ATOM 0 HG12 VAL A 450 8.737 -13.459 -6.754 1.00 41.30 H new ATOM 0 HG13 VAL A 450 9.411 -11.819 -6.599 1.00 41.30 H new ATOM 0 HG21 VAL A 450 8.281 -10.795 -9.296 1.00 22.02 H new ATOM 0 HG22 VAL A 450 9.957 -10.504 -8.774 1.00 22.02 H new ATOM 0 HG23 VAL A 450 9.636 -11.292 -10.337 1.00 22.02 H new ATOM 251 N GLY A 451 10.681 -14.428 -10.692 1.00 1.42 N ATOM 252 CA GLY A 451 11.002 -14.724 -12.083 1.00 52.41 C ATOM 253 C GLY A 451 10.086 -14.010 -13.074 1.00 24.45 C ATOM 254 O GLY A 451 8.945 -13.667 -12.748 1.00 4.15 O ATOM 0 H GLY A 451 10.033 -15.085 -10.257 1.00 1.42 H new ATOM 0 HA2 GLY A 451 12.035 -14.437 -12.280 1.00 52.41 H new ATOM 0 HA3 GLY A 451 10.934 -15.800 -12.244 1.00 52.41 H new ATOM 258 N VAL A 452 10.574 -13.792 -14.289 1.00 1.12 N ATOM 259 CA VAL A 452 9.779 -13.141 -15.333 1.00 5.14 C ATOM 260 C VAL A 452 8.625 -14.053 -15.803 1.00 72.32 C ATOM 261 O VAL A 452 8.794 -15.265 -15.955 1.00 61.33 O ATOM 262 CB VAL A 452 10.671 -12.728 -16.536 1.00 1.43 C ATOM 263 CG1 VAL A 452 11.242 -13.952 -17.249 1.00 42.34 C ATOM 264 CG2 VAL A 452 9.903 -11.831 -17.506 1.00 1.10 C ATOM 0 H VAL A 452 11.516 -14.055 -14.580 1.00 1.12 H new ATOM 0 HA VAL A 452 9.345 -12.238 -14.903 1.00 5.14 H new ATOM 0 HB VAL A 452 11.511 -12.154 -16.145 1.00 1.43 H new ATOM 0 HG11 VAL A 452 11.861 -13.630 -18.086 1.00 42.34 H new ATOM 0 HG12 VAL A 452 11.847 -14.530 -16.551 1.00 42.34 H new ATOM 0 HG13 VAL A 452 10.425 -14.571 -17.620 1.00 42.34 H new ATOM 0 HG21 VAL A 452 10.551 -11.557 -18.339 1.00 1.10 H new ATOM 0 HG22 VAL A 452 9.032 -12.366 -17.885 1.00 1.10 H new ATOM 0 HG23 VAL A 452 9.577 -10.929 -16.987 1.00 1.10 H new ATOM 274 N ASN A 453 7.453 -13.452 -16.022 1.00 14.53 N ATOM 275 CA ASN A 453 6.228 -14.183 -16.395 1.00 70.15 C ATOM 276 C ASN A 453 5.732 -15.095 -15.254 1.00 12.13 C ATOM 277 O ASN A 453 4.968 -16.036 -15.486 1.00 73.10 O ATOM 278 CB ASN A 453 6.430 -15.009 -17.674 1.00 4.45 C ATOM 279 CG ASN A 453 6.964 -14.182 -18.827 1.00 32.22 C ATOM 280 OD1 ASN A 453 8.266 -14.213 -19.021 1.00 24.14 O flip ATOM 281 ND2 ASN A 453 6.212 -13.532 -19.543 1.00 21.32 N flip ATOM 0 H ASN A 453 7.321 -12.443 -15.947 1.00 14.53 H new ATOM 0 HA ASN A 453 5.465 -13.429 -16.585 1.00 70.15 H new ATOM 0 HB2 ASN A 453 7.121 -15.827 -17.468 1.00 4.45 H new ATOM 0 HB3 ASN A 453 5.481 -15.459 -17.964 1.00 4.45 H new ATOM 0 HD21 ASN A 453 5.208 -13.532 -19.362 1.00 21.32 H new ATOM 0 HD22 ASN A 453 6.590 -12.990 -20.321 1.00 21.32 H new ATOM 288 N LYS A 454 6.163 -14.815 -14.026 1.00 14.24 N ATOM 289 CA LYS A 454 5.706 -15.572 -12.854 1.00 31.44 C ATOM 290 C LYS A 454 4.667 -14.783 -12.044 1.00 32.30 C ATOM 291 O LYS A 454 4.574 -13.563 -12.153 1.00 52.42 O ATOM 292 CB LYS A 454 6.893 -15.951 -11.953 1.00 72.13 C ATOM 293 CG LYS A 454 7.904 -16.885 -12.615 1.00 33.11 C ATOM 294 CD LYS A 454 7.244 -18.160 -13.136 1.00 50.51 C ATOM 295 CE LYS A 454 6.543 -18.943 -12.029 1.00 65.25 C ATOM 296 NZ LYS A 454 5.803 -20.113 -12.566 1.00 42.50 N ATOM 0 H LYS A 454 6.827 -14.071 -13.813 1.00 14.24 H new ATOM 0 HA LYS A 454 5.233 -16.483 -13.221 1.00 31.44 H new ATOM 0 HB2 LYS A 454 7.405 -15.040 -11.642 1.00 72.13 H new ATOM 0 HB3 LYS A 454 6.512 -16.427 -11.049 1.00 72.13 H new ATOM 0 HG2 LYS A 454 8.392 -16.366 -13.440 1.00 33.11 H new ATOM 0 HG3 LYS A 454 8.682 -17.146 -11.897 1.00 33.11 H new ATOM 0 HD2 LYS A 454 6.521 -17.902 -13.910 1.00 50.51 H new ATOM 0 HD3 LYS A 454 7.999 -18.792 -13.603 1.00 50.51 H new ATOM 0 HE2 LYS A 454 7.280 -19.282 -11.301 1.00 65.25 H new ATOM 0 HE3 LYS A 454 5.851 -18.286 -11.501 1.00 65.25 H new ATOM 0 HZ1 LYS A 454 5.340 -20.620 -11.784 1.00 42.50 H new ATOM 0 HZ2 LYS A 454 5.083 -19.788 -13.242 1.00 42.50 H new ATOM 0 HZ3 LYS A 454 6.467 -20.752 -13.048 1.00 42.50 H new ATOM 310 N LEU A 455 3.891 -15.492 -11.232 1.00 72.31 N ATOM 311 CA LEU A 455 2.858 -14.871 -10.396 1.00 44.33 C ATOM 312 C LEU A 455 3.381 -14.596 -8.976 1.00 55.11 C ATOM 313 O LEU A 455 3.831 -15.515 -8.283 1.00 24.34 O ATOM 314 CB LEU A 455 1.628 -15.788 -10.321 1.00 75.34 C ATOM 315 CG LEU A 455 0.412 -15.193 -9.593 1.00 74.13 C ATOM 316 CD1 LEU A 455 -0.144 -14.005 -10.369 1.00 2.34 C ATOM 317 CD2 LEU A 455 -0.664 -16.255 -9.376 1.00 72.01 C ATOM 0 H LEU A 455 3.955 -16.505 -11.131 1.00 72.31 H new ATOM 0 HA LEU A 455 2.583 -13.919 -10.851 1.00 44.33 H new ATOM 0 HB2 LEU A 455 1.330 -16.053 -11.335 1.00 75.34 H new ATOM 0 HB3 LEU A 455 1.914 -16.713 -9.821 1.00 75.34 H new ATOM 0 HG LEU A 455 0.736 -14.840 -8.614 1.00 74.13 H new ATOM 0 HD11 LEU A 455 -1.005 -13.595 -9.840 1.00 2.34 H new ATOM 0 HD12 LEU A 455 0.625 -13.238 -10.460 1.00 2.34 H new ATOM 0 HD13 LEU A 455 -0.451 -14.331 -11.363 1.00 2.34 H new ATOM 0 HD21 LEU A 455 -1.515 -15.811 -8.859 1.00 72.01 H new ATOM 0 HD22 LEU A 455 -0.989 -16.646 -10.340 1.00 72.01 H new ATOM 0 HD23 LEU A 455 -0.257 -17.067 -8.774 1.00 72.01 H new ATOM 329 N ALA A 456 3.322 -13.338 -8.544 1.00 74.33 N ATOM 330 CA ALA A 456 3.753 -12.958 -7.192 1.00 53.31 C ATOM 331 C ALA A 456 2.616 -12.283 -6.405 1.00 13.52 C ATOM 332 O ALA A 456 1.944 -11.387 -6.913 1.00 52.11 O ATOM 333 CB ALA A 456 4.963 -12.033 -7.272 1.00 34.10 C ATOM 0 H ALA A 456 2.980 -12.560 -9.108 1.00 74.33 H new ATOM 0 HA ALA A 456 4.029 -13.867 -6.659 1.00 53.31 H new ATOM 0 HB1 ALA A 456 5.276 -11.756 -6.265 1.00 34.10 H new ATOM 0 HB2 ALA A 456 5.781 -12.546 -7.778 1.00 34.10 H new ATOM 0 HB3 ALA A 456 4.698 -11.135 -7.830 1.00 34.10 H new ATOM 339 N GLU A 457 2.410 -12.717 -5.162 1.00 32.13 N ATOM 340 CA GLU A 457 1.363 -12.146 -4.298 1.00 55.32 C ATOM 341 C GLU A 457 1.949 -11.277 -3.179 1.00 72.11 C ATOM 342 O GLU A 457 2.929 -11.646 -2.528 1.00 73.25 O ATOM 343 CB GLU A 457 0.507 -13.262 -3.681 1.00 24.52 C ATOM 344 CG GLU A 457 -0.522 -13.848 -4.637 1.00 42.32 C ATOM 345 CD GLU A 457 -1.238 -15.059 -4.067 1.00 11.31 C ATOM 346 OE1 GLU A 457 -0.562 -16.066 -3.768 1.00 34.13 O ATOM 347 OE2 GLU A 457 -2.477 -15.013 -3.928 1.00 43.14 O ATOM 0 H GLU A 457 2.952 -13.463 -4.725 1.00 32.13 H new ATOM 0 HA GLU A 457 0.742 -11.511 -4.930 1.00 55.32 H new ATOM 0 HB2 GLU A 457 1.163 -14.060 -3.334 1.00 24.52 H new ATOM 0 HB3 GLU A 457 -0.008 -12.869 -2.804 1.00 24.52 H new ATOM 0 HG2 GLU A 457 -1.257 -13.082 -4.886 1.00 42.32 H new ATOM 0 HG3 GLU A 457 -0.027 -14.129 -5.567 1.00 42.32 H new ATOM 354 N TYR A 458 1.331 -10.123 -2.958 1.00 51.30 N ATOM 355 CA TYR A 458 1.733 -9.210 -1.884 1.00 23.44 C ATOM 356 C TYR A 458 0.528 -8.853 -1.000 1.00 5.21 C ATOM 357 O TYR A 458 -0.624 -8.973 -1.427 1.00 31.01 O ATOM 358 CB TYR A 458 2.350 -7.932 -2.475 1.00 2.51 C ATOM 359 CG TYR A 458 3.609 -8.176 -3.295 1.00 25.41 C ATOM 360 CD1 TYR A 458 3.533 -8.587 -4.624 1.00 44.35 C ATOM 361 CD2 TYR A 458 4.873 -8.001 -2.738 1.00 63.22 C ATOM 362 CE1 TYR A 458 4.675 -8.815 -5.369 1.00 10.22 C ATOM 363 CE2 TYR A 458 6.019 -8.226 -3.478 1.00 1.24 C ATOM 364 CZ TYR A 458 5.914 -8.633 -4.792 1.00 32.11 C ATOM 365 OH TYR A 458 7.053 -8.859 -5.531 1.00 73.12 O ATOM 0 H TYR A 458 0.541 -9.791 -3.512 1.00 51.30 H new ATOM 0 HA TYR A 458 2.480 -9.711 -1.268 1.00 23.44 H new ATOM 0 HB2 TYR A 458 1.608 -7.440 -3.104 1.00 2.51 H new ATOM 0 HB3 TYR A 458 2.585 -7.245 -1.662 1.00 2.51 H new ATOM 0 HD1 TYR A 458 2.565 -8.730 -5.080 1.00 44.35 H new ATOM 0 HD2 TYR A 458 4.960 -7.684 -1.709 1.00 63.22 H new ATOM 0 HE1 TYR A 458 4.597 -9.134 -6.398 1.00 10.22 H new ATOM 0 HE2 TYR A 458 6.991 -8.084 -3.030 1.00 1.24 H new ATOM 0 HH TYR A 458 7.757 -9.211 -4.947 1.00 73.12 H new ATOM 375 N GLU A 459 0.798 -8.405 0.225 1.00 51.33 N ATOM 376 CA GLU A 459 -0.268 -7.986 1.142 1.00 24.14 C ATOM 377 C GLU A 459 -0.116 -6.517 1.530 1.00 33.21 C ATOM 378 O GLU A 459 0.947 -6.092 1.990 1.00 0.02 O ATOM 379 CB GLU A 459 -0.256 -8.808 2.441 1.00 25.34 C ATOM 380 CG GLU A 459 -0.551 -10.293 2.284 1.00 33.53 C ATOM 381 CD GLU A 459 -0.795 -10.966 3.631 1.00 53.13 C ATOM 382 OE1 GLU A 459 0.050 -10.803 4.543 1.00 12.12 O ATOM 383 OE2 GLU A 459 -1.842 -11.627 3.796 1.00 30.52 O ATOM 0 H GLU A 459 1.740 -8.322 0.607 1.00 51.33 H new ATOM 0 HA GLU A 459 -1.205 -8.145 0.609 1.00 24.14 H new ATOM 0 HB2 GLU A 459 0.722 -8.698 2.910 1.00 25.34 H new ATOM 0 HB3 GLU A 459 -0.988 -8.381 3.126 1.00 25.34 H new ATOM 0 HG2 GLU A 459 -1.426 -10.425 1.648 1.00 33.53 H new ATOM 0 HG3 GLU A 459 0.285 -10.779 1.781 1.00 33.53 H new ATOM 390 N VAL A 460 -1.184 -5.752 1.357 1.00 3.03 N ATOM 391 CA VAL A 460 -1.242 -4.389 1.871 1.00 33.33 C ATOM 392 C VAL A 460 -2.055 -4.360 3.171 1.00 54.35 C ATOM 393 O VAL A 460 -3.264 -4.593 3.168 1.00 11.41 O ATOM 394 CB VAL A 460 -1.878 -3.416 0.843 1.00 41.41 C ATOM 395 CG1 VAL A 460 -1.843 -1.975 1.356 1.00 14.24 C ATOM 396 CG2 VAL A 460 -1.181 -3.531 -0.510 1.00 53.03 C ATOM 0 H VAL A 460 -2.025 -6.052 0.863 1.00 3.03 H new ATOM 0 HA VAL A 460 -0.220 -4.061 2.061 1.00 33.33 H new ATOM 0 HB VAL A 460 -2.923 -3.697 0.712 1.00 41.41 H new ATOM 0 HG11 VAL A 460 -2.295 -1.314 0.616 1.00 14.24 H new ATOM 0 HG12 VAL A 460 -2.400 -1.908 2.291 1.00 14.24 H new ATOM 0 HG13 VAL A 460 -0.809 -1.675 1.527 1.00 14.24 H new ATOM 0 HG21 VAL A 460 -1.642 -2.841 -1.217 1.00 53.03 H new ATOM 0 HG22 VAL A 460 -0.125 -3.284 -0.398 1.00 53.03 H new ATOM 0 HG23 VAL A 460 -1.277 -4.550 -0.883 1.00 53.03 H new ATOM 406 N HIS A 461 -1.388 -4.079 4.283 1.00 25.21 N ATOM 407 CA HIS A 461 -2.063 -3.992 5.582 1.00 31.02 C ATOM 408 C HIS A 461 -2.305 -2.526 5.957 1.00 61.14 C ATOM 409 O HIS A 461 -1.364 -1.789 6.250 1.00 12.53 O ATOM 410 CB HIS A 461 -1.243 -4.702 6.673 1.00 40.44 C ATOM 411 CG HIS A 461 -1.268 -6.200 6.577 1.00 23.21 C ATOM 412 ND1 HIS A 461 -1.982 -6.999 7.444 1.00 5.31 N ATOM 413 CD2 HIS A 461 -0.649 -7.049 5.718 1.00 4.12 C ATOM 414 CE1 HIS A 461 -1.803 -8.266 7.126 1.00 50.44 C ATOM 415 NE2 HIS A 461 -1.001 -8.324 6.082 1.00 23.40 N ATOM 0 H HIS A 461 -0.383 -3.907 4.317 1.00 25.21 H new ATOM 0 HA HIS A 461 -3.027 -4.495 5.503 1.00 31.02 H new ATOM 0 HB2 HIS A 461 -0.209 -4.362 6.616 1.00 40.44 H new ATOM 0 HB3 HIS A 461 -1.623 -4.404 7.650 1.00 40.44 H new ATOM 0 HD1 HIS A 461 -2.560 -6.662 8.214 1.00 5.31 H new ATOM 0 HD2 HIS A 461 -0.000 -6.772 4.900 1.00 4.12 H new ATOM 0 HE1 HIS A 461 -2.240 -9.113 7.635 1.00 50.44 H new ATOM 0 HE2 HIS A 461 -0.692 -9.179 5.619 1.00 23.40 H new ATOM 424 N VAL A 462 -3.569 -2.108 5.922 1.00 3.12 N ATOM 425 CA VAL A 462 -3.939 -0.719 6.197 1.00 54.23 C ATOM 426 C VAL A 462 -4.700 -0.617 7.526 1.00 62.34 C ATOM 427 O VAL A 462 -5.685 -1.320 7.752 1.00 13.54 O ATOM 428 CB VAL A 462 -4.785 -0.118 5.035 1.00 40.54 C ATOM 429 CG1 VAL A 462 -4.074 -0.329 3.702 1.00 41.22 C ATOM 430 CG2 VAL A 462 -6.194 -0.709 4.987 1.00 21.33 C ATOM 0 H VAL A 462 -4.359 -2.715 5.705 1.00 3.12 H new ATOM 0 HA VAL A 462 -3.020 -0.138 6.276 1.00 54.23 H new ATOM 0 HB VAL A 462 -4.888 0.951 5.222 1.00 40.54 H new ATOM 0 HG11 VAL A 462 -4.675 0.095 2.898 1.00 41.22 H new ATOM 0 HG12 VAL A 462 -3.102 0.163 3.726 1.00 41.22 H new ATOM 0 HG13 VAL A 462 -3.936 -1.396 3.528 1.00 41.22 H new ATOM 0 HG21 VAL A 462 -6.748 -0.262 4.162 1.00 21.33 H new ATOM 0 HG22 VAL A 462 -6.131 -1.787 4.840 1.00 21.33 H new ATOM 0 HG23 VAL A 462 -6.708 -0.500 5.925 1.00 21.33 H new ATOM 440 N LYS A 463 -4.227 0.246 8.414 1.00 63.43 N ATOM 441 CA LYS A 463 -4.799 0.352 9.757 1.00 23.31 C ATOM 442 C LYS A 463 -4.797 1.790 10.279 1.00 23.42 C ATOM 443 O LYS A 463 -3.935 2.598 9.924 1.00 2.31 O ATOM 444 CB LYS A 463 -4.022 -0.545 10.729 1.00 55.42 C ATOM 445 CG LYS A 463 -2.507 -0.377 10.630 1.00 43.22 C ATOM 446 CD LYS A 463 -1.781 -0.801 11.908 1.00 34.12 C ATOM 447 CE LYS A 463 -1.795 -2.312 12.129 1.00 35.44 C ATOM 448 NZ LYS A 463 -3.145 -2.833 12.469 1.00 5.04 N ATOM 0 H LYS A 463 -3.451 0.883 8.234 1.00 63.43 H new ATOM 0 HA LYS A 463 -5.837 0.025 9.691 1.00 23.31 H new ATOM 0 HB2 LYS A 463 -4.339 -0.324 11.748 1.00 55.42 H new ATOM 0 HB3 LYS A 463 -4.278 -1.586 10.534 1.00 55.42 H new ATOM 0 HG2 LYS A 463 -2.134 -0.967 9.793 1.00 43.22 H new ATOM 0 HG3 LYS A 463 -2.275 0.666 10.414 1.00 43.22 H new ATOM 0 HD2 LYS A 463 -0.748 -0.455 11.864 1.00 34.12 H new ATOM 0 HD3 LYS A 463 -2.246 -0.310 12.763 1.00 34.12 H new ATOM 0 HE2 LYS A 463 -1.435 -2.809 11.228 1.00 35.44 H new ATOM 0 HE3 LYS A 463 -1.101 -2.564 12.931 1.00 35.44 H new ATOM 0 HZ1 LYS A 463 -3.070 -3.499 13.264 1.00 5.04 H new ATOM 0 HZ2 LYS A 463 -3.765 -2.042 12.737 1.00 5.04 H new ATOM 0 HZ3 LYS A 463 -3.546 -3.323 11.644 1.00 5.04 H new ATOM 462 N ASN A 464 -5.776 2.095 11.124 1.00 75.12 N ATOM 463 CA ASN A 464 -5.841 3.384 11.810 1.00 41.42 C ATOM 464 C ASN A 464 -5.374 3.218 13.263 1.00 74.42 C ATOM 465 O ASN A 464 -5.888 2.372 13.994 1.00 34.15 O ATOM 466 CB ASN A 464 -7.285 3.906 11.765 1.00 40.31 C ATOM 467 CG ASN A 464 -7.431 5.335 12.265 1.00 2.12 C ATOM 468 OD1 ASN A 464 -6.679 5.804 13.115 1.00 31.33 O ATOM 469 ND2 ASN A 464 -8.413 6.038 11.742 1.00 32.33 N ATOM 0 H ASN A 464 -6.542 1.462 11.353 1.00 75.12 H new ATOM 0 HA ASN A 464 -5.188 4.102 11.315 1.00 41.42 H new ATOM 0 HB2 ASN A 464 -7.651 3.849 10.740 1.00 40.31 H new ATOM 0 HB3 ASN A 464 -7.918 3.253 12.366 1.00 40.31 H new ATOM 0 HD21 ASN A 464 -8.566 7.001 12.041 1.00 32.33 H new ATOM 0 HD22 ASN A 464 -9.021 5.620 11.038 1.00 32.33 H new ATOM 476 N LEU A 465 -4.416 4.033 13.686 1.00 53.11 N ATOM 477 CA LEU A 465 -3.873 3.942 15.049 1.00 30.44 C ATOM 478 C LEU A 465 -4.310 5.127 15.923 1.00 2.43 C ATOM 479 O LEU A 465 -4.133 5.108 17.141 1.00 2.32 O ATOM 480 CB LEU A 465 -2.341 3.851 14.995 1.00 33.14 C ATOM 481 CG LEU A 465 -1.785 2.613 14.269 1.00 23.44 C ATOM 482 CD1 LEU A 465 -0.260 2.657 14.203 1.00 61.34 C ATOM 483 CD2 LEU A 465 -2.260 1.328 14.948 1.00 73.31 C ATOM 0 H LEU A 465 -3.996 4.764 13.113 1.00 53.11 H new ATOM 0 HA LEU A 465 -4.274 3.038 15.508 1.00 30.44 H new ATOM 0 HB2 LEU A 465 -1.957 4.744 14.503 1.00 33.14 H new ATOM 0 HB3 LEU A 465 -1.956 3.858 16.015 1.00 33.14 H new ATOM 0 HG LEU A 465 -2.167 2.621 13.248 1.00 23.44 H new ATOM 0 HD11 LEU A 465 0.107 1.771 13.685 1.00 61.34 H new ATOM 0 HD12 LEU A 465 0.055 3.550 13.663 1.00 61.34 H new ATOM 0 HD13 LEU A 465 0.147 2.682 15.214 1.00 61.34 H new ATOM 0 HD21 LEU A 465 -1.855 0.466 14.418 1.00 73.31 H new ATOM 0 HD22 LEU A 465 -1.915 1.314 15.982 1.00 73.31 H new ATOM 0 HD23 LEU A 465 -3.349 1.287 14.928 1.00 73.31 H new ATOM 495 N GLY A 466 -4.910 6.142 15.301 1.00 3.15 N ATOM 496 CA GLY A 466 -5.307 7.347 16.031 1.00 2.14 C ATOM 497 C GLY A 466 -6.521 7.153 16.941 1.00 34.52 C ATOM 498 O GLY A 466 -6.756 7.952 17.847 1.00 60.03 O ATOM 0 H GLY A 466 -5.130 6.155 14.305 1.00 3.15 H new ATOM 0 HA2 GLY A 466 -4.465 7.688 16.634 1.00 2.14 H new ATOM 0 HA3 GLY A 466 -5.526 8.138 15.314 1.00 2.14 H new ATOM 502 N GLY A 467 -7.299 6.099 16.688 1.00 22.30 N ATOM 503 CA GLY A 467 -8.462 5.798 17.530 1.00 60.22 C ATOM 504 C GLY A 467 -9.739 6.524 17.107 1.00 60.00 C ATOM 505 O GLY A 467 -10.708 6.580 17.860 1.00 21.42 O ATOM 0 H GLY A 467 -7.150 5.447 15.918 1.00 22.30 H new ATOM 0 HA2 GLY A 467 -8.644 4.723 17.511 1.00 60.22 H new ATOM 0 HA3 GLY A 467 -8.230 6.063 18.561 1.00 60.22 H new ATOM 509 N ILE A 468 -9.744 7.061 15.895 1.00 71.21 N ATOM 510 CA ILE A 468 -10.902 7.793 15.354 1.00 42.14 C ATOM 511 C ILE A 468 -11.155 7.410 13.886 1.00 51.14 C ATOM 512 O ILE A 468 -10.214 7.248 13.111 1.00 13.34 O ATOM 513 CB ILE A 468 -10.703 9.328 15.490 1.00 74.44 C ATOM 514 CG1 ILE A 468 -11.809 10.105 14.750 1.00 13.53 C ATOM 515 CG2 ILE A 468 -9.324 9.737 14.986 1.00 4.25 C ATOM 516 CD1 ILE A 468 -11.733 11.609 14.935 1.00 24.11 C ATOM 0 H ILE A 468 -8.953 7.007 15.254 1.00 71.21 H new ATOM 0 HA ILE A 468 -11.778 7.510 15.938 1.00 42.14 H new ATOM 0 HB ILE A 468 -10.772 9.582 16.548 1.00 74.44 H new ATOM 0 HG12 ILE A 468 -11.750 9.876 13.686 1.00 13.53 H new ATOM 0 HG13 ILE A 468 -12.781 9.755 15.098 1.00 13.53 H new ATOM 0 HG21 ILE A 468 -9.204 10.815 15.090 1.00 4.25 H new ATOM 0 HG22 ILE A 468 -8.557 9.229 15.571 1.00 4.25 H new ATOM 0 HG23 ILE A 468 -9.223 9.460 13.937 1.00 4.25 H new ATOM 0 HD11 ILE A 468 -12.544 12.085 14.384 1.00 24.11 H new ATOM 0 HD12 ILE A 468 -11.823 11.850 15.994 1.00 24.11 H new ATOM 0 HD13 ILE A 468 -10.777 11.974 14.560 1.00 24.11 H new ATOM 528 N GLY A 469 -12.427 7.269 13.514 1.00 74.32 N ATOM 529 CA GLY A 469 -12.781 6.757 12.190 1.00 63.11 C ATOM 530 C GLY A 469 -12.593 7.755 11.043 1.00 13.41 C ATOM 531 O GLY A 469 -12.854 8.950 11.194 1.00 31.53 O ATOM 0 H GLY A 469 -13.225 7.500 14.106 1.00 74.32 H new ATOM 0 HA2 GLY A 469 -12.178 5.872 11.985 1.00 63.11 H new ATOM 0 HA3 GLY A 469 -13.823 6.436 12.207 1.00 63.11 H new ATOM 535 N VAL A 470 -12.144 7.250 9.889 1.00 61.23 N ATOM 536 CA VAL A 470 -11.946 8.066 8.681 1.00 44.31 C ATOM 537 C VAL A 470 -12.581 7.396 7.441 1.00 73.31 C ATOM 538 O VAL A 470 -12.214 6.276 7.077 1.00 13.30 O ATOM 539 CB VAL A 470 -10.436 8.308 8.405 1.00 2.13 C ATOM 540 CG1 VAL A 470 -10.238 9.176 7.160 1.00 31.42 C ATOM 541 CG2 VAL A 470 -9.758 8.945 9.619 1.00 23.12 C ATOM 0 H VAL A 470 -11.907 6.266 9.764 1.00 61.23 H new ATOM 0 HA VAL A 470 -12.436 9.022 8.863 1.00 44.31 H new ATOM 0 HB VAL A 470 -9.970 7.340 8.220 1.00 2.13 H new ATOM 0 HG11 VAL A 470 -9.172 9.330 6.990 1.00 31.42 H new ATOM 0 HG12 VAL A 470 -10.675 8.677 6.295 1.00 31.42 H new ATOM 0 HG13 VAL A 470 -10.725 10.140 7.307 1.00 31.42 H new ATOM 0 HG21 VAL A 470 -8.702 9.105 9.403 1.00 23.12 H new ATOM 0 HG22 VAL A 470 -10.232 9.901 9.841 1.00 23.12 H new ATOM 0 HG23 VAL A 470 -9.856 8.283 10.479 1.00 23.12 H new ATOM 551 N PRO A 471 -13.546 8.068 6.777 1.00 54.30 N ATOM 552 CA PRO A 471 -14.192 7.553 5.561 1.00 42.22 C ATOM 553 C PRO A 471 -13.419 7.903 4.269 1.00 73.10 C ATOM 554 O PRO A 471 -13.694 7.361 3.197 1.00 2.33 O ATOM 555 CB PRO A 471 -15.572 8.248 5.572 1.00 21.21 C ATOM 556 CG PRO A 471 -15.543 9.249 6.698 1.00 1.53 C ATOM 557 CD PRO A 471 -14.113 9.365 7.160 1.00 63.15 C ATOM 0 HA PRO A 471 -14.241 6.464 5.563 1.00 42.22 H new ATOM 0 HB2 PRO A 471 -15.764 8.742 4.620 1.00 21.21 H new ATOM 0 HB3 PRO A 471 -16.370 7.521 5.721 1.00 21.21 H new ATOM 0 HG2 PRO A 471 -15.918 10.216 6.362 1.00 1.53 H new ATOM 0 HG3 PRO A 471 -16.186 8.925 7.516 1.00 1.53 H new ATOM 0 HD2 PRO A 471 -13.596 10.193 6.674 1.00 63.15 H new ATOM 0 HD3 PRO A 471 -14.047 9.535 8.235 1.00 63.15 H new ATOM 565 N SER A 472 -12.449 8.804 4.389 1.00 51.41 N ATOM 566 CA SER A 472 -11.675 9.314 3.239 1.00 60.11 C ATOM 567 C SER A 472 -10.493 8.403 2.859 1.00 34.24 C ATOM 568 O SER A 472 -9.626 8.790 2.077 1.00 53.01 O ATOM 569 CB SER A 472 -11.160 10.733 3.513 1.00 12.41 C ATOM 570 OG SER A 472 -10.555 11.285 2.352 1.00 61.51 O ATOM 0 H SER A 472 -12.169 9.208 5.283 1.00 51.41 H new ATOM 0 HA SER A 472 -12.364 9.328 2.394 1.00 60.11 H new ATOM 0 HB2 SER A 472 -11.985 11.368 3.835 1.00 12.41 H new ATOM 0 HB3 SER A 472 -10.438 10.711 4.329 1.00 12.41 H new ATOM 0 HG SER A 472 -10.027 10.595 1.899 1.00 61.51 H new ATOM 576 N THR A 473 -10.463 7.185 3.386 1.00 44.20 N ATOM 577 CA THR A 473 -9.248 6.366 3.338 1.00 42.24 C ATOM 578 C THR A 473 -9.145 5.559 2.034 1.00 54.34 C ATOM 579 O THR A 473 -9.670 4.452 1.908 1.00 1.13 O ATOM 580 CB THR A 473 -9.206 5.384 4.540 1.00 14.53 C ATOM 581 OG1 THR A 473 -9.234 6.117 5.775 1.00 11.34 O ATOM 582 CG2 THR A 473 -7.963 4.497 4.503 1.00 72.40 C ATOM 0 H THR A 473 -11.256 6.741 3.849 1.00 44.20 H new ATOM 0 HA THR A 473 -8.404 7.054 3.386 1.00 42.24 H new ATOM 0 HB THR A 473 -10.083 4.741 4.470 1.00 14.53 H new ATOM 0 HG1 THR A 473 -10.150 6.137 6.123 1.00 11.34 H new ATOM 0 HG21 THR A 473 -7.971 3.824 5.360 1.00 72.40 H new ATOM 0 HG22 THR A 473 -7.960 3.912 3.583 1.00 72.40 H new ATOM 0 HG23 THR A 473 -7.070 5.121 4.539 1.00 72.40 H new ATOM 590 N LYS A 474 -8.480 6.159 1.049 1.00 3.50 N ATOM 591 CA LYS A 474 -8.176 5.490 -0.220 1.00 40.35 C ATOM 592 C LYS A 474 -6.743 4.929 -0.209 1.00 51.20 C ATOM 593 O LYS A 474 -5.798 5.636 0.144 1.00 55.41 O ATOM 594 CB LYS A 474 -8.332 6.470 -1.393 1.00 54.24 C ATOM 595 CG LYS A 474 -9.706 7.136 -1.472 1.00 50.31 C ATOM 596 CD LYS A 474 -9.829 8.025 -2.709 1.00 23.11 C ATOM 597 CE LYS A 474 -11.140 8.808 -2.733 1.00 51.21 C ATOM 598 NZ LYS A 474 -12.334 7.918 -2.691 1.00 12.33 N ATOM 0 H LYS A 474 -8.137 7.118 1.104 1.00 3.50 H new ATOM 0 HA LYS A 474 -8.879 4.666 -0.343 1.00 40.35 H new ATOM 0 HB2 LYS A 474 -7.569 7.244 -1.309 1.00 54.24 H new ATOM 0 HB3 LYS A 474 -8.144 5.937 -2.325 1.00 54.24 H new ATOM 0 HG2 LYS A 474 -10.481 6.370 -1.495 1.00 50.31 H new ATOM 0 HG3 LYS A 474 -9.874 7.733 -0.576 1.00 50.31 H new ATOM 0 HD2 LYS A 474 -8.992 8.722 -2.737 1.00 23.11 H new ATOM 0 HD3 LYS A 474 -9.760 7.408 -3.605 1.00 23.11 H new ATOM 0 HE2 LYS A 474 -11.168 9.490 -1.883 1.00 51.21 H new ATOM 0 HE3 LYS A 474 -11.178 9.420 -3.634 1.00 51.21 H new ATOM 0 HZ1 LYS A 474 -12.985 8.174 -3.460 1.00 12.33 H new ATOM 0 HZ2 LYS A 474 -12.034 6.929 -2.807 1.00 12.33 H new ATOM 0 HZ3 LYS A 474 -12.817 8.029 -1.777 1.00 12.33 H new ATOM 612 N VAL A 475 -6.594 3.663 -0.594 1.00 70.33 N ATOM 613 CA VAL A 475 -5.284 2.991 -0.621 1.00 41.45 C ATOM 614 C VAL A 475 -4.862 2.670 -2.064 1.00 71.12 C ATOM 615 O VAL A 475 -5.614 2.051 -2.813 1.00 43.44 O ATOM 616 CB VAL A 475 -5.321 1.681 0.204 1.00 44.43 C ATOM 617 CG1 VAL A 475 -3.940 1.026 0.255 1.00 15.34 C ATOM 618 CG2 VAL A 475 -5.856 1.953 1.610 1.00 14.42 C ATOM 0 H VAL A 475 -7.369 3.072 -0.895 1.00 70.33 H new ATOM 0 HA VAL A 475 -4.556 3.672 -0.180 1.00 41.45 H new ATOM 0 HB VAL A 475 -5.997 0.983 -0.289 1.00 44.43 H new ATOM 0 HG11 VAL A 475 -3.994 0.108 0.840 1.00 15.34 H new ATOM 0 HG12 VAL A 475 -3.611 0.792 -0.757 1.00 15.34 H new ATOM 0 HG13 VAL A 475 -3.230 1.711 0.718 1.00 15.34 H new ATOM 0 HG21 VAL A 475 -5.876 1.023 2.178 1.00 14.42 H new ATOM 0 HG22 VAL A 475 -5.209 2.671 2.113 1.00 14.42 H new ATOM 0 HG23 VAL A 475 -6.865 2.359 1.543 1.00 14.42 H new ATOM 628 N ARG A 476 -3.659 3.088 -2.451 1.00 22.25 N ATOM 629 CA ARG A 476 -3.193 2.922 -3.837 1.00 31.11 C ATOM 630 C ARG A 476 -1.792 2.288 -3.900 1.00 44.43 C ATOM 631 O ARG A 476 -0.962 2.499 -3.015 1.00 44.30 O ATOM 632 CB ARG A 476 -3.192 4.287 -4.546 1.00 41.03 C ATOM 633 CG ARG A 476 -4.549 4.989 -4.517 1.00 13.32 C ATOM 634 CD ARG A 476 -4.491 6.392 -5.109 1.00 22.13 C ATOM 635 NE ARG A 476 -5.775 7.081 -4.992 1.00 53.00 N ATOM 636 CZ ARG A 476 -5.909 8.373 -4.852 1.00 24.35 C ATOM 637 NH1 ARG A 476 -4.866 9.142 -4.819 1.00 12.34 N ATOM 638 NH2 ARG A 476 -7.092 8.889 -4.737 1.00 72.21 N ATOM 0 H ARG A 476 -2.988 3.543 -1.832 1.00 22.25 H new ATOM 0 HA ARG A 476 -3.879 2.243 -4.344 1.00 31.11 H new ATOM 0 HB2 ARG A 476 -2.448 4.931 -4.077 1.00 41.03 H new ATOM 0 HB3 ARG A 476 -2.885 4.149 -5.583 1.00 41.03 H new ATOM 0 HG2 ARG A 476 -5.275 4.394 -5.071 1.00 13.32 H new ATOM 0 HG3 ARG A 476 -4.903 5.046 -3.488 1.00 13.32 H new ATOM 0 HD2 ARG A 476 -3.720 6.970 -4.600 1.00 22.13 H new ATOM 0 HD3 ARG A 476 -4.204 6.333 -6.159 1.00 22.13 H new ATOM 0 HE ARG A 476 -6.623 6.515 -5.022 1.00 53.00 H new ATOM 0 HH11 ARG A 476 -3.933 8.739 -4.903 1.00 12.34 H new ATOM 0 HH12 ARG A 476 -4.979 10.150 -4.709 1.00 12.34 H new ATOM 0 HH21 ARG A 476 -7.915 8.287 -4.756 1.00 72.21 H new ATOM 0 HH22 ARG A 476 -7.200 9.897 -4.628 1.00 72.21 H new ATOM 652 N VAL A 477 -1.537 1.510 -4.958 1.00 61.41 N ATOM 653 CA VAL A 477 -0.237 0.853 -5.154 1.00 64.53 C ATOM 654 C VAL A 477 0.417 1.300 -6.472 1.00 55.54 C ATOM 655 O VAL A 477 -0.165 1.152 -7.549 1.00 64.45 O ATOM 656 CB VAL A 477 -0.390 -0.692 -5.162 1.00 54.22 C ATOM 657 CG1 VAL A 477 0.926 -1.375 -5.531 1.00 63.15 C ATOM 658 CG2 VAL A 477 -0.893 -1.190 -3.808 1.00 21.11 C ATOM 0 H VAL A 477 -2.216 1.319 -5.695 1.00 61.41 H new ATOM 0 HA VAL A 477 0.401 1.147 -4.321 1.00 64.53 H new ATOM 0 HB VAL A 477 -1.127 -0.952 -5.922 1.00 54.22 H new ATOM 0 HG11 VAL A 477 0.788 -2.456 -5.528 1.00 63.15 H new ATOM 0 HG12 VAL A 477 1.238 -1.051 -6.524 1.00 63.15 H new ATOM 0 HG13 VAL A 477 1.692 -1.105 -4.804 1.00 63.15 H new ATOM 0 HG21 VAL A 477 -0.994 -2.275 -3.834 1.00 21.11 H new ATOM 0 HG22 VAL A 477 -0.182 -0.910 -3.030 1.00 21.11 H new ATOM 0 HG23 VAL A 477 -1.862 -0.741 -3.592 1.00 21.11 H new ATOM 668 N TYR A 478 1.622 1.854 -6.375 1.00 21.22 N ATOM 669 CA TYR A 478 2.368 2.328 -7.546 1.00 10.33 C ATOM 670 C TYR A 478 3.632 1.485 -7.782 1.00 2.13 C ATOM 671 O TYR A 478 4.357 1.162 -6.842 1.00 4.01 O ATOM 672 CB TYR A 478 2.764 3.801 -7.356 1.00 32.02 C ATOM 673 CG TYR A 478 1.584 4.751 -7.231 1.00 25.13 C ATOM 674 CD1 TYR A 478 0.903 4.904 -6.025 1.00 45.44 C ATOM 675 CD2 TYR A 478 1.152 5.498 -8.322 1.00 70.43 C ATOM 676 CE1 TYR A 478 -0.170 5.768 -5.916 1.00 70.21 C ATOM 677 CE2 TYR A 478 0.081 6.362 -8.218 1.00 61.25 C ATOM 678 CZ TYR A 478 -0.576 6.494 -7.015 1.00 55.31 C ATOM 679 OH TYR A 478 -1.646 7.352 -6.915 1.00 1.41 O ATOM 0 H TYR A 478 2.110 1.988 -5.490 1.00 21.22 H new ATOM 0 HA TYR A 478 1.720 2.229 -8.417 1.00 10.33 H new ATOM 0 HB2 TYR A 478 3.382 3.887 -6.462 1.00 32.02 H new ATOM 0 HB3 TYR A 478 3.379 4.112 -8.200 1.00 32.02 H new ATOM 0 HD1 TYR A 478 1.219 4.338 -5.161 1.00 45.44 H new ATOM 0 HD2 TYR A 478 1.664 5.400 -9.268 1.00 70.43 H new ATOM 0 HE1 TYR A 478 -0.688 5.874 -4.974 1.00 70.21 H new ATOM 0 HE2 TYR A 478 -0.241 6.932 -9.077 1.00 61.25 H new ATOM 0 HH TYR A 478 -1.712 7.687 -5.996 1.00 1.41 H new ATOM 689 N ILE A 479 3.894 1.138 -9.039 1.00 52.30 N ATOM 690 CA ILE A 479 5.115 0.411 -9.410 1.00 1.53 C ATOM 691 C ILE A 479 6.045 1.323 -10.220 1.00 62.02 C ATOM 692 O ILE A 479 5.724 1.705 -11.347 1.00 70.13 O ATOM 693 CB ILE A 479 4.794 -0.863 -10.237 1.00 70.42 C ATOM 694 CG1 ILE A 479 3.853 -1.793 -9.451 1.00 21.15 C ATOM 695 CG2 ILE A 479 6.084 -1.594 -10.614 1.00 71.22 C ATOM 696 CD1 ILE A 479 3.465 -3.055 -10.198 1.00 44.54 C ATOM 0 H ILE A 479 3.277 1.347 -9.824 1.00 52.30 H new ATOM 0 HA ILE A 479 5.608 0.104 -8.488 1.00 1.53 H new ATOM 0 HB ILE A 479 4.289 -0.562 -11.155 1.00 70.42 H new ATOM 0 HG12 ILE A 479 4.334 -2.072 -8.514 1.00 21.15 H new ATOM 0 HG13 ILE A 479 2.948 -1.243 -9.193 1.00 21.15 H new ATOM 0 HG21 ILE A 479 5.841 -2.485 -11.193 1.00 71.22 H new ATOM 0 HG22 ILE A 479 6.715 -0.934 -11.210 1.00 71.22 H new ATOM 0 HG23 ILE A 479 6.616 -1.884 -9.708 1.00 71.22 H new ATOM 0 HD11 ILE A 479 2.801 -3.656 -9.577 1.00 44.54 H new ATOM 0 HD12 ILE A 479 2.953 -2.788 -11.123 1.00 44.54 H new ATOM 0 HD13 ILE A 479 4.361 -3.629 -10.432 1.00 44.54 H new ATOM 708 N ASN A 480 7.189 1.682 -9.634 1.00 72.22 N ATOM 709 CA ASN A 480 8.128 2.628 -10.258 1.00 15.03 C ATOM 710 C ASN A 480 7.434 3.953 -10.622 1.00 43.31 C ATOM 711 O ASN A 480 7.766 4.586 -11.624 1.00 12.34 O ATOM 712 CB ASN A 480 8.785 2.014 -11.505 1.00 55.34 C ATOM 713 CG ASN A 480 9.744 0.887 -11.167 1.00 10.11 C ATOM 714 OD1 ASN A 480 10.322 0.849 -10.089 1.00 52.42 O ATOM 715 ND2 ASN A 480 9.941 -0.031 -12.093 1.00 11.35 N ATOM 0 H ASN A 480 7.492 1.333 -8.725 1.00 72.22 H new ATOM 0 HA ASN A 480 8.906 2.841 -9.525 1.00 15.03 H new ATOM 0 HB2 ASN A 480 8.009 1.638 -12.171 1.00 55.34 H new ATOM 0 HB3 ASN A 480 9.322 2.792 -12.048 1.00 55.34 H new ATOM 0 HD21 ASN A 480 10.590 -0.799 -11.920 1.00 11.35 H new ATOM 0 HD22 ASN A 480 9.445 0.027 -12.982 1.00 11.35 H new ATOM 722 N GLY A 481 6.480 4.369 -9.792 1.00 41.13 N ATOM 723 CA GLY A 481 5.778 5.628 -10.018 1.00 21.30 C ATOM 724 C GLY A 481 4.400 5.464 -10.659 1.00 25.14 C ATOM 725 O GLY A 481 3.471 6.201 -10.331 1.00 43.24 O ATOM 0 H GLY A 481 6.178 3.857 -8.963 1.00 41.13 H new ATOM 0 HA2 GLY A 481 5.665 6.146 -9.065 1.00 21.30 H new ATOM 0 HA3 GLY A 481 6.391 6.265 -10.656 1.00 21.30 H new ATOM 729 N THR A 482 4.263 4.501 -11.566 1.00 74.13 N ATOM 730 CA THR A 482 3.005 4.304 -12.307 1.00 41.22 C ATOM 731 C THR A 482 1.986 3.488 -11.495 1.00 61.13 C ATOM 732 O THR A 482 2.313 2.427 -10.958 1.00 41.22 O ATOM 733 CB THR A 482 3.260 3.593 -13.660 1.00 12.13 C ATOM 734 OG1 THR A 482 4.230 4.324 -14.429 1.00 34.40 O ATOM 735 CG2 THR A 482 1.973 3.460 -14.473 1.00 53.43 C ATOM 0 H THR A 482 5.002 3.842 -11.811 1.00 74.13 H new ATOM 0 HA THR A 482 2.593 5.296 -12.490 1.00 41.22 H new ATOM 0 HB THR A 482 3.637 2.594 -13.440 1.00 12.13 H new ATOM 0 HG1 THR A 482 4.385 3.865 -15.281 1.00 34.40 H new ATOM 0 HG21 THR A 482 2.188 2.957 -15.416 1.00 53.43 H new ATOM 0 HG22 THR A 482 1.245 2.877 -13.909 1.00 53.43 H new ATOM 0 HG23 THR A 482 1.566 4.451 -14.675 1.00 53.43 H new ATOM 743 N LEU A 483 0.749 3.979 -11.426 1.00 62.24 N ATOM 744 CA LEU A 483 -0.313 3.317 -10.656 1.00 22.34 C ATOM 745 C LEU A 483 -0.622 1.913 -11.198 1.00 64.24 C ATOM 746 O LEU A 483 -0.763 1.711 -12.407 1.00 62.23 O ATOM 747 CB LEU A 483 -1.590 4.174 -10.666 1.00 15.42 C ATOM 748 CG LEU A 483 -2.771 3.613 -9.851 1.00 1.12 C ATOM 749 CD1 LEU A 483 -2.403 3.482 -8.374 1.00 60.02 C ATOM 750 CD2 LEU A 483 -4.010 4.491 -10.027 1.00 63.02 C ATOM 0 H LEU A 483 0.453 4.836 -11.894 1.00 62.24 H new ATOM 0 HA LEU A 483 0.045 3.208 -9.632 1.00 22.34 H new ATOM 0 HB2 LEU A 483 -1.345 5.165 -10.283 1.00 15.42 H new ATOM 0 HB3 LEU A 483 -1.913 4.302 -11.699 1.00 15.42 H new ATOM 0 HG LEU A 483 -3.001 2.617 -10.228 1.00 1.12 H new ATOM 0 HD11 LEU A 483 -3.254 3.084 -7.821 1.00 60.02 H new ATOM 0 HD12 LEU A 483 -1.554 2.807 -8.269 1.00 60.02 H new ATOM 0 HD13 LEU A 483 -2.138 4.462 -7.977 1.00 60.02 H new ATOM 0 HD21 LEU A 483 -4.834 4.079 -9.444 1.00 63.02 H new ATOM 0 HD22 LEU A 483 -3.792 5.502 -9.682 1.00 63.02 H new ATOM 0 HD23 LEU A 483 -4.289 4.519 -11.080 1.00 63.02 H new ATOM 762 N TYR A 484 -0.707 0.941 -10.294 1.00 64.44 N ATOM 763 CA TYR A 484 -1.030 -0.441 -10.660 1.00 12.44 C ATOM 764 C TYR A 484 -2.475 -0.812 -10.279 1.00 52.24 C ATOM 765 O TYR A 484 -3.191 -1.433 -11.062 1.00 52.31 O ATOM 766 CB TYR A 484 -0.042 -1.401 -9.979 1.00 61.11 C ATOM 767 CG TYR A 484 -0.404 -2.867 -10.142 1.00 12.50 C ATOM 768 CD1 TYR A 484 -0.204 -3.524 -11.353 1.00 53.21 C ATOM 769 CD2 TYR A 484 -0.955 -3.588 -9.087 1.00 63.24 C ATOM 770 CE1 TYR A 484 -0.542 -4.854 -11.506 1.00 51.12 C ATOM 771 CE2 TYR A 484 -1.298 -4.919 -9.235 1.00 63.41 C ATOM 772 CZ TYR A 484 -1.089 -5.548 -10.447 1.00 73.24 C ATOM 773 OH TYR A 484 -1.431 -6.874 -10.604 1.00 41.01 O ATOM 0 H TYR A 484 -0.556 1.083 -9.295 1.00 64.44 H new ATOM 0 HA TYR A 484 -0.943 -0.530 -11.743 1.00 12.44 H new ATOM 0 HB2 TYR A 484 0.954 -1.234 -10.389 1.00 61.11 H new ATOM 0 HB3 TYR A 484 0.007 -1.164 -8.916 1.00 61.11 H new ATOM 0 HD1 TYR A 484 0.222 -2.985 -12.186 1.00 53.21 H new ATOM 0 HD2 TYR A 484 -1.117 -3.100 -8.137 1.00 63.24 H new ATOM 0 HE1 TYR A 484 -0.379 -5.349 -12.452 1.00 51.12 H new ATOM 0 HE2 TYR A 484 -1.727 -5.464 -8.407 1.00 63.41 H new ATOM 0 HH TYR A 484 -1.802 -7.218 -9.765 1.00 41.01 H new ATOM 783 N LYS A 485 -2.894 -0.424 -9.075 1.00 62.15 N ATOM 784 CA LYS A 485 -4.227 -0.772 -8.564 1.00 12.42 C ATOM 785 C LYS A 485 -4.619 0.159 -7.403 1.00 73.53 C ATOM 786 O LYS A 485 -3.750 0.662 -6.687 1.00 32.34 O ATOM 787 CB LYS A 485 -4.234 -2.246 -8.114 1.00 44.13 C ATOM 788 CG LYS A 485 -5.624 -2.824 -7.842 1.00 24.14 C ATOM 789 CD LYS A 485 -5.574 -4.332 -7.589 1.00 50.30 C ATOM 790 CE LYS A 485 -6.970 -4.929 -7.421 1.00 25.34 C ATOM 791 NZ LYS A 485 -6.927 -6.403 -7.210 1.00 65.21 N ATOM 0 H LYS A 485 -2.331 0.132 -8.431 1.00 62.15 H new ATOM 0 HA LYS A 485 -4.963 -0.642 -9.357 1.00 12.42 H new ATOM 0 HB2 LYS A 485 -3.749 -2.849 -8.882 1.00 44.13 H new ATOM 0 HB3 LYS A 485 -3.633 -2.338 -7.209 1.00 44.13 H new ATOM 0 HG2 LYS A 485 -6.062 -2.325 -6.978 1.00 24.14 H new ATOM 0 HG3 LYS A 485 -6.275 -2.620 -8.692 1.00 24.14 H new ATOM 0 HD2 LYS A 485 -5.067 -4.823 -8.420 1.00 50.30 H new ATOM 0 HD3 LYS A 485 -4.984 -4.530 -6.694 1.00 50.30 H new ATOM 0 HE2 LYS A 485 -7.466 -4.456 -6.574 1.00 25.34 H new ATOM 0 HE3 LYS A 485 -7.568 -4.707 -8.305 1.00 25.34 H new ATOM 0 HZ1 LYS A 485 -7.895 -6.766 -7.101 1.00 65.21 H new ATOM 0 HZ2 LYS A 485 -6.477 -6.858 -8.030 1.00 65.21 H new ATOM 0 HZ3 LYS A 485 -6.379 -6.615 -6.352 1.00 65.21 H new ATOM 805 N ASN A 486 -5.920 0.397 -7.222 1.00 14.02 N ATOM 806 CA ASN A 486 -6.393 1.337 -6.191 1.00 71.11 C ATOM 807 C ASN A 486 -7.656 0.833 -5.468 1.00 35.00 C ATOM 808 O ASN A 486 -8.459 0.083 -6.028 1.00 4.55 O ATOM 809 CB ASN A 486 -6.659 2.714 -6.819 1.00 41.22 C ATOM 810 CG ASN A 486 -7.664 2.655 -7.956 1.00 30.45 C ATOM 811 OD1 ASN A 486 -8.863 2.823 -7.758 1.00 32.03 O ATOM 812 ND2 ASN A 486 -7.186 2.406 -9.160 1.00 44.33 N ATOM 0 H ASN A 486 -6.662 -0.041 -7.768 1.00 14.02 H new ATOM 0 HA ASN A 486 -5.605 1.418 -5.442 1.00 71.11 H new ATOM 0 HB2 ASN A 486 -7.025 3.395 -6.051 1.00 41.22 H new ATOM 0 HB3 ASN A 486 -5.721 3.127 -7.190 1.00 41.22 H new ATOM 0 HD21 ASN A 486 -7.819 2.349 -9.958 1.00 44.33 H new ATOM 0 HD22 ASN A 486 -6.184 2.271 -9.293 1.00 44.33 H new ATOM 819 N TRP A 487 -7.812 1.264 -4.217 1.00 50.01 N ATOM 820 CA TRP A 487 -8.960 0.894 -3.379 1.00 53.05 C ATOM 821 C TRP A 487 -9.501 2.111 -2.616 1.00 41.00 C ATOM 822 O TRP A 487 -8.753 3.027 -2.275 1.00 11.22 O ATOM 823 CB TRP A 487 -8.561 -0.172 -2.345 1.00 41.00 C ATOM 824 CG TRP A 487 -8.128 -1.485 -2.928 1.00 73.14 C ATOM 825 CD1 TRP A 487 -8.931 -2.531 -3.283 1.00 54.05 C ATOM 826 CD2 TRP A 487 -6.784 -1.904 -3.194 1.00 30.12 C ATOM 827 NE1 TRP A 487 -8.168 -3.568 -3.759 1.00 55.30 N ATOM 828 CE2 TRP A 487 -6.849 -3.209 -3.713 1.00 1.55 C ATOM 829 CE3 TRP A 487 -5.531 -1.302 -3.044 1.00 54.33 C ATOM 830 CZ2 TRP A 487 -5.713 -3.922 -4.084 1.00 64.13 C ATOM 831 CZ3 TRP A 487 -4.404 -2.011 -3.414 1.00 52.23 C ATOM 832 CH2 TRP A 487 -4.501 -3.309 -3.929 1.00 0.42 C ATOM 0 H TRP A 487 -7.146 1.881 -3.752 1.00 50.01 H new ATOM 0 HA TRP A 487 -9.727 0.502 -4.046 1.00 53.05 H new ATOM 0 HB2 TRP A 487 -7.750 0.222 -1.732 1.00 41.00 H new ATOM 0 HB3 TRP A 487 -9.407 -0.347 -1.680 1.00 41.00 H new ATOM 0 HD1 TRP A 487 -10.008 -2.541 -3.201 1.00 54.05 H new ATOM 0 HE1 TRP A 487 -8.527 -4.462 -4.093 1.00 55.30 H new ATOM 0 HE3 TRP A 487 -5.446 -0.302 -2.646 1.00 54.33 H new ATOM 0 HZ2 TRP A 487 -5.786 -4.924 -4.480 1.00 64.13 H new ATOM 0 HZ3 TRP A 487 -3.431 -1.555 -3.304 1.00 52.23 H new ATOM 0 HH2 TRP A 487 -3.601 -3.836 -4.209 1.00 0.42 H new ATOM 843 N THR A 488 -10.803 2.115 -2.350 1.00 51.40 N ATOM 844 CA THR A 488 -11.407 3.105 -1.444 1.00 63.33 C ATOM 845 C THR A 488 -12.138 2.396 -0.300 1.00 10.44 C ATOM 846 O THR A 488 -13.081 1.638 -0.531 1.00 50.44 O ATOM 847 CB THR A 488 -12.402 4.043 -2.174 1.00 74.50 C ATOM 848 OG1 THR A 488 -11.712 4.827 -3.160 1.00 15.23 O ATOM 849 CG2 THR A 488 -13.102 4.975 -1.188 1.00 64.22 C ATOM 0 H THR A 488 -11.466 1.448 -2.745 1.00 51.40 H new ATOM 0 HA THR A 488 -10.592 3.715 -1.054 1.00 63.33 H new ATOM 0 HB THR A 488 -13.152 3.420 -2.660 1.00 74.50 H new ATOM 0 HG1 THR A 488 -12.362 5.217 -3.781 1.00 15.23 H new ATOM 0 HG21 THR A 488 -13.794 5.622 -1.727 1.00 64.22 H new ATOM 0 HG22 THR A 488 -13.653 4.384 -0.457 1.00 64.22 H new ATOM 0 HG23 THR A 488 -12.359 5.586 -0.675 1.00 64.22 H new ATOM 857 N VAL A 489 -11.703 2.647 0.933 1.00 20.40 N ATOM 858 CA VAL A 489 -12.272 1.985 2.114 1.00 51.40 C ATOM 859 C VAL A 489 -12.489 2.976 3.267 1.00 72.20 C ATOM 860 O VAL A 489 -12.114 4.147 3.184 1.00 71.45 O ATOM 861 CB VAL A 489 -11.364 0.825 2.615 1.00 41.41 C ATOM 862 CG1 VAL A 489 -11.245 -0.278 1.564 1.00 45.24 C ATOM 863 CG2 VAL A 489 -9.981 1.347 3.009 1.00 12.44 C ATOM 0 H VAL A 489 -10.955 3.307 1.145 1.00 20.40 H new ATOM 0 HA VAL A 489 -13.234 1.578 1.803 1.00 51.40 H new ATOM 0 HB VAL A 489 -11.833 0.395 3.500 1.00 41.41 H new ATOM 0 HG11 VAL A 489 -10.604 -1.074 1.943 1.00 45.24 H new ATOM 0 HG12 VAL A 489 -12.234 -0.681 1.346 1.00 45.24 H new ATOM 0 HG13 VAL A 489 -10.811 0.133 0.652 1.00 45.24 H new ATOM 0 HG21 VAL A 489 -9.364 0.518 3.356 1.00 12.44 H new ATOM 0 HG22 VAL A 489 -9.508 1.814 2.145 1.00 12.44 H new ATOM 0 HG23 VAL A 489 -10.083 2.082 3.807 1.00 12.44 H new ATOM 873 N SER A 490 -13.124 2.501 4.329 1.00 75.14 N ATOM 874 CA SER A 490 -13.296 3.288 5.556 1.00 43.13 C ATOM 875 C SER A 490 -12.649 2.571 6.749 1.00 5.11 C ATOM 876 O SER A 490 -12.809 1.360 6.917 1.00 74.44 O ATOM 877 CB SER A 490 -14.787 3.535 5.830 1.00 60.40 C ATOM 878 OG SER A 490 -15.520 2.319 5.837 1.00 62.11 O ATOM 0 H SER A 490 -13.534 1.568 4.372 1.00 75.14 H new ATOM 0 HA SER A 490 -12.803 4.250 5.419 1.00 43.13 H new ATOM 0 HB2 SER A 490 -14.904 4.038 6.790 1.00 60.40 H new ATOM 0 HB3 SER A 490 -15.193 4.202 5.069 1.00 60.40 H new ATOM 0 HG SER A 490 -16.465 2.508 6.016 1.00 62.11 H new ATOM 884 N LEU A 491 -11.908 3.314 7.571 1.00 10.32 N ATOM 885 CA LEU A 491 -11.237 2.735 8.745 1.00 20.24 C ATOM 886 C LEU A 491 -11.764 3.346 10.044 1.00 14.42 C ATOM 887 O LEU A 491 -11.658 4.551 10.262 1.00 64.42 O ATOM 888 CB LEU A 491 -9.714 2.944 8.658 1.00 21.44 C ATOM 889 CG LEU A 491 -8.993 2.114 7.585 1.00 35.51 C ATOM 890 CD1 LEU A 491 -7.503 2.443 7.553 1.00 52.22 C ATOM 891 CD2 LEU A 491 -9.204 0.624 7.833 1.00 51.53 C ATOM 0 H LEU A 491 -11.755 4.315 7.450 1.00 10.32 H new ATOM 0 HA LEU A 491 -11.454 1.667 8.751 1.00 20.24 H new ATOM 0 HB2 LEU A 491 -9.520 3.999 8.467 1.00 21.44 H new ATOM 0 HB3 LEU A 491 -9.277 2.710 9.629 1.00 21.44 H new ATOM 0 HG LEU A 491 -9.419 2.369 6.615 1.00 35.51 H new ATOM 0 HD11 LEU A 491 -7.014 1.843 6.786 1.00 52.22 H new ATOM 0 HD12 LEU A 491 -7.369 3.501 7.327 1.00 52.22 H new ATOM 0 HD13 LEU A 491 -7.060 2.221 8.524 1.00 52.22 H new ATOM 0 HD21 LEU A 491 -8.687 0.050 7.064 1.00 51.53 H new ATOM 0 HD22 LEU A 491 -8.807 0.358 8.813 1.00 51.53 H new ATOM 0 HD23 LEU A 491 -10.270 0.397 7.800 1.00 51.53 H new ATOM 903 N GLY A 492 -12.316 2.505 10.911 1.00 33.20 N ATOM 904 CA GLY A 492 -12.828 2.977 12.190 1.00 61.20 C ATOM 905 C GLY A 492 -11.744 3.109 13.257 1.00 42.12 C ATOM 906 O GLY A 492 -10.549 3.001 12.959 1.00 24.50 O ATOM 0 H GLY A 492 -12.420 1.503 10.753 1.00 33.20 H new ATOM 0 HA2 GLY A 492 -13.309 3.945 12.047 1.00 61.20 H new ATOM 0 HA3 GLY A 492 -13.596 2.289 12.544 1.00 61.20 H new ATOM 910 N PRO A 493 -12.131 3.344 14.523 1.00 21.05 N ATOM 911 CA PRO A 493 -11.171 3.478 15.629 1.00 62.21 C ATOM 912 C PRO A 493 -10.334 2.205 15.839 1.00 24.03 C ATOM 913 O PRO A 493 -10.849 1.175 16.277 1.00 61.51 O ATOM 914 CB PRO A 493 -12.064 3.763 16.849 1.00 12.43 C ATOM 915 CG PRO A 493 -13.419 3.267 16.462 1.00 14.54 C ATOM 916 CD PRO A 493 -13.525 3.494 14.979 1.00 1.40 C ATOM 0 HA PRO A 493 -10.436 4.260 15.440 1.00 62.21 H new ATOM 0 HB2 PRO A 493 -11.695 3.250 17.737 1.00 12.43 H new ATOM 0 HB3 PRO A 493 -12.085 4.828 17.082 1.00 12.43 H new ATOM 0 HG2 PRO A 493 -13.534 2.211 16.706 1.00 14.54 H new ATOM 0 HG3 PRO A 493 -14.201 3.805 16.998 1.00 14.54 H new ATOM 0 HD2 PRO A 493 -14.185 2.768 14.505 1.00 1.40 H new ATOM 0 HD3 PRO A 493 -13.921 4.483 14.749 1.00 1.40 H new ATOM 924 N LYS A 494 -9.043 2.286 15.497 1.00 55.24 N ATOM 925 CA LYS A 494 -8.099 1.164 15.656 1.00 11.24 C ATOM 926 C LYS A 494 -8.384 0.015 14.659 1.00 2.33 C ATOM 927 O LYS A 494 -7.917 -1.110 14.847 1.00 33.52 O ATOM 928 CB LYS A 494 -8.126 0.629 17.102 1.00 64.13 C ATOM 929 CG LYS A 494 -7.841 1.681 18.179 1.00 13.32 C ATOM 930 CD LYS A 494 -6.457 2.312 18.036 1.00 12.12 C ATOM 931 CE LYS A 494 -5.960 2.902 19.356 1.00 61.13 C ATOM 932 NZ LYS A 494 -6.979 3.758 20.030 1.00 23.01 N ATOM 0 H LYS A 494 -8.620 3.127 15.103 1.00 55.24 H new ATOM 0 HA LYS A 494 -7.104 1.552 15.437 1.00 11.24 H new ATOM 0 HB2 LYS A 494 -9.104 0.188 17.294 1.00 64.13 H new ATOM 0 HB3 LYS A 494 -7.392 -0.172 17.192 1.00 64.13 H new ATOM 0 HG2 LYS A 494 -8.599 2.462 18.127 1.00 13.32 H new ATOM 0 HG3 LYS A 494 -7.925 1.220 19.163 1.00 13.32 H new ATOM 0 HD2 LYS A 494 -5.750 1.560 17.685 1.00 12.12 H new ATOM 0 HD3 LYS A 494 -6.492 3.095 17.279 1.00 12.12 H new ATOM 0 HE2 LYS A 494 -5.674 2.091 20.026 1.00 61.13 H new ATOM 0 HE3 LYS A 494 -5.063 3.493 19.169 1.00 61.13 H new ATOM 0 HZ1 LYS A 494 -6.523 4.618 20.395 1.00 23.01 H new ATOM 0 HZ2 LYS A 494 -7.718 4.021 19.347 1.00 23.01 H new ATOM 0 HZ3 LYS A 494 -7.407 3.232 20.818 1.00 23.01 H new ATOM 946 N GLU A 495 -9.114 0.311 13.583 1.00 25.33 N ATOM 947 CA GLU A 495 -9.511 -0.713 12.603 1.00 35.33 C ATOM 948 C GLU A 495 -8.373 -1.046 11.615 1.00 51.25 C ATOM 949 O GLU A 495 -7.523 -0.202 11.322 1.00 75.43 O ATOM 950 CB GLU A 495 -10.748 -0.232 11.829 1.00 14.23 C ATOM 951 CG GLU A 495 -11.239 -1.200 10.750 1.00 44.50 C ATOM 952 CD GLU A 495 -11.809 -2.496 11.312 1.00 13.31 C ATOM 953 OE1 GLU A 495 -11.026 -3.412 11.642 1.00 54.02 O ATOM 954 OE2 GLU A 495 -13.049 -2.611 11.410 1.00 63.53 O ATOM 0 H GLU A 495 -9.445 1.251 13.364 1.00 25.33 H new ATOM 0 HA GLU A 495 -9.743 -1.625 13.153 1.00 35.33 H new ATOM 0 HB2 GLU A 495 -11.558 -0.056 12.537 1.00 14.23 H new ATOM 0 HB3 GLU A 495 -10.519 0.726 11.362 1.00 14.23 H new ATOM 0 HG2 GLU A 495 -12.003 -0.706 10.150 1.00 44.50 H new ATOM 0 HG3 GLU A 495 -10.412 -1.436 10.081 1.00 44.50 H new ATOM 961 N GLU A 496 -8.366 -2.286 11.114 1.00 52.31 N ATOM 962 CA GLU A 496 -7.400 -2.720 10.091 1.00 60.22 C ATOM 963 C GLU A 496 -8.088 -3.528 8.978 1.00 64.22 C ATOM 964 O GLU A 496 -8.882 -4.429 9.252 1.00 60.53 O ATOM 965 CB GLU A 496 -6.284 -3.582 10.706 1.00 41.31 C ATOM 966 CG GLU A 496 -5.232 -4.028 9.682 1.00 63.32 C ATOM 967 CD GLU A 496 -4.246 -5.057 10.220 1.00 63.11 C ATOM 968 OE1 GLU A 496 -3.959 -5.040 11.434 1.00 43.04 O ATOM 969 OE2 GLU A 496 -3.752 -5.890 9.430 1.00 42.44 O ATOM 0 H GLU A 496 -9.022 -3.013 11.401 1.00 52.31 H new ATOM 0 HA GLU A 496 -6.967 -1.814 9.666 1.00 60.22 H new ATOM 0 HB2 GLU A 496 -5.793 -3.018 11.499 1.00 41.31 H new ATOM 0 HB3 GLU A 496 -6.728 -4.463 11.169 1.00 41.31 H new ATOM 0 HG2 GLU A 496 -5.740 -4.445 8.812 1.00 63.32 H new ATOM 0 HG3 GLU A 496 -4.679 -3.154 9.339 1.00 63.32 H new ATOM 976 N LYS A 497 -7.765 -3.212 7.728 1.00 21.22 N ATOM 977 CA LYS A 497 -8.240 -3.986 6.574 1.00 10.15 C ATOM 978 C LYS A 497 -7.042 -4.615 5.839 1.00 31.15 C ATOM 979 O LYS A 497 -6.068 -3.926 5.524 1.00 34.21 O ATOM 980 CB LYS A 497 -9.028 -3.083 5.605 1.00 75.41 C ATOM 981 CG LYS A 497 -10.137 -2.260 6.266 1.00 53.11 C ATOM 982 CD LYS A 497 -11.276 -3.122 6.809 1.00 42.43 C ATOM 983 CE LYS A 497 -12.088 -3.775 5.696 1.00 53.13 C ATOM 984 NZ LYS A 497 -13.276 -4.495 6.229 1.00 13.04 N ATOM 0 H LYS A 497 -7.172 -2.420 7.482 1.00 21.22 H new ATOM 0 HA LYS A 497 -8.901 -4.775 6.933 1.00 10.15 H new ATOM 0 HB2 LYS A 497 -8.332 -2.403 5.114 1.00 75.41 H new ATOM 0 HB3 LYS A 497 -9.469 -3.705 4.826 1.00 75.41 H new ATOM 0 HG2 LYS A 497 -9.711 -1.675 7.081 1.00 53.11 H new ATOM 0 HG3 LYS A 497 -10.538 -1.552 5.541 1.00 53.11 H new ATOM 0 HD2 LYS A 497 -10.866 -3.895 7.458 1.00 42.43 H new ATOM 0 HD3 LYS A 497 -11.934 -2.507 7.423 1.00 42.43 H new ATOM 0 HE2 LYS A 497 -12.412 -3.013 4.987 1.00 53.13 H new ATOM 0 HE3 LYS A 497 -11.456 -4.473 5.146 1.00 53.13 H new ATOM 0 HZ1 LYS A 497 -13.803 -4.926 5.442 1.00 13.04 H new ATOM 0 HZ2 LYS A 497 -12.965 -5.239 6.886 1.00 13.04 H new ATOM 0 HZ3 LYS A 497 -13.892 -3.824 6.732 1.00 13.04 H new ATOM 998 N VAL A 498 -7.105 -5.915 5.568 1.00 11.24 N ATOM 999 CA VAL A 498 -6.013 -6.599 4.868 1.00 73.03 C ATOM 1000 C VAL A 498 -6.337 -6.789 3.381 1.00 32.24 C ATOM 1001 O VAL A 498 -7.283 -7.490 3.019 1.00 32.04 O ATOM 1002 CB VAL A 498 -5.702 -7.976 5.504 1.00 10.14 C ATOM 1003 CG1 VAL A 498 -4.555 -8.666 4.767 1.00 12.44 C ATOM 1004 CG2 VAL A 498 -5.382 -7.824 6.991 1.00 51.51 C ATOM 0 H VAL A 498 -7.891 -6.515 5.818 1.00 11.24 H new ATOM 0 HA VAL A 498 -5.134 -5.962 4.963 1.00 73.03 H new ATOM 0 HB VAL A 498 -6.588 -8.603 5.411 1.00 10.14 H new ATOM 0 HG11 VAL A 498 -4.353 -9.632 5.231 1.00 12.44 H new ATOM 0 HG12 VAL A 498 -4.831 -8.815 3.723 1.00 12.44 H new ATOM 0 HG13 VAL A 498 -3.661 -8.044 4.821 1.00 12.44 H new ATOM 0 HG21 VAL A 498 -5.166 -8.803 7.419 1.00 51.51 H new ATOM 0 HG22 VAL A 498 -4.514 -7.176 7.112 1.00 51.51 H new ATOM 0 HG23 VAL A 498 -6.237 -7.384 7.504 1.00 51.51 H new ATOM 1014 N LEU A 499 -5.548 -6.147 2.527 1.00 53.30 N ATOM 1015 CA LEU A 499 -5.727 -6.233 1.077 1.00 54.45 C ATOM 1016 C LEU A 499 -4.651 -7.126 0.442 1.00 34.13 C ATOM 1017 O LEU A 499 -3.499 -7.136 0.876 1.00 64.20 O ATOM 1018 CB LEU A 499 -5.669 -4.825 0.464 1.00 45.44 C ATOM 1019 CG LEU A 499 -6.701 -3.828 1.018 1.00 72.13 C ATOM 1020 CD1 LEU A 499 -6.468 -2.434 0.445 1.00 52.53 C ATOM 1021 CD2 LEU A 499 -8.124 -4.301 0.729 1.00 40.45 C ATOM 0 H LEU A 499 -4.769 -5.554 2.815 1.00 53.30 H new ATOM 0 HA LEU A 499 -6.701 -6.678 0.875 1.00 54.45 H new ATOM 0 HB2 LEU A 499 -4.671 -4.417 0.624 1.00 45.44 H new ATOM 0 HB3 LEU A 499 -5.810 -4.909 -0.614 1.00 45.44 H new ATOM 0 HG LEU A 499 -6.575 -3.777 2.099 1.00 72.13 H new ATOM 0 HD11 LEU A 499 -7.209 -1.745 0.850 1.00 52.53 H new ATOM 0 HD12 LEU A 499 -5.469 -2.092 0.715 1.00 52.53 H new ATOM 0 HD13 LEU A 499 -6.559 -2.467 -0.641 1.00 52.53 H new ATOM 0 HD21 LEU A 499 -8.836 -3.580 1.130 1.00 40.45 H new ATOM 0 HD22 LEU A 499 -8.266 -4.390 -0.348 1.00 40.45 H new ATOM 0 HD23 LEU A 499 -8.287 -5.271 1.198 1.00 40.45 H new ATOM 1033 N THR A 500 -5.037 -7.880 -0.580 1.00 64.11 N ATOM 1034 CA THR A 500 -4.097 -8.732 -1.324 1.00 72.53 C ATOM 1035 C THR A 500 -4.206 -8.500 -2.829 1.00 5.41 C ATOM 1036 O THR A 500 -5.283 -8.211 -3.351 1.00 32.40 O ATOM 1037 CB THR A 500 -4.319 -10.244 -1.055 1.00 1.53 C ATOM 1038 OG1 THR A 500 -5.722 -10.555 -1.053 1.00 2.33 O ATOM 1039 CG2 THR A 500 -3.686 -10.678 0.261 1.00 51.02 C ATOM 0 H THR A 500 -5.998 -7.924 -0.919 1.00 64.11 H new ATOM 0 HA THR A 500 -3.106 -8.450 -0.968 1.00 72.53 H new ATOM 0 HB THR A 500 -3.833 -10.795 -1.860 1.00 1.53 H new ATOM 0 HG1 THR A 500 -5.845 -11.512 -0.884 1.00 2.33 H new ATOM 0 HG21 THR A 500 -3.862 -11.743 0.416 1.00 51.02 H new ATOM 0 HG22 THR A 500 -2.613 -10.488 0.229 1.00 51.02 H new ATOM 0 HG23 THR A 500 -4.130 -10.114 1.082 1.00 51.02 H new ATOM 1047 N PHE A 501 -3.081 -8.631 -3.523 1.00 24.25 N ATOM 1048 CA PHE A 501 -3.061 -8.558 -4.985 1.00 35.31 C ATOM 1049 C PHE A 501 -1.937 -9.434 -5.550 1.00 75.12 C ATOM 1050 O PHE A 501 -0.892 -9.610 -4.917 1.00 31.44 O ATOM 1051 CB PHE A 501 -2.902 -7.101 -5.465 1.00 75.43 C ATOM 1052 CG PHE A 501 -1.582 -6.459 -5.103 1.00 23.44 C ATOM 1053 CD1 PHE A 501 -1.388 -5.890 -3.851 1.00 64.34 C ATOM 1054 CD2 PHE A 501 -0.536 -6.419 -6.019 1.00 64.32 C ATOM 1055 CE1 PHE A 501 -0.182 -5.297 -3.522 1.00 71.25 C ATOM 1056 CE2 PHE A 501 0.670 -5.829 -5.693 1.00 20.22 C ATOM 1057 CZ PHE A 501 0.849 -5.268 -4.444 1.00 2.12 C ATOM 0 H PHE A 501 -2.167 -8.789 -3.098 1.00 24.25 H new ATOM 0 HA PHE A 501 -4.015 -8.933 -5.355 1.00 35.31 H new ATOM 0 HB2 PHE A 501 -3.019 -7.075 -6.548 1.00 75.43 H new ATOM 0 HB3 PHE A 501 -3.710 -6.503 -5.043 1.00 75.43 H new ATOM 0 HD1 PHE A 501 -2.188 -5.911 -3.126 1.00 64.34 H new ATOM 0 HD2 PHE A 501 -0.668 -6.855 -6.998 1.00 64.32 H new ATOM 0 HE1 PHE A 501 -0.045 -4.857 -2.545 1.00 71.25 H new ATOM 0 HE2 PHE A 501 1.473 -5.807 -6.415 1.00 20.22 H new ATOM 0 HZ PHE A 501 1.792 -4.808 -4.187 1.00 2.12 H new ATOM 1067 N SER A 502 -2.156 -9.986 -6.739 1.00 64.44 N ATOM 1068 CA SER A 502 -1.150 -10.830 -7.393 1.00 24.42 C ATOM 1069 C SER A 502 -0.655 -10.187 -8.693 1.00 53.51 C ATOM 1070 O SER A 502 -1.405 -10.046 -9.663 1.00 40.02 O ATOM 1071 CB SER A 502 -1.716 -12.230 -7.675 1.00 2.51 C ATOM 1072 OG SER A 502 -2.857 -12.178 -8.519 1.00 35.43 O ATOM 0 H SER A 502 -3.017 -9.867 -7.272 1.00 64.44 H new ATOM 0 HA SER A 502 -0.303 -10.927 -6.714 1.00 24.42 H new ATOM 0 HB2 SER A 502 -0.947 -12.846 -8.141 1.00 2.51 H new ATOM 0 HB3 SER A 502 -1.982 -12.711 -6.734 1.00 2.51 H new ATOM 0 HG SER A 502 -2.742 -11.465 -9.181 1.00 35.43 H new ATOM 1078 N TRP A 503 0.618 -9.812 -8.710 1.00 4.22 N ATOM 1079 CA TRP A 503 1.224 -9.147 -9.865 1.00 22.11 C ATOM 1080 C TRP A 503 2.076 -10.122 -10.686 1.00 41.23 C ATOM 1081 O TRP A 503 2.859 -10.898 -10.133 1.00 25.32 O ATOM 1082 CB TRP A 503 2.076 -7.960 -9.391 1.00 31.01 C ATOM 1083 CG TRP A 503 2.809 -7.246 -10.497 1.00 73.40 C ATOM 1084 CD1 TRP A 503 2.278 -6.764 -11.660 1.00 73.22 C ATOM 1085 CD2 TRP A 503 4.205 -6.918 -10.529 1.00 22.23 C ATOM 1086 NE1 TRP A 503 3.258 -6.171 -12.417 1.00 1.31 N ATOM 1087 CE2 TRP A 503 4.449 -6.250 -11.745 1.00 55.24 C ATOM 1088 CE3 TRP A 503 5.273 -7.127 -9.651 1.00 55.35 C ATOM 1089 CZ2 TRP A 503 5.713 -5.791 -12.103 1.00 50.53 C ATOM 1090 CZ3 TRP A 503 6.529 -6.671 -10.008 1.00 40.04 C ATOM 1091 CH2 TRP A 503 6.738 -6.008 -11.223 1.00 61.44 C ATOM 0 H TRP A 503 1.259 -9.957 -7.930 1.00 4.22 H new ATOM 0 HA TRP A 503 0.425 -8.783 -10.510 1.00 22.11 H new ATOM 0 HB2 TRP A 503 1.431 -7.246 -8.878 1.00 31.01 H new ATOM 0 HB3 TRP A 503 2.802 -8.317 -8.660 1.00 31.01 H new ATOM 0 HD1 TRP A 503 1.238 -6.839 -11.943 1.00 73.22 H new ATOM 0 HE1 TRP A 503 3.121 -5.741 -13.332 1.00 1.31 H new ATOM 0 HE3 TRP A 503 5.120 -7.636 -8.711 1.00 55.35 H new ATOM 0 HZ2 TRP A 503 5.879 -5.282 -13.041 1.00 50.53 H new ATOM 0 HZ3 TRP A 503 7.362 -6.829 -9.339 1.00 40.04 H new ATOM 0 HH2 TRP A 503 7.730 -5.660 -11.471 1.00 61.44 H new ATOM 1102 N THR A 504 1.908 -10.087 -12.005 1.00 61.21 N ATOM 1103 CA THR A 504 2.697 -10.930 -12.913 1.00 15.54 C ATOM 1104 C THR A 504 3.625 -10.069 -13.785 1.00 74.31 C ATOM 1105 O THR A 504 3.184 -9.467 -14.767 1.00 50.34 O ATOM 1106 CB THR A 504 1.788 -11.782 -13.841 1.00 42.25 C ATOM 1107 OG1 THR A 504 0.848 -12.538 -13.059 1.00 53.43 O ATOM 1108 CG2 THR A 504 2.617 -12.734 -14.704 1.00 23.03 C ATOM 0 H THR A 504 1.232 -9.484 -12.475 1.00 61.21 H new ATOM 0 HA THR A 504 3.289 -11.599 -12.289 1.00 15.54 H new ATOM 0 HB THR A 504 1.249 -11.099 -14.498 1.00 42.25 H new ATOM 0 HG1 THR A 504 0.280 -13.070 -13.655 1.00 53.43 H new ATOM 0 HG21 THR A 504 1.954 -13.317 -15.343 1.00 23.03 H new ATOM 0 HG22 THR A 504 3.304 -12.158 -15.324 1.00 23.03 H new ATOM 0 HG23 THR A 504 3.185 -13.406 -14.061 1.00 23.03 H new ATOM 1116 N PRO A 505 4.922 -9.984 -13.434 1.00 61.35 N ATOM 1117 CA PRO A 505 5.899 -9.199 -14.204 1.00 34.10 C ATOM 1118 C PRO A 505 6.335 -9.890 -15.508 1.00 32.04 C ATOM 1119 O PRO A 505 7.231 -10.734 -15.512 1.00 43.45 O ATOM 1120 CB PRO A 505 7.079 -9.071 -13.234 1.00 10.33 C ATOM 1121 CG PRO A 505 7.002 -10.299 -12.387 1.00 12.30 C ATOM 1122 CD PRO A 505 5.534 -10.618 -12.248 1.00 13.24 C ATOM 0 HA PRO A 505 5.486 -8.245 -14.532 1.00 34.10 H new ATOM 0 HB2 PRO A 505 8.028 -9.016 -13.768 1.00 10.33 H new ATOM 0 HB3 PRO A 505 7.000 -8.167 -12.630 1.00 10.33 H new ATOM 0 HG2 PRO A 505 7.539 -11.127 -12.850 1.00 12.30 H new ATOM 0 HG3 PRO A 505 7.458 -10.129 -11.412 1.00 12.30 H new ATOM 0 HD2 PRO A 505 5.358 -11.694 -12.234 1.00 13.24 H new ATOM 0 HD3 PRO A 505 5.123 -10.215 -11.322 1.00 13.24 H new ATOM 1130 N THR A 506 5.687 -9.539 -16.618 1.00 75.31 N ATOM 1131 CA THR A 506 6.050 -10.089 -17.934 1.00 21.54 C ATOM 1132 C THR A 506 7.269 -9.368 -18.534 1.00 43.24 C ATOM 1133 O THR A 506 7.654 -9.617 -19.678 1.00 4.04 O ATOM 1134 CB THR A 506 4.869 -10.013 -18.931 1.00 52.24 C ATOM 1135 OG1 THR A 506 4.419 -8.657 -19.069 1.00 61.44 O ATOM 1136 CG2 THR A 506 3.712 -10.891 -18.469 1.00 33.44 C ATOM 0 H THR A 506 4.910 -8.879 -16.638 1.00 75.31 H new ATOM 0 HA THR A 506 6.305 -11.136 -17.769 1.00 21.54 H new ATOM 0 HB THR A 506 5.220 -10.376 -19.897 1.00 52.24 H new ATOM 0 HG1 THR A 506 3.673 -8.623 -19.704 1.00 61.44 H new ATOM 0 HG21 THR A 506 2.894 -10.821 -19.186 1.00 33.44 H new ATOM 0 HG22 THR A 506 4.046 -11.926 -18.399 1.00 33.44 H new ATOM 0 HG23 THR A 506 3.368 -10.554 -17.491 1.00 33.44 H new ATOM 1144 N GLN A 507 7.871 -8.474 -17.749 1.00 52.11 N ATOM 1145 CA GLN A 507 9.102 -7.775 -18.137 1.00 22.33 C ATOM 1146 C GLN A 507 10.109 -7.801 -16.974 1.00 1.13 C ATOM 1147 O GLN A 507 9.722 -7.702 -15.807 1.00 62.53 O ATOM 1148 CB GLN A 507 8.787 -6.323 -18.538 1.00 75.51 C ATOM 1149 CG GLN A 507 9.990 -5.555 -19.079 1.00 60.10 C ATOM 1150 CD GLN A 507 9.669 -4.104 -19.411 1.00 33.43 C ATOM 1151 OE1 GLN A 507 8.809 -3.485 -18.795 1.00 23.43 O ATOM 1152 NE2 GLN A 507 10.364 -3.550 -20.382 1.00 55.24 N ATOM 0 H GLN A 507 7.522 -8.213 -16.827 1.00 52.11 H new ATOM 0 HA GLN A 507 9.541 -8.284 -18.995 1.00 22.33 H new ATOM 0 HB2 GLN A 507 8.002 -6.328 -19.294 1.00 75.51 H new ATOM 0 HB3 GLN A 507 8.391 -5.795 -17.671 1.00 75.51 H new ATOM 0 HG2 GLN A 507 10.794 -5.584 -18.343 1.00 60.10 H new ATOM 0 HG3 GLN A 507 10.360 -6.054 -19.975 1.00 60.10 H new ATOM 0 HE21 GLN A 507 11.073 -4.092 -20.875 1.00 55.24 H new ATOM 0 HE22 GLN A 507 10.194 -2.578 -20.641 1.00 55.24 H new ATOM 1161 N GLU A 508 11.395 -7.948 -17.290 1.00 23.33 N ATOM 1162 CA GLU A 508 12.437 -8.076 -16.259 1.00 34.12 C ATOM 1163 C GLU A 508 13.062 -6.719 -15.894 1.00 61.25 C ATOM 1164 O GLU A 508 13.114 -5.799 -16.716 1.00 50.05 O ATOM 1165 CB GLU A 508 13.535 -9.054 -16.716 1.00 35.50 C ATOM 1166 CG GLU A 508 14.522 -8.496 -17.746 1.00 11.20 C ATOM 1167 CD GLU A 508 13.862 -7.981 -19.018 1.00 13.44 C ATOM 1168 OE1 GLU A 508 13.025 -8.706 -19.600 1.00 3.51 O ATOM 1169 OE2 GLU A 508 14.170 -6.846 -19.437 1.00 30.24 O ATOM 0 H GLU A 508 11.745 -7.982 -18.248 1.00 23.33 H new ATOM 0 HA GLU A 508 11.953 -8.469 -15.365 1.00 34.12 H new ATOM 0 HB2 GLU A 508 14.095 -9.380 -15.840 1.00 35.50 H new ATOM 0 HB3 GLU A 508 13.058 -9.939 -17.137 1.00 35.50 H new ATOM 0 HG2 GLU A 508 15.089 -7.685 -17.289 1.00 11.20 H new ATOM 0 HG3 GLU A 508 15.237 -9.276 -18.009 1.00 11.20 H new ATOM 1176 N GLY A 509 13.526 -6.599 -14.653 1.00 0.11 N ATOM 1177 CA GLY A 509 14.156 -5.364 -14.197 1.00 13.15 C ATOM 1178 C GLY A 509 13.965 -5.115 -12.707 1.00 43.31 C ATOM 1179 O GLY A 509 13.505 -5.994 -11.976 1.00 22.05 O ATOM 0 H GLY A 509 13.478 -7.336 -13.950 1.00 0.11 H new ATOM 0 HA2 GLY A 509 15.222 -5.403 -14.420 1.00 13.15 H new ATOM 0 HA3 GLY A 509 13.744 -4.524 -14.756 1.00 13.15 H new ATOM 1183 N MET A 510 14.323 -3.916 -12.255 1.00 32.30 N ATOM 1184 CA MET A 510 14.154 -3.538 -10.851 1.00 54.23 C ATOM 1185 C MET A 510 12.873 -2.705 -10.669 1.00 42.00 C ATOM 1186 O MET A 510 12.773 -1.577 -11.161 1.00 32.14 O ATOM 1187 CB MET A 510 15.378 -2.751 -10.363 1.00 55.12 C ATOM 1188 CG MET A 510 15.445 -2.617 -8.851 1.00 42.23 C ATOM 1189 SD MET A 510 15.649 -4.215 -8.037 1.00 24.23 S ATOM 1190 CE MET A 510 15.517 -3.742 -6.316 1.00 34.43 C ATOM 0 H MET A 510 14.733 -3.187 -12.840 1.00 32.30 H new ATOM 0 HA MET A 510 14.062 -4.446 -10.255 1.00 54.23 H new ATOM 0 HB2 MET A 510 16.283 -3.245 -10.717 1.00 55.12 H new ATOM 0 HB3 MET A 510 15.362 -1.756 -10.808 1.00 55.12 H new ATOM 0 HG2 MET A 510 16.276 -1.965 -8.582 1.00 42.23 H new ATOM 0 HG3 MET A 510 14.534 -2.140 -8.489 1.00 42.23 H new ATOM 0 HE1 MET A 510 16.422 -4.039 -5.787 1.00 34.43 H new ATOM 0 HE2 MET A 510 15.392 -2.662 -6.244 1.00 34.43 H new ATOM 0 HE3 MET A 510 14.656 -4.237 -5.868 1.00 34.43 H new ATOM 1200 N TYR A 511 11.893 -3.268 -9.967 1.00 71.23 N ATOM 1201 CA TYR A 511 10.593 -2.613 -9.783 1.00 43.33 C ATOM 1202 C TYR A 511 10.327 -2.285 -8.307 1.00 50.14 C ATOM 1203 O TYR A 511 10.152 -3.180 -7.483 1.00 11.43 O ATOM 1204 CB TYR A 511 9.470 -3.505 -10.331 1.00 4.24 C ATOM 1205 CG TYR A 511 9.540 -3.733 -11.833 1.00 65.22 C ATOM 1206 CD1 TYR A 511 10.357 -4.722 -12.373 1.00 52.23 C ATOM 1207 CD2 TYR A 511 8.785 -2.958 -12.709 1.00 44.11 C ATOM 1208 CE1 TYR A 511 10.419 -4.930 -13.739 1.00 43.24 C ATOM 1209 CE2 TYR A 511 8.842 -3.162 -14.075 1.00 31.54 C ATOM 1210 CZ TYR A 511 9.659 -4.148 -14.585 1.00 24.25 C ATOM 1211 OH TYR A 511 9.717 -4.354 -15.946 1.00 2.24 O ATOM 0 H TYR A 511 11.971 -4.178 -9.514 1.00 71.23 H new ATOM 0 HA TYR A 511 10.615 -1.674 -10.336 1.00 43.33 H new ATOM 0 HB2 TYR A 511 9.506 -4.470 -9.825 1.00 4.24 H new ATOM 0 HB3 TYR A 511 8.509 -3.053 -10.087 1.00 4.24 H new ATOM 0 HD1 TYR A 511 10.952 -5.337 -11.715 1.00 52.23 H new ATOM 0 HD2 TYR A 511 8.144 -2.184 -12.314 1.00 44.11 H new ATOM 0 HE1 TYR A 511 11.059 -5.701 -14.142 1.00 43.24 H new ATOM 0 HE2 TYR A 511 8.249 -2.551 -14.740 1.00 31.54 H new ATOM 0 HH TYR A 511 9.121 -3.721 -16.398 1.00 2.24 H new ATOM 1221 N ARG A 512 10.300 -0.999 -7.981 1.00 61.11 N ATOM 1222 CA ARG A 512 10.012 -0.551 -6.616 1.00 13.31 C ATOM 1223 C ARG A 512 8.511 -0.277 -6.433 1.00 30.11 C ATOM 1224 O ARG A 512 7.945 0.623 -7.059 1.00 13.35 O ATOM 1225 CB ARG A 512 10.839 0.701 -6.285 1.00 25.53 C ATOM 1226 CG ARG A 512 10.575 1.275 -4.894 1.00 15.43 C ATOM 1227 CD ARG A 512 11.567 2.382 -4.546 1.00 44.23 C ATOM 1228 NE ARG A 512 11.609 3.430 -5.566 1.00 11.24 N ATOM 1229 CZ ARG A 512 12.695 4.070 -5.922 1.00 3.42 C ATOM 1230 NH1 ARG A 512 13.834 3.813 -5.361 1.00 41.45 N ATOM 1231 NH2 ARG A 512 12.643 4.969 -6.847 1.00 54.34 N ATOM 0 H ARG A 512 10.474 -0.242 -8.643 1.00 61.11 H new ATOM 0 HA ARG A 512 10.292 -1.346 -5.925 1.00 13.31 H new ATOM 0 HB2 ARG A 512 11.898 0.457 -6.370 1.00 25.53 H new ATOM 0 HB3 ARG A 512 10.628 1.469 -7.029 1.00 25.53 H new ATOM 0 HG2 ARG A 512 9.559 1.668 -4.849 1.00 15.43 H new ATOM 0 HG3 ARG A 512 10.642 0.479 -4.152 1.00 15.43 H new ATOM 0 HD2 ARG A 512 11.295 2.822 -3.587 1.00 44.23 H new ATOM 0 HD3 ARG A 512 12.562 1.952 -4.429 1.00 44.23 H new ATOM 0 HE ARG A 512 10.735 3.679 -6.030 1.00 11.24 H new ATOM 0 HH11 ARG A 512 13.894 3.103 -4.631 1.00 41.45 H new ATOM 0 HH12 ARG A 512 14.671 4.320 -5.650 1.00 41.45 H new ATOM 0 HH21 ARG A 512 11.755 5.182 -7.302 1.00 54.34 H new ATOM 0 HH22 ARG A 512 13.490 5.466 -7.123 1.00 54.34 H new ATOM 1245 N ILE A 513 7.874 -1.070 -5.576 1.00 35.32 N ATOM 1246 CA ILE A 513 6.434 -0.963 -5.320 1.00 63.35 C ATOM 1247 C ILE A 513 6.148 -0.150 -4.046 1.00 32.24 C ATOM 1248 O ILE A 513 6.666 -0.453 -2.969 1.00 13.53 O ATOM 1249 CB ILE A 513 5.792 -2.367 -5.180 1.00 73.01 C ATOM 1250 CG1 ILE A 513 6.029 -3.194 -6.460 1.00 13.24 C ATOM 1251 CG2 ILE A 513 4.296 -2.253 -4.878 1.00 21.15 C ATOM 1252 CD1 ILE A 513 5.437 -4.590 -6.415 1.00 34.03 C ATOM 0 H ILE A 513 8.336 -1.804 -5.039 1.00 35.32 H new ATOM 0 HA ILE A 513 5.996 -0.446 -6.174 1.00 63.35 H new ATOM 0 HB ILE A 513 6.266 -2.881 -4.344 1.00 73.01 H new ATOM 0 HG12 ILE A 513 5.605 -2.658 -7.309 1.00 13.24 H new ATOM 0 HG13 ILE A 513 7.102 -3.272 -6.636 1.00 13.24 H new ATOM 0 HG21 ILE A 513 3.867 -3.250 -4.784 1.00 21.15 H new ATOM 0 HG22 ILE A 513 4.154 -1.707 -3.945 1.00 21.15 H new ATOM 0 HG23 ILE A 513 3.801 -1.720 -5.689 1.00 21.15 H new ATOM 0 HD11 ILE A 513 5.648 -5.105 -7.352 1.00 34.03 H new ATOM 0 HD12 ILE A 513 5.879 -5.146 -5.588 1.00 34.03 H new ATOM 0 HD13 ILE A 513 4.358 -4.523 -6.272 1.00 34.03 H new ATOM 1264 N ASN A 514 5.325 0.886 -4.178 1.00 60.22 N ATOM 1265 CA ASN A 514 4.945 1.736 -3.044 1.00 3.04 C ATOM 1266 C ASN A 514 3.425 1.740 -2.822 1.00 2.24 C ATOM 1267 O ASN A 514 2.646 1.699 -3.773 1.00 71.43 O ATOM 1268 CB ASN A 514 5.431 3.171 -3.269 1.00 60.33 C ATOM 1269 CG ASN A 514 6.940 3.292 -3.193 1.00 73.12 C ATOM 1270 OD1 ASN A 514 7.450 3.548 -2.009 1.00 11.34 O flip ATOM 1271 ND2 ASN A 514 7.644 3.155 -4.188 1.00 62.05 N flip ATOM 0 H ASN A 514 4.903 1.162 -5.065 1.00 60.22 H new ATOM 0 HA ASN A 514 5.419 1.323 -2.154 1.00 3.04 H new ATOM 0 HB2 ASN A 514 5.091 3.517 -4.245 1.00 60.33 H new ATOM 0 HB3 ASN A 514 4.979 3.825 -2.523 1.00 60.33 H new ATOM 0 HD21 ASN A 514 7.216 2.957 -5.092 1.00 62.05 H new ATOM 0 HD22 ASN A 514 8.658 3.239 -4.111 1.00 62.05 H new ATOM 1278 N ALA A 515 3.014 1.789 -1.559 1.00 51.51 N ATOM 1279 CA ALA A 515 1.594 1.914 -1.208 1.00 23.22 C ATOM 1280 C ALA A 515 1.358 3.184 -0.388 1.00 2.12 C ATOM 1281 O ALA A 515 2.157 3.529 0.488 1.00 34.34 O ATOM 1282 CB ALA A 515 1.103 0.687 -0.445 1.00 14.14 C ATOM 0 H ALA A 515 3.642 1.744 -0.756 1.00 51.51 H new ATOM 0 HA ALA A 515 1.023 1.983 -2.134 1.00 23.22 H new ATOM 0 HB1 ALA A 515 0.048 0.809 -0.199 1.00 14.14 H new ATOM 0 HB2 ALA A 515 1.231 -0.201 -1.064 1.00 14.14 H new ATOM 0 HB3 ALA A 515 1.679 0.575 0.474 1.00 14.14 H new ATOM 1288 N THR A 516 0.269 3.880 -0.683 1.00 41.20 N ATOM 1289 CA THR A 516 -0.061 5.139 0.000 1.00 32.24 C ATOM 1290 C THR A 516 -1.527 5.173 0.442 1.00 11.24 C ATOM 1291 O THR A 516 -2.370 4.451 -0.096 1.00 32.30 O ATOM 1292 CB THR A 516 0.203 6.358 -0.915 1.00 40.00 C ATOM 1293 OG1 THR A 516 -0.525 6.205 -2.143 1.00 50.23 O ATOM 1294 CG2 THR A 516 1.691 6.520 -1.221 1.00 3.34 C ATOM 0 H THR A 516 -0.408 3.599 -1.392 1.00 41.20 H new ATOM 0 HA THR A 516 0.582 5.192 0.878 1.00 32.24 H new ATOM 0 HB THR A 516 -0.133 7.252 -0.389 1.00 40.00 H new ATOM 0 HG1 THR A 516 0.035 6.495 -2.893 1.00 50.23 H new ATOM 0 HG21 THR A 516 1.838 7.386 -1.866 1.00 3.34 H new ATOM 0 HG22 THR A 516 2.240 6.663 -0.291 1.00 3.34 H new ATOM 0 HG23 THR A 516 2.058 5.626 -1.725 1.00 3.34 H new ATOM 1302 N VAL A 517 -1.823 6.015 1.432 1.00 65.35 N ATOM 1303 CA VAL A 517 -3.198 6.204 1.906 1.00 34.11 C ATOM 1304 C VAL A 517 -3.547 7.699 2.039 1.00 35.50 C ATOM 1305 O VAL A 517 -2.721 8.500 2.476 1.00 73.11 O ATOM 1306 CB VAL A 517 -3.420 5.489 3.265 1.00 11.40 C ATOM 1307 CG1 VAL A 517 -2.418 5.970 4.312 1.00 72.04 C ATOM 1308 CG2 VAL A 517 -4.851 5.681 3.754 1.00 25.14 C ATOM 0 H VAL A 517 -1.129 6.579 1.923 1.00 65.35 H new ATOM 0 HA VAL A 517 -3.860 5.761 1.162 1.00 34.11 H new ATOM 0 HB VAL A 517 -3.255 4.423 3.111 1.00 11.40 H new ATOM 0 HG11 VAL A 517 -2.598 5.451 5.254 1.00 72.04 H new ATOM 0 HG12 VAL A 517 -1.405 5.759 3.970 1.00 72.04 H new ATOM 0 HG13 VAL A 517 -2.535 7.043 4.461 1.00 72.04 H new ATOM 0 HG21 VAL A 517 -4.981 5.170 4.708 1.00 25.14 H new ATOM 0 HG22 VAL A 517 -5.052 6.745 3.881 1.00 25.14 H new ATOM 0 HG23 VAL A 517 -5.544 5.265 3.023 1.00 25.14 H new ATOM 1318 N ASP A 518 -4.781 8.053 1.657 1.00 52.22 N ATOM 1319 CA ASP A 518 -5.262 9.449 1.668 1.00 64.05 C ATOM 1320 C ASP A 518 -4.200 10.430 1.124 1.00 74.35 C ATOM 1321 O ASP A 518 -3.823 11.400 1.783 1.00 63.03 O ATOM 1322 CB ASP A 518 -5.715 9.862 3.082 1.00 14.43 C ATOM 1323 CG ASP A 518 -6.531 11.152 3.072 1.00 23.03 C ATOM 1324 OD1 ASP A 518 -7.592 11.180 2.414 1.00 2.12 O ATOM 1325 OD2 ASP A 518 -6.114 12.147 3.699 1.00 14.11 O ATOM 0 H ASP A 518 -5.477 7.383 1.331 1.00 52.22 H new ATOM 0 HA ASP A 518 -6.122 9.500 1.001 1.00 64.05 H new ATOM 0 HB2 ASP A 518 -6.311 9.061 3.519 1.00 14.43 H new ATOM 0 HB3 ASP A 518 -4.840 9.993 3.718 1.00 14.43 H new ATOM 1330 N GLU A 519 -3.715 10.164 -0.090 1.00 71.22 N ATOM 1331 CA GLU A 519 -2.729 11.041 -0.743 1.00 71.40 C ATOM 1332 C GLU A 519 -3.231 12.487 -0.827 1.00 44.44 C ATOM 1333 O GLU A 519 -2.450 13.439 -0.763 1.00 31.32 O ATOM 1334 CB GLU A 519 -2.403 10.542 -2.153 1.00 5.35 C ATOM 1335 CG GLU A 519 -1.829 9.137 -2.194 1.00 53.32 C ATOM 1336 CD GLU A 519 -1.367 8.747 -3.586 1.00 3.12 C ATOM 1337 OE1 GLU A 519 -2.225 8.549 -4.463 1.00 11.11 O ATOM 1338 OE2 GLU A 519 -0.140 8.644 -3.807 1.00 1.32 O ATOM 0 H GLU A 519 -3.985 9.351 -0.644 1.00 71.22 H new ATOM 0 HA GLU A 519 -1.827 11.016 -0.131 1.00 71.40 H new ATOM 0 HB2 GLU A 519 -3.311 10.570 -2.756 1.00 5.35 H new ATOM 0 HB3 GLU A 519 -1.692 11.227 -2.614 1.00 5.35 H new ATOM 0 HG2 GLU A 519 -0.990 9.069 -1.502 1.00 53.32 H new ATOM 0 HG3 GLU A 519 -2.583 8.428 -1.851 1.00 53.32 H new ATOM 1345 N GLU A 520 -4.544 12.624 -0.978 1.00 74.10 N ATOM 1346 CA GLU A 520 -5.200 13.926 -1.115 1.00 71.34 C ATOM 1347 C GLU A 520 -5.132 14.758 0.179 1.00 13.33 C ATOM 1348 O GLU A 520 -5.542 15.926 0.193 1.00 22.21 O ATOM 1349 CB GLU A 520 -6.651 13.690 -1.561 1.00 73.22 C ATOM 1350 CG GLU A 520 -6.731 13.003 -2.925 1.00 63.12 C ATOM 1351 CD GLU A 520 -8.087 12.390 -3.235 1.00 42.11 C ATOM 1352 OE1 GLU A 520 -9.104 13.112 -3.181 1.00 4.20 O ATOM 1353 OE2 GLU A 520 -8.136 11.184 -3.559 1.00 3.13 O ATOM 0 H GLU A 520 -5.188 11.834 -1.009 1.00 74.10 H new ATOM 0 HA GLU A 520 -4.672 14.513 -1.867 1.00 71.34 H new ATOM 0 HB2 GLU A 520 -7.163 13.079 -0.818 1.00 73.22 H new ATOM 0 HB3 GLU A 520 -7.176 14.644 -1.605 1.00 73.22 H new ATOM 0 HG2 GLU A 520 -6.487 13.730 -3.700 1.00 63.12 H new ATOM 0 HG3 GLU A 520 -5.972 12.222 -2.971 1.00 63.12 H new ATOM 1360 N ASN A 521 -4.610 14.154 1.255 1.00 63.25 N ATOM 1361 CA ASN A 521 -4.347 14.856 2.524 1.00 73.34 C ATOM 1362 C ASN A 521 -5.605 15.591 3.026 1.00 71.15 C ATOM 1363 O ASN A 521 -5.590 16.801 3.273 1.00 33.20 O ATOM 1364 CB ASN A 521 -3.168 15.830 2.344 1.00 71.31 C ATOM 1365 CG ASN A 521 -2.614 16.357 3.657 1.00 60.04 C ATOM 1366 OD1 ASN A 521 -1.724 15.765 4.254 1.00 2.33 O ATOM 1367 ND2 ASN A 521 -3.131 17.479 4.115 1.00 72.30 N ATOM 0 H ASN A 521 -4.357 13.166 1.273 1.00 63.25 H new ATOM 0 HA ASN A 521 -4.081 14.120 3.282 1.00 73.34 H new ATOM 0 HB2 ASN A 521 -2.370 15.326 1.798 1.00 71.31 H new ATOM 0 HB3 ASN A 521 -3.492 16.671 1.731 1.00 71.31 H new ATOM 0 HD21 ASN A 521 -2.790 17.878 4.990 1.00 72.30 H new ATOM 0 HD22 ASN A 521 -3.872 17.949 3.595 1.00 72.30 H new ATOM 1374 N THR A 522 -6.692 14.848 3.168 1.00 52.14 N ATOM 1375 CA THR A 522 -7.983 15.416 3.571 1.00 65.20 C ATOM 1376 C THR A 522 -8.130 15.447 5.096 1.00 22.11 C ATOM 1377 O THR A 522 -8.718 16.374 5.660 1.00 22.25 O ATOM 1378 CB THR A 522 -9.159 14.603 2.981 1.00 45.45 C ATOM 1379 OG1 THR A 522 -9.214 13.307 3.597 1.00 21.25 O ATOM 1380 CG2 THR A 522 -9.017 14.443 1.466 1.00 33.03 C ATOM 0 H THR A 522 -6.712 13.841 3.010 1.00 52.14 H new ATOM 0 HA THR A 522 -8.010 16.435 3.184 1.00 65.20 H new ATOM 0 HB THR A 522 -10.081 15.148 3.184 1.00 45.45 H new ATOM 0 HG1 THR A 522 -9.688 12.684 3.007 1.00 21.25 H new ATOM 0 HG21 THR A 522 -9.858 13.867 1.080 1.00 33.03 H new ATOM 0 HG22 THR A 522 -9.004 15.426 0.996 1.00 33.03 H new ATOM 0 HG23 THR A 522 -8.087 13.921 1.241 1.00 33.03 H new ATOM 1388 N VAL A 523 -7.586 14.431 5.756 1.00 65.34 N ATOM 1389 CA VAL A 523 -7.708 14.287 7.210 1.00 60.40 C ATOM 1390 C VAL A 523 -6.405 14.681 7.937 1.00 11.35 C ATOM 1391 O VAL A 523 -5.305 14.485 7.420 1.00 62.44 O ATOM 1392 CB VAL A 523 -8.115 12.838 7.589 1.00 72.14 C ATOM 1393 CG1 VAL A 523 -7.014 11.839 7.229 1.00 53.30 C ATOM 1394 CG2 VAL A 523 -8.487 12.752 9.069 1.00 4.53 C ATOM 0 H VAL A 523 -7.051 13.687 5.307 1.00 65.34 H new ATOM 0 HA VAL A 523 -8.492 14.971 7.536 1.00 60.40 H new ATOM 0 HB VAL A 523 -8.996 12.570 7.006 1.00 72.14 H new ATOM 0 HG11 VAL A 523 -7.330 10.834 7.507 1.00 53.30 H new ATOM 0 HG12 VAL A 523 -6.825 11.876 6.156 1.00 53.30 H new ATOM 0 HG13 VAL A 523 -6.101 12.094 7.767 1.00 53.30 H new ATOM 0 HG21 VAL A 523 -8.769 11.728 9.314 1.00 4.53 H new ATOM 0 HG22 VAL A 523 -7.632 13.048 9.677 1.00 4.53 H new ATOM 0 HG23 VAL A 523 -9.325 13.418 9.273 1.00 4.53 H new ATOM 1404 N VAL A 524 -6.541 15.293 9.117 1.00 14.23 N ATOM 1405 CA VAL A 524 -5.383 15.672 9.941 1.00 71.23 C ATOM 1406 C VAL A 524 -4.897 14.482 10.788 1.00 33.34 C ATOM 1407 O VAL A 524 -5.602 14.017 11.683 1.00 72.22 O ATOM 1408 CB VAL A 524 -5.725 16.859 10.879 1.00 71.41 C ATOM 1409 CG1 VAL A 524 -4.523 17.237 11.746 1.00 24.24 C ATOM 1410 CG2 VAL A 524 -6.217 18.062 10.070 1.00 55.43 C ATOM 0 H VAL A 524 -7.443 15.538 9.526 1.00 14.23 H new ATOM 0 HA VAL A 524 -4.589 15.976 9.259 1.00 71.23 H new ATOM 0 HB VAL A 524 -6.529 16.545 11.544 1.00 71.41 H new ATOM 0 HG11 VAL A 524 -4.790 18.072 12.394 1.00 24.24 H new ATOM 0 HG12 VAL A 524 -4.232 16.382 12.357 1.00 24.24 H new ATOM 0 HG13 VAL A 524 -3.690 17.527 11.106 1.00 24.24 H new ATOM 0 HG21 VAL A 524 -6.452 18.884 10.746 1.00 55.43 H new ATOM 0 HG22 VAL A 524 -5.439 18.375 9.374 1.00 55.43 H new ATOM 0 HG23 VAL A 524 -7.112 17.784 9.513 1.00 55.43 H new ATOM 1420 N GLU A 525 -3.682 14.016 10.508 1.00 71.41 N ATOM 1421 CA GLU A 525 -3.139 12.799 11.133 1.00 40.23 C ATOM 1422 C GLU A 525 -2.329 13.099 12.409 1.00 10.03 C ATOM 1423 O GLU A 525 -2.131 14.254 12.789 1.00 23.40 O ATOM 1424 CB GLU A 525 -2.231 12.078 10.122 1.00 31.51 C ATOM 1425 CG GLU A 525 -2.929 11.678 8.825 1.00 21.02 C ATOM 1426 CD GLU A 525 -3.769 10.422 8.975 1.00 75.13 C ATOM 1427 OE1 GLU A 525 -4.887 10.505 9.523 1.00 11.12 O ATOM 1428 OE2 GLU A 525 -3.296 9.346 8.561 1.00 53.34 O ATOM 0 H GLU A 525 -3.046 14.463 9.848 1.00 71.41 H new ATOM 0 HA GLU A 525 -3.984 12.174 11.420 1.00 40.23 H new ATOM 0 HB2 GLU A 525 -1.388 12.726 9.882 1.00 31.51 H new ATOM 0 HB3 GLU A 525 -1.822 11.183 10.592 1.00 31.51 H new ATOM 0 HG2 GLU A 525 -3.565 12.498 8.492 1.00 21.02 H new ATOM 0 HG3 GLU A 525 -2.181 11.519 8.049 1.00 21.02 H new ATOM 1435 N LEU A 526 -1.876 12.035 13.072 1.00 71.34 N ATOM 1436 CA LEU A 526 -0.882 12.148 14.146 1.00 31.33 C ATOM 1437 C LEU A 526 0.529 12.232 13.547 1.00 72.02 C ATOM 1438 O LEU A 526 1.451 12.773 14.157 1.00 52.22 O ATOM 1439 CB LEU A 526 -0.972 10.945 15.099 1.00 33.14 C ATOM 1440 CG LEU A 526 -2.225 10.886 15.987 1.00 50.32 C ATOM 1441 CD1 LEU A 526 -2.276 9.569 16.761 1.00 15.02 C ATOM 1442 CD2 LEU A 526 -2.260 12.075 16.946 1.00 63.42 C ATOM 0 H LEU A 526 -2.182 11.080 12.885 1.00 71.34 H new ATOM 0 HA LEU A 526 -1.089 13.056 14.712 1.00 31.33 H new ATOM 0 HB2 LEU A 526 -0.927 10.032 14.506 1.00 33.14 H new ATOM 0 HB3 LEU A 526 -0.093 10.950 15.744 1.00 33.14 H new ATOM 0 HG LEU A 526 -3.103 10.938 15.343 1.00 50.32 H new ATOM 0 HD11 LEU A 526 -3.170 9.547 17.384 1.00 15.02 H new ATOM 0 HD12 LEU A 526 -2.302 8.735 16.059 1.00 15.02 H new ATOM 0 HD13 LEU A 526 -1.392 9.484 17.393 1.00 15.02 H new ATOM 0 HD21 LEU A 526 -3.154 12.016 17.566 1.00 63.42 H new ATOM 0 HD22 LEU A 526 -1.375 12.056 17.582 1.00 63.42 H new ATOM 0 HD23 LEU A 526 -2.276 13.003 16.375 1.00 63.42 H new ATOM 1454 N ASN A 527 0.677 11.678 12.345 1.00 42.32 N ATOM 1455 CA ASN A 527 1.942 11.703 11.605 1.00 73.15 C ATOM 1456 C ASN A 527 1.684 11.565 10.095 1.00 14.44 C ATOM 1457 O ASN A 527 1.312 10.496 9.616 1.00 70.14 O ATOM 1458 CB ASN A 527 2.870 10.580 12.100 1.00 3.21 C ATOM 1459 CG ASN A 527 4.142 10.456 11.277 1.00 64.33 C ATOM 1460 OD1 ASN A 527 4.609 11.416 10.675 1.00 70.31 O ATOM 1461 ND2 ASN A 527 4.718 9.272 11.256 1.00 55.42 N ATOM 0 H ASN A 527 -0.077 11.198 11.854 1.00 42.32 H new ATOM 0 HA ASN A 527 2.431 12.661 11.783 1.00 73.15 H new ATOM 0 HB2 ASN A 527 3.134 10.766 13.141 1.00 3.21 H new ATOM 0 HB3 ASN A 527 2.332 9.633 12.072 1.00 3.21 H new ATOM 0 HD21 ASN A 527 5.579 9.133 10.728 1.00 55.42 H new ATOM 0 HD22 ASN A 527 4.303 8.494 11.768 1.00 55.42 H new ATOM 1468 N GLU A 528 1.922 12.640 9.344 1.00 20.35 N ATOM 1469 CA GLU A 528 1.583 12.679 7.914 1.00 11.13 C ATOM 1470 C GLU A 528 2.674 12.020 7.052 1.00 15.11 C ATOM 1471 O GLU A 528 2.554 11.941 5.828 1.00 54.20 O ATOM 1472 CB GLU A 528 1.366 14.131 7.449 1.00 30.22 C ATOM 1473 CG GLU A 528 0.257 14.890 8.191 1.00 1.23 C ATOM 1474 CD GLU A 528 0.628 15.296 9.615 1.00 31.23 C ATOM 1475 OE1 GLU A 528 1.839 15.374 9.931 1.00 14.30 O ATOM 1476 OE2 GLU A 528 -0.288 15.550 10.422 1.00 23.32 O ATOM 0 H GLU A 528 2.348 13.497 9.698 1.00 20.35 H new ATOM 0 HA GLU A 528 0.659 12.115 7.786 1.00 11.13 H new ATOM 0 HB2 GLU A 528 2.301 14.678 7.566 1.00 30.22 H new ATOM 0 HB3 GLU A 528 1.132 14.125 6.384 1.00 30.22 H new ATOM 0 HG2 GLU A 528 0.001 15.785 7.624 1.00 1.23 H new ATOM 0 HG3 GLU A 528 -0.637 14.267 8.223 1.00 1.23 H new ATOM 1483 N ASN A 529 3.742 11.558 7.695 1.00 43.43 N ATOM 1484 CA ASN A 529 4.807 10.822 7.003 1.00 34.42 C ATOM 1485 C ASN A 529 4.557 9.300 7.065 1.00 53.24 C ATOM 1486 O ASN A 529 5.220 8.517 6.390 1.00 43.43 O ATOM 1487 CB ASN A 529 6.164 11.175 7.630 1.00 63.54 C ATOM 1488 CG ASN A 529 7.337 10.538 6.907 1.00 22.33 C ATOM 1489 OD1 ASN A 529 7.806 9.468 7.276 1.00 62.25 O ATOM 1490 ND2 ASN A 529 7.817 11.188 5.867 1.00 75.33 N ATOM 0 H ASN A 529 3.898 11.678 8.696 1.00 43.43 H new ATOM 0 HA ASN A 529 4.812 11.113 5.953 1.00 34.42 H new ATOM 0 HB2 ASN A 529 6.288 12.258 7.628 1.00 63.54 H new ATOM 0 HB3 ASN A 529 6.170 10.856 8.672 1.00 63.54 H new ATOM 0 HD21 ASN A 529 8.602 10.802 5.343 1.00 75.33 H new ATOM 0 HD22 ASN A 529 7.403 12.077 5.586 1.00 75.33 H new ATOM 1497 N ASN A 530 3.567 8.898 7.859 1.00 65.13 N ATOM 1498 CA ASN A 530 3.273 7.475 8.095 1.00 13.11 C ATOM 1499 C ASN A 530 2.329 6.900 7.018 1.00 31.25 C ATOM 1500 O ASN A 530 2.092 5.693 6.960 1.00 53.13 O ATOM 1501 CB ASN A 530 2.644 7.322 9.488 1.00 43.22 C ATOM 1502 CG ASN A 530 2.537 5.881 9.941 1.00 5.04 C ATOM 1503 OD1 ASN A 530 3.343 5.033 9.571 1.00 32.31 O ATOM 1504 ND2 ASN A 530 1.543 5.586 10.754 1.00 62.12 N ATOM 0 H ASN A 530 2.947 9.538 8.356 1.00 65.13 H new ATOM 0 HA ASN A 530 4.206 6.914 8.040 1.00 13.11 H new ATOM 0 HB2 ASN A 530 3.239 7.880 10.211 1.00 43.22 H new ATOM 0 HB3 ASN A 530 1.650 7.768 9.481 1.00 43.22 H new ATOM 0 HD21 ASN A 530 1.428 4.631 11.093 1.00 62.12 H new ATOM 0 HD22 ASN A 530 0.889 6.313 11.044 1.00 62.12 H new ATOM 1511 N ASN A 531 1.823 7.774 6.151 1.00 31.42 N ATOM 1512 CA ASN A 531 0.827 7.392 5.138 1.00 21.53 C ATOM 1513 C ASN A 531 1.454 6.686 3.918 1.00 52.22 C ATOM 1514 O ASN A 531 0.769 6.437 2.922 1.00 33.54 O ATOM 1515 CB ASN A 531 0.067 8.641 4.674 1.00 73.42 C ATOM 1516 CG ASN A 531 -0.551 9.405 5.831 1.00 45.15 C ATOM 1517 OD1 ASN A 531 0.079 10.280 6.413 1.00 33.05 O ATOM 1518 ND2 ASN A 531 -1.781 9.080 6.168 1.00 25.34 N ATOM 0 H ASN A 531 2.085 8.759 6.126 1.00 31.42 H new ATOM 0 HA ASN A 531 0.147 6.680 5.606 1.00 21.53 H new ATOM 0 HB2 ASN A 531 0.748 9.297 4.131 1.00 73.42 H new ATOM 0 HB3 ASN A 531 -0.717 8.348 3.976 1.00 73.42 H new ATOM 0 HD21 ASN A 531 -2.243 9.563 6.939 1.00 25.34 H new ATOM 0 HD22 ASN A 531 -2.272 8.345 5.658 1.00 25.34 H new ATOM 1525 N VAL A 532 2.747 6.359 3.994 1.00 24.31 N ATOM 1526 CA VAL A 532 3.464 5.752 2.859 1.00 34.20 C ATOM 1527 C VAL A 532 4.294 4.519 3.281 1.00 15.14 C ATOM 1528 O VAL A 532 4.832 4.462 4.389 1.00 10.01 O ATOM 1529 CB VAL A 532 4.412 6.781 2.178 1.00 53.42 C ATOM 1530 CG1 VAL A 532 5.107 6.170 0.958 1.00 51.00 C ATOM 1531 CG2 VAL A 532 3.652 8.048 1.786 1.00 73.55 C ATOM 0 H VAL A 532 3.321 6.502 4.825 1.00 24.31 H new ATOM 0 HA VAL A 532 2.697 5.432 2.154 1.00 34.20 H new ATOM 0 HB VAL A 532 5.180 7.053 2.902 1.00 53.42 H new ATOM 0 HG11 VAL A 532 5.763 6.912 0.503 1.00 51.00 H new ATOM 0 HG12 VAL A 532 5.696 5.307 1.269 1.00 51.00 H new ATOM 0 HG13 VAL A 532 4.357 5.855 0.232 1.00 51.00 H new ATOM 0 HG21 VAL A 532 4.337 8.751 1.312 1.00 73.55 H new ATOM 0 HG22 VAL A 532 2.854 7.793 1.089 1.00 73.55 H new ATOM 0 HG23 VAL A 532 3.222 8.505 2.677 1.00 73.55 H new ATOM 1541 N ALA A 533 4.386 3.532 2.384 1.00 35.15 N ATOM 1542 CA ALA A 533 5.264 2.365 2.576 1.00 43.13 C ATOM 1543 C ALA A 533 6.063 2.067 1.295 1.00 11.43 C ATOM 1544 O ALA A 533 5.542 2.206 0.186 1.00 62.13 O ATOM 1545 CB ALA A 533 4.448 1.143 2.990 1.00 72.03 C ATOM 0 H ALA A 533 3.860 3.515 1.510 1.00 35.15 H new ATOM 0 HA ALA A 533 5.969 2.598 3.374 1.00 43.13 H new ATOM 0 HB1 ALA A 533 5.113 0.291 3.127 1.00 72.03 H new ATOM 0 HB2 ALA A 533 3.929 1.352 3.925 1.00 72.03 H new ATOM 0 HB3 ALA A 533 3.719 0.912 2.214 1.00 72.03 H new ATOM 1551 N THR A 534 7.324 1.660 1.449 1.00 1.24 N ATOM 1552 CA THR A 534 8.210 1.408 0.297 1.00 71.31 C ATOM 1553 C THR A 534 8.749 -0.031 0.278 1.00 3.01 C ATOM 1554 O THR A 534 9.356 -0.490 1.246 1.00 71.34 O ATOM 1555 CB THR A 534 9.420 2.381 0.297 1.00 14.35 C ATOM 1556 OG1 THR A 534 8.965 3.745 0.278 1.00 61.24 O ATOM 1557 CG2 THR A 534 10.329 2.134 -0.908 1.00 52.03 C ATOM 0 H THR A 534 7.760 1.496 2.356 1.00 1.24 H new ATOM 0 HA THR A 534 7.599 1.568 -0.591 1.00 71.31 H new ATOM 0 HB THR A 534 9.990 2.199 1.208 1.00 14.35 H new ATOM 0 HG1 THR A 534 8.385 3.885 -0.499 1.00 61.24 H new ATOM 0 HG21 THR A 534 11.167 2.830 -0.880 1.00 52.03 H new ATOM 0 HG22 THR A 534 10.706 1.112 -0.876 1.00 52.03 H new ATOM 0 HG23 THR A 534 9.763 2.284 -1.827 1.00 52.03 H new ATOM 1565 N PHE A 535 8.542 -0.734 -0.836 1.00 14.53 N ATOM 1566 CA PHE A 535 9.082 -2.087 -1.021 1.00 31.43 C ATOM 1567 C PHE A 535 9.746 -2.218 -2.404 1.00 73.11 C ATOM 1568 O PHE A 535 9.255 -1.679 -3.393 1.00 2.43 O ATOM 1569 CB PHE A 535 7.971 -3.135 -0.860 1.00 70.33 C ATOM 1570 CG PHE A 535 8.477 -4.559 -0.796 1.00 61.52 C ATOM 1571 CD1 PHE A 535 9.002 -5.067 0.386 1.00 51.31 C ATOM 1572 CD2 PHE A 535 8.435 -5.385 -1.911 1.00 20.22 C ATOM 1573 CE1 PHE A 535 9.471 -6.366 0.452 1.00 23.52 C ATOM 1574 CE2 PHE A 535 8.905 -6.685 -1.847 1.00 21.43 C ATOM 1575 CZ PHE A 535 9.422 -7.175 -0.665 1.00 34.04 C ATOM 0 H PHE A 535 8.002 -0.389 -1.629 1.00 14.53 H new ATOM 0 HA PHE A 535 9.838 -2.263 -0.256 1.00 31.43 H new ATOM 0 HB2 PHE A 535 7.409 -2.918 0.049 1.00 70.33 H new ATOM 0 HB3 PHE A 535 7.275 -3.044 -1.694 1.00 70.33 H new ATOM 0 HD1 PHE A 535 9.044 -4.439 1.264 1.00 51.31 H new ATOM 0 HD2 PHE A 535 8.031 -5.009 -2.839 1.00 20.22 H new ATOM 0 HE1 PHE A 535 9.876 -6.748 1.378 1.00 23.52 H new ATOM 0 HE2 PHE A 535 8.867 -7.316 -2.722 1.00 21.43 H new ATOM 0 HZ PHE A 535 9.788 -8.190 -0.614 1.00 34.04 H new ATOM 1585 N ASP A 536 10.868 -2.927 -2.467 1.00 63.42 N ATOM 1586 CA ASP A 536 11.637 -3.060 -3.711 1.00 43.34 C ATOM 1587 C ASP A 536 11.697 -4.521 -4.205 1.00 53.14 C ATOM 1588 O ASP A 536 12.087 -5.427 -3.465 1.00 14.03 O ATOM 1589 CB ASP A 536 13.045 -2.486 -3.499 1.00 21.24 C ATOM 1590 CG ASP A 536 13.674 -2.952 -2.195 1.00 75.13 C ATOM 1591 OD1 ASP A 536 13.340 -2.385 -1.128 1.00 43.44 O ATOM 1592 OD2 ASP A 536 14.510 -3.877 -2.229 1.00 22.23 O ATOM 0 H ASP A 536 11.271 -3.422 -1.671 1.00 63.42 H new ATOM 0 HA ASP A 536 11.129 -2.494 -4.492 1.00 43.34 H new ATOM 0 HB2 ASP A 536 13.683 -2.781 -4.332 1.00 21.24 H new ATOM 0 HB3 ASP A 536 12.995 -1.397 -3.506 1.00 21.24 H new ATOM 1597 N VAL A 537 11.309 -4.730 -5.467 1.00 23.23 N ATOM 1598 CA VAL A 537 11.250 -6.072 -6.070 1.00 74.31 C ATOM 1599 C VAL A 537 12.224 -6.209 -7.258 1.00 42.31 C ATOM 1600 O VAL A 537 12.424 -5.268 -8.030 1.00 54.13 O ATOM 1601 CB VAL A 537 9.812 -6.391 -6.562 1.00 73.10 C ATOM 1602 CG1 VAL A 537 9.720 -7.808 -7.131 1.00 22.23 C ATOM 1603 CG2 VAL A 537 8.798 -6.190 -5.437 1.00 55.53 C ATOM 0 H VAL A 537 11.028 -3.980 -6.099 1.00 23.23 H new ATOM 0 HA VAL A 537 11.542 -6.779 -5.294 1.00 74.31 H new ATOM 0 HB VAL A 537 9.573 -5.695 -7.366 1.00 73.10 H new ATOM 0 HG11 VAL A 537 8.701 -8.000 -7.467 1.00 22.23 H new ATOM 0 HG12 VAL A 537 10.404 -7.907 -7.974 1.00 22.23 H new ATOM 0 HG13 VAL A 537 9.989 -8.528 -6.359 1.00 22.23 H new ATOM 0 HG21 VAL A 537 7.797 -6.419 -5.804 1.00 55.53 H new ATOM 0 HG22 VAL A 537 9.040 -6.853 -4.606 1.00 55.53 H new ATOM 0 HG23 VAL A 537 8.832 -5.155 -5.097 1.00 55.53 H new ATOM 1613 N SER A 538 12.820 -7.394 -7.401 1.00 71.04 N ATOM 1614 CA SER A 538 13.751 -7.681 -8.507 1.00 65.41 C ATOM 1615 C SER A 538 13.217 -8.815 -9.396 1.00 63.53 C ATOM 1616 O SER A 538 12.987 -9.930 -8.923 1.00 32.11 O ATOM 1617 CB SER A 538 15.135 -8.063 -7.960 1.00 11.00 C ATOM 1618 OG SER A 538 16.051 -8.333 -9.012 1.00 25.54 O ATOM 0 H SER A 538 12.677 -8.178 -6.764 1.00 71.04 H new ATOM 0 HA SER A 538 13.840 -6.777 -9.110 1.00 65.41 H new ATOM 0 HB2 SER A 538 15.519 -7.253 -7.340 1.00 11.00 H new ATOM 0 HB3 SER A 538 15.045 -8.940 -7.319 1.00 11.00 H new ATOM 0 HG SER A 538 16.923 -8.571 -8.633 1.00 25.54 H new ATOM 1624 N VAL A 539 13.018 -8.526 -10.681 1.00 51.12 N ATOM 1625 CA VAL A 539 12.508 -9.520 -11.635 1.00 50.33 C ATOM 1626 C VAL A 539 13.637 -10.063 -12.532 1.00 30.43 C ATOM 1627 O VAL A 539 14.319 -9.298 -13.218 1.00 1.52 O ATOM 1628 CB VAL A 539 11.392 -8.919 -12.526 1.00 45.44 C ATOM 1629 CG1 VAL A 539 10.800 -9.982 -13.451 1.00 30.44 C ATOM 1630 CG2 VAL A 539 10.304 -8.275 -11.666 1.00 53.12 C ATOM 0 H VAL A 539 13.202 -7.610 -11.090 1.00 51.12 H new ATOM 0 HA VAL A 539 12.094 -10.341 -11.050 1.00 50.33 H new ATOM 0 HB VAL A 539 11.836 -8.143 -13.150 1.00 45.44 H new ATOM 0 HG11 VAL A 539 10.019 -9.535 -14.066 1.00 30.44 H new ATOM 0 HG12 VAL A 539 11.584 -10.382 -14.094 1.00 30.44 H new ATOM 0 HG13 VAL A 539 10.374 -10.788 -12.853 1.00 30.44 H new ATOM 0 HG21 VAL A 539 9.530 -7.859 -12.310 1.00 53.12 H new ATOM 0 HG22 VAL A 539 9.865 -9.027 -11.011 1.00 53.12 H new ATOM 0 HG23 VAL A 539 10.741 -7.479 -11.063 1.00 53.12 H new ATOM 1640 N VAL A 540 13.820 -11.386 -12.528 1.00 23.00 N ATOM 1641 CA VAL A 540 14.914 -12.032 -13.274 1.00 63.03 C ATOM 1642 C VAL A 540 14.411 -12.825 -14.494 1.00 42.50 C ATOM 1643 O VAL A 540 13.243 -13.199 -14.572 1.00 12.41 O ATOM 1644 CB VAL A 540 15.720 -12.985 -12.356 1.00 3.50 C ATOM 1645 CG1 VAL A 540 16.310 -12.220 -11.176 1.00 71.42 C ATOM 1646 CG2 VAL A 540 14.849 -14.143 -11.865 1.00 70.33 C ATOM 0 H VAL A 540 13.225 -12.037 -12.016 1.00 23.00 H new ATOM 0 HA VAL A 540 15.554 -11.225 -13.631 1.00 63.03 H new ATOM 0 HB VAL A 540 16.539 -13.404 -12.941 1.00 3.50 H new ATOM 0 HG11 VAL A 540 16.873 -12.906 -10.542 1.00 71.42 H new ATOM 0 HG12 VAL A 540 16.975 -11.439 -11.545 1.00 71.42 H new ATOM 0 HG13 VAL A 540 15.505 -11.768 -10.596 1.00 71.42 H new ATOM 0 HG21 VAL A 540 15.440 -14.796 -11.223 1.00 70.33 H new ATOM 0 HG22 VAL A 540 14.003 -13.749 -11.302 1.00 70.33 H new ATOM 0 HG23 VAL A 540 14.482 -14.710 -12.720 1.00 70.33 H new ATOM 1656 N LEU A 541 15.316 -13.093 -15.440 1.00 21.11 N ATOM 1657 CA LEU A 541 14.984 -13.861 -16.653 1.00 64.54 C ATOM 1658 C LEU A 541 15.167 -15.374 -16.448 1.00 64.53 C ATOM 1659 O LEU A 541 14.840 -16.175 -17.327 1.00 41.44 O ATOM 1660 CB LEU A 541 15.860 -13.398 -17.829 1.00 1.53 C ATOM 1661 CG LEU A 541 15.581 -11.977 -18.344 1.00 41.12 C ATOM 1662 CD1 LEU A 541 16.594 -11.579 -19.417 1.00 22.33 C ATOM 1663 CD2 LEU A 541 14.156 -11.876 -18.886 1.00 21.32 C ATOM 0 H LEU A 541 16.289 -12.790 -15.392 1.00 21.11 H new ATOM 0 HA LEU A 541 13.933 -13.675 -16.874 1.00 64.54 H new ATOM 0 HB2 LEU A 541 16.905 -13.457 -17.526 1.00 1.53 H new ATOM 0 HB3 LEU A 541 15.728 -14.097 -18.655 1.00 1.53 H new ATOM 0 HG LEU A 541 15.683 -11.285 -17.508 1.00 41.12 H new ATOM 0 HD11 LEU A 541 16.376 -10.570 -19.766 1.00 22.33 H new ATOM 0 HD12 LEU A 541 17.599 -11.609 -18.997 1.00 22.33 H new ATOM 0 HD13 LEU A 541 16.530 -12.274 -20.254 1.00 22.33 H new ATOM 0 HD21 LEU A 541 13.975 -10.863 -19.247 1.00 21.32 H new ATOM 0 HD22 LEU A 541 14.028 -12.582 -19.707 1.00 21.32 H new ATOM 0 HD23 LEU A 541 13.447 -12.111 -18.092 1.00 21.32 H new ATOM 1675 N GLU A 542 15.699 -15.760 -15.295 1.00 42.05 N ATOM 1676 CA GLU A 542 15.986 -17.173 -14.999 1.00 5.40 C ATOM 1677 C GLU A 542 14.913 -17.820 -14.092 1.00 42.13 C ATOM 1678 O GLU A 542 14.952 -17.621 -12.856 1.00 38.94 O ATOM 1679 CB GLU A 542 17.386 -17.298 -14.375 1.00 22.34 C ATOM 1680 CG GLU A 542 17.678 -16.277 -13.280 1.00 52.42 C ATOM 1681 CD GLU A 542 19.055 -16.458 -12.667 1.00 53.24 C ATOM 1682 OE1 GLU A 542 20.043 -15.978 -13.265 1.00 24.24 O ATOM 1683 OE2 GLU A 542 19.158 -17.082 -11.591 1.00 43.31 O ATOM 0 H GLU A 542 15.944 -15.117 -14.542 1.00 42.05 H new ATOM 0 HA GLU A 542 15.960 -17.721 -15.941 1.00 5.40 H new ATOM 0 HB2 GLU A 542 17.498 -18.300 -13.961 1.00 22.34 H new ATOM 0 HB3 GLU A 542 18.133 -17.193 -15.162 1.00 22.34 H new ATOM 0 HG2 GLU A 542 17.598 -15.272 -13.694 1.00 52.42 H new ATOM 0 HG3 GLU A 542 16.922 -16.361 -12.499 1.00 52.42 H new TER 1690 GLU A 542