USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1226 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 97 GLN : amide:sc= 1.2 K(o=2.1,f=-0.43) USER MOD Set 1.2: B 98 GLN : amide:sc= 0.89 K(o=2.1,f=-2.7) USER MOD Set 2.1: B 78 HIS : no HE2:sc= -2.46! X(o=-3.1!,f=-3.2) USER MOD Set 2.2: B 80 SER OG : rot -160:sc= -0.678 USER MOD Set 3.1: B 45 HIS : no HE2:sc= -0.973 K(o=-0.43,f=-2!) USER MOD Set 3.2: B 75 THR OG1 : rot -132:sc= 0.543 USER MOD Set 4.1: B 56 SER OG : rot -107:sc= 1.88 USER MOD Set 4.2: B 64 GLN : amide:sc= -3.51! C(o=-1.6!,f=-1.7!) USER MOD Set 5.1: B 54 LYS NZ :NH3+ -134:sc= 0.827 (180deg=-0.867!) USER MOD Set 5.2: B 66 GLN : amide:sc= -2.99! C(o=-1.7!,f=-6.2!) USER MOD Set 5.3: B 74 THR OG1 : rot 28:sc= 0.484 USER MOD Set 6.1: B 51 LYS NZ :NH3+ 151:sc= 1.33 (180deg=0.0192) USER MOD Set 6.2: B 52 CYS SG : rot 174:sc= -1.27! USER MOD Single : A 397 MET CE :methyl -131:sc= -0.202 (180deg=-1.13) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 TYR OH : rot 150:sc= -0.0582 USER MOD Single : A 406 SER OG : rot 62:sc= 1.21 USER MOD Single : A 409 SER OG : rot -85:sc= 1.06 USER MOD Single : A 410 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.15) USER MOD Single : A 417 GLN : amide:sc= 0.963 K(o=0.96,f=-7.1!) USER MOD Single : A 418 MET CE :methyl -156:sc= -4.3! (180deg=-5.9!) USER MOD Single : A 419 THR OG1 : rot 159:sc= 0.957 USER MOD Single : A 423 LYS NZ :NH3+ -171:sc= -4.06! (180deg=-4.11!) USER MOD Single : A 426 TYR OH : rot 180:sc= -0.285 USER MOD Single : A 429 MET CE :methyl -150:sc= -4.38! (180deg=-5.54!) USER MOD Single : A 431 GLN : amide:sc= 0.542 K(o=0.54,f=-8.1!) USER MOD Single : A 433 MET CE :methyl -139:sc= -1.78 (180deg=-4.71!) USER MOD Single : B 13 LYS NZ :NH3+ 179:sc= -0.174 (180deg=-0.181) USER MOD Single : B 14 LYS NZ :NH3+ 139:sc= 1.49 (180deg=-2.56!) USER MOD Single : B 17 GLN : amide:sc= 0.865 K(o=0.86,f=-0.9) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 GLN : amide:sc= 0.582 K(o=0.58,f=-0.5) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -137:sc= -2.92! (180deg=-9.15!) USER MOD Single : B 38 LYS NZ :NH3+ 156:sc= 0.738 (180deg=-1.21!) USER MOD Single : B 42 THR OG1 : rot 180:sc= -0.146 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl 162:sc= -0.041 (180deg=-0.21) USER MOD Single : B 47 TYR OH : rot 26:sc= -1.84! USER MOD Single : B 53 GLN : amide:sc= -3.45! K(o=-3.4!,f=-2.7) USER MOD Single : B 60 LYS NZ :NH3+ -125:sc= 2.19 (180deg=-1.29) USER MOD Single : B 62 LYS NZ :NH3+ -146:sc= 2.44 (180deg=-0.434) USER MOD Single : B 70 HIS : no HD1:sc= -1.72 K(o=-1.7,f=-3.1!) USER MOD Single : B 76 ASN : amide:sc= -1.18! C(o=-1.2!,f=-7!) USER MOD Single : B 81 ASN : amide:sc= 0.769 K(o=0.77,f=-2.6!) USER MOD Single : B 83 SER OG : rot 180:sc= 0.12 USER MOD Single : B 84 THR OG1 : rot 105:sc= 1.2 USER MOD Single : B 87 LYS NZ :NH3+ 174:sc= 1.26 (180deg=1.24) USER MOD Single : B 93 LYS NZ :NH3+ 161:sc= -1.13! (180deg=-2.4!) USER MOD Single : B 102 LYS NZ :NH3+ -148:sc= -0.694 (180deg=-1.55!) USER MOD Single : B 104 LYS NZ :NH3+ -151:sc= 2.3 (180deg=0.419!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 10.038 8.884 10.487 1.00 0.00 N ATOM 59 CA GLU A 382 9.203 7.695 10.337 1.00 0.00 C ATOM 60 C GLU A 382 8.425 7.468 11.637 1.00 0.00 C ATOM 61 O GLU A 382 8.608 6.473 12.340 1.00 0.00 O ATOM 62 CB GLU A 382 10.061 6.473 9.973 1.00 0.00 C ATOM 63 CG GLU A 382 10.622 6.517 8.552 1.00 0.00 C ATOM 64 CD GLU A 382 11.930 7.287 8.434 1.00 0.00 C ATOM 65 OE1 GLU A 382 11.892 8.514 8.186 1.00 0.00 O ATOM 66 OE2 GLU A 382 13.003 6.660 8.566 1.00 0.00 O ATOM 0 HA GLU A 382 8.494 7.842 9.523 1.00 0.00 H new ATOM 0 HB2 GLU A 382 10.888 6.398 10.679 1.00 0.00 H new ATOM 0 HB3 GLU A 382 9.460 5.571 10.089 1.00 0.00 H new ATOM 0 HG2 GLU A 382 10.778 5.497 8.201 1.00 0.00 H new ATOM 0 HG3 GLU A 382 9.882 6.971 7.893 1.00 0.00 H new ATOM 73 N GLU A 383 7.551 8.421 11.938 1.00 0.00 N ATOM 74 CA GLU A 383 6.764 8.419 13.165 1.00 0.00 C ATOM 75 C GLU A 383 5.318 7.953 12.945 1.00 0.00 C ATOM 76 O GLU A 383 5.074 6.852 12.460 1.00 0.00 O ATOM 77 CB GLU A 383 6.775 9.834 13.768 1.00 0.00 C ATOM 78 CG GLU A 383 7.157 10.938 12.777 1.00 0.00 C ATOM 79 CD GLU A 383 6.156 11.117 11.643 1.00 0.00 C ATOM 80 OE1 GLU A 383 6.189 10.323 10.681 1.00 0.00 O ATOM 81 OE2 GLU A 383 5.341 12.055 11.708 1.00 0.00 O ATOM 0 H GLU A 383 7.367 9.222 11.334 1.00 0.00 H new ATOM 0 HA GLU A 383 7.220 7.705 13.850 1.00 0.00 H new ATOM 0 HB2 GLU A 383 5.787 10.051 14.173 1.00 0.00 H new ATOM 0 HB3 GLU A 383 7.474 9.855 14.604 1.00 0.00 H new ATOM 0 HG2 GLU A 383 7.254 11.880 13.316 1.00 0.00 H new ATOM 0 HG3 GLU A 383 8.135 10.711 12.354 1.00 0.00 H new ATOM 88 N ASP A 384 4.371 8.810 13.322 1.00 0.00 N ATOM 89 CA ASP A 384 2.941 8.523 13.198 1.00 0.00 C ATOM 90 C ASP A 384 2.166 9.810 13.454 1.00 0.00 C ATOM 91 O ASP A 384 1.335 9.886 14.358 1.00 0.00 O ATOM 92 CB ASP A 384 2.510 7.441 14.197 1.00 0.00 C ATOM 93 CG ASP A 384 1.504 6.461 13.614 1.00 0.00 C ATOM 94 OD1 ASP A 384 0.425 6.893 13.147 1.00 0.00 O ATOM 95 OD2 ASP A 384 1.782 5.241 13.626 1.00 0.00 O ATOM 0 H ASP A 384 4.573 9.726 13.723 1.00 0.00 H new ATOM 0 HA ASP A 384 2.733 8.151 12.195 1.00 0.00 H new ATOM 0 HB2 ASP A 384 3.390 6.893 14.533 1.00 0.00 H new ATOM 0 HB3 ASP A 384 2.077 7.918 15.076 1.00 0.00 H new ATOM 100 N ASP A 385 2.481 10.828 12.660 1.00 0.00 N ATOM 101 CA ASP A 385 1.865 12.145 12.772 1.00 0.00 C ATOM 102 C ASP A 385 0.346 12.083 12.619 1.00 0.00 C ATOM 103 O ASP A 385 -0.386 12.572 13.477 1.00 0.00 O ATOM 104 CB ASP A 385 2.464 13.070 11.712 1.00 0.00 C ATOM 105 CG ASP A 385 2.386 14.542 12.073 1.00 0.00 C ATOM 106 OD1 ASP A 385 1.535 14.916 12.905 1.00 0.00 O ATOM 107 OD2 ASP A 385 3.152 15.335 11.487 1.00 0.00 O ATOM 0 H ASP A 385 3.175 10.762 11.916 1.00 0.00 H new ATOM 0 HA ASP A 385 2.071 12.533 13.769 1.00 0.00 H new ATOM 0 HB2 ASP A 385 3.508 12.799 11.553 1.00 0.00 H new ATOM 0 HB3 ASP A 385 1.946 12.909 10.767 1.00 0.00 H new ATOM 112 N GLU A 386 -0.128 11.475 11.528 1.00 0.00 N ATOM 113 CA GLU A 386 -1.548 11.366 11.261 1.00 0.00 C ATOM 114 C GLU A 386 -1.724 10.570 10.002 1.00 0.00 C ATOM 115 O GLU A 386 -1.664 11.110 8.895 1.00 0.00 O ATOM 116 CB GLU A 386 -2.178 12.734 11.072 1.00 0.00 C ATOM 117 CG GLU A 386 -3.395 13.000 11.933 1.00 0.00 C ATOM 118 CD GLU A 386 -3.792 14.460 11.902 1.00 0.00 C ATOM 119 OE1 GLU A 386 -4.553 14.848 10.996 1.00 0.00 O ATOM 120 OE2 GLU A 386 -3.302 15.226 12.760 1.00 0.00 O ATOM 0 H GLU A 386 0.465 11.050 10.815 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.034 10.882 12.108 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.428 13.496 11.284 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.460 12.847 10.025 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -4.228 12.389 11.585 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.187 12.701 12.960 1.00 0.00 H new ATOM 127 N PHE A 387 -1.909 9.290 10.159 1.00 0.00 N ATOM 128 CA PHE A 387 -2.045 8.433 9.015 1.00 0.00 C ATOM 129 C PHE A 387 -3.345 7.650 9.027 1.00 0.00 C ATOM 130 O PHE A 387 -3.843 7.257 10.081 1.00 0.00 O ATOM 131 CB PHE A 387 -0.878 7.448 8.950 1.00 0.00 C ATOM 132 CG PHE A 387 0.487 8.074 8.891 1.00 0.00 C ATOM 133 CD1 PHE A 387 1.101 8.536 10.044 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.165 8.186 7.688 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.353 9.096 9.996 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.418 8.745 7.644 1.00 0.00 C ATOM 137 CZ PHE A 387 3.009 9.200 8.800 1.00 0.00 C ATOM 0 H PHE A 387 -1.969 8.819 11.062 1.00 0.00 H new ATOM 0 HA PHE A 387 -2.047 9.081 8.139 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.924 6.797 9.823 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.007 6.814 8.073 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.589 8.454 10.991 1.00 0.00 H new ATOM 0 HD2 PHE A 387 0.704 7.831 6.778 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.820 9.454 10.902 1.00 0.00 H new ATOM 0 HE2 PHE A 387 2.940 8.828 6.702 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.994 9.641 8.763 1.00 0.00 H new ATOM 147 N GLU A 388 -3.860 7.420 7.833 1.00 0.00 N ATOM 148 CA GLU A 388 -5.065 6.648 7.631 1.00 0.00 C ATOM 149 C GLU A 388 -4.627 5.228 7.409 1.00 0.00 C ATOM 150 O GLU A 388 -3.831 4.984 6.500 1.00 0.00 O ATOM 151 CB GLU A 388 -5.825 7.117 6.382 1.00 0.00 C ATOM 152 CG GLU A 388 -6.839 8.214 6.629 1.00 0.00 C ATOM 153 CD GLU A 388 -7.988 7.768 7.509 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.811 7.729 8.744 1.00 0.00 O ATOM 155 OE2 GLU A 388 -9.065 7.452 6.962 1.00 0.00 O ATOM 0 H GLU A 388 -3.446 7.769 6.969 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.725 6.758 8.491 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.103 7.469 5.645 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.337 6.261 5.943 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.341 9.064 7.094 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.233 8.559 5.673 1.00 0.00 H new ATOM 162 N GLU A 389 -5.075 4.304 8.232 1.00 0.00 N ATOM 163 CA GLU A 389 -4.676 2.930 8.036 1.00 0.00 C ATOM 164 C GLU A 389 -5.240 2.466 6.703 1.00 0.00 C ATOM 165 O GLU A 389 -6.439 2.217 6.574 1.00 0.00 O ATOM 166 CB GLU A 389 -5.172 2.045 9.184 1.00 0.00 C ATOM 167 CG GLU A 389 -4.474 0.693 9.260 1.00 0.00 C ATOM 168 CD GLU A 389 -3.618 0.532 10.504 1.00 0.00 C ATOM 169 OE1 GLU A 389 -3.260 1.555 11.125 1.00 0.00 O ATOM 170 OE2 GLU A 389 -3.292 -0.626 10.853 1.00 0.00 O ATOM 0 H GLU A 389 -5.698 4.473 9.022 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.589 2.853 8.027 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.027 2.573 10.127 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -6.244 1.885 9.070 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -5.224 -0.098 9.238 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -3.848 0.564 8.377 1.00 0.00 H new ATOM 177 N VAL A 390 -4.372 2.359 5.709 1.00 0.00 N ATOM 178 CA VAL A 390 -4.803 1.952 4.400 1.00 0.00 C ATOM 179 C VAL A 390 -5.004 0.451 4.383 1.00 0.00 C ATOM 180 O VAL A 390 -4.095 -0.312 4.728 1.00 0.00 O ATOM 181 CB VAL A 390 -3.823 2.316 3.264 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.523 2.227 1.919 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.227 3.695 3.444 1.00 0.00 C ATOM 0 H VAL A 390 -3.373 2.549 5.792 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.728 2.497 4.211 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.005 1.597 3.300 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.822 2.486 1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -4.886 1.211 1.765 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.364 2.920 1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.544 3.907 2.621 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -4.025 4.438 3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.682 3.736 4.387 1.00 0.00 H new ATOM 193 N ALA A 391 -6.176 0.033 3.979 1.00 0.00 N ATOM 194 CA ALA A 391 -6.497 -1.371 3.922 1.00 0.00 C ATOM 195 C ALA A 391 -6.237 -1.905 2.530 1.00 0.00 C ATOM 196 O ALA A 391 -6.411 -1.195 1.547 1.00 0.00 O ATOM 197 CB ALA A 391 -7.946 -1.602 4.322 1.00 0.00 C ATOM 0 H ALA A 391 -6.931 0.651 3.682 1.00 0.00 H new ATOM 0 HA ALA A 391 -5.860 -1.906 4.626 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.171 -2.667 4.273 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.104 -1.244 5.339 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.602 -1.061 3.640 1.00 0.00 H new ATOM 203 N ASP A 392 -5.751 -3.126 2.477 1.00 0.00 N ATOM 204 CA ASP A 392 -5.478 -3.822 1.228 1.00 0.00 C ATOM 205 C ASP A 392 -6.770 -4.077 0.467 1.00 0.00 C ATOM 206 O ASP A 392 -7.327 -5.172 0.509 1.00 0.00 O ATOM 207 CB ASP A 392 -4.774 -5.154 1.505 1.00 0.00 C ATOM 208 CG ASP A 392 -5.378 -5.923 2.668 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.276 -5.448 3.820 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.931 -7.021 2.441 1.00 0.00 O ATOM 0 H ASP A 392 -5.530 -3.675 3.308 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.827 -3.192 0.621 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.816 -5.773 0.609 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.721 -4.964 1.712 1.00 0.00 H new ATOM 215 N ASP A 393 -7.244 -3.066 -0.230 1.00 0.00 N ATOM 216 CA ASP A 393 -8.477 -3.191 -0.974 1.00 0.00 C ATOM 217 C ASP A 393 -8.216 -3.355 -2.463 1.00 0.00 C ATOM 218 O ASP A 393 -7.631 -2.481 -3.105 1.00 0.00 O ATOM 219 CB ASP A 393 -9.363 -1.976 -0.726 1.00 0.00 C ATOM 220 CG ASP A 393 -10.828 -2.259 -1.025 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.465 -3.008 -0.259 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.354 -1.735 -2.027 1.00 0.00 O ATOM 0 H ASP A 393 -6.796 -2.152 -0.296 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.989 -4.088 -0.625 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.261 -1.660 0.312 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -9.021 -1.147 -1.346 1.00 0.00 H new ATOM 227 N PRO A 394 -8.637 -4.492 -3.028 1.00 0.00 N ATOM 228 CA PRO A 394 -8.469 -4.777 -4.446 1.00 0.00 C ATOM 229 C PRO A 394 -9.507 -4.053 -5.299 1.00 0.00 C ATOM 230 O PRO A 394 -10.502 -3.533 -4.791 1.00 0.00 O ATOM 231 CB PRO A 394 -8.674 -6.290 -4.521 1.00 0.00 C ATOM 232 CG PRO A 394 -9.611 -6.587 -3.409 1.00 0.00 C ATOM 233 CD PRO A 394 -9.296 -5.600 -2.316 1.00 0.00 C ATOM 0 HA PRO A 394 -7.503 -4.445 -4.826 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -9.091 -6.588 -5.483 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.732 -6.826 -4.402 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.646 -6.488 -3.736 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.484 -7.611 -3.057 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.199 -5.267 -1.804 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.643 -6.035 -1.559 1.00 0.00 H new ATOM 241 N ILE A 395 -9.282 -4.043 -6.598 1.00 0.00 N ATOM 242 CA ILE A 395 -10.185 -3.382 -7.526 1.00 0.00 C ATOM 243 C ILE A 395 -11.009 -4.416 -8.284 1.00 0.00 C ATOM 244 O ILE A 395 -10.466 -5.292 -8.956 1.00 0.00 O ATOM 245 CB ILE A 395 -9.409 -2.480 -8.524 1.00 0.00 C ATOM 246 CG1 ILE A 395 -9.014 -1.161 -7.855 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.220 -2.210 -9.786 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.187 -0.349 -7.347 1.00 0.00 C ATOM 0 H ILE A 395 -8.477 -4.488 -7.039 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.854 -2.745 -6.947 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.506 -3.015 -8.818 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.346 -1.375 -7.021 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.451 -0.559 -8.568 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -9.644 -1.576 -10.460 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.447 -3.154 -10.282 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.150 -1.707 -9.520 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -9.822 0.569 -6.887 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -10.846 -0.101 -8.179 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.739 -0.930 -6.608 1.00 0.00 H new ATOM 260 N VAL A 396 -12.318 -4.312 -8.154 1.00 0.00 N ATOM 261 CA VAL A 396 -13.237 -5.216 -8.816 1.00 0.00 C ATOM 262 C VAL A 396 -14.191 -4.413 -9.695 1.00 0.00 C ATOM 263 O VAL A 396 -14.936 -3.559 -9.212 1.00 0.00 O ATOM 264 CB VAL A 396 -13.998 -6.100 -7.787 1.00 0.00 C ATOM 265 CG1 VAL A 396 -14.210 -5.369 -6.472 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.315 -6.613 -8.345 1.00 0.00 C ATOM 0 H VAL A 396 -12.774 -3.598 -7.586 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.673 -5.899 -9.452 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.368 -6.967 -7.588 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.745 -6.017 -5.778 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.244 -5.099 -6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.794 -4.466 -6.648 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.814 -7.226 -7.594 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.953 -5.769 -8.607 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -15.124 -7.213 -9.235 1.00 0.00 H new ATOM 276 N MET A 397 -14.143 -4.673 -10.993 1.00 0.00 N ATOM 277 CA MET A 397 -14.959 -3.953 -11.942 1.00 0.00 C ATOM 278 C MET A 397 -16.352 -4.540 -12.004 1.00 0.00 C ATOM 279 O MET A 397 -16.530 -5.755 -11.934 1.00 0.00 O ATOM 280 CB MET A 397 -14.311 -3.984 -13.329 1.00 0.00 C ATOM 281 CG MET A 397 -12.799 -3.809 -13.294 1.00 0.00 C ATOM 282 SD MET A 397 -12.072 -3.649 -14.936 1.00 0.00 S ATOM 283 CE MET A 397 -12.494 -1.954 -15.322 1.00 0.00 C ATOM 0 H MET A 397 -13.541 -5.384 -11.409 1.00 0.00 H new ATOM 0 HA MET A 397 -15.036 -2.917 -11.611 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.549 -4.932 -13.812 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.746 -3.196 -13.943 1.00 0.00 H new ATOM 0 HG2 MET A 397 -12.554 -2.924 -12.706 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.351 -4.663 -12.786 1.00 0.00 H new ATOM 0 HE1 MET A 397 -12.939 -1.907 -16.316 1.00 0.00 H new ATOM 0 HE2 MET A 397 -13.207 -1.580 -14.587 1.00 0.00 H new ATOM 0 HE3 MET A 397 -11.593 -1.340 -15.299 1.00 0.00 H new ATOM 293 N VAL A 398 -17.329 -3.660 -12.092 1.00 0.00 N ATOM 294 CA VAL A 398 -18.717 -4.051 -12.185 1.00 0.00 C ATOM 295 C VAL A 398 -19.364 -3.323 -13.349 1.00 0.00 C ATOM 296 O VAL A 398 -19.441 -2.089 -13.352 1.00 0.00 O ATOM 297 CB VAL A 398 -19.492 -3.734 -10.899 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.953 -4.086 -11.086 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.905 -4.487 -9.716 1.00 0.00 C ATOM 0 H VAL A 398 -17.180 -2.651 -12.101 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.750 -5.130 -12.338 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.408 -2.668 -10.690 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.502 -3.860 -10.172 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.365 -3.503 -11.910 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -21.045 -5.148 -11.311 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.470 -4.247 -8.815 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.960 -5.559 -9.904 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.864 -4.195 -9.579 1.00 0.00 H new ATOM 309 N ALA A 399 -19.815 -4.090 -14.332 1.00 0.00 N ATOM 310 CA ALA A 399 -20.426 -3.556 -15.536 1.00 0.00 C ATOM 311 C ALA A 399 -19.396 -2.733 -16.300 1.00 0.00 C ATOM 312 O ALA A 399 -19.737 -1.797 -17.024 1.00 0.00 O ATOM 313 CB ALA A 399 -21.665 -2.730 -15.206 1.00 0.00 C ATOM 0 H ALA A 399 -19.766 -5.109 -14.314 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.755 -4.382 -16.166 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -22.101 -2.343 -16.127 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -22.395 -3.358 -14.695 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -21.386 -1.898 -14.560 1.00 0.00 H new ATOM 319 N GLY A 400 -18.119 -3.081 -16.113 1.00 0.00 N ATOM 320 CA GLY A 400 -17.050 -2.366 -16.782 1.00 0.00 C ATOM 321 C GLY A 400 -16.553 -1.194 -15.961 1.00 0.00 C ATOM 322 O GLY A 400 -15.483 -0.648 -16.221 1.00 0.00 O ATOM 0 H GLY A 400 -17.812 -3.845 -15.510 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -16.223 -3.049 -16.977 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -17.403 -2.008 -17.749 1.00 0.00 H new ATOM 326 N ARG A 401 -17.336 -0.812 -14.962 1.00 0.00 N ATOM 327 CA ARG A 401 -16.979 0.297 -14.091 1.00 0.00 C ATOM 328 C ARG A 401 -16.034 -0.194 -13.004 1.00 0.00 C ATOM 329 O ARG A 401 -16.369 -1.108 -12.253 1.00 0.00 O ATOM 330 CB ARG A 401 -18.231 0.909 -13.459 1.00 0.00 C ATOM 331 CG ARG A 401 -19.308 1.286 -14.463 1.00 0.00 C ATOM 332 CD ARG A 401 -20.675 1.379 -13.801 1.00 0.00 C ATOM 333 NE ARG A 401 -21.102 0.093 -13.244 1.00 0.00 N ATOM 334 CZ ARG A 401 -22.287 -0.124 -12.669 1.00 0.00 C ATOM 335 NH1 ARG A 401 -23.165 0.865 -12.544 1.00 0.00 N ATOM 336 NH2 ARG A 401 -22.593 -1.332 -12.213 1.00 0.00 N ATOM 0 H ARG A 401 -18.226 -1.256 -14.735 1.00 0.00 H new ATOM 0 HA ARG A 401 -16.483 1.065 -14.684 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -18.648 0.200 -12.743 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -17.945 1.798 -12.897 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -19.059 2.242 -14.924 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -19.338 0.545 -15.262 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -20.644 2.126 -13.008 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -21.409 1.720 -14.531 1.00 0.00 H new ATOM 0 HE ARG A 401 -20.450 -0.689 -13.299 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -22.936 1.797 -12.888 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -24.069 0.692 -12.104 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -21.923 -2.096 -12.302 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -23.499 -1.497 -11.774 1.00 0.00 H new ATOM 350 N PRO A 402 -14.839 0.395 -12.912 1.00 0.00 N ATOM 351 CA PRO A 402 -13.842 0.001 -11.923 1.00 0.00 C ATOM 352 C PRO A 402 -14.198 0.459 -10.513 1.00 0.00 C ATOM 353 O PRO A 402 -14.112 1.645 -10.193 1.00 0.00 O ATOM 354 CB PRO A 402 -12.550 0.687 -12.398 1.00 0.00 C ATOM 355 CG PRO A 402 -12.872 1.304 -13.723 1.00 0.00 C ATOM 356 CD PRO A 402 -14.360 1.492 -13.755 1.00 0.00 C ATOM 0 HA PRO A 402 -13.760 -1.084 -11.857 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -12.225 1.444 -11.684 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.737 -0.033 -12.491 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -12.358 2.258 -13.842 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -12.545 0.661 -14.540 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -14.654 2.465 -13.360 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -14.755 1.426 -14.769 1.00 0.00 H new ATOM 364 N PHE A 403 -14.611 -0.485 -9.685 1.00 0.00 N ATOM 365 CA PHE A 403 -14.964 -0.199 -8.307 1.00 0.00 C ATOM 366 C PHE A 403 -13.987 -0.900 -7.382 1.00 0.00 C ATOM 367 O PHE A 403 -13.258 -1.795 -7.804 1.00 0.00 O ATOM 368 CB PHE A 403 -16.386 -0.683 -7.998 1.00 0.00 C ATOM 369 CG PHE A 403 -17.469 0.095 -8.690 1.00 0.00 C ATOM 370 CD1 PHE A 403 -17.705 1.423 -8.371 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.262 -0.510 -9.652 1.00 0.00 C ATOM 372 CE1 PHE A 403 -18.710 2.133 -9.000 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.267 0.195 -10.284 1.00 0.00 C ATOM 374 CZ PHE A 403 -19.491 1.518 -9.958 1.00 0.00 C ATOM 0 H PHE A 403 -14.710 -1.466 -9.948 1.00 0.00 H new ATOM 0 HA PHE A 403 -14.920 0.879 -8.154 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.470 -1.732 -8.283 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.549 -0.631 -6.921 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -17.097 1.908 -7.622 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -18.092 -1.545 -9.910 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -18.884 3.167 -8.743 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -19.877 -0.288 -11.033 1.00 0.00 H new ATOM 0 HZ PHE A 403 -20.276 2.071 -10.452 1.00 0.00 H new ATOM 384 N SER A 404 -13.948 -0.485 -6.137 1.00 0.00 N ATOM 385 CA SER A 404 -13.075 -1.113 -5.168 1.00 0.00 C ATOM 386 C SER A 404 -13.844 -2.229 -4.467 1.00 0.00 C ATOM 387 O SER A 404 -15.070 -2.283 -4.553 1.00 0.00 O ATOM 388 CB SER A 404 -12.579 -0.078 -4.166 1.00 0.00 C ATOM 389 OG SER A 404 -12.494 1.206 -4.764 1.00 0.00 O ATOM 0 H SER A 404 -14.509 0.284 -5.770 1.00 0.00 H new ATOM 0 HA SER A 404 -12.204 -1.538 -5.667 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.254 -0.041 -3.311 1.00 0.00 H new ATOM 0 HB3 SER A 404 -11.600 -0.373 -3.787 1.00 0.00 H new ATOM 0 HG SER A 404 -12.175 1.855 -4.102 1.00 0.00 H new ATOM 395 N TYR A 405 -13.147 -3.115 -3.786 1.00 0.00 N ATOM 396 CA TYR A 405 -13.795 -4.215 -3.096 1.00 0.00 C ATOM 397 C TYR A 405 -14.688 -3.684 -1.987 1.00 0.00 C ATOM 398 O TYR A 405 -15.835 -4.100 -1.872 1.00 0.00 O ATOM 399 CB TYR A 405 -12.776 -5.204 -2.535 1.00 0.00 C ATOM 400 CG TYR A 405 -13.407 -6.476 -2.011 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.942 -6.537 -0.729 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.480 -7.613 -2.806 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.528 -7.694 -0.256 1.00 0.00 C ATOM 404 CE2 TYR A 405 -14.067 -8.772 -2.338 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.590 -8.806 -1.062 1.00 0.00 C ATOM 406 OH TYR A 405 -15.179 -9.957 -0.594 1.00 0.00 O ATOM 0 H TYR A 405 -12.131 -3.096 -3.695 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.408 -4.751 -3.821 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -12.057 -5.457 -3.314 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.218 -4.724 -1.731 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.898 -5.665 -0.093 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -13.071 -7.590 -3.805 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.936 -7.725 0.743 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -14.116 -9.648 -2.968 1.00 0.00 H new ATOM 0 HH TYR A 405 -15.573 -10.451 -1.343 1.00 0.00 H new ATOM 416 N SER A 406 -14.169 -2.751 -1.190 1.00 0.00 N ATOM 417 CA SER A 406 -14.946 -2.149 -0.105 1.00 0.00 C ATOM 418 C SER A 406 -16.155 -1.400 -0.667 1.00 0.00 C ATOM 419 O SER A 406 -17.092 -1.065 0.054 1.00 0.00 O ATOM 420 CB SER A 406 -14.070 -1.202 0.719 1.00 0.00 C ATOM 421 OG SER A 406 -13.090 -1.920 1.448 1.00 0.00 O ATOM 0 H SER A 406 -13.217 -2.396 -1.274 1.00 0.00 H new ATOM 0 HA SER A 406 -15.303 -2.946 0.547 1.00 0.00 H new ATOM 0 HB2 SER A 406 -13.583 -0.484 0.059 1.00 0.00 H new ATOM 0 HB3 SER A 406 -14.693 -0.631 1.407 1.00 0.00 H new ATOM 0 HG SER A 406 -12.501 -2.395 0.825 1.00 0.00 H new ATOM 427 N GLU A 407 -16.123 -1.162 -1.967 1.00 0.00 N ATOM 428 CA GLU A 407 -17.197 -0.487 -2.666 1.00 0.00 C ATOM 429 C GLU A 407 -18.225 -1.502 -3.137 1.00 0.00 C ATOM 430 O GLU A 407 -19.413 -1.397 -2.837 1.00 0.00 O ATOM 431 CB GLU A 407 -16.626 0.287 -3.853 1.00 0.00 C ATOM 432 CG GLU A 407 -16.270 1.725 -3.530 1.00 0.00 C ATOM 433 CD GLU A 407 -17.494 2.617 -3.551 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.360 2.410 -4.424 1.00 0.00 O ATOM 435 OE2 GLU A 407 -17.609 3.512 -2.692 1.00 0.00 O ATOM 0 H GLU A 407 -15.346 -1.434 -2.568 1.00 0.00 H new ATOM 0 HA GLU A 407 -17.687 0.214 -1.991 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -15.735 -0.226 -4.215 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.352 0.276 -4.666 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.800 1.773 -2.548 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -15.539 2.091 -4.251 1.00 0.00 H new ATOM 442 N VAL A 408 -17.741 -2.501 -3.854 1.00 0.00 N ATOM 443 CA VAL A 408 -18.584 -3.560 -4.382 1.00 0.00 C ATOM 444 C VAL A 408 -19.255 -4.350 -3.255 1.00 0.00 C ATOM 445 O VAL A 408 -20.406 -4.760 -3.373 1.00 0.00 O ATOM 446 CB VAL A 408 -17.754 -4.519 -5.265 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.617 -5.624 -5.829 1.00 0.00 C ATOM 448 CG2 VAL A 408 -17.073 -3.766 -6.393 1.00 0.00 C ATOM 0 H VAL A 408 -16.753 -2.601 -4.087 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.362 -3.093 -4.987 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.988 -4.967 -4.632 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -18.007 -6.283 -6.446 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -19.056 -6.196 -5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.411 -5.191 -6.437 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.495 -4.464 -6.999 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.827 -3.282 -7.015 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.407 -3.010 -5.976 1.00 0.00 H new ATOM 458 N SER A 409 -18.535 -4.538 -2.155 1.00 0.00 N ATOM 459 CA SER A 409 -19.062 -5.291 -1.016 1.00 0.00 C ATOM 460 C SER A 409 -20.117 -4.497 -0.255 1.00 0.00 C ATOM 461 O SER A 409 -21.090 -5.060 0.246 1.00 0.00 O ATOM 462 CB SER A 409 -17.930 -5.689 -0.065 1.00 0.00 C ATOM 463 OG SER A 409 -17.151 -4.565 0.308 1.00 0.00 O ATOM 0 H SER A 409 -17.588 -4.182 -2.025 1.00 0.00 H new ATOM 0 HA SER A 409 -19.534 -6.190 -1.413 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.349 -6.156 0.827 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.293 -6.432 -0.545 1.00 0.00 H new ATOM 0 HG SER A 409 -16.463 -4.404 -0.371 1.00 0.00 H new ATOM 469 N GLN A 410 -19.922 -3.189 -0.173 1.00 0.00 N ATOM 470 CA GLN A 410 -20.853 -2.327 0.539 1.00 0.00 C ATOM 471 C GLN A 410 -22.049 -1.963 -0.327 1.00 0.00 C ATOM 472 O GLN A 410 -23.025 -1.396 0.166 1.00 0.00 O ATOM 473 CB GLN A 410 -20.152 -1.054 1.013 1.00 0.00 C ATOM 474 CG GLN A 410 -19.480 -1.193 2.370 1.00 0.00 C ATOM 475 CD GLN A 410 -20.466 -1.474 3.491 1.00 0.00 C ATOM 476 OE1 GLN A 410 -20.127 -2.107 4.488 1.00 0.00 O ATOM 477 NE2 GLN A 410 -21.697 -1.007 3.335 1.00 0.00 N ATOM 0 H GLN A 410 -19.129 -2.702 -0.590 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.214 -2.882 1.405 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -19.403 -0.766 0.275 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -20.881 -0.245 1.060 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -18.748 -1.999 2.326 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -18.933 -0.277 2.595 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -21.942 -0.485 2.493 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -22.399 -1.169 4.057 1.00 0.00 H new ATOM 486 N ARG A 411 -21.971 -2.274 -1.614 1.00 0.00 N ATOM 487 CA ARG A 411 -23.059 -1.965 -2.526 1.00 0.00 C ATOM 488 C ARG A 411 -23.639 -3.224 -3.163 1.00 0.00 C ATOM 489 O ARG A 411 -23.123 -3.734 -4.171 1.00 0.00 O ATOM 490 CB ARG A 411 -22.595 -0.994 -3.608 1.00 0.00 C ATOM 491 CG ARG A 411 -22.161 0.352 -3.060 1.00 0.00 C ATOM 492 CD ARG A 411 -21.843 1.331 -4.174 1.00 0.00 C ATOM 493 NE ARG A 411 -20.875 2.341 -3.748 1.00 0.00 N ATOM 494 CZ ARG A 411 -21.179 3.436 -3.060 1.00 0.00 C ATOM 495 NH1 ARG A 411 -22.448 3.714 -2.767 1.00 0.00 N ATOM 496 NH2 ARG A 411 -20.209 4.254 -2.667 1.00 0.00 N ATOM 0 H ARG A 411 -21.171 -2.737 -2.046 1.00 0.00 H new ATOM 0 HA ARG A 411 -23.848 -1.494 -1.941 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.765 -1.440 -4.155 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.404 -0.844 -4.323 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -22.951 0.761 -2.430 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -21.283 0.222 -2.427 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.448 0.789 -5.033 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -22.760 1.821 -4.500 1.00 0.00 H new ATOM 0 HE ARG A 411 -19.897 2.194 -3.997 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -23.191 3.085 -3.071 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -22.677 4.556 -2.239 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -19.238 4.040 -2.894 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -20.435 5.097 -2.138 1.00 0.00 H new ATOM 510 N PRO A 412 -24.731 -3.742 -2.581 1.00 0.00 N ATOM 511 CA PRO A 412 -25.411 -4.928 -3.093 1.00 0.00 C ATOM 512 C PRO A 412 -25.908 -4.716 -4.520 1.00 0.00 C ATOM 513 O PRO A 412 -26.047 -5.671 -5.282 1.00 0.00 O ATOM 514 CB PRO A 412 -26.592 -5.125 -2.133 1.00 0.00 C ATOM 515 CG PRO A 412 -26.756 -3.815 -1.440 1.00 0.00 C ATOM 516 CD PRO A 412 -25.383 -3.213 -1.372 1.00 0.00 C ATOM 0 HA PRO A 412 -24.749 -5.793 -3.136 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.497 -5.400 -2.674 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.391 -5.925 -1.420 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.441 -3.167 -1.987 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -27.173 -3.950 -0.442 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -25.419 -2.124 -1.376 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.856 -3.511 -0.466 1.00 0.00 H new ATOM 524 N GLU A 413 -26.154 -3.455 -4.884 1.00 0.00 N ATOM 525 CA GLU A 413 -26.623 -3.122 -6.220 1.00 0.00 C ATOM 526 C GLU A 413 -25.503 -3.352 -7.215 1.00 0.00 C ATOM 527 O GLU A 413 -25.742 -3.740 -8.353 1.00 0.00 O ATOM 528 CB GLU A 413 -27.087 -1.664 -6.317 1.00 0.00 C ATOM 529 CG GLU A 413 -27.643 -1.097 -5.025 1.00 0.00 C ATOM 530 CD GLU A 413 -26.580 -0.385 -4.218 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.861 -1.067 -3.468 1.00 0.00 O ATOM 532 OE2 GLU A 413 -26.451 0.848 -4.351 1.00 0.00 O ATOM 0 H GLU A 413 -26.034 -2.651 -4.268 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.476 -3.763 -6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.247 -1.048 -6.638 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.851 -1.589 -7.091 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.452 -0.403 -5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -28.072 -1.903 -4.430 1.00 0.00 H new ATOM 539 N LEU A 414 -24.273 -3.120 -6.773 1.00 0.00 N ATOM 540 CA LEU A 414 -23.119 -3.320 -7.628 1.00 0.00 C ATOM 541 C LEU A 414 -22.980 -4.794 -7.953 1.00 0.00 C ATOM 542 O LEU A 414 -22.848 -5.167 -9.108 1.00 0.00 O ATOM 543 CB LEU A 414 -21.838 -2.800 -6.973 1.00 0.00 C ATOM 544 CG LEU A 414 -21.694 -1.279 -6.941 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.268 -0.893 -6.583 1.00 0.00 C ATOM 546 CD2 LEU A 414 -22.094 -0.671 -8.278 1.00 0.00 C ATOM 0 H LEU A 414 -24.054 -2.795 -5.831 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.271 -2.754 -8.547 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.794 -3.175 -5.950 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.982 -3.219 -7.503 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.363 -0.885 -6.176 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -20.179 0.193 -6.564 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -20.018 -1.295 -5.601 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.583 -1.300 -7.327 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.984 0.412 -8.233 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.453 -1.068 -9.065 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -23.132 -0.921 -8.495 1.00 0.00 H new ATOM 558 N VAL A 415 -23.062 -5.635 -6.935 1.00 0.00 N ATOM 559 CA VAL A 415 -22.952 -7.078 -7.140 1.00 0.00 C ATOM 560 C VAL A 415 -24.179 -7.586 -7.901 1.00 0.00 C ATOM 561 O VAL A 415 -24.147 -8.637 -8.549 1.00 0.00 O ATOM 562 CB VAL A 415 -22.794 -7.824 -5.790 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.699 -9.332 -5.983 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.566 -7.317 -5.053 1.00 0.00 C ATOM 0 H VAL A 415 -23.203 -5.351 -5.965 1.00 0.00 H new ATOM 0 HA VAL A 415 -22.059 -7.279 -7.732 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.685 -7.621 -5.196 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.589 -9.817 -5.013 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.605 -9.694 -6.469 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.835 -9.565 -6.605 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.465 -7.848 -4.106 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.679 -7.490 -5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.672 -6.249 -4.861 1.00 0.00 H new ATOM 574 N ALA A 416 -25.246 -6.803 -7.841 1.00 0.00 N ATOM 575 CA ALA A 416 -26.487 -7.124 -8.524 1.00 0.00 C ATOM 576 C ALA A 416 -26.418 -6.720 -9.994 1.00 0.00 C ATOM 577 O ALA A 416 -27.159 -7.240 -10.826 1.00 0.00 O ATOM 578 CB ALA A 416 -27.644 -6.418 -7.844 1.00 0.00 C ATOM 0 H ALA A 416 -25.274 -5.928 -7.317 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.642 -8.202 -8.473 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.573 -6.662 -8.360 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.709 -6.743 -6.806 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.483 -5.340 -7.877 1.00 0.00 H new ATOM 584 N GLN A 417 -25.511 -5.800 -10.306 1.00 0.00 N ATOM 585 CA GLN A 417 -25.340 -5.324 -11.670 1.00 0.00 C ATOM 586 C GLN A 417 -24.083 -5.933 -12.241 1.00 0.00 C ATOM 587 O GLN A 417 -23.762 -5.758 -13.415 1.00 0.00 O ATOM 588 CB GLN A 417 -25.227 -3.797 -11.720 1.00 0.00 C ATOM 589 CG GLN A 417 -26.472 -3.063 -11.256 1.00 0.00 C ATOM 590 CD GLN A 417 -26.361 -1.561 -11.431 1.00 0.00 C ATOM 591 OE1 GLN A 417 -25.264 -0.996 -11.414 1.00 0.00 O ATOM 592 NE2 GLN A 417 -27.496 -0.901 -11.597 1.00 0.00 N ATOM 0 H GLN A 417 -24.882 -5.369 -9.628 1.00 0.00 H new ATOM 0 HA GLN A 417 -26.213 -5.618 -12.253 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.385 -3.486 -11.102 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -25.001 -3.494 -12.742 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -27.334 -3.428 -11.815 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.653 -3.291 -10.206 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -28.383 -1.405 -11.605 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -27.484 0.112 -11.717 1.00 0.00 H new ATOM 601 N MET A 418 -23.368 -6.644 -11.385 1.00 0.00 N ATOM 602 CA MET A 418 -22.146 -7.281 -11.778 1.00 0.00 C ATOM 603 C MET A 418 -22.472 -8.607 -12.423 1.00 0.00 C ATOM 604 O MET A 418 -23.321 -9.373 -11.944 1.00 0.00 O ATOM 605 CB MET A 418 -21.206 -7.433 -10.577 1.00 0.00 C ATOM 606 CG MET A 418 -21.070 -8.843 -10.047 1.00 0.00 C ATOM 607 SD MET A 418 -20.389 -8.887 -8.380 1.00 0.00 S ATOM 608 CE MET A 418 -18.914 -7.899 -8.598 1.00 0.00 C ATOM 0 H MET A 418 -23.625 -6.789 -10.409 1.00 0.00 H new ATOM 0 HA MET A 418 -21.620 -6.665 -12.507 1.00 0.00 H new ATOM 0 HB2 MET A 418 -20.218 -7.070 -10.860 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.563 -6.791 -9.772 1.00 0.00 H new ATOM 0 HG2 MET A 418 -22.047 -9.325 -10.050 1.00 0.00 H new ATOM 0 HG3 MET A 418 -20.428 -9.419 -10.714 1.00 0.00 H new ATOM 0 HE1 MET A 418 -18.183 -8.163 -7.834 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.492 -8.088 -9.585 1.00 0.00 H new ATOM 0 HE3 MET A 418 -19.167 -6.843 -8.508 1.00 0.00 H new ATOM 618 N THR A 419 -21.795 -8.857 -13.504 1.00 0.00 N ATOM 619 CA THR A 419 -21.996 -10.071 -14.286 1.00 0.00 C ATOM 620 C THR A 419 -21.417 -11.275 -13.557 1.00 0.00 C ATOM 621 O THR A 419 -20.750 -11.108 -12.538 1.00 0.00 O ATOM 622 CB THR A 419 -21.337 -9.943 -15.676 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.911 -9.909 -15.547 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.816 -8.689 -16.392 1.00 0.00 C ATOM 0 H THR A 419 -21.083 -8.232 -13.881 1.00 0.00 H new ATOM 0 HA THR A 419 -23.069 -10.212 -14.416 1.00 0.00 H new ATOM 0 HB THR A 419 -21.626 -10.812 -16.267 1.00 0.00 H new ATOM 0 HG1 THR A 419 -19.499 -10.160 -16.400 1.00 0.00 H new ATOM 0 HG21 THR A 419 -21.337 -8.622 -17.369 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.897 -8.734 -16.521 1.00 0.00 H new ATOM 0 HG23 THR A 419 -21.557 -7.811 -15.800 1.00 0.00 H new ATOM 632 N PRO A 420 -21.706 -12.509 -14.018 1.00 0.00 N ATOM 633 CA PRO A 420 -21.147 -13.714 -13.404 1.00 0.00 C ATOM 634 C PRO A 420 -19.628 -13.613 -13.325 1.00 0.00 C ATOM 635 O PRO A 420 -19.033 -13.857 -12.281 1.00 0.00 O ATOM 636 CB PRO A 420 -21.573 -14.836 -14.354 1.00 0.00 C ATOM 637 CG PRO A 420 -22.796 -14.317 -15.025 1.00 0.00 C ATOM 638 CD PRO A 420 -22.607 -12.829 -15.142 1.00 0.00 C ATOM 0 HA PRO A 420 -21.494 -13.876 -12.383 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -20.790 -15.061 -15.077 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -21.780 -15.758 -13.811 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -22.925 -14.772 -16.007 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -23.688 -14.552 -14.445 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -22.167 -12.554 -16.101 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -23.554 -12.296 -15.062 1.00 0.00 H new ATOM 646 N GLU A 421 -19.020 -13.194 -14.431 1.00 0.00 N ATOM 647 CA GLU A 421 -17.572 -13.028 -14.500 1.00 0.00 C ATOM 648 C GLU A 421 -17.097 -12.086 -13.400 1.00 0.00 C ATOM 649 O GLU A 421 -16.149 -12.389 -12.677 1.00 0.00 O ATOM 650 CB GLU A 421 -17.143 -12.462 -15.859 1.00 0.00 C ATOM 651 CG GLU A 421 -17.854 -13.077 -17.053 1.00 0.00 C ATOM 652 CD GLU A 421 -19.198 -12.433 -17.312 1.00 0.00 C ATOM 653 OE1 GLU A 421 -19.226 -11.275 -17.771 1.00 0.00 O ATOM 654 OE2 GLU A 421 -20.226 -13.073 -17.018 1.00 0.00 O ATOM 0 H GLU A 421 -19.510 -12.962 -15.295 1.00 0.00 H new ATOM 0 HA GLU A 421 -17.121 -14.011 -14.368 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -17.320 -11.386 -15.862 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -16.069 -12.609 -15.977 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -17.227 -12.975 -17.939 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -17.992 -14.145 -16.881 1.00 0.00 H new ATOM 661 N GLU A 422 -17.771 -10.947 -13.274 1.00 0.00 N ATOM 662 CA GLU A 422 -17.429 -9.951 -12.277 1.00 0.00 C ATOM 663 C GLU A 422 -17.721 -10.462 -10.868 1.00 0.00 C ATOM 664 O GLU A 422 -16.929 -10.261 -9.950 1.00 0.00 O ATOM 665 CB GLU A 422 -18.201 -8.676 -12.587 1.00 0.00 C ATOM 666 CG GLU A 422 -17.784 -8.068 -13.914 1.00 0.00 C ATOM 667 CD GLU A 422 -18.566 -6.829 -14.266 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.764 -6.755 -13.906 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.987 -5.917 -14.896 1.00 0.00 O ATOM 0 H GLU A 422 -18.566 -10.694 -13.860 1.00 0.00 H new ATOM 0 HA GLU A 422 -16.360 -9.740 -12.313 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -19.269 -8.894 -12.608 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -18.039 -7.951 -11.789 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.723 -7.823 -13.877 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.913 -8.809 -14.703 1.00 0.00 H new ATOM 676 N LYS A 423 -18.864 -11.113 -10.707 1.00 0.00 N ATOM 677 CA LYS A 423 -19.266 -11.685 -9.425 1.00 0.00 C ATOM 678 C LYS A 423 -18.255 -12.701 -8.934 1.00 0.00 C ATOM 679 O LYS A 423 -17.748 -12.590 -7.820 1.00 0.00 O ATOM 680 CB LYS A 423 -20.629 -12.358 -9.558 1.00 0.00 C ATOM 681 CG LYS A 423 -21.277 -12.698 -8.229 1.00 0.00 C ATOM 682 CD LYS A 423 -22.706 -13.178 -8.413 1.00 0.00 C ATOM 683 CE LYS A 423 -23.693 -12.022 -8.399 1.00 0.00 C ATOM 684 NZ LYS A 423 -23.518 -11.112 -9.565 1.00 0.00 N ATOM 0 H LYS A 423 -19.539 -11.261 -11.457 1.00 0.00 H new ATOM 0 HA LYS A 423 -19.322 -10.872 -8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -21.295 -11.702 -10.119 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -20.517 -13.272 -10.141 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.695 -13.470 -7.726 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -21.267 -11.820 -7.583 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -22.790 -13.717 -9.357 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -22.959 -13.882 -7.620 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -24.709 -12.416 -8.398 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -23.570 -11.454 -7.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -24.104 -10.263 -9.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -22.519 -10.834 -9.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -23.809 -11.602 -10.435 1.00 0.00 H new ATOM 698 N GLU A 424 -17.945 -13.666 -9.781 1.00 0.00 N ATOM 699 CA GLU A 424 -17.007 -14.718 -9.429 1.00 0.00 C ATOM 700 C GLU A 424 -15.633 -14.120 -9.195 1.00 0.00 C ATOM 701 O GLU A 424 -14.863 -14.601 -8.366 1.00 0.00 O ATOM 702 CB GLU A 424 -16.968 -15.792 -10.518 1.00 0.00 C ATOM 703 CG GLU A 424 -18.030 -16.874 -10.344 1.00 0.00 C ATOM 704 CD GLU A 424 -19.454 -16.337 -10.397 1.00 0.00 C ATOM 705 OE1 GLU A 424 -19.935 -15.811 -9.369 1.00 0.00 O ATOM 706 OE2 GLU A 424 -20.092 -16.443 -11.465 1.00 0.00 O ATOM 0 H GLU A 424 -18.331 -13.743 -10.722 1.00 0.00 H new ATOM 0 HA GLU A 424 -17.336 -15.198 -8.507 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -17.100 -15.317 -11.490 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -15.983 -16.258 -10.522 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -17.904 -17.626 -11.123 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -17.874 -17.376 -9.389 1.00 0.00 H new ATOM 713 N ALA A 425 -15.341 -13.052 -9.924 1.00 0.00 N ATOM 714 CA ALA A 425 -14.084 -12.348 -9.777 1.00 0.00 C ATOM 715 C ALA A 425 -14.033 -11.692 -8.403 1.00 0.00 C ATOM 716 O ALA A 425 -13.034 -11.785 -7.691 1.00 0.00 O ATOM 717 CB ALA A 425 -13.937 -11.311 -10.875 1.00 0.00 C ATOM 0 H ALA A 425 -15.965 -12.655 -10.627 1.00 0.00 H new ATOM 0 HA ALA A 425 -13.257 -13.052 -9.863 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.989 -10.787 -10.756 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -13.959 -11.804 -11.847 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -14.757 -10.596 -10.812 1.00 0.00 H new ATOM 723 N TYR A 426 -15.133 -11.041 -8.035 1.00 0.00 N ATOM 724 CA TYR A 426 -15.257 -10.385 -6.747 1.00 0.00 C ATOM 725 C TYR A 426 -15.210 -11.421 -5.629 1.00 0.00 C ATOM 726 O TYR A 426 -14.547 -11.222 -4.613 1.00 0.00 O ATOM 727 CB TYR A 426 -16.573 -9.597 -6.702 1.00 0.00 C ATOM 728 CG TYR A 426 -17.067 -9.264 -5.312 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.569 -8.170 -4.620 1.00 0.00 C ATOM 730 CD2 TYR A 426 -18.033 -10.048 -4.697 1.00 0.00 C ATOM 731 CE1 TYR A 426 -17.020 -7.867 -3.351 1.00 0.00 C ATOM 732 CE2 TYR A 426 -18.488 -9.752 -3.429 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.980 -8.663 -2.760 1.00 0.00 C ATOM 734 OH TYR A 426 -18.430 -8.373 -1.494 1.00 0.00 O ATOM 0 H TYR A 426 -15.961 -10.956 -8.625 1.00 0.00 H new ATOM 0 HA TYR A 426 -14.427 -9.693 -6.607 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.443 -8.669 -7.258 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -17.342 -10.172 -7.217 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.817 -7.546 -5.081 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -18.435 -10.903 -5.220 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.624 -7.012 -2.824 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -19.240 -10.372 -2.964 1.00 0.00 H new ATOM 0 HH TYR A 426 -19.105 -9.031 -1.228 1.00 0.00 H new ATOM 744 N ILE A 427 -15.908 -12.531 -5.837 1.00 0.00 N ATOM 745 CA ILE A 427 -15.949 -13.607 -4.860 1.00 0.00 C ATOM 746 C ILE A 427 -14.555 -14.208 -4.673 1.00 0.00 C ATOM 747 O ILE A 427 -14.103 -14.415 -3.546 1.00 0.00 O ATOM 748 CB ILE A 427 -16.958 -14.706 -5.273 1.00 0.00 C ATOM 749 CG1 ILE A 427 -18.386 -14.148 -5.226 1.00 0.00 C ATOM 750 CG2 ILE A 427 -16.834 -15.928 -4.370 1.00 0.00 C ATOM 751 CD1 ILE A 427 -19.413 -15.024 -5.913 1.00 0.00 C ATOM 0 H ILE A 427 -16.456 -12.708 -6.679 1.00 0.00 H new ATOM 0 HA ILE A 427 -16.283 -13.186 -3.912 1.00 0.00 H new ATOM 0 HB ILE A 427 -16.731 -15.018 -6.293 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -18.678 -14.012 -4.185 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -18.395 -13.162 -5.691 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -17.554 -16.685 -4.681 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -15.825 -16.334 -4.444 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -17.034 -15.640 -3.338 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -20.397 -14.560 -5.836 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -19.148 -15.140 -6.964 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -19.435 -16.003 -5.434 1.00 0.00 H new ATOM 763 N ALA A 428 -13.871 -14.464 -5.785 1.00 0.00 N ATOM 764 CA ALA A 428 -12.523 -15.022 -5.748 1.00 0.00 C ATOM 765 C ALA A 428 -11.561 -14.047 -5.076 1.00 0.00 C ATOM 766 O ALA A 428 -10.677 -14.450 -4.318 1.00 0.00 O ATOM 767 CB ALA A 428 -12.046 -15.359 -7.152 1.00 0.00 C ATOM 0 H ALA A 428 -14.229 -14.293 -6.725 1.00 0.00 H new ATOM 0 HA ALA A 428 -12.547 -15.942 -5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -11.039 -15.774 -7.104 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -12.719 -16.091 -7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -12.037 -14.455 -7.760 1.00 0.00 H new ATOM 773 N MET A 429 -11.743 -12.763 -5.357 1.00 0.00 N ATOM 774 CA MET A 429 -10.910 -11.725 -4.766 1.00 0.00 C ATOM 775 C MET A 429 -11.192 -11.620 -3.275 1.00 0.00 C ATOM 776 O MET A 429 -10.302 -11.319 -2.481 1.00 0.00 O ATOM 777 CB MET A 429 -11.160 -10.380 -5.452 1.00 0.00 C ATOM 778 CG MET A 429 -10.358 -10.197 -6.729 1.00 0.00 C ATOM 779 SD MET A 429 -9.802 -8.499 -6.951 1.00 0.00 S ATOM 780 CE MET A 429 -11.291 -7.607 -6.516 1.00 0.00 C ATOM 0 H MET A 429 -12.462 -12.416 -5.992 1.00 0.00 H new ATOM 0 HA MET A 429 -9.863 -11.992 -4.909 1.00 0.00 H new ATOM 0 HB2 MET A 429 -12.222 -10.289 -5.682 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.914 -9.576 -4.759 1.00 0.00 H new ATOM 0 HG2 MET A 429 -9.493 -10.860 -6.710 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.967 -10.492 -7.583 1.00 0.00 H new ATOM 0 HE1 MET A 429 -11.328 -6.669 -7.070 1.00 0.00 H new ATOM 0 HE2 MET A 429 -12.163 -8.211 -6.766 1.00 0.00 H new ATOM 0 HE3 MET A 429 -11.290 -7.397 -5.446 1.00 0.00 H new ATOM 790 N GLY A 430 -12.438 -11.890 -2.908 1.00 0.00 N ATOM 791 CA GLY A 430 -12.838 -11.844 -1.523 1.00 0.00 C ATOM 792 C GLY A 430 -12.196 -12.956 -0.740 1.00 0.00 C ATOM 793 O GLY A 430 -11.751 -12.745 0.381 1.00 0.00 O ATOM 0 H GLY A 430 -13.184 -12.142 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -12.559 -10.883 -1.092 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.923 -11.923 -1.451 1.00 0.00 H new ATOM 797 N GLN A 431 -12.132 -14.137 -1.357 1.00 0.00 N ATOM 798 CA GLN A 431 -11.523 -15.316 -0.744 1.00 0.00 C ATOM 799 C GLN A 431 -10.130 -14.979 -0.225 1.00 0.00 C ATOM 800 O GLN A 431 -9.738 -15.402 0.860 1.00 0.00 O ATOM 801 CB GLN A 431 -11.450 -16.456 -1.773 1.00 0.00 C ATOM 802 CG GLN A 431 -10.755 -17.720 -1.275 1.00 0.00 C ATOM 803 CD GLN A 431 -9.247 -17.692 -1.474 1.00 0.00 C ATOM 804 OE1 GLN A 431 -8.738 -17.094 -2.429 1.00 0.00 O ATOM 805 NE2 GLN A 431 -8.526 -18.333 -0.572 1.00 0.00 N ATOM 0 H GLN A 431 -12.500 -14.302 -2.294 1.00 0.00 H new ATOM 0 HA GLN A 431 -12.136 -15.638 0.098 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -12.463 -16.713 -2.083 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -10.927 -16.095 -2.659 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -10.973 -17.853 -0.215 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -11.168 -18.584 -1.796 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -8.986 -18.814 0.201 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -7.509 -18.347 -0.648 1.00 0.00 H new ATOM 814 N ARG A 432 -9.405 -14.190 -1.008 1.00 0.00 N ATOM 815 CA ARG A 432 -8.056 -13.783 -0.654 1.00 0.00 C ATOM 816 C ARG A 432 -8.026 -13.098 0.705 1.00 0.00 C ATOM 817 O ARG A 432 -7.266 -13.481 1.585 1.00 0.00 O ATOM 818 CB ARG A 432 -7.502 -12.840 -1.713 1.00 0.00 C ATOM 819 CG ARG A 432 -5.998 -12.911 -1.838 1.00 0.00 C ATOM 820 CD ARG A 432 -5.584 -13.703 -3.067 1.00 0.00 C ATOM 821 NE ARG A 432 -6.102 -15.071 -3.026 1.00 0.00 N ATOM 822 CZ ARG A 432 -5.340 -16.146 -2.849 1.00 0.00 C ATOM 823 NH1 ARG A 432 -4.022 -16.017 -2.767 1.00 0.00 N ATOM 824 NH2 ARG A 432 -5.894 -17.347 -2.756 1.00 0.00 N ATOM 0 H ARG A 432 -9.734 -13.818 -1.899 1.00 0.00 H new ATOM 0 HA ARG A 432 -7.437 -14.679 -0.601 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -7.953 -13.079 -2.676 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -7.793 -11.818 -1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -5.588 -11.903 -1.897 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -5.578 -13.374 -0.945 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -5.949 -13.202 -3.963 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -4.496 -13.727 -3.136 1.00 0.00 H new ATOM 0 HE ARG A 432 -7.106 -15.208 -3.140 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -3.594 -15.094 -2.840 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -3.436 -16.841 -2.631 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -6.907 -17.448 -2.820 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -5.307 -18.170 -2.620 1.00 0.00 H new ATOM 838 N MET A 433 -8.868 -12.090 0.875 1.00 0.00 N ATOM 839 CA MET A 433 -8.929 -11.357 2.132 1.00 0.00 C ATOM 840 C MET A 433 -9.651 -12.177 3.188 1.00 0.00 C ATOM 841 O MET A 433 -9.383 -12.050 4.377 1.00 0.00 O ATOM 842 CB MET A 433 -9.640 -10.019 1.938 1.00 0.00 C ATOM 843 CG MET A 433 -8.820 -8.996 1.171 1.00 0.00 C ATOM 844 SD MET A 433 -9.847 -7.738 0.394 1.00 0.00 S ATOM 845 CE MET A 433 -10.839 -8.746 -0.700 1.00 0.00 C ATOM 0 H MET A 433 -9.517 -11.761 0.161 1.00 0.00 H new ATOM 0 HA MET A 433 -7.909 -11.167 2.467 1.00 0.00 H new ATOM 0 HB2 MET A 433 -10.578 -10.190 1.409 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.895 -9.608 2.915 1.00 0.00 H new ATOM 0 HG2 MET A 433 -8.114 -8.517 1.850 1.00 0.00 H new ATOM 0 HG3 MET A 433 -8.232 -9.504 0.407 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.949 -8.241 -1.660 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.351 -9.709 -0.850 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.823 -8.903 -0.258 1.00 0.00 H new ATOM 855 N PHE A 434 -10.558 -13.029 2.738 1.00 0.00 N ATOM 856 CA PHE A 434 -11.335 -13.880 3.627 1.00 0.00 C ATOM 857 C PHE A 434 -10.430 -14.806 4.439 1.00 0.00 C ATOM 858 O PHE A 434 -10.713 -15.089 5.603 1.00 0.00 O ATOM 859 CB PHE A 434 -12.358 -14.686 2.818 1.00 0.00 C ATOM 860 CG PHE A 434 -13.678 -13.984 2.659 1.00 0.00 C ATOM 861 CD1 PHE A 434 -14.081 -13.018 3.567 1.00 0.00 C ATOM 862 CD2 PHE A 434 -14.511 -14.285 1.593 1.00 0.00 C ATOM 863 CE1 PHE A 434 -15.290 -12.366 3.416 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.719 -13.636 1.435 1.00 0.00 C ATOM 865 CZ PHE A 434 -16.110 -12.675 2.348 1.00 0.00 C ATOM 0 H PHE A 434 -10.777 -13.151 1.749 1.00 0.00 H new ATOM 0 HA PHE A 434 -11.869 -13.244 4.333 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -11.946 -14.897 1.831 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.522 -15.646 3.307 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -13.443 -12.772 4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -14.211 -15.036 0.877 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -15.593 -11.616 4.132 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -16.358 -13.879 0.599 1.00 0.00 H new ATOM 0 HZ PHE A 434 -17.055 -12.166 2.227 1.00 0.00 H new ATOM 875 N GLU A 435 -9.339 -15.256 3.835 1.00 0.00 N ATOM 876 CA GLU A 435 -8.400 -16.136 4.524 1.00 0.00 C ATOM 877 C GLU A 435 -7.123 -15.393 4.858 1.00 0.00 C ATOM 878 O GLU A 435 -6.122 -15.988 5.256 1.00 0.00 O ATOM 879 CB GLU A 435 -8.094 -17.375 3.678 1.00 0.00 C ATOM 880 CG GLU A 435 -9.285 -18.305 3.501 1.00 0.00 C ATOM 881 CD GLU A 435 -9.034 -19.380 2.462 1.00 0.00 C ATOM 882 OE1 GLU A 435 -8.059 -20.145 2.614 1.00 0.00 O ATOM 883 OE2 GLU A 435 -9.812 -19.459 1.488 1.00 0.00 O ATOM 0 H GLU A 435 -9.081 -15.029 2.875 1.00 0.00 H new ATOM 0 HA GLU A 435 -8.863 -16.465 5.455 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -7.744 -17.056 2.696 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -7.278 -17.929 4.143 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -9.520 -18.775 4.456 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -10.158 -17.721 3.211 1.00 0.00 H new ATOM 890 N ASP A 436 -7.187 -14.084 4.728 1.00 0.00 N ATOM 891 CA ASP A 436 -6.046 -13.236 5.017 1.00 0.00 C ATOM 892 C ASP A 436 -6.503 -11.859 5.470 1.00 0.00 C ATOM 893 O ASP A 436 -6.154 -10.841 4.871 1.00 0.00 O ATOM 894 CB ASP A 436 -5.124 -13.110 3.805 1.00 0.00 C ATOM 895 CG ASP A 436 -3.692 -12.843 4.215 1.00 0.00 C ATOM 896 OD1 ASP A 436 -3.368 -11.688 4.557 1.00 0.00 O ATOM 897 OD2 ASP A 436 -2.883 -13.787 4.210 1.00 0.00 O ATOM 0 H ASP A 436 -8.020 -13.581 4.423 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.484 -13.705 5.824 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -5.169 -14.027 3.217 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -5.475 -12.302 3.163 1.00 0.00 H new ATOM 1036 N GLU B 7 7.420 -6.685 -12.565 1.00 0.00 N ATOM 1037 CA GLU B 7 6.563 -5.628 -13.074 1.00 0.00 C ATOM 1038 C GLU B 7 6.649 -4.380 -12.196 1.00 0.00 C ATOM 1039 O GLU B 7 5.957 -4.276 -11.187 1.00 0.00 O ATOM 1040 CB GLU B 7 5.099 -6.113 -13.180 1.00 0.00 C ATOM 1041 CG GLU B 7 4.647 -7.002 -12.022 1.00 0.00 C ATOM 1042 CD GLU B 7 3.190 -7.440 -12.116 1.00 0.00 C ATOM 1043 OE1 GLU B 7 2.734 -7.768 -13.229 1.00 0.00 O ATOM 1044 OE2 GLU B 7 2.500 -7.476 -11.064 1.00 0.00 O ATOM 0 HA GLU B 7 6.914 -5.366 -14.072 1.00 0.00 H new ATOM 0 HB2 GLU B 7 4.443 -5.244 -13.233 1.00 0.00 H new ATOM 0 HB3 GLU B 7 4.977 -6.662 -14.114 1.00 0.00 H new ATOM 0 HG2 GLU B 7 5.281 -7.888 -11.987 1.00 0.00 H new ATOM 0 HG3 GLU B 7 4.796 -6.466 -11.085 1.00 0.00 H new ATOM 1051 N VAL B 8 7.537 -3.450 -12.553 1.00 0.00 N ATOM 1052 CA VAL B 8 7.654 -2.205 -11.805 1.00 0.00 C ATOM 1053 C VAL B 8 6.355 -1.443 -11.933 1.00 0.00 C ATOM 1054 O VAL B 8 5.919 -1.102 -13.032 1.00 0.00 O ATOM 1055 CB VAL B 8 8.824 -1.332 -12.263 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.716 0.058 -11.650 1.00 0.00 C ATOM 1057 CG2 VAL B 8 10.114 -1.993 -11.842 1.00 0.00 C ATOM 0 H VAL B 8 8.175 -3.536 -13.344 1.00 0.00 H new ATOM 0 HA VAL B 8 7.857 -2.460 -10.765 1.00 0.00 H new ATOM 0 HB VAL B 8 8.803 -1.226 -13.348 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.555 0.669 -11.984 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.781 0.522 -11.964 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.735 -0.021 -10.563 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.958 -1.381 -12.162 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.132 -2.097 -10.757 1.00 0.00 H new ATOM 0 HG23 VAL B 8 10.185 -2.978 -12.302 1.00 0.00 H new ATOM 1067 N LEU B 9 5.751 -1.192 -10.803 1.00 0.00 N ATOM 1068 CA LEU B 9 4.473 -0.533 -10.748 1.00 0.00 C ATOM 1069 C LEU B 9 4.622 0.969 -10.759 1.00 0.00 C ATOM 1070 O LEU B 9 4.084 1.651 -11.628 1.00 0.00 O ATOM 1071 CB LEU B 9 3.747 -1.001 -9.490 1.00 0.00 C ATOM 1072 CG LEU B 9 4.055 -2.451 -9.121 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.808 -2.727 -7.657 1.00 0.00 C ATOM 1074 CD2 LEU B 9 3.239 -3.390 -9.974 1.00 0.00 C ATOM 0 H LEU B 9 6.133 -1.440 -9.890 1.00 0.00 H new ATOM 0 HA LEU B 9 3.892 -0.795 -11.633 1.00 0.00 H new ATOM 0 HB2 LEU B 9 4.023 -0.354 -8.657 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.673 -0.891 -9.636 1.00 0.00 H new ATOM 0 HG LEU B 9 5.115 -2.619 -9.311 1.00 0.00 H new ATOM 0 HD11 LEU B 9 4.040 -3.770 -7.439 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.444 -2.080 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.762 -2.531 -7.421 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.467 -4.420 -9.702 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.178 -3.199 -9.813 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.481 -3.230 -11.025 1.00 0.00 H new ATOM 1086 N LEU B 10 5.351 1.486 -9.796 1.00 0.00 N ATOM 1087 CA LEU B 10 5.529 2.918 -9.711 1.00 0.00 C ATOM 1088 C LEU B 10 6.909 3.315 -9.221 1.00 0.00 C ATOM 1089 O LEU B 10 7.436 2.755 -8.259 1.00 0.00 O ATOM 1090 CB LEU B 10 4.479 3.487 -8.783 1.00 0.00 C ATOM 1091 CG LEU B 10 4.207 4.976 -8.932 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.374 5.250 -10.176 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.513 5.493 -7.688 1.00 0.00 C ATOM 0 H LEU B 10 5.824 0.946 -9.071 1.00 0.00 H new ATOM 0 HA LEU B 10 5.423 3.323 -10.718 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.546 2.948 -8.945 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.785 3.293 -7.755 1.00 0.00 H new ATOM 0 HG LEU B 10 5.155 5.501 -9.048 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.191 6.321 -10.263 1.00 0.00 H new ATOM 0 HD12 LEU B 10 3.911 4.901 -11.058 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.422 4.725 -10.099 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.319 6.560 -7.797 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.569 4.965 -7.552 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.151 5.327 -6.820 1.00 0.00 H new ATOM 1105 N ILE B 11 7.484 4.276 -9.915 1.00 0.00 N ATOM 1106 CA ILE B 11 8.777 4.828 -9.568 1.00 0.00 C ATOM 1107 C ILE B 11 8.596 6.241 -9.031 1.00 0.00 C ATOM 1108 O ILE B 11 8.393 7.185 -9.800 1.00 0.00 O ATOM 1109 CB ILE B 11 9.709 4.868 -10.794 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.037 3.451 -11.261 1.00 0.00 C ATOM 1111 CG2 ILE B 11 10.978 5.640 -10.478 1.00 0.00 C ATOM 1112 CD1 ILE B 11 10.716 3.401 -12.611 1.00 0.00 C ATOM 0 H ILE B 11 7.063 4.699 -10.742 1.00 0.00 H new ATOM 0 HA ILE B 11 9.230 4.191 -8.808 1.00 0.00 H new ATOM 0 HB ILE B 11 9.193 5.384 -11.603 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.680 2.974 -10.522 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.116 2.870 -11.305 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.622 5.656 -11.357 1.00 0.00 H new ATOM 0 HG22 ILE B 11 10.722 6.661 -10.197 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.502 5.157 -9.653 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.919 2.364 -12.878 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.065 3.849 -13.362 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.654 3.954 -12.567 1.00 0.00 H new ATOM 1124 N VAL B 12 8.651 6.396 -7.718 1.00 0.00 N ATOM 1125 CA VAL B 12 8.490 7.703 -7.117 1.00 0.00 C ATOM 1126 C VAL B 12 9.844 8.282 -6.789 1.00 0.00 C ATOM 1127 O VAL B 12 10.736 7.557 -6.396 1.00 0.00 O ATOM 1128 CB VAL B 12 7.652 7.629 -5.835 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.325 9.017 -5.320 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.391 6.839 -6.082 1.00 0.00 C ATOM 0 H VAL B 12 8.805 5.637 -7.055 1.00 0.00 H new ATOM 0 HA VAL B 12 7.971 8.340 -7.833 1.00 0.00 H new ATOM 0 HB VAL B 12 8.237 7.119 -5.070 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.730 8.937 -4.410 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.250 9.552 -5.103 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.760 9.562 -6.076 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.805 6.794 -5.164 1.00 0.00 H new ATOM 0 HG22 VAL B 12 5.805 7.323 -6.863 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.651 5.828 -6.397 1.00 0.00 H new ATOM 1140 N LYS B 13 9.998 9.578 -6.972 1.00 0.00 N ATOM 1141 CA LYS B 13 11.264 10.243 -6.684 1.00 0.00 C ATOM 1142 C LYS B 13 11.047 11.295 -5.609 1.00 0.00 C ATOM 1143 O LYS B 13 9.904 11.592 -5.262 1.00 0.00 O ATOM 1144 CB LYS B 13 11.898 10.854 -7.936 1.00 0.00 C ATOM 1145 CG LYS B 13 12.643 9.854 -8.812 1.00 0.00 C ATOM 1146 CD LYS B 13 11.729 8.789 -9.387 1.00 0.00 C ATOM 1147 CE LYS B 13 10.790 9.356 -10.434 1.00 0.00 C ATOM 1148 NZ LYS B 13 9.449 9.705 -9.875 1.00 0.00 N ATOM 0 H LYS B 13 9.265 10.197 -7.319 1.00 0.00 H new ATOM 0 HA LYS B 13 11.967 9.494 -6.321 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.117 11.329 -8.530 1.00 0.00 H new ATOM 0 HB3 LYS B 13 12.590 11.640 -7.632 1.00 0.00 H new ATOM 0 HG2 LYS B 13 13.134 10.386 -9.627 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.428 9.376 -8.225 1.00 0.00 H new ATOM 0 HD2 LYS B 13 12.330 7.995 -9.830 1.00 0.00 H new ATOM 0 HD3 LYS B 13 11.147 8.337 -8.584 1.00 0.00 H new ATOM 0 HE2 LYS B 13 11.239 10.246 -10.875 1.00 0.00 H new ATOM 0 HE3 LYS B 13 10.667 8.630 -11.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 8.852 10.104 -10.628 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 8.999 8.849 -9.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 9.561 10.406 -9.115 1.00 0.00 H new ATOM 1162 N LYS B 14 12.140 11.848 -5.093 1.00 0.00 N ATOM 1163 CA LYS B 14 12.084 12.820 -4.009 1.00 0.00 C ATOM 1164 C LYS B 14 11.378 12.227 -2.798 1.00 0.00 C ATOM 1165 O LYS B 14 10.775 12.931 -1.986 1.00 0.00 O ATOM 1166 CB LYS B 14 11.422 14.108 -4.471 1.00 0.00 C ATOM 1167 CG LYS B 14 12.397 15.152 -4.994 1.00 0.00 C ATOM 1168 CD LYS B 14 13.072 14.715 -6.280 1.00 0.00 C ATOM 1169 CE LYS B 14 14.525 15.165 -6.324 1.00 0.00 C ATOM 1170 NZ LYS B 14 15.401 14.311 -5.474 1.00 0.00 N ATOM 0 H LYS B 14 13.085 11.636 -5.413 1.00 0.00 H new ATOM 0 HA LYS B 14 13.103 13.068 -3.711 1.00 0.00 H new ATOM 0 HB2 LYS B 14 10.702 13.873 -5.255 1.00 0.00 H new ATOM 0 HB3 LYS B 14 10.861 14.534 -3.640 1.00 0.00 H new ATOM 0 HG2 LYS B 14 11.866 16.089 -5.165 1.00 0.00 H new ATOM 0 HG3 LYS B 14 13.156 15.349 -4.237 1.00 0.00 H new ATOM 0 HD2 LYS B 14 13.023 13.630 -6.368 1.00 0.00 H new ATOM 0 HD3 LYS B 14 12.535 15.129 -7.134 1.00 0.00 H new ATOM 0 HE2 LYS B 14 14.882 15.138 -7.354 1.00 0.00 H new ATOM 0 HE3 LYS B 14 14.594 16.200 -5.990 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 16.297 14.130 -5.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 15.595 14.798 -4.576 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 14.923 13.407 -5.281 1.00 0.00 H new ATOM 1184 N VAL B 15 11.476 10.912 -2.691 1.00 0.00 N ATOM 1185 CA VAL B 15 10.886 10.178 -1.594 1.00 0.00 C ATOM 1186 C VAL B 15 11.851 10.240 -0.421 1.00 0.00 C ATOM 1187 O VAL B 15 12.843 9.525 -0.386 1.00 0.00 O ATOM 1188 CB VAL B 15 10.604 8.713 -2.015 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.688 8.016 -1.027 1.00 0.00 C ATOM 1190 CG2 VAL B 15 9.979 8.688 -3.389 1.00 0.00 C ATOM 0 H VAL B 15 11.969 10.327 -3.366 1.00 0.00 H new ATOM 0 HA VAL B 15 9.931 10.618 -1.307 1.00 0.00 H new ATOM 0 HB VAL B 15 11.555 8.180 -2.030 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.512 6.991 -1.354 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.155 8.007 -0.042 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.738 8.548 -0.974 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.783 7.656 -3.681 1.00 0.00 H new ATOM 0 HG22 VAL B 15 9.042 9.245 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.660 9.145 -4.107 1.00 0.00 H new ATOM 1200 N ARG B 16 11.569 11.117 0.525 1.00 0.00 N ATOM 1201 CA ARG B 16 12.441 11.317 1.666 1.00 0.00 C ATOM 1202 C ARG B 16 12.180 10.342 2.798 1.00 0.00 C ATOM 1203 O ARG B 16 11.052 10.151 3.238 1.00 0.00 O ATOM 1204 CB ARG B 16 12.321 12.755 2.182 1.00 0.00 C ATOM 1205 CG ARG B 16 13.313 13.699 1.531 1.00 0.00 C ATOM 1206 CD ARG B 16 12.778 15.113 1.393 1.00 0.00 C ATOM 1207 NE ARG B 16 13.681 15.939 0.591 1.00 0.00 N ATOM 1208 CZ ARG B 16 13.359 17.119 0.070 1.00 0.00 C ATOM 1209 NH1 ARG B 16 12.172 17.661 0.313 1.00 0.00 N ATOM 1210 NH2 ARG B 16 14.237 17.756 -0.696 1.00 0.00 N ATOM 0 H ARG B 16 10.736 11.706 0.524 1.00 0.00 H new ATOM 0 HA ARG B 16 13.455 11.129 1.313 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.309 13.118 2.001 1.00 0.00 H new ATOM 0 HB3 ARG B 16 12.474 12.763 3.261 1.00 0.00 H new ATOM 0 HG2 ARG B 16 14.230 13.718 2.121 1.00 0.00 H new ATOM 0 HG3 ARG B 16 13.577 13.318 0.545 1.00 0.00 H new ATOM 0 HD2 ARG B 16 11.792 15.089 0.928 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.654 15.557 2.381 1.00 0.00 H new ATOM 0 HE ARG B 16 14.622 15.585 0.420 1.00 0.00 H new ATOM 0 HH11 ARG B 16 11.499 17.172 0.903 1.00 0.00 H new ATOM 0 HH12 ARG B 16 11.933 18.567 -0.090 1.00 0.00 H new ATOM 0 HH21 ARG B 16 15.150 17.340 -0.880 1.00 0.00 H new ATOM 0 HH22 ARG B 16 13.999 18.662 -1.100 1.00 0.00 H new ATOM 1224 N GLN B 17 13.250 9.709 3.229 1.00 0.00 N ATOM 1225 CA GLN B 17 13.224 8.794 4.352 1.00 0.00 C ATOM 1226 C GLN B 17 14.334 9.232 5.288 1.00 0.00 C ATOM 1227 O GLN B 17 15.501 9.189 4.914 1.00 0.00 O ATOM 1228 CB GLN B 17 13.426 7.345 3.898 1.00 0.00 C ATOM 1229 CG GLN B 17 13.345 6.342 5.039 1.00 0.00 C ATOM 1230 CD GLN B 17 14.710 5.905 5.535 1.00 0.00 C ATOM 1231 OE1 GLN B 17 15.636 5.696 4.749 1.00 0.00 O ATOM 1232 NE2 GLN B 17 14.855 5.792 6.845 1.00 0.00 N ATOM 0 H GLN B 17 14.172 9.816 2.806 1.00 0.00 H new ATOM 0 HA GLN B 17 12.255 8.822 4.851 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.672 7.097 3.151 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.398 7.255 3.413 1.00 0.00 H new ATOM 0 HG2 GLN B 17 12.787 6.783 5.865 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.786 5.467 4.708 1.00 0.00 H new ATOM 0 HE21 GLN B 17 14.064 5.973 7.463 1.00 0.00 H new ATOM 0 HE22 GLN B 17 15.758 5.523 7.237 1.00 0.00 H new ATOM 1241 N LYS B 18 13.971 9.696 6.475 1.00 0.00 N ATOM 1242 CA LYS B 18 14.946 10.197 7.442 1.00 0.00 C ATOM 1243 C LYS B 18 15.640 11.460 6.908 1.00 0.00 C ATOM 1244 O LYS B 18 16.806 11.708 7.205 1.00 0.00 O ATOM 1245 CB LYS B 18 15.978 9.122 7.804 1.00 0.00 C ATOM 1246 CG LYS B 18 16.103 8.869 9.301 1.00 0.00 C ATOM 1247 CD LYS B 18 16.913 9.954 10.002 1.00 0.00 C ATOM 1248 CE LYS B 18 16.018 10.953 10.723 1.00 0.00 C ATOM 1249 NZ LYS B 18 16.783 11.805 11.673 1.00 0.00 N ATOM 0 H LYS B 18 13.004 9.737 6.796 1.00 0.00 H new ATOM 0 HA LYS B 18 14.407 10.458 8.353 1.00 0.00 H new ATOM 0 HB2 LYS B 18 15.707 8.190 7.309 1.00 0.00 H new ATOM 0 HB3 LYS B 18 16.951 9.419 7.413 1.00 0.00 H new ATOM 0 HG2 LYS B 18 15.108 8.817 9.743 1.00 0.00 H new ATOM 0 HG3 LYS B 18 16.576 7.901 9.466 1.00 0.00 H new ATOM 0 HD2 LYS B 18 17.594 9.494 10.718 1.00 0.00 H new ATOM 0 HD3 LYS B 18 17.527 10.479 9.270 1.00 0.00 H new ATOM 0 HE2 LYS B 18 15.518 11.586 9.990 1.00 0.00 H new ATOM 0 HE3 LYS B 18 15.239 10.416 11.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 16.135 12.470 12.142 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 17.239 11.204 12.388 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 17.510 12.337 11.154 1.00 0.00 H new ATOM 1263 N LYS B 19 14.895 12.233 6.104 1.00 0.00 N ATOM 1264 CA LYS B 19 15.353 13.515 5.526 1.00 0.00 C ATOM 1265 C LYS B 19 16.221 13.385 4.267 1.00 0.00 C ATOM 1266 O LYS B 19 16.869 14.352 3.876 1.00 0.00 O ATOM 1267 CB LYS B 19 16.086 14.376 6.563 1.00 0.00 C ATOM 1268 CG LYS B 19 15.296 15.596 7.004 1.00 0.00 C ATOM 1269 CD LYS B 19 14.033 15.193 7.744 1.00 0.00 C ATOM 1270 CE LYS B 19 14.364 14.469 9.033 1.00 0.00 C ATOM 1271 NZ LYS B 19 13.194 13.733 9.560 1.00 0.00 N ATOM 0 H LYS B 19 13.944 11.986 5.830 1.00 0.00 H new ATOM 0 HA LYS B 19 14.430 14.006 5.216 1.00 0.00 H new ATOM 0 HB2 LYS B 19 16.313 13.765 7.436 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.039 14.701 6.145 1.00 0.00 H new ATOM 0 HG2 LYS B 19 15.915 16.220 7.649 1.00 0.00 H new ATOM 0 HG3 LYS B 19 15.035 16.198 6.133 1.00 0.00 H new ATOM 0 HD2 LYS B 19 13.438 16.079 7.964 1.00 0.00 H new ATOM 0 HD3 LYS B 19 13.425 14.550 7.108 1.00 0.00 H new ATOM 0 HE2 LYS B 19 15.185 13.773 8.860 1.00 0.00 H new ATOM 0 HE3 LYS B 19 14.708 15.188 9.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 13.457 13.249 10.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 12.420 14.401 9.749 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 12.882 13.030 8.860 1.00 0.00 H new ATOM 1285 N GLN B 20 16.231 12.232 3.616 1.00 0.00 N ATOM 1286 CA GLN B 20 17.013 12.086 2.387 1.00 0.00 C ATOM 1287 C GLN B 20 16.082 11.681 1.262 1.00 0.00 C ATOM 1288 O GLN B 20 15.431 10.637 1.341 1.00 0.00 O ATOM 1289 CB GLN B 20 18.156 11.070 2.536 1.00 0.00 C ATOM 1290 CG GLN B 20 17.968 10.077 3.666 1.00 0.00 C ATOM 1291 CD GLN B 20 18.376 8.668 3.285 1.00 0.00 C ATOM 1292 OE1 GLN B 20 19.286 8.461 2.482 1.00 0.00 O ATOM 1293 NE2 GLN B 20 17.693 7.688 3.850 1.00 0.00 N ATOM 0 H GLN B 20 15.720 11.398 3.905 1.00 0.00 H new ATOM 0 HA GLN B 20 17.481 13.044 2.163 1.00 0.00 H new ATOM 0 HB2 GLN B 20 18.262 10.521 1.600 1.00 0.00 H new ATOM 0 HB3 GLN B 20 19.088 11.611 2.696 1.00 0.00 H new ATOM 0 HG2 GLN B 20 18.553 10.399 4.527 1.00 0.00 H new ATOM 0 HG3 GLN B 20 16.922 10.077 3.973 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.946 7.902 4.511 1.00 0.00 H new ATOM 0 HE22 GLN B 20 17.913 6.718 3.625 1.00 0.00 H new ATOM 1302 N ASP B 21 15.979 12.520 0.234 1.00 0.00 N ATOM 1303 CA ASP B 21 15.083 12.223 -0.872 1.00 0.00 C ATOM 1304 C ASP B 21 15.670 11.233 -1.839 1.00 0.00 C ATOM 1305 O ASP B 21 16.663 11.488 -2.519 1.00 0.00 O ATOM 1306 CB ASP B 21 14.610 13.470 -1.634 1.00 0.00 C ATOM 1307 CG ASP B 21 15.637 14.573 -1.768 1.00 0.00 C ATOM 1308 OD1 ASP B 21 15.988 15.188 -0.736 1.00 0.00 O ATOM 1309 OD2 ASP B 21 16.048 14.862 -2.912 1.00 0.00 O ATOM 0 H ASP B 21 16.496 13.395 0.147 1.00 0.00 H new ATOM 0 HA ASP B 21 14.209 11.776 -0.398 1.00 0.00 H new ATOM 0 HB2 ASP B 21 14.293 13.167 -2.632 1.00 0.00 H new ATOM 0 HB3 ASP B 21 13.732 13.873 -1.129 1.00 0.00 H new ATOM 1314 N GLY B 22 15.049 10.084 -1.858 1.00 0.00 N ATOM 1315 CA GLY B 22 15.432 9.045 -2.750 1.00 0.00 C ATOM 1316 C GLY B 22 14.296 8.721 -3.674 1.00 0.00 C ATOM 1317 O GLY B 22 13.644 9.616 -4.204 1.00 0.00 O ATOM 0 H GLY B 22 14.263 9.851 -1.251 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.305 9.352 -3.326 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.718 8.157 -2.186 1.00 0.00 H new ATOM 1321 N ALA B 23 14.020 7.457 -3.829 1.00 0.00 N ATOM 1322 CA ALA B 23 12.963 7.032 -4.696 1.00 0.00 C ATOM 1323 C ALA B 23 12.263 5.812 -4.143 1.00 0.00 C ATOM 1324 O ALA B 23 12.904 4.867 -3.681 1.00 0.00 O ATOM 1325 CB ALA B 23 13.518 6.756 -6.071 1.00 0.00 C ATOM 0 H ALA B 23 14.518 6.699 -3.361 1.00 0.00 H new ATOM 0 HA ALA B 23 12.223 7.830 -4.765 1.00 0.00 H new ATOM 0 HB1 ALA B 23 12.713 6.432 -6.730 1.00 0.00 H new ATOM 0 HB2 ALA B 23 13.971 7.664 -6.470 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.272 5.972 -6.008 1.00 0.00 H new ATOM 1331 N LEU B 24 10.945 5.849 -4.185 1.00 0.00 N ATOM 1332 CA LEU B 24 10.142 4.757 -3.699 1.00 0.00 C ATOM 1333 C LEU B 24 9.711 3.930 -4.899 1.00 0.00 C ATOM 1334 O LEU B 24 8.877 4.356 -5.699 1.00 0.00 O ATOM 1335 CB LEU B 24 8.927 5.273 -2.936 1.00 0.00 C ATOM 1336 CG LEU B 24 8.459 4.373 -1.794 1.00 0.00 C ATOM 1337 CD1 LEU B 24 6.966 4.507 -1.574 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.831 2.928 -2.048 1.00 0.00 C ATOM 0 H LEU B 24 10.409 6.634 -4.555 1.00 0.00 H new ATOM 0 HA LEU B 24 10.720 4.146 -3.006 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.161 6.258 -2.532 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.103 5.404 -3.638 1.00 0.00 H new ATOM 0 HG LEU B 24 8.969 4.699 -0.887 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.659 3.856 -0.756 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.726 5.541 -1.325 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.437 4.221 -2.483 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.485 2.312 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.363 2.589 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.914 2.841 -2.137 1.00 0.00 H new ATOM 1350 N TYR B 25 10.307 2.770 -5.030 1.00 0.00 N ATOM 1351 CA TYR B 25 10.023 1.886 -6.145 1.00 0.00 C ATOM 1352 C TYR B 25 9.075 0.758 -5.775 1.00 0.00 C ATOM 1353 O TYR B 25 9.421 -0.122 -4.986 1.00 0.00 O ATOM 1354 CB TYR B 25 11.318 1.266 -6.657 1.00 0.00 C ATOM 1355 CG TYR B 25 12.073 2.114 -7.641 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.518 3.379 -7.299 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.347 1.639 -8.912 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.215 4.152 -8.198 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.047 2.401 -9.819 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.481 3.659 -9.459 1.00 0.00 C ATOM 1361 OH TYR B 25 14.180 4.426 -10.364 1.00 0.00 O ATOM 0 H TYR B 25 10.999 2.409 -4.373 1.00 0.00 H new ATOM 0 HA TYR B 25 9.546 2.498 -6.911 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.966 1.057 -5.806 1.00 0.00 H new ATOM 0 HB3 TYR B 25 11.087 0.309 -7.125 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.315 3.765 -6.311 1.00 0.00 H new ATOM 0 HD2 TYR B 25 12.006 0.655 -9.196 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.552 5.139 -7.919 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.255 2.016 -10.806 1.00 0.00 H new ATOM 0 HH TYR B 25 14.282 3.930 -11.203 1.00 0.00 H new ATOM 1371 N LEU B 26 7.880 0.780 -6.340 1.00 0.00 N ATOM 1372 CA LEU B 26 6.943 -0.302 -6.113 1.00 0.00 C ATOM 1373 C LEU B 26 7.173 -1.315 -7.201 1.00 0.00 C ATOM 1374 O LEU B 26 6.819 -1.067 -8.352 1.00 0.00 O ATOM 1375 CB LEU B 26 5.477 0.125 -6.194 1.00 0.00 C ATOM 1376 CG LEU B 26 5.139 1.493 -5.647 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.741 1.887 -6.081 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.222 1.505 -4.140 1.00 0.00 C ATOM 0 H LEU B 26 7.541 1.524 -6.950 1.00 0.00 H new ATOM 0 HA LEU B 26 7.115 -0.682 -5.106 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.169 0.091 -7.239 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.877 -0.613 -5.661 1.00 0.00 H new ATOM 0 HG LEU B 26 5.861 2.208 -6.040 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.501 2.874 -5.685 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.691 1.911 -7.170 1.00 0.00 H new ATOM 0 HD13 LEU B 26 3.024 1.159 -5.701 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.975 2.500 -3.770 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.518 0.780 -3.731 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.233 1.243 -3.829 1.00 0.00 H new ATOM 1390 N MET B 27 7.796 -2.419 -6.876 1.00 0.00 N ATOM 1391 CA MET B 27 8.028 -3.426 -7.878 1.00 0.00 C ATOM 1392 C MET B 27 6.963 -4.488 -7.793 1.00 0.00 C ATOM 1393 O MET B 27 6.143 -4.453 -6.874 1.00 0.00 O ATOM 1394 CB MET B 27 9.434 -4.013 -7.779 1.00 0.00 C ATOM 1395 CG MET B 27 10.455 -3.274 -8.628 1.00 0.00 C ATOM 1396 SD MET B 27 12.074 -3.159 -7.845 1.00 0.00 S ATOM 1397 CE MET B 27 11.698 -2.032 -6.514 1.00 0.00 C ATOM 0 H MET B 27 8.146 -2.641 -5.944 1.00 0.00 H new ATOM 0 HA MET B 27 7.965 -2.958 -8.860 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.756 -3.994 -6.738 1.00 0.00 H new ATOM 0 HB3 MET B 27 9.406 -5.059 -8.085 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.557 -3.782 -9.587 1.00 0.00 H new ATOM 0 HG3 MET B 27 10.087 -2.270 -8.837 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.497 -1.296 -6.424 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.757 -1.523 -6.723 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.610 -2.588 -5.580 1.00 0.00 H new ATOM 1407 N ALA B 28 7.067 -5.477 -8.671 1.00 0.00 N ATOM 1408 CA ALA B 28 6.052 -6.511 -8.826 1.00 0.00 C ATOM 1409 C ALA B 28 5.410 -6.944 -7.516 1.00 0.00 C ATOM 1410 O ALA B 28 4.198 -6.852 -7.357 1.00 0.00 O ATOM 1411 CB ALA B 28 6.649 -7.721 -9.506 1.00 0.00 C ATOM 0 H ALA B 28 7.863 -5.585 -9.300 1.00 0.00 H new ATOM 0 HA ALA B 28 5.264 -6.069 -9.435 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.884 -8.490 -9.618 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.025 -7.437 -10.489 1.00 0.00 H new ATOM 0 HB3 ALA B 28 7.469 -8.110 -8.902 1.00 0.00 H new ATOM 1417 N GLU B 29 6.224 -7.380 -6.575 1.00 0.00 N ATOM 1418 CA GLU B 29 5.724 -7.802 -5.279 1.00 0.00 C ATOM 1419 C GLU B 29 6.696 -7.387 -4.203 1.00 0.00 C ATOM 1420 O GLU B 29 6.682 -7.903 -3.081 1.00 0.00 O ATOM 1421 CB GLU B 29 5.500 -9.313 -5.237 1.00 0.00 C ATOM 1422 CG GLU B 29 6.601 -10.136 -5.882 1.00 0.00 C ATOM 1423 CD GLU B 29 6.260 -11.609 -5.885 1.00 0.00 C ATOM 1424 OE1 GLU B 29 6.443 -12.270 -4.841 1.00 0.00 O ATOM 1425 OE2 GLU B 29 5.766 -12.113 -6.913 1.00 0.00 O ATOM 0 H GLU B 29 7.236 -7.452 -6.683 1.00 0.00 H new ATOM 0 HA GLU B 29 4.762 -7.319 -5.106 1.00 0.00 H new ATOM 0 HB2 GLU B 29 5.396 -9.622 -4.197 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.557 -9.541 -5.733 1.00 0.00 H new ATOM 0 HG2 GLU B 29 6.759 -9.796 -6.905 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.537 -9.979 -5.345 1.00 0.00 H new ATOM 1432 N ARG B 30 7.509 -6.410 -4.540 1.00 0.00 N ATOM 1433 CA ARG B 30 8.517 -5.927 -3.624 1.00 0.00 C ATOM 1434 C ARG B 30 8.619 -4.417 -3.699 1.00 0.00 C ATOM 1435 O ARG B 30 8.819 -3.851 -4.767 1.00 0.00 O ATOM 1436 CB ARG B 30 9.870 -6.569 -3.951 1.00 0.00 C ATOM 1437 CG ARG B 30 10.107 -6.762 -5.444 1.00 0.00 C ATOM 1438 CD ARG B 30 11.435 -7.446 -5.722 1.00 0.00 C ATOM 1439 NE ARG B 30 12.571 -6.600 -5.352 1.00 0.00 N ATOM 1440 CZ ARG B 30 13.366 -5.991 -6.234 1.00 0.00 C ATOM 1441 NH1 ARG B 30 13.159 -6.138 -7.539 1.00 0.00 N ATOM 1442 NH2 ARG B 30 14.370 -5.230 -5.810 1.00 0.00 N ATOM 0 H ARG B 30 7.491 -5.935 -5.442 1.00 0.00 H new ATOM 0 HA ARG B 30 8.231 -6.203 -2.609 1.00 0.00 H new ATOM 0 HB2 ARG B 30 10.666 -5.947 -3.542 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.934 -7.537 -3.453 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.297 -7.356 -5.867 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.086 -5.793 -5.943 1.00 0.00 H new ATOM 0 HD2 ARG B 30 11.484 -8.383 -5.168 1.00 0.00 H new ATOM 0 HD3 ARG B 30 11.499 -7.698 -6.780 1.00 0.00 H new ATOM 0 HE ARG B 30 12.767 -6.468 -4.360 1.00 0.00 H new ATOM 0 HH11 ARG B 30 12.389 -6.719 -7.871 1.00 0.00 H new ATOM 0 HH12 ARG B 30 13.770 -5.670 -8.208 1.00 0.00 H new ATOM 0 HH21 ARG B 30 14.533 -5.111 -4.810 1.00 0.00 H new ATOM 0 HH22 ARG B 30 14.977 -4.765 -6.485 1.00 0.00 H new ATOM 1456 N ILE B 31 8.479 -3.771 -2.565 1.00 0.00 N ATOM 1457 CA ILE B 31 8.577 -2.333 -2.506 1.00 0.00 C ATOM 1458 C ILE B 31 9.954 -1.971 -1.976 1.00 0.00 C ATOM 1459 O ILE B 31 10.309 -2.303 -0.843 1.00 0.00 O ATOM 1460 CB ILE B 31 7.449 -1.707 -1.648 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.735 -0.234 -1.367 1.00 0.00 C ATOM 1462 CG2 ILE B 31 7.247 -2.477 -0.349 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.499 0.559 -1.010 1.00 0.00 C ATOM 0 H ILE B 31 8.296 -4.221 -1.668 1.00 0.00 H new ATOM 0 HA ILE B 31 8.449 -1.921 -3.507 1.00 0.00 H new ATOM 0 HB ILE B 31 6.523 -1.773 -2.219 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.454 -0.160 -0.551 1.00 0.00 H new ATOM 0 HG13 ILE B 31 8.203 0.212 -2.245 1.00 0.00 H new ATOM 0 HG21 ILE B 31 6.449 -2.012 0.229 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.977 -3.508 -0.576 1.00 0.00 H new ATOM 0 HG23 ILE B 31 8.170 -2.462 0.230 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.774 1.597 -0.823 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.788 0.515 -1.835 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.042 0.138 -0.114 1.00 0.00 H new ATOM 1475 N ALA B 32 10.747 -1.333 -2.817 1.00 0.00 N ATOM 1476 CA ALA B 32 12.099 -0.977 -2.440 1.00 0.00 C ATOM 1477 C ALA B 32 12.378 0.500 -2.657 1.00 0.00 C ATOM 1478 O ALA B 32 12.052 1.066 -3.694 1.00 0.00 O ATOM 1479 CB ALA B 32 13.099 -1.827 -3.206 1.00 0.00 C ATOM 0 H ALA B 32 10.479 -1.053 -3.760 1.00 0.00 H new ATOM 0 HA ALA B 32 12.207 -1.174 -1.373 1.00 0.00 H new ATOM 0 HB1 ALA B 32 14.112 -1.550 -2.914 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.931 -2.880 -2.979 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.972 -1.662 -4.276 1.00 0.00 H new ATOM 1485 N TRP B 33 12.981 1.104 -1.660 1.00 0.00 N ATOM 1486 CA TRP B 33 13.329 2.507 -1.694 1.00 0.00 C ATOM 1487 C TRP B 33 14.845 2.664 -1.684 1.00 0.00 C ATOM 1488 O TRP B 33 15.554 1.882 -1.044 1.00 0.00 O ATOM 1489 CB TRP B 33 12.703 3.193 -0.470 1.00 0.00 C ATOM 1490 CG TRP B 33 13.030 4.654 -0.300 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.187 5.709 -0.474 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.285 5.218 0.101 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.845 6.885 -0.204 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.129 6.608 0.149 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.520 4.676 0.418 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.166 7.464 0.508 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.551 5.510 0.765 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.371 6.901 0.811 1.00 0.00 C ATOM 0 H TRP B 33 13.246 0.633 -0.795 1.00 0.00 H new ATOM 0 HA TRP B 33 12.948 2.970 -2.604 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.620 3.087 -0.532 1.00 0.00 H new ATOM 0 HB3 TRP B 33 13.025 2.661 0.425 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.154 5.633 -0.779 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.435 7.818 -0.260 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.669 3.607 0.392 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.022 8.534 0.545 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.516 5.090 1.007 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.199 7.535 1.091 1.00 0.00 H new ATOM 1509 N ALA B 34 15.331 3.666 -2.400 1.00 0.00 N ATOM 1510 CA ALA B 34 16.756 3.976 -2.449 1.00 0.00 C ATOM 1511 C ALA B 34 16.927 5.472 -2.632 1.00 0.00 C ATOM 1512 O ALA B 34 16.093 6.094 -3.265 1.00 0.00 O ATOM 1513 CB ALA B 34 17.434 3.227 -3.566 1.00 0.00 C ATOM 0 H ALA B 34 14.752 4.288 -2.964 1.00 0.00 H new ATOM 0 HA ALA B 34 17.222 3.664 -1.515 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.495 3.476 -3.580 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.315 2.155 -3.410 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.983 3.507 -4.518 1.00 0.00 H new ATOM 1519 N PRO B 35 17.993 6.079 -2.094 1.00 0.00 N ATOM 1520 CA PRO B 35 18.203 7.522 -2.210 1.00 0.00 C ATOM 1521 C PRO B 35 18.597 7.914 -3.629 1.00 0.00 C ATOM 1522 O PRO B 35 19.188 7.107 -4.353 1.00 0.00 O ATOM 1523 CB PRO B 35 19.356 7.815 -1.237 1.00 0.00 C ATOM 1524 CG PRO B 35 19.628 6.534 -0.511 1.00 0.00 C ATOM 1525 CD PRO B 35 19.092 5.427 -1.374 1.00 0.00 C ATOM 0 HA PRO B 35 17.298 8.085 -1.981 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.242 8.153 -1.774 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.084 8.607 -0.539 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.697 6.407 -0.338 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.144 6.532 0.466 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.850 5.043 -2.056 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.742 4.584 -0.779 1.00 0.00 H new ATOM 1533 N GLU B 36 18.272 9.141 -4.036 1.00 0.00 N ATOM 1534 CA GLU B 36 18.618 9.598 -5.375 1.00 0.00 C ATOM 1535 C GLU B 36 20.109 9.916 -5.464 1.00 0.00 C ATOM 1536 O GLU B 36 20.518 11.076 -5.485 1.00 0.00 O ATOM 1537 CB GLU B 36 17.778 10.809 -5.771 1.00 0.00 C ATOM 1538 CG GLU B 36 16.491 10.436 -6.488 1.00 0.00 C ATOM 1539 CD GLU B 36 15.620 11.638 -6.769 1.00 0.00 C ATOM 1540 OE1 GLU B 36 15.969 12.441 -7.654 1.00 0.00 O ATOM 1541 OE2 GLU B 36 14.592 11.804 -6.084 1.00 0.00 O ATOM 0 H GLU B 36 17.777 9.825 -3.465 1.00 0.00 H new ATOM 0 HA GLU B 36 18.398 8.794 -6.078 1.00 0.00 H new ATOM 0 HB2 GLU B 36 17.535 11.383 -4.877 1.00 0.00 H new ATOM 0 HB3 GLU B 36 18.370 11.459 -6.415 1.00 0.00 H new ATOM 0 HG2 GLU B 36 16.732 9.938 -7.427 1.00 0.00 H new ATOM 0 HG3 GLU B 36 15.935 9.721 -5.882 1.00 0.00 H new ATOM 1548 N GLY B 37 20.910 8.862 -5.493 1.00 0.00 N ATOM 1549 CA GLY B 37 22.345 9.007 -5.576 1.00 0.00 C ATOM 1550 C GLY B 37 23.064 7.801 -5.007 1.00 0.00 C ATOM 1551 O GLY B 37 24.076 7.935 -4.321 1.00 0.00 O ATOM 0 H GLY B 37 20.584 7.896 -5.460 1.00 0.00 H new ATOM 0 HA2 GLY B 37 22.637 9.147 -6.617 1.00 0.00 H new ATOM 0 HA3 GLY B 37 22.652 9.902 -5.035 1.00 0.00 H new ATOM 1555 N LYS B 38 22.536 6.614 -5.284 1.00 0.00 N ATOM 1556 CA LYS B 38 23.135 5.389 -4.796 1.00 0.00 C ATOM 1557 C LYS B 38 23.041 4.304 -5.863 1.00 0.00 C ATOM 1558 O LYS B 38 22.698 4.582 -7.010 1.00 0.00 O ATOM 1559 CB LYS B 38 22.462 4.938 -3.492 1.00 0.00 C ATOM 1560 CG LYS B 38 23.365 4.110 -2.576 1.00 0.00 C ATOM 1561 CD LYS B 38 24.573 4.903 -2.085 1.00 0.00 C ATOM 1562 CE LYS B 38 25.774 4.764 -3.018 1.00 0.00 C ATOM 1563 NZ LYS B 38 26.365 3.397 -2.984 1.00 0.00 N ATOM 0 H LYS B 38 21.694 6.480 -5.844 1.00 0.00 H new ATOM 0 HA LYS B 38 24.187 5.573 -4.580 1.00 0.00 H new ATOM 0 HB2 LYS B 38 22.121 5.819 -2.948 1.00 0.00 H new ATOM 0 HB3 LYS B 38 21.576 4.352 -3.737 1.00 0.00 H new ATOM 0 HG2 LYS B 38 22.789 3.762 -1.719 1.00 0.00 H new ATOM 0 HG3 LYS B 38 23.707 3.224 -3.111 1.00 0.00 H new ATOM 0 HD2 LYS B 38 24.303 5.955 -1.998 1.00 0.00 H new ATOM 0 HD3 LYS B 38 24.849 4.561 -1.088 1.00 0.00 H new ATOM 0 HE2 LYS B 38 25.468 4.999 -4.037 1.00 0.00 H new ATOM 0 HE3 LYS B 38 26.535 5.493 -2.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 26.875 3.217 -3.872 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 27.026 3.324 -2.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 25.607 2.694 -2.872 1.00 0.00 H new ATOM 1577 N ASP B 39 23.337 3.079 -5.470 1.00 0.00 N ATOM 1578 CA ASP B 39 23.330 1.941 -6.375 1.00 0.00 C ATOM 1579 C ASP B 39 22.354 0.873 -5.899 1.00 0.00 C ATOM 1580 O ASP B 39 21.483 0.424 -6.643 1.00 0.00 O ATOM 1581 CB ASP B 39 24.744 1.348 -6.450 1.00 0.00 C ATOM 1582 CG ASP B 39 25.542 1.592 -5.174 1.00 0.00 C ATOM 1583 OD1 ASP B 39 25.001 1.359 -4.062 1.00 0.00 O ATOM 1584 OD2 ASP B 39 26.691 2.070 -5.264 1.00 0.00 O ATOM 0 H ASP B 39 23.590 2.843 -4.511 1.00 0.00 H new ATOM 0 HA ASP B 39 23.013 2.280 -7.361 1.00 0.00 H new ATOM 0 HB2 ASP B 39 24.677 0.276 -6.634 1.00 0.00 H new ATOM 0 HB3 ASP B 39 25.274 1.784 -7.297 1.00 0.00 H new ATOM 1589 N ARG B 40 22.509 0.481 -4.651 1.00 0.00 N ATOM 1590 CA ARG B 40 21.672 -0.547 -4.055 1.00 0.00 C ATOM 1591 C ARG B 40 20.557 0.071 -3.217 1.00 0.00 C ATOM 1592 O ARG B 40 20.747 1.110 -2.584 1.00 0.00 O ATOM 1593 CB ARG B 40 22.537 -1.475 -3.194 1.00 0.00 C ATOM 1594 CG ARG B 40 21.876 -2.801 -2.846 1.00 0.00 C ATOM 1595 CD ARG B 40 21.501 -2.868 -1.374 1.00 0.00 C ATOM 1596 NE ARG B 40 22.660 -2.681 -0.498 1.00 0.00 N ATOM 1597 CZ ARG B 40 22.658 -1.896 0.582 1.00 0.00 C ATOM 1598 NH1 ARG B 40 21.575 -1.198 0.902 1.00 0.00 N ATOM 1599 NH2 ARG B 40 23.749 -1.803 1.337 1.00 0.00 N ATOM 0 H ARG B 40 23.215 0.862 -4.021 1.00 0.00 H new ATOM 0 HA ARG B 40 21.206 -1.125 -4.853 1.00 0.00 H new ATOM 0 HB2 ARG B 40 23.470 -1.675 -3.720 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.796 -0.958 -2.270 1.00 0.00 H new ATOM 0 HG2 ARG B 40 20.983 -2.935 -3.456 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.553 -3.621 -3.088 1.00 0.00 H new ATOM 0 HD2 ARG B 40 20.756 -2.103 -1.156 1.00 0.00 H new ATOM 0 HD3 ARG B 40 21.040 -3.832 -1.162 1.00 0.00 H new ATOM 0 HE ARG B 40 23.520 -3.180 -0.727 1.00 0.00 H new ATOM 0 HH11 ARG B 40 20.739 -1.260 0.322 1.00 0.00 H new ATOM 0 HH12 ARG B 40 21.579 -0.600 1.728 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.586 -2.331 1.091 1.00 0.00 H new ATOM 0 HH22 ARG B 40 23.749 -1.204 2.162 1.00 0.00 H new ATOM 1613 N PHE B 41 19.394 -0.580 -3.223 1.00 0.00 N ATOM 1614 CA PHE B 41 18.239 -0.114 -2.462 1.00 0.00 C ATOM 1615 C PHE B 41 18.529 -0.151 -0.966 1.00 0.00 C ATOM 1616 O PHE B 41 19.265 -1.013 -0.487 1.00 0.00 O ATOM 1617 CB PHE B 41 17.012 -0.974 -2.775 1.00 0.00 C ATOM 1618 CG PHE B 41 16.493 -0.805 -4.176 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.741 0.306 -4.519 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.752 -1.761 -5.146 1.00 0.00 C ATOM 1621 CE1 PHE B 41 15.256 0.463 -5.803 1.00 0.00 C ATOM 1622 CE2 PHE B 41 16.270 -1.608 -6.433 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.521 -0.495 -6.762 1.00 0.00 C ATOM 0 H PHE B 41 19.228 -1.437 -3.751 1.00 0.00 H new ATOM 0 HA PHE B 41 18.034 0.916 -2.753 1.00 0.00 H new ATOM 0 HB2 PHE B 41 17.264 -2.022 -2.615 1.00 0.00 H new ATOM 0 HB3 PHE B 41 16.217 -0.727 -2.071 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.531 1.059 -3.774 1.00 0.00 H new ATOM 0 HD2 PHE B 41 17.336 -2.634 -4.894 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.670 1.334 -6.057 1.00 0.00 H new ATOM 0 HE2 PHE B 41 16.479 -2.359 -7.181 1.00 0.00 H new ATOM 0 HZ PHE B 41 15.144 -0.374 -7.767 1.00 0.00 H new ATOM 1633 N THR B 42 17.936 0.772 -0.235 1.00 0.00 N ATOM 1634 CA THR B 42 18.139 0.862 1.200 1.00 0.00 C ATOM 1635 C THR B 42 17.046 0.119 1.962 1.00 0.00 C ATOM 1636 O THR B 42 17.323 -0.628 2.899 1.00 0.00 O ATOM 1637 CB THR B 42 18.157 2.339 1.648 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.257 3.023 1.032 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.257 2.457 3.161 1.00 0.00 C ATOM 0 H THR B 42 17.304 1.477 -0.614 1.00 0.00 H new ATOM 0 HA THR B 42 19.099 0.398 1.426 1.00 0.00 H new ATOM 0 HB THR B 42 17.220 2.798 1.334 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.262 3.960 1.319 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.267 3.510 3.444 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.400 1.966 3.622 1.00 0.00 H new ATOM 0 HG23 THR B 42 19.176 1.980 3.503 1.00 0.00 H new ATOM 1647 N ILE B 43 15.810 0.313 1.537 1.00 0.00 N ATOM 1648 CA ILE B 43 14.672 -0.304 2.195 1.00 0.00 C ATOM 1649 C ILE B 43 13.911 -1.218 1.238 1.00 0.00 C ATOM 1650 O ILE B 43 13.434 -0.775 0.199 1.00 0.00 O ATOM 1651 CB ILE B 43 13.736 0.790 2.756 1.00 0.00 C ATOM 1652 CG1 ILE B 43 14.283 1.318 4.083 1.00 0.00 C ATOM 1653 CG2 ILE B 43 12.315 0.276 2.929 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.652 2.621 4.516 1.00 0.00 C ATOM 0 H ILE B 43 15.568 0.896 0.735 1.00 0.00 H new ATOM 0 HA ILE B 43 15.040 -0.917 3.018 1.00 0.00 H new ATOM 0 HB ILE B 43 13.702 1.607 2.035 1.00 0.00 H new ATOM 0 HG12 ILE B 43 14.121 0.569 4.858 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.360 1.456 3.994 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.686 1.073 3.325 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.925 -0.048 1.964 1.00 0.00 H new ATOM 0 HG23 ILE B 43 12.314 -0.565 3.622 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.086 2.938 5.464 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.836 3.384 3.759 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.578 2.482 4.637 1.00 0.00 H new ATOM 1666 N SER B 44 13.849 -2.500 1.568 1.00 0.00 N ATOM 1667 CA SER B 44 13.139 -3.472 0.746 1.00 0.00 C ATOM 1668 C SER B 44 12.145 -4.282 1.572 1.00 0.00 C ATOM 1669 O SER B 44 12.520 -4.951 2.532 1.00 0.00 O ATOM 1670 CB SER B 44 14.136 -4.396 0.044 1.00 0.00 C ATOM 1671 OG SER B 44 15.055 -3.645 -0.732 1.00 0.00 O ATOM 0 H SER B 44 14.284 -2.893 2.403 1.00 0.00 H new ATOM 0 HA SER B 44 12.571 -2.926 -0.008 1.00 0.00 H new ATOM 0 HB2 SER B 44 14.675 -4.987 0.784 1.00 0.00 H new ATOM 0 HB3 SER B 44 13.601 -5.098 -0.596 1.00 0.00 H new ATOM 0 HG SER B 44 15.685 -4.253 -1.172 1.00 0.00 H new ATOM 1677 N HIS B 45 10.879 -4.211 1.184 1.00 0.00 N ATOM 1678 CA HIS B 45 9.816 -4.931 1.860 1.00 0.00 C ATOM 1679 C HIS B 45 8.969 -5.639 0.832 1.00 0.00 C ATOM 1680 O HIS B 45 8.858 -5.203 -0.313 1.00 0.00 O ATOM 1681 CB HIS B 45 8.939 -3.989 2.696 1.00 0.00 C ATOM 1682 CG HIS B 45 9.685 -3.248 3.761 1.00 0.00 C ATOM 1683 ND1 HIS B 45 10.233 -3.839 4.878 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.983 -1.931 3.852 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.837 -2.883 5.596 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.716 -1.706 5.015 1.00 0.00 N ATOM 0 H HIS B 45 10.563 -3.652 0.392 1.00 0.00 H new ATOM 0 HA HIS B 45 10.268 -5.654 2.540 1.00 0.00 H new ATOM 0 HB2 HIS B 45 8.463 -3.268 2.032 1.00 0.00 H new ATOM 0 HB3 HIS B 45 8.142 -4.569 3.161 1.00 0.00 H new ATOM 0 HD1 HIS B 45 10.187 -4.830 5.116 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.698 -1.174 3.136 1.00 0.00 H new ATOM 0 HE1 HIS B 45 11.355 -3.054 6.528 1.00 0.00 H new ATOM 1694 N MET B 46 8.404 -6.743 1.232 1.00 0.00 N ATOM 1695 CA MET B 46 7.562 -7.519 0.353 1.00 0.00 C ATOM 1696 C MET B 46 6.109 -7.336 0.747 1.00 0.00 C ATOM 1697 O MET B 46 5.777 -7.372 1.928 1.00 0.00 O ATOM 1698 CB MET B 46 7.961 -8.987 0.409 1.00 0.00 C ATOM 1699 CG MET B 46 9.150 -9.321 -0.477 1.00 0.00 C ATOM 1700 SD MET B 46 9.166 -11.045 -0.999 1.00 0.00 S ATOM 1701 CE MET B 46 7.855 -11.031 -2.220 1.00 0.00 C ATOM 0 H MET B 46 8.510 -7.132 2.169 1.00 0.00 H new ATOM 0 HA MET B 46 7.690 -7.172 -0.672 1.00 0.00 H new ATOM 0 HB2 MET B 46 8.198 -9.253 1.439 1.00 0.00 H new ATOM 0 HB3 MET B 46 7.110 -9.599 0.110 1.00 0.00 H new ATOM 0 HG2 MET B 46 9.133 -8.679 -1.358 1.00 0.00 H new ATOM 0 HG3 MET B 46 10.072 -9.100 0.061 1.00 0.00 H new ATOM 0 HE1 MET B 46 7.942 -11.911 -2.858 1.00 0.00 H new ATOM 0 HE2 MET B 46 6.888 -11.043 -1.716 1.00 0.00 H new ATOM 0 HE3 MET B 46 7.935 -10.131 -2.830 1.00 0.00 H new ATOM 1711 N TYR B 47 5.253 -7.145 -0.251 1.00 0.00 N ATOM 1712 CA TYR B 47 3.813 -6.929 -0.030 1.00 0.00 C ATOM 1713 C TYR B 47 3.199 -8.047 0.813 1.00 0.00 C ATOM 1714 O TYR B 47 2.161 -7.870 1.441 1.00 0.00 O ATOM 1715 CB TYR B 47 3.064 -6.844 -1.366 1.00 0.00 C ATOM 1716 CG TYR B 47 3.421 -5.652 -2.233 1.00 0.00 C ATOM 1717 CD1 TYR B 47 4.743 -5.299 -2.462 1.00 0.00 C ATOM 1718 CD2 TYR B 47 2.427 -4.890 -2.838 1.00 0.00 C ATOM 1719 CE1 TYR B 47 5.069 -4.224 -3.259 1.00 0.00 C ATOM 1720 CE2 TYR B 47 2.747 -3.814 -3.642 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.070 -3.486 -3.847 1.00 0.00 C ATOM 1722 OH TYR B 47 4.399 -2.422 -4.647 1.00 0.00 O ATOM 0 H TYR B 47 5.528 -7.134 -1.233 1.00 0.00 H new ATOM 0 HA TYR B 47 3.712 -5.986 0.508 1.00 0.00 H new ATOM 0 HB2 TYR B 47 3.258 -7.755 -1.932 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.993 -6.817 -1.163 1.00 0.00 H new ATOM 0 HD1 TYR B 47 5.532 -5.879 -2.006 1.00 0.00 H new ATOM 0 HD2 TYR B 47 1.390 -5.144 -2.677 1.00 0.00 H new ATOM 0 HE1 TYR B 47 6.104 -3.962 -3.421 1.00 0.00 H new ATOM 0 HE2 TYR B 47 1.965 -3.233 -4.108 1.00 0.00 H new ATOM 0 HH TYR B 47 5.292 -2.561 -5.025 1.00 0.00 H new ATOM 1732 N ALA B 48 3.853 -9.197 0.804 1.00 0.00 N ATOM 1733 CA ALA B 48 3.402 -10.363 1.550 1.00 0.00 C ATOM 1734 C ALA B 48 3.552 -10.177 3.061 1.00 0.00 C ATOM 1735 O ALA B 48 2.805 -10.774 3.840 1.00 0.00 O ATOM 1736 CB ALA B 48 4.167 -11.594 1.084 1.00 0.00 C ATOM 0 H ALA B 48 4.714 -9.350 0.278 1.00 0.00 H new ATOM 0 HA ALA B 48 2.338 -10.496 1.352 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.828 -12.466 1.643 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.988 -11.753 0.021 1.00 0.00 H new ATOM 0 HB3 ALA B 48 5.233 -11.446 1.254 1.00 0.00 H new ATOM 1742 N ASP B 49 4.514 -9.356 3.477 1.00 0.00 N ATOM 1743 CA ASP B 49 4.739 -9.109 4.898 1.00 0.00 C ATOM 1744 C ASP B 49 4.010 -7.852 5.338 1.00 0.00 C ATOM 1745 O ASP B 49 3.631 -7.722 6.497 1.00 0.00 O ATOM 1746 CB ASP B 49 6.246 -9.010 5.195 1.00 0.00 C ATOM 1747 CG ASP B 49 6.616 -7.836 6.093 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.369 -7.910 7.321 1.00 0.00 O ATOM 1749 OD2 ASP B 49 7.163 -6.844 5.567 1.00 0.00 O ATOM 0 H ASP B 49 5.146 -8.854 2.854 1.00 0.00 H new ATOM 0 HA ASP B 49 4.339 -9.948 5.467 1.00 0.00 H new ATOM 0 HB2 ASP B 49 6.576 -9.935 5.667 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.788 -8.921 4.254 1.00 0.00 H new ATOM 1754 N ILE B 50 3.786 -6.943 4.406 1.00 0.00 N ATOM 1755 CA ILE B 50 3.099 -5.706 4.721 1.00 0.00 C ATOM 1756 C ILE B 50 1.660 -5.982 5.148 1.00 0.00 C ATOM 1757 O ILE B 50 0.851 -6.488 4.372 1.00 0.00 O ATOM 1758 CB ILE B 50 3.115 -4.714 3.545 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.460 -4.763 2.822 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.859 -3.309 4.056 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.549 -3.821 1.644 1.00 0.00 C ATOM 0 H ILE B 50 4.068 -7.038 3.430 1.00 0.00 H new ATOM 0 HA ILE B 50 3.640 -5.247 5.549 1.00 0.00 H new ATOM 0 HB ILE B 50 2.330 -4.993 2.842 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.253 -4.521 3.530 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.640 -5.781 2.477 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.871 -2.610 3.220 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.886 -3.272 4.546 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.636 -3.034 4.770 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.531 -3.910 1.180 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.779 -4.076 0.916 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.401 -2.796 1.985 1.00 0.00 H new ATOM 1773 N LYS B 51 1.369 -5.657 6.398 1.00 0.00 N ATOM 1774 CA LYS B 51 0.054 -5.856 6.984 1.00 0.00 C ATOM 1775 C LYS B 51 -0.948 -4.869 6.408 1.00 0.00 C ATOM 1776 O LYS B 51 -1.972 -5.251 5.847 1.00 0.00 O ATOM 1777 CB LYS B 51 0.147 -5.671 8.502 1.00 0.00 C ATOM 1778 CG LYS B 51 -1.198 -5.565 9.197 1.00 0.00 C ATOM 1779 CD LYS B 51 -1.079 -4.834 10.523 1.00 0.00 C ATOM 1780 CE LYS B 51 -2.387 -4.881 11.288 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.230 -3.679 11.035 1.00 0.00 N ATOM 0 H LYS B 51 2.046 -5.244 7.040 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.287 -6.865 6.752 1.00 0.00 H new ATOM 0 HB2 LYS B 51 0.698 -6.510 8.926 1.00 0.00 H new ATOM 0 HB3 LYS B 51 0.725 -4.771 8.713 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -1.902 -5.040 8.552 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -1.603 -6.563 9.365 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -0.287 -5.285 11.121 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -0.794 -3.797 10.346 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -2.940 -5.777 11.005 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -2.179 -4.959 12.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.234 -3.931 11.136 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -2.989 -2.935 11.721 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.056 -3.330 10.071 1.00 0.00 H new ATOM 1795 N CYS B 52 -0.635 -3.598 6.561 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.490 -2.531 6.081 1.00 0.00 C ATOM 1797 C CYS B 52 -0.635 -1.328 5.761 1.00 0.00 C ATOM 1798 O CYS B 52 0.592 -1.387 5.834 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.527 -2.172 7.146 1.00 0.00 C ATOM 1800 SG CYS B 52 -1.833 -2.031 8.809 1.00 0.00 S ATOM 0 H CYS B 52 0.217 -3.276 7.020 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.016 -2.856 5.183 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -3.000 -1.228 6.877 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.309 -2.931 7.150 1.00 0.00 H new ATOM 0 HG CYS B 52 -2.745 -1.591 9.624 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.269 -0.243 5.403 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.549 0.965 5.095 1.00 0.00 C ATOM 1808 C GLN B 53 -1.105 2.088 5.941 1.00 0.00 C ATOM 1809 O GLN B 53 -2.031 1.884 6.714 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.669 1.310 3.610 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.608 0.104 2.686 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.697 0.133 1.633 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.548 0.778 0.601 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -2.800 -0.565 1.884 1.00 0.00 N ATOM 0 H GLN B 53 -2.283 -0.170 5.317 1.00 0.00 H new ATOM 0 HA GLN B 53 0.509 0.821 5.316 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.610 1.834 3.445 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.131 2.000 3.342 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.366 0.072 2.198 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.700 -0.808 3.276 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.885 -1.089 2.755 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.561 -0.577 1.205 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.517 3.250 5.817 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.962 4.424 6.532 1.00 0.00 C ATOM 1825 C LYS B 54 -0.557 5.645 5.729 1.00 0.00 C ATOM 1826 O LYS B 54 0.495 5.644 5.101 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.372 4.447 7.939 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.326 3.932 9.005 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.612 3.718 10.325 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.470 4.137 11.503 1.00 0.00 C ATOM 1831 NZ LYS B 54 -0.644 4.466 12.694 1.00 0.00 N ATOM 0 H LYS B 54 0.289 3.412 5.214 1.00 0.00 H new ATOM 0 HA LYS B 54 -2.046 4.415 6.647 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.536 3.844 7.954 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.081 5.468 8.186 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.141 4.643 9.141 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -1.773 2.994 8.674 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -0.343 2.667 10.427 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.318 4.287 10.332 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -2.071 5.003 11.226 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -2.164 3.334 11.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -1.054 4.014 13.536 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.326 4.118 12.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -0.625 5.497 12.829 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.387 6.673 5.714 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.091 7.859 4.913 1.00 0.00 C ATOM 1847 C ILE B 55 -1.569 9.142 5.549 1.00 0.00 C ATOM 1848 O ILE B 55 -2.512 9.135 6.320 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.808 7.774 3.564 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.277 7.428 3.784 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.150 6.759 2.668 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.146 7.757 2.605 1.00 0.00 C ATOM 0 H ILE B 55 -2.261 6.716 6.238 1.00 0.00 H new ATOM 0 HA ILE B 55 -0.005 7.878 4.817 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.742 8.743 3.070 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.364 6.364 4.005 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.643 7.966 4.658 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.678 6.718 1.716 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.112 7.045 2.495 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.182 5.779 3.144 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.178 7.486 2.827 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.088 8.825 2.397 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.804 7.198 1.734 1.00 0.00 H new ATOM 1864 N SER B 56 -0.919 10.239 5.201 1.00 0.00 N ATOM 1865 CA SER B 56 -1.328 11.548 5.670 1.00 0.00 C ATOM 1866 C SER B 56 -2.482 12.006 4.788 1.00 0.00 C ATOM 1867 O SER B 56 -2.267 12.407 3.652 1.00 0.00 O ATOM 1868 CB SER B 56 -0.165 12.529 5.565 1.00 0.00 C ATOM 1869 OG SER B 56 1.070 11.839 5.540 1.00 0.00 O ATOM 0 H SER B 56 -0.101 10.247 4.592 1.00 0.00 H new ATOM 0 HA SER B 56 -1.637 11.504 6.714 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.270 13.130 4.662 1.00 0.00 H new ATOM 0 HB3 SER B 56 -0.186 13.217 6.410 1.00 0.00 H new ATOM 0 HG SER B 56 1.527 11.955 6.399 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.721 11.942 5.285 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.914 12.297 4.514 1.00 0.00 C ATOM 1877 C PRO B 57 -5.121 13.800 4.407 1.00 0.00 C ATOM 1878 O PRO B 57 -6.169 14.336 4.771 1.00 0.00 O ATOM 1879 CB PRO B 57 -6.042 11.651 5.298 1.00 0.00 C ATOM 1880 CG PRO B 57 -5.370 10.829 6.339 1.00 0.00 C ATOM 1881 CD PRO B 57 -4.090 11.530 6.630 1.00 0.00 C ATOM 0 HA PRO B 57 -4.846 11.957 3.481 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.691 12.403 5.748 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.668 11.035 4.653 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.986 10.748 7.234 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.190 9.814 5.983 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -4.221 12.376 7.304 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.348 10.873 7.084 1.00 0.00 H new ATOM 1889 N GLU B 58 -4.086 14.446 3.921 1.00 0.00 N ATOM 1890 CA GLU B 58 -4.035 15.896 3.719 1.00 0.00 C ATOM 1891 C GLU B 58 -4.139 16.672 5.027 1.00 0.00 C ATOM 1892 O GLU B 58 -4.337 17.886 5.030 1.00 0.00 O ATOM 1893 CB GLU B 58 -5.097 16.343 2.716 1.00 0.00 C ATOM 1894 CG GLU B 58 -4.565 16.426 1.292 1.00 0.00 C ATOM 1895 CD GLU B 58 -3.700 15.234 0.915 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -2.554 15.130 1.414 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -4.159 14.396 0.122 1.00 0.00 O ATOM 0 H GLU B 58 -3.226 13.973 3.644 1.00 0.00 H new ATOM 0 HA GLU B 58 -3.055 16.127 3.302 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -5.935 15.646 2.746 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.483 17.318 3.012 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.404 16.494 0.599 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -3.984 17.341 1.179 1.00 0.00 H new ATOM 1904 N GLY B 59 -3.993 15.965 6.136 1.00 0.00 N ATOM 1905 CA GLY B 59 -4.031 16.607 7.432 1.00 0.00 C ATOM 1906 C GLY B 59 -2.633 16.978 7.876 1.00 0.00 C ATOM 1907 O GLY B 59 -2.439 17.703 8.851 1.00 0.00 O ATOM 0 H GLY B 59 -3.849 14.956 6.162 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -4.654 17.500 7.385 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -4.487 15.939 8.163 1.00 0.00 H new ATOM 1911 N LYS B 60 -1.653 16.480 7.132 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.252 16.732 7.420 1.00 0.00 C ATOM 1913 C LYS B 60 0.389 17.474 6.263 1.00 0.00 C ATOM 1914 O LYS B 60 -0.048 17.348 5.123 1.00 0.00 O ATOM 1915 CB LYS B 60 0.505 15.418 7.629 1.00 0.00 C ATOM 1916 CG LYS B 60 -0.206 14.414 8.515 1.00 0.00 C ATOM 1917 CD LYS B 60 0.071 14.667 9.981 1.00 0.00 C ATOM 1918 CE LYS B 60 -0.955 15.601 10.591 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.793 15.754 12.064 1.00 0.00 N ATOM 0 H LYS B 60 -1.810 15.891 6.314 1.00 0.00 H new ATOM 0 HA LYS B 60 -0.200 17.330 8.330 1.00 0.00 H new ATOM 0 HB2 LYS B 60 0.687 14.960 6.657 1.00 0.00 H new ATOM 0 HB3 LYS B 60 1.479 15.641 8.064 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -1.280 14.464 8.333 1.00 0.00 H new ATOM 0 HG3 LYS B 60 0.115 13.406 8.253 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.068 13.720 10.521 1.00 0.00 H new ATOM 0 HD3 LYS B 60 1.067 15.096 10.095 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -0.875 16.580 10.118 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -1.955 15.224 10.377 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -1.689 15.520 12.538 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.046 15.113 12.400 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -0.531 16.736 12.284 1.00 0.00 H new ATOM 1933 N ALA B 61 1.423 18.240 6.560 1.00 0.00 N ATOM 1934 CA ALA B 61 2.140 18.968 5.528 1.00 0.00 C ATOM 1935 C ALA B 61 3.142 18.043 4.865 1.00 0.00 C ATOM 1936 O ALA B 61 3.557 18.258 3.730 1.00 0.00 O ATOM 1937 CB ALA B 61 2.838 20.173 6.119 1.00 0.00 C ATOM 0 H ALA B 61 1.785 18.374 7.504 1.00 0.00 H new ATOM 0 HA ALA B 61 1.432 19.323 4.779 1.00 0.00 H new ATOM 0 HB1 ALA B 61 3.370 20.707 5.332 1.00 0.00 H new ATOM 0 HB2 ALA B 61 2.100 20.835 6.572 1.00 0.00 H new ATOM 0 HB3 ALA B 61 3.547 19.846 6.879 1.00 0.00 H new ATOM 1943 N LYS B 62 3.532 17.013 5.601 1.00 0.00 N ATOM 1944 CA LYS B 62 4.462 16.030 5.099 1.00 0.00 C ATOM 1945 C LYS B 62 3.672 14.944 4.391 1.00 0.00 C ATOM 1946 O LYS B 62 2.776 14.343 4.985 1.00 0.00 O ATOM 1947 CB LYS B 62 5.288 15.408 6.239 1.00 0.00 C ATOM 1948 CG LYS B 62 5.218 16.161 7.562 1.00 0.00 C ATOM 1949 CD LYS B 62 4.852 15.232 8.714 1.00 0.00 C ATOM 1950 CE LYS B 62 6.055 14.909 9.596 1.00 0.00 C ATOM 1951 NZ LYS B 62 5.664 14.646 11.011 1.00 0.00 N ATOM 0 H LYS B 62 3.212 16.841 6.554 1.00 0.00 H new ATOM 0 HA LYS B 62 5.156 16.514 4.412 1.00 0.00 H new ATOM 0 HB2 LYS B 62 4.947 14.385 6.400 1.00 0.00 H new ATOM 0 HB3 LYS B 62 6.330 15.350 5.924 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.179 16.633 7.765 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.480 16.960 7.489 1.00 0.00 H new ATOM 0 HD2 LYS B 62 4.073 15.696 9.320 1.00 0.00 H new ATOM 0 HD3 LYS B 62 4.437 14.307 8.315 1.00 0.00 H new ATOM 0 HE2 LYS B 62 6.572 14.037 9.196 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.760 15.740 9.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.411 14.990 11.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 4.774 15.140 11.223 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 5.534 13.624 11.151 1.00 0.00 H new ATOM 1965 N ILE B 63 3.968 14.711 3.124 1.00 0.00 N ATOM 1966 CA ILE B 63 3.274 13.682 2.376 1.00 0.00 C ATOM 1967 C ILE B 63 3.894 12.336 2.758 1.00 0.00 C ATOM 1968 O ILE B 63 4.809 11.851 2.103 1.00 0.00 O ATOM 1969 CB ILE B 63 3.375 13.947 0.854 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.516 15.154 0.463 1.00 0.00 C ATOM 1971 CG2 ILE B 63 2.916 12.737 0.055 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.044 16.506 0.890 1.00 0.00 C ATOM 0 H ILE B 63 4.679 15.217 2.596 1.00 0.00 H new ATOM 0 HA ILE B 63 2.211 13.680 2.619 1.00 0.00 H new ATOM 0 HB ILE B 63 4.421 14.149 0.626 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.399 15.157 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.522 15.022 0.890 1.00 0.00 H new ATOM 0 HG21 ILE B 63 2.998 12.952 -1.010 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.542 11.880 0.301 1.00 0.00 H new ATOM 0 HG23 ILE B 63 1.878 12.511 0.301 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.357 17.285 0.561 1.00 0.00 H new ATOM 0 HD12 ILE B 63 3.133 16.536 1.976 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.023 16.672 0.441 1.00 0.00 H new ATOM 1984 N GLN B 64 3.411 11.744 3.846 1.00 0.00 N ATOM 1985 CA GLN B 64 3.980 10.493 4.331 1.00 0.00 C ATOM 1986 C GLN B 64 3.095 9.281 4.063 1.00 0.00 C ATOM 1987 O GLN B 64 1.865 9.367 4.025 1.00 0.00 O ATOM 1988 CB GLN B 64 4.263 10.561 5.842 1.00 0.00 C ATOM 1989 CG GLN B 64 4.391 11.964 6.413 1.00 0.00 C ATOM 1990 CD GLN B 64 3.621 12.153 7.711 1.00 0.00 C ATOM 1991 OE1 GLN B 64 2.452 12.531 7.699 1.00 0.00 O ATOM 1992 NE2 GLN B 64 4.263 11.890 8.841 1.00 0.00 N ATOM 0 H GLN B 64 2.636 12.106 4.402 1.00 0.00 H new ATOM 0 HA GLN B 64 4.908 10.366 3.773 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.462 10.043 6.369 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.185 10.017 6.048 1.00 0.00 H new ATOM 0 HG2 GLN B 64 5.444 12.184 6.587 1.00 0.00 H new ATOM 0 HG3 GLN B 64 4.032 12.683 5.677 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.234 11.578 8.815 1.00 0.00 H new ATOM 0 HE22 GLN B 64 3.786 12.000 9.736 1.00 0.00 H new ATOM 2001 N LEU B 65 3.764 8.158 3.861 1.00 0.00 N ATOM 2002 CA LEU B 65 3.136 6.867 3.654 1.00 0.00 C ATOM 2003 C LEU B 65 3.773 5.882 4.626 1.00 0.00 C ATOM 2004 O LEU B 65 4.940 5.542 4.475 1.00 0.00 O ATOM 2005 CB LEU B 65 3.374 6.370 2.238 1.00 0.00 C ATOM 2006 CG LEU B 65 2.615 5.097 1.866 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.263 5.414 1.229 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.478 4.221 0.978 1.00 0.00 C ATOM 0 H LEU B 65 4.783 8.120 3.836 1.00 0.00 H new ATOM 0 HA LEU B 65 2.062 6.956 3.815 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.095 7.159 1.540 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.441 6.191 2.106 1.00 0.00 H new ATOM 0 HG LEU B 65 2.398 4.541 2.778 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.752 4.484 0.978 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.655 5.984 1.931 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.416 6.000 0.323 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.930 3.316 0.717 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.734 4.765 0.069 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.391 3.952 1.509 1.00 0.00 H new ATOM 2020 N GLN B 66 3.024 5.440 5.611 1.00 0.00 N ATOM 2021 CA GLN B 66 3.539 4.526 6.619 1.00 0.00 C ATOM 2022 C GLN B 66 3.178 3.075 6.307 1.00 0.00 C ATOM 2023 O GLN B 66 2.036 2.658 6.466 1.00 0.00 O ATOM 2024 CB GLN B 66 2.999 4.943 7.975 1.00 0.00 C ATOM 2025 CG GLN B 66 3.380 4.036 9.133 1.00 0.00 C ATOM 2026 CD GLN B 66 2.912 4.606 10.456 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.911 5.316 10.510 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.631 4.319 11.527 1.00 0.00 N ATOM 0 H GLN B 66 2.046 5.699 5.740 1.00 0.00 H new ATOM 0 HA GLN B 66 4.628 4.580 6.623 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.351 5.951 8.194 1.00 0.00 H new ATOM 0 HB3 GLN B 66 1.912 4.991 7.915 1.00 0.00 H new ATOM 0 HG2 GLN B 66 2.941 3.049 8.984 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.462 3.904 9.154 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.456 3.726 11.443 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.361 4.691 12.437 1.00 0.00 H new ATOM 2037 N LEU B 67 4.159 2.322 5.839 1.00 0.00 N ATOM 2038 CA LEU B 67 3.965 0.915 5.515 1.00 0.00 C ATOM 2039 C LEU B 67 3.984 0.071 6.777 1.00 0.00 C ATOM 2040 O LEU B 67 5.048 -0.224 7.309 1.00 0.00 O ATOM 2041 CB LEU B 67 5.062 0.422 4.577 1.00 0.00 C ATOM 2042 CG LEU B 67 4.889 0.786 3.109 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.033 0.203 2.301 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.554 0.283 2.587 1.00 0.00 C ATOM 0 H LEU B 67 5.106 2.663 5.673 1.00 0.00 H new ATOM 0 HA LEU B 67 2.997 0.818 5.024 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.016 0.822 4.921 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.123 -0.663 4.658 1.00 0.00 H new ATOM 0 HG LEU B 67 4.902 1.871 3.009 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.907 0.465 1.250 1.00 0.00 H new ATOM 0 HD12 LEU B 67 6.978 0.606 2.665 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.037 -0.882 2.406 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.449 0.553 1.536 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.508 -0.801 2.689 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.745 0.736 3.160 1.00 0.00 H new ATOM 2056 N VAL B 68 2.818 -0.312 7.252 1.00 0.00 N ATOM 2057 CA VAL B 68 2.725 -1.119 8.454 1.00 0.00 C ATOM 2058 C VAL B 68 2.865 -2.592 8.114 1.00 0.00 C ATOM 2059 O VAL B 68 1.942 -3.208 7.591 1.00 0.00 O ATOM 2060 CB VAL B 68 1.396 -0.892 9.188 1.00 0.00 C ATOM 2061 CG1 VAL B 68 1.452 -1.512 10.567 1.00 0.00 C ATOM 2062 CG2 VAL B 68 1.083 0.589 9.282 1.00 0.00 C ATOM 0 H VAL B 68 1.921 -0.079 6.826 1.00 0.00 H new ATOM 0 HA VAL B 68 3.538 -0.814 9.112 1.00 0.00 H new ATOM 0 HB VAL B 68 0.598 -1.372 8.621 1.00 0.00 H new ATOM 0 HG11 VAL B 68 0.505 -1.345 11.080 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.633 -2.583 10.477 1.00 0.00 H new ATOM 0 HG13 VAL B 68 2.259 -1.055 11.139 1.00 0.00 H new ATOM 0 HG21 VAL B 68 0.137 0.728 9.806 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.879 1.095 9.829 1.00 0.00 H new ATOM 0 HG23 VAL B 68 1.008 1.009 8.279 1.00 0.00 H new ATOM 2072 N LEU B 69 4.020 -3.154 8.415 1.00 0.00 N ATOM 2073 CA LEU B 69 4.283 -4.549 8.112 1.00 0.00 C ATOM 2074 C LEU B 69 3.851 -5.459 9.253 1.00 0.00 C ATOM 2075 O LEU B 69 3.552 -4.996 10.355 1.00 0.00 O ATOM 2076 CB LEU B 69 5.764 -4.758 7.837 1.00 0.00 C ATOM 2077 CG LEU B 69 6.493 -3.557 7.244 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.982 -3.770 7.328 1.00 0.00 C ATOM 2079 CD2 LEU B 69 6.087 -3.319 5.805 1.00 0.00 C ATOM 0 H LEU B 69 4.792 -2.666 8.869 1.00 0.00 H new ATOM 0 HA LEU B 69 3.703 -4.806 7.226 1.00 0.00 H new ATOM 0 HB2 LEU B 69 6.254 -5.035 8.770 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.875 -5.602 7.156 1.00 0.00 H new ATOM 0 HG LEU B 69 6.216 -2.675 7.822 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.497 -2.909 6.903 1.00 0.00 H new ATOM 0 HD12 LEU B 69 8.274 -3.889 8.371 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.253 -4.667 6.771 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.625 -2.456 5.413 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.329 -4.199 5.209 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.014 -3.131 5.756 1.00 0.00 H new ATOM 2091 N HIS B 70 3.826 -6.757 8.979 1.00 0.00 N ATOM 2092 CA HIS B 70 3.447 -7.749 9.980 1.00 0.00 C ATOM 2093 C HIS B 70 4.603 -7.998 10.929 1.00 0.00 C ATOM 2094 O HIS B 70 4.405 -8.429 12.065 1.00 0.00 O ATOM 2095 CB HIS B 70 3.045 -9.072 9.322 1.00 0.00 C ATOM 2096 CG HIS B 70 1.650 -9.086 8.788 1.00 0.00 C ATOM 2097 ND1 HIS B 70 0.526 -8.892 9.563 1.00 0.00 N ATOM 2098 CD2 HIS B 70 1.206 -9.275 7.522 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -0.543 -8.966 8.764 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -0.186 -9.199 7.512 1.00 0.00 N ATOM 0 H HIS B 70 4.065 -7.150 8.068 1.00 0.00 H new ATOM 0 HA HIS B 70 2.592 -7.357 10.531 1.00 0.00 H new ATOM 0 HB2 HIS B 70 3.737 -9.286 8.507 1.00 0.00 H new ATOM 0 HB3 HIS B 70 3.152 -9.876 10.051 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.830 -9.456 6.659 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -1.564 -8.851 9.097 1.00 0.00 H new ATOM 0 HE2 HIS B 70 -0.802 -9.302 6.706 1.00 0.00 H new ATOM 2108 N ALA B 71 5.809 -7.731 10.446 1.00 0.00 N ATOM 2109 CA ALA B 71 7.017 -7.917 11.236 1.00 0.00 C ATOM 2110 C ALA B 71 7.018 -7.038 12.480 1.00 0.00 C ATOM 2111 O ALA B 71 7.630 -7.384 13.491 1.00 0.00 O ATOM 2112 CB ALA B 71 8.248 -7.633 10.389 1.00 0.00 C ATOM 0 H ALA B 71 5.976 -7.382 9.502 1.00 0.00 H new ATOM 0 HA ALA B 71 7.040 -8.956 11.566 1.00 0.00 H new ATOM 0 HB1 ALA B 71 9.145 -7.776 10.992 1.00 0.00 H new ATOM 0 HB2 ALA B 71 8.270 -8.315 9.539 1.00 0.00 H new ATOM 0 HB3 ALA B 71 8.213 -6.605 10.029 1.00 0.00 H new ATOM 2118 N GLY B 72 6.338 -5.902 12.407 1.00 0.00 N ATOM 2119 CA GLY B 72 6.298 -5.005 13.537 1.00 0.00 C ATOM 2120 C GLY B 72 7.134 -3.800 13.238 1.00 0.00 C ATOM 2121 O GLY B 72 7.773 -3.223 14.115 1.00 0.00 O ATOM 0 H GLY B 72 5.817 -5.589 11.588 1.00 0.00 H new ATOM 0 HA2 GLY B 72 5.270 -4.707 13.744 1.00 0.00 H new ATOM 0 HA3 GLY B 72 6.670 -5.508 14.429 1.00 0.00 H new ATOM 2125 N ASP B 73 7.106 -3.431 11.975 1.00 0.00 N ATOM 2126 CA ASP B 73 7.858 -2.319 11.470 1.00 0.00 C ATOM 2127 C ASP B 73 6.947 -1.524 10.588 1.00 0.00 C ATOM 2128 O ASP B 73 6.066 -2.083 9.932 1.00 0.00 O ATOM 2129 CB ASP B 73 9.062 -2.792 10.653 1.00 0.00 C ATOM 2130 CG ASP B 73 9.960 -1.643 10.237 1.00 0.00 C ATOM 2131 OD1 ASP B 73 10.057 -0.661 11.003 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.556 -1.717 9.143 1.00 0.00 O ATOM 0 H ASP B 73 6.549 -3.907 11.265 1.00 0.00 H new ATOM 0 HA ASP B 73 8.231 -1.722 12.302 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.638 -3.507 11.240 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.712 -3.317 9.764 1.00 0.00 H new ATOM 2137 N THR B 74 7.112 -0.239 10.596 1.00 0.00 N ATOM 2138 CA THR B 74 6.302 0.602 9.767 1.00 0.00 C ATOM 2139 C THR B 74 7.203 1.599 9.040 1.00 0.00 C ATOM 2140 O THR B 74 7.882 2.407 9.673 1.00 0.00 O ATOM 2141 CB THR B 74 5.230 1.332 10.589 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.831 2.091 11.645 1.00 0.00 O ATOM 2143 CG2 THR B 74 4.225 0.348 11.169 1.00 0.00 C ATOM 0 H THR B 74 7.800 0.253 11.167 1.00 0.00 H new ATOM 0 HA THR B 74 5.779 -0.016 9.037 1.00 0.00 H new ATOM 0 HB THR B 74 4.705 2.013 9.919 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.736 2.359 11.381 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.477 0.890 11.747 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.736 -0.193 10.359 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.741 -0.360 11.818 1.00 0.00 H new ATOM 2151 N THR B 75 7.205 1.542 7.721 1.00 0.00 N ATOM 2152 CA THR B 75 8.048 2.411 6.914 1.00 0.00 C ATOM 2153 C THR B 75 7.316 3.670 6.464 1.00 0.00 C ATOM 2154 O THR B 75 6.472 3.608 5.576 1.00 0.00 O ATOM 2155 CB THR B 75 8.531 1.656 5.668 1.00 0.00 C ATOM 2156 OG1 THR B 75 8.522 0.245 5.924 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.925 2.102 5.270 1.00 0.00 C ATOM 0 H THR B 75 6.628 0.898 7.180 1.00 0.00 H new ATOM 0 HA THR B 75 8.890 2.709 7.539 1.00 0.00 H new ATOM 0 HB THR B 75 7.854 1.880 4.844 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.374 -0.145 5.636 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.244 1.552 4.385 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.917 3.170 5.051 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.618 1.905 6.088 1.00 0.00 H new ATOM 2165 N ASN B 76 7.642 4.809 7.064 1.00 0.00 N ATOM 2166 CA ASN B 76 6.997 6.067 6.692 1.00 0.00 C ATOM 2167 C ASN B 76 7.817 6.791 5.634 1.00 0.00 C ATOM 2168 O ASN B 76 8.894 7.306 5.914 1.00 0.00 O ATOM 2169 CB ASN B 76 6.803 7.003 7.896 1.00 0.00 C ATOM 2170 CG ASN B 76 6.094 6.362 9.071 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.189 5.160 9.302 1.00 0.00 O ATOM 2172 ND2 ASN B 76 5.385 7.175 9.831 1.00 0.00 N ATOM 0 H ASN B 76 8.341 4.890 7.802 1.00 0.00 H new ATOM 0 HA ASN B 76 6.014 5.809 6.298 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.779 7.360 8.225 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.235 7.876 7.576 1.00 0.00 H new ATOM 0 HD21 ASN B 76 4.890 6.810 10.645 1.00 0.00 H new ATOM 0 HD22 ASN B 76 5.332 8.168 9.604 1.00 0.00 H new ATOM 2179 N PHE B 77 7.312 6.809 4.415 1.00 0.00 N ATOM 2180 CA PHE B 77 7.988 7.484 3.322 1.00 0.00 C ATOM 2181 C PHE B 77 7.436 8.893 3.160 1.00 0.00 C ATOM 2182 O PHE B 77 6.234 9.071 2.981 1.00 0.00 O ATOM 2183 CB PHE B 77 7.815 6.699 2.022 1.00 0.00 C ATOM 2184 CG PHE B 77 8.547 5.390 2.014 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.918 5.348 2.200 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.864 4.203 1.815 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.596 4.147 2.188 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.537 2.997 1.802 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.904 2.969 1.988 1.00 0.00 C ATOM 0 H PHE B 77 6.433 6.362 4.156 1.00 0.00 H new ATOM 0 HA PHE B 77 9.052 7.544 3.552 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.754 6.514 1.857 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.166 7.308 1.189 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.463 6.267 2.356 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.794 4.220 1.668 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.666 4.128 2.335 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.994 2.077 1.646 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.432 2.027 1.977 1.00 0.00 H new ATOM 2199 N HIS B 78 8.311 9.882 3.227 1.00 0.00 N ATOM 2200 CA HIS B 78 7.908 11.275 3.094 1.00 0.00 C ATOM 2201 C HIS B 78 8.145 11.745 1.660 1.00 0.00 C ATOM 2202 O HIS B 78 9.251 12.127 1.288 1.00 0.00 O ATOM 2203 CB HIS B 78 8.686 12.145 4.090 1.00 0.00 C ATOM 2204 CG HIS B 78 8.309 13.601 4.091 1.00 0.00 C ATOM 2205 ND1 HIS B 78 8.917 14.535 4.896 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.396 14.285 3.353 1.00 0.00 C ATOM 2207 CE1 HIS B 78 8.381 15.728 4.626 1.00 0.00 C ATOM 2208 NE2 HIS B 78 7.450 15.633 3.694 1.00 0.00 N ATOM 0 H HIS B 78 9.311 9.746 3.374 1.00 0.00 H new ATOM 0 HA HIS B 78 6.845 11.368 3.318 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.536 11.746 5.093 1.00 0.00 H new ATOM 0 HB3 HIS B 78 9.750 12.061 3.869 1.00 0.00 H new ATOM 0 HD1 HIS B 78 9.650 14.349 5.580 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.734 13.851 2.618 1.00 0.00 H new ATOM 0 HE1 HIS B 78 8.671 16.650 5.107 1.00 0.00 H new ATOM 2216 N PHE B 79 7.100 11.699 0.859 1.00 0.00 N ATOM 2217 CA PHE B 79 7.177 12.113 -0.531 1.00 0.00 C ATOM 2218 C PHE B 79 7.225 13.630 -0.619 1.00 0.00 C ATOM 2219 O PHE B 79 6.252 14.308 -0.299 1.00 0.00 O ATOM 2220 CB PHE B 79 5.968 11.598 -1.315 1.00 0.00 C ATOM 2221 CG PHE B 79 5.757 10.112 -1.234 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.260 9.525 -0.083 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.043 9.306 -2.318 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.054 8.163 -0.017 1.00 0.00 C ATOM 2225 CE2 PHE B 79 5.836 7.944 -2.261 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.341 7.371 -1.108 1.00 0.00 C ATOM 0 H PHE B 79 6.177 11.376 1.149 1.00 0.00 H new ATOM 0 HA PHE B 79 8.085 11.692 -0.964 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.073 12.099 -0.948 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.084 11.879 -2.362 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.031 10.141 0.774 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.434 9.748 -3.222 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.668 7.718 0.888 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.061 7.327 -3.118 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.179 6.304 -1.060 1.00 0.00 H new ATOM 2236 N SER B 80 8.358 14.157 -1.030 1.00 0.00 N ATOM 2237 CA SER B 80 8.522 15.590 -1.160 1.00 0.00 C ATOM 2238 C SER B 80 8.933 15.960 -2.579 1.00 0.00 C ATOM 2239 O SER B 80 10.018 16.493 -2.804 1.00 0.00 O ATOM 2240 CB SER B 80 9.562 16.101 -0.166 1.00 0.00 C ATOM 2241 OG SER B 80 9.523 15.369 1.049 1.00 0.00 O ATOM 0 H SER B 80 9.183 13.612 -1.281 1.00 0.00 H new ATOM 0 HA SER B 80 7.564 16.061 -0.942 1.00 0.00 H new ATOM 0 HB2 SER B 80 10.556 16.025 -0.606 1.00 0.00 H new ATOM 0 HB3 SER B 80 9.384 17.157 0.038 1.00 0.00 H new ATOM 0 HG SER B 80 9.949 15.892 1.760 1.00 0.00 H new ATOM 2247 N ASN B 81 8.076 15.642 -3.542 1.00 0.00 N ATOM 2248 CA ASN B 81 8.345 15.973 -4.931 1.00 0.00 C ATOM 2249 C ASN B 81 7.537 17.206 -5.290 1.00 0.00 C ATOM 2250 O ASN B 81 7.239 17.466 -6.458 1.00 0.00 O ATOM 2251 CB ASN B 81 7.990 14.804 -5.848 1.00 0.00 C ATOM 2252 CG ASN B 81 8.841 14.775 -7.104 1.00 0.00 C ATOM 2253 OD1 ASN B 81 9.744 15.591 -7.286 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.564 13.826 -7.978 1.00 0.00 N ATOM 0 H ASN B 81 7.193 15.157 -3.385 1.00 0.00 H new ATOM 0 HA ASN B 81 9.408 16.175 -5.064 1.00 0.00 H new ATOM 0 HB2 ASN B 81 8.117 13.868 -5.304 1.00 0.00 H new ATOM 0 HB3 ASN B 81 6.938 14.871 -6.126 1.00 0.00 H new ATOM 0 HD21 ASN B 81 9.106 13.751 -8.839 1.00 0.00 H new ATOM 0 HD22 ASN B 81 7.808 13.167 -7.793 1.00 0.00 H new ATOM 2261 N GLU B 82 7.197 17.947 -4.234 1.00 0.00 N ATOM 2262 CA GLU B 82 6.421 19.183 -4.294 1.00 0.00 C ATOM 2263 C GLU B 82 5.185 19.059 -5.184 1.00 0.00 C ATOM 2264 O GLU B 82 4.102 18.703 -4.713 1.00 0.00 O ATOM 2265 CB GLU B 82 7.311 20.344 -4.751 1.00 0.00 C ATOM 2266 CG GLU B 82 8.687 20.356 -4.089 1.00 0.00 C ATOM 2267 CD GLU B 82 8.623 20.230 -2.574 1.00 0.00 C ATOM 2268 OE1 GLU B 82 8.514 19.088 -2.070 1.00 0.00 O ATOM 2269 OE2 GLU B 82 8.687 21.271 -1.890 1.00 0.00 O ATOM 0 H GLU B 82 7.464 17.693 -3.283 1.00 0.00 H new ATOM 0 HA GLU B 82 6.057 19.387 -3.287 1.00 0.00 H new ATOM 0 HB2 GLU B 82 7.438 20.290 -5.832 1.00 0.00 H new ATOM 0 HB3 GLU B 82 6.805 21.285 -4.536 1.00 0.00 H new ATOM 0 HG2 GLU B 82 9.284 19.537 -4.491 1.00 0.00 H new ATOM 0 HG3 GLU B 82 9.200 21.282 -4.349 1.00 0.00 H new ATOM 2276 N SER B 83 5.370 19.327 -6.469 1.00 0.00 N ATOM 2277 CA SER B 83 4.303 19.279 -7.456 1.00 0.00 C ATOM 2278 C SER B 83 3.500 17.973 -7.409 1.00 0.00 C ATOM 2279 O SER B 83 2.285 17.980 -7.637 1.00 0.00 O ATOM 2280 CB SER B 83 4.911 19.466 -8.844 1.00 0.00 C ATOM 2281 OG SER B 83 6.276 19.840 -8.746 1.00 0.00 O ATOM 0 H SER B 83 6.276 19.587 -6.859 1.00 0.00 H new ATOM 0 HA SER B 83 3.602 20.081 -7.226 1.00 0.00 H new ATOM 0 HB2 SER B 83 4.822 18.541 -9.413 1.00 0.00 H new ATOM 0 HB3 SER B 83 4.357 20.230 -9.389 1.00 0.00 H new ATOM 0 HG SER B 83 6.649 19.954 -9.645 1.00 0.00 H new ATOM 2287 N THR B 84 4.157 16.857 -7.118 1.00 0.00 N ATOM 2288 CA THR B 84 3.461 15.578 -7.075 1.00 0.00 C ATOM 2289 C THR B 84 3.646 14.832 -5.766 1.00 0.00 C ATOM 2290 O THR B 84 3.315 13.653 -5.700 1.00 0.00 O ATOM 2291 CB THR B 84 3.928 14.653 -8.199 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.357 14.663 -8.274 1.00 0.00 O ATOM 2293 CG2 THR B 84 3.349 15.084 -9.529 1.00 0.00 C ATOM 0 H THR B 84 5.155 16.811 -6.911 1.00 0.00 H new ATOM 0 HA THR B 84 2.407 15.832 -7.189 1.00 0.00 H new ATOM 0 HB THR B 84 3.579 13.644 -7.978 1.00 0.00 H new ATOM 0 HG1 THR B 84 5.710 13.827 -7.903 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.696 14.410 -10.312 1.00 0.00 H new ATOM 0 HG22 THR B 84 2.261 15.053 -9.479 1.00 0.00 H new ATOM 0 HG23 THR B 84 3.673 16.100 -9.755 1.00 0.00 H new ATOM 2301 N ALA B 85 4.145 15.508 -4.736 1.00 0.00 N ATOM 2302 CA ALA B 85 4.371 14.878 -3.431 1.00 0.00 C ATOM 2303 C ALA B 85 3.189 13.987 -3.030 1.00 0.00 C ATOM 2304 O ALA B 85 3.299 12.761 -3.002 1.00 0.00 O ATOM 2305 CB ALA B 85 4.619 15.949 -2.381 1.00 0.00 C ATOM 0 H ALA B 85 4.402 16.494 -4.776 1.00 0.00 H new ATOM 0 HA ALA B 85 5.251 14.239 -3.503 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.786 15.477 -1.413 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.497 16.533 -2.657 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.751 16.606 -2.319 1.00 0.00 H new ATOM 2311 N VAL B 86 2.068 14.624 -2.733 1.00 0.00 N ATOM 2312 CA VAL B 86 0.828 13.939 -2.358 1.00 0.00 C ATOM 2313 C VAL B 86 0.385 12.875 -3.371 1.00 0.00 C ATOM 2314 O VAL B 86 0.106 11.739 -2.994 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.289 14.991 -2.161 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.650 14.453 -2.571 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.353 15.451 -0.719 1.00 0.00 C ATOM 0 H VAL B 86 1.986 15.641 -2.744 1.00 0.00 H new ATOM 0 HA VAL B 86 1.022 13.404 -1.428 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.039 15.836 -2.803 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.407 15.222 -2.417 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.628 14.171 -3.624 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -1.893 13.579 -1.966 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.146 16.190 -0.608 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.559 14.597 -0.074 1.00 0.00 H new ATOM 0 HG23 VAL B 86 0.601 15.897 -0.437 1.00 0.00 H new ATOM 2327 N LYS B 87 0.361 13.232 -4.648 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.092 12.319 -5.696 1.00 0.00 C ATOM 2329 C LYS B 87 0.786 11.079 -5.796 1.00 0.00 C ATOM 2330 O LYS B 87 0.270 9.985 -5.966 1.00 0.00 O ATOM 2331 CB LYS B 87 -0.127 13.049 -7.042 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.862 14.380 -6.991 1.00 0.00 C ATOM 2333 CD LYS B 87 -0.327 15.356 -8.028 1.00 0.00 C ATOM 2334 CE LYS B 87 -0.938 16.739 -7.860 1.00 0.00 C ATOM 2335 NZ LYS B 87 -0.215 17.770 -8.655 1.00 0.00 N ATOM 0 H LYS B 87 0.650 14.150 -4.987 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.096 11.986 -5.432 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.895 13.220 -7.380 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.605 12.407 -7.782 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.926 14.215 -7.161 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -0.761 14.814 -5.996 1.00 0.00 H new ATOM 0 HD2 LYS B 87 0.757 15.423 -7.940 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.543 14.981 -9.028 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -1.984 16.713 -8.166 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -0.922 17.017 -6.806 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.723 18.675 -8.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 0.748 17.886 -8.279 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -0.164 17.469 -9.649 1.00 0.00 H new ATOM 2349 N GLU B 88 2.099 11.239 -5.692 1.00 0.00 N ATOM 2350 CA GLU B 88 2.992 10.091 -5.772 1.00 0.00 C ATOM 2351 C GLU B 88 2.810 9.200 -4.542 1.00 0.00 C ATOM 2352 O GLU B 88 2.913 7.975 -4.633 1.00 0.00 O ATOM 2353 CB GLU B 88 4.446 10.534 -5.961 1.00 0.00 C ATOM 2354 CG GLU B 88 4.833 10.667 -7.435 1.00 0.00 C ATOM 2355 CD GLU B 88 6.231 11.228 -7.652 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.429 12.427 -7.387 1.00 0.00 O ATOM 2357 OE2 GLU B 88 7.133 10.474 -8.107 1.00 0.00 O ATOM 0 H GLU B 88 2.563 12.137 -5.554 1.00 0.00 H new ATOM 0 HA GLU B 88 2.733 9.500 -6.650 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.598 11.491 -5.461 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.107 9.814 -5.479 1.00 0.00 H new ATOM 0 HG2 GLU B 88 4.766 9.688 -7.909 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.110 11.312 -7.934 1.00 0.00 H new ATOM 2364 N ARG B 89 2.514 9.817 -3.396 1.00 0.00 N ATOM 2365 CA ARG B 89 2.248 9.065 -2.168 1.00 0.00 C ATOM 2366 C ARG B 89 0.986 8.265 -2.368 1.00 0.00 C ATOM 2367 O ARG B 89 0.943 7.051 -2.161 1.00 0.00 O ATOM 2368 CB ARG B 89 2.035 10.008 -0.985 1.00 0.00 C ATOM 2369 CG ARG B 89 1.219 9.414 0.163 1.00 0.00 C ATOM 2370 CD ARG B 89 0.451 10.489 0.931 1.00 0.00 C ATOM 2371 NE ARG B 89 -0.793 10.890 0.259 1.00 0.00 N ATOM 2372 CZ ARG B 89 -1.425 12.053 0.471 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -0.923 12.953 1.304 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -2.558 12.323 -0.158 1.00 0.00 N ATOM 0 H ARG B 89 2.453 10.830 -3.293 1.00 0.00 H new ATOM 0 HA ARG B 89 3.101 8.421 -1.957 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.008 10.314 -0.601 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.535 10.909 -1.341 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.518 8.679 -0.232 1.00 0.00 H new ATOM 0 HG3 ARG B 89 1.884 8.885 0.846 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.216 10.118 1.929 1.00 0.00 H new ATOM 0 HD3 ARG B 89 1.089 11.364 1.058 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.202 10.241 -0.413 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -0.047 12.764 1.791 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -1.412 13.835 1.458 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.955 11.644 -0.808 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -3.034 13.210 0.007 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.041 8.986 -2.773 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.338 8.419 -3.042 1.00 0.00 C ATOM 2390 C ASP B 90 -1.269 7.354 -4.100 1.00 0.00 C ATOM 2391 O ASP B 90 -1.934 6.336 -4.006 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.312 9.518 -3.446 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.070 10.031 -2.256 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.199 9.267 -1.271 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -3.532 11.178 -2.290 1.00 0.00 O ATOM 0 H ASP B 90 0.007 9.993 -2.925 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.696 7.945 -2.128 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.767 10.337 -3.915 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.011 9.134 -4.189 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.416 7.574 -5.063 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.251 6.639 -6.169 1.00 0.00 C ATOM 2402 C ALA B 91 0.341 5.343 -5.674 1.00 0.00 C ATOM 2403 O ALA B 91 -0.143 4.255 -5.986 1.00 0.00 O ATOM 2404 CB ALA B 91 0.650 7.235 -7.228 1.00 0.00 C ATOM 0 H ALA B 91 0.185 8.396 -5.114 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.231 6.442 -6.603 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.765 6.527 -8.048 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.208 8.158 -7.604 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.627 7.451 -6.795 1.00 0.00 H new ATOM 2410 N VAL B 92 1.405 5.482 -4.913 1.00 0.00 N ATOM 2411 CA VAL B 92 2.084 4.354 -4.327 1.00 0.00 C ATOM 2412 C VAL B 92 1.107 3.581 -3.468 1.00 0.00 C ATOM 2413 O VAL B 92 0.989 2.370 -3.577 1.00 0.00 O ATOM 2414 CB VAL B 92 3.260 4.859 -3.485 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.562 3.949 -2.318 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.485 5.020 -4.343 1.00 0.00 C ATOM 0 H VAL B 92 1.822 6.384 -4.685 1.00 0.00 H new ATOM 0 HA VAL B 92 2.467 3.695 -5.106 1.00 0.00 H new ATOM 0 HB VAL B 92 2.970 5.828 -3.077 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.403 4.350 -1.752 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.687 3.884 -1.671 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.814 2.955 -2.687 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.313 5.379 -3.732 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.750 4.059 -4.783 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.281 5.739 -5.137 1.00 0.00 H new ATOM 2426 N LYS B 93 0.385 4.326 -2.652 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.618 3.781 -1.759 1.00 0.00 C ATOM 2428 C LYS B 93 -1.704 3.083 -2.542 1.00 0.00 C ATOM 2429 O LYS B 93 -2.146 2.002 -2.170 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.232 4.924 -0.974 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.415 4.517 -0.130 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.174 5.734 0.334 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.293 6.117 -0.614 1.00 0.00 C ATOM 2434 NZ LYS B 93 -3.801 6.669 -1.906 1.00 0.00 N ATOM 0 H LYS B 93 0.481 5.340 -2.591 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.150 3.058 -1.091 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.470 5.360 -0.328 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.544 5.703 -1.669 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.074 3.867 -0.706 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.075 3.943 0.732 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.590 5.543 1.323 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.484 6.572 0.434 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -4.910 5.240 -0.812 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -4.934 6.855 -0.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.557 6.612 -2.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.523 7.663 -1.776 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -2.979 6.119 -2.228 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.139 3.719 -3.614 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.174 3.152 -4.449 1.00 0.00 C ATOM 2450 C ASP B 94 -2.731 1.798 -4.967 1.00 0.00 C ATOM 2451 O ASP B 94 -3.416 0.792 -4.798 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.516 4.073 -5.614 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.655 5.020 -5.276 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.651 5.597 -4.160 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -5.567 5.168 -6.112 1.00 0.00 O ATOM 0 H ASP B 94 -1.791 4.626 -3.924 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.072 3.034 -3.843 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.634 4.651 -5.890 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.789 3.473 -6.482 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.554 1.782 -5.573 1.00 0.00 N ATOM 2461 CA LEU B 95 -0.985 0.560 -6.107 1.00 0.00 C ATOM 2462 C LEU B 95 -0.759 -0.447 -4.986 1.00 0.00 C ATOM 2463 O LEU B 95 -1.072 -1.623 -5.124 1.00 0.00 O ATOM 2464 CB LEU B 95 0.325 0.871 -6.837 1.00 0.00 C ATOM 2465 CG LEU B 95 0.301 0.633 -8.352 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.077 0.928 -8.930 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.353 1.491 -9.036 1.00 0.00 C ATOM 0 H LEU B 95 -0.973 2.609 -5.707 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.681 0.121 -6.822 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.586 1.913 -6.653 1.00 0.00 H new ATOM 0 HB3 LEU B 95 1.118 0.262 -6.402 1.00 0.00 H new ATOM 0 HG LEU B 95 0.528 -0.418 -8.534 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.066 0.751 -10.005 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -1.815 0.276 -8.463 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.338 1.968 -8.736 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.325 1.313 -10.111 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.150 2.543 -8.838 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.339 1.233 -8.651 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.261 0.046 -3.866 1.00 0.00 N ATOM 2480 CA LEU B 96 0.020 -0.776 -2.700 1.00 0.00 C ATOM 2481 C LEU B 96 -1.239 -1.460 -2.177 1.00 0.00 C ATOM 2482 O LEU B 96 -1.304 -2.685 -2.108 1.00 0.00 O ATOM 2483 CB LEU B 96 0.642 0.097 -1.614 1.00 0.00 C ATOM 2484 CG LEU B 96 2.148 0.287 -1.743 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.641 1.310 -0.739 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.869 -1.038 -1.570 1.00 0.00 C ATOM 0 H LEU B 96 -0.039 1.033 -3.738 1.00 0.00 H new ATOM 0 HA LEU B 96 0.717 -1.562 -2.988 1.00 0.00 H new ATOM 0 HB2 LEU B 96 0.162 1.075 -1.633 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.426 -0.346 -0.642 1.00 0.00 H new ATOM 0 HG LEU B 96 2.367 0.662 -2.743 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.719 1.434 -0.845 1.00 0.00 H new ATOM 0 HD12 LEU B 96 2.147 2.265 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.412 0.968 0.271 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.944 -0.883 -1.665 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.648 -1.447 -0.584 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.534 -1.737 -2.336 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.230 -0.655 -1.827 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.499 -1.145 -1.306 1.00 0.00 C ATOM 2500 C GLN B 97 -4.162 -2.158 -2.249 1.00 0.00 C ATOM 2501 O GLN B 97 -4.628 -3.208 -1.811 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.412 0.049 -1.015 1.00 0.00 C ATOM 2503 CG GLN B 97 -5.891 -0.198 -1.196 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.695 1.079 -1.052 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.135 1.435 0.039 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -6.877 1.783 -2.153 1.00 0.00 N ATOM 0 H GLN B 97 -2.178 0.361 -1.896 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.313 -1.686 -0.378 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.239 0.373 0.011 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.118 0.874 -1.664 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.070 -0.631 -2.180 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.231 -0.927 -0.460 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -6.495 1.452 -3.039 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.400 2.658 -2.118 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.159 -1.860 -3.543 1.00 0.00 N ATOM 2516 CA GLN B 98 -4.780 -2.735 -4.542 1.00 0.00 C ATOM 2517 C GLN B 98 -3.976 -4.013 -4.802 1.00 0.00 C ATOM 2518 O GLN B 98 -4.551 -5.081 -5.016 1.00 0.00 O ATOM 2519 CB GLN B 98 -4.962 -1.988 -5.865 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.292 -1.262 -5.982 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.199 0.215 -5.651 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -6.360 0.616 -4.505 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -5.941 1.036 -6.659 1.00 0.00 N ATOM 0 H GLN B 98 -3.733 -1.018 -3.930 1.00 0.00 H new ATOM 0 HA GLN B 98 -5.746 -3.027 -4.131 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.153 -1.266 -5.978 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -4.873 -2.698 -6.687 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -6.673 -1.377 -6.997 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -7.015 -1.732 -5.315 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -5.813 0.664 -7.600 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -5.870 2.040 -6.494 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.655 -3.907 -4.787 1.00 0.00 N ATOM 2533 CA LEU B 99 -1.789 -5.051 -5.072 1.00 0.00 C ATOM 2534 C LEU B 99 -1.544 -5.937 -3.857 1.00 0.00 C ATOM 2535 O LEU B 99 -1.181 -7.103 -4.008 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.452 -4.560 -5.611 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.463 -4.133 -7.075 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.561 -3.039 -7.304 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.179 -5.327 -7.973 1.00 0.00 C ATOM 0 H LEU B 99 -2.156 -3.042 -4.581 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.308 -5.658 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.121 -3.717 -5.005 1.00 0.00 H new ATOM 0 HB3 LEU B 99 0.286 -5.352 -5.485 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.450 -3.743 -7.323 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.546 -2.740 -8.352 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.321 -2.179 -6.678 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.553 -3.410 -7.046 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.190 -5.009 -9.015 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.800 -5.741 -7.730 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -0.943 -6.089 -7.818 1.00 0.00 H new ATOM 2551 N LEU B 100 -1.735 -5.384 -2.668 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.517 -6.121 -1.420 1.00 0.00 C ATOM 2553 C LEU B 100 -2.151 -7.518 -1.414 1.00 0.00 C ATOM 2554 O LEU B 100 -1.445 -8.502 -1.186 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.034 -5.321 -0.232 1.00 0.00 C ATOM 2556 CG LEU B 100 -1.023 -4.389 0.415 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.709 -3.546 1.479 1.00 0.00 C ATOM 2558 CD2 LEU B 100 0.130 -5.196 0.998 1.00 0.00 C ATOM 0 H LEU B 100 -2.043 -4.421 -2.535 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.439 -6.262 -1.339 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.890 -4.731 -0.558 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.396 -6.018 0.524 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.612 -3.715 -0.336 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.981 -2.879 1.940 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.502 -2.955 1.020 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.137 -4.198 2.240 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.850 -4.520 1.460 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.253 -5.887 1.749 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.619 -5.759 0.203 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.473 -7.646 -1.676 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.150 -8.951 -1.663 1.00 0.00 C ATOM 2572 C PRO B 101 -3.529 -9.970 -2.621 1.00 0.00 C ATOM 2573 O PRO B 101 -3.729 -11.169 -2.468 1.00 0.00 O ATOM 2574 CB PRO B 101 -5.585 -8.623 -2.090 1.00 0.00 C ATOM 2575 CG PRO B 101 -5.760 -7.181 -1.778 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.416 -6.552 -1.990 1.00 0.00 C ATOM 0 HA PRO B 101 -4.075 -9.419 -0.682 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -5.735 -8.818 -3.152 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.307 -9.234 -1.549 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -6.510 -6.729 -2.427 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.100 -7.041 -0.752 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.295 -6.198 -3.014 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.267 -5.693 -1.336 1.00 0.00 H new ATOM 2584 N LYS B 102 -2.760 -9.500 -3.590 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.136 -10.395 -4.556 1.00 0.00 C ATOM 2586 C LYS B 102 -0.880 -11.052 -3.978 1.00 0.00 C ATOM 2587 O LYS B 102 -0.411 -12.063 -4.502 1.00 0.00 O ATOM 2588 CB LYS B 102 -1.780 -9.630 -5.843 1.00 0.00 C ATOM 2589 CG LYS B 102 -1.807 -10.495 -7.099 1.00 0.00 C ATOM 2590 CD LYS B 102 -0.559 -10.304 -7.965 1.00 0.00 C ATOM 2591 CE LYS B 102 -0.556 -8.971 -8.715 1.00 0.00 C ATOM 2592 NZ LYS B 102 0.721 -8.749 -9.467 1.00 0.00 N ATOM 0 H LYS B 102 -2.553 -8.511 -3.730 1.00 0.00 H new ATOM 0 HA LYS B 102 -2.854 -11.181 -4.791 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -2.478 -8.802 -5.968 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -0.786 -9.195 -5.733 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -1.891 -11.544 -6.813 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -2.693 -10.253 -7.685 1.00 0.00 H new ATOM 0 HD2 LYS B 102 0.328 -10.363 -7.334 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -0.493 -11.120 -8.684 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -1.395 -8.945 -9.411 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -0.705 -8.157 -8.006 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 0.935 -7.732 -9.495 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 1.496 -9.253 -8.991 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.619 -9.108 -10.438 1.00 0.00 H new ATOM 2606 N PHE B 103 -0.333 -10.485 -2.902 1.00 0.00 N ATOM 2607 CA PHE B 103 0.886 -11.018 -2.305 1.00 0.00 C ATOM 2608 C PHE B 103 0.710 -11.385 -0.844 1.00 0.00 C ATOM 2609 O PHE B 103 1.601 -11.984 -0.257 1.00 0.00 O ATOM 2610 CB PHE B 103 2.016 -10.014 -2.493 1.00 0.00 C ATOM 2611 CG PHE B 103 2.093 -9.539 -3.913 1.00 0.00 C ATOM 2612 CD1 PHE B 103 2.400 -10.428 -4.931 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.819 -8.223 -4.235 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.435 -10.009 -6.244 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.858 -7.798 -5.546 1.00 0.00 C ATOM 2616 CZ PHE B 103 2.164 -8.693 -6.550 1.00 0.00 C ATOM 0 H PHE B 103 -0.713 -9.664 -2.431 1.00 0.00 H new ATOM 0 HA PHE B 103 1.136 -11.948 -2.816 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.862 -9.162 -1.830 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.963 -10.472 -2.209 1.00 0.00 H new ATOM 0 HD1 PHE B 103 2.614 -11.460 -4.693 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.572 -7.521 -3.452 1.00 0.00 H new ATOM 0 HE1 PHE B 103 2.674 -10.710 -7.030 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.649 -6.766 -5.786 1.00 0.00 H new ATOM 0 HZ PHE B 103 2.191 -8.362 -7.578 1.00 0.00 H new ATOM 2626 N LYS B 104 -0.438 -11.049 -0.273 1.00 0.00 N ATOM 2627 CA LYS B 104 -0.712 -11.355 1.127 1.00 0.00 C ATOM 2628 C LYS B 104 -0.462 -12.829 1.434 1.00 0.00 C ATOM 2629 O LYS B 104 -1.083 -13.713 0.838 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.151 -10.986 1.486 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.344 -9.512 1.790 1.00 0.00 C ATOM 2632 CD LYS B 104 -3.707 -9.248 2.401 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.587 -8.702 3.817 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.918 -8.454 4.431 1.00 0.00 N ATOM 0 H LYS B 104 -1.195 -10.565 -0.756 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.029 -10.759 1.733 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -2.806 -11.267 0.661 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -2.462 -11.570 2.352 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.565 -9.175 2.474 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -2.236 -8.932 0.873 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.253 -8.537 1.781 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -4.286 -10.171 2.414 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -3.029 -9.408 4.432 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -3.016 -7.774 3.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.843 -7.679 5.120 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -5.599 -8.194 3.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -5.244 -9.316 4.913 1.00 0.00 H new