USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 825 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 514 ASN : amide:sc= -0.542 K(o=-1.2,f=2.2) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= -0.619 USER MOD Set 2.1: A 506 THR OG1 : rot 69:sc= 1.21 USER MOD Set 2.2: A 507 GLN : amide:sc= 0.902 K(o=2.1,f=-0.49) USER MOD Set 3.1: A 478 TYR OH : rot -142:sc= 0.478 USER MOD Set 3.2: A 516 THR OG1 : rot 78:sc= -0.894 USER MOD Set 4.1: A 441 THR OG1 : rot 133:sc= 0.527 USER MOD Set 4.2: A 530 ASN : amide:sc= -2.08! C(o=-1.6!,f=-2.9!) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= 0 K(o=0,f=-2.7!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -140:sc= 0.46 USER MOD Single : A 461 HIS : no HE2:sc= 0.232 K(o=0.23,f=-3.4!) USER MOD Single : A 463 LYS NZ :NH3+ -140:sc= 0.447 (180deg=-1.62) USER MOD Single : A 464 ASN : amide:sc= 0.717 K(o=0.72,f=-9.3!) USER MOD Single : A 472 SER OG : rot 77:sc= 0.0412 USER MOD Single : A 473 THR OG1 : rot 100:sc=-0.00199 USER MOD Single : A 474 LYS NZ :NH3+ -164:sc= 1.15 (180deg=0.958) USER MOD Single : A 480 ASN : amide:sc= -0.528 K(o=-0.53,f=-5.8!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 74:sc= 0.694 USER MOD Single : A 485 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0725) 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+ -174:sc= 0 (180deg=-0.0341) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 38:sc= 0.17 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 510 MET CE :methyl -165:sc= -0.139 (180deg=-0.534) USER MOD Single : A 511 TYR OH : rot 180:sc= -0.211 USER MOD Single : A 521 ASN : amide:sc= -0.478 K(o=-0.48,f=-3.6!) USER MOD Single : A 522 THR OG1 : rot -128:sc= 0.167 USER MOD Single : A 527 ASN : amide:sc= -3.14! C(o=-3.1!,f=-16!) USER MOD Single : A 529 ASN : amide:sc= -0.377 X(o=-0.38,f=0) USER MOD Single : A 531 ASN : amide:sc= -0.998 K(o=-1,f=0) USER MOD Single : A 538 SER OG : rot 83:sc= 0.00165 USER MOD ----------------------------------------------------------------- ATOM 35 N PHE A 437 -7.618 13.353 16.253 1.00 25.23 N ATOM 36 CA PHE A 437 -7.078 13.299 14.889 1.00 32.01 C ATOM 37 C PHE A 437 -6.507 11.903 14.591 1.00 1.23 C ATOM 38 O PHE A 437 -5.810 11.319 15.422 1.00 4.12 O ATOM 39 CB PHE A 437 -5.997 14.371 14.692 1.00 23.12 C ATOM 40 CG PHE A 437 -6.504 15.783 14.858 1.00 25.01 C ATOM 41 CD1 PHE A 437 -7.090 16.456 13.793 1.00 44.33 C ATOM 42 CD2 PHE A 437 -6.391 16.438 16.077 1.00 2.21 C ATOM 43 CE1 PHE A 437 -7.554 17.749 13.944 1.00 31.13 C ATOM 44 CE2 PHE A 437 -6.854 17.730 16.230 1.00 53.14 C ATOM 45 CZ PHE A 437 -7.435 18.387 15.163 1.00 52.14 C ATOM 0 HA PHE A 437 -7.892 13.498 14.191 1.00 32.01 H new ATOM 0 HB2 PHE A 437 -5.192 14.197 15.406 1.00 23.12 H new ATOM 0 HB3 PHE A 437 -5.569 14.263 13.696 1.00 23.12 H new ATOM 0 HD1 PHE A 437 -7.184 15.963 12.837 1.00 44.33 H new ATOM 0 HD2 PHE A 437 -5.936 15.931 16.915 1.00 2.21 H new ATOM 0 HE1 PHE A 437 -8.010 18.260 13.109 1.00 31.13 H new ATOM 0 HE2 PHE A 437 -6.762 18.227 17.184 1.00 53.14 H new ATOM 0 HZ PHE A 437 -7.796 19.398 15.282 1.00 52.14 H new ATOM 55 N PRO A 438 -6.811 11.339 13.410 1.00 54.50 N ATOM 56 CA PRO A 438 -6.374 9.982 13.046 1.00 33.11 C ATOM 57 C PRO A 438 -4.898 9.885 12.629 1.00 34.12 C ATOM 58 O PRO A 438 -4.189 10.885 12.522 1.00 11.24 O ATOM 59 CB PRO A 438 -7.293 9.630 11.874 1.00 40.24 C ATOM 60 CG PRO A 438 -7.604 10.941 11.233 1.00 43.40 C ATOM 61 CD PRO A 438 -7.616 11.966 12.342 1.00 4.11 C ATOM 0 HA PRO A 438 -6.442 9.304 13.897 1.00 33.11 H new ATOM 0 HB2 PRO A 438 -6.802 8.953 11.175 1.00 40.24 H new ATOM 0 HB3 PRO A 438 -8.200 9.131 12.217 1.00 40.24 H new ATOM 0 HG2 PRO A 438 -6.857 11.192 10.480 1.00 43.40 H new ATOM 0 HG3 PRO A 438 -8.568 10.906 10.726 1.00 43.40 H new ATOM 0 HD2 PRO A 438 -7.182 12.912 12.017 1.00 4.11 H new ATOM 0 HD3 PRO A 438 -8.631 12.179 12.679 1.00 4.11 H new ATOM 69 N ASP A 439 -4.450 8.652 12.420 1.00 13.22 N ATOM 70 CA ASP A 439 -3.094 8.365 11.950 1.00 33.21 C ATOM 71 C ASP A 439 -3.142 7.135 11.030 1.00 71.04 C ATOM 72 O ASP A 439 -3.149 5.998 11.502 1.00 14.34 O ATOM 73 CB ASP A 439 -2.171 8.118 13.153 1.00 13.32 C ATOM 74 CG ASP A 439 -0.696 8.085 12.783 1.00 5.34 C ATOM 75 OD1 ASP A 439 -0.247 7.091 12.180 1.00 22.41 O ATOM 76 OD2 ASP A 439 0.023 9.049 13.120 1.00 75.21 O ATOM 0 H ASP A 439 -5.017 7.818 12.572 1.00 13.22 H new ATOM 0 HA ASP A 439 -2.699 9.212 11.390 1.00 33.21 H new ATOM 0 HB2 ASP A 439 -2.335 8.900 13.894 1.00 13.32 H new ATOM 0 HB3 ASP A 439 -2.442 7.172 13.622 1.00 13.32 H new ATOM 81 N LEU A 440 -3.234 7.364 9.727 1.00 4.15 N ATOM 82 CA LEU A 440 -3.452 6.277 8.768 1.00 73.41 C ATOM 83 C LEU A 440 -2.145 5.860 8.081 1.00 4.34 C ATOM 84 O LEU A 440 -1.489 6.666 7.420 1.00 41.34 O ATOM 85 CB LEU A 440 -4.494 6.714 7.728 1.00 72.55 C ATOM 86 CG LEU A 440 -5.845 7.162 8.316 1.00 52.33 C ATOM 87 CD1 LEU A 440 -6.751 7.725 7.227 1.00 41.32 C ATOM 88 CD2 LEU A 440 -6.532 6.006 9.045 1.00 24.21 C ATOM 0 H LEU A 440 -3.162 8.290 9.305 1.00 4.15 H new ATOM 0 HA LEU A 440 -3.823 5.408 9.311 1.00 73.41 H new ATOM 0 HB2 LEU A 440 -4.079 7.534 7.141 1.00 72.55 H new ATOM 0 HB3 LEU A 440 -4.669 5.887 7.040 1.00 72.55 H new ATOM 0 HG LEU A 440 -5.651 7.953 9.040 1.00 52.33 H new ATOM 0 HD11 LEU A 440 -7.699 8.035 7.667 1.00 41.32 H new ATOM 0 HD12 LEU A 440 -6.269 8.585 6.761 1.00 41.32 H new ATOM 0 HD13 LEU A 440 -6.933 6.959 6.473 1.00 41.32 H new ATOM 0 HD21 LEU A 440 -7.484 6.347 9.452 1.00 24.21 H new ATOM 0 HD22 LEU A 440 -6.708 5.188 8.346 1.00 24.21 H new ATOM 0 HD23 LEU A 440 -5.894 5.658 9.858 1.00 24.21 H new ATOM 100 N THR A 441 -1.766 4.591 8.233 1.00 43.43 N ATOM 101 CA THR A 441 -0.510 4.093 7.657 1.00 11.33 C ATOM 102 C THR A 441 -0.710 2.810 6.842 1.00 12.02 C ATOM 103 O THR A 441 -1.696 2.089 7.013 1.00 34.13 O ATOM 104 CB THR A 441 0.554 3.830 8.747 1.00 54.12 C ATOM 105 OG1 THR A 441 1.803 3.455 8.145 1.00 33.24 O ATOM 106 CG2 THR A 441 0.106 2.743 9.717 1.00 33.21 C ATOM 0 H THR A 441 -2.303 3.892 8.745 1.00 43.43 H new ATOM 0 HA THR A 441 -0.160 4.881 6.990 1.00 11.33 H new ATOM 0 HB THR A 441 0.684 4.755 9.308 1.00 54.12 H new ATOM 0 HG1 THR A 441 2.530 3.972 8.550 1.00 33.24 H new ATOM 0 HG21 THR A 441 0.879 2.585 10.469 1.00 33.21 H new ATOM 0 HG22 THR A 441 -0.819 3.050 10.206 1.00 33.21 H new ATOM 0 HG23 THR A 441 -0.063 1.815 9.171 1.00 33.21 H new ATOM 114 N VAL A 442 0.246 2.530 5.960 1.00 25.34 N ATOM 115 CA VAL A 442 0.186 1.358 5.083 1.00 74.54 C ATOM 116 C VAL A 442 1.415 0.451 5.270 1.00 55.31 C ATOM 117 O VAL A 442 2.511 0.923 5.577 1.00 42.42 O ATOM 118 CB VAL A 442 0.092 1.785 3.594 1.00 72.11 C ATOM 119 CG1 VAL A 442 -1.214 2.524 3.319 1.00 74.04 C ATOM 120 CG2 VAL A 442 1.287 2.652 3.206 1.00 55.14 C ATOM 0 H VAL A 442 1.080 3.103 5.831 1.00 25.34 H new ATOM 0 HA VAL A 442 -0.709 0.800 5.358 1.00 74.54 H new ATOM 0 HB VAL A 442 0.107 0.882 2.984 1.00 72.11 H new ATOM 0 HG11 VAL A 442 -1.255 2.812 2.269 1.00 74.04 H new ATOM 0 HG12 VAL A 442 -2.057 1.872 3.549 1.00 74.04 H new ATOM 0 HG13 VAL A 442 -1.265 3.417 3.942 1.00 74.04 H new ATOM 0 HG21 VAL A 442 1.202 2.941 2.158 1.00 55.14 H new ATOM 0 HG22 VAL A 442 1.305 3.546 3.829 1.00 55.14 H new ATOM 0 HG23 VAL A 442 2.208 2.089 3.354 1.00 55.14 H new ATOM 130 N GLU A 443 1.222 -0.852 5.086 1.00 25.23 N ATOM 131 CA GLU A 443 2.308 -1.834 5.196 1.00 74.30 C ATOM 132 C GLU A 443 2.287 -2.787 3.991 1.00 13.02 C ATOM 133 O GLU A 443 1.223 -3.246 3.578 1.00 63.34 O ATOM 134 CB GLU A 443 2.158 -2.637 6.499 1.00 61.42 C ATOM 135 CG GLU A 443 2.048 -1.768 7.751 1.00 64.11 C ATOM 136 CD GLU A 443 1.653 -2.559 8.989 1.00 31.01 C ATOM 137 OE1 GLU A 443 0.612 -3.244 8.955 1.00 72.20 O ATOM 138 OE2 GLU A 443 2.378 -2.504 10.006 1.00 43.54 O ATOM 0 H GLU A 443 0.316 -1.260 4.858 1.00 25.23 H new ATOM 0 HA GLU A 443 3.260 -1.304 5.209 1.00 74.30 H new ATOM 0 HB2 GLU A 443 1.271 -3.267 6.426 1.00 61.42 H new ATOM 0 HB3 GLU A 443 3.014 -3.303 6.605 1.00 61.42 H new ATOM 0 HG2 GLU A 443 3.004 -1.276 7.930 1.00 64.11 H new ATOM 0 HG3 GLU A 443 1.312 -0.982 7.578 1.00 64.11 H new ATOM 145 N ILE A 444 3.455 -3.085 3.427 1.00 43.14 N ATOM 146 CA ILE A 444 3.538 -3.956 2.240 1.00 20.44 C ATOM 147 C ILE A 444 4.231 -5.292 2.559 1.00 42.43 C ATOM 148 O ILE A 444 5.342 -5.318 3.090 1.00 23.25 O ATOM 149 CB ILE A 444 4.291 -3.265 1.074 1.00 61.02 C ATOM 150 CG1 ILE A 444 3.656 -1.902 0.754 1.00 61.13 C ATOM 151 CG2 ILE A 444 4.294 -4.164 -0.168 1.00 62.34 C ATOM 152 CD1 ILE A 444 4.374 -1.133 -0.338 1.00 53.22 C ATOM 0 H ILE A 444 4.355 -2.743 3.764 1.00 43.14 H new ATOM 0 HA ILE A 444 2.510 -4.152 1.936 1.00 20.44 H new ATOM 0 HB ILE A 444 5.324 -3.098 1.381 1.00 61.02 H new ATOM 0 HG12 ILE A 444 2.619 -2.056 0.455 1.00 61.13 H new ATOM 0 HG13 ILE A 444 3.640 -1.297 1.661 1.00 61.13 H new ATOM 0 HG21 ILE A 444 4.826 -3.664 -0.977 1.00 62.34 H new ATOM 0 HG22 ILE A 444 4.790 -5.106 0.066 1.00 62.34 H new ATOM 0 HG23 ILE A 444 3.267 -4.362 -0.477 1.00 62.34 H new ATOM 0 HD11 ILE A 444 3.867 -0.183 -0.507 1.00 53.22 H new ATOM 0 HD12 ILE A 444 5.404 -0.946 -0.034 1.00 53.22 H new ATOM 0 HD13 ILE A 444 4.367 -1.717 -1.259 1.00 53.22 H new ATOM 164 N LYS A 445 3.565 -6.395 2.222 1.00 22.52 N ATOM 165 CA LYS A 445 4.112 -7.740 2.428 1.00 1.44 C ATOM 166 C LYS A 445 3.975 -8.575 1.144 1.00 60.45 C ATOM 167 O LYS A 445 3.001 -8.430 0.406 1.00 51.15 O ATOM 168 CB LYS A 445 3.381 -8.428 3.595 1.00 31.54 C ATOM 169 CG LYS A 445 3.991 -9.764 4.019 1.00 12.00 C ATOM 170 CD LYS A 445 5.416 -9.591 4.537 1.00 13.12 C ATOM 171 CE LYS A 445 6.012 -10.909 5.016 1.00 50.22 C ATOM 172 NZ LYS A 445 7.399 -10.734 5.525 1.00 52.35 N ATOM 0 H LYS A 445 2.636 -6.385 1.801 1.00 22.52 H new ATOM 0 HA LYS A 445 5.171 -7.658 2.674 1.00 1.44 H new ATOM 0 HB2 LYS A 445 3.377 -7.755 4.453 1.00 31.54 H new ATOM 0 HB3 LYS A 445 2.341 -8.590 3.312 1.00 31.54 H new ATOM 0 HG2 LYS A 445 3.374 -10.217 4.795 1.00 12.00 H new ATOM 0 HG3 LYS A 445 3.992 -10.450 3.172 1.00 12.00 H new ATOM 0 HD2 LYS A 445 6.041 -9.176 3.747 1.00 13.12 H new ATOM 0 HD3 LYS A 445 5.419 -8.872 5.356 1.00 13.12 H new ATOM 0 HE2 LYS A 445 5.385 -11.326 5.804 1.00 50.22 H new ATOM 0 HE3 LYS A 445 6.013 -11.627 4.196 1.00 50.22 H new ATOM 0 HZ1 LYS A 445 7.771 -11.652 5.842 1.00 52.35 H new ATOM 0 HZ2 LYS A 445 8.003 -10.359 4.766 1.00 52.35 H new ATOM 0 HZ3 LYS A 445 7.394 -10.068 6.324 1.00 52.35 H new ATOM 186 N GLY A 446 4.957 -9.428 0.865 1.00 31.40 N ATOM 187 CA GLY A 446 4.892 -10.276 -0.323 1.00 63.40 C ATOM 188 C GLY A 446 6.254 -10.814 -0.757 1.00 51.20 C ATOM 189 O GLY A 446 7.258 -10.585 -0.080 1.00 35.40 O ATOM 0 H GLY A 446 5.794 -9.550 1.434 1.00 31.40 H new ATOM 0 HA2 GLY A 446 4.224 -11.114 -0.126 1.00 63.40 H new ATOM 0 HA3 GLY A 446 4.456 -9.707 -1.144 1.00 63.40 H new ATOM 193 N PRO A 447 6.317 -11.547 -1.887 1.00 63.43 N ATOM 194 CA PRO A 447 7.580 -12.113 -2.406 1.00 61.15 C ATOM 195 C PRO A 447 8.569 -11.037 -2.897 1.00 53.13 C ATOM 196 O PRO A 447 8.306 -10.329 -3.869 1.00 71.12 O ATOM 197 CB PRO A 447 7.118 -13.005 -3.570 1.00 64.44 C ATOM 198 CG PRO A 447 5.808 -12.428 -3.994 1.00 15.04 C ATOM 199 CD PRO A 447 5.163 -11.899 -2.740 1.00 14.53 C ATOM 0 HA PRO A 447 8.129 -12.648 -1.631 1.00 61.15 H new ATOM 0 HB2 PRO A 447 7.839 -12.994 -4.388 1.00 64.44 H new ATOM 0 HB3 PRO A 447 7.010 -14.043 -3.255 1.00 64.44 H new ATOM 0 HG2 PRO A 447 5.950 -11.632 -4.725 1.00 15.04 H new ATOM 0 HG3 PRO A 447 5.182 -13.186 -4.465 1.00 15.04 H new ATOM 0 HD2 PRO A 447 4.535 -11.032 -2.945 1.00 14.53 H new ATOM 0 HD3 PRO A 447 4.527 -12.648 -2.268 1.00 14.53 H new ATOM 207 N ASP A 448 9.707 -10.930 -2.216 1.00 13.30 N ATOM 208 CA ASP A 448 10.742 -9.944 -2.558 1.00 51.22 C ATOM 209 C ASP A 448 11.542 -10.336 -3.821 1.00 54.42 C ATOM 210 O ASP A 448 12.264 -9.514 -4.392 1.00 64.25 O ATOM 211 CB ASP A 448 11.682 -9.758 -1.362 1.00 33.14 C ATOM 212 CG ASP A 448 12.156 -11.083 -0.791 1.00 44.44 C ATOM 213 OD1 ASP A 448 11.438 -11.661 0.053 1.00 72.31 O ATOM 214 OD2 ASP A 448 13.238 -11.561 -1.187 1.00 13.02 O ATOM 0 H ASP A 448 9.942 -11.518 -1.416 1.00 13.30 H new ATOM 0 HA ASP A 448 10.242 -9.003 -2.788 1.00 51.22 H new ATOM 0 HB2 ASP A 448 12.545 -9.168 -1.669 1.00 33.14 H new ATOM 0 HB3 ASP A 448 11.169 -9.192 -0.584 1.00 33.14 H new ATOM 219 N VAL A 449 11.422 -11.592 -4.248 1.00 1.50 N ATOM 220 CA VAL A 449 12.066 -12.066 -5.485 1.00 3.41 C ATOM 221 C VAL A 449 11.072 -12.859 -6.347 1.00 31.13 C ATOM 222 O VAL A 449 10.440 -13.802 -5.868 1.00 45.02 O ATOM 223 CB VAL A 449 13.305 -12.956 -5.193 1.00 11.12 C ATOM 224 CG1 VAL A 449 13.924 -13.477 -6.493 1.00 4.34 C ATOM 225 CG2 VAL A 449 14.345 -12.194 -4.373 1.00 34.51 C ATOM 0 H VAL A 449 10.884 -12.307 -3.758 1.00 1.50 H new ATOM 0 HA VAL A 449 12.397 -11.179 -6.025 1.00 3.41 H new ATOM 0 HB VAL A 449 12.969 -13.812 -4.608 1.00 11.12 H new ATOM 0 HG11 VAL A 449 14.790 -14.097 -6.261 1.00 4.34 H new ATOM 0 HG12 VAL A 449 13.187 -14.070 -7.035 1.00 4.34 H new ATOM 0 HG13 VAL A 449 14.236 -12.635 -7.110 1.00 4.34 H new ATOM 0 HG21 VAL A 449 15.202 -12.840 -4.182 1.00 34.51 H new ATOM 0 HG22 VAL A 449 14.670 -11.313 -4.926 1.00 34.51 H new ATOM 0 HG23 VAL A 449 13.905 -11.885 -3.425 1.00 34.51 H new ATOM 235 N VAL A 450 10.928 -12.467 -7.615 1.00 3.22 N ATOM 236 CA VAL A 450 10.013 -13.151 -8.539 1.00 24.40 C ATOM 237 C VAL A 450 10.658 -13.378 -9.919 1.00 40.31 C ATOM 238 O VAL A 450 11.654 -12.741 -10.273 1.00 73.10 O ATOM 239 CB VAL A 450 8.685 -12.364 -8.722 1.00 61.13 C ATOM 240 CG1 VAL A 450 7.938 -12.234 -7.395 1.00 23.01 C ATOM 241 CG2 VAL A 450 8.944 -10.991 -9.335 1.00 20.40 C ATOM 0 H VAL A 450 11.431 -11.681 -8.027 1.00 3.22 H new ATOM 0 HA VAL A 450 9.793 -14.118 -8.087 1.00 24.40 H new ATOM 0 HB VAL A 450 8.055 -12.928 -9.410 1.00 61.13 H new ATOM 0 HG11 VAL A 450 7.013 -11.679 -7.551 1.00 23.01 H new ATOM 0 HG12 VAL A 450 7.705 -13.227 -7.010 1.00 23.01 H new ATOM 0 HG13 VAL A 450 8.562 -11.703 -6.676 1.00 23.01 H new ATOM 0 HG21 VAL A 450 7.999 -10.461 -9.453 1.00 20.40 H new ATOM 0 HG22 VAL A 450 9.602 -10.419 -8.681 1.00 20.40 H new ATOM 0 HG23 VAL A 450 9.416 -11.111 -10.310 1.00 20.40 H new ATOM 251 N GLY A 451 10.078 -14.293 -10.693 1.00 44.21 N ATOM 252 CA GLY A 451 10.582 -14.580 -12.033 1.00 52.31 C ATOM 253 C GLY A 451 9.807 -13.853 -13.129 1.00 12.52 C ATOM 254 O GLY A 451 8.631 -13.521 -12.958 1.00 51.13 O ATOM 0 H GLY A 451 9.265 -14.844 -10.418 1.00 44.21 H new ATOM 0 HA2 GLY A 451 11.633 -14.296 -12.089 1.00 52.31 H new ATOM 0 HA3 GLY A 451 10.532 -15.654 -12.212 1.00 52.31 H new ATOM 258 N VAL A 452 10.464 -13.608 -14.259 1.00 72.44 N ATOM 259 CA VAL A 452 9.830 -12.928 -15.394 1.00 25.15 C ATOM 260 C VAL A 452 8.669 -13.761 -15.972 1.00 32.55 C ATOM 261 O VAL A 452 8.744 -14.991 -16.033 1.00 63.42 O ATOM 262 CB VAL A 452 10.865 -12.625 -16.512 1.00 40.41 C ATOM 263 CG1 VAL A 452 11.424 -13.915 -17.109 1.00 71.15 C ATOM 264 CG2 VAL A 452 10.256 -11.740 -17.598 1.00 62.41 C ATOM 0 H VAL A 452 11.437 -13.869 -14.417 1.00 72.44 H new ATOM 0 HA VAL A 452 9.428 -11.986 -15.020 1.00 25.15 H new ATOM 0 HB VAL A 452 11.693 -12.080 -16.059 1.00 40.41 H new ATOM 0 HG11 VAL A 452 12.146 -13.672 -17.889 1.00 71.15 H new ATOM 0 HG12 VAL A 452 11.915 -14.495 -16.327 1.00 71.15 H new ATOM 0 HG13 VAL A 452 10.610 -14.500 -17.537 1.00 71.15 H new ATOM 0 HG21 VAL A 452 11.002 -11.543 -18.368 1.00 62.41 H new ATOM 0 HG22 VAL A 452 9.400 -12.247 -18.043 1.00 62.41 H new ATOM 0 HG23 VAL A 452 9.931 -10.797 -17.159 1.00 62.41 H new ATOM 274 N ASN A 453 7.597 -13.077 -16.382 1.00 24.10 N ATOM 275 CA ASN A 453 6.401 -13.726 -16.953 1.00 11.54 C ATOM 276 C ASN A 453 5.657 -14.603 -15.929 1.00 14.44 C ATOM 277 O ASN A 453 4.778 -15.384 -16.299 1.00 74.51 O ATOM 278 CB ASN A 453 6.772 -14.565 -18.189 1.00 32.32 C ATOM 279 CG ASN A 453 7.215 -13.709 -19.363 1.00 75.21 C ATOM 280 OD1 ASN A 453 6.758 -12.587 -19.536 1.00 24.40 O ATOM 281 ND2 ASN A 453 8.095 -14.235 -20.186 1.00 23.44 N ATOM 0 H ASN A 453 7.528 -12.061 -16.330 1.00 24.10 H new ATOM 0 HA ASN A 453 5.725 -12.924 -17.249 1.00 11.54 H new ATOM 0 HB2 ASN A 453 7.572 -15.258 -17.927 1.00 32.32 H new ATOM 0 HB3 ASN A 453 5.913 -15.167 -18.486 1.00 32.32 H new ATOM 0 HD21 ASN A 453 8.416 -13.705 -20.996 1.00 23.44 H new ATOM 0 HD22 ASN A 453 8.457 -15.173 -20.014 1.00 23.44 H new ATOM 288 N LYS A 454 5.988 -14.459 -14.647 1.00 12.15 N ATOM 289 CA LYS A 454 5.345 -15.252 -13.586 1.00 61.15 C ATOM 290 C LYS A 454 4.342 -14.419 -12.775 1.00 0.44 C ATOM 291 O LYS A 454 4.364 -13.190 -12.809 1.00 23.44 O ATOM 292 CB LYS A 454 6.406 -15.851 -12.651 1.00 54.22 C ATOM 293 CG LYS A 454 7.403 -16.774 -13.352 1.00 0.32 C ATOM 294 CD LYS A 454 6.715 -17.936 -14.067 1.00 55.14 C ATOM 295 CE LYS A 454 5.877 -18.783 -13.112 1.00 21.24 C ATOM 296 NZ LYS A 454 5.289 -19.966 -13.789 1.00 14.53 N ATOM 0 H LYS A 454 6.695 -13.804 -14.313 1.00 12.15 H new ATOM 0 HA LYS A 454 4.793 -16.057 -14.071 1.00 61.15 H new ATOM 0 HB2 LYS A 454 6.953 -15.039 -12.172 1.00 54.22 H new ATOM 0 HB3 LYS A 454 5.905 -16.408 -11.860 1.00 54.22 H new ATOM 0 HG2 LYS A 454 7.982 -16.198 -14.074 1.00 0.32 H new ATOM 0 HG3 LYS A 454 8.108 -17.167 -12.619 1.00 0.32 H new ATOM 0 HD2 LYS A 454 6.077 -17.546 -14.860 1.00 55.14 H new ATOM 0 HD3 LYS A 454 7.467 -18.565 -14.543 1.00 55.14 H new ATOM 0 HE2 LYS A 454 6.499 -19.113 -12.280 1.00 21.24 H new ATOM 0 HE3 LYS A 454 5.079 -18.172 -12.691 1.00 21.24 H new ATOM 0 HZ1 LYS A 454 4.728 -20.514 -13.106 1.00 14.53 H new ATOM 0 HZ2 LYS A 454 4.675 -19.651 -14.567 1.00 14.53 H new ATOM 0 HZ3 LYS A 454 6.051 -20.563 -14.169 1.00 14.53 H new ATOM 310 N LEU A 455 3.461 -15.098 -12.044 1.00 73.21 N ATOM 311 CA LEU A 455 2.438 -14.423 -11.239 1.00 61.02 C ATOM 312 C LEU A 455 2.913 -14.194 -9.795 1.00 51.21 C ATOM 313 O LEU A 455 3.450 -15.101 -9.158 1.00 42.50 O ATOM 314 CB LEU A 455 1.146 -15.254 -11.223 1.00 24.22 C ATOM 315 CG LEU A 455 -0.040 -14.596 -10.504 1.00 63.52 C ATOM 316 CD1 LEU A 455 -0.439 -13.307 -11.215 1.00 25.11 C ATOM 317 CD2 LEU A 455 -1.221 -15.559 -10.412 1.00 11.21 C ATOM 0 H LEU A 455 3.433 -16.116 -11.991 1.00 73.21 H new ATOM 0 HA LEU A 455 2.249 -13.452 -11.696 1.00 61.02 H new ATOM 0 HB2 LEU A 455 0.855 -15.466 -12.252 1.00 24.22 H new ATOM 0 HB3 LEU A 455 1.354 -16.212 -10.747 1.00 24.22 H new ATOM 0 HG LEU A 455 0.265 -14.347 -9.488 1.00 63.52 H new ATOM 0 HD11 LEU A 455 -1.281 -12.850 -10.695 1.00 25.11 H new ATOM 0 HD12 LEU A 455 0.404 -12.616 -11.217 1.00 25.11 H new ATOM 0 HD13 LEU A 455 -0.726 -13.532 -12.242 1.00 25.11 H new ATOM 0 HD21 LEU A 455 -2.049 -15.071 -9.899 1.00 11.21 H new ATOM 0 HD22 LEU A 455 -1.535 -15.847 -11.415 1.00 11.21 H new ATOM 0 HD23 LEU A 455 -0.923 -16.448 -9.856 1.00 11.21 H new ATOM 329 N ALA A 456 2.707 -12.983 -9.285 1.00 73.42 N ATOM 330 CA ALA A 456 3.041 -12.654 -7.894 1.00 72.54 C ATOM 331 C ALA A 456 1.875 -11.940 -7.189 1.00 14.11 C ATOM 332 O ALA A 456 1.288 -11.007 -7.732 1.00 34.15 O ATOM 333 CB ALA A 456 4.294 -11.788 -7.850 1.00 33.31 C ATOM 0 H ALA A 456 2.309 -12.207 -9.814 1.00 73.42 H new ATOM 0 HA ALA A 456 3.229 -13.587 -7.363 1.00 72.54 H new ATOM 0 HB1 ALA A 456 4.535 -11.549 -6.814 1.00 33.31 H new ATOM 0 HB2 ALA A 456 5.126 -12.329 -8.300 1.00 33.31 H new ATOM 0 HB3 ALA A 456 4.119 -10.866 -8.404 1.00 33.31 H new ATOM 339 N GLU A 457 1.540 -12.388 -5.982 1.00 33.22 N ATOM 340 CA GLU A 457 0.486 -11.756 -5.177 1.00 42.44 C ATOM 341 C GLU A 457 1.068 -11.093 -3.926 1.00 44.12 C ATOM 342 O GLU A 457 1.840 -11.706 -3.189 1.00 53.31 O ATOM 343 CB GLU A 457 -0.581 -12.787 -4.774 1.00 23.50 C ATOM 344 CG GLU A 457 -1.592 -13.092 -5.871 1.00 43.40 C ATOM 345 CD GLU A 457 -2.519 -14.237 -5.506 1.00 23.41 C ATOM 346 OE1 GLU A 457 -3.524 -13.998 -4.802 1.00 31.13 O ATOM 347 OE2 GLU A 457 -2.240 -15.388 -5.905 1.00 4.33 O ATOM 0 H GLU A 457 1.983 -13.190 -5.534 1.00 33.22 H new ATOM 0 HA GLU A 457 0.020 -10.985 -5.791 1.00 42.44 H new ATOM 0 HB2 GLU A 457 -0.085 -13.713 -4.483 1.00 23.50 H new ATOM 0 HB3 GLU A 457 -1.112 -12.420 -3.896 1.00 23.50 H new ATOM 0 HG2 GLU A 457 -2.184 -12.200 -6.073 1.00 43.40 H new ATOM 0 HG3 GLU A 457 -1.062 -13.337 -6.791 1.00 43.40 H new ATOM 354 N TYR A 458 0.671 -9.850 -3.682 1.00 1.31 N ATOM 355 CA TYR A 458 1.162 -9.086 -2.528 1.00 52.14 C ATOM 356 C TYR A 458 0.003 -8.643 -1.629 1.00 42.44 C ATOM 357 O TYR A 458 -1.144 -8.538 -2.077 1.00 14.40 O ATOM 358 CB TYR A 458 1.941 -7.847 -2.998 1.00 44.11 C ATOM 359 CG TYR A 458 3.220 -8.158 -3.757 1.00 0.12 C ATOM 360 CD1 TYR A 458 3.184 -8.556 -5.089 1.00 54.13 C ATOM 361 CD2 TYR A 458 4.462 -8.047 -3.139 1.00 70.12 C ATOM 362 CE1 TYR A 458 4.346 -8.839 -5.779 1.00 14.33 C ATOM 363 CE2 TYR A 458 5.626 -8.327 -3.824 1.00 75.11 C ATOM 364 CZ TYR A 458 5.563 -8.723 -5.145 1.00 2.10 C ATOM 365 OH TYR A 458 6.721 -9.008 -5.829 1.00 73.43 O ATOM 0 H TYR A 458 0.007 -9.343 -4.267 1.00 1.31 H new ATOM 0 HA TYR A 458 1.823 -9.737 -1.956 1.00 52.14 H new ATOM 0 HB2 TYR A 458 1.292 -7.246 -3.635 1.00 44.11 H new ATOM 0 HB3 TYR A 458 2.188 -7.237 -2.129 1.00 44.11 H new ATOM 0 HD1 TYR A 458 2.232 -8.645 -5.592 1.00 54.13 H new ATOM 0 HD2 TYR A 458 4.515 -7.736 -2.106 1.00 70.12 H new ATOM 0 HE1 TYR A 458 4.301 -9.150 -6.812 1.00 14.33 H new ATOM 0 HE2 TYR A 458 6.582 -8.237 -3.329 1.00 75.11 H new ATOM 0 HH TYR A 458 7.341 -9.485 -5.239 1.00 73.43 H new ATOM 375 N GLU A 459 0.317 -8.367 -0.367 1.00 21.34 N ATOM 376 CA GLU A 459 -0.685 -7.946 0.616 1.00 61.32 C ATOM 377 C GLU A 459 -0.359 -6.561 1.187 1.00 23.14 C ATOM 378 O GLU A 459 0.744 -6.323 1.684 1.00 22.41 O ATOM 379 CB GLU A 459 -0.748 -8.947 1.777 1.00 24.41 C ATOM 380 CG GLU A 459 -1.055 -10.377 1.361 1.00 10.41 C ATOM 381 CD GLU A 459 -1.102 -11.317 2.552 1.00 63.14 C ATOM 382 OE1 GLU A 459 -0.041 -11.838 2.949 1.00 53.43 O ATOM 383 OE2 GLU A 459 -2.196 -11.521 3.112 1.00 40.01 O ATOM 0 H GLU A 459 1.265 -8.427 0.005 1.00 21.34 H new ATOM 0 HA GLU A 459 -1.645 -7.905 0.101 1.00 61.32 H new ATOM 0 HB2 GLU A 459 0.206 -8.932 2.305 1.00 24.41 H new ATOM 0 HB3 GLU A 459 -1.509 -8.616 2.484 1.00 24.41 H new ATOM 0 HG2 GLU A 459 -2.011 -10.405 0.839 1.00 10.41 H new ATOM 0 HG3 GLU A 459 -0.297 -10.721 0.657 1.00 10.41 H new ATOM 390 N VAL A 460 -1.328 -5.658 1.125 1.00 22.23 N ATOM 391 CA VAL A 460 -1.203 -4.343 1.744 1.00 31.44 C ATOM 392 C VAL A 460 -1.996 -4.299 3.058 1.00 74.41 C ATOM 393 O VAL A 460 -3.223 -4.398 3.056 1.00 61.23 O ATOM 394 CB VAL A 460 -1.718 -3.226 0.801 1.00 1.04 C ATOM 395 CG1 VAL A 460 -1.476 -1.843 1.410 1.00 15.20 C ATOM 396 CG2 VAL A 460 -1.073 -3.338 -0.580 1.00 54.32 C ATOM 0 H VAL A 460 -2.217 -5.813 0.649 1.00 22.23 H new ATOM 0 HA VAL A 460 -0.145 -4.171 1.944 1.00 31.44 H new ATOM 0 HB VAL A 460 -2.794 -3.355 0.680 1.00 1.04 H new ATOM 0 HG11 VAL A 460 -1.846 -1.076 0.730 1.00 15.20 H new ATOM 0 HG12 VAL A 460 -2.002 -1.768 2.362 1.00 15.20 H new ATOM 0 HG13 VAL A 460 -0.408 -1.699 1.573 1.00 15.20 H new ATOM 0 HG21 VAL A 460 -1.451 -2.543 -1.223 1.00 54.32 H new ATOM 0 HG22 VAL A 460 0.009 -3.245 -0.485 1.00 54.32 H new ATOM 0 HG23 VAL A 460 -1.317 -4.306 -1.018 1.00 54.32 H new ATOM 406 N HIS A 461 -1.289 -4.168 4.173 1.00 62.42 N ATOM 407 CA HIS A 461 -1.929 -4.050 5.485 1.00 5.02 C ATOM 408 C HIS A 461 -2.081 -2.577 5.870 1.00 14.35 C ATOM 409 O HIS A 461 -1.094 -1.881 6.106 1.00 44.10 O ATOM 410 CB HIS A 461 -1.110 -4.787 6.554 1.00 3.21 C ATOM 411 CG HIS A 461 -1.061 -6.275 6.373 1.00 1.12 C ATOM 412 ND1 HIS A 461 -1.713 -7.155 7.210 1.00 74.12 N ATOM 413 CD2 HIS A 461 -0.415 -7.045 5.462 1.00 3.14 C ATOM 414 CE1 HIS A 461 -1.471 -8.391 6.826 1.00 75.32 C ATOM 415 NE2 HIS A 461 -0.688 -8.354 5.768 1.00 12.15 N ATOM 0 H HIS A 461 -0.270 -4.140 4.199 1.00 62.42 H new ATOM 0 HA HIS A 461 -2.917 -4.506 5.426 1.00 5.02 H new ATOM 0 HB2 HIS A 461 -0.092 -4.398 6.548 1.00 3.21 H new ATOM 0 HB3 HIS A 461 -1.530 -4.565 7.535 1.00 3.21 H new ATOM 0 HD1 HIS A 461 -2.294 -6.889 8.005 1.00 74.12 H new ATOM 0 HD2 HIS A 461 0.200 -6.693 4.647 1.00 3.14 H new ATOM 0 HE1 HIS A 461 -1.851 -9.285 7.299 1.00 75.32 H new ATOM 424 N VAL A 462 -3.316 -2.100 5.911 1.00 1.32 N ATOM 425 CA VAL A 462 -3.592 -0.710 6.267 1.00 3.54 C ATOM 426 C VAL A 462 -4.190 -0.621 7.678 1.00 53.34 C ATOM 427 O VAL A 462 -5.216 -1.231 7.970 1.00 31.00 O ATOM 428 CB VAL A 462 -4.538 -0.048 5.232 1.00 64.35 C ATOM 429 CG1 VAL A 462 -3.895 -0.075 3.850 1.00 2.04 C ATOM 430 CG2 VAL A 462 -5.905 -0.734 5.197 1.00 71.44 C ATOM 0 H VAL A 462 -4.147 -2.654 5.702 1.00 1.32 H new ATOM 0 HA VAL A 462 -2.647 -0.167 6.258 1.00 3.54 H new ATOM 0 HB VAL A 462 -4.698 0.987 5.535 1.00 64.35 H new ATOM 0 HG11 VAL A 462 -4.565 0.392 3.128 1.00 2.04 H new ATOM 0 HG12 VAL A 462 -2.952 0.472 3.877 1.00 2.04 H new ATOM 0 HG13 VAL A 462 -3.707 -1.108 3.556 1.00 2.04 H new ATOM 0 HG21 VAL A 462 -6.540 -0.242 4.460 1.00 71.44 H new ATOM 0 HG22 VAL A 462 -5.779 -1.782 4.926 1.00 71.44 H new ATOM 0 HG23 VAL A 462 -6.371 -0.667 6.180 1.00 71.44 H new ATOM 440 N LYS A 463 -3.538 0.136 8.553 1.00 22.43 N ATOM 441 CA LYS A 463 -3.948 0.209 9.960 1.00 11.00 C ATOM 442 C LYS A 463 -4.074 1.656 10.455 1.00 15.20 C ATOM 443 O LYS A 463 -3.354 2.553 10.005 1.00 54.20 O ATOM 444 CB LYS A 463 -2.965 -0.569 10.850 1.00 64.55 C ATOM 445 CG LYS A 463 -1.495 -0.363 10.487 1.00 34.31 C ATOM 446 CD LYS A 463 -0.582 -0.473 11.706 1.00 33.32 C ATOM 447 CE LYS A 463 -0.624 -1.855 12.355 1.00 61.55 C ATOM 448 NZ LYS A 463 -0.116 -2.923 11.452 1.00 64.20 N ATOM 0 H LYS A 463 -2.726 0.708 8.319 1.00 22.43 H new ATOM 0 HA LYS A 463 -4.935 -0.248 10.028 1.00 11.00 H new ATOM 0 HB2 LYS A 463 -3.117 -0.271 11.887 1.00 64.55 H new ATOM 0 HB3 LYS A 463 -3.198 -1.632 10.787 1.00 64.55 H new ATOM 0 HG2 LYS A 463 -1.198 -1.103 9.744 1.00 34.31 H new ATOM 0 HG3 LYS A 463 -1.369 0.617 10.028 1.00 34.31 H new ATOM 0 HD2 LYS A 463 0.442 -0.247 11.409 1.00 33.32 H new ATOM 0 HD3 LYS A 463 -0.873 0.277 12.441 1.00 33.32 H new ATOM 0 HE2 LYS A 463 -0.029 -1.842 13.268 1.00 61.55 H new ATOM 0 HE3 LYS A 463 -1.649 -2.086 12.645 1.00 61.55 H new ATOM 0 HZ1 LYS A 463 -0.708 -3.772 11.551 1.00 64.20 H new ATOM 0 HZ2 LYS A 463 -0.150 -2.590 10.467 1.00 64.20 H new ATOM 0 HZ3 LYS A 463 0.866 -3.154 11.706 1.00 64.20 H new ATOM 462 N ASN A 464 -4.997 1.867 11.391 1.00 52.11 N ATOM 463 CA ASN A 464 -5.204 3.179 12.006 1.00 73.32 C ATOM 464 C ASN A 464 -4.505 3.235 13.374 1.00 25.45 C ATOM 465 O ASN A 464 -4.717 2.373 14.226 1.00 3.33 O ATOM 466 CB ASN A 464 -6.715 3.423 12.160 1.00 65.53 C ATOM 467 CG ASN A 464 -7.071 4.821 12.646 1.00 52.20 C ATOM 468 OD1 ASN A 464 -6.321 5.468 13.372 1.00 73.24 O ATOM 469 ND2 ASN A 464 -8.242 5.289 12.268 1.00 53.41 N ATOM 0 H ASN A 464 -5.619 1.140 11.744 1.00 52.11 H new ATOM 0 HA ASN A 464 -4.776 3.957 11.374 1.00 73.32 H new ATOM 0 HB2 ASN A 464 -7.200 3.249 11.200 1.00 65.53 H new ATOM 0 HB3 ASN A 464 -7.121 2.692 12.859 1.00 65.53 H new ATOM 0 HD21 ASN A 464 -8.547 6.211 12.579 1.00 53.41 H new ATOM 0 HD22 ASN A 464 -8.844 4.729 11.664 1.00 53.41 H new ATOM 476 N LEU A 465 -3.687 4.258 13.588 1.00 72.24 N ATOM 477 CA LEU A 465 -2.941 4.409 14.844 1.00 42.13 C ATOM 478 C LEU A 465 -3.478 5.577 15.689 1.00 44.25 C ATOM 479 O LEU A 465 -3.119 5.726 16.858 1.00 73.12 O ATOM 480 CB LEU A 465 -1.448 4.616 14.539 1.00 5.10 C ATOM 481 CG LEU A 465 -0.793 3.503 13.700 1.00 52.44 C ATOM 482 CD1 LEU A 465 0.677 3.815 13.426 1.00 73.20 C ATOM 483 CD2 LEU A 465 -0.941 2.151 14.394 1.00 25.44 C ATOM 0 H LEU A 465 -3.519 5.001 12.909 1.00 72.24 H new ATOM 0 HA LEU A 465 -3.072 3.497 15.426 1.00 42.13 H new ATOM 0 HB2 LEU A 465 -1.328 5.564 14.014 1.00 5.10 H new ATOM 0 HB3 LEU A 465 -0.909 4.704 15.482 1.00 5.10 H new ATOM 0 HG LEU A 465 -1.308 3.454 12.741 1.00 52.44 H new ATOM 0 HD11 LEU A 465 1.115 3.013 12.832 1.00 73.20 H new ATOM 0 HD12 LEU A 465 0.754 4.755 12.879 1.00 73.20 H new ATOM 0 HD13 LEU A 465 1.213 3.900 14.371 1.00 73.20 H new ATOM 0 HD21 LEU A 465 -0.472 1.377 13.786 1.00 25.44 H new ATOM 0 HD22 LEU A 465 -0.458 2.188 15.370 1.00 25.44 H new ATOM 0 HD23 LEU A 465 -1.999 1.921 14.521 1.00 25.44 H new ATOM 495 N GLY A 466 -4.348 6.391 15.093 1.00 12.32 N ATOM 496 CA GLY A 466 -4.911 7.545 15.793 1.00 32.25 C ATOM 497 C GLY A 466 -5.997 7.177 16.802 1.00 40.55 C ATOM 498 O GLY A 466 -6.195 7.878 17.793 1.00 23.33 O ATOM 0 H GLY A 466 -4.677 6.275 14.134 1.00 12.32 H new ATOM 0 HA2 GLY A 466 -4.109 8.072 16.310 1.00 32.25 H new ATOM 0 HA3 GLY A 466 -5.327 8.237 15.060 1.00 32.25 H new ATOM 502 N GLY A 467 -6.704 6.075 16.550 1.00 71.21 N ATOM 503 CA GLY A 467 -7.748 5.621 17.474 1.00 63.41 C ATOM 504 C GLY A 467 -9.114 6.254 17.205 1.00 72.04 C ATOM 505 O GLY A 467 -9.970 6.306 18.087 1.00 5.24 O ATOM 0 H GLY A 467 -6.577 5.486 15.727 1.00 71.21 H new ATOM 0 HA2 GLY A 467 -7.838 4.537 17.404 1.00 63.41 H new ATOM 0 HA3 GLY A 467 -7.444 5.851 18.495 1.00 63.41 H new ATOM 509 N ILE A 468 -9.312 6.725 15.982 1.00 53.22 N ATOM 510 CA ILE A 468 -10.582 7.343 15.562 1.00 0.21 C ATOM 511 C ILE A 468 -10.988 6.873 14.152 1.00 24.22 C ATOM 512 O ILE A 468 -10.154 6.818 13.246 1.00 15.34 O ATOM 513 CB ILE A 468 -10.491 8.895 15.607 1.00 41.12 C ATOM 514 CG1 ILE A 468 -11.692 9.547 14.893 1.00 33.42 C ATOM 515 CG2 ILE A 468 -9.174 9.371 14.997 1.00 4.31 C ATOM 516 CD1 ILE A 468 -11.751 11.055 15.046 1.00 53.25 C ATOM 0 H ILE A 468 -8.605 6.694 15.248 1.00 53.22 H new ATOM 0 HA ILE A 468 -11.351 7.023 16.265 1.00 0.21 H new ATOM 0 HB ILE A 468 -10.520 9.204 16.652 1.00 41.12 H new ATOM 0 HG12 ILE A 468 -11.650 9.300 13.832 1.00 33.42 H new ATOM 0 HG13 ILE A 468 -12.613 9.115 15.284 1.00 33.42 H new ATOM 0 HG21 ILE A 468 -9.127 10.459 15.037 1.00 4.31 H new ATOM 0 HG22 ILE A 468 -8.340 8.951 15.559 1.00 4.31 H new ATOM 0 HG23 ILE A 468 -9.114 9.043 13.959 1.00 4.31 H new ATOM 0 HD11 ILE A 468 -12.622 11.441 14.517 1.00 53.25 H new ATOM 0 HD12 ILE A 468 -11.826 11.311 16.103 1.00 53.25 H new ATOM 0 HD13 ILE A 468 -10.847 11.499 14.628 1.00 53.25 H new ATOM 528 N GLY A 469 -12.270 6.539 13.976 1.00 41.34 N ATOM 529 CA GLY A 469 -12.746 5.971 12.711 1.00 62.40 C ATOM 530 C GLY A 469 -12.765 6.955 11.537 1.00 34.24 C ATOM 531 O GLY A 469 -13.255 8.083 11.661 1.00 52.34 O ATOM 0 H GLY A 469 -12.992 6.651 14.688 1.00 41.34 H new ATOM 0 HA2 GLY A 469 -12.113 5.124 12.447 1.00 62.40 H new ATOM 0 HA3 GLY A 469 -13.754 5.583 12.859 1.00 62.40 H new ATOM 535 N VAL A 470 -12.239 6.510 10.391 1.00 54.12 N ATOM 536 CA VAL A 470 -12.197 7.312 9.159 1.00 21.53 C ATOM 537 C VAL A 470 -12.715 6.505 7.945 1.00 63.22 C ATOM 538 O VAL A 470 -12.159 5.462 7.599 1.00 61.15 O ATOM 539 CB VAL A 470 -10.753 7.803 8.860 1.00 34.44 C ATOM 540 CG1 VAL A 470 -10.713 8.641 7.582 1.00 41.13 C ATOM 541 CG2 VAL A 470 -10.192 8.591 10.042 1.00 0.41 C ATOM 0 H VAL A 470 -11.829 5.582 10.289 1.00 54.12 H new ATOM 0 HA VAL A 470 -12.846 8.173 9.319 1.00 21.53 H new ATOM 0 HB VAL A 470 -10.125 6.925 8.707 1.00 34.44 H new ATOM 0 HG11 VAL A 470 -9.691 8.972 7.396 1.00 41.13 H new ATOM 0 HG12 VAL A 470 -11.058 8.039 6.741 1.00 41.13 H new ATOM 0 HG13 VAL A 470 -11.361 9.510 7.696 1.00 41.13 H new ATOM 0 HG21 VAL A 470 -9.181 8.924 9.810 1.00 0.41 H new ATOM 0 HG22 VAL A 470 -10.825 9.458 10.235 1.00 0.41 H new ATOM 0 HG23 VAL A 470 -10.170 7.954 10.926 1.00 0.41 H new ATOM 551 N PRO A 471 -13.810 6.965 7.299 1.00 30.43 N ATOM 552 CA PRO A 471 -14.359 6.325 6.095 1.00 3.23 C ATOM 553 C PRO A 471 -13.750 6.852 4.773 1.00 50.40 C ATOM 554 O PRO A 471 -13.990 6.293 3.703 1.00 0.04 O ATOM 555 CB PRO A 471 -15.847 6.671 6.194 1.00 3.25 C ATOM 556 CG PRO A 471 -15.892 8.001 6.879 1.00 50.24 C ATOM 557 CD PRO A 471 -14.630 8.121 7.714 1.00 73.12 C ATOM 0 HA PRO A 471 -14.141 5.258 6.063 1.00 3.23 H new ATOM 0 HB2 PRO A 471 -16.307 6.720 5.207 1.00 3.25 H new ATOM 0 HB3 PRO A 471 -16.391 5.916 6.762 1.00 3.25 H new ATOM 0 HG2 PRO A 471 -15.948 8.808 6.148 1.00 50.24 H new ATOM 0 HG3 PRO A 471 -16.778 8.079 7.509 1.00 50.24 H new ATOM 0 HD2 PRO A 471 -14.115 9.063 7.525 1.00 73.12 H new ATOM 0 HD3 PRO A 471 -14.853 8.089 8.780 1.00 73.12 H new ATOM 565 N SER A 472 -12.976 7.933 4.854 1.00 1.20 N ATOM 566 CA SER A 472 -12.371 8.574 3.667 1.00 1.22 C ATOM 567 C SER A 472 -11.086 7.873 3.201 1.00 1.54 C ATOM 568 O SER A 472 -10.376 8.391 2.338 1.00 61.21 O ATOM 569 CB SER A 472 -12.062 10.053 3.935 1.00 42.45 C ATOM 570 OG SER A 472 -11.043 10.214 4.916 1.00 72.15 O ATOM 0 H SER A 472 -12.746 8.394 5.734 1.00 1.20 H new ATOM 0 HA SER A 472 -13.112 8.487 2.872 1.00 1.22 H new ATOM 0 HB2 SER A 472 -11.751 10.533 3.007 1.00 42.45 H new ATOM 0 HB3 SER A 472 -12.969 10.559 4.267 1.00 42.45 H new ATOM 0 HG SER A 472 -10.169 10.031 4.513 1.00 72.15 H new ATOM 576 N THR A 473 -10.810 6.683 3.727 1.00 41.03 N ATOM 577 CA THR A 473 -9.476 6.080 3.611 1.00 11.43 C ATOM 578 C THR A 473 -9.319 5.272 2.318 1.00 21.33 C ATOM 579 O THR A 473 -9.911 4.209 2.136 1.00 12.04 O ATOM 580 CB THR A 473 -9.185 5.156 4.822 1.00 4.44 C ATOM 581 OG1 THR A 473 -9.215 5.916 6.037 1.00 44.35 O ATOM 582 CG2 THR A 473 -7.829 4.467 4.691 1.00 41.04 C ATOM 0 H THR A 473 -11.486 6.115 4.237 1.00 41.03 H new ATOM 0 HA THR A 473 -8.762 6.903 3.592 1.00 11.43 H new ATOM 0 HB THR A 473 -9.958 4.388 4.844 1.00 4.44 H new ATOM 0 HG1 THR A 473 -10.081 5.793 6.478 1.00 44.35 H new ATOM 0 HG21 THR A 473 -7.660 3.828 5.558 1.00 41.04 H new ATOM 0 HG22 THR A 473 -7.815 3.861 3.785 1.00 41.04 H new ATOM 0 HG23 THR A 473 -7.042 5.219 4.636 1.00 41.04 H new ATOM 590 N LYS A 474 -8.503 5.808 1.416 1.00 13.13 N ATOM 591 CA LYS A 474 -8.299 5.225 0.086 1.00 2.04 C ATOM 592 C LYS A 474 -6.824 4.851 -0.128 1.00 14.14 C ATOM 593 O LYS A 474 -5.928 5.678 0.065 1.00 21.01 O ATOM 594 CB LYS A 474 -8.760 6.226 -0.982 1.00 51.25 C ATOM 595 CG LYS A 474 -10.194 6.705 -0.772 1.00 75.03 C ATOM 596 CD LYS A 474 -10.538 7.897 -1.656 1.00 13.44 C ATOM 597 CE LYS A 474 -11.911 8.466 -1.315 1.00 70.13 C ATOM 598 NZ LYS A 474 -12.194 9.721 -2.059 1.00 34.41 N ATOM 0 H LYS A 474 -7.963 6.657 1.582 1.00 13.13 H new ATOM 0 HA LYS A 474 -8.888 4.312 0.005 1.00 2.04 H new ATOM 0 HB2 LYS A 474 -8.091 7.087 -0.978 1.00 51.25 H new ATOM 0 HB3 LYS A 474 -8.678 5.763 -1.965 1.00 51.25 H new ATOM 0 HG2 LYS A 474 -10.883 5.887 -0.983 1.00 75.03 H new ATOM 0 HG3 LYS A 474 -10.335 6.978 0.274 1.00 75.03 H new ATOM 0 HD2 LYS A 474 -9.781 8.672 -1.535 1.00 13.44 H new ATOM 0 HD3 LYS A 474 -10.518 7.593 -2.703 1.00 13.44 H new ATOM 0 HE2 LYS A 474 -12.678 7.727 -1.547 1.00 70.13 H new ATOM 0 HE3 LYS A 474 -11.968 8.659 -0.244 1.00 70.13 H new ATOM 0 HZ1 LYS A 474 -12.993 10.216 -1.614 1.00 34.41 H new ATOM 0 HZ2 LYS A 474 -11.354 10.333 -2.039 1.00 34.41 H new ATOM 0 HZ3 LYS A 474 -12.434 9.493 -3.045 1.00 34.41 H new ATOM 612 N VAL A 475 -6.582 3.608 -0.537 1.00 44.12 N ATOM 613 CA VAL A 475 -5.218 3.083 -0.686 1.00 42.04 C ATOM 614 C VAL A 475 -4.794 2.998 -2.162 1.00 4.30 C ATOM 615 O VAL A 475 -5.563 2.558 -3.014 1.00 52.24 O ATOM 616 CB VAL A 475 -5.102 1.678 -0.045 1.00 62.04 C ATOM 617 CG1 VAL A 475 -3.654 1.186 -0.041 1.00 23.22 C ATOM 618 CG2 VAL A 475 -5.681 1.687 1.369 1.00 23.33 C ATOM 0 H VAL A 475 -7.314 2.939 -0.774 1.00 44.12 H new ATOM 0 HA VAL A 475 -4.553 3.779 -0.175 1.00 42.04 H new ATOM 0 HB VAL A 475 -5.682 0.982 -0.650 1.00 62.04 H new ATOM 0 HG11 VAL A 475 -3.607 0.197 0.416 1.00 23.22 H new ATOM 0 HG12 VAL A 475 -3.286 1.131 -1.065 1.00 23.22 H new ATOM 0 HG13 VAL A 475 -3.036 1.879 0.530 1.00 23.22 H new ATOM 0 HG21 VAL A 475 -5.592 0.692 1.805 1.00 23.33 H new ATOM 0 HG22 VAL A 475 -5.133 2.402 1.982 1.00 23.33 H new ATOM 0 HG23 VAL A 475 -6.732 1.973 1.330 1.00 23.33 H new ATOM 628 N ARG A 476 -3.570 3.427 -2.450 1.00 2.01 N ATOM 629 CA ARG A 476 -3.003 3.352 -3.802 1.00 62.01 C ATOM 630 C ARG A 476 -1.681 2.572 -3.809 1.00 23.24 C ATOM 631 O ARG A 476 -0.885 2.670 -2.874 1.00 44.31 O ATOM 632 CB ARG A 476 -2.771 4.762 -4.367 1.00 54.04 C ATOM 633 CG ARG A 476 -4.054 5.493 -4.755 1.00 43.21 C ATOM 634 CD ARG A 476 -3.770 6.899 -5.278 1.00 71.20 C ATOM 635 NE ARG A 476 -4.957 7.522 -5.869 1.00 71.51 N ATOM 636 CZ ARG A 476 -5.541 8.595 -5.407 1.00 75.31 C ATOM 637 NH1 ARG A 476 -5.141 9.142 -4.307 1.00 3.42 N ATOM 638 NH2 ARG A 476 -6.537 9.117 -6.043 1.00 15.01 N ATOM 0 H ARG A 476 -2.941 3.836 -1.759 1.00 2.01 H new ATOM 0 HA ARG A 476 -3.720 2.824 -4.431 1.00 62.01 H new ATOM 0 HB2 ARG A 476 -2.236 5.356 -3.626 1.00 54.04 H new ATOM 0 HB3 ARG A 476 -2.127 4.690 -5.243 1.00 54.04 H new ATOM 0 HG2 ARG A 476 -4.581 4.921 -5.518 1.00 43.21 H new ATOM 0 HG3 ARG A 476 -4.714 5.554 -3.889 1.00 43.21 H new ATOM 0 HD2 ARG A 476 -3.404 7.521 -4.461 1.00 71.20 H new ATOM 0 HD3 ARG A 476 -2.977 6.854 -6.024 1.00 71.20 H new ATOM 0 HE ARG A 476 -5.356 7.087 -6.701 1.00 71.51 H new ATOM 0 HH11 ARG A 476 -4.361 8.736 -3.790 1.00 3.42 H new ATOM 0 HH12 ARG A 476 -5.605 9.980 -3.956 1.00 3.42 H new ATOM 0 HH21 ARG A 476 -6.869 8.691 -6.908 1.00 15.01 H new ATOM 0 HH22 ARG A 476 -6.991 9.955 -5.680 1.00 15.01 H new ATOM 652 N VAL A 477 -1.453 1.804 -4.873 1.00 20.10 N ATOM 653 CA VAL A 477 -0.216 1.030 -5.025 1.00 11.14 C ATOM 654 C VAL A 477 0.540 1.439 -6.298 1.00 11.50 C ATOM 655 O VAL A 477 -0.003 1.388 -7.402 1.00 53.00 O ATOM 656 CB VAL A 477 -0.509 -0.495 -5.071 1.00 44.21 C ATOM 657 CG1 VAL A 477 0.766 -1.295 -5.334 1.00 1.41 C ATOM 658 CG2 VAL A 477 -1.180 -0.953 -3.774 1.00 61.33 C ATOM 0 H VAL A 477 -2.109 1.699 -5.647 1.00 20.10 H new ATOM 0 HA VAL A 477 0.405 1.246 -4.156 1.00 11.14 H new ATOM 0 HB VAL A 477 -1.195 -0.681 -5.898 1.00 44.21 H new ATOM 0 HG11 VAL A 477 0.529 -2.359 -5.361 1.00 1.41 H new ATOM 0 HG12 VAL A 477 1.193 -0.994 -6.291 1.00 1.41 H new ATOM 0 HG13 VAL A 477 1.486 -1.103 -4.539 1.00 1.41 H new ATOM 0 HG21 VAL A 477 -1.377 -2.024 -3.825 1.00 61.33 H new ATOM 0 HG22 VAL A 477 -0.522 -0.745 -2.931 1.00 61.33 H new ATOM 0 HG23 VAL A 477 -2.120 -0.417 -3.641 1.00 61.33 H new ATOM 668 N TYR A 478 1.793 1.852 -6.126 1.00 33.22 N ATOM 669 CA TYR A 478 2.650 2.269 -7.240 1.00 63.45 C ATOM 670 C TYR A 478 3.793 1.265 -7.451 1.00 32.04 C ATOM 671 O TYR A 478 4.393 0.788 -6.491 1.00 0.03 O ATOM 672 CB TYR A 478 3.258 3.656 -6.967 1.00 53.41 C ATOM 673 CG TYR A 478 2.252 4.736 -6.614 1.00 42.40 C ATOM 674 CD1 TYR A 478 1.659 5.518 -7.600 1.00 51.14 C ATOM 675 CD2 TYR A 478 1.908 4.984 -5.289 1.00 61.41 C ATOM 676 CE1 TYR A 478 0.755 6.513 -7.276 1.00 42.42 C ATOM 677 CE2 TYR A 478 1.005 5.973 -4.960 1.00 44.23 C ATOM 678 CZ TYR A 478 0.431 6.735 -5.954 1.00 12.50 C ATOM 679 OH TYR A 478 -0.466 7.728 -5.621 1.00 43.52 O ATOM 0 H TYR A 478 2.245 1.908 -5.213 1.00 33.22 H new ATOM 0 HA TYR A 478 2.029 2.310 -8.135 1.00 63.45 H new ATOM 0 HB2 TYR A 478 3.976 3.568 -6.152 1.00 53.41 H new ATOM 0 HB3 TYR A 478 3.815 3.973 -7.849 1.00 53.41 H new ATOM 0 HD1 TYR A 478 1.909 5.345 -8.636 1.00 51.14 H new ATOM 0 HD2 TYR A 478 2.356 4.392 -4.505 1.00 61.41 H new ATOM 0 HE1 TYR A 478 0.305 7.113 -8.054 1.00 42.42 H new ATOM 0 HE2 TYR A 478 0.748 6.150 -3.926 1.00 44.23 H new ATOM 0 HH TYR A 478 -0.171 8.173 -4.799 1.00 43.52 H new ATOM 689 N ILE A 479 4.082 0.947 -8.707 1.00 44.34 N ATOM 690 CA ILE A 479 5.230 0.101 -9.054 1.00 22.34 C ATOM 691 C ILE A 479 6.242 0.903 -9.886 1.00 3.13 C ATOM 692 O ILE A 479 5.970 1.255 -11.038 1.00 61.11 O ATOM 693 CB ILE A 479 4.787 -1.159 -9.845 1.00 21.42 C ATOM 694 CG1 ILE A 479 3.747 -1.954 -9.034 1.00 40.21 C ATOM 695 CG2 ILE A 479 5.996 -2.033 -10.188 1.00 75.43 C ATOM 696 CD1 ILE A 479 3.210 -3.180 -9.742 1.00 45.15 C ATOM 0 H ILE A 479 3.537 1.262 -9.510 1.00 44.34 H new ATOM 0 HA ILE A 479 5.696 -0.226 -8.125 1.00 22.34 H new ATOM 0 HB ILE A 479 4.326 -0.842 -10.781 1.00 21.42 H new ATOM 0 HG12 ILE A 479 4.197 -2.262 -8.090 1.00 40.21 H new ATOM 0 HG13 ILE A 479 2.913 -1.296 -8.790 1.00 40.21 H new ATOM 0 HG21 ILE A 479 5.665 -2.911 -10.742 1.00 75.43 H new ATOM 0 HG22 ILE A 479 6.696 -1.462 -10.798 1.00 75.43 H new ATOM 0 HG23 ILE A 479 6.489 -2.349 -9.269 1.00 75.43 H new ATOM 0 HD11 ILE A 479 2.484 -3.681 -9.102 1.00 45.15 H new ATOM 0 HD12 ILE A 479 2.728 -2.881 -10.672 1.00 45.15 H new ATOM 0 HD13 ILE A 479 4.031 -3.862 -9.962 1.00 45.15 H new ATOM 708 N ASN A 480 7.395 1.213 -9.289 1.00 33.22 N ATOM 709 CA ASN A 480 8.402 2.078 -9.926 1.00 22.41 C ATOM 710 C ASN A 480 7.795 3.432 -10.340 1.00 62.34 C ATOM 711 O ASN A 480 8.179 4.019 -11.357 1.00 71.21 O ATOM 712 CB ASN A 480 9.037 1.378 -11.139 1.00 51.43 C ATOM 713 CG ASN A 480 9.905 0.197 -10.744 1.00 1.44 C ATOM 714 OD1 ASN A 480 10.438 0.140 -9.643 1.00 73.41 O ATOM 715 ND2 ASN A 480 10.073 -0.749 -11.642 1.00 12.34 N ATOM 0 H ASN A 480 7.659 0.879 -8.362 1.00 33.22 H new ATOM 0 HA ASN A 480 9.184 2.271 -9.191 1.00 22.41 H new ATOM 0 HB2 ASN A 480 8.249 1.036 -11.810 1.00 51.43 H new ATOM 0 HB3 ASN A 480 9.639 2.097 -11.694 1.00 51.43 H new ATOM 0 HD21 ASN A 480 10.659 -1.556 -11.429 1.00 12.34 H new ATOM 0 HD22 ASN A 480 9.617 -0.676 -12.551 1.00 12.34 H new ATOM 722 N GLY A 481 6.851 3.922 -9.534 1.00 40.44 N ATOM 723 CA GLY A 481 6.219 5.214 -9.789 1.00 72.00 C ATOM 724 C GLY A 481 4.875 5.109 -10.511 1.00 52.41 C ATOM 725 O GLY A 481 4.037 6.006 -10.409 1.00 23.21 O ATOM 0 H GLY A 481 6.509 3.443 -8.701 1.00 40.44 H new ATOM 0 HA2 GLY A 481 6.072 5.730 -8.840 1.00 72.00 H new ATOM 0 HA3 GLY A 481 6.895 5.828 -10.385 1.00 72.00 H new ATOM 729 N THR A 482 4.665 4.019 -11.239 1.00 22.42 N ATOM 730 CA THR A 482 3.428 3.824 -12.011 1.00 44.22 C ATOM 731 C THR A 482 2.290 3.279 -11.135 1.00 35.21 C ATOM 732 O THR A 482 2.410 2.205 -10.548 1.00 3.33 O ATOM 733 CB THR A 482 3.659 2.858 -13.203 1.00 43.44 C ATOM 734 OG1 THR A 482 4.601 3.432 -14.125 1.00 31.11 O ATOM 735 CG2 THR A 482 2.356 2.550 -13.937 1.00 55.53 C ATOM 0 H THR A 482 5.332 3.251 -11.316 1.00 22.42 H new ATOM 0 HA THR A 482 3.139 4.804 -12.390 1.00 44.22 H new ATOM 0 HB THR A 482 4.054 1.925 -12.801 1.00 43.44 H new ATOM 0 HG1 THR A 482 4.743 2.816 -14.874 1.00 31.11 H new ATOM 0 HG21 THR A 482 2.557 1.871 -14.765 1.00 55.53 H new ATOM 0 HG22 THR A 482 1.652 2.084 -13.248 1.00 55.53 H new ATOM 0 HG23 THR A 482 1.928 3.475 -14.322 1.00 55.53 H new ATOM 743 N LEU A 483 1.187 4.025 -11.048 1.00 72.14 N ATOM 744 CA LEU A 483 0.013 3.587 -10.284 1.00 63.25 C ATOM 745 C LEU A 483 -0.582 2.300 -10.879 1.00 53.11 C ATOM 746 O LEU A 483 -1.076 2.291 -12.006 1.00 75.15 O ATOM 747 CB LEU A 483 -1.052 4.695 -10.258 1.00 53.41 C ATOM 748 CG LEU A 483 -2.349 4.348 -9.501 1.00 33.21 C ATOM 749 CD1 LEU A 483 -2.064 4.057 -8.027 1.00 21.25 C ATOM 750 CD2 LEU A 483 -3.374 5.473 -9.641 1.00 72.23 C ATOM 0 H LEU A 483 1.080 4.935 -11.496 1.00 72.14 H new ATOM 0 HA LEU A 483 0.334 3.378 -9.263 1.00 63.25 H new ATOM 0 HB2 LEU A 483 -0.615 5.585 -9.806 1.00 53.41 H new ATOM 0 HB3 LEU A 483 -1.309 4.953 -11.285 1.00 53.41 H new ATOM 0 HG LEU A 483 -2.767 3.446 -9.947 1.00 33.21 H new ATOM 0 HD11 LEU A 483 -2.996 3.815 -7.517 1.00 21.25 H new ATOM 0 HD12 LEU A 483 -1.378 3.213 -7.949 1.00 21.25 H new ATOM 0 HD13 LEU A 483 -1.614 4.935 -7.563 1.00 21.25 H new ATOM 0 HD21 LEU A 483 -4.282 5.208 -9.099 1.00 72.23 H new ATOM 0 HD22 LEU A 483 -2.962 6.394 -9.229 1.00 72.23 H new ATOM 0 HD23 LEU A 483 -3.610 5.621 -10.695 1.00 72.23 H new ATOM 762 N TYR A 484 -0.529 1.219 -10.109 1.00 3.00 N ATOM 763 CA TYR A 484 -1.031 -0.084 -10.555 1.00 64.14 C ATOM 764 C TYR A 484 -2.519 -0.289 -10.210 1.00 43.44 C ATOM 765 O TYR A 484 -3.294 -0.771 -11.038 1.00 43.45 O ATOM 766 CB TYR A 484 -0.182 -1.203 -9.925 1.00 33.22 C ATOM 767 CG TYR A 484 -0.753 -2.597 -10.127 1.00 21.40 C ATOM 768 CD1 TYR A 484 -0.597 -3.270 -11.335 1.00 24.34 C ATOM 769 CD2 TYR A 484 -1.462 -3.230 -9.111 1.00 43.00 C ATOM 770 CE1 TYR A 484 -1.129 -4.533 -11.518 1.00 62.32 C ATOM 771 CE2 TYR A 484 -1.999 -4.487 -9.291 1.00 52.33 C ATOM 772 CZ TYR A 484 -1.829 -5.135 -10.495 1.00 31.41 C ATOM 773 OH TYR A 484 -2.370 -6.386 -10.676 1.00 51.24 O ATOM 0 H TYR A 484 -0.141 1.216 -9.166 1.00 3.00 H new ATOM 0 HA TYR A 484 -0.948 -0.118 -11.641 1.00 64.14 H new ATOM 0 HB2 TYR A 484 0.821 -1.167 -10.349 1.00 33.22 H new ATOM 0 HB3 TYR A 484 -0.083 -1.013 -8.856 1.00 33.22 H new ATOM 0 HD1 TYR A 484 -0.053 -2.799 -12.141 1.00 24.34 H new ATOM 0 HD2 TYR A 484 -1.594 -2.728 -8.164 1.00 43.00 H new ATOM 0 HE1 TYR A 484 -0.996 -5.046 -12.459 1.00 62.32 H new ATOM 0 HE2 TYR A 484 -2.550 -4.961 -8.492 1.00 52.33 H new ATOM 0 HH TYR A 484 -1.656 -7.057 -10.660 1.00 51.24 H new ATOM 783 N LYS A 485 -2.920 0.082 -8.993 1.00 43.44 N ATOM 784 CA LYS A 485 -4.289 -0.183 -8.524 1.00 44.34 C ATOM 785 C LYS A 485 -4.630 0.656 -7.278 1.00 24.21 C ATOM 786 O LYS A 485 -3.734 1.168 -6.603 1.00 5.14 O ATOM 787 CB LYS A 485 -4.431 -1.684 -8.212 1.00 40.13 C ATOM 788 CG LYS A 485 -5.864 -2.153 -7.979 1.00 33.42 C ATOM 789 CD LYS A 485 -5.927 -3.664 -7.767 1.00 20.11 C ATOM 790 CE LYS A 485 -7.358 -4.162 -7.582 1.00 15.31 C ATOM 791 NZ LYS A 485 -8.171 -4.005 -8.817 1.00 42.14 N ATOM 0 H LYS A 485 -2.326 0.562 -8.317 1.00 43.44 H new ATOM 0 HA LYS A 485 -4.989 0.101 -9.310 1.00 44.34 H new ATOM 0 HB2 LYS A 485 -4.006 -2.255 -9.038 1.00 40.13 H new ATOM 0 HB3 LYS A 485 -3.839 -1.915 -7.327 1.00 40.13 H new ATOM 0 HG2 LYS A 485 -6.278 -1.644 -7.109 1.00 33.42 H new ATOM 0 HG3 LYS A 485 -6.482 -1.878 -8.833 1.00 33.42 H new ATOM 0 HD2 LYS A 485 -5.477 -4.168 -8.622 1.00 20.11 H new ATOM 0 HD3 LYS A 485 -5.335 -3.931 -6.891 1.00 20.11 H new ATOM 0 HE2 LYS A 485 -7.341 -5.212 -7.291 1.00 15.31 H new ATOM 0 HE3 LYS A 485 -7.829 -3.613 -6.767 1.00 15.31 H new ATOM 0 HZ1 LYS A 485 -9.083 -4.491 -8.697 1.00 42.14 H new ATOM 0 HZ2 LYS A 485 -8.339 -2.994 -8.996 1.00 42.14 H new ATOM 0 HZ3 LYS A 485 -7.661 -4.420 -9.623 1.00 42.14 H new ATOM 805 N ASN A 486 -5.927 0.806 -6.987 1.00 13.31 N ATOM 806 CA ASN A 486 -6.379 1.538 -5.792 1.00 73.23 C ATOM 807 C ASN A 486 -7.663 0.927 -5.193 1.00 63.22 C ATOM 808 O ASN A 486 -8.439 0.272 -5.892 1.00 74.51 O ATOM 809 CB ASN A 486 -6.600 3.022 -6.124 1.00 11.33 C ATOM 810 CG ASN A 486 -7.602 3.231 -7.245 1.00 63.43 C ATOM 811 OD1 ASN A 486 -8.798 3.371 -7.014 1.00 64.13 O ATOM 812 ND2 ASN A 486 -7.124 3.261 -8.473 1.00 54.20 N ATOM 0 H ASN A 486 -6.683 0.432 -7.560 1.00 13.31 H new ATOM 0 HA ASN A 486 -5.593 1.453 -5.041 1.00 73.23 H new ATOM 0 HB2 ASN A 486 -6.947 3.542 -5.231 1.00 11.33 H new ATOM 0 HB3 ASN A 486 -5.648 3.472 -6.405 1.00 11.33 H new ATOM 0 HD21 ASN A 486 -7.754 3.404 -9.262 1.00 54.20 H new ATOM 0 HD22 ASN A 486 -6.124 3.142 -8.634 1.00 54.20 H new ATOM 819 N TRP A 487 -7.869 1.144 -3.892 1.00 22.21 N ATOM 820 CA TRP A 487 -9.056 0.643 -3.176 1.00 32.53 C ATOM 821 C TRP A 487 -9.662 1.725 -2.267 1.00 72.54 C ATOM 822 O TRP A 487 -8.946 2.575 -1.734 1.00 73.14 O ATOM 823 CB TRP A 487 -8.698 -0.568 -2.299 1.00 12.21 C ATOM 824 CG TRP A 487 -8.177 -1.763 -3.043 1.00 14.32 C ATOM 825 CD1 TRP A 487 -8.911 -2.741 -3.652 1.00 62.42 C ATOM 826 CD2 TRP A 487 -6.803 -2.120 -3.227 1.00 20.34 C ATOM 827 NE1 TRP A 487 -8.077 -3.680 -4.207 1.00 40.55 N ATOM 828 CE2 TRP A 487 -6.776 -3.321 -3.960 1.00 73.42 C ATOM 829 CE3 TRP A 487 -5.591 -1.537 -2.845 1.00 61.13 C ATOM 830 CZ2 TRP A 487 -5.586 -3.949 -4.315 1.00 22.41 C ATOM 831 CZ3 TRP A 487 -4.411 -2.161 -3.199 1.00 44.22 C ATOM 832 CH2 TRP A 487 -4.417 -3.356 -3.929 1.00 42.43 C ATOM 0 H TRP A 487 -7.223 1.669 -3.302 1.00 22.21 H new ATOM 0 HA TRP A 487 -9.781 0.355 -3.937 1.00 32.53 H new ATOM 0 HB2 TRP A 487 -7.949 -0.259 -1.569 1.00 12.21 H new ATOM 0 HB3 TRP A 487 -9.585 -0.866 -1.740 1.00 12.21 H new ATOM 0 HD1 TRP A 487 -9.990 -2.771 -3.691 1.00 62.42 H new ATOM 0 HE1 TRP A 487 -8.376 -4.510 -4.720 1.00 40.55 H new ATOM 0 HE3 TRP A 487 -5.578 -0.615 -2.283 1.00 61.13 H new ATOM 0 HZ2 TRP A 487 -5.586 -4.872 -4.876 1.00 22.41 H new ATOM 0 HZ3 TRP A 487 -3.469 -1.720 -2.908 1.00 44.22 H new ATOM 0 HH2 TRP A 487 -3.478 -3.819 -4.193 1.00 42.43 H new ATOM 843 N THR A 488 -10.981 1.681 -2.081 1.00 1.04 N ATOM 844 CA THR A 488 -11.660 2.544 -1.100 1.00 21.23 C ATOM 845 C THR A 488 -12.076 1.722 0.130 1.00 72.11 C ATOM 846 O THR A 488 -12.861 0.781 0.014 1.00 75.44 O ATOM 847 CB THR A 488 -12.926 3.222 -1.696 1.00 13.33 C ATOM 848 OG1 THR A 488 -12.588 3.985 -2.865 1.00 53.03 O ATOM 849 CG2 THR A 488 -13.591 4.141 -0.674 1.00 12.34 C ATOM 0 H THR A 488 -11.605 1.059 -2.594 1.00 1.04 H new ATOM 0 HA THR A 488 -10.951 3.322 -0.817 1.00 21.23 H new ATOM 0 HB THR A 488 -13.624 2.430 -1.967 1.00 13.33 H new ATOM 0 HG1 THR A 488 -13.397 4.403 -3.228 1.00 53.03 H new ATOM 0 HG21 THR A 488 -14.473 4.601 -1.119 1.00 12.34 H new ATOM 0 HG22 THR A 488 -13.886 3.560 0.200 1.00 12.34 H new ATOM 0 HG23 THR A 488 -12.889 4.919 -0.373 1.00 12.34 H new ATOM 857 N VAL A 489 -11.557 2.081 1.305 1.00 62.44 N ATOM 858 CA VAL A 489 -11.842 1.340 2.544 1.00 50.23 C ATOM 859 C VAL A 489 -12.115 2.284 3.726 1.00 1.43 C ATOM 860 O VAL A 489 -11.993 3.503 3.614 1.00 54.03 O ATOM 861 CB VAL A 489 -10.676 0.379 2.925 1.00 54.32 C ATOM 862 CG1 VAL A 489 -10.487 -0.710 1.866 1.00 14.22 C ATOM 863 CG2 VAL A 489 -9.377 1.153 3.144 1.00 12.20 C ATOM 0 H VAL A 489 -10.936 2.881 1.429 1.00 62.44 H new ATOM 0 HA VAL A 489 -12.738 0.753 2.343 1.00 50.23 H new ATOM 0 HB VAL A 489 -10.943 -0.108 3.863 1.00 54.32 H new ATOM 0 HG11 VAL A 489 -9.667 -1.365 2.160 1.00 14.22 H new ATOM 0 HG12 VAL A 489 -11.403 -1.294 1.777 1.00 14.22 H new ATOM 0 HG13 VAL A 489 -10.257 -0.248 0.906 1.00 14.22 H new ATOM 0 HG21 VAL A 489 -8.580 0.458 3.409 1.00 12.20 H new ATOM 0 HG22 VAL A 489 -9.109 1.681 2.229 1.00 12.20 H new ATOM 0 HG23 VAL A 489 -9.514 1.873 3.951 1.00 12.20 H new ATOM 873 N SER A 490 -12.516 1.708 4.852 1.00 51.21 N ATOM 874 CA SER A 490 -12.737 2.474 6.085 1.00 63.40 C ATOM 875 C SER A 490 -11.945 1.867 7.249 1.00 42.42 C ATOM 876 O SER A 490 -11.939 0.650 7.440 1.00 32.43 O ATOM 877 CB SER A 490 -14.233 2.504 6.433 1.00 43.21 C ATOM 878 OG SER A 490 -14.755 1.191 6.591 1.00 54.52 O ATOM 0 H SER A 490 -12.697 0.708 4.943 1.00 51.21 H new ATOM 0 HA SER A 490 -12.389 3.494 5.919 1.00 63.40 H new ATOM 0 HB2 SER A 490 -14.383 3.070 7.352 1.00 43.21 H new ATOM 0 HB3 SER A 490 -14.781 3.023 5.646 1.00 43.21 H new ATOM 0 HG SER A 490 -15.708 1.242 6.814 1.00 54.52 H new ATOM 884 N LEU A 491 -11.275 2.714 8.026 1.00 41.34 N ATOM 885 CA LEU A 491 -10.504 2.245 9.186 1.00 41.34 C ATOM 886 C LEU A 491 -11.060 2.822 10.494 1.00 62.53 C ATOM 887 O LEU A 491 -11.056 4.034 10.701 1.00 44.11 O ATOM 888 CB LEU A 491 -9.025 2.645 9.041 1.00 33.55 C ATOM 889 CG LEU A 491 -8.253 1.941 7.912 1.00 65.13 C ATOM 890 CD1 LEU A 491 -6.829 2.490 7.803 1.00 41.44 C ATOM 891 CD2 LEU A 491 -8.229 0.431 8.140 1.00 32.40 C ATOM 0 H LEU A 491 -11.247 3.723 7.879 1.00 41.34 H new ATOM 0 HA LEU A 491 -10.588 1.159 9.221 1.00 41.34 H new ATOM 0 HB2 LEU A 491 -8.973 3.721 8.876 1.00 33.55 H new ATOM 0 HB3 LEU A 491 -8.518 2.442 9.985 1.00 33.55 H new ATOM 0 HG LEU A 491 -8.768 2.140 6.972 1.00 65.13 H new ATOM 0 HD11 LEU A 491 -6.302 1.977 6.998 1.00 41.44 H new ATOM 0 HD12 LEU A 491 -6.866 3.558 7.590 1.00 41.44 H new ATOM 0 HD13 LEU A 491 -6.303 2.326 8.743 1.00 41.44 H new ATOM 0 HD21 LEU A 491 -7.679 -0.050 7.332 1.00 32.40 H new ATOM 0 HD22 LEU A 491 -7.741 0.214 9.090 1.00 32.40 H new ATOM 0 HD23 LEU A 491 -9.250 0.050 8.161 1.00 32.40 H new ATOM 903 N GLY A 492 -11.505 1.942 11.384 1.00 60.32 N ATOM 904 CA GLY A 492 -12.007 2.371 12.685 1.00 3.14 C ATOM 905 C GLY A 492 -10.887 2.632 13.691 1.00 40.43 C ATOM 906 O GLY A 492 -9.713 2.712 13.314 1.00 12.41 O ATOM 0 H GLY A 492 -11.529 0.934 11.231 1.00 60.32 H new ATOM 0 HA2 GLY A 492 -12.597 3.279 12.561 1.00 3.14 H new ATOM 0 HA3 GLY A 492 -12.676 1.607 13.082 1.00 3.14 H new ATOM 910 N PRO A 493 -11.209 2.764 14.990 1.00 44.21 N ATOM 911 CA PRO A 493 -10.195 2.993 16.027 1.00 33.25 C ATOM 912 C PRO A 493 -9.225 1.809 16.161 1.00 34.21 C ATOM 913 O PRO A 493 -9.596 0.744 16.653 1.00 4.03 O ATOM 914 CB PRO A 493 -11.023 3.180 17.310 1.00 74.43 C ATOM 915 CG PRO A 493 -12.322 2.501 17.028 1.00 4.34 C ATOM 916 CD PRO A 493 -12.571 2.693 15.554 1.00 61.02 C ATOM 0 HA PRO A 493 -9.560 3.849 15.798 1.00 33.25 H new ATOM 0 HB2 PRO A 493 -10.524 2.736 18.171 1.00 74.43 H new ATOM 0 HB3 PRO A 493 -11.170 4.236 17.536 1.00 74.43 H new ATOM 0 HG2 PRO A 493 -12.274 1.442 17.282 1.00 4.34 H new ATOM 0 HG3 PRO A 493 -13.127 2.935 17.621 1.00 4.34 H new ATOM 0 HD2 PRO A 493 -13.140 1.865 15.130 1.00 61.02 H new ATOM 0 HD3 PRO A 493 -13.137 3.603 15.356 1.00 61.02 H new ATOM 924 N LYS A 494 -7.988 2.002 15.688 1.00 2.03 N ATOM 925 CA LYS A 494 -6.943 0.965 15.755 1.00 24.13 C ATOM 926 C LYS A 494 -7.257 -0.227 14.821 1.00 41.50 C ATOM 927 O LYS A 494 -6.735 -1.330 15.005 1.00 40.44 O ATOM 928 CB LYS A 494 -6.761 0.482 17.206 1.00 10.33 C ATOM 929 CG LYS A 494 -6.341 1.578 18.190 1.00 52.34 C ATOM 930 CD LYS A 494 -4.938 2.110 17.902 1.00 5.44 C ATOM 931 CE LYS A 494 -4.329 2.796 19.122 1.00 5.21 C ATOM 932 NZ LYS A 494 -5.171 3.908 19.640 1.00 20.35 N ATOM 0 H LYS A 494 -7.682 2.872 15.251 1.00 2.03 H new ATOM 0 HA LYS A 494 -6.010 1.412 15.411 1.00 24.13 H new ATOM 0 HB2 LYS A 494 -7.697 0.042 17.549 1.00 10.33 H new ATOM 0 HB3 LYS A 494 -6.012 -0.310 17.221 1.00 10.33 H new ATOM 0 HG2 LYS A 494 -7.056 2.400 18.142 1.00 52.34 H new ATOM 0 HG3 LYS A 494 -6.376 1.184 19.206 1.00 52.34 H new ATOM 0 HD2 LYS A 494 -4.295 1.288 17.589 1.00 5.44 H new ATOM 0 HD3 LYS A 494 -4.980 2.815 17.072 1.00 5.44 H new ATOM 0 HE2 LYS A 494 -4.183 2.059 19.912 1.00 5.21 H new ATOM 0 HE3 LYS A 494 -3.344 3.183 18.861 1.00 5.21 H new ATOM 0 HZ1 LYS A 494 -4.664 4.402 20.402 1.00 20.35 H new ATOM 0 HZ2 LYS A 494 -5.375 4.577 18.870 1.00 20.35 H new ATOM 0 HZ3 LYS A 494 -6.064 3.524 20.011 1.00 20.35 H new ATOM 946 N GLU A 495 -8.077 0.018 13.797 1.00 14.03 N ATOM 947 CA GLU A 495 -8.504 -1.032 12.856 1.00 74.21 C ATOM 948 C GLU A 495 -7.445 -1.293 11.767 1.00 30.24 C ATOM 949 O GLU A 495 -6.702 -0.387 11.384 1.00 12.24 O ATOM 950 CB GLU A 495 -9.830 -0.615 12.200 1.00 21.21 C ATOM 951 CG GLU A 495 -10.404 -1.632 11.215 1.00 1.11 C ATOM 952 CD GLU A 495 -10.804 -2.939 11.881 1.00 25.04 C ATOM 953 OE1 GLU A 495 -11.934 -3.026 12.400 1.00 44.44 O ATOM 954 OE2 GLU A 495 -9.984 -3.879 11.899 1.00 32.25 O ATOM 0 H GLU A 495 -8.464 0.940 13.593 1.00 14.03 H new ATOM 0 HA GLU A 495 -8.634 -1.957 13.418 1.00 74.21 H new ATOM 0 HB2 GLU A 495 -10.566 -0.434 12.984 1.00 21.21 H new ATOM 0 HB3 GLU A 495 -9.680 0.330 11.679 1.00 21.21 H new ATOM 0 HG2 GLU A 495 -11.274 -1.200 10.721 1.00 1.11 H new ATOM 0 HG3 GLU A 495 -9.666 -1.836 10.440 1.00 1.11 H new ATOM 961 N GLU A 496 -7.384 -2.534 11.272 1.00 3.50 N ATOM 962 CA GLU A 496 -6.474 -2.900 10.176 1.00 63.12 C ATOM 963 C GLU A 496 -7.187 -3.766 9.124 1.00 0.43 C ATOM 964 O GLU A 496 -7.905 -4.708 9.465 1.00 21.03 O ATOM 965 CB GLU A 496 -5.245 -3.652 10.705 1.00 51.14 C ATOM 966 CG GLU A 496 -4.208 -3.962 9.621 1.00 10.43 C ATOM 967 CD GLU A 496 -3.010 -4.741 10.137 1.00 21.43 C ATOM 968 OE1 GLU A 496 -2.374 -4.288 11.113 1.00 44.32 O ATOM 969 OE2 GLU A 496 -2.694 -5.811 9.569 1.00 3.43 O ATOM 0 H GLU A 496 -7.956 -3.306 11.613 1.00 3.50 H new ATOM 0 HA GLU A 496 -6.149 -1.971 9.707 1.00 63.12 H new ATOM 0 HB2 GLU A 496 -4.774 -3.058 11.488 1.00 51.14 H new ATOM 0 HB3 GLU A 496 -5.570 -4.586 11.164 1.00 51.14 H new ATOM 0 HG2 GLU A 496 -4.686 -4.531 8.824 1.00 10.43 H new ATOM 0 HG3 GLU A 496 -3.862 -3.026 9.182 1.00 10.43 H new ATOM 976 N LYS A 497 -6.985 -3.443 7.849 1.00 42.44 N ATOM 977 CA LYS A 497 -7.554 -4.230 6.745 1.00 51.03 C ATOM 978 C LYS A 497 -6.437 -4.808 5.860 1.00 61.12 C ATOM 979 O LYS A 497 -5.367 -4.210 5.731 1.00 71.22 O ATOM 980 CB LYS A 497 -8.494 -3.364 5.891 1.00 21.34 C ATOM 981 CG LYS A 497 -9.503 -2.545 6.697 1.00 30.10 C ATOM 982 CD LYS A 497 -10.376 -3.408 7.607 1.00 73.50 C ATOM 983 CE LYS A 497 -11.230 -4.393 6.820 1.00 14.43 C ATOM 984 NZ LYS A 497 -12.080 -5.218 7.715 1.00 1.42 N ATOM 0 H LYS A 497 -6.431 -2.641 7.549 1.00 42.44 H new ATOM 0 HA LYS A 497 -8.125 -5.052 7.177 1.00 51.03 H new ATOM 0 HB2 LYS A 497 -7.893 -2.685 5.286 1.00 21.34 H new ATOM 0 HB3 LYS A 497 -9.037 -4.010 5.201 1.00 21.34 H new ATOM 0 HG2 LYS A 497 -8.969 -1.813 7.302 1.00 30.10 H new ATOM 0 HG3 LYS A 497 -10.141 -1.987 6.012 1.00 30.10 H new ATOM 0 HD2 LYS A 497 -9.741 -3.956 8.304 1.00 73.50 H new ATOM 0 HD3 LYS A 497 -11.023 -2.765 8.204 1.00 73.50 H new ATOM 0 HE2 LYS A 497 -11.862 -3.848 6.119 1.00 14.43 H new ATOM 0 HE3 LYS A 497 -10.585 -5.043 6.229 1.00 14.43 H new ATOM 0 HZ1 LYS A 497 -12.647 -5.877 7.145 1.00 1.42 H new ATOM 0 HZ2 LYS A 497 -11.476 -5.757 8.368 1.00 1.42 H new ATOM 0 HZ3 LYS A 497 -12.713 -4.599 8.261 1.00 1.42 H new ATOM 998 N VAL A 498 -6.685 -5.968 5.251 1.00 44.02 N ATOM 999 CA VAL A 498 -5.683 -6.616 4.391 1.00 31.43 C ATOM 1000 C VAL A 498 -6.152 -6.677 2.927 1.00 5.14 C ATOM 1001 O VAL A 498 -7.108 -7.379 2.596 1.00 13.14 O ATOM 1002 CB VAL A 498 -5.355 -8.050 4.886 1.00 11.23 C ATOM 1003 CG1 VAL A 498 -4.242 -8.679 4.045 1.00 42.22 C ATOM 1004 CG2 VAL A 498 -4.977 -8.037 6.368 1.00 71.42 C ATOM 0 H VAL A 498 -7.564 -6.479 5.334 1.00 44.02 H new ATOM 0 HA VAL A 498 -4.781 -6.007 4.447 1.00 31.43 H new ATOM 0 HB VAL A 498 -6.250 -8.661 4.768 1.00 11.23 H new ATOM 0 HG11 VAL A 498 -4.031 -9.683 4.413 1.00 42.22 H new ATOM 0 HG12 VAL A 498 -4.559 -8.733 3.004 1.00 42.22 H new ATOM 0 HG13 VAL A 498 -3.341 -8.069 4.119 1.00 42.22 H new ATOM 0 HG21 VAL A 498 -4.751 -9.052 6.695 1.00 71.42 H new ATOM 0 HG22 VAL A 498 -4.101 -7.405 6.515 1.00 71.42 H new ATOM 0 HG23 VAL A 498 -5.809 -7.645 6.952 1.00 71.42 H new ATOM 1014 N LEU A 499 -5.464 -5.942 2.058 1.00 1.23 N ATOM 1015 CA LEU A 499 -5.801 -5.891 0.629 1.00 4.41 C ATOM 1016 C LEU A 499 -4.790 -6.695 -0.206 1.00 45.42 C ATOM 1017 O LEU A 499 -3.611 -6.753 0.132 1.00 51.23 O ATOM 1018 CB LEU A 499 -5.825 -4.427 0.162 1.00 25.14 C ATOM 1019 CG LEU A 499 -6.730 -3.495 0.992 1.00 65.24 C ATOM 1020 CD1 LEU A 499 -6.561 -2.043 0.559 1.00 24.44 C ATOM 1021 CD2 LEU A 499 -8.193 -3.923 0.882 1.00 1.15 C ATOM 0 H LEU A 499 -4.662 -5.367 2.317 1.00 1.23 H new ATOM 0 HA LEU A 499 -6.785 -6.337 0.487 1.00 4.41 H new ATOM 0 HB2 LEU A 499 -4.808 -4.037 0.186 1.00 25.14 H new ATOM 0 HB3 LEU A 499 -6.154 -4.398 -0.877 1.00 25.14 H new ATOM 0 HG LEU A 499 -6.427 -3.574 2.036 1.00 65.24 H new ATOM 0 HD11 LEU A 499 -7.210 -1.406 1.160 1.00 24.44 H new ATOM 0 HD12 LEU A 499 -5.524 -1.740 0.700 1.00 24.44 H new ATOM 0 HD13 LEU A 499 -6.828 -1.944 -0.493 1.00 24.44 H new ATOM 0 HD21 LEU A 499 -8.814 -3.252 1.475 1.00 1.15 H new ATOM 0 HD22 LEU A 499 -8.507 -3.881 -0.161 1.00 1.15 H new ATOM 0 HD23 LEU A 499 -8.303 -4.942 1.253 1.00 1.15 H new ATOM 1033 N THR A 500 -5.245 -7.321 -1.291 1.00 5.12 N ATOM 1034 CA THR A 500 -4.353 -8.127 -2.149 1.00 13.01 C ATOM 1035 C THR A 500 -4.471 -7.759 -3.631 1.00 72.44 C ATOM 1036 O THR A 500 -5.532 -7.346 -4.108 1.00 40.40 O ATOM 1037 CB THR A 500 -4.632 -9.644 -2.010 1.00 5.12 C ATOM 1038 OG1 THR A 500 -6.041 -9.903 -2.128 1.00 71.15 O ATOM 1039 CG2 THR A 500 -4.111 -10.189 -0.685 1.00 32.21 C ATOM 0 H THR A 500 -6.216 -7.291 -1.602 1.00 5.12 H new ATOM 0 HA THR A 500 -3.345 -7.900 -1.801 1.00 13.01 H new ATOM 0 HB THR A 500 -4.103 -10.154 -2.815 1.00 5.12 H new ATOM 0 HG1 THR A 500 -6.205 -10.865 -2.040 1.00 71.15 H new ATOM 0 HG21 THR A 500 -4.324 -11.256 -0.622 1.00 32.21 H new ATOM 0 HG22 THR A 500 -3.034 -10.030 -0.624 1.00 32.21 H new ATOM 0 HG23 THR A 500 -4.602 -9.671 0.139 1.00 32.21 H new ATOM 1047 N PHE A 501 -3.368 -7.925 -4.359 1.00 44.34 N ATOM 1048 CA PHE A 501 -3.356 -7.727 -5.811 1.00 55.44 C ATOM 1049 C PHE A 501 -2.413 -8.728 -6.500 1.00 70.53 C ATOM 1050 O PHE A 501 -1.401 -9.142 -5.930 1.00 23.05 O ATOM 1051 CB PHE A 501 -2.967 -6.280 -6.159 1.00 3.15 C ATOM 1052 CG PHE A 501 -1.601 -5.856 -5.671 1.00 24.23 C ATOM 1053 CD1 PHE A 501 -1.429 -5.365 -4.382 1.00 34.14 C ATOM 1054 CD2 PHE A 501 -0.493 -5.933 -6.505 1.00 31.43 C ATOM 1055 CE1 PHE A 501 -0.184 -4.959 -3.939 1.00 4.43 C ATOM 1056 CE2 PHE A 501 0.754 -5.531 -6.064 1.00 53.24 C ATOM 1057 CZ PHE A 501 0.909 -5.044 -4.780 1.00 51.33 C ATOM 0 H PHE A 501 -2.467 -8.197 -3.967 1.00 44.34 H new ATOM 0 HA PHE A 501 -4.364 -7.909 -6.183 1.00 55.44 H new ATOM 0 HB2 PHE A 501 -3.004 -6.159 -7.242 1.00 3.15 H new ATOM 0 HB3 PHE A 501 -3.713 -5.607 -5.737 1.00 3.15 H new ATOM 0 HD1 PHE A 501 -2.279 -5.300 -3.718 1.00 34.14 H new ATOM 0 HD2 PHE A 501 -0.607 -6.311 -7.510 1.00 31.43 H new ATOM 0 HE1 PHE A 501 -0.066 -4.576 -2.936 1.00 4.43 H new ATOM 0 HE2 PHE A 501 1.607 -5.598 -6.723 1.00 53.24 H new ATOM 0 HZ PHE A 501 1.883 -4.730 -4.434 1.00 51.33 H new ATOM 1067 N SER A 502 -2.757 -9.112 -7.728 1.00 33.51 N ATOM 1068 CA SER A 502 -1.967 -10.084 -8.498 1.00 72.43 C ATOM 1069 C SER A 502 -1.269 -9.422 -9.697 1.00 4.44 C ATOM 1070 O SER A 502 -1.916 -8.962 -10.637 1.00 23.04 O ATOM 1071 CB SER A 502 -2.869 -11.230 -8.977 1.00 71.51 C ATOM 1072 OG SER A 502 -4.025 -10.736 -9.637 1.00 33.22 O ATOM 0 H SER A 502 -3.582 -8.765 -8.218 1.00 33.51 H new ATOM 0 HA SER A 502 -1.193 -10.482 -7.842 1.00 72.43 H new ATOM 0 HB2 SER A 502 -2.310 -11.877 -9.653 1.00 71.51 H new ATOM 0 HB3 SER A 502 -3.167 -11.841 -8.125 1.00 71.51 H new ATOM 0 HG SER A 502 -3.787 -9.948 -10.168 1.00 33.22 H new ATOM 1078 N TRP A 503 0.058 -9.406 -9.662 1.00 34.33 N ATOM 1079 CA TRP A 503 0.870 -8.703 -10.663 1.00 43.01 C ATOM 1080 C TRP A 503 1.826 -9.664 -11.394 1.00 13.23 C ATOM 1081 O TRP A 503 2.436 -10.540 -10.780 1.00 1.12 O ATOM 1082 CB TRP A 503 1.647 -7.579 -9.962 1.00 34.05 C ATOM 1083 CG TRP A 503 2.649 -6.872 -10.824 1.00 22.32 C ATOM 1084 CD1 TRP A 503 2.408 -6.166 -11.968 1.00 23.15 C ATOM 1085 CD2 TRP A 503 4.058 -6.785 -10.589 1.00 33.34 C ATOM 1086 NE1 TRP A 503 3.582 -5.658 -12.463 1.00 12.05 N ATOM 1087 CE2 TRP A 503 4.609 -6.023 -11.632 1.00 25.33 C ATOM 1088 CE3 TRP A 503 4.909 -7.285 -9.593 1.00 31.32 C ATOM 1089 CZ2 TRP A 503 5.970 -5.743 -11.709 1.00 33.11 C ATOM 1090 CZ3 TRP A 503 6.260 -7.006 -9.671 1.00 43.32 C ATOM 1091 CH2 TRP A 503 6.777 -6.243 -10.722 1.00 51.30 C ATOM 0 H TRP A 503 0.606 -9.877 -8.943 1.00 34.33 H new ATOM 0 HA TRP A 503 0.213 -8.278 -11.423 1.00 43.01 H new ATOM 0 HB2 TRP A 503 0.935 -6.846 -9.583 1.00 34.05 H new ATOM 0 HB3 TRP A 503 2.164 -7.998 -9.098 1.00 34.05 H new ATOM 0 HD1 TRP A 503 1.436 -6.028 -12.417 1.00 23.15 H new ATOM 0 HE1 TRP A 503 3.676 -5.100 -13.311 1.00 12.05 H new ATOM 0 HE3 TRP A 503 4.516 -7.877 -8.780 1.00 31.32 H new ATOM 0 HZ2 TRP A 503 6.375 -5.153 -12.518 1.00 33.11 H new ATOM 0 HZ3 TRP A 503 6.926 -7.383 -8.909 1.00 43.32 H new ATOM 0 HH2 TRP A 503 7.838 -6.043 -10.756 1.00 51.30 H new ATOM 1102 N THR A 504 1.935 -9.504 -12.715 1.00 44.33 N ATOM 1103 CA THR A 504 2.815 -10.349 -13.540 1.00 11.33 C ATOM 1104 C THR A 504 3.870 -9.505 -14.276 1.00 63.02 C ATOM 1105 O THR A 504 3.570 -8.858 -15.283 1.00 22.01 O ATOM 1106 CB THR A 504 2.004 -11.163 -14.583 1.00 4.10 C ATOM 1107 OG1 THR A 504 1.054 -12.012 -13.917 1.00 50.43 O ATOM 1108 CG2 THR A 504 2.916 -12.021 -15.456 1.00 65.11 C ATOM 0 H THR A 504 1.424 -8.795 -13.242 1.00 44.33 H new ATOM 0 HA THR A 504 3.316 -11.038 -12.860 1.00 11.33 H new ATOM 0 HB THR A 504 1.483 -10.450 -15.222 1.00 4.10 H new ATOM 0 HG1 THR A 504 0.546 -12.520 -14.583 1.00 50.43 H new ATOM 0 HG21 THR A 504 2.314 -12.577 -16.175 1.00 65.11 H new ATOM 0 HG22 THR A 504 3.618 -11.380 -15.990 1.00 65.11 H new ATOM 0 HG23 THR A 504 3.469 -12.720 -14.828 1.00 65.11 H new ATOM 1116 N PRO A 505 5.123 -9.489 -13.778 1.00 64.25 N ATOM 1117 CA PRO A 505 6.219 -8.736 -14.412 1.00 24.22 C ATOM 1118 C PRO A 505 6.786 -9.434 -15.665 1.00 74.52 C ATOM 1119 O PRO A 505 7.520 -10.418 -15.563 1.00 12.15 O ATOM 1120 CB PRO A 505 7.274 -8.672 -13.303 1.00 40.32 C ATOM 1121 CG PRO A 505 7.050 -9.908 -12.494 1.00 63.34 C ATOM 1122 CD PRO A 505 5.568 -10.188 -12.552 1.00 24.21 C ATOM 0 HA PRO A 505 5.889 -7.762 -14.773 1.00 24.22 H new ATOM 0 HB2 PRO A 505 8.282 -8.647 -13.717 1.00 40.32 H new ATOM 0 HB3 PRO A 505 7.156 -7.775 -12.696 1.00 40.32 H new ATOM 0 HG2 PRO A 505 7.620 -10.745 -12.897 1.00 63.34 H new ATOM 0 HG3 PRO A 505 7.379 -9.764 -11.465 1.00 63.34 H new ATOM 0 HD2 PRO A 505 5.365 -11.258 -12.606 1.00 24.21 H new ATOM 0 HD3 PRO A 505 5.055 -9.810 -11.668 1.00 24.21 H new ATOM 1130 N THR A 506 6.439 -8.929 -16.847 1.00 53.15 N ATOM 1131 CA THR A 506 6.923 -9.505 -18.114 1.00 52.53 C ATOM 1132 C THR A 506 8.283 -8.919 -18.531 1.00 44.43 C ATOM 1133 O THR A 506 8.970 -9.463 -19.396 1.00 73.14 O ATOM 1134 CB THR A 506 5.901 -9.299 -19.258 1.00 73.15 C ATOM 1135 OG1 THR A 506 5.639 -7.900 -19.441 1.00 73.22 O ATOM 1136 CG2 THR A 506 4.593 -10.024 -18.956 1.00 14.43 C ATOM 0 H THR A 506 5.825 -8.123 -16.961 1.00 53.15 H new ATOM 0 HA THR A 506 7.047 -10.573 -17.937 1.00 52.53 H new ATOM 0 HB THR A 506 6.329 -9.713 -20.171 1.00 73.15 H new ATOM 0 HG1 THR A 506 6.437 -7.463 -19.805 1.00 73.22 H new ATOM 0 HG21 THR A 506 3.891 -9.864 -19.774 1.00 14.43 H new ATOM 0 HG22 THR A 506 4.786 -11.091 -18.846 1.00 14.43 H new ATOM 0 HG23 THR A 506 4.167 -9.635 -18.031 1.00 14.43 H new ATOM 1144 N GLN A 507 8.665 -7.798 -17.921 1.00 24.52 N ATOM 1145 CA GLN A 507 10.011 -7.236 -18.099 1.00 3.14 C ATOM 1146 C GLN A 507 10.883 -7.506 -16.865 1.00 32.20 C ATOM 1147 O GLN A 507 10.433 -7.347 -15.729 1.00 60.40 O ATOM 1148 CB GLN A 507 9.961 -5.720 -18.368 1.00 71.10 C ATOM 1149 CG GLN A 507 9.551 -5.325 -19.783 1.00 31.15 C ATOM 1150 CD GLN A 507 8.095 -5.617 -20.093 1.00 64.04 C ATOM 1151 OE1 GLN A 507 7.754 -6.670 -20.615 1.00 25.42 O ATOM 1152 NE2 GLN A 507 7.219 -4.691 -19.757 1.00 63.43 N ATOM 0 H GLN A 507 8.064 -7.258 -17.298 1.00 24.52 H new ATOM 0 HA GLN A 507 10.451 -7.728 -18.967 1.00 3.14 H new ATOM 0 HB2 GLN A 507 9.264 -5.265 -17.664 1.00 71.10 H new ATOM 0 HB3 GLN A 507 10.944 -5.298 -18.160 1.00 71.10 H new ATOM 0 HG2 GLN A 507 9.738 -4.260 -19.923 1.00 31.15 H new ATOM 0 HG3 GLN A 507 10.180 -5.856 -20.497 1.00 31.15 H new ATOM 0 HE21 GLN A 507 7.535 -3.824 -19.323 1.00 63.43 H new ATOM 0 HE22 GLN A 507 6.225 -4.842 -19.931 1.00 63.43 H new ATOM 1161 N GLU A 508 12.132 -7.892 -17.100 1.00 2.33 N ATOM 1162 CA GLU A 508 13.079 -8.190 -16.012 1.00 31.24 C ATOM 1163 C GLU A 508 13.771 -6.919 -15.479 1.00 32.42 C ATOM 1164 O GLU A 508 13.960 -5.945 -16.210 1.00 53.24 O ATOM 1165 CB GLU A 508 14.117 -9.240 -16.473 1.00 61.21 C ATOM 1166 CG GLU A 508 14.591 -9.100 -17.926 1.00 41.01 C ATOM 1167 CD GLU A 508 15.391 -7.838 -18.208 1.00 74.25 C ATOM 1168 OE1 GLU A 508 16.594 -7.798 -17.869 1.00 20.43 O ATOM 1169 OE2 GLU A 508 14.825 -6.886 -18.791 1.00 73.04 O ATOM 0 H GLU A 508 12.521 -8.009 -18.036 1.00 2.33 H new ATOM 0 HA GLU A 508 12.507 -8.607 -15.183 1.00 31.24 H new ATOM 0 HB2 GLU A 508 14.986 -9.180 -15.817 1.00 61.21 H new ATOM 0 HB3 GLU A 508 13.687 -10.233 -16.342 1.00 61.21 H new ATOM 0 HG2 GLU A 508 15.201 -9.967 -18.181 1.00 41.01 H new ATOM 0 HG3 GLU A 508 13.721 -9.118 -18.582 1.00 41.01 H new ATOM 1176 N GLY A 509 14.135 -6.929 -14.195 1.00 23.31 N ATOM 1177 CA GLY A 509 14.785 -5.770 -13.583 1.00 33.11 C ATOM 1178 C GLY A 509 14.371 -5.546 -12.133 1.00 75.02 C ATOM 1179 O GLY A 509 13.757 -6.414 -11.513 1.00 12.25 O ATOM 0 H GLY A 509 13.992 -7.718 -13.565 1.00 23.31 H new ATOM 0 HA2 GLY A 509 15.866 -5.901 -13.629 1.00 33.11 H new ATOM 0 HA3 GLY A 509 14.547 -4.879 -14.164 1.00 33.11 H new ATOM 1183 N MET A 510 14.715 -4.383 -11.586 1.00 31.14 N ATOM 1184 CA MET A 510 14.342 -4.030 -10.210 1.00 53.23 C ATOM 1185 C MET A 510 12.980 -3.320 -10.163 1.00 73.34 C ATOM 1186 O MET A 510 12.791 -2.264 -10.773 1.00 74.50 O ATOM 1187 CB MET A 510 15.412 -3.136 -9.574 1.00 40.51 C ATOM 1188 CG MET A 510 16.762 -3.821 -9.397 1.00 41.15 C ATOM 1189 SD MET A 510 16.650 -5.338 -8.425 1.00 32.22 S ATOM 1190 CE MET A 510 15.934 -4.727 -6.896 1.00 71.04 C ATOM 0 H MET A 510 15.252 -3.665 -12.072 1.00 31.14 H new ATOM 0 HA MET A 510 14.266 -4.958 -9.644 1.00 53.23 H new ATOM 0 HB2 MET A 510 15.544 -2.248 -10.192 1.00 40.51 H new ATOM 0 HB3 MET A 510 15.057 -2.797 -8.601 1.00 40.51 H new ATOM 0 HG2 MET A 510 17.179 -4.052 -10.377 1.00 41.15 H new ATOM 0 HG3 MET A 510 17.453 -3.133 -8.911 1.00 41.15 H new ATOM 0 HE1 MET A 510 16.050 -5.478 -6.114 1.00 71.04 H new ATOM 0 HE2 MET A 510 16.443 -3.811 -6.597 1.00 71.04 H new ATOM 0 HE3 MET A 510 14.874 -4.521 -7.047 1.00 71.04 H new ATOM 1200 N TYR A 511 12.033 -3.898 -9.429 1.00 74.40 N ATOM 1201 CA TYR A 511 10.692 -3.320 -9.299 1.00 22.33 C ATOM 1202 C TYR A 511 10.352 -3.036 -7.837 1.00 63.14 C ATOM 1203 O TYR A 511 10.183 -3.949 -7.028 1.00 44.43 O ATOM 1204 CB TYR A 511 9.648 -4.247 -9.931 1.00 31.41 C ATOM 1205 CG TYR A 511 9.765 -4.315 -11.440 1.00 73.34 C ATOM 1206 CD1 TYR A 511 10.769 -5.059 -12.046 1.00 72.40 C ATOM 1207 CD2 TYR A 511 8.886 -3.616 -12.258 1.00 63.50 C ATOM 1208 CE1 TYR A 511 10.894 -5.105 -13.418 1.00 24.10 C ATOM 1209 CE2 TYR A 511 9.008 -3.655 -13.631 1.00 41.44 C ATOM 1210 CZ TYR A 511 10.011 -4.402 -14.204 1.00 71.14 C ATOM 1211 OH TYR A 511 10.143 -4.433 -15.570 1.00 22.14 O ATOM 0 H TYR A 511 12.167 -4.768 -8.913 1.00 74.40 H new ATOM 0 HA TYR A 511 10.679 -2.369 -9.832 1.00 22.33 H new ATOM 0 HB2 TYR A 511 9.759 -5.249 -9.516 1.00 31.41 H new ATOM 0 HB3 TYR A 511 8.650 -3.900 -9.663 1.00 31.41 H new ATOM 0 HD1 TYR A 511 11.464 -5.611 -11.431 1.00 72.40 H new ATOM 0 HD2 TYR A 511 8.094 -3.033 -11.811 1.00 63.50 H new ATOM 0 HE1 TYR A 511 11.680 -5.689 -13.873 1.00 24.10 H new ATOM 0 HE2 TYR A 511 8.320 -3.102 -14.253 1.00 41.44 H new ATOM 0 HH TYR A 511 9.440 -3.886 -15.979 1.00 22.14 H new ATOM 1221 N ARG A 512 10.258 -1.758 -7.505 1.00 21.44 N ATOM 1222 CA ARG A 512 9.985 -1.330 -6.137 1.00 32.35 C ATOM 1223 C ARG A 512 8.529 -0.867 -5.977 1.00 52.22 C ATOM 1224 O ARG A 512 8.077 0.066 -6.647 1.00 63.25 O ATOM 1225 CB ARG A 512 10.960 -0.215 -5.751 1.00 34.44 C ATOM 1226 CG ARG A 512 10.862 0.225 -4.295 1.00 71.44 C ATOM 1227 CD ARG A 512 12.097 1.012 -3.880 1.00 42.51 C ATOM 1228 NE ARG A 512 13.311 0.206 -4.008 1.00 72.32 N ATOM 1229 CZ ARG A 512 14.509 0.638 -3.746 1.00 0.03 C ATOM 1230 NH1 ARG A 512 14.706 1.859 -3.374 1.00 33.55 N ATOM 1231 NH2 ARG A 512 15.517 -0.160 -3.874 1.00 52.44 N ATOM 0 H ARG A 512 10.367 -0.991 -8.169 1.00 21.44 H new ATOM 0 HA ARG A 512 10.127 -2.178 -5.468 1.00 32.35 H new ATOM 0 HB2 ARG A 512 11.977 -0.553 -5.949 1.00 34.44 H new ATOM 0 HB3 ARG A 512 10.780 0.648 -6.392 1.00 34.44 H new ATOM 0 HG2 ARG A 512 9.972 0.838 -4.156 1.00 71.44 H new ATOM 0 HG3 ARG A 512 10.751 -0.649 -3.654 1.00 71.44 H new ATOM 0 HD2 ARG A 512 12.185 1.906 -4.497 1.00 42.51 H new ATOM 0 HD3 ARG A 512 11.988 1.347 -2.848 1.00 42.51 H new ATOM 0 HE ARG A 512 13.211 -0.759 -4.324 1.00 72.32 H new ATOM 0 HH11 ARG A 512 13.916 2.498 -3.282 1.00 33.55 H new ATOM 0 HH12 ARG A 512 15.651 2.184 -3.172 1.00 33.55 H new ATOM 0 HH21 ARG A 512 15.370 -1.122 -4.179 1.00 52.44 H new ATOM 0 HH22 ARG A 512 16.460 0.172 -3.670 1.00 52.44 H new ATOM 1245 N ILE A 513 7.803 -1.536 -5.088 1.00 73.34 N ATOM 1246 CA ILE A 513 6.389 -1.241 -4.848 1.00 51.15 C ATOM 1247 C ILE A 513 6.207 -0.292 -3.651 1.00 1.14 C ATOM 1248 O ILE A 513 6.742 -0.526 -2.565 1.00 23.23 O ATOM 1249 CB ILE A 513 5.587 -2.549 -4.599 1.00 33.31 C ATOM 1250 CG1 ILE A 513 5.728 -3.500 -5.805 1.00 1.33 C ATOM 1251 CG2 ILE A 513 4.112 -2.243 -4.318 1.00 71.43 C ATOM 1252 CD1 ILE A 513 4.992 -4.816 -5.643 1.00 65.22 C ATOM 0 H ILE A 513 8.172 -2.294 -4.515 1.00 73.34 H new ATOM 0 HA ILE A 513 6.006 -0.749 -5.742 1.00 51.15 H new ATOM 0 HB ILE A 513 5.999 -3.042 -3.718 1.00 33.31 H new ATOM 0 HG12 ILE A 513 5.357 -2.996 -6.697 1.00 1.33 H new ATOM 0 HG13 ILE A 513 6.786 -3.705 -5.971 1.00 1.33 H new ATOM 0 HG21 ILE A 513 3.573 -3.175 -4.147 1.00 71.43 H new ATOM 0 HG22 ILE A 513 4.034 -1.611 -3.433 1.00 71.43 H new ATOM 0 HG23 ILE A 513 3.679 -1.725 -5.173 1.00 71.43 H new ATOM 0 HD11 ILE A 513 5.141 -5.428 -6.533 1.00 65.22 H new ATOM 0 HD12 ILE A 513 5.378 -5.344 -4.771 1.00 65.22 H new ATOM 0 HD13 ILE A 513 3.928 -4.623 -5.509 1.00 65.22 H new ATOM 1264 N ASN A 514 5.458 0.786 -3.865 1.00 10.52 N ATOM 1265 CA ASN A 514 5.159 1.761 -2.811 1.00 61.42 C ATOM 1266 C ASN A 514 3.645 1.922 -2.623 1.00 72.52 C ATOM 1267 O ASN A 514 2.902 2.029 -3.594 1.00 74.24 O ATOM 1268 CB ASN A 514 5.777 3.123 -3.149 1.00 22.34 C ATOM 1269 CG ASN A 514 7.291 3.099 -3.136 1.00 54.44 C ATOM 1270 OD1 ASN A 514 7.935 2.861 -4.154 1.00 32.01 O ATOM 1271 ND2 ASN A 514 7.872 3.338 -1.980 1.00 0.43 N ATOM 0 H ASN A 514 5.041 1.011 -4.768 1.00 10.52 H new ATOM 0 HA ASN A 514 5.591 1.388 -1.883 1.00 61.42 H new ATOM 0 HB2 ASN A 514 5.431 3.440 -4.133 1.00 22.34 H new ATOM 0 HB3 ASN A 514 5.424 3.865 -2.433 1.00 22.34 H new ATOM 0 HD21 ASN A 514 8.889 3.329 -1.909 1.00 0.43 H new ATOM 0 HD22 ASN A 514 7.305 3.532 -1.155 1.00 0.43 H new ATOM 1278 N ALA A 515 3.192 1.940 -1.374 1.00 1.12 N ATOM 1279 CA ALA A 515 1.770 2.142 -1.075 1.00 41.41 C ATOM 1280 C ALA A 515 1.531 3.482 -0.374 1.00 62.41 C ATOM 1281 O ALA A 515 2.313 3.892 0.489 1.00 50.21 O ATOM 1282 CB ALA A 515 1.235 0.997 -0.222 1.00 4.30 C ATOM 0 H ALA A 515 3.783 1.818 -0.552 1.00 1.12 H new ATOM 0 HA ALA A 515 1.232 2.158 -2.023 1.00 41.41 H new ATOM 0 HB1 ALA A 515 0.179 1.164 -0.010 1.00 4.30 H new ATOM 0 HB2 ALA A 515 1.353 0.056 -0.760 1.00 4.30 H new ATOM 0 HB3 ALA A 515 1.790 0.951 0.715 1.00 4.30 H new ATOM 1288 N THR A 516 0.455 4.165 -0.754 1.00 25.41 N ATOM 1289 CA THR A 516 0.071 5.437 -0.129 1.00 73.02 C ATOM 1290 C THR A 516 -1.398 5.418 0.297 1.00 43.12 C ATOM 1291 O THR A 516 -2.220 4.718 -0.296 1.00 62.55 O ATOM 1292 CB THR A 516 0.291 6.635 -1.081 1.00 14.42 C ATOM 1293 OG1 THR A 516 -0.480 6.461 -2.280 1.00 21.43 O ATOM 1294 CG2 THR A 516 1.769 6.798 -1.438 1.00 65.32 C ATOM 0 H THR A 516 -0.174 3.860 -1.497 1.00 25.41 H new ATOM 0 HA THR A 516 0.710 5.556 0.746 1.00 73.02 H new ATOM 0 HB THR A 516 -0.037 7.537 -0.564 1.00 14.42 H new ATOM 0 HG1 THR A 516 -1.417 6.685 -2.102 1.00 21.43 H new ATOM 0 HG21 THR A 516 1.890 7.649 -2.109 1.00 65.32 H new ATOM 0 HG22 THR A 516 2.346 6.968 -0.529 1.00 65.32 H new ATOM 0 HG23 THR A 516 2.126 5.894 -1.931 1.00 65.32 H new ATOM 1302 N VAL A 517 -1.726 6.186 1.329 1.00 25.42 N ATOM 1303 CA VAL A 517 -3.100 6.257 1.836 1.00 41.41 C ATOM 1304 C VAL A 517 -3.570 7.714 1.991 1.00 22.25 C ATOM 1305 O VAL A 517 -2.789 8.590 2.377 1.00 52.23 O ATOM 1306 CB VAL A 517 -3.222 5.515 3.192 1.00 45.24 C ATOM 1307 CG1 VAL A 517 -2.332 6.154 4.256 1.00 2.54 C ATOM 1308 CG2 VAL A 517 -4.673 5.450 3.654 1.00 3.52 C ATOM 0 H VAL A 517 -1.061 6.771 1.835 1.00 25.42 H new ATOM 0 HA VAL A 517 -3.743 5.769 1.104 1.00 41.41 H new ATOM 0 HB VAL A 517 -2.874 4.493 3.042 1.00 45.24 H new ATOM 0 HG11 VAL A 517 -2.440 5.611 5.195 1.00 2.54 H new ATOM 0 HG12 VAL A 517 -1.292 6.115 3.932 1.00 2.54 H new ATOM 0 HG13 VAL A 517 -2.628 7.193 4.402 1.00 2.54 H new ATOM 0 HG21 VAL A 517 -4.728 4.924 4.607 1.00 3.52 H new ATOM 0 HG22 VAL A 517 -5.062 6.461 3.774 1.00 3.52 H new ATOM 0 HG23 VAL A 517 -5.268 4.918 2.911 1.00 3.52 H new ATOM 1318 N ASP A 518 -4.844 7.964 1.668 1.00 2.42 N ATOM 1319 CA ASP A 518 -5.439 9.306 1.773 1.00 2.24 C ATOM 1320 C ASP A 518 -4.580 10.385 1.090 1.00 22.12 C ATOM 1321 O ASP A 518 -4.333 11.446 1.654 1.00 72.22 O ATOM 1322 CB ASP A 518 -5.697 9.655 3.246 1.00 63.52 C ATOM 1323 CG ASP A 518 -6.942 8.966 3.777 1.00 72.53 C ATOM 1324 OD1 ASP A 518 -6.896 7.736 3.971 1.00 34.42 O ATOM 1325 OD2 ASP A 518 -7.975 9.648 3.976 1.00 44.43 O ATOM 0 H ASP A 518 -5.489 7.250 1.329 1.00 2.42 H new ATOM 0 HA ASP A 518 -6.390 9.286 1.241 1.00 2.24 H new ATOM 0 HB2 ASP A 518 -4.835 9.362 3.846 1.00 63.52 H new ATOM 0 HB3 ASP A 518 -5.806 10.734 3.351 1.00 63.52 H new ATOM 1330 N GLU A 519 -4.151 10.107 -0.142 1.00 52.43 N ATOM 1331 CA GLU A 519 -3.349 11.054 -0.942 1.00 2.13 C ATOM 1332 C GLU A 519 -4.023 12.436 -1.061 1.00 54.11 C ATOM 1333 O GLU A 519 -3.348 13.464 -1.151 1.00 43.11 O ATOM 1334 CB GLU A 519 -3.100 10.471 -2.342 1.00 33.42 C ATOM 1335 CG GLU A 519 -2.167 9.261 -2.364 1.00 60.20 C ATOM 1336 CD GLU A 519 -0.694 9.635 -2.252 1.00 74.13 C ATOM 1337 OE1 GLU A 519 -0.276 10.135 -1.188 1.00 52.12 O ATOM 1338 OE2 GLU A 519 0.053 9.428 -3.236 1.00 33.10 O ATOM 0 H GLU A 519 -4.345 9.226 -0.618 1.00 52.43 H new ATOM 0 HA GLU A 519 -2.401 11.198 -0.425 1.00 2.13 H new ATOM 0 HB2 GLU A 519 -4.057 10.185 -2.779 1.00 33.42 H new ATOM 0 HB3 GLU A 519 -2.680 11.250 -2.978 1.00 33.42 H new ATOM 0 HG2 GLU A 519 -2.429 8.594 -1.543 1.00 60.20 H new ATOM 0 HG3 GLU A 519 -2.325 8.706 -3.289 1.00 60.20 H new ATOM 1345 N GLU A 520 -5.355 12.451 -1.087 1.00 61.51 N ATOM 1346 CA GLU A 520 -6.124 13.702 -1.157 1.00 33.32 C ATOM 1347 C GLU A 520 -6.006 14.532 0.140 1.00 53.11 C ATOM 1348 O GLU A 520 -6.319 15.725 0.150 1.00 1.34 O ATOM 1349 CB GLU A 520 -7.595 13.386 -1.461 1.00 71.04 C ATOM 1350 CG GLU A 520 -8.244 12.432 -0.461 1.00 14.32 C ATOM 1351 CD GLU A 520 -9.634 11.994 -0.893 1.00 72.21 C ATOM 1352 OE1 GLU A 520 -9.737 11.090 -1.751 1.00 22.24 O ATOM 1353 OE2 GLU A 520 -10.628 12.560 -0.391 1.00 31.34 O ATOM 0 H GLU A 520 -5.930 11.609 -1.061 1.00 61.51 H new ATOM 0 HA GLU A 520 -5.706 14.308 -1.961 1.00 33.32 H new ATOM 0 HB2 GLU A 520 -8.160 14.318 -1.478 1.00 71.04 H new ATOM 0 HB3 GLU A 520 -7.664 12.953 -2.459 1.00 71.04 H new ATOM 0 HG2 GLU A 520 -7.611 11.553 -0.339 1.00 14.32 H new ATOM 0 HG3 GLU A 520 -8.306 12.918 0.513 1.00 14.32 H new ATOM 1360 N ASN A 521 -5.559 13.891 1.227 1.00 21.33 N ATOM 1361 CA ASN A 521 -5.331 14.561 2.520 1.00 11.45 C ATOM 1362 C ASN A 521 -6.537 15.412 2.972 1.00 43.32 C ATOM 1363 O ASN A 521 -6.375 16.475 3.575 1.00 45.02 O ATOM 1364 CB ASN A 521 -4.059 15.425 2.457 1.00 54.13 C ATOM 1365 CG ASN A 521 -2.794 14.604 2.264 1.00 64.30 C ATOM 1366 OD1 ASN A 521 -2.792 13.569 1.612 1.00 44.25 O ATOM 1367 ND2 ASN A 521 -1.702 15.063 2.835 1.00 42.50 N ATOM 0 H ASN A 521 -5.344 12.894 1.238 1.00 21.33 H new ATOM 0 HA ASN A 521 -5.201 13.776 3.265 1.00 11.45 H new ATOM 0 HB2 ASN A 521 -4.151 16.139 1.638 1.00 54.13 H new ATOM 0 HB3 ASN A 521 -3.973 16.004 3.377 1.00 54.13 H new ATOM 0 HD21 ASN A 521 -0.824 14.553 2.740 1.00 42.50 H new ATOM 0 HD22 ASN A 521 -1.733 15.929 3.373 1.00 42.50 H new ATOM 1374 N THR A 522 -7.748 14.924 2.705 1.00 2.52 N ATOM 1375 CA THR A 522 -8.975 15.623 3.121 1.00 3.11 C ATOM 1376 C THR A 522 -9.198 15.529 4.637 1.00 42.42 C ATOM 1377 O THR A 522 -9.990 16.283 5.208 1.00 34.02 O ATOM 1378 CB THR A 522 -10.224 15.072 2.392 1.00 42.00 C ATOM 1379 OG1 THR A 522 -10.304 13.644 2.550 1.00 60.44 O ATOM 1380 CG2 THR A 522 -10.189 15.428 0.910 1.00 21.51 C ATOM 0 H THR A 522 -7.911 14.050 2.204 1.00 2.52 H new ATOM 0 HA THR A 522 -8.836 16.669 2.847 1.00 3.11 H new ATOM 0 HB THR A 522 -11.106 15.531 2.838 1.00 42.00 H new ATOM 0 HG1 THR A 522 -10.409 13.223 1.671 1.00 60.44 H new ATOM 0 HG21 THR A 522 -11.077 15.030 0.419 1.00 21.51 H new ATOM 0 HG22 THR A 522 -10.167 16.512 0.797 1.00 21.51 H new ATOM 0 HG23 THR A 522 -9.298 14.997 0.453 1.00 21.51 H new ATOM 1388 N VAL A 523 -8.505 14.594 5.280 1.00 52.52 N ATOM 1389 CA VAL A 523 -8.564 14.437 6.736 1.00 52.14 C ATOM 1390 C VAL A 523 -7.255 14.907 7.397 1.00 72.11 C ATOM 1391 O VAL A 523 -6.165 14.622 6.906 1.00 73.22 O ATOM 1392 CB VAL A 523 -8.850 12.960 7.124 1.00 74.04 C ATOM 1393 CG1 VAL A 523 -7.761 12.025 6.592 1.00 54.53 C ATOM 1394 CG2 VAL A 523 -9.007 12.814 8.637 1.00 71.23 C ATOM 0 H VAL A 523 -7.890 13.927 4.814 1.00 52.52 H new ATOM 0 HA VAL A 523 -9.381 15.060 7.100 1.00 52.14 H new ATOM 0 HB VAL A 523 -9.791 12.670 6.657 1.00 74.04 H new ATOM 0 HG11 VAL A 523 -7.990 10.999 6.880 1.00 54.53 H new ATOM 0 HG12 VAL A 523 -7.719 12.096 5.505 1.00 54.53 H new ATOM 0 HG13 VAL A 523 -6.797 12.313 7.012 1.00 54.53 H new ATOM 0 HG21 VAL A 523 -9.207 11.771 8.883 1.00 71.23 H new ATOM 0 HG22 VAL A 523 -8.089 13.134 9.131 1.00 71.23 H new ATOM 0 HG23 VAL A 523 -9.837 13.432 8.978 1.00 71.23 H new ATOM 1404 N VAL A 524 -7.365 15.646 8.501 1.00 75.33 N ATOM 1405 CA VAL A 524 -6.181 16.115 9.232 1.00 33.42 C ATOM 1406 C VAL A 524 -5.673 15.036 10.202 1.00 33.14 C ATOM 1407 O VAL A 524 -6.350 14.687 11.170 1.00 32.21 O ATOM 1408 CB VAL A 524 -6.476 17.421 10.011 1.00 23.43 C ATOM 1409 CG1 VAL A 524 -5.254 17.875 10.810 1.00 12.44 C ATOM 1410 CG2 VAL A 524 -6.934 18.522 9.057 1.00 3.02 C ATOM 0 H VAL A 524 -8.255 15.933 8.909 1.00 75.33 H new ATOM 0 HA VAL A 524 -5.407 16.322 8.493 1.00 33.42 H new ATOM 0 HB VAL A 524 -7.281 17.217 10.717 1.00 23.43 H new ATOM 0 HG11 VAL A 524 -5.491 18.794 11.346 1.00 12.44 H new ATOM 0 HG12 VAL A 524 -4.977 17.099 11.524 1.00 12.44 H new ATOM 0 HG13 VAL A 524 -4.421 18.056 10.130 1.00 12.44 H new ATOM 0 HG21 VAL A 524 -7.137 19.432 9.622 1.00 3.02 H new ATOM 0 HG22 VAL A 524 -6.151 18.717 8.324 1.00 3.02 H new ATOM 0 HG23 VAL A 524 -7.841 18.204 8.543 1.00 3.02 H new ATOM 1420 N GLU A 525 -4.485 14.510 9.920 1.00 44.22 N ATOM 1421 CA GLU A 525 -3.892 13.432 10.719 1.00 65.41 C ATOM 1422 C GLU A 525 -2.831 13.952 11.703 1.00 31.13 C ATOM 1423 O GLU A 525 -2.475 15.132 11.695 1.00 42.01 O ATOM 1424 CB GLU A 525 -3.254 12.398 9.784 1.00 10.31 C ATOM 1425 CG GLU A 525 -4.240 11.746 8.824 1.00 65.14 C ATOM 1426 CD GLU A 525 -3.543 10.931 7.749 1.00 22.20 C ATOM 1427 OE1 GLU A 525 -3.169 9.774 8.027 1.00 41.41 O ATOM 1428 OE2 GLU A 525 -3.347 11.463 6.634 1.00 45.05 O ATOM 0 H GLU A 525 -3.906 14.814 9.137 1.00 44.22 H new ATOM 0 HA GLU A 525 -4.691 12.978 11.305 1.00 65.41 H new ATOM 0 HB2 GLU A 525 -2.465 12.881 9.207 1.00 10.31 H new ATOM 0 HB3 GLU A 525 -2.780 11.622 10.385 1.00 10.31 H new ATOM 0 HG2 GLU A 525 -4.917 11.101 9.384 1.00 65.14 H new ATOM 0 HG3 GLU A 525 -4.850 12.517 8.354 1.00 65.14 H new ATOM 1435 N LEU A 526 -2.334 13.049 12.546 1.00 24.42 N ATOM 1436 CA LEU A 526 -1.274 13.368 13.511 1.00 31.21 C ATOM 1437 C LEU A 526 0.121 13.303 12.865 1.00 54.22 C ATOM 1438 O LEU A 526 1.069 13.939 13.339 1.00 1.11 O ATOM 1439 CB LEU A 526 -1.330 12.387 14.693 1.00 3.23 C ATOM 1440 CG LEU A 526 -2.623 12.413 15.524 1.00 12.14 C ATOM 1441 CD1 LEU A 526 -2.628 11.280 16.548 1.00 0.43 C ATOM 1442 CD2 LEU A 526 -2.788 13.765 16.216 1.00 72.21 C ATOM 0 H LEU A 526 -2.650 12.080 12.583 1.00 24.42 H new ATOM 0 HA LEU A 526 -1.442 14.387 13.860 1.00 31.21 H new ATOM 0 HB2 LEU A 526 -1.188 11.377 14.309 1.00 3.23 H new ATOM 0 HB3 LEU A 526 -0.490 12.598 15.356 1.00 3.23 H new ATOM 0 HG LEU A 526 -3.467 12.267 14.850 1.00 12.14 H new ATOM 0 HD11 LEU A 526 -3.551 11.316 17.126 1.00 0.43 H new ATOM 0 HD12 LEU A 526 -2.560 10.323 16.032 1.00 0.43 H new ATOM 0 HD13 LEU A 526 -1.776 11.392 17.218 1.00 0.43 H new ATOM 0 HD21 LEU A 526 -3.709 13.765 16.800 1.00 72.21 H new ATOM 0 HD22 LEU A 526 -1.939 13.941 16.877 1.00 72.21 H new ATOM 0 HD23 LEU A 526 -2.834 14.554 15.466 1.00 72.21 H new ATOM 1454 N ASN A 527 0.242 12.530 11.787 1.00 2.41 N ATOM 1455 CA ASN A 527 1.537 12.290 11.142 1.00 5.52 C ATOM 1456 C ASN A 527 1.549 12.800 9.687 1.00 2.43 C ATOM 1457 O ASN A 527 0.501 12.978 9.066 1.00 54.34 O ATOM 1458 CB ASN A 527 1.849 10.787 11.193 1.00 14.31 C ATOM 1459 CG ASN A 527 3.320 10.457 10.995 1.00 43.41 C ATOM 1460 OD1 ASN A 527 4.034 11.120 10.253 1.00 42.24 O ATOM 1461 ND2 ASN A 527 3.787 9.425 11.666 1.00 15.22 N ATOM 0 H ASN A 527 -0.542 12.057 11.339 1.00 2.41 H new ATOM 0 HA ASN A 527 2.306 12.844 11.680 1.00 5.52 H new ATOM 0 HB2 ASN A 527 1.524 10.391 12.155 1.00 14.31 H new ATOM 0 HB3 ASN A 527 1.266 10.278 10.425 1.00 14.31 H new ATOM 0 HD21 ASN A 527 4.768 9.159 11.575 1.00 15.22 H new ATOM 0 HD22 ASN A 527 3.168 8.891 12.277 1.00 15.22 H new ATOM 1468 N GLU A 528 2.747 13.049 9.162 1.00 0.32 N ATOM 1469 CA GLU A 528 2.921 13.552 7.790 1.00 11.42 C ATOM 1470 C GLU A 528 3.722 12.569 6.912 1.00 51.22 C ATOM 1471 O GLU A 528 3.600 12.570 5.686 1.00 54.30 O ATOM 1472 CB GLU A 528 3.635 14.916 7.847 1.00 74.43 C ATOM 1473 CG GLU A 528 3.959 15.534 6.489 1.00 4.23 C ATOM 1474 CD GLU A 528 2.735 15.807 5.628 1.00 53.35 C ATOM 1475 OE1 GLU A 528 1.687 16.216 6.175 1.00 64.21 O ATOM 1476 OE2 GLU A 528 2.831 15.651 4.393 1.00 22.11 O ATOM 0 H GLU A 528 3.622 12.911 9.667 1.00 0.32 H new ATOM 0 HA GLU A 528 1.937 13.659 7.334 1.00 11.42 H new ATOM 0 HB2 GLU A 528 3.010 15.613 8.406 1.00 74.43 H new ATOM 0 HB3 GLU A 528 4.563 14.800 8.407 1.00 74.43 H new ATOM 0 HG2 GLU A 528 4.497 16.469 6.645 1.00 4.23 H new ATOM 0 HG3 GLU A 528 4.630 14.867 5.948 1.00 4.23 H new ATOM 1483 N ASN A 529 4.533 11.719 7.542 1.00 53.24 N ATOM 1484 CA ASN A 529 5.443 10.820 6.808 1.00 10.35 C ATOM 1485 C ASN A 529 4.955 9.357 6.819 1.00 72.42 C ATOM 1486 O ASN A 529 5.511 8.506 6.126 1.00 1.00 O ATOM 1487 CB ASN A 529 6.845 10.887 7.431 1.00 2.53 C ATOM 1488 CG ASN A 529 7.350 12.311 7.611 1.00 32.41 C ATOM 1489 OD1 ASN A 529 8.071 12.608 8.559 1.00 70.32 O ATOM 1490 ND2 ASN A 529 6.994 13.203 6.709 1.00 20.54 N ATOM 0 H ASN A 529 4.583 11.629 8.557 1.00 53.24 H new ATOM 0 HA ASN A 529 5.466 11.156 5.771 1.00 10.35 H new ATOM 0 HB2 ASN A 529 6.830 10.388 8.400 1.00 2.53 H new ATOM 0 HB3 ASN A 529 7.543 10.337 6.800 1.00 2.53 H new ATOM 0 HD21 ASN A 529 7.319 14.167 6.789 1.00 20.54 H new ATOM 0 HD22 ASN A 529 6.394 12.930 5.931 1.00 20.54 H new ATOM 1497 N ASN A 530 3.906 9.075 7.587 1.00 4.32 N ATOM 1498 CA ASN A 530 3.476 7.689 7.839 1.00 3.31 C ATOM 1499 C ASN A 530 2.512 7.157 6.755 1.00 4.42 C ATOM 1500 O ASN A 530 2.194 5.969 6.729 1.00 52.31 O ATOM 1501 CB ASN A 530 2.816 7.611 9.225 1.00 33.45 C ATOM 1502 CG ASN A 530 2.753 6.203 9.782 1.00 33.44 C ATOM 1503 OD1 ASN A 530 3.581 5.354 9.459 1.00 53.55 O ATOM 1504 ND2 ASN A 530 1.787 5.944 10.636 1.00 72.43 N ATOM 0 H ASN A 530 3.334 9.782 8.048 1.00 4.32 H new ATOM 0 HA ASN A 530 4.361 7.054 7.805 1.00 3.31 H new ATOM 0 HB2 ASN A 530 3.369 8.244 9.919 1.00 33.45 H new ATOM 0 HB3 ASN A 530 1.805 8.014 9.161 1.00 33.45 H new ATOM 0 HD21 ASN A 530 1.709 5.016 11.052 1.00 72.43 H new ATOM 0 HD22 ASN A 530 1.116 6.671 10.883 1.00 72.43 H new ATOM 1511 N ASN A 531 2.075 8.033 5.850 1.00 2.10 N ATOM 1512 CA ASN A 531 1.109 7.658 4.801 1.00 34.21 C ATOM 1513 C ASN A 531 1.741 6.826 3.662 1.00 3.12 C ATOM 1514 O ASN A 531 1.050 6.443 2.717 1.00 13.54 O ATOM 1515 CB ASN A 531 0.474 8.921 4.203 1.00 73.33 C ATOM 1516 CG ASN A 531 -0.290 9.741 5.227 1.00 32.42 C ATOM 1517 OD1 ASN A 531 0.286 10.581 5.912 1.00 63.23 O ATOM 1518 ND2 ASN A 531 -1.589 9.526 5.316 1.00 14.32 N ATOM 0 H ASN A 531 2.371 9.009 5.817 1.00 2.10 H new ATOM 0 HA ASN A 531 0.356 7.034 5.282 1.00 34.21 H new ATOM 0 HB2 ASN A 531 1.255 9.539 3.760 1.00 73.33 H new ATOM 0 HB3 ASN A 531 -0.202 8.635 3.397 1.00 73.33 H new ATOM 0 HD21 ASN A 531 -2.152 10.068 5.972 1.00 14.32 H new ATOM 0 HD22 ASN A 531 -2.030 8.818 4.729 1.00 14.32 H new ATOM 1525 N VAL A 532 3.047 6.551 3.744 1.00 14.43 N ATOM 1526 CA VAL A 532 3.761 5.844 2.664 1.00 53.31 C ATOM 1527 C VAL A 532 4.531 4.609 3.177 1.00 33.22 C ATOM 1528 O VAL A 532 5.039 4.601 4.299 1.00 33.33 O ATOM 1529 CB VAL A 532 4.759 6.792 1.942 1.00 43.22 C ATOM 1530 CG1 VAL A 532 5.455 6.084 0.776 1.00 41.41 C ATOM 1531 CG2 VAL A 532 4.054 8.061 1.462 1.00 11.50 C ATOM 0 H VAL A 532 3.632 6.804 4.540 1.00 14.43 H new ATOM 0 HA VAL A 532 2.995 5.507 1.965 1.00 53.31 H new ATOM 0 HB VAL A 532 5.525 7.078 2.663 1.00 43.22 H new ATOM 0 HG11 VAL A 532 6.146 6.774 0.292 1.00 41.41 H new ATOM 0 HG12 VAL A 532 6.006 5.221 1.151 1.00 41.41 H new ATOM 0 HG13 VAL A 532 4.709 5.752 0.054 1.00 41.41 H new ATOM 0 HG21 VAL A 532 4.773 8.709 0.960 1.00 11.50 H new ATOM 0 HG22 VAL A 532 3.258 7.794 0.767 1.00 11.50 H new ATOM 0 HG23 VAL A 532 3.628 8.586 2.317 1.00 11.50 H new ATOM 1541 N ALA A 533 4.602 3.568 2.342 1.00 51.42 N ATOM 1542 CA ALA A 533 5.402 2.366 2.637 1.00 43.14 C ATOM 1543 C ALA A 533 6.196 1.907 1.402 1.00 0.32 C ATOM 1544 O ALA A 533 5.707 1.988 0.274 1.00 30.43 O ATOM 1545 CB ALA A 533 4.507 1.238 3.133 1.00 53.31 C ATOM 0 H ALA A 533 4.112 3.530 1.448 1.00 51.42 H new ATOM 0 HA ALA A 533 6.113 2.625 3.421 1.00 43.14 H new ATOM 0 HB1 ALA A 533 5.114 0.358 3.346 1.00 53.31 H new ATOM 0 HB2 ALA A 533 3.994 1.553 4.042 1.00 53.31 H new ATOM 0 HB3 ALA A 533 3.771 0.994 2.367 1.00 53.31 H new ATOM 1551 N THR A 534 7.423 1.426 1.624 1.00 24.14 N ATOM 1552 CA THR A 534 8.303 0.977 0.528 1.00 44.24 C ATOM 1553 C THR A 534 8.640 -0.520 0.623 1.00 72.53 C ATOM 1554 O THR A 534 8.976 -1.026 1.696 1.00 1.42 O ATOM 1555 CB THR A 534 9.632 1.777 0.510 1.00 64.54 C ATOM 1556 OG1 THR A 534 9.372 3.164 0.252 1.00 54.43 O ATOM 1557 CG2 THR A 534 10.598 1.243 -0.544 1.00 13.22 C ATOM 0 H THR A 534 7.835 1.335 2.553 1.00 24.14 H new ATOM 0 HA THR A 534 7.747 1.155 -0.392 1.00 44.24 H new ATOM 0 HB THR A 534 10.094 1.661 1.490 1.00 64.54 H new ATOM 0 HG1 THR A 534 10.218 3.659 0.244 1.00 54.43 H new ATOM 0 HG21 THR A 534 11.517 1.829 -0.526 1.00 13.22 H new ATOM 0 HG22 THR A 534 10.829 0.199 -0.330 1.00 13.22 H new ATOM 0 HG23 THR A 534 10.139 1.319 -1.530 1.00 13.22 H new ATOM 1565 N PHE A 535 8.557 -1.219 -0.510 1.00 43.33 N ATOM 1566 CA PHE A 535 8.964 -2.630 -0.596 1.00 41.42 C ATOM 1567 C PHE A 535 9.731 -2.888 -1.908 1.00 62.42 C ATOM 1568 O PHE A 535 9.245 -2.569 -2.992 1.00 11.33 O ATOM 1569 CB PHE A 535 7.729 -3.536 -0.510 1.00 2.31 C ATOM 1570 CG PHE A 535 8.047 -5.001 -0.318 1.00 62.40 C ATOM 1571 CD1 PHE A 535 8.301 -5.507 0.950 1.00 63.03 C ATOM 1572 CD2 PHE A 535 8.091 -5.870 -1.401 1.00 54.55 C ATOM 1573 CE1 PHE A 535 8.588 -6.847 1.131 1.00 34.52 C ATOM 1574 CE2 PHE A 535 8.376 -7.209 -1.221 1.00 54.52 C ATOM 1575 CZ PHE A 535 8.628 -7.698 0.045 1.00 24.43 C ATOM 0 H PHE A 535 8.210 -0.832 -1.388 1.00 43.33 H new ATOM 0 HA PHE A 535 9.626 -2.858 0.239 1.00 41.42 H new ATOM 0 HB2 PHE A 535 7.103 -3.200 0.317 1.00 2.31 H new ATOM 0 HB3 PHE A 535 7.143 -3.419 -1.421 1.00 2.31 H new ATOM 0 HD1 PHE A 535 8.274 -4.846 1.804 1.00 63.03 H new ATOM 0 HD2 PHE A 535 7.900 -5.494 -2.395 1.00 54.55 H new ATOM 0 HE1 PHE A 535 8.781 -7.228 2.123 1.00 34.52 H new ATOM 0 HE2 PHE A 535 8.402 -7.874 -2.071 1.00 54.52 H new ATOM 0 HZ PHE A 535 8.856 -8.744 0.185 1.00 24.43 H new ATOM 1585 N ASP A 536 10.931 -3.461 -1.806 1.00 2.24 N ATOM 1586 CA ASP A 536 11.809 -3.643 -2.972 1.00 64.11 C ATOM 1587 C ASP A 536 11.790 -5.100 -3.484 1.00 32.21 C ATOM 1588 O ASP A 536 12.072 -6.038 -2.733 1.00 61.34 O ATOM 1589 CB ASP A 536 13.234 -3.214 -2.596 1.00 44.10 C ATOM 1590 CG ASP A 536 14.221 -3.348 -3.738 1.00 74.32 C ATOM 1591 OD1 ASP A 536 14.210 -2.486 -4.640 1.00 14.32 O ATOM 1592 OD2 ASP A 536 15.028 -4.303 -3.727 1.00 54.14 O ATOM 0 H ASP A 536 11.321 -3.808 -0.930 1.00 2.24 H new ATOM 0 HA ASP A 536 11.441 -3.020 -3.787 1.00 64.11 H new ATOM 0 HB2 ASP A 536 13.217 -2.177 -2.259 1.00 44.10 H new ATOM 0 HB3 ASP A 536 13.578 -3.817 -1.755 1.00 44.10 H new ATOM 1597 N VAL A 537 11.449 -5.277 -4.767 1.00 53.52 N ATOM 1598 CA VAL A 537 11.375 -6.608 -5.390 1.00 12.40 C ATOM 1599 C VAL A 537 12.337 -6.730 -6.587 1.00 21.00 C ATOM 1600 O VAL A 537 12.549 -5.770 -7.332 1.00 24.21 O ATOM 1601 CB VAL A 537 9.933 -6.919 -5.878 1.00 51.30 C ATOM 1602 CG1 VAL A 537 9.846 -8.319 -6.484 1.00 71.40 C ATOM 1603 CG2 VAL A 537 8.929 -6.761 -4.740 1.00 41.23 C ATOM 0 H VAL A 537 11.218 -4.510 -5.399 1.00 53.52 H new ATOM 0 HA VAL A 537 11.666 -7.326 -4.623 1.00 12.40 H new ATOM 0 HB VAL A 537 9.683 -6.199 -6.657 1.00 51.30 H new ATOM 0 HG11 VAL A 537 8.825 -8.509 -6.817 1.00 71.40 H new ATOM 0 HG12 VAL A 537 10.524 -8.390 -7.334 1.00 71.40 H new ATOM 0 HG13 VAL A 537 10.126 -9.058 -5.734 1.00 71.40 H new ATOM 0 HG21 VAL A 537 7.927 -6.984 -5.106 1.00 41.23 H new ATOM 0 HG22 VAL A 537 9.182 -7.449 -3.933 1.00 41.23 H new ATOM 0 HG23 VAL A 537 8.960 -5.737 -4.367 1.00 41.23 H new ATOM 1613 N SER A 538 12.917 -7.918 -6.770 1.00 44.33 N ATOM 1614 CA SER A 538 13.807 -8.188 -7.912 1.00 55.54 C ATOM 1615 C SER A 538 13.186 -9.208 -8.878 1.00 11.40 C ATOM 1616 O SER A 538 12.769 -10.294 -8.467 1.00 22.25 O ATOM 1617 CB SER A 538 15.171 -8.708 -7.428 1.00 31.24 C ATOM 1618 OG SER A 538 16.055 -8.936 -8.519 1.00 75.14 O ATOM 0 H SER A 538 12.789 -8.713 -6.143 1.00 44.33 H new ATOM 0 HA SER A 538 13.947 -7.246 -8.442 1.00 55.54 H new ATOM 0 HB2 SER A 538 15.615 -7.986 -6.742 1.00 31.24 H new ATOM 0 HB3 SER A 538 15.032 -9.634 -6.870 1.00 31.24 H new ATOM 0 HG SER A 538 16.476 -8.091 -8.781 1.00 75.14 H new ATOM 1624 N VAL A 539 13.117 -8.848 -10.159 1.00 74.41 N ATOM 1625 CA VAL A 539 12.583 -9.743 -11.195 1.00 35.20 C ATOM 1626 C VAL A 539 13.716 -10.330 -12.057 1.00 33.40 C ATOM 1627 O VAL A 539 14.462 -9.593 -12.710 1.00 21.14 O ATOM 1628 CB VAL A 539 11.580 -9.004 -12.116 1.00 15.21 C ATOM 1629 CG1 VAL A 539 10.998 -9.953 -13.165 1.00 13.52 C ATOM 1630 CG2 VAL A 539 10.470 -8.353 -11.294 1.00 65.21 C ATOM 0 H VAL A 539 13.424 -7.941 -10.509 1.00 74.41 H new ATOM 0 HA VAL A 539 12.065 -10.552 -10.680 1.00 35.20 H new ATOM 0 HB VAL A 539 12.120 -8.216 -12.641 1.00 15.21 H new ATOM 0 HG11 VAL A 539 10.297 -9.409 -13.798 1.00 13.52 H new ATOM 0 HG12 VAL A 539 11.804 -10.356 -13.778 1.00 13.52 H new ATOM 0 HG13 VAL A 539 10.478 -10.771 -12.667 1.00 13.52 H new ATOM 0 HG21 VAL A 539 9.777 -7.840 -11.961 1.00 65.21 H new ATOM 0 HG22 VAL A 539 9.934 -9.120 -10.734 1.00 65.21 H new ATOM 0 HG23 VAL A 539 10.905 -7.634 -10.600 1.00 65.21 H new ATOM 1640 N VAL A 540 13.827 -11.657 -12.072 1.00 14.34 N ATOM 1641 CA VAL A 540 14.909 -12.344 -12.796 1.00 44.42 C ATOM 1642 C VAL A 540 14.387 -13.175 -13.983 1.00 52.43 C ATOM 1643 O VAL A 540 13.213 -13.541 -14.036 1.00 30.12 O ATOM 1644 CB VAL A 540 15.708 -13.272 -11.841 1.00 4.15 C ATOM 1645 CG1 VAL A 540 16.385 -12.459 -10.736 1.00 53.42 C ATOM 1646 CG2 VAL A 540 14.798 -14.348 -11.242 1.00 55.22 C ATOM 0 H VAL A 540 13.182 -12.284 -11.591 1.00 14.34 H new ATOM 0 HA VAL A 540 15.561 -11.563 -13.188 1.00 44.42 H new ATOM 0 HB VAL A 540 16.485 -13.769 -12.422 1.00 4.15 H new ATOM 0 HG11 VAL A 540 16.939 -13.129 -10.079 1.00 53.42 H new ATOM 0 HG12 VAL A 540 17.071 -11.739 -11.182 1.00 53.42 H new ATOM 0 HG13 VAL A 540 15.628 -11.929 -10.159 1.00 53.42 H new ATOM 0 HG21 VAL A 540 15.379 -14.986 -10.576 1.00 55.22 H new ATOM 0 HG22 VAL A 540 13.994 -13.873 -10.679 1.00 55.22 H new ATOM 0 HG23 VAL A 540 14.372 -14.952 -12.043 1.00 55.22 H new ATOM 1656 N LEU A 541 15.276 -13.467 -14.936 1.00 61.45 N ATOM 1657 CA LEU A 541 14.941 -14.308 -16.097 1.00 13.03 C ATOM 1658 C LEU A 541 15.004 -15.804 -15.750 1.00 42.33 C ATOM 1659 O LEU A 541 14.306 -16.619 -16.356 1.00 5.33 O ATOM 1660 CB LEU A 541 15.904 -14.020 -17.261 1.00 74.02 C ATOM 1661 CG LEU A 541 15.752 -12.642 -17.925 1.00 22.14 C ATOM 1662 CD1 LEU A 541 16.890 -12.390 -18.913 1.00 41.30 C ATOM 1663 CD2 LEU A 541 14.402 -12.534 -18.629 1.00 41.22 C ATOM 0 H LEU A 541 16.240 -13.133 -14.929 1.00 61.45 H new ATOM 0 HA LEU A 541 13.920 -14.063 -16.391 1.00 13.03 H new ATOM 0 HB2 LEU A 541 16.926 -14.116 -16.895 1.00 74.02 H new ATOM 0 HB3 LEU A 541 15.765 -14.787 -18.022 1.00 74.02 H new ATOM 0 HG LEU A 541 15.799 -11.881 -17.146 1.00 22.14 H new ATOM 0 HD11 LEU A 541 16.763 -11.409 -19.372 1.00 41.30 H new ATOM 0 HD12 LEU A 541 17.844 -12.423 -18.386 1.00 41.30 H new ATOM 0 HD13 LEU A 541 16.876 -13.157 -19.687 1.00 41.30 H new ATOM 0 HD21 LEU A 541 14.311 -11.552 -19.093 1.00 41.22 H new ATOM 0 HD22 LEU A 541 14.328 -13.306 -19.395 1.00 41.22 H new ATOM 0 HD23 LEU A 541 13.601 -12.667 -17.902 1.00 41.22 H new ATOM 1675 N GLU A 542 15.851 -16.151 -14.781 1.00 43.50 N ATOM 1676 CA GLU A 542 16.070 -17.556 -14.384 1.00 11.11 C ATOM 1677 C GLU A 542 14.827 -18.187 -13.702 1.00 75.31 C ATOM 1678 O GLU A 542 14.717 -18.148 -12.453 1.00 37.87 O ATOM 1679 CB GLU A 542 17.315 -17.655 -13.477 1.00 44.32 C ATOM 1680 CG GLU A 542 17.359 -16.614 -12.358 1.00 42.21 C ATOM 1681 CD GLU A 542 18.548 -16.790 -11.426 1.00 21.15 C ATOM 1682 OE1 GLU A 542 19.664 -16.361 -11.787 1.00 53.43 O ATOM 1683 OE2 GLU A 542 18.372 -17.366 -10.330 1.00 23.44 O ATOM 0 H GLU A 542 16.404 -15.479 -14.249 1.00 43.50 H new ATOM 0 HA GLU A 542 16.241 -18.133 -15.293 1.00 11.11 H new ATOM 0 HB2 GLU A 542 17.350 -18.650 -13.034 1.00 44.32 H new ATOM 0 HB3 GLU A 542 18.208 -17.549 -14.092 1.00 44.32 H new ATOM 0 HG2 GLU A 542 17.394 -15.617 -12.798 1.00 42.21 H new ATOM 0 HG3 GLU A 542 16.438 -16.674 -11.778 1.00 42.21 H new