USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1226 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: B 14 LYS NZ :NH3+ -170:sc= 2.22 (180deg=0.876) USER MOD Set 1.2: B 81 ASN : amide:sc= 1.07 K(o=3.3,f=-8.3!) USER MOD Set 2.1: B 78 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-1.8!) USER MOD Set 2.2: B 80 SER OG : rot -60:sc= 0 USER MOD Set 3.1: B 45 HIS : no HE2:sc= 0.402 K(o=1.1,f=-0.83) USER MOD Set 3.2: B 75 THR OG1 : rot -126:sc= 0.656 USER MOD Set 4.1: B 54 LYS NZ :NH3+ -108:sc= 1.49 (180deg=-3.28!) USER MOD Set 4.2: B 66 GLN : amide:sc= 0.878 K(o=-0.37,f=-13!) USER MOD Set 4.3: B 76 ASN : amide:sc= -2.74! C(o=-0.37!,f=-9.9!) USER MOD Set 5.1: B 51 LYS NZ :NH3+ 176:sc= 2.23 (180deg=1.23) USER MOD Set 5.2: B 52 CYS SG : rot -40:sc= 0.717 USER MOD Set 6.1: B 38 LYS NZ :NH3+ 180:sc= 2.35 (180deg=1.24) USER MOD Set 6.2: B 42 THR OG1 : rot -137:sc= 0.727 USER MOD Set 7.1: A 405 TYR OH : rot 150:sc= -0.21 USER MOD Set 7.2: A 426 TYR OH : rot 180:sc= -0.264 USER MOD Single : A 397 MET CE :methyl -127:sc= 0 (180deg=-1.14) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 406 SER OG : rot 133:sc= 1.27 USER MOD Single : A 409 SER OG : rot -93:sc= 0.914 USER MOD Single : A 410 GLN : amide:sc= 1.13 K(o=1.1,f=-0.017) USER MOD Single : A 417 GLN : amide:sc= -0.408 X(o=-0.41,f=-0.13) USER MOD Single : A 418 MET CE :methyl -169:sc= -3.52! (180deg=-4.01!) USER MOD Single : A 419 THR OG1 : rot 180:sc= -0.0616 USER MOD Single : A 423 LYS NZ :NH3+ 165:sc= -3.82! (180deg=-4.27!) USER MOD Single : A 429 MET CE :methyl -169:sc= -4.56! (180deg=-4.84!) USER MOD Single : A 431 GLN : amide:sc= -0.31 K(o=-0.31,f=-0.91) USER MOD Single : A 433 MET CE :methyl -143:sc= -2.88! (180deg=-6.07!) USER MOD Single : B 13 LYS NZ :NH3+ 169:sc= 2.02 (180deg=1.81) USER MOD Single : B 17 GLN :FLIP amide:sc= -0.754 F(o=-2.3!,f=-0.75) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 GLN : amide:sc= -0.0264 X(o=-0.026,f=0) USER MOD Single : B 25 TYR OH : rot 30:sc= 1.27 USER MOD Single : B 27 MET CE :methyl -134:sc= -2.08 (180deg=-9.49!) USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -149:sc= -0.717 (180deg=-1.62) USER MOD Single : B 47 TYR OH : rot 180:sc= -1.71! USER MOD Single : B 53 GLN : amide:sc= -4.18! C(o=-4.2!,f=-4.3!) USER MOD Single : B 56 SER OG : rot 150:sc= 0.292 USER MOD Single : B 60 LYS NZ :NH3+ -111:sc= -0.46! (180deg=-5.36!) USER MOD Single : B 62 LYS NZ :NH3+ -143:sc= 0.98 (180deg=-1.14!) USER MOD Single : B 64 GLN : amide:sc= -4.82! C(o=-4.8!,f=-8!) USER MOD Single : B 70 HIS : no HE2:sc= -3.46 K(o=-3.5,f=-6.1!) USER MOD Single : B 74 THR OG1 : rot 31:sc= 0.128 USER MOD Single : B 83 SER OG : rot 78:sc= 1.19 USER MOD Single : B 84 THR OG1 : rot 180:sc= -0.047 USER MOD Single : B 87 LYS NZ :NH3+ 176:sc= 1.3 (180deg=1.29) USER MOD Single : B 93 LYS NZ :NH3+ 149:sc= -0.175! (180deg=-2.41!) USER MOD Single : B 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : B 102 LYS NZ :NH3+ -175:sc= 0.57 (180deg=0.507) USER MOD Single : B 104 LYS NZ :NH3+ -133:sc= 2.02 (180deg=-0.542!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 9.948 12.488 13.494 1.00 0.00 N ATOM 59 CA GLU A 382 8.546 12.518 13.109 1.00 0.00 C ATOM 60 C GLU A 382 8.379 12.119 11.657 1.00 0.00 C ATOM 61 O GLU A 382 8.873 12.793 10.755 1.00 0.00 O ATOM 62 CB GLU A 382 7.935 13.906 13.327 1.00 0.00 C ATOM 63 CG GLU A 382 6.418 13.958 13.134 1.00 0.00 C ATOM 64 CD GLU A 382 6.003 14.123 11.680 1.00 0.00 C ATOM 65 OE1 GLU A 382 6.221 15.213 11.117 1.00 0.00 O ATOM 66 OE2 GLU A 382 5.474 13.155 11.084 1.00 0.00 O ATOM 0 HA GLU A 382 8.023 11.803 13.743 1.00 0.00 H new ATOM 0 HB2 GLU A 382 8.174 14.242 14.336 1.00 0.00 H new ATOM 0 HB3 GLU A 382 8.403 14.609 12.638 1.00 0.00 H new ATOM 0 HG2 GLU A 382 5.977 13.043 13.529 1.00 0.00 H new ATOM 0 HG3 GLU A 382 6.012 14.785 13.717 1.00 0.00 H new ATOM 73 N GLU A 383 7.700 11.008 11.454 1.00 0.00 N ATOM 74 CA GLU A 383 7.399 10.505 10.125 1.00 0.00 C ATOM 75 C GLU A 383 6.031 9.836 10.162 1.00 0.00 C ATOM 76 O GLU A 383 5.600 9.209 9.201 1.00 0.00 O ATOM 77 CB GLU A 383 8.478 9.528 9.640 1.00 0.00 C ATOM 78 CG GLU A 383 9.763 10.202 9.169 1.00 0.00 C ATOM 79 CD GLU A 383 9.585 11.011 7.893 1.00 0.00 C ATOM 80 OE1 GLU A 383 8.711 11.907 7.862 1.00 0.00 O ATOM 81 OE2 GLU A 383 10.334 10.761 6.923 1.00 0.00 O ATOM 0 H GLU A 383 7.339 10.424 12.209 1.00 0.00 H new ATOM 0 HA GLU A 383 7.385 11.334 9.417 1.00 0.00 H new ATOM 0 HB2 GLU A 383 8.718 8.838 10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 383 8.072 8.932 8.822 1.00 0.00 H new ATOM 0 HG2 GLU A 383 10.132 10.857 9.958 1.00 0.00 H new ATOM 0 HG3 GLU A 383 10.525 9.441 9.005 1.00 0.00 H new ATOM 88 N ASP A 384 5.354 10.011 11.294 1.00 0.00 N ATOM 89 CA ASP A 384 4.027 9.451 11.540 1.00 0.00 C ATOM 90 C ASP A 384 3.406 10.206 12.707 1.00 0.00 C ATOM 91 O ASP A 384 4.127 10.617 13.617 1.00 0.00 O ATOM 92 CB ASP A 384 4.104 7.950 11.858 1.00 0.00 C ATOM 93 CG ASP A 384 2.735 7.315 12.065 1.00 0.00 C ATOM 94 OD1 ASP A 384 1.720 7.923 11.655 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.675 6.198 12.624 1.00 0.00 O ATOM 0 H ASP A 384 5.717 10.554 12.078 1.00 0.00 H new ATOM 0 HA ASP A 384 3.415 9.560 10.645 1.00 0.00 H new ATOM 0 HB2 ASP A 384 4.617 7.438 11.044 1.00 0.00 H new ATOM 0 HB3 ASP A 384 4.705 7.805 12.755 1.00 0.00 H new ATOM 100 N ASP A 385 2.085 10.369 12.679 1.00 0.00 N ATOM 101 CA ASP A 385 1.362 11.109 13.720 1.00 0.00 C ATOM 102 C ASP A 385 -0.118 11.232 13.366 1.00 0.00 C ATOM 103 O ASP A 385 -0.981 11.272 14.240 1.00 0.00 O ATOM 104 CB ASP A 385 1.965 12.512 13.897 1.00 0.00 C ATOM 105 CG ASP A 385 1.097 13.438 14.728 1.00 0.00 C ATOM 106 OD1 ASP A 385 1.085 13.298 15.966 1.00 0.00 O ATOM 107 OD2 ASP A 385 0.441 14.322 14.134 1.00 0.00 O ATOM 0 H ASP A 385 1.486 9.997 11.942 1.00 0.00 H new ATOM 0 HA ASP A 385 1.458 10.556 14.654 1.00 0.00 H new ATOM 0 HB2 ASP A 385 2.944 12.422 14.369 1.00 0.00 H new ATOM 0 HB3 ASP A 385 2.124 12.958 12.915 1.00 0.00 H new ATOM 112 N GLU A 386 -0.413 11.239 12.071 1.00 0.00 N ATOM 113 CA GLU A 386 -1.771 11.390 11.597 1.00 0.00 C ATOM 114 C GLU A 386 -1.932 10.563 10.356 1.00 0.00 C ATOM 115 O GLU A 386 -2.046 11.098 9.253 1.00 0.00 O ATOM 116 CB GLU A 386 -2.051 12.842 11.247 1.00 0.00 C ATOM 117 CG GLU A 386 -3.041 13.546 12.148 1.00 0.00 C ATOM 118 CD GLU A 386 -3.379 14.923 11.619 1.00 0.00 C ATOM 119 OE1 GLU A 386 -2.434 15.704 11.366 1.00 0.00 O ATOM 120 OE2 GLU A 386 -4.573 15.211 11.423 1.00 0.00 O ATOM 0 H GLU A 386 0.281 11.141 11.330 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.462 11.070 12.377 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.110 13.392 11.270 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.422 12.886 10.223 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -3.951 12.951 12.228 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -2.626 13.631 13.152 1.00 0.00 H new ATOM 127 N PHE A 387 -1.907 9.266 10.518 1.00 0.00 N ATOM 128 CA PHE A 387 -1.998 8.400 9.376 1.00 0.00 C ATOM 129 C PHE A 387 -3.269 7.577 9.366 1.00 0.00 C ATOM 130 O PHE A 387 -3.741 7.113 10.403 1.00 0.00 O ATOM 131 CB PHE A 387 -0.797 7.459 9.332 1.00 0.00 C ATOM 132 CG PHE A 387 0.479 8.098 8.878 1.00 0.00 C ATOM 133 CD1 PHE A 387 0.555 9.462 8.696 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.611 7.333 8.642 1.00 0.00 C ATOM 135 CE1 PHE A 387 1.716 10.051 8.292 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.782 7.924 8.232 1.00 0.00 C ATOM 137 CZ PHE A 387 2.830 9.285 8.059 1.00 0.00 C ATOM 0 H PHE A 387 -1.825 8.792 11.418 1.00 0.00 H new ATOM 0 HA PHE A 387 -2.011 9.044 8.497 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.644 7.039 10.326 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.028 6.627 8.667 1.00 0.00 H new ATOM 0 HD1 PHE A 387 -0.317 10.073 8.876 1.00 0.00 H new ATOM 0 HD2 PHE A 387 1.572 6.263 8.782 1.00 0.00 H new ATOM 0 HE1 PHE A 387 1.759 11.121 8.155 1.00 0.00 H new ATOM 0 HE2 PHE A 387 3.659 7.321 8.047 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.748 9.754 7.738 1.00 0.00 H new ATOM 147 N GLU A 388 -3.789 7.390 8.170 1.00 0.00 N ATOM 148 CA GLU A 388 -4.971 6.591 7.951 1.00 0.00 C ATOM 149 C GLU A 388 -4.496 5.200 7.648 1.00 0.00 C ATOM 150 O GLU A 388 -3.741 5.025 6.689 1.00 0.00 O ATOM 151 CB GLU A 388 -5.770 7.095 6.741 1.00 0.00 C ATOM 152 CG GLU A 388 -6.769 8.189 7.049 1.00 0.00 C ATOM 153 CD GLU A 388 -7.877 7.731 7.977 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.637 7.663 9.201 1.00 0.00 O ATOM 155 OE2 GLU A 388 -8.981 7.431 7.478 1.00 0.00 O ATOM 0 H GLU A 388 -3.398 7.793 7.318 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.615 6.638 8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.071 7.462 5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.301 6.252 6.298 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.248 9.033 7.502 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.207 8.547 6.117 1.00 0.00 H new ATOM 162 N GLU A 389 -4.857 4.223 8.458 1.00 0.00 N ATOM 163 CA GLU A 389 -4.432 2.875 8.163 1.00 0.00 C ATOM 164 C GLU A 389 -5.069 2.491 6.840 1.00 0.00 C ATOM 165 O GLU A 389 -6.270 2.234 6.763 1.00 0.00 O ATOM 166 CB GLU A 389 -4.819 1.892 9.277 1.00 0.00 C ATOM 167 CG GLU A 389 -4.422 0.449 8.980 1.00 0.00 C ATOM 168 CD GLU A 389 -3.306 -0.076 9.871 1.00 0.00 C ATOM 169 OE1 GLU A 389 -2.342 0.671 10.135 1.00 0.00 O ATOM 170 OE2 GLU A 389 -3.389 -1.251 10.299 1.00 0.00 O ATOM 0 H GLU A 389 -5.425 4.333 9.298 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.345 2.830 8.097 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -4.347 2.206 10.208 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -5.897 1.939 9.434 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -5.297 -0.190 9.095 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -4.108 0.375 7.939 1.00 0.00 H new ATOM 177 N VAL A 390 -4.256 2.470 5.797 1.00 0.00 N ATOM 178 CA VAL A 390 -4.745 2.152 4.487 1.00 0.00 C ATOM 179 C VAL A 390 -4.964 0.662 4.405 1.00 0.00 C ATOM 180 O VAL A 390 -4.024 -0.122 4.563 1.00 0.00 O ATOM 181 CB VAL A 390 -3.789 2.558 3.343 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.517 2.517 2.012 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.187 3.928 3.563 1.00 0.00 C ATOM 0 H VAL A 390 -3.257 2.671 5.843 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.665 2.721 4.353 1.00 0.00 H new ATOM 0 HB VAL A 390 -2.971 1.838 3.333 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.833 2.805 1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -4.884 1.507 1.829 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.358 3.209 2.036 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.522 4.171 2.734 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -3.983 4.670 3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.621 3.932 4.495 1.00 0.00 H new ATOM 193 N ALA A 391 -6.192 0.278 4.176 1.00 0.00 N ATOM 194 CA ALA A 391 -6.533 -1.109 4.080 1.00 0.00 C ATOM 195 C ALA A 391 -6.122 -1.640 2.728 1.00 0.00 C ATOM 196 O ALA A 391 -6.164 -0.922 1.733 1.00 0.00 O ATOM 197 CB ALA A 391 -8.024 -1.308 4.306 1.00 0.00 C ATOM 0 H ALA A 391 -6.977 0.917 4.052 1.00 0.00 H new ATOM 0 HA ALA A 391 -5.999 -1.662 4.853 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.265 -2.368 4.229 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.293 -0.945 5.298 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.583 -0.753 3.553 1.00 0.00 H new ATOM 203 N ASP A 392 -5.651 -2.862 2.730 1.00 0.00 N ATOM 204 CA ASP A 392 -5.247 -3.568 1.528 1.00 0.00 C ATOM 205 C ASP A 392 -6.475 -3.893 0.684 1.00 0.00 C ATOM 206 O ASP A 392 -6.834 -5.052 0.484 1.00 0.00 O ATOM 207 CB ASP A 392 -4.513 -4.847 1.925 1.00 0.00 C ATOM 208 CG ASP A 392 -5.127 -5.518 3.141 1.00 0.00 C ATOM 209 OD1 ASP A 392 -4.942 -5.000 4.269 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.775 -6.571 2.985 1.00 0.00 O ATOM 0 H ASP A 392 -5.533 -3.410 3.582 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.579 -2.943 0.935 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.524 -5.543 1.086 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.469 -4.613 2.132 1.00 0.00 H new ATOM 215 N ASP A 393 -7.097 -2.842 0.188 1.00 0.00 N ATOM 216 CA ASP A 393 -8.309 -2.945 -0.599 1.00 0.00 C ATOM 217 C ASP A 393 -8.019 -3.257 -2.058 1.00 0.00 C ATOM 218 O ASP A 393 -7.364 -2.479 -2.754 1.00 0.00 O ATOM 219 CB ASP A 393 -9.061 -1.625 -0.508 1.00 0.00 C ATOM 220 CG ASP A 393 -10.570 -1.797 -0.418 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.169 -2.436 -1.317 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.167 -1.279 0.546 1.00 0.00 O ATOM 0 H ASP A 393 -6.772 -1.884 0.321 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.906 -3.765 -0.200 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -8.712 -1.076 0.366 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -8.823 -1.018 -1.382 1.00 0.00 H new ATOM 227 N PRO A 394 -8.505 -4.401 -2.543 1.00 0.00 N ATOM 228 CA PRO A 394 -8.332 -4.798 -3.927 1.00 0.00 C ATOM 229 C PRO A 394 -9.353 -4.114 -4.828 1.00 0.00 C ATOM 230 O PRO A 394 -10.379 -3.615 -4.362 1.00 0.00 O ATOM 231 CB PRO A 394 -8.573 -6.303 -3.882 1.00 0.00 C ATOM 232 CG PRO A 394 -9.559 -6.474 -2.791 1.00 0.00 C ATOM 233 CD PRO A 394 -9.246 -5.411 -1.767 1.00 0.00 C ATOM 0 HA PRO A 394 -7.357 -4.526 -4.331 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -8.959 -6.674 -4.831 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.652 -6.849 -3.677 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.577 -6.365 -3.166 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.486 -7.469 -2.353 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.153 -4.995 -1.328 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.647 -5.807 -0.946 1.00 0.00 H new ATOM 241 N ILE A 395 -9.084 -4.116 -6.114 1.00 0.00 N ATOM 242 CA ILE A 395 -9.977 -3.486 -7.071 1.00 0.00 C ATOM 243 C ILE A 395 -10.750 -4.542 -7.840 1.00 0.00 C ATOM 244 O ILE A 395 -10.165 -5.404 -8.499 1.00 0.00 O ATOM 245 CB ILE A 395 -9.213 -2.576 -8.063 1.00 0.00 C ATOM 246 CG1 ILE A 395 -8.768 -1.290 -7.366 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.065 -2.246 -9.288 1.00 0.00 C ATOM 248 CD1 ILE A 395 -9.903 -0.531 -6.714 1.00 0.00 C ATOM 0 H ILE A 395 -8.255 -4.546 -6.525 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.669 -2.861 -6.507 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.332 -3.120 -8.405 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.024 -1.536 -6.608 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.280 -0.642 -8.094 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -9.498 -1.606 -9.964 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.335 -3.168 -9.803 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -10.971 -1.729 -8.972 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -9.513 0.369 -6.239 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -10.637 -0.254 -7.470 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.377 -1.161 -5.962 1.00 0.00 H new ATOM 260 N VAL A 396 -12.057 -4.479 -7.724 1.00 0.00 N ATOM 261 CA VAL A 396 -12.937 -5.396 -8.411 1.00 0.00 C ATOM 262 C VAL A 396 -13.863 -4.591 -9.312 1.00 0.00 C ATOM 263 O VAL A 396 -14.630 -3.747 -8.846 1.00 0.00 O ATOM 264 CB VAL A 396 -13.723 -6.288 -7.409 1.00 0.00 C ATOM 265 CG1 VAL A 396 -14.014 -5.550 -6.114 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.001 -6.834 -8.023 1.00 0.00 C ATOM 0 H VAL A 396 -12.541 -3.789 -7.149 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.351 -6.081 -9.024 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.083 -7.138 -7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.564 -6.204 -5.438 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.076 -5.252 -5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.611 -4.663 -6.327 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.521 -7.452 -7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.644 -6.006 -8.321 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.756 -7.436 -8.898 1.00 0.00 H new ATOM 276 N MET A 397 -13.764 -4.830 -10.609 1.00 0.00 N ATOM 277 CA MET A 397 -14.552 -4.103 -11.568 1.00 0.00 C ATOM 278 C MET A 397 -15.943 -4.682 -11.651 1.00 0.00 C ATOM 279 O MET A 397 -16.135 -5.886 -11.511 1.00 0.00 O ATOM 280 CB MET A 397 -13.880 -4.131 -12.943 1.00 0.00 C ATOM 281 CG MET A 397 -12.383 -3.862 -12.888 1.00 0.00 C ATOM 282 SD MET A 397 -11.657 -3.587 -14.514 1.00 0.00 S ATOM 283 CE MET A 397 -12.217 -1.920 -14.849 1.00 0.00 C ATOM 0 H MET A 397 -13.140 -5.527 -11.015 1.00 0.00 H new ATOM 0 HA MET A 397 -14.626 -3.066 -11.240 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.050 -5.104 -13.403 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.352 -3.388 -13.585 1.00 0.00 H new ATOM 0 HG2 MET A 397 -12.199 -2.989 -12.262 1.00 0.00 H new ATOM 0 HG3 MET A 397 -11.885 -4.707 -12.412 1.00 0.00 H new ATOM 0 HE1 MET A 397 -12.719 -1.892 -15.816 1.00 0.00 H new ATOM 0 HE2 MET A 397 -12.912 -1.606 -14.070 1.00 0.00 H new ATOM 0 HE3 MET A 397 -11.361 -1.245 -14.865 1.00 0.00 H new ATOM 293 N VAL A 398 -16.904 -3.803 -11.814 1.00 0.00 N ATOM 294 CA VAL A 398 -18.290 -4.184 -11.944 1.00 0.00 C ATOM 295 C VAL A 398 -18.894 -3.447 -13.124 1.00 0.00 C ATOM 296 O VAL A 398 -18.901 -2.214 -13.144 1.00 0.00 O ATOM 297 CB VAL A 398 -19.099 -3.866 -10.680 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.559 -4.194 -10.912 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.559 -4.632 -9.482 1.00 0.00 C ATOM 0 H VAL A 398 -16.744 -2.797 -11.860 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.329 -5.262 -12.097 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.005 -2.802 -10.463 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.130 -3.967 -10.012 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -20.938 -3.599 -11.743 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.661 -5.253 -11.149 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.150 -4.389 -8.599 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.621 -5.703 -9.677 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.519 -4.354 -9.311 1.00 0.00 H new ATOM 309 N ALA A 399 -19.360 -4.200 -14.113 1.00 0.00 N ATOM 310 CA ALA A 399 -19.940 -3.634 -15.320 1.00 0.00 C ATOM 311 C ALA A 399 -18.885 -2.812 -16.056 1.00 0.00 C ATOM 312 O ALA A 399 -19.205 -1.871 -16.788 1.00 0.00 O ATOM 313 CB ALA A 399 -21.172 -2.793 -14.994 1.00 0.00 C ATOM 0 H ALA A 399 -19.345 -5.220 -14.099 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.268 -4.445 -15.971 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.586 -2.382 -15.915 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -21.921 -3.418 -14.507 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.890 -1.978 -14.327 1.00 0.00 H new ATOM 319 N GLY A 400 -17.615 -3.169 -15.851 1.00 0.00 N ATOM 320 CA GLY A 400 -16.537 -2.453 -16.497 1.00 0.00 C ATOM 321 C GLY A 400 -16.146 -1.208 -15.728 1.00 0.00 C ATOM 322 O GLY A 400 -15.423 -0.346 -16.235 1.00 0.00 O ATOM 0 H GLY A 400 -17.321 -3.939 -15.250 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -15.671 -3.108 -16.592 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -16.839 -2.176 -17.507 1.00 0.00 H new ATOM 326 N ARG A 401 -16.657 -1.092 -14.511 1.00 0.00 N ATOM 327 CA ARG A 401 -16.350 0.039 -13.649 1.00 0.00 C ATOM 328 C ARG A 401 -15.453 -0.430 -12.512 1.00 0.00 C ATOM 329 O ARG A 401 -15.831 -1.316 -11.754 1.00 0.00 O ATOM 330 CB ARG A 401 -17.629 0.655 -13.076 1.00 0.00 C ATOM 331 CG ARG A 401 -18.710 0.947 -14.105 1.00 0.00 C ATOM 332 CD ARG A 401 -18.346 2.131 -14.982 1.00 0.00 C ATOM 333 NE ARG A 401 -17.457 1.744 -16.079 1.00 0.00 N ATOM 334 CZ ARG A 401 -17.535 2.226 -17.318 1.00 0.00 C ATOM 335 NH1 ARG A 401 -18.454 3.136 -17.627 1.00 0.00 N ATOM 336 NH2 ARG A 401 -16.691 1.793 -18.248 1.00 0.00 N ATOM 0 H ARG A 401 -17.292 -1.774 -14.096 1.00 0.00 H new ATOM 0 HA ARG A 401 -15.840 0.801 -14.239 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -18.036 -0.020 -12.323 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -17.372 1.583 -12.566 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -18.866 0.067 -14.729 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -19.652 1.148 -13.596 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -19.255 2.574 -15.390 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -17.863 2.897 -14.376 1.00 0.00 H new ATOM 0 HE ARG A 401 -16.728 1.058 -15.881 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -19.103 3.468 -16.914 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -18.510 3.502 -18.577 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -15.987 1.094 -18.012 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -16.747 2.160 -19.198 1.00 0.00 H new ATOM 350 N PRO A 402 -14.253 0.143 -12.384 1.00 0.00 N ATOM 351 CA PRO A 402 -13.311 -0.255 -11.340 1.00 0.00 C ATOM 352 C PRO A 402 -13.703 0.242 -9.950 1.00 0.00 C ATOM 353 O PRO A 402 -13.553 1.421 -9.632 1.00 0.00 O ATOM 354 CB PRO A 402 -11.996 0.381 -11.792 1.00 0.00 C ATOM 355 CG PRO A 402 -12.400 1.570 -12.595 1.00 0.00 C ATOM 356 CD PRO A 402 -13.720 1.222 -13.237 1.00 0.00 C ATOM 0 HA PRO A 402 -13.267 -1.339 -11.233 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -11.383 0.671 -10.938 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.405 -0.315 -12.387 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -12.497 2.452 -11.962 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -11.650 1.801 -13.351 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -14.391 2.080 -13.262 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -13.589 0.890 -14.267 1.00 0.00 H new ATOM 364 N PHE A 403 -14.221 -0.666 -9.139 1.00 0.00 N ATOM 365 CA PHE A 403 -14.612 -0.347 -7.775 1.00 0.00 C ATOM 366 C PHE A 403 -13.719 -1.105 -6.812 1.00 0.00 C ATOM 367 O PHE A 403 -13.074 -2.076 -7.197 1.00 0.00 O ATOM 368 CB PHE A 403 -16.072 -0.735 -7.520 1.00 0.00 C ATOM 369 CG PHE A 403 -17.057 -0.022 -8.405 1.00 0.00 C ATOM 370 CD1 PHE A 403 -17.153 1.361 -8.394 1.00 0.00 C ATOM 371 CD2 PHE A 403 -17.884 -0.740 -9.254 1.00 0.00 C ATOM 372 CE1 PHE A 403 -18.059 2.012 -9.215 1.00 0.00 C ATOM 373 CE2 PHE A 403 -18.787 -0.096 -10.075 1.00 0.00 C ATOM 374 CZ PHE A 403 -18.876 1.282 -10.057 1.00 0.00 C ATOM 0 H PHE A 403 -14.382 -1.638 -9.404 1.00 0.00 H new ATOM 0 HA PHE A 403 -14.507 0.727 -7.624 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.182 -1.810 -7.663 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.317 -0.525 -6.479 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -16.515 1.936 -7.739 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -17.821 -1.818 -9.273 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -18.127 3.090 -9.197 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -19.424 -0.670 -10.732 1.00 0.00 H new ATOM 0 HZ PHE A 403 -19.582 1.788 -10.699 1.00 0.00 H new ATOM 384 N SER A 404 -13.660 -0.667 -5.574 1.00 0.00 N ATOM 385 CA SER A 404 -12.858 -1.356 -4.588 1.00 0.00 C ATOM 386 C SER A 404 -13.696 -2.463 -3.966 1.00 0.00 C ATOM 387 O SER A 404 -14.919 -2.468 -4.100 1.00 0.00 O ATOM 388 CB SER A 404 -12.365 -0.383 -3.522 1.00 0.00 C ATOM 389 OG SER A 404 -12.114 0.898 -4.079 1.00 0.00 O ATOM 0 H SER A 404 -14.153 0.156 -5.228 1.00 0.00 H new ATOM 0 HA SER A 404 -11.980 -1.790 -5.066 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.108 -0.299 -2.729 1.00 0.00 H new ATOM 0 HB3 SER A 404 -11.454 -0.770 -3.065 1.00 0.00 H new ATOM 0 HG SER A 404 -11.801 1.505 -3.376 1.00 0.00 H new ATOM 395 N TYR A 405 -13.058 -3.388 -3.289 1.00 0.00 N ATOM 396 CA TYR A 405 -13.765 -4.497 -2.675 1.00 0.00 C ATOM 397 C TYR A 405 -14.687 -3.997 -1.578 1.00 0.00 C ATOM 398 O TYR A 405 -15.841 -4.410 -1.513 1.00 0.00 O ATOM 399 CB TYR A 405 -12.796 -5.540 -2.127 1.00 0.00 C ATOM 400 CG TYR A 405 -13.484 -6.806 -1.668 1.00 0.00 C ATOM 401 CD1 TYR A 405 -14.017 -6.911 -0.388 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.614 -7.893 -2.523 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.657 -8.063 0.025 1.00 0.00 C ATOM 404 CE2 TYR A 405 -14.255 -9.046 -2.116 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.775 -9.126 -0.841 1.00 0.00 C ATOM 406 OH TYR A 405 -15.418 -10.270 -0.438 1.00 0.00 O ATOM 0 H TYR A 405 -12.048 -3.398 -3.147 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.368 -4.977 -3.446 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -12.066 -5.789 -2.897 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.244 -5.110 -1.291 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.929 -6.078 0.294 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -13.207 -7.835 -3.522 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -15.063 -8.129 1.023 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -14.349 -9.882 -2.793 1.00 0.00 H new ATOM 0 HH TYR A 405 -15.836 -10.701 -1.213 1.00 0.00 H new ATOM 416 N SER A 406 -14.193 -3.094 -0.733 1.00 0.00 N ATOM 417 CA SER A 406 -15.010 -2.537 0.345 1.00 0.00 C ATOM 418 C SER A 406 -16.161 -1.716 -0.234 1.00 0.00 C ATOM 419 O SER A 406 -17.096 -1.343 0.469 1.00 0.00 O ATOM 420 CB SER A 406 -14.160 -1.677 1.276 1.00 0.00 C ATOM 421 OG SER A 406 -13.084 -2.425 1.808 1.00 0.00 O ATOM 0 H SER A 406 -13.239 -2.734 -0.772 1.00 0.00 H new ATOM 0 HA SER A 406 -15.425 -3.362 0.924 1.00 0.00 H new ATOM 0 HB2 SER A 406 -13.775 -0.815 0.732 1.00 0.00 H new ATOM 0 HB3 SER A 406 -14.777 -1.292 2.088 1.00 0.00 H new ATOM 0 HG SER A 406 -12.255 -1.909 1.727 1.00 0.00 H new ATOM 427 N GLU A 407 -16.077 -1.454 -1.528 1.00 0.00 N ATOM 428 CA GLU A 407 -17.094 -0.710 -2.242 1.00 0.00 C ATOM 429 C GLU A 407 -18.115 -1.665 -2.837 1.00 0.00 C ATOM 430 O GLU A 407 -19.320 -1.531 -2.622 1.00 0.00 O ATOM 431 CB GLU A 407 -16.440 0.134 -3.337 1.00 0.00 C ATOM 432 CG GLU A 407 -16.077 1.537 -2.885 1.00 0.00 C ATOM 433 CD GLU A 407 -17.305 2.412 -2.707 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.389 1.867 -2.419 1.00 0.00 O ATOM 435 OE2 GLU A 407 -17.201 3.640 -2.875 1.00 0.00 O ATOM 0 H GLU A 407 -15.297 -1.754 -2.113 1.00 0.00 H new ATOM 0 HA GLU A 407 -17.610 -0.045 -1.550 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -15.539 -0.371 -3.685 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.118 0.199 -4.188 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.530 1.485 -1.944 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -15.410 1.993 -3.617 1.00 0.00 H new ATOM 442 N VAL A 408 -17.614 -2.650 -3.562 1.00 0.00 N ATOM 443 CA VAL A 408 -18.455 -3.651 -4.195 1.00 0.00 C ATOM 444 C VAL A 408 -19.216 -4.470 -3.148 1.00 0.00 C ATOM 445 O VAL A 408 -20.329 -4.930 -3.390 1.00 0.00 O ATOM 446 CB VAL A 408 -17.608 -4.602 -5.071 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.482 -5.618 -5.766 1.00 0.00 C ATOM 448 CG2 VAL A 408 -16.797 -3.831 -6.097 1.00 0.00 C ATOM 0 H VAL A 408 -16.616 -2.778 -3.728 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.173 -3.126 -4.825 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.919 -5.126 -4.409 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.862 -6.275 -6.376 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -19.015 -6.210 -5.022 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.202 -5.104 -6.403 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.212 -4.528 -6.697 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.470 -3.270 -6.745 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.126 -3.141 -5.586 1.00 0.00 H new ATOM 458 N SER A 409 -18.616 -4.629 -1.975 1.00 0.00 N ATOM 459 CA SER A 409 -19.233 -5.407 -0.901 1.00 0.00 C ATOM 460 C SER A 409 -20.352 -4.633 -0.213 1.00 0.00 C ATOM 461 O SER A 409 -21.344 -5.219 0.219 1.00 0.00 O ATOM 462 CB SER A 409 -18.183 -5.821 0.134 1.00 0.00 C ATOM 463 OG SER A 409 -17.396 -4.715 0.537 1.00 0.00 O ATOM 0 H SER A 409 -17.706 -4.232 -1.741 1.00 0.00 H new ATOM 0 HA SER A 409 -19.666 -6.298 -1.356 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.677 -6.255 1.003 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.540 -6.594 -0.286 1.00 0.00 H new ATOM 0 HG SER A 409 -16.593 -4.663 -0.023 1.00 0.00 H new ATOM 469 N GLN A 410 -20.191 -3.321 -0.116 1.00 0.00 N ATOM 470 CA GLN A 410 -21.188 -2.485 0.537 1.00 0.00 C ATOM 471 C GLN A 410 -22.333 -2.155 -0.408 1.00 0.00 C ATOM 472 O GLN A 410 -23.399 -1.724 0.029 1.00 0.00 O ATOM 473 CB GLN A 410 -20.554 -1.194 1.054 1.00 0.00 C ATOM 474 CG GLN A 410 -19.726 -1.383 2.312 1.00 0.00 C ATOM 475 CD GLN A 410 -19.223 -0.070 2.877 1.00 0.00 C ATOM 476 OE1 GLN A 410 -19.845 0.522 3.758 1.00 0.00 O ATOM 477 NE2 GLN A 410 -18.099 0.400 2.364 1.00 0.00 N ATOM 0 H GLN A 410 -19.384 -2.814 -0.479 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.588 -3.047 1.381 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -19.921 -0.772 0.273 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -21.342 -0.467 1.254 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -20.326 -1.893 3.065 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -18.876 -2.029 2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -17.614 -0.122 1.634 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -17.717 1.285 2.698 1.00 0.00 H new ATOM 486 N ARG A 411 -22.112 -2.356 -1.699 1.00 0.00 N ATOM 487 CA ARG A 411 -23.134 -2.062 -2.690 1.00 0.00 C ATOM 488 C ARG A 411 -23.667 -3.338 -3.344 1.00 0.00 C ATOM 489 O ARG A 411 -23.086 -3.864 -4.308 1.00 0.00 O ATOM 490 CB ARG A 411 -22.580 -1.108 -3.745 1.00 0.00 C ATOM 491 CG ARG A 411 -22.024 0.178 -3.156 1.00 0.00 C ATOM 492 CD ARG A 411 -21.579 1.136 -4.243 1.00 0.00 C ATOM 493 NE ARG A 411 -20.628 2.130 -3.747 1.00 0.00 N ATOM 494 CZ ARG A 411 -20.779 3.444 -3.874 1.00 0.00 C ATOM 495 NH1 ARG A 411 -21.897 3.941 -4.397 1.00 0.00 N ATOM 496 NH2 ARG A 411 -19.816 4.262 -3.459 1.00 0.00 N ATOM 0 H ARG A 411 -21.239 -2.719 -2.082 1.00 0.00 H new ATOM 0 HA ARG A 411 -23.970 -1.583 -2.181 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.793 -1.613 -4.305 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.370 -0.863 -4.455 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -22.784 0.655 -2.537 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -21.181 -0.053 -2.505 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.122 0.573 -5.057 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -22.450 1.644 -4.657 1.00 0.00 H new ATOM 0 HE ARG A 411 -19.792 1.792 -3.271 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -22.641 3.313 -4.702 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -22.010 4.950 -4.493 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -18.966 3.880 -3.045 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -19.928 5.271 -3.555 1.00 0.00 H new ATOM 510 N PRO A 412 -24.790 -3.854 -2.821 1.00 0.00 N ATOM 511 CA PRO A 412 -25.430 -5.059 -3.344 1.00 0.00 C ATOM 512 C PRO A 412 -25.852 -4.893 -4.800 1.00 0.00 C ATOM 513 O PRO A 412 -25.888 -5.863 -5.553 1.00 0.00 O ATOM 514 CB PRO A 412 -26.662 -5.244 -2.450 1.00 0.00 C ATOM 515 CG PRO A 412 -26.371 -4.455 -1.221 1.00 0.00 C ATOM 516 CD PRO A 412 -25.526 -3.300 -1.671 1.00 0.00 C ATOM 0 HA PRO A 412 -24.754 -5.914 -3.329 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.565 -4.886 -2.944 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.824 -6.296 -2.214 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.291 -4.107 -0.752 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -25.846 -5.060 -0.482 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -26.135 -2.442 -1.957 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.851 -2.964 -0.884 1.00 0.00 H new ATOM 524 N GLU A 413 -26.147 -3.654 -5.197 1.00 0.00 N ATOM 525 CA GLU A 413 -26.562 -3.369 -6.564 1.00 0.00 C ATOM 526 C GLU A 413 -25.392 -3.597 -7.499 1.00 0.00 C ATOM 527 O GLU A 413 -25.566 -4.031 -8.632 1.00 0.00 O ATOM 528 CB GLU A 413 -27.059 -1.928 -6.720 1.00 0.00 C ATOM 529 CG GLU A 413 -27.686 -1.346 -5.470 1.00 0.00 C ATOM 530 CD GLU A 413 -26.675 -0.590 -4.637 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.915 -1.247 -3.900 1.00 0.00 O ATOM 532 OE2 GLU A 413 -26.623 0.651 -4.737 1.00 0.00 O ATOM 0 H GLU A 413 -26.105 -2.836 -4.590 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.387 -4.038 -6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.222 -1.298 -7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.789 -1.893 -7.529 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.501 -0.677 -5.749 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -28.122 -2.148 -4.874 1.00 0.00 H new ATOM 539 N LEU A 414 -24.192 -3.311 -7.007 1.00 0.00 N ATOM 540 CA LEU A 414 -22.991 -3.505 -7.795 1.00 0.00 C ATOM 541 C LEU A 414 -22.811 -4.981 -8.083 1.00 0.00 C ATOM 542 O LEU A 414 -22.642 -5.378 -9.224 1.00 0.00 O ATOM 543 CB LEU A 414 -21.758 -2.955 -7.076 1.00 0.00 C ATOM 544 CG LEU A 414 -21.608 -1.434 -7.111 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.215 -1.033 -6.657 1.00 0.00 C ATOM 546 CD2 LEU A 414 -21.894 -0.896 -8.506 1.00 0.00 C ATOM 0 H LEU A 414 -24.030 -2.945 -6.069 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.101 -2.958 -8.731 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.791 -3.277 -6.035 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.869 -3.402 -7.520 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.335 -0.999 -6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -20.121 0.053 -6.687 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -20.049 -1.384 -5.638 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.474 -1.479 -7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.781 0.188 -8.508 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.193 -1.335 -9.216 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -22.913 -1.156 -8.794 1.00 0.00 H new ATOM 558 N VAL A 415 -22.905 -5.798 -7.050 1.00 0.00 N ATOM 559 CA VAL A 415 -22.754 -7.242 -7.217 1.00 0.00 C ATOM 560 C VAL A 415 -23.927 -7.792 -8.032 1.00 0.00 C ATOM 561 O VAL A 415 -23.809 -8.810 -8.725 1.00 0.00 O ATOM 562 CB VAL A 415 -22.657 -7.948 -5.842 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.691 -9.462 -5.978 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.394 -7.512 -5.117 1.00 0.00 C ATOM 0 H VAL A 415 -23.083 -5.496 -6.092 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.828 -7.440 -7.756 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.528 -7.652 -5.258 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.621 -9.918 -4.990 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.625 -9.764 -6.451 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.851 -9.791 -6.590 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.337 -8.015 -4.152 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.522 -7.775 -5.715 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.417 -6.433 -4.963 1.00 0.00 H new ATOM 574 N ALA A 416 -25.041 -7.079 -7.972 1.00 0.00 N ATOM 575 CA ALA A 416 -26.246 -7.449 -8.697 1.00 0.00 C ATOM 576 C ALA A 416 -26.147 -7.058 -10.168 1.00 0.00 C ATOM 577 O ALA A 416 -26.880 -7.577 -11.007 1.00 0.00 O ATOM 578 CB ALA A 416 -27.447 -6.775 -8.063 1.00 0.00 C ATOM 0 H ALA A 416 -25.135 -6.227 -7.419 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.361 -8.532 -8.643 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.350 -7.053 -8.607 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.537 -7.094 -7.024 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.319 -5.693 -8.101 1.00 0.00 H new ATOM 584 N GLN A 417 -25.241 -6.140 -10.474 1.00 0.00 N ATOM 585 CA GLN A 417 -25.048 -5.683 -11.841 1.00 0.00 C ATOM 586 C GLN A 417 -23.712 -6.178 -12.338 1.00 0.00 C ATOM 587 O GLN A 417 -23.316 -5.926 -13.475 1.00 0.00 O ATOM 588 CB GLN A 417 -25.100 -4.155 -11.930 1.00 0.00 C ATOM 589 CG GLN A 417 -26.466 -3.570 -11.608 1.00 0.00 C ATOM 590 CD GLN A 417 -27.519 -3.940 -12.635 1.00 0.00 C ATOM 591 OE1 GLN A 417 -27.761 -3.201 -13.585 1.00 0.00 O ATOM 592 NE2 GLN A 417 -28.144 -5.095 -12.459 1.00 0.00 N ATOM 0 H GLN A 417 -24.627 -5.697 -9.791 1.00 0.00 H new ATOM 0 HA GLN A 417 -25.853 -6.081 -12.460 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.364 -3.735 -11.245 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -24.811 -3.848 -12.935 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -26.784 -3.920 -10.626 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.387 -2.484 -11.550 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -27.915 -5.682 -11.657 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -28.854 -5.397 -13.126 1.00 0.00 H new ATOM 601 N MET A 418 -23.021 -6.892 -11.467 1.00 0.00 N ATOM 602 CA MET A 418 -21.734 -7.425 -11.796 1.00 0.00 C ATOM 603 C MET A 418 -21.926 -8.717 -12.554 1.00 0.00 C ATOM 604 O MET A 418 -22.754 -9.565 -12.192 1.00 0.00 O ATOM 605 CB MET A 418 -20.885 -7.605 -10.531 1.00 0.00 C ATOM 606 CG MET A 418 -20.674 -9.040 -10.100 1.00 0.00 C ATOM 607 SD MET A 418 -20.161 -9.170 -8.378 1.00 0.00 S ATOM 608 CE MET A 418 -18.736 -8.085 -8.371 1.00 0.00 C ATOM 0 H MET A 418 -23.342 -7.111 -10.524 1.00 0.00 H new ATOM 0 HA MET A 418 -21.187 -6.731 -12.435 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.911 -7.145 -10.697 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.359 -7.062 -9.713 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.598 -9.600 -10.244 1.00 0.00 H new ATOM 0 HG3 MET A 418 -19.919 -9.501 -10.737 1.00 0.00 H new ATOM 0 HE1 MET A 418 -18.191 -8.206 -7.435 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.083 -8.337 -9.207 1.00 0.00 H new ATOM 0 HE3 MET A 418 -19.066 -7.051 -8.467 1.00 0.00 H new ATOM 618 N THR A 419 -21.162 -8.843 -13.602 1.00 0.00 N ATOM 619 CA THR A 419 -21.224 -10.003 -14.484 1.00 0.00 C ATOM 620 C THR A 419 -20.727 -11.246 -13.761 1.00 0.00 C ATOM 621 O THR A 419 -20.169 -11.134 -12.674 1.00 0.00 O ATOM 622 CB THR A 419 -20.364 -9.773 -15.740 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.050 -9.363 -15.351 1.00 0.00 O ATOM 624 CG2 THR A 419 -20.986 -8.718 -16.643 1.00 0.00 C ATOM 0 H THR A 419 -20.471 -8.147 -13.881 1.00 0.00 H new ATOM 0 HA THR A 419 -22.263 -10.146 -14.780 1.00 0.00 H new ATOM 0 HB THR A 419 -20.309 -10.708 -16.297 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.502 -9.218 -16.151 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.358 -8.576 -17.522 1.00 0.00 H new ATOM 0 HG22 THR A 419 -21.978 -9.045 -16.955 1.00 0.00 H new ATOM 0 HG23 THR A 419 -21.068 -7.777 -16.100 1.00 0.00 H new ATOM 632 N PRO A 420 -20.964 -12.450 -14.310 1.00 0.00 N ATOM 633 CA PRO A 420 -20.465 -13.683 -13.700 1.00 0.00 C ATOM 634 C PRO A 420 -18.955 -13.596 -13.524 1.00 0.00 C ATOM 635 O PRO A 420 -18.416 -13.907 -12.466 1.00 0.00 O ATOM 636 CB PRO A 420 -20.839 -14.771 -14.710 1.00 0.00 C ATOM 637 CG PRO A 420 -21.975 -14.199 -15.487 1.00 0.00 C ATOM 638 CD PRO A 420 -21.736 -12.715 -15.540 1.00 0.00 C ATOM 0 HA PRO A 420 -20.883 -13.877 -12.712 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -19.998 -15.013 -15.360 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -21.129 -15.694 -14.207 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -22.015 -14.624 -16.490 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -22.928 -14.424 -15.008 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -21.180 -12.429 -16.433 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -22.672 -12.157 -15.555 1.00 0.00 H new ATOM 646 N GLU A 421 -18.291 -13.106 -14.566 1.00 0.00 N ATOM 647 CA GLU A 421 -16.850 -12.932 -14.554 1.00 0.00 C ATOM 648 C GLU A 421 -16.436 -12.032 -13.393 1.00 0.00 C ATOM 649 O GLU A 421 -15.501 -12.345 -12.656 1.00 0.00 O ATOM 650 CB GLU A 421 -16.374 -12.329 -15.880 1.00 0.00 C ATOM 651 CG GLU A 421 -16.791 -13.129 -17.106 1.00 0.00 C ATOM 652 CD GLU A 421 -18.084 -12.628 -17.726 1.00 0.00 C ATOM 653 OE1 GLU A 421 -19.120 -12.633 -17.028 1.00 0.00 O ATOM 654 OE2 GLU A 421 -18.063 -12.234 -18.908 1.00 0.00 O ATOM 0 H GLU A 421 -18.738 -12.821 -15.437 1.00 0.00 H new ATOM 0 HA GLU A 421 -16.385 -13.909 -14.426 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -16.766 -11.316 -15.969 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -15.287 -12.250 -15.862 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -15.996 -13.085 -17.850 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -16.909 -14.176 -16.828 1.00 0.00 H new ATOM 661 N GLU A 422 -17.146 -10.917 -13.229 1.00 0.00 N ATOM 662 CA GLU A 422 -16.861 -9.978 -12.161 1.00 0.00 C ATOM 663 C GLU A 422 -17.256 -10.564 -10.804 1.00 0.00 C ATOM 664 O GLU A 422 -16.555 -10.378 -9.812 1.00 0.00 O ATOM 665 CB GLU A 422 -17.583 -8.667 -12.456 1.00 0.00 C ATOM 666 CG GLU A 422 -16.924 -7.896 -13.589 1.00 0.00 C ATOM 667 CD GLU A 422 -17.810 -6.817 -14.162 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.055 -6.967 -14.099 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.271 -5.816 -14.682 1.00 0.00 O ATOM 0 H GLU A 422 -17.925 -10.647 -13.829 1.00 0.00 H new ATOM 0 HA GLU A 422 -15.790 -9.781 -12.112 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.621 -8.875 -12.715 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.596 -8.050 -11.557 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.001 -7.445 -13.225 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -16.648 -8.591 -14.382 1.00 0.00 H new ATOM 676 N LYS A 423 -18.389 -11.258 -10.772 1.00 0.00 N ATOM 677 CA LYS A 423 -18.873 -11.921 -9.562 1.00 0.00 C ATOM 678 C LYS A 423 -17.849 -12.906 -9.031 1.00 0.00 C ATOM 679 O LYS A 423 -17.431 -12.818 -7.878 1.00 0.00 O ATOM 680 CB LYS A 423 -20.170 -12.673 -9.866 1.00 0.00 C ATOM 681 CG LYS A 423 -20.836 -13.278 -8.641 1.00 0.00 C ATOM 682 CD LYS A 423 -21.775 -12.295 -7.963 1.00 0.00 C ATOM 683 CE LYS A 423 -23.120 -12.223 -8.672 1.00 0.00 C ATOM 684 NZ LYS A 423 -23.107 -11.269 -9.816 1.00 0.00 N ATOM 0 H LYS A 423 -18.998 -11.378 -11.581 1.00 0.00 H new ATOM 0 HA LYS A 423 -19.050 -11.154 -8.808 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -20.870 -11.990 -10.347 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -19.958 -13.468 -10.581 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -21.392 -14.169 -8.933 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -20.072 -13.597 -7.933 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -21.926 -12.592 -6.925 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -21.318 -11.306 -7.948 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -23.391 -13.215 -9.033 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -23.888 -11.922 -7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -23.940 -11.435 -10.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -23.129 -10.294 -9.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -22.243 -11.411 -10.377 1.00 0.00 H new ATOM 698 N GLU A 424 -17.432 -13.821 -9.890 1.00 0.00 N ATOM 699 CA GLU A 424 -16.470 -14.844 -9.514 1.00 0.00 C ATOM 700 C GLU A 424 -15.148 -14.198 -9.144 1.00 0.00 C ATOM 701 O GLU A 424 -14.434 -14.670 -8.259 1.00 0.00 O ATOM 702 CB GLU A 424 -16.288 -15.857 -10.647 1.00 0.00 C ATOM 703 CG GLU A 424 -17.296 -17.002 -10.613 1.00 0.00 C ATOM 704 CD GLU A 424 -18.741 -16.538 -10.719 1.00 0.00 C ATOM 705 OE1 GLU A 424 -19.308 -16.106 -9.690 1.00 0.00 O ATOM 706 OE2 GLU A 424 -19.311 -16.607 -11.828 1.00 0.00 O ATOM 0 H GLU A 424 -17.747 -13.876 -10.859 1.00 0.00 H new ATOM 0 HA GLU A 424 -16.848 -15.382 -8.645 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -16.372 -15.339 -11.602 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -15.281 -16.270 -10.595 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -17.082 -17.689 -11.432 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -17.169 -17.561 -9.686 1.00 0.00 H new ATOM 713 N ALA A 425 -14.836 -13.104 -9.824 1.00 0.00 N ATOM 714 CA ALA A 425 -13.625 -12.354 -9.553 1.00 0.00 C ATOM 715 C ALA A 425 -13.701 -11.762 -8.152 1.00 0.00 C ATOM 716 O ALA A 425 -12.754 -11.851 -7.370 1.00 0.00 O ATOM 717 CB ALA A 425 -13.454 -11.261 -10.591 1.00 0.00 C ATOM 0 H ALA A 425 -15.411 -12.717 -10.572 1.00 0.00 H new ATOM 0 HA ALA A 425 -12.761 -13.016 -9.608 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.543 -10.701 -10.383 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -13.386 -11.708 -11.583 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -14.310 -10.588 -10.555 1.00 0.00 H new ATOM 723 N TYR A 426 -14.849 -11.168 -7.846 1.00 0.00 N ATOM 724 CA TYR A 426 -15.100 -10.580 -6.543 1.00 0.00 C ATOM 725 C TYR A 426 -15.059 -11.664 -5.477 1.00 0.00 C ATOM 726 O TYR A 426 -14.428 -11.501 -4.433 1.00 0.00 O ATOM 727 CB TYR A 426 -16.469 -9.889 -6.546 1.00 0.00 C ATOM 728 CG TYR A 426 -16.994 -9.522 -5.176 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.664 -8.310 -4.587 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.818 -10.391 -4.470 1.00 0.00 C ATOM 731 CE1 TYR A 426 -17.140 -7.972 -3.336 1.00 0.00 C ATOM 732 CE2 TYR A 426 -18.296 -10.061 -3.219 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.953 -8.853 -2.656 1.00 0.00 C ATOM 734 OH TYR A 426 -18.429 -8.526 -1.408 1.00 0.00 O ATOM 0 H TYR A 426 -15.630 -11.082 -8.497 1.00 0.00 H new ATOM 0 HA TYR A 426 -14.331 -9.840 -6.322 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.403 -8.984 -7.149 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -17.191 -10.545 -7.033 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -16.024 -7.619 -5.116 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -18.088 -11.340 -4.908 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.877 -7.023 -2.893 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.936 -10.747 -2.684 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.988 -9.256 -1.069 1.00 0.00 H new ATOM 744 N ILE A 427 -15.726 -12.775 -5.761 1.00 0.00 N ATOM 745 CA ILE A 427 -15.781 -13.896 -4.843 1.00 0.00 C ATOM 746 C ILE A 427 -14.378 -14.429 -4.560 1.00 0.00 C ATOM 747 O ILE A 427 -13.995 -14.607 -3.405 1.00 0.00 O ATOM 748 CB ILE A 427 -16.677 -15.034 -5.390 1.00 0.00 C ATOM 749 CG1 ILE A 427 -18.138 -14.572 -5.440 1.00 0.00 C ATOM 750 CG2 ILE A 427 -16.543 -16.290 -4.535 1.00 0.00 C ATOM 751 CD1 ILE A 427 -19.070 -15.548 -6.129 1.00 0.00 C ATOM 0 H ILE A 427 -16.240 -12.920 -6.630 1.00 0.00 H new ATOM 0 HA ILE A 427 -16.220 -13.535 -3.913 1.00 0.00 H new ATOM 0 HB ILE A 427 -16.349 -15.278 -6.400 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -18.491 -14.406 -4.422 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -18.188 -13.613 -5.955 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -17.182 -17.075 -4.939 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -15.506 -16.626 -4.542 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -16.845 -16.067 -3.512 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -20.084 -15.149 -6.123 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -18.745 -15.697 -7.159 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -19.053 -16.502 -5.602 1.00 0.00 H new ATOM 763 N ALA A 428 -13.610 -14.654 -5.622 1.00 0.00 N ATOM 764 CA ALA A 428 -12.247 -15.161 -5.498 1.00 0.00 C ATOM 765 C ALA A 428 -11.368 -14.193 -4.712 1.00 0.00 C ATOM 766 O ALA A 428 -10.596 -14.605 -3.845 1.00 0.00 O ATOM 767 CB ALA A 428 -11.653 -15.418 -6.875 1.00 0.00 C ATOM 0 H ALA A 428 -13.911 -14.492 -6.583 1.00 0.00 H new ATOM 0 HA ALA A 428 -12.285 -16.102 -4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -10.636 -15.796 -6.768 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -12.260 -16.154 -7.402 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -11.637 -14.488 -7.443 1.00 0.00 H new ATOM 773 N MET A 429 -11.497 -12.905 -5.013 1.00 0.00 N ATOM 774 CA MET A 429 -10.719 -11.879 -4.329 1.00 0.00 C ATOM 775 C MET A 429 -11.107 -11.807 -2.859 1.00 0.00 C ATOM 776 O MET A 429 -10.266 -11.552 -1.995 1.00 0.00 O ATOM 777 CB MET A 429 -10.921 -10.516 -5.000 1.00 0.00 C ATOM 778 CG MET A 429 -10.041 -10.314 -6.220 1.00 0.00 C ATOM 779 SD MET A 429 -9.330 -8.658 -6.291 1.00 0.00 S ATOM 780 CE MET A 429 -10.815 -7.669 -6.132 1.00 0.00 C ATOM 0 H MET A 429 -12.133 -12.547 -5.726 1.00 0.00 H new ATOM 0 HA MET A 429 -9.664 -12.146 -4.396 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.966 -10.414 -5.293 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.714 -9.728 -4.276 1.00 0.00 H new ATOM 0 HG2 MET A 429 -9.238 -11.051 -6.211 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.628 -10.493 -7.121 1.00 0.00 H new ATOM 0 HE1 MET A 429 -10.583 -6.627 -6.351 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.568 -8.028 -6.833 1.00 0.00 H new ATOM 0 HE3 MET A 429 -11.198 -7.749 -5.115 1.00 0.00 H new ATOM 790 N GLY A 430 -12.378 -12.061 -2.583 1.00 0.00 N ATOM 791 CA GLY A 430 -12.870 -12.031 -1.231 1.00 0.00 C ATOM 792 C GLY A 430 -12.376 -13.213 -0.446 1.00 0.00 C ATOM 793 O GLY A 430 -12.006 -13.073 0.712 1.00 0.00 O ATOM 0 H GLY A 430 -13.081 -12.290 -3.285 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -12.550 -11.109 -0.745 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.960 -12.026 -1.238 1.00 0.00 H new ATOM 797 N GLN A 431 -12.346 -14.377 -1.093 1.00 0.00 N ATOM 798 CA GLN A 431 -11.877 -15.601 -0.455 1.00 0.00 C ATOM 799 C GLN A 431 -10.468 -15.408 0.080 1.00 0.00 C ATOM 800 O GLN A 431 -10.137 -15.889 1.155 1.00 0.00 O ATOM 801 CB GLN A 431 -11.908 -16.780 -1.431 1.00 0.00 C ATOM 802 CG GLN A 431 -13.308 -17.170 -1.873 1.00 0.00 C ATOM 803 CD GLN A 431 -14.247 -17.428 -0.708 1.00 0.00 C ATOM 804 OE1 GLN A 431 -13.835 -17.900 0.348 1.00 0.00 O ATOM 805 NE2 GLN A 431 -15.518 -17.110 -0.895 1.00 0.00 N ATOM 0 H GLN A 431 -12.642 -14.496 -2.062 1.00 0.00 H new ATOM 0 HA GLN A 431 -12.548 -15.826 0.374 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -11.316 -16.528 -2.311 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -11.431 -17.641 -0.962 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -13.721 -16.377 -2.496 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -13.252 -18.065 -2.492 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -15.820 -16.720 -1.788 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -16.195 -17.255 -0.146 1.00 0.00 H new ATOM 814 N ARG A 432 -9.652 -14.678 -0.672 1.00 0.00 N ATOM 815 CA ARG A 432 -8.281 -14.398 -0.265 1.00 0.00 C ATOM 816 C ARG A 432 -8.274 -13.641 1.065 1.00 0.00 C ATOM 817 O ARG A 432 -7.569 -14.013 1.993 1.00 0.00 O ATOM 818 CB ARG A 432 -7.563 -13.594 -1.354 1.00 0.00 C ATOM 819 CG ARG A 432 -6.251 -12.969 -0.908 1.00 0.00 C ATOM 820 CD ARG A 432 -5.095 -13.966 -0.919 1.00 0.00 C ATOM 821 NE ARG A 432 -4.985 -14.709 0.338 1.00 0.00 N ATOM 822 CZ ARG A 432 -4.613 -14.173 1.502 1.00 0.00 C ATOM 823 NH1 ARG A 432 -4.276 -12.890 1.584 1.00 0.00 N ATOM 824 NH2 ARG A 432 -4.567 -14.932 2.585 1.00 0.00 N ATOM 0 H ARG A 432 -9.917 -14.269 -1.568 1.00 0.00 H new ATOM 0 HA ARG A 432 -7.749 -15.339 -0.127 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -7.370 -14.248 -2.204 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -8.228 -12.804 -1.704 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -6.010 -12.131 -1.563 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -6.368 -12.565 0.097 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -5.232 -14.668 -1.742 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -4.162 -13.434 -1.106 1.00 0.00 H new ATOM 0 HE ARG A 432 -5.208 -15.704 0.323 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -4.300 -12.302 0.751 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -3.994 -12.493 2.480 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -4.815 -15.920 2.526 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -4.284 -14.529 3.478 1.00 0.00 H new ATOM 838 N MET A 433 -9.087 -12.596 1.162 1.00 0.00 N ATOM 839 CA MET A 433 -9.171 -11.810 2.391 1.00 0.00 C ATOM 840 C MET A 433 -9.932 -12.588 3.460 1.00 0.00 C ATOM 841 O MET A 433 -9.827 -12.309 4.652 1.00 0.00 O ATOM 842 CB MET A 433 -9.857 -10.469 2.129 1.00 0.00 C ATOM 843 CG MET A 433 -8.951 -9.440 1.477 1.00 0.00 C ATOM 844 SD MET A 433 -9.872 -8.073 0.748 1.00 0.00 S ATOM 845 CE MET A 433 -10.937 -8.959 -0.382 1.00 0.00 C ATOM 0 H MET A 433 -9.695 -12.273 0.410 1.00 0.00 H new ATOM 0 HA MET A 433 -8.159 -11.616 2.745 1.00 0.00 H new ATOM 0 HB2 MET A 433 -10.725 -10.633 1.490 1.00 0.00 H new ATOM 0 HB3 MET A 433 -10.227 -10.069 3.073 1.00 0.00 H new ATOM 0 HG2 MET A 433 -8.256 -9.050 2.220 1.00 0.00 H new ATOM 0 HG3 MET A 433 -8.353 -9.924 0.705 1.00 0.00 H new ATOM 0 HE1 MET A 433 -11.061 -8.378 -1.296 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.490 -9.924 -0.623 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.910 -9.116 0.083 1.00 0.00 H new ATOM 855 N PHE A 434 -10.699 -13.570 3.014 1.00 0.00 N ATOM 856 CA PHE A 434 -11.475 -14.415 3.903 1.00 0.00 C ATOM 857 C PHE A 434 -10.564 -15.424 4.595 1.00 0.00 C ATOM 858 O PHE A 434 -10.752 -15.745 5.766 1.00 0.00 O ATOM 859 CB PHE A 434 -12.585 -15.113 3.111 1.00 0.00 C ATOM 860 CG PHE A 434 -13.853 -14.314 3.016 1.00 0.00 C ATOM 861 CD1 PHE A 434 -14.150 -13.337 3.955 1.00 0.00 C ATOM 862 CD2 PHE A 434 -14.749 -14.537 1.981 1.00 0.00 C ATOM 863 CE1 PHE A 434 -15.316 -12.599 3.862 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.914 -13.804 1.884 1.00 0.00 C ATOM 865 CZ PHE A 434 -16.199 -12.834 2.825 1.00 0.00 C ATOM 0 H PHE A 434 -10.800 -13.802 2.026 1.00 0.00 H new ATOM 0 HA PHE A 434 -11.941 -13.803 4.676 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -12.223 -15.325 2.105 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.805 -16.073 3.579 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -13.463 -13.151 4.767 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -14.532 -15.294 1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -15.536 -11.840 4.598 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -16.603 -13.989 1.073 1.00 0.00 H new ATOM 0 HZ PHE A 434 -17.111 -12.260 2.751 1.00 0.00 H new ATOM 875 N GLU A 435 -9.569 -15.912 3.867 1.00 0.00 N ATOM 876 CA GLU A 435 -8.605 -16.851 4.427 1.00 0.00 C ATOM 877 C GLU A 435 -7.395 -16.083 4.929 1.00 0.00 C ATOM 878 O GLU A 435 -6.396 -16.654 5.363 1.00 0.00 O ATOM 879 CB GLU A 435 -8.180 -17.901 3.393 1.00 0.00 C ATOM 880 CG GLU A 435 -7.657 -17.303 2.097 1.00 0.00 C ATOM 881 CD GLU A 435 -6.377 -17.954 1.616 1.00 0.00 C ATOM 882 OE1 GLU A 435 -6.345 -19.194 1.503 1.00 0.00 O ATOM 883 OE2 GLU A 435 -5.405 -17.217 1.340 1.00 0.00 O ATOM 0 H GLU A 435 -9.408 -15.674 2.888 1.00 0.00 H new ATOM 0 HA GLU A 435 -9.075 -17.381 5.256 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -7.408 -18.535 3.828 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -9.032 -18.544 3.169 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -8.420 -17.401 1.325 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -7.484 -16.236 2.240 1.00 0.00 H new ATOM 890 N ASP A 436 -7.535 -14.771 4.905 1.00 0.00 N ATOM 891 CA ASP A 436 -6.480 -13.860 5.335 1.00 0.00 C ATOM 892 C ASP A 436 -6.439 -13.779 6.851 1.00 0.00 C ATOM 893 O ASP A 436 -5.594 -13.108 7.435 1.00 0.00 O ATOM 894 CB ASP A 436 -6.703 -12.473 4.739 1.00 0.00 C ATOM 895 CG ASP A 436 -5.430 -11.670 4.652 1.00 0.00 C ATOM 896 OD1 ASP A 436 -4.432 -12.198 4.115 1.00 0.00 O ATOM 897 OD2 ASP A 436 -5.426 -10.505 5.100 1.00 0.00 O ATOM 0 H ASP A 436 -8.383 -14.302 4.587 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.524 -14.243 4.980 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -7.134 -12.574 3.743 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -7.429 -11.932 5.347 1.00 0.00 H new ATOM 1036 N GLU B 7 7.778 -6.324 -12.827 1.00 0.00 N ATOM 1037 CA GLU B 7 7.058 -5.165 -13.326 1.00 0.00 C ATOM 1038 C GLU B 7 7.064 -4.002 -12.355 1.00 0.00 C ATOM 1039 O GLU B 7 6.378 -4.025 -11.338 1.00 0.00 O ATOM 1040 CB GLU B 7 5.612 -5.558 -13.601 1.00 0.00 C ATOM 1041 CG GLU B 7 5.392 -6.181 -14.961 1.00 0.00 C ATOM 1042 CD GLU B 7 6.389 -7.279 -15.295 1.00 0.00 C ATOM 1043 OE1 GLU B 7 6.602 -8.174 -14.452 1.00 0.00 O ATOM 1044 OE2 GLU B 7 6.973 -7.244 -16.401 1.00 0.00 O ATOM 0 HA GLU B 7 7.566 -4.840 -14.234 1.00 0.00 H new ATOM 0 HB2 GLU B 7 5.285 -6.260 -12.834 1.00 0.00 H new ATOM 0 HB3 GLU B 7 4.982 -4.673 -13.512 1.00 0.00 H new ATOM 0 HG2 GLU B 7 4.383 -6.592 -15.004 1.00 0.00 H new ATOM 0 HG3 GLU B 7 5.452 -5.403 -15.722 1.00 0.00 H new ATOM 1051 N VAL B 8 7.846 -2.988 -12.666 1.00 0.00 N ATOM 1052 CA VAL B 8 7.888 -1.815 -11.832 1.00 0.00 C ATOM 1053 C VAL B 8 6.630 -1.014 -12.043 1.00 0.00 C ATOM 1054 O VAL B 8 6.346 -0.526 -13.136 1.00 0.00 O ATOM 1055 CB VAL B 8 9.126 -0.972 -12.079 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.961 0.398 -11.442 1.00 0.00 C ATOM 1057 CG2 VAL B 8 10.303 -1.716 -11.491 1.00 0.00 C ATOM 0 H VAL B 8 8.454 -2.957 -13.484 1.00 0.00 H new ATOM 0 HA VAL B 8 7.946 -2.136 -10.792 1.00 0.00 H new ATOM 0 HB VAL B 8 9.286 -0.811 -13.145 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.855 0.994 -11.625 1.00 0.00 H new ATOM 0 HG12 VAL B 8 8.095 0.899 -11.875 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.814 0.285 -10.368 1.00 0.00 H new ATOM 0 HG21 VAL B 8 11.214 -1.139 -11.650 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.146 -1.859 -10.422 1.00 0.00 H new ATOM 0 HG23 VAL B 8 10.399 -2.687 -11.977 1.00 0.00 H new ATOM 1067 N LEU B 9 5.882 -0.917 -10.980 1.00 0.00 N ATOM 1068 CA LEU B 9 4.611 -0.241 -10.984 1.00 0.00 C ATOM 1069 C LEU B 9 4.777 1.259 -10.907 1.00 0.00 C ATOM 1070 O LEU B 9 4.209 1.998 -11.708 1.00 0.00 O ATOM 1071 CB LEU B 9 3.777 -0.737 -9.802 1.00 0.00 C ATOM 1072 CG LEU B 9 4.061 -2.181 -9.391 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.712 -2.424 -7.941 1.00 0.00 C ATOM 1074 CD2 LEU B 9 3.297 -3.133 -10.272 1.00 0.00 C ATOM 0 H LEU B 9 6.139 -1.309 -10.074 1.00 0.00 H new ATOM 0 HA LEU B 9 4.103 -0.466 -11.922 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.958 -0.086 -8.947 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.721 -0.645 -10.054 1.00 0.00 H new ATOM 0 HG LEU B 9 5.130 -2.357 -9.513 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.927 -3.461 -7.684 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.305 -1.763 -7.308 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.652 -2.223 -7.783 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.508 -4.158 -9.969 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.229 -2.939 -10.177 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.600 -2.992 -11.309 1.00 0.00 H new ATOM 1086 N LEU B 10 5.548 1.711 -9.942 1.00 0.00 N ATOM 1087 CA LEU B 10 5.736 3.133 -9.769 1.00 0.00 C ATOM 1088 C LEU B 10 7.141 3.489 -9.318 1.00 0.00 C ATOM 1089 O LEU B 10 7.685 2.889 -8.389 1.00 0.00 O ATOM 1090 CB LEU B 10 4.725 3.633 -8.755 1.00 0.00 C ATOM 1091 CG LEU B 10 4.352 5.105 -8.872 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.589 5.363 -10.162 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.530 5.525 -7.668 1.00 0.00 C ATOM 0 H LEU B 10 6.048 1.124 -9.274 1.00 0.00 H new ATOM 0 HA LEU B 10 5.589 3.613 -10.736 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.817 3.037 -8.849 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.121 3.455 -7.755 1.00 0.00 H new ATOM 0 HG LEU B 10 5.265 5.700 -8.897 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.331 6.420 -10.227 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.211 5.088 -11.014 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.677 4.766 -10.171 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.266 6.579 -7.757 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.621 4.926 -7.621 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.112 5.372 -6.759 1.00 0.00 H new ATOM 1105 N ILE B 11 7.720 4.458 -10.005 1.00 0.00 N ATOM 1106 CA ILE B 11 9.039 4.966 -9.681 1.00 0.00 C ATOM 1107 C ILE B 11 8.889 6.383 -9.157 1.00 0.00 C ATOM 1108 O ILE B 11 8.708 7.320 -9.935 1.00 0.00 O ATOM 1109 CB ILE B 11 9.968 4.990 -10.912 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.232 3.570 -11.411 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.277 5.697 -10.580 1.00 0.00 C ATOM 1112 CD1 ILE B 11 11.025 3.516 -12.698 1.00 0.00 C ATOM 0 H ILE B 11 7.286 4.916 -10.806 1.00 0.00 H new ATOM 0 HA ILE B 11 9.486 4.307 -8.937 1.00 0.00 H new ATOM 0 HB ILE B 11 9.472 5.546 -11.708 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.769 3.017 -10.640 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.278 3.064 -11.560 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.920 5.704 -11.460 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.069 6.722 -10.274 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.779 5.171 -9.768 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.173 2.477 -12.991 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.480 4.040 -13.483 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.994 3.993 -12.549 1.00 0.00 H new ATOM 1124 N VAL B 12 8.928 6.550 -7.850 1.00 0.00 N ATOM 1125 CA VAL B 12 8.777 7.866 -7.283 1.00 0.00 C ATOM 1126 C VAL B 12 10.123 8.417 -6.865 1.00 0.00 C ATOM 1127 O VAL B 12 10.940 7.695 -6.307 1.00 0.00 O ATOM 1128 CB VAL B 12 7.837 7.848 -6.067 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.320 9.242 -5.778 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.686 6.880 -6.286 1.00 0.00 C ATOM 0 H VAL B 12 9.061 5.799 -7.172 1.00 0.00 H new ATOM 0 HA VAL B 12 8.341 8.505 -8.051 1.00 0.00 H new ATOM 0 HB VAL B 12 8.403 7.505 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.656 9.212 -4.914 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.159 9.905 -5.568 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.772 9.614 -6.644 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.035 6.885 -5.412 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.117 7.184 -7.164 1.00 0.00 H new ATOM 0 HG23 VAL B 12 7.080 5.875 -6.439 1.00 0.00 H new ATOM 1140 N LYS B 13 10.353 9.684 -7.152 1.00 0.00 N ATOM 1141 CA LYS B 13 11.598 10.336 -6.784 1.00 0.00 C ATOM 1142 C LYS B 13 11.306 11.404 -5.747 1.00 0.00 C ATOM 1143 O LYS B 13 10.141 11.706 -5.488 1.00 0.00 O ATOM 1144 CB LYS B 13 12.303 10.928 -8.002 1.00 0.00 C ATOM 1145 CG LYS B 13 12.747 9.883 -9.010 1.00 0.00 C ATOM 1146 CD LYS B 13 13.651 8.833 -8.378 1.00 0.00 C ATOM 1147 CE LYS B 13 15.026 8.790 -9.031 1.00 0.00 C ATOM 1148 NZ LYS B 13 16.028 8.111 -8.167 1.00 0.00 N ATOM 0 H LYS B 13 9.691 10.286 -7.641 1.00 0.00 H new ATOM 0 HA LYS B 13 12.276 9.595 -6.360 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.633 11.634 -8.493 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.173 11.494 -7.669 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.871 9.397 -9.439 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.275 10.370 -9.830 1.00 0.00 H new ATOM 0 HD2 LYS B 13 13.762 9.044 -7.314 1.00 0.00 H new ATOM 0 HD3 LYS B 13 13.180 7.853 -8.461 1.00 0.00 H new ATOM 0 HE2 LYS B 13 14.958 8.270 -9.986 1.00 0.00 H new ATOM 0 HE3 LYS B 13 15.359 9.806 -9.244 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.895 7.935 -8.713 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 16.249 8.716 -7.351 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 15.641 7.206 -7.832 1.00 0.00 H new ATOM 1162 N LYS B 14 12.357 11.960 -5.150 1.00 0.00 N ATOM 1163 CA LYS B 14 12.221 12.968 -4.102 1.00 0.00 C ATOM 1164 C LYS B 14 11.545 12.367 -2.865 1.00 0.00 C ATOM 1165 O LYS B 14 11.083 13.089 -1.977 1.00 0.00 O ATOM 1166 CB LYS B 14 11.415 14.148 -4.628 1.00 0.00 C ATOM 1167 CG LYS B 14 12.244 15.251 -5.267 1.00 0.00 C ATOM 1168 CD LYS B 14 11.371 16.443 -5.630 1.00 0.00 C ATOM 1169 CE LYS B 14 11.961 17.257 -6.771 1.00 0.00 C ATOM 1170 NZ LYS B 14 10.956 18.176 -7.376 1.00 0.00 N ATOM 0 H LYS B 14 13.323 11.726 -5.378 1.00 0.00 H new ATOM 0 HA LYS B 14 13.213 13.316 -3.813 1.00 0.00 H new ATOM 0 HB2 LYS B 14 10.697 13.781 -5.361 1.00 0.00 H new ATOM 0 HB3 LYS B 14 10.841 14.574 -3.805 1.00 0.00 H new ATOM 0 HG2 LYS B 14 13.030 15.566 -4.580 1.00 0.00 H new ATOM 0 HG3 LYS B 14 12.737 14.870 -6.161 1.00 0.00 H new ATOM 0 HD2 LYS B 14 10.378 16.092 -5.911 1.00 0.00 H new ATOM 0 HD3 LYS B 14 11.248 17.082 -4.755 1.00 0.00 H new ATOM 0 HE2 LYS B 14 12.808 17.837 -6.403 1.00 0.00 H new ATOM 0 HE3 LYS B 14 12.344 16.583 -7.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 11.342 18.586 -8.250 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 10.089 17.646 -7.596 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 10.734 18.939 -6.705 1.00 0.00 H new ATOM 1184 N VAL B 15 11.500 11.040 -2.823 1.00 0.00 N ATOM 1185 CA VAL B 15 10.892 10.309 -1.716 1.00 0.00 C ATOM 1186 C VAL B 15 11.850 10.277 -0.533 1.00 0.00 C ATOM 1187 O VAL B 15 12.806 9.511 -0.522 1.00 0.00 O ATOM 1188 CB VAL B 15 10.525 8.866 -2.135 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.613 8.207 -1.120 1.00 0.00 C ATOM 1190 CG2 VAL B 15 9.858 8.864 -3.493 1.00 0.00 C ATOM 0 H VAL B 15 11.883 10.441 -3.554 1.00 0.00 H new ATOM 0 HA VAL B 15 9.975 10.823 -1.429 1.00 0.00 H new ATOM 0 HB VAL B 15 11.452 8.294 -2.185 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.376 7.195 -1.447 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.113 8.168 -0.152 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.693 8.784 -1.029 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.606 7.841 -3.773 1.00 0.00 H new ATOM 0 HG22 VAL B 15 8.949 9.464 -3.453 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.538 9.286 -4.233 1.00 0.00 H new ATOM 1200 N ARG B 16 11.587 11.103 0.462 1.00 0.00 N ATOM 1201 CA ARG B 16 12.447 11.202 1.626 1.00 0.00 C ATOM 1202 C ARG B 16 12.022 10.248 2.736 1.00 0.00 C ATOM 1203 O ARG B 16 10.977 10.422 3.344 1.00 0.00 O ATOM 1204 CB ARG B 16 12.448 12.639 2.158 1.00 0.00 C ATOM 1205 CG ARG B 16 12.494 13.697 1.065 1.00 0.00 C ATOM 1206 CD ARG B 16 12.776 15.079 1.634 1.00 0.00 C ATOM 1207 NE ARG B 16 14.089 15.136 2.278 1.00 0.00 N ATOM 1208 CZ ARG B 16 15.191 15.594 1.682 1.00 0.00 C ATOM 1209 NH1 ARG B 16 15.120 16.171 0.489 1.00 0.00 N ATOM 1210 NH2 ARG B 16 16.367 15.492 2.288 1.00 0.00 N ATOM 0 H ARG B 16 10.776 11.721 0.487 1.00 0.00 H new ATOM 0 HA ARG B 16 13.452 10.921 1.311 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.555 12.793 2.763 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.306 12.772 2.817 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.265 13.438 0.339 1.00 0.00 H new ATOM 0 HG3 ARG B 16 11.544 13.710 0.530 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.729 15.819 0.835 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.003 15.341 2.357 1.00 0.00 H new ATOM 0 HE ARG B 16 14.166 14.806 3.240 1.00 0.00 H new ATOM 0 HH11 ARG B 16 14.218 16.267 0.022 1.00 0.00 H new ATOM 0 HH12 ARG B 16 15.967 16.519 0.039 1.00 0.00 H new ATOM 0 HH21 ARG B 16 16.429 15.063 3.211 1.00 0.00 H new ATOM 0 HH22 ARG B 16 17.209 15.843 1.831 1.00 0.00 H new ATOM 1224 N GLN B 17 12.830 9.236 2.987 1.00 0.00 N ATOM 1225 CA GLN B 17 12.551 8.291 4.059 1.00 0.00 C ATOM 1226 C GLN B 17 13.354 8.722 5.273 1.00 0.00 C ATOM 1227 O GLN B 17 14.582 8.657 5.248 1.00 0.00 O ATOM 1228 CB GLN B 17 12.923 6.864 3.642 1.00 0.00 C ATOM 1229 CG GLN B 17 12.329 5.780 4.534 1.00 0.00 C ATOM 1230 CD GLN B 17 13.227 5.395 5.695 1.00 0.00 C ATOM 1231 OE1 GLN B 17 14.530 5.552 5.520 1.00 0.00 O flip ATOM 1232 NE2 GLN B 17 12.755 4.961 6.742 1.00 0.00 N flip ATOM 0 H GLN B 17 13.685 9.044 2.465 1.00 0.00 H new ATOM 0 HA GLN B 17 11.486 8.289 4.290 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.591 6.698 2.617 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.009 6.767 3.645 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.372 6.125 4.924 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.127 4.894 3.931 1.00 0.00 H new ATOM 0 HE21 GLN B 17 11.745 4.854 6.840 1.00 0.00 H new ATOM 0 HE22 GLN B 17 13.372 4.708 7.513 1.00 0.00 H new ATOM 1241 N LYS B 18 12.665 9.203 6.305 1.00 0.00 N ATOM 1242 CA LYS B 18 13.322 9.690 7.517 1.00 0.00 C ATOM 1243 C LYS B 18 14.144 10.923 7.173 1.00 0.00 C ATOM 1244 O LYS B 18 15.226 11.142 7.717 1.00 0.00 O ATOM 1245 CB LYS B 18 14.204 8.612 8.157 1.00 0.00 C ATOM 1246 CG LYS B 18 13.416 7.494 8.814 1.00 0.00 C ATOM 1247 CD LYS B 18 14.330 6.415 9.371 1.00 0.00 C ATOM 1248 CE LYS B 18 15.064 6.887 10.615 1.00 0.00 C ATOM 1249 NZ LYS B 18 14.842 5.966 11.763 1.00 0.00 N ATOM 0 H LYS B 18 11.647 9.266 6.327 1.00 0.00 H new ATOM 0 HA LYS B 18 12.557 9.949 8.249 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.855 8.186 7.393 1.00 0.00 H new ATOM 0 HB3 LYS B 18 14.849 9.077 8.902 1.00 0.00 H new ATOM 0 HG2 LYS B 18 12.804 7.904 9.618 1.00 0.00 H new ATOM 0 HG3 LYS B 18 12.734 7.054 8.087 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.743 5.528 9.609 1.00 0.00 H new ATOM 0 HD3 LYS B 18 15.054 6.123 8.610 1.00 0.00 H new ATOM 0 HE2 LYS B 18 16.131 6.957 10.404 1.00 0.00 H new ATOM 0 HE3 LYS B 18 14.725 7.889 10.880 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 15.357 6.318 12.595 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.826 5.919 11.979 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 15.188 5.016 11.518 1.00 0.00 H new ATOM 1263 N LYS B 19 13.590 11.713 6.245 1.00 0.00 N ATOM 1264 CA LYS B 19 14.201 12.952 5.752 1.00 0.00 C ATOM 1265 C LYS B 19 15.308 12.685 4.730 1.00 0.00 C ATOM 1266 O LYS B 19 15.941 13.623 4.249 1.00 0.00 O ATOM 1267 CB LYS B 19 14.751 13.817 6.891 1.00 0.00 C ATOM 1268 CG LYS B 19 13.702 14.261 7.899 1.00 0.00 C ATOM 1269 CD LYS B 19 14.352 14.868 9.131 1.00 0.00 C ATOM 1270 CE LYS B 19 15.408 13.940 9.710 1.00 0.00 C ATOM 1271 NZ LYS B 19 16.264 14.624 10.710 1.00 0.00 N ATOM 0 H LYS B 19 12.691 11.506 5.810 1.00 0.00 H new ATOM 0 HA LYS B 19 13.399 13.500 5.257 1.00 0.00 H new ATOM 0 HB2 LYS B 19 15.528 13.259 7.414 1.00 0.00 H new ATOM 0 HB3 LYS B 19 15.226 14.701 6.464 1.00 0.00 H new ATOM 0 HG2 LYS B 19 13.036 14.991 7.438 1.00 0.00 H new ATOM 0 HG3 LYS B 19 13.089 13.408 8.190 1.00 0.00 H new ATOM 0 HD2 LYS B 19 14.807 15.824 8.872 1.00 0.00 H new ATOM 0 HD3 LYS B 19 13.591 15.071 9.884 1.00 0.00 H new ATOM 0 HE2 LYS B 19 14.921 13.083 10.176 1.00 0.00 H new ATOM 0 HE3 LYS B 19 16.031 13.553 8.904 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 16.970 13.955 11.079 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 16.750 15.426 10.261 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 15.674 14.971 11.493 1.00 0.00 H new ATOM 1285 N GLN B 20 15.523 11.421 4.376 1.00 0.00 N ATOM 1286 CA GLN B 20 16.552 11.072 3.406 1.00 0.00 C ATOM 1287 C GLN B 20 15.959 11.084 2.010 1.00 0.00 C ATOM 1288 O GLN B 20 15.138 10.233 1.680 1.00 0.00 O ATOM 1289 CB GLN B 20 17.143 9.690 3.710 1.00 0.00 C ATOM 1290 CG GLN B 20 18.434 9.728 4.514 1.00 0.00 C ATOM 1291 CD GLN B 20 18.272 10.410 5.856 1.00 0.00 C ATOM 1292 OE1 GLN B 20 17.951 9.771 6.857 1.00 0.00 O ATOM 1293 NE2 GLN B 20 18.504 11.712 5.883 1.00 0.00 N ATOM 0 H GLN B 20 15.001 10.626 4.745 1.00 0.00 H new ATOM 0 HA GLN B 20 17.354 11.808 3.469 1.00 0.00 H new ATOM 0 HB2 GLN B 20 16.405 9.104 4.257 1.00 0.00 H new ATOM 0 HB3 GLN B 20 17.329 9.172 2.769 1.00 0.00 H new ATOM 0 HG2 GLN B 20 18.789 8.709 4.670 1.00 0.00 H new ATOM 0 HG3 GLN B 20 19.200 10.248 3.938 1.00 0.00 H new ATOM 0 HE21 GLN B 20 18.768 12.201 5.028 1.00 0.00 H new ATOM 0 HE22 GLN B 20 18.419 12.227 6.759 1.00 0.00 H new ATOM 1302 N ASP B 21 16.362 12.050 1.201 1.00 0.00 N ATOM 1303 CA ASP B 21 15.849 12.169 -0.157 1.00 0.00 C ATOM 1304 C ASP B 21 16.274 10.997 -1.021 1.00 0.00 C ATOM 1305 O ASP B 21 17.459 10.751 -1.235 1.00 0.00 O ATOM 1306 CB ASP B 21 16.256 13.496 -0.814 1.00 0.00 C ATOM 1307 CG ASP B 21 17.573 14.069 -0.308 1.00 0.00 C ATOM 1308 OD1 ASP B 21 18.478 13.296 0.053 1.00 0.00 O ATOM 1309 OD2 ASP B 21 17.673 15.317 -0.225 1.00 0.00 O ATOM 0 H ASP B 21 17.043 12.764 1.460 1.00 0.00 H new ATOM 0 HA ASP B 21 14.762 12.157 -0.078 1.00 0.00 H new ATOM 0 HB2 ASP B 21 16.328 13.347 -1.891 1.00 0.00 H new ATOM 0 HB3 ASP B 21 15.466 14.228 -0.646 1.00 0.00 H new ATOM 1314 N GLY B 22 15.285 10.256 -1.486 1.00 0.00 N ATOM 1315 CA GLY B 22 15.530 9.124 -2.326 1.00 0.00 C ATOM 1316 C GLY B 22 14.411 8.861 -3.308 1.00 0.00 C ATOM 1317 O GLY B 22 13.779 9.781 -3.820 1.00 0.00 O ATOM 0 H GLY B 22 14.300 10.429 -1.287 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.458 9.281 -2.876 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.674 8.241 -1.703 1.00 0.00 H new ATOM 1321 N ALA B 23 14.152 7.592 -3.533 1.00 0.00 N ATOM 1322 CA ALA B 23 13.150 7.151 -4.464 1.00 0.00 C ATOM 1323 C ALA B 23 12.379 5.976 -3.902 1.00 0.00 C ATOM 1324 O ALA B 23 12.953 5.098 -3.261 1.00 0.00 O ATOM 1325 CB ALA B 23 13.821 6.743 -5.755 1.00 0.00 C ATOM 0 H ALA B 23 14.642 6.830 -3.065 1.00 0.00 H new ATOM 0 HA ALA B 23 12.452 7.968 -4.646 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.067 6.407 -6.467 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.358 7.595 -6.171 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.523 5.932 -5.560 1.00 0.00 H new ATOM 1331 N LEU B 24 11.086 5.953 -4.160 1.00 0.00 N ATOM 1332 CA LEU B 24 10.249 4.879 -3.682 1.00 0.00 C ATOM 1333 C LEU B 24 9.812 4.054 -4.887 1.00 0.00 C ATOM 1334 O LEU B 24 8.994 4.497 -5.694 1.00 0.00 O ATOM 1335 CB LEU B 24 9.041 5.435 -2.938 1.00 0.00 C ATOM 1336 CG LEU B 24 8.537 4.567 -1.784 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.045 4.744 -1.585 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.884 3.108 -1.998 1.00 0.00 C ATOM 0 H LEU B 24 10.596 6.667 -4.698 1.00 0.00 H new ATOM 0 HA LEU B 24 10.801 4.252 -2.982 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.296 6.420 -2.547 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.227 5.575 -3.650 1.00 0.00 H new ATOM 0 HG LEU B 24 9.042 4.898 -0.877 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.711 4.116 -0.759 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.830 5.788 -1.358 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.520 4.455 -2.495 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.512 2.519 -1.160 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.424 2.756 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.966 2.998 -2.067 1.00 0.00 H new ATOM 1350 N TYR B 25 10.385 2.877 -5.018 1.00 0.00 N ATOM 1351 CA TYR B 25 10.088 1.998 -6.140 1.00 0.00 C ATOM 1352 C TYR B 25 9.092 0.904 -5.780 1.00 0.00 C ATOM 1353 O TYR B 25 9.363 0.069 -4.916 1.00 0.00 O ATOM 1354 CB TYR B 25 11.368 1.321 -6.629 1.00 0.00 C ATOM 1355 CG TYR B 25 12.204 2.146 -7.570 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.815 3.314 -7.147 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.395 1.740 -8.883 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.593 4.059 -8.006 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.175 2.476 -9.748 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.773 3.639 -9.305 1.00 0.00 C ATOM 1361 OH TYR B 25 14.553 4.382 -10.161 1.00 0.00 O ATOM 0 H TYR B 25 11.065 2.500 -4.358 1.00 0.00 H new ATOM 0 HA TYR B 25 9.651 2.627 -6.915 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.975 1.058 -5.763 1.00 0.00 H new ATOM 0 HB3 TYR B 25 11.101 0.389 -7.127 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.680 3.646 -6.128 1.00 0.00 H new ATOM 0 HD2 TYR B 25 11.925 0.833 -9.232 1.00 0.00 H new ATOM 0 HE1 TYR B 25 14.060 4.970 -7.662 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.318 2.145 -10.766 1.00 0.00 H new ATOM 0 HH TYR B 25 15.249 4.846 -9.650 1.00 0.00 H new ATOM 1371 N LEU B 26 7.943 0.903 -6.435 1.00 0.00 N ATOM 1372 CA LEU B 26 6.971 -0.154 -6.219 1.00 0.00 C ATOM 1373 C LEU B 26 7.192 -1.187 -7.290 1.00 0.00 C ATOM 1374 O LEU B 26 6.873 -0.940 -8.455 1.00 0.00 O ATOM 1375 CB LEU B 26 5.518 0.313 -6.327 1.00 0.00 C ATOM 1376 CG LEU B 26 5.189 1.646 -5.698 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.762 2.038 -6.038 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.352 1.596 -4.196 1.00 0.00 C ATOM 0 H LEU B 26 7.663 1.613 -7.112 1.00 0.00 H new ATOM 0 HA LEU B 26 7.116 -0.531 -5.206 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.252 0.360 -7.383 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.881 -0.445 -5.871 1.00 0.00 H new ATOM 0 HG LEU B 26 5.882 2.388 -6.096 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.530 3.000 -5.582 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.654 2.114 -7.120 1.00 0.00 H new ATOM 0 HD13 LEU B 26 3.076 1.281 -5.657 1.00 0.00 H new ATOM 0 HD21 LEU B 26 5.108 2.570 -3.771 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.683 0.842 -3.782 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.383 1.341 -3.950 1.00 0.00 H new ATOM 1390 N MET B 27 7.763 -2.313 -6.936 1.00 0.00 N ATOM 1391 CA MET B 27 7.992 -3.339 -7.921 1.00 0.00 C ATOM 1392 C MET B 27 6.889 -4.360 -7.867 1.00 0.00 C ATOM 1393 O MET B 27 6.113 -4.391 -6.910 1.00 0.00 O ATOM 1394 CB MET B 27 9.356 -4.008 -7.746 1.00 0.00 C ATOM 1395 CG MET B 27 10.475 -3.341 -8.522 1.00 0.00 C ATOM 1396 SD MET B 27 11.994 -3.208 -7.566 1.00 0.00 S ATOM 1397 CE MET B 27 11.469 -2.069 -6.292 1.00 0.00 C ATOM 0 H MET B 27 8.072 -2.539 -5.991 1.00 0.00 H new ATOM 0 HA MET B 27 7.992 -2.864 -8.902 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.614 -4.011 -6.687 1.00 0.00 H new ATOM 0 HB3 MET B 27 9.281 -5.049 -8.059 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.671 -3.909 -9.431 1.00 0.00 H new ATOM 0 HG3 MET B 27 10.156 -2.346 -8.830 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.227 -1.297 -6.160 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.526 -1.606 -6.584 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.333 -2.609 -5.355 1.00 0.00 H new ATOM 1407 N ALA B 28 6.887 -5.222 -8.871 1.00 0.00 N ATOM 1408 CA ALA B 28 5.861 -6.228 -9.056 1.00 0.00 C ATOM 1409 C ALA B 28 5.369 -6.863 -7.759 1.00 0.00 C ATOM 1410 O ALA B 28 4.174 -6.850 -7.472 1.00 0.00 O ATOM 1411 CB ALA B 28 6.347 -7.318 -9.988 1.00 0.00 C ATOM 0 H ALA B 28 7.611 -5.240 -9.590 1.00 0.00 H new ATOM 0 HA ALA B 28 5.013 -5.698 -9.491 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.563 -8.065 -10.115 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.595 -6.884 -10.957 1.00 0.00 H new ATOM 0 HB3 ALA B 28 7.233 -7.791 -9.564 1.00 0.00 H new ATOM 1417 N GLU B 29 6.287 -7.407 -6.976 1.00 0.00 N ATOM 1418 CA GLU B 29 5.911 -8.065 -5.732 1.00 0.00 C ATOM 1419 C GLU B 29 6.643 -7.489 -4.525 1.00 0.00 C ATOM 1420 O GLU B 29 6.462 -7.966 -3.402 1.00 0.00 O ATOM 1421 CB GLU B 29 6.226 -9.554 -5.830 1.00 0.00 C ATOM 1422 CG GLU B 29 5.013 -10.460 -5.862 1.00 0.00 C ATOM 1423 CD GLU B 29 5.258 -11.770 -5.133 1.00 0.00 C ATOM 1424 OE1 GLU B 29 6.436 -12.188 -5.031 1.00 0.00 O ATOM 1425 OE2 GLU B 29 4.276 -12.382 -4.649 1.00 0.00 O ATOM 0 H GLU B 29 7.287 -7.407 -7.175 1.00 0.00 H new ATOM 0 HA GLU B 29 4.843 -7.899 -5.589 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.815 -9.728 -6.730 1.00 0.00 H new ATOM 0 HB3 GLU B 29 6.850 -9.835 -4.982 1.00 0.00 H new ATOM 0 HG2 GLU B 29 4.165 -9.946 -5.408 1.00 0.00 H new ATOM 0 HG3 GLU B 29 4.743 -10.667 -6.898 1.00 0.00 H new ATOM 1432 N ARG B 30 7.435 -6.444 -4.720 1.00 0.00 N ATOM 1433 CA ARG B 30 8.195 -5.896 -3.608 1.00 0.00 C ATOM 1434 C ARG B 30 8.392 -4.397 -3.737 1.00 0.00 C ATOM 1435 O ARG B 30 8.626 -3.876 -4.820 1.00 0.00 O ATOM 1436 CB ARG B 30 9.558 -6.590 -3.486 1.00 0.00 C ATOM 1437 CG ARG B 30 10.138 -7.056 -4.813 1.00 0.00 C ATOM 1438 CD ARG B 30 10.515 -8.530 -4.764 1.00 0.00 C ATOM 1439 NE ARG B 30 10.125 -9.230 -5.983 1.00 0.00 N ATOM 1440 CZ ARG B 30 9.363 -10.322 -6.014 1.00 0.00 C ATOM 1441 NH1 ARG B 30 8.925 -10.876 -4.890 1.00 0.00 N ATOM 1442 NH2 ARG B 30 9.029 -10.849 -7.180 1.00 0.00 N ATOM 0 H ARG B 30 7.566 -5.970 -5.613 1.00 0.00 H new ATOM 0 HA ARG B 30 7.614 -6.082 -2.705 1.00 0.00 H new ATOM 0 HB2 ARG B 30 10.262 -5.904 -3.015 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.458 -7.450 -2.823 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.411 -6.890 -5.608 1.00 0.00 H new ATOM 0 HG3 ARG B 30 11.018 -6.461 -5.057 1.00 0.00 H new ATOM 0 HD2 ARG B 30 11.591 -8.625 -4.619 1.00 0.00 H new ATOM 0 HD3 ARG B 30 10.035 -9.000 -3.906 1.00 0.00 H new ATOM 0 HE ARG B 30 10.459 -8.858 -6.872 1.00 0.00 H new ATOM 0 HH11 ARG B 30 9.171 -10.465 -3.989 1.00 0.00 H new ATOM 0 HH12 ARG B 30 8.342 -11.712 -4.927 1.00 0.00 H new ATOM 0 HH21 ARG B 30 9.355 -10.419 -8.046 1.00 0.00 H new ATOM 0 HH22 ARG B 30 8.446 -11.685 -7.213 1.00 0.00 H new ATOM 1456 N ILE B 31 8.290 -3.712 -2.618 1.00 0.00 N ATOM 1457 CA ILE B 31 8.473 -2.279 -2.585 1.00 0.00 C ATOM 1458 C ILE B 31 9.861 -1.972 -2.037 1.00 0.00 C ATOM 1459 O ILE B 31 10.218 -2.402 -0.938 1.00 0.00 O ATOM 1460 CB ILE B 31 7.378 -1.585 -1.739 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.648 -0.085 -1.627 1.00 0.00 C ATOM 1462 CG2 ILE B 31 7.274 -2.218 -0.359 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.514 0.688 -0.988 1.00 0.00 C ATOM 0 H ILE B 31 8.079 -4.130 -1.712 1.00 0.00 H new ATOM 0 HA ILE B 31 8.385 -1.887 -3.598 1.00 0.00 H new ATOM 0 HB ILE B 31 6.423 -1.722 -2.247 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.556 0.070 -1.044 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.836 0.317 -2.622 1.00 0.00 H new ATOM 0 HG21 ILE B 31 6.498 -1.713 0.216 1.00 0.00 H new ATOM 0 HG22 ILE B 31 7.021 -3.273 -0.461 1.00 0.00 H new ATOM 0 HG23 ILE B 31 8.229 -2.122 0.158 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.775 1.745 -0.941 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.609 0.564 -1.582 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.340 0.312 0.020 1.00 0.00 H new ATOM 1475 N ALA B 32 10.659 -1.272 -2.817 1.00 0.00 N ATOM 1476 CA ALA B 32 12.012 -0.946 -2.395 1.00 0.00 C ATOM 1477 C ALA B 32 12.316 0.539 -2.547 1.00 0.00 C ATOM 1478 O ALA B 32 11.949 1.166 -3.534 1.00 0.00 O ATOM 1479 CB ALA B 32 13.018 -1.786 -3.160 1.00 0.00 C ATOM 0 H ALA B 32 10.401 -0.919 -3.739 1.00 0.00 H new ATOM 0 HA ALA B 32 12.093 -1.180 -1.333 1.00 0.00 H new ATOM 0 HB1 ALA B 32 14.027 -1.532 -2.834 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.830 -2.843 -2.969 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.921 -1.588 -4.227 1.00 0.00 H new ATOM 1485 N TRP B 33 12.990 1.086 -1.550 1.00 0.00 N ATOM 1486 CA TRP B 33 13.356 2.490 -1.531 1.00 0.00 C ATOM 1487 C TRP B 33 14.876 2.652 -1.489 1.00 0.00 C ATOM 1488 O TRP B 33 15.581 1.834 -0.892 1.00 0.00 O ATOM 1489 CB TRP B 33 12.712 3.143 -0.296 1.00 0.00 C ATOM 1490 CG TRP B 33 13.033 4.602 -0.093 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.199 5.665 -0.290 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.274 5.157 0.362 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.851 6.837 0.015 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.123 6.549 0.412 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.499 4.604 0.723 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.151 7.394 0.816 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.520 5.433 1.112 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.343 6.824 1.159 1.00 0.00 C ATOM 0 H TRP B 33 13.299 0.566 -0.729 1.00 0.00 H new ATOM 0 HA TRP B 33 12.997 2.975 -2.439 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.630 3.034 -0.371 1.00 0.00 H new ATOM 0 HB3 TRP B 33 13.027 2.593 0.591 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.178 5.596 -0.635 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.447 7.772 -0.046 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.644 3.534 0.697 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.011 8.464 0.857 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.475 5.009 1.386 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.163 7.454 1.472 1.00 0.00 H new ATOM 1509 N ALA B 34 15.368 3.712 -2.123 1.00 0.00 N ATOM 1510 CA ALA B 34 16.792 4.042 -2.140 1.00 0.00 C ATOM 1511 C ALA B 34 16.940 5.560 -2.224 1.00 0.00 C ATOM 1512 O ALA B 34 16.034 6.202 -2.696 1.00 0.00 O ATOM 1513 CB ALA B 34 17.468 3.386 -3.305 1.00 0.00 C ATOM 0 H ALA B 34 14.788 4.371 -2.643 1.00 0.00 H new ATOM 0 HA ALA B 34 17.265 3.676 -1.229 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.527 3.642 -3.302 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.356 2.304 -3.229 1.00 0.00 H new ATOM 0 HB3 ALA B 34 17.013 3.733 -4.233 1.00 0.00 H new ATOM 1519 N PRO B 35 18.051 6.171 -1.766 1.00 0.00 N ATOM 1520 CA PRO B 35 18.218 7.635 -1.814 1.00 0.00 C ATOM 1521 C PRO B 35 18.630 8.152 -3.197 1.00 0.00 C ATOM 1522 O PRO B 35 19.101 7.389 -4.043 1.00 0.00 O ATOM 1523 CB PRO B 35 19.340 7.910 -0.802 1.00 0.00 C ATOM 1524 CG PRO B 35 19.715 6.584 -0.217 1.00 0.00 C ATOM 1525 CD PRO B 35 19.220 5.530 -1.170 1.00 0.00 C ATOM 0 HA PRO B 35 17.278 8.140 -1.591 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.197 8.376 -1.289 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.003 8.596 -0.025 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.795 6.511 -0.087 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.266 6.456 0.768 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.970 5.275 -1.919 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.958 4.606 -0.654 1.00 0.00 H new ATOM 1533 N GLU B 36 18.467 9.458 -3.403 1.00 0.00 N ATOM 1534 CA GLU B 36 18.814 10.090 -4.670 1.00 0.00 C ATOM 1535 C GLU B 36 20.326 10.119 -4.844 1.00 0.00 C ATOM 1536 O GLU B 36 21.046 10.784 -4.103 1.00 0.00 O ATOM 1537 CB GLU B 36 18.236 11.509 -4.748 1.00 0.00 C ATOM 1538 CG GLU B 36 16.718 11.567 -4.616 1.00 0.00 C ATOM 1539 CD GLU B 36 15.985 10.986 -5.815 1.00 0.00 C ATOM 1540 OE1 GLU B 36 16.434 9.950 -6.356 1.00 0.00 O ATOM 1541 OE2 GLU B 36 14.950 11.562 -6.218 1.00 0.00 O ATOM 0 H GLU B 36 18.095 10.100 -2.703 1.00 0.00 H new ATOM 0 HA GLU B 36 18.379 9.503 -5.479 1.00 0.00 H new ATOM 0 HB2 GLU B 36 18.683 12.116 -3.961 1.00 0.00 H new ATOM 0 HB3 GLU B 36 18.525 11.957 -5.699 1.00 0.00 H new ATOM 0 HG2 GLU B 36 16.418 11.026 -3.719 1.00 0.00 H new ATOM 0 HG3 GLU B 36 16.412 12.604 -4.480 1.00 0.00 H new ATOM 1548 N GLY B 37 20.794 9.368 -5.822 1.00 0.00 N ATOM 1549 CA GLY B 37 22.215 9.272 -6.091 1.00 0.00 C ATOM 1550 C GLY B 37 22.652 7.837 -5.953 1.00 0.00 C ATOM 1551 O GLY B 37 23.650 7.404 -6.526 1.00 0.00 O ATOM 0 H GLY B 37 20.208 8.813 -6.446 1.00 0.00 H new ATOM 0 HA2 GLY B 37 22.432 9.635 -7.096 1.00 0.00 H new ATOM 0 HA3 GLY B 37 22.772 9.902 -5.397 1.00 0.00 H new ATOM 1555 N LYS B 38 21.868 7.107 -5.182 1.00 0.00 N ATOM 1556 CA LYS B 38 22.085 5.700 -4.944 1.00 0.00 C ATOM 1557 C LYS B 38 20.779 4.985 -5.230 1.00 0.00 C ATOM 1558 O LYS B 38 20.117 4.492 -4.317 1.00 0.00 O ATOM 1559 CB LYS B 38 22.530 5.453 -3.495 1.00 0.00 C ATOM 1560 CG LYS B 38 22.814 3.992 -3.167 1.00 0.00 C ATOM 1561 CD LYS B 38 23.012 3.790 -1.672 1.00 0.00 C ATOM 1562 CE LYS B 38 22.964 2.318 -1.290 1.00 0.00 C ATOM 1563 NZ LYS B 38 21.571 1.794 -1.261 1.00 0.00 N ATOM 0 H LYS B 38 21.053 7.484 -4.699 1.00 0.00 H new ATOM 0 HA LYS B 38 22.877 5.324 -5.591 1.00 0.00 H new ATOM 0 HB2 LYS B 38 23.428 6.039 -3.298 1.00 0.00 H new ATOM 0 HB3 LYS B 38 21.756 5.821 -2.822 1.00 0.00 H new ATOM 0 HG2 LYS B 38 21.987 3.372 -3.514 1.00 0.00 H new ATOM 0 HG3 LYS B 38 23.705 3.663 -3.702 1.00 0.00 H new ATOM 0 HD2 LYS B 38 23.971 4.212 -1.372 1.00 0.00 H new ATOM 0 HD3 LYS B 38 22.240 4.333 -1.126 1.00 0.00 H new ATOM 0 HE2 LYS B 38 23.554 1.740 -2.001 1.00 0.00 H new ATOM 0 HE3 LYS B 38 23.423 2.183 -0.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 21.584 0.788 -0.996 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 21.014 2.328 -0.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 21.141 1.899 -2.202 1.00 0.00 H new ATOM 1577 N ASP B 39 20.405 4.953 -6.508 1.00 0.00 N ATOM 1578 CA ASP B 39 19.156 4.322 -6.940 1.00 0.00 C ATOM 1579 C ASP B 39 19.128 2.838 -6.596 1.00 0.00 C ATOM 1580 O ASP B 39 18.112 2.169 -6.781 1.00 0.00 O ATOM 1581 CB ASP B 39 18.916 4.538 -8.437 1.00 0.00 C ATOM 1582 CG ASP B 39 17.912 5.650 -8.704 1.00 0.00 C ATOM 1583 OD1 ASP B 39 18.327 6.828 -8.790 1.00 0.00 O ATOM 1584 OD2 ASP B 39 16.701 5.359 -8.821 1.00 0.00 O ATOM 0 H ASP B 39 20.952 5.359 -7.267 1.00 0.00 H new ATOM 0 HA ASP B 39 18.345 4.803 -6.393 1.00 0.00 H new ATOM 0 HB2 ASP B 39 19.861 4.780 -8.924 1.00 0.00 H new ATOM 0 HB3 ASP B 39 18.556 3.611 -8.883 1.00 0.00 H new ATOM 1589 N ARG B 40 20.243 2.313 -6.097 1.00 0.00 N ATOM 1590 CA ARG B 40 20.276 0.930 -5.689 1.00 0.00 C ATOM 1591 C ARG B 40 19.550 0.850 -4.359 1.00 0.00 C ATOM 1592 O ARG B 40 19.984 1.449 -3.372 1.00 0.00 O ATOM 1593 CB ARG B 40 21.712 0.417 -5.549 1.00 0.00 C ATOM 1594 CG ARG B 40 21.834 -1.090 -5.725 1.00 0.00 C ATOM 1595 CD ARG B 40 22.516 -1.750 -4.535 1.00 0.00 C ATOM 1596 NE ARG B 40 21.570 -2.069 -3.460 1.00 0.00 N ATOM 1597 CZ ARG B 40 21.654 -3.157 -2.689 1.00 0.00 C ATOM 1598 NH1 ARG B 40 22.636 -4.035 -2.870 1.00 0.00 N ATOM 1599 NH2 ARG B 40 20.750 -3.364 -1.738 1.00 0.00 N ATOM 0 H ARG B 40 21.118 2.822 -5.970 1.00 0.00 H new ATOM 0 HA ARG B 40 19.797 0.303 -6.441 1.00 0.00 H new ATOM 0 HB2 ARG B 40 22.341 0.914 -6.287 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.095 0.693 -4.566 1.00 0.00 H new ATOM 0 HG2 ARG B 40 20.842 -1.521 -5.859 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.400 -1.304 -6.632 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.012 -2.664 -4.863 1.00 0.00 H new ATOM 0 HD3 ARG B 40 23.291 -1.088 -4.150 1.00 0.00 H new ATOM 0 HE ARG B 40 20.801 -1.421 -3.291 1.00 0.00 H new ATOM 0 HH11 ARG B 40 23.331 -3.880 -3.601 1.00 0.00 H new ATOM 0 HH12 ARG B 40 22.695 -4.864 -2.278 1.00 0.00 H new ATOM 0 HH21 ARG B 40 19.994 -2.693 -1.598 1.00 0.00 H new ATOM 0 HH22 ARG B 40 20.811 -4.194 -1.148 1.00 0.00 H new ATOM 1613 N PHE B 41 18.469 0.090 -4.350 1.00 0.00 N ATOM 1614 CA PHE B 41 17.597 -0.054 -3.186 1.00 0.00 C ATOM 1615 C PHE B 41 18.338 -0.269 -1.873 1.00 0.00 C ATOM 1616 O PHE B 41 19.351 -0.974 -1.802 1.00 0.00 O ATOM 1617 CB PHE B 41 16.615 -1.192 -3.421 1.00 0.00 C ATOM 1618 CG PHE B 41 16.049 -1.193 -4.813 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.363 -0.087 -5.290 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.211 -2.289 -5.646 1.00 0.00 C ATOM 1621 CE1 PHE B 41 14.851 -0.072 -6.571 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.698 -2.279 -6.929 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.016 -1.169 -7.392 1.00 0.00 C ATOM 0 H PHE B 41 18.164 -0.453 -5.158 1.00 0.00 H new ATOM 0 HA PHE B 41 17.072 0.895 -3.079 1.00 0.00 H new ATOM 0 HB2 PHE B 41 17.116 -2.142 -3.236 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.799 -1.117 -2.702 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.228 0.773 -4.651 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.743 -3.159 -5.289 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.321 0.798 -6.931 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.830 -3.138 -7.570 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.613 -1.160 -8.394 1.00 0.00 H new ATOM 1633 N THR B 42 17.815 0.379 -0.848 1.00 0.00 N ATOM 1634 CA THR B 42 18.341 0.300 0.501 1.00 0.00 C ATOM 1635 C THR B 42 17.362 -0.475 1.373 1.00 0.00 C ATOM 1636 O THR B 42 17.730 -1.406 2.084 1.00 0.00 O ATOM 1637 CB THR B 42 18.526 1.713 1.093 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.453 2.473 0.302 1.00 0.00 O ATOM 1639 CG2 THR B 42 19.002 1.648 2.536 1.00 0.00 C ATOM 0 H THR B 42 16.999 0.985 -0.932 1.00 0.00 H new ATOM 0 HA THR B 42 19.307 -0.203 0.473 1.00 0.00 H new ATOM 0 HB THR B 42 17.556 2.210 1.076 1.00 0.00 H new ATOM 0 HG1 THR B 42 20.062 2.963 0.893 1.00 0.00 H new ATOM 0 HG21 THR B 42 19.123 2.659 2.925 1.00 0.00 H new ATOM 0 HG22 THR B 42 18.267 1.113 3.138 1.00 0.00 H new ATOM 0 HG23 THR B 42 19.957 1.125 2.581 1.00 0.00 H new ATOM 1647 N ILE B 43 16.103 -0.079 1.280 1.00 0.00 N ATOM 1648 CA ILE B 43 15.030 -0.691 2.041 1.00 0.00 C ATOM 1649 C ILE B 43 14.144 -1.511 1.109 1.00 0.00 C ATOM 1650 O ILE B 43 13.669 -1.001 0.098 1.00 0.00 O ATOM 1651 CB ILE B 43 14.198 0.401 2.757 1.00 0.00 C ATOM 1652 CG1 ILE B 43 14.794 0.705 4.132 1.00 0.00 C ATOM 1653 CG2 ILE B 43 12.730 0.006 2.884 1.00 0.00 C ATOM 1654 CD1 ILE B 43 14.144 1.887 4.819 1.00 0.00 C ATOM 0 H ILE B 43 15.797 0.680 0.671 1.00 0.00 H new ATOM 0 HA ILE B 43 15.455 -1.352 2.796 1.00 0.00 H new ATOM 0 HB ILE B 43 14.239 1.302 2.145 1.00 0.00 H new ATOM 0 HG12 ILE B 43 14.693 -0.176 4.767 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.861 0.899 4.023 1.00 0.00 H new ATOM 0 HG21 ILE B 43 12.182 0.800 3.392 1.00 0.00 H new ATOM 0 HG22 ILE B 43 12.308 -0.148 1.891 1.00 0.00 H new ATOM 0 HG23 ILE B 43 12.650 -0.916 3.460 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.614 2.048 5.789 1.00 0.00 H new ATOM 0 HD12 ILE B 43 14.267 2.778 4.204 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.082 1.687 4.959 1.00 0.00 H new ATOM 1666 N SER B 44 13.967 -2.785 1.421 1.00 0.00 N ATOM 1667 CA SER B 44 13.140 -3.660 0.602 1.00 0.00 C ATOM 1668 C SER B 44 12.092 -4.373 1.453 1.00 0.00 C ATOM 1669 O SER B 44 12.424 -5.023 2.443 1.00 0.00 O ATOM 1670 CB SER B 44 14.022 -4.680 -0.120 1.00 0.00 C ATOM 1671 OG SER B 44 15.152 -4.044 -0.694 1.00 0.00 O ATOM 0 H SER B 44 14.384 -3.237 2.235 1.00 0.00 H new ATOM 0 HA SER B 44 12.618 -3.052 -0.137 1.00 0.00 H new ATOM 0 HB2 SER B 44 14.347 -5.449 0.581 1.00 0.00 H new ATOM 0 HB3 SER B 44 13.446 -5.181 -0.898 1.00 0.00 H new ATOM 0 HG SER B 44 15.706 -4.711 -1.150 1.00 0.00 H new ATOM 1677 N HIS B 45 10.832 -4.244 1.064 1.00 0.00 N ATOM 1678 CA HIS B 45 9.740 -4.880 1.775 1.00 0.00 C ATOM 1679 C HIS B 45 8.858 -5.614 0.789 1.00 0.00 C ATOM 1680 O HIS B 45 8.511 -5.093 -0.268 1.00 0.00 O ATOM 1681 CB HIS B 45 8.905 -3.859 2.558 1.00 0.00 C ATOM 1682 CG HIS B 45 9.640 -3.212 3.692 1.00 0.00 C ATOM 1683 ND1 HIS B 45 10.142 -3.893 4.780 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.969 -1.912 3.881 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.751 -3.005 5.576 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.676 -1.787 5.073 1.00 0.00 N ATOM 0 H HIS B 45 10.542 -3.699 0.252 1.00 0.00 H new ATOM 0 HA HIS B 45 10.165 -5.583 2.492 1.00 0.00 H new ATOM 0 HB2 HIS B 45 8.561 -3.084 1.873 1.00 0.00 H new ATOM 0 HB3 HIS B 45 8.017 -4.355 2.950 1.00 0.00 H new ATOM 0 HD1 HIS B 45 10.064 -4.896 4.949 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.722 -1.101 3.212 1.00 0.00 H new ATOM 0 HE1 HIS B 45 11.239 -3.253 6.507 1.00 0.00 H new ATOM 1694 N MET B 46 8.523 -6.831 1.125 1.00 0.00 N ATOM 1695 CA MET B 46 7.684 -7.649 0.278 1.00 0.00 C ATOM 1696 C MET B 46 6.225 -7.351 0.575 1.00 0.00 C ATOM 1697 O MET B 46 5.838 -7.321 1.738 1.00 0.00 O ATOM 1698 CB MET B 46 7.981 -9.118 0.552 1.00 0.00 C ATOM 1699 CG MET B 46 9.152 -9.674 -0.241 1.00 0.00 C ATOM 1700 SD MET B 46 8.817 -9.769 -2.009 1.00 0.00 S ATOM 1701 CE MET B 46 7.275 -10.683 -2.025 1.00 0.00 C ATOM 0 H MET B 46 8.820 -7.285 1.988 1.00 0.00 H new ATOM 0 HA MET B 46 7.886 -7.429 -0.770 1.00 0.00 H new ATOM 0 HB2 MET B 46 8.184 -9.244 1.615 1.00 0.00 H new ATOM 0 HB3 MET B 46 7.091 -9.706 0.326 1.00 0.00 H new ATOM 0 HG2 MET B 46 10.028 -9.046 -0.075 1.00 0.00 H new ATOM 0 HG3 MET B 46 9.397 -10.669 0.131 1.00 0.00 H new ATOM 0 HE1 MET B 46 7.216 -11.281 -2.934 1.00 0.00 H new ATOM 0 HE2 MET B 46 7.232 -11.339 -1.156 1.00 0.00 H new ATOM 0 HE3 MET B 46 6.438 -9.985 -1.995 1.00 0.00 H new ATOM 1711 N TYR B 47 5.414 -7.138 -0.465 1.00 0.00 N ATOM 1712 CA TYR B 47 3.983 -6.856 -0.268 1.00 0.00 C ATOM 1713 C TYR B 47 3.338 -7.998 0.515 1.00 0.00 C ATOM 1714 O TYR B 47 2.279 -7.848 1.114 1.00 0.00 O ATOM 1715 CB TYR B 47 3.243 -6.718 -1.601 1.00 0.00 C ATOM 1716 CG TYR B 47 3.525 -5.458 -2.386 1.00 0.00 C ATOM 1717 CD1 TYR B 47 4.801 -5.164 -2.838 1.00 0.00 C ATOM 1718 CD2 TYR B 47 2.498 -4.576 -2.705 1.00 0.00 C ATOM 1719 CE1 TYR B 47 5.051 -4.028 -3.577 1.00 0.00 C ATOM 1720 CE2 TYR B 47 2.740 -3.440 -3.448 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.019 -3.170 -3.880 1.00 0.00 C ATOM 1722 OH TYR B 47 4.269 -2.046 -4.625 1.00 0.00 O ATOM 0 H TYR B 47 5.714 -7.154 -1.440 1.00 0.00 H new ATOM 0 HA TYR B 47 3.909 -5.915 0.277 1.00 0.00 H new ATOM 0 HB2 TYR B 47 3.495 -7.576 -2.225 1.00 0.00 H new ATOM 0 HB3 TYR B 47 2.172 -6.770 -1.407 1.00 0.00 H new ATOM 0 HD1 TYR B 47 5.614 -5.837 -2.607 1.00 0.00 H new ATOM 0 HD2 TYR B 47 1.494 -4.784 -2.365 1.00 0.00 H new ATOM 0 HE1 TYR B 47 6.053 -3.812 -3.917 1.00 0.00 H new ATOM 0 HE2 TYR B 47 1.931 -2.766 -3.690 1.00 0.00 H new ATOM 0 HH TYR B 47 3.436 -1.546 -4.753 1.00 0.00 H new ATOM 1732 N ALA B 48 4.003 -9.143 0.467 1.00 0.00 N ATOM 1733 CA ALA B 48 3.563 -10.349 1.144 1.00 0.00 C ATOM 1734 C ALA B 48 3.657 -10.219 2.660 1.00 0.00 C ATOM 1735 O ALA B 48 2.959 -10.919 3.393 1.00 0.00 O ATOM 1736 CB ALA B 48 4.382 -11.531 0.658 1.00 0.00 C ATOM 0 H ALA B 48 4.874 -9.260 -0.050 1.00 0.00 H new ATOM 0 HA ALA B 48 2.512 -10.509 0.903 1.00 0.00 H new ATOM 0 HB1 ALA B 48 4.051 -12.437 1.167 1.00 0.00 H new ATOM 0 HB2 ALA B 48 4.248 -11.649 -0.417 1.00 0.00 H new ATOM 0 HB3 ALA B 48 5.436 -11.357 0.875 1.00 0.00 H new ATOM 1742 N ASP B 49 4.523 -9.333 3.122 1.00 0.00 N ATOM 1743 CA ASP B 49 4.692 -9.111 4.548 1.00 0.00 C ATOM 1744 C ASP B 49 3.966 -7.844 4.957 1.00 0.00 C ATOM 1745 O ASP B 49 3.508 -7.722 6.084 1.00 0.00 O ATOM 1746 CB ASP B 49 6.185 -9.040 4.908 1.00 0.00 C ATOM 1747 CG ASP B 49 6.506 -8.007 5.977 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.119 -8.210 7.152 1.00 0.00 O ATOM 1749 OD2 ASP B 49 7.151 -6.994 5.638 1.00 0.00 O ATOM 0 H ASP B 49 5.120 -8.756 2.530 1.00 0.00 H new ATOM 0 HA ASP B 49 4.260 -9.948 5.096 1.00 0.00 H new ATOM 0 HB2 ASP B 49 6.514 -10.021 5.252 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.756 -8.809 4.009 1.00 0.00 H new ATOM 1754 N ILE B 50 3.834 -6.911 4.027 1.00 0.00 N ATOM 1755 CA ILE B 50 3.149 -5.666 4.320 1.00 0.00 C ATOM 1756 C ILE B 50 1.672 -5.925 4.591 1.00 0.00 C ATOM 1757 O ILE B 50 0.931 -6.368 3.716 1.00 0.00 O ATOM 1758 CB ILE B 50 3.285 -4.635 3.187 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.679 -4.686 2.575 1.00 0.00 C ATOM 1760 CG2 ILE B 50 3.008 -3.243 3.725 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.829 -3.798 1.367 1.00 0.00 C ATOM 0 H ILE B 50 4.188 -6.992 3.074 1.00 0.00 H new ATOM 0 HA ILE B 50 3.626 -5.249 5.207 1.00 0.00 H new ATOM 0 HB ILE B 50 2.559 -4.875 2.410 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.410 -4.391 3.328 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.908 -5.714 2.293 1.00 0.00 H new ATOM 0 HG21 ILE B 50 3.105 -2.515 2.919 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.996 -3.204 4.129 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.723 -3.009 4.514 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.844 -3.880 0.979 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.121 -4.107 0.598 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.631 -2.764 1.649 1.00 0.00 H new ATOM 1773 N LYS B 51 1.266 -5.655 5.818 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.106 -5.854 6.245 1.00 0.00 C ATOM 1775 C LYS B 51 -1.013 -4.788 5.660 1.00 0.00 C ATOM 1776 O LYS B 51 -1.944 -5.079 4.914 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.183 -5.800 7.771 1.00 0.00 C ATOM 1778 CG LYS B 51 -1.601 -5.761 8.305 1.00 0.00 C ATOM 1779 CD LYS B 51 -1.688 -4.985 9.603 1.00 0.00 C ATOM 1780 CE LYS B 51 -3.107 -4.988 10.132 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.855 -3.762 9.732 1.00 0.00 N ATOM 0 H LYS B 51 1.879 -5.291 6.547 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.438 -6.830 5.890 1.00 0.00 H new ATOM 0 HB2 LYS B 51 0.328 -6.670 8.183 1.00 0.00 H new ATOM 0 HB3 LYS B 51 0.353 -4.919 8.123 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.257 -5.305 7.563 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -1.958 -6.778 8.464 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.018 -5.425 10.342 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.356 -3.959 9.443 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.630 -5.869 9.761 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -3.088 -5.063 11.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.840 -3.835 10.056 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -3.409 -2.927 10.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.838 -3.667 8.696 1.00 0.00 H new ATOM 1795 N CYS B 52 -0.723 -3.549 6.012 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.509 -2.418 5.560 1.00 0.00 C ATOM 1797 C CYS B 52 -0.599 -1.219 5.380 1.00 0.00 C ATOM 1798 O CYS B 52 0.623 -1.344 5.422 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.616 -2.100 6.572 1.00 0.00 C ATOM 1800 SG CYS B 52 -3.877 -3.393 6.731 1.00 0.00 S ATOM 0 H CYS B 52 0.060 -3.300 6.616 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.979 -2.662 4.607 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.162 -1.930 7.548 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.102 -1.169 6.280 1.00 0.00 H new ATOM 0 HG CYS B 52 -4.151 -3.879 5.557 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.187 -0.064 5.176 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.422 1.151 4.992 1.00 0.00 C ATOM 1808 C GLN B 53 -0.989 2.241 5.874 1.00 0.00 C ATOM 1809 O GLN B 53 -1.910 2.000 6.636 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.440 1.608 3.532 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.428 0.475 2.524 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.646 0.504 1.633 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.670 1.212 0.634 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -2.673 -0.257 1.990 1.00 0.00 N ATOM 0 H GLN B 53 -2.198 0.062 5.133 1.00 0.00 H new ATOM 0 HA GLN B 53 0.613 0.947 5.268 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.328 2.218 3.365 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.424 2.248 3.353 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.472 0.542 1.912 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.385 -0.479 3.050 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.613 -0.833 2.830 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.522 -0.266 1.425 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.385 3.406 5.821 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.847 4.558 6.567 1.00 0.00 C ATOM 1825 C LYS B 54 -0.493 5.803 5.772 1.00 0.00 C ATOM 1826 O LYS B 54 0.466 5.785 5.007 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.249 4.592 7.970 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.018 3.747 8.972 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.942 4.321 10.374 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.415 3.314 11.403 1.00 0.00 C ATOM 1831 NZ LYS B 54 -0.563 2.099 11.405 1.00 0.00 N ATOM 0 H LYS B 54 0.446 3.584 5.256 1.00 0.00 H new ATOM 0 HA LYS B 54 -1.927 4.505 6.703 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.782 4.242 7.926 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.221 5.624 8.321 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.061 3.679 8.664 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -0.619 2.733 8.973 1.00 0.00 H new ATOM 0 HD2 LYS B 54 0.084 4.616 10.594 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -1.553 5.222 10.435 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.403 3.770 12.393 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -2.448 3.035 11.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -1.090 1.305 10.988 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.296 2.276 10.846 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -0.297 1.863 12.382 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.271 6.864 5.913 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.033 8.085 5.144 1.00 0.00 C ATOM 1847 C ILE B 55 -1.500 9.326 5.866 1.00 0.00 C ATOM 1848 O ILE B 55 -2.374 9.247 6.716 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.828 8.055 3.826 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.290 7.701 4.104 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.224 7.088 2.842 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.179 7.840 2.897 1.00 0.00 C ATOM 0 H ILE B 55 -2.069 6.910 6.547 1.00 0.00 H new ATOM 0 HA ILE B 55 0.044 8.120 4.983 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.783 9.048 3.379 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.345 6.676 4.470 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.667 8.344 4.899 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.809 7.091 1.923 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.199 7.386 2.621 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.226 6.085 3.269 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.201 7.573 3.165 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.154 8.871 2.543 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.827 7.177 2.107 1.00 0.00 H new ATOM 1864 N SER B 56 -0.918 10.466 5.522 1.00 0.00 N ATOM 1865 CA SER B 56 -1.351 11.736 6.074 1.00 0.00 C ATOM 1866 C SER B 56 -2.516 12.207 5.210 1.00 0.00 C ATOM 1867 O SER B 56 -2.314 12.707 4.110 1.00 0.00 O ATOM 1868 CB SER B 56 -0.208 12.756 6.071 1.00 0.00 C ATOM 1869 OG SER B 56 0.480 12.778 4.828 1.00 0.00 O ATOM 0 H SER B 56 -0.144 10.535 4.862 1.00 0.00 H new ATOM 0 HA SER B 56 -1.659 11.627 7.114 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.606 13.748 6.283 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.494 12.517 6.870 1.00 0.00 H new ATOM 0 HG SER B 56 0.835 13.677 4.666 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.751 12.039 5.685 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.956 12.362 4.921 1.00 0.00 C ATOM 1877 C PRO B 57 -5.239 13.854 4.813 1.00 0.00 C ATOM 1878 O PRO B 57 -6.234 14.360 5.331 1.00 0.00 O ATOM 1879 CB PRO B 57 -6.059 11.651 5.681 1.00 0.00 C ATOM 1880 CG PRO B 57 -5.356 10.810 6.685 1.00 0.00 C ATOM 1881 CD PRO B 57 -4.103 11.542 7.006 1.00 0.00 C ATOM 0 HA PRO B 57 -4.858 12.045 3.883 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.729 12.363 6.163 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.669 11.042 5.014 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.968 10.669 7.576 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.141 9.819 6.286 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -4.263 12.346 7.724 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.336 10.890 7.423 1.00 0.00 H new ATOM 1889 N GLU B 58 -4.330 14.527 4.138 1.00 0.00 N ATOM 1890 CA GLU B 58 -4.381 15.972 3.878 1.00 0.00 C ATOM 1891 C GLU B 58 -4.397 16.820 5.155 1.00 0.00 C ATOM 1892 O GLU B 58 -4.541 18.040 5.092 1.00 0.00 O ATOM 1893 CB GLU B 58 -5.571 16.313 2.980 1.00 0.00 C ATOM 1894 CG GLU B 58 -5.486 15.666 1.604 1.00 0.00 C ATOM 1895 CD GLU B 58 -4.104 15.785 0.982 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -3.212 14.980 1.342 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -3.909 16.675 0.133 1.00 0.00 O ATOM 0 H GLU B 58 -3.505 14.080 3.738 1.00 0.00 H new ATOM 0 HA GLU B 58 -3.457 16.226 3.360 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -6.491 15.993 3.469 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.632 17.395 2.863 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.753 14.612 1.686 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.218 16.130 0.943 1.00 0.00 H new ATOM 1904 N GLY B 59 -4.243 16.182 6.306 1.00 0.00 N ATOM 1905 CA GLY B 59 -4.213 16.915 7.556 1.00 0.00 C ATOM 1906 C GLY B 59 -2.802 17.343 7.892 1.00 0.00 C ATOM 1907 O GLY B 59 -2.576 18.233 8.710 1.00 0.00 O ATOM 0 H GLY B 59 -4.138 15.171 6.397 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -4.857 17.792 7.485 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -4.610 16.292 8.358 1.00 0.00 H new ATOM 1911 N LYS B 60 -1.850 16.711 7.224 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.443 16.994 7.431 1.00 0.00 C ATOM 1913 C LYS B 60 0.162 17.535 6.147 1.00 0.00 C ATOM 1914 O LYS B 60 0.051 16.909 5.094 1.00 0.00 O ATOM 1915 CB LYS B 60 0.285 15.725 7.880 1.00 0.00 C ATOM 1916 CG LYS B 60 -0.480 14.933 8.926 1.00 0.00 C ATOM 1917 CD LYS B 60 0.419 13.961 9.669 1.00 0.00 C ATOM 1918 CE LYS B 60 1.070 14.598 10.889 1.00 0.00 C ATOM 1919 NZ LYS B 60 0.094 15.300 11.772 1.00 0.00 N ATOM 0 H LYS B 60 -2.032 15.990 6.526 1.00 0.00 H new ATOM 0 HA LYS B 60 -0.335 17.746 8.213 1.00 0.00 H new ATOM 0 HB2 LYS B 60 0.463 15.090 7.012 1.00 0.00 H new ATOM 0 HB3 LYS B 60 1.261 15.997 8.282 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -0.939 15.620 9.637 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -1.290 14.384 8.445 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -0.165 13.095 9.981 1.00 0.00 H new ATOM 0 HD3 LYS B 60 1.194 13.597 8.994 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.583 13.827 11.464 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.829 15.308 10.560 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.257 16.326 11.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.874 15.087 11.457 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 0.218 14.977 12.753 1.00 0.00 H new ATOM 1933 N ALA B 61 0.788 18.704 6.246 1.00 0.00 N ATOM 1934 CA ALA B 61 1.407 19.356 5.096 1.00 0.00 C ATOM 1935 C ALA B 61 2.441 18.464 4.424 1.00 0.00 C ATOM 1936 O ALA B 61 2.532 18.429 3.199 1.00 0.00 O ATOM 1937 CB ALA B 61 2.042 20.664 5.515 1.00 0.00 C ATOM 0 H ALA B 61 0.880 19.223 7.119 1.00 0.00 H new ATOM 0 HA ALA B 61 0.619 19.552 4.369 1.00 0.00 H new ATOM 0 HB1 ALA B 61 2.500 21.140 4.648 1.00 0.00 H new ATOM 0 HB2 ALA B 61 1.279 21.323 5.930 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.805 20.473 6.269 1.00 0.00 H new ATOM 1943 N LYS B 62 3.237 17.765 5.221 1.00 0.00 N ATOM 1944 CA LYS B 62 4.232 16.869 4.664 1.00 0.00 C ATOM 1945 C LYS B 62 3.537 15.614 4.158 1.00 0.00 C ATOM 1946 O LYS B 62 2.690 15.035 4.843 1.00 0.00 O ATOM 1947 CB LYS B 62 5.326 16.533 5.683 1.00 0.00 C ATOM 1948 CG LYS B 62 4.822 16.303 7.094 1.00 0.00 C ATOM 1949 CD LYS B 62 5.947 15.876 8.027 1.00 0.00 C ATOM 1950 CE LYS B 62 6.509 14.512 7.651 1.00 0.00 C ATOM 1951 NZ LYS B 62 7.126 13.826 8.817 1.00 0.00 N ATOM 0 H LYS B 62 3.212 17.801 6.240 1.00 0.00 H new ATOM 0 HA LYS B 62 4.731 17.365 3.831 1.00 0.00 H new ATOM 0 HB2 LYS B 62 5.854 15.640 5.349 1.00 0.00 H new ATOM 0 HB3 LYS B 62 6.053 17.345 5.698 1.00 0.00 H new ATOM 0 HG2 LYS B 62 4.363 17.217 7.471 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.046 15.537 7.084 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.745 16.618 7.997 1.00 0.00 H new ATOM 0 HD3 LYS B 62 5.577 15.846 9.052 1.00 0.00 H new ATOM 0 HE2 LYS B 62 5.711 13.890 7.244 1.00 0.00 H new ATOM 0 HE3 LYS B 62 7.254 14.631 6.864 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 7.970 13.304 8.506 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.398 14.532 9.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 6.441 13.161 9.231 1.00 0.00 H new ATOM 1965 N ILE B 63 3.880 15.214 2.948 1.00 0.00 N ATOM 1966 CA ILE B 63 3.270 14.057 2.317 1.00 0.00 C ATOM 1967 C ILE B 63 3.895 12.778 2.869 1.00 0.00 C ATOM 1968 O ILE B 63 4.832 12.232 2.294 1.00 0.00 O ATOM 1969 CB ILE B 63 3.456 14.147 0.797 1.00 0.00 C ATOM 1970 CG1 ILE B 63 3.044 15.544 0.302 1.00 0.00 C ATOM 1971 CG2 ILE B 63 2.671 13.063 0.080 1.00 0.00 C ATOM 1972 CD1 ILE B 63 1.878 16.174 1.047 1.00 0.00 C ATOM 0 H ILE B 63 4.586 15.679 2.377 1.00 0.00 H new ATOM 0 HA ILE B 63 2.202 14.037 2.536 1.00 0.00 H new ATOM 0 HB ILE B 63 4.510 13.989 0.568 1.00 0.00 H new ATOM 0 HG12 ILE B 63 3.905 16.208 0.378 1.00 0.00 H new ATOM 0 HG13 ILE B 63 2.786 15.477 -0.755 1.00 0.00 H new ATOM 0 HG21 ILE B 63 2.824 13.154 -0.995 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.015 12.084 0.414 1.00 0.00 H new ATOM 0 HG23 ILE B 63 1.610 13.172 0.306 1.00 0.00 H new ATOM 0 HD11 ILE B 63 1.664 17.156 0.624 1.00 0.00 H new ATOM 0 HD12 ILE B 63 0.998 15.538 0.950 1.00 0.00 H new ATOM 0 HD13 ILE B 63 2.135 16.281 2.101 1.00 0.00 H new ATOM 1984 N GLN B 64 3.369 12.305 3.986 1.00 0.00 N ATOM 1985 CA GLN B 64 3.913 11.127 4.651 1.00 0.00 C ATOM 1986 C GLN B 64 3.037 9.878 4.468 1.00 0.00 C ATOM 1987 O GLN B 64 1.814 9.919 4.616 1.00 0.00 O ATOM 1988 CB GLN B 64 4.122 11.445 6.141 1.00 0.00 C ATOM 1989 CG GLN B 64 3.156 12.497 6.671 1.00 0.00 C ATOM 1990 CD GLN B 64 3.449 12.966 8.091 1.00 0.00 C ATOM 1991 OE1 GLN B 64 3.242 14.132 8.412 1.00 0.00 O ATOM 1992 NE2 GLN B 64 3.888 12.071 8.959 1.00 0.00 N ATOM 0 H GLN B 64 2.563 12.718 4.455 1.00 0.00 H new ATOM 0 HA GLN B 64 4.869 10.888 4.185 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.006 10.529 6.721 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.145 11.791 6.292 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.177 13.360 6.005 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.144 12.093 6.637 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.051 11.109 8.661 1.00 0.00 H new ATOM 0 HE22 GLN B 64 4.064 12.342 9.926 1.00 0.00 H new ATOM 2001 N LEU B 65 3.702 8.783 4.116 1.00 0.00 N ATOM 2002 CA LEU B 65 3.085 7.473 3.908 1.00 0.00 C ATOM 2003 C LEU B 65 3.711 6.478 4.884 1.00 0.00 C ATOM 2004 O LEU B 65 4.786 6.736 5.402 1.00 0.00 O ATOM 2005 CB LEU B 65 3.349 6.999 2.478 1.00 0.00 C ATOM 2006 CG LEU B 65 2.706 5.662 2.095 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.323 5.863 1.483 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.624 4.880 1.169 1.00 0.00 C ATOM 0 H LEU B 65 4.710 8.779 3.963 1.00 0.00 H new ATOM 0 HA LEU B 65 2.010 7.543 4.073 1.00 0.00 H new ATOM 0 HB2 LEU B 65 2.992 7.764 1.789 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.426 6.918 2.334 1.00 0.00 H new ATOM 0 HG LEU B 65 2.566 5.076 3.004 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.896 4.894 1.223 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.676 6.364 2.203 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.408 6.475 0.585 1.00 0.00 H new ATOM 0 HD21 LEU B 65 3.154 3.933 0.906 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.806 5.459 0.264 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.571 4.687 1.673 1.00 0.00 H new ATOM 2020 N GLN B 66 3.042 5.365 5.153 1.00 0.00 N ATOM 2021 CA GLN B 66 3.581 4.355 6.058 1.00 0.00 C ATOM 2022 C GLN B 66 3.236 2.947 5.588 1.00 0.00 C ATOM 2023 O GLN B 66 2.141 2.699 5.094 1.00 0.00 O ATOM 2024 CB GLN B 66 3.057 4.561 7.469 1.00 0.00 C ATOM 2025 CG GLN B 66 3.492 3.488 8.460 1.00 0.00 C ATOM 2026 CD GLN B 66 2.926 3.712 9.847 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.902 3.134 10.218 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.593 4.549 10.619 1.00 0.00 N ATOM 0 H GLN B 66 2.129 5.138 4.760 1.00 0.00 H new ATOM 0 HA GLN B 66 4.665 4.466 6.058 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.394 5.532 7.831 1.00 0.00 H new ATOM 0 HB3 GLN B 66 1.968 4.592 7.439 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.174 2.511 8.095 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.580 3.469 8.515 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.436 5.004 10.269 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.266 4.741 11.566 1.00 0.00 H new ATOM 2037 N LEU B 67 4.192 2.044 5.726 1.00 0.00 N ATOM 2038 CA LEU B 67 4.009 0.650 5.361 1.00 0.00 C ATOM 2039 C LEU B 67 3.912 -0.191 6.617 1.00 0.00 C ATOM 2040 O LEU B 67 4.926 -0.521 7.221 1.00 0.00 O ATOM 2041 CB LEU B 67 5.180 0.143 4.526 1.00 0.00 C ATOM 2042 CG LEU B 67 5.321 0.755 3.141 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.515 0.143 2.430 1.00 0.00 C ATOM 2044 CD2 LEU B 67 4.050 0.542 2.336 1.00 0.00 C ATOM 0 H LEU B 67 5.119 2.258 6.095 1.00 0.00 H new ATOM 0 HA LEU B 67 3.094 0.571 4.774 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.102 0.326 5.079 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.083 -0.937 4.417 1.00 0.00 H new ATOM 0 HG LEU B 67 5.483 1.828 3.240 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.613 0.584 1.438 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.420 0.338 3.005 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.370 -0.933 2.336 1.00 0.00 H new ATOM 0 HD21 LEU B 67 4.167 0.986 1.347 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.859 -0.526 2.234 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.211 1.014 2.848 1.00 0.00 H new ATOM 2056 N VAL B 68 2.705 -0.524 7.021 1.00 0.00 N ATOM 2057 CA VAL B 68 2.515 -1.329 8.210 1.00 0.00 C ATOM 2058 C VAL B 68 2.659 -2.793 7.857 1.00 0.00 C ATOM 2059 O VAL B 68 1.742 -3.400 7.315 1.00 0.00 O ATOM 2060 CB VAL B 68 1.142 -1.091 8.853 1.00 0.00 C ATOM 2061 CG1 VAL B 68 1.114 -1.670 10.253 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.824 0.389 8.877 1.00 0.00 C ATOM 0 H VAL B 68 1.844 -0.252 6.547 1.00 0.00 H new ATOM 0 HA VAL B 68 3.276 -1.036 8.933 1.00 0.00 H new ATOM 0 HB VAL B 68 0.380 -1.594 8.258 1.00 0.00 H new ATOM 0 HG11 VAL B 68 0.135 -1.495 10.699 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.306 -2.742 10.207 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.881 -1.190 10.861 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.153 0.544 9.336 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.584 0.915 9.455 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.812 0.775 7.858 1.00 0.00 H new ATOM 2072 N LEU B 69 3.810 -3.353 8.162 1.00 0.00 N ATOM 2073 CA LEU B 69 4.083 -4.739 7.842 1.00 0.00 C ATOM 2074 C LEU B 69 3.560 -5.676 8.922 1.00 0.00 C ATOM 2075 O LEU B 69 3.334 -5.263 10.061 1.00 0.00 O ATOM 2076 CB LEU B 69 5.580 -4.954 7.659 1.00 0.00 C ATOM 2077 CG LEU B 69 6.362 -3.743 7.145 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.844 -3.956 7.342 1.00 0.00 C ATOM 2079 CD2 LEU B 69 6.072 -3.481 5.682 1.00 0.00 C ATOM 0 H LEU B 69 4.574 -2.869 8.633 1.00 0.00 H new ATOM 0 HA LEU B 69 3.565 -4.969 6.911 1.00 0.00 H new ATOM 0 HB2 LEU B 69 6.005 -5.260 8.615 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.728 -5.781 6.965 1.00 0.00 H new ATOM 0 HG LEU B 69 6.042 -2.873 7.718 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.389 -3.087 6.972 1.00 0.00 H new ATOM 0 HD12 LEU B 69 8.054 -4.092 8.403 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.160 -4.843 6.793 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.643 -2.615 5.347 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.357 -4.353 5.093 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.007 -3.287 5.551 1.00 0.00 H new ATOM 2091 N HIS B 70 3.378 -6.937 8.551 1.00 0.00 N ATOM 2092 CA HIS B 70 2.893 -7.962 9.472 1.00 0.00 C ATOM 2093 C HIS B 70 3.974 -8.302 10.485 1.00 0.00 C ATOM 2094 O HIS B 70 3.687 -8.793 11.575 1.00 0.00 O ATOM 2095 CB HIS B 70 2.500 -9.240 8.720 1.00 0.00 C ATOM 2096 CG HIS B 70 1.185 -9.167 8.006 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -0.032 -9.083 8.642 1.00 0.00 N ATOM 2098 CD2 HIS B 70 0.915 -9.163 6.677 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -0.986 -9.019 7.705 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -0.465 -9.068 6.493 1.00 0.00 N ATOM 0 H HIS B 70 3.561 -7.279 7.608 1.00 0.00 H new ATOM 0 HA HIS B 70 2.014 -7.565 9.979 1.00 0.00 H new ATOM 0 HB2 HIS B 70 3.279 -9.473 7.994 1.00 0.00 H new ATOM 0 HB3 HIS B 70 2.468 -10.067 9.429 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -0.181 -9.071 9.651 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.650 -9.224 5.888 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.043 -8.938 7.913 1.00 0.00 H new ATOM 2108 N ALA B 71 5.221 -8.056 10.097 1.00 0.00 N ATOM 2109 CA ALA B 71 6.364 -8.328 10.954 1.00 0.00 C ATOM 2110 C ALA B 71 6.312 -7.519 12.243 1.00 0.00 C ATOM 2111 O ALA B 71 6.802 -7.961 13.281 1.00 0.00 O ATOM 2112 CB ALA B 71 7.659 -8.047 10.208 1.00 0.00 C ATOM 0 H ALA B 71 5.464 -7.666 9.187 1.00 0.00 H new ATOM 0 HA ALA B 71 6.327 -9.383 11.227 1.00 0.00 H new ATOM 0 HB1 ALA B 71 8.507 -8.254 10.860 1.00 0.00 H new ATOM 0 HB2 ALA B 71 7.716 -8.684 9.325 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.683 -7.001 9.903 1.00 0.00 H new ATOM 2118 N GLY B 72 5.719 -6.335 12.179 1.00 0.00 N ATOM 2119 CA GLY B 72 5.638 -5.498 13.351 1.00 0.00 C ATOM 2120 C GLY B 72 6.522 -4.304 13.165 1.00 0.00 C ATOM 2121 O GLY B 72 7.131 -3.797 14.105 1.00 0.00 O ATOM 0 H GLY B 72 5.295 -5.943 11.338 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.608 -5.181 13.516 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.944 -6.058 14.235 1.00 0.00 H new ATOM 2125 N ASP B 73 6.572 -3.862 11.924 1.00 0.00 N ATOM 2126 CA ASP B 73 7.379 -2.748 11.525 1.00 0.00 C ATOM 2127 C ASP B 73 6.534 -1.885 10.636 1.00 0.00 C ATOM 2128 O ASP B 73 5.578 -2.367 10.020 1.00 0.00 O ATOM 2129 CB ASP B 73 8.623 -3.212 10.763 1.00 0.00 C ATOM 2130 CG ASP B 73 9.592 -2.077 10.491 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.535 -1.060 11.216 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.403 -2.200 9.552 1.00 0.00 O ATOM 0 H ASP B 73 6.041 -4.280 11.160 1.00 0.00 H new ATOM 0 HA ASP B 73 7.719 -2.201 12.404 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.129 -3.988 11.337 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.320 -3.662 9.817 1.00 0.00 H new ATOM 2137 N THR B 74 6.858 -0.632 10.572 1.00 0.00 N ATOM 2138 CA THR B 74 6.111 0.281 9.756 1.00 0.00 C ATOM 2139 C THR B 74 7.072 1.260 9.072 1.00 0.00 C ATOM 2140 O THR B 74 7.774 2.019 9.742 1.00 0.00 O ATOM 2141 CB THR B 74 5.086 1.039 10.610 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.707 1.549 11.797 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.918 0.143 10.990 1.00 0.00 C ATOM 0 H THR B 74 7.639 -0.213 11.077 1.00 0.00 H new ATOM 0 HA THR B 74 5.571 -0.277 8.991 1.00 0.00 H new ATOM 0 HB THR B 74 4.706 1.869 10.015 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.647 1.754 11.612 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.208 0.707 11.595 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.423 -0.212 10.086 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.284 -0.710 11.562 1.00 0.00 H new ATOM 2151 N THR B 75 7.090 1.248 7.748 1.00 0.00 N ATOM 2152 CA THR B 75 7.986 2.108 6.978 1.00 0.00 C ATOM 2153 C THR B 75 7.315 3.410 6.550 1.00 0.00 C ATOM 2154 O THR B 75 6.435 3.400 5.696 1.00 0.00 O ATOM 2155 CB THR B 75 8.454 1.373 5.714 1.00 0.00 C ATOM 2156 OG1 THR B 75 8.442 -0.041 5.947 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.844 1.826 5.301 1.00 0.00 C ATOM 0 H THR B 75 6.492 0.650 7.178 1.00 0.00 H new ATOM 0 HA THR B 75 8.828 2.349 7.627 1.00 0.00 H new ATOM 0 HB THR B 75 7.769 1.612 4.901 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.322 -0.415 5.733 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.150 1.289 4.403 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.832 2.897 5.097 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.549 1.618 6.106 1.00 0.00 H new ATOM 2165 N ASN B 76 7.738 4.531 7.115 1.00 0.00 N ATOM 2166 CA ASN B 76 7.145 5.812 6.748 1.00 0.00 C ATOM 2167 C ASN B 76 7.979 6.483 5.655 1.00 0.00 C ATOM 2168 O ASN B 76 9.204 6.539 5.738 1.00 0.00 O ATOM 2169 CB ASN B 76 6.989 6.759 7.953 1.00 0.00 C ATOM 2170 CG ASN B 76 6.706 6.052 9.270 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.067 5.004 9.309 1.00 0.00 O ATOM 2172 ND2 ASN B 76 7.175 6.636 10.365 1.00 0.00 N ATOM 0 H ASN B 76 8.476 4.583 7.817 1.00 0.00 H new ATOM 0 HA ASN B 76 6.143 5.606 6.372 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.900 7.348 8.058 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.179 7.459 7.748 1.00 0.00 H new ATOM 0 HD21 ASN B 76 7.009 6.215 11.279 1.00 0.00 H new ATOM 0 HD22 ASN B 76 7.702 7.506 10.293 1.00 0.00 H new ATOM 2179 N PHE B 77 7.297 6.969 4.625 1.00 0.00 N ATOM 2180 CA PHE B 77 7.940 7.634 3.496 1.00 0.00 C ATOM 2181 C PHE B 77 7.406 9.053 3.344 1.00 0.00 C ATOM 2182 O PHE B 77 6.196 9.262 3.322 1.00 0.00 O ATOM 2183 CB PHE B 77 7.688 6.855 2.203 1.00 0.00 C ATOM 2184 CG PHE B 77 8.386 5.526 2.145 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.766 5.455 2.213 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.664 4.351 2.018 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.414 4.237 2.156 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.308 3.131 1.960 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.685 3.073 2.029 1.00 0.00 C ATOM 0 H PHE B 77 6.281 6.914 4.548 1.00 0.00 H new ATOM 0 HA PHE B 77 9.012 7.671 3.688 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.616 6.696 2.090 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.011 7.461 1.357 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.343 6.363 2.312 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.586 4.389 1.964 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.492 4.196 2.211 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.734 2.222 1.861 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.190 2.119 1.984 1.00 0.00 H new ATOM 2199 N HIS B 78 8.300 10.020 3.233 1.00 0.00 N ATOM 2200 CA HIS B 78 7.906 11.413 3.088 1.00 0.00 C ATOM 2201 C HIS B 78 8.145 11.900 1.658 1.00 0.00 C ATOM 2202 O HIS B 78 9.280 12.123 1.243 1.00 0.00 O ATOM 2203 CB HIS B 78 8.680 12.274 4.094 1.00 0.00 C ATOM 2204 CG HIS B 78 8.408 13.746 3.998 1.00 0.00 C ATOM 2205 ND1 HIS B 78 9.281 14.709 4.449 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.351 14.416 3.472 1.00 0.00 C ATOM 2207 CE1 HIS B 78 8.745 15.906 4.187 1.00 0.00 C ATOM 2208 NE2 HIS B 78 7.574 15.785 3.594 1.00 0.00 N ATOM 0 H HIS B 78 9.308 9.866 3.240 1.00 0.00 H new ATOM 0 HA HIS B 78 6.839 11.502 3.293 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.437 11.938 5.102 1.00 0.00 H new ATOM 0 HB3 HIS B 78 9.747 12.105 3.951 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.477 13.960 3.030 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.211 16.849 4.430 1.00 0.00 H new ATOM 0 HE2 HIS B 78 6.958 16.538 3.288 1.00 0.00 H new ATOM 2216 N PHE B 79 7.068 12.064 0.913 1.00 0.00 N ATOM 2217 CA PHE B 79 7.143 12.537 -0.459 1.00 0.00 C ATOM 2218 C PHE B 79 7.207 14.058 -0.454 1.00 0.00 C ATOM 2219 O PHE B 79 6.355 14.723 0.131 1.00 0.00 O ATOM 2220 CB PHE B 79 5.941 12.043 -1.265 1.00 0.00 C ATOM 2221 CG PHE B 79 5.811 10.544 -1.283 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.298 9.864 -0.191 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.204 9.819 -2.394 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.180 8.489 -0.208 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.087 8.443 -2.416 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.574 7.778 -1.323 1.00 0.00 C ATOM 0 H PHE B 79 6.120 11.874 1.239 1.00 0.00 H new ATOM 0 HA PHE B 79 8.041 12.141 -0.933 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.031 12.475 -0.848 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.026 12.406 -2.289 1.00 0.00 H new ATOM 0 HD1 PHE B 79 4.987 10.416 0.684 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.607 10.335 -3.253 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.780 7.970 0.650 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.397 7.888 -3.289 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.481 6.702 -1.339 1.00 0.00 H new ATOM 2236 N SER B 80 8.225 14.605 -1.086 1.00 0.00 N ATOM 2237 CA SER B 80 8.415 16.046 -1.105 1.00 0.00 C ATOM 2238 C SER B 80 8.490 16.631 -2.517 1.00 0.00 C ATOM 2239 O SER B 80 9.159 17.643 -2.728 1.00 0.00 O ATOM 2240 CB SER B 80 9.686 16.400 -0.332 1.00 0.00 C ATOM 2241 OG SER B 80 9.729 15.714 0.909 1.00 0.00 O ATOM 0 H SER B 80 8.935 14.077 -1.594 1.00 0.00 H new ATOM 0 HA SER B 80 7.538 16.488 -0.632 1.00 0.00 H new ATOM 0 HB2 SER B 80 10.562 16.141 -0.926 1.00 0.00 H new ATOM 0 HB3 SER B 80 9.724 17.476 -0.160 1.00 0.00 H new ATOM 0 HG SER B 80 8.952 15.967 1.450 1.00 0.00 H new ATOM 2247 N ASN B 81 7.826 16.016 -3.490 1.00 0.00 N ATOM 2248 CA ASN B 81 7.841 16.564 -4.832 1.00 0.00 C ATOM 2249 C ASN B 81 6.838 17.701 -4.887 1.00 0.00 C ATOM 2250 O ASN B 81 5.642 17.467 -4.871 1.00 0.00 O ATOM 2251 CB ASN B 81 7.484 15.496 -5.860 1.00 0.00 C ATOM 2252 CG ASN B 81 8.219 15.671 -7.174 1.00 0.00 C ATOM 2253 OD1 ASN B 81 8.660 16.765 -7.518 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.354 14.588 -7.918 1.00 0.00 N ATOM 0 H ASN B 81 7.285 15.159 -3.376 1.00 0.00 H new ATOM 0 HA ASN B 81 8.841 16.927 -5.070 1.00 0.00 H new ATOM 0 HB2 ASN B 81 7.714 14.513 -5.449 1.00 0.00 H new ATOM 0 HB3 ASN B 81 6.410 15.521 -6.044 1.00 0.00 H new ATOM 0 HD21 ASN B 81 8.839 14.642 -8.814 1.00 0.00 H new ATOM 0 HD22 ASN B 81 7.973 13.698 -7.597 1.00 0.00 H new ATOM 2261 N GLU B 82 7.316 18.929 -4.937 1.00 0.00 N ATOM 2262 CA GLU B 82 6.434 20.096 -4.964 1.00 0.00 C ATOM 2263 C GLU B 82 5.341 19.974 -6.035 1.00 0.00 C ATOM 2264 O GLU B 82 4.268 20.563 -5.912 1.00 0.00 O ATOM 2265 CB GLU B 82 7.251 21.382 -5.172 1.00 0.00 C ATOM 2266 CG GLU B 82 7.873 21.526 -6.559 1.00 0.00 C ATOM 2267 CD GLU B 82 8.809 20.387 -6.913 1.00 0.00 C ATOM 2268 OE1 GLU B 82 9.825 20.196 -6.207 1.00 0.00 O ATOM 2269 OE2 GLU B 82 8.519 19.654 -7.879 1.00 0.00 O ATOM 0 H GLU B 82 8.311 19.152 -4.960 1.00 0.00 H new ATOM 0 HA GLU B 82 5.933 20.144 -3.997 1.00 0.00 H new ATOM 0 HB2 GLU B 82 6.605 22.240 -4.988 1.00 0.00 H new ATOM 0 HB3 GLU B 82 8.046 21.416 -4.427 1.00 0.00 H new ATOM 0 HG2 GLU B 82 7.078 21.580 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU B 82 8.421 22.467 -6.609 1.00 0.00 H new ATOM 2276 N SER B 83 5.608 19.185 -7.065 1.00 0.00 N ATOM 2277 CA SER B 83 4.656 18.995 -8.141 1.00 0.00 C ATOM 2278 C SER B 83 3.711 17.801 -7.906 1.00 0.00 C ATOM 2279 O SER B 83 2.510 17.889 -8.193 1.00 0.00 O ATOM 2280 CB SER B 83 5.413 18.809 -9.457 1.00 0.00 C ATOM 2281 OG SER B 83 6.398 19.818 -9.626 1.00 0.00 O ATOM 0 H SER B 83 6.479 18.666 -7.175 1.00 0.00 H new ATOM 0 HA SER B 83 4.029 19.886 -8.181 1.00 0.00 H new ATOM 0 HB2 SER B 83 5.887 17.827 -9.472 1.00 0.00 H new ATOM 0 HB3 SER B 83 4.712 18.837 -10.291 1.00 0.00 H new ATOM 0 HG SER B 83 7.178 19.610 -9.071 1.00 0.00 H new ATOM 2287 N THR B 84 4.222 16.692 -7.373 1.00 0.00 N ATOM 2288 CA THR B 84 3.389 15.500 -7.194 1.00 0.00 C ATOM 2289 C THR B 84 3.383 14.899 -5.794 1.00 0.00 C ATOM 2290 O THR B 84 2.773 13.856 -5.613 1.00 0.00 O ATOM 2291 CB THR B 84 3.859 14.398 -8.141 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.282 14.480 -8.305 1.00 0.00 O ATOM 2293 CG2 THR B 84 3.195 14.525 -9.486 1.00 0.00 C ATOM 0 H THR B 84 5.188 16.592 -7.063 1.00 0.00 H new ATOM 0 HA THR B 84 2.378 15.851 -7.399 1.00 0.00 H new ATOM 0 HB THR B 84 3.588 13.435 -7.708 1.00 0.00 H new ATOM 0 HG1 THR B 84 5.583 13.771 -8.911 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.547 13.729 -10.142 1.00 0.00 H new ATOM 0 HG22 THR B 84 2.114 14.447 -9.367 1.00 0.00 H new ATOM 0 HG23 THR B 84 3.443 15.492 -9.924 1.00 0.00 H new ATOM 2301 N ALA B 85 3.996 15.566 -4.828 1.00 0.00 N ATOM 2302 CA ALA B 85 4.128 15.072 -3.448 1.00 0.00 C ATOM 2303 C ALA B 85 2.952 14.195 -3.006 1.00 0.00 C ATOM 2304 O ALA B 85 3.082 12.975 -2.887 1.00 0.00 O ATOM 2305 CB ALA B 85 4.308 16.257 -2.512 1.00 0.00 C ATOM 0 H ALA B 85 4.425 16.480 -4.973 1.00 0.00 H new ATOM 0 HA ALA B 85 5.006 14.427 -3.408 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.407 15.899 -1.487 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.206 16.809 -2.792 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.441 16.914 -2.585 1.00 0.00 H new ATOM 2311 N VAL B 86 1.811 14.823 -2.781 1.00 0.00 N ATOM 2312 CA VAL B 86 0.585 14.128 -2.380 1.00 0.00 C ATOM 2313 C VAL B 86 0.214 12.994 -3.334 1.00 0.00 C ATOM 2314 O VAL B 86 -0.002 11.862 -2.903 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.564 15.149 -2.294 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.900 14.526 -2.669 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.653 15.742 -0.903 1.00 0.00 C ATOM 0 H VAL B 86 1.701 15.833 -2.870 1.00 0.00 H new ATOM 0 HA VAL B 86 0.761 13.671 -1.406 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.342 15.941 -3.010 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.685 15.278 -2.596 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.852 14.150 -3.691 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -2.121 13.703 -1.989 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.472 16.461 -0.866 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.834 14.947 -0.180 1.00 0.00 H new ATOM 0 HG23 VAL B 86 0.283 16.246 -0.662 1.00 0.00 H new ATOM 2327 N LYS B 87 0.174 13.302 -4.623 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.197 12.325 -5.642 1.00 0.00 C ATOM 2329 C LYS B 87 0.733 11.120 -5.612 1.00 0.00 C ATOM 2330 O LYS B 87 0.306 10.014 -5.885 1.00 0.00 O ATOM 2331 CB LYS B 87 -0.166 12.972 -7.034 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.687 14.404 -7.069 1.00 0.00 C ATOM 2333 CD LYS B 87 -0.463 15.042 -8.434 1.00 0.00 C ATOM 2334 CE LYS B 87 -1.004 16.466 -8.492 1.00 0.00 C ATOM 2335 NZ LYS B 87 -0.127 17.439 -7.779 1.00 0.00 N ATOM 0 H LYS B 87 0.395 14.227 -4.991 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.209 11.983 -5.426 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.859 12.961 -7.405 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.759 12.365 -7.718 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.751 14.412 -6.832 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -0.185 14.995 -6.303 1.00 0.00 H new ATOM 0 HD2 LYS B 87 0.603 15.049 -8.661 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.948 14.438 -9.201 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -1.107 16.770 -9.534 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -2.001 16.491 -8.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.502 18.401 -7.905 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -0.103 17.207 -6.766 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 0.836 17.389 -8.169 1.00 0.00 H new ATOM 2349 N GLU B 88 1.996 11.338 -5.278 1.00 0.00 N ATOM 2350 CA GLU B 88 2.966 10.255 -5.209 1.00 0.00 C ATOM 2351 C GLU B 88 2.642 9.333 -4.045 1.00 0.00 C ATOM 2352 O GLU B 88 2.550 8.117 -4.216 1.00 0.00 O ATOM 2353 CB GLU B 88 4.372 10.819 -5.067 1.00 0.00 C ATOM 2354 CG GLU B 88 4.812 11.618 -6.273 1.00 0.00 C ATOM 2355 CD GLU B 88 6.062 12.424 -6.015 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.272 12.854 -4.861 1.00 0.00 O ATOM 2357 OE2 GLU B 88 6.824 12.651 -6.978 1.00 0.00 O ATOM 0 H GLU B 88 2.374 12.257 -5.050 1.00 0.00 H new ATOM 0 HA GLU B 88 2.915 9.677 -6.132 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.415 11.454 -4.182 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.072 9.999 -4.906 1.00 0.00 H new ATOM 0 HG2 GLU B 88 4.988 10.940 -7.108 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.007 12.290 -6.572 1.00 0.00 H new ATOM 2364 N ARG B 89 2.465 9.921 -2.865 1.00 0.00 N ATOM 2365 CA ARG B 89 2.112 9.157 -1.673 1.00 0.00 C ATOM 2366 C ARG B 89 0.834 8.395 -1.934 1.00 0.00 C ATOM 2367 O ARG B 89 0.731 7.202 -1.663 1.00 0.00 O ATOM 2368 CB ARG B 89 1.905 10.094 -0.482 1.00 0.00 C ATOM 2369 CG ARG B 89 1.027 9.524 0.626 1.00 0.00 C ATOM 2370 CD ARG B 89 0.288 10.624 1.377 1.00 0.00 C ATOM 2371 NE ARG B 89 -0.832 11.173 0.606 1.00 0.00 N ATOM 2372 CZ ARG B 89 -1.391 12.365 0.840 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -0.921 13.156 1.793 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -2.421 12.775 0.121 1.00 0.00 N ATOM 0 H ARG B 89 2.560 10.924 -2.709 1.00 0.00 H new ATOM 0 HA ARG B 89 2.922 8.465 -1.442 1.00 0.00 H new ATOM 0 HB2 ARG B 89 2.878 10.348 -0.062 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.460 11.023 -0.840 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.306 8.827 0.198 1.00 0.00 H new ATOM 0 HG3 ARG B 89 1.643 8.957 1.324 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -0.085 10.228 2.322 1.00 0.00 H new ATOM 0 HD3 ARG B 89 0.985 11.426 1.620 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.208 10.610 -0.157 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -0.125 12.858 2.357 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -1.355 14.063 1.963 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.795 12.181 -0.619 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -2.842 13.686 0.306 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.127 9.112 -2.481 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.420 8.556 -2.799 1.00 0.00 C ATOM 2390 C ASP B 90 -1.339 7.485 -3.865 1.00 0.00 C ATOM 2391 O ASP B 90 -1.993 6.458 -3.762 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.375 9.666 -3.223 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.155 10.188 -2.045 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.636 9.354 -1.246 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -3.272 11.414 -1.901 1.00 0.00 O ATOM 0 H ASP B 90 -0.029 10.100 -2.717 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.802 8.076 -1.898 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.812 10.480 -3.680 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.062 9.289 -3.980 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.502 7.709 -4.850 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.345 6.763 -5.959 1.00 0.00 C ATOM 2402 C ALA B 91 0.281 5.480 -5.479 1.00 0.00 C ATOM 2403 O ALA B 91 -0.200 4.383 -5.762 1.00 0.00 O ATOM 2404 CB ALA B 91 0.526 7.353 -7.046 1.00 0.00 C ATOM 0 H ALA B 91 0.089 8.538 -4.917 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.338 6.557 -6.359 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.630 6.635 -7.859 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.067 8.266 -7.425 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.510 7.584 -6.638 1.00 0.00 H new ATOM 2410 N VAL B 92 1.376 5.644 -4.770 1.00 0.00 N ATOM 2411 CA VAL B 92 2.101 4.536 -4.204 1.00 0.00 C ATOM 2412 C VAL B 92 1.161 3.736 -3.322 1.00 0.00 C ATOM 2413 O VAL B 92 1.066 2.520 -3.432 1.00 0.00 O ATOM 2414 CB VAL B 92 3.285 5.083 -3.395 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.683 4.153 -2.270 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.464 5.348 -4.303 1.00 0.00 C ATOM 0 H VAL B 92 1.788 6.556 -4.571 1.00 0.00 H new ATOM 0 HA VAL B 92 2.485 3.882 -4.986 1.00 0.00 H new ATOM 0 HB VAL B 92 2.965 6.021 -2.942 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.524 4.581 -1.725 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.840 4.021 -1.591 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.971 3.186 -2.682 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.296 5.736 -3.715 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.765 4.420 -4.789 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.183 6.080 -5.060 1.00 0.00 H new ATOM 2426 N LYS B 93 0.434 4.467 -2.496 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.544 3.906 -1.585 1.00 0.00 C ATOM 2428 C LYS B 93 -1.626 3.182 -2.353 1.00 0.00 C ATOM 2429 O LYS B 93 -2.030 2.087 -1.983 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.173 5.050 -0.808 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.353 4.652 0.040 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.100 5.879 0.507 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.278 6.213 -0.386 1.00 0.00 C ATOM 2434 NZ LYS B 93 -3.873 6.731 -1.720 1.00 0.00 N ATOM 0 H LYS B 93 0.509 5.483 -2.440 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.056 3.198 -0.915 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.414 5.498 -0.166 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.490 5.820 -1.511 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.020 4.008 -0.533 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.013 4.075 0.900 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.453 5.720 1.526 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.417 6.728 0.535 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -4.889 5.320 -0.520 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -4.903 6.955 0.110 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.583 6.457 -2.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.803 7.768 -1.683 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -2.950 6.331 -1.982 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.095 3.809 -3.416 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.134 3.219 -4.230 1.00 0.00 C ATOM 2450 C ASP B 94 -2.695 1.859 -4.740 1.00 0.00 C ATOM 2451 O ASP B 94 -3.386 0.859 -4.547 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.504 4.120 -5.400 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.651 5.053 -5.055 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.733 5.499 -3.884 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -5.483 5.321 -5.942 1.00 0.00 O ATOM 0 H ASP B 94 -1.772 4.723 -3.733 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.018 3.099 -3.604 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.634 4.707 -5.695 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.780 3.506 -6.258 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.524 1.836 -5.372 1.00 0.00 N ATOM 2461 CA LEU B 95 -0.956 0.604 -5.901 1.00 0.00 C ATOM 2462 C LEU B 95 -0.740 -0.389 -4.768 1.00 0.00 C ATOM 2463 O LEU B 95 -1.114 -1.557 -4.869 1.00 0.00 O ATOM 2464 CB LEU B 95 0.360 0.899 -6.633 1.00 0.00 C ATOM 2465 CG LEU B 95 0.327 0.691 -8.157 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.058 0.983 -8.717 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.357 1.584 -8.831 1.00 0.00 C ATOM 0 H LEU B 95 -0.949 2.663 -5.530 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.649 0.165 -6.618 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.646 1.931 -6.430 1.00 0.00 H new ATOM 0 HB3 LEU B 95 1.140 0.264 -6.213 1.00 0.00 H new ATOM 0 HG LEU B 95 0.568 -0.352 -8.362 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.054 0.828 -9.796 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -1.785 0.314 -8.257 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.328 2.016 -8.499 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.324 1.428 -9.909 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.135 2.628 -8.609 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.351 1.337 -8.459 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.166 0.107 -3.682 1.00 0.00 N ATOM 2480 CA LEU B 96 0.100 -0.691 -2.496 1.00 0.00 C ATOM 2481 C LEU B 96 -1.170 -1.381 -2.011 1.00 0.00 C ATOM 2482 O LEU B 96 -1.281 -2.605 -2.066 1.00 0.00 O ATOM 2483 CB LEU B 96 0.655 0.223 -1.403 1.00 0.00 C ATOM 2484 CG LEU B 96 2.138 0.542 -1.531 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.525 1.633 -0.550 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.979 -0.705 -1.319 1.00 0.00 C ATOM 0 H LEU B 96 0.130 1.080 -3.599 1.00 0.00 H new ATOM 0 HA LEU B 96 0.828 -1.465 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU B 96 0.094 1.158 -1.411 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.480 -0.245 -0.434 1.00 0.00 H new ATOM 0 HG LEU B 96 2.330 0.904 -2.541 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.588 1.853 -0.651 1.00 0.00 H new ATOM 0 HD12 LEU B 96 1.947 2.533 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.319 1.298 0.467 1.00 0.00 H new ATOM 0 HD21 LEU B 96 4.035 -0.452 -1.415 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.791 -1.106 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.715 -1.453 -2.067 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.123 -0.571 -1.569 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.413 -1.037 -1.069 1.00 0.00 C ATOM 2500 C GLN B 97 -4.075 -2.060 -2.003 1.00 0.00 C ATOM 2501 O GLN B 97 -4.533 -3.108 -1.563 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.314 0.180 -0.847 1.00 0.00 C ATOM 2503 CG GLN B 97 -5.791 -0.055 -1.076 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.566 1.245 -1.128 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.087 1.718 -0.120 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -6.628 1.843 -2.304 1.00 0.00 N ATOM 0 H GLN B 97 -2.022 0.444 -1.547 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.254 -1.561 -0.127 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.174 0.533 0.175 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -3.984 0.981 -1.509 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -5.932 -0.600 -2.010 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.187 -0.683 -0.278 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -6.182 1.417 -3.117 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.122 2.730 -2.399 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.074 -1.764 -3.295 1.00 0.00 N ATOM 2516 CA GLN B 98 -4.709 -2.627 -4.293 1.00 0.00 C ATOM 2517 C GLN B 98 -3.997 -3.964 -4.493 1.00 0.00 C ATOM 2518 O GLN B 98 -4.646 -5.002 -4.668 1.00 0.00 O ATOM 2519 CB GLN B 98 -4.773 -1.903 -5.634 1.00 0.00 C ATOM 2520 CG GLN B 98 -5.744 -0.735 -5.660 1.00 0.00 C ATOM 2521 CD GLN B 98 -5.599 0.108 -6.911 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -5.273 -0.402 -7.982 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -5.831 1.405 -6.784 1.00 0.00 N ATOM 0 H GLN B 98 -3.638 -0.927 -3.683 1.00 0.00 H new ATOM 0 HA GLN B 98 -5.706 -2.847 -3.911 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -3.777 -1.540 -5.887 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.058 -2.616 -6.407 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -6.764 -1.113 -5.596 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -5.580 -0.110 -4.782 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -6.099 1.789 -5.878 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -5.741 2.021 -7.592 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.674 -3.946 -4.480 1.00 0.00 N ATOM 2533 CA LEU B 99 -1.887 -5.152 -4.719 1.00 0.00 C ATOM 2534 C LEU B 99 -1.696 -6.004 -3.469 1.00 0.00 C ATOM 2535 O LEU B 99 -1.675 -7.232 -3.555 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.522 -4.770 -5.280 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.542 -4.135 -6.668 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.630 -3.184 -6.828 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.506 -5.208 -7.743 1.00 0.00 C ATOM 0 H LEU B 99 -2.118 -3.109 -4.306 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.447 -5.754 -5.435 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.044 -4.076 -4.588 1.00 0.00 H new ATOM 0 HB3 LEU B 99 0.101 -5.664 -5.316 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.467 -3.568 -6.778 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.604 -2.738 -7.822 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.566 -2.398 -6.076 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.563 -3.732 -6.701 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.521 -4.738 -8.727 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.404 -5.799 -7.637 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.375 -5.858 -7.638 1.00 0.00 H new ATOM 2551 N LEU B 100 -1.580 -5.342 -2.328 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.345 -5.989 -1.031 1.00 0.00 C ATOM 2553 C LEU B 100 -2.066 -7.327 -0.818 1.00 0.00 C ATOM 2554 O LEU B 100 -1.405 -8.341 -0.593 1.00 0.00 O ATOM 2555 CB LEU B 100 -1.718 -5.040 0.093 1.00 0.00 C ATOM 2556 CG LEU B 100 -0.652 -4.026 0.439 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.174 -3.084 1.514 1.00 0.00 C ATOM 2558 CD2 LEU B 100 0.623 -4.744 0.868 1.00 0.00 C ATOM 0 H LEU B 100 -1.646 -4.326 -2.268 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.281 -6.225 -1.026 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.629 -4.510 -0.184 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -1.948 -5.625 0.984 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.407 -3.423 -0.436 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.404 -2.353 1.763 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.060 -2.567 1.146 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -1.432 -3.656 2.405 1.00 0.00 H new ATOM 0 HD21 LEU B 100 1.389 -4.009 1.116 1.00 0.00 H new ATOM 0 HD22 LEU B 100 0.416 -5.362 1.742 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.977 -5.375 0.053 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.414 -7.379 -0.910 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.170 -8.615 -0.658 1.00 0.00 C ATOM 2572 C PRO B 101 -3.790 -9.771 -1.580 1.00 0.00 C ATOM 2573 O PRO B 101 -4.121 -10.918 -1.304 1.00 0.00 O ATOM 2574 CB PRO B 101 -5.630 -8.207 -0.898 1.00 0.00 C ATOM 2575 CG PRO B 101 -5.551 -6.977 -1.732 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.311 -6.268 -1.280 1.00 0.00 C ATOM 0 HA PRO B 101 -3.967 -8.991 0.345 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.182 -8.996 -1.409 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.146 -8.014 0.042 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -5.498 -7.224 -2.792 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.433 -6.352 -1.594 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -3.886 -5.652 -2.072 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.508 -5.609 -0.435 1.00 0.00 H new ATOM 2584 N LYS B 102 -3.087 -9.476 -2.662 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.698 -10.509 -3.610 1.00 0.00 C ATOM 2586 C LYS B 102 -1.277 -11.002 -3.363 1.00 0.00 C ATOM 2587 O LYS B 102 -0.853 -12.005 -3.940 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.838 -9.994 -5.041 1.00 0.00 C ATOM 2589 CG LYS B 102 -4.263 -10.061 -5.570 1.00 0.00 C ATOM 2590 CD LYS B 102 -4.425 -9.256 -6.850 1.00 0.00 C ATOM 2591 CE LYS B 102 -4.394 -7.761 -6.576 1.00 0.00 C ATOM 2592 NZ LYS B 102 -5.503 -7.338 -5.678 1.00 0.00 N ATOM 0 H LYS B 102 -2.775 -8.536 -2.905 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.369 -11.356 -3.466 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -2.491 -8.962 -5.083 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -2.188 -10.576 -5.694 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -4.534 -11.100 -5.757 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -4.951 -9.684 -4.813 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -3.629 -9.516 -7.548 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -5.368 -9.519 -7.330 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -3.439 -7.495 -6.123 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -4.463 -7.218 -7.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -5.498 -6.302 -5.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -6.412 -7.644 -6.081 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -5.376 -7.771 -4.741 1.00 0.00 H new ATOM 2606 N PHE B 103 -0.539 -10.319 -2.497 1.00 0.00 N ATOM 2607 CA PHE B 103 0.824 -10.716 -2.218 1.00 0.00 C ATOM 2608 C PHE B 103 0.982 -11.099 -0.770 1.00 0.00 C ATOM 2609 O PHE B 103 1.732 -12.013 -0.461 1.00 0.00 O ATOM 2610 CB PHE B 103 1.813 -9.616 -2.593 1.00 0.00 C ATOM 2611 CG PHE B 103 1.697 -9.178 -4.027 1.00 0.00 C ATOM 2612 CD1 PHE B 103 1.668 -10.113 -5.049 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.614 -7.836 -4.354 1.00 0.00 C ATOM 2614 CE1 PHE B 103 1.560 -9.719 -6.367 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.506 -7.436 -5.670 1.00 0.00 C ATOM 2616 CZ PHE B 103 1.478 -8.378 -6.678 1.00 0.00 C ATOM 0 H PHE B 103 -0.861 -9.498 -1.984 1.00 0.00 H new ATOM 0 HA PHE B 103 1.046 -11.588 -2.833 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.653 -8.756 -1.943 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.827 -9.970 -2.409 1.00 0.00 H new ATOM 0 HD1 PHE B 103 1.731 -11.165 -4.811 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.634 -7.093 -3.570 1.00 0.00 H new ATOM 0 HE1 PHE B 103 1.540 -10.459 -7.153 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.443 -6.385 -5.911 1.00 0.00 H new ATOM 0 HZ PHE B 103 1.392 -8.066 -7.708 1.00 0.00 H new ATOM 2626 N LYS B 104 0.264 -10.417 0.111 1.00 0.00 N ATOM 2627 CA LYS B 104 0.349 -10.702 1.533 1.00 0.00 C ATOM 2628 C LYS B 104 0.039 -12.172 1.810 1.00 0.00 C ATOM 2629 O LYS B 104 -0.988 -12.708 1.383 1.00 0.00 O ATOM 2630 CB LYS B 104 -0.576 -9.782 2.334 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.029 -10.197 2.304 1.00 0.00 C ATOM 2632 CD LYS B 104 -2.740 -9.787 3.573 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.417 -8.443 3.420 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.397 -8.195 4.507 1.00 0.00 N ATOM 0 H LYS B 104 -0.381 -9.666 -0.134 1.00 0.00 H new ATOM 0 HA LYS B 104 1.371 -10.507 1.857 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -0.237 -9.755 3.370 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -0.490 -8.768 1.944 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -2.522 -9.743 1.445 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -2.099 -11.277 2.177 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -3.482 -10.541 3.836 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -2.025 -9.744 4.394 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -2.665 -7.654 3.421 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -3.924 -8.398 2.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -5.288 -7.847 4.099 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -4.575 -9.081 5.022 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -4.015 -7.484 5.163 1.00 0.00 H new