USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1226 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 14 LYS NZ :NH3+ -162:sc= 1.49 (180deg=-0.549!) USER MOD Set 1.2: B 81 ASN : amide:sc= 2.15 K(o=4.8,f=-7.8!) USER MOD Set 1.3: B 84 THR OG1 : rot 89:sc= 1.13 USER MOD Set 2.1: B 78 HIS : no HE2:sc= -0.347 K(o=-0.35,f=-1.4) USER MOD Set 2.2: B 80 SER OG : rot -140:sc= 0 USER MOD Set 3.1: B 56 SER OG : rot -121:sc= 1.61 USER MOD Set 3.2: B 64 GLN : amide:sc= -1.62 K(o=-0.018,f=-9.2!) USER MOD Set 4.1: B 54 LYS NZ :NH3+ -177:sc= 2.32 (180deg=1.03) USER MOD Set 4.2: B 66 GLN : amide:sc= 0.495! C(o=2!,f=-15!) USER MOD Set 4.3: B 76 ASN : amide:sc= -0.856! C(o=2!,f=-8.4!) USER MOD Set 5.1: B 45 HIS : no HD1:sc= -1.29 X(o=-1.3,f=-1.6) USER MOD Set 5.2: B 75 THR OG1 : rot -170:sc= 0 USER MOD Set 6.1: B 17 GLN : amide:sc= -5.04! C(o=-4.6!,f=-3.9!) USER MOD Set 6.2: B 18 LYS NZ :NH3+ -134:sc= 0.455 (180deg=-0.0383) USER MOD Set 7.1: A 405 TYR OH : rot 150:sc= -0.314 USER MOD Set 7.2: A 426 TYR OH : rot 180:sc= -0.749 USER MOD Single : A 397 MET CE :methyl -122:sc= -0.233 (180deg=-1.87!) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 406 SER OG : rot 100:sc= 1.26 USER MOD Single : A 409 SER OG : rot -93:sc= 1.02 USER MOD Single : A 410 GLN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 417 GLN : amide:sc= -0.593 X(o=-0.59,f=-0.25) USER MOD Single : A 418 MET CE :methyl -166:sc= -3.17! (180deg=-3.68!) USER MOD Single : A 419 THR OG1 : rot 161:sc= 0.757 USER MOD Single : A 423 LYS NZ :NH3+ 170:sc= -4.49! (180deg=-4.91!) USER MOD Single : A 429 MET CE :methyl -163:sc= -3.83! (180deg=-5.36!) USER MOD Single : A 431 GLN : amide:sc= -0.401! K(o=-0.4!,f=-1.3) USER MOD Single : A 433 MET CE :methyl -121:sc= -3.05! (180deg=-4.87!) USER MOD Single : B 13 LYS NZ :NH3+ -120:sc= 2.41 (180deg=-1.38) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 GLN : amide:sc= -1.75! K(o=-1.8!,f=-0.38) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -135:sc= -3.12! (180deg=-8.72!) USER MOD Single : B 38 LYS NZ :NH3+ -168:sc= 0.29! (180deg=0.0884) USER MOD Single : B 42 THR OG1 : rot -170:sc= 0 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -166:sc= -0.107 (180deg=-0.446) USER MOD Single : B 47 TYR OH : rot 30:sc= -2.57! USER MOD Single : B 51 LYS NZ :NH3+ -149:sc= 1.2 (180deg=1.08) USER MOD Single : B 52 CYS SG : rot 3:sc= 0.164 USER MOD Single : B 53 GLN : amide:sc= -3.66! K(o=-3.7!,f=-2.9) USER MOD Single : B 60 LYS NZ :NH3+ 146:sc= 1.21! (180deg=-1.03!) USER MOD Single : B 62 LYS NZ :NH3+ -160:sc= -0.376 (180deg=-2.19!) USER MOD Single : B 70 HIS : no HE2:sc= -3.7! C(o=-3.7!,f=-7.7!) USER MOD Single : B 74 THR OG1 : rot 33:sc= 0.449 USER MOD Single : B 83 SER OG : rot -87:sc= 1.28 USER MOD Single : B 87 LYS NZ :NH3+ 178:sc= 1.3 (180deg=1.27) USER MOD Single : B 93 LYS NZ :NH3+ 144:sc= 2.86 (180deg=0.788) USER MOD Single : B 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 GLN : amide:sc= 0.455 K(o=0.45,f=-1.4) USER MOD Single : B 102 LYS NZ :NH3+ -148:sc= 0.0172 (180deg=-0.486) USER MOD Single : B 104 LYS NZ :NH3+ -152:sc= 1.9 (180deg=-0.318!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 9.982 12.037 11.479 1.00 0.00 N ATOM 59 CA GLU A 382 8.672 12.302 12.053 1.00 0.00 C ATOM 60 C GLU A 382 8.218 11.172 12.983 1.00 0.00 C ATOM 61 O GLU A 382 9.041 10.499 13.604 1.00 0.00 O ATOM 62 CB GLU A 382 7.650 12.526 10.941 1.00 0.00 C ATOM 63 CG GLU A 382 7.487 11.343 10.007 1.00 0.00 C ATOM 64 CD GLU A 382 6.037 11.058 9.707 1.00 0.00 C ATOM 65 OE1 GLU A 382 5.162 11.757 10.266 1.00 0.00 O ATOM 66 OE2 GLU A 382 5.765 10.147 8.909 1.00 0.00 O ATOM 0 HA GLU A 382 8.748 13.206 12.657 1.00 0.00 H new ATOM 0 HB2 GLU A 382 6.684 12.757 11.390 1.00 0.00 H new ATOM 0 HB3 GLU A 382 7.947 13.398 10.358 1.00 0.00 H new ATOM 0 HG2 GLU A 382 8.018 11.540 9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 382 7.945 10.461 10.455 1.00 0.00 H new ATOM 73 N GLU A 383 6.900 10.990 13.085 1.00 0.00 N ATOM 74 CA GLU A 383 6.316 9.974 13.953 1.00 0.00 C ATOM 75 C GLU A 383 5.009 9.413 13.365 1.00 0.00 C ATOM 76 O GLU A 383 5.032 8.519 12.519 1.00 0.00 O ATOM 77 CB GLU A 383 6.063 10.568 15.350 1.00 0.00 C ATOM 78 CG GLU A 383 6.145 12.095 15.403 1.00 0.00 C ATOM 79 CD GLU A 383 5.072 12.774 14.571 1.00 0.00 C ATOM 80 OE1 GLU A 383 3.906 12.749 14.994 1.00 0.00 O ATOM 81 OE2 GLU A 383 5.395 13.307 13.479 1.00 0.00 O ATOM 0 H GLU A 383 6.213 11.541 12.570 1.00 0.00 H new ATOM 0 HA GLU A 383 7.022 9.147 14.033 1.00 0.00 H new ATOM 0 HB2 GLU A 383 5.077 10.256 15.693 1.00 0.00 H new ATOM 0 HB3 GLU A 383 6.790 10.151 16.047 1.00 0.00 H new ATOM 0 HG2 GLU A 383 6.056 12.423 16.439 1.00 0.00 H new ATOM 0 HG3 GLU A 383 7.126 12.413 15.051 1.00 0.00 H new ATOM 88 N ASP A 384 3.874 9.947 13.818 1.00 0.00 N ATOM 89 CA ASP A 384 2.555 9.514 13.346 1.00 0.00 C ATOM 90 C ASP A 384 1.624 10.721 13.336 1.00 0.00 C ATOM 91 O ASP A 384 0.456 10.636 13.716 1.00 0.00 O ATOM 92 CB ASP A 384 1.982 8.397 14.234 1.00 0.00 C ATOM 93 CG ASP A 384 1.387 7.244 13.431 1.00 0.00 C ATOM 94 OD1 ASP A 384 0.211 7.331 13.009 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.090 6.231 13.228 1.00 0.00 O ATOM 0 H ASP A 384 3.841 10.688 14.518 1.00 0.00 H new ATOM 0 HA ASP A 384 2.650 9.107 12.339 1.00 0.00 H new ATOM 0 HB2 ASP A 384 2.771 8.013 14.880 1.00 0.00 H new ATOM 0 HB3 ASP A 384 1.213 8.815 14.884 1.00 0.00 H new ATOM 100 N ASP A 385 2.200 11.839 12.894 1.00 0.00 N ATOM 101 CA ASP A 385 1.539 13.151 12.797 1.00 0.00 C ATOM 102 C ASP A 385 0.062 13.061 12.410 1.00 0.00 C ATOM 103 O ASP A 385 -0.802 13.627 13.080 1.00 0.00 O ATOM 104 CB ASP A 385 2.288 13.984 11.756 1.00 0.00 C ATOM 105 CG ASP A 385 2.142 15.485 11.933 1.00 0.00 C ATOM 106 OD1 ASP A 385 1.115 15.938 12.473 1.00 0.00 O ATOM 107 OD2 ASP A 385 3.043 16.219 11.466 1.00 0.00 O ATOM 0 H ASP A 385 3.171 11.863 12.582 1.00 0.00 H new ATOM 0 HA ASP A 385 1.570 13.612 13.784 1.00 0.00 H new ATOM 0 HB2 ASP A 385 3.346 13.727 11.795 1.00 0.00 H new ATOM 0 HB3 ASP A 385 1.930 13.711 10.763 1.00 0.00 H new ATOM 112 N GLU A 386 -0.222 12.353 11.326 1.00 0.00 N ATOM 113 CA GLU A 386 -1.566 12.194 10.834 1.00 0.00 C ATOM 114 C GLU A 386 -1.513 11.130 9.788 1.00 0.00 C ATOM 115 O GLU A 386 -0.938 11.332 8.718 1.00 0.00 O ATOM 116 CB GLU A 386 -2.078 13.477 10.216 1.00 0.00 C ATOM 117 CG GLU A 386 -3.437 13.920 10.722 1.00 0.00 C ATOM 118 CD GLU A 386 -3.870 15.222 10.090 1.00 0.00 C ATOM 119 OE1 GLU A 386 -3.285 16.271 10.436 1.00 0.00 O ATOM 120 OE2 GLU A 386 -4.766 15.197 9.230 1.00 0.00 O ATOM 0 H GLU A 386 0.483 11.874 10.766 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.238 11.932 11.652 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.356 14.271 10.408 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.131 13.349 9.135 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -4.175 13.148 10.507 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.402 14.035 11.805 1.00 0.00 H new ATOM 127 N PHE A 387 -2.075 9.999 10.095 1.00 0.00 N ATOM 128 CA PHE A 387 -2.031 8.900 9.176 1.00 0.00 C ATOM 129 C PHE A 387 -3.342 8.150 9.112 1.00 0.00 C ATOM 130 O PHE A 387 -3.870 7.702 10.127 1.00 0.00 O ATOM 131 CB PHE A 387 -0.914 7.935 9.568 1.00 0.00 C ATOM 132 CG PHE A 387 0.463 8.423 9.246 1.00 0.00 C ATOM 133 CD1 PHE A 387 0.932 8.406 7.944 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.288 8.909 10.245 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.190 8.861 7.648 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.546 9.368 9.949 1.00 0.00 C ATOM 137 CZ PHE A 387 2.994 9.343 8.653 1.00 0.00 C ATOM 0 H PHE A 387 -2.567 9.813 10.969 1.00 0.00 H new ATOM 0 HA PHE A 387 -1.839 9.317 8.188 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.977 7.741 10.639 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.077 6.984 9.061 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.300 8.030 7.153 1.00 0.00 H new ATOM 0 HD2 PHE A 387 0.938 8.927 11.267 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.548 8.841 6.629 1.00 0.00 H new ATOM 0 HE2 PHE A 387 3.182 9.748 10.734 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.985 9.704 8.421 1.00 0.00 H new ATOM 147 N GLU A 388 -3.843 8.010 7.901 1.00 0.00 N ATOM 148 CA GLU A 388 -5.063 7.272 7.659 1.00 0.00 C ATOM 149 C GLU A 388 -4.661 5.849 7.399 1.00 0.00 C ATOM 150 O GLU A 388 -3.858 5.610 6.491 1.00 0.00 O ATOM 151 CB GLU A 388 -5.810 7.794 6.423 1.00 0.00 C ATOM 152 CG GLU A 388 -6.686 9.006 6.670 1.00 0.00 C ATOM 153 CD GLU A 388 -7.813 8.730 7.641 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.565 8.758 8.864 1.00 0.00 O ATOM 155 OE2 GLU A 388 -8.944 8.481 7.178 1.00 0.00 O ATOM 0 H GLU A 388 -3.417 8.403 7.062 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.725 7.375 8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.079 8.043 5.653 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.430 6.991 6.026 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.072 9.819 7.056 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.105 9.345 5.722 1.00 0.00 H new ATOM 162 N GLU A 389 -5.135 4.911 8.197 1.00 0.00 N ATOM 163 CA GLU A 389 -4.791 3.532 7.942 1.00 0.00 C ATOM 164 C GLU A 389 -5.410 3.168 6.606 1.00 0.00 C ATOM 165 O GLU A 389 -6.625 2.998 6.495 1.00 0.00 O ATOM 166 CB GLU A 389 -5.289 2.606 9.058 1.00 0.00 C ATOM 167 CG GLU A 389 -4.775 1.174 8.935 1.00 0.00 C ATOM 168 CD GLU A 389 -3.967 0.722 10.140 1.00 0.00 C ATOM 169 OE1 GLU A 389 -3.170 1.528 10.664 1.00 0.00 O ATOM 170 OE2 GLU A 389 -4.119 -0.451 10.559 1.00 0.00 O ATOM 0 H GLU A 389 -5.740 5.073 9.002 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.708 3.408 7.916 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -4.981 3.013 10.021 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -6.379 2.594 9.051 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -5.622 0.501 8.801 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -4.158 1.092 8.040 1.00 0.00 H new ATOM 177 N VAL A 390 -4.574 3.071 5.586 1.00 0.00 N ATOM 178 CA VAL A 390 -5.063 2.769 4.269 1.00 0.00 C ATOM 179 C VAL A 390 -5.390 1.297 4.191 1.00 0.00 C ATOM 180 O VAL A 390 -4.518 0.447 4.397 1.00 0.00 O ATOM 181 CB VAL A 390 -4.070 3.097 3.138 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.772 3.058 1.794 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.414 4.440 3.341 1.00 0.00 C ATOM 0 H VAL A 390 -3.564 3.197 5.652 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.940 3.399 4.120 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.287 2.339 3.158 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -4.058 3.292 1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -5.185 2.063 1.628 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.578 3.791 1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.721 4.634 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -4.177 5.218 3.363 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.869 4.440 4.285 1.00 0.00 H new ATOM 193 N ALA A 391 -6.630 1.001 3.898 1.00 0.00 N ATOM 194 CA ALA A 391 -7.069 -0.365 3.801 1.00 0.00 C ATOM 195 C ALA A 391 -6.662 -0.934 2.462 1.00 0.00 C ATOM 196 O ALA A 391 -6.718 -0.247 1.448 1.00 0.00 O ATOM 197 CB ALA A 391 -8.575 -0.460 3.989 1.00 0.00 C ATOM 0 H ALA A 391 -7.357 1.694 3.721 1.00 0.00 H new ATOM 0 HA ALA A 391 -6.596 -0.946 4.592 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.886 -1.502 3.912 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.844 -0.073 4.972 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -9.076 0.126 3.218 1.00 0.00 H new ATOM 203 N ASP A 392 -6.184 -2.159 2.490 1.00 0.00 N ATOM 204 CA ASP A 392 -5.783 -2.884 1.296 1.00 0.00 C ATOM 205 C ASP A 392 -7.013 -3.233 0.478 1.00 0.00 C ATOM 206 O ASP A 392 -7.394 -4.397 0.356 1.00 0.00 O ATOM 207 CB ASP A 392 -5.029 -4.157 1.686 1.00 0.00 C ATOM 208 CG ASP A 392 -5.582 -4.828 2.933 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.552 -4.201 4.018 1.00 0.00 O ATOM 210 OD2 ASP A 392 -6.003 -5.999 2.845 1.00 0.00 O ATOM 0 H ASP A 392 -6.060 -2.690 3.352 1.00 0.00 H new ATOM 0 HA ASP A 392 -5.122 -2.257 0.697 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -5.067 -4.862 0.856 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.979 -3.913 1.849 1.00 0.00 H new ATOM 215 N ASP A 393 -7.616 -2.209 -0.090 1.00 0.00 N ATOM 216 CA ASP A 393 -8.829 -2.371 -0.858 1.00 0.00 C ATOM 217 C ASP A 393 -8.547 -2.464 -2.347 1.00 0.00 C ATOM 218 O ASP A 393 -8.009 -1.533 -2.952 1.00 0.00 O ATOM 219 CB ASP A 393 -9.757 -1.195 -0.578 1.00 0.00 C ATOM 220 CG ASP A 393 -11.227 -1.581 -0.605 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.650 -2.301 -1.537 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.971 -1.156 0.300 1.00 0.00 O ATOM 0 H ASP A 393 -7.280 -1.248 -0.032 1.00 0.00 H new ATOM 0 HA ASP A 393 -9.302 -3.306 -0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.516 -0.773 0.397 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -9.578 -0.414 -1.317 1.00 0.00 H new ATOM 227 N PRO A 394 -8.903 -3.598 -2.957 1.00 0.00 N ATOM 228 CA PRO A 394 -8.717 -3.817 -4.383 1.00 0.00 C ATOM 229 C PRO A 394 -9.832 -3.180 -5.198 1.00 0.00 C ATOM 230 O PRO A 394 -10.868 -2.782 -4.660 1.00 0.00 O ATOM 231 CB PRO A 394 -8.778 -5.334 -4.507 1.00 0.00 C ATOM 232 CG PRO A 394 -9.704 -5.752 -3.424 1.00 0.00 C ATOM 233 CD PRO A 394 -9.504 -4.771 -2.295 1.00 0.00 C ATOM 0 HA PRO A 394 -7.791 -3.379 -4.756 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -9.147 -5.639 -5.486 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.793 -5.783 -4.384 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.738 -5.741 -3.770 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.488 -6.769 -3.098 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.448 -4.519 -1.811 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.849 -5.176 -1.524 1.00 0.00 H new ATOM 241 N ILE A 395 -9.632 -3.110 -6.496 1.00 0.00 N ATOM 242 CA ILE A 395 -10.622 -2.527 -7.377 1.00 0.00 C ATOM 243 C ILE A 395 -11.312 -3.616 -8.178 1.00 0.00 C ATOM 244 O ILE A 395 -10.720 -4.231 -9.066 1.00 0.00 O ATOM 245 CB ILE A 395 -9.992 -1.482 -8.330 1.00 0.00 C ATOM 246 CG1 ILE A 395 -9.626 -0.221 -7.551 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.930 -1.136 -9.482 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.750 0.300 -6.688 1.00 0.00 C ATOM 0 H ILE A 395 -8.793 -3.450 -6.966 1.00 0.00 H new ATOM 0 HA ILE A 395 -11.357 -2.012 -6.759 1.00 0.00 H new ATOM 0 HB ILE A 395 -9.089 -1.918 -8.758 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.762 -0.431 -6.921 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -9.327 0.557 -8.254 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -10.454 -0.400 -10.130 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -11.149 -2.037 -10.056 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.858 -0.724 -9.085 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -10.420 1.197 -6.163 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -11.608 0.541 -7.315 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -11.034 -0.461 -5.962 1.00 0.00 H new ATOM 260 N VAL A 396 -12.556 -3.873 -7.833 1.00 0.00 N ATOM 261 CA VAL A 396 -13.341 -4.873 -8.517 1.00 0.00 C ATOM 262 C VAL A 396 -14.457 -4.184 -9.290 1.00 0.00 C ATOM 263 O VAL A 396 -15.313 -3.512 -8.715 1.00 0.00 O ATOM 264 CB VAL A 396 -13.884 -5.949 -7.535 1.00 0.00 C ATOM 265 CG1 VAL A 396 -14.191 -5.360 -6.167 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.096 -6.673 -8.103 1.00 0.00 C ATOM 0 H VAL A 396 -13.047 -3.397 -7.076 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.705 -5.408 -9.223 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.091 -6.686 -7.406 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.568 -6.144 -5.510 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.282 -4.936 -5.741 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.944 -4.578 -6.268 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.445 -7.416 -7.386 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.892 -5.954 -8.296 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.821 -7.168 -9.034 1.00 0.00 H new ATOM 276 N MET A 397 -14.428 -4.337 -10.604 1.00 0.00 N ATOM 277 CA MET A 397 -15.398 -3.699 -11.458 1.00 0.00 C ATOM 278 C MET A 397 -16.657 -4.527 -11.532 1.00 0.00 C ATOM 279 O MET A 397 -16.603 -5.753 -11.571 1.00 0.00 O ATOM 280 CB MET A 397 -14.815 -3.487 -12.856 1.00 0.00 C ATOM 281 CG MET A 397 -13.399 -2.933 -12.838 1.00 0.00 C ATOM 282 SD MET A 397 -12.772 -2.550 -14.483 1.00 0.00 S ATOM 283 CE MET A 397 -13.604 -1.000 -14.804 1.00 0.00 C ATOM 0 H MET A 397 -13.737 -4.902 -11.098 1.00 0.00 H new ATOM 0 HA MET A 397 -15.649 -2.726 -11.035 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.820 -4.436 -13.392 1.00 0.00 H new ATOM 0 HB3 MET A 397 -15.458 -2.804 -13.411 1.00 0.00 H new ATOM 0 HG2 MET A 397 -13.376 -2.031 -12.227 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.737 -3.657 -12.363 1.00 0.00 H new ATOM 0 HE1 MET A 397 -14.201 -1.088 -15.712 1.00 0.00 H new ATOM 0 HE2 MET A 397 -14.255 -0.756 -13.965 1.00 0.00 H new ATOM 0 HE3 MET A 397 -12.864 -0.210 -14.931 1.00 0.00 H new ATOM 293 N VAL A 398 -17.778 -3.842 -11.496 1.00 0.00 N ATOM 294 CA VAL A 398 -19.072 -4.476 -11.578 1.00 0.00 C ATOM 295 C VAL A 398 -19.898 -3.770 -12.634 1.00 0.00 C ATOM 296 O VAL A 398 -20.101 -2.559 -12.552 1.00 0.00 O ATOM 297 CB VAL A 398 -19.817 -4.428 -10.240 1.00 0.00 C ATOM 298 CG1 VAL A 398 -21.193 -5.040 -10.404 1.00 0.00 C ATOM 299 CG2 VAL A 398 -19.034 -5.150 -9.156 1.00 0.00 C ATOM 0 H VAL A 398 -17.817 -2.826 -11.409 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.921 -5.524 -11.839 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.923 -3.387 -9.933 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.722 -5.006 -9.452 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.754 -4.479 -11.152 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -21.094 -6.076 -10.727 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.584 -5.102 -8.216 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.894 -6.193 -9.441 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -18.061 -4.674 -9.032 1.00 0.00 H new ATOM 309 N ALA A 399 -20.338 -4.523 -13.632 1.00 0.00 N ATOM 310 CA ALA A 399 -21.115 -3.984 -14.735 1.00 0.00 C ATOM 311 C ALA A 399 -20.280 -2.953 -15.487 1.00 0.00 C ATOM 312 O ALA A 399 -20.815 -2.057 -16.152 1.00 0.00 O ATOM 313 CB ALA A 399 -22.427 -3.380 -14.243 1.00 0.00 C ATOM 0 H ALA A 399 -20.165 -5.526 -13.698 1.00 0.00 H new ATOM 0 HA ALA A 399 -21.372 -4.795 -15.416 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -22.986 -2.985 -15.091 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -23.018 -4.149 -13.745 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -22.216 -2.574 -13.541 1.00 0.00 H new ATOM 319 N GLY A 400 -18.956 -3.076 -15.369 1.00 0.00 N ATOM 320 CA GLY A 400 -18.066 -2.149 -16.033 1.00 0.00 C ATOM 321 C GLY A 400 -17.760 -0.936 -15.176 1.00 0.00 C ATOM 322 O GLY A 400 -17.013 -0.049 -15.588 1.00 0.00 O ATOM 0 H GLY A 400 -18.490 -3.802 -14.825 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -17.136 -2.658 -16.285 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -18.516 -1.825 -16.971 1.00 0.00 H new ATOM 326 N ARG A 401 -18.349 -0.884 -13.987 1.00 0.00 N ATOM 327 CA ARG A 401 -18.119 0.225 -13.074 1.00 0.00 C ATOM 328 C ARG A 401 -17.041 -0.167 -12.076 1.00 0.00 C ATOM 329 O ARG A 401 -17.165 -1.182 -11.395 1.00 0.00 O ATOM 330 CB ARG A 401 -19.394 0.610 -12.312 1.00 0.00 C ATOM 331 CG ARG A 401 -20.693 0.362 -13.059 1.00 0.00 C ATOM 332 CD ARG A 401 -20.875 1.328 -14.211 1.00 0.00 C ATOM 333 NE ARG A 401 -20.813 0.640 -15.500 1.00 0.00 N ATOM 334 CZ ARG A 401 -20.522 1.229 -16.656 1.00 0.00 C ATOM 335 NH1 ARG A 401 -20.272 2.535 -16.703 1.00 0.00 N ATOM 336 NH2 ARG A 401 -20.482 0.504 -17.768 1.00 0.00 N ATOM 0 H ARG A 401 -18.988 -1.597 -13.635 1.00 0.00 H new ATOM 0 HA ARG A 401 -17.805 1.087 -13.663 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -19.420 0.054 -11.375 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -19.338 1.667 -12.053 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -20.705 -0.660 -13.437 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -21.532 0.457 -12.370 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -21.835 1.836 -14.114 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -20.102 2.096 -14.169 1.00 0.00 H new ATOM 0 HE ARG A 401 -21.006 -0.361 -15.513 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -20.303 3.091 -15.849 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -20.049 2.980 -17.593 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -20.674 -0.497 -17.731 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -20.260 0.948 -18.659 1.00 0.00 H new ATOM 350 N PRO A 402 -15.971 0.621 -11.972 1.00 0.00 N ATOM 351 CA PRO A 402 -14.873 0.328 -11.061 1.00 0.00 C ATOM 352 C PRO A 402 -15.205 0.650 -9.610 1.00 0.00 C ATOM 353 O PRO A 402 -15.199 1.811 -9.203 1.00 0.00 O ATOM 354 CB PRO A 402 -13.724 1.221 -11.554 1.00 0.00 C ATOM 355 CG PRO A 402 -14.236 1.933 -12.768 1.00 0.00 C ATOM 356 CD PRO A 402 -15.736 1.857 -12.719 1.00 0.00 C ATOM 0 HA PRO A 402 -14.633 -0.735 -11.068 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -13.426 1.932 -10.783 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -12.844 0.625 -11.795 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -13.902 2.971 -12.777 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -13.855 1.468 -13.677 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -16.169 2.722 -12.217 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -16.172 1.816 -13.717 1.00 0.00 H new ATOM 364 N PHE A 403 -15.516 -0.382 -8.847 1.00 0.00 N ATOM 365 CA PHE A 403 -15.822 -0.226 -7.436 1.00 0.00 C ATOM 366 C PHE A 403 -14.728 -0.887 -6.623 1.00 0.00 C ATOM 367 O PHE A 403 -13.927 -1.648 -7.159 1.00 0.00 O ATOM 368 CB PHE A 403 -17.163 -0.881 -7.084 1.00 0.00 C ATOM 369 CG PHE A 403 -18.338 -0.349 -7.853 1.00 0.00 C ATOM 370 CD1 PHE A 403 -18.661 0.998 -7.822 1.00 0.00 C ATOM 371 CD2 PHE A 403 -19.125 -1.204 -8.609 1.00 0.00 C ATOM 372 CE1 PHE A 403 -19.743 1.482 -8.533 1.00 0.00 C ATOM 373 CE2 PHE A 403 -20.207 -0.727 -9.320 1.00 0.00 C ATOM 374 CZ PHE A 403 -20.518 0.619 -9.282 1.00 0.00 C ATOM 0 H PHE A 403 -15.564 -1.344 -9.183 1.00 0.00 H new ATOM 0 HA PHE A 403 -15.886 0.839 -7.211 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -17.086 -1.954 -7.260 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -17.351 -0.745 -6.019 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -18.060 1.678 -7.236 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -18.888 -2.257 -8.642 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -19.982 2.535 -8.503 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -20.810 -1.405 -9.906 1.00 0.00 H new ATOM 0 HZ PHE A 403 -21.365 0.995 -9.837 1.00 0.00 H new ATOM 384 N SER A 404 -14.668 -0.590 -5.347 1.00 0.00 N ATOM 385 CA SER A 404 -13.687 -1.217 -4.494 1.00 0.00 C ATOM 386 C SER A 404 -14.299 -2.490 -3.919 1.00 0.00 C ATOM 387 O SER A 404 -15.494 -2.730 -4.081 1.00 0.00 O ATOM 388 CB SER A 404 -13.258 -0.266 -3.385 1.00 0.00 C ATOM 389 OG SER A 404 -13.346 1.084 -3.812 1.00 0.00 O ATOM 0 H SER A 404 -15.282 0.077 -4.879 1.00 0.00 H new ATOM 0 HA SER A 404 -12.795 -1.467 -5.068 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.888 -0.416 -2.508 1.00 0.00 H new ATOM 0 HB3 SER A 404 -12.235 -0.490 -3.084 1.00 0.00 H new ATOM 0 HG SER A 404 -13.067 1.677 -3.083 1.00 0.00 H new ATOM 395 N TYR A 405 -13.509 -3.287 -3.239 1.00 0.00 N ATOM 396 CA TYR A 405 -14.000 -4.532 -2.676 1.00 0.00 C ATOM 397 C TYR A 405 -14.976 -4.252 -1.548 1.00 0.00 C ATOM 398 O TYR A 405 -16.059 -4.833 -1.508 1.00 0.00 O ATOM 399 CB TYR A 405 -12.851 -5.406 -2.181 1.00 0.00 C ATOM 400 CG TYR A 405 -13.284 -6.794 -1.766 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.740 -7.050 -0.478 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.244 -7.848 -2.668 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.142 -8.315 -0.101 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.646 -9.116 -2.298 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.094 -9.345 -1.014 1.00 0.00 C ATOM 406 OH TYR A 405 -14.498 -10.607 -0.646 1.00 0.00 O ATOM 0 H TYR A 405 -12.523 -3.099 -3.060 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.520 -5.076 -3.465 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -12.102 -5.488 -2.969 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.371 -4.916 -1.334 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.780 -6.245 0.240 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -12.893 -7.674 -3.674 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.492 -8.496 0.904 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.610 -9.926 -3.012 1.00 0.00 H new ATOM 0 HH TYR A 405 -14.858 -11.076 -1.427 1.00 0.00 H new ATOM 416 N SER A 406 -14.604 -3.346 -0.645 1.00 0.00 N ATOM 417 CA SER A 406 -15.473 -2.983 0.472 1.00 0.00 C ATOM 418 C SER A 406 -16.727 -2.288 -0.047 1.00 0.00 C ATOM 419 O SER A 406 -17.718 -2.135 0.663 1.00 0.00 O ATOM 420 CB SER A 406 -14.732 -2.077 1.454 1.00 0.00 C ATOM 421 OG SER A 406 -13.474 -2.629 1.798 1.00 0.00 O ATOM 0 H SER A 406 -13.712 -2.852 -0.665 1.00 0.00 H new ATOM 0 HA SER A 406 -15.765 -3.892 0.997 1.00 0.00 H new ATOM 0 HB2 SER A 406 -14.592 -1.091 1.011 1.00 0.00 H new ATOM 0 HB3 SER A 406 -15.332 -1.940 2.354 1.00 0.00 H new ATOM 0 HG SER A 406 -12.770 -2.190 1.276 1.00 0.00 H new ATOM 427 N GLU A 407 -16.674 -1.889 -1.307 1.00 0.00 N ATOM 428 CA GLU A 407 -17.783 -1.229 -1.959 1.00 0.00 C ATOM 429 C GLU A 407 -18.715 -2.282 -2.550 1.00 0.00 C ATOM 430 O GLU A 407 -19.920 -2.321 -2.261 1.00 0.00 O ATOM 431 CB GLU A 407 -17.245 -0.304 -3.055 1.00 0.00 C ATOM 432 CG GLU A 407 -16.761 1.045 -2.542 1.00 0.00 C ATOM 433 CD GLU A 407 -17.838 1.805 -1.796 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.118 1.455 -0.631 1.00 0.00 O ATOM 435 OE2 GLU A 407 -18.435 2.730 -2.380 1.00 0.00 O ATOM 0 H GLU A 407 -15.857 -2.016 -1.904 1.00 0.00 H new ATOM 0 HA GLU A 407 -18.342 -0.630 -1.240 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -16.422 -0.803 -3.567 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -18.028 -0.140 -3.795 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.906 0.894 -1.883 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -16.413 1.646 -3.382 1.00 0.00 H new ATOM 442 N VAL A 408 -18.127 -3.159 -3.352 1.00 0.00 N ATOM 443 CA VAL A 408 -18.851 -4.240 -4.004 1.00 0.00 C ATOM 444 C VAL A 408 -19.514 -5.161 -2.976 1.00 0.00 C ATOM 445 O VAL A 408 -20.634 -5.624 -3.178 1.00 0.00 O ATOM 446 CB VAL A 408 -17.899 -5.071 -4.897 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.610 -6.268 -5.490 1.00 0.00 C ATOM 448 CG2 VAL A 408 -17.306 -4.222 -6.007 1.00 0.00 C ATOM 0 H VAL A 408 -17.131 -3.140 -3.569 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.627 -3.789 -4.623 1.00 0.00 H new ATOM 0 HB VAL A 408 -17.089 -5.427 -4.260 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.915 -6.832 -6.112 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.979 -6.907 -4.687 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.449 -5.929 -6.098 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.642 -4.834 -6.617 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -18.108 -3.825 -6.630 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.742 -3.397 -5.572 1.00 0.00 H new ATOM 458 N SER A 409 -18.827 -5.400 -1.864 1.00 0.00 N ATOM 459 CA SER A 409 -19.348 -6.277 -0.817 1.00 0.00 C ATOM 460 C SER A 409 -20.506 -5.632 -0.061 1.00 0.00 C ATOM 461 O SER A 409 -21.367 -6.327 0.475 1.00 0.00 O ATOM 462 CB SER A 409 -18.235 -6.660 0.161 1.00 0.00 C ATOM 463 OG SER A 409 -17.489 -5.524 0.554 1.00 0.00 O ATOM 0 H SER A 409 -17.910 -5.001 -1.663 1.00 0.00 H new ATOM 0 HA SER A 409 -19.726 -7.176 -1.304 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.668 -7.137 1.041 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.573 -7.390 -0.304 1.00 0.00 H new ATOM 0 HG SER A 409 -16.711 -5.424 -0.033 1.00 0.00 H new ATOM 469 N GLN A 410 -20.522 -4.305 -0.019 1.00 0.00 N ATOM 470 CA GLN A 410 -21.577 -3.582 0.678 1.00 0.00 C ATOM 471 C GLN A 410 -22.893 -3.657 -0.079 1.00 0.00 C ATOM 472 O GLN A 410 -23.960 -3.664 0.528 1.00 0.00 O ATOM 473 CB GLN A 410 -21.192 -2.117 0.879 1.00 0.00 C ATOM 474 CG GLN A 410 -20.453 -1.850 2.177 1.00 0.00 C ATOM 475 CD GLN A 410 -20.145 -0.378 2.365 1.00 0.00 C ATOM 476 OE1 GLN A 410 -20.927 0.362 2.959 1.00 0.00 O ATOM 477 NE2 GLN A 410 -19.007 0.054 1.851 1.00 0.00 N ATOM 0 H GLN A 410 -19.819 -3.710 -0.458 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.704 -4.057 1.651 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -20.568 -1.797 0.044 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -22.095 -1.507 0.854 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -21.053 -2.204 3.015 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -19.523 -2.419 2.188 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -18.388 -0.595 1.366 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -18.748 1.037 1.939 1.00 0.00 H new ATOM 486 N ARG A 411 -22.821 -3.702 -1.405 1.00 0.00 N ATOM 487 CA ARG A 411 -24.038 -3.764 -2.210 1.00 0.00 C ATOM 488 C ARG A 411 -24.252 -5.145 -2.829 1.00 0.00 C ATOM 489 O ARG A 411 -23.602 -5.512 -3.822 1.00 0.00 O ATOM 490 CB ARG A 411 -24.036 -2.709 -3.321 1.00 0.00 C ATOM 491 CG ARG A 411 -24.034 -1.271 -2.827 1.00 0.00 C ATOM 492 CD ARG A 411 -22.633 -0.835 -2.458 1.00 0.00 C ATOM 493 NE ARG A 411 -22.452 0.612 -2.490 1.00 0.00 N ATOM 494 CZ ARG A 411 -21.371 1.215 -2.000 1.00 0.00 C ATOM 495 NH1 ARG A 411 -20.482 0.511 -1.318 1.00 0.00 N ATOM 496 NH2 ARG A 411 -21.190 2.518 -2.163 1.00 0.00 N ATOM 0 H ARG A 411 -21.951 -3.697 -1.938 1.00 0.00 H new ATOM 0 HA ARG A 411 -24.860 -3.560 -1.524 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -23.160 -2.865 -3.950 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -24.912 -2.862 -3.951 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -24.433 -0.615 -3.601 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -24.689 -1.178 -1.961 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -22.397 -1.202 -1.459 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -21.923 -1.298 -3.143 1.00 0.00 H new ATOM 0 HE ARG A 411 -23.185 1.187 -2.906 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -20.627 -0.488 -1.170 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -19.652 0.967 -0.940 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -21.883 3.070 -2.668 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -20.358 2.969 -1.783 1.00 0.00 H new ATOM 510 N PRO A 412 -25.167 -5.937 -2.247 1.00 0.00 N ATOM 511 CA PRO A 412 -25.502 -7.259 -2.765 1.00 0.00 C ATOM 512 C PRO A 412 -26.032 -7.167 -4.195 1.00 0.00 C ATOM 513 O PRO A 412 -25.898 -8.109 -4.976 1.00 0.00 O ATOM 514 CB PRO A 412 -26.593 -7.771 -1.815 1.00 0.00 C ATOM 515 CG PRO A 412 -27.086 -6.564 -1.090 1.00 0.00 C ATOM 516 CD PRO A 412 -25.924 -5.615 -1.027 1.00 0.00 C ATOM 0 HA PRO A 412 -24.636 -7.920 -2.805 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.399 -8.254 -2.367 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.194 -8.511 -1.121 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.930 -6.113 -1.612 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -27.432 -6.824 -0.090 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -26.252 -4.576 -1.018 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -25.326 -5.768 -0.129 1.00 0.00 H new ATOM 524 N GLU A 413 -26.612 -6.013 -4.538 1.00 0.00 N ATOM 525 CA GLU A 413 -27.143 -5.790 -5.875 1.00 0.00 C ATOM 526 C GLU A 413 -25.992 -5.690 -6.855 1.00 0.00 C ATOM 527 O GLU A 413 -26.111 -6.094 -8.005 1.00 0.00 O ATOM 528 CB GLU A 413 -27.984 -4.510 -5.956 1.00 0.00 C ATOM 529 CG GLU A 413 -28.687 -4.138 -4.666 1.00 0.00 C ATOM 530 CD GLU A 413 -27.852 -3.208 -3.817 1.00 0.00 C ATOM 531 OE1 GLU A 413 -27.037 -3.715 -3.027 1.00 0.00 O ATOM 532 OE2 GLU A 413 -27.991 -1.979 -3.956 1.00 0.00 O ATOM 0 H GLU A 413 -26.723 -5.222 -3.904 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.791 -6.631 -6.121 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -27.338 -3.684 -6.254 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -28.731 -4.630 -6.741 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -29.640 -3.662 -4.896 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -28.911 -5.043 -4.101 1.00 0.00 H new ATOM 539 N LEU A 414 -24.871 -5.156 -6.384 1.00 0.00 N ATOM 540 CA LEU A 414 -23.688 -5.023 -7.217 1.00 0.00 C ATOM 541 C LEU A 414 -23.202 -6.399 -7.619 1.00 0.00 C ATOM 542 O LEU A 414 -23.008 -6.676 -8.791 1.00 0.00 O ATOM 543 CB LEU A 414 -22.570 -4.276 -6.487 1.00 0.00 C ATOM 544 CG LEU A 414 -22.756 -2.762 -6.368 1.00 0.00 C ATOM 545 CD1 LEU A 414 -21.476 -2.112 -5.873 1.00 0.00 C ATOM 546 CD2 LEU A 414 -23.181 -2.161 -7.698 1.00 0.00 C ATOM 0 H LEU A 414 -24.759 -4.810 -5.431 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.956 -4.445 -8.102 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -22.474 -4.692 -5.484 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -21.630 -4.469 -7.004 1.00 0.00 H new ATOM 0 HG LEU A 414 -23.548 -2.570 -5.644 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -21.622 -1.035 -5.793 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -21.217 -2.517 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -20.668 -2.317 -6.576 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -23.307 -1.084 -7.587 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -22.417 -2.362 -8.449 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -24.125 -2.606 -8.013 1.00 0.00 H new ATOM 558 N VAL A 415 -23.057 -7.281 -6.644 1.00 0.00 N ATOM 559 CA VAL A 415 -22.598 -8.640 -6.923 1.00 0.00 C ATOM 560 C VAL A 415 -23.657 -9.385 -7.737 1.00 0.00 C ATOM 561 O VAL A 415 -23.352 -10.311 -8.498 1.00 0.00 O ATOM 562 CB VAL A 415 -22.277 -9.395 -5.608 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.048 -10.881 -5.847 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.061 -8.781 -4.934 1.00 0.00 C ATOM 0 H VAL A 415 -23.247 -7.088 -5.661 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.679 -8.589 -7.506 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.143 -9.296 -4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -21.826 -11.372 -4.899 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -22.945 -11.322 -6.283 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.209 -11.015 -6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -20.846 -9.320 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.202 -8.848 -5.602 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.262 -7.735 -4.704 1.00 0.00 H new ATOM 574 N ALA A 416 -24.895 -8.940 -7.596 1.00 0.00 N ATOM 575 CA ALA A 416 -26.016 -9.523 -8.312 1.00 0.00 C ATOM 576 C ALA A 416 -26.084 -9.000 -9.743 1.00 0.00 C ATOM 577 O ALA A 416 -26.750 -9.584 -10.595 1.00 0.00 O ATOM 578 CB ALA A 416 -27.303 -9.211 -7.580 1.00 0.00 C ATOM 0 H ALA A 416 -25.150 -8.166 -6.983 1.00 0.00 H new ATOM 0 HA ALA A 416 -25.876 -10.603 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.143 -9.649 -8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.260 -9.628 -6.574 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.434 -8.131 -7.520 1.00 0.00 H new ATOM 584 N GLN A 417 -25.396 -7.894 -9.999 1.00 0.00 N ATOM 585 CA GLN A 417 -25.369 -7.295 -11.323 1.00 0.00 C ATOM 586 C GLN A 417 -24.002 -7.505 -11.923 1.00 0.00 C ATOM 587 O GLN A 417 -23.740 -7.143 -13.068 1.00 0.00 O ATOM 588 CB GLN A 417 -25.690 -5.799 -11.261 1.00 0.00 C ATOM 589 CG GLN A 417 -27.124 -5.498 -10.863 1.00 0.00 C ATOM 590 CD GLN A 417 -28.132 -5.993 -11.883 1.00 0.00 C ATOM 591 OE1 GLN A 417 -28.545 -5.256 -12.774 1.00 0.00 O ATOM 592 NE2 GLN A 417 -28.527 -7.253 -11.767 1.00 0.00 N ATOM 0 H GLN A 417 -24.847 -7.393 -9.301 1.00 0.00 H new ATOM 0 HA GLN A 417 -26.129 -7.771 -11.943 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -25.017 -5.321 -10.549 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -25.492 -5.353 -12.236 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -27.333 -5.960 -9.898 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -27.243 -4.422 -10.734 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -28.161 -7.835 -11.013 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -29.197 -7.641 -12.432 1.00 0.00 H new ATOM 601 N MET A 418 -23.130 -8.103 -11.126 1.00 0.00 N ATOM 602 CA MET A 418 -21.787 -8.370 -11.550 1.00 0.00 C ATOM 603 C MET A 418 -21.787 -9.638 -12.375 1.00 0.00 C ATOM 604 O MET A 418 -22.417 -10.645 -12.018 1.00 0.00 O ATOM 605 CB MET A 418 -20.847 -8.454 -10.343 1.00 0.00 C ATOM 606 CG MET A 418 -20.345 -9.844 -10.015 1.00 0.00 C ATOM 607 SD MET A 418 -19.732 -9.972 -8.327 1.00 0.00 S ATOM 608 CE MET A 418 -18.534 -8.642 -8.306 1.00 0.00 C ATOM 0 H MET A 418 -23.342 -8.410 -10.177 1.00 0.00 H new ATOM 0 HA MET A 418 -21.414 -7.555 -12.171 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.988 -7.808 -10.525 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.365 -8.056 -9.470 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.152 -10.562 -10.161 1.00 0.00 H new ATOM 0 HG3 MET A 418 -19.549 -10.113 -10.709 1.00 0.00 H new ATOM 0 HE1 MET A 418 -17.895 -8.742 -7.429 1.00 0.00 H new ATOM 0 HE2 MET A 418 -17.923 -8.689 -9.207 1.00 0.00 H new ATOM 0 HE3 MET A 418 -19.054 -7.685 -8.269 1.00 0.00 H new ATOM 618 N THR A 419 -21.084 -9.569 -13.470 1.00 0.00 N ATOM 619 CA THR A 419 -21.001 -10.677 -14.416 1.00 0.00 C ATOM 620 C THR A 419 -20.183 -11.820 -13.828 1.00 0.00 C ATOM 621 O THR A 419 -19.585 -11.659 -12.766 1.00 0.00 O ATOM 622 CB THR A 419 -20.370 -10.224 -15.752 1.00 0.00 C ATOM 623 OG1 THR A 419 -18.978 -9.944 -15.576 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.075 -8.992 -16.299 1.00 0.00 C ATOM 0 H THR A 419 -20.546 -8.747 -13.744 1.00 0.00 H new ATOM 0 HA THR A 419 -22.016 -11.022 -14.610 1.00 0.00 H new ATOM 0 HB THR A 419 -20.485 -11.037 -16.469 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.527 -9.966 -16.446 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.611 -8.695 -17.239 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.127 -9.221 -16.470 1.00 0.00 H new ATOM 0 HG23 THR A 419 -20.993 -8.177 -15.580 1.00 0.00 H new ATOM 632 N PRO A 420 -20.184 -13.006 -14.465 1.00 0.00 N ATOM 633 CA PRO A 420 -19.390 -14.140 -13.990 1.00 0.00 C ATOM 634 C PRO A 420 -17.927 -13.739 -13.848 1.00 0.00 C ATOM 635 O PRO A 420 -17.294 -14.003 -12.830 1.00 0.00 O ATOM 636 CB PRO A 420 -19.567 -15.193 -15.086 1.00 0.00 C ATOM 637 CG PRO A 420 -20.861 -14.846 -15.736 1.00 0.00 C ATOM 638 CD PRO A 420 -20.964 -13.346 -15.670 1.00 0.00 C ATOM 0 HA PRO A 420 -19.702 -14.502 -13.010 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -18.744 -15.164 -15.800 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -19.591 -16.200 -14.668 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -20.886 -15.195 -16.768 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -21.697 -15.318 -15.220 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -20.552 -12.875 -16.562 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -22.000 -13.017 -15.585 1.00 0.00 H new ATOM 646 N GLU A 421 -17.416 -13.050 -14.863 1.00 0.00 N ATOM 647 CA GLU A 421 -16.038 -12.577 -14.857 1.00 0.00 C ATOM 648 C GLU A 421 -15.790 -11.701 -13.634 1.00 0.00 C ATOM 649 O GLU A 421 -14.793 -11.866 -12.934 1.00 0.00 O ATOM 650 CB GLU A 421 -15.720 -11.771 -16.123 1.00 0.00 C ATOM 651 CG GLU A 421 -16.268 -12.373 -17.408 1.00 0.00 C ATOM 652 CD GLU A 421 -17.721 -12.014 -17.635 1.00 0.00 C ATOM 653 OE1 GLU A 421 -18.006 -10.835 -17.920 1.00 0.00 O ATOM 654 OE2 GLU A 421 -18.577 -12.905 -17.495 1.00 0.00 O ATOM 0 H GLU A 421 -17.939 -12.806 -15.704 1.00 0.00 H new ATOM 0 HA GLU A 421 -15.388 -13.452 -14.826 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -16.122 -10.764 -16.008 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -14.638 -11.674 -16.215 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -15.673 -12.025 -18.253 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -16.165 -13.458 -17.372 1.00 0.00 H new ATOM 661 N GLU A 422 -16.714 -10.779 -13.379 1.00 0.00 N ATOM 662 CA GLU A 422 -16.613 -9.871 -12.253 1.00 0.00 C ATOM 663 C GLU A 422 -16.785 -10.624 -10.933 1.00 0.00 C ATOM 664 O GLU A 422 -16.069 -10.370 -9.966 1.00 0.00 O ATOM 665 CB GLU A 422 -17.656 -8.771 -12.426 1.00 0.00 C ATOM 666 CG GLU A 422 -17.411 -7.945 -13.679 1.00 0.00 C ATOM 667 CD GLU A 422 -18.479 -6.907 -13.923 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.649 -7.150 -13.546 1.00 0.00 O ATOM 669 OE2 GLU A 422 -18.155 -5.836 -14.486 1.00 0.00 O ATOM 0 H GLU A 422 -17.550 -10.645 -13.948 1.00 0.00 H new ATOM 0 HA GLU A 422 -15.623 -9.416 -12.222 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.649 -9.218 -12.475 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.643 -8.118 -11.553 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.444 -7.450 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.356 -8.610 -14.541 1.00 0.00 H new ATOM 676 N LYS A 423 -17.746 -11.539 -10.902 1.00 0.00 N ATOM 677 CA LYS A 423 -18.008 -12.371 -9.729 1.00 0.00 C ATOM 678 C LYS A 423 -16.782 -13.175 -9.340 1.00 0.00 C ATOM 679 O LYS A 423 -16.313 -13.096 -8.205 1.00 0.00 O ATOM 680 CB LYS A 423 -19.154 -13.336 -10.027 1.00 0.00 C ATOM 681 CG LYS A 423 -19.623 -14.131 -8.820 1.00 0.00 C ATOM 682 CD LYS A 423 -20.683 -13.386 -8.028 1.00 0.00 C ATOM 683 CE LYS A 423 -22.055 -13.503 -8.675 1.00 0.00 C ATOM 684 NZ LYS A 423 -22.257 -12.500 -9.760 1.00 0.00 N ATOM 0 H LYS A 423 -18.367 -11.727 -11.689 1.00 0.00 H new ATOM 0 HA LYS A 423 -18.272 -11.711 -8.903 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -19.996 -12.771 -10.427 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -18.838 -14.030 -10.806 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.023 -15.090 -9.150 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -18.772 -14.346 -8.174 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -20.724 -13.782 -7.013 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -20.406 -12.335 -7.949 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -22.177 -14.506 -9.083 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -22.825 -13.372 -7.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -23.129 -12.724 -10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -22.336 -11.550 -9.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -21.447 -12.526 -10.412 1.00 0.00 H new ATOM 698 N GLU A 424 -16.258 -13.923 -10.296 1.00 0.00 N ATOM 699 CA GLU A 424 -15.101 -14.768 -10.059 1.00 0.00 C ATOM 700 C GLU A 424 -13.903 -13.912 -9.697 1.00 0.00 C ATOM 701 O GLU A 424 -13.061 -14.303 -8.888 1.00 0.00 O ATOM 702 CB GLU A 424 -14.809 -15.636 -11.284 1.00 0.00 C ATOM 703 CG GLU A 424 -15.573 -16.957 -11.292 1.00 0.00 C ATOM 704 CD GLU A 424 -17.085 -16.780 -11.291 1.00 0.00 C ATOM 705 OE1 GLU A 424 -17.660 -16.557 -10.203 1.00 0.00 O ATOM 706 OE2 GLU A 424 -17.695 -16.866 -12.377 1.00 0.00 O ATOM 0 H GLU A 424 -16.619 -13.962 -11.249 1.00 0.00 H new ATOM 0 HA GLU A 424 -15.313 -15.435 -9.223 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -15.060 -15.075 -12.184 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -13.740 -15.844 -11.325 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -15.282 -17.531 -12.172 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -15.282 -17.542 -10.419 1.00 0.00 H new ATOM 713 N ALA A 425 -13.842 -12.730 -10.291 1.00 0.00 N ATOM 714 CA ALA A 425 -12.779 -11.786 -10.011 1.00 0.00 C ATOM 715 C ALA A 425 -12.882 -11.327 -8.564 1.00 0.00 C ATOM 716 O ALA A 425 -11.895 -11.312 -7.830 1.00 0.00 O ATOM 717 CB ALA A 425 -12.874 -10.607 -10.959 1.00 0.00 C ATOM 0 H ALA A 425 -14.524 -12.403 -10.975 1.00 0.00 H new ATOM 0 HA ALA A 425 -11.811 -12.265 -10.159 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.072 -9.901 -10.743 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -12.782 -10.958 -11.987 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -13.837 -10.113 -10.830 1.00 0.00 H new ATOM 723 N TYR A 426 -14.097 -10.970 -8.164 1.00 0.00 N ATOM 724 CA TYR A 426 -14.375 -10.529 -6.808 1.00 0.00 C ATOM 725 C TYR A 426 -14.065 -11.647 -5.818 1.00 0.00 C ATOM 726 O TYR A 426 -13.396 -11.427 -4.809 1.00 0.00 O ATOM 727 CB TYR A 426 -15.847 -10.111 -6.702 1.00 0.00 C ATOM 728 CG TYR A 426 -16.353 -9.914 -5.290 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.241 -8.683 -4.658 1.00 0.00 C ATOM 730 CD2 TYR A 426 -16.947 -10.958 -4.592 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.705 -8.498 -3.370 1.00 0.00 C ATOM 732 CE2 TYR A 426 -17.412 -10.781 -3.305 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.288 -9.552 -2.698 1.00 0.00 C ATOM 734 OH TYR A 426 -17.749 -9.375 -1.414 1.00 0.00 O ATOM 0 H TYR A 426 -14.915 -10.979 -8.773 1.00 0.00 H new ATOM 0 HA TYR A 426 -13.743 -9.674 -6.567 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -15.987 -9.182 -7.255 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -16.461 -10.868 -7.190 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.784 -7.857 -5.182 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -17.046 -11.924 -5.064 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.612 -7.534 -2.892 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -17.871 -11.603 -2.776 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.132 -10.215 -1.085 1.00 0.00 H new ATOM 744 N ILE A 427 -14.546 -12.846 -6.129 1.00 0.00 N ATOM 745 CA ILE A 427 -14.334 -14.006 -5.276 1.00 0.00 C ATOM 746 C ILE A 427 -12.842 -14.303 -5.113 1.00 0.00 C ATOM 747 O ILE A 427 -12.346 -14.467 -3.995 1.00 0.00 O ATOM 748 CB ILE A 427 -15.056 -15.257 -5.832 1.00 0.00 C ATOM 749 CG1 ILE A 427 -16.575 -15.052 -5.797 1.00 0.00 C ATOM 750 CG2 ILE A 427 -14.672 -16.501 -5.040 1.00 0.00 C ATOM 751 CD1 ILE A 427 -17.354 -16.132 -6.519 1.00 0.00 C ATOM 0 H ILE A 427 -15.088 -13.039 -6.971 1.00 0.00 H new ATOM 0 HA ILE A 427 -14.756 -13.767 -4.300 1.00 0.00 H new ATOM 0 HB ILE A 427 -14.744 -15.401 -6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -16.903 -15.013 -4.758 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -16.812 -14.086 -6.243 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -15.192 -17.367 -5.449 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -13.596 -16.658 -5.108 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -14.954 -16.369 -3.995 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -18.421 -15.918 -6.451 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -17.055 -16.157 -7.567 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -17.147 -17.099 -6.059 1.00 0.00 H new ATOM 763 N ALA A 428 -12.124 -14.341 -6.232 1.00 0.00 N ATOM 764 CA ALA A 428 -10.691 -14.620 -6.219 1.00 0.00 C ATOM 765 C ALA A 428 -9.909 -13.521 -5.505 1.00 0.00 C ATOM 766 O ALA A 428 -8.848 -13.770 -4.935 1.00 0.00 O ATOM 767 CB ALA A 428 -10.173 -14.799 -7.639 1.00 0.00 C ATOM 0 H ALA A 428 -12.512 -14.182 -7.162 1.00 0.00 H new ATOM 0 HA ALA A 428 -10.541 -15.547 -5.665 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -9.103 -15.006 -7.613 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -10.692 -15.632 -8.114 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -10.352 -13.887 -8.209 1.00 0.00 H new ATOM 773 N MET A 429 -10.433 -12.304 -5.542 1.00 0.00 N ATOM 774 CA MET A 429 -9.784 -11.173 -4.890 1.00 0.00 C ATOM 775 C MET A 429 -10.053 -11.190 -3.393 1.00 0.00 C ATOM 776 O MET A 429 -9.189 -10.827 -2.594 1.00 0.00 O ATOM 777 CB MET A 429 -10.270 -9.860 -5.509 1.00 0.00 C ATOM 778 CG MET A 429 -9.532 -9.489 -6.783 1.00 0.00 C ATOM 779 SD MET A 429 -9.307 -7.713 -6.959 1.00 0.00 S ATOM 780 CE MET A 429 -10.954 -7.135 -6.573 1.00 0.00 C ATOM 0 H MET A 429 -11.306 -12.073 -6.017 1.00 0.00 H new ATOM 0 HA MET A 429 -8.708 -11.254 -5.042 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.335 -9.940 -5.724 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.151 -9.057 -4.781 1.00 0.00 H new ATOM 0 HG2 MET A 429 -8.558 -9.977 -6.790 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.085 -9.869 -7.642 1.00 0.00 H new ATOM 0 HE1 MET A 429 -11.071 -6.109 -6.922 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.688 -7.772 -7.067 1.00 0.00 H new ATOM 0 HE3 MET A 429 -11.109 -7.171 -5.495 1.00 0.00 H new ATOM 790 N GLY A 430 -11.244 -11.638 -3.019 1.00 0.00 N ATOM 791 CA GLY A 430 -11.616 -11.697 -1.626 1.00 0.00 C ATOM 792 C GLY A 430 -10.870 -12.777 -0.894 1.00 0.00 C ATOM 793 O GLY A 430 -10.550 -12.620 0.278 1.00 0.00 O ATOM 0 H GLY A 430 -11.963 -11.964 -3.665 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.416 -10.734 -1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -12.688 -11.876 -1.543 1.00 0.00 H new ATOM 797 N GLN A 431 -10.581 -13.866 -1.604 1.00 0.00 N ATOM 798 CA GLN A 431 -9.859 -15.006 -1.043 1.00 0.00 C ATOM 799 C GLN A 431 -8.622 -14.556 -0.269 1.00 0.00 C ATOM 800 O GLN A 431 -8.421 -14.951 0.874 1.00 0.00 O ATOM 801 CB GLN A 431 -9.446 -15.962 -2.166 1.00 0.00 C ATOM 802 CG GLN A 431 -8.774 -17.232 -1.671 1.00 0.00 C ATOM 803 CD GLN A 431 -7.684 -17.724 -2.607 1.00 0.00 C ATOM 804 OE1 GLN A 431 -7.755 -17.531 -3.823 1.00 0.00 O ATOM 805 NE2 GLN A 431 -6.664 -18.350 -2.047 1.00 0.00 N ATOM 0 H GLN A 431 -10.841 -13.983 -2.583 1.00 0.00 H new ATOM 0 HA GLN A 431 -10.525 -15.518 -0.349 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -10.329 -16.231 -2.745 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -8.767 -15.442 -2.842 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -8.346 -17.050 -0.685 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -9.525 -18.013 -1.553 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -6.644 -18.489 -1.037 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -5.897 -18.694 -2.625 1.00 0.00 H new ATOM 814 N ARG A 432 -7.826 -13.689 -0.887 1.00 0.00 N ATOM 815 CA ARG A 432 -6.600 -13.192 -0.270 1.00 0.00 C ATOM 816 C ARG A 432 -6.872 -12.504 1.064 1.00 0.00 C ATOM 817 O ARG A 432 -6.195 -12.767 2.050 1.00 0.00 O ATOM 818 CB ARG A 432 -5.894 -12.224 -1.209 1.00 0.00 C ATOM 819 CG ARG A 432 -4.396 -12.455 -1.294 1.00 0.00 C ATOM 820 CD ARG A 432 -3.972 -12.878 -2.692 1.00 0.00 C ATOM 821 NE ARG A 432 -4.708 -14.052 -3.160 1.00 0.00 N ATOM 822 CZ ARG A 432 -5.749 -13.997 -3.987 1.00 0.00 C ATOM 823 NH1 ARG A 432 -6.182 -12.826 -4.443 1.00 0.00 N ATOM 824 NH2 ARG A 432 -6.357 -15.115 -4.359 1.00 0.00 N ATOM 0 H ARG A 432 -8.009 -13.315 -1.818 1.00 0.00 H new ATOM 0 HA ARG A 432 -5.960 -14.054 -0.080 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -6.326 -12.315 -2.206 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -6.079 -11.203 -0.874 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -3.870 -11.542 -1.015 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -4.105 -13.223 -0.577 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.132 -12.051 -3.384 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -2.904 -13.095 -2.696 1.00 0.00 H new ATOM 0 HE ARG A 432 -4.405 -14.969 -2.832 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -5.716 -11.964 -4.159 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -6.980 -12.789 -5.077 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -6.027 -16.015 -4.011 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -7.155 -15.075 -4.993 1.00 0.00 H new ATOM 838 N MET A 433 -7.864 -11.623 1.086 1.00 0.00 N ATOM 839 CA MET A 433 -8.219 -10.902 2.308 1.00 0.00 C ATOM 840 C MET A 433 -8.895 -11.848 3.292 1.00 0.00 C ATOM 841 O MET A 433 -8.799 -11.683 4.507 1.00 0.00 O ATOM 842 CB MET A 433 -9.147 -9.730 1.988 1.00 0.00 C ATOM 843 CG MET A 433 -8.442 -8.546 1.348 1.00 0.00 C ATOM 844 SD MET A 433 -9.589 -7.412 0.543 1.00 0.00 S ATOM 845 CE MET A 433 -10.188 -8.429 -0.801 1.00 0.00 C ATOM 0 H MET A 433 -8.437 -11.389 0.276 1.00 0.00 H new ATOM 0 HA MET A 433 -7.307 -10.510 2.758 1.00 0.00 H new ATOM 0 HB2 MET A 433 -9.936 -10.075 1.320 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.630 -9.400 2.908 1.00 0.00 H new ATOM 0 HG2 MET A 433 -7.879 -8.008 2.110 1.00 0.00 H new ATOM 0 HG3 MET A 433 -7.721 -8.909 0.616 1.00 0.00 H new ATOM 0 HE1 MET A 433 -9.966 -7.943 -1.751 1.00 0.00 H new ATOM 0 HE2 MET A 433 -9.698 -9.402 -0.768 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.265 -8.562 -0.704 1.00 0.00 H new ATOM 855 N PHE A 434 -9.574 -12.843 2.745 1.00 0.00 N ATOM 856 CA PHE A 434 -10.270 -13.837 3.540 1.00 0.00 C ATOM 857 C PHE A 434 -9.273 -14.694 4.317 1.00 0.00 C ATOM 858 O PHE A 434 -9.518 -15.061 5.466 1.00 0.00 O ATOM 859 CB PHE A 434 -11.156 -14.698 2.631 1.00 0.00 C ATOM 860 CG PHE A 434 -12.522 -14.114 2.397 1.00 0.00 C ATOM 861 CD1 PHE A 434 -13.091 -13.252 3.322 1.00 0.00 C ATOM 862 CD2 PHE A 434 -13.233 -14.420 1.247 1.00 0.00 C ATOM 863 CE1 PHE A 434 -14.343 -12.709 3.106 1.00 0.00 C ATOM 864 CE2 PHE A 434 -14.485 -13.880 1.025 1.00 0.00 C ATOM 865 CZ PHE A 434 -15.040 -13.023 1.956 1.00 0.00 C ATOM 0 H PHE A 434 -9.657 -12.983 1.738 1.00 0.00 H new ATOM 0 HA PHE A 434 -10.908 -13.334 4.267 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -10.657 -14.831 1.671 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -11.264 -15.688 3.074 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -12.549 -13.002 4.222 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -12.803 -15.089 0.516 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -14.776 -12.040 3.835 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -15.029 -14.127 0.125 1.00 0.00 H new ATOM 0 HZ PHE A 434 -16.018 -12.599 1.784 1.00 0.00 H new ATOM 875 N GLU A 435 -8.138 -14.986 3.693 1.00 0.00 N ATOM 876 CA GLU A 435 -7.092 -15.777 4.333 1.00 0.00 C ATOM 877 C GLU A 435 -6.080 -14.860 5.004 1.00 0.00 C ATOM 878 O GLU A 435 -5.054 -15.302 5.523 1.00 0.00 O ATOM 879 CB GLU A 435 -6.385 -16.671 3.312 1.00 0.00 C ATOM 880 CG GLU A 435 -7.329 -17.497 2.454 1.00 0.00 C ATOM 881 CD GLU A 435 -6.721 -17.858 1.113 1.00 0.00 C ATOM 882 OE1 GLU A 435 -6.060 -16.991 0.502 1.00 0.00 O ATOM 883 OE2 GLU A 435 -6.913 -19.005 0.656 1.00 0.00 O ATOM 0 H GLU A 435 -7.918 -14.687 2.743 1.00 0.00 H new ATOM 0 HA GLU A 435 -7.557 -16.412 5.087 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -5.772 -16.047 2.662 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -5.709 -17.343 3.840 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -7.596 -18.410 2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -8.252 -16.940 2.294 1.00 0.00 H new ATOM 890 N ASP A 436 -6.403 -13.583 5.007 1.00 0.00 N ATOM 891 CA ASP A 436 -5.538 -12.562 5.588 1.00 0.00 C ATOM 892 C ASP A 436 -5.981 -12.212 7.002 1.00 0.00 C ATOM 893 O ASP A 436 -5.257 -11.553 7.743 1.00 0.00 O ATOM 894 CB ASP A 436 -5.541 -11.304 4.717 1.00 0.00 C ATOM 895 CG ASP A 436 -4.487 -10.304 5.138 1.00 0.00 C ATOM 896 OD1 ASP A 436 -3.294 -10.557 4.880 1.00 0.00 O ATOM 897 OD2 ASP A 436 -4.850 -9.261 5.715 1.00 0.00 O ATOM 0 H ASP A 436 -7.269 -13.219 4.609 1.00 0.00 H new ATOM 0 HA ASP A 436 -4.526 -12.964 5.632 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -5.375 -11.586 3.677 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -6.523 -10.834 4.767 1.00 0.00 H new ATOM 1036 N GLU B 7 6.518 -6.665 -12.477 1.00 0.00 N ATOM 1037 CA GLU B 7 5.699 -5.582 -12.983 1.00 0.00 C ATOM 1038 C GLU B 7 5.910 -4.337 -12.126 1.00 0.00 C ATOM 1039 O GLU B 7 5.277 -4.189 -11.088 1.00 0.00 O ATOM 1040 CB GLU B 7 4.205 -5.972 -12.982 1.00 0.00 C ATOM 1041 CG GLU B 7 3.906 -7.307 -12.298 1.00 0.00 C ATOM 1042 CD GLU B 7 2.499 -7.391 -11.717 1.00 0.00 C ATOM 1043 OE1 GLU B 7 2.236 -6.750 -10.678 1.00 0.00 O ATOM 1044 OE2 GLU B 7 1.653 -8.123 -12.278 1.00 0.00 O ATOM 0 HA GLU B 7 5.997 -5.374 -14.011 1.00 0.00 H new ATOM 0 HB2 GLU B 7 3.636 -5.186 -12.485 1.00 0.00 H new ATOM 0 HB3 GLU B 7 3.852 -6.017 -14.012 1.00 0.00 H new ATOM 0 HG2 GLU B 7 4.042 -8.114 -13.018 1.00 0.00 H new ATOM 0 HG3 GLU B 7 4.630 -7.467 -11.500 1.00 0.00 H new ATOM 1051 N VAL B 8 6.843 -3.473 -12.523 1.00 0.00 N ATOM 1052 CA VAL B 8 7.076 -2.245 -11.774 1.00 0.00 C ATOM 1053 C VAL B 8 5.849 -1.372 -11.882 1.00 0.00 C ATOM 1054 O VAL B 8 5.406 -1.022 -12.975 1.00 0.00 O ATOM 1055 CB VAL B 8 8.321 -1.483 -12.231 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.342 -0.086 -11.621 1.00 0.00 C ATOM 1057 CG2 VAL B 8 9.542 -2.261 -11.804 1.00 0.00 C ATOM 0 H VAL B 8 7.438 -3.598 -13.342 1.00 0.00 H new ATOM 0 HA VAL B 8 7.262 -2.519 -10.736 1.00 0.00 H new ATOM 0 HB VAL B 8 8.311 -1.376 -13.316 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.234 0.444 -11.956 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.454 0.462 -11.937 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.353 -0.164 -10.534 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.440 -1.732 -12.122 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.547 -2.364 -10.719 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.522 -3.250 -12.262 1.00 0.00 H new ATOM 1067 N LEU B 9 5.311 -1.039 -10.738 1.00 0.00 N ATOM 1068 CA LEU B 9 4.097 -0.270 -10.657 1.00 0.00 C ATOM 1069 C LEU B 9 4.362 1.218 -10.699 1.00 0.00 C ATOM 1070 O LEU B 9 3.901 1.916 -11.600 1.00 0.00 O ATOM 1071 CB LEU B 9 3.376 -0.651 -9.366 1.00 0.00 C ATOM 1072 CG LEU B 9 3.583 -2.109 -8.963 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.308 -2.330 -7.495 1.00 0.00 C ATOM 1074 CD2 LEU B 9 2.705 -3.009 -9.797 1.00 0.00 C ATOM 0 H LEU B 9 5.704 -1.295 -9.832 1.00 0.00 H new ATOM 0 HA LEU B 9 3.475 -0.498 -11.523 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.725 -0.006 -8.560 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.309 -0.463 -9.485 1.00 0.00 H new ATOM 0 HG LEU B 9 4.629 -2.356 -9.144 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.467 -3.380 -7.249 1.00 0.00 H new ATOM 0 HD12 LEU B 9 3.982 -1.712 -6.902 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.276 -2.057 -7.273 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.861 -4.046 -9.501 1.00 0.00 H new ATOM 0 HD22 LEU B 9 1.660 -2.741 -9.643 1.00 0.00 H new ATOM 0 HD23 LEU B 9 2.959 -2.891 -10.850 1.00 0.00 H new ATOM 1086 N LEU B 10 5.101 1.706 -9.728 1.00 0.00 N ATOM 1087 CA LEU B 10 5.375 3.125 -9.665 1.00 0.00 C ATOM 1088 C LEU B 10 6.768 3.437 -9.150 1.00 0.00 C ATOM 1089 O LEU B 10 7.206 2.910 -8.128 1.00 0.00 O ATOM 1090 CB LEU B 10 4.344 3.777 -8.770 1.00 0.00 C ATOM 1091 CG LEU B 10 4.214 5.287 -8.897 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.408 5.657 -10.131 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.576 5.849 -7.641 1.00 0.00 C ATOM 0 H LEU B 10 5.518 1.151 -8.981 1.00 0.00 H new ATOM 0 HA LEU B 10 5.321 3.519 -10.680 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.373 3.329 -8.981 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.587 3.538 -7.735 1.00 0.00 H new ATOM 0 HG LEU B 10 5.207 5.722 -9.011 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.328 6.742 -10.202 1.00 0.00 H new ATOM 0 HD12 LEU B 10 3.907 5.271 -11.020 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.411 5.224 -10.058 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.483 6.931 -7.733 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.587 5.410 -7.508 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.198 5.610 -6.779 1.00 0.00 H new ATOM 1105 N ILE B 11 7.455 4.285 -9.887 1.00 0.00 N ATOM 1106 CA ILE B 11 8.781 4.741 -9.521 1.00 0.00 C ATOM 1107 C ILE B 11 8.704 6.168 -8.992 1.00 0.00 C ATOM 1108 O ILE B 11 8.549 7.113 -9.768 1.00 0.00 O ATOM 1109 CB ILE B 11 9.731 4.711 -10.735 1.00 0.00 C ATOM 1110 CG1 ILE B 11 9.945 3.272 -11.206 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.059 5.374 -10.395 1.00 0.00 C ATOM 1112 CD1 ILE B 11 10.662 3.170 -12.534 1.00 0.00 C ATOM 0 H ILE B 11 7.108 4.680 -10.761 1.00 0.00 H new ATOM 0 HA ILE B 11 9.169 4.073 -8.752 1.00 0.00 H new ATOM 0 HB ILE B 11 9.273 5.274 -11.548 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.517 2.733 -10.451 1.00 0.00 H new ATOM 0 HG13 ILE B 11 8.977 2.777 -11.286 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.715 5.342 -11.265 1.00 0.00 H new ATOM 0 HG22 ILE B 11 10.885 6.411 -10.109 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.529 4.844 -9.567 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.779 2.121 -12.805 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.080 3.680 -13.302 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.644 3.635 -12.454 1.00 0.00 H new ATOM 1124 N VAL B 12 8.790 6.331 -7.681 1.00 0.00 N ATOM 1125 CA VAL B 12 8.735 7.647 -7.088 1.00 0.00 C ATOM 1126 C VAL B 12 10.139 8.088 -6.759 1.00 0.00 C ATOM 1127 O VAL B 12 10.942 7.286 -6.330 1.00 0.00 O ATOM 1128 CB VAL B 12 7.884 7.648 -5.811 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.649 9.061 -5.316 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.571 6.942 -6.059 1.00 0.00 C ATOM 0 H VAL B 12 8.898 5.567 -7.014 1.00 0.00 H new ATOM 0 HA VAL B 12 8.275 8.333 -7.799 1.00 0.00 H new ATOM 0 HB VAL B 12 8.428 7.110 -5.035 1.00 0.00 H new ATOM 0 HG11 VAL B 12 7.043 9.033 -4.410 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.606 9.534 -5.098 1.00 0.00 H new ATOM 0 HG13 VAL B 12 7.128 9.633 -6.083 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.976 6.949 -5.146 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.026 7.455 -6.851 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.763 5.912 -6.359 1.00 0.00 H new ATOM 1140 N LYS B 13 10.439 9.347 -6.990 1.00 0.00 N ATOM 1141 CA LYS B 13 11.768 9.880 -6.718 1.00 0.00 C ATOM 1142 C LYS B 13 11.672 10.997 -5.690 1.00 0.00 C ATOM 1143 O LYS B 13 10.576 11.457 -5.378 1.00 0.00 O ATOM 1144 CB LYS B 13 12.440 10.390 -8.004 1.00 0.00 C ATOM 1145 CG LYS B 13 12.662 9.318 -9.077 1.00 0.00 C ATOM 1146 CD LYS B 13 11.376 8.965 -9.823 1.00 0.00 C ATOM 1147 CE LYS B 13 10.411 10.137 -9.838 1.00 0.00 C ATOM 1148 NZ LYS B 13 9.010 9.730 -10.147 1.00 0.00 N ATOM 0 H LYS B 13 9.781 10.029 -7.368 1.00 0.00 H new ATOM 0 HA LYS B 13 12.386 9.076 -6.319 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.828 11.187 -8.427 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.403 10.831 -7.745 1.00 0.00 H new ATOM 0 HG2 LYS B 13 13.407 9.670 -9.790 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.067 8.420 -8.611 1.00 0.00 H new ATOM 0 HD2 LYS B 13 11.614 8.673 -10.846 1.00 0.00 H new ATOM 0 HD3 LYS B 13 10.902 8.106 -9.349 1.00 0.00 H new ATOM 0 HE2 LYS B 13 10.434 10.633 -8.868 1.00 0.00 H new ATOM 0 HE3 LYS B 13 10.744 10.866 -10.577 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 8.690 10.215 -11.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 8.972 8.701 -10.294 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 8.390 9.990 -9.353 1.00 0.00 H new ATOM 1162 N LYS B 14 12.824 11.429 -5.178 1.00 0.00 N ATOM 1163 CA LYS B 14 12.894 12.470 -4.162 1.00 0.00 C ATOM 1164 C LYS B 14 12.162 12.024 -2.896 1.00 0.00 C ATOM 1165 O LYS B 14 11.717 12.837 -2.082 1.00 0.00 O ATOM 1166 CB LYS B 14 12.333 13.768 -4.727 1.00 0.00 C ATOM 1167 CG LYS B 14 13.387 14.638 -5.396 1.00 0.00 C ATOM 1168 CD LYS B 14 12.770 15.625 -6.373 1.00 0.00 C ATOM 1169 CE LYS B 14 12.401 16.936 -5.697 1.00 0.00 C ATOM 1170 NZ LYS B 14 11.755 17.881 -6.646 1.00 0.00 N ATOM 0 H LYS B 14 13.734 11.064 -5.459 1.00 0.00 H new ATOM 0 HA LYS B 14 13.932 12.649 -3.883 1.00 0.00 H new ATOM 0 HB2 LYS B 14 11.552 13.534 -5.451 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.863 14.333 -3.922 1.00 0.00 H new ATOM 0 HG2 LYS B 14 13.945 15.182 -4.634 1.00 0.00 H new ATOM 0 HG3 LYS B 14 14.100 14.004 -5.922 1.00 0.00 H new ATOM 0 HD2 LYS B 14 13.472 15.820 -7.184 1.00 0.00 H new ATOM 0 HD3 LYS B 14 11.879 15.184 -6.821 1.00 0.00 H new ATOM 0 HE2 LYS B 14 11.726 16.739 -4.864 1.00 0.00 H new ATOM 0 HE3 LYS B 14 13.297 17.395 -5.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 11.793 18.845 -6.257 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 12.256 17.855 -7.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 10.763 17.605 -6.789 1.00 0.00 H new ATOM 1184 N VAL B 15 12.066 10.708 -2.750 1.00 0.00 N ATOM 1185 CA VAL B 15 11.426 10.079 -1.608 1.00 0.00 C ATOM 1186 C VAL B 15 12.440 10.003 -0.476 1.00 0.00 C ATOM 1187 O VAL B 15 13.463 9.340 -0.604 1.00 0.00 O ATOM 1188 CB VAL B 15 10.921 8.662 -1.986 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.905 8.137 -0.995 1.00 0.00 C ATOM 1190 CG2 VAL B 15 10.313 8.676 -3.370 1.00 0.00 C ATOM 0 H VAL B 15 12.435 10.043 -3.430 1.00 0.00 H new ATOM 0 HA VAL B 15 10.563 10.665 -1.292 1.00 0.00 H new ATOM 0 HB VAL B 15 11.785 7.997 -1.966 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.580 7.142 -1.300 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.357 8.083 -0.005 1.00 0.00 H new ATOM 0 HG13 VAL B 15 9.046 8.807 -0.966 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.962 7.676 -3.624 1.00 0.00 H new ATOM 0 HG22 VAL B 15 9.474 9.371 -3.392 1.00 0.00 H new ATOM 0 HG23 VAL B 15 11.064 8.992 -4.094 1.00 0.00 H new ATOM 1200 N ARG B 16 12.176 10.700 0.612 1.00 0.00 N ATOM 1201 CA ARG B 16 13.091 10.740 1.731 1.00 0.00 C ATOM 1202 C ARG B 16 12.704 9.747 2.812 1.00 0.00 C ATOM 1203 O ARG B 16 11.535 9.608 3.158 1.00 0.00 O ATOM 1204 CB ARG B 16 13.128 12.151 2.323 1.00 0.00 C ATOM 1205 CG ARG B 16 13.347 13.240 1.286 1.00 0.00 C ATOM 1206 CD ARG B 16 13.765 14.549 1.935 1.00 0.00 C ATOM 1207 NE ARG B 16 15.075 14.433 2.583 1.00 0.00 N ATOM 1208 CZ ARG B 16 16.235 14.653 1.957 1.00 0.00 C ATOM 1209 NH1 ARG B 16 16.248 15.158 0.732 1.00 0.00 N ATOM 1210 NH2 ARG B 16 17.390 14.396 2.562 1.00 0.00 N ATOM 0 H ARG B 16 11.327 11.250 0.743 1.00 0.00 H new ATOM 0 HA ARG B 16 14.078 10.466 1.359 1.00 0.00 H new ATOM 0 HB2 ARG B 16 12.191 12.342 2.845 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.923 12.203 3.066 1.00 0.00 H new ATOM 0 HG2 ARG B 16 14.113 12.922 0.579 1.00 0.00 H new ATOM 0 HG3 ARG B 16 12.430 13.391 0.716 1.00 0.00 H new ATOM 0 HD2 ARG B 16 13.799 15.335 1.181 1.00 0.00 H new ATOM 0 HD3 ARG B 16 13.018 14.846 2.672 1.00 0.00 H new ATOM 0 HE ARG B 16 15.103 14.169 3.568 1.00 0.00 H new ATOM 0 HH11 ARG B 16 15.370 15.381 0.263 1.00 0.00 H new ATOM 0 HH12 ARG B 16 17.136 15.324 0.258 1.00 0.00 H new ATOM 0 HH21 ARG B 16 17.397 14.027 3.513 1.00 0.00 H new ATOM 0 HH22 ARG B 16 18.270 14.567 2.075 1.00 0.00 H new ATOM 1224 N GLN B 17 13.697 9.041 3.310 1.00 0.00 N ATOM 1225 CA GLN B 17 13.504 8.089 4.384 1.00 0.00 C ATOM 1226 C GLN B 17 14.710 8.170 5.302 1.00 0.00 C ATOM 1227 O GLN B 17 15.839 7.939 4.867 1.00 0.00 O ATOM 1228 CB GLN B 17 13.305 6.672 3.848 1.00 0.00 C ATOM 1229 CG GLN B 17 12.466 5.802 4.770 1.00 0.00 C ATOM 1230 CD GLN B 17 13.263 5.243 5.929 1.00 0.00 C ATOM 1231 OE1 GLN B 17 12.778 5.159 7.057 1.00 0.00 O ATOM 1232 NE2 GLN B 17 14.498 4.850 5.657 1.00 0.00 N ATOM 0 H GLN B 17 14.660 9.111 2.982 1.00 0.00 H new ATOM 0 HA GLN B 17 12.598 8.335 4.938 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.826 6.723 2.870 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.279 6.204 3.702 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.632 6.388 5.157 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.039 4.979 4.197 1.00 0.00 H new ATOM 0 HE21 GLN B 17 14.863 4.936 4.709 1.00 0.00 H new ATOM 0 HE22 GLN B 17 15.084 4.461 6.396 1.00 0.00 H new ATOM 1241 N LYS B 18 14.457 8.536 6.552 1.00 0.00 N ATOM 1242 CA LYS B 18 15.496 8.717 7.559 1.00 0.00 C ATOM 1243 C LYS B 18 16.297 9.957 7.204 1.00 0.00 C ATOM 1244 O LYS B 18 17.501 10.036 7.439 1.00 0.00 O ATOM 1245 CB LYS B 18 16.396 7.481 7.702 1.00 0.00 C ATOM 1246 CG LYS B 18 15.652 6.222 8.145 1.00 0.00 C ATOM 1247 CD LYS B 18 15.304 6.226 9.631 1.00 0.00 C ATOM 1248 CE LYS B 18 14.280 7.295 9.989 1.00 0.00 C ATOM 1249 NZ LYS B 18 12.931 7.035 9.405 1.00 0.00 N ATOM 0 H LYS B 18 13.515 8.718 6.899 1.00 0.00 H new ATOM 0 HA LYS B 18 15.026 8.849 8.533 1.00 0.00 H new ATOM 0 HB2 LYS B 18 16.883 7.286 6.747 1.00 0.00 H new ATOM 0 HB3 LYS B 18 17.184 7.699 8.423 1.00 0.00 H new ATOM 0 HG2 LYS B 18 14.735 6.125 7.563 1.00 0.00 H new ATOM 0 HG3 LYS B 18 16.264 5.348 7.923 1.00 0.00 H new ATOM 0 HD2 LYS B 18 14.916 5.247 9.912 1.00 0.00 H new ATOM 0 HD3 LYS B 18 16.212 6.388 10.213 1.00 0.00 H new ATOM 0 HE2 LYS B 18 14.193 7.357 11.074 1.00 0.00 H new ATOM 0 HE3 LYS B 18 14.639 8.264 9.642 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 12.562 7.910 8.981 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.005 6.300 8.673 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 12.285 6.714 10.154 1.00 0.00 H new ATOM 1263 N LYS B 19 15.572 10.929 6.639 1.00 0.00 N ATOM 1264 CA LYS B 19 16.132 12.209 6.219 1.00 0.00 C ATOM 1265 C LYS B 19 17.118 12.035 5.065 1.00 0.00 C ATOM 1266 O LYS B 19 17.982 12.884 4.848 1.00 0.00 O ATOM 1267 CB LYS B 19 16.802 12.918 7.402 1.00 0.00 C ATOM 1268 CG LYS B 19 15.854 13.184 8.565 1.00 0.00 C ATOM 1269 CD LYS B 19 16.606 13.583 9.826 1.00 0.00 C ATOM 1270 CE LYS B 19 17.474 12.446 10.345 1.00 0.00 C ATOM 1271 NZ LYS B 19 18.814 12.923 10.795 1.00 0.00 N ATOM 0 H LYS B 19 14.571 10.844 6.461 1.00 0.00 H new ATOM 0 HA LYS B 19 15.311 12.831 5.862 1.00 0.00 H new ATOM 0 HB2 LYS B 19 17.636 12.311 7.754 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.219 13.865 7.059 1.00 0.00 H new ATOM 0 HG2 LYS B 19 15.156 13.976 8.292 1.00 0.00 H new ATOM 0 HG3 LYS B 19 15.261 12.291 8.762 1.00 0.00 H new ATOM 0 HD2 LYS B 19 17.230 14.452 9.618 1.00 0.00 H new ATOM 0 HD3 LYS B 19 15.894 13.879 10.597 1.00 0.00 H new ATOM 0 HE2 LYS B 19 16.967 11.954 11.175 1.00 0.00 H new ATOM 0 HE3 LYS B 19 17.600 11.700 9.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 19.372 12.116 11.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 19.309 13.370 9.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 18.696 13.616 11.561 1.00 0.00 H new ATOM 1285 N GLN B 20 16.942 10.971 4.283 1.00 0.00 N ATOM 1286 CA GLN B 20 17.830 10.690 3.166 1.00 0.00 C ATOM 1287 C GLN B 20 17.037 10.689 1.869 1.00 0.00 C ATOM 1288 O GLN B 20 16.005 10.025 1.770 1.00 0.00 O ATOM 1289 CB GLN B 20 18.529 9.342 3.380 1.00 0.00 C ATOM 1290 CG GLN B 20 19.424 8.913 2.227 1.00 0.00 C ATOM 1291 CD GLN B 20 20.203 7.651 2.541 1.00 0.00 C ATOM 1292 OE1 GLN B 20 21.349 7.706 2.980 1.00 0.00 O ATOM 1293 NE2 GLN B 20 19.580 6.502 2.331 1.00 0.00 N ATOM 0 H GLN B 20 16.191 10.292 4.406 1.00 0.00 H new ATOM 0 HA GLN B 20 18.594 11.465 3.105 1.00 0.00 H new ATOM 0 HB2 GLN B 20 19.128 9.396 4.289 1.00 0.00 H new ATOM 0 HB3 GLN B 20 17.772 8.575 3.542 1.00 0.00 H new ATOM 0 HG2 GLN B 20 18.814 8.749 1.338 1.00 0.00 H new ATOM 0 HG3 GLN B 20 20.120 9.718 1.992 1.00 0.00 H new ATOM 0 HE21 GLN B 20 18.628 6.498 1.965 1.00 0.00 H new ATOM 0 HE22 GLN B 20 20.052 5.621 2.535 1.00 0.00 H new ATOM 1302 N ASP B 21 17.507 11.448 0.890 1.00 0.00 N ATOM 1303 CA ASP B 21 16.826 11.547 -0.394 1.00 0.00 C ATOM 1304 C ASP B 21 17.108 10.351 -1.284 1.00 0.00 C ATOM 1305 O ASP B 21 18.257 10.000 -1.548 1.00 0.00 O ATOM 1306 CB ASP B 21 17.197 12.840 -1.131 1.00 0.00 C ATOM 1307 CG ASP B 21 18.595 13.339 -0.814 1.00 0.00 C ATOM 1308 OD1 ASP B 21 18.776 13.945 0.269 1.00 0.00 O ATOM 1309 OD2 ASP B 21 19.498 13.145 -1.643 1.00 0.00 O ATOM 0 H ASP B 21 18.358 12.005 0.960 1.00 0.00 H new ATOM 0 HA ASP B 21 15.759 11.563 -0.173 1.00 0.00 H new ATOM 0 HB2 ASP B 21 17.114 12.673 -2.205 1.00 0.00 H new ATOM 0 HB3 ASP B 21 16.476 13.616 -0.873 1.00 0.00 H new ATOM 1314 N GLY B 22 16.035 9.711 -1.708 1.00 0.00 N ATOM 1315 CA GLY B 22 16.125 8.585 -2.589 1.00 0.00 C ATOM 1316 C GLY B 22 14.910 8.476 -3.478 1.00 0.00 C ATOM 1317 O GLY B 22 14.403 9.481 -3.978 1.00 0.00 O ATOM 0 H GLY B 22 15.082 9.964 -1.446 1.00 0.00 H new ATOM 0 HA2 GLY B 22 17.020 8.675 -3.205 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.231 7.672 -2.003 1.00 0.00 H new ATOM 1321 N ALA B 23 14.432 7.263 -3.658 1.00 0.00 N ATOM 1322 CA ALA B 23 13.285 7.004 -4.489 1.00 0.00 C ATOM 1323 C ALA B 23 12.529 5.782 -3.986 1.00 0.00 C ATOM 1324 O ALA B 23 13.130 4.829 -3.490 1.00 0.00 O ATOM 1325 CB ALA B 23 13.722 6.819 -5.929 1.00 0.00 C ATOM 0 H ALA B 23 14.832 6.429 -3.229 1.00 0.00 H new ATOM 0 HA ALA B 23 12.610 7.859 -4.441 1.00 0.00 H new ATOM 0 HB1 ALA B 23 12.849 6.623 -6.552 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.221 7.724 -6.277 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.411 5.977 -5.995 1.00 0.00 H new ATOM 1331 N LEU B 24 11.215 5.818 -4.126 1.00 0.00 N ATOM 1332 CA LEU B 24 10.361 4.740 -3.676 1.00 0.00 C ATOM 1333 C LEU B 24 9.879 3.952 -4.892 1.00 0.00 C ATOM 1334 O LEU B 24 9.166 4.478 -5.745 1.00 0.00 O ATOM 1335 CB LEU B 24 9.174 5.311 -2.900 1.00 0.00 C ATOM 1336 CG LEU B 24 8.639 4.428 -1.773 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.167 4.703 -1.526 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.867 2.959 -2.061 1.00 0.00 C ATOM 0 H LEU B 24 10.714 6.596 -4.555 1.00 0.00 H new ATOM 0 HA LEU B 24 10.915 4.075 -3.014 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.467 6.272 -2.477 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.363 5.506 -3.602 1.00 0.00 H new ATOM 0 HG LEU B 24 9.194 4.678 -0.869 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.808 4.063 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU B 24 7.034 5.748 -1.247 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.601 4.495 -2.434 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.474 2.362 -1.238 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.356 2.686 -2.984 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.935 2.771 -2.168 1.00 0.00 H new ATOM 1350 N TYR B 25 10.280 2.703 -4.966 1.00 0.00 N ATOM 1351 CA TYR B 25 9.923 1.841 -6.083 1.00 0.00 C ATOM 1352 C TYR B 25 8.863 0.807 -5.728 1.00 0.00 C ATOM 1353 O TYR B 25 9.107 -0.090 -4.922 1.00 0.00 O ATOM 1354 CB TYR B 25 11.157 1.086 -6.563 1.00 0.00 C ATOM 1355 CG TYR B 25 11.944 1.780 -7.633 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.561 2.994 -7.392 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.079 1.206 -8.886 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.292 3.625 -8.371 1.00 0.00 C ATOM 1359 CE2 TYR B 25 12.807 1.826 -9.874 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.416 3.037 -9.614 1.00 0.00 C ATOM 1361 OH TYR B 25 14.145 3.662 -10.599 1.00 0.00 O ATOM 0 H TYR B 25 10.861 2.252 -4.259 1.00 0.00 H new ATOM 0 HA TYR B 25 9.519 2.496 -6.855 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.811 0.907 -5.709 1.00 0.00 H new ATOM 0 HB3 TYR B 25 10.846 0.110 -6.936 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.467 3.454 -6.419 1.00 0.00 H new ATOM 0 HD2 TYR B 25 11.605 0.257 -9.090 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.766 4.574 -8.169 1.00 0.00 H new ATOM 0 HE2 TYR B 25 12.902 1.368 -10.848 1.00 0.00 H new ATOM 0 HH TYR B 25 14.133 3.115 -11.412 1.00 0.00 H new ATOM 1371 N LEU B 26 7.691 0.916 -6.333 1.00 0.00 N ATOM 1372 CA LEU B 26 6.656 -0.078 -6.113 1.00 0.00 C ATOM 1373 C LEU B 26 6.825 -1.149 -7.157 1.00 0.00 C ATOM 1374 O LEU B 26 6.489 -0.927 -8.321 1.00 0.00 O ATOM 1375 CB LEU B 26 5.235 0.473 -6.266 1.00 0.00 C ATOM 1376 CG LEU B 26 4.951 1.812 -5.629 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.574 2.296 -6.036 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.022 1.724 -4.126 1.00 0.00 C ATOM 0 H LEU B 26 7.436 1.671 -6.970 1.00 0.00 H new ATOM 0 HA LEU B 26 6.767 -0.438 -5.090 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.013 0.550 -7.330 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.541 -0.256 -5.848 1.00 0.00 H new ATOM 0 HG LEU B 26 5.708 2.516 -5.974 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.376 3.263 -5.572 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.530 2.398 -7.120 1.00 0.00 H new ATOM 0 HD13 LEU B 26 2.824 1.576 -5.708 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.813 2.703 -3.694 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.285 1.005 -3.768 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.019 1.401 -3.827 1.00 0.00 H new ATOM 1390 N MET B 27 7.374 -2.283 -6.785 1.00 0.00 N ATOM 1391 CA MET B 27 7.531 -3.345 -7.748 1.00 0.00 C ATOM 1392 C MET B 27 6.434 -4.361 -7.577 1.00 0.00 C ATOM 1393 O MET B 27 5.712 -4.334 -6.579 1.00 0.00 O ATOM 1394 CB MET B 27 8.906 -4.010 -7.670 1.00 0.00 C ATOM 1395 CG MET B 27 9.947 -3.375 -8.573 1.00 0.00 C ATOM 1396 SD MET B 27 11.587 -3.354 -7.829 1.00 0.00 S ATOM 1397 CE MET B 27 11.296 -2.221 -6.480 1.00 0.00 C ATOM 0 H MET B 27 7.712 -2.490 -5.845 1.00 0.00 H new ATOM 0 HA MET B 27 7.458 -2.900 -8.740 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.260 -3.971 -6.640 1.00 0.00 H new ATOM 0 HB3 MET B 27 8.805 -5.063 -7.932 1.00 0.00 H new ATOM 0 HG2 MET B 27 9.987 -3.921 -9.516 1.00 0.00 H new ATOM 0 HG3 MET B 27 9.645 -2.354 -8.808 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.116 -1.505 -6.423 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.360 -1.689 -6.647 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.235 -2.777 -5.545 1.00 0.00 H new ATOM 1407 N ALA B 28 6.373 -5.279 -8.529 1.00 0.00 N ATOM 1408 CA ALA B 28 5.328 -6.282 -8.596 1.00 0.00 C ATOM 1409 C ALA B 28 4.907 -6.852 -7.246 1.00 0.00 C ATOM 1410 O ALA B 28 3.754 -6.738 -6.865 1.00 0.00 O ATOM 1411 CB ALA B 28 5.766 -7.417 -9.491 1.00 0.00 C ATOM 0 H ALA B 28 7.056 -5.347 -9.284 1.00 0.00 H new ATOM 0 HA ALA B 28 4.456 -5.767 -8.999 1.00 0.00 H new ATOM 0 HB1 ALA B 28 4.978 -8.168 -9.538 1.00 0.00 H new ATOM 0 HB2 ALA B 28 5.964 -7.035 -10.493 1.00 0.00 H new ATOM 0 HB3 ALA B 28 6.673 -7.868 -9.089 1.00 0.00 H new ATOM 1417 N GLU B 29 5.840 -7.408 -6.498 1.00 0.00 N ATOM 1418 CA GLU B 29 5.496 -7.991 -5.208 1.00 0.00 C ATOM 1419 C GLU B 29 6.304 -7.371 -4.088 1.00 0.00 C ATOM 1420 O GLU B 29 6.200 -7.787 -2.933 1.00 0.00 O ATOM 1421 CB GLU B 29 5.736 -9.506 -5.217 1.00 0.00 C ATOM 1422 CG GLU B 29 4.723 -10.294 -6.028 1.00 0.00 C ATOM 1423 CD GLU B 29 4.444 -11.664 -5.437 1.00 0.00 C ATOM 1424 OE1 GLU B 29 3.848 -11.734 -4.338 1.00 0.00 O ATOM 1425 OE2 GLU B 29 4.803 -12.680 -6.071 1.00 0.00 O ATOM 0 H GLU B 29 6.826 -7.470 -6.751 1.00 0.00 H new ATOM 0 HA GLU B 29 4.439 -7.788 -5.035 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.732 -9.702 -5.613 1.00 0.00 H new ATOM 0 HB3 GLU B 29 5.724 -9.870 -4.190 1.00 0.00 H new ATOM 0 HG2 GLU B 29 3.792 -9.731 -6.086 1.00 0.00 H new ATOM 0 HG3 GLU B 29 5.090 -10.410 -7.048 1.00 0.00 H new ATOM 1432 N ARG B 30 7.065 -6.338 -4.402 1.00 0.00 N ATOM 1433 CA ARG B 30 7.917 -5.734 -3.396 1.00 0.00 C ATOM 1434 C ARG B 30 8.058 -4.234 -3.569 1.00 0.00 C ATOM 1435 O ARG B 30 8.403 -3.741 -4.640 1.00 0.00 O ATOM 1436 CB ARG B 30 9.303 -6.378 -3.436 1.00 0.00 C ATOM 1437 CG ARG B 30 9.843 -6.535 -4.846 1.00 0.00 C ATOM 1438 CD ARG B 30 11.302 -6.945 -4.858 1.00 0.00 C ATOM 1439 NE ARG B 30 11.771 -7.171 -6.219 1.00 0.00 N ATOM 1440 CZ ARG B 30 12.873 -6.642 -6.738 1.00 0.00 C ATOM 1441 NH1 ARG B 30 13.662 -5.866 -6.001 1.00 0.00 N ATOM 1442 NH2 ARG B 30 13.176 -6.895 -8.002 1.00 0.00 N ATOM 0 H ARG B 30 7.111 -5.908 -5.326 1.00 0.00 H new ATOM 0 HA ARG B 30 7.440 -5.909 -2.431 1.00 0.00 H new ATOM 0 HB2 ARG B 30 9.996 -5.772 -2.853 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.257 -7.357 -2.959 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.253 -7.281 -5.378 1.00 0.00 H new ATOM 0 HG3 ARG B 30 9.727 -5.594 -5.384 1.00 0.00 H new ATOM 0 HD2 ARG B 30 11.905 -6.169 -4.386 1.00 0.00 H new ATOM 0 HD3 ARG B 30 11.433 -7.853 -4.269 1.00 0.00 H new ATOM 0 HE ARG B 30 11.212 -7.780 -6.817 1.00 0.00 H new ATOM 0 HH11 ARG B 30 13.423 -5.673 -5.028 1.00 0.00 H new ATOM 0 HH12 ARG B 30 14.506 -5.464 -6.408 1.00 0.00 H new ATOM 0 HH21 ARG B 30 12.566 -7.489 -8.564 1.00 0.00 H new ATOM 0 HH22 ARG B 30 14.019 -6.496 -8.414 1.00 0.00 H new ATOM 1456 N ILE B 31 7.783 -3.516 -2.504 1.00 0.00 N ATOM 1457 CA ILE B 31 7.936 -2.082 -2.496 1.00 0.00 C ATOM 1458 C ILE B 31 9.307 -1.789 -1.906 1.00 0.00 C ATOM 1459 O ILE B 31 9.548 -2.010 -0.718 1.00 0.00 O ATOM 1460 CB ILE B 31 6.810 -1.380 -1.698 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.197 0.063 -1.372 1.00 0.00 C ATOM 1462 CG2 ILE B 31 6.479 -2.154 -0.428 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.036 0.917 -0.917 1.00 0.00 C ATOM 0 H ILE B 31 7.449 -3.909 -1.624 1.00 0.00 H new ATOM 0 HA ILE B 31 7.859 -1.689 -3.510 1.00 0.00 H new ATOM 0 HB ILE B 31 5.916 -1.359 -2.321 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.960 0.058 -0.593 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.646 0.517 -2.255 1.00 0.00 H new ATOM 0 HG21 ILE B 31 5.685 -1.640 0.115 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.148 -3.159 -0.690 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.367 -2.217 0.201 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.388 1.926 -0.704 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.282 0.954 -1.703 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.600 0.487 -0.015 1.00 0.00 H new ATOM 1475 N ALA B 32 10.219 -1.342 -2.745 1.00 0.00 N ATOM 1476 CA ALA B 32 11.576 -1.092 -2.302 1.00 0.00 C ATOM 1477 C ALA B 32 12.006 0.345 -2.531 1.00 0.00 C ATOM 1478 O ALA B 32 11.709 0.944 -3.554 1.00 0.00 O ATOM 1479 CB ALA B 32 12.529 -2.051 -2.993 1.00 0.00 C ATOM 0 H ALA B 32 10.048 -1.145 -3.731 1.00 0.00 H new ATOM 0 HA ALA B 32 11.606 -1.261 -1.226 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.547 -1.858 -2.656 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.254 -3.077 -2.748 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.471 -1.908 -4.072 1.00 0.00 H new ATOM 1485 N TRP B 33 12.716 0.879 -1.560 1.00 0.00 N ATOM 1486 CA TRP B 33 13.210 2.237 -1.617 1.00 0.00 C ATOM 1487 C TRP B 33 14.736 2.234 -1.642 1.00 0.00 C ATOM 1488 O TRP B 33 15.376 1.391 -1.004 1.00 0.00 O ATOM 1489 CB TRP B 33 12.684 3.000 -0.389 1.00 0.00 C ATOM 1490 CG TRP B 33 13.150 4.430 -0.242 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.400 5.561 -0.392 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.463 4.879 0.111 1.00 0.00 C ATOM 1493 NE1 TRP B 33 13.176 6.673 -0.151 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.440 6.277 0.158 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.653 4.225 0.387 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.565 7.032 0.476 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.770 4.959 0.691 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.723 6.359 0.738 1.00 0.00 C ATOM 0 H TRP B 33 12.967 0.381 -0.706 1.00 0.00 H new ATOM 0 HA TRP B 33 12.860 2.729 -2.525 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.595 2.997 -0.424 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.976 2.451 0.506 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.354 5.581 -0.660 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.854 7.640 -0.197 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.700 3.146 0.363 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.523 8.111 0.514 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.700 4.451 0.897 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.616 6.913 0.985 1.00 0.00 H new ATOM 1509 N ALA B 34 15.305 3.169 -2.388 1.00 0.00 N ATOM 1510 CA ALA B 34 16.751 3.335 -2.480 1.00 0.00 C ATOM 1511 C ALA B 34 17.052 4.821 -2.579 1.00 0.00 C ATOM 1512 O ALA B 34 16.191 5.571 -2.998 1.00 0.00 O ATOM 1513 CB ALA B 34 17.306 2.596 -3.670 1.00 0.00 C ATOM 0 H ALA B 34 14.777 3.837 -2.949 1.00 0.00 H new ATOM 0 HA ALA B 34 17.227 2.916 -1.593 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.386 2.737 -3.714 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.082 1.533 -3.575 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.852 2.982 -4.582 1.00 0.00 H new ATOM 1519 N PRO B 35 18.245 5.280 -2.181 1.00 0.00 N ATOM 1520 CA PRO B 35 18.585 6.706 -2.226 1.00 0.00 C ATOM 1521 C PRO B 35 18.888 7.202 -3.644 1.00 0.00 C ATOM 1522 O PRO B 35 18.590 6.515 -4.624 1.00 0.00 O ATOM 1523 CB PRO B 35 19.838 6.817 -1.342 1.00 0.00 C ATOM 1524 CG PRO B 35 20.073 5.450 -0.774 1.00 0.00 C ATOM 1525 CD PRO B 35 19.352 4.478 -1.661 1.00 0.00 C ATOM 0 HA PRO B 35 17.752 7.321 -1.885 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.697 7.149 -1.925 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.690 7.548 -0.547 1.00 0.00 H new ATOM 0 HG2 PRO B 35 21.139 5.224 -0.740 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.701 5.388 0.249 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.993 4.106 -2.460 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.997 3.609 -1.106 1.00 0.00 H new ATOM 1533 N GLU B 36 19.471 8.407 -3.711 1.00 0.00 N ATOM 1534 CA GLU B 36 19.843 9.089 -4.963 1.00 0.00 C ATOM 1535 C GLU B 36 20.195 8.136 -6.112 1.00 0.00 C ATOM 1536 O GLU B 36 19.569 8.173 -7.172 1.00 0.00 O ATOM 1537 CB GLU B 36 21.018 10.048 -4.711 1.00 0.00 C ATOM 1538 CG GLU B 36 21.818 9.752 -3.444 1.00 0.00 C ATOM 1539 CD GLU B 36 22.778 8.587 -3.602 1.00 0.00 C ATOM 1540 OE1 GLU B 36 22.344 7.421 -3.460 1.00 0.00 O ATOM 1541 OE2 GLU B 36 23.971 8.817 -3.879 1.00 0.00 O ATOM 0 H GLU B 36 19.703 8.949 -2.878 1.00 0.00 H new ATOM 0 HA GLU B 36 18.957 9.639 -5.279 1.00 0.00 H new ATOM 0 HB2 GLU B 36 21.691 10.010 -5.567 1.00 0.00 H new ATOM 0 HB3 GLU B 36 20.633 11.066 -4.653 1.00 0.00 H new ATOM 0 HG2 GLU B 36 22.380 10.642 -3.161 1.00 0.00 H new ATOM 0 HG3 GLU B 36 21.128 9.538 -2.628 1.00 0.00 H new ATOM 1548 N GLY B 37 21.193 7.296 -5.902 1.00 0.00 N ATOM 1549 CA GLY B 37 21.604 6.370 -6.933 1.00 0.00 C ATOM 1550 C GLY B 37 22.351 5.185 -6.370 1.00 0.00 C ATOM 1551 O GLY B 37 23.582 5.182 -6.317 1.00 0.00 O ATOM 0 H GLY B 37 21.727 7.238 -5.035 1.00 0.00 H new ATOM 0 HA2 GLY B 37 20.726 6.020 -7.475 1.00 0.00 H new ATOM 0 HA3 GLY B 37 22.238 6.888 -7.653 1.00 0.00 H new ATOM 1555 N LYS B 38 21.609 4.187 -5.922 1.00 0.00 N ATOM 1556 CA LYS B 38 22.202 2.984 -5.365 1.00 0.00 C ATOM 1557 C LYS B 38 21.581 1.750 -6.001 1.00 0.00 C ATOM 1558 O LYS B 38 20.363 1.671 -6.151 1.00 0.00 O ATOM 1559 CB LYS B 38 22.019 2.944 -3.843 1.00 0.00 C ATOM 1560 CG LYS B 38 22.804 4.018 -3.104 1.00 0.00 C ATOM 1561 CD LYS B 38 24.304 3.850 -3.296 1.00 0.00 C ATOM 1562 CE LYS B 38 25.052 5.154 -3.052 1.00 0.00 C ATOM 1563 NZ LYS B 38 24.629 6.221 -3.997 1.00 0.00 N ATOM 0 H LYS B 38 20.589 4.187 -5.934 1.00 0.00 H new ATOM 0 HA LYS B 38 23.270 2.994 -5.583 1.00 0.00 H new ATOM 0 HB2 LYS B 38 20.960 3.056 -3.610 1.00 0.00 H new ATOM 0 HB3 LYS B 38 22.325 1.965 -3.475 1.00 0.00 H new ATOM 0 HG2 LYS B 38 22.499 5.002 -3.461 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.566 3.976 -2.041 1.00 0.00 H new ATOM 0 HD2 LYS B 38 24.675 3.085 -2.614 1.00 0.00 H new ATOM 0 HD3 LYS B 38 24.504 3.499 -4.308 1.00 0.00 H new ATOM 0 HE2 LYS B 38 24.878 5.486 -2.028 1.00 0.00 H new ATOM 0 HE3 LYS B 38 26.124 4.982 -3.154 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 25.292 7.020 -3.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 24.625 5.845 -4.967 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 23.673 6.546 -3.748 1.00 0.00 H new ATOM 1577 N ASP B 39 22.426 0.805 -6.389 1.00 0.00 N ATOM 1578 CA ASP B 39 21.971 -0.433 -7.015 1.00 0.00 C ATOM 1579 C ASP B 39 21.283 -1.329 -5.991 1.00 0.00 C ATOM 1580 O ASP B 39 20.339 -2.051 -6.310 1.00 0.00 O ATOM 1581 CB ASP B 39 23.156 -1.171 -7.646 1.00 0.00 C ATOM 1582 CG ASP B 39 24.237 -1.500 -6.635 1.00 0.00 C ATOM 1583 OD1 ASP B 39 24.945 -0.570 -6.186 1.00 0.00 O ATOM 1584 OD2 ASP B 39 24.373 -2.682 -6.265 1.00 0.00 O ATOM 0 H ASP B 39 23.438 0.871 -6.281 1.00 0.00 H new ATOM 0 HA ASP B 39 21.253 -0.182 -7.795 1.00 0.00 H new ATOM 0 HB2 ASP B 39 22.802 -2.093 -8.108 1.00 0.00 H new ATOM 0 HB3 ASP B 39 23.580 -0.558 -8.441 1.00 0.00 H new ATOM 1589 N ARG B 40 21.759 -1.268 -4.757 1.00 0.00 N ATOM 1590 CA ARG B 40 21.192 -2.061 -3.683 1.00 0.00 C ATOM 1591 C ARG B 40 20.148 -1.254 -2.930 1.00 0.00 C ATOM 1592 O ARG B 40 20.442 -0.179 -2.404 1.00 0.00 O ATOM 1593 CB ARG B 40 22.289 -2.532 -2.728 1.00 0.00 C ATOM 1594 CG ARG B 40 22.928 -3.848 -3.141 1.00 0.00 C ATOM 1595 CD ARG B 40 24.429 -3.838 -2.902 1.00 0.00 C ATOM 1596 NE ARG B 40 25.107 -2.888 -3.778 1.00 0.00 N ATOM 1597 CZ ARG B 40 26.204 -2.209 -3.455 1.00 0.00 C ATOM 1598 NH1 ARG B 40 26.787 -2.397 -2.274 1.00 0.00 N ATOM 1599 NH2 ARG B 40 26.712 -1.338 -4.317 1.00 0.00 N ATOM 0 H ARG B 40 22.540 -0.675 -4.476 1.00 0.00 H new ATOM 0 HA ARG B 40 20.712 -2.939 -4.116 1.00 0.00 H new ATOM 0 HB2 ARG B 40 23.061 -1.765 -2.668 1.00 0.00 H new ATOM 0 HB3 ARG B 40 21.868 -2.639 -1.728 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.475 -4.665 -2.580 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.728 -4.036 -4.196 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.630 -3.582 -1.862 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.831 -4.837 -3.068 1.00 0.00 H new ATOM 0 HE ARG B 40 24.711 -2.734 -4.705 1.00 0.00 H new ATOM 0 HH11 ARG B 40 26.393 -3.065 -1.611 1.00 0.00 H new ATOM 0 HH12 ARG B 40 27.628 -1.874 -2.031 1.00 0.00 H new ATOM 0 HH21 ARG B 40 26.261 -1.193 -5.221 1.00 0.00 H new ATOM 0 HH22 ARG B 40 27.553 -0.814 -4.076 1.00 0.00 H new ATOM 1613 N PHE B 41 18.927 -1.771 -2.899 1.00 0.00 N ATOM 1614 CA PHE B 41 17.833 -1.108 -2.207 1.00 0.00 C ATOM 1615 C PHE B 41 18.099 -1.064 -0.710 1.00 0.00 C ATOM 1616 O PHE B 41 18.776 -1.932 -0.160 1.00 0.00 O ATOM 1617 CB PHE B 41 16.508 -1.816 -2.490 1.00 0.00 C ATOM 1618 CG PHE B 41 16.006 -1.613 -3.891 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.467 -0.396 -4.279 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.072 -2.638 -4.820 1.00 0.00 C ATOM 1621 CE1 PHE B 41 15.002 -0.206 -5.566 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.610 -2.454 -6.109 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.074 -1.236 -6.482 1.00 0.00 C ATOM 0 H PHE B 41 18.670 -2.651 -3.347 1.00 0.00 H new ATOM 0 HA PHE B 41 17.764 -0.086 -2.578 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.630 -2.884 -2.308 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.756 -1.456 -1.788 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.410 0.413 -3.566 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.489 -3.592 -4.534 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.583 0.747 -5.855 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.668 -3.261 -6.824 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.712 -1.090 -7.489 1.00 0.00 H new ATOM 1633 N THR B 42 17.555 -0.054 -0.060 1.00 0.00 N ATOM 1634 CA THR B 42 17.737 0.129 1.365 1.00 0.00 C ATOM 1635 C THR B 42 16.570 -0.466 2.137 1.00 0.00 C ATOM 1636 O THR B 42 16.738 -1.035 3.215 1.00 0.00 O ATOM 1637 CB THR B 42 17.863 1.630 1.693 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.023 2.169 1.047 1.00 0.00 O ATOM 1639 CG2 THR B 42 17.945 1.873 3.193 1.00 0.00 C ATOM 0 H THR B 42 16.977 0.660 -0.503 1.00 0.00 H new ATOM 0 HA THR B 42 18.651 -0.385 1.662 1.00 0.00 H new ATOM 0 HB THR B 42 16.968 2.131 1.324 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.191 3.075 1.379 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.033 2.943 3.384 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.044 1.492 3.673 1.00 0.00 H new ATOM 0 HG23 THR B 42 18.817 1.359 3.598 1.00 0.00 H new ATOM 1647 N ILE B 43 15.386 -0.346 1.567 1.00 0.00 N ATOM 1648 CA ILE B 43 14.186 -0.845 2.204 1.00 0.00 C ATOM 1649 C ILE B 43 13.383 -1.708 1.247 1.00 0.00 C ATOM 1650 O ILE B 43 13.067 -1.286 0.142 1.00 0.00 O ATOM 1651 CB ILE B 43 13.326 0.332 2.707 1.00 0.00 C ATOM 1652 CG1 ILE B 43 13.859 0.835 4.044 1.00 0.00 C ATOM 1653 CG2 ILE B 43 11.860 -0.058 2.828 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.364 2.213 4.394 1.00 0.00 C ATOM 0 H ILE B 43 15.231 0.095 0.660 1.00 0.00 H new ATOM 0 HA ILE B 43 14.480 -1.461 3.054 1.00 0.00 H new ATOM 0 HB ILE B 43 13.391 1.135 1.973 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.566 0.139 4.830 1.00 0.00 H new ATOM 0 HG13 ILE B 43 14.949 0.843 4.015 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.285 0.796 3.185 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.484 -0.367 1.853 1.00 0.00 H new ATOM 0 HG23 ILE B 43 11.760 -0.883 3.533 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.778 2.515 5.356 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.679 2.919 3.626 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.276 2.204 4.454 1.00 0.00 H new ATOM 1666 N SER B 44 13.104 -2.932 1.662 1.00 0.00 N ATOM 1667 CA SER B 44 12.324 -3.862 0.863 1.00 0.00 C ATOM 1668 C SER B 44 11.172 -4.425 1.685 1.00 0.00 C ATOM 1669 O SER B 44 11.382 -4.974 2.766 1.00 0.00 O ATOM 1670 CB SER B 44 13.215 -4.990 0.343 1.00 0.00 C ATOM 1671 OG SER B 44 14.349 -4.464 -0.327 1.00 0.00 O ATOM 0 H SER B 44 13.411 -3.308 2.559 1.00 0.00 H new ATOM 0 HA SER B 44 11.909 -3.328 0.008 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.536 -5.619 1.173 1.00 0.00 H new ATOM 0 HB3 SER B 44 12.647 -5.625 -0.337 1.00 0.00 H new ATOM 0 HG SER B 44 14.908 -5.201 -0.651 1.00 0.00 H new ATOM 1677 N HIS B 45 9.961 -4.275 1.173 1.00 0.00 N ATOM 1678 CA HIS B 45 8.774 -4.767 1.837 1.00 0.00 C ATOM 1679 C HIS B 45 7.959 -5.529 0.824 1.00 0.00 C ATOM 1680 O HIS B 45 7.835 -5.113 -0.328 1.00 0.00 O ATOM 1681 CB HIS B 45 7.933 -3.628 2.423 1.00 0.00 C ATOM 1682 CG HIS B 45 8.617 -2.834 3.494 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.190 -3.382 4.621 1.00 0.00 N ATOM 1684 CD2 HIS B 45 8.804 -1.497 3.594 1.00 0.00 C ATOM 1685 CE1 HIS B 45 9.695 -2.380 5.354 1.00 0.00 C ATOM 1686 NE2 HIS B 45 9.487 -1.215 4.773 1.00 0.00 N ATOM 0 H HIS B 45 9.778 -3.808 0.285 1.00 0.00 H new ATOM 0 HA HIS B 45 9.072 -5.407 2.667 1.00 0.00 H new ATOM 0 HB2 HIS B 45 7.646 -2.954 1.616 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.013 -4.046 2.831 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.475 -0.764 2.872 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.205 -2.510 6.297 1.00 0.00 H new ATOM 0 HE2 HIS B 45 9.769 -0.297 5.117 1.00 0.00 H new ATOM 1694 N MET B 46 7.417 -6.639 1.238 1.00 0.00 N ATOM 1695 CA MET B 46 6.628 -7.464 0.359 1.00 0.00 C ATOM 1696 C MET B 46 5.156 -7.160 0.570 1.00 0.00 C ATOM 1697 O MET B 46 4.693 -7.116 1.703 1.00 0.00 O ATOM 1698 CB MET B 46 6.921 -8.929 0.653 1.00 0.00 C ATOM 1699 CG MET B 46 8.345 -9.355 0.327 1.00 0.00 C ATOM 1700 SD MET B 46 8.734 -9.247 -1.429 1.00 0.00 S ATOM 1701 CE MET B 46 7.647 -10.508 -2.093 1.00 0.00 C ATOM 0 H MET B 46 7.507 -6.999 2.188 1.00 0.00 H new ATOM 0 HA MET B 46 6.881 -7.255 -0.680 1.00 0.00 H new ATOM 0 HB2 MET B 46 6.728 -9.122 1.708 1.00 0.00 H new ATOM 0 HB3 MET B 46 6.228 -9.548 0.083 1.00 0.00 H new ATOM 0 HG2 MET B 46 9.041 -8.730 0.886 1.00 0.00 H new ATOM 0 HG3 MET B 46 8.497 -10.381 0.664 1.00 0.00 H new ATOM 0 HE1 MET B 46 7.940 -10.739 -3.117 1.00 0.00 H new ATOM 0 HE2 MET B 46 7.719 -11.409 -1.483 1.00 0.00 H new ATOM 0 HE3 MET B 46 6.619 -10.145 -2.083 1.00 0.00 H new ATOM 1711 N TYR B 47 4.414 -6.962 -0.514 1.00 0.00 N ATOM 1712 CA TYR B 47 2.980 -6.654 -0.413 1.00 0.00 C ATOM 1713 C TYR B 47 2.244 -7.780 0.314 1.00 0.00 C ATOM 1714 O TYR B 47 1.103 -7.630 0.744 1.00 0.00 O ATOM 1715 CB TYR B 47 2.352 -6.460 -1.798 1.00 0.00 C ATOM 1716 CG TYR B 47 2.843 -5.245 -2.552 1.00 0.00 C ATOM 1717 CD1 TYR B 47 4.196 -5.016 -2.731 1.00 0.00 C ATOM 1718 CD2 TYR B 47 1.946 -4.330 -3.090 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.648 -3.914 -3.420 1.00 0.00 C ATOM 1720 CE2 TYR B 47 2.393 -3.223 -3.784 1.00 0.00 C ATOM 1721 CZ TYR B 47 3.746 -3.022 -3.943 1.00 0.00 C ATOM 1722 OH TYR B 47 4.203 -1.927 -4.628 1.00 0.00 O ATOM 0 H TYR B 47 4.772 -7.007 -1.468 1.00 0.00 H new ATOM 0 HA TYR B 47 2.884 -5.725 0.150 1.00 0.00 H new ATOM 0 HB2 TYR B 47 2.550 -7.348 -2.399 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.270 -6.387 -1.684 1.00 0.00 H new ATOM 0 HD1 TYR B 47 4.910 -5.715 -2.322 1.00 0.00 H new ATOM 0 HD2 TYR B 47 0.885 -4.487 -2.964 1.00 0.00 H new ATOM 0 HE1 TYR B 47 5.708 -3.752 -3.549 1.00 0.00 H new ATOM 0 HE2 TYR B 47 1.686 -2.520 -4.199 1.00 0.00 H new ATOM 0 HH TYR B 47 5.056 -2.144 -5.059 1.00 0.00 H new ATOM 1732 N ALA B 48 2.924 -8.907 0.426 1.00 0.00 N ATOM 1733 CA ALA B 48 2.398 -10.086 1.084 1.00 0.00 C ATOM 1734 C ALA B 48 2.554 -10.011 2.602 1.00 0.00 C ATOM 1735 O ALA B 48 1.862 -10.723 3.331 1.00 0.00 O ATOM 1736 CB ALA B 48 3.098 -11.321 0.536 1.00 0.00 C ATOM 0 H ALA B 48 3.867 -9.029 0.058 1.00 0.00 H new ATOM 0 HA ALA B 48 1.329 -10.145 0.877 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.705 -12.211 1.029 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.922 -11.393 -0.537 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.169 -11.246 0.724 1.00 0.00 H new ATOM 1742 N ASP B 49 3.460 -9.156 3.076 1.00 0.00 N ATOM 1743 CA ASP B 49 3.694 -9.008 4.511 1.00 0.00 C ATOM 1744 C ASP B 49 3.155 -7.677 5.018 1.00 0.00 C ATOM 1745 O ASP B 49 2.983 -7.486 6.223 1.00 0.00 O ATOM 1746 CB ASP B 49 5.190 -9.162 4.849 1.00 0.00 C ATOM 1747 CG ASP B 49 5.985 -7.867 4.749 1.00 0.00 C ATOM 1748 OD1 ASP B 49 5.986 -7.091 5.726 1.00 0.00 O ATOM 1749 OD2 ASP B 49 6.631 -7.642 3.702 1.00 0.00 O ATOM 0 H ASP B 49 4.042 -8.558 2.489 1.00 0.00 H new ATOM 0 HA ASP B 49 3.153 -9.805 5.020 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.284 -9.557 5.861 1.00 0.00 H new ATOM 0 HB3 ASP B 49 5.630 -9.899 4.177 1.00 0.00 H new ATOM 1754 N ILE B 50 2.873 -6.763 4.102 1.00 0.00 N ATOM 1755 CA ILE B 50 2.336 -5.467 4.481 1.00 0.00 C ATOM 1756 C ILE B 50 0.870 -5.608 4.874 1.00 0.00 C ATOM 1757 O ILE B 50 0.054 -6.111 4.104 1.00 0.00 O ATOM 1758 CB ILE B 50 2.465 -4.419 3.359 1.00 0.00 C ATOM 1759 CG1 ILE B 50 3.849 -4.473 2.719 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.214 -3.031 3.921 1.00 0.00 C ATOM 1761 CD1 ILE B 50 3.972 -3.618 1.480 1.00 0.00 C ATOM 0 H ILE B 50 3.006 -6.894 3.099 1.00 0.00 H new ATOM 0 HA ILE B 50 2.925 -5.115 5.328 1.00 0.00 H new ATOM 0 HB ILE B 50 1.723 -4.643 2.593 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.591 -4.150 3.449 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.082 -5.506 2.463 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.306 -2.293 3.124 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.210 -2.985 4.343 1.00 0.00 H new ATOM 0 HG23 ILE B 50 2.945 -2.816 4.700 1.00 0.00 H new ATOM 0 HD11 ILE B 50 4.981 -3.704 1.077 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.253 -3.955 0.733 1.00 0.00 H new ATOM 0 HD13 ILE B 50 3.770 -2.577 1.734 1.00 0.00 H new ATOM 1773 N LYS B 51 0.551 -5.155 6.075 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.799 -5.236 6.603 1.00 0.00 C ATOM 1775 C LYS B 51 -1.682 -4.159 6.003 1.00 0.00 C ATOM 1776 O LYS B 51 -2.653 -4.442 5.307 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.773 -5.073 8.124 1.00 0.00 C ATOM 1778 CG LYS B 51 -2.151 -5.095 8.754 1.00 0.00 C ATOM 1779 CD LYS B 51 -2.252 -4.128 9.916 1.00 0.00 C ATOM 1780 CE LYS B 51 -3.663 -4.100 10.467 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.890 -2.933 11.362 1.00 0.00 N ATOM 0 H LYS B 51 1.221 -4.721 6.710 1.00 0.00 H new ATOM 0 HA LYS B 51 -1.207 -6.212 6.340 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -0.170 -5.871 8.558 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -0.282 -4.132 8.373 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.899 -4.840 8.003 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.377 -6.104 9.099 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.555 -4.421 10.701 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.963 -3.129 9.590 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.374 -4.067 9.641 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -3.856 -5.021 11.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.586 -3.186 12.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -2.994 -2.664 11.816 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -4.249 -2.132 10.804 1.00 0.00 H new ATOM 1795 N CYS B 52 -1.325 -2.921 6.286 1.00 0.00 N ATOM 1796 CA CYS B 52 -2.073 -1.775 5.808 1.00 0.00 C ATOM 1797 C CYS B 52 -1.115 -0.630 5.563 1.00 0.00 C ATOM 1798 O CYS B 52 0.100 -0.794 5.670 1.00 0.00 O ATOM 1799 CB CYS B 52 -3.143 -1.371 6.830 1.00 0.00 C ATOM 1800 SG CYS B 52 -4.453 -2.600 7.056 1.00 0.00 S ATOM 0 H CYS B 52 -0.511 -2.682 6.852 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.577 -2.031 4.876 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.662 -1.188 7.791 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.593 -0.430 6.515 1.00 0.00 H new ATOM 0 HG CYS B 52 -4.196 -3.647 6.329 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.645 0.521 5.229 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.810 1.671 4.977 1.00 0.00 C ATOM 1808 C GLN B 53 -1.248 2.824 5.866 1.00 0.00 C ATOM 1809 O GLN B 53 -2.217 2.706 6.601 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.889 2.075 3.506 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.839 0.900 2.540 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.958 0.945 1.521 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.846 1.616 0.500 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -3.049 0.233 1.786 1.00 0.00 N ATOM 0 H GLN B 53 -2.646 0.687 5.126 1.00 0.00 H new ATOM 0 HA GLN B 53 0.225 1.416 5.206 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.813 2.629 3.341 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.066 2.753 3.281 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.120 0.899 2.023 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.900 -0.032 3.102 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -3.105 -0.313 2.646 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.830 0.233 1.129 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.515 3.912 5.819 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.834 5.106 6.583 1.00 0.00 C ATOM 1825 C LYS B 54 -0.455 6.309 5.738 1.00 0.00 C ATOM 1826 O LYS B 54 0.610 6.319 5.128 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.078 5.134 7.913 1.00 0.00 C ATOM 1828 CG LYS B 54 -0.566 4.131 8.946 1.00 0.00 C ATOM 1829 CD LYS B 54 -1.548 4.768 9.912 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.403 4.217 11.323 1.00 0.00 C ATOM 1831 NZ LYS B 54 -0.233 4.802 12.043 1.00 0.00 N ATOM 0 H LYS B 54 0.325 3.999 5.248 1.00 0.00 H new ATOM 0 HA LYS B 54 -1.898 5.118 6.819 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.978 4.949 7.718 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.153 6.136 8.336 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -1.042 3.289 8.442 1.00 0.00 H new ATOM 0 HG3 LYS B 54 0.284 3.732 9.499 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -1.393 5.847 9.927 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -2.565 4.597 9.559 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -2.313 4.423 11.886 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -1.294 3.133 11.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -0.145 4.359 12.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.634 4.628 11.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -0.372 5.827 12.156 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.310 7.313 5.680 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.029 8.483 4.851 1.00 0.00 C ATOM 1847 C ILE B 55 -1.350 9.785 5.542 1.00 0.00 C ATOM 1848 O ILE B 55 -2.078 9.801 6.522 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.861 8.446 3.567 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.355 8.476 3.897 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.519 7.217 2.769 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.238 8.541 2.678 1.00 0.00 C ATOM 0 H ILE B 55 -2.194 7.348 6.187 1.00 0.00 H new ATOM 0 HA ILE B 55 0.040 8.440 4.641 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.627 9.327 2.969 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.610 7.587 4.473 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.562 9.337 4.532 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.115 7.198 1.857 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.460 7.234 2.510 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.733 6.327 3.361 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.283 8.559 2.986 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.011 9.444 2.112 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -4.060 7.666 2.052 1.00 0.00 H new ATOM 1864 N SER B 56 -0.803 10.865 5.003 1.00 0.00 N ATOM 1865 CA SER B 56 -1.057 12.201 5.506 1.00 0.00 C ATOM 1866 C SER B 56 -2.274 12.771 4.775 1.00 0.00 C ATOM 1867 O SER B 56 -2.164 13.266 3.654 1.00 0.00 O ATOM 1868 CB SER B 56 0.169 13.077 5.274 1.00 0.00 C ATOM 1869 OG SER B 56 1.172 12.377 4.553 1.00 0.00 O ATOM 0 H SER B 56 -0.170 10.836 4.204 1.00 0.00 H new ATOM 0 HA SER B 56 -1.258 12.173 6.577 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.120 13.973 4.724 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.570 13.407 6.232 1.00 0.00 H new ATOM 0 HG SER B 56 1.994 12.343 5.086 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.449 12.697 5.397 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.709 13.135 4.808 1.00 0.00 C ATOM 1877 C PRO B 57 -4.973 14.626 4.984 1.00 0.00 C ATOM 1878 O PRO B 57 -4.082 15.382 5.384 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.747 12.312 5.581 1.00 0.00 C ATOM 1880 CG PRO B 57 -4.956 11.465 6.522 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.677 12.192 6.739 1.00 0.00 C ATOM 0 HA PRO B 57 -4.724 12.986 3.728 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.439 12.959 6.121 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.344 11.698 4.906 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.489 11.321 7.462 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -4.777 10.475 6.102 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.770 12.990 7.475 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -2.876 11.536 7.080 1.00 0.00 H new ATOM 1889 N GLU B 58 -6.208 15.025 4.673 1.00 0.00 N ATOM 1890 CA GLU B 58 -6.657 16.409 4.789 1.00 0.00 C ATOM 1891 C GLU B 58 -5.661 17.383 4.152 1.00 0.00 C ATOM 1892 O GLU B 58 -5.337 17.272 2.967 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.899 16.760 6.264 1.00 0.00 C ATOM 1894 CG GLU B 58 -7.966 17.824 6.471 1.00 0.00 C ATOM 1895 CD GLU B 58 -9.196 17.585 5.618 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -9.961 16.647 5.925 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -9.387 18.329 4.634 1.00 0.00 O ATOM 0 H GLU B 58 -6.929 14.389 4.331 1.00 0.00 H new ATOM 0 HA GLU B 58 -7.595 16.507 4.243 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -7.190 15.857 6.800 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.964 17.105 6.705 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -8.255 17.845 7.522 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -7.549 18.803 6.235 1.00 0.00 H new ATOM 1904 N GLY B 59 -5.164 18.316 4.949 1.00 0.00 N ATOM 1905 CA GLY B 59 -4.224 19.298 4.457 1.00 0.00 C ATOM 1906 C GLY B 59 -2.874 19.175 5.127 1.00 0.00 C ATOM 1907 O GLY B 59 -2.332 20.154 5.643 1.00 0.00 O ATOM 0 H GLY B 59 -5.398 18.410 5.937 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -4.106 19.179 3.380 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -4.623 20.298 4.626 1.00 0.00 H new ATOM 1911 N LYS B 60 -2.342 17.964 5.139 1.00 0.00 N ATOM 1912 CA LYS B 60 -1.048 17.705 5.745 1.00 0.00 C ATOM 1913 C LYS B 60 0.070 18.313 4.905 1.00 0.00 C ATOM 1914 O LYS B 60 0.206 18.006 3.721 1.00 0.00 O ATOM 1915 CB LYS B 60 -0.830 16.203 5.901 1.00 0.00 C ATOM 1916 CG LYS B 60 0.056 15.842 7.077 1.00 0.00 C ATOM 1917 CD LYS B 60 -0.756 15.642 8.342 1.00 0.00 C ATOM 1918 CE LYS B 60 0.078 15.918 9.573 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.722 16.483 10.696 1.00 0.00 N ATOM 0 H LYS B 60 -2.789 17.142 4.734 1.00 0.00 H new ATOM 0 HA LYS B 60 -1.031 18.169 6.731 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -1.797 15.714 6.020 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -0.385 15.811 4.986 1.00 0.00 H new ATOM 0 HG2 LYS B 60 0.610 14.931 6.851 1.00 0.00 H new ATOM 0 HG3 LYS B 60 0.791 16.631 7.236 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -1.622 16.303 8.330 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -1.135 14.621 8.377 1.00 0.00 H new ATOM 0 HE2 LYS B 60 0.552 14.993 9.900 1.00 0.00 H new ATOM 0 HE3 LYS B 60 0.878 16.613 9.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -0.341 16.139 11.601 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.671 17.521 10.671 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -1.713 16.183 10.601 1.00 0.00 H new ATOM 1933 N ALA B 61 0.861 19.179 5.532 1.00 0.00 N ATOM 1934 CA ALA B 61 1.967 19.852 4.860 1.00 0.00 C ATOM 1935 C ALA B 61 3.029 18.869 4.390 1.00 0.00 C ATOM 1936 O ALA B 61 3.440 18.904 3.235 1.00 0.00 O ATOM 1937 CB ALA B 61 2.586 20.886 5.778 1.00 0.00 C ATOM 0 H ALA B 61 0.754 19.433 6.514 1.00 0.00 H new ATOM 0 HA ALA B 61 1.561 20.347 3.978 1.00 0.00 H new ATOM 0 HB1 ALA B 61 3.410 21.381 5.265 1.00 0.00 H new ATOM 0 HB2 ALA B 61 1.834 21.625 6.053 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.960 20.397 6.677 1.00 0.00 H new ATOM 1943 N LYS B 62 3.496 18.011 5.290 1.00 0.00 N ATOM 1944 CA LYS B 62 4.497 17.028 4.920 1.00 0.00 C ATOM 1945 C LYS B 62 3.805 15.843 4.260 1.00 0.00 C ATOM 1946 O LYS B 62 2.763 15.383 4.728 1.00 0.00 O ATOM 1947 CB LYS B 62 5.346 16.594 6.133 1.00 0.00 C ATOM 1948 CG LYS B 62 4.572 15.922 7.262 1.00 0.00 C ATOM 1949 CD LYS B 62 5.458 15.706 8.488 1.00 0.00 C ATOM 1950 CE LYS B 62 4.888 14.639 9.413 1.00 0.00 C ATOM 1951 NZ LYS B 62 5.256 14.854 10.843 1.00 0.00 N ATOM 0 H LYS B 62 3.201 17.978 6.266 1.00 0.00 H new ATOM 0 HA LYS B 62 5.192 17.475 4.209 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.120 15.909 5.787 1.00 0.00 H new ATOM 0 HB3 LYS B 62 5.853 17.472 6.534 1.00 0.00 H new ATOM 0 HG2 LYS B 62 3.714 16.537 7.534 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.182 14.964 6.919 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.458 15.414 8.168 1.00 0.00 H new ATOM 0 HD3 LYS B 62 5.560 16.644 9.034 1.00 0.00 H new ATOM 0 HE2 LYS B 62 3.802 14.627 9.320 1.00 0.00 H new ATOM 0 HE3 LYS B 62 5.246 13.660 9.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 5.148 13.962 11.367 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 6.244 15.173 10.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 4.633 15.577 11.257 1.00 0.00 H new ATOM 1965 N ILE B 63 4.361 15.384 3.153 1.00 0.00 N ATOM 1966 CA ILE B 63 3.786 14.277 2.417 1.00 0.00 C ATOM 1967 C ILE B 63 4.538 13.002 2.743 1.00 0.00 C ATOM 1968 O ILE B 63 5.720 12.892 2.448 1.00 0.00 O ATOM 1969 CB ILE B 63 3.846 14.531 0.904 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.940 15.705 0.534 1.00 0.00 C ATOM 1971 CG2 ILE B 63 3.429 13.282 0.142 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.532 17.071 0.795 1.00 0.00 C ATOM 0 H ILE B 63 5.214 15.764 2.744 1.00 0.00 H new ATOM 0 HA ILE B 63 2.741 14.178 2.711 1.00 0.00 H new ATOM 0 HB ILE B 63 4.872 14.778 0.630 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.687 15.631 -0.524 1.00 0.00 H new ATOM 0 HG13 ILE B 63 2.008 15.616 1.092 1.00 0.00 H new ATOM 0 HG21 ILE B 63 3.476 13.477 -0.929 1.00 0.00 H new ATOM 0 HG22 ILE B 63 4.102 12.462 0.392 1.00 0.00 H new ATOM 0 HG23 ILE B 63 2.410 13.011 0.417 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.817 17.840 0.502 1.00 0.00 H new ATOM 0 HD12 ILE B 63 3.759 17.173 1.856 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.448 17.187 0.216 1.00 0.00 H new ATOM 1984 N GLN B 64 3.874 12.042 3.360 1.00 0.00 N ATOM 1985 CA GLN B 64 4.539 10.803 3.709 1.00 0.00 C ATOM 1986 C GLN B 64 3.562 9.631 3.768 1.00 0.00 C ATOM 1987 O GLN B 64 2.349 9.815 3.858 1.00 0.00 O ATOM 1988 CB GLN B 64 5.304 10.962 5.030 1.00 0.00 C ATOM 1989 CG GLN B 64 4.454 10.806 6.274 1.00 0.00 C ATOM 1990 CD GLN B 64 3.757 12.081 6.707 1.00 0.00 C ATOM 1991 OE1 GLN B 64 3.375 12.910 5.893 1.00 0.00 O ATOM 1992 NE2 GLN B 64 3.596 12.251 8.005 1.00 0.00 N ATOM 0 H GLN B 64 2.891 12.095 3.626 1.00 0.00 H new ATOM 0 HA GLN B 64 5.257 10.574 2.921 1.00 0.00 H new ATOM 0 HB2 GLN B 64 6.107 10.226 5.060 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.773 11.946 5.047 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.703 10.036 6.095 1.00 0.00 H new ATOM 0 HG3 GLN B 64 5.084 10.453 7.090 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.926 11.540 8.657 1.00 0.00 H new ATOM 0 HE22 GLN B 64 3.141 13.094 8.356 1.00 0.00 H new ATOM 2001 N LEU B 65 4.114 8.430 3.702 1.00 0.00 N ATOM 2002 CA LEU B 65 3.337 7.201 3.715 1.00 0.00 C ATOM 2003 C LEU B 65 3.939 6.202 4.698 1.00 0.00 C ATOM 2004 O LEU B 65 5.099 5.833 4.564 1.00 0.00 O ATOM 2005 CB LEU B 65 3.367 6.577 2.325 1.00 0.00 C ATOM 2006 CG LEU B 65 2.364 5.452 2.082 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.059 5.989 1.507 1.00 0.00 C ATOM 2008 CD2 LEU B 65 2.979 4.401 1.182 1.00 0.00 C ATOM 0 H LEU B 65 5.121 8.280 3.637 1.00 0.00 H new ATOM 0 HA LEU B 65 2.315 7.437 4.013 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.189 7.362 1.590 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.370 6.191 2.142 1.00 0.00 H new ATOM 0 HG LEU B 65 2.121 4.987 3.038 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.366 5.164 1.345 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.619 6.701 2.206 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.257 6.487 0.558 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.259 3.601 1.012 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.251 4.853 0.228 1.00 0.00 H new ATOM 0 HD23 LEU B 65 3.871 3.992 1.657 1.00 0.00 H new ATOM 2020 N GLN B 66 3.158 5.754 5.664 1.00 0.00 N ATOM 2021 CA GLN B 66 3.647 4.790 6.639 1.00 0.00 C ATOM 2022 C GLN B 66 3.185 3.381 6.287 1.00 0.00 C ATOM 2023 O GLN B 66 2.001 3.068 6.358 1.00 0.00 O ATOM 2024 CB GLN B 66 3.189 5.156 8.041 1.00 0.00 C ATOM 2025 CG GLN B 66 3.638 4.171 9.109 1.00 0.00 C ATOM 2026 CD GLN B 66 3.045 4.482 10.463 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.980 3.980 10.812 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.729 5.306 11.235 1.00 0.00 N ATOM 0 H GLN B 66 2.188 6.039 5.796 1.00 0.00 H new ATOM 0 HA GLN B 66 4.736 4.815 6.614 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.569 6.147 8.290 1.00 0.00 H new ATOM 0 HB3 GLN B 66 2.101 5.220 8.053 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.351 3.162 8.813 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.726 4.186 9.179 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.610 5.701 10.905 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.377 5.548 12.161 1.00 0.00 H new ATOM 2037 N LEU B 67 4.122 2.544 5.886 1.00 0.00 N ATOM 2038 CA LEU B 67 3.821 1.166 5.537 1.00 0.00 C ATOM 2039 C LEU B 67 3.700 0.322 6.791 1.00 0.00 C ATOM 2040 O LEU B 67 4.699 0.021 7.437 1.00 0.00 O ATOM 2041 CB LEU B 67 4.917 0.583 4.648 1.00 0.00 C ATOM 2042 CG LEU B 67 4.821 0.940 3.169 1.00 0.00 C ATOM 2043 CD1 LEU B 67 5.948 0.271 2.406 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.470 0.522 2.607 1.00 0.00 C ATOM 0 H LEU B 67 5.106 2.795 5.793 1.00 0.00 H new ATOM 0 HA LEU B 67 2.876 1.155 4.995 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.883 0.920 5.023 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.899 -0.503 4.744 1.00 0.00 H new ATOM 0 HG LEU B 67 4.914 2.020 3.058 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.875 0.529 1.349 1.00 0.00 H new ATOM 0 HD12 LEU B 67 6.906 0.613 2.798 1.00 0.00 H new ATOM 0 HD13 LEU B 67 5.874 -0.810 2.521 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.419 0.784 1.550 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.346 -0.555 2.720 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.676 1.037 3.148 1.00 0.00 H new ATOM 2056 N VAL B 68 2.483 -0.046 7.139 1.00 0.00 N ATOM 2057 CA VAL B 68 2.254 -0.860 8.316 1.00 0.00 C ATOM 2058 C VAL B 68 2.250 -2.327 7.934 1.00 0.00 C ATOM 2059 O VAL B 68 1.304 -2.817 7.325 1.00 0.00 O ATOM 2060 CB VAL B 68 0.930 -0.507 9.008 1.00 0.00 C ATOM 2061 CG1 VAL B 68 0.831 -1.230 10.335 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.816 0.994 9.206 1.00 0.00 C ATOM 0 H VAL B 68 1.639 0.205 6.625 1.00 0.00 H new ATOM 0 HA VAL B 68 3.063 -0.658 9.018 1.00 0.00 H new ATOM 0 HB VAL B 68 0.105 -0.828 8.373 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.111 -0.974 10.819 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.872 -2.306 10.167 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.661 -0.931 10.975 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.129 1.225 9.698 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.642 1.343 9.825 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.852 1.493 8.237 1.00 0.00 H new ATOM 2072 N LEU B 69 3.310 -3.025 8.289 1.00 0.00 N ATOM 2073 CA LEU B 69 3.435 -4.429 7.951 1.00 0.00 C ATOM 2074 C LEU B 69 2.870 -5.315 9.056 1.00 0.00 C ATOM 2075 O LEU B 69 2.783 -4.893 10.211 1.00 0.00 O ATOM 2076 CB LEU B 69 4.897 -4.770 7.712 1.00 0.00 C ATOM 2077 CG LEU B 69 5.750 -3.615 7.185 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.211 -3.980 7.233 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.354 -3.233 5.775 1.00 0.00 C ATOM 0 H LEU B 69 4.098 -2.643 8.812 1.00 0.00 H new ATOM 0 HA LEU B 69 2.862 -4.614 7.042 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.330 -5.125 8.647 1.00 0.00 H new ATOM 0 HB3 LEU B 69 4.951 -5.596 7.002 1.00 0.00 H new ATOM 0 HG LEU B 69 5.576 -2.752 7.828 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.806 -3.149 6.855 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.499 -4.194 8.262 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.386 -4.862 6.616 1.00 0.00 H new ATOM 0 HD21 LEU B 69 5.980 -2.409 5.432 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.488 -4.090 5.115 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.309 -2.924 5.762 1.00 0.00 H new ATOM 2091 N HIS B 70 2.503 -6.544 8.699 1.00 0.00 N ATOM 2092 CA HIS B 70 1.950 -7.500 9.663 1.00 0.00 C ATOM 2093 C HIS B 70 3.014 -7.902 10.675 1.00 0.00 C ATOM 2094 O HIS B 70 2.709 -8.286 11.800 1.00 0.00 O ATOM 2095 CB HIS B 70 1.443 -8.770 8.961 1.00 0.00 C ATOM 2096 CG HIS B 70 0.190 -8.593 8.162 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -1.043 -8.313 8.708 1.00 0.00 N ATOM 2098 CD2 HIS B 70 -0.006 -8.675 6.821 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -1.930 -8.236 7.711 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -1.352 -8.447 6.543 1.00 0.00 N ATOM 0 H HIS B 70 2.578 -6.904 7.748 1.00 0.00 H new ATOM 0 HA HIS B 70 1.116 -7.010 10.165 1.00 0.00 H new ATOM 0 HB2 HIS B 70 2.228 -9.140 8.301 1.00 0.00 H new ATOM 0 HB3 HIS B 70 1.270 -9.539 9.714 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -1.244 -8.186 9.700 1.00 0.00 H new ATOM 0 HD2 HIS B 70 0.759 -8.884 6.088 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.982 -8.028 7.844 1.00 0.00 H new ATOM 2108 N ALA B 71 4.270 -7.803 10.254 1.00 0.00 N ATOM 2109 CA ALA B 71 5.403 -8.169 11.093 1.00 0.00 C ATOM 2110 C ALA B 71 5.498 -7.306 12.348 1.00 0.00 C ATOM 2111 O ALA B 71 6.027 -7.746 13.367 1.00 0.00 O ATOM 2112 CB ALA B 71 6.694 -8.076 10.293 1.00 0.00 C ATOM 0 H ALA B 71 4.530 -7.468 9.326 1.00 0.00 H new ATOM 0 HA ALA B 71 5.247 -9.197 11.420 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.536 -8.351 10.928 1.00 0.00 H new ATOM 0 HB2 ALA B 71 6.644 -8.755 9.442 1.00 0.00 H new ATOM 0 HB3 ALA B 71 6.828 -7.055 9.935 1.00 0.00 H new ATOM 2118 N GLY B 72 4.993 -6.081 12.276 1.00 0.00 N ATOM 2119 CA GLY B 72 5.064 -5.201 13.419 1.00 0.00 C ATOM 2120 C GLY B 72 6.083 -4.128 13.167 1.00 0.00 C ATOM 2121 O GLY B 72 6.728 -3.620 14.082 1.00 0.00 O ATOM 0 H GLY B 72 4.540 -5.686 11.452 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.088 -4.753 13.607 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.331 -5.768 14.311 1.00 0.00 H new ATOM 2125 N ASP B 73 6.205 -3.789 11.899 1.00 0.00 N ATOM 2126 CA ASP B 73 7.135 -2.796 11.440 1.00 0.00 C ATOM 2127 C ASP B 73 6.362 -1.823 10.605 1.00 0.00 C ATOM 2128 O ASP B 73 5.498 -2.220 9.822 1.00 0.00 O ATOM 2129 CB ASP B 73 8.246 -3.420 10.591 1.00 0.00 C ATOM 2130 CG ASP B 73 9.277 -2.395 10.145 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.057 -1.742 9.101 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.299 -2.243 10.840 1.00 0.00 O ATOM 0 H ASP B 73 5.649 -4.207 11.153 1.00 0.00 H new ATOM 0 HA ASP B 73 7.608 -2.312 12.294 1.00 0.00 H new ATOM 0 HB2 ASP B 73 8.741 -4.204 11.164 1.00 0.00 H new ATOM 0 HB3 ASP B 73 7.806 -3.895 9.714 1.00 0.00 H new ATOM 2137 N THR B 74 6.613 -0.565 10.801 1.00 0.00 N ATOM 2138 CA THR B 74 5.930 0.435 10.039 1.00 0.00 C ATOM 2139 C THR B 74 6.952 1.458 9.531 1.00 0.00 C ATOM 2140 O THR B 74 7.622 2.113 10.331 1.00 0.00 O ATOM 2141 CB THR B 74 4.857 1.127 10.895 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.447 1.676 12.079 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.754 0.155 11.280 1.00 0.00 C ATOM 0 H THR B 74 7.284 -0.207 11.480 1.00 0.00 H new ATOM 0 HA THR B 74 5.431 -0.034 9.191 1.00 0.00 H new ATOM 0 HB THR B 74 4.420 1.930 10.301 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.364 1.963 11.885 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.009 0.671 11.885 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.282 -0.236 10.378 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.179 -0.669 11.853 1.00 0.00 H new ATOM 2151 N THR B 75 7.071 1.598 8.220 1.00 0.00 N ATOM 2152 CA THR B 75 8.041 2.523 7.639 1.00 0.00 C ATOM 2153 C THR B 75 7.361 3.718 6.968 1.00 0.00 C ATOM 2154 O THR B 75 6.530 3.547 6.079 1.00 0.00 O ATOM 2155 CB THR B 75 8.939 1.783 6.620 1.00 0.00 C ATOM 2156 OG1 THR B 75 9.939 1.026 7.315 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.611 2.752 5.655 1.00 0.00 C ATOM 0 H THR B 75 6.512 1.087 7.537 1.00 0.00 H new ATOM 0 HA THR B 75 8.655 2.908 8.453 1.00 0.00 H new ATOM 0 HB THR B 75 8.303 1.115 6.039 1.00 0.00 H new ATOM 0 HG1 THR B 75 10.598 0.688 6.673 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.233 2.195 4.955 1.00 0.00 H new ATOM 0 HG22 THR B 75 8.849 3.304 5.104 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.232 3.451 6.215 1.00 0.00 H new ATOM 2165 N ASN B 76 7.720 4.929 7.390 1.00 0.00 N ATOM 2166 CA ASN B 76 7.134 6.139 6.816 1.00 0.00 C ATOM 2167 C ASN B 76 8.059 6.720 5.744 1.00 0.00 C ATOM 2168 O ASN B 76 9.228 6.999 6.003 1.00 0.00 O ATOM 2169 CB ASN B 76 6.855 7.230 7.876 1.00 0.00 C ATOM 2170 CG ASN B 76 6.251 6.740 9.185 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.344 5.570 9.554 1.00 0.00 O ATOM 2172 ND2 ASN B 76 5.637 7.661 9.907 1.00 0.00 N ATOM 0 H ASN B 76 8.409 5.098 8.123 1.00 0.00 H new ATOM 0 HA ASN B 76 6.181 5.842 6.379 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.791 7.742 8.098 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.182 7.969 7.441 1.00 0.00 H new ATOM 0 HD21 ASN B 76 5.220 7.412 10.804 1.00 0.00 H new ATOM 0 HD22 ASN B 76 5.580 8.621 9.567 1.00 0.00 H new ATOM 2179 N PHE B 77 7.534 6.870 4.535 1.00 0.00 N ATOM 2180 CA PHE B 77 8.286 7.438 3.419 1.00 0.00 C ATOM 2181 C PHE B 77 7.877 8.892 3.214 1.00 0.00 C ATOM 2182 O PHE B 77 6.718 9.165 2.925 1.00 0.00 O ATOM 2183 CB PHE B 77 8.025 6.648 2.136 1.00 0.00 C ATOM 2184 CG PHE B 77 8.683 5.300 2.105 1.00 0.00 C ATOM 2185 CD1 PHE B 77 10.056 5.186 2.230 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.930 4.149 1.941 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.667 3.950 2.192 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.537 2.909 1.902 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.907 2.811 2.027 1.00 0.00 C ATOM 0 H PHE B 77 6.578 6.603 4.299 1.00 0.00 H new ATOM 0 HA PHE B 77 9.349 7.384 3.653 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.950 6.519 2.013 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.375 7.232 1.285 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.656 6.075 2.359 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.857 4.222 1.843 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.740 3.874 2.291 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.940 2.018 1.774 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.384 1.843 1.996 1.00 0.00 H new ATOM 2199 N HIS B 78 8.823 9.809 3.336 1.00 0.00 N ATOM 2200 CA HIS B 78 8.543 11.238 3.196 1.00 0.00 C ATOM 2201 C HIS B 78 8.766 11.709 1.757 1.00 0.00 C ATOM 2202 O HIS B 78 9.897 11.892 1.314 1.00 0.00 O ATOM 2203 CB HIS B 78 9.428 12.032 4.164 1.00 0.00 C ATOM 2204 CG HIS B 78 9.123 13.501 4.226 1.00 0.00 C ATOM 2205 ND1 HIS B 78 10.090 14.480 4.203 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.936 14.154 4.327 1.00 0.00 C ATOM 2207 CE1 HIS B 78 9.480 15.667 4.289 1.00 0.00 C ATOM 2208 NE2 HIS B 78 8.172 15.526 4.366 1.00 0.00 N ATOM 0 H HIS B 78 9.800 9.592 3.533 1.00 0.00 H new ATOM 0 HA HIS B 78 7.495 11.411 3.440 1.00 0.00 H new ATOM 0 HB2 HIS B 78 9.321 11.609 5.163 1.00 0.00 H new ATOM 0 HB3 HIS B 78 10.470 11.902 3.873 1.00 0.00 H new ATOM 0 HD1 HIS B 78 11.096 14.327 4.133 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.964 13.684 4.370 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.993 16.618 4.295 1.00 0.00 H new ATOM 2216 N PHE B 79 7.675 11.907 1.036 1.00 0.00 N ATOM 2217 CA PHE B 79 7.729 12.366 -0.344 1.00 0.00 C ATOM 2218 C PHE B 79 7.865 13.884 -0.362 1.00 0.00 C ATOM 2219 O PHE B 79 6.892 14.607 -0.170 1.00 0.00 O ATOM 2220 CB PHE B 79 6.469 11.950 -1.106 1.00 0.00 C ATOM 2221 CG PHE B 79 6.191 10.473 -1.085 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.662 9.866 0.042 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.447 9.694 -2.199 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.396 8.511 0.057 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.181 8.339 -2.191 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.655 7.747 -1.061 1.00 0.00 C ATOM 0 H PHE B 79 6.730 11.755 1.388 1.00 0.00 H new ATOM 0 HA PHE B 79 8.590 11.910 -0.833 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.613 12.475 -0.682 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.561 12.275 -2.142 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.455 10.460 0.920 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.860 10.151 -3.086 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.986 8.050 0.943 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.384 7.743 -3.068 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.447 6.687 -1.052 1.00 0.00 H new ATOM 2236 N SER B 80 9.076 14.357 -0.578 1.00 0.00 N ATOM 2237 CA SER B 80 9.350 15.785 -0.591 1.00 0.00 C ATOM 2238 C SER B 80 9.468 16.360 -2.006 1.00 0.00 C ATOM 2239 O SER B 80 10.274 17.260 -2.245 1.00 0.00 O ATOM 2240 CB SER B 80 10.635 16.056 0.187 1.00 0.00 C ATOM 2241 OG SER B 80 10.718 15.218 1.326 1.00 0.00 O ATOM 0 H SER B 80 9.893 13.771 -0.748 1.00 0.00 H new ATOM 0 HA SER B 80 8.502 16.283 -0.121 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.498 15.888 -0.457 1.00 0.00 H new ATOM 0 HB3 SER B 80 10.666 17.101 0.495 1.00 0.00 H new ATOM 0 HG SER B 80 11.078 15.728 2.082 1.00 0.00 H new ATOM 2247 N ASN B 81 8.683 15.852 -2.949 1.00 0.00 N ATOM 2248 CA ASN B 81 8.714 16.382 -4.296 1.00 0.00 C ATOM 2249 C ASN B 81 7.805 17.603 -4.331 1.00 0.00 C ATOM 2250 O ASN B 81 6.599 17.465 -4.399 1.00 0.00 O ATOM 2251 CB ASN B 81 8.236 15.326 -5.299 1.00 0.00 C ATOM 2252 CG ASN B 81 8.953 15.417 -6.630 1.00 0.00 C ATOM 2253 OD1 ASN B 81 9.517 16.452 -6.976 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.930 14.335 -7.390 1.00 0.00 N ATOM 0 H ASN B 81 8.027 15.084 -2.804 1.00 0.00 H new ATOM 0 HA ASN B 81 9.731 16.659 -4.573 1.00 0.00 H new ATOM 0 HB2 ASN B 81 8.389 14.333 -4.876 1.00 0.00 H new ATOM 0 HB3 ASN B 81 7.164 15.442 -5.460 1.00 0.00 H new ATOM 0 HD21 ASN B 81 9.392 14.341 -8.300 1.00 0.00 H new ATOM 0 HD22 ASN B 81 8.451 13.495 -7.067 1.00 0.00 H new ATOM 2261 N GLU B 82 8.377 18.794 -4.254 1.00 0.00 N ATOM 2262 CA GLU B 82 7.584 20.031 -4.235 1.00 0.00 C ATOM 2263 C GLU B 82 6.519 20.072 -5.342 1.00 0.00 C ATOM 2264 O GLU B 82 5.500 20.750 -5.207 1.00 0.00 O ATOM 2265 CB GLU B 82 8.499 21.263 -4.330 1.00 0.00 C ATOM 2266 CG GLU B 82 9.120 21.491 -5.705 1.00 0.00 C ATOM 2267 CD GLU B 82 10.000 20.341 -6.149 1.00 0.00 C ATOM 2268 OE1 GLU B 82 11.042 20.100 -5.508 1.00 0.00 O ATOM 2269 OE2 GLU B 82 9.637 19.649 -7.123 1.00 0.00 O ATOM 0 H GLU B 82 9.385 18.939 -4.203 1.00 0.00 H new ATOM 0 HA GLU B 82 7.055 20.048 -3.282 1.00 0.00 H new ATOM 0 HB2 GLU B 82 7.925 22.147 -4.055 1.00 0.00 H new ATOM 0 HB3 GLU B 82 9.299 21.162 -3.597 1.00 0.00 H new ATOM 0 HG2 GLU B 82 8.326 21.639 -6.437 1.00 0.00 H new ATOM 0 HG3 GLU B 82 9.710 22.407 -5.685 1.00 0.00 H new ATOM 2276 N SER B 83 6.743 19.332 -6.416 1.00 0.00 N ATOM 2277 CA SER B 83 5.809 19.300 -7.522 1.00 0.00 C ATOM 2278 C SER B 83 4.786 18.157 -7.406 1.00 0.00 C ATOM 2279 O SER B 83 3.597 18.353 -7.686 1.00 0.00 O ATOM 2280 CB SER B 83 6.590 19.180 -8.830 1.00 0.00 C ATOM 2281 OG SER B 83 7.796 18.460 -8.631 1.00 0.00 O ATOM 0 H SER B 83 7.567 18.745 -6.542 1.00 0.00 H new ATOM 0 HA SER B 83 5.239 20.229 -7.503 1.00 0.00 H new ATOM 0 HB2 SER B 83 5.979 18.676 -9.579 1.00 0.00 H new ATOM 0 HB3 SER B 83 6.814 20.174 -9.218 1.00 0.00 H new ATOM 0 HG SER B 83 8.504 19.078 -8.355 1.00 0.00 H new ATOM 2287 N THR B 84 5.224 16.967 -6.993 1.00 0.00 N ATOM 2288 CA THR B 84 4.317 15.818 -6.915 1.00 0.00 C ATOM 2289 C THR B 84 4.304 15.100 -5.572 1.00 0.00 C ATOM 2290 O THR B 84 3.835 13.971 -5.509 1.00 0.00 O ATOM 2291 CB THR B 84 4.699 14.777 -7.964 1.00 0.00 C ATOM 2292 OG1 THR B 84 6.095 14.487 -7.862 1.00 0.00 O ATOM 2293 CG2 THR B 84 4.409 15.288 -9.349 1.00 0.00 C ATOM 0 H THR B 84 6.185 16.773 -6.711 1.00 0.00 H new ATOM 0 HA THR B 84 3.327 16.243 -7.078 1.00 0.00 H new ATOM 0 HB THR B 84 4.112 13.876 -7.786 1.00 0.00 H new ATOM 0 HG1 THR B 84 6.231 13.755 -7.224 1.00 0.00 H new ATOM 0 HG21 THR B 84 4.688 14.531 -10.082 1.00 0.00 H new ATOM 0 HG22 THR B 84 3.345 15.507 -9.441 1.00 0.00 H new ATOM 0 HG23 THR B 84 4.983 16.197 -9.529 1.00 0.00 H new ATOM 2301 N ALA B 85 4.786 15.743 -4.524 1.00 0.00 N ATOM 2302 CA ALA B 85 4.857 15.136 -3.194 1.00 0.00 C ATOM 2303 C ALA B 85 3.597 14.349 -2.852 1.00 0.00 C ATOM 2304 O ALA B 85 3.606 13.116 -2.843 1.00 0.00 O ATOM 2305 CB ALA B 85 5.107 16.219 -2.156 1.00 0.00 C ATOM 0 H ALA B 85 5.140 16.699 -4.564 1.00 0.00 H new ATOM 0 HA ALA B 85 5.684 14.426 -3.192 1.00 0.00 H new ATOM 0 HB1 ALA B 85 5.160 15.768 -1.165 1.00 0.00 H new ATOM 0 HB2 ALA B 85 6.048 16.723 -2.376 1.00 0.00 H new ATOM 0 HB3 ALA B 85 4.292 16.943 -2.182 1.00 0.00 H new ATOM 2311 N VAL B 86 2.519 15.070 -2.589 1.00 0.00 N ATOM 2312 CA VAL B 86 1.231 14.467 -2.256 1.00 0.00 C ATOM 2313 C VAL B 86 0.787 13.414 -3.275 1.00 0.00 C ATOM 2314 O VAL B 86 0.472 12.287 -2.905 1.00 0.00 O ATOM 2315 CB VAL B 86 0.158 15.571 -2.118 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.211 15.083 -2.565 1.00 0.00 C ATOM 2317 CG2 VAL B 86 0.065 16.064 -0.686 1.00 0.00 C ATOM 0 H VAL B 86 2.508 16.090 -2.599 1.00 0.00 H new ATOM 0 HA VAL B 86 1.352 13.948 -1.305 1.00 0.00 H new ATOM 0 HB VAL B 86 0.467 16.392 -2.766 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -1.938 15.887 -2.453 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.165 14.778 -3.610 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -1.512 14.233 -1.952 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -0.697 16.840 -0.617 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.202 15.234 -0.032 1.00 0.00 H new ATOM 0 HG23 VAL B 86 1.028 16.473 -0.379 1.00 0.00 H new ATOM 2327 N LYS B 87 0.810 13.780 -4.547 1.00 0.00 N ATOM 2328 CA LYS B 87 0.366 12.890 -5.617 1.00 0.00 C ATOM 2329 C LYS B 87 1.173 11.597 -5.675 1.00 0.00 C ATOM 2330 O LYS B 87 0.591 10.532 -5.771 1.00 0.00 O ATOM 2331 CB LYS B 87 0.446 13.614 -6.966 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.090 15.040 -6.926 1.00 0.00 C ATOM 2333 CD LYS B 87 0.623 15.936 -7.930 1.00 0.00 C ATOM 2334 CE LYS B 87 0.229 17.396 -7.755 1.00 0.00 C ATOM 2335 NZ LYS B 87 1.065 18.306 -8.587 1.00 0.00 N ATOM 0 H LYS B 87 1.133 14.693 -4.868 1.00 0.00 H new ATOM 0 HA LYS B 87 -0.667 12.617 -5.401 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.484 13.634 -7.297 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.114 13.045 -7.708 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.159 15.033 -7.139 1.00 0.00 H new ATOM 0 HG3 LYS B 87 0.033 15.447 -5.923 1.00 0.00 H new ATOM 0 HD2 LYS B 87 1.701 15.832 -7.810 1.00 0.00 H new ATOM 0 HD3 LYS B 87 0.383 15.612 -8.943 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -0.820 17.522 -8.023 1.00 0.00 H new ATOM 0 HE3 LYS B 87 0.326 17.674 -6.705 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 0.740 19.286 -8.463 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 2.059 18.231 -8.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 0.980 18.037 -9.588 1.00 0.00 H new ATOM 2349 N GLU B 88 2.500 11.677 -5.613 1.00 0.00 N ATOM 2350 CA GLU B 88 3.326 10.474 -5.673 1.00 0.00 C ATOM 2351 C GLU B 88 3.089 9.597 -4.442 1.00 0.00 C ATOM 2352 O GLU B 88 3.086 8.370 -4.540 1.00 0.00 O ATOM 2353 CB GLU B 88 4.807 10.825 -5.852 1.00 0.00 C ATOM 2354 CG GLU B 88 5.192 11.046 -7.315 1.00 0.00 C ATOM 2355 CD GLU B 88 6.677 11.304 -7.523 1.00 0.00 C ATOM 2356 OE1 GLU B 88 7.200 12.272 -6.937 1.00 0.00 O ATOM 2357 OE2 GLU B 88 7.324 10.547 -8.291 1.00 0.00 O ATOM 0 H GLU B 88 3.021 12.549 -5.522 1.00 0.00 H new ATOM 0 HA GLU B 88 3.030 9.897 -6.549 1.00 0.00 H new ATOM 0 HB2 GLU B 88 5.033 11.726 -5.282 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.418 10.023 -5.438 1.00 0.00 H new ATOM 0 HG2 GLU B 88 4.899 10.171 -7.895 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.627 11.892 -7.707 1.00 0.00 H new ATOM 2364 N ARG B 89 2.865 10.224 -3.289 1.00 0.00 N ATOM 2365 CA ARG B 89 2.569 9.483 -2.063 1.00 0.00 C ATOM 2366 C ARG B 89 1.234 8.788 -2.224 1.00 0.00 C ATOM 2367 O ARG B 89 1.103 7.581 -2.017 1.00 0.00 O ATOM 2368 CB ARG B 89 2.490 10.424 -0.862 1.00 0.00 C ATOM 2369 CG ARG B 89 1.744 9.838 0.330 1.00 0.00 C ATOM 2370 CD ARG B 89 1.171 10.923 1.228 1.00 0.00 C ATOM 2371 NE ARG B 89 0.054 11.640 0.606 1.00 0.00 N ATOM 2372 CZ ARG B 89 -0.423 12.803 1.051 1.00 0.00 C ATOM 2373 NH1 ARG B 89 0.149 13.413 2.081 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -1.472 13.357 0.463 1.00 0.00 N ATOM 0 H ARG B 89 2.882 11.238 -3.177 1.00 0.00 H new ATOM 0 HA ARG B 89 3.366 8.760 -1.890 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.501 10.688 -0.552 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.999 11.348 -1.168 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.937 9.197 -0.026 1.00 0.00 H new ATOM 0 HG3 ARG B 89 2.420 9.208 0.908 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.834 10.475 2.163 1.00 0.00 H new ATOM 0 HD3 ARG B 89 1.958 11.634 1.480 1.00 0.00 H new ATOM 0 HE ARG B 89 -0.384 11.225 -0.216 1.00 0.00 H new ATOM 0 HH11 ARG B 89 0.959 12.993 2.537 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -0.221 14.302 2.416 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -1.915 12.894 -0.330 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -1.837 14.247 0.804 1.00 0.00 H new ATOM 2388 N ASP B 90 0.249 9.587 -2.595 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.103 9.122 -2.829 1.00 0.00 C ATOM 2390 C ASP B 90 -1.140 8.079 -3.919 1.00 0.00 C ATOM 2391 O ASP B 90 -1.951 7.165 -3.885 1.00 0.00 O ATOM 2392 CB ASP B 90 -1.995 10.310 -3.184 1.00 0.00 C ATOM 2393 CG ASP B 90 -2.673 10.879 -1.961 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.567 10.197 -1.415 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -2.295 11.983 -1.529 1.00 0.00 O ATOM 0 H ASP B 90 0.369 10.589 -2.744 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.476 8.654 -1.918 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.397 11.085 -3.663 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -2.749 9.997 -3.906 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.223 8.209 -4.847 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.120 7.286 -5.976 1.00 0.00 C ATOM 2402 C ALA B 91 0.383 5.944 -5.508 1.00 0.00 C ATOM 2403 O ALA B 91 -0.173 4.898 -5.840 1.00 0.00 O ATOM 2404 CB ALA B 91 0.832 7.834 -7.015 1.00 0.00 C ATOM 0 H ALA B 91 0.476 8.952 -4.851 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.111 7.171 -6.415 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.900 7.137 -7.850 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.465 8.796 -7.374 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.819 7.965 -6.571 1.00 0.00 H new ATOM 2410 N VAL B 92 1.458 5.999 -4.748 1.00 0.00 N ATOM 2411 CA VAL B 92 2.067 4.820 -4.182 1.00 0.00 C ATOM 2412 C VAL B 92 1.031 4.099 -3.351 1.00 0.00 C ATOM 2413 O VAL B 92 0.836 2.900 -3.473 1.00 0.00 O ATOM 2414 CB VAL B 92 3.264 5.240 -3.319 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.545 4.255 -2.205 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.490 5.417 -4.176 1.00 0.00 C ATOM 0 H VAL B 92 1.933 6.869 -4.507 1.00 0.00 H new ATOM 0 HA VAL B 92 2.424 4.152 -4.966 1.00 0.00 H new ATOM 0 HB VAL B 92 3.005 6.191 -2.853 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.401 4.598 -1.624 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.672 4.181 -1.556 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.765 3.276 -2.632 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.331 5.715 -3.550 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.724 4.477 -4.675 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.303 6.188 -4.924 1.00 0.00 H new ATOM 2426 N LYS B 93 0.342 4.888 -2.550 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.717 4.425 -1.679 1.00 0.00 C ATOM 2428 C LYS B 93 -1.845 3.820 -2.488 1.00 0.00 C ATOM 2429 O LYS B 93 -2.370 2.765 -2.145 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.231 5.633 -0.916 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.560 5.427 -0.235 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.168 6.763 0.123 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.400 7.062 -0.690 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.078 7.624 -2.032 1.00 0.00 N ATOM 0 H LYS B 93 0.508 5.892 -2.486 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.341 3.659 -1.001 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.492 5.913 -0.165 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.318 6.472 -1.606 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.233 4.876 -0.892 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.428 4.825 0.664 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.423 6.772 1.183 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.431 7.550 -0.035 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -4.981 6.148 -0.813 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -5.028 7.768 -0.146 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.762 7.268 -2.730 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -4.129 8.662 -1.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.118 7.334 -2.308 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.215 4.503 -3.558 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.282 4.036 -4.417 1.00 0.00 C ATOM 2450 C ASP B 94 -2.955 2.653 -4.941 1.00 0.00 C ATOM 2451 O ASP B 94 -3.747 1.717 -4.812 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.506 4.990 -5.585 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.543 6.051 -5.267 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.905 6.198 -4.074 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -4.998 6.735 -6.200 1.00 0.00 O ATOM 0 H ASP B 94 -1.790 5.383 -3.850 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.198 3.996 -3.828 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.563 5.472 -5.844 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.825 4.423 -6.459 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.765 2.537 -5.516 1.00 0.00 N ATOM 2461 CA LEU B 95 -1.289 1.278 -6.057 1.00 0.00 C ATOM 2462 C LEU B 95 -1.158 0.247 -4.949 1.00 0.00 C ATOM 2463 O LEU B 95 -1.636 -0.874 -5.074 1.00 0.00 O ATOM 2464 CB LEU B 95 0.049 1.486 -6.774 1.00 0.00 C ATOM 2465 CG LEU B 95 0.017 1.246 -8.289 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.330 1.648 -8.875 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.133 2.020 -8.968 1.00 0.00 C ATOM 0 H LEU B 95 -1.108 3.311 -5.618 1.00 0.00 H new ATOM 0 HA LEU B 95 -2.012 0.906 -6.783 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.388 2.505 -6.590 1.00 0.00 H new ATOM 0 HB3 LEU B 95 0.789 0.819 -6.331 1.00 0.00 H new ATOM 0 HG LEU B 95 0.164 0.181 -8.467 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.327 1.468 -9.950 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -2.120 1.058 -8.410 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.508 2.706 -8.685 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.099 1.841 -10.043 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.008 3.085 -8.774 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.095 1.691 -8.576 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.540 0.659 -3.856 1.00 0.00 N ATOM 2480 CA LEU B 96 -0.333 -0.195 -2.698 1.00 0.00 C ATOM 2481 C LEU B 96 -1.643 -0.804 -2.213 1.00 0.00 C ATOM 2482 O LEU B 96 -1.803 -2.021 -2.210 1.00 0.00 O ATOM 2483 CB LEU B 96 0.323 0.627 -1.593 1.00 0.00 C ATOM 2484 CG LEU B 96 1.840 0.711 -1.694 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.390 1.655 -0.647 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.466 -0.666 -1.566 1.00 0.00 C ATOM 0 H LEU B 96 -0.165 1.601 -3.746 1.00 0.00 H new ATOM 0 HA LEU B 96 0.319 -1.023 -2.978 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -0.088 1.636 -1.614 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.058 0.195 -0.628 1.00 0.00 H new ATOM 0 HG LEU B 96 2.097 1.106 -2.677 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.475 1.703 -0.734 1.00 0.00 H new ATOM 0 HD12 LEU B 96 1.970 2.650 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.121 1.294 0.346 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.550 -0.581 -1.641 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.202 -1.097 -0.601 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.096 -1.309 -2.364 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.578 0.054 -1.829 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.887 -0.367 -1.343 1.00 0.00 C ATOM 2500 C GLN B 97 -4.598 -1.325 -2.310 1.00 0.00 C ATOM 2501 O GLN B 97 -5.120 -2.356 -1.894 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.737 0.873 -1.061 1.00 0.00 C ATOM 2503 CG GLN B 97 -6.222 0.705 -1.290 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.946 2.034 -1.279 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.437 2.486 -0.248 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -6.997 2.678 -2.430 1.00 0.00 N ATOM 0 H GLN B 97 -2.451 1.066 -1.845 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.744 -0.930 -0.421 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.578 1.174 -0.026 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.379 1.689 -1.689 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.389 0.208 -2.246 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.638 0.058 -0.518 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -6.576 2.267 -3.263 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.457 3.587 -2.486 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.574 -1.005 -3.598 1.00 0.00 N ATOM 2516 CA GLN B 98 -5.251 -1.827 -4.606 1.00 0.00 C ATOM 2517 C GLN B 98 -4.513 -3.134 -4.906 1.00 0.00 C ATOM 2518 O GLN B 98 -5.138 -4.163 -5.159 1.00 0.00 O ATOM 2519 CB GLN B 98 -5.415 -1.044 -5.912 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.527 -0.012 -5.889 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.377 1.016 -6.996 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -6.830 0.810 -8.119 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -5.733 2.126 -6.690 1.00 0.00 N ATOM 0 H GLN B 98 -4.096 -0.186 -3.973 1.00 0.00 H new ATOM 0 HA GLN B 98 -6.224 -2.081 -4.186 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.475 -0.542 -6.141 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.606 -1.748 -6.722 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -7.489 -0.514 -5.990 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -6.531 0.494 -4.924 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -5.371 2.262 -5.746 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -5.597 2.848 -7.397 1.00 0.00 H new ATOM 2532 N LEU B 99 -3.191 -3.093 -4.878 1.00 0.00 N ATOM 2533 CA LEU B 99 -2.382 -4.265 -5.199 1.00 0.00 C ATOM 2534 C LEU B 99 -2.163 -5.191 -4.010 1.00 0.00 C ATOM 2535 O LEU B 99 -1.860 -6.366 -4.195 1.00 0.00 O ATOM 2536 CB LEU B 99 -1.032 -3.821 -5.745 1.00 0.00 C ATOM 2537 CG LEU B 99 -1.058 -3.287 -7.174 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.030 -2.249 -7.360 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.879 -4.427 -8.162 1.00 0.00 C ATOM 0 H LEU B 99 -2.652 -2.262 -4.636 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.937 -4.832 -5.947 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.629 -3.047 -5.091 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -0.344 -4.665 -5.701 1.00 0.00 H new ATOM 0 HG LEU B 99 -2.024 -2.817 -7.359 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.004 -1.874 -8.383 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -0.132 -1.424 -6.666 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.002 -2.702 -7.165 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.899 -4.034 -9.179 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.077 -4.918 -7.982 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.687 -5.148 -8.036 1.00 0.00 H new ATOM 2551 N LEU B 100 -2.310 -4.672 -2.804 1.00 0.00 N ATOM 2552 CA LEU B 100 -2.103 -5.465 -1.592 1.00 0.00 C ATOM 2553 C LEU B 100 -2.843 -6.810 -1.615 1.00 0.00 C ATOM 2554 O LEU B 100 -2.211 -7.853 -1.457 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.497 -4.664 -0.358 1.00 0.00 C ATOM 2556 CG LEU B 100 -1.407 -3.747 0.177 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.976 -2.823 1.243 1.00 0.00 C ATOM 2558 CD2 LEU B 100 -0.248 -4.581 0.709 1.00 0.00 C ATOM 0 H LEU B 100 -2.573 -3.702 -2.631 1.00 0.00 H new ATOM 0 HA LEU B 100 -1.039 -5.697 -1.552 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -3.375 -4.063 -0.596 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.790 -5.357 0.431 1.00 0.00 H new ATOM 0 HG LEU B 100 -1.026 -3.120 -0.629 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.187 -2.171 1.619 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.773 -2.217 0.812 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.377 -3.418 2.064 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.530 -3.920 1.091 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.603 -5.226 1.512 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.159 -5.194 -0.096 1.00 0.00 H new ATOM 2570 N PRO B 101 -4.176 -6.832 -1.835 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.949 -8.086 -1.866 1.00 0.00 C ATOM 2572 C PRO B 101 -4.563 -9.006 -3.027 1.00 0.00 C ATOM 2573 O PRO B 101 -5.160 -10.064 -3.222 1.00 0.00 O ATOM 2574 CB PRO B 101 -6.396 -7.614 -2.009 1.00 0.00 C ATOM 2575 CG PRO B 101 -6.289 -6.264 -2.616 1.00 0.00 C ATOM 2576 CD PRO B 101 -5.043 -5.659 -2.051 1.00 0.00 C ATOM 0 HA PRO B 101 -4.767 -8.686 -0.974 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.973 -8.289 -2.641 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.898 -7.576 -1.042 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -6.235 -6.327 -3.703 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -7.162 -5.657 -2.375 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.592 -4.945 -2.740 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -5.239 -5.125 -1.121 1.00 0.00 H new ATOM 2584 N LYS B 102 -3.593 -8.583 -3.816 1.00 0.00 N ATOM 2585 CA LYS B 102 -3.108 -9.382 -4.925 1.00 0.00 C ATOM 2586 C LYS B 102 -1.843 -10.136 -4.507 1.00 0.00 C ATOM 2587 O LYS B 102 -1.497 -11.155 -5.097 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.833 -8.486 -6.144 1.00 0.00 C ATOM 2589 CG LYS B 102 -2.320 -9.230 -7.370 1.00 0.00 C ATOM 2590 CD LYS B 102 -1.887 -8.262 -8.469 1.00 0.00 C ATOM 2591 CE LYS B 102 -1.013 -8.942 -9.520 1.00 0.00 C ATOM 2592 NZ LYS B 102 -0.193 -7.959 -10.292 1.00 0.00 N ATOM 0 H LYS B 102 -3.123 -7.684 -3.708 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.870 -10.110 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -3.752 -7.963 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -2.103 -7.726 -5.864 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -1.478 -9.862 -7.088 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -3.100 -9.889 -7.750 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -2.770 -7.841 -8.950 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -1.339 -7.431 -8.025 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -0.353 -9.660 -9.033 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -1.645 -9.505 -10.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -0.057 -8.307 -11.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -0.684 -7.042 -10.318 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.733 -7.843 -9.833 1.00 0.00 H new ATOM 2606 N PHE B 103 -1.164 -9.643 -3.463 1.00 0.00 N ATOM 2607 CA PHE B 103 0.076 -10.255 -3.008 1.00 0.00 C ATOM 2608 C PHE B 103 0.007 -10.678 -1.559 1.00 0.00 C ATOM 2609 O PHE B 103 0.817 -11.479 -1.126 1.00 0.00 O ATOM 2610 CB PHE B 103 1.236 -9.292 -3.243 1.00 0.00 C ATOM 2611 CG PHE B 103 1.214 -8.705 -4.625 1.00 0.00 C ATOM 2612 CD1 PHE B 103 1.477 -9.497 -5.728 1.00 0.00 C ATOM 2613 CD2 PHE B 103 0.904 -7.372 -4.819 1.00 0.00 C ATOM 2614 CE1 PHE B 103 1.430 -8.971 -7.001 1.00 0.00 C ATOM 2615 CE2 PHE B 103 0.858 -6.838 -6.090 1.00 0.00 C ATOM 2616 CZ PHE B 103 1.121 -7.638 -7.182 1.00 0.00 C ATOM 0 H PHE B 103 -1.456 -8.827 -2.925 1.00 0.00 H new ATOM 0 HA PHE B 103 0.238 -11.164 -3.588 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.194 -8.488 -2.508 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.179 -9.817 -3.088 1.00 0.00 H new ATOM 0 HD1 PHE B 103 1.722 -10.540 -5.590 1.00 0.00 H new ATOM 0 HD2 PHE B 103 0.696 -6.742 -3.967 1.00 0.00 H new ATOM 0 HE1 PHE B 103 1.634 -9.600 -7.855 1.00 0.00 H new ATOM 0 HE2 PHE B 103 0.616 -5.795 -6.230 1.00 0.00 H new ATOM 0 HZ PHE B 103 1.085 -7.222 -8.178 1.00 0.00 H new ATOM 2626 N LYS B 104 -0.979 -10.177 -0.827 1.00 0.00 N ATOM 2627 CA LYS B 104 -1.126 -10.505 0.587 1.00 0.00 C ATOM 2628 C LYS B 104 -1.101 -12.011 0.829 1.00 0.00 C ATOM 2629 O LYS B 104 -1.843 -12.770 0.206 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.415 -9.908 1.145 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.203 -8.572 1.829 1.00 0.00 C ATOM 2632 CD LYS B 104 -3.446 -8.130 2.576 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.092 -7.221 3.738 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.262 -6.962 4.613 1.00 0.00 N ATOM 0 H LYS B 104 -1.690 -9.541 -1.188 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.273 -10.070 1.108 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -3.132 -9.784 0.334 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -2.855 -10.608 1.856 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.366 -8.646 2.524 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -1.936 -7.820 1.087 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.117 -7.608 1.894 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -3.982 -9.004 2.945 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -2.293 -7.675 4.324 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.708 -6.275 3.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.153 -6.035 5.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -5.131 -6.965 4.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -4.323 -7.704 5.339 1.00 0.00 H new