USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=30 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 527 ASN :FLIP amide:sc= -0.0327 F(o=-3.1!,f=-1.6) USER MOD Set 1.2: A 529 ASN :FLIP amide:sc= -0.234 F(o=-3.1,f=-1.6) USER MOD Set 1.3: A 530 ASN : amide:sc= -1.33! C(o=-1.6!,f=-9.1!) USER MOD Set 2.1: A 472 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 522 THR OG1 : rot -28:sc= -2.85! USER MOD Set 3.1: A 514 ASN : amide:sc= -1.62 X(o=-1.7,f=-1.3!) USER MOD Set 3.2: A 534 THR OG1 : rot 180:sc= -0.038 USER MOD Set 4.1: A 507 GLN : amide:sc= 0.483 K(o=-0.69,f=-2.3) USER MOD Set 4.2: A 511 TYR OH : rot -115:sc= -1.17! USER MOD Single : A 435 MET CE :methyl 171:sc=-0.00864 (180deg=-0.182) USER MOD Single : A 441 THR OG1 : rot 46:sc= 0.15 USER MOD Single : A 445 LYS NZ :NH3+ 161:sc= -0.0364 (180deg=-0.389) USER MOD Single : A 453 ASN :FLIP amide:sc= -1.42 F(o=-3.8!,f=-1.4) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -147:sc= 0.901 USER MOD Single : A 461 HIS : +bothHN:sc= 1.18 K(o=1.2,f=-5.9!) USER MOD Single : A 463 LYS NZ :NH3+ -143:sc= 0.158 (180deg=-3.68!) USER MOD Single : A 464 ASN : amide:sc= 0.0628 K(o=0.063,f=-8!) USER MOD Single : A 473 THR OG1 : rot 180:sc= 0 USER MOD Single : A 474 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.17) USER MOD Single : A 478 TYR OH : rot -133:sc= 0.531 USER MOD Single : A 480 ASN : amide:sc= -0.271 K(o=-0.27,f=-8.4!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 20:sc= 0.0117 USER MOD Single : A 485 LYS NZ :NH3+ 172:sc= -0.0107 (180deg=-0.118) USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 176:sc= 1.24 (180deg=1.18) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 34:sc= 0.235 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 -165:sc= -0.116 (180deg=-0.454) USER MOD Single : A 516 THR OG1 : rot -60:sc= -0.0587 USER MOD Single : A 521 ASN :FLIP amide:sc= -0.0685 F(o=-1.1!,f=-0.069) USER MOD Single : A 531 ASN : amide:sc= -4.39! C(o=-4.4!,f=-5.2!) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -9.226 17.313 20.925 1.00 41.33 N ATOM 2 CA MET A 435 -9.774 16.768 19.651 1.00 21.21 C ATOM 3 C MET A 435 -8.980 15.542 19.178 1.00 62.13 C ATOM 4 O MET A 435 -7.758 15.493 19.311 1.00 70.42 O ATOM 5 CB MET A 435 -9.774 17.855 18.564 1.00 13.25 C ATOM 6 CG MET A 435 -10.198 17.349 17.190 1.00 5.23 C ATOM 7 SD MET A 435 -11.742 16.416 17.247 1.00 74.14 S ATOM 8 CE MET A 435 -12.883 17.667 17.837 1.00 35.11 C ATOM 0 HA MET A 435 -10.800 16.450 19.837 1.00 21.21 H new ATOM 0 HB2 MET A 435 -10.444 18.660 18.867 1.00 13.25 H new ATOM 0 HB3 MET A 435 -8.774 18.283 18.491 1.00 13.25 H new ATOM 0 HG2 MET A 435 -10.313 18.196 16.514 1.00 5.23 H new ATOM 0 HG3 MET A 435 -9.410 16.718 16.779 1.00 5.23 H new ATOM 0 HE1 MET A 435 -13.903 17.289 17.772 1.00 35.11 H new ATOM 0 HE2 MET A 435 -12.652 17.910 18.874 1.00 35.11 H new ATOM 0 HE3 MET A 435 -12.788 18.564 17.224 1.00 35.11 H new ATOM 20 N GLU A 436 -9.684 14.557 18.621 1.00 3.32 N ATOM 21 CA GLU A 436 -9.054 13.322 18.136 1.00 3.32 C ATOM 22 C GLU A 436 -8.592 13.468 16.680 1.00 62.32 C ATOM 23 O GLU A 436 -9.379 13.822 15.801 1.00 33.21 O ATOM 24 CB GLU A 436 -10.027 12.133 18.249 1.00 24.32 C ATOM 25 CG GLU A 436 -10.400 11.744 19.681 1.00 4.55 C ATOM 26 CD GLU A 436 -11.228 12.798 20.405 1.00 72.32 C ATOM 27 OE1 GLU A 436 -12.442 12.903 20.135 1.00 61.13 O ATOM 28 OE2 GLU A 436 -10.671 13.523 21.257 1.00 71.24 O ATOM 0 H GLU A 436 -10.695 14.588 18.493 1.00 3.32 H new ATOM 0 HA GLU A 436 -8.182 13.133 18.762 1.00 3.32 H new ATOM 0 HB2 GLU A 436 -10.939 12.375 17.704 1.00 24.32 H new ATOM 0 HB3 GLU A 436 -9.581 11.269 17.757 1.00 24.32 H new ATOM 0 HG2 GLU A 436 -10.958 10.808 19.660 1.00 4.55 H new ATOM 0 HG3 GLU A 436 -9.487 11.559 20.248 1.00 4.55 H new ATOM 35 N PHE A 437 -7.313 13.199 16.428 1.00 52.52 N ATOM 36 CA PHE A 437 -6.759 13.252 15.068 1.00 75.15 C ATOM 37 C PHE A 437 -6.295 11.861 14.603 1.00 13.05 C ATOM 38 O PHE A 437 -5.679 11.118 15.368 1.00 1.51 O ATOM 39 CB PHE A 437 -5.597 14.254 15.001 1.00 4.43 C ATOM 40 CG PHE A 437 -6.016 15.678 15.269 1.00 1.12 C ATOM 41 CD1 PHE A 437 -6.530 16.467 14.249 1.00 24.23 C ATOM 42 CD2 PHE A 437 -5.903 16.224 16.540 1.00 21.45 C ATOM 43 CE1 PHE A 437 -6.921 17.769 14.491 1.00 32.04 C ATOM 44 CE2 PHE A 437 -6.292 17.526 16.786 1.00 23.32 C ATOM 45 CZ PHE A 437 -6.802 18.299 15.761 1.00 52.00 C ATOM 0 H PHE A 437 -6.636 12.941 17.146 1.00 52.52 H new ATOM 0 HA PHE A 437 -7.549 13.586 14.396 1.00 75.15 H new ATOM 0 HB2 PHE A 437 -4.836 13.965 15.726 1.00 4.43 H new ATOM 0 HB3 PHE A 437 -5.136 14.198 14.015 1.00 4.43 H new ATOM 0 HD1 PHE A 437 -6.625 16.058 13.254 1.00 24.23 H new ATOM 0 HD2 PHE A 437 -5.506 15.624 17.346 1.00 21.45 H new ATOM 0 HE1 PHE A 437 -7.319 18.372 13.688 1.00 32.04 H new ATOM 0 HE2 PHE A 437 -6.198 17.940 17.779 1.00 23.32 H new ATOM 0 HZ PHE A 437 -7.107 19.317 15.952 1.00 52.00 H new ATOM 55 N PRO A 438 -6.602 11.483 13.344 1.00 4.01 N ATOM 56 CA PRO A 438 -6.237 10.165 12.788 1.00 45.44 C ATOM 57 C PRO A 438 -4.723 9.929 12.653 1.00 11.23 C ATOM 58 O PRO A 438 -3.906 10.830 12.858 1.00 50.21 O ATOM 59 CB PRO A 438 -6.892 10.162 11.393 1.00 74.24 C ATOM 60 CG PRO A 438 -7.905 11.252 11.437 1.00 20.21 C ATOM 61 CD PRO A 438 -7.353 12.290 12.368 1.00 4.14 C ATOM 0 HA PRO A 438 -6.574 9.370 13.453 1.00 45.44 H new ATOM 0 HB2 PRO A 438 -6.154 10.341 10.611 1.00 74.24 H new ATOM 0 HB3 PRO A 438 -7.357 9.200 11.178 1.00 74.24 H new ATOM 0 HG2 PRO A 438 -8.074 11.668 10.444 1.00 20.21 H new ATOM 0 HG3 PRO A 438 -8.865 10.879 11.794 1.00 20.21 H new ATOM 0 HD2 PRO A 438 -6.709 12.999 11.848 1.00 4.14 H new ATOM 0 HD3 PRO A 438 -8.144 12.869 12.844 1.00 4.14 H new ATOM 69 N ASP A 439 -4.379 8.698 12.292 1.00 74.45 N ATOM 70 CA ASP A 439 -2.991 8.288 12.074 1.00 71.32 C ATOM 71 C ASP A 439 -2.990 6.998 11.236 1.00 21.03 C ATOM 72 O ASP A 439 -3.029 5.893 11.778 1.00 72.14 O ATOM 73 CB ASP A 439 -2.294 8.073 13.429 1.00 23.15 C ATOM 74 CG ASP A 439 -0.784 7.942 13.317 1.00 11.02 C ATOM 75 OD1 ASP A 439 -0.299 6.859 12.934 1.00 12.03 O ATOM 76 OD2 ASP A 439 -0.075 8.912 13.652 1.00 60.22 O ATOM 0 H ASP A 439 -5.056 7.950 12.141 1.00 74.45 H new ATOM 0 HA ASP A 439 -2.443 9.062 11.537 1.00 71.32 H new ATOM 0 HB2 ASP A 439 -2.531 8.909 14.088 1.00 23.15 H new ATOM 0 HB3 ASP A 439 -2.696 7.174 13.897 1.00 23.15 H new ATOM 81 N LEU A 440 -3.021 7.144 9.913 1.00 24.44 N ATOM 82 CA LEU A 440 -3.176 5.995 9.011 1.00 53.40 C ATOM 83 C LEU A 440 -1.826 5.507 8.463 1.00 43.41 C ATOM 84 O LEU A 440 -1.010 6.293 7.986 1.00 30.15 O ATOM 85 CB LEU A 440 -4.111 6.372 7.851 1.00 41.41 C ATOM 86 CG LEU A 440 -5.524 6.830 8.263 1.00 41.44 C ATOM 87 CD1 LEU A 440 -6.297 7.352 7.053 1.00 54.10 C ATOM 88 CD2 LEU A 440 -6.289 5.692 8.942 1.00 65.33 C ATOM 0 H LEU A 440 -2.941 8.043 9.438 1.00 24.44 H new ATOM 0 HA LEU A 440 -3.610 5.176 9.585 1.00 53.40 H new ATOM 0 HB2 LEU A 440 -3.643 7.169 7.274 1.00 41.41 H new ATOM 0 HB3 LEU A 440 -4.205 5.512 7.188 1.00 41.41 H new ATOM 0 HG LEU A 440 -5.420 7.644 8.980 1.00 41.44 H new ATOM 0 HD11 LEU A 440 -7.291 7.670 7.366 1.00 54.10 H new ATOM 0 HD12 LEU A 440 -5.765 8.199 6.619 1.00 54.10 H new ATOM 0 HD13 LEU A 440 -6.387 6.560 6.309 1.00 54.10 H new ATOM 0 HD21 LEU A 440 -7.283 6.039 9.224 1.00 65.33 H new ATOM 0 HD22 LEU A 440 -6.380 4.852 8.253 1.00 65.33 H new ATOM 0 HD23 LEU A 440 -5.750 5.373 9.834 1.00 65.33 H new ATOM 100 N THR A 441 -1.601 4.195 8.519 1.00 45.11 N ATOM 101 CA THR A 441 -0.353 3.608 8.011 1.00 22.13 C ATOM 102 C THR A 441 -0.615 2.386 7.127 1.00 60.13 C ATOM 103 O THR A 441 -1.619 1.686 7.290 1.00 11.40 O ATOM 104 CB THR A 441 0.602 3.209 9.162 1.00 1.43 C ATOM 105 OG1 THR A 441 1.822 2.660 8.636 1.00 22.32 O ATOM 106 CG2 THR A 441 -0.046 2.203 10.106 1.00 45.43 C ATOM 0 H THR A 441 -2.259 3.519 8.907 1.00 45.11 H new ATOM 0 HA THR A 441 0.122 4.382 7.408 1.00 22.13 H new ATOM 0 HB THR A 441 0.825 4.114 9.727 1.00 1.43 H new ATOM 0 HG1 THR A 441 2.145 3.224 7.903 1.00 22.32 H new ATOM 0 HG21 THR A 441 0.654 1.947 10.901 1.00 45.43 H new ATOM 0 HG22 THR A 441 -0.945 2.639 10.541 1.00 45.43 H new ATOM 0 HG23 THR A 441 -0.311 1.303 9.552 1.00 45.43 H new ATOM 114 N VAL A 442 0.296 2.141 6.186 1.00 14.40 N ATOM 115 CA VAL A 442 0.176 1.020 5.251 1.00 13.44 C ATOM 116 C VAL A 442 1.407 0.098 5.317 1.00 2.22 C ATOM 117 O VAL A 442 2.521 0.547 5.590 1.00 62.12 O ATOM 118 CB VAL A 442 0.005 1.529 3.795 1.00 61.25 C ATOM 119 CG1 VAL A 442 -1.241 2.403 3.660 1.00 12.33 C ATOM 120 CG2 VAL A 442 1.246 2.297 3.344 1.00 14.50 C ATOM 0 H VAL A 442 1.133 2.708 6.050 1.00 14.40 H new ATOM 0 HA VAL A 442 -0.708 0.454 5.545 1.00 13.44 H new ATOM 0 HB VAL A 442 -0.120 0.660 3.149 1.00 61.25 H new ATOM 0 HG11 VAL A 442 -1.335 2.745 2.629 1.00 12.33 H new ATOM 0 HG12 VAL A 442 -2.123 1.823 3.932 1.00 12.33 H new ATOM 0 HG13 VAL A 442 -1.155 3.265 4.322 1.00 12.33 H new ATOM 0 HG21 VAL A 442 1.106 2.645 2.321 1.00 14.50 H new ATOM 0 HG22 VAL A 442 1.403 3.153 4.001 1.00 14.50 H new ATOM 0 HG23 VAL A 442 2.116 1.641 3.388 1.00 14.50 H new ATOM 130 N GLU A 443 1.198 -1.191 5.068 1.00 55.50 N ATOM 131 CA GLU A 443 2.291 -2.176 5.064 1.00 65.53 C ATOM 132 C GLU A 443 2.257 -3.056 3.806 1.00 12.54 C ATOM 133 O GLU A 443 1.217 -3.620 3.467 1.00 20.42 O ATOM 134 CB GLU A 443 2.200 -3.069 6.309 1.00 21.03 C ATOM 135 CG GLU A 443 2.355 -2.323 7.628 1.00 2.42 C ATOM 136 CD GLU A 443 2.296 -3.256 8.827 1.00 24.25 C ATOM 137 OE1 GLU A 443 3.352 -3.809 9.210 1.00 62.54 O ATOM 138 OE2 GLU A 443 1.196 -3.456 9.383 1.00 63.24 O ATOM 0 H GLU A 443 0.280 -1.586 4.865 1.00 55.50 H new ATOM 0 HA GLU A 443 3.230 -1.623 5.070 1.00 65.53 H new ATOM 0 HB2 GLU A 443 1.238 -3.581 6.305 1.00 21.03 H new ATOM 0 HB3 GLU A 443 2.970 -3.838 6.247 1.00 21.03 H new ATOM 0 HG2 GLU A 443 3.305 -1.789 7.632 1.00 2.42 H new ATOM 0 HG3 GLU A 443 1.568 -1.574 7.714 1.00 2.42 H new ATOM 145 N ILE A 444 3.395 -3.176 3.124 1.00 34.10 N ATOM 146 CA ILE A 444 3.516 -4.062 1.955 1.00 74.14 C ATOM 147 C ILE A 444 4.240 -5.367 2.331 1.00 13.53 C ATOM 148 O ILE A 444 5.339 -5.338 2.885 1.00 2.32 O ATOM 149 CB ILE A 444 4.288 -3.375 0.797 1.00 64.33 C ATOM 150 CG1 ILE A 444 3.623 -2.038 0.417 1.00 62.23 C ATOM 151 CG2 ILE A 444 4.375 -4.301 -0.422 1.00 42.44 C ATOM 152 CD1 ILE A 444 4.357 -1.277 -0.669 1.00 2.51 C ATOM 0 H ILE A 444 4.251 -2.672 3.357 1.00 34.10 H new ATOM 0 HA ILE A 444 2.503 -4.287 1.621 1.00 74.14 H new ATOM 0 HB ILE A 444 5.301 -3.167 1.140 1.00 64.33 H new ATOM 0 HG12 ILE A 444 2.603 -2.232 0.086 1.00 62.23 H new ATOM 0 HG13 ILE A 444 3.556 -1.411 1.306 1.00 62.23 H new ATOM 0 HG21 ILE A 444 4.920 -3.799 -1.222 1.00 42.44 H new ATOM 0 HG22 ILE A 444 4.897 -5.217 -0.146 1.00 42.44 H new ATOM 0 HG23 ILE A 444 3.370 -4.545 -0.766 1.00 42.44 H new ATOM 0 HD11 ILE A 444 3.829 -0.347 -0.882 1.00 2.51 H new ATOM 0 HD12 ILE A 444 5.369 -1.051 -0.334 1.00 2.51 H new ATOM 0 HD13 ILE A 444 4.401 -1.885 -1.573 1.00 2.51 H new ATOM 164 N LYS A 445 3.627 -6.506 2.023 1.00 52.22 N ATOM 165 CA LYS A 445 4.204 -7.814 2.364 1.00 40.41 C ATOM 166 C LYS A 445 4.182 -8.762 1.154 1.00 73.21 C ATOM 167 O LYS A 445 3.177 -8.853 0.452 1.00 43.40 O ATOM 168 CB LYS A 445 3.416 -8.425 3.532 1.00 10.31 C ATOM 169 CG LYS A 445 4.117 -9.593 4.216 1.00 14.12 C ATOM 170 CD LYS A 445 3.262 -10.179 5.337 1.00 54.13 C ATOM 171 CE LYS A 445 4.065 -11.104 6.244 1.00 0.32 C ATOM 172 NZ LYS A 445 5.145 -10.376 6.967 1.00 44.33 N ATOM 0 H LYS A 445 2.731 -6.556 1.538 1.00 52.22 H new ATOM 0 HA LYS A 445 5.245 -7.673 2.656 1.00 40.41 H new ATOM 0 HB2 LYS A 445 3.224 -7.648 4.272 1.00 10.31 H new ATOM 0 HB3 LYS A 445 2.447 -8.762 3.165 1.00 10.31 H new ATOM 0 HG2 LYS A 445 4.337 -10.368 3.481 1.00 14.12 H new ATOM 0 HG3 LYS A 445 5.072 -9.259 4.622 1.00 14.12 H new ATOM 0 HD2 LYS A 445 2.837 -9.369 5.930 1.00 54.13 H new ATOM 0 HD3 LYS A 445 2.427 -10.730 4.905 1.00 54.13 H new ATOM 0 HE2 LYS A 445 3.397 -11.573 6.967 1.00 0.32 H new ATOM 0 HE3 LYS A 445 4.503 -11.905 5.649 1.00 0.32 H new ATOM 0 HZ1 LYS A 445 5.451 -10.935 7.789 1.00 44.33 H new ATOM 0 HZ2 LYS A 445 5.953 -10.229 6.328 1.00 44.33 H new ATOM 0 HZ3 LYS A 445 4.787 -9.454 7.289 1.00 44.33 H new ATOM 186 N GLY A 446 5.290 -9.459 0.900 1.00 40.35 N ATOM 187 CA GLY A 446 5.338 -10.400 -0.220 1.00 15.42 C ATOM 188 C GLY A 446 6.757 -10.733 -0.685 1.00 20.35 C ATOM 189 O GLY A 446 7.733 -10.377 -0.019 1.00 54.20 O ATOM 0 H GLY A 446 6.151 -9.393 1.443 1.00 40.35 H new ATOM 0 HA2 GLY A 446 4.835 -11.322 0.070 1.00 15.42 H new ATOM 0 HA3 GLY A 446 4.780 -9.982 -1.058 1.00 15.42 H new ATOM 193 N PRO A 447 6.902 -11.423 -1.837 1.00 24.44 N ATOM 194 CA PRO A 447 8.220 -11.817 -2.373 1.00 63.31 C ATOM 195 C PRO A 447 9.040 -10.622 -2.898 1.00 24.13 C ATOM 196 O PRO A 447 8.568 -9.842 -3.725 1.00 3.22 O ATOM 197 CB PRO A 447 7.857 -12.775 -3.520 1.00 51.52 C ATOM 198 CG PRO A 447 6.493 -12.348 -3.952 1.00 3.45 C ATOM 199 CD PRO A 447 5.791 -11.872 -2.705 1.00 1.20 C ATOM 0 HA PRO A 447 8.853 -12.262 -1.605 1.00 63.31 H new ATOM 0 HB2 PRO A 447 8.573 -12.702 -4.339 1.00 51.52 H new ATOM 0 HB3 PRO A 447 7.860 -13.812 -3.186 1.00 51.52 H new ATOM 0 HG2 PRO A 447 6.550 -11.553 -4.695 1.00 3.45 H new ATOM 0 HG3 PRO A 447 5.953 -13.175 -4.412 1.00 3.45 H new ATOM 0 HD2 PRO A 447 5.096 -11.061 -2.920 1.00 1.20 H new ATOM 0 HD3 PRO A 447 5.214 -12.671 -2.239 1.00 1.20 H new ATOM 207 N ASP A 448 10.279 -10.498 -2.421 1.00 44.22 N ATOM 208 CA ASP A 448 11.164 -9.391 -2.813 1.00 0.41 C ATOM 209 C ASP A 448 11.935 -9.696 -4.113 1.00 21.32 C ATOM 210 O ASP A 448 12.421 -8.788 -4.787 1.00 52.12 O ATOM 211 CB ASP A 448 12.138 -9.090 -1.669 1.00 12.14 C ATOM 212 CG ASP A 448 12.977 -10.299 -1.290 1.00 5.14 C ATOM 213 OD1 ASP A 448 12.418 -11.274 -0.742 1.00 52.21 O ATOM 214 OD2 ASP A 448 14.196 -10.291 -1.550 1.00 22.42 O ATOM 0 H ASP A 448 10.698 -11.152 -1.759 1.00 44.22 H new ATOM 0 HA ASP A 448 10.545 -8.516 -3.010 1.00 0.41 H new ATOM 0 HB2 ASP A 448 12.796 -8.272 -1.961 1.00 12.14 H new ATOM 0 HB3 ASP A 448 11.577 -8.752 -0.797 1.00 12.14 H new ATOM 219 N VAL A 449 12.051 -10.979 -4.453 1.00 72.04 N ATOM 220 CA VAL A 449 12.717 -11.406 -5.697 1.00 74.35 C ATOM 221 C VAL A 449 11.859 -12.434 -6.450 1.00 43.01 C ATOM 222 O VAL A 449 11.538 -13.498 -5.914 1.00 54.11 O ATOM 223 CB VAL A 449 14.117 -12.023 -5.423 1.00 65.41 C ATOM 224 CG1 VAL A 449 14.770 -12.498 -6.723 1.00 61.32 C ATOM 225 CG2 VAL A 449 15.020 -11.025 -4.702 1.00 34.55 C ATOM 0 H VAL A 449 11.693 -11.748 -3.887 1.00 72.04 H new ATOM 0 HA VAL A 449 12.843 -10.512 -6.307 1.00 74.35 H new ATOM 0 HB VAL A 449 13.980 -12.889 -4.775 1.00 65.41 H new ATOM 0 HG11 VAL A 449 15.748 -12.926 -6.504 1.00 61.32 H new ATOM 0 HG12 VAL A 449 14.140 -13.254 -7.191 1.00 61.32 H new ATOM 0 HG13 VAL A 449 14.887 -11.653 -7.401 1.00 61.32 H new ATOM 0 HG21 VAL A 449 15.994 -11.480 -4.521 1.00 34.55 H new ATOM 0 HG22 VAL A 449 15.144 -10.135 -5.319 1.00 34.55 H new ATOM 0 HG23 VAL A 449 14.568 -10.747 -3.750 1.00 34.55 H new ATOM 235 N VAL A 450 11.496 -12.115 -7.690 1.00 22.14 N ATOM 236 CA VAL A 450 10.639 -12.990 -8.504 1.00 14.32 C ATOM 237 C VAL A 450 11.225 -13.220 -9.909 1.00 73.31 C ATOM 238 O VAL A 450 12.108 -12.487 -10.361 1.00 3.35 O ATOM 239 CB VAL A 450 9.202 -12.412 -8.638 1.00 62.30 C ATOM 240 CG1 VAL A 450 8.514 -12.333 -7.276 1.00 60.15 C ATOM 241 CG2 VAL A 450 9.228 -11.039 -9.308 1.00 5.53 C ATOM 0 H VAL A 450 11.780 -11.255 -8.159 1.00 22.14 H new ATOM 0 HA VAL A 450 10.593 -13.946 -7.983 1.00 14.32 H new ATOM 0 HB VAL A 450 8.627 -13.089 -9.269 1.00 62.30 H new ATOM 0 HG11 VAL A 450 7.511 -11.925 -7.398 1.00 60.15 H new ATOM 0 HG12 VAL A 450 8.450 -13.331 -6.842 1.00 60.15 H new ATOM 0 HG13 VAL A 450 9.090 -11.686 -6.614 1.00 60.15 H new ATOM 0 HG21 VAL A 450 8.211 -10.655 -9.391 1.00 5.53 H new ATOM 0 HG22 VAL A 450 9.827 -10.353 -8.709 1.00 5.53 H new ATOM 0 HG23 VAL A 450 9.664 -11.128 -10.303 1.00 5.53 H new ATOM 251 N GLY A 451 10.734 -14.254 -10.588 1.00 41.34 N ATOM 252 CA GLY A 451 11.194 -14.555 -11.939 1.00 3.22 C ATOM 253 C GLY A 451 10.353 -13.887 -13.025 1.00 22.41 C ATOM 254 O GLY A 451 9.230 -13.439 -12.774 1.00 51.31 O ATOM 0 H GLY A 451 10.024 -14.892 -10.228 1.00 41.34 H new ATOM 0 HA2 GLY A 451 12.231 -14.234 -12.043 1.00 3.22 H new ATOM 0 HA3 GLY A 451 11.178 -15.635 -12.089 1.00 3.22 H new ATOM 258 N VAL A 452 10.895 -13.826 -14.234 1.00 32.32 N ATOM 259 CA VAL A 452 10.204 -13.211 -15.369 1.00 53.23 C ATOM 260 C VAL A 452 9.004 -14.064 -15.833 1.00 62.11 C ATOM 261 O VAL A 452 9.072 -15.296 -15.861 1.00 24.41 O ATOM 262 CB VAL A 452 11.183 -12.985 -16.550 1.00 2.12 C ATOM 263 CG1 VAL A 452 11.649 -14.314 -17.140 1.00 55.45 C ATOM 264 CG2 VAL A 452 10.559 -12.097 -17.622 1.00 23.55 C ATOM 0 H VAL A 452 11.818 -14.197 -14.459 1.00 32.32 H new ATOM 0 HA VAL A 452 9.824 -12.246 -15.034 1.00 53.23 H new ATOM 0 HB VAL A 452 12.059 -12.468 -16.160 1.00 2.12 H new ATOM 0 HG11 VAL A 452 12.334 -14.125 -17.966 1.00 55.45 H new ATOM 0 HG12 VAL A 452 12.159 -14.895 -16.371 1.00 55.45 H new ATOM 0 HG13 VAL A 452 10.787 -14.873 -17.504 1.00 55.45 H new ATOM 0 HG21 VAL A 452 11.269 -11.957 -18.437 1.00 23.55 H new ATOM 0 HG22 VAL A 452 9.655 -12.570 -18.006 1.00 23.55 H new ATOM 0 HG23 VAL A 452 10.306 -11.129 -17.190 1.00 23.55 H new ATOM 274 N ASN A 453 7.905 -13.393 -16.184 1.00 34.44 N ATOM 275 CA ASN A 453 6.662 -14.056 -16.621 1.00 45.01 C ATOM 276 C ASN A 453 6.040 -14.917 -15.505 1.00 72.11 C ATOM 277 O ASN A 453 5.200 -15.782 -15.767 1.00 71.02 O ATOM 278 CB ASN A 453 6.906 -14.919 -17.872 1.00 55.30 C ATOM 279 CG ASN A 453 7.486 -14.117 -19.021 1.00 53.51 C ATOM 280 OD1 ASN A 453 8.793 -14.163 -19.187 1.00 12.13 O flip ATOM 281 ND2 ASN A 453 6.762 -13.474 -19.774 1.00 74.22 N flip ATOM 0 H ASN A 453 7.846 -12.375 -16.175 1.00 34.44 H new ATOM 0 HA ASN A 453 5.955 -13.263 -16.867 1.00 45.01 H new ATOM 0 HB2 ASN A 453 7.585 -15.734 -17.622 1.00 55.30 H new ATOM 0 HB3 ASN A 453 5.966 -15.373 -18.187 1.00 55.30 H new ATOM 0 HD21 ASN A 453 5.754 -13.457 -19.621 1.00 74.22 H new ATOM 0 HD22 ASN A 453 7.168 -12.956 -20.553 1.00 74.22 H new ATOM 288 N LYS A 454 6.442 -14.669 -14.259 1.00 43.11 N ATOM 289 CA LYS A 454 5.924 -15.431 -13.116 1.00 53.30 C ATOM 290 C LYS A 454 4.868 -14.643 -12.334 1.00 41.33 C ATOM 291 O LYS A 454 4.733 -13.429 -12.490 1.00 74.12 O ATOM 292 CB LYS A 454 7.070 -15.845 -12.180 1.00 5.44 C ATOM 293 CG LYS A 454 8.154 -16.675 -12.865 1.00 10.23 C ATOM 294 CD LYS A 454 7.576 -17.870 -13.617 1.00 72.30 C ATOM 295 CE LYS A 454 6.770 -18.790 -12.705 1.00 62.43 C ATOM 296 NZ LYS A 454 6.211 -19.951 -13.444 1.00 70.34 N ATOM 0 H LYS A 454 7.122 -13.950 -14.013 1.00 43.11 H new ATOM 0 HA LYS A 454 5.445 -16.325 -13.515 1.00 53.30 H new ATOM 0 HB2 LYS A 454 7.524 -14.949 -11.758 1.00 5.44 H new ATOM 0 HB3 LYS A 454 6.659 -16.416 -11.348 1.00 5.44 H new ATOM 0 HG2 LYS A 454 8.708 -16.044 -13.560 1.00 10.23 H new ATOM 0 HG3 LYS A 454 8.866 -17.027 -12.118 1.00 10.23 H new ATOM 0 HD2 LYS A 454 6.938 -17.514 -14.426 1.00 72.30 H new ATOM 0 HD3 LYS A 454 8.387 -18.436 -14.076 1.00 72.30 H new ATOM 0 HE2 LYS A 454 7.406 -19.147 -11.895 1.00 62.43 H new ATOM 0 HE3 LYS A 454 5.958 -18.226 -12.247 1.00 62.43 H new ATOM 0 HZ1 LYS A 454 5.670 -20.552 -12.789 1.00 70.34 H new ATOM 0 HZ2 LYS A 454 5.583 -19.611 -14.201 1.00 70.34 H new ATOM 0 HZ3 LYS A 454 6.987 -20.504 -13.860 1.00 70.34 H new ATOM 310 N LEU A 455 4.121 -15.345 -11.489 1.00 75.04 N ATOM 311 CA LEU A 455 3.067 -14.724 -10.684 1.00 43.20 C ATOM 312 C LEU A 455 3.574 -14.353 -9.283 1.00 52.33 C ATOM 313 O LEU A 455 4.283 -15.129 -8.642 1.00 11.24 O ATOM 314 CB LEU A 455 1.866 -15.674 -10.565 1.00 32.44 C ATOM 315 CG LEU A 455 0.664 -15.116 -9.786 1.00 2.20 C ATOM 316 CD1 LEU A 455 0.141 -13.844 -10.445 1.00 2.30 C ATOM 317 CD2 LEU A 455 -0.441 -16.165 -9.672 1.00 13.02 C ATOM 0 H LEU A 455 4.224 -16.349 -11.341 1.00 75.04 H new ATOM 0 HA LEU A 455 2.760 -13.807 -11.188 1.00 43.20 H new ATOM 0 HB2 LEU A 455 1.535 -15.943 -11.568 1.00 32.44 H new ATOM 0 HB3 LEU A 455 2.197 -16.593 -10.081 1.00 32.44 H new ATOM 0 HG LEU A 455 0.995 -14.865 -8.778 1.00 2.20 H new ATOM 0 HD11 LEU A 455 -0.710 -13.464 -9.879 1.00 2.30 H new ATOM 0 HD12 LEU A 455 0.930 -13.092 -10.462 1.00 2.30 H new ATOM 0 HD13 LEU A 455 -0.172 -14.065 -11.465 1.00 2.30 H new ATOM 0 HD21 LEU A 455 -1.282 -15.749 -9.117 1.00 13.02 H new ATOM 0 HD22 LEU A 455 -0.772 -16.455 -10.669 1.00 13.02 H new ATOM 0 HD23 LEU A 455 -0.058 -17.041 -9.148 1.00 13.02 H new ATOM 329 N ALA A 456 3.210 -13.164 -8.814 1.00 24.21 N ATOM 330 CA ALA A 456 3.558 -12.727 -7.461 1.00 32.14 C ATOM 331 C ALA A 456 2.354 -12.075 -6.768 1.00 31.13 C ATOM 332 O ALA A 456 1.672 -11.228 -7.348 1.00 63.22 O ATOM 333 CB ALA A 456 4.740 -11.762 -7.505 1.00 23.34 C ATOM 0 H ALA A 456 2.673 -12.482 -9.350 1.00 24.21 H new ATOM 0 HA ALA A 456 3.845 -13.604 -6.881 1.00 32.14 H new ATOM 0 HB1 ALA A 456 4.989 -11.445 -6.492 1.00 23.34 H new ATOM 0 HB2 ALA A 456 5.601 -12.261 -7.950 1.00 23.34 H new ATOM 0 HB3 ALA A 456 4.476 -10.890 -8.104 1.00 23.34 H new ATOM 339 N GLU A 457 2.088 -12.482 -5.531 1.00 42.44 N ATOM 340 CA GLU A 457 1.004 -11.901 -4.735 1.00 64.42 C ATOM 341 C GLU A 457 1.548 -11.132 -3.530 1.00 31.41 C ATOM 342 O GLU A 457 2.391 -11.634 -2.783 1.00 52.13 O ATOM 343 CB GLU A 457 0.026 -12.990 -4.268 1.00 4.14 C ATOM 344 CG GLU A 457 -0.993 -13.391 -5.328 1.00 73.25 C ATOM 345 CD GLU A 457 -1.906 -14.521 -4.878 1.00 13.40 C ATOM 346 OE1 GLU A 457 -2.859 -14.249 -4.120 1.00 1.50 O ATOM 347 OE2 GLU A 457 -1.677 -15.682 -5.281 1.00 50.14 O ATOM 0 H GLU A 457 2.610 -13.216 -5.053 1.00 42.44 H new ATOM 0 HA GLU A 457 0.469 -11.199 -5.374 1.00 64.42 H new ATOM 0 HB2 GLU A 457 0.593 -13.872 -3.969 1.00 4.14 H new ATOM 0 HB3 GLU A 457 -0.503 -12.636 -3.383 1.00 4.14 H new ATOM 0 HG2 GLU A 457 -1.599 -12.523 -5.588 1.00 73.25 H new ATOM 0 HG3 GLU A 457 -0.467 -13.695 -6.233 1.00 73.25 H new ATOM 354 N TYR A 458 1.048 -9.917 -3.340 1.00 3.44 N ATOM 355 CA TYR A 458 1.473 -9.064 -2.229 1.00 72.21 C ATOM 356 C TYR A 458 0.277 -8.666 -1.354 1.00 30.03 C ATOM 357 O TYR A 458 -0.875 -8.699 -1.799 1.00 43.20 O ATOM 358 CB TYR A 458 2.166 -7.800 -2.758 1.00 13.25 C ATOM 359 CG TYR A 458 3.430 -8.069 -3.558 1.00 53.25 C ATOM 360 CD1 TYR A 458 3.365 -8.449 -4.895 1.00 35.20 C ATOM 361 CD2 TYR A 458 4.687 -7.940 -2.975 1.00 2.24 C ATOM 362 CE1 TYR A 458 4.512 -8.693 -5.624 1.00 74.34 C ATOM 363 CE2 TYR A 458 5.838 -8.182 -3.701 1.00 55.14 C ATOM 364 CZ TYR A 458 5.745 -8.558 -5.023 1.00 14.14 C ATOM 365 OH TYR A 458 6.890 -8.801 -5.747 1.00 14.45 O ATOM 0 H TYR A 458 0.343 -9.495 -3.944 1.00 3.44 H new ATOM 0 HA TYR A 458 2.177 -9.633 -1.622 1.00 72.21 H new ATOM 0 HB2 TYR A 458 1.464 -7.250 -3.384 1.00 13.25 H new ATOM 0 HB3 TYR A 458 2.414 -7.155 -1.915 1.00 13.25 H new ATOM 0 HD1 TYR A 458 2.401 -8.555 -5.371 1.00 35.20 H new ATOM 0 HD2 TYR A 458 4.764 -7.646 -1.939 1.00 2.24 H new ATOM 0 HE1 TYR A 458 4.443 -8.988 -6.661 1.00 74.34 H new ATOM 0 HE2 TYR A 458 6.806 -8.077 -3.234 1.00 55.14 H new ATOM 0 HH TYR A 458 7.578 -9.174 -5.156 1.00 14.45 H new ATOM 375 N GLU A 459 0.565 -8.268 -0.122 1.00 74.34 N ATOM 376 CA GLU A 459 -0.464 -7.890 0.845 1.00 22.45 C ATOM 377 C GLU A 459 -0.280 -6.442 1.301 1.00 3.35 C ATOM 378 O GLU A 459 0.804 -6.054 1.741 1.00 60.42 O ATOM 379 CB GLU A 459 -0.387 -8.789 2.087 1.00 43.15 C ATOM 380 CG GLU A 459 -0.652 -10.266 1.828 1.00 53.40 C ATOM 381 CD GLU A 459 -0.492 -11.100 3.089 1.00 41.35 C ATOM 382 OE1 GLU A 459 -1.117 -10.750 4.118 1.00 31.50 O ATOM 383 OE2 GLU A 459 0.259 -12.101 3.063 1.00 23.50 O ATOM 0 H GLU A 459 1.517 -8.197 0.238 1.00 74.34 H new ATOM 0 HA GLU A 459 -1.430 -8.003 0.353 1.00 22.45 H new ATOM 0 HB2 GLU A 459 0.603 -8.685 2.532 1.00 43.15 H new ATOM 0 HB3 GLU A 459 -1.106 -8.429 2.823 1.00 43.15 H new ATOM 0 HG2 GLU A 459 -1.661 -10.390 1.436 1.00 53.40 H new ATOM 0 HG3 GLU A 459 0.034 -10.629 1.063 1.00 53.40 H new ATOM 390 N VAL A 460 -1.337 -5.649 1.198 1.00 14.43 N ATOM 391 CA VAL A 460 -1.348 -4.306 1.766 1.00 3.24 C ATOM 392 C VAL A 460 -2.153 -4.300 3.073 1.00 11.41 C ATOM 393 O VAL A 460 -3.367 -4.505 3.068 1.00 24.33 O ATOM 394 CB VAL A 460 -1.956 -3.272 0.785 1.00 23.15 C ATOM 395 CG1 VAL A 460 -1.862 -1.854 1.352 1.00 13.10 C ATOM 396 CG2 VAL A 460 -1.277 -3.356 -0.583 1.00 11.44 C ATOM 0 H VAL A 460 -2.201 -5.912 0.725 1.00 14.43 H new ATOM 0 HA VAL A 460 -0.314 -4.022 1.961 1.00 3.24 H new ATOM 0 HB VAL A 460 -3.011 -3.512 0.657 1.00 23.15 H new ATOM 0 HG11 VAL A 460 -2.296 -1.149 0.643 1.00 13.10 H new ATOM 0 HG12 VAL A 460 -2.407 -1.802 2.295 1.00 13.10 H new ATOM 0 HG13 VAL A 460 -0.816 -1.599 1.523 1.00 13.10 H new ATOM 0 HG21 VAL A 460 -1.720 -2.621 -1.255 1.00 11.44 H new ATOM 0 HG22 VAL A 460 -0.212 -3.152 -0.474 1.00 11.44 H new ATOM 0 HG23 VAL A 460 -1.414 -4.355 -0.997 1.00 11.44 H new ATOM 406 N HIS A 461 -1.475 -4.082 4.190 1.00 13.52 N ATOM 407 CA HIS A 461 -2.136 -4.004 5.493 1.00 21.02 C ATOM 408 C HIS A 461 -2.324 -2.542 5.907 1.00 43.42 C ATOM 409 O HIS A 461 -1.353 -1.828 6.152 1.00 71.51 O ATOM 410 CB HIS A 461 -1.330 -4.770 6.553 1.00 33.45 C ATOM 411 CG HIS A 461 -1.396 -6.261 6.395 1.00 63.23 C ATOM 412 ND1 HIS A 461 -2.081 -7.078 7.267 1.00 63.33 N ATOM 413 CD2 HIS A 461 -0.859 -7.084 5.460 1.00 1.25 C ATOM 414 CE1 HIS A 461 -1.967 -8.333 6.880 1.00 40.30 C ATOM 415 NE2 HIS A 461 -1.233 -8.367 5.786 1.00 3.15 N ATOM 0 H HIS A 461 -0.464 -3.955 4.224 1.00 13.52 H new ATOM 0 HA HIS A 461 -3.119 -4.468 5.413 1.00 21.02 H new ATOM 0 HB2 HIS A 461 -0.288 -4.453 6.504 1.00 33.45 H new ATOM 0 HB3 HIS A 461 -1.699 -4.501 7.543 1.00 33.45 H new ATOM 0 HD1 HIS A 461 -2.598 -6.760 8.087 1.00 63.33 H new ATOM 0 HD2 HIS A 461 -0.252 -6.788 4.618 1.00 1.25 H new ATOM 0 HE1 HIS A 461 -2.402 -9.189 7.376 1.00 40.30 H new ATOM 0 HE2 HIS A 461 -0.983 -9.208 5.266 1.00 3.15 H new ATOM 424 N VAL A 462 -3.577 -2.099 5.960 1.00 2.32 N ATOM 425 CA VAL A 462 -3.895 -0.711 6.297 1.00 32.01 C ATOM 426 C VAL A 462 -4.623 -0.630 7.645 1.00 3.21 C ATOM 427 O VAL A 462 -5.650 -1.275 7.855 1.00 10.32 O ATOM 428 CB VAL A 462 -4.744 -0.043 5.182 1.00 34.24 C ATOM 429 CG1 VAL A 462 -3.999 -0.102 3.852 1.00 21.02 C ATOM 430 CG2 VAL A 462 -6.124 -0.694 5.051 1.00 62.13 C ATOM 0 H VAL A 462 -4.393 -2.682 5.773 1.00 2.32 H new ATOM 0 HA VAL A 462 -2.954 -0.166 6.379 1.00 32.01 H new ATOM 0 HB VAL A 462 -4.900 0.999 5.461 1.00 34.24 H new ATOM 0 HG11 VAL A 462 -4.602 0.369 3.076 1.00 21.02 H new ATOM 0 HG12 VAL A 462 -3.049 0.425 3.943 1.00 21.02 H new ATOM 0 HG13 VAL A 462 -3.812 -1.142 3.585 1.00 21.02 H new ATOM 0 HG21 VAL A 462 -6.687 -0.198 4.260 1.00 62.13 H new ATOM 0 HG22 VAL A 462 -6.007 -1.749 4.805 1.00 62.13 H new ATOM 0 HG23 VAL A 462 -6.662 -0.599 5.994 1.00 62.13 H new ATOM 440 N LYS A 463 -4.079 0.154 8.564 1.00 33.44 N ATOM 441 CA LYS A 463 -4.638 0.258 9.916 1.00 14.31 C ATOM 442 C LYS A 463 -4.693 1.709 10.413 1.00 74.42 C ATOM 443 O LYS A 463 -3.885 2.552 10.017 1.00 0.43 O ATOM 444 CB LYS A 463 -3.821 -0.596 10.896 1.00 70.45 C ATOM 445 CG LYS A 463 -2.314 -0.422 10.753 1.00 42.44 C ATOM 446 CD LYS A 463 -1.565 -0.675 12.064 1.00 33.43 C ATOM 447 CE LYS A 463 -1.565 -2.145 12.486 1.00 63.21 C ATOM 448 NZ LYS A 463 -2.919 -2.647 12.854 1.00 44.24 N ATOM 0 H LYS A 463 -3.252 0.729 8.405 1.00 33.44 H new ATOM 0 HA LYS A 463 -5.662 -0.113 9.869 1.00 14.31 H new ATOM 0 HB2 LYS A 463 -4.112 -0.342 11.915 1.00 70.45 H new ATOM 0 HB3 LYS A 463 -4.072 -1.646 10.746 1.00 70.45 H new ATOM 0 HG2 LYS A 463 -1.944 -1.106 9.990 1.00 42.44 H new ATOM 0 HG3 LYS A 463 -2.100 0.589 10.406 1.00 42.44 H new ATOM 0 HD2 LYS A 463 -0.535 -0.335 11.958 1.00 33.43 H new ATOM 0 HD3 LYS A 463 -2.018 -0.077 12.855 1.00 33.43 H new ATOM 0 HE2 LYS A 463 -1.168 -2.751 11.671 1.00 63.21 H new ATOM 0 HE3 LYS A 463 -0.893 -2.273 13.335 1.00 63.21 H new ATOM 0 HZ1 LYS A 463 -2.839 -3.309 13.652 1.00 44.24 H new ATOM 0 HZ2 LYS A 463 -3.524 -1.846 13.127 1.00 44.24 H new ATOM 0 HZ3 LYS A 463 -3.341 -3.137 12.039 1.00 44.24 H new ATOM 462 N ASN A 464 -5.656 1.981 11.292 1.00 41.30 N ATOM 463 CA ASN A 464 -5.819 3.305 11.900 1.00 12.54 C ATOM 464 C ASN A 464 -5.210 3.320 13.314 1.00 63.24 C ATOM 465 O ASN A 464 -5.526 2.468 14.139 1.00 4.14 O ATOM 466 CB ASN A 464 -7.317 3.641 11.960 1.00 40.21 C ATOM 467 CG ASN A 464 -7.615 5.076 12.368 1.00 22.13 C ATOM 468 OD1 ASN A 464 -6.850 5.717 13.085 1.00 10.40 O ATOM 469 ND2 ASN A 464 -8.743 5.585 11.921 1.00 44.30 N ATOM 0 H ASN A 464 -6.344 1.295 11.603 1.00 41.30 H new ATOM 0 HA ASN A 464 -5.300 4.052 11.299 1.00 12.54 H new ATOM 0 HB2 ASN A 464 -7.760 3.453 10.982 1.00 40.21 H new ATOM 0 HB3 ASN A 464 -7.802 2.966 12.665 1.00 40.21 H new ATOM 0 HD21 ASN A 464 -9.005 6.539 12.168 1.00 44.30 H new ATOM 0 HD22 ASN A 464 -9.355 5.025 11.328 1.00 44.30 H new ATOM 476 N LEU A 465 -4.350 4.292 13.599 1.00 32.23 N ATOM 477 CA LEU A 465 -3.694 4.381 14.912 1.00 50.32 C ATOM 478 C LEU A 465 -4.139 5.624 15.695 1.00 3.04 C ATOM 479 O LEU A 465 -3.793 5.786 16.865 1.00 20.41 O ATOM 480 CB LEU A 465 -2.169 4.387 14.735 1.00 42.13 C ATOM 481 CG LEU A 465 -1.586 3.152 14.027 1.00 4.24 C ATOM 482 CD1 LEU A 465 -0.077 3.288 13.862 1.00 4.34 C ATOM 483 CD2 LEU A 465 -1.933 1.878 14.796 1.00 72.21 C ATOM 0 H LEU A 465 -4.087 5.030 12.946 1.00 32.23 H new ATOM 0 HA LEU A 465 -3.993 3.507 15.490 1.00 50.32 H new ATOM 0 HB2 LEU A 465 -1.889 5.276 14.170 1.00 42.13 H new ATOM 0 HB3 LEU A 465 -1.706 4.475 15.718 1.00 42.13 H new ATOM 0 HG LEU A 465 -2.032 3.084 13.035 1.00 4.24 H new ATOM 0 HD11 LEU A 465 0.315 2.404 13.359 1.00 4.34 H new ATOM 0 HD12 LEU A 465 0.146 4.173 13.266 1.00 4.34 H new ATOM 0 HD13 LEU A 465 0.389 3.384 14.843 1.00 4.34 H new ATOM 0 HD21 LEU A 465 -1.512 1.015 14.280 1.00 72.21 H new ATOM 0 HD22 LEU A 465 -1.519 1.936 15.802 1.00 72.21 H new ATOM 0 HD23 LEU A 465 -3.016 1.772 14.855 1.00 72.21 H new ATOM 495 N GLY A 466 -4.921 6.490 15.054 1.00 11.30 N ATOM 496 CA GLY A 466 -5.353 7.731 15.695 1.00 74.20 C ATOM 497 C GLY A 466 -6.452 7.529 16.740 1.00 73.13 C ATOM 498 O GLY A 466 -6.676 8.391 17.592 1.00 40.32 O ATOM 0 H GLY A 466 -5.265 6.359 14.103 1.00 11.30 H new ATOM 0 HA2 GLY A 466 -4.493 8.203 16.170 1.00 74.20 H new ATOM 0 HA3 GLY A 466 -5.712 8.419 14.930 1.00 74.20 H new ATOM 502 N GLY A 467 -7.139 6.391 16.673 1.00 33.41 N ATOM 503 CA GLY A 467 -8.217 6.102 17.618 1.00 21.01 C ATOM 504 C GLY A 467 -9.538 6.788 17.261 1.00 61.42 C ATOM 505 O GLY A 467 -10.420 6.930 18.107 1.00 51.10 O ATOM 0 H GLY A 467 -6.972 5.660 15.982 1.00 33.41 H new ATOM 0 HA2 GLY A 467 -8.375 5.024 17.659 1.00 21.01 H new ATOM 0 HA3 GLY A 467 -7.910 6.417 18.615 1.00 21.01 H new ATOM 509 N ILE A 468 -9.671 7.200 16.002 1.00 52.35 N ATOM 510 CA ILE A 468 -10.889 7.858 15.510 1.00 64.44 C ATOM 511 C ILE A 468 -11.306 7.285 14.142 1.00 35.52 C ATOM 512 O ILE A 468 -10.461 7.033 13.284 1.00 74.20 O ATOM 513 CB ILE A 468 -10.681 9.394 15.395 1.00 34.40 C ATOM 514 CG1 ILE A 468 -11.930 10.079 14.808 1.00 4.13 C ATOM 515 CG2 ILE A 468 -9.439 9.712 14.561 1.00 13.02 C ATOM 516 CD1 ILE A 468 -11.816 11.589 14.717 1.00 53.20 C ATOM 0 H ILE A 468 -8.945 7.090 15.294 1.00 52.35 H new ATOM 0 HA ILE A 468 -11.684 7.665 16.230 1.00 64.44 H new ATOM 0 HB ILE A 468 -10.525 9.789 16.399 1.00 34.40 H new ATOM 0 HG12 ILE A 468 -12.118 9.678 13.812 1.00 4.13 H new ATOM 0 HG13 ILE A 468 -12.794 9.826 15.422 1.00 4.13 H new ATOM 0 HG21 ILE A 468 -9.313 10.793 14.494 1.00 13.02 H new ATOM 0 HG22 ILE A 468 -8.561 9.273 15.034 1.00 13.02 H new ATOM 0 HG23 ILE A 468 -9.557 9.297 13.560 1.00 13.02 H new ATOM 0 HD11 ILE A 468 -12.734 11.998 14.294 1.00 53.20 H new ATOM 0 HD12 ILE A 468 -11.659 12.003 15.713 1.00 53.20 H new ATOM 0 HD13 ILE A 468 -10.973 11.852 14.078 1.00 53.20 H new ATOM 528 N GLY A 469 -12.607 7.075 13.955 1.00 30.41 N ATOM 529 CA GLY A 469 -13.114 6.488 12.714 1.00 0.34 C ATOM 530 C GLY A 469 -12.928 7.383 11.487 1.00 0.14 C ATOM 531 O GLY A 469 -13.406 8.517 11.456 1.00 24.35 O ATOM 0 H GLY A 469 -13.327 7.301 14.642 1.00 30.41 H new ATOM 0 HA2 GLY A 469 -12.609 5.538 12.539 1.00 0.34 H new ATOM 0 HA3 GLY A 469 -14.175 6.268 12.834 1.00 0.34 H new ATOM 535 N VAL A 470 -12.240 6.865 10.469 1.00 44.15 N ATOM 536 CA VAL A 470 -11.970 7.626 9.244 1.00 32.11 C ATOM 537 C VAL A 470 -12.573 6.941 7.997 1.00 32.24 C ATOM 538 O VAL A 470 -12.159 5.845 7.618 1.00 21.14 O ATOM 539 CB VAL A 470 -10.443 7.807 9.034 1.00 41.22 C ATOM 540 CG1 VAL A 470 -10.152 8.659 7.798 1.00 31.32 C ATOM 541 CG2 VAL A 470 -9.797 8.414 10.276 1.00 50.53 C ATOM 0 H VAL A 470 -11.858 5.919 10.467 1.00 44.15 H new ATOM 0 HA VAL A 470 -12.442 8.601 9.368 1.00 32.11 H new ATOM 0 HB VAL A 470 -10.008 6.822 8.868 1.00 41.22 H new ATOM 0 HG11 VAL A 470 -9.074 8.768 7.677 1.00 31.32 H new ATOM 0 HG12 VAL A 470 -10.569 8.174 6.915 1.00 31.32 H new ATOM 0 HG13 VAL A 470 -10.605 9.643 7.919 1.00 31.32 H new ATOM 0 HG21 VAL A 470 -8.727 8.533 10.108 1.00 50.53 H new ATOM 0 HG22 VAL A 470 -10.243 9.388 10.479 1.00 50.53 H new ATOM 0 HG23 VAL A 470 -9.960 7.756 11.129 1.00 50.53 H new ATOM 551 N PRO A 471 -13.577 7.576 7.356 1.00 63.24 N ATOM 552 CA PRO A 471 -14.135 7.105 6.071 1.00 64.24 C ATOM 553 C PRO A 471 -13.302 7.574 4.862 1.00 64.04 C ATOM 554 O PRO A 471 -13.479 7.107 3.737 1.00 65.40 O ATOM 555 CB PRO A 471 -15.519 7.759 6.056 1.00 70.31 C ATOM 556 CG PRO A 471 -15.334 9.043 6.794 1.00 54.21 C ATOM 557 CD PRO A 471 -14.284 8.781 7.849 1.00 74.51 C ATOM 0 HA PRO A 471 -14.149 6.018 5.993 1.00 64.24 H new ATOM 0 HB2 PRO A 471 -15.865 7.933 5.037 1.00 70.31 H new ATOM 0 HB3 PRO A 471 -16.262 7.126 6.541 1.00 70.31 H new ATOM 0 HG2 PRO A 471 -15.016 9.837 6.118 1.00 54.21 H new ATOM 0 HG3 PRO A 471 -16.270 9.368 7.249 1.00 54.21 H new ATOM 0 HD2 PRO A 471 -13.605 9.627 7.956 1.00 74.51 H new ATOM 0 HD3 PRO A 471 -14.734 8.608 8.827 1.00 74.51 H new ATOM 565 N SER A 472 -12.382 8.491 5.129 1.00 60.11 N ATOM 566 CA SER A 472 -11.572 9.163 4.101 1.00 73.40 C ATOM 567 C SER A 472 -10.371 8.320 3.634 1.00 0.55 C ATOM 568 O SER A 472 -9.493 8.817 2.929 1.00 13.51 O ATOM 569 CB SER A 472 -11.081 10.515 4.633 1.00 31.15 C ATOM 570 OG SER A 472 -12.170 11.346 5.016 1.00 63.22 O ATOM 0 H SER A 472 -12.168 8.799 6.078 1.00 60.11 H new ATOM 0 HA SER A 472 -12.215 9.306 3.233 1.00 73.40 H new ATOM 0 HB2 SER A 472 -10.425 10.355 5.488 1.00 31.15 H new ATOM 0 HB3 SER A 472 -10.490 11.017 3.867 1.00 31.15 H new ATOM 0 HG SER A 472 -11.827 12.200 5.352 1.00 63.22 H new ATOM 576 N THR A 473 -10.338 7.043 3.998 1.00 61.10 N ATOM 577 CA THR A 473 -9.127 6.226 3.839 1.00 24.03 C ATOM 578 C THR A 473 -9.061 5.541 2.465 1.00 30.13 C ATOM 579 O THR A 473 -9.701 4.519 2.219 1.00 53.15 O ATOM 580 CB THR A 473 -9.057 5.138 4.942 1.00 25.14 C ATOM 581 OG1 THR A 473 -9.053 5.745 6.243 1.00 31.34 O ATOM 582 CG2 THR A 473 -7.821 4.255 4.792 1.00 53.14 C ATOM 0 H THR A 473 -11.131 6.546 4.405 1.00 61.10 H new ATOM 0 HA THR A 473 -8.280 6.907 3.925 1.00 24.03 H new ATOM 0 HB THR A 473 -9.941 4.510 4.831 1.00 25.14 H new ATOM 0 HG1 THR A 473 -9.010 5.047 6.930 1.00 31.34 H new ATOM 0 HG21 THR A 473 -7.810 3.506 5.584 1.00 53.14 H new ATOM 0 HG22 THR A 473 -7.845 3.757 3.823 1.00 53.14 H new ATOM 0 HG23 THR A 473 -6.924 4.870 4.862 1.00 53.14 H new ATOM 590 N LYS A 474 -8.285 6.136 1.560 1.00 3.14 N ATOM 591 CA LYS A 474 -8.047 5.563 0.228 1.00 30.34 C ATOM 592 C LYS A 474 -6.641 4.955 0.137 1.00 3.33 C ATOM 593 O LYS A 474 -5.655 5.599 0.492 1.00 64.12 O ATOM 594 CB LYS A 474 -8.194 6.641 -0.851 1.00 4.51 C ATOM 595 CG LYS A 474 -9.539 7.359 -0.846 1.00 21.51 C ATOM 596 CD LYS A 474 -9.614 8.398 -1.963 1.00 32.50 C ATOM 597 CE LYS A 474 -10.915 9.188 -1.933 1.00 51.02 C ATOM 598 NZ LYS A 474 -10.994 10.139 -3.071 1.00 22.43 N ATOM 0 H LYS A 474 -7.805 7.021 1.723 1.00 3.14 H new ATOM 0 HA LYS A 474 -8.787 4.779 0.067 1.00 30.34 H new ATOM 0 HB2 LYS A 474 -7.402 7.378 -0.721 1.00 4.51 H new ATOM 0 HB3 LYS A 474 -8.045 6.182 -1.828 1.00 4.51 H new ATOM 0 HG2 LYS A 474 -10.343 6.633 -0.967 1.00 21.51 H new ATOM 0 HG3 LYS A 474 -9.691 7.845 0.118 1.00 21.51 H new ATOM 0 HD2 LYS A 474 -8.773 9.085 -1.874 1.00 32.50 H new ATOM 0 HD3 LYS A 474 -9.517 7.899 -2.927 1.00 32.50 H new ATOM 0 HE2 LYS A 474 -11.761 8.502 -1.970 1.00 51.02 H new ATOM 0 HE3 LYS A 474 -10.989 9.735 -0.993 1.00 51.02 H new ATOM 0 HZ1 LYS A 474 -11.822 10.756 -2.951 1.00 22.43 H new ATOM 0 HZ2 LYS A 474 -10.131 10.719 -3.099 1.00 22.43 H new ATOM 0 HZ3 LYS A 474 -11.084 9.609 -3.961 1.00 22.43 H new ATOM 612 N VAL A 475 -6.554 3.720 -0.349 1.00 34.45 N ATOM 613 CA VAL A 475 -5.270 3.024 -0.507 1.00 22.40 C ATOM 614 C VAL A 475 -4.849 2.972 -1.984 1.00 24.15 C ATOM 615 O VAL A 475 -5.548 2.397 -2.815 1.00 62.13 O ATOM 616 CB VAL A 475 -5.359 1.580 0.045 1.00 25.34 C ATOM 617 CG1 VAL A 475 -3.987 0.904 0.034 1.00 42.35 C ATOM 618 CG2 VAL A 475 -5.967 1.576 1.449 1.00 71.02 C ATOM 0 H VAL A 475 -7.362 3.172 -0.644 1.00 34.45 H new ATOM 0 HA VAL A 475 -4.524 3.583 0.057 1.00 22.40 H new ATOM 0 HB VAL A 475 -6.016 1.005 -0.608 1.00 25.34 H new ATOM 0 HG11 VAL A 475 -4.077 -0.109 0.427 1.00 42.35 H new ATOM 0 HG12 VAL A 475 -3.609 0.865 -0.988 1.00 42.35 H new ATOM 0 HG13 VAL A 475 -3.296 1.474 0.655 1.00 42.35 H new ATOM 0 HG21 VAL A 475 -6.021 0.552 1.819 1.00 71.02 H new ATOM 0 HG22 VAL A 475 -5.344 2.171 2.117 1.00 71.02 H new ATOM 0 HG23 VAL A 475 -6.970 2.002 1.413 1.00 71.02 H new ATOM 628 N ARG A 476 -3.708 3.571 -2.313 1.00 23.13 N ATOM 629 CA ARG A 476 -3.212 3.596 -3.697 1.00 44.23 C ATOM 630 C ARG A 476 -1.874 2.842 -3.821 1.00 33.04 C ATOM 631 O ARG A 476 -1.001 2.967 -2.965 1.00 22.32 O ATOM 632 CB ARG A 476 -3.050 5.054 -4.167 1.00 41.11 C ATOM 633 CG ARG A 476 -4.335 5.883 -4.065 1.00 44.12 C ATOM 634 CD ARG A 476 -4.148 7.308 -4.587 1.00 12.31 C ATOM 635 NE ARG A 476 -5.350 8.133 -4.407 1.00 24.22 N ATOM 636 CZ ARG A 476 -5.611 9.219 -5.094 1.00 54.35 C ATOM 637 NH1 ARG A 476 -4.800 9.626 -6.018 1.00 74.32 N ATOM 638 NH2 ARG A 476 -6.688 9.902 -4.858 1.00 13.35 N ATOM 0 H ARG A 476 -3.104 4.048 -1.643 1.00 23.13 H new ATOM 0 HA ARG A 476 -3.940 3.092 -4.333 1.00 44.23 H new ATOM 0 HB2 ARG A 476 -2.272 5.533 -3.573 1.00 41.11 H new ATOM 0 HB3 ARG A 476 -2.708 5.056 -5.202 1.00 41.11 H new ATOM 0 HG2 ARG A 476 -5.127 5.392 -4.630 1.00 44.12 H new ATOM 0 HG3 ARG A 476 -4.660 5.919 -3.025 1.00 44.12 H new ATOM 0 HD2 ARG A 476 -3.310 7.774 -4.069 1.00 12.31 H new ATOM 0 HD3 ARG A 476 -3.890 7.273 -5.645 1.00 12.31 H new ATOM 0 HE ARG A 476 -6.026 7.842 -3.701 1.00 24.22 H new ATOM 0 HH11 ARG A 476 -3.949 9.100 -6.217 1.00 74.32 H new ATOM 0 HH12 ARG A 476 -5.012 10.472 -6.547 1.00 74.32 H new ATOM 0 HH21 ARG A 476 -7.338 9.595 -4.134 1.00 13.35 H new ATOM 0 HH22 ARG A 476 -6.885 10.746 -5.396 1.00 13.35 H new ATOM 652 N VAL A 477 -1.718 2.056 -4.891 1.00 10.22 N ATOM 653 CA VAL A 477 -0.491 1.275 -5.113 1.00 71.05 C ATOM 654 C VAL A 477 0.183 1.652 -6.442 1.00 32.35 C ATOM 655 O VAL A 477 -0.463 1.692 -7.493 1.00 5.43 O ATOM 656 CB VAL A 477 -0.786 -0.251 -5.112 1.00 2.01 C ATOM 657 CG1 VAL A 477 0.478 -1.056 -5.413 1.00 11.32 C ATOM 658 CG2 VAL A 477 -1.395 -0.685 -3.779 1.00 51.14 C ATOM 0 H VAL A 477 -2.424 1.942 -5.618 1.00 10.22 H new ATOM 0 HA VAL A 477 0.184 1.512 -4.291 1.00 71.05 H new ATOM 0 HB VAL A 477 -1.510 -0.451 -5.902 1.00 2.01 H new ATOM 0 HG11 VAL A 477 0.242 -2.120 -5.406 1.00 11.32 H new ATOM 0 HG12 VAL A 477 0.863 -0.776 -6.394 1.00 11.32 H new ATOM 0 HG13 VAL A 477 1.232 -0.847 -4.654 1.00 11.32 H new ATOM 0 HG21 VAL A 477 -1.593 -1.757 -3.801 1.00 51.14 H new ATOM 0 HG22 VAL A 477 -0.699 -0.461 -2.971 1.00 51.14 H new ATOM 0 HG23 VAL A 477 -2.328 -0.147 -3.613 1.00 51.14 H new ATOM 668 N TYR A 478 1.488 1.919 -6.385 1.00 73.32 N ATOM 669 CA TYR A 478 2.262 2.326 -7.564 1.00 12.34 C ATOM 670 C TYR A 478 3.425 1.358 -7.828 1.00 65.12 C ATOM 671 O TYR A 478 4.089 0.908 -6.897 1.00 44.21 O ATOM 672 CB TYR A 478 2.830 3.740 -7.363 1.00 22.22 C ATOM 673 CG TYR A 478 1.810 4.757 -6.889 1.00 65.34 C ATOM 674 CD1 TYR A 478 0.980 5.415 -7.789 1.00 72.14 C ATOM 675 CD2 TYR A 478 1.687 5.066 -5.537 1.00 64.20 C ATOM 676 CE1 TYR A 478 0.057 6.348 -7.358 1.00 12.21 C ATOM 677 CE2 TYR A 478 0.766 5.996 -5.098 1.00 13.31 C ATOM 678 CZ TYR A 478 -0.044 6.635 -6.011 1.00 41.33 C ATOM 679 OH TYR A 478 -0.959 7.566 -5.572 1.00 75.43 O ATOM 0 H TYR A 478 2.038 1.861 -5.528 1.00 73.32 H new ATOM 0 HA TYR A 478 1.588 2.312 -8.421 1.00 12.34 H new ATOM 0 HB2 TYR A 478 3.644 3.693 -6.639 1.00 22.22 H new ATOM 0 HB3 TYR A 478 3.260 4.084 -8.304 1.00 22.22 H new ATOM 0 HD1 TYR A 478 1.058 5.193 -8.843 1.00 72.14 H new ATOM 0 HD2 TYR A 478 2.323 4.570 -4.819 1.00 64.20 H new ATOM 0 HE1 TYR A 478 -0.582 6.850 -8.070 1.00 12.21 H new ATOM 0 HE2 TYR A 478 0.681 6.221 -4.045 1.00 13.31 H new ATOM 0 HH TYR A 478 -0.524 8.182 -4.946 1.00 75.43 H new ATOM 689 N ILE A 479 3.661 1.040 -9.097 1.00 4.13 N ATOM 690 CA ILE A 479 4.832 0.251 -9.500 1.00 31.04 C ATOM 691 C ILE A 479 5.718 1.068 -10.451 1.00 41.51 C ATOM 692 O ILE A 479 5.291 1.429 -11.552 1.00 44.54 O ATOM 693 CB ILE A 479 4.428 -1.085 -10.179 1.00 75.20 C ATOM 694 CG1 ILE A 479 3.586 -1.940 -9.216 1.00 42.45 C ATOM 695 CG2 ILE A 479 5.670 -1.852 -10.639 1.00 61.23 C ATOM 696 CD1 ILE A 479 3.179 -3.285 -9.781 1.00 65.21 C ATOM 0 H ILE A 479 3.057 1.316 -9.871 1.00 4.13 H new ATOM 0 HA ILE A 479 5.388 0.009 -8.594 1.00 31.04 H new ATOM 0 HB ILE A 479 3.824 -0.859 -11.058 1.00 75.20 H new ATOM 0 HG12 ILE A 479 4.152 -2.099 -8.298 1.00 42.45 H new ATOM 0 HG13 ILE A 479 2.688 -1.385 -8.944 1.00 42.45 H new ATOM 0 HG21 ILE A 479 5.366 -2.786 -11.112 1.00 61.23 H new ATOM 0 HG22 ILE A 479 6.227 -1.247 -11.354 1.00 61.23 H new ATOM 0 HG23 ILE A 479 6.302 -2.070 -9.778 1.00 61.23 H new ATOM 0 HD11 ILE A 479 2.589 -3.827 -9.042 1.00 65.21 H new ATOM 0 HD12 ILE A 479 2.584 -3.136 -10.682 1.00 65.21 H new ATOM 0 HD13 ILE A 479 4.071 -3.862 -10.026 1.00 65.21 H new ATOM 708 N ASN A 480 6.943 1.367 -10.012 1.00 60.13 N ATOM 709 CA ASN A 480 7.862 2.238 -10.761 1.00 64.20 C ATOM 710 C ASN A 480 7.199 3.581 -11.126 1.00 21.40 C ATOM 711 O ASN A 480 7.406 4.119 -12.218 1.00 11.11 O ATOM 712 CB ASN A 480 8.386 1.525 -12.022 1.00 33.34 C ATOM 713 CG ASN A 480 9.247 0.319 -11.686 1.00 54.44 C ATOM 714 OD1 ASN A 480 9.816 0.231 -10.605 1.00 41.12 O ATOM 715 ND2 ASN A 480 9.374 -0.609 -12.613 1.00 74.22 N ATOM 0 H ASN A 480 7.327 1.017 -9.134 1.00 60.13 H new ATOM 0 HA ASN A 480 8.710 2.456 -10.112 1.00 64.20 H new ATOM 0 HB2 ASN A 480 7.542 1.207 -12.634 1.00 33.34 H new ATOM 0 HB3 ASN A 480 8.966 2.228 -12.620 1.00 33.34 H new ATOM 0 HD21 ASN A 480 9.958 -1.427 -12.439 1.00 74.22 H new ATOM 0 HD22 ASN A 480 8.888 -0.509 -13.504 1.00 74.22 H new ATOM 722 N GLY A 481 6.406 4.119 -10.198 1.00 22.22 N ATOM 723 CA GLY A 481 5.744 5.403 -10.419 1.00 2.54 C ATOM 724 C GLY A 481 4.376 5.285 -11.092 1.00 55.32 C ATOM 725 O GLY A 481 3.576 6.220 -11.047 1.00 13.14 O ATOM 0 H GLY A 481 6.208 3.689 -9.294 1.00 22.22 H new ATOM 0 HA2 GLY A 481 5.625 5.909 -9.461 1.00 2.54 H new ATOM 0 HA3 GLY A 481 6.388 6.032 -11.034 1.00 2.54 H new ATOM 729 N THR A 482 4.100 4.138 -11.713 1.00 54.45 N ATOM 730 CA THR A 482 2.839 3.929 -12.448 1.00 5.03 C ATOM 731 C THR A 482 1.734 3.375 -11.532 1.00 74.11 C ATOM 732 O THR A 482 1.954 2.405 -10.809 1.00 73.41 O ATOM 733 CB THR A 482 3.043 2.951 -13.635 1.00 71.15 C ATOM 734 OG1 THR A 482 4.071 3.441 -14.514 1.00 21.10 O ATOM 735 CG2 THR A 482 1.753 2.760 -14.431 1.00 4.42 C ATOM 0 H THR A 482 4.729 3.335 -11.725 1.00 54.45 H new ATOM 0 HA THR A 482 2.531 4.904 -12.826 1.00 5.03 H new ATOM 0 HB THR A 482 3.340 1.989 -13.218 1.00 71.15 H new ATOM 0 HG1 THR A 482 4.191 2.814 -15.258 1.00 21.10 H new ATOM 0 HG21 THR A 482 1.933 2.069 -15.255 1.00 4.42 H new ATOM 0 HG22 THR A 482 0.980 2.354 -13.779 1.00 4.42 H new ATOM 0 HG23 THR A 482 1.425 3.721 -14.828 1.00 4.42 H new ATOM 743 N LEU A 483 0.545 3.985 -11.567 1.00 23.42 N ATOM 744 CA LEU A 483 -0.580 3.522 -10.739 1.00 43.12 C ATOM 745 C LEU A 483 -1.025 2.107 -11.145 1.00 12.52 C ATOM 746 O LEU A 483 -1.512 1.890 -12.257 1.00 23.44 O ATOM 747 CB LEU A 483 -1.770 4.490 -10.842 1.00 55.44 C ATOM 748 CG LEU A 483 -3.016 4.094 -10.024 1.00 40.20 C ATOM 749 CD1 LEU A 483 -2.709 4.093 -8.526 1.00 23.12 C ATOM 750 CD2 LEU A 483 -4.189 5.020 -10.347 1.00 72.55 C ATOM 0 H LEU A 483 0.335 4.793 -12.153 1.00 23.42 H new ATOM 0 HA LEU A 483 -0.234 3.494 -9.706 1.00 43.12 H new ATOM 0 HB2 LEU A 483 -1.442 5.478 -10.518 1.00 55.44 H new ATOM 0 HB3 LEU A 483 -2.057 4.577 -11.890 1.00 55.44 H new ATOM 0 HG LEU A 483 -3.300 3.080 -10.304 1.00 40.20 H new ATOM 0 HD11 LEU A 483 -3.604 3.811 -7.971 1.00 23.12 H new ATOM 0 HD12 LEU A 483 -1.913 3.378 -8.318 1.00 23.12 H new ATOM 0 HD13 LEU A 483 -2.391 5.089 -8.219 1.00 23.12 H new ATOM 0 HD21 LEU A 483 -5.058 4.724 -9.760 1.00 72.55 H new ATOM 0 HD22 LEU A 483 -3.919 6.048 -10.103 1.00 72.55 H new ATOM 0 HD23 LEU A 483 -4.427 4.949 -11.408 1.00 72.55 H new ATOM 762 N TYR A 484 -0.856 1.156 -10.234 1.00 72.40 N ATOM 763 CA TYR A 484 -1.204 -0.245 -10.494 1.00 12.22 C ATOM 764 C TYR A 484 -2.660 -0.563 -10.106 1.00 22.32 C ATOM 765 O TYR A 484 -3.377 -1.234 -10.850 1.00 62.04 O ATOM 766 CB TYR A 484 -0.242 -1.158 -9.718 1.00 33.24 C ATOM 767 CG TYR A 484 -0.623 -2.628 -9.751 1.00 74.21 C ATOM 768 CD1 TYR A 484 -0.276 -3.437 -10.828 1.00 30.41 C ATOM 769 CD2 TYR A 484 -1.340 -3.202 -8.705 1.00 53.03 C ATOM 770 CE1 TYR A 484 -0.628 -4.772 -10.858 1.00 21.23 C ATOM 771 CE2 TYR A 484 -1.697 -4.535 -8.732 1.00 2.25 C ATOM 772 CZ TYR A 484 -1.339 -5.315 -9.810 1.00 22.45 C ATOM 773 OH TYR A 484 -1.696 -6.645 -9.842 1.00 35.24 O ATOM 0 H TYR A 484 -0.478 1.326 -9.302 1.00 72.40 H new ATOM 0 HA TYR A 484 -1.110 -0.422 -11.565 1.00 12.22 H new ATOM 0 HB2 TYR A 484 0.761 -1.044 -10.129 1.00 33.24 H new ATOM 0 HB3 TYR A 484 -0.201 -0.827 -8.680 1.00 33.24 H new ATOM 0 HD1 TYR A 484 0.277 -3.014 -11.654 1.00 30.41 H new ATOM 0 HD2 TYR A 484 -1.622 -2.594 -7.858 1.00 53.03 H new ATOM 0 HE1 TYR A 484 -0.347 -5.388 -11.699 1.00 21.23 H new ATOM 0 HE2 TYR A 484 -2.254 -4.964 -7.912 1.00 2.25 H new ATOM 0 HH TYR A 484 -1.123 -7.122 -10.478 1.00 35.24 H new ATOM 783 N LYS A 485 -3.086 -0.074 -8.941 1.00 22.24 N ATOM 784 CA LYS A 485 -4.434 -0.345 -8.421 1.00 24.20 C ATOM 785 C LYS A 485 -4.741 0.568 -7.220 1.00 11.20 C ATOM 786 O LYS A 485 -3.826 1.113 -6.600 1.00 30.33 O ATOM 787 CB LYS A 485 -4.559 -1.828 -8.017 1.00 21.40 C ATOM 788 CG LYS A 485 -5.971 -2.258 -7.622 1.00 74.33 C ATOM 789 CD LYS A 485 -6.056 -3.762 -7.373 1.00 42.25 C ATOM 790 CE LYS A 485 -7.458 -4.200 -6.954 1.00 42.54 C ATOM 791 NZ LYS A 485 -8.484 -3.896 -7.989 1.00 62.02 N ATOM 0 H LYS A 485 -2.516 0.515 -8.334 1.00 22.24 H new ATOM 0 HA LYS A 485 -5.160 -0.135 -9.206 1.00 24.20 H new ATOM 0 HB2 LYS A 485 -4.223 -2.448 -8.848 1.00 21.40 H new ATOM 0 HB3 LYS A 485 -3.886 -2.022 -7.182 1.00 21.40 H new ATOM 0 HG2 LYS A 485 -6.276 -1.723 -6.723 1.00 74.33 H new ATOM 0 HG3 LYS A 485 -6.670 -1.980 -8.411 1.00 74.33 H new ATOM 0 HD2 LYS A 485 -5.766 -4.295 -8.278 1.00 42.25 H new ATOM 0 HD3 LYS A 485 -5.343 -4.041 -6.597 1.00 42.25 H new ATOM 0 HE2 LYS A 485 -7.456 -5.271 -6.753 1.00 42.54 H new ATOM 0 HE3 LYS A 485 -7.728 -3.702 -6.023 1.00 42.54 H new ATOM 0 HZ1 LYS A 485 -9.389 -4.331 -7.719 1.00 62.02 H new ATOM 0 HZ2 LYS A 485 -8.604 -2.866 -8.066 1.00 62.02 H new ATOM 0 HZ3 LYS A 485 -8.176 -4.278 -8.906 1.00 62.02 H new ATOM 805 N ASN A 486 -6.025 0.743 -6.898 1.00 62.34 N ATOM 806 CA ASN A 486 -6.427 1.608 -5.779 1.00 63.12 C ATOM 807 C ASN A 486 -7.748 1.146 -5.136 1.00 24.33 C ATOM 808 O ASN A 486 -8.611 0.575 -5.800 1.00 2.53 O ATOM 809 CB ASN A 486 -6.553 3.061 -6.259 1.00 14.20 C ATOM 810 CG ASN A 486 -7.587 3.222 -7.357 1.00 64.00 C ATOM 811 OD1 ASN A 486 -8.756 3.474 -7.094 1.00 22.55 O ATOM 812 ND2 ASN A 486 -7.167 3.071 -8.597 1.00 2.30 N ATOM 0 H ASN A 486 -6.802 0.302 -7.391 1.00 62.34 H new ATOM 0 HA ASN A 486 -5.652 1.540 -5.016 1.00 63.12 H new ATOM 0 HB2 ASN A 486 -6.821 3.697 -5.415 1.00 14.20 H new ATOM 0 HB3 ASN A 486 -5.585 3.405 -6.623 1.00 14.20 H new ATOM 0 HD21 ASN A 486 -7.823 3.164 -9.373 1.00 2.30 H new ATOM 0 HD22 ASN A 486 -6.186 2.861 -8.781 1.00 2.30 H new ATOM 819 N TRP A 487 -7.892 1.402 -3.838 1.00 32.34 N ATOM 820 CA TRP A 487 -9.105 1.051 -3.086 1.00 13.04 C ATOM 821 C TRP A 487 -9.618 2.260 -2.286 1.00 5.01 C ATOM 822 O TRP A 487 -8.830 3.058 -1.778 1.00 24.42 O ATOM 823 CB TRP A 487 -8.824 -0.088 -2.092 1.00 21.43 C ATOM 824 CG TRP A 487 -8.344 -1.372 -2.704 1.00 72.03 C ATOM 825 CD1 TRP A 487 -9.117 -2.405 -3.151 1.00 51.04 C ATOM 826 CD2 TRP A 487 -6.983 -1.775 -2.904 1.00 45.30 C ATOM 827 NE1 TRP A 487 -8.321 -3.422 -3.615 1.00 54.40 N ATOM 828 CE2 TRP A 487 -7.008 -3.059 -3.478 1.00 52.54 C ATOM 829 CE3 TRP A 487 -5.747 -1.171 -2.660 1.00 1.55 C ATOM 830 CZ2 TRP A 487 -5.846 -3.752 -3.805 1.00 43.11 C ATOM 831 CZ3 TRP A 487 -4.595 -1.861 -2.983 1.00 45.54 C ATOM 832 CH2 TRP A 487 -4.651 -3.139 -3.551 1.00 40.21 C ATOM 0 H TRP A 487 -7.175 1.858 -3.274 1.00 32.34 H new ATOM 0 HA TRP A 487 -9.853 0.736 -3.813 1.00 13.04 H new ATOM 0 HB2 TRP A 487 -8.078 0.254 -1.375 1.00 21.43 H new ATOM 0 HB3 TRP A 487 -9.736 -0.291 -1.531 1.00 21.43 H new ATOM 0 HD1 TRP A 487 -10.197 -2.420 -3.141 1.00 51.04 H new ATOM 0 HE1 TRP A 487 -8.654 -4.306 -4.000 1.00 54.40 H new ATOM 0 HE3 TRP A 487 -5.693 -0.183 -2.227 1.00 1.55 H new ATOM 0 HZ2 TRP A 487 -5.887 -4.738 -4.243 1.00 43.11 H new ATOM 0 HZ3 TRP A 487 -3.634 -1.406 -2.794 1.00 45.54 H new ATOM 0 HH2 TRP A 487 -3.732 -3.651 -3.793 1.00 40.21 H new ATOM 843 N THR A 488 -10.935 2.398 -2.178 1.00 34.20 N ATOM 844 CA THR A 488 -11.530 3.373 -1.252 1.00 73.01 C ATOM 845 C THR A 488 -12.232 2.639 -0.103 1.00 42.23 C ATOM 846 O THR A 488 -13.200 1.911 -0.326 1.00 44.42 O ATOM 847 CB THR A 488 -12.555 4.293 -1.961 1.00 43.01 C ATOM 848 OG1 THR A 488 -11.958 4.924 -3.107 1.00 31.32 O ATOM 849 CG2 THR A 488 -13.073 5.368 -1.008 1.00 11.00 C ATOM 0 H THR A 488 -11.612 1.854 -2.713 1.00 34.20 H new ATOM 0 HA THR A 488 -10.720 3.994 -0.869 1.00 73.01 H new ATOM 0 HB THR A 488 -13.390 3.671 -2.284 1.00 43.01 H new ATOM 0 HG1 THR A 488 -12.619 5.500 -3.545 1.00 31.32 H new ATOM 0 HG21 THR A 488 -13.791 6.001 -1.529 1.00 11.00 H new ATOM 0 HG22 THR A 488 -13.559 4.894 -0.155 1.00 11.00 H new ATOM 0 HG23 THR A 488 -12.239 5.977 -0.659 1.00 11.00 H new ATOM 857 N VAL A 489 -11.765 2.851 1.129 1.00 40.22 N ATOM 858 CA VAL A 489 -12.262 2.099 2.292 1.00 65.20 C ATOM 859 C VAL A 489 -12.386 2.986 3.542 1.00 24.12 C ATOM 860 O VAL A 489 -12.022 4.161 3.530 1.00 62.44 O ATOM 861 CB VAL A 489 -11.344 0.886 2.626 1.00 30.44 C ATOM 862 CG1 VAL A 489 -11.340 -0.136 1.487 1.00 72.43 C ATOM 863 CG2 VAL A 489 -9.921 1.351 2.943 1.00 72.02 C ATOM 0 H VAL A 489 -11.043 3.537 1.351 1.00 40.22 H new ATOM 0 HA VAL A 489 -13.252 1.737 2.015 1.00 65.20 H new ATOM 0 HB VAL A 489 -11.749 0.397 3.512 1.00 30.44 H new ATOM 0 HG11 VAL A 489 -10.690 -0.971 1.750 1.00 72.43 H new ATOM 0 HG12 VAL A 489 -12.353 -0.502 1.323 1.00 72.43 H new ATOM 0 HG13 VAL A 489 -10.973 0.336 0.576 1.00 72.43 H new ATOM 0 HG21 VAL A 489 -9.298 0.486 3.173 1.00 72.02 H new ATOM 0 HG22 VAL A 489 -9.509 1.876 2.081 1.00 72.02 H new ATOM 0 HG23 VAL A 489 -9.940 2.023 3.801 1.00 72.02 H new ATOM 873 N SER A 490 -12.938 2.416 4.608 1.00 42.21 N ATOM 874 CA SER A 490 -13.056 3.111 5.896 1.00 54.20 C ATOM 875 C SER A 490 -12.360 2.322 7.014 1.00 22.12 C ATOM 876 O SER A 490 -12.505 1.100 7.109 1.00 53.42 O ATOM 877 CB SER A 490 -14.534 3.321 6.258 1.00 11.31 C ATOM 878 OG SER A 490 -15.219 2.081 6.380 1.00 71.11 O ATOM 0 H SER A 490 -13.315 1.468 4.610 1.00 42.21 H new ATOM 0 HA SER A 490 -12.568 4.080 5.797 1.00 54.20 H new ATOM 0 HB2 SER A 490 -14.606 3.872 7.196 1.00 11.31 H new ATOM 0 HB3 SER A 490 -15.015 3.930 5.493 1.00 11.31 H new ATOM 0 HG SER A 490 -16.156 2.247 6.613 1.00 71.11 H new ATOM 884 N LEU A 491 -11.591 3.019 7.848 1.00 45.52 N ATOM 885 CA LEU A 491 -10.943 2.396 9.011 1.00 74.21 C ATOM 886 C LEU A 491 -11.398 3.059 10.317 1.00 13.12 C ATOM 887 O LEU A 491 -11.174 4.254 10.527 1.00 34.35 O ATOM 888 CB LEU A 491 -9.414 2.498 8.890 1.00 70.35 C ATOM 889 CG LEU A 491 -8.783 1.708 7.730 1.00 72.43 C ATOM 890 CD1 LEU A 491 -7.277 1.957 7.669 1.00 13.41 C ATOM 891 CD2 LEU A 491 -9.079 0.216 7.871 1.00 4.23 C ATOM 0 H LEU A 491 -11.399 4.015 7.744 1.00 45.52 H new ATOM 0 HA LEU A 491 -11.236 1.346 9.032 1.00 74.21 H new ATOM 0 HB2 LEU A 491 -9.146 3.549 8.778 1.00 70.35 H new ATOM 0 HB3 LEU A 491 -8.970 2.153 9.824 1.00 70.35 H new ATOM 0 HG LEU A 491 -9.225 2.056 6.796 1.00 72.43 H new ATOM 0 HD11 LEU A 491 -6.848 1.390 6.843 1.00 13.41 H new ATOM 0 HD12 LEU A 491 -7.090 3.020 7.516 1.00 13.41 H new ATOM 0 HD13 LEU A 491 -6.817 1.639 8.605 1.00 13.41 H new ATOM 0 HD21 LEU A 491 -8.624 -0.325 7.041 1.00 4.23 H new ATOM 0 HD22 LEU A 491 -8.667 -0.149 8.812 1.00 4.23 H new ATOM 0 HD23 LEU A 491 -10.157 0.056 7.861 1.00 4.23 H new ATOM 903 N GLY A 492 -12.012 2.275 11.200 1.00 2.41 N ATOM 904 CA GLY A 492 -12.470 2.799 12.482 1.00 61.31 C ATOM 905 C GLY A 492 -11.351 2.926 13.515 1.00 70.50 C ATOM 906 O GLY A 492 -10.172 2.744 13.192 1.00 35.05 O ATOM 0 H GLY A 492 -12.202 1.284 11.053 1.00 2.41 H new ATOM 0 HA2 GLY A 492 -12.924 3.777 12.326 1.00 61.31 H new ATOM 0 HA3 GLY A 492 -13.248 2.146 12.877 1.00 61.31 H new ATOM 910 N PRO A 493 -11.691 3.233 14.781 1.00 61.25 N ATOM 911 CA PRO A 493 -10.696 3.392 15.855 1.00 31.43 C ATOM 912 C PRO A 493 -9.848 2.124 16.066 1.00 42.24 C ATOM 913 O PRO A 493 -10.315 1.137 16.639 1.00 2.35 O ATOM 914 CB PRO A 493 -11.548 3.709 17.098 1.00 65.23 C ATOM 915 CG PRO A 493 -12.929 3.252 16.753 1.00 11.40 C ATOM 916 CD PRO A 493 -13.065 3.444 15.267 1.00 3.50 C ATOM 0 HA PRO A 493 -9.968 4.170 15.624 1.00 31.43 H new ATOM 0 HB2 PRO A 493 -11.169 3.189 17.978 1.00 65.23 H new ATOM 0 HB3 PRO A 493 -11.531 4.775 17.326 1.00 65.23 H new ATOM 0 HG2 PRO A 493 -13.075 2.207 17.027 1.00 11.40 H new ATOM 0 HG3 PRO A 493 -13.679 3.831 17.292 1.00 11.40 H new ATOM 0 HD2 PRO A 493 -13.762 2.730 14.830 1.00 3.50 H new ATOM 0 HD3 PRO A 493 -13.432 4.440 15.020 1.00 3.50 H new ATOM 924 N LYS A 494 -8.606 2.161 15.573 1.00 4.30 N ATOM 925 CA LYS A 494 -7.672 1.029 15.677 1.00 70.55 C ATOM 926 C LYS A 494 -8.173 -0.207 14.912 1.00 41.42 C ATOM 927 O LYS A 494 -7.970 -1.347 15.335 1.00 63.33 O ATOM 928 CB LYS A 494 -7.386 0.699 17.150 1.00 11.30 C ATOM 929 CG LYS A 494 -6.613 1.802 17.867 1.00 43.33 C ATOM 930 CD LYS A 494 -6.343 1.462 19.328 1.00 12.31 C ATOM 931 CE LYS A 494 -5.458 2.514 19.991 1.00 72.44 C ATOM 932 NZ LYS A 494 -5.236 2.227 21.431 1.00 11.35 N ATOM 0 H LYS A 494 -8.218 2.972 15.092 1.00 4.30 H new ATOM 0 HA LYS A 494 -6.737 1.330 15.205 1.00 70.55 H new ATOM 0 HB2 LYS A 494 -8.329 0.528 17.668 1.00 11.30 H new ATOM 0 HB3 LYS A 494 -6.819 -0.230 17.205 1.00 11.30 H new ATOM 0 HG2 LYS A 494 -5.666 1.971 17.354 1.00 43.33 H new ATOM 0 HG3 LYS A 494 -7.177 2.733 17.811 1.00 43.33 H new ATOM 0 HD2 LYS A 494 -7.288 1.388 19.866 1.00 12.31 H new ATOM 0 HD3 LYS A 494 -5.862 0.486 19.393 1.00 12.31 H new ATOM 0 HE2 LYS A 494 -4.497 2.556 19.477 1.00 72.44 H new ATOM 0 HE3 LYS A 494 -5.919 3.496 19.884 1.00 72.44 H new ATOM 0 HZ1 LYS A 494 -4.630 2.965 21.843 1.00 11.35 H new ATOM 0 HZ2 LYS A 494 -6.150 2.213 21.927 1.00 11.35 H new ATOM 0 HZ3 LYS A 494 -4.772 1.302 21.533 1.00 11.35 H new ATOM 946 N GLU A 495 -8.804 0.034 13.763 1.00 11.02 N ATOM 947 CA GLU A 495 -9.250 -1.044 12.873 1.00 33.45 C ATOM 948 C GLU A 495 -8.213 -1.303 11.763 1.00 71.41 C ATOM 949 O GLU A 495 -7.421 -0.420 11.431 1.00 4.53 O ATOM 950 CB GLU A 495 -10.607 -0.683 12.249 1.00 20.14 C ATOM 951 CG GLU A 495 -11.210 -1.787 11.387 1.00 54.13 C ATOM 952 CD GLU A 495 -11.550 -3.037 12.183 1.00 20.13 C ATOM 953 OE1 GLU A 495 -10.639 -3.856 12.434 1.00 64.13 O ATOM 954 OE2 GLU A 495 -12.731 -3.212 12.557 1.00 73.40 O ATOM 0 H GLU A 495 -9.020 0.971 13.423 1.00 11.02 H new ATOM 0 HA GLU A 495 -9.356 -1.954 13.463 1.00 33.45 H new ATOM 0 HB2 GLU A 495 -11.307 -0.436 13.047 1.00 20.14 H new ATOM 0 HB3 GLU A 495 -10.488 0.214 11.641 1.00 20.14 H new ATOM 0 HG2 GLU A 495 -12.113 -1.413 10.904 1.00 54.13 H new ATOM 0 HG3 GLU A 495 -10.509 -2.046 10.594 1.00 54.13 H new ATOM 961 N GLU A 496 -8.208 -2.518 11.208 1.00 33.41 N ATOM 962 CA GLU A 496 -7.279 -2.876 10.121 1.00 3.32 C ATOM 963 C GLU A 496 -7.993 -3.633 8.986 1.00 51.41 C ATOM 964 O GLU A 496 -8.895 -4.437 9.232 1.00 13.02 O ATOM 965 CB GLU A 496 -6.122 -3.736 10.658 1.00 42.13 C ATOM 966 CG GLU A 496 -5.059 -4.059 9.604 1.00 33.23 C ATOM 967 CD GLU A 496 -3.934 -4.943 10.130 1.00 2.02 C ATOM 968 OE1 GLU A 496 -3.369 -4.622 11.197 1.00 71.23 O ATOM 969 OE2 GLU A 496 -3.598 -5.953 9.470 1.00 31.45 O ATOM 0 H GLU A 496 -8.834 -3.273 11.490 1.00 33.41 H new ATOM 0 HA GLU A 496 -6.884 -1.943 9.718 1.00 3.32 H new ATOM 0 HB2 GLU A 496 -5.650 -3.216 11.491 1.00 42.13 H new ATOM 0 HB3 GLU A 496 -6.526 -4.668 11.053 1.00 42.13 H new ATOM 0 HG2 GLU A 496 -5.535 -4.555 8.758 1.00 33.23 H new ATOM 0 HG3 GLU A 496 -4.634 -3.128 9.230 1.00 33.23 H new ATOM 976 N LYS A 497 -7.579 -3.364 7.748 1.00 42.22 N ATOM 977 CA LYS A 497 -8.095 -4.074 6.567 1.00 12.31 C ATOM 978 C LYS A 497 -6.944 -4.661 5.735 1.00 14.13 C ATOM 979 O LYS A 497 -5.957 -3.977 5.453 1.00 33.41 O ATOM 980 CB LYS A 497 -8.946 -3.136 5.703 1.00 14.31 C ATOM 981 CG LYS A 497 -10.317 -2.862 6.300 1.00 53.24 C ATOM 982 CD LYS A 497 -11.210 -2.064 5.359 1.00 33.02 C ATOM 983 CE LYS A 497 -12.675 -2.219 5.736 1.00 73.11 C ATOM 984 NZ LYS A 497 -12.987 -1.649 7.078 1.00 41.25 N ATOM 0 H LYS A 497 -6.881 -2.653 7.531 1.00 42.22 H new ATOM 0 HA LYS A 497 -8.722 -4.895 6.915 1.00 12.31 H new ATOM 0 HB2 LYS A 497 -8.417 -2.192 5.572 1.00 14.31 H new ATOM 0 HB3 LYS A 497 -9.068 -3.574 4.712 1.00 14.31 H new ATOM 0 HG2 LYS A 497 -10.801 -3.808 6.541 1.00 53.24 H new ATOM 0 HG3 LYS A 497 -10.200 -2.316 7.236 1.00 53.24 H new ATOM 0 HD2 LYS A 497 -10.931 -1.011 5.393 1.00 33.02 H new ATOM 0 HD3 LYS A 497 -11.057 -2.401 4.334 1.00 33.02 H new ATOM 0 HE2 LYS A 497 -13.293 -1.728 4.985 1.00 73.11 H new ATOM 0 HE3 LYS A 497 -12.939 -3.276 5.725 1.00 73.11 H new ATOM 0 HZ1 LYS A 497 -14.009 -1.720 7.256 1.00 41.25 H new ATOM 0 HZ2 LYS A 497 -12.470 -2.179 7.809 1.00 41.25 H new ATOM 0 HZ3 LYS A 497 -12.699 -0.650 7.106 1.00 41.25 H new ATOM 998 N VAL A 498 -7.070 -5.930 5.356 1.00 31.23 N ATOM 999 CA VAL A 498 -6.038 -6.611 4.565 1.00 42.24 C ATOM 1000 C VAL A 498 -6.430 -6.692 3.081 1.00 34.25 C ATOM 1001 O VAL A 498 -7.435 -7.307 2.723 1.00 62.13 O ATOM 1002 CB VAL A 498 -5.770 -8.039 5.104 1.00 73.20 C ATOM 1003 CG1 VAL A 498 -4.652 -8.725 4.315 1.00 41.04 C ATOM 1004 CG2 VAL A 498 -5.443 -7.993 6.598 1.00 21.11 C ATOM 0 H VAL A 498 -7.877 -6.512 5.582 1.00 31.23 H new ATOM 0 HA VAL A 498 -5.127 -6.019 4.656 1.00 42.24 H new ATOM 0 HB VAL A 498 -6.676 -8.630 4.971 1.00 73.20 H new ATOM 0 HG11 VAL A 498 -4.485 -9.725 4.715 1.00 41.04 H new ATOM 0 HG12 VAL A 498 -4.938 -8.797 3.266 1.00 41.04 H new ATOM 0 HG13 VAL A 498 -3.735 -8.142 4.402 1.00 41.04 H new ATOM 0 HG21 VAL A 498 -5.257 -9.004 6.961 1.00 21.11 H new ATOM 0 HG22 VAL A 498 -4.555 -7.381 6.757 1.00 21.11 H new ATOM 0 HG23 VAL A 498 -6.283 -7.561 7.141 1.00 21.11 H new ATOM 1014 N LEU A 499 -5.630 -6.060 2.227 1.00 13.33 N ATOM 1015 CA LEU A 499 -5.880 -6.036 0.782 1.00 55.23 C ATOM 1016 C LEU A 499 -4.808 -6.843 0.028 1.00 32.20 C ATOM 1017 O LEU A 499 -3.650 -6.880 0.440 1.00 74.42 O ATOM 1018 CB LEU A 499 -5.890 -4.578 0.299 1.00 41.45 C ATOM 1019 CG LEU A 499 -6.865 -3.653 1.054 1.00 71.14 C ATOM 1020 CD1 LEU A 499 -6.667 -2.194 0.642 1.00 73.23 C ATOM 1021 CD2 LEU A 499 -8.314 -4.088 0.820 1.00 41.15 C ATOM 0 H LEU A 499 -4.793 -5.551 2.511 1.00 13.33 H new ATOM 0 HA LEU A 499 -6.847 -6.495 0.579 1.00 55.23 H new ATOM 0 HB2 LEU A 499 -4.882 -4.173 0.391 1.00 41.45 H new ATOM 0 HB3 LEU A 499 -6.144 -4.563 -0.761 1.00 41.45 H new ATOM 0 HG LEU A 499 -6.649 -3.735 2.119 1.00 71.14 H new ATOM 0 HD11 LEU A 499 -7.367 -1.563 1.189 1.00 73.23 H new ATOM 0 HD12 LEU A 499 -5.647 -1.887 0.871 1.00 73.23 H new ATOM 0 HD13 LEU A 499 -6.846 -2.091 -0.428 1.00 73.23 H new ATOM 0 HD21 LEU A 499 -8.986 -3.422 1.362 1.00 41.15 H new ATOM 0 HD22 LEU A 499 -8.540 -4.043 -0.245 1.00 41.15 H new ATOM 0 HD23 LEU A 499 -8.450 -5.109 1.177 1.00 41.15 H new ATOM 1033 N THR A 500 -5.193 -7.494 -1.070 1.00 54.13 N ATOM 1034 CA THR A 500 -4.245 -8.294 -1.869 1.00 41.42 C ATOM 1035 C THR A 500 -4.401 -8.051 -3.373 1.00 33.14 C ATOM 1036 O THR A 500 -5.483 -7.709 -3.860 1.00 24.25 O ATOM 1037 CB THR A 500 -4.397 -9.818 -1.619 1.00 40.21 C ATOM 1038 OG1 THR A 500 -5.781 -10.198 -1.659 1.00 74.33 O ATOM 1039 CG2 THR A 500 -3.782 -10.237 -0.290 1.00 11.10 C ATOM 0 H THR A 500 -6.147 -7.488 -1.430 1.00 54.13 H new ATOM 0 HA THR A 500 -3.259 -7.965 -1.542 1.00 41.42 H new ATOM 0 HB THR A 500 -3.859 -10.333 -2.415 1.00 40.21 H new ATOM 0 HG1 THR A 500 -5.860 -11.162 -1.501 1.00 74.33 H new ATOM 0 HG21 THR A 500 -3.909 -11.311 -0.153 1.00 11.10 H new ATOM 0 HG22 THR A 500 -2.719 -9.994 -0.288 1.00 11.10 H new ATOM 0 HG23 THR A 500 -4.277 -9.706 0.523 1.00 11.10 H new ATOM 1047 N PHE A 501 -3.307 -8.237 -4.105 1.00 4.41 N ATOM 1048 CA PHE A 501 -3.316 -8.136 -5.567 1.00 45.54 C ATOM 1049 C PHE A 501 -2.336 -9.141 -6.197 1.00 14.34 C ATOM 1050 O PHE A 501 -1.365 -9.563 -5.561 1.00 33.02 O ATOM 1051 CB PHE A 501 -2.987 -6.700 -6.012 1.00 12.11 C ATOM 1052 CG PHE A 501 -1.665 -6.167 -5.503 1.00 51.33 C ATOM 1053 CD1 PHE A 501 -0.487 -6.400 -6.202 1.00 33.42 C ATOM 1054 CD2 PHE A 501 -1.604 -5.425 -4.331 1.00 70.45 C ATOM 1055 CE1 PHE A 501 0.718 -5.904 -5.743 1.00 52.32 C ATOM 1056 CE2 PHE A 501 -0.400 -4.926 -3.870 1.00 44.32 C ATOM 1057 CZ PHE A 501 0.762 -5.166 -4.575 1.00 72.14 C ATOM 0 H PHE A 501 -2.394 -8.460 -3.709 1.00 4.41 H new ATOM 0 HA PHE A 501 -4.318 -8.383 -5.917 1.00 45.54 H new ATOM 0 HB2 PHE A 501 -2.983 -6.664 -7.101 1.00 12.11 H new ATOM 0 HB3 PHE A 501 -3.784 -6.038 -5.674 1.00 12.11 H new ATOM 0 HD1 PHE A 501 -0.514 -6.976 -7.115 1.00 33.42 H new ATOM 0 HD2 PHE A 501 -2.509 -5.235 -3.772 1.00 70.45 H new ATOM 0 HE1 PHE A 501 1.626 -6.093 -6.297 1.00 52.32 H new ATOM 0 HE2 PHE A 501 -0.369 -4.348 -2.958 1.00 44.32 H new ATOM 0 HZ PHE A 501 1.703 -4.778 -4.215 1.00 72.14 H new ATOM 1067 N SER A 502 -2.603 -9.532 -7.442 1.00 23.03 N ATOM 1068 CA SER A 502 -1.742 -10.479 -8.170 1.00 51.50 C ATOM 1069 C SER A 502 -1.037 -9.795 -9.351 1.00 75.51 C ATOM 1070 O SER A 502 -1.675 -9.384 -10.319 1.00 11.12 O ATOM 1071 CB SER A 502 -2.572 -11.668 -8.673 1.00 44.31 C ATOM 1072 OG SER A 502 -3.706 -11.236 -9.410 1.00 62.01 O ATOM 0 H SER A 502 -3.411 -9.209 -7.974 1.00 23.03 H new ATOM 0 HA SER A 502 -0.978 -10.838 -7.480 1.00 51.50 H new ATOM 0 HB2 SER A 502 -1.951 -12.307 -9.300 1.00 44.31 H new ATOM 0 HB3 SER A 502 -2.896 -12.272 -7.825 1.00 44.31 H new ATOM 0 HG SER A 502 -3.485 -10.417 -9.900 1.00 62.01 H new ATOM 1078 N TRP A 503 0.286 -9.707 -9.268 1.00 1.54 N ATOM 1079 CA TRP A 503 1.105 -8.995 -10.256 1.00 20.15 C ATOM 1080 C TRP A 503 2.023 -9.963 -11.025 1.00 61.32 C ATOM 1081 O TRP A 503 2.608 -10.876 -10.437 1.00 41.21 O ATOM 1082 CB TRP A 503 1.929 -7.918 -9.531 1.00 61.40 C ATOM 1083 CG TRP A 503 2.965 -7.235 -10.378 1.00 3.22 C ATOM 1084 CD1 TRP A 503 2.754 -6.509 -11.515 1.00 44.43 C ATOM 1085 CD2 TRP A 503 4.375 -7.196 -10.132 1.00 54.41 C ATOM 1086 NE1 TRP A 503 3.948 -6.035 -11.999 1.00 72.24 N ATOM 1087 CE2 TRP A 503 4.959 -6.443 -11.165 1.00 4.23 C ATOM 1088 CE3 TRP A 503 5.200 -7.734 -9.138 1.00 71.33 C ATOM 1089 CZ2 TRP A 503 6.329 -6.208 -11.228 1.00 72.42 C ATOM 1090 CZ3 TRP A 503 6.560 -7.502 -9.203 1.00 23.42 C ATOM 1091 CH2 TRP A 503 7.114 -6.745 -10.241 1.00 53.52 C ATOM 0 H TRP A 503 0.827 -10.127 -8.513 1.00 1.54 H new ATOM 0 HA TRP A 503 0.452 -8.524 -10.991 1.00 20.15 H new ATOM 0 HB2 TRP A 503 1.247 -7.164 -9.138 1.00 61.40 H new ATOM 0 HB3 TRP A 503 2.425 -8.376 -8.675 1.00 61.40 H new ATOM 0 HD1 TRP A 503 1.789 -6.333 -11.967 1.00 44.43 H new ATOM 0 HE1 TRP A 503 4.065 -5.471 -12.841 1.00 72.24 H new ATOM 0 HE3 TRP A 503 4.781 -8.320 -8.334 1.00 71.33 H new ATOM 0 HZ2 TRP A 503 6.759 -5.623 -12.027 1.00 72.42 H new ATOM 0 HZ3 TRP A 503 7.206 -7.911 -8.440 1.00 23.42 H new ATOM 0 HH2 TRP A 503 8.181 -6.581 -10.265 1.00 53.52 H new ATOM 1102 N THR A 504 2.130 -9.777 -12.343 1.00 22.31 N ATOM 1103 CA THR A 504 2.985 -10.634 -13.182 1.00 14.12 C ATOM 1104 C THR A 504 3.979 -9.807 -14.014 1.00 43.14 C ATOM 1105 O THR A 504 3.606 -9.197 -15.018 1.00 10.41 O ATOM 1106 CB THR A 504 2.150 -11.522 -14.142 1.00 71.41 C ATOM 1107 OG1 THR A 504 1.303 -12.403 -13.386 1.00 25.25 O ATOM 1108 CG2 THR A 504 3.047 -12.350 -15.062 1.00 32.35 C ATOM 0 H THR A 504 1.639 -9.044 -12.855 1.00 22.31 H new ATOM 0 HA THR A 504 3.537 -11.273 -12.493 1.00 14.12 H new ATOM 0 HB THR A 504 1.542 -10.860 -14.759 1.00 71.41 H new ATOM 0 HG1 THR A 504 0.778 -12.959 -14.000 1.00 25.25 H new ATOM 0 HG21 THR A 504 2.429 -12.960 -15.721 1.00 32.35 H new ATOM 0 HG22 THR A 504 3.668 -11.684 -15.661 1.00 32.35 H new ATOM 0 HG23 THR A 504 3.685 -12.998 -14.461 1.00 32.35 H new ATOM 1116 N PRO A 505 5.263 -9.768 -13.608 1.00 12.32 N ATOM 1117 CA PRO A 505 6.309 -9.068 -14.365 1.00 31.12 C ATOM 1118 C PRO A 505 6.848 -9.895 -15.549 1.00 70.40 C ATOM 1119 O PRO A 505 7.696 -10.772 -15.377 1.00 40.20 O ATOM 1120 CB PRO A 505 7.401 -8.853 -13.316 1.00 31.30 C ATOM 1121 CG PRO A 505 7.263 -10.014 -12.386 1.00 70.12 C ATOM 1122 CD PRO A 505 5.795 -10.380 -12.372 1.00 21.44 C ATOM 0 HA PRO A 505 5.939 -8.150 -14.821 1.00 31.12 H new ATOM 0 HB2 PRO A 505 8.390 -8.826 -13.773 1.00 31.30 H new ATOM 0 HB3 PRO A 505 7.267 -7.907 -12.792 1.00 31.30 H new ATOM 0 HG2 PRO A 505 7.869 -10.855 -12.722 1.00 70.12 H new ATOM 0 HG3 PRO A 505 7.607 -9.753 -11.385 1.00 70.12 H new ATOM 0 HD2 PRO A 505 5.653 -11.461 -12.368 1.00 21.44 H new ATOM 0 HD3 PRO A 505 5.295 -9.990 -11.486 1.00 21.44 H new ATOM 1130 N THR A 506 6.339 -9.627 -16.753 1.00 1.13 N ATOM 1131 CA THR A 506 6.831 -10.303 -17.967 1.00 11.11 C ATOM 1132 C THR A 506 8.171 -9.710 -18.426 1.00 24.24 C ATOM 1133 O THR A 506 8.805 -10.215 -19.351 1.00 21.21 O ATOM 1134 CB THR A 506 5.821 -10.213 -19.138 1.00 75.12 C ATOM 1135 OG1 THR A 506 5.650 -8.845 -19.544 1.00 32.33 O ATOM 1136 CG2 THR A 506 4.470 -10.805 -18.741 1.00 31.14 C ATOM 0 H THR A 506 5.592 -8.953 -16.919 1.00 1.13 H new ATOM 0 HA THR A 506 6.962 -11.351 -17.698 1.00 11.11 H new ATOM 0 HB THR A 506 6.221 -10.789 -19.973 1.00 75.12 H new ATOM 0 HG1 THR A 506 5.011 -8.801 -20.286 1.00 32.33 H new ATOM 0 HG21 THR A 506 3.779 -10.730 -19.580 1.00 31.14 H new ATOM 0 HG22 THR A 506 4.598 -11.853 -18.469 1.00 31.14 H new ATOM 0 HG23 THR A 506 4.068 -10.256 -17.890 1.00 31.14 H new ATOM 1144 N GLN A 507 8.588 -8.632 -17.772 1.00 25.23 N ATOM 1145 CA GLN A 507 9.883 -7.997 -18.032 1.00 63.10 C ATOM 1146 C GLN A 507 10.794 -8.123 -16.800 1.00 25.52 C ATOM 1147 O GLN A 507 10.327 -8.022 -15.665 1.00 12.11 O ATOM 1148 CB GLN A 507 9.664 -6.521 -18.388 1.00 31.32 C ATOM 1149 CG GLN A 507 10.950 -5.710 -18.533 1.00 74.40 C ATOM 1150 CD GLN A 507 10.692 -4.225 -18.724 1.00 15.31 C ATOM 1151 OE1 GLN A 507 9.692 -3.685 -18.251 1.00 45.32 O ATOM 1152 NE2 GLN A 507 11.595 -3.545 -19.401 1.00 42.14 N ATOM 0 H GLN A 507 8.041 -8.170 -17.046 1.00 25.23 H new ATOM 0 HA GLN A 507 10.369 -8.498 -18.869 1.00 63.10 H new ATOM 0 HB2 GLN A 507 9.106 -6.464 -19.322 1.00 31.32 H new ATOM 0 HB3 GLN A 507 9.044 -6.062 -17.618 1.00 31.32 H new ATOM 0 HG2 GLN A 507 11.568 -5.856 -17.647 1.00 74.40 H new ATOM 0 HG3 GLN A 507 11.518 -6.088 -19.383 1.00 74.40 H new ATOM 0 HE21 GLN A 507 12.413 -4.021 -19.781 1.00 42.14 H new ATOM 0 HE22 GLN A 507 11.476 -2.542 -19.545 1.00 42.14 H new ATOM 1161 N GLU A 508 12.085 -8.360 -17.023 1.00 33.44 N ATOM 1162 CA GLU A 508 13.037 -8.496 -15.916 1.00 13.51 C ATOM 1163 C GLU A 508 13.670 -7.142 -15.558 1.00 65.40 C ATOM 1164 O GLU A 508 13.815 -6.266 -16.413 1.00 45.42 O ATOM 1165 CB GLU A 508 14.114 -9.544 -16.260 1.00 20.12 C ATOM 1166 CG GLU A 508 15.056 -9.160 -17.406 1.00 1.22 C ATOM 1167 CD GLU A 508 16.343 -8.499 -16.928 1.00 45.41 C ATOM 1168 OE1 GLU A 508 17.219 -9.217 -16.398 1.00 33.40 O ATOM 1169 OE2 GLU A 508 16.486 -7.268 -17.073 1.00 53.23 O ATOM 0 H GLU A 508 12.496 -8.462 -17.951 1.00 33.44 H new ATOM 0 HA GLU A 508 12.493 -8.843 -15.037 1.00 13.51 H new ATOM 0 HB2 GLU A 508 14.711 -9.734 -15.368 1.00 20.12 H new ATOM 0 HB3 GLU A 508 13.618 -10.480 -16.517 1.00 20.12 H new ATOM 0 HG2 GLU A 508 15.305 -10.054 -17.978 1.00 1.22 H new ATOM 0 HG3 GLU A 508 14.537 -8.482 -18.083 1.00 1.22 H new ATOM 1176 N GLY A 509 14.027 -6.971 -14.288 1.00 2.41 N ATOM 1177 CA GLY A 509 14.610 -5.715 -13.826 1.00 32.12 C ATOM 1178 C GLY A 509 14.105 -5.298 -12.449 1.00 62.31 C ATOM 1179 O GLY A 509 13.420 -6.065 -11.770 1.00 21.45 O ATOM 0 H GLY A 509 13.924 -7.682 -13.564 1.00 2.41 H new ATOM 0 HA2 GLY A 509 15.695 -5.814 -13.795 1.00 32.12 H new ATOM 0 HA3 GLY A 509 14.382 -4.928 -14.545 1.00 32.12 H new ATOM 1183 N MET A 510 14.450 -4.086 -12.026 1.00 61.45 N ATOM 1184 CA MET A 510 14.007 -3.570 -10.727 1.00 10.10 C ATOM 1185 C MET A 510 12.600 -2.954 -10.802 1.00 53.42 C ATOM 1186 O MET A 510 12.323 -2.101 -11.648 1.00 33.54 O ATOM 1187 CB MET A 510 15.007 -2.534 -10.200 1.00 72.22 C ATOM 1188 CG MET A 510 16.394 -3.104 -9.932 1.00 21.23 C ATOM 1189 SD MET A 510 16.369 -4.469 -8.751 1.00 34.20 S ATOM 1190 CE MET A 510 15.697 -3.662 -7.296 1.00 2.32 C ATOM 0 H MET A 510 15.033 -3.441 -12.559 1.00 61.45 H new ATOM 0 HA MET A 510 13.961 -4.414 -10.039 1.00 10.10 H new ATOM 0 HB2 MET A 510 15.091 -1.722 -10.923 1.00 72.22 H new ATOM 0 HB3 MET A 510 14.617 -2.101 -9.279 1.00 72.22 H new ATOM 0 HG2 MET A 510 16.828 -3.449 -10.870 1.00 21.23 H new ATOM 0 HG3 MET A 510 17.041 -2.313 -9.553 1.00 21.23 H new ATOM 0 HE1 MET A 510 15.867 -4.289 -6.421 1.00 2.32 H new ATOM 0 HE2 MET A 510 16.189 -2.700 -7.154 1.00 2.32 H new ATOM 0 HE3 MET A 510 14.626 -3.506 -7.428 1.00 2.32 H new ATOM 1200 N TYR A 511 11.718 -3.405 -9.914 1.00 31.45 N ATOM 1201 CA TYR A 511 10.357 -2.866 -9.803 1.00 63.42 C ATOM 1202 C TYR A 511 10.057 -2.426 -8.362 1.00 5.34 C ATOM 1203 O TYR A 511 9.956 -3.254 -7.459 1.00 22.04 O ATOM 1204 CB TYR A 511 9.325 -3.913 -10.244 1.00 54.34 C ATOM 1205 CG TYR A 511 9.318 -4.192 -11.736 1.00 3.11 C ATOM 1206 CD1 TYR A 511 10.223 -5.080 -12.308 1.00 44.20 C ATOM 1207 CD2 TYR A 511 8.397 -3.567 -12.569 1.00 34.54 C ATOM 1208 CE1 TYR A 511 10.208 -5.337 -13.665 1.00 4.23 C ATOM 1209 CE2 TYR A 511 8.375 -3.820 -13.925 1.00 50.41 C ATOM 1210 CZ TYR A 511 9.284 -4.703 -14.468 1.00 35.22 C ATOM 1211 OH TYR A 511 9.260 -4.963 -15.817 1.00 13.24 O ATOM 0 H TYR A 511 11.922 -4.153 -9.251 1.00 31.45 H new ATOM 0 HA TYR A 511 10.289 -1.997 -10.458 1.00 63.42 H new ATOM 0 HB2 TYR A 511 9.520 -4.845 -9.713 1.00 54.34 H new ATOM 0 HB3 TYR A 511 8.332 -3.577 -9.944 1.00 54.34 H new ATOM 0 HD1 TYR A 511 10.949 -5.576 -11.681 1.00 44.20 H new ATOM 0 HD2 TYR A 511 7.687 -2.871 -12.147 1.00 34.54 H new ATOM 0 HE1 TYR A 511 10.916 -6.030 -14.094 1.00 4.23 H new ATOM 0 HE2 TYR A 511 7.650 -3.329 -14.557 1.00 50.41 H new ATOM 0 HH TYR A 511 9.497 -4.151 -16.311 1.00 13.24 H new ATOM 1221 N ARG A 512 9.914 -1.125 -8.153 1.00 13.14 N ATOM 1222 CA ARG A 512 9.612 -0.589 -6.823 1.00 51.05 C ATOM 1223 C ARG A 512 8.101 -0.407 -6.625 1.00 30.51 C ATOM 1224 O ARG A 512 7.461 0.393 -7.314 1.00 20.31 O ATOM 1225 CB ARG A 512 10.340 0.741 -6.604 1.00 5.44 C ATOM 1226 CG ARG A 512 9.997 1.422 -5.279 1.00 33.10 C ATOM 1227 CD ARG A 512 10.895 2.622 -5.016 1.00 42.43 C ATOM 1228 NE ARG A 512 12.287 2.219 -4.843 1.00 23.32 N ATOM 1229 CZ ARG A 512 13.314 2.919 -5.227 1.00 12.14 C ATOM 1230 NH1 ARG A 512 13.153 4.054 -5.832 1.00 12.51 N ATOM 1231 NH2 ARG A 512 14.507 2.466 -5.018 1.00 44.45 N ATOM 0 H ARG A 512 10.001 -0.418 -8.883 1.00 13.14 H new ATOM 0 HA ARG A 512 9.964 -1.310 -6.085 1.00 51.05 H new ATOM 0 HB2 ARG A 512 11.415 0.567 -6.644 1.00 5.44 H new ATOM 0 HB3 ARG A 512 10.096 1.417 -7.423 1.00 5.44 H new ATOM 0 HG2 ARG A 512 8.955 1.743 -5.293 1.00 33.10 H new ATOM 0 HG3 ARG A 512 10.099 0.705 -4.464 1.00 33.10 H new ATOM 0 HD2 ARG A 512 10.819 3.324 -5.846 1.00 42.43 H new ATOM 0 HD3 ARG A 512 10.553 3.146 -4.123 1.00 42.43 H new ATOM 0 HE ARG A 512 12.468 1.324 -4.388 1.00 23.32 H new ATOM 0 HH11 ARG A 512 12.213 4.407 -6.012 1.00 12.51 H new ATOM 0 HH12 ARG A 512 13.966 4.594 -6.128 1.00 12.51 H new ATOM 0 HH21 ARG A 512 14.637 1.566 -4.555 1.00 44.45 H new ATOM 0 HH22 ARG A 512 15.318 3.008 -5.316 1.00 44.45 H new ATOM 1245 N ILE A 513 7.544 -1.165 -5.687 1.00 51.55 N ATOM 1246 CA ILE A 513 6.126 -1.067 -5.337 1.00 24.23 C ATOM 1247 C ILE A 513 5.922 -0.152 -4.114 1.00 51.32 C ATOM 1248 O ILE A 513 6.573 -0.321 -3.083 1.00 32.15 O ATOM 1249 CB ILE A 513 5.527 -2.469 -5.040 1.00 1.44 C ATOM 1250 CG1 ILE A 513 5.728 -3.403 -6.248 1.00 14.41 C ATOM 1251 CG2 ILE A 513 4.045 -2.361 -4.679 1.00 72.53 C ATOM 1252 CD1 ILE A 513 5.200 -4.811 -6.041 1.00 63.31 C ATOM 0 H ILE A 513 8.057 -1.863 -5.148 1.00 51.55 H new ATOM 0 HA ILE A 513 5.608 -0.635 -6.194 1.00 24.23 H new ATOM 0 HB ILE A 513 6.051 -2.894 -4.184 1.00 1.44 H new ATOM 0 HG12 ILE A 513 5.235 -2.966 -7.117 1.00 14.41 H new ATOM 0 HG13 ILE A 513 6.792 -3.456 -6.479 1.00 14.41 H new ATOM 0 HG21 ILE A 513 3.647 -3.355 -4.475 1.00 72.53 H new ATOM 0 HG22 ILE A 513 3.931 -1.736 -3.794 1.00 72.53 H new ATOM 0 HG23 ILE A 513 3.499 -1.915 -5.511 1.00 72.53 H new ATOM 0 HD11 ILE A 513 5.381 -5.403 -6.938 1.00 63.31 H new ATOM 0 HD12 ILE A 513 5.710 -5.270 -5.194 1.00 63.31 H new ATOM 0 HD13 ILE A 513 4.129 -4.772 -5.842 1.00 63.31 H new ATOM 1264 N ASN A 514 5.025 0.821 -4.244 1.00 74.31 N ATOM 1265 CA ASN A 514 4.719 1.752 -3.152 1.00 41.41 C ATOM 1266 C ASN A 514 3.221 1.761 -2.832 1.00 73.44 C ATOM 1267 O ASN A 514 2.388 1.850 -3.730 1.00 5.22 O ATOM 1268 CB ASN A 514 5.168 3.173 -3.514 1.00 23.53 C ATOM 1269 CG ASN A 514 6.674 3.291 -3.626 1.00 35.52 C ATOM 1270 OD1 ASN A 514 7.247 3.106 -4.696 1.00 11.51 O ATOM 1271 ND2 ASN A 514 7.329 3.596 -2.523 1.00 24.11 N ATOM 0 H ASN A 514 4.493 0.989 -5.098 1.00 74.31 H new ATOM 0 HA ASN A 514 5.263 1.412 -2.271 1.00 41.41 H new ATOM 0 HB2 ASN A 514 4.712 3.466 -4.460 1.00 23.53 H new ATOM 0 HB3 ASN A 514 4.807 3.869 -2.757 1.00 23.53 H new ATOM 0 HD21 ASN A 514 8.345 3.685 -2.541 1.00 24.11 H new ATOM 0 HD22 ASN A 514 6.820 3.743 -1.652 1.00 24.11 H new ATOM 1278 N ALA A 515 2.889 1.662 -1.550 1.00 50.24 N ATOM 1279 CA ALA A 515 1.500 1.794 -1.099 1.00 64.20 C ATOM 1280 C ALA A 515 1.329 3.072 -0.275 1.00 4.31 C ATOM 1281 O ALA A 515 2.154 3.379 0.587 1.00 12.43 O ATOM 1282 CB ALA A 515 1.074 0.579 -0.283 1.00 25.45 C ATOM 0 H ALA A 515 3.560 1.491 -0.801 1.00 50.24 H new ATOM 0 HA ALA A 515 0.861 1.854 -1.980 1.00 64.20 H new ATOM 0 HB1 ALA A 515 0.040 0.702 0.040 1.00 25.45 H new ATOM 0 HB2 ALA A 515 1.159 -0.319 -0.895 1.00 25.45 H new ATOM 0 HB3 ALA A 515 1.718 0.484 0.591 1.00 25.45 H new ATOM 1288 N THR A 516 0.271 3.822 -0.553 1.00 24.14 N ATOM 1289 CA THR A 516 0.012 5.085 0.145 1.00 74.02 C ATOM 1290 C THR A 516 -1.449 5.184 0.589 1.00 24.44 C ATOM 1291 O THR A 516 -2.359 4.767 -0.130 1.00 13.30 O ATOM 1292 CB THR A 516 0.331 6.300 -0.762 1.00 23.20 C ATOM 1293 OG1 THR A 516 -0.511 6.278 -1.925 1.00 5.12 O ATOM 1294 CG2 THR A 516 1.794 6.298 -1.203 1.00 55.14 C ATOM 0 H THR A 516 -0.426 3.581 -1.258 1.00 24.14 H new ATOM 0 HA THR A 516 0.661 5.099 1.020 1.00 74.02 H new ATOM 0 HB THR A 516 0.144 7.204 -0.183 1.00 23.20 H new ATOM 0 HG1 THR A 516 -0.353 5.452 -2.428 1.00 5.12 H new ATOM 0 HG21 THR A 516 1.984 7.163 -1.838 1.00 55.14 H new ATOM 0 HG22 THR A 516 2.439 6.343 -0.325 1.00 55.14 H new ATOM 0 HG23 THR A 516 2.005 5.386 -1.761 1.00 55.14 H new ATOM 1302 N VAL A 517 -1.680 5.729 1.780 1.00 14.51 N ATOM 1303 CA VAL A 517 -3.045 5.974 2.249 1.00 64.11 C ATOM 1304 C VAL A 517 -3.358 7.480 2.269 1.00 54.33 C ATOM 1305 O VAL A 517 -2.527 8.293 2.670 1.00 61.33 O ATOM 1306 CB VAL A 517 -3.282 5.360 3.654 1.00 63.40 C ATOM 1307 CG1 VAL A 517 -2.281 5.900 4.670 1.00 4.12 C ATOM 1308 CG2 VAL A 517 -4.712 5.607 4.115 1.00 65.42 C ATOM 0 H VAL A 517 -0.949 6.008 2.434 1.00 14.51 H new ATOM 0 HA VAL A 517 -3.721 5.486 1.547 1.00 64.11 H new ATOM 0 HB VAL A 517 -3.129 4.283 3.579 1.00 63.40 H new ATOM 0 HG11 VAL A 517 -2.473 5.451 5.644 1.00 4.12 H new ATOM 0 HG12 VAL A 517 -1.269 5.653 4.350 1.00 4.12 H new ATOM 0 HG13 VAL A 517 -2.385 6.983 4.743 1.00 4.12 H new ATOM 0 HG21 VAL A 517 -4.857 5.168 5.102 1.00 65.42 H new ATOM 0 HG22 VAL A 517 -4.898 6.680 4.164 1.00 65.42 H new ATOM 0 HG23 VAL A 517 -5.406 5.150 3.409 1.00 65.42 H new ATOM 1318 N ASP A 518 -4.578 7.820 1.845 1.00 50.12 N ATOM 1319 CA ASP A 518 -5.039 9.212 1.707 1.00 73.24 C ATOM 1320 C ASP A 518 -3.936 10.156 1.163 1.00 13.44 C ATOM 1321 O ASP A 518 -3.478 11.064 1.856 1.00 41.53 O ATOM 1322 CB ASP A 518 -5.612 9.740 3.037 1.00 12.34 C ATOM 1323 CG ASP A 518 -6.497 10.973 2.850 1.00 43.32 C ATOM 1324 OD1 ASP A 518 -6.725 11.387 1.690 1.00 54.53 O ATOM 1325 OD2 ASP A 518 -6.971 11.536 3.859 1.00 62.03 O ATOM 0 H ASP A 518 -5.284 7.132 1.584 1.00 50.12 H new ATOM 0 HA ASP A 518 -5.838 9.204 0.966 1.00 73.24 H new ATOM 0 HB2 ASP A 518 -6.191 8.951 3.517 1.00 12.34 H new ATOM 0 HB3 ASP A 518 -4.790 9.986 3.710 1.00 12.34 H new ATOM 1330 N GLU A 519 -3.513 9.917 -0.085 1.00 71.52 N ATOM 1331 CA GLU A 519 -2.585 10.825 -0.788 1.00 43.11 C ATOM 1332 C GLU A 519 -3.103 12.269 -0.764 1.00 31.31 C ATOM 1333 O GLU A 519 -2.332 13.229 -0.697 1.00 20.44 O ATOM 1334 CB GLU A 519 -2.413 10.370 -2.248 1.00 52.43 C ATOM 1335 CG GLU A 519 -1.547 9.124 -2.421 1.00 34.54 C ATOM 1336 CD GLU A 519 -0.066 9.448 -2.572 1.00 43.14 C ATOM 1337 OE1 GLU A 519 0.607 9.714 -1.555 1.00 51.11 O ATOM 1338 OE2 GLU A 519 0.427 9.436 -3.720 1.00 71.11 O ATOM 0 H GLU A 519 -3.796 9.104 -0.632 1.00 71.52 H new ATOM 0 HA GLU A 519 -1.624 10.791 -0.274 1.00 43.11 H new ATOM 0 HB2 GLU A 519 -3.397 10.176 -2.674 1.00 52.43 H new ATOM 0 HB3 GLU A 519 -1.973 11.186 -2.821 1.00 52.43 H new ATOM 0 HG2 GLU A 519 -1.685 8.470 -1.560 1.00 34.54 H new ATOM 0 HG3 GLU A 519 -1.884 8.572 -3.298 1.00 34.54 H new ATOM 1345 N GLU A 520 -4.422 12.396 -0.810 1.00 41.12 N ATOM 1346 CA GLU A 520 -5.091 13.693 -0.824 1.00 72.21 C ATOM 1347 C GLU A 520 -5.020 14.382 0.548 1.00 71.32 C ATOM 1348 O GLU A 520 -5.095 15.611 0.638 1.00 64.35 O ATOM 1349 CB GLU A 520 -6.554 13.492 -1.240 1.00 34.02 C ATOM 1350 CG GLU A 520 -6.712 12.832 -2.606 1.00 71.25 C ATOM 1351 CD GLU A 520 -8.153 12.472 -2.925 1.00 13.52 C ATOM 1352 OE1 GLU A 520 -8.988 13.398 -3.049 1.00 44.12 O ATOM 1353 OE2 GLU A 520 -8.457 11.270 -3.072 1.00 1.14 O ATOM 0 H GLU A 520 -5.061 11.602 -0.839 1.00 41.12 H new ATOM 0 HA GLU A 520 -4.583 14.340 -1.539 1.00 72.21 H new ATOM 0 HB2 GLU A 520 -7.056 12.881 -0.490 1.00 34.02 H new ATOM 0 HB3 GLU A 520 -7.056 14.459 -1.252 1.00 34.02 H new ATOM 0 HG2 GLU A 520 -6.332 13.504 -3.375 1.00 71.25 H new ATOM 0 HG3 GLU A 520 -6.101 11.930 -2.641 1.00 71.25 H new ATOM 1360 N ASN A 521 -4.857 13.582 1.605 1.00 34.44 N ATOM 1361 CA ASN A 521 -4.870 14.085 2.981 1.00 0.13 C ATOM 1362 C ASN A 521 -6.153 14.883 3.250 1.00 32.42 C ATOM 1363 O ASN A 521 -6.123 16.049 3.657 1.00 21.31 O ATOM 1364 CB ASN A 521 -3.611 14.914 3.271 1.00 3.45 C ATOM 1365 CG ASN A 521 -2.361 14.055 3.377 1.00 63.13 C ATOM 1366 OD1 ASN A 521 -2.482 12.890 3.990 1.00 44.41 O flip ATOM 1367 ND2 ASN A 521 -1.285 14.444 2.931 1.00 74.11 N flip ATOM 0 H ASN A 521 -4.713 12.575 1.532 1.00 34.44 H new ATOM 0 HA ASN A 521 -4.862 13.235 3.663 1.00 0.13 H new ATOM 0 HB2 ASN A 521 -3.475 15.652 2.480 1.00 3.45 H new ATOM 0 HB3 ASN A 521 -3.749 15.466 4.201 1.00 3.45 H new ATOM 0 HD21 ASN A 521 -1.224 15.348 2.463 1.00 74.11 H new ATOM 0 HD22 ASN A 521 -0.452 13.863 3.029 1.00 74.11 H new ATOM 1374 N THR A 522 -7.282 14.225 3.008 1.00 24.31 N ATOM 1375 CA THR A 522 -8.612 14.821 3.200 1.00 24.41 C ATOM 1376 C THR A 522 -8.964 14.950 4.686 1.00 21.44 C ATOM 1377 O THR A 522 -10.004 15.508 5.049 1.00 53.23 O ATOM 1378 CB THR A 522 -9.703 13.970 2.512 1.00 51.34 C ATOM 1379 OG1 THR A 522 -9.748 12.665 3.106 1.00 63.03 O ATOM 1380 CG2 THR A 522 -9.438 13.837 1.017 1.00 42.41 C ATOM 0 H THR A 522 -7.307 13.262 2.673 1.00 24.31 H new ATOM 0 HA THR A 522 -8.577 15.814 2.752 1.00 24.41 H new ATOM 0 HB THR A 522 -10.660 14.473 2.649 1.00 51.34 H new ATOM 0 HG1 THR A 522 -8.864 12.436 3.461 1.00 63.03 H new ATOM 0 HG21 THR A 522 -10.222 13.233 0.561 1.00 42.41 H new ATOM 0 HG22 THR A 522 -9.429 14.826 0.560 1.00 42.41 H new ATOM 0 HG23 THR A 522 -8.472 13.356 0.860 1.00 42.41 H new ATOM 1388 N VAL A 523 -8.106 14.408 5.542 1.00 0.54 N ATOM 1389 CA VAL A 523 -8.275 14.510 6.990 1.00 72.41 C ATOM 1390 C VAL A 523 -6.947 14.889 7.673 1.00 63.14 C ATOM 1391 O VAL A 523 -5.874 14.459 7.247 1.00 22.45 O ATOM 1392 CB VAL A 523 -8.821 13.186 7.586 1.00 33.11 C ATOM 1393 CG1 VAL A 523 -7.822 12.040 7.407 1.00 2.13 C ATOM 1394 CG2 VAL A 523 -9.205 13.369 9.052 1.00 22.12 C ATOM 0 H VAL A 523 -7.277 13.887 5.256 1.00 0.54 H new ATOM 0 HA VAL A 523 -9.003 15.298 7.180 1.00 72.41 H new ATOM 0 HB VAL A 523 -9.723 12.917 7.036 1.00 33.11 H new ATOM 0 HG11 VAL A 523 -8.235 11.127 7.835 1.00 2.13 H new ATOM 0 HG12 VAL A 523 -7.629 11.888 6.345 1.00 2.13 H new ATOM 0 HG13 VAL A 523 -6.889 12.288 7.913 1.00 2.13 H new ATOM 0 HG21 VAL A 523 -9.585 12.428 9.449 1.00 22.12 H new ATOM 0 HG22 VAL A 523 -8.328 13.675 9.622 1.00 22.12 H new ATOM 0 HG23 VAL A 523 -9.976 14.135 9.133 1.00 22.12 H new ATOM 1404 N VAL A 524 -7.019 15.709 8.723 1.00 44.40 N ATOM 1405 CA VAL A 524 -5.812 16.169 9.424 1.00 14.51 C ATOM 1406 C VAL A 524 -5.317 15.109 10.423 1.00 2.12 C ATOM 1407 O VAL A 524 -5.944 14.868 11.456 1.00 71.30 O ATOM 1408 CB VAL A 524 -6.070 17.503 10.171 1.00 22.40 C ATOM 1409 CG1 VAL A 524 -4.792 18.012 10.840 1.00 74.45 C ATOM 1410 CG2 VAL A 524 -6.646 18.553 9.218 1.00 74.33 C ATOM 0 H VAL A 524 -7.893 16.068 9.107 1.00 44.40 H new ATOM 0 HA VAL A 524 -5.043 16.333 8.669 1.00 14.51 H new ATOM 0 HB VAL A 524 -6.805 17.317 10.954 1.00 22.40 H new ATOM 0 HG11 VAL A 524 -5.000 18.949 11.357 1.00 74.45 H new ATOM 0 HG12 VAL A 524 -4.438 17.272 11.558 1.00 74.45 H new ATOM 0 HG13 VAL A 524 -4.026 18.178 10.082 1.00 74.45 H new ATOM 0 HG21 VAL A 524 -6.820 19.482 9.762 1.00 74.33 H new ATOM 0 HG22 VAL A 524 -5.941 18.734 8.407 1.00 74.33 H new ATOM 0 HG23 VAL A 524 -7.588 18.192 8.806 1.00 74.33 H new ATOM 1420 N GLU A 525 -4.184 14.488 10.103 1.00 23.44 N ATOM 1421 CA GLU A 525 -3.633 13.383 10.901 1.00 14.21 C ATOM 1422 C GLU A 525 -2.527 13.855 11.858 1.00 75.13 C ATOM 1423 O GLU A 525 -2.150 15.028 11.871 1.00 40.53 O ATOM 1424 CB GLU A 525 -3.075 12.305 9.964 1.00 4.22 C ATOM 1425 CG GLU A 525 -4.113 11.720 9.013 1.00 4.02 C ATOM 1426 CD GLU A 525 -3.492 10.819 7.961 1.00 30.31 C ATOM 1427 OE1 GLU A 525 -3.110 11.337 6.885 1.00 45.21 O ATOM 1428 OE2 GLU A 525 -3.373 9.600 8.211 1.00 34.44 O ATOM 0 H GLU A 525 -3.621 14.731 9.288 1.00 23.44 H new ATOM 0 HA GLU A 525 -4.442 12.977 11.508 1.00 14.21 H new ATOM 0 HB2 GLU A 525 -2.260 12.731 9.380 1.00 4.22 H new ATOM 0 HB3 GLU A 525 -2.650 11.500 10.564 1.00 4.22 H new ATOM 0 HG2 GLU A 525 -4.847 11.153 9.585 1.00 4.02 H new ATOM 0 HG3 GLU A 525 -4.650 12.532 8.521 1.00 4.02 H new ATOM 1435 N LEU A 526 -2.013 12.929 12.665 1.00 44.13 N ATOM 1436 CA LEU A 526 -0.921 13.227 13.601 1.00 11.23 C ATOM 1437 C LEU A 526 0.465 13.095 12.940 1.00 42.41 C ATOM 1438 O LEU A 526 1.363 13.894 13.202 1.00 60.03 O ATOM 1439 CB LEU A 526 -1.005 12.291 14.815 1.00 60.53 C ATOM 1440 CG LEU A 526 -2.249 12.477 15.699 1.00 12.34 C ATOM 1441 CD1 LEU A 526 -2.300 11.412 16.792 1.00 41.31 C ATOM 1442 CD2 LEU A 526 -2.271 13.881 16.306 1.00 53.23 C ATOM 0 H LEU A 526 -2.334 11.961 12.692 1.00 44.13 H new ATOM 0 HA LEU A 526 -1.038 14.263 13.919 1.00 11.23 H new ATOM 0 HB2 LEU A 526 -0.981 11.260 14.461 1.00 60.53 H new ATOM 0 HB3 LEU A 526 -0.117 12.438 15.429 1.00 60.53 H new ATOM 0 HG LEU A 526 -3.134 12.361 15.074 1.00 12.34 H new ATOM 0 HD11 LEU A 526 -3.188 11.563 17.406 1.00 41.31 H new ATOM 0 HD12 LEU A 526 -2.338 10.423 16.335 1.00 41.31 H new ATOM 0 HD13 LEU A 526 -1.410 11.489 17.417 1.00 41.31 H new ATOM 0 HD21 LEU A 526 -3.159 13.994 16.929 1.00 53.23 H new ATOM 0 HD22 LEU A 526 -1.379 14.028 16.915 1.00 53.23 H new ATOM 0 HD23 LEU A 526 -2.291 14.622 15.507 1.00 53.23 H new ATOM 1454 N ASN A 527 0.632 12.094 12.080 1.00 54.15 N ATOM 1455 CA ASN A 527 1.934 11.815 11.460 1.00 5.11 C ATOM 1456 C ASN A 527 1.788 11.379 9.993 1.00 53.25 C ATOM 1457 O ASN A 527 1.168 10.364 9.702 1.00 63.33 O ATOM 1458 CB ASN A 527 2.661 10.736 12.271 1.00 3.34 C ATOM 1459 CG ASN A 527 3.941 10.256 11.613 1.00 51.03 C ATOM 1460 OD1 ASN A 527 3.844 9.194 10.841 1.00 64.30 O flip ATOM 1461 ND2 ASN A 527 5.006 10.830 11.794 1.00 75.34 N flip ATOM 0 H ASN A 527 -0.114 11.460 11.794 1.00 54.15 H new ATOM 0 HA ASN A 527 2.519 12.735 11.464 1.00 5.11 H new ATOM 0 HB2 ASN A 527 2.894 11.129 13.261 1.00 3.34 H new ATOM 0 HB3 ASN A 527 1.993 9.887 12.415 1.00 3.34 H new ATOM 0 HD21 ASN A 527 5.047 11.651 12.398 1.00 75.34 H new ATOM 0 HD22 ASN A 527 5.853 10.488 11.340 1.00 75.34 H new ATOM 1468 N GLU A 528 2.393 12.143 9.081 1.00 12.25 N ATOM 1469 CA GLU A 528 2.308 11.861 7.636 1.00 1.24 C ATOM 1470 C GLU A 528 3.490 11.003 7.135 1.00 34.32 C ATOM 1471 O GLU A 528 3.716 10.879 5.927 1.00 0.51 O ATOM 1472 CB GLU A 528 2.265 13.178 6.850 1.00 43.20 C ATOM 1473 CG GLU A 528 3.520 14.032 7.016 1.00 63.14 C ATOM 1474 CD GLU A 528 3.519 15.263 6.124 1.00 55.12 C ATOM 1475 OE1 GLU A 528 3.864 15.135 4.928 1.00 11.13 O ATOM 1476 OE2 GLU A 528 3.182 16.364 6.612 1.00 32.31 O ATOM 0 H GLU A 528 2.950 12.965 9.313 1.00 12.25 H new ATOM 0 HA GLU A 528 1.393 11.292 7.471 1.00 1.24 H new ATOM 0 HB2 GLU A 528 2.125 12.955 5.792 1.00 43.20 H new ATOM 0 HB3 GLU A 528 1.398 13.755 7.172 1.00 43.20 H new ATOM 0 HG2 GLU A 528 3.606 14.344 8.057 1.00 63.14 H new ATOM 0 HG3 GLU A 528 4.398 13.427 6.791 1.00 63.14 H new ATOM 1483 N ASN A 529 4.235 10.400 8.060 1.00 62.00 N ATOM 1484 CA ASN A 529 5.434 9.624 7.704 1.00 61.51 C ATOM 1485 C ASN A 529 5.117 8.140 7.455 1.00 13.54 C ATOM 1486 O ASN A 529 5.819 7.462 6.705 1.00 34.25 O ATOM 1487 CB ASN A 529 6.486 9.751 8.814 1.00 51.22 C ATOM 1488 CG ASN A 529 6.885 11.192 9.068 1.00 11.30 C ATOM 1489 OD1 ASN A 529 7.269 11.498 10.289 1.00 31.01 O flip ATOM 1490 ND2 ASN A 529 6.843 12.026 8.175 1.00 31.44 N flip ATOM 0 H ASN A 529 4.035 10.430 9.060 1.00 62.00 H new ATOM 0 HA ASN A 529 5.823 10.036 6.773 1.00 61.51 H new ATOM 0 HB2 ASN A 529 6.094 9.317 9.734 1.00 51.22 H new ATOM 0 HB3 ASN A 529 7.370 9.174 8.541 1.00 51.22 H new ATOM 0 HD21 ASN A 529 6.541 11.756 7.239 1.00 31.44 H new ATOM 0 HD22 ASN A 529 7.110 12.992 8.366 1.00 31.44 H new ATOM 1497 N ASN A 530 4.050 7.641 8.076 1.00 1.21 N ATOM 1498 CA ASN A 530 3.696 6.213 7.991 1.00 5.14 C ATOM 1499 C ASN A 530 2.612 5.950 6.928 1.00 70.33 C ATOM 1500 O ASN A 530 2.265 4.798 6.655 1.00 41.11 O ATOM 1501 CB ASN A 530 3.248 5.698 9.370 1.00 14.30 C ATOM 1502 CG ASN A 530 2.113 6.513 9.965 1.00 61.44 C ATOM 1503 OD1 ASN A 530 1.950 7.682 9.650 1.00 42.30 O ATOM 1504 ND2 ASN A 530 1.349 5.917 10.856 1.00 41.01 N ATOM 0 H ASN A 530 3.412 8.198 8.644 1.00 1.21 H new ATOM 0 HA ASN A 530 4.586 5.666 7.680 1.00 5.14 H new ATOM 0 HB2 ASN A 530 2.933 4.658 9.279 1.00 14.30 H new ATOM 0 HB3 ASN A 530 4.098 5.715 10.052 1.00 14.30 H new ATOM 0 HD21 ASN A 530 0.593 6.433 11.307 1.00 41.01 H new ATOM 0 HD22 ASN A 530 1.513 4.939 11.096 1.00 41.01 H new ATOM 1511 N ASN A 531 2.087 7.022 6.331 1.00 31.41 N ATOM 1512 CA ASN A 531 1.087 6.918 5.258 1.00 23.32 C ATOM 1513 C ASN A 531 1.645 6.204 4.012 1.00 72.11 C ATOM 1514 O ASN A 531 0.889 5.641 3.218 1.00 51.23 O ATOM 1515 CB ASN A 531 0.599 8.318 4.862 1.00 0.03 C ATOM 1516 CG ASN A 531 -0.113 9.026 5.998 1.00 71.35 C ATOM 1517 OD1 ASN A 531 0.524 9.577 6.882 1.00 71.02 O ATOM 1518 ND2 ASN A 531 -1.431 9.045 5.959 1.00 42.51 N ATOM 0 H ASN A 531 2.338 7.981 6.573 1.00 31.41 H new ATOM 0 HA ASN A 531 0.259 6.324 5.644 1.00 23.32 H new ATOM 0 HB2 ASN A 531 1.450 8.918 4.540 1.00 0.03 H new ATOM 0 HB3 ASN A 531 -0.075 8.237 4.009 1.00 0.03 H new ATOM 0 HD21 ASN A 531 -1.956 9.533 6.685 1.00 42.51 H new ATOM 0 HD22 ASN A 531 -1.926 8.572 5.203 1.00 42.51 H new ATOM 1525 N VAL A 532 2.966 6.242 3.839 1.00 21.22 N ATOM 1526 CA VAL A 532 3.614 5.657 2.657 1.00 63.11 C ATOM 1527 C VAL A 532 4.528 4.479 3.034 1.00 31.42 C ATOM 1528 O VAL A 532 5.272 4.545 4.011 1.00 64.14 O ATOM 1529 CB VAL A 532 4.458 6.719 1.897 1.00 20.13 C ATOM 1530 CG1 VAL A 532 5.070 6.127 0.624 1.00 33.24 C ATOM 1531 CG2 VAL A 532 3.618 7.958 1.579 1.00 51.13 C ATOM 0 H VAL A 532 3.612 6.671 4.501 1.00 21.22 H new ATOM 0 HA VAL A 532 2.813 5.295 2.012 1.00 63.11 H new ATOM 0 HB VAL A 532 5.277 7.026 2.548 1.00 20.13 H new ATOM 0 HG11 VAL A 532 5.655 6.891 0.112 1.00 33.24 H new ATOM 0 HG12 VAL A 532 5.717 5.290 0.887 1.00 33.24 H new ATOM 0 HG13 VAL A 532 4.274 5.778 -0.034 1.00 33.24 H new ATOM 0 HG21 VAL A 532 4.231 8.686 1.047 1.00 51.13 H new ATOM 0 HG22 VAL A 532 2.770 7.673 0.956 1.00 51.13 H new ATOM 0 HG23 VAL A 532 3.254 8.399 2.507 1.00 51.13 H new ATOM 1541 N ALA A 533 4.469 3.406 2.246 1.00 65.13 N ATOM 1542 CA ALA A 533 5.354 2.248 2.431 1.00 62.24 C ATOM 1543 C ALA A 533 6.070 1.891 1.119 1.00 21.34 C ATOM 1544 O ALA A 533 5.430 1.724 0.078 1.00 32.30 O ATOM 1545 CB ALA A 533 4.566 1.048 2.944 1.00 63.41 C ATOM 0 H ALA A 533 3.815 3.311 1.469 1.00 65.13 H new ATOM 0 HA ALA A 533 6.107 2.515 3.172 1.00 62.24 H new ATOM 0 HB1 ALA A 533 5.238 0.200 3.075 1.00 63.41 H new ATOM 0 HB2 ALA A 533 4.106 1.297 3.900 1.00 63.41 H new ATOM 0 HB3 ALA A 533 3.790 0.788 2.224 1.00 63.41 H new ATOM 1551 N THR A 534 7.395 1.788 1.170 1.00 24.44 N ATOM 1552 CA THR A 534 8.204 1.471 -0.018 1.00 45.20 C ATOM 1553 C THR A 534 8.715 0.023 0.015 1.00 32.14 C ATOM 1554 O THR A 534 9.235 -0.441 1.032 1.00 52.01 O ATOM 1555 CB THR A 534 9.419 2.425 -0.140 1.00 3.44 C ATOM 1556 OG1 THR A 534 8.973 3.794 -0.150 1.00 60.43 O ATOM 1557 CG2 THR A 534 10.224 2.145 -1.408 1.00 12.20 C ATOM 0 H THR A 534 7.940 1.919 2.022 1.00 24.44 H new ATOM 0 HA THR A 534 7.551 1.600 -0.881 1.00 45.20 H new ATOM 0 HB THR A 534 10.064 2.252 0.722 1.00 3.44 H new ATOM 0 HG1 THR A 534 9.747 4.390 -0.226 1.00 60.43 H new ATOM 0 HG21 THR A 534 11.069 2.832 -1.462 1.00 12.20 H new ATOM 0 HG22 THR A 534 10.591 1.119 -1.387 1.00 12.20 H new ATOM 0 HG23 THR A 534 9.587 2.284 -2.282 1.00 12.20 H new ATOM 1565 N PHE A 535 8.567 -0.688 -1.103 1.00 14.14 N ATOM 1566 CA PHE A 535 9.047 -2.070 -1.218 1.00 64.52 C ATOM 1567 C PHE A 535 9.678 -2.316 -2.599 1.00 32.04 C ATOM 1568 O PHE A 535 9.006 -2.218 -3.624 1.00 63.04 O ATOM 1569 CB PHE A 535 7.883 -3.042 -0.981 1.00 70.32 C ATOM 1570 CG PHE A 535 8.293 -4.492 -0.867 1.00 25.54 C ATOM 1571 CD1 PHE A 535 8.805 -4.988 0.326 1.00 60.00 C ATOM 1572 CD2 PHE A 535 8.163 -5.358 -1.943 1.00 64.34 C ATOM 1573 CE1 PHE A 535 9.175 -6.315 0.440 1.00 4.41 C ATOM 1574 CE2 PHE A 535 8.531 -6.687 -1.831 1.00 62.14 C ATOM 1575 CZ PHE A 535 9.038 -7.165 -0.639 1.00 14.31 C ATOM 0 H PHE A 535 8.117 -0.330 -1.946 1.00 14.14 H new ATOM 0 HA PHE A 535 9.814 -2.239 -0.462 1.00 64.52 H new ATOM 0 HB2 PHE A 535 7.363 -2.751 -0.068 1.00 70.32 H new ATOM 0 HB3 PHE A 535 7.170 -2.942 -1.799 1.00 70.32 H new ATOM 0 HD1 PHE A 535 8.915 -4.329 1.174 1.00 60.00 H new ATOM 0 HD2 PHE A 535 7.770 -4.990 -2.879 1.00 64.34 H new ATOM 0 HE1 PHE A 535 9.571 -6.687 1.373 1.00 4.41 H new ATOM 0 HE2 PHE A 535 8.422 -7.351 -2.676 1.00 62.14 H new ATOM 0 HZ PHE A 535 9.327 -8.202 -0.551 1.00 14.31 H new ATOM 1585 N ASP A 536 10.971 -2.632 -2.619 1.00 50.11 N ATOM 1586 CA ASP A 536 11.697 -2.870 -3.875 1.00 25.41 C ATOM 1587 C ASP A 536 11.726 -4.363 -4.248 1.00 44.30 C ATOM 1588 O ASP A 536 12.125 -5.210 -3.446 1.00 54.34 O ATOM 1589 CB ASP A 536 13.129 -2.327 -3.768 1.00 31.42 C ATOM 1590 CG ASP A 536 13.178 -0.808 -3.752 1.00 32.13 C ATOM 1591 OD1 ASP A 536 12.579 -0.193 -2.847 1.00 50.54 O ATOM 1592 OD2 ASP A 536 13.823 -0.218 -4.645 1.00 64.22 O ATOM 0 H ASP A 536 11.543 -2.731 -1.780 1.00 50.11 H new ATOM 0 HA ASP A 536 11.165 -2.342 -4.667 1.00 25.41 H new ATOM 0 HB2 ASP A 536 13.593 -2.711 -2.859 1.00 31.42 H new ATOM 0 HB3 ASP A 536 13.718 -2.697 -4.607 1.00 31.42 H new ATOM 1597 N VAL A 537 11.308 -4.669 -5.476 1.00 2.22 N ATOM 1598 CA VAL A 537 11.300 -6.047 -5.987 1.00 32.45 C ATOM 1599 C VAL A 537 12.320 -6.225 -7.128 1.00 1.22 C ATOM 1600 O VAL A 537 12.445 -5.367 -8.003 1.00 34.12 O ATOM 1601 CB VAL A 537 9.892 -6.442 -6.509 1.00 34.24 C ATOM 1602 CG1 VAL A 537 9.866 -7.897 -6.980 1.00 44.52 C ATOM 1603 CG2 VAL A 537 8.829 -6.196 -5.439 1.00 22.44 C ATOM 0 H VAL A 537 10.967 -3.977 -6.143 1.00 2.22 H new ATOM 0 HA VAL A 537 11.573 -6.695 -5.154 1.00 32.45 H new ATOM 0 HB VAL A 537 9.663 -5.810 -7.367 1.00 34.24 H new ATOM 0 HG11 VAL A 537 8.868 -8.145 -7.340 1.00 44.52 H new ATOM 0 HG12 VAL A 537 10.586 -8.031 -7.787 1.00 44.52 H new ATOM 0 HG13 VAL A 537 10.126 -8.553 -6.149 1.00 44.52 H new ATOM 0 HG21 VAL A 537 7.850 -6.480 -5.826 1.00 22.44 H new ATOM 0 HG22 VAL A 537 9.057 -6.793 -4.556 1.00 22.44 H new ATOM 0 HG23 VAL A 537 8.821 -5.140 -5.171 1.00 22.44 H new ATOM 1613 N SER A 538 13.047 -7.340 -7.111 1.00 22.25 N ATOM 1614 CA SER A 538 14.009 -7.665 -8.177 1.00 72.32 C ATOM 1615 C SER A 538 13.486 -8.802 -9.061 1.00 61.22 C ATOM 1616 O SER A 538 13.175 -9.891 -8.572 1.00 42.33 O ATOM 1617 CB SER A 538 15.368 -8.059 -7.578 1.00 34.22 C ATOM 1618 OG SER A 538 16.308 -8.379 -8.594 1.00 21.02 O ATOM 0 H SER A 538 12.992 -8.040 -6.371 1.00 22.25 H new ATOM 0 HA SER A 538 14.135 -6.774 -8.792 1.00 72.32 H new ATOM 0 HB2 SER A 538 15.751 -7.239 -6.971 1.00 34.22 H new ATOM 0 HB3 SER A 538 15.241 -8.915 -6.915 1.00 34.22 H new ATOM 0 HG SER A 538 17.163 -8.624 -8.183 1.00 21.02 H new ATOM 1624 N VAL A 539 13.371 -8.543 -10.363 1.00 1.05 N ATOM 1625 CA VAL A 539 12.885 -9.551 -11.313 1.00 50.21 C ATOM 1626 C VAL A 539 14.024 -10.071 -12.208 1.00 14.42 C ATOM 1627 O VAL A 539 14.771 -9.292 -12.806 1.00 44.21 O ATOM 1628 CB VAL A 539 11.745 -8.992 -12.203 1.00 52.24 C ATOM 1629 CG1 VAL A 539 11.169 -10.088 -13.101 1.00 42.23 C ATOM 1630 CG2 VAL A 539 10.648 -8.359 -11.344 1.00 54.10 C ATOM 0 H VAL A 539 13.607 -7.646 -10.787 1.00 1.05 H new ATOM 0 HA VAL A 539 12.493 -10.378 -10.720 1.00 50.21 H new ATOM 0 HB VAL A 539 12.164 -8.216 -12.844 1.00 52.24 H new ATOM 0 HG11 VAL A 539 10.371 -9.672 -13.716 1.00 42.23 H new ATOM 0 HG12 VAL A 539 11.956 -10.482 -13.745 1.00 42.23 H new ATOM 0 HG13 VAL A 539 10.769 -10.892 -12.483 1.00 42.23 H new ATOM 0 HG21 VAL A 539 9.858 -7.973 -11.989 1.00 54.10 H new ATOM 0 HG22 VAL A 539 10.233 -9.110 -10.672 1.00 54.10 H new ATOM 0 HG23 VAL A 539 11.070 -7.542 -10.759 1.00 54.10 H new ATOM 1640 N VAL A 540 14.146 -11.394 -12.303 1.00 13.40 N ATOM 1641 CA VAL A 540 15.221 -12.031 -13.077 1.00 10.32 C ATOM 1642 C VAL A 540 14.678 -13.021 -14.124 1.00 63.00 C ATOM 1643 O VAL A 540 13.532 -13.457 -14.052 1.00 23.32 O ATOM 1644 CB VAL A 540 16.209 -12.770 -12.139 1.00 65.00 C ATOM 1645 CG1 VAL A 540 16.977 -11.774 -11.269 1.00 3.25 C ATOM 1646 CG2 VAL A 540 15.468 -13.792 -11.273 1.00 23.11 C ATOM 0 H VAL A 540 13.511 -12.053 -11.852 1.00 13.40 H new ATOM 0 HA VAL A 540 15.741 -11.231 -13.604 1.00 10.32 H new ATOM 0 HB VAL A 540 16.930 -13.306 -12.756 1.00 65.00 H new ATOM 0 HG11 VAL A 540 17.665 -12.314 -10.618 1.00 3.25 H new ATOM 0 HG12 VAL A 540 17.540 -11.093 -11.907 1.00 3.25 H new ATOM 0 HG13 VAL A 540 16.274 -11.204 -10.661 1.00 3.25 H new ATOM 0 HG21 VAL A 540 16.179 -14.300 -10.621 1.00 23.11 H new ATOM 0 HG22 VAL A 540 14.721 -13.281 -10.666 1.00 23.11 H new ATOM 0 HG23 VAL A 540 14.976 -14.524 -11.914 1.00 23.11 H new ATOM 1656 N LEU A 541 15.518 -13.376 -15.099 1.00 53.34 N ATOM 1657 CA LEU A 541 15.133 -14.315 -16.168 1.00 53.34 C ATOM 1658 C LEU A 541 15.113 -15.773 -15.675 1.00 74.41 C ATOM 1659 O LEU A 541 14.615 -16.669 -16.363 1.00 2.31 O ATOM 1660 CB LEU A 541 16.096 -14.186 -17.359 1.00 33.20 C ATOM 1661 CG LEU A 541 16.074 -12.828 -18.081 1.00 50.42 C ATOM 1662 CD1 LEU A 541 17.137 -12.784 -19.176 1.00 54.33 C ATOM 1663 CD2 LEU A 541 14.691 -12.545 -18.667 1.00 73.43 C ATOM 0 H LEU A 541 16.474 -13.029 -15.175 1.00 53.34 H new ATOM 0 HA LEU A 541 14.122 -14.054 -16.481 1.00 53.34 H new ATOM 0 HB2 LEU A 541 17.110 -14.375 -17.007 1.00 33.20 H new ATOM 0 HB3 LEU A 541 15.859 -14.967 -18.082 1.00 33.20 H new ATOM 0 HG LEU A 541 16.299 -12.052 -17.349 1.00 50.42 H new ATOM 0 HD11 LEU A 541 17.105 -11.815 -19.675 1.00 54.33 H new ATOM 0 HD12 LEU A 541 18.122 -12.932 -18.733 1.00 54.33 H new ATOM 0 HD13 LEU A 541 16.944 -13.573 -19.903 1.00 54.33 H new ATOM 0 HD21 LEU A 541 14.701 -11.579 -19.172 1.00 73.43 H new ATOM 0 HD22 LEU A 541 14.432 -13.326 -19.382 1.00 73.43 H new ATOM 0 HD23 LEU A 541 13.953 -12.528 -17.865 1.00 73.43 H new ATOM 1675 N GLU A 542 15.669 -16.003 -14.491 1.00 74.21 N ATOM 1676 CA GLU A 542 15.724 -17.345 -13.890 1.00 62.12 C ATOM 1677 C GLU A 542 14.566 -17.572 -12.888 1.00 74.22 C ATOM 1678 O GLU A 542 14.642 -17.074 -11.744 1.00 37.52 O ATOM 1679 CB GLU A 542 17.095 -17.564 -13.218 1.00 72.41 C ATOM 1680 CG GLU A 542 17.593 -16.365 -12.418 1.00 1.13 C ATOM 1681 CD GLU A 542 18.877 -16.649 -11.661 1.00 73.12 C ATOM 1682 OE1 GLU A 542 19.951 -16.678 -12.294 1.00 71.42 O ATOM 1683 OE2 GLU A 542 18.816 -16.839 -10.427 1.00 45.11 O ATOM 0 H GLU A 542 16.094 -15.274 -13.918 1.00 74.21 H new ATOM 0 HA GLU A 542 15.602 -18.080 -14.685 1.00 62.12 H new ATOM 0 HB2 GLU A 542 17.030 -18.427 -12.556 1.00 72.41 H new ATOM 0 HB3 GLU A 542 17.830 -17.806 -13.986 1.00 72.41 H new ATOM 0 HG2 GLU A 542 17.755 -15.526 -13.094 1.00 1.13 H new ATOM 0 HG3 GLU A 542 16.821 -16.061 -11.711 1.00 1.13 H new TER 1690 GLU A 542