USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=39 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 81 ASN : amide:sc= 0.649 K(o=1.4,f=-5!) USER MOD Set 1.2: B 84 THR OG1 : rot 121:sc= 0.765 USER MOD Set 2.1: B 78 HIS : no HD1:sc= -3.53! C(o=-3.5!,f=-4.6!) USER MOD Set 2.2: B 80 SER OG : rot -48:sc= 0.0676 USER MOD Set 3.1: B 45 HIS : no HE2:sc= -0.0575 K(o=1.2,f=-3.7) USER MOD Set 3.2: B 75 THR OG1 : rot 151:sc= 1.29 USER MOD Set 4.1: B 54 LYS NZ :NH3+ 159:sc= 0.781 (180deg=-0.412) USER MOD Set 4.2: B 66 GLN : amide:sc= -0.601! C(o=-2.9!,f=-21!) USER MOD Set 4.3: B 76 ASN : amide:sc= -3.12! C(o=-2.9!,f=-17!) USER MOD Set 5.1: B 51 LYS NZ :NH3+ -161:sc= 2.4 (180deg=0.695) USER MOD Set 5.2: B 52 CYS SG : rot 25:sc= 1.57 USER MOD Set 6.1: B 13 LYS NZ :NH3+ 171:sc= 1.11 (180deg=1.01) USER MOD Set 6.2: B 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 397 MET CE :methyl -128:sc= 0 (180deg=-1.35) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 TYR OH : rot 165:sc= -0.0892 USER MOD Single : A 406 SER OG : rot 93:sc= 1.24 USER MOD Single : A 409 SER OG : rot -82:sc= 1.2 USER MOD Single : A 410 GLN : amide:sc= -0.94 K(o=-0.94,f=-0.37) USER MOD Single : A 417 GLN : amide:sc= -0.0592 X(o=-0.059,f=-0.15) USER MOD Single : A 418 MET CE :methyl -148:sc= -4.07! (180deg=-5.9!) USER MOD Single : A 419 THR OG1 : rot 155:sc= 0.856 USER MOD Single : A 423 LYS NZ :NH3+ -133:sc= -2.08! (180deg=-4.58!) USER MOD Single : A 426 TYR OH : rot 180:sc= -0.136 USER MOD Single : A 429 MET CE :methyl -171:sc= -5.18! (180deg=-5.95!) USER MOD Single : A 431 GLN : amide:sc= 1.19 K(o=1.2,f=-0.081) USER MOD Single : A 433 MET CE :methyl -137:sc= -3.01 (180deg=-7.51!) USER MOD Single : B 14 LYS NZ :NH3+ -173:sc= 1.17 (180deg=0.995) USER MOD Single : B 17 GLN : amide:sc= -2.24! K(o=-2.2!,f=-1.5) USER MOD Single : B 18 LYS NZ :NH3+ 147:sc= 0.634 (180deg=-0.599) USER MOD Single : B 19 LYS NZ :NH3+ -178:sc= 1.25 (180deg=1.06) USER MOD Single : B 20 GLN : amide:sc= -1.1 K(o=-1.1,f=-5.5!) USER MOD Single : B 27 MET CE :methyl -126:sc= -4.22! (180deg=-9!) USER MOD Single : B 38 LYS NZ :NH3+ -113:sc= -1.56 (180deg=-3.97!) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -118:sc= -0.845 (180deg=-1.72) USER MOD Single : B 47 TYR OH : rot 90:sc= -0.614 USER MOD Single : B 53 GLN : amide:sc= -2.67 K(o=-2.7,f=-4.4) USER MOD Single : B 56 SER OG : rot 29:sc= 1.35 USER MOD Single : B 60 LYS NZ :NH3+ -127:sc= 0.343! (180deg=-6.38!) USER MOD Single : B 62 LYS NZ :NH3+ -176:sc= 2.41 (180deg=2.34) USER MOD Single : B 64 GLN : amide:sc= -1.78 X(o=-1.8,f=-1.6) USER MOD Single : B 70 HIS : no HE2:sc= -5.34! C(o=-5.3!,f=-7.4!) USER MOD Single : B 74 THR OG1 : rot 30:sc= 0.341 USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 87 LYS NZ :NH3+ 157:sc= 1.27 (180deg=1.14) USER MOD Single : B 93 LYS NZ :NH3+ -179:sc= 1.49 (180deg=1.49) USER MOD Single : B 97 GLN : amide:sc= -2.42! K(o=-2.4!,f=-0.32) USER MOD Single : B 98 GLN : amide:sc= 0.228 K(o=0.23,f=-1.4) USER MOD Single : B 102 LYS NZ :NH3+ 148:sc= 1.07 (180deg=0.291) USER MOD Single : B 104 LYS NZ :NH3+ -144:sc= 2.23 (180deg=-3.17!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 10.057 12.246 13.855 1.00 0.00 N ATOM 59 CA GLU A 382 9.130 11.144 13.588 1.00 0.00 C ATOM 60 C GLU A 382 8.427 11.357 12.248 1.00 0.00 C ATOM 61 O GLU A 382 8.099 12.482 11.864 1.00 0.00 O ATOM 62 CB GLU A 382 8.115 10.957 14.726 1.00 0.00 C ATOM 63 CG GLU A 382 7.307 9.668 14.623 1.00 0.00 C ATOM 64 CD GLU A 382 8.153 8.471 14.226 1.00 0.00 C ATOM 65 OE1 GLU A 382 8.821 7.894 15.104 1.00 0.00 O ATOM 66 OE2 GLU A 382 8.155 8.117 13.023 1.00 0.00 O ATOM 0 HA GLU A 382 9.713 10.224 13.533 1.00 0.00 H new ATOM 0 HB2 GLU A 382 8.645 10.968 15.679 1.00 0.00 H new ATOM 0 HB3 GLU A 382 7.430 11.805 14.733 1.00 0.00 H new ATOM 0 HG2 GLU A 382 6.829 9.467 15.582 1.00 0.00 H new ATOM 0 HG3 GLU A 382 6.510 9.802 13.892 1.00 0.00 H new ATOM 73 N GLU A 383 8.195 10.270 11.535 1.00 0.00 N ATOM 74 CA GLU A 383 7.564 10.341 10.232 1.00 0.00 C ATOM 75 C GLU A 383 6.112 9.872 10.296 1.00 0.00 C ATOM 76 O GLU A 383 5.463 9.743 9.266 1.00 0.00 O ATOM 77 CB GLU A 383 8.353 9.519 9.211 1.00 0.00 C ATOM 78 CG GLU A 383 9.850 9.802 9.209 1.00 0.00 C ATOM 79 CD GLU A 383 10.211 11.130 8.565 1.00 0.00 C ATOM 80 OE1 GLU A 383 9.323 11.996 8.419 1.00 0.00 O ATOM 81 OE2 GLU A 383 11.395 11.311 8.206 1.00 0.00 O ATOM 0 H GLU A 383 8.435 9.326 11.838 1.00 0.00 H new ATOM 0 HA GLU A 383 7.564 11.383 9.913 1.00 0.00 H new ATOM 0 HB2 GLU A 383 8.195 8.460 9.413 1.00 0.00 H new ATOM 0 HB3 GLU A 383 7.955 9.717 8.216 1.00 0.00 H new ATOM 0 HG2 GLU A 383 10.216 9.793 10.236 1.00 0.00 H new ATOM 0 HG3 GLU A 383 10.364 8.999 8.681 1.00 0.00 H new ATOM 88 N ASP A 384 5.617 9.606 11.502 1.00 0.00 N ATOM 89 CA ASP A 384 4.223 9.190 11.702 1.00 0.00 C ATOM 90 C ASP A 384 3.579 10.134 12.708 1.00 0.00 C ATOM 91 O ASP A 384 4.258 10.611 13.615 1.00 0.00 O ATOM 92 CB ASP A 384 4.130 7.738 12.198 1.00 0.00 C ATOM 93 CG ASP A 384 2.708 7.180 12.161 1.00 0.00 C ATOM 94 OD1 ASP A 384 1.816 7.817 11.562 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.476 6.083 12.720 1.00 0.00 O ATOM 0 H ASP A 384 6.161 9.670 12.363 1.00 0.00 H new ATOM 0 HA ASP A 384 3.698 9.236 10.748 1.00 0.00 H new ATOM 0 HB2 ASP A 384 4.776 7.109 11.585 1.00 0.00 H new ATOM 0 HB3 ASP A 384 4.508 7.685 13.219 1.00 0.00 H new ATOM 100 N ASP A 385 2.285 10.407 12.548 1.00 0.00 N ATOM 101 CA ASP A 385 1.583 11.332 13.446 1.00 0.00 C ATOM 102 C ASP A 385 0.092 11.418 13.119 1.00 0.00 C ATOM 103 O ASP A 385 -0.755 11.311 14.003 1.00 0.00 O ATOM 104 CB ASP A 385 2.207 12.732 13.353 1.00 0.00 C ATOM 105 CG ASP A 385 1.364 13.807 14.013 1.00 0.00 C ATOM 106 OD1 ASP A 385 1.345 13.874 15.256 1.00 0.00 O ATOM 107 OD2 ASP A 385 0.731 14.596 13.278 1.00 0.00 O ATOM 0 H ASP A 385 1.703 10.006 11.813 1.00 0.00 H new ATOM 0 HA ASP A 385 1.687 10.946 14.460 1.00 0.00 H new ATOM 0 HB2 ASP A 385 3.192 12.715 13.819 1.00 0.00 H new ATOM 0 HB3 ASP A 385 2.354 12.988 12.304 1.00 0.00 H new ATOM 112 N GLU A 386 -0.226 11.558 11.838 1.00 0.00 N ATOM 113 CA GLU A 386 -1.596 11.694 11.399 1.00 0.00 C ATOM 114 C GLU A 386 -1.742 10.911 10.135 1.00 0.00 C ATOM 115 O GLU A 386 -1.676 11.462 9.038 1.00 0.00 O ATOM 116 CB GLU A 386 -1.934 13.149 11.118 1.00 0.00 C ATOM 117 CG GLU A 386 -2.806 13.815 12.161 1.00 0.00 C ATOM 118 CD GLU A 386 -3.356 15.136 11.668 1.00 0.00 C ATOM 119 OE1 GLU A 386 -2.656 15.802 10.870 1.00 0.00 O ATOM 120 OE2 GLU A 386 -4.478 15.503 12.063 1.00 0.00 O ATOM 0 H GLU A 386 0.460 11.580 11.083 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.268 11.331 12.177 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.005 13.712 11.030 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.437 13.210 10.153 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -3.631 13.152 12.423 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -2.227 13.978 13.070 1.00 0.00 H new ATOM 127 N PHE A 387 -1.876 9.620 10.273 1.00 0.00 N ATOM 128 CA PHE A 387 -1.967 8.782 9.114 1.00 0.00 C ATOM 129 C PHE A 387 -3.257 8.001 9.098 1.00 0.00 C ATOM 130 O PHE A 387 -3.749 7.558 10.135 1.00 0.00 O ATOM 131 CB PHE A 387 -0.794 7.802 9.069 1.00 0.00 C ATOM 132 CG PHE A 387 0.524 8.421 8.727 1.00 0.00 C ATOM 133 CD1 PHE A 387 0.923 9.598 9.322 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.366 7.823 7.808 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.119 10.168 9.012 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.571 8.394 7.498 1.00 0.00 C ATOM 137 CZ PHE A 387 2.943 9.568 8.100 1.00 0.00 C ATOM 0 H PHE A 387 -1.924 9.132 11.167 1.00 0.00 H new ATOM 0 HA PHE A 387 -1.939 9.434 8.241 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.709 7.313 10.039 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.016 7.024 8.338 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.277 10.075 10.045 1.00 0.00 H new ATOM 0 HD2 PHE A 387 1.071 6.900 7.332 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.417 11.092 9.485 1.00 0.00 H new ATOM 0 HE2 PHE A 387 3.226 7.921 6.782 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.892 10.021 7.853 1.00 0.00 H new ATOM 147 N GLU A 388 -3.757 7.807 7.904 1.00 0.00 N ATOM 148 CA GLU A 388 -4.972 7.059 7.690 1.00 0.00 C ATOM 149 C GLU A 388 -4.567 5.639 7.399 1.00 0.00 C ATOM 150 O GLU A 388 -3.780 5.417 6.475 1.00 0.00 O ATOM 151 CB GLU A 388 -5.752 7.614 6.492 1.00 0.00 C ATOM 152 CG GLU A 388 -6.231 9.040 6.661 1.00 0.00 C ATOM 153 CD GLU A 388 -7.371 9.167 7.650 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.171 8.832 8.837 1.00 0.00 O ATOM 155 OE2 GLU A 388 -8.463 9.611 7.239 1.00 0.00 O ATOM 0 H GLU A 388 -3.332 8.165 7.049 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.613 7.126 8.569 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.120 7.559 5.606 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.615 6.974 6.308 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.398 9.660 6.993 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.551 9.427 5.694 1.00 0.00 H new ATOM 162 N GLU A 389 -5.024 4.684 8.195 1.00 0.00 N ATOM 163 CA GLU A 389 -4.672 3.308 7.920 1.00 0.00 C ATOM 164 C GLU A 389 -5.295 2.950 6.588 1.00 0.00 C ATOM 165 O GLU A 389 -6.512 2.790 6.480 1.00 0.00 O ATOM 166 CB GLU A 389 -5.139 2.344 9.018 1.00 0.00 C ATOM 167 CG GLU A 389 -4.037 1.386 9.457 1.00 0.00 C ATOM 168 CD GLU A 389 -4.527 -0.021 9.763 1.00 0.00 C ATOM 169 OE1 GLU A 389 -5.695 -0.338 9.469 1.00 0.00 O ATOM 170 OE2 GLU A 389 -3.727 -0.830 10.289 1.00 0.00 O ATOM 0 H GLU A 389 -5.620 4.832 9.010 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.587 3.211 7.891 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.483 2.917 9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -5.992 1.771 8.656 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -3.281 1.334 8.673 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -3.549 1.791 10.344 1.00 0.00 H new ATOM 177 N VAL A 390 -4.467 2.854 5.567 1.00 0.00 N ATOM 178 CA VAL A 390 -4.962 2.561 4.252 1.00 0.00 C ATOM 179 C VAL A 390 -5.304 1.095 4.152 1.00 0.00 C ATOM 180 O VAL A 390 -4.478 0.228 4.452 1.00 0.00 O ATOM 181 CB VAL A 390 -3.971 2.889 3.126 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.678 2.859 1.782 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.313 4.228 3.345 1.00 0.00 C ATOM 0 H VAL A 390 -3.456 2.975 5.629 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.838 3.196 4.118 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.189 2.130 3.133 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.966 3.093 0.991 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -5.095 1.866 1.613 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.481 3.596 1.777 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.618 4.429 2.530 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -4.075 5.007 3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.771 4.217 4.290 1.00 0.00 H new ATOM 193 N ALA A 391 -6.506 0.830 3.718 1.00 0.00 N ATOM 194 CA ALA A 391 -6.976 -0.524 3.573 1.00 0.00 C ATOM 195 C ALA A 391 -6.543 -1.084 2.235 1.00 0.00 C ATOM 196 O ALA A 391 -6.571 -0.389 1.223 1.00 0.00 O ATOM 197 CB ALA A 391 -8.490 -0.581 3.713 1.00 0.00 C ATOM 0 H ALA A 391 -7.187 1.543 3.455 1.00 0.00 H new ATOM 0 HA ALA A 391 -6.538 -1.133 4.364 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.827 -1.611 3.601 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.779 -0.210 4.696 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.950 0.037 2.942 1.00 0.00 H new ATOM 203 N ASP A 392 -6.077 -2.313 2.265 1.00 0.00 N ATOM 204 CA ASP A 392 -5.658 -3.039 1.077 1.00 0.00 C ATOM 205 C ASP A 392 -6.877 -3.416 0.254 1.00 0.00 C ATOM 206 O ASP A 392 -7.236 -4.587 0.137 1.00 0.00 O ATOM 207 CB ASP A 392 -4.887 -4.295 1.485 1.00 0.00 C ATOM 208 CG ASP A 392 -5.415 -4.935 2.755 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.293 -4.313 3.837 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.925 -6.072 2.687 1.00 0.00 O ATOM 0 H ASP A 392 -5.975 -2.848 3.127 1.00 0.00 H new ATOM 0 HA ASP A 392 -5.006 -2.406 0.475 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.933 -5.021 0.674 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.837 -4.039 1.624 1.00 0.00 H new ATOM 215 N ASP A 393 -7.496 -2.408 -0.325 1.00 0.00 N ATOM 216 CA ASP A 393 -8.706 -2.593 -1.099 1.00 0.00 C ATOM 217 C ASP A 393 -8.421 -2.702 -2.588 1.00 0.00 C ATOM 218 O ASP A 393 -7.854 -1.793 -3.196 1.00 0.00 O ATOM 219 CB ASP A 393 -9.645 -1.431 -0.830 1.00 0.00 C ATOM 220 CG ASP A 393 -11.109 -1.828 -0.952 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.647 -2.438 -0.009 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.731 -1.531 -1.993 1.00 0.00 O ATOM 0 H ASP A 393 -7.176 -1.441 -0.273 1.00 0.00 H new ATOM 0 HA ASP A 393 -9.168 -3.532 -0.793 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.459 -1.041 0.171 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -9.430 -0.624 -1.531 1.00 0.00 H new ATOM 227 N PRO A 394 -8.804 -3.833 -3.190 1.00 0.00 N ATOM 228 CA PRO A 394 -8.610 -4.076 -4.613 1.00 0.00 C ATOM 229 C PRO A 394 -9.692 -3.431 -5.464 1.00 0.00 C ATOM 230 O PRO A 394 -10.724 -2.982 -4.960 1.00 0.00 O ATOM 231 CB PRO A 394 -8.712 -5.591 -4.715 1.00 0.00 C ATOM 232 CG PRO A 394 -9.658 -5.970 -3.632 1.00 0.00 C ATOM 233 CD PRO A 394 -9.448 -4.975 -2.519 1.00 0.00 C ATOM 0 HA PRO A 394 -7.670 -3.659 -4.974 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -9.082 -5.900 -5.693 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.740 -6.065 -4.578 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.688 -5.943 -3.988 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.467 -6.986 -3.287 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.392 -4.687 -2.056 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.817 -5.384 -1.730 1.00 0.00 H new ATOM 241 N ILE A 395 -9.461 -3.415 -6.760 1.00 0.00 N ATOM 242 CA ILE A 395 -10.409 -2.841 -7.692 1.00 0.00 C ATOM 243 C ILE A 395 -11.142 -3.951 -8.428 1.00 0.00 C ATOM 244 O ILE A 395 -10.568 -4.653 -9.262 1.00 0.00 O ATOM 245 CB ILE A 395 -9.710 -1.894 -8.699 1.00 0.00 C ATOM 246 CG1 ILE A 395 -9.352 -0.580 -8.011 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.583 -1.629 -9.921 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.533 0.094 -7.350 1.00 0.00 C ATOM 0 H ILE A 395 -8.620 -3.795 -7.194 1.00 0.00 H new ATOM 0 HA ILE A 395 -11.128 -2.247 -7.127 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.799 -2.383 -9.045 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.584 -0.769 -7.261 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.920 0.100 -8.745 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -10.059 -0.961 -10.604 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.797 -2.571 -10.427 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.518 -1.166 -9.606 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -10.206 1.022 -6.881 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -11.293 0.314 -8.100 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.952 -0.568 -6.592 1.00 0.00 H new ATOM 260 N VAL A 396 -12.402 -4.123 -8.087 1.00 0.00 N ATOM 261 CA VAL A 396 -13.229 -5.135 -8.703 1.00 0.00 C ATOM 262 C VAL A 396 -14.276 -4.464 -9.582 1.00 0.00 C ATOM 263 O VAL A 396 -15.103 -3.683 -9.108 1.00 0.00 O ATOM 264 CB VAL A 396 -13.871 -6.072 -7.641 1.00 0.00 C ATOM 265 CG1 VAL A 396 -14.110 -5.348 -6.325 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.149 -6.716 -8.151 1.00 0.00 C ATOM 0 H VAL A 396 -12.879 -3.567 -7.377 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.605 -5.771 -9.331 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.155 -6.872 -7.453 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.560 -6.035 -5.608 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.161 -4.984 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.781 -4.505 -6.490 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.564 -7.362 -7.378 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.872 -5.940 -8.402 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.929 -7.308 -9.039 1.00 0.00 H new ATOM 276 N MET A 397 -14.219 -4.752 -10.873 1.00 0.00 N ATOM 277 CA MET A 397 -15.123 -4.154 -11.823 1.00 0.00 C ATOM 278 C MET A 397 -16.436 -4.901 -11.842 1.00 0.00 C ATOM 279 O MET A 397 -16.467 -6.124 -11.733 1.00 0.00 O ATOM 280 CB MET A 397 -14.497 -4.146 -13.219 1.00 0.00 C ATOM 281 CG MET A 397 -13.036 -3.720 -13.224 1.00 0.00 C ATOM 282 SD MET A 397 -12.372 -3.500 -14.884 1.00 0.00 S ATOM 283 CE MET A 397 -13.100 -1.926 -15.325 1.00 0.00 C ATOM 0 H MET A 397 -13.548 -5.402 -11.282 1.00 0.00 H new ATOM 0 HA MET A 397 -15.313 -3.124 -11.520 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.578 -5.143 -13.651 1.00 0.00 H new ATOM 0 HB3 MET A 397 -15.066 -3.473 -13.860 1.00 0.00 H new ATOM 0 HG2 MET A 397 -12.934 -2.786 -12.671 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.443 -4.468 -12.698 1.00 0.00 H new ATOM 0 HE1 MET A 397 -13.606 -2.016 -16.287 1.00 0.00 H new ATOM 0 HE2 MET A 397 -13.821 -1.632 -14.562 1.00 0.00 H new ATOM 0 HE3 MET A 397 -12.318 -1.170 -15.395 1.00 0.00 H new ATOM 293 N VAL A 398 -17.508 -4.146 -11.931 1.00 0.00 N ATOM 294 CA VAL A 398 -18.839 -4.704 -11.989 1.00 0.00 C ATOM 295 C VAL A 398 -19.571 -4.118 -13.179 1.00 0.00 C ATOM 296 O VAL A 398 -19.704 -2.893 -13.295 1.00 0.00 O ATOM 297 CB VAL A 398 -19.640 -4.424 -10.713 1.00 0.00 C ATOM 298 CG1 VAL A 398 -21.051 -4.952 -10.873 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.967 -5.053 -9.504 1.00 0.00 C ATOM 0 H VAL A 398 -17.481 -3.127 -11.965 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.744 -5.785 -12.088 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.679 -3.347 -10.550 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.619 -4.752 -9.965 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.531 -4.458 -11.718 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -21.019 -6.027 -11.052 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.553 -4.841 -8.610 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.899 -6.132 -9.646 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.966 -4.638 -9.388 1.00 0.00 H new ATOM 309 N ALA A 399 -20.012 -4.992 -14.071 1.00 0.00 N ATOM 310 CA ALA A 399 -20.707 -4.596 -15.278 1.00 0.00 C ATOM 311 C ALA A 399 -19.795 -3.723 -16.133 1.00 0.00 C ATOM 312 O ALA A 399 -20.261 -2.876 -16.904 1.00 0.00 O ATOM 313 CB ALA A 399 -22.012 -3.880 -14.943 1.00 0.00 C ATOM 0 H ALA A 399 -19.895 -6.001 -13.974 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.966 -5.488 -15.849 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -22.516 -3.592 -15.865 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -22.656 -4.547 -14.370 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -21.797 -2.989 -14.354 1.00 0.00 H new ATOM 319 N GLY A 400 -18.483 -3.919 -15.977 1.00 0.00 N ATOM 320 CA GLY A 400 -17.521 -3.148 -16.740 1.00 0.00 C ATOM 321 C GLY A 400 -17.131 -1.855 -16.049 1.00 0.00 C ATOM 322 O GLY A 400 -16.268 -1.123 -16.529 1.00 0.00 O ATOM 0 H GLY A 400 -18.074 -4.598 -15.335 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -16.628 -3.750 -16.907 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -17.939 -2.920 -17.720 1.00 0.00 H new ATOM 326 N ARG A 401 -17.766 -1.569 -14.922 1.00 0.00 N ATOM 327 CA ARG A 401 -17.471 -0.360 -14.168 1.00 0.00 C ATOM 328 C ARG A 401 -16.522 -0.684 -13.025 1.00 0.00 C ATOM 329 O ARG A 401 -16.808 -1.550 -12.204 1.00 0.00 O ATOM 330 CB ARG A 401 -18.756 0.271 -13.632 1.00 0.00 C ATOM 331 CG ARG A 401 -19.383 1.272 -14.588 1.00 0.00 C ATOM 332 CD ARG A 401 -20.873 1.029 -14.751 1.00 0.00 C ATOM 333 NE ARG A 401 -21.153 -0.093 -15.648 1.00 0.00 N ATOM 334 CZ ARG A 401 -22.272 -0.217 -16.361 1.00 0.00 C ATOM 335 NH1 ARG A 401 -23.233 0.696 -16.263 1.00 0.00 N ATOM 336 NH2 ARG A 401 -22.430 -1.261 -17.168 1.00 0.00 N ATOM 0 H ARG A 401 -18.489 -2.158 -14.509 1.00 0.00 H new ATOM 0 HA ARG A 401 -16.993 0.359 -14.834 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -19.478 -0.518 -13.419 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -18.540 0.769 -12.687 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -19.217 2.284 -14.218 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -18.894 1.204 -15.560 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -21.317 0.832 -13.775 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -21.346 1.930 -15.140 1.00 0.00 H new ATOM 0 HE ARG A 401 -20.448 -0.825 -15.733 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -23.116 1.495 -15.640 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -24.088 0.597 -16.811 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -21.696 -1.965 -17.241 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -23.286 -1.358 -17.715 1.00 0.00 H new ATOM 350 N PRO A 402 -15.377 0.001 -12.962 1.00 0.00 N ATOM 351 CA PRO A 402 -14.378 -0.239 -11.923 1.00 0.00 C ATOM 352 C PRO A 402 -14.799 0.268 -10.548 1.00 0.00 C ATOM 353 O PRO A 402 -14.874 1.473 -10.308 1.00 0.00 O ATOM 354 CB PRO A 402 -13.152 0.523 -12.428 1.00 0.00 C ATOM 355 CG PRO A 402 -13.707 1.616 -13.276 1.00 0.00 C ATOM 356 CD PRO A 402 -14.965 1.068 -13.893 1.00 0.00 C ATOM 0 HA PRO A 402 -14.209 -1.305 -11.774 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -12.566 0.923 -11.600 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -12.491 -0.126 -13.002 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -13.920 2.503 -12.679 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -12.994 1.913 -14.045 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -15.733 1.836 -13.986 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -14.782 0.677 -14.894 1.00 0.00 H new ATOM 364 N PHE A 403 -15.085 -0.668 -9.660 1.00 0.00 N ATOM 365 CA PHE A 403 -15.470 -0.353 -8.298 1.00 0.00 C ATOM 366 C PHE A 403 -14.424 -0.922 -7.359 1.00 0.00 C ATOM 367 O PHE A 403 -13.576 -1.708 -7.774 1.00 0.00 O ATOM 368 CB PHE A 403 -16.840 -0.955 -7.963 1.00 0.00 C ATOM 369 CG PHE A 403 -17.988 -0.298 -8.673 1.00 0.00 C ATOM 370 CD1 PHE A 403 -18.384 0.988 -8.342 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.674 -0.971 -9.670 1.00 0.00 C ATOM 372 CE1 PHE A 403 -19.443 1.592 -8.996 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.733 -0.374 -10.325 1.00 0.00 C ATOM 374 CZ PHE A 403 -20.118 0.908 -9.989 1.00 0.00 C ATOM 0 H PHE A 403 -15.057 -1.667 -9.864 1.00 0.00 H new ATOM 0 HA PHE A 403 -15.538 0.729 -8.186 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.830 -2.016 -8.214 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -17.003 -0.884 -6.888 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -17.860 1.525 -7.565 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -18.377 -1.974 -9.938 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -19.741 2.596 -8.731 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -20.260 -0.910 -11.100 1.00 0.00 H new ATOM 0 HZ PHE A 403 -20.946 1.376 -10.501 1.00 0.00 H new ATOM 384 N SER A 404 -14.454 -0.519 -6.112 1.00 0.00 N ATOM 385 CA SER A 404 -13.514 -1.040 -5.146 1.00 0.00 C ATOM 386 C SER A 404 -14.165 -2.204 -4.407 1.00 0.00 C ATOM 387 O SER A 404 -15.374 -2.406 -4.509 1.00 0.00 O ATOM 388 CB SER A 404 -13.100 0.060 -4.177 1.00 0.00 C ATOM 389 OG SER A 404 -13.147 1.331 -4.806 1.00 0.00 O ATOM 0 H SER A 404 -15.115 0.164 -5.742 1.00 0.00 H new ATOM 0 HA SER A 404 -12.616 -1.396 -5.650 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.760 0.054 -3.310 1.00 0.00 H new ATOM 0 HB3 SER A 404 -12.091 -0.132 -3.811 1.00 0.00 H new ATOM 0 HG SER A 404 -12.879 2.023 -4.166 1.00 0.00 H new ATOM 395 N TYR A 405 -13.385 -2.969 -3.671 1.00 0.00 N ATOM 396 CA TYR A 405 -13.915 -4.103 -2.936 1.00 0.00 C ATOM 397 C TYR A 405 -14.846 -3.616 -1.840 1.00 0.00 C ATOM 398 O TYR A 405 -15.938 -4.151 -1.676 1.00 0.00 O ATOM 399 CB TYR A 405 -12.795 -4.954 -2.348 1.00 0.00 C ATOM 400 CG TYR A 405 -13.255 -6.306 -1.853 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.795 -6.459 -0.581 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.154 -7.431 -2.662 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.221 -7.693 -0.130 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.577 -8.668 -2.216 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.110 -8.794 -0.950 1.00 0.00 C ATOM 406 OH TYR A 405 -14.535 -10.024 -0.506 1.00 0.00 O ATOM 0 H TYR A 405 -12.380 -2.827 -3.565 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.476 -4.730 -3.629 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -12.024 -5.097 -3.105 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.334 -4.412 -1.522 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.883 -5.598 0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -12.739 -7.337 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.639 -7.794 0.861 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.491 -9.533 -2.856 1.00 0.00 H new ATOM 0 HH TYR A 405 -14.614 -10.637 -1.267 1.00 0.00 H new ATOM 416 N SER A 406 -14.423 -2.588 -1.107 1.00 0.00 N ATOM 417 CA SER A 406 -15.248 -2.011 -0.045 1.00 0.00 C ATOM 418 C SER A 406 -16.533 -1.425 -0.632 1.00 0.00 C ATOM 419 O SER A 406 -17.487 -1.131 0.081 1.00 0.00 O ATOM 420 CB SER A 406 -14.470 -0.933 0.715 1.00 0.00 C ATOM 421 OG SER A 406 -13.483 -1.513 1.551 1.00 0.00 O ATOM 0 H SER A 406 -13.516 -2.138 -1.228 1.00 0.00 H new ATOM 0 HA SER A 406 -15.513 -2.803 0.656 1.00 0.00 H new ATOM 0 HB2 SER A 406 -13.997 -0.253 0.006 1.00 0.00 H new ATOM 0 HB3 SER A 406 -15.158 -0.339 1.317 1.00 0.00 H new ATOM 0 HG SER A 406 -12.632 -1.561 1.068 1.00 0.00 H new ATOM 427 N GLU A 407 -16.539 -1.278 -1.948 1.00 0.00 N ATOM 428 CA GLU A 407 -17.682 -0.763 -2.674 1.00 0.00 C ATOM 429 C GLU A 407 -18.588 -1.909 -3.096 1.00 0.00 C ATOM 430 O GLU A 407 -19.773 -1.941 -2.772 1.00 0.00 O ATOM 431 CB GLU A 407 -17.201 0.014 -3.898 1.00 0.00 C ATOM 432 CG GLU A 407 -17.002 1.497 -3.647 1.00 0.00 C ATOM 433 CD GLU A 407 -18.305 2.260 -3.771 1.00 0.00 C ATOM 434 OE1 GLU A 407 -19.114 1.908 -4.652 1.00 0.00 O ATOM 435 OE2 GLU A 407 -18.539 3.195 -2.981 1.00 0.00 O ATOM 0 H GLU A 407 -15.745 -1.515 -2.543 1.00 0.00 H new ATOM 0 HA GLU A 407 -18.249 -0.092 -2.029 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -16.260 -0.416 -4.242 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.923 -0.114 -4.704 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -16.585 1.646 -2.651 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -16.278 1.894 -4.358 1.00 0.00 H new ATOM 442 N VAL A 408 -17.999 -2.865 -3.795 1.00 0.00 N ATOM 443 CA VAL A 408 -18.719 -4.032 -4.283 1.00 0.00 C ATOM 444 C VAL A 408 -19.291 -4.864 -3.130 1.00 0.00 C ATOM 445 O VAL A 408 -20.388 -5.406 -3.231 1.00 0.00 O ATOM 446 CB VAL A 408 -17.791 -4.919 -5.145 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.522 -6.142 -5.649 1.00 0.00 C ATOM 448 CG2 VAL A 408 -17.218 -4.138 -6.316 1.00 0.00 C ATOM 0 H VAL A 408 -17.009 -2.855 -4.041 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.548 -3.671 -4.892 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.968 -5.243 -4.508 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.845 -6.747 -6.252 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.877 -6.729 -4.802 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.372 -5.833 -6.257 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.570 -4.787 -6.904 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -18.032 -3.773 -6.943 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.641 -3.292 -5.942 1.00 0.00 H new ATOM 458 N SER A 409 -18.556 -4.931 -2.028 1.00 0.00 N ATOM 459 CA SER A 409 -18.985 -5.716 -0.869 1.00 0.00 C ATOM 460 C SER A 409 -20.109 -5.030 -0.101 1.00 0.00 C ATOM 461 O SER A 409 -20.905 -5.687 0.569 1.00 0.00 O ATOM 462 CB SER A 409 -17.805 -5.977 0.073 1.00 0.00 C ATOM 463 OG SER A 409 -17.214 -4.764 0.505 1.00 0.00 O ATOM 0 H SER A 409 -17.662 -4.454 -1.908 1.00 0.00 H new ATOM 0 HA SER A 409 -19.364 -6.665 -1.249 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.146 -6.546 0.938 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.059 -6.587 -0.436 1.00 0.00 H new ATOM 0 HG SER A 409 -16.590 -4.443 -0.179 1.00 0.00 H new ATOM 469 N GLN A 410 -20.168 -3.710 -0.190 1.00 0.00 N ATOM 470 CA GLN A 410 -21.192 -2.953 0.512 1.00 0.00 C ATOM 471 C GLN A 410 -22.407 -2.725 -0.373 1.00 0.00 C ATOM 472 O GLN A 410 -23.442 -2.254 0.093 1.00 0.00 O ATOM 473 CB GLN A 410 -20.631 -1.620 1.001 1.00 0.00 C ATOM 474 CG GLN A 410 -19.754 -1.751 2.237 1.00 0.00 C ATOM 475 CD GLN A 410 -20.503 -2.322 3.428 1.00 0.00 C ATOM 476 OE1 GLN A 410 -21.068 -1.585 4.233 1.00 0.00 O ATOM 477 NE2 GLN A 410 -20.514 -3.641 3.547 1.00 0.00 N ATOM 0 H GLN A 410 -19.522 -3.143 -0.739 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.508 -3.537 1.377 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -20.051 -1.162 0.200 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -21.458 -0.945 1.221 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -18.902 -2.391 2.007 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -19.354 -0.771 2.500 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -20.033 -4.219 2.858 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -21.003 -4.079 4.328 1.00 0.00 H new ATOM 486 N ARG A 411 -22.278 -3.055 -1.649 1.00 0.00 N ATOM 487 CA ARG A 411 -23.378 -2.883 -2.582 1.00 0.00 C ATOM 488 C ARG A 411 -23.840 -4.219 -3.152 1.00 0.00 C ATOM 489 O ARG A 411 -23.263 -4.743 -4.120 1.00 0.00 O ATOM 490 CB ARG A 411 -22.984 -1.932 -3.708 1.00 0.00 C ATOM 491 CG ARG A 411 -22.639 -0.537 -3.225 1.00 0.00 C ATOM 492 CD ARG A 411 -22.429 0.417 -4.386 1.00 0.00 C ATOM 493 NE ARG A 411 -21.606 1.562 -4.003 1.00 0.00 N ATOM 494 CZ ARG A 411 -22.061 2.642 -3.379 1.00 0.00 C ATOM 495 NH1 ARG A 411 -23.360 2.767 -3.114 1.00 0.00 N ATOM 496 NH2 ARG A 411 -21.210 3.598 -3.021 1.00 0.00 N ATOM 0 H ARG A 411 -21.428 -3.441 -2.059 1.00 0.00 H new ATOM 0 HA ARG A 411 -24.212 -2.448 -2.032 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -22.128 -2.346 -4.240 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.804 -1.868 -4.423 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -23.439 -0.164 -2.586 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -21.736 -0.575 -2.616 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.953 -0.113 -5.211 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -23.395 0.768 -4.748 1.00 0.00 H new ATOM 0 HE ARG A 411 -20.612 1.529 -4.231 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -24.010 2.031 -3.391 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -23.705 3.598 -2.634 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -20.216 3.499 -3.226 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -21.551 4.431 -2.541 1.00 0.00 H new ATOM 510 N PRO A 412 -24.896 -4.792 -2.554 1.00 0.00 N ATOM 511 CA PRO A 412 -25.465 -6.059 -3.000 1.00 0.00 C ATOM 512 C PRO A 412 -25.947 -5.980 -4.443 1.00 0.00 C ATOM 513 O PRO A 412 -25.986 -6.987 -5.143 1.00 0.00 O ATOM 514 CB PRO A 412 -26.649 -6.289 -2.054 1.00 0.00 C ATOM 515 CG PRO A 412 -26.373 -5.430 -0.869 1.00 0.00 C ATOM 516 CD PRO A 412 -25.611 -4.246 -1.389 1.00 0.00 C ATOM 0 HA PRO A 412 -24.733 -6.866 -2.975 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.591 -6.015 -2.528 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.728 -7.338 -1.770 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.300 -5.118 -0.388 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -25.793 -5.970 -0.121 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -26.277 -3.431 -1.671 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.922 -3.851 -0.642 1.00 0.00 H new ATOM 524 N GLU A 413 -26.290 -4.770 -4.889 1.00 0.00 N ATOM 525 CA GLU A 413 -26.760 -4.561 -6.249 1.00 0.00 C ATOM 526 C GLU A 413 -25.602 -4.736 -7.210 1.00 0.00 C ATOM 527 O GLU A 413 -25.780 -5.204 -8.329 1.00 0.00 O ATOM 528 CB GLU A 413 -27.361 -3.163 -6.435 1.00 0.00 C ATOM 529 CG GLU A 413 -27.996 -2.583 -5.185 1.00 0.00 C ATOM 530 CD GLU A 413 -27.023 -1.727 -4.403 1.00 0.00 C ATOM 531 OE1 GLU A 413 -26.202 -2.301 -3.666 1.00 0.00 O ATOM 532 OE2 GLU A 413 -27.065 -0.490 -4.541 1.00 0.00 O ATOM 0 H GLU A 413 -26.249 -3.922 -4.323 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.541 -5.294 -6.451 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.578 -2.487 -6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -28.112 -3.206 -7.223 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.864 -1.985 -5.463 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -28.357 -3.393 -4.552 1.00 0.00 H new ATOM 539 N LEU A 414 -24.409 -4.369 -6.760 1.00 0.00 N ATOM 540 CA LEU A 414 -23.224 -4.504 -7.584 1.00 0.00 C ATOM 541 C LEU A 414 -22.953 -5.970 -7.843 1.00 0.00 C ATOM 542 O LEU A 414 -22.802 -6.383 -8.980 1.00 0.00 O ATOM 543 CB LEU A 414 -22.006 -3.849 -6.929 1.00 0.00 C ATOM 544 CG LEU A 414 -21.977 -2.322 -6.993 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.602 -1.804 -6.607 1.00 0.00 C ATOM 546 CD2 LEU A 414 -22.362 -1.836 -8.383 1.00 0.00 C ATOM 0 H LEU A 414 -24.241 -3.978 -5.833 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.404 -3.991 -8.529 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.968 -4.154 -5.883 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -21.105 -4.234 -7.407 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.706 -1.932 -6.282 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -20.596 -0.715 -6.657 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -20.365 -2.122 -5.592 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.857 -2.203 -7.295 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -22.335 -0.747 -8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.659 -2.233 -9.115 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -23.368 -2.180 -8.623 1.00 0.00 H new ATOM 558 N VAL A 415 -22.948 -6.769 -6.788 1.00 0.00 N ATOM 559 CA VAL A 415 -22.702 -8.203 -6.937 1.00 0.00 C ATOM 560 C VAL A 415 -23.890 -8.864 -7.641 1.00 0.00 C ATOM 561 O VAL A 415 -23.781 -9.951 -8.207 1.00 0.00 O ATOM 562 CB VAL A 415 -22.433 -8.871 -5.564 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.167 -10.364 -5.707 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.256 -8.198 -4.876 1.00 0.00 C ATOM 0 H VAL A 415 -23.109 -6.459 -5.830 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.810 -8.339 -7.548 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.329 -8.748 -4.955 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -21.983 -10.797 -4.724 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.034 -10.846 -6.159 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.294 -10.519 -6.341 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.076 -8.675 -3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.367 -8.293 -5.500 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.480 -7.142 -4.722 1.00 0.00 H new ATOM 574 N ALA A 416 -25.018 -8.166 -7.630 1.00 0.00 N ATOM 575 CA ALA A 416 -26.232 -8.645 -8.267 1.00 0.00 C ATOM 576 C ALA A 416 -26.278 -8.237 -9.735 1.00 0.00 C ATOM 577 O ALA A 416 -27.113 -8.719 -10.499 1.00 0.00 O ATOM 578 CB ALA A 416 -27.442 -8.096 -7.544 1.00 0.00 C ATOM 0 H ALA A 416 -25.115 -7.256 -7.180 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.239 -9.734 -8.214 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.350 -8.459 -8.026 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.426 -8.426 -6.505 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.423 -7.007 -7.579 1.00 0.00 H new ATOM 584 N GLN A 417 -25.397 -7.323 -10.118 1.00 0.00 N ATOM 585 CA GLN A 417 -25.332 -6.862 -11.493 1.00 0.00 C ATOM 586 C GLN A 417 -23.979 -7.217 -12.057 1.00 0.00 C ATOM 587 O GLN A 417 -23.657 -6.895 -13.201 1.00 0.00 O ATOM 588 CB GLN A 417 -25.567 -5.352 -11.589 1.00 0.00 C ATOM 589 CG GLN A 417 -26.982 -4.934 -11.220 1.00 0.00 C ATOM 590 CD GLN A 417 -28.009 -5.384 -12.240 1.00 0.00 C ATOM 591 OE1 GLN A 417 -28.354 -4.645 -13.159 1.00 0.00 O ATOM 592 NE2 GLN A 417 -28.499 -6.606 -12.094 1.00 0.00 N ATOM 0 H GLN A 417 -24.718 -6.887 -9.494 1.00 0.00 H new ATOM 0 HA GLN A 417 -26.119 -7.350 -12.068 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.863 -4.840 -10.933 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -25.353 -5.023 -12.606 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -27.237 -5.350 -10.245 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -27.023 -3.849 -11.124 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -28.188 -7.191 -11.318 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -29.187 -6.962 -12.758 1.00 0.00 H new ATOM 601 N MET A 418 -23.188 -7.885 -11.234 1.00 0.00 N ATOM 602 CA MET A 418 -21.871 -8.297 -11.636 1.00 0.00 C ATOM 603 C MET A 418 -21.976 -9.636 -12.324 1.00 0.00 C ATOM 604 O MET A 418 -22.786 -10.490 -11.950 1.00 0.00 O ATOM 605 CB MET A 418 -20.910 -8.333 -10.437 1.00 0.00 C ATOM 606 CG MET A 418 -20.654 -9.708 -9.847 1.00 0.00 C ATOM 607 SD MET A 418 -19.957 -9.617 -8.183 1.00 0.00 S ATOM 608 CE MET A 418 -18.617 -8.456 -8.431 1.00 0.00 C ATOM 0 H MET A 418 -23.444 -8.150 -10.283 1.00 0.00 H new ATOM 0 HA MET A 418 -21.453 -7.574 -12.336 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.956 -7.905 -10.745 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.310 -7.689 -9.654 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.588 -10.269 -9.818 1.00 0.00 H new ATOM 0 HG3 MET A 418 -19.972 -10.259 -10.495 1.00 0.00 H new ATOM 0 HE1 MET A 418 -17.795 -8.699 -7.757 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.270 -8.516 -9.463 1.00 0.00 H new ATOM 0 HE3 MET A 418 -18.968 -7.445 -8.224 1.00 0.00 H new ATOM 618 N THR A 419 -21.173 -9.801 -13.334 1.00 0.00 N ATOM 619 CA THR A 419 -21.180 -11.022 -14.120 1.00 0.00 C ATOM 620 C THR A 419 -20.510 -12.150 -13.350 1.00 0.00 C ATOM 621 O THR A 419 -19.839 -11.899 -12.348 1.00 0.00 O ATOM 622 CB THR A 419 -20.472 -10.823 -15.480 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.063 -10.652 -15.291 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.040 -9.619 -16.217 1.00 0.00 C ATOM 0 H THR A 419 -20.495 -9.104 -13.643 1.00 0.00 H new ATOM 0 HA THR A 419 -22.220 -11.285 -14.313 1.00 0.00 H new ATOM 0 HB THR A 419 -20.646 -11.715 -16.082 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.588 -10.930 -16.102 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.526 -9.500 -17.171 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.105 -9.771 -16.395 1.00 0.00 H new ATOM 0 HG23 THR A 419 -20.897 -8.723 -15.614 1.00 0.00 H new ATOM 632 N PRO A 420 -20.716 -13.414 -13.766 1.00 0.00 N ATOM 633 CA PRO A 420 -20.084 -14.561 -13.114 1.00 0.00 C ATOM 634 C PRO A 420 -18.583 -14.341 -12.974 1.00 0.00 C ATOM 635 O PRO A 420 -18.000 -14.608 -11.926 1.00 0.00 O ATOM 636 CB PRO A 420 -20.387 -15.721 -14.062 1.00 0.00 C ATOM 637 CG PRO A 420 -21.650 -15.322 -14.743 1.00 0.00 C ATOM 638 CD PRO A 420 -21.588 -13.825 -14.883 1.00 0.00 C ATOM 0 HA PRO A 420 -20.452 -14.737 -12.103 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -19.579 -15.870 -14.778 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -20.508 -16.658 -13.518 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -21.737 -15.802 -15.718 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -22.520 -15.624 -14.160 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -21.174 -13.528 -15.847 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -22.577 -13.373 -14.808 1.00 0.00 H new ATOM 646 N GLU A 421 -17.980 -13.812 -14.034 1.00 0.00 N ATOM 647 CA GLU A 421 -16.554 -13.516 -14.046 1.00 0.00 C ATOM 648 C GLU A 421 -16.219 -12.510 -12.954 1.00 0.00 C ATOM 649 O GLU A 421 -15.298 -12.721 -12.169 1.00 0.00 O ATOM 650 CB GLU A 421 -16.119 -12.940 -15.397 1.00 0.00 C ATOM 651 CG GLU A 421 -16.696 -13.658 -16.605 1.00 0.00 C ATOM 652 CD GLU A 421 -18.097 -13.188 -16.932 1.00 0.00 C ATOM 653 OE1 GLU A 421 -18.242 -12.060 -17.441 1.00 0.00 O ATOM 654 OE2 GLU A 421 -19.053 -13.933 -16.645 1.00 0.00 O ATOM 0 H GLU A 421 -18.463 -13.578 -14.902 1.00 0.00 H new ATOM 0 HA GLU A 421 -16.021 -14.451 -13.871 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -16.411 -11.891 -15.441 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -15.031 -12.971 -15.457 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -16.049 -13.494 -17.467 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -16.709 -14.731 -16.416 1.00 0.00 H new ATOM 661 N GLU A 422 -16.985 -11.422 -12.905 1.00 0.00 N ATOM 662 CA GLU A 422 -16.774 -10.377 -11.926 1.00 0.00 C ATOM 663 C GLU A 422 -17.020 -10.903 -10.515 1.00 0.00 C ATOM 664 O GLU A 422 -16.266 -10.597 -9.595 1.00 0.00 O ATOM 665 CB GLU A 422 -17.683 -9.201 -12.268 1.00 0.00 C ATOM 666 CG GLU A 422 -17.317 -8.559 -13.598 1.00 0.00 C ATOM 667 CD GLU A 422 -18.284 -7.481 -14.021 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.486 -7.591 -13.689 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.848 -6.512 -14.684 1.00 0.00 O ATOM 0 H GLU A 422 -17.763 -11.248 -13.542 1.00 0.00 H new ATOM 0 HA GLU A 422 -15.738 -10.038 -11.954 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.718 -9.542 -12.304 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.621 -8.454 -11.477 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.316 -8.133 -13.526 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.281 -9.329 -14.369 1.00 0.00 H new ATOM 676 N LYS A 423 -18.072 -11.696 -10.352 1.00 0.00 N ATOM 677 CA LYS A 423 -18.394 -12.292 -9.059 1.00 0.00 C ATOM 678 C LYS A 423 -17.277 -13.211 -8.588 1.00 0.00 C ATOM 679 O LYS A 423 -16.845 -13.125 -7.440 1.00 0.00 O ATOM 680 CB LYS A 423 -19.700 -13.082 -9.145 1.00 0.00 C ATOM 681 CG LYS A 423 -20.444 -13.163 -7.823 1.00 0.00 C ATOM 682 CD LYS A 423 -21.550 -14.206 -7.859 1.00 0.00 C ATOM 683 CE LYS A 423 -21.011 -15.602 -7.582 1.00 0.00 C ATOM 684 NZ LYS A 423 -20.393 -16.214 -8.788 1.00 0.00 N ATOM 0 H LYS A 423 -18.719 -11.942 -11.101 1.00 0.00 H new ATOM 0 HA LYS A 423 -18.508 -11.481 -8.339 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -20.347 -12.620 -9.890 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -19.483 -14.092 -9.494 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -19.742 -13.406 -7.025 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -20.871 -12.189 -7.586 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -22.311 -13.956 -7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -22.035 -14.189 -8.835 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -20.272 -15.552 -6.782 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -21.821 -16.239 -7.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -20.740 -17.188 -8.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -20.647 -15.657 -9.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -19.359 -16.225 -8.680 1.00 0.00 H new ATOM 698 N GLU A 424 -16.800 -14.071 -9.478 1.00 0.00 N ATOM 699 CA GLU A 424 -15.733 -15.002 -9.133 1.00 0.00 C ATOM 700 C GLU A 424 -14.464 -14.226 -8.842 1.00 0.00 C ATOM 701 O GLU A 424 -13.705 -14.564 -7.934 1.00 0.00 O ATOM 702 CB GLU A 424 -15.501 -16.015 -10.256 1.00 0.00 C ATOM 703 CG GLU A 424 -16.227 -17.340 -10.048 1.00 0.00 C ATOM 704 CD GLU A 424 -17.679 -17.164 -9.642 1.00 0.00 C ATOM 705 OE1 GLU A 424 -17.956 -17.042 -8.427 1.00 0.00 O ATOM 706 OE2 GLU A 424 -18.559 -17.142 -10.527 1.00 0.00 O ATOM 0 H GLU A 424 -17.133 -14.144 -10.439 1.00 0.00 H new ATOM 0 HA GLU A 424 -16.026 -15.560 -8.244 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -15.826 -15.578 -11.200 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -14.432 -16.207 -10.345 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -16.181 -17.921 -10.969 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -15.708 -17.916 -9.281 1.00 0.00 H new ATOM 713 N ALA A 425 -14.253 -13.171 -9.617 1.00 0.00 N ATOM 714 CA ALA A 425 -13.103 -12.308 -9.440 1.00 0.00 C ATOM 715 C ALA A 425 -13.175 -11.637 -8.077 1.00 0.00 C ATOM 716 O ALA A 425 -12.197 -11.608 -7.336 1.00 0.00 O ATOM 717 CB ALA A 425 -13.057 -11.271 -10.547 1.00 0.00 C ATOM 0 H ALA A 425 -14.872 -12.894 -10.379 1.00 0.00 H new ATOM 0 HA ALA A 425 -12.191 -12.903 -9.490 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.189 -10.627 -10.406 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -12.984 -11.772 -11.512 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -13.965 -10.668 -10.519 1.00 0.00 H new ATOM 723 N TYR A 426 -14.354 -11.118 -7.750 1.00 0.00 N ATOM 724 CA TYR A 426 -14.589 -10.463 -6.478 1.00 0.00 C ATOM 725 C TYR A 426 -14.364 -11.443 -5.330 1.00 0.00 C ATOM 726 O TYR A 426 -13.681 -11.126 -4.356 1.00 0.00 O ATOM 727 CB TYR A 426 -16.019 -9.910 -6.445 1.00 0.00 C ATOM 728 CG TYR A 426 -16.533 -9.591 -5.062 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.207 -8.398 -4.436 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.344 -10.491 -4.381 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.672 -8.108 -3.170 1.00 0.00 C ATOM 732 CE2 TYR A 426 -17.810 -10.210 -3.115 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.474 -9.019 -2.513 1.00 0.00 C ATOM 734 OH TYR A 426 -17.932 -8.745 -1.247 1.00 0.00 O ATOM 0 H TYR A 426 -15.170 -11.142 -8.362 1.00 0.00 H new ATOM 0 HA TYR A 426 -13.887 -9.637 -6.361 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.060 -9.006 -7.052 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -16.687 -10.636 -6.909 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.579 -7.684 -4.948 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -17.613 -11.425 -4.851 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.410 -7.174 -2.696 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.436 -10.921 -2.597 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.484 -9.490 -0.930 1.00 0.00 H new ATOM 744 N ILE A 427 -14.934 -12.636 -5.463 1.00 0.00 N ATOM 745 CA ILE A 427 -14.800 -13.665 -4.440 1.00 0.00 C ATOM 746 C ILE A 427 -13.335 -14.064 -4.253 1.00 0.00 C ATOM 747 O ILE A 427 -12.824 -14.081 -3.129 1.00 0.00 O ATOM 748 CB ILE A 427 -15.644 -14.917 -4.780 1.00 0.00 C ATOM 749 CG1 ILE A 427 -17.134 -14.580 -4.699 1.00 0.00 C ATOM 750 CG2 ILE A 427 -15.307 -16.070 -3.841 1.00 0.00 C ATOM 751 CD1 ILE A 427 -18.040 -15.687 -5.196 1.00 0.00 C ATOM 0 H ILE A 427 -15.493 -12.914 -6.270 1.00 0.00 H new ATOM 0 HA ILE A 427 -15.173 -13.241 -3.508 1.00 0.00 H new ATOM 0 HB ILE A 427 -15.406 -15.229 -5.797 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -17.389 -14.352 -3.664 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -17.325 -13.678 -5.281 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -15.913 -16.939 -4.099 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -14.251 -16.322 -3.939 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -15.516 -15.775 -2.813 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -19.080 -15.373 -5.107 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -17.814 -15.901 -6.241 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -17.879 -16.585 -4.599 1.00 0.00 H new ATOM 763 N ALA A 428 -12.659 -14.356 -5.359 1.00 0.00 N ATOM 764 CA ALA A 428 -11.255 -14.751 -5.326 1.00 0.00 C ATOM 765 C ALA A 428 -10.385 -13.638 -4.750 1.00 0.00 C ATOM 766 O ALA A 428 -9.405 -13.896 -4.048 1.00 0.00 O ATOM 767 CB ALA A 428 -10.782 -15.128 -6.722 1.00 0.00 C ATOM 0 H ALA A 428 -13.064 -14.326 -6.295 1.00 0.00 H new ATOM 0 HA ALA A 428 -11.161 -15.621 -4.676 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -9.733 -15.421 -6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -11.378 -15.961 -7.096 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -10.896 -14.273 -7.388 1.00 0.00 H new ATOM 773 N MET A 429 -10.757 -12.398 -5.041 1.00 0.00 N ATOM 774 CA MET A 429 -10.022 -11.240 -4.556 1.00 0.00 C ATOM 775 C MET A 429 -10.204 -11.078 -3.054 1.00 0.00 C ATOM 776 O MET A 429 -9.312 -10.593 -2.358 1.00 0.00 O ATOM 777 CB MET A 429 -10.490 -9.984 -5.289 1.00 0.00 C ATOM 778 CG MET A 429 -9.762 -9.752 -6.600 1.00 0.00 C ATOM 779 SD MET A 429 -9.565 -8.005 -6.987 1.00 0.00 S ATOM 780 CE MET A 429 -11.155 -7.378 -6.468 1.00 0.00 C ATOM 0 H MET A 429 -11.569 -12.169 -5.614 1.00 0.00 H new ATOM 0 HA MET A 429 -8.961 -11.391 -4.754 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.560 -10.062 -5.483 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.346 -9.118 -4.642 1.00 0.00 H new ATOM 0 HG2 MET A 429 -8.780 -10.222 -6.553 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.311 -10.239 -7.406 1.00 0.00 H new ATOM 0 HE1 MET A 429 -11.258 -6.341 -6.786 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.947 -7.976 -6.919 1.00 0.00 H new ATOM 0 HE3 MET A 429 -11.231 -7.434 -5.382 1.00 0.00 H new ATOM 790 N GLY A 430 -11.353 -11.515 -2.561 1.00 0.00 N ATOM 791 CA GLY A 430 -11.645 -11.421 -1.155 1.00 0.00 C ATOM 792 C GLY A 430 -10.822 -12.397 -0.361 1.00 0.00 C ATOM 793 O GLY A 430 -10.456 -12.122 0.777 1.00 0.00 O ATOM 0 H GLY A 430 -12.093 -11.937 -3.121 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.447 -10.407 -0.807 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -12.705 -11.614 -0.987 1.00 0.00 H new ATOM 797 N GLN A 431 -10.508 -13.531 -0.980 1.00 0.00 N ATOM 798 CA GLN A 431 -9.713 -14.568 -0.337 1.00 0.00 C ATOM 799 C GLN A 431 -8.365 -14.017 0.117 1.00 0.00 C ATOM 800 O GLN A 431 -7.835 -14.429 1.142 1.00 0.00 O ATOM 801 CB GLN A 431 -9.493 -15.750 -1.281 1.00 0.00 C ATOM 802 CG GLN A 431 -9.319 -17.076 -0.556 1.00 0.00 C ATOM 803 CD GLN A 431 -8.702 -18.146 -1.432 1.00 0.00 C ATOM 804 OE1 GLN A 431 -9.399 -18.835 -2.175 1.00 0.00 O ATOM 805 NE2 GLN A 431 -7.391 -18.306 -1.339 1.00 0.00 N ATOM 0 H GLN A 431 -10.795 -13.754 -1.933 1.00 0.00 H new ATOM 0 HA GLN A 431 -10.266 -14.912 0.537 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -10.341 -15.825 -1.962 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -8.610 -15.559 -1.891 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -8.691 -16.925 0.322 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -10.290 -17.420 -0.199 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -6.848 -17.714 -0.710 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -6.924 -19.022 -1.896 1.00 0.00 H new ATOM 814 N ARG A 432 -7.825 -13.063 -0.633 1.00 0.00 N ATOM 815 CA ARG A 432 -6.536 -12.474 -0.289 1.00 0.00 C ATOM 816 C ARG A 432 -6.644 -11.654 0.992 1.00 0.00 C ATOM 817 O ARG A 432 -5.722 -11.631 1.802 1.00 0.00 O ATOM 818 CB ARG A 432 -6.007 -11.614 -1.432 1.00 0.00 C ATOM 819 CG ARG A 432 -4.491 -11.669 -1.573 1.00 0.00 C ATOM 820 CD ARG A 432 -4.058 -12.526 -2.758 1.00 0.00 C ATOM 821 NE ARG A 432 -3.293 -13.704 -2.332 1.00 0.00 N ATOM 822 CZ ARG A 432 -3.810 -14.738 -1.655 1.00 0.00 C ATOM 823 NH1 ARG A 432 -5.120 -14.849 -1.493 1.00 0.00 N ATOM 824 NH2 ARG A 432 -3.019 -15.690 -1.182 1.00 0.00 N ATOM 0 H ARG A 432 -8.255 -12.683 -1.476 1.00 0.00 H new ATOM 0 HA ARG A 432 -5.829 -13.286 -0.120 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -6.464 -11.941 -2.366 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -6.313 -10.580 -1.272 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -4.101 -10.658 -1.695 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -4.056 -12.070 -0.657 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.938 -12.847 -3.315 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -3.452 -11.926 -3.437 1.00 0.00 H new ATOM 0 HE ARG A 432 -2.301 -13.738 -2.567 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -5.744 -14.144 -1.885 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -5.505 -15.640 -0.976 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -2.012 -15.638 -1.333 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -3.418 -16.475 -0.667 1.00 0.00 H new ATOM 838 N MET A 433 -7.778 -10.985 1.169 1.00 0.00 N ATOM 839 CA MET A 433 -8.015 -10.193 2.373 1.00 0.00 C ATOM 840 C MET A 433 -8.535 -11.108 3.471 1.00 0.00 C ATOM 841 O MET A 433 -8.584 -10.747 4.642 1.00 0.00 O ATOM 842 CB MET A 433 -9.022 -9.074 2.102 1.00 0.00 C ATOM 843 CG MET A 433 -8.440 -7.895 1.341 1.00 0.00 C ATOM 844 SD MET A 433 -9.707 -6.929 0.500 1.00 0.00 S ATOM 845 CE MET A 433 -10.404 -8.169 -0.584 1.00 0.00 C ATOM 0 H MET A 433 -8.546 -10.974 0.498 1.00 0.00 H new ATOM 0 HA MET A 433 -7.078 -9.732 2.686 1.00 0.00 H new ATOM 0 HB2 MET A 433 -9.860 -9.481 1.536 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.421 -8.719 3.052 1.00 0.00 H new ATOM 0 HG2 MET A 433 -7.896 -7.252 2.033 1.00 0.00 H new ATOM 0 HG3 MET A 433 -7.718 -8.259 0.609 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.566 -7.739 -1.572 1.00 0.00 H new ATOM 0 HE2 MET A 433 -9.717 -9.011 -0.663 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.355 -8.514 -0.178 1.00 0.00 H new ATOM 855 N PHE A 434 -8.935 -12.300 3.063 1.00 0.00 N ATOM 856 CA PHE A 434 -9.437 -13.305 3.977 1.00 0.00 C ATOM 857 C PHE A 434 -8.263 -14.012 4.646 1.00 0.00 C ATOM 858 O PHE A 434 -8.356 -14.453 5.789 1.00 0.00 O ATOM 859 CB PHE A 434 -10.332 -14.291 3.220 1.00 0.00 C ATOM 860 CG PHE A 434 -11.772 -13.861 3.151 1.00 0.00 C ATOM 861 CD1 PHE A 434 -12.309 -13.022 4.115 1.00 0.00 C ATOM 862 CD2 PHE A 434 -12.584 -14.283 2.109 1.00 0.00 C ATOM 863 CE1 PHE A 434 -13.628 -12.616 4.043 1.00 0.00 C ATOM 864 CE2 PHE A 434 -13.903 -13.879 2.032 1.00 0.00 C ATOM 865 CZ PHE A 434 -14.425 -13.043 3.000 1.00 0.00 C ATOM 0 H PHE A 434 -8.920 -12.596 2.087 1.00 0.00 H new ATOM 0 HA PHE A 434 -10.040 -12.837 4.755 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -9.949 -14.414 2.207 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -10.275 -15.266 3.703 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -11.690 -12.682 4.932 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -12.181 -14.935 1.349 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -14.035 -11.965 4.802 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -14.525 -14.216 1.216 1.00 0.00 H new ATOM 0 HZ PHE A 434 -15.455 -12.724 2.941 1.00 0.00 H new ATOM 875 N GLU A 435 -7.148 -14.080 3.922 1.00 0.00 N ATOM 876 CA GLU A 435 -5.914 -14.686 4.424 1.00 0.00 C ATOM 877 C GLU A 435 -5.113 -13.641 5.209 1.00 0.00 C ATOM 878 O GLU A 435 -3.897 -13.745 5.365 1.00 0.00 O ATOM 879 CB GLU A 435 -5.070 -15.220 3.255 1.00 0.00 C ATOM 880 CG GLU A 435 -5.659 -16.443 2.561 1.00 0.00 C ATOM 881 CD GLU A 435 -5.045 -16.699 1.192 1.00 0.00 C ATOM 882 OE1 GLU A 435 -3.806 -16.861 1.100 1.00 0.00 O ATOM 883 OE2 GLU A 435 -5.796 -16.732 0.189 1.00 0.00 O ATOM 0 H GLU A 435 -7.073 -13.717 2.972 1.00 0.00 H new ATOM 0 HA GLU A 435 -6.168 -15.518 5.081 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -4.945 -14.425 2.520 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -4.076 -15.471 3.625 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -5.509 -17.320 3.191 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -6.735 -16.310 2.452 1.00 0.00 H new ATOM 890 N ASP A 436 -5.824 -12.631 5.692 1.00 0.00 N ATOM 891 CA ASP A 436 -5.229 -11.531 6.451 1.00 0.00 C ATOM 892 C ASP A 436 -5.497 -11.696 7.945 1.00 0.00 C ATOM 893 O ASP A 436 -4.769 -11.157 8.782 1.00 0.00 O ATOM 894 CB ASP A 436 -5.801 -10.199 5.933 1.00 0.00 C ATOM 895 CG ASP A 436 -5.854 -9.086 6.972 1.00 0.00 C ATOM 896 OD1 ASP A 436 -6.819 -9.045 7.761 1.00 0.00 O ATOM 897 OD2 ASP A 436 -4.946 -8.226 6.967 1.00 0.00 O ATOM 0 H ASP A 436 -6.833 -12.548 5.570 1.00 0.00 H new ATOM 0 HA ASP A 436 -4.148 -11.537 6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -5.198 -9.863 5.090 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -6.808 -10.374 5.555 1.00 0.00 H new ATOM 1036 N GLU B 7 6.619 -6.064 -13.420 1.00 0.00 N ATOM 1037 CA GLU B 7 5.708 -4.934 -13.487 1.00 0.00 C ATOM 1038 C GLU B 7 6.055 -3.835 -12.480 1.00 0.00 C ATOM 1039 O GLU B 7 5.439 -3.754 -11.421 1.00 0.00 O ATOM 1040 CB GLU B 7 4.251 -5.385 -13.257 1.00 0.00 C ATOM 1041 CG GLU B 7 4.091 -6.870 -12.947 1.00 0.00 C ATOM 1042 CD GLU B 7 2.815 -7.190 -12.177 1.00 0.00 C ATOM 1043 OE1 GLU B 7 1.741 -6.654 -12.526 1.00 0.00 O ATOM 1044 OE2 GLU B 7 2.877 -7.991 -11.216 1.00 0.00 O ATOM 0 HA GLU B 7 5.815 -4.520 -14.490 1.00 0.00 H new ATOM 0 HB2 GLU B 7 3.831 -4.807 -12.434 1.00 0.00 H new ATOM 0 HB3 GLU B 7 3.666 -5.147 -14.145 1.00 0.00 H new ATOM 0 HG2 GLU B 7 4.094 -7.432 -13.881 1.00 0.00 H new ATOM 0 HG3 GLU B 7 4.951 -7.208 -12.369 1.00 0.00 H new ATOM 1051 N VAL B 8 7.063 -3.011 -12.780 1.00 0.00 N ATOM 1052 CA VAL B 8 7.379 -1.891 -11.899 1.00 0.00 C ATOM 1053 C VAL B 8 6.203 -0.942 -11.969 1.00 0.00 C ATOM 1054 O VAL B 8 5.866 -0.421 -13.032 1.00 0.00 O ATOM 1055 CB VAL B 8 8.676 -1.157 -12.259 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.703 0.208 -11.585 1.00 0.00 C ATOM 1057 CG2 VAL B 8 9.863 -1.987 -11.810 1.00 0.00 C ATOM 0 H VAL B 8 7.658 -3.096 -13.604 1.00 0.00 H new ATOM 0 HA VAL B 8 7.547 -2.276 -10.893 1.00 0.00 H new ATOM 0 HB VAL B 8 8.726 -1.013 -13.338 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.627 0.724 -11.845 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.851 0.798 -11.923 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.650 0.081 -10.504 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.787 -1.468 -12.065 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.816 -2.136 -10.731 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.841 -2.955 -12.311 1.00 0.00 H new ATOM 1067 N LEU B 9 5.583 -0.742 -10.839 1.00 0.00 N ATOM 1068 CA LEU B 9 4.387 0.062 -10.753 1.00 0.00 C ATOM 1069 C LEU B 9 4.675 1.545 -10.737 1.00 0.00 C ATOM 1070 O LEU B 9 4.227 2.284 -11.611 1.00 0.00 O ATOM 1071 CB LEU B 9 3.617 -0.341 -9.499 1.00 0.00 C ATOM 1072 CG LEU B 9 3.754 -1.819 -9.146 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.474 -2.071 -7.684 1.00 0.00 C ATOM 1074 CD2 LEU B 9 2.834 -2.650 -10.004 1.00 0.00 C ATOM 0 H LEU B 9 5.890 -1.131 -9.948 1.00 0.00 H new ATOM 0 HA LEU B 9 3.792 -0.124 -11.647 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.968 0.258 -8.659 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.562 -0.106 -9.640 1.00 0.00 H new ATOM 0 HG LEU B 9 4.786 -2.111 -9.342 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.581 -3.135 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.180 -1.506 -7.076 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.458 -1.755 -7.448 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.943 -3.702 -9.741 1.00 0.00 H new ATOM 0 HD22 LEU B 9 1.802 -2.339 -9.838 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.091 -2.510 -11.054 1.00 0.00 H new ATOM 1086 N LEU B 10 5.419 1.982 -9.750 1.00 0.00 N ATOM 1087 CA LEU B 10 5.703 3.393 -9.625 1.00 0.00 C ATOM 1088 C LEU B 10 7.105 3.671 -9.117 1.00 0.00 C ATOM 1089 O LEU B 10 7.531 3.142 -8.090 1.00 0.00 O ATOM 1090 CB LEU B 10 4.686 4.006 -8.681 1.00 0.00 C ATOM 1091 CG LEU B 10 4.507 5.515 -8.785 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.742 5.881 -10.048 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.791 6.028 -7.548 1.00 0.00 C ATOM 0 H LEU B 10 5.834 1.391 -9.030 1.00 0.00 H new ATOM 0 HA LEU B 10 5.638 3.837 -10.618 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.721 3.532 -8.860 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.976 3.764 -7.659 1.00 0.00 H new ATOM 0 HG LEU B 10 5.488 5.987 -8.845 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.626 6.963 -10.102 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.293 5.531 -10.921 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.759 5.411 -10.027 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.663 7.108 -7.623 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.814 5.552 -7.469 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.381 5.793 -6.662 1.00 0.00 H new ATOM 1105 N ILE B 11 7.813 4.493 -9.867 1.00 0.00 N ATOM 1106 CA ILE B 11 9.149 4.919 -9.507 1.00 0.00 C ATOM 1107 C ILE B 11 9.073 6.350 -8.999 1.00 0.00 C ATOM 1108 O ILE B 11 8.992 7.290 -9.790 1.00 0.00 O ATOM 1109 CB ILE B 11 10.108 4.858 -10.716 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.354 3.406 -11.127 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.423 5.560 -10.396 1.00 0.00 C ATOM 1112 CD1 ILE B 11 11.163 3.267 -12.398 1.00 0.00 C ATOM 0 H ILE B 11 7.475 4.885 -10.746 1.00 0.00 H new ATOM 0 HA ILE B 11 9.537 4.250 -8.739 1.00 0.00 H new ATOM 0 HB ILE B 11 9.643 5.378 -11.553 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.872 2.891 -10.318 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.394 2.907 -11.260 1.00 0.00 H new ATOM 0 HG21 ILE B 11 12.084 5.506 -11.261 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.228 6.605 -10.153 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.898 5.072 -9.545 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.299 2.210 -12.629 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.637 3.753 -13.219 1.00 0.00 H new ATOM 0 HD13 ILE B 11 12.137 3.737 -12.262 1.00 0.00 H new ATOM 1124 N VAL B 12 9.060 6.527 -7.689 1.00 0.00 N ATOM 1125 CA VAL B 12 8.976 7.857 -7.138 1.00 0.00 C ATOM 1126 C VAL B 12 10.345 8.326 -6.701 1.00 0.00 C ATOM 1127 O VAL B 12 11.108 7.563 -6.117 1.00 0.00 O ATOM 1128 CB VAL B 12 8.014 7.912 -5.937 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.530 9.331 -5.707 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.840 6.970 -6.144 1.00 0.00 C ATOM 0 H VAL B 12 9.106 5.775 -7.001 1.00 0.00 H new ATOM 0 HA VAL B 12 8.590 8.512 -7.919 1.00 0.00 H new ATOM 0 HB VAL B 12 8.556 7.587 -5.049 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.851 9.350 -4.854 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.384 9.978 -5.506 1.00 0.00 H new ATOM 0 HG13 VAL B 12 7.007 9.685 -6.595 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.173 7.025 -5.283 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.296 7.259 -7.043 1.00 0.00 H new ATOM 0 HG23 VAL B 12 7.207 5.950 -6.254 1.00 0.00 H new ATOM 1140 N LYS B 13 10.665 9.565 -7.006 1.00 0.00 N ATOM 1141 CA LYS B 13 11.939 10.130 -6.618 1.00 0.00 C ATOM 1142 C LYS B 13 11.707 11.220 -5.590 1.00 0.00 C ATOM 1143 O LYS B 13 10.566 11.603 -5.348 1.00 0.00 O ATOM 1144 CB LYS B 13 12.717 10.656 -7.823 1.00 0.00 C ATOM 1145 CG LYS B 13 13.083 9.576 -8.827 1.00 0.00 C ATOM 1146 CD LYS B 13 13.871 8.449 -8.175 1.00 0.00 C ATOM 1147 CE LYS B 13 14.958 7.907 -9.092 1.00 0.00 C ATOM 1148 NZ LYS B 13 15.825 6.911 -8.401 1.00 0.00 N ATOM 0 H LYS B 13 10.059 10.202 -7.523 1.00 0.00 H new ATOM 0 HA LYS B 13 12.551 9.344 -6.175 1.00 0.00 H new ATOM 0 HB2 LYS B 13 12.122 11.420 -8.324 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.629 11.140 -7.473 1.00 0.00 H new ATOM 0 HG2 LYS B 13 12.175 9.173 -9.276 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.671 10.013 -9.634 1.00 0.00 H new ATOM 0 HD2 LYS B 13 14.323 8.810 -7.251 1.00 0.00 H new ATOM 0 HD3 LYS B 13 13.191 7.642 -7.903 1.00 0.00 H new ATOM 0 HE2 LYS B 13 14.498 7.444 -9.965 1.00 0.00 H new ATOM 0 HE3 LYS B 13 15.571 8.732 -9.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.452 6.455 -9.095 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 16.399 7.392 -7.679 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 15.230 6.190 -7.946 1.00 0.00 H new ATOM 1162 N LYS B 14 12.787 11.697 -4.980 1.00 0.00 N ATOM 1163 CA LYS B 14 12.715 12.707 -3.933 1.00 0.00 C ATOM 1164 C LYS B 14 12.014 12.139 -2.700 1.00 0.00 C ATOM 1165 O LYS B 14 11.587 12.880 -1.811 1.00 0.00 O ATOM 1166 CB LYS B 14 11.998 13.947 -4.446 1.00 0.00 C ATOM 1167 CG LYS B 14 12.915 14.992 -5.059 1.00 0.00 C ATOM 1168 CD LYS B 14 12.197 16.324 -5.224 1.00 0.00 C ATOM 1169 CE LYS B 14 12.941 17.452 -4.521 1.00 0.00 C ATOM 1170 NZ LYS B 14 12.019 18.524 -4.061 1.00 0.00 N ATOM 0 H LYS B 14 13.736 11.394 -5.198 1.00 0.00 H new ATOM 0 HA LYS B 14 13.727 12.994 -3.647 1.00 0.00 H new ATOM 0 HB2 LYS B 14 11.262 13.645 -5.191 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.449 14.402 -3.622 1.00 0.00 H new ATOM 0 HG2 LYS B 14 13.793 15.125 -4.427 1.00 0.00 H new ATOM 0 HG3 LYS B 14 13.270 14.644 -6.029 1.00 0.00 H new ATOM 0 HD2 LYS B 14 12.100 16.557 -6.284 1.00 0.00 H new ATOM 0 HD3 LYS B 14 11.187 16.246 -4.821 1.00 0.00 H new ATOM 0 HE2 LYS B 14 13.485 17.050 -3.666 1.00 0.00 H new ATOM 0 HE3 LYS B 14 13.681 17.876 -5.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 12.573 19.325 -3.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 11.433 18.844 -4.858 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 11.406 18.154 -3.307 1.00 0.00 H new ATOM 1184 N VAL B 15 11.907 10.816 -2.663 1.00 0.00 N ATOM 1185 CA VAL B 15 11.278 10.117 -1.552 1.00 0.00 C ATOM 1186 C VAL B 15 12.275 10.021 -0.408 1.00 0.00 C ATOM 1187 O VAL B 15 13.167 9.181 -0.423 1.00 0.00 O ATOM 1188 CB VAL B 15 10.815 8.703 -1.972 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.915 8.081 -0.926 1.00 0.00 C ATOM 1190 CG2 VAL B 15 10.094 8.753 -3.301 1.00 0.00 C ATOM 0 H VAL B 15 12.253 10.201 -3.400 1.00 0.00 H new ATOM 0 HA VAL B 15 10.396 10.674 -1.236 1.00 0.00 H new ATOM 0 HB VAL B 15 11.706 8.083 -2.069 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.608 7.088 -1.254 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.455 8.001 0.017 1.00 0.00 H new ATOM 0 HG13 VAL B 15 9.033 8.706 -0.787 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.776 7.749 -3.580 1.00 0.00 H new ATOM 0 HG22 VAL B 15 9.221 9.400 -3.217 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.765 9.146 -4.065 1.00 0.00 H new ATOM 1200 N ARG B 16 12.122 10.886 0.577 1.00 0.00 N ATOM 1201 CA ARG B 16 13.039 10.939 1.698 1.00 0.00 C ATOM 1202 C ARG B 16 12.600 10.044 2.847 1.00 0.00 C ATOM 1203 O ARG B 16 11.699 10.383 3.608 1.00 0.00 O ATOM 1204 CB ARG B 16 13.177 12.383 2.189 1.00 0.00 C ATOM 1205 CG ARG B 16 13.156 13.409 1.068 1.00 0.00 C ATOM 1206 CD ARG B 16 13.516 14.797 1.567 1.00 0.00 C ATOM 1207 NE ARG B 16 14.964 14.993 1.656 1.00 0.00 N ATOM 1208 CZ ARG B 16 15.544 16.119 2.059 1.00 0.00 C ATOM 1209 NH1 ARG B 16 14.804 17.154 2.445 1.00 0.00 N ATOM 1210 NH2 ARG B 16 16.868 16.206 2.070 1.00 0.00 N ATOM 0 H ARG B 16 11.364 11.567 0.622 1.00 0.00 H new ATOM 0 HA ARG B 16 14.003 10.570 1.347 1.00 0.00 H new ATOM 0 HB2 ARG B 16 12.367 12.601 2.885 1.00 0.00 H new ATOM 0 HB3 ARG B 16 14.110 12.482 2.744 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.857 13.110 0.288 1.00 0.00 H new ATOM 0 HG3 ARG B 16 12.165 13.432 0.614 1.00 0.00 H new ATOM 0 HD2 ARG B 16 13.090 15.544 0.897 1.00 0.00 H new ATOM 0 HD3 ARG B 16 13.068 14.956 2.548 1.00 0.00 H new ATOM 0 HE ARG B 16 15.567 14.214 1.391 1.00 0.00 H new ATOM 0 HH11 ARG B 16 13.786 17.086 2.433 1.00 0.00 H new ATOM 0 HH12 ARG B 16 15.254 18.016 2.753 1.00 0.00 H new ATOM 0 HH21 ARG B 16 17.434 15.412 1.770 1.00 0.00 H new ATOM 0 HH22 ARG B 16 17.320 17.067 2.378 1.00 0.00 H new ATOM 1224 N GLN B 17 13.245 8.899 2.972 1.00 0.00 N ATOM 1225 CA GLN B 17 12.955 7.980 4.057 1.00 0.00 C ATOM 1226 C GLN B 17 13.761 8.426 5.262 1.00 0.00 C ATOM 1227 O GLN B 17 14.986 8.374 5.235 1.00 0.00 O ATOM 1228 CB GLN B 17 13.318 6.546 3.658 1.00 0.00 C ATOM 1229 CG GLN B 17 13.268 5.541 4.798 1.00 0.00 C ATOM 1230 CD GLN B 17 14.647 5.050 5.198 1.00 0.00 C ATOM 1231 OE1 GLN B 17 15.200 4.144 4.582 1.00 0.00 O ATOM 1232 NE2 GLN B 17 15.207 5.639 6.242 1.00 0.00 N ATOM 0 H GLN B 17 13.975 8.583 2.334 1.00 0.00 H new ATOM 0 HA GLN B 17 11.891 7.989 4.292 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.638 6.218 2.872 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.322 6.544 3.233 1.00 0.00 H new ATOM 0 HG2 GLN B 17 12.784 5.998 5.661 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.654 4.690 4.502 1.00 0.00 H new ATOM 0 HE21 GLN B 17 14.716 6.389 6.729 1.00 0.00 H new ATOM 0 HE22 GLN B 17 16.130 5.343 6.560 1.00 0.00 H new ATOM 1241 N LYS B 18 13.077 8.907 6.294 1.00 0.00 N ATOM 1242 CA LYS B 18 13.747 9.400 7.495 1.00 0.00 C ATOM 1243 C LYS B 18 14.654 10.571 7.120 1.00 0.00 C ATOM 1244 O LYS B 18 15.741 10.729 7.668 1.00 0.00 O ATOM 1245 CB LYS B 18 14.560 8.286 8.172 1.00 0.00 C ATOM 1246 CG LYS B 18 14.738 8.481 9.669 1.00 0.00 C ATOM 1247 CD LYS B 18 16.089 7.974 10.153 1.00 0.00 C ATOM 1248 CE LYS B 18 17.220 8.922 9.772 1.00 0.00 C ATOM 1249 NZ LYS B 18 16.937 10.321 10.180 1.00 0.00 N ATOM 0 H LYS B 18 12.059 8.967 6.325 1.00 0.00 H new ATOM 0 HA LYS B 18 12.993 9.736 8.207 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.067 7.330 7.995 1.00 0.00 H new ATOM 0 HB3 LYS B 18 15.542 8.229 7.703 1.00 0.00 H new ATOM 0 HG2 LYS B 18 14.640 9.539 9.911 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.943 7.958 10.200 1.00 0.00 H new ATOM 0 HD2 LYS B 18 16.065 7.854 11.236 1.00 0.00 H new ATOM 0 HD3 LYS B 18 16.281 6.989 9.727 1.00 0.00 H new ATOM 0 HE2 LYS B 18 18.146 8.588 10.241 1.00 0.00 H new ATOM 0 HE3 LYS B 18 17.377 8.884 8.694 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 17.827 10.796 10.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 16.486 10.828 9.392 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 16.299 10.321 11.001 1.00 0.00 H new ATOM 1263 N LYS B 19 14.174 11.373 6.159 1.00 0.00 N ATOM 1264 CA LYS B 19 14.882 12.554 5.641 1.00 0.00 C ATOM 1265 C LYS B 19 15.927 12.186 4.588 1.00 0.00 C ATOM 1266 O LYS B 19 16.560 13.069 4.014 1.00 0.00 O ATOM 1267 CB LYS B 19 15.533 13.382 6.755 1.00 0.00 C ATOM 1268 CG LYS B 19 14.673 14.535 7.253 1.00 0.00 C ATOM 1269 CD LYS B 19 13.516 14.049 8.110 1.00 0.00 C ATOM 1270 CE LYS B 19 14.009 13.296 9.336 1.00 0.00 C ATOM 1271 NZ LYS B 19 12.902 12.583 10.023 1.00 0.00 N ATOM 0 H LYS B 19 13.270 11.218 5.713 1.00 0.00 H new ATOM 0 HA LYS B 19 14.117 13.168 5.166 1.00 0.00 H new ATOM 0 HB2 LYS B 19 15.764 12.726 7.594 1.00 0.00 H new ATOM 0 HB3 LYS B 19 16.481 13.780 6.392 1.00 0.00 H new ATOM 0 HG2 LYS B 19 15.289 15.224 7.831 1.00 0.00 H new ATOM 0 HG3 LYS B 19 14.285 15.093 6.401 1.00 0.00 H new ATOM 0 HD2 LYS B 19 12.911 14.900 8.423 1.00 0.00 H new ATOM 0 HD3 LYS B 19 12.871 13.400 7.518 1.00 0.00 H new ATOM 0 HE2 LYS B 19 14.775 12.580 9.040 1.00 0.00 H new ATOM 0 HE3 LYS B 19 14.477 13.995 10.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 13.269 12.109 10.873 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 12.167 13.266 10.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 12.494 11.875 9.380 1.00 0.00 H new ATOM 1285 N GLN B 20 16.098 10.895 4.317 1.00 0.00 N ATOM 1286 CA GLN B 20 17.061 10.458 3.315 1.00 0.00 C ATOM 1287 C GLN B 20 16.407 10.511 1.948 1.00 0.00 C ATOM 1288 O GLN B 20 15.640 9.621 1.593 1.00 0.00 O ATOM 1289 CB GLN B 20 17.547 9.032 3.597 1.00 0.00 C ATOM 1290 CG GLN B 20 18.809 8.954 4.442 1.00 0.00 C ATOM 1291 CD GLN B 20 18.569 9.293 5.899 1.00 0.00 C ATOM 1292 OE1 GLN B 20 18.213 8.428 6.699 1.00 0.00 O ATOM 1293 NE2 GLN B 20 18.773 10.551 6.252 1.00 0.00 N ATOM 0 H GLN B 20 15.586 10.140 4.774 1.00 0.00 H new ATOM 0 HA GLN B 20 17.925 11.122 3.348 1.00 0.00 H new ATOM 0 HB2 GLN B 20 16.752 8.483 4.102 1.00 0.00 H new ATOM 0 HB3 GLN B 20 17.728 8.529 2.647 1.00 0.00 H new ATOM 0 HG2 GLN B 20 19.224 7.949 4.372 1.00 0.00 H new ATOM 0 HG3 GLN B 20 19.555 9.636 4.034 1.00 0.00 H new ATOM 0 HE21 GLN B 20 19.068 11.235 5.555 1.00 0.00 H new ATOM 0 HE22 GLN B 20 18.636 10.837 7.221 1.00 0.00 H new ATOM 1302 N ASP B 21 16.679 11.565 1.197 1.00 0.00 N ATOM 1303 CA ASP B 21 16.090 11.724 -0.126 1.00 0.00 C ATOM 1304 C ASP B 21 16.554 10.633 -1.076 1.00 0.00 C ATOM 1305 O ASP B 21 17.727 10.535 -1.430 1.00 0.00 O ATOM 1306 CB ASP B 21 16.393 13.099 -0.720 1.00 0.00 C ATOM 1307 CG ASP B 21 17.714 13.676 -0.248 1.00 0.00 C ATOM 1308 OD1 ASP B 21 17.803 14.045 0.947 1.00 0.00 O ATOM 1309 OD2 ASP B 21 18.647 13.775 -1.062 1.00 0.00 O ATOM 0 H ASP B 21 17.302 12.322 1.478 1.00 0.00 H new ATOM 0 HA ASP B 21 15.011 11.638 -0.000 1.00 0.00 H new ATOM 0 HB2 ASP B 21 16.405 13.023 -1.807 1.00 0.00 H new ATOM 0 HB3 ASP B 21 15.589 13.786 -0.457 1.00 0.00 H new ATOM 1314 N GLY B 22 15.615 9.794 -1.458 1.00 0.00 N ATOM 1315 CA GLY B 22 15.899 8.723 -2.359 1.00 0.00 C ATOM 1316 C GLY B 22 14.786 8.472 -3.346 1.00 0.00 C ATOM 1317 O GLY B 22 14.329 9.385 -4.038 1.00 0.00 O ATOM 0 H GLY B 22 14.644 9.843 -1.150 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.816 8.947 -2.903 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.082 7.813 -1.787 1.00 0.00 H new ATOM 1321 N ALA B 23 14.336 7.235 -3.388 1.00 0.00 N ATOM 1322 CA ALA B 23 13.306 6.821 -4.309 1.00 0.00 C ATOM 1323 C ALA B 23 12.473 5.694 -3.740 1.00 0.00 C ATOM 1324 O ALA B 23 13.006 4.747 -3.162 1.00 0.00 O ATOM 1325 CB ALA B 23 13.952 6.357 -5.592 1.00 0.00 C ATOM 0 H ALA B 23 14.677 6.489 -2.782 1.00 0.00 H new ATOM 0 HA ALA B 23 12.649 7.671 -4.492 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.181 6.042 -6.295 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.526 7.175 -6.027 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.616 5.519 -5.382 1.00 0.00 H new ATOM 1331 N LEU B 24 11.172 5.788 -3.923 1.00 0.00 N ATOM 1332 CA LEU B 24 10.271 4.764 -3.449 1.00 0.00 C ATOM 1333 C LEU B 24 9.814 3.976 -4.669 1.00 0.00 C ATOM 1334 O LEU B 24 9.066 4.483 -5.505 1.00 0.00 O ATOM 1335 CB LEU B 24 9.078 5.383 -2.724 1.00 0.00 C ATOM 1336 CG LEU B 24 8.514 4.549 -1.573 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.053 4.876 -1.332 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.698 3.065 -1.819 1.00 0.00 C ATOM 0 H LEU B 24 10.716 6.567 -4.399 1.00 0.00 H new ATOM 0 HA LEU B 24 10.771 4.111 -2.733 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.375 6.357 -2.335 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.283 5.558 -3.449 1.00 0.00 H new ATOM 0 HG LEU B 24 9.076 4.808 -0.676 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.675 4.270 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.953 5.932 -1.081 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.479 4.662 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.286 2.503 -0.981 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.181 2.781 -2.736 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.760 2.842 -1.918 1.00 0.00 H new ATOM 1350 N TYR B 25 10.296 2.757 -4.784 1.00 0.00 N ATOM 1351 CA TYR B 25 9.978 1.918 -5.925 1.00 0.00 C ATOM 1352 C TYR B 25 8.897 0.890 -5.626 1.00 0.00 C ATOM 1353 O TYR B 25 9.110 -0.035 -4.840 1.00 0.00 O ATOM 1354 CB TYR B 25 11.225 1.166 -6.379 1.00 0.00 C ATOM 1355 CG TYR B 25 12.070 1.894 -7.386 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.545 3.167 -7.128 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.407 1.294 -8.588 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.335 3.827 -8.040 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.194 1.945 -9.511 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.658 3.215 -9.233 1.00 0.00 C ATOM 1361 OH TYR B 25 14.452 3.876 -10.146 1.00 0.00 O ATOM 0 H TYR B 25 10.913 2.321 -4.099 1.00 0.00 H new ATOM 0 HA TYR B 25 9.608 2.588 -6.702 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.837 0.945 -5.505 1.00 0.00 H new ATOM 0 HB3 TYR B 25 10.920 0.210 -6.805 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.292 3.650 -6.196 1.00 0.00 H new ATOM 0 HD2 TYR B 25 12.046 0.299 -8.805 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.701 4.820 -7.823 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.446 1.466 -10.445 1.00 0.00 H new ATOM 0 HH TYR B 25 14.587 3.308 -10.933 1.00 0.00 H new ATOM 1371 N LEU B 26 7.742 1.048 -6.245 1.00 0.00 N ATOM 1372 CA LEU B 26 6.685 0.067 -6.094 1.00 0.00 C ATOM 1373 C LEU B 26 6.872 -0.941 -7.192 1.00 0.00 C ATOM 1374 O LEU B 26 6.662 -0.623 -8.361 1.00 0.00 O ATOM 1375 CB LEU B 26 5.282 0.664 -6.224 1.00 0.00 C ATOM 1376 CG LEU B 26 5.056 1.998 -5.543 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.710 2.569 -5.945 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.110 1.858 -4.038 1.00 0.00 C ATOM 0 H LEU B 26 7.514 1.837 -6.850 1.00 0.00 H new ATOM 0 HA LEU B 26 6.754 -0.363 -5.095 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.055 0.778 -7.284 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.566 -0.052 -5.820 1.00 0.00 H new ATOM 0 HG LEU B 26 5.851 2.673 -5.860 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.559 3.528 -5.449 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.683 2.711 -7.025 1.00 0.00 H new ATOM 0 HD13 LEU B 26 2.919 1.879 -5.650 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.944 2.831 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.337 1.164 -3.709 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.088 1.478 -3.743 1.00 0.00 H new ATOM 1390 N MET B 27 7.302 -2.130 -6.855 1.00 0.00 N ATOM 1391 CA MET B 27 7.504 -3.129 -7.870 1.00 0.00 C ATOM 1392 C MET B 27 6.367 -4.112 -7.894 1.00 0.00 C ATOM 1393 O MET B 27 5.536 -4.127 -6.991 1.00 0.00 O ATOM 1394 CB MET B 27 8.842 -3.847 -7.708 1.00 0.00 C ATOM 1395 CG MET B 27 9.979 -3.196 -8.472 1.00 0.00 C ATOM 1396 SD MET B 27 11.558 -3.365 -7.630 1.00 0.00 S ATOM 1397 CE MET B 27 11.335 -2.150 -6.343 1.00 0.00 C ATOM 0 H MET B 27 7.516 -2.426 -5.903 1.00 0.00 H new ATOM 0 HA MET B 27 7.529 -2.611 -8.829 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.100 -3.882 -6.650 1.00 0.00 H new ATOM 0 HB3 MET B 27 8.734 -4.878 -8.044 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.050 -3.643 -9.463 1.00 0.00 H new ATOM 0 HG3 MET B 27 9.758 -2.138 -8.615 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.166 -1.445 -6.361 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.400 -1.614 -6.507 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.302 -2.648 -5.374 1.00 0.00 H new ATOM 1407 N ALA B 28 6.408 -4.972 -8.896 1.00 0.00 N ATOM 1408 CA ALA B 28 5.364 -5.943 -9.164 1.00 0.00 C ATOM 1409 C ALA B 28 4.750 -6.563 -7.917 1.00 0.00 C ATOM 1410 O ALA B 28 3.542 -6.474 -7.716 1.00 0.00 O ATOM 1411 CB ALA B 28 5.912 -7.034 -10.050 1.00 0.00 C ATOM 0 H ALA B 28 7.183 -5.015 -9.558 1.00 0.00 H new ATOM 0 HA ALA B 28 4.560 -5.397 -9.657 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.130 -7.765 -10.253 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.257 -6.601 -10.989 1.00 0.00 H new ATOM 0 HB3 ALA B 28 6.746 -7.525 -9.549 1.00 0.00 H new ATOM 1417 N GLU B 29 5.576 -7.157 -7.065 1.00 0.00 N ATOM 1418 CA GLU B 29 5.066 -7.798 -5.861 1.00 0.00 C ATOM 1419 C GLU B 29 5.823 -7.370 -4.613 1.00 0.00 C ATOM 1420 O GLU B 29 5.731 -8.025 -3.570 1.00 0.00 O ATOM 1421 CB GLU B 29 5.115 -9.322 -6.004 1.00 0.00 C ATOM 1422 CG GLU B 29 6.367 -9.849 -6.681 1.00 0.00 C ATOM 1423 CD GLU B 29 7.208 -10.697 -5.755 1.00 0.00 C ATOM 1424 OE1 GLU B 29 6.647 -11.606 -5.094 1.00 0.00 O ATOM 1425 OE2 GLU B 29 8.430 -10.451 -5.677 1.00 0.00 O ATOM 0 H GLU B 29 6.588 -7.208 -7.183 1.00 0.00 H new ATOM 0 HA GLU B 29 4.031 -7.476 -5.744 1.00 0.00 H new ATOM 0 HB2 GLU B 29 5.036 -9.770 -5.014 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.244 -9.649 -6.572 1.00 0.00 H new ATOM 0 HG2 GLU B 29 6.085 -10.439 -7.553 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.962 -9.010 -7.042 1.00 0.00 H new ATOM 1432 N ARG B 30 6.539 -6.261 -4.689 1.00 0.00 N ATOM 1433 CA ARG B 30 7.292 -5.802 -3.536 1.00 0.00 C ATOM 1434 C ARG B 30 7.600 -4.320 -3.629 1.00 0.00 C ATOM 1435 O ARG B 30 7.844 -3.785 -4.708 1.00 0.00 O ATOM 1436 CB ARG B 30 8.585 -6.614 -3.373 1.00 0.00 C ATOM 1437 CG ARG B 30 9.723 -6.168 -4.277 1.00 0.00 C ATOM 1438 CD ARG B 30 10.652 -7.322 -4.612 1.00 0.00 C ATOM 1439 NE ARG B 30 10.077 -8.205 -5.625 1.00 0.00 N ATOM 1440 CZ ARG B 30 10.130 -7.970 -6.934 1.00 0.00 C ATOM 1441 NH1 ARG B 30 10.730 -6.883 -7.400 1.00 0.00 N ATOM 1442 NH2 ARG B 30 9.580 -8.827 -7.779 1.00 0.00 N ATOM 0 H ARG B 30 6.614 -5.673 -5.519 1.00 0.00 H new ATOM 0 HA ARG B 30 6.672 -5.958 -2.653 1.00 0.00 H new ATOM 0 HB2 ARG B 30 8.913 -6.548 -2.336 1.00 0.00 H new ATOM 0 HB3 ARG B 30 8.368 -7.664 -3.572 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.315 -5.749 -5.197 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.288 -5.375 -3.788 1.00 0.00 H new ATOM 0 HD2 ARG B 30 11.604 -6.930 -4.970 1.00 0.00 H new ATOM 0 HD3 ARG B 30 10.862 -7.894 -3.708 1.00 0.00 H new ATOM 0 HE ARG B 30 9.606 -9.053 -5.309 1.00 0.00 H new ATOM 0 HH11 ARG B 30 11.156 -6.219 -6.754 1.00 0.00 H new ATOM 0 HH12 ARG B 30 10.766 -6.711 -8.405 1.00 0.00 H new ATOM 0 HH21 ARG B 30 9.117 -9.665 -7.427 1.00 0.00 H new ATOM 0 HH22 ARG B 30 9.619 -8.650 -8.783 1.00 0.00 H new ATOM 1456 N ILE B 31 7.573 -3.669 -2.489 1.00 0.00 N ATOM 1457 CA ILE B 31 7.858 -2.256 -2.402 1.00 0.00 C ATOM 1458 C ILE B 31 9.259 -2.073 -1.837 1.00 0.00 C ATOM 1459 O ILE B 31 9.560 -2.525 -0.731 1.00 0.00 O ATOM 1460 CB ILE B 31 6.808 -1.522 -1.530 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.273 -0.104 -1.197 1.00 0.00 C ATOM 1462 CG2 ILE B 31 6.509 -2.311 -0.259 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.159 0.801 -0.720 1.00 0.00 C ATOM 0 H ILE B 31 7.352 -4.106 -1.594 1.00 0.00 H new ATOM 0 HA ILE B 31 7.806 -1.817 -3.398 1.00 0.00 H new ATOM 0 HB ILE B 31 5.884 -1.447 -2.104 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.044 -0.154 -0.428 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.734 0.336 -2.082 1.00 0.00 H new ATOM 0 HG21 ILE B 31 5.769 -1.775 0.336 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.119 -3.294 -0.524 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.425 -2.428 0.320 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.562 1.790 -0.502 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.398 0.882 -1.496 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.713 0.384 0.183 1.00 0.00 H new ATOM 1475 N ALA B 32 10.127 -1.450 -2.610 1.00 0.00 N ATOM 1476 CA ALA B 32 11.498 -1.246 -2.179 1.00 0.00 C ATOM 1477 C ALA B 32 11.925 0.202 -2.352 1.00 0.00 C ATOM 1478 O ALA B 32 11.643 0.833 -3.363 1.00 0.00 O ATOM 1479 CB ALA B 32 12.430 -2.178 -2.934 1.00 0.00 C ATOM 0 H ALA B 32 9.910 -1.078 -3.535 1.00 0.00 H new ATOM 0 HA ALA B 32 11.556 -1.479 -1.116 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.455 -2.015 -2.602 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.146 -3.212 -2.740 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.359 -1.976 -4.003 1.00 0.00 H new ATOM 1485 N TRP B 33 12.606 0.718 -1.351 1.00 0.00 N ATOM 1486 CA TRP B 33 13.075 2.087 -1.361 1.00 0.00 C ATOM 1487 C TRP B 33 14.604 2.134 -1.333 1.00 0.00 C ATOM 1488 O TRP B 33 15.247 1.281 -0.715 1.00 0.00 O ATOM 1489 CB TRP B 33 12.487 2.812 -0.139 1.00 0.00 C ATOM 1490 CG TRP B 33 12.924 4.243 0.018 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.187 5.365 -0.223 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.205 4.697 0.457 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.944 6.485 0.033 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.184 6.095 0.451 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.367 4.044 0.849 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.287 6.854 0.822 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.462 4.786 1.208 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.419 6.188 1.196 1.00 0.00 C ATOM 0 H TRP B 33 12.850 0.200 -0.507 1.00 0.00 H new ATOM 0 HA TRP B 33 12.748 2.582 -2.276 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.399 2.785 -0.207 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.764 2.262 0.760 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.162 5.373 -0.564 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.630 7.450 -0.072 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.407 2.965 0.871 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.250 7.933 0.815 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.371 4.284 1.504 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.295 6.749 1.487 1.00 0.00 H new ATOM 1509 N ALA B 34 15.173 3.133 -2.005 1.00 0.00 N ATOM 1510 CA ALA B 34 16.621 3.347 -2.035 1.00 0.00 C ATOM 1511 C ALA B 34 16.905 4.832 -2.225 1.00 0.00 C ATOM 1512 O ALA B 34 16.121 5.513 -2.864 1.00 0.00 O ATOM 1513 CB ALA B 34 17.261 2.545 -3.138 1.00 0.00 C ATOM 0 H ALA B 34 14.644 3.818 -2.545 1.00 0.00 H new ATOM 0 HA ALA B 34 17.048 3.012 -1.090 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.337 2.721 -3.139 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.067 1.485 -2.976 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.843 2.848 -4.098 1.00 0.00 H new ATOM 1519 N PRO B 35 18.018 5.364 -1.688 1.00 0.00 N ATOM 1520 CA PRO B 35 18.343 6.793 -1.809 1.00 0.00 C ATOM 1521 C PRO B 35 18.741 7.184 -3.234 1.00 0.00 C ATOM 1522 O PRO B 35 19.120 6.324 -4.036 1.00 0.00 O ATOM 1523 CB PRO B 35 19.524 6.993 -0.844 1.00 0.00 C ATOM 1524 CG PRO B 35 19.655 5.713 -0.082 1.00 0.00 C ATOM 1525 CD PRO B 35 19.052 4.639 -0.942 1.00 0.00 C ATOM 0 HA PRO B 35 17.482 7.418 -1.573 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.440 7.218 -1.390 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.341 7.831 -0.171 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.701 5.495 0.133 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.139 5.778 0.876 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.791 4.190 -1.606 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.629 3.832 -0.344 1.00 0.00 H new ATOM 1533 N GLU B 36 18.656 8.498 -3.509 1.00 0.00 N ATOM 1534 CA GLU B 36 18.971 9.109 -4.814 1.00 0.00 C ATOM 1535 C GLU B 36 18.748 8.161 -6.000 1.00 0.00 C ATOM 1536 O GLU B 36 17.614 7.983 -6.471 1.00 0.00 O ATOM 1537 CB GLU B 36 20.400 9.683 -4.832 1.00 0.00 C ATOM 1538 CG GLU B 36 21.324 9.137 -3.746 1.00 0.00 C ATOM 1539 CD GLU B 36 22.084 7.906 -4.193 1.00 0.00 C ATOM 1540 OE1 GLU B 36 22.269 7.727 -5.415 1.00 0.00 O ATOM 1541 OE2 GLU B 36 22.497 7.102 -3.333 1.00 0.00 O ATOM 0 H GLU B 36 18.359 9.182 -2.813 1.00 0.00 H new ATOM 0 HA GLU B 36 18.263 9.929 -4.939 1.00 0.00 H new ATOM 0 HB2 GLU B 36 20.846 9.479 -5.805 1.00 0.00 H new ATOM 0 HB3 GLU B 36 20.342 10.767 -4.729 1.00 0.00 H new ATOM 0 HG2 GLU B 36 22.033 9.912 -3.455 1.00 0.00 H new ATOM 0 HG3 GLU B 36 20.735 8.895 -2.861 1.00 0.00 H new ATOM 1548 N GLY B 37 19.826 7.564 -6.483 1.00 0.00 N ATOM 1549 CA GLY B 37 19.744 6.645 -7.595 1.00 0.00 C ATOM 1550 C GLY B 37 20.552 5.394 -7.339 1.00 0.00 C ATOM 1551 O GLY B 37 21.314 4.948 -8.193 1.00 0.00 O ATOM 0 H GLY B 37 20.768 7.703 -6.118 1.00 0.00 H new ATOM 0 HA2 GLY B 37 18.702 6.377 -7.771 1.00 0.00 H new ATOM 0 HA3 GLY B 37 20.105 7.134 -8.500 1.00 0.00 H new ATOM 1555 N LYS B 38 20.400 4.841 -6.145 1.00 0.00 N ATOM 1556 CA LYS B 38 21.117 3.636 -5.766 1.00 0.00 C ATOM 1557 C LYS B 38 20.488 2.403 -6.402 1.00 0.00 C ATOM 1558 O LYS B 38 19.265 2.267 -6.435 1.00 0.00 O ATOM 1559 CB LYS B 38 21.140 3.489 -4.243 1.00 0.00 C ATOM 1560 CG LYS B 38 22.368 2.760 -3.718 1.00 0.00 C ATOM 1561 CD LYS B 38 23.447 3.729 -3.251 1.00 0.00 C ATOM 1562 CE LYS B 38 24.274 4.276 -4.409 1.00 0.00 C ATOM 1563 NZ LYS B 38 23.626 5.445 -5.061 1.00 0.00 N ATOM 0 H LYS B 38 19.784 5.210 -5.421 1.00 0.00 H new ATOM 0 HA LYS B 38 22.141 3.723 -6.130 1.00 0.00 H new ATOM 0 HB2 LYS B 38 21.095 4.480 -3.790 1.00 0.00 H new ATOM 0 HB3 LYS B 38 20.246 2.952 -3.925 1.00 0.00 H new ATOM 0 HG2 LYS B 38 22.079 2.112 -2.891 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.771 2.117 -4.501 1.00 0.00 H new ATOM 0 HD2 LYS B 38 22.982 4.557 -2.717 1.00 0.00 H new ATOM 0 HD3 LYS B 38 24.105 3.223 -2.544 1.00 0.00 H new ATOM 0 HE2 LYS B 38 25.259 4.566 -4.044 1.00 0.00 H new ATOM 0 HE3 LYS B 38 24.427 3.489 -5.148 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 23.339 5.189 -6.027 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 22.788 5.727 -4.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 24.298 6.238 -5.099 1.00 0.00 H new ATOM 1577 N ASP B 39 21.335 1.520 -6.916 1.00 0.00 N ATOM 1578 CA ASP B 39 20.883 0.286 -7.546 1.00 0.00 C ATOM 1579 C ASP B 39 20.417 -0.703 -6.484 1.00 0.00 C ATOM 1580 O ASP B 39 19.471 -1.463 -6.689 1.00 0.00 O ATOM 1581 CB ASP B 39 22.018 -0.327 -8.375 1.00 0.00 C ATOM 1582 CG ASP B 39 23.228 -0.680 -7.531 1.00 0.00 C ATOM 1583 OD1 ASP B 39 23.947 0.247 -7.092 1.00 0.00 O ATOM 1584 OD2 ASP B 39 23.459 -1.878 -7.282 1.00 0.00 O ATOM 0 H ASP B 39 22.348 1.638 -6.908 1.00 0.00 H new ATOM 0 HA ASP B 39 20.047 0.513 -8.207 1.00 0.00 H new ATOM 0 HB2 ASP B 39 21.654 -1.224 -8.876 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.315 0.375 -9.154 1.00 0.00 H new ATOM 1589 N ARG B 40 21.088 -0.676 -5.341 1.00 0.00 N ATOM 1590 CA ARG B 40 20.747 -1.553 -4.237 1.00 0.00 C ATOM 1591 C ARG B 40 19.770 -0.858 -3.303 1.00 0.00 C ATOM 1592 O ARG B 40 20.071 0.201 -2.748 1.00 0.00 O ATOM 1593 CB ARG B 40 22.003 -1.973 -3.473 1.00 0.00 C ATOM 1594 CG ARG B 40 22.596 -3.287 -3.954 1.00 0.00 C ATOM 1595 CD ARG B 40 24.115 -3.243 -3.963 1.00 0.00 C ATOM 1596 NE ARG B 40 24.622 -2.338 -4.991 1.00 0.00 N ATOM 1597 CZ ARG B 40 25.820 -1.764 -4.971 1.00 0.00 C ATOM 1598 NH1 ARG B 40 26.675 -2.025 -3.986 1.00 0.00 N ATOM 1599 NH2 ARG B 40 26.157 -0.924 -5.940 1.00 0.00 N ATOM 0 H ARG B 40 21.874 -0.053 -5.157 1.00 0.00 H new ATOM 0 HA ARG B 40 20.276 -2.450 -4.639 1.00 0.00 H new ATOM 0 HB2 ARG B 40 22.754 -1.189 -3.567 1.00 0.00 H new ATOM 0 HB3 ARG B 40 21.762 -2.059 -2.413 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.258 -4.098 -3.308 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.231 -3.506 -4.958 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.476 -2.923 -2.986 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.507 -4.245 -4.135 1.00 0.00 H new ATOM 0 HE ARG B 40 24.012 -2.132 -5.782 1.00 0.00 H new ATOM 0 HH11 ARG B 40 26.412 -2.669 -3.240 1.00 0.00 H new ATOM 0 HH12 ARG B 40 27.593 -1.581 -3.977 1.00 0.00 H new ATOM 0 HH21 ARG B 40 25.499 -0.723 -6.693 1.00 0.00 H new ATOM 0 HH22 ARG B 40 27.075 -0.479 -5.933 1.00 0.00 H new ATOM 1613 N PHE B 41 18.600 -1.453 -3.147 1.00 0.00 N ATOM 1614 CA PHE B 41 17.568 -0.900 -2.290 1.00 0.00 C ATOM 1615 C PHE B 41 17.934 -1.066 -0.822 1.00 0.00 C ATOM 1616 O PHE B 41 18.648 -1.994 -0.446 1.00 0.00 O ATOM 1617 CB PHE B 41 16.225 -1.569 -2.584 1.00 0.00 C ATOM 1618 CG PHE B 41 15.763 -1.375 -4.001 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.197 -0.175 -4.400 1.00 0.00 C ATOM 1620 CD2 PHE B 41 15.901 -2.391 -4.934 1.00 0.00 C ATOM 1621 CE1 PHE B 41 14.776 0.008 -5.703 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.480 -2.213 -6.239 1.00 0.00 C ATOM 1623 CZ PHE B 41 14.918 -1.013 -6.624 1.00 0.00 C ATOM 0 H PHE B 41 18.341 -2.326 -3.607 1.00 0.00 H new ATOM 0 HA PHE B 41 17.484 0.167 -2.499 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.306 -2.636 -2.378 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.471 -1.170 -1.905 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.084 0.626 -3.685 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.342 -3.332 -4.638 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.336 0.948 -6.002 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.591 -3.013 -6.956 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.590 -0.872 -7.643 1.00 0.00 H new ATOM 1633 N THR B 42 17.438 -0.157 -0.005 1.00 0.00 N ATOM 1634 CA THR B 42 17.700 -0.171 1.421 1.00 0.00 C ATOM 1635 C THR B 42 16.565 -0.863 2.165 1.00 0.00 C ATOM 1636 O THR B 42 16.785 -1.715 3.024 1.00 0.00 O ATOM 1637 CB THR B 42 17.853 1.270 1.945 1.00 0.00 C ATOM 1638 OG1 THR B 42 18.986 1.892 1.325 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.002 1.301 3.459 1.00 0.00 C ATOM 0 H THR B 42 16.842 0.612 -0.311 1.00 0.00 H new ATOM 0 HA THR B 42 18.625 -0.720 1.595 1.00 0.00 H new ATOM 0 HB THR B 42 16.948 1.822 1.690 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.079 2.809 1.659 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.108 2.333 3.793 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.119 0.859 3.921 1.00 0.00 H new ATOM 0 HG23 THR B 42 18.886 0.733 3.749 1.00 0.00 H new ATOM 1647 N ILE B 43 15.349 -0.499 1.807 1.00 0.00 N ATOM 1648 CA ILE B 43 14.169 -1.050 2.438 1.00 0.00 C ATOM 1649 C ILE B 43 13.362 -1.867 1.436 1.00 0.00 C ATOM 1650 O ILE B 43 12.990 -1.368 0.378 1.00 0.00 O ATOM 1651 CB ILE B 43 13.308 0.085 3.035 1.00 0.00 C ATOM 1652 CG1 ILE B 43 13.849 0.487 4.406 1.00 0.00 C ATOM 1653 CG2 ILE B 43 11.841 -0.314 3.134 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.242 1.762 4.939 1.00 0.00 C ATOM 0 H ILE B 43 15.153 0.183 1.075 1.00 0.00 H new ATOM 0 HA ILE B 43 14.479 -1.712 3.246 1.00 0.00 H new ATOM 0 HB ILE B 43 13.368 0.941 2.363 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.660 -0.320 5.114 1.00 0.00 H new ATOM 0 HG13 ILE B 43 14.930 0.608 4.341 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.268 0.510 3.558 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.460 -0.547 2.140 1.00 0.00 H new ATOM 0 HG23 ILE B 43 11.745 -1.191 3.775 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.671 1.989 5.915 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.453 2.581 4.251 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.163 1.639 5.036 1.00 0.00 H new ATOM 1666 N SER B 44 13.134 -3.129 1.760 1.00 0.00 N ATOM 1667 CA SER B 44 12.375 -4.022 0.901 1.00 0.00 C ATOM 1668 C SER B 44 11.251 -4.682 1.685 1.00 0.00 C ATOM 1669 O SER B 44 11.481 -5.258 2.749 1.00 0.00 O ATOM 1670 CB SER B 44 13.295 -5.082 0.295 1.00 0.00 C ATOM 1671 OG SER B 44 14.431 -4.480 -0.304 1.00 0.00 O ATOM 0 H SER B 44 13.468 -3.561 2.621 1.00 0.00 H new ATOM 0 HA SER B 44 11.936 -3.438 0.092 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.613 -5.779 1.070 1.00 0.00 H new ATOM 0 HB3 SER B 44 12.749 -5.661 -0.450 1.00 0.00 H new ATOM 0 HG SER B 44 15.007 -5.175 -0.684 1.00 0.00 H new ATOM 1677 N HIS B 45 10.043 -4.585 1.157 1.00 0.00 N ATOM 1678 CA HIS B 45 8.875 -5.162 1.782 1.00 0.00 C ATOM 1679 C HIS B 45 8.044 -5.822 0.710 1.00 0.00 C ATOM 1680 O HIS B 45 7.906 -5.302 -0.395 1.00 0.00 O ATOM 1681 CB HIS B 45 8.048 -4.101 2.512 1.00 0.00 C ATOM 1682 CG HIS B 45 8.738 -3.489 3.691 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.204 -4.205 4.771 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.045 -2.193 3.942 1.00 0.00 C ATOM 1685 CE1 HIS B 45 9.771 -3.343 5.623 1.00 0.00 C ATOM 1686 NE2 HIS B 45 9.701 -2.106 5.167 1.00 0.00 N ATOM 0 H HIS B 45 9.849 -4.102 0.280 1.00 0.00 H new ATOM 0 HA HIS B 45 9.191 -5.893 2.526 1.00 0.00 H new ATOM 0 HB2 HIS B 45 7.788 -3.311 1.807 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.113 -4.551 2.846 1.00 0.00 H new ATOM 0 HD1 HIS B 45 9.130 -5.214 4.899 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.817 -1.360 3.294 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.227 -3.623 6.561 1.00 0.00 H new ATOM 1694 N MET B 46 7.513 -6.965 1.028 1.00 0.00 N ATOM 1695 CA MET B 46 6.712 -7.712 0.091 1.00 0.00 C ATOM 1696 C MET B 46 5.245 -7.386 0.298 1.00 0.00 C ATOM 1697 O MET B 46 4.782 -7.337 1.428 1.00 0.00 O ATOM 1698 CB MET B 46 6.955 -9.196 0.314 1.00 0.00 C ATOM 1699 CG MET B 46 8.385 -9.635 0.052 1.00 0.00 C ATOM 1700 SD MET B 46 8.472 -11.124 -0.956 1.00 0.00 S ATOM 1701 CE MET B 46 7.921 -10.465 -2.521 1.00 0.00 C ATOM 0 H MET B 46 7.619 -7.409 1.940 1.00 0.00 H new ATOM 0 HA MET B 46 6.987 -7.446 -0.930 1.00 0.00 H new ATOM 0 HB2 MET B 46 6.692 -9.446 1.342 1.00 0.00 H new ATOM 0 HB3 MET B 46 6.287 -9.764 -0.333 1.00 0.00 H new ATOM 0 HG2 MET B 46 8.924 -8.830 -0.447 1.00 0.00 H new ATOM 0 HG3 MET B 46 8.887 -9.813 1.003 1.00 0.00 H new ATOM 0 HE1 MET B 46 7.000 -10.965 -2.822 1.00 0.00 H new ATOM 0 HE2 MET B 46 7.738 -9.395 -2.421 1.00 0.00 H new ATOM 0 HE3 MET B 46 8.688 -10.632 -3.277 1.00 0.00 H new ATOM 1711 N TYR B 47 4.503 -7.185 -0.789 1.00 0.00 N ATOM 1712 CA TYR B 47 3.069 -6.867 -0.686 1.00 0.00 C ATOM 1713 C TYR B 47 2.310 -7.996 0.009 1.00 0.00 C ATOM 1714 O TYR B 47 1.125 -7.877 0.310 1.00 0.00 O ATOM 1715 CB TYR B 47 2.447 -6.614 -2.066 1.00 0.00 C ATOM 1716 CG TYR B 47 3.015 -5.413 -2.780 1.00 0.00 C ATOM 1717 CD1 TYR B 47 3.608 -4.377 -2.073 1.00 0.00 C ATOM 1718 CD2 TYR B 47 2.960 -5.316 -4.162 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.135 -3.283 -2.723 1.00 0.00 C ATOM 1720 CE2 TYR B 47 3.483 -4.223 -4.818 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.070 -3.209 -4.093 1.00 0.00 C ATOM 1722 OH TYR B 47 4.603 -2.125 -4.744 1.00 0.00 O ATOM 0 H TYR B 47 4.860 -7.234 -1.743 1.00 0.00 H new ATOM 0 HA TYR B 47 2.986 -5.956 -0.093 1.00 0.00 H new ATOM 0 HB2 TYR B 47 2.594 -7.497 -2.688 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.371 -6.481 -1.950 1.00 0.00 H new ATOM 0 HD1 TYR B 47 3.657 -4.429 -0.995 1.00 0.00 H new ATOM 0 HD2 TYR B 47 2.500 -6.109 -4.733 1.00 0.00 H new ATOM 0 HE1 TYR B 47 4.597 -2.487 -2.158 1.00 0.00 H new ATOM 0 HE2 TYR B 47 3.433 -4.161 -5.895 1.00 0.00 H new ATOM 0 HH TYR B 47 5.542 -2.303 -4.960 1.00 0.00 H new ATOM 1732 N ALA B 48 3.010 -9.092 0.242 1.00 0.00 N ATOM 1733 CA ALA B 48 2.448 -10.250 0.898 1.00 0.00 C ATOM 1734 C ALA B 48 2.551 -10.141 2.417 1.00 0.00 C ATOM 1735 O ALA B 48 1.794 -10.794 3.136 1.00 0.00 O ATOM 1736 CB ALA B 48 3.146 -11.506 0.400 1.00 0.00 C ATOM 0 H ALA B 48 3.989 -9.200 -0.022 1.00 0.00 H new ATOM 0 HA ALA B 48 1.388 -10.305 0.651 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.721 -12.379 0.896 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.007 -11.597 -0.677 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.211 -11.444 0.624 1.00 0.00 H new ATOM 1742 N ASP B 49 3.477 -9.317 2.908 1.00 0.00 N ATOM 1743 CA ASP B 49 3.655 -9.154 4.348 1.00 0.00 C ATOM 1744 C ASP B 49 3.080 -7.830 4.834 1.00 0.00 C ATOM 1745 O ASP B 49 2.939 -7.617 6.041 1.00 0.00 O ATOM 1746 CB ASP B 49 5.138 -9.270 4.747 1.00 0.00 C ATOM 1747 CG ASP B 49 6.012 -8.143 4.211 1.00 0.00 C ATOM 1748 OD1 ASP B 49 5.910 -7.008 4.718 1.00 0.00 O ATOM 1749 OD2 ASP B 49 6.816 -8.401 3.289 1.00 0.00 O ATOM 0 H ASP B 49 4.109 -8.758 2.335 1.00 0.00 H new ATOM 0 HA ASP B 49 3.106 -9.962 4.831 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.211 -9.287 5.834 1.00 0.00 H new ATOM 0 HB3 ASP B 49 5.528 -10.222 4.386 1.00 0.00 H new ATOM 1754 N ILE B 50 2.730 -6.946 3.906 1.00 0.00 N ATOM 1755 CA ILE B 50 2.169 -5.662 4.287 1.00 0.00 C ATOM 1756 C ILE B 50 0.723 -5.848 4.725 1.00 0.00 C ATOM 1757 O ILE B 50 -0.125 -6.269 3.939 1.00 0.00 O ATOM 1758 CB ILE B 50 2.201 -4.620 3.149 1.00 0.00 C ATOM 1759 CG1 ILE B 50 3.371 -4.858 2.191 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.298 -3.224 3.747 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.707 -4.372 2.705 1.00 0.00 C ATOM 0 H ILE B 50 2.824 -7.094 2.901 1.00 0.00 H new ATOM 0 HA ILE B 50 2.789 -5.284 5.100 1.00 0.00 H new ATOM 0 HB ILE B 50 1.280 -4.719 2.574 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.442 -5.925 1.982 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.157 -4.361 1.245 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.321 -2.486 2.946 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.433 -3.041 4.385 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.209 -3.145 4.340 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.479 -4.580 1.964 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.658 -3.298 2.887 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.948 -4.887 3.635 1.00 0.00 H new ATOM 1773 N LYS B 51 0.453 -5.540 5.980 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.882 -5.674 6.537 1.00 0.00 C ATOM 1775 C LYS B 51 -1.794 -4.583 5.996 1.00 0.00 C ATOM 1776 O LYS B 51 -2.885 -4.857 5.503 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.816 -5.600 8.064 1.00 0.00 C ATOM 1778 CG LYS B 51 -2.158 -5.772 8.747 1.00 0.00 C ATOM 1779 CD LYS B 51 -2.631 -4.474 9.361 1.00 0.00 C ATOM 1780 CE LYS B 51 -4.134 -4.490 9.570 1.00 0.00 C ATOM 1781 NZ LYS B 51 -4.733 -3.123 9.505 1.00 0.00 N ATOM 0 H LYS B 51 1.148 -5.192 6.640 1.00 0.00 H new ATOM 0 HA LYS B 51 -1.291 -6.641 6.245 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -0.134 -6.370 8.426 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -0.393 -4.638 8.353 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.894 -6.125 8.024 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.080 -6.536 9.521 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -2.129 -4.314 10.315 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -2.359 -3.640 8.714 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.597 -5.123 8.813 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -4.359 -4.936 10.539 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -5.669 -3.132 9.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -4.114 -2.449 10.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -4.834 -2.835 8.511 1.00 0.00 H new ATOM 1795 N CYS B 52 -1.332 -3.351 6.098 1.00 0.00 N ATOM 1796 CA CYS B 52 -2.080 -2.193 5.629 1.00 0.00 C ATOM 1797 C CYS B 52 -1.112 -1.051 5.385 1.00 0.00 C ATOM 1798 O CYS B 52 0.102 -1.240 5.412 1.00 0.00 O ATOM 1799 CB CYS B 52 -3.146 -1.782 6.649 1.00 0.00 C ATOM 1800 SG CYS B 52 -4.705 -2.693 6.501 1.00 0.00 S ATOM 0 H CYS B 52 -0.427 -3.122 6.508 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.592 -2.447 4.701 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.747 -1.927 7.653 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.348 -0.717 6.537 1.00 0.00 H new ATOM 0 HG CYS B 52 -4.483 -3.845 5.941 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.635 0.127 5.141 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.794 1.280 4.900 1.00 0.00 C ATOM 1808 C GLN B 53 -1.230 2.426 5.787 1.00 0.00 C ATOM 1809 O GLN B 53 -2.146 2.283 6.584 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.851 1.710 3.435 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.845 0.558 2.447 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.999 0.644 1.474 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.924 1.355 0.480 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -3.078 -0.073 1.757 1.00 0.00 N ATOM 0 H GLN B 53 -2.637 0.314 5.104 1.00 0.00 H new ATOM 0 HA GLN B 53 0.235 1.005 5.134 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.751 2.304 3.277 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.000 2.358 3.225 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.095 0.557 1.896 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.897 -0.386 2.990 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -3.099 -0.653 2.596 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.886 -0.045 1.136 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.535 3.533 5.683 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.846 4.725 6.436 1.00 0.00 C ATOM 1825 C LYS B 54 -0.457 5.928 5.598 1.00 0.00 C ATOM 1826 O LYS B 54 0.584 5.917 4.947 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.092 4.739 7.760 1.00 0.00 C ATOM 1828 CG LYS B 54 -0.716 3.885 8.844 1.00 0.00 C ATOM 1829 CD LYS B 54 -1.482 4.744 9.821 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.132 4.413 11.260 1.00 0.00 C ATOM 1831 NZ LYS B 54 0.199 4.965 11.652 1.00 0.00 N ATOM 0 H LYS B 54 0.271 3.633 5.066 1.00 0.00 H new ATOM 0 HA LYS B 54 -1.912 4.751 6.662 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.928 4.397 7.587 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.027 5.767 8.116 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -1.384 3.150 8.396 1.00 0.00 H new ATOM 0 HG3 LYS B 54 0.061 3.330 9.370 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -1.266 5.795 9.627 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -2.552 4.604 9.666 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.900 4.814 11.922 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -1.130 3.331 11.393 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 0.253 5.039 12.688 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.951 4.333 11.311 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.321 5.908 11.231 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.293 6.945 5.578 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.003 8.134 4.789 1.00 0.00 C ATOM 1847 C ILE B 55 -1.346 9.400 5.539 1.00 0.00 C ATOM 1848 O ILE B 55 -2.330 9.439 6.269 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.808 8.150 3.472 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.311 8.138 3.759 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.434 6.976 2.596 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.161 8.106 2.514 1.00 0.00 C ATOM 0 H ILE B 55 -2.173 6.977 6.093 1.00 0.00 H new ATOM 0 HA ILE B 55 0.066 8.098 4.580 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.562 9.068 2.939 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.548 7.270 4.374 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.568 9.022 4.343 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.015 7.010 1.674 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.372 7.024 2.357 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.645 6.046 3.124 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.215 8.099 2.793 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.952 8.988 1.908 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.932 7.208 1.940 1.00 0.00 H new ATOM 1864 N SER B 56 -0.523 10.419 5.387 1.00 0.00 N ATOM 1865 CA SER B 56 -0.810 11.699 5.995 1.00 0.00 C ATOM 1866 C SER B 56 -1.800 12.402 5.082 1.00 0.00 C ATOM 1867 O SER B 56 -1.439 12.800 3.977 1.00 0.00 O ATOM 1868 CB SER B 56 0.464 12.526 6.154 1.00 0.00 C ATOM 1869 OG SER B 56 1.078 12.773 4.899 1.00 0.00 O ATOM 0 H SER B 56 0.344 10.384 4.851 1.00 0.00 H new ATOM 0 HA SER B 56 -1.225 11.569 6.994 1.00 0.00 H new ATOM 0 HB2 SER B 56 0.227 13.473 6.638 1.00 0.00 H new ATOM 0 HB3 SER B 56 1.162 12.001 6.806 1.00 0.00 H new ATOM 0 HG SER B 56 0.394 12.791 4.198 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.058 12.539 5.509 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.105 13.146 4.696 1.00 0.00 C ATOM 1877 C PRO B 57 -3.914 14.657 4.537 1.00 0.00 C ATOM 1878 O PRO B 57 -2.835 15.186 4.820 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.394 12.820 5.459 1.00 0.00 C ATOM 1880 CG PRO B 57 -4.992 11.842 6.502 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.568 12.143 6.819 1.00 0.00 C ATOM 0 HA PRO B 57 -4.107 12.762 3.676 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.825 13.716 5.905 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.149 12.399 4.795 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.618 11.938 7.389 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.104 10.819 6.142 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.471 12.941 7.556 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.044 11.275 7.218 1.00 0.00 H new ATOM 1889 N GLU B 58 -4.961 15.351 4.107 1.00 0.00 N ATOM 1890 CA GLU B 58 -4.893 16.798 3.894 1.00 0.00 C ATOM 1891 C GLU B 58 -4.919 17.579 5.208 1.00 0.00 C ATOM 1892 O GLU B 58 -5.816 18.384 5.458 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.025 17.254 2.971 1.00 0.00 C ATOM 1894 CG GLU B 58 -5.651 17.217 1.495 1.00 0.00 C ATOM 1895 CD GLU B 58 -4.793 16.018 1.142 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -5.357 14.960 0.808 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -3.551 16.124 1.225 1.00 0.00 O ATOM 0 H GLU B 58 -5.870 14.938 3.898 1.00 0.00 H new ATOM 0 HA GLU B 58 -3.937 17.012 3.416 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -6.896 16.619 3.134 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -6.317 18.269 3.239 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -6.560 17.198 0.894 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -5.116 18.131 1.236 1.00 0.00 H new ATOM 1904 N GLY B 59 -3.927 17.315 6.041 1.00 0.00 N ATOM 1905 CA GLY B 59 -3.796 17.996 7.313 1.00 0.00 C ATOM 1906 C GLY B 59 -2.357 17.997 7.787 1.00 0.00 C ATOM 1907 O GLY B 59 -2.060 18.345 8.928 1.00 0.00 O ATOM 0 H GLY B 59 -3.196 16.628 5.855 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -4.151 19.022 7.218 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -4.426 17.508 8.056 1.00 0.00 H new ATOM 1911 N LYS B 60 -1.451 17.622 6.891 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.036 17.550 7.210 1.00 0.00 C ATOM 1913 C LYS B 60 0.777 18.284 6.155 1.00 0.00 C ATOM 1914 O LYS B 60 0.474 18.203 4.967 1.00 0.00 O ATOM 1915 CB LYS B 60 0.403 16.084 7.304 1.00 0.00 C ATOM 1916 CG LYS B 60 -0.477 15.250 8.219 1.00 0.00 C ATOM 1917 CD LYS B 60 0.349 14.373 9.139 1.00 0.00 C ATOM 1918 CE LYS B 60 0.954 15.170 10.281 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.078 15.786 11.162 1.00 0.00 N ATOM 0 H LYS B 60 -1.677 17.362 5.931 1.00 0.00 H new ATOM 0 HA LYS B 60 0.137 18.029 8.173 1.00 0.00 H new ATOM 0 HB2 LYS B 60 0.396 15.645 6.306 1.00 0.00 H new ATOM 0 HB3 LYS B 60 1.431 16.042 7.663 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -1.111 15.908 8.814 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -1.140 14.626 7.619 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -0.277 13.577 9.542 1.00 0.00 H new ATOM 0 HD3 LYS B 60 1.144 13.894 8.568 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.592 14.517 10.877 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.593 15.954 9.873 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.108 16.805 11.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -1.020 15.642 10.746 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -0.043 15.341 12.102 1.00 0.00 H new ATOM 1933 N ALA B 61 1.794 19.011 6.596 1.00 0.00 N ATOM 1934 CA ALA B 61 2.642 19.768 5.685 1.00 0.00 C ATOM 1935 C ALA B 61 3.572 18.850 4.912 1.00 0.00 C ATOM 1936 O ALA B 61 3.604 18.885 3.685 1.00 0.00 O ATOM 1937 CB ALA B 61 3.440 20.803 6.446 1.00 0.00 C ATOM 0 H ALA B 61 2.052 19.093 7.579 1.00 0.00 H new ATOM 0 HA ALA B 61 1.997 20.277 4.969 1.00 0.00 H new ATOM 0 HB1 ALA B 61 4.069 21.360 5.752 1.00 0.00 H new ATOM 0 HB2 ALA B 61 2.759 21.489 6.950 1.00 0.00 H new ATOM 0 HB3 ALA B 61 4.068 20.307 7.186 1.00 0.00 H new ATOM 1943 N LYS B 62 4.350 18.050 5.628 1.00 0.00 N ATOM 1944 CA LYS B 62 5.246 17.122 4.972 1.00 0.00 C ATOM 1945 C LYS B 62 4.441 15.908 4.539 1.00 0.00 C ATOM 1946 O LYS B 62 3.636 15.382 5.310 1.00 0.00 O ATOM 1947 CB LYS B 62 6.435 16.742 5.872 1.00 0.00 C ATOM 1948 CG LYS B 62 6.091 15.929 7.110 1.00 0.00 C ATOM 1949 CD LYS B 62 7.356 15.438 7.804 1.00 0.00 C ATOM 1950 CE LYS B 62 7.047 14.617 9.047 1.00 0.00 C ATOM 1951 NZ LYS B 62 8.280 14.061 9.668 1.00 0.00 N ATOM 0 H LYS B 62 4.376 18.028 6.647 1.00 0.00 H new ATOM 0 HA LYS B 62 5.685 17.594 4.093 1.00 0.00 H new ATOM 0 HB2 LYS B 62 7.152 16.177 5.276 1.00 0.00 H new ATOM 0 HB3 LYS B 62 6.935 17.658 6.188 1.00 0.00 H new ATOM 0 HG2 LYS B 62 5.506 16.538 7.799 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.470 15.078 6.831 1.00 0.00 H new ATOM 0 HD2 LYS B 62 7.940 14.835 7.108 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.973 16.293 8.080 1.00 0.00 H new ATOM 0 HE2 LYS B 62 6.525 15.240 9.773 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.374 13.801 8.785 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 8.021 13.453 10.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 8.801 13.500 8.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 8.881 14.840 10.004 1.00 0.00 H new ATOM 1965 N ILE B 63 4.631 15.495 3.301 1.00 0.00 N ATOM 1966 CA ILE B 63 3.892 14.375 2.751 1.00 0.00 C ATOM 1967 C ILE B 63 4.506 13.075 3.256 1.00 0.00 C ATOM 1968 O ILE B 63 5.499 12.582 2.727 1.00 0.00 O ATOM 1969 CB ILE B 63 3.856 14.447 1.213 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.868 15.536 0.772 1.00 0.00 C ATOM 1971 CG2 ILE B 63 3.448 13.109 0.607 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.161 16.938 1.282 1.00 0.00 C ATOM 0 H ILE B 63 5.295 15.921 2.654 1.00 0.00 H new ATOM 0 HA ILE B 63 2.856 14.415 3.087 1.00 0.00 H new ATOM 0 HB ILE B 63 4.858 14.690 0.859 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.848 15.563 -0.317 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.869 15.250 1.103 1.00 0.00 H new ATOM 0 HG21 ILE B 63 3.432 13.192 -0.480 1.00 0.00 H new ATOM 0 HG22 ILE B 63 4.165 12.342 0.902 1.00 0.00 H new ATOM 0 HG23 ILE B 63 2.456 12.835 0.965 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.402 17.626 0.911 1.00 0.00 H new ATOM 0 HD12 ILE B 63 3.149 16.939 2.372 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.142 17.256 0.930 1.00 0.00 H new ATOM 1984 N GLN B 64 3.912 12.542 4.306 1.00 0.00 N ATOM 1985 CA GLN B 64 4.412 11.340 4.948 1.00 0.00 C ATOM 1986 C GLN B 64 3.498 10.131 4.700 1.00 0.00 C ATOM 1987 O GLN B 64 2.274 10.223 4.776 1.00 0.00 O ATOM 1988 CB GLN B 64 4.581 11.625 6.451 1.00 0.00 C ATOM 1989 CG GLN B 64 3.690 12.766 6.944 1.00 0.00 C ATOM 1990 CD GLN B 64 3.926 13.188 8.388 1.00 0.00 C ATOM 1991 OE1 GLN B 64 3.786 14.362 8.728 1.00 0.00 O ATOM 1992 NE2 GLN B 64 4.257 12.248 9.254 1.00 0.00 N ATOM 0 H GLN B 64 3.072 12.928 4.738 1.00 0.00 H new ATOM 0 HA GLN B 64 5.377 11.077 4.515 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.351 10.721 7.015 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.623 11.871 6.654 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.843 13.631 6.299 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.648 12.467 6.834 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.366 11.283 8.942 1.00 0.00 H new ATOM 0 HE22 GLN B 64 4.404 12.487 10.235 1.00 0.00 H new ATOM 2001 N LEU B 65 4.119 9.004 4.382 1.00 0.00 N ATOM 2002 CA LEU B 65 3.420 7.749 4.122 1.00 0.00 C ATOM 2003 C LEU B 65 3.950 6.677 5.070 1.00 0.00 C ATOM 2004 O LEU B 65 5.041 6.824 5.600 1.00 0.00 O ATOM 2005 CB LEU B 65 3.675 7.303 2.681 1.00 0.00 C ATOM 2006 CG LEU B 65 2.826 6.129 2.189 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.544 6.621 1.526 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.635 5.251 1.252 1.00 0.00 C ATOM 0 H LEU B 65 5.133 8.932 4.296 1.00 0.00 H new ATOM 0 HA LEU B 65 2.351 7.894 4.276 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.503 8.153 2.021 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.726 7.032 2.585 1.00 0.00 H new ATOM 0 HG LEU B 65 2.535 5.527 3.050 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.959 5.766 1.186 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.961 7.197 2.245 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.794 7.252 0.673 1.00 0.00 H new ATOM 0 HD21 LEU B 65 3.019 4.420 0.910 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.961 5.839 0.394 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.507 4.863 1.779 1.00 0.00 H new ATOM 2020 N GLN B 66 3.190 5.613 5.293 1.00 0.00 N ATOM 2021 CA GLN B 66 3.636 4.540 6.171 1.00 0.00 C ATOM 2022 C GLN B 66 3.151 3.175 5.688 1.00 0.00 C ATOM 2023 O GLN B 66 2.043 3.040 5.173 1.00 0.00 O ATOM 2024 CB GLN B 66 3.178 4.776 7.607 1.00 0.00 C ATOM 2025 CG GLN B 66 3.546 3.650 8.562 1.00 0.00 C ATOM 2026 CD GLN B 66 3.018 3.875 9.963 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.917 3.450 10.299 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.803 4.537 10.790 1.00 0.00 N ATOM 0 H GLN B 66 2.268 5.470 4.881 1.00 0.00 H new ATOM 0 HA GLN B 66 4.726 4.543 6.145 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.616 5.706 7.970 1.00 0.00 H new ATOM 0 HB3 GLN B 66 2.096 4.909 7.616 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.152 2.709 8.177 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.631 3.550 8.599 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.712 4.874 10.471 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.502 4.712 11.749 1.00 0.00 H new ATOM 2037 N LEU B 67 4.010 2.181 5.835 1.00 0.00 N ATOM 2038 CA LEU B 67 3.700 0.812 5.466 1.00 0.00 C ATOM 2039 C LEU B 67 3.508 -0.008 6.721 1.00 0.00 C ATOM 2040 O LEU B 67 4.467 -0.265 7.442 1.00 0.00 O ATOM 2041 CB LEU B 67 4.835 0.186 4.658 1.00 0.00 C ATOM 2042 CG LEU B 67 5.185 0.874 3.347 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.289 0.101 2.650 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.958 0.984 2.458 1.00 0.00 C ATOM 0 H LEU B 67 4.948 2.303 6.216 1.00 0.00 H new ATOM 0 HA LEU B 67 2.794 0.822 4.860 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.728 0.164 5.282 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.571 -0.849 4.442 1.00 0.00 H new ATOM 0 HG LEU B 67 5.537 1.884 3.555 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.540 0.593 1.711 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.171 0.069 3.290 1.00 0.00 H new ATOM 0 HD13 LEU B 67 5.950 -0.915 2.448 1.00 0.00 H new ATOM 0 HD21 LEU B 67 4.228 1.479 1.525 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.574 -0.013 2.242 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.190 1.566 2.968 1.00 0.00 H new ATOM 2056 N VAL B 68 2.286 -0.408 6.994 1.00 0.00 N ATOM 2057 CA VAL B 68 2.015 -1.202 8.173 1.00 0.00 C ATOM 2058 C VAL B 68 2.067 -2.675 7.821 1.00 0.00 C ATOM 2059 O VAL B 68 1.188 -3.189 7.139 1.00 0.00 O ATOM 2060 CB VAL B 68 0.652 -0.868 8.792 1.00 0.00 C ATOM 2061 CG1 VAL B 68 0.475 -1.633 10.087 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.530 0.627 9.027 1.00 0.00 C ATOM 0 H VAL B 68 1.469 -0.199 6.421 1.00 0.00 H new ATOM 0 HA VAL B 68 2.781 -0.966 8.912 1.00 0.00 H new ATOM 0 HB VAL B 68 -0.136 -1.166 8.101 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.495 -1.392 10.522 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.527 -2.703 9.887 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.265 -1.355 10.785 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.443 0.848 9.467 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.318 0.954 9.706 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.627 1.154 8.078 1.00 0.00 H new ATOM 2072 N LEU B 69 3.097 -3.349 8.284 1.00 0.00 N ATOM 2073 CA LEU B 69 3.274 -4.756 7.989 1.00 0.00 C ATOM 2074 C LEU B 69 2.506 -5.624 8.982 1.00 0.00 C ATOM 2075 O LEU B 69 2.085 -5.151 10.039 1.00 0.00 O ATOM 2076 CB LEU B 69 4.755 -5.095 7.997 1.00 0.00 C ATOM 2077 CG LEU B 69 5.651 -3.994 7.422 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.100 -4.389 7.503 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.290 -3.674 5.986 1.00 0.00 C ATOM 0 H LEU B 69 3.828 -2.944 8.869 1.00 0.00 H new ATOM 0 HA LEU B 69 2.871 -4.963 6.998 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.064 -5.302 9.022 1.00 0.00 H new ATOM 0 HB3 LEU B 69 4.910 -6.010 7.426 1.00 0.00 H new ATOM 0 HG LEU B 69 5.488 -3.100 8.024 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.718 -3.592 7.089 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.374 -4.557 8.545 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.260 -5.305 6.934 1.00 0.00 H new ATOM 0 HD21 LEU B 69 5.947 -2.889 5.612 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.408 -4.568 5.373 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.255 -3.335 5.938 1.00 0.00 H new ATOM 2091 N HIS B 70 2.323 -6.891 8.633 1.00 0.00 N ATOM 2092 CA HIS B 70 1.579 -7.830 9.471 1.00 0.00 C ATOM 2093 C HIS B 70 2.333 -8.194 10.746 1.00 0.00 C ATOM 2094 O HIS B 70 1.728 -8.622 11.726 1.00 0.00 O ATOM 2095 CB HIS B 70 1.287 -9.120 8.697 1.00 0.00 C ATOM 2096 CG HIS B 70 0.023 -9.081 7.904 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -1.228 -8.953 8.465 1.00 0.00 N ATOM 2098 CD2 HIS B 70 -0.168 -9.132 6.562 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -2.122 -8.922 7.472 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -1.531 -9.031 6.295 1.00 0.00 N ATOM 0 H HIS B 70 2.682 -7.297 7.769 1.00 0.00 H new ATOM 0 HA HIS B 70 0.651 -7.330 9.748 1.00 0.00 H new ATOM 0 HB2 HIS B 70 2.120 -9.324 8.024 1.00 0.00 H new ATOM 0 HB3 HIS B 70 1.236 -9.950 9.401 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -1.436 -8.893 9.462 1.00 0.00 H new ATOM 0 HD2 HIS B 70 0.611 -9.234 5.821 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -3.188 -8.821 7.613 1.00 0.00 H new ATOM 2108 N ALA B 71 3.646 -8.028 10.729 1.00 0.00 N ATOM 2109 CA ALA B 71 4.472 -8.382 11.875 1.00 0.00 C ATOM 2110 C ALA B 71 4.374 -7.354 13.000 1.00 0.00 C ATOM 2111 O ALA B 71 4.503 -7.699 14.175 1.00 0.00 O ATOM 2112 CB ALA B 71 5.914 -8.559 11.434 1.00 0.00 C ATOM 0 H ALA B 71 4.164 -7.651 9.935 1.00 0.00 H new ATOM 0 HA ALA B 71 4.097 -9.324 12.276 1.00 0.00 H new ATOM 0 HB1 ALA B 71 6.528 -8.824 12.295 1.00 0.00 H new ATOM 0 HB2 ALA B 71 5.972 -9.353 10.689 1.00 0.00 H new ATOM 0 HB3 ALA B 71 6.279 -7.628 11.001 1.00 0.00 H new ATOM 2118 N GLY B 72 4.130 -6.103 12.644 1.00 0.00 N ATOM 2119 CA GLY B 72 4.040 -5.059 13.644 1.00 0.00 C ATOM 2120 C GLY B 72 5.125 -4.038 13.429 1.00 0.00 C ATOM 2121 O GLY B 72 5.575 -3.365 14.355 1.00 0.00 O ATOM 0 H GLY B 72 3.993 -5.791 11.683 1.00 0.00 H new ATOM 0 HA2 GLY B 72 3.063 -4.579 13.592 1.00 0.00 H new ATOM 0 HA3 GLY B 72 4.130 -5.491 14.641 1.00 0.00 H new ATOM 2125 N ASP B 73 5.524 -3.929 12.177 1.00 0.00 N ATOM 2126 CA ASP B 73 6.559 -3.032 11.749 1.00 0.00 C ATOM 2127 C ASP B 73 5.926 -2.072 10.794 1.00 0.00 C ATOM 2128 O ASP B 73 5.138 -2.471 9.939 1.00 0.00 O ATOM 2129 CB ASP B 73 7.695 -3.774 11.031 1.00 0.00 C ATOM 2130 CG ASP B 73 7.520 -5.282 11.024 1.00 0.00 C ATOM 2131 OD1 ASP B 73 6.507 -5.762 10.464 1.00 0.00 O ATOM 2132 OD2 ASP B 73 8.393 -5.984 11.573 1.00 0.00 O ATOM 0 H ASP B 73 5.123 -4.479 11.417 1.00 0.00 H new ATOM 0 HA ASP B 73 6.993 -2.532 12.615 1.00 0.00 H new ATOM 0 HB2 ASP B 73 7.758 -3.418 10.003 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.641 -3.528 11.513 1.00 0.00 H new ATOM 2137 N THR B 74 6.215 -0.817 10.942 1.00 0.00 N ATOM 2138 CA THR B 74 5.634 0.151 10.064 1.00 0.00 C ATOM 2139 C THR B 74 6.718 1.104 9.538 1.00 0.00 C ATOM 2140 O THR B 74 7.379 1.790 10.318 1.00 0.00 O ATOM 2141 CB THR B 74 4.532 0.927 10.797 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.052 1.523 11.991 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.364 0.017 11.150 1.00 0.00 C ATOM 0 H THR B 74 6.842 -0.441 11.653 1.00 0.00 H new ATOM 0 HA THR B 74 5.186 -0.360 9.212 1.00 0.00 H new ATOM 0 HB THR B 74 4.175 1.710 10.128 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.002 1.731 11.866 1.00 0.00 H new ATOM 0 HG21 THR B 74 2.598 0.593 11.669 1.00 0.00 H new ATOM 0 HG22 THR B 74 2.944 -0.407 10.238 1.00 0.00 H new ATOM 0 HG23 THR B 74 3.713 -0.788 11.797 1.00 0.00 H new ATOM 2151 N THR B 75 6.902 1.134 8.225 1.00 0.00 N ATOM 2152 CA THR B 75 7.916 1.988 7.602 1.00 0.00 C ATOM 2153 C THR B 75 7.297 3.272 7.058 1.00 0.00 C ATOM 2154 O THR B 75 6.344 3.218 6.292 1.00 0.00 O ATOM 2155 CB THR B 75 8.623 1.234 6.459 1.00 0.00 C ATOM 2156 OG1 THR B 75 9.257 0.058 6.976 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.652 2.116 5.770 1.00 0.00 C ATOM 0 H THR B 75 6.362 0.576 7.564 1.00 0.00 H new ATOM 0 HA THR B 75 8.644 2.251 8.369 1.00 0.00 H new ATOM 0 HB THR B 75 7.872 0.952 5.721 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.292 -0.629 6.278 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.133 1.556 4.969 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.158 2.994 5.353 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.403 2.432 6.494 1.00 0.00 H new ATOM 2165 N ASN B 76 7.848 4.424 7.432 1.00 0.00 N ATOM 2166 CA ASN B 76 7.295 5.692 6.974 1.00 0.00 C ATOM 2167 C ASN B 76 8.206 6.341 5.928 1.00 0.00 C ATOM 2168 O ASN B 76 9.426 6.398 6.096 1.00 0.00 O ATOM 2169 CB ASN B 76 7.060 6.666 8.145 1.00 0.00 C ATOM 2170 CG ASN B 76 6.757 5.984 9.471 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.137 4.928 9.519 1.00 0.00 O ATOM 2172 ND2 ASN B 76 7.199 6.590 10.564 1.00 0.00 N ATOM 0 H ASN B 76 8.663 4.505 8.040 1.00 0.00 H new ATOM 0 HA ASN B 76 6.331 5.474 6.515 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.944 7.293 8.265 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.232 7.328 7.892 1.00 0.00 H new ATOM 0 HD21 ASN B 76 7.026 6.178 11.481 1.00 0.00 H new ATOM 0 HD22 ASN B 76 7.712 7.468 10.488 1.00 0.00 H new ATOM 2179 N PHE B 77 7.596 6.813 4.848 1.00 0.00 N ATOM 2180 CA PHE B 77 8.313 7.468 3.753 1.00 0.00 C ATOM 2181 C PHE B 77 7.841 8.914 3.606 1.00 0.00 C ATOM 2182 O PHE B 77 6.645 9.180 3.634 1.00 0.00 O ATOM 2183 CB PHE B 77 8.079 6.723 2.437 1.00 0.00 C ATOM 2184 CG PHE B 77 8.667 5.342 2.407 1.00 0.00 C ATOM 2185 CD1 PHE B 77 10.019 5.147 2.628 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.867 4.241 2.149 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.564 3.879 2.594 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.406 2.970 2.113 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.757 2.788 2.336 1.00 0.00 C ATOM 0 H PHE B 77 6.588 6.754 4.703 1.00 0.00 H new ATOM 0 HA PHE B 77 9.378 7.455 3.986 1.00 0.00 H new ATOM 0 HB2 PHE B 77 7.006 6.655 2.255 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.504 7.306 1.620 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.655 5.996 2.829 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.810 4.378 1.974 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.621 3.740 2.769 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.772 2.119 1.911 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.181 1.795 2.309 1.00 0.00 H new ATOM 2199 N HIS B 78 8.774 9.841 3.441 1.00 0.00 N ATOM 2200 CA HIS B 78 8.434 11.251 3.301 1.00 0.00 C ATOM 2201 C HIS B 78 8.683 11.738 1.872 1.00 0.00 C ATOM 2202 O HIS B 78 9.817 11.779 1.407 1.00 0.00 O ATOM 2203 CB HIS B 78 9.259 12.062 4.310 1.00 0.00 C ATOM 2204 CG HIS B 78 9.139 13.555 4.188 1.00 0.00 C ATOM 2205 ND1 HIS B 78 10.120 14.429 4.599 1.00 0.00 N ATOM 2206 CD2 HIS B 78 8.146 14.326 3.672 1.00 0.00 C ATOM 2207 CE1 HIS B 78 9.709 15.672 4.324 1.00 0.00 C ATOM 2208 NE2 HIS B 78 8.518 15.665 3.759 1.00 0.00 N ATOM 0 H HIS B 78 9.774 9.642 3.401 1.00 0.00 H new ATOM 0 HA HIS B 78 7.372 11.389 3.506 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.958 11.771 5.317 1.00 0.00 H new ATOM 0 HB3 HIS B 78 10.308 11.788 4.199 1.00 0.00 H new ATOM 0 HD2 HIS B 78 7.217 13.959 3.260 1.00 0.00 H new ATOM 0 HE1 HIS B 78 10.279 16.565 4.537 1.00 0.00 H new ATOM 0 HE2 HIS B 78 7.980 16.474 3.449 1.00 0.00 H new ATOM 2216 N PHE B 79 7.615 12.107 1.184 1.00 0.00 N ATOM 2217 CA PHE B 79 7.710 12.606 -0.181 1.00 0.00 C ATOM 2218 C PHE B 79 7.863 14.119 -0.149 1.00 0.00 C ATOM 2219 O PHE B 79 7.053 14.822 0.455 1.00 0.00 O ATOM 2220 CB PHE B 79 6.469 12.224 -0.991 1.00 0.00 C ATOM 2221 CG PHE B 79 6.182 10.749 -1.000 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.415 10.172 -0.002 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.676 9.942 -2.010 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.146 8.820 -0.010 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.410 8.587 -2.022 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.644 8.026 -1.022 1.00 0.00 C ATOM 0 H PHE B 79 6.664 12.070 1.551 1.00 0.00 H new ATOM 0 HA PHE B 79 8.578 12.155 -0.661 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.605 12.750 -0.585 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.597 12.566 -2.018 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.023 10.789 0.793 1.00 0.00 H new ATOM 0 HD2 PHE B 79 7.275 10.376 -2.796 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.546 8.383 0.775 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.802 7.967 -2.815 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.434 6.967 -1.031 1.00 0.00 H new ATOM 2236 N SER B 80 8.902 14.622 -0.791 1.00 0.00 N ATOM 2237 CA SER B 80 9.159 16.049 -0.792 1.00 0.00 C ATOM 2238 C SER B 80 9.215 16.644 -2.200 1.00 0.00 C ATOM 2239 O SER B 80 10.056 17.502 -2.475 1.00 0.00 O ATOM 2240 CB SER B 80 10.469 16.333 -0.059 1.00 0.00 C ATOM 2241 OG SER B 80 10.517 15.646 1.180 1.00 0.00 O ATOM 0 H SER B 80 9.578 14.066 -1.315 1.00 0.00 H new ATOM 0 HA SER B 80 8.324 16.526 -0.279 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.311 16.029 -0.681 1.00 0.00 H new ATOM 0 HB3 SER B 80 10.570 17.405 0.111 1.00 0.00 H new ATOM 0 HG SER B 80 9.681 15.796 1.670 1.00 0.00 H new ATOM 2247 N ASN B 81 8.353 16.192 -3.103 1.00 0.00 N ATOM 2248 CA ASN B 81 8.326 16.760 -4.435 1.00 0.00 C ATOM 2249 C ASN B 81 7.347 17.921 -4.420 1.00 0.00 C ATOM 2250 O ASN B 81 6.151 17.724 -4.261 1.00 0.00 O ATOM 2251 CB ASN B 81 7.916 15.714 -5.465 1.00 0.00 C ATOM 2252 CG ASN B 81 8.141 16.168 -6.894 1.00 0.00 C ATOM 2253 OD1 ASN B 81 8.177 17.365 -7.187 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.272 15.211 -7.795 1.00 0.00 N ATOM 0 H ASN B 81 7.677 15.447 -2.937 1.00 0.00 H new ATOM 0 HA ASN B 81 9.320 17.109 -4.717 1.00 0.00 H new ATOM 0 HB2 ASN B 81 8.479 14.798 -5.288 1.00 0.00 H new ATOM 0 HB3 ASN B 81 6.862 15.472 -5.329 1.00 0.00 H new ATOM 0 HD21 ASN B 81 8.409 15.450 -8.777 1.00 0.00 H new ATOM 0 HD22 ASN B 81 8.236 14.233 -7.509 1.00 0.00 H new ATOM 2261 N GLU B 82 7.849 19.127 -4.580 1.00 0.00 N ATOM 2262 CA GLU B 82 7.013 20.321 -4.535 1.00 0.00 C ATOM 2263 C GLU B 82 5.868 20.259 -5.548 1.00 0.00 C ATOM 2264 O GLU B 82 4.850 20.932 -5.391 1.00 0.00 O ATOM 2265 CB GLU B 82 7.862 21.575 -4.785 1.00 0.00 C ATOM 2266 CG GLU B 82 8.984 21.789 -3.771 1.00 0.00 C ATOM 2267 CD GLU B 82 10.191 20.892 -4.004 1.00 0.00 C ATOM 2268 OE1 GLU B 82 10.235 20.188 -5.041 1.00 0.00 O ATOM 2269 OE2 GLU B 82 11.095 20.866 -3.145 1.00 0.00 O ATOM 0 H GLU B 82 8.838 19.313 -4.744 1.00 0.00 H new ATOM 0 HA GLU B 82 6.573 20.370 -3.539 1.00 0.00 H new ATOM 0 HB2 GLU B 82 8.297 21.512 -5.782 1.00 0.00 H new ATOM 0 HB3 GLU B 82 7.210 22.448 -4.777 1.00 0.00 H new ATOM 0 HG2 GLU B 82 9.303 22.831 -3.808 1.00 0.00 H new ATOM 0 HG3 GLU B 82 8.596 21.610 -2.768 1.00 0.00 H new ATOM 2276 N SER B 83 6.023 19.438 -6.576 1.00 0.00 N ATOM 2277 CA SER B 83 5.002 19.316 -7.597 1.00 0.00 C ATOM 2278 C SER B 83 4.022 18.169 -7.318 1.00 0.00 C ATOM 2279 O SER B 83 2.811 18.313 -7.534 1.00 0.00 O ATOM 2280 CB SER B 83 5.665 19.118 -8.960 1.00 0.00 C ATOM 2281 OG SER B 83 6.701 20.064 -9.155 1.00 0.00 O ATOM 0 H SER B 83 6.844 18.850 -6.722 1.00 0.00 H new ATOM 0 HA SER B 83 4.421 20.238 -7.591 1.00 0.00 H new ATOM 0 HB2 SER B 83 6.070 18.108 -9.030 1.00 0.00 H new ATOM 0 HB3 SER B 83 4.921 19.218 -9.750 1.00 0.00 H new ATOM 0 HG SER B 83 7.114 19.920 -10.032 1.00 0.00 H new ATOM 2287 N THR B 84 4.518 17.037 -6.829 1.00 0.00 N ATOM 2288 CA THR B 84 3.648 15.888 -6.599 1.00 0.00 C ATOM 2289 C THR B 84 3.720 15.284 -5.206 1.00 0.00 C ATOM 2290 O THR B 84 3.239 14.183 -5.030 1.00 0.00 O ATOM 2291 CB THR B 84 3.983 14.768 -7.582 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.395 14.740 -7.822 1.00 0.00 O ATOM 2293 CG2 THR B 84 3.264 14.975 -8.888 1.00 0.00 C ATOM 0 H THR B 84 5.498 16.891 -6.588 1.00 0.00 H new ATOM 0 HA THR B 84 2.643 16.288 -6.733 1.00 0.00 H new ATOM 0 HB THR B 84 3.662 13.822 -7.147 1.00 0.00 H new ATOM 0 HG1 THR B 84 5.752 13.863 -7.569 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.516 14.167 -9.574 1.00 0.00 H new ATOM 0 HG22 THR B 84 2.188 14.981 -8.714 1.00 0.00 H new ATOM 0 HG23 THR B 84 3.566 15.928 -9.323 1.00 0.00 H new ATOM 2301 N ALA B 85 4.258 16.003 -4.233 1.00 0.00 N ATOM 2302 CA ALA B 85 4.413 15.490 -2.864 1.00 0.00 C ATOM 2303 C ALA B 85 3.222 14.625 -2.427 1.00 0.00 C ATOM 2304 O ALA B 85 3.324 13.402 -2.340 1.00 0.00 O ATOM 2305 CB ALA B 85 4.624 16.661 -1.912 1.00 0.00 C ATOM 0 H ALA B 85 4.601 16.955 -4.360 1.00 0.00 H new ATOM 0 HA ALA B 85 5.286 14.838 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.740 16.287 -0.895 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.521 17.208 -2.201 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.762 17.327 -1.958 1.00 0.00 H new ATOM 2311 N VAL B 86 2.094 15.267 -2.182 1.00 0.00 N ATOM 2312 CA VAL B 86 0.862 14.583 -1.781 1.00 0.00 C ATOM 2313 C VAL B 86 0.404 13.553 -2.809 1.00 0.00 C ATOM 2314 O VAL B 86 0.002 12.448 -2.447 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.234 15.636 -1.537 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.611 15.105 -1.905 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.232 16.088 -0.088 1.00 0.00 C ATOM 0 H VAL B 86 1.999 16.280 -2.254 1.00 0.00 H new ATOM 0 HA VAL B 86 1.061 14.030 -0.863 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.012 16.488 -2.179 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.360 15.875 -1.720 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.625 14.831 -2.960 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -1.836 14.227 -1.299 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.014 16.832 0.062 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.417 15.232 0.561 1.00 0.00 H new ATOM 0 HG23 VAL B 86 0.736 16.525 0.155 1.00 0.00 H new ATOM 2327 N LYS B 87 0.502 13.900 -4.082 1.00 0.00 N ATOM 2328 CA LYS B 87 0.081 13.000 -5.149 1.00 0.00 C ATOM 2329 C LYS B 87 0.939 11.742 -5.158 1.00 0.00 C ATOM 2330 O LYS B 87 0.480 10.697 -5.574 1.00 0.00 O ATOM 2331 CB LYS B 87 0.164 13.706 -6.505 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.395 15.124 -6.500 1.00 0.00 C ATOM 2333 CD LYS B 87 -0.242 15.788 -7.860 1.00 0.00 C ATOM 2334 CE LYS B 87 -0.808 17.201 -7.868 1.00 0.00 C ATOM 2335 NZ LYS B 87 0.116 18.184 -7.233 1.00 0.00 N ATOM 0 H LYS B 87 0.868 14.796 -4.404 1.00 0.00 H new ATOM 0 HA LYS B 87 -0.954 12.712 -4.967 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.206 13.738 -6.823 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.377 13.116 -7.244 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.449 15.100 -6.222 1.00 0.00 H new ATOM 0 HG3 LYS B 87 0.120 15.717 -5.744 1.00 0.00 H new ATOM 0 HD2 LYS B 87 0.813 15.818 -8.133 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.750 15.189 -8.616 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -1.007 17.504 -8.896 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -1.763 17.211 -7.342 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.096 19.139 -7.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -0.010 18.162 -6.201 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 1.099 17.938 -7.467 1.00 0.00 H new ATOM 2349 N GLU B 88 2.180 11.854 -4.702 1.00 0.00 N ATOM 2350 CA GLU B 88 3.080 10.714 -4.638 1.00 0.00 C ATOM 2351 C GLU B 88 2.667 9.819 -3.484 1.00 0.00 C ATOM 2352 O GLU B 88 2.593 8.601 -3.631 1.00 0.00 O ATOM 2353 CB GLU B 88 4.525 11.178 -4.483 1.00 0.00 C ATOM 2354 CG GLU B 88 5.089 11.781 -5.757 1.00 0.00 C ATOM 2355 CD GLU B 88 6.297 12.661 -5.516 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.552 13.031 -4.350 1.00 0.00 O ATOM 2357 OE2 GLU B 88 6.979 13.004 -6.506 1.00 0.00 O ATOM 0 H GLU B 88 2.586 12.729 -4.370 1.00 0.00 H new ATOM 0 HA GLU B 88 3.016 10.148 -5.567 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.581 11.915 -3.682 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.143 10.332 -4.182 1.00 0.00 H new ATOM 0 HG2 GLU B 88 5.363 10.978 -6.441 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.313 12.367 -6.249 1.00 0.00 H new ATOM 2364 N ARG B 89 2.392 10.437 -2.336 1.00 0.00 N ATOM 2365 CA ARG B 89 1.923 9.707 -1.164 1.00 0.00 C ATOM 2366 C ARG B 89 0.673 8.954 -1.555 1.00 0.00 C ATOM 2367 O ARG B 89 0.535 7.759 -1.311 1.00 0.00 O ATOM 2368 CB ARG B 89 1.603 10.678 -0.013 1.00 0.00 C ATOM 2369 CG ARG B 89 0.309 10.382 0.749 1.00 0.00 C ATOM 2370 CD ARG B 89 -0.378 11.661 1.225 1.00 0.00 C ATOM 2371 NE ARG B 89 -1.689 11.865 0.591 1.00 0.00 N ATOM 2372 CZ ARG B 89 -2.446 12.959 0.750 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -2.075 13.926 1.574 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -3.588 13.081 0.090 1.00 0.00 N ATOM 0 H ARG B 89 2.487 11.443 -2.195 1.00 0.00 H new ATOM 0 HA ARG B 89 2.697 9.020 -0.822 1.00 0.00 H new ATOM 0 HB2 ARG B 89 2.433 10.665 0.694 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.545 11.689 -0.417 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -0.371 9.823 0.106 1.00 0.00 H new ATOM 0 HG3 ARG B 89 0.530 9.748 1.607 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -0.503 11.621 2.307 1.00 0.00 H new ATOM 0 HD3 ARG B 89 0.263 12.516 1.010 1.00 0.00 H new ATOM 0 HE ARG B 89 -2.046 11.123 -0.011 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -1.203 13.844 2.097 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -2.661 14.754 1.686 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -3.894 12.341 -0.542 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -4.162 13.915 0.213 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.211 9.682 -2.202 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.467 9.146 -2.656 1.00 0.00 C ATOM 2390 C ASP B 90 -1.303 8.156 -3.783 1.00 0.00 C ATOM 2391 O ASP B 90 -2.059 7.204 -3.869 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.400 10.277 -3.074 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.285 10.709 -1.934 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.218 10.066 -0.863 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -4.050 11.668 -2.098 1.00 0.00 O ATOM 0 H ASP B 90 -0.074 10.667 -2.427 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.905 8.602 -1.819 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.812 11.126 -3.422 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.016 9.951 -3.912 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.299 8.358 -4.613 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.069 7.473 -5.756 1.00 0.00 C ATOM 2402 C ALA B 91 0.442 6.142 -5.292 1.00 0.00 C ATOM 2403 O ALA B 91 -0.073 5.085 -5.657 1.00 0.00 O ATOM 2404 CB ALA B 91 0.946 8.075 -6.703 1.00 0.00 C ATOM 0 H ALA B 91 0.372 9.121 -4.525 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.020 7.345 -6.273 1.00 0.00 H new ATOM 0 HB1 ALA B 91 1.102 7.401 -7.545 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.579 9.034 -7.069 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.890 8.224 -6.178 1.00 0.00 H new ATOM 2410 N VAL B 92 1.477 6.222 -4.491 1.00 0.00 N ATOM 2411 CA VAL B 92 2.101 5.065 -3.926 1.00 0.00 C ATOM 2412 C VAL B 92 1.059 4.290 -3.144 1.00 0.00 C ATOM 2413 O VAL B 92 0.910 3.089 -3.313 1.00 0.00 O ATOM 2414 CB VAL B 92 3.255 5.512 -3.023 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.641 4.434 -2.035 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.450 5.920 -3.859 1.00 0.00 C ATOM 0 H VAL B 92 1.909 7.104 -4.215 1.00 0.00 H new ATOM 0 HA VAL B 92 2.507 4.419 -4.705 1.00 0.00 H new ATOM 0 HB VAL B 92 2.914 6.374 -2.450 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.463 4.788 -1.412 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.785 4.195 -1.404 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.954 3.541 -2.575 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.262 6.235 -3.204 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.778 5.073 -4.462 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.171 6.746 -4.514 1.00 0.00 H new ATOM 2426 N LYS B 93 0.304 5.025 -2.341 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.765 4.466 -1.532 1.00 0.00 C ATOM 2428 C LYS B 93 -1.822 3.849 -2.414 1.00 0.00 C ATOM 2429 O LYS B 93 -2.293 2.748 -2.153 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.410 5.581 -0.706 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.656 5.150 0.052 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.921 5.398 -0.760 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.339 6.850 -0.712 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.360 7.475 -2.065 1.00 0.00 N ATOM 0 H LYS B 93 0.418 6.033 -2.233 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.346 3.701 -0.879 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.678 5.961 0.006 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.668 6.407 -1.369 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -2.584 4.091 0.299 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.716 5.694 0.995 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.753 5.101 -1.795 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -4.728 4.774 -0.377 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -5.329 6.927 -0.263 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -3.654 7.402 -0.069 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.636 8.474 -1.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.414 7.411 -2.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -5.046 6.976 -2.667 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.207 4.582 -3.447 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.236 4.116 -4.347 1.00 0.00 C ATOM 2450 C ASP B 94 -2.867 2.755 -4.905 1.00 0.00 C ATOM 2451 O ASP B 94 -3.630 1.793 -4.790 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.479 5.096 -5.487 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.564 6.098 -5.141 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -5.167 5.969 -4.046 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -4.808 7.013 -5.943 1.00 0.00 O ATOM 0 H ASP B 94 -1.821 5.498 -3.678 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.160 4.036 -3.774 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.554 5.625 -5.716 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.763 4.547 -6.385 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.674 2.691 -5.489 1.00 0.00 N ATOM 2461 CA LEU B 95 -1.155 1.460 -6.059 1.00 0.00 C ATOM 2462 C LEU B 95 -1.021 0.402 -4.976 1.00 0.00 C ATOM 2463 O LEU B 95 -1.472 -0.726 -5.140 1.00 0.00 O ATOM 2464 CB LEU B 95 0.196 1.722 -6.732 1.00 0.00 C ATOM 2465 CG LEU B 95 0.216 1.544 -8.256 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.085 2.036 -8.876 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.394 2.290 -8.857 1.00 0.00 C ATOM 0 H LEU B 95 -1.045 3.489 -5.578 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.850 1.094 -6.814 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.509 2.740 -6.498 1.00 0.00 H new ATOM 0 HB3 LEU B 95 0.937 1.052 -6.295 1.00 0.00 H new ATOM 0 HG LEU B 95 0.321 0.481 -8.473 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.047 1.900 -9.957 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -1.921 1.468 -8.467 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.220 3.093 -8.648 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.396 2.155 -9.939 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.310 3.351 -8.624 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.323 1.899 -8.441 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.430 0.798 -3.861 1.00 0.00 N ATOM 2480 CA LEU B 96 -0.224 -0.084 -2.721 1.00 0.00 C ATOM 2481 C LEU B 96 -1.528 -0.750 -2.292 1.00 0.00 C ATOM 2482 O LEU B 96 -1.638 -1.972 -2.288 1.00 0.00 O ATOM 2483 CB LEU B 96 0.359 0.727 -1.567 1.00 0.00 C ATOM 2484 CG LEU B 96 1.872 0.893 -1.617 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.341 1.807 -0.499 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.560 -0.460 -1.552 1.00 0.00 C ATOM 0 H LEU B 96 -0.077 1.745 -3.719 1.00 0.00 H new ATOM 0 HA LEU B 96 0.469 -0.875 -3.008 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -0.103 1.714 -1.563 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.089 0.245 -0.627 1.00 0.00 H new ATOM 0 HG LEU B 96 2.143 1.357 -2.565 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.424 1.916 -0.548 1.00 0.00 H new ATOM 0 HD12 LEU B 96 1.873 2.785 -0.608 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.063 1.377 0.463 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.640 -0.321 -1.589 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.290 -0.961 -0.622 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.244 -1.070 -2.398 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.507 0.074 -1.956 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.820 -0.386 -1.523 1.00 0.00 C ATOM 2500 C GLN B 97 -4.473 -1.352 -2.518 1.00 0.00 C ATOM 2501 O GLN B 97 -4.984 -2.395 -2.123 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.707 0.833 -1.256 1.00 0.00 C ATOM 2503 CG GLN B 97 -6.180 0.642 -1.547 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.837 1.922 -2.034 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -8.002 2.185 -1.751 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -6.089 2.729 -2.777 1.00 0.00 N ATOM 0 H GLN B 97 -2.414 1.090 -1.976 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.696 -0.959 -0.604 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.595 1.120 -0.210 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.341 1.666 -1.856 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.302 -0.137 -2.300 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.685 0.296 -0.645 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -5.124 2.477 -2.991 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -6.479 3.601 -3.133 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.417 -1.024 -3.801 1.00 0.00 N ATOM 2516 CA GLN B 98 -5.042 -1.855 -4.833 1.00 0.00 C ATOM 2517 C GLN B 98 -4.241 -3.120 -5.151 1.00 0.00 C ATOM 2518 O GLN B 98 -4.812 -4.147 -5.515 1.00 0.00 O ATOM 2519 CB GLN B 98 -5.236 -1.050 -6.122 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.417 -0.099 -6.084 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.277 1.037 -7.081 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -6.643 0.909 -8.247 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -5.743 2.159 -6.629 1.00 0.00 N ATOM 0 H GLN B 98 -3.947 -0.191 -4.157 1.00 0.00 H new ATOM 0 HA GLN B 98 -6.005 -2.167 -4.430 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.329 -0.479 -6.321 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.366 -1.742 -6.954 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -7.332 -0.652 -6.294 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -6.516 0.313 -5.080 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -5.451 2.228 -5.654 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -5.623 2.955 -7.255 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.926 -3.050 -5.010 1.00 0.00 N ATOM 2533 CA LEU B 99 -2.064 -4.186 -5.329 1.00 0.00 C ATOM 2534 C LEU B 99 -1.817 -5.095 -4.132 1.00 0.00 C ATOM 2535 O LEU B 99 -1.300 -6.202 -4.286 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.738 -3.680 -5.875 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.813 -3.064 -7.267 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.238 -1.985 -7.417 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.628 -4.137 -8.329 1.00 0.00 C ATOM 0 H LEU B 99 -2.430 -2.223 -4.678 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.581 -4.784 -6.080 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.337 -2.937 -5.185 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -0.030 -4.509 -5.897 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.796 -2.613 -7.399 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.175 -1.552 -8.415 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.069 -1.207 -6.673 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.228 -2.418 -7.271 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.684 -3.683 -9.318 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.345 -4.611 -8.202 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.413 -4.887 -8.229 1.00 0.00 H new ATOM 2551 N LEU B 100 -2.168 -4.631 -2.947 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.982 -5.424 -1.738 1.00 0.00 C ATOM 2553 C LEU B 100 -2.758 -6.741 -1.790 1.00 0.00 C ATOM 2554 O LEU B 100 -2.167 -7.805 -1.610 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.386 -4.630 -0.508 1.00 0.00 C ATOM 2556 CG LEU B 100 -1.269 -3.828 0.126 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.822 -3.008 1.283 1.00 0.00 C ATOM 2558 CD2 LEU B 100 -0.155 -4.769 0.569 1.00 0.00 C ATOM 0 H LEU B 100 -2.583 -3.712 -2.792 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.921 -5.666 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -3.193 -3.950 -0.781 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.787 -5.318 0.236 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.845 -3.132 -0.598 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.017 -2.431 1.738 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.590 -2.329 0.913 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.256 -3.676 2.027 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.649 -4.192 1.025 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.547 -5.481 1.295 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.231 -5.308 -0.296 1.00 0.00 H new ATOM 2570 N PRO B 101 -4.083 -6.706 -2.055 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.905 -7.923 -2.138 1.00 0.00 C ATOM 2572 C PRO B 101 -4.527 -8.802 -3.330 1.00 0.00 C ATOM 2573 O PRO B 101 -5.248 -9.728 -3.691 1.00 0.00 O ATOM 2574 CB PRO B 101 -6.328 -7.391 -2.291 1.00 0.00 C ATOM 2575 CG PRO B 101 -6.155 -6.033 -2.864 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.895 -5.495 -2.269 1.00 0.00 C ATOM 0 HA PRO B 101 -4.771 -8.560 -1.264 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.921 -8.027 -2.948 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.844 -7.355 -1.332 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -6.087 -6.074 -3.951 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -7.005 -5.395 -2.621 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.401 -4.792 -2.939 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -5.084 -4.966 -1.335 1.00 0.00 H new ATOM 2584 N LYS B 102 -3.424 -8.465 -3.969 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.914 -9.240 -5.076 1.00 0.00 C ATOM 2586 C LYS B 102 -1.810 -10.170 -4.571 1.00 0.00 C ATOM 2587 O LYS B 102 -1.626 -11.271 -5.088 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.388 -8.309 -6.174 1.00 0.00 C ATOM 2589 CG LYS B 102 -1.859 -9.023 -7.410 1.00 0.00 C ATOM 2590 CD LYS B 102 -1.330 -8.017 -8.436 1.00 0.00 C ATOM 2591 CE LYS B 102 -0.413 -8.663 -9.472 1.00 0.00 C ATOM 2592 NZ LYS B 102 0.514 -7.670 -10.097 1.00 0.00 N ATOM 0 H LYS B 102 -2.860 -7.648 -3.734 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.715 -9.843 -5.504 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -3.190 -7.635 -6.475 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -1.592 -7.692 -5.758 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -1.063 -9.711 -7.125 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -2.653 -9.622 -7.857 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -2.171 -7.546 -8.944 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -0.787 -7.227 -7.918 1.00 0.00 H new ATOM 0 HE2 LYS B 102 0.169 -9.454 -8.998 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -1.017 -9.133 -10.248 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 1.411 -8.137 -10.340 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 0.080 -7.285 -10.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.697 -6.896 -9.427 1.00 0.00 H new ATOM 2606 N PHE B 103 -1.087 -9.728 -3.534 1.00 0.00 N ATOM 2607 CA PHE B 103 0.015 -10.509 -2.989 1.00 0.00 C ATOM 2608 C PHE B 103 -0.135 -10.819 -1.520 1.00 0.00 C ATOM 2609 O PHE B 103 0.644 -11.599 -0.996 1.00 0.00 O ATOM 2610 CB PHE B 103 1.333 -9.798 -3.250 1.00 0.00 C ATOM 2611 CG PHE B 103 1.612 -9.686 -4.709 1.00 0.00 C ATOM 2612 CD1 PHE B 103 1.989 -10.803 -5.438 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.469 -8.478 -5.360 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.222 -10.712 -6.793 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.705 -8.381 -6.711 1.00 0.00 C ATOM 2616 CZ PHE B 103 2.082 -9.498 -7.429 1.00 0.00 C ATOM 0 H PHE B 103 -1.249 -8.838 -3.062 1.00 0.00 H new ATOM 0 HA PHE B 103 0.002 -11.470 -3.504 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.305 -8.803 -2.806 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.143 -10.341 -2.764 1.00 0.00 H new ATOM 0 HD1 PHE B 103 2.101 -11.754 -4.939 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.169 -7.602 -4.804 1.00 0.00 H new ATOM 0 HE1 PHE B 103 2.513 -11.588 -7.354 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.595 -7.430 -7.211 1.00 0.00 H new ATOM 0 HZ PHE B 103 2.267 -9.420 -8.490 1.00 0.00 H new ATOM 2626 N LYS B 104 -1.144 -10.256 -0.867 1.00 0.00 N ATOM 2627 CA LYS B 104 -1.347 -10.499 0.557 1.00 0.00 C ATOM 2628 C LYS B 104 -1.338 -11.992 0.850 1.00 0.00 C ATOM 2629 O LYS B 104 -2.169 -12.741 0.332 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.658 -9.880 1.032 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.454 -8.681 1.934 1.00 0.00 C ATOM 2632 CD LYS B 104 -3.670 -8.421 2.798 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.305 -7.569 4.001 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.497 -7.016 4.692 1.00 0.00 N ATOM 0 H LYS B 104 -1.829 -9.633 -1.295 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.527 -10.029 1.099 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -3.247 -9.580 0.165 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -3.237 -10.634 1.565 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.584 -8.847 2.569 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -2.243 -7.800 1.328 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.438 -7.918 2.210 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -4.093 -9.368 3.133 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -2.728 -8.169 4.705 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.663 -6.749 3.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.283 -6.061 5.043 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -5.294 -6.969 4.026 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -4.751 -7.630 5.492 1.00 0.00 H new