USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 703 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 270 SER OG : rot 67:sc= -0.146! USER MOD Set 1.2: B 68 HIS : no HD1:sc= -1.49! K(o=-1.6!,f=2) USER MOD Single : A 265 LYS NZ :NH3+ -165:sc= -0.05 (180deg=-0.316) USER MOD Single : A 272 LYS NZ :NH3+ 147:sc= -0.0973 (180deg=-0.555) USER MOD Single : B 1 MET CE :methyl -158:sc= 0 (180deg=-0.612) USER MOD Single : B 1 MET N :NH3+ 163:sc= 1.18 (180deg=0.723) USER MOD Single : B 2 GLN : amide:sc= -5.81! K(o=-5.8!,f=0.35) USER MOD Single : B 6 LYS NZ :NH3+ -169:sc= -0.0204 (180deg=-0.187) USER MOD Single : B 7 THR OG1 : rot -4:sc= -0.133 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -29:sc= 1.9 USER MOD Single : B 19 SER OG : rot 180:sc=-0.00314 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -4.1! C(o=-4.1!,f=-1.6!) USER MOD Single : B 27 LYS NZ :NH3+ 173:sc= -3.15! (180deg=-3.88!) USER MOD Single : B 28 SER OG : rot 67:sc= 0.0371 USER MOD Single : B 29 LYS NZ :NH3+ -165:sc= -0.0382 (180deg=-0.357) USER MOD Single : B 31 GLN : amide:sc= -2.79! C(o=-2.8!,f=-1.6!) USER MOD Single : B 33 LYS NZ :NH3+ -115:sc= -0.129 (180deg=-1.61!) USER MOD Single : B 40 GLN : amide:sc= -5.02! C(o=-5!,f=-3.1!) USER MOD Single : B 41 GLN : amide:sc= -0.317 K(o=-0.32,f=-1.1) USER MOD Single : B 48 LYS NZ :NH3+ 166:sc= -0.0151 (180deg=-0.245) USER MOD Single : B 49 GLN : amide:sc= -1.43 K(o=-1.4,f=-2!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -130:sc= 0.441 USER MOD Single : B 60 ASN : amide:sc= -0.459 K(o=-0.46,f=-3.2) USER MOD Single : B 62 GLN : amide:sc= 0.0252 X(o=0.025,f=-0.057) USER MOD Single : B 63 LYS NZ :NH3+ -167:sc= -0.0339 (180deg=-0.267) USER MOD Single : B 65 SER OG : rot 74:sc= -0.866 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 259 14.887 1.371 -1.684 1.00 0.00 N ATOM 66 CA GLU A 259 13.436 1.315 -1.810 1.00 0.00 C ATOM 67 C GLU A 259 12.980 -0.056 -2.298 1.00 0.00 C ATOM 68 O GLU A 259 11.996 -0.603 -1.804 1.00 0.00 O ATOM 69 CB GLU A 259 12.950 2.389 -2.781 1.00 0.00 C ATOM 70 CG GLU A 259 11.441 2.425 -2.934 1.00 0.00 C ATOM 71 CD GLU A 259 10.988 3.352 -4.044 1.00 0.00 C ATOM 72 OE1 GLU A 259 11.859 3.888 -4.762 1.00 0.00 O ATOM 73 OE2 GLU A 259 9.763 3.535 -4.202 1.00 0.00 O ATOM 0 HA GLU A 259 13.007 1.493 -0.824 1.00 0.00 H new ATOM 0 HB2 GLU A 259 13.296 3.363 -2.436 1.00 0.00 H new ATOM 0 HB3 GLU A 259 13.403 2.217 -3.758 1.00 0.00 H new ATOM 0 HG2 GLU A 259 11.076 1.418 -3.136 1.00 0.00 H new ATOM 0 HG3 GLU A 259 10.992 2.744 -1.994 1.00 0.00 H new ATOM 80 N GLU A 260 13.695 -0.601 -3.278 1.00 0.00 N ATOM 81 CA GLU A 260 13.359 -1.904 -3.841 1.00 0.00 C ATOM 82 C GLU A 260 13.396 -2.992 -2.773 1.00 0.00 C ATOM 83 O GLU A 260 12.489 -3.821 -2.688 1.00 0.00 O ATOM 84 CB GLU A 260 14.324 -2.255 -4.976 1.00 0.00 C ATOM 85 CG GLU A 260 14.312 -1.251 -6.117 1.00 0.00 C ATOM 86 CD GLU A 260 15.251 -1.638 -7.243 1.00 0.00 C ATOM 87 OE1 GLU A 260 16.465 -1.770 -6.985 1.00 0.00 O ATOM 88 OE2 GLU A 260 14.771 -1.810 -8.383 1.00 0.00 O ATOM 0 H GLU A 260 14.512 -0.159 -3.699 1.00 0.00 H new ATOM 0 HA GLU A 260 12.345 -1.847 -4.236 1.00 0.00 H new ATOM 0 HB2 GLU A 260 15.335 -2.324 -4.574 1.00 0.00 H new ATOM 0 HB3 GLU A 260 14.069 -3.240 -5.367 1.00 0.00 H new ATOM 0 HG2 GLU A 260 13.298 -1.163 -6.508 1.00 0.00 H new ATOM 0 HG3 GLU A 260 14.593 -0.269 -5.735 1.00 0.00 H new ATOM 95 N GLU A 261 14.448 -2.986 -1.962 1.00 0.00 N ATOM 96 CA GLU A 261 14.599 -3.976 -0.901 1.00 0.00 C ATOM 97 C GLU A 261 13.484 -3.840 0.132 1.00 0.00 C ATOM 98 O GLU A 261 12.919 -4.833 0.589 1.00 0.00 O ATOM 99 CB GLU A 261 15.963 -3.826 -0.225 1.00 0.00 C ATOM 100 CG GLU A 261 16.225 -4.866 0.852 1.00 0.00 C ATOM 101 CD GLU A 261 17.573 -4.687 1.525 1.00 0.00 C ATOM 102 OE1 GLU A 261 18.307 -3.748 1.149 1.00 0.00 O ATOM 103 OE2 GLU A 261 17.895 -5.488 2.429 1.00 0.00 O ATOM 0 H GLU A 261 15.208 -2.308 -2.018 1.00 0.00 H new ATOM 0 HA GLU A 261 14.533 -4.967 -1.349 1.00 0.00 H new ATOM 0 HB2 GLU A 261 16.744 -3.894 -0.982 1.00 0.00 H new ATOM 0 HB3 GLU A 261 16.033 -2.832 0.217 1.00 0.00 H new ATOM 0 HG2 GLU A 261 15.438 -4.810 1.604 1.00 0.00 H new ATOM 0 HG3 GLU A 261 16.174 -5.861 0.410 1.00 0.00 H new ATOM 110 N LEU A 262 13.169 -2.603 0.494 1.00 0.00 N ATOM 111 CA LEU A 262 12.119 -2.337 1.469 1.00 0.00 C ATOM 112 C LEU A 262 10.766 -2.803 0.936 1.00 0.00 C ATOM 113 O LEU A 262 9.993 -3.458 1.643 1.00 0.00 O ATOM 114 CB LEU A 262 12.078 -0.843 1.794 1.00 0.00 C ATOM 115 CG LEU A 262 11.117 -0.444 2.914 1.00 0.00 C ATOM 116 CD1 LEU A 262 11.488 -1.143 4.214 1.00 0.00 C ATOM 117 CD2 LEU A 262 11.122 1.066 3.098 1.00 0.00 C ATOM 0 H LEU A 262 13.626 -1.768 0.127 1.00 0.00 H new ATOM 0 HA LEU A 262 12.337 -2.891 2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 262 13.082 -0.520 2.067 1.00 0.00 H new ATOM 0 HB3 LEU A 262 11.803 -0.299 0.891 1.00 0.00 H new ATOM 0 HG LEU A 262 10.111 -0.757 2.635 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.792 -0.846 4.998 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.437 -2.223 4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 262 12.501 -0.862 4.502 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.434 1.337 3.898 1.00 0.00 H new ATOM 0 HD22 LEU A 262 12.128 1.398 3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 262 10.808 1.547 2.171 1.00 0.00 H new ATOM 129 N ILE A 263 10.495 -2.468 -0.322 1.00 0.00 N ATOM 130 CA ILE A 263 9.248 -2.851 -0.972 1.00 0.00 C ATOM 131 C ILE A 263 9.049 -4.363 -0.935 1.00 0.00 C ATOM 132 O ILE A 263 7.984 -4.841 -0.545 1.00 0.00 O ATOM 133 CB ILE A 263 9.212 -2.365 -2.439 1.00 0.00 C ATOM 134 CG1 ILE A 263 8.863 -0.878 -2.511 1.00 0.00 C ATOM 135 CG2 ILE A 263 8.227 -3.187 -3.263 1.00 0.00 C ATOM 136 CD1 ILE A 263 8.883 -0.313 -3.915 1.00 0.00 C ATOM 0 H ILE A 263 11.127 -1.929 -0.914 1.00 0.00 H new ATOM 0 HA ILE A 263 8.439 -2.374 -0.420 1.00 0.00 H new ATOM 0 HB ILE A 263 10.207 -2.504 -2.862 1.00 0.00 H new ATOM 0 HG12 ILE A 263 7.873 -0.726 -2.082 1.00 0.00 H new ATOM 0 HG13 ILE A 263 9.567 -0.319 -1.894 1.00 0.00 H new ATOM 0 HG21 ILE A 263 8.221 -2.824 -4.291 1.00 0.00 H new ATOM 0 HG22 ILE A 263 8.527 -4.235 -3.249 1.00 0.00 H new ATOM 0 HG23 ILE A 263 7.228 -3.090 -2.838 1.00 0.00 H new ATOM 0 HD11 ILE A 263 8.625 0.746 -3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 263 9.879 -0.432 -4.341 1.00 0.00 H new ATOM 0 HD13 ILE A 263 8.159 -0.845 -4.532 1.00 0.00 H new ATOM 148 N ARG A 264 10.072 -5.117 -1.341 1.00 0.00 N ATOM 149 CA ARG A 264 9.971 -6.572 -1.342 1.00 0.00 C ATOM 150 C ARG A 264 9.757 -7.096 0.069 1.00 0.00 C ATOM 151 O ARG A 264 9.006 -8.049 0.269 1.00 0.00 O ATOM 152 CB ARG A 264 11.194 -7.231 -1.981 1.00 0.00 C ATOM 153 CG ARG A 264 12.502 -6.963 -1.257 1.00 0.00 C ATOM 154 CD ARG A 264 13.654 -7.724 -1.893 1.00 0.00 C ATOM 155 NE ARG A 264 13.439 -9.168 -1.854 1.00 0.00 N ATOM 156 CZ ARG A 264 14.289 -10.058 -2.360 1.00 0.00 C ATOM 157 NH1 ARG A 264 15.406 -9.655 -2.950 1.00 0.00 N ATOM 158 NH2 ARG A 264 14.019 -11.354 -2.276 1.00 0.00 N ATOM 0 H ARG A 264 10.965 -4.749 -1.668 1.00 0.00 H new ATOM 0 HA ARG A 264 9.105 -6.836 -1.949 1.00 0.00 H new ATOM 0 HB2 ARG A 264 11.031 -8.308 -2.023 1.00 0.00 H new ATOM 0 HB3 ARG A 264 11.284 -6.881 -3.009 1.00 0.00 H new ATOM 0 HG2 ARG A 264 12.717 -5.894 -1.274 1.00 0.00 H new ATOM 0 HG3 ARG A 264 12.406 -7.253 -0.211 1.00 0.00 H new ATOM 0 HD2 ARG A 264 13.774 -7.403 -2.928 1.00 0.00 H new ATOM 0 HD3 ARG A 264 14.581 -7.481 -1.374 1.00 0.00 H new ATOM 0 HE ARG A 264 12.587 -9.515 -1.413 1.00 0.00 H new ATOM 0 HH11 ARG A 264 15.617 -8.659 -3.017 1.00 0.00 H new ATOM 0 HH12 ARG A 264 16.055 -10.341 -3.336 1.00 0.00 H new ATOM 0 HH21 ARG A 264 13.160 -11.668 -1.824 1.00 0.00 H new ATOM 0 HH22 ARG A 264 14.670 -12.037 -2.664 1.00 0.00 H new ATOM 172 N LYS A 265 10.390 -6.460 1.057 1.00 0.00 N ATOM 173 CA LYS A 265 10.204 -6.881 2.440 1.00 0.00 C ATOM 174 C LYS A 265 8.716 -6.880 2.745 1.00 0.00 C ATOM 175 O LYS A 265 8.168 -7.854 3.268 1.00 0.00 O ATOM 176 CB LYS A 265 10.931 -5.948 3.411 1.00 0.00 C ATOM 177 CG LYS A 265 12.446 -6.034 3.338 1.00 0.00 C ATOM 178 CD LYS A 265 13.097 -5.171 4.408 1.00 0.00 C ATOM 179 CE LYS A 265 14.611 -5.289 4.379 1.00 0.00 C ATOM 180 NZ LYS A 265 15.063 -6.692 4.588 1.00 0.00 N ATOM 0 H LYS A 265 11.021 -5.670 0.927 1.00 0.00 H new ATOM 0 HA LYS A 265 10.623 -7.879 2.566 1.00 0.00 H new ATOM 0 HB2 LYS A 265 10.626 -4.921 3.208 1.00 0.00 H new ATOM 0 HB3 LYS A 265 10.613 -6.180 4.428 1.00 0.00 H new ATOM 0 HG2 LYS A 265 12.761 -7.070 3.461 1.00 0.00 H new ATOM 0 HG3 LYS A 265 12.784 -5.713 2.353 1.00 0.00 H new ATOM 0 HD2 LYS A 265 12.810 -4.130 4.260 1.00 0.00 H new ATOM 0 HD3 LYS A 265 12.727 -5.467 5.390 1.00 0.00 H new ATOM 0 HE2 LYS A 265 14.985 -4.926 3.422 1.00 0.00 H new ATOM 0 HE3 LYS A 265 15.040 -4.651 5.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 16.078 -6.700 4.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 14.530 -7.115 5.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 14.897 -7.243 3.722 1.00 0.00 H new ATOM 194 N ALA A 266 8.062 -5.784 2.371 1.00 0.00 N ATOM 195 CA ALA A 266 6.628 -5.651 2.560 1.00 0.00 C ATOM 196 C ALA A 266 5.896 -6.704 1.737 1.00 0.00 C ATOM 197 O ALA A 266 4.850 -7.211 2.143 1.00 0.00 O ATOM 198 CB ALA A 266 6.168 -4.252 2.175 1.00 0.00 C ATOM 0 H ALA A 266 8.507 -4.976 1.935 1.00 0.00 H new ATOM 0 HA ALA A 266 6.394 -5.807 3.613 1.00 0.00 H new ATOM 0 HB1 ALA A 266 5.091 -4.170 2.323 1.00 0.00 H new ATOM 0 HB2 ALA A 266 6.677 -3.517 2.799 1.00 0.00 H new ATOM 0 HB3 ALA A 266 6.406 -4.066 1.128 1.00 0.00 H new ATOM 204 N ILE A 267 6.465 -7.034 0.576 1.00 0.00 N ATOM 205 CA ILE A 267 5.880 -8.034 -0.309 1.00 0.00 C ATOM 206 C ILE A 267 5.758 -9.380 0.398 1.00 0.00 C ATOM 207 O ILE A 267 4.696 -10.003 0.391 1.00 0.00 O ATOM 208 CB ILE A 267 6.712 -8.210 -1.599 1.00 0.00 C ATOM 209 CG1 ILE A 267 6.696 -6.920 -2.427 1.00 0.00 C ATOM 210 CG2 ILE A 267 6.190 -9.381 -2.421 1.00 0.00 C ATOM 211 CD1 ILE A 267 5.317 -6.523 -2.912 1.00 0.00 C ATOM 0 H ILE A 267 7.331 -6.621 0.230 1.00 0.00 H new ATOM 0 HA ILE A 267 4.887 -7.676 -0.581 1.00 0.00 H new ATOM 0 HB ILE A 267 7.742 -8.426 -1.316 1.00 0.00 H new ATOM 0 HG12 ILE A 267 7.108 -6.109 -1.827 1.00 0.00 H new ATOM 0 HG13 ILE A 267 7.352 -7.044 -3.288 1.00 0.00 H new ATOM 0 HG21 ILE A 267 6.790 -9.487 -3.325 1.00 0.00 H new ATOM 0 HG22 ILE A 267 6.255 -10.296 -1.833 1.00 0.00 H new ATOM 0 HG23 ILE A 267 5.151 -9.199 -2.695 1.00 0.00 H new ATOM 0 HD11 ILE A 267 5.386 -5.601 -3.490 1.00 0.00 H new ATOM 0 HD12 ILE A 267 4.910 -7.316 -3.540 1.00 0.00 H new ATOM 0 HD13 ILE A 267 4.661 -6.366 -2.056 1.00 0.00 H new ATOM 223 N GLU A 268 6.852 -9.819 1.015 1.00 0.00 N ATOM 224 CA GLU A 268 6.868 -11.087 1.734 1.00 0.00 C ATOM 225 C GLU A 268 5.887 -11.056 2.899 1.00 0.00 C ATOM 226 O GLU A 268 5.126 -12.003 3.109 1.00 0.00 O ATOM 227 CB GLU A 268 8.279 -11.393 2.242 1.00 0.00 C ATOM 228 CG GLU A 268 9.309 -11.548 1.134 1.00 0.00 C ATOM 229 CD GLU A 268 9.044 -12.748 0.242 1.00 0.00 C ATOM 230 OE1 GLU A 268 8.085 -13.499 0.520 1.00 0.00 O ATOM 231 OE2 GLU A 268 9.802 -12.942 -0.731 1.00 0.00 O ATOM 0 H GLU A 268 7.738 -9.314 1.031 1.00 0.00 H new ATOM 0 HA GLU A 268 6.563 -11.875 1.045 1.00 0.00 H new ATOM 0 HB2 GLU A 268 8.596 -10.593 2.911 1.00 0.00 H new ATOM 0 HB3 GLU A 268 8.252 -12.309 2.832 1.00 0.00 H new ATOM 0 HG2 GLU A 268 9.318 -10.644 0.525 1.00 0.00 H new ATOM 0 HG3 GLU A 268 10.300 -11.644 1.577 1.00 0.00 H new ATOM 238 N LEU A 269 5.903 -9.958 3.651 1.00 0.00 N ATOM 239 CA LEU A 269 5.006 -9.804 4.791 1.00 0.00 C ATOM 240 C LEU A 269 3.552 -9.944 4.348 1.00 0.00 C ATOM 241 O LEU A 269 2.734 -10.545 5.045 1.00 0.00 O ATOM 242 CB LEU A 269 5.221 -8.444 5.463 1.00 0.00 C ATOM 243 CG LEU A 269 6.642 -8.180 5.969 1.00 0.00 C ATOM 244 CD1 LEU A 269 6.740 -6.792 6.581 1.00 0.00 C ATOM 245 CD2 LEU A 269 7.057 -9.237 6.982 1.00 0.00 C ATOM 0 H LEU A 269 6.525 -9.165 3.492 1.00 0.00 H new ATOM 0 HA LEU A 269 5.231 -10.590 5.512 1.00 0.00 H new ATOM 0 HB2 LEU A 269 4.955 -7.661 4.753 1.00 0.00 H new ATOM 0 HB3 LEU A 269 4.532 -8.360 6.304 1.00 0.00 H new ATOM 0 HG LEU A 269 7.322 -8.233 5.119 1.00 0.00 H new ATOM 0 HD11 LEU A 269 7.757 -6.622 6.935 1.00 0.00 H new ATOM 0 HD12 LEU A 269 6.488 -6.044 5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 269 6.046 -6.714 7.418 1.00 0.00 H new ATOM 0 HD21 LEU A 269 8.070 -9.031 7.329 1.00 0.00 H new ATOM 0 HD22 LEU A 269 6.372 -9.217 7.830 1.00 0.00 H new ATOM 0 HD23 LEU A 269 7.027 -10.221 6.514 1.00 0.00 H new ATOM 257 N SER A 270 3.244 -9.386 3.181 1.00 0.00 N ATOM 258 CA SER A 270 1.894 -9.446 2.631 1.00 0.00 C ATOM 259 C SER A 270 1.507 -10.882 2.293 1.00 0.00 C ATOM 260 O SER A 270 0.401 -11.326 2.598 1.00 0.00 O ATOM 261 CB SER A 270 1.793 -8.579 1.375 1.00 0.00 C ATOM 262 OG SER A 270 2.132 -7.232 1.650 1.00 0.00 O ATOM 0 H SER A 270 3.914 -8.886 2.596 1.00 0.00 H new ATOM 0 HA SER A 270 1.206 -9.067 3.387 1.00 0.00 H new ATOM 0 HB2 SER A 270 2.456 -8.973 0.605 1.00 0.00 H new ATOM 0 HB3 SER A 270 0.779 -8.627 0.978 1.00 0.00 H new ATOM 0 HG SER A 270 3.083 -7.175 1.881 1.00 0.00 H new ATOM 268 N LEU A 271 2.428 -11.598 1.653 1.00 0.00 N ATOM 269 CA LEU A 271 2.189 -12.983 1.262 1.00 0.00 C ATOM 270 C LEU A 271 1.824 -13.840 2.469 1.00 0.00 C ATOM 271 O LEU A 271 0.885 -14.635 2.416 1.00 0.00 O ATOM 272 CB LEU A 271 3.428 -13.560 0.571 1.00 0.00 C ATOM 273 CG LEU A 271 3.874 -12.824 -0.697 1.00 0.00 C ATOM 274 CD1 LEU A 271 5.142 -13.450 -1.258 1.00 0.00 C ATOM 275 CD2 LEU A 271 2.766 -12.834 -1.741 1.00 0.00 C ATOM 0 H LEU A 271 3.348 -11.241 1.394 1.00 0.00 H new ATOM 0 HA LEU A 271 1.350 -12.995 0.566 1.00 0.00 H new ATOM 0 HB2 LEU A 271 4.254 -13.558 1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 271 3.230 -14.601 0.316 1.00 0.00 H new ATOM 0 HG LEU A 271 4.088 -11.788 -0.435 1.00 0.00 H new ATOM 0 HD11 LEU A 271 5.444 -12.915 -2.158 1.00 0.00 H new ATOM 0 HD12 LEU A 271 5.937 -13.389 -0.515 1.00 0.00 H new ATOM 0 HD13 LEU A 271 4.954 -14.495 -1.503 1.00 0.00 H new ATOM 0 HD21 LEU A 271 3.102 -12.307 -2.634 1.00 0.00 H new ATOM 0 HD22 LEU A 271 2.519 -13.864 -1.999 1.00 0.00 H new ATOM 0 HD23 LEU A 271 1.882 -12.339 -1.338 1.00 0.00 H new ATOM 287 N LYS A 272 2.572 -13.675 3.555 1.00 0.00 N ATOM 288 CA LYS A 272 2.329 -14.438 4.775 1.00 0.00 C ATOM 289 C LYS A 272 0.938 -14.149 5.336 1.00 0.00 C ATOM 290 O LYS A 272 0.228 -15.062 5.760 1.00 0.00 O ATOM 291 CB LYS A 272 3.395 -14.114 5.825 1.00 0.00 C ATOM 292 CG LYS A 272 4.827 -14.380 5.369 1.00 0.00 C ATOM 293 CD LYS A 272 5.173 -15.867 5.362 1.00 0.00 C ATOM 294 CE LYS A 272 4.538 -16.605 4.192 1.00 0.00 C ATOM 295 NZ LYS A 272 4.949 -16.030 2.882 1.00 0.00 N ATOM 0 H LYS A 272 3.352 -13.020 3.616 1.00 0.00 H new ATOM 0 HA LYS A 272 2.384 -15.498 4.526 1.00 0.00 H new ATOM 0 HB2 LYS A 272 3.305 -13.065 6.106 1.00 0.00 H new ATOM 0 HB3 LYS A 272 3.196 -14.702 6.721 1.00 0.00 H new ATOM 0 HG2 LYS A 272 4.967 -13.973 4.368 1.00 0.00 H new ATOM 0 HG3 LYS A 272 5.518 -13.853 6.027 1.00 0.00 H new ATOM 0 HD2 LYS A 272 6.256 -15.985 5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 272 4.841 -16.319 6.297 1.00 0.00 H new ATOM 0 HE2 LYS A 272 4.820 -17.657 4.231 1.00 0.00 H new ATOM 0 HE3 LYS A 272 3.453 -16.562 4.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 5.000 -16.787 2.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 4.252 -15.319 2.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 5.882 -15.581 2.977 1.00 0.00 H new ATOM 396 N MET B 1 -15.612 0.859 1.520 1.00 0.00 N ATOM 397 CA MET B 1 -15.135 0.021 2.652 1.00 0.00 C ATOM 398 C MET B 1 -13.954 0.671 3.365 1.00 0.00 C ATOM 399 O MET B 1 -13.042 1.196 2.725 1.00 0.00 O ATOM 400 CB MET B 1 -14.737 -1.354 2.110 1.00 0.00 C ATOM 401 CG MET B 1 -13.645 -1.304 1.053 1.00 0.00 C ATOM 402 SD MET B 1 -13.199 -2.939 0.437 1.00 0.00 S ATOM 403 CE MET B 1 -11.948 -2.513 -0.771 1.00 0.00 C ATOM 0 H1 MET B 1 -16.204 0.284 0.888 1.00 0.00 H new ATOM 0 H2 MET B 1 -16.171 1.655 1.889 1.00 0.00 H new ATOM 0 H3 MET B 1 -14.795 1.225 0.991 1.00 0.00 H new ATOM 0 HA MET B 1 -15.938 -0.082 3.381 1.00 0.00 H new ATOM 0 HB2 MET B 1 -14.400 -1.977 2.938 1.00 0.00 H new ATOM 0 HB3 MET B 1 -15.618 -1.836 1.686 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.979 -0.685 0.220 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.761 -0.824 1.472 1.00 0.00 H new ATOM 0 HE1 MET B 1 -11.853 -3.321 -1.496 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.236 -1.596 -1.285 1.00 0.00 H new ATOM 0 HE3 MET B 1 -10.993 -2.362 -0.268 1.00 0.00 H new ATOM 415 N GLN B 2 -13.975 0.629 4.694 1.00 0.00 N ATOM 416 CA GLN B 2 -12.904 1.209 5.496 1.00 0.00 C ATOM 417 C GLN B 2 -11.676 0.306 5.484 1.00 0.00 C ATOM 418 O GLN B 2 -11.798 -0.912 5.563 1.00 0.00 O ATOM 419 CB GLN B 2 -13.365 1.444 6.939 1.00 0.00 C ATOM 420 CG GLN B 2 -14.485 2.468 7.072 1.00 0.00 C ATOM 421 CD GLN B 2 -15.856 1.920 6.711 1.00 0.00 C ATOM 422 OE1 GLN B 2 -16.822 2.674 6.594 1.00 0.00 O ATOM 423 NE2 GLN B 2 -15.959 0.604 6.557 1.00 0.00 N ATOM 0 H GLN B 2 -14.723 0.199 5.238 1.00 0.00 H new ATOM 0 HA GLN B 2 -12.640 2.170 5.055 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -13.700 0.497 7.361 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -12.513 1.774 7.533 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -14.509 2.837 8.097 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -14.264 3.322 6.431 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -15.135 0.012 6.662 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -16.862 0.186 6.334 1.00 0.00 H new ATOM 432 N ILE B 3 -10.497 0.910 5.385 1.00 0.00 N ATOM 433 CA ILE B 3 -9.247 0.154 5.362 1.00 0.00 C ATOM 434 C ILE B 3 -8.144 0.899 6.103 1.00 0.00 C ATOM 435 O ILE B 3 -8.129 2.131 6.138 1.00 0.00 O ATOM 436 CB ILE B 3 -8.780 -0.134 3.920 1.00 0.00 C ATOM 437 CG1 ILE B 3 -8.590 1.172 3.143 1.00 0.00 C ATOM 438 CG2 ILE B 3 -9.776 -1.041 3.212 1.00 0.00 C ATOM 439 CD1 ILE B 3 -8.050 0.975 1.742 1.00 0.00 C ATOM 0 H ILE B 3 -10.379 1.921 5.319 1.00 0.00 H new ATOM 0 HA ILE B 3 -9.445 -0.794 5.862 1.00 0.00 H new ATOM 0 HB ILE B 3 -7.819 -0.646 3.964 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -9.546 1.692 3.084 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.910 1.818 3.697 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.433 -1.235 2.196 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.859 -1.983 3.753 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -10.751 -0.555 3.179 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.942 1.944 1.254 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -7.078 0.484 1.792 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -8.740 0.355 1.170 1.00 0.00 H new ATOM 451 N PHE B 4 -7.223 0.145 6.703 1.00 0.00 N ATOM 452 CA PHE B 4 -6.120 0.744 7.447 1.00 0.00 C ATOM 453 C PHE B 4 -4.809 0.653 6.682 1.00 0.00 C ATOM 454 O PHE B 4 -4.435 -0.412 6.190 1.00 0.00 O ATOM 455 CB PHE B 4 -5.957 0.084 8.815 1.00 0.00 C ATOM 456 CG PHE B 4 -6.902 0.608 9.854 1.00 0.00 C ATOM 457 CD1 PHE B 4 -8.215 0.169 9.912 1.00 0.00 C ATOM 458 CD2 PHE B 4 -6.469 1.543 10.779 1.00 0.00 C ATOM 459 CE1 PHE B 4 -9.078 0.655 10.876 1.00 0.00 C ATOM 460 CE2 PHE B 4 -7.325 2.032 11.744 1.00 0.00 C ATOM 461 CZ PHE B 4 -8.632 1.588 11.794 1.00 0.00 C ATOM 0 H PHE B 4 -7.220 -0.875 6.688 1.00 0.00 H new ATOM 0 HA PHE B 4 -6.368 1.796 7.584 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.106 -0.991 8.710 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -4.934 0.232 9.160 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -8.567 -0.560 9.197 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -5.448 1.894 10.745 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -10.100 0.306 10.912 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -6.974 2.761 12.459 1.00 0.00 H new ATOM 0 HZ PHE B 4 -9.304 1.969 12.549 1.00 0.00 H new ATOM 471 N VAL B 5 -4.105 1.777 6.605 1.00 0.00 N ATOM 472 CA VAL B 5 -2.822 1.829 5.924 1.00 0.00 C ATOM 473 C VAL B 5 -1.683 1.815 6.937 1.00 0.00 C ATOM 474 O VAL B 5 -1.556 2.728 7.755 1.00 0.00 O ATOM 475 CB VAL B 5 -2.702 3.086 5.042 1.00 0.00 C ATOM 476 CG1 VAL B 5 -1.361 3.113 4.323 1.00 0.00 C ATOM 477 CG2 VAL B 5 -3.850 3.148 4.045 1.00 0.00 C ATOM 0 H VAL B 5 -4.404 2.665 7.008 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.756 0.949 5.284 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.759 3.964 5.685 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -1.297 4.009 3.706 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.555 3.120 5.057 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -1.269 2.230 3.691 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -3.750 4.042 3.430 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -3.826 2.264 3.407 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.798 3.182 4.583 1.00 0.00 H new ATOM 487 N LYS B 6 -0.859 0.774 6.878 1.00 0.00 N ATOM 488 CA LYS B 6 0.271 0.640 7.789 1.00 0.00 C ATOM 489 C LYS B 6 1.540 1.207 7.164 1.00 0.00 C ATOM 490 O LYS B 6 1.962 0.775 6.088 1.00 0.00 O ATOM 491 CB LYS B 6 0.486 -0.829 8.161 1.00 0.00 C ATOM 492 CG LYS B 6 1.639 -1.053 9.127 1.00 0.00 C ATOM 493 CD LYS B 6 1.787 -2.523 9.485 1.00 0.00 C ATOM 494 CE LYS B 6 2.921 -2.746 10.474 1.00 0.00 C ATOM 495 NZ LYS B 6 4.234 -2.309 9.925 1.00 0.00 N ATOM 0 H LYS B 6 -0.953 0.011 6.208 1.00 0.00 H new ATOM 0 HA LYS B 6 0.045 1.206 8.693 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.429 -1.220 8.605 1.00 0.00 H new ATOM 0 HB3 LYS B 6 0.669 -1.402 7.252 1.00 0.00 H new ATOM 0 HG2 LYS B 6 2.565 -0.691 8.680 1.00 0.00 H new ATOM 0 HG3 LYS B 6 1.474 -0.471 10.034 1.00 0.00 H new ATOM 0 HD2 LYS B 6 0.854 -2.890 9.912 1.00 0.00 H new ATOM 0 HD3 LYS B 6 1.973 -3.102 8.580 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.713 -2.199 11.394 1.00 0.00 H new ATOM 0 HE3 LYS B 6 2.971 -3.803 10.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.999 -2.645 10.545 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.361 -2.706 8.972 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 4.261 -1.271 9.874 1.00 0.00 H new ATOM 509 N THR B 7 2.150 2.167 7.847 1.00 0.00 N ATOM 510 CA THR B 7 3.375 2.783 7.364 1.00 0.00 C ATOM 511 C THR B 7 4.579 1.895 7.642 1.00 0.00 C ATOM 512 O THR B 7 4.637 1.221 8.671 1.00 0.00 O ATOM 513 CB THR B 7 3.606 4.166 7.997 1.00 0.00 C ATOM 514 OG1 THR B 7 3.561 4.069 9.425 1.00 0.00 O ATOM 515 CG2 THR B 7 2.560 5.156 7.512 1.00 0.00 C ATOM 0 H THR B 7 1.815 2.535 8.737 1.00 0.00 H new ATOM 0 HA THR B 7 3.260 2.909 6.287 1.00 0.00 H new ATOM 0 HB THR B 7 4.591 4.523 7.695 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.332 3.152 9.684 1.00 0.00 H new ATOM 0 HG21 THR B 7 2.739 6.129 7.970 1.00 0.00 H new ATOM 0 HG22 THR B 7 2.622 5.249 6.428 1.00 0.00 H new ATOM 0 HG23 THR B 7 1.567 4.802 7.790 1.00 0.00 H new ATOM 563 N LYS B 11 2.844 2.443 11.703 1.00 0.00 N ATOM 564 CA LYS B 11 1.670 3.212 12.104 1.00 0.00 C ATOM 565 C LYS B 11 0.495 2.980 11.156 1.00 0.00 C ATOM 566 O LYS B 11 0.565 3.306 9.972 1.00 0.00 O ATOM 567 CB LYS B 11 2.013 4.701 12.137 1.00 0.00 C ATOM 568 CG LYS B 11 0.901 5.574 12.698 1.00 0.00 C ATOM 569 CD LYS B 11 1.287 7.046 12.694 1.00 0.00 C ATOM 570 CE LYS B 11 1.524 7.561 11.283 1.00 0.00 C ATOM 571 NZ LYS B 11 1.903 9.001 11.276 1.00 0.00 N ATOM 0 HA LYS B 11 1.375 2.876 13.098 1.00 0.00 H new ATOM 0 HB2 LYS B 11 2.912 4.844 12.736 1.00 0.00 H new ATOM 0 HB3 LYS B 11 2.248 5.033 11.126 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.005 5.433 12.108 1.00 0.00 H new ATOM 0 HG3 LYS B 11 0.670 5.261 13.716 1.00 0.00 H new ATOM 0 HD2 LYS B 11 0.498 7.630 13.167 1.00 0.00 H new ATOM 0 HD3 LYS B 11 2.189 7.187 13.289 1.00 0.00 H new ATOM 0 HE2 LYS B 11 2.312 6.975 10.810 1.00 0.00 H new ATOM 0 HE3 LYS B 11 0.622 7.420 10.688 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.056 9.315 10.296 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 1.140 9.563 11.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 2.778 9.132 11.822 1.00 0.00 H new ATOM 585 N THR B 12 -0.591 2.431 11.694 1.00 0.00 N ATOM 586 CA THR B 12 -1.791 2.171 10.910 1.00 0.00 C ATOM 587 C THR B 12 -2.764 3.341 11.012 1.00 0.00 C ATOM 588 O THR B 12 -2.952 3.905 12.089 1.00 0.00 O ATOM 589 CB THR B 12 -2.503 0.889 11.379 1.00 0.00 C ATOM 590 OG1 THR B 12 -2.809 0.980 12.776 1.00 0.00 O ATOM 591 CG2 THR B 12 -1.642 -0.339 11.121 1.00 0.00 C ATOM 0 H THR B 12 -0.663 2.157 12.674 1.00 0.00 H new ATOM 0 HA THR B 12 -1.476 2.042 9.874 1.00 0.00 H new ATOM 0 HB THR B 12 -3.428 0.788 10.811 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.263 0.161 13.065 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.168 -1.231 11.462 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.439 -0.423 10.053 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.701 -0.244 11.663 1.00 0.00 H new ATOM 599 N ILE B 13 -3.379 3.706 9.891 1.00 0.00 N ATOM 600 CA ILE B 13 -4.326 4.816 9.880 1.00 0.00 C ATOM 601 C ILE B 13 -5.617 4.454 9.152 1.00 0.00 C ATOM 602 O ILE B 13 -5.597 3.792 8.115 1.00 0.00 O ATOM 603 CB ILE B 13 -3.723 6.071 9.220 1.00 0.00 C ATOM 604 CG1 ILE B 13 -2.435 6.494 9.935 1.00 0.00 C ATOM 605 CG2 ILE B 13 -4.741 7.202 9.228 1.00 0.00 C ATOM 606 CD1 ILE B 13 -2.635 6.876 11.388 1.00 0.00 C ATOM 0 H ILE B 13 -3.241 3.255 8.987 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.552 5.030 10.925 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.470 5.836 8.186 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -1.716 5.677 9.880 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.998 7.340 9.404 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.307 8.085 8.760 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.629 6.897 8.674 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.018 7.435 10.256 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.678 7.163 11.824 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.329 7.714 11.452 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.042 6.026 11.935 1.00 0.00 H new ATOM 618 N THR B 14 -6.740 4.906 9.707 1.00 0.00 N ATOM 619 CA THR B 14 -8.050 4.648 9.121 1.00 0.00 C ATOM 620 C THR B 14 -8.229 5.419 7.817 1.00 0.00 C ATOM 621 O THR B 14 -7.836 6.582 7.718 1.00 0.00 O ATOM 622 CB THR B 14 -9.185 5.054 10.081 1.00 0.00 C ATOM 623 OG1 THR B 14 -8.984 4.458 11.367 1.00 0.00 O ATOM 624 CG2 THR B 14 -10.537 4.627 9.528 1.00 0.00 C ATOM 0 H THR B 14 -6.766 5.455 10.566 1.00 0.00 H new ATOM 0 HA THR B 14 -8.100 3.576 8.928 1.00 0.00 H new ATOM 0 HB THR B 14 -9.172 6.139 10.180 1.00 0.00 H new ATOM 0 HG1 THR B 14 -8.504 3.610 11.263 1.00 0.00 H new ATOM 0 HG21 THR B 14 -11.324 4.923 10.222 1.00 0.00 H new ATOM 0 HG22 THR B 14 -10.704 5.107 8.564 1.00 0.00 H new ATOM 0 HG23 THR B 14 -10.553 3.544 9.402 1.00 0.00 H new ATOM 632 N LEU B 15 -8.836 4.776 6.824 1.00 0.00 N ATOM 633 CA LEU B 15 -9.075 5.424 5.539 1.00 0.00 C ATOM 634 C LEU B 15 -10.202 4.717 4.789 1.00 0.00 C ATOM 635 O LEU B 15 -10.043 3.587 4.328 1.00 0.00 O ATOM 636 CB LEU B 15 -7.794 5.420 4.696 1.00 0.00 C ATOM 637 CG LEU B 15 -7.657 6.574 3.693 1.00 0.00 C ATOM 638 CD1 LEU B 15 -8.824 6.598 2.718 1.00 0.00 C ATOM 639 CD2 LEU B 15 -7.549 7.903 4.425 1.00 0.00 C ATOM 0 H LEU B 15 -9.169 3.814 6.883 1.00 0.00 H new ATOM 0 HA LEU B 15 -9.372 6.457 5.721 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -6.937 5.444 5.369 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -7.743 4.479 4.149 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.744 6.414 3.119 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -8.698 7.426 2.021 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -8.855 5.659 2.165 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -9.756 6.726 3.269 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.452 8.711 3.700 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.444 8.061 5.027 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -6.673 7.891 5.074 1.00 0.00 H new ATOM 651 N GLU B 16 -11.341 5.394 4.675 1.00 0.00 N ATOM 652 CA GLU B 16 -12.502 4.837 3.987 1.00 0.00 C ATOM 653 C GLU B 16 -12.437 5.102 2.486 1.00 0.00 C ATOM 654 O GLU B 16 -12.186 6.228 2.055 1.00 0.00 O ATOM 655 CB GLU B 16 -13.790 5.426 4.567 1.00 0.00 C ATOM 656 CG GLU B 16 -15.049 4.895 3.922 1.00 0.00 C ATOM 657 CD GLU B 16 -16.310 5.504 4.506 1.00 0.00 C ATOM 658 OE1 GLU B 16 -16.196 6.339 5.428 1.00 0.00 O ATOM 659 OE2 GLU B 16 -17.413 5.143 4.043 1.00 0.00 O ATOM 0 H GLU B 16 -11.485 6.331 5.051 1.00 0.00 H new ATOM 0 HA GLU B 16 -12.498 3.758 4.140 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.825 5.217 5.636 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -13.765 6.510 4.455 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -15.016 5.096 2.851 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.085 3.812 4.042 1.00 0.00 H new ATOM 666 N VAL B 17 -12.682 4.058 1.698 1.00 0.00 N ATOM 667 CA VAL B 17 -12.669 4.165 0.241 1.00 0.00 C ATOM 668 C VAL B 17 -13.576 3.115 -0.387 1.00 0.00 C ATOM 669 O VAL B 17 -13.526 1.938 -0.027 1.00 0.00 O ATOM 670 CB VAL B 17 -11.249 4.000 -0.341 1.00 0.00 C ATOM 671 CG1 VAL B 17 -10.371 5.192 0.008 1.00 0.00 C ATOM 672 CG2 VAL B 17 -10.616 2.706 0.150 1.00 0.00 C ATOM 0 H VAL B 17 -12.893 3.123 2.047 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.032 5.165 0.002 1.00 0.00 H new ATOM 0 HB VAL B 17 -11.334 3.953 -1.427 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -9.377 5.048 -0.415 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -10.812 6.101 -0.402 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.294 5.283 1.092 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -9.615 2.608 -0.271 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -10.552 2.722 1.238 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -11.227 1.860 -0.165 1.00 0.00 H new ATOM 682 N GLU B 18 -14.404 3.547 -1.331 1.00 0.00 N ATOM 683 CA GLU B 18 -15.321 2.646 -2.014 1.00 0.00 C ATOM 684 C GLU B 18 -14.552 1.599 -2.812 1.00 0.00 C ATOM 685 O GLU B 18 -13.484 1.882 -3.350 1.00 0.00 O ATOM 686 CB GLU B 18 -16.249 3.434 -2.941 1.00 0.00 C ATOM 687 CG GLU B 18 -17.090 4.477 -2.219 1.00 0.00 C ATOM 688 CD GLU B 18 -18.051 3.870 -1.212 1.00 0.00 C ATOM 689 OE1 GLU B 18 -18.106 2.626 -1.110 1.00 0.00 O ATOM 690 OE2 GLU B 18 -18.756 4.642 -0.528 1.00 0.00 O ATOM 0 H GLU B 18 -14.458 4.517 -1.640 1.00 0.00 H new ATOM 0 HA GLU B 18 -15.923 2.136 -1.262 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -15.650 3.928 -3.706 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -16.912 2.738 -3.455 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -16.430 5.177 -1.707 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -17.656 5.051 -2.953 1.00 0.00 H new ATOM 697 N SER B 19 -15.096 0.389 -2.881 1.00 0.00 N ATOM 698 CA SER B 19 -14.451 -0.693 -3.615 1.00 0.00 C ATOM 699 C SER B 19 -14.184 -0.280 -5.060 1.00 0.00 C ATOM 700 O SER B 19 -13.110 -0.539 -5.602 1.00 0.00 O ATOM 701 CB SER B 19 -15.318 -1.952 -3.582 1.00 0.00 C ATOM 702 OG SER B 19 -16.585 -1.716 -4.171 1.00 0.00 O ATOM 0 H SER B 19 -15.979 0.133 -2.439 1.00 0.00 H new ATOM 0 HA SER B 19 -13.497 -0.909 -3.133 1.00 0.00 H new ATOM 0 HB2 SER B 19 -14.812 -2.759 -4.112 1.00 0.00 H new ATOM 0 HB3 SER B 19 -15.449 -2.280 -2.551 1.00 0.00 H new ATOM 0 HG SER B 19 -17.119 -2.537 -4.139 1.00 0.00 H new ATOM 708 N SER B 20 -15.169 0.365 -5.676 1.00 0.00 N ATOM 709 CA SER B 20 -15.041 0.819 -7.057 1.00 0.00 C ATOM 710 C SER B 20 -14.295 2.151 -7.134 1.00 0.00 C ATOM 711 O SER B 20 -14.672 3.039 -7.899 1.00 0.00 O ATOM 712 CB SER B 20 -16.424 0.956 -7.696 1.00 0.00 C ATOM 713 OG SER B 20 -17.218 1.900 -6.997 1.00 0.00 O ATOM 0 H SER B 20 -16.065 0.585 -5.241 1.00 0.00 H new ATOM 0 HA SER B 20 -14.464 0.074 -7.605 1.00 0.00 H new ATOM 0 HB2 SER B 20 -16.318 1.264 -8.736 1.00 0.00 H new ATOM 0 HB3 SER B 20 -16.924 -0.013 -7.700 1.00 0.00 H new ATOM 0 HG SER B 20 -18.096 1.970 -7.426 1.00 0.00 H new ATOM 719 N ASP B 21 -13.236 2.286 -6.339 1.00 0.00 N ATOM 720 CA ASP B 21 -12.444 3.513 -6.325 1.00 0.00 C ATOM 721 C ASP B 21 -11.067 3.284 -6.942 1.00 0.00 C ATOM 722 O ASP B 21 -10.370 2.330 -6.597 1.00 0.00 O ATOM 723 CB ASP B 21 -12.291 4.032 -4.892 1.00 0.00 C ATOM 724 CG ASP B 21 -11.553 5.356 -4.820 1.00 0.00 C ATOM 725 OD1 ASP B 21 -11.203 5.904 -5.886 1.00 0.00 O ATOM 726 OD2 ASP B 21 -11.327 5.847 -3.694 1.00 0.00 O ATOM 0 H ASP B 21 -12.907 1.564 -5.698 1.00 0.00 H new ATOM 0 HA ASP B 21 -12.970 4.258 -6.922 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -13.278 4.147 -4.445 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -11.757 3.291 -4.297 1.00 0.00 H new ATOM 731 N THR B 22 -10.683 4.173 -7.852 1.00 0.00 N ATOM 732 CA THR B 22 -9.389 4.083 -8.519 1.00 0.00 C ATOM 733 C THR B 22 -8.247 4.316 -7.536 1.00 0.00 C ATOM 734 O THR B 22 -8.364 5.126 -6.617 1.00 0.00 O ATOM 735 CB THR B 22 -9.279 5.104 -9.666 1.00 0.00 C ATOM 736 OG1 THR B 22 -9.443 6.433 -9.156 1.00 0.00 O ATOM 737 CG2 THR B 22 -10.330 4.833 -10.733 1.00 0.00 C ATOM 0 H THR B 22 -11.252 4.967 -8.145 1.00 0.00 H new ATOM 0 HA THR B 22 -9.312 3.076 -8.929 1.00 0.00 H new ATOM 0 HB THR B 22 -8.291 5.007 -10.117 1.00 0.00 H new ATOM 0 HG1 THR B 22 -9.370 7.077 -9.891 1.00 0.00 H new ATOM 0 HG21 THR B 22 -10.233 5.567 -11.533 1.00 0.00 H new ATOM 0 HG22 THR B 22 -10.186 3.832 -11.139 1.00 0.00 H new ATOM 0 HG23 THR B 22 -11.324 4.906 -10.292 1.00 0.00 H new ATOM 745 N ILE B 23 -7.146 3.598 -7.736 1.00 0.00 N ATOM 746 CA ILE B 23 -5.979 3.721 -6.868 1.00 0.00 C ATOM 747 C ILE B 23 -5.512 5.171 -6.761 1.00 0.00 C ATOM 748 O ILE B 23 -5.154 5.636 -5.680 1.00 0.00 O ATOM 749 CB ILE B 23 -4.810 2.848 -7.375 1.00 0.00 C ATOM 750 CG1 ILE B 23 -5.186 1.363 -7.320 1.00 0.00 C ATOM 751 CG2 ILE B 23 -3.547 3.112 -6.567 1.00 0.00 C ATOM 752 CD1 ILE B 23 -5.510 0.864 -5.927 1.00 0.00 C ATOM 0 H ILE B 23 -7.037 2.923 -8.493 1.00 0.00 H new ATOM 0 HA ILE B 23 -6.284 3.374 -5.881 1.00 0.00 H new ATOM 0 HB ILE B 23 -4.610 3.115 -8.413 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -6.047 1.192 -7.966 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -4.362 0.774 -7.724 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -2.737 2.486 -6.942 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -3.268 4.161 -6.661 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -3.730 2.878 -5.518 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -5.766 -0.195 -5.970 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -4.643 1.002 -5.281 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -6.354 1.426 -5.527 1.00 0.00 H new ATOM 764 N ASP B 24 -5.512 5.877 -7.888 1.00 0.00 N ATOM 765 CA ASP B 24 -5.081 7.273 -7.919 1.00 0.00 C ATOM 766 C ASP B 24 -5.900 8.121 -6.947 1.00 0.00 C ATOM 767 O ASP B 24 -5.344 8.862 -6.132 1.00 0.00 O ATOM 768 CB ASP B 24 -5.208 7.832 -9.339 1.00 0.00 C ATOM 769 CG ASP B 24 -4.709 9.260 -9.453 1.00 0.00 C ATOM 770 OD1 ASP B 24 -5.276 10.146 -8.780 1.00 0.00 O ATOM 771 OD2 ASP B 24 -3.748 9.491 -10.217 1.00 0.00 O ATOM 0 H ASP B 24 -5.805 5.506 -8.792 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.036 7.313 -7.610 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -4.646 7.199 -10.026 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -6.252 7.790 -9.649 1.00 0.00 H new ATOM 776 N ASN B 25 -7.222 8.006 -7.035 1.00 0.00 N ATOM 777 CA ASN B 25 -8.111 8.761 -6.161 1.00 0.00 C ATOM 778 C ASN B 25 -7.828 8.430 -4.701 1.00 0.00 C ATOM 779 O ASN B 25 -7.771 9.320 -3.849 1.00 0.00 O ATOM 780 CB ASN B 25 -9.573 8.462 -6.494 1.00 0.00 C ATOM 781 CG ASN B 25 -10.532 9.306 -5.677 1.00 0.00 C ATOM 782 OD1 ASN B 25 -10.513 10.534 -5.752 1.00 0.00 O ATOM 783 ND2 ASN B 25 -11.376 8.651 -4.888 1.00 0.00 N ATOM 0 H ASN B 25 -7.699 7.399 -7.701 1.00 0.00 H new ATOM 0 HA ASN B 25 -7.928 9.823 -6.322 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -9.746 8.643 -7.555 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -9.776 7.407 -6.313 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -12.042 9.167 -4.314 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -11.358 7.632 -4.856 1.00 0.00 H new ATOM 790 N VAL B 26 -7.640 7.143 -4.421 1.00 0.00 N ATOM 791 CA VAL B 26 -7.350 6.692 -3.067 1.00 0.00 C ATOM 792 C VAL B 26 -6.083 7.356 -2.544 1.00 0.00 C ATOM 793 O VAL B 26 -6.031 7.794 -1.396 1.00 0.00 O ATOM 794 CB VAL B 26 -7.182 5.161 -3.003 1.00 0.00 C ATOM 795 CG1 VAL B 26 -6.896 4.713 -1.578 1.00 0.00 C ATOM 796 CG2 VAL B 26 -8.419 4.463 -3.550 1.00 0.00 C ATOM 0 H VAL B 26 -7.684 6.396 -5.114 1.00 0.00 H new ATOM 0 HA VAL B 26 -8.198 6.975 -2.444 1.00 0.00 H new ATOM 0 HB VAL B 26 -6.331 4.883 -3.625 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -6.781 3.629 -1.553 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -5.978 5.184 -1.226 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -7.724 5.004 -0.932 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -8.281 3.383 -3.496 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -9.289 4.748 -2.958 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -8.574 4.758 -4.588 1.00 0.00 H new ATOM 806 N LYS B 27 -5.067 7.434 -3.398 1.00 0.00 N ATOM 807 CA LYS B 27 -3.802 8.055 -3.026 1.00 0.00 C ATOM 808 C LYS B 27 -4.018 9.512 -2.644 1.00 0.00 C ATOM 809 O LYS B 27 -3.441 9.998 -1.673 1.00 0.00 O ATOM 810 CB LYS B 27 -2.795 7.950 -4.173 1.00 0.00 C ATOM 811 CG LYS B 27 -2.424 6.518 -4.522 1.00 0.00 C ATOM 812 CD LYS B 27 -1.649 5.851 -3.396 1.00 0.00 C ATOM 813 CE LYS B 27 -1.399 4.381 -3.691 1.00 0.00 C ATOM 814 NZ LYS B 27 -2.664 3.596 -3.711 1.00 0.00 N ATOM 0 H LYS B 27 -5.096 7.075 -4.352 1.00 0.00 H new ATOM 0 HA LYS B 27 -3.399 7.525 -2.163 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -3.210 8.435 -5.056 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -1.891 8.496 -3.904 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -3.329 5.947 -4.730 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -1.825 6.508 -5.433 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.697 6.362 -3.255 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -2.204 5.947 -2.463 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -0.896 4.284 -4.653 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -0.728 3.969 -2.938 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -2.466 2.626 -4.031 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -3.071 3.569 -2.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -3.340 4.044 -4.362 1.00 0.00 H new ATOM 828 N SER B 28 -4.863 10.201 -3.407 1.00 0.00 N ATOM 829 CA SER B 28 -5.163 11.601 -3.134 1.00 0.00 C ATOM 830 C SER B 28 -5.749 11.752 -1.733 1.00 0.00 C ATOM 831 O SER B 28 -5.316 12.602 -0.953 1.00 0.00 O ATOM 832 CB SER B 28 -6.141 12.152 -4.173 1.00 0.00 C ATOM 833 OG SER B 28 -5.600 12.061 -5.480 1.00 0.00 O ATOM 0 H SER B 28 -5.349 9.813 -4.215 1.00 0.00 H new ATOM 0 HA SER B 28 -4.235 12.170 -3.192 1.00 0.00 H new ATOM 0 HB2 SER B 28 -7.079 11.598 -4.125 1.00 0.00 H new ATOM 0 HB3 SER B 28 -6.373 13.192 -3.943 1.00 0.00 H new ATOM 0 HG SER B 28 -5.515 11.118 -5.734 1.00 0.00 H new ATOM 839 N LYS B 29 -6.729 10.908 -1.417 1.00 0.00 N ATOM 840 CA LYS B 29 -7.368 10.935 -0.106 1.00 0.00 C ATOM 841 C LYS B 29 -6.349 10.663 0.992 1.00 0.00 C ATOM 842 O LYS B 29 -6.344 11.329 2.027 1.00 0.00 O ATOM 843 CB LYS B 29 -8.495 9.904 -0.039 1.00 0.00 C ATOM 844 CG LYS B 29 -9.618 10.166 -1.027 1.00 0.00 C ATOM 845 CD LYS B 29 -10.732 9.143 -0.884 1.00 0.00 C ATOM 846 CE LYS B 29 -11.877 9.430 -1.840 1.00 0.00 C ATOM 847 NZ LYS B 29 -12.457 10.783 -1.619 1.00 0.00 N ATOM 0 H LYS B 29 -7.097 10.198 -2.051 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.790 11.928 0.046 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.081 8.913 -0.226 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.906 9.892 0.971 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.019 11.167 -0.868 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -9.225 10.138 -2.043 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.338 8.145 -1.076 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -11.103 9.148 0.141 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -11.521 9.351 -2.867 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.654 8.676 -1.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.377 10.849 -2.099 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.586 10.943 -0.600 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -11.814 11.504 -2.004 1.00 0.00 H new ATOM 861 N ILE B 30 -5.481 9.684 0.754 1.00 0.00 N ATOM 862 CA ILE B 30 -4.447 9.326 1.715 1.00 0.00 C ATOM 863 C ILE B 30 -3.488 10.492 1.932 1.00 0.00 C ATOM 864 O ILE B 30 -3.024 10.727 3.047 1.00 0.00 O ATOM 865 CB ILE B 30 -3.655 8.082 1.259 1.00 0.00 C ATOM 866 CG1 ILE B 30 -4.585 6.868 1.170 1.00 0.00 C ATOM 867 CG2 ILE B 30 -2.501 7.805 2.213 1.00 0.00 C ATOM 868 CD1 ILE B 30 -3.897 5.606 0.696 1.00 0.00 C ATOM 0 H ILE B 30 -5.475 9.124 -0.099 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.946 9.090 2.655 1.00 0.00 H new ATOM 0 HB ILE B 30 -3.240 8.275 0.270 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -5.024 6.685 2.151 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.406 7.100 0.492 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.954 6.925 1.876 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -1.830 8.664 2.232 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.892 7.628 3.215 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.619 4.790 0.659 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -3.482 5.769 -0.299 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.094 5.348 1.386 1.00 0.00 H new ATOM 880 N GLN B 31 -3.200 11.223 0.860 1.00 0.00 N ATOM 881 CA GLN B 31 -2.303 12.370 0.937 1.00 0.00 C ATOM 882 C GLN B 31 -2.876 13.439 1.861 1.00 0.00 C ATOM 883 O GLN B 31 -2.183 13.951 2.736 1.00 0.00 O ATOM 884 CB GLN B 31 -2.062 12.958 -0.456 1.00 0.00 C ATOM 885 CG GLN B 31 -1.222 14.226 -0.444 1.00 0.00 C ATOM 886 CD GLN B 31 -1.010 14.802 -1.831 1.00 0.00 C ATOM 887 OE1 GLN B 31 -1.967 15.120 -2.538 1.00 0.00 O ATOM 888 NE2 GLN B 31 0.250 14.943 -2.226 1.00 0.00 N ATOM 0 H GLN B 31 -3.574 11.042 -0.071 1.00 0.00 H new ATOM 0 HA GLN B 31 -1.351 12.029 1.344 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.568 12.210 -1.076 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -3.024 13.173 -0.922 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -1.708 14.973 0.184 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -0.253 14.011 0.007 1.00 0.00 H new ATOM 0 HE21 GLN B 31 1.012 14.666 -1.607 1.00 0.00 H new ATOM 0 HE22 GLN B 31 0.455 15.328 -3.148 1.00 0.00 H new ATOM 897 N ASP B 32 -4.146 13.771 1.660 1.00 0.00 N ATOM 898 CA ASP B 32 -4.811 14.773 2.468 1.00 0.00 C ATOM 899 C ASP B 32 -4.948 14.317 3.920 1.00 0.00 C ATOM 900 O ASP B 32 -4.768 15.105 4.848 1.00 0.00 O ATOM 901 CB ASP B 32 -6.186 15.062 1.874 1.00 0.00 C ATOM 902 CG ASP B 32 -6.103 15.745 0.522 1.00 0.00 C ATOM 903 OD1 ASP B 32 -5.501 15.161 -0.403 1.00 0.00 O ATOM 904 OD2 ASP B 32 -6.642 16.863 0.388 1.00 0.00 O ATOM 0 H ASP B 32 -4.735 13.355 0.938 1.00 0.00 H new ATOM 0 HA ASP B 32 -4.208 15.681 2.464 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -6.738 14.128 1.772 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -6.750 15.692 2.562 1.00 0.00 H new ATOM 909 N LYS B 33 -5.282 13.043 4.105 1.00 0.00 N ATOM 910 CA LYS B 33 -5.462 12.477 5.440 1.00 0.00 C ATOM 911 C LYS B 33 -4.137 12.338 6.190 1.00 0.00 C ATOM 912 O LYS B 33 -3.908 13.013 7.194 1.00 0.00 O ATOM 913 CB LYS B 33 -6.140 11.107 5.333 1.00 0.00 C ATOM 914 CG LYS B 33 -6.344 10.413 6.673 1.00 0.00 C ATOM 915 CD LYS B 33 -7.296 11.188 7.570 1.00 0.00 C ATOM 916 CE LYS B 33 -8.686 11.285 6.961 1.00 0.00 C ATOM 917 NZ LYS B 33 -9.303 9.944 6.769 1.00 0.00 N ATOM 0 H LYS B 33 -5.434 12.380 3.345 1.00 0.00 H new ATOM 0 HA LYS B 33 -6.091 13.164 6.006 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -7.108 11.229 4.847 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -5.539 10.464 4.690 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -6.736 9.410 6.507 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -5.383 10.300 7.174 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -7.358 10.701 8.543 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -6.902 12.190 7.740 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -9.324 11.889 7.606 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -8.627 11.798 6.001 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -9.433 9.764 5.753 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -8.682 9.215 7.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -10.227 9.915 7.246 1.00 0.00 H new ATOM 931 N GLU B 34 -3.281 11.443 5.709 1.00 0.00 N ATOM 932 CA GLU B 34 -1.989 11.190 6.344 1.00 0.00 C ATOM 933 C GLU B 34 -1.010 12.344 6.142 1.00 0.00 C ATOM 934 O GLU B 34 -0.268 12.701 7.057 1.00 0.00 O ATOM 935 CB GLU B 34 -1.381 9.896 5.802 1.00 0.00 C ATOM 936 CG GLU B 34 -2.228 8.663 6.076 1.00 0.00 C ATOM 937 CD GLU B 34 -1.593 7.389 5.551 1.00 0.00 C ATOM 938 OE1 GLU B 34 -0.491 7.470 4.967 1.00 0.00 O ATOM 939 OE2 GLU B 34 -2.198 6.311 5.722 1.00 0.00 O ATOM 0 H GLU B 34 -3.458 10.878 4.879 1.00 0.00 H new ATOM 0 HA GLU B 34 -2.169 11.094 7.415 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -1.236 9.995 4.726 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -0.395 9.755 6.244 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -2.388 8.569 7.150 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -3.208 8.791 5.617 1.00 0.00 H new ATOM 946 N GLY B 35 -0.996 12.911 4.941 1.00 0.00 N ATOM 947 CA GLY B 35 -0.082 14.003 4.652 1.00 0.00 C ATOM 948 C GLY B 35 1.246 13.505 4.117 1.00 0.00 C ATOM 949 O GLY B 35 2.307 13.878 4.618 1.00 0.00 O ATOM 0 H GLY B 35 -1.598 12.636 4.165 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -0.538 14.674 3.924 1.00 0.00 H new ATOM 0 HA3 GLY B 35 0.087 14.584 5.559 1.00 0.00 H new ATOM 953 N ILE B 36 1.181 12.650 3.099 1.00 0.00 N ATOM 954 CA ILE B 36 2.379 12.082 2.490 1.00 0.00 C ATOM 955 C ILE B 36 2.251 12.047 0.965 1.00 0.00 C ATOM 956 O ILE B 36 1.195 11.701 0.435 1.00 0.00 O ATOM 957 CB ILE B 36 2.637 10.650 3.012 1.00 0.00 C ATOM 958 CG1 ILE B 36 2.784 10.661 4.536 1.00 0.00 C ATOM 959 CG2 ILE B 36 3.877 10.055 2.359 1.00 0.00 C ATOM 960 CD1 ILE B 36 2.956 9.284 5.141 1.00 0.00 C ATOM 0 H ILE B 36 0.307 12.335 2.678 1.00 0.00 H new ATOM 0 HA ILE B 36 3.219 12.720 2.765 1.00 0.00 H new ATOM 0 HB ILE B 36 1.783 10.026 2.749 1.00 0.00 H new ATOM 0 HG12 ILE B 36 3.643 11.276 4.805 1.00 0.00 H new ATOM 0 HG13 ILE B 36 1.904 11.133 4.974 1.00 0.00 H new ATOM 0 HG21 ILE B 36 4.041 9.047 2.740 1.00 0.00 H new ATOM 0 HG22 ILE B 36 3.736 10.016 1.279 1.00 0.00 H new ATOM 0 HG23 ILE B 36 4.743 10.675 2.590 1.00 0.00 H new ATOM 0 HD11 ILE B 36 3.054 9.372 6.223 1.00 0.00 H new ATOM 0 HD12 ILE B 36 2.086 8.671 4.904 1.00 0.00 H new ATOM 0 HD13 ILE B 36 3.852 8.816 4.732 1.00 0.00 H new ATOM 972 N PRO B 37 3.325 12.412 0.235 1.00 0.00 N ATOM 973 CA PRO B 37 3.313 12.419 -1.232 1.00 0.00 C ATOM 974 C PRO B 37 2.881 11.076 -1.816 1.00 0.00 C ATOM 975 O PRO B 37 3.353 10.026 -1.382 1.00 0.00 O ATOM 976 CB PRO B 37 4.768 12.706 -1.610 1.00 0.00 C ATOM 977 CG PRO B 37 5.364 13.371 -0.418 1.00 0.00 C ATOM 978 CD PRO B 37 4.624 12.847 0.782 1.00 0.00 C ATOM 0 HA PRO B 37 2.604 13.150 -1.621 1.00 0.00 H new ATOM 0 HB2 PRO B 37 5.299 11.786 -1.853 1.00 0.00 H new ATOM 0 HB3 PRO B 37 4.826 13.349 -2.488 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.429 13.150 -0.343 1.00 0.00 H new ATOM 0 HG3 PRO B 37 5.267 14.454 -0.490 1.00 0.00 H new ATOM 0 HD2 PRO B 37 5.157 12.020 1.251 1.00 0.00 H new ATOM 0 HD3 PRO B 37 4.499 13.618 1.543 1.00 0.00 H new ATOM 986 N PRO B 38 1.978 11.089 -2.815 1.00 0.00 N ATOM 987 CA PRO B 38 1.492 9.861 -3.456 1.00 0.00 C ATOM 988 C PRO B 38 2.626 9.051 -4.078 1.00 0.00 C ATOM 989 O PRO B 38 2.672 7.827 -3.951 1.00 0.00 O ATOM 990 CB PRO B 38 0.540 10.369 -4.546 1.00 0.00 C ATOM 991 CG PRO B 38 0.172 11.752 -4.130 1.00 0.00 C ATOM 992 CD PRO B 38 1.366 12.295 -3.400 1.00 0.00 C ATOM 0 HA PRO B 38 1.015 9.192 -2.740 1.00 0.00 H new ATOM 0 HB2 PRO B 38 1.023 10.367 -5.523 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -0.342 9.734 -4.626 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -0.070 12.369 -4.996 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -0.708 11.745 -3.487 1.00 0.00 H new ATOM 0 HD2 PRO B 38 2.052 12.808 -4.074 1.00 0.00 H new ATOM 0 HD3 PRO B 38 1.077 13.013 -2.632 1.00 0.00 H new ATOM 1000 N ASP B 39 3.536 9.745 -4.755 1.00 0.00 N ATOM 1001 CA ASP B 39 4.671 9.099 -5.405 1.00 0.00 C ATOM 1002 C ASP B 39 5.655 8.538 -4.381 1.00 0.00 C ATOM 1003 O ASP B 39 6.134 7.412 -4.521 1.00 0.00 O ATOM 1004 CB ASP B 39 5.387 10.092 -6.322 1.00 0.00 C ATOM 1005 CG ASP B 39 4.477 10.641 -7.402 1.00 0.00 C ATOM 1006 OD1 ASP B 39 3.964 9.839 -8.211 1.00 0.00 O ATOM 1007 OD2 ASP B 39 4.274 11.873 -7.438 1.00 0.00 O ATOM 0 H ASP B 39 3.509 10.758 -4.868 1.00 0.00 H new ATOM 0 HA ASP B 39 4.288 8.268 -5.997 1.00 0.00 H new ATOM 0 HB2 ASP B 39 5.777 10.917 -5.726 1.00 0.00 H new ATOM 0 HB3 ASP B 39 6.243 9.602 -6.786 1.00 0.00 H new ATOM 1012 N GLN B 40 5.961 9.332 -3.357 1.00 0.00 N ATOM 1013 CA GLN B 40 6.898 8.912 -2.319 1.00 0.00 C ATOM 1014 C GLN B 40 6.428 7.638 -1.621 1.00 0.00 C ATOM 1015 O GLN B 40 7.144 6.637 -1.597 1.00 0.00 O ATOM 1016 CB GLN B 40 7.097 10.034 -1.294 1.00 0.00 C ATOM 1017 CG GLN B 40 7.867 11.229 -1.838 1.00 0.00 C ATOM 1018 CD GLN B 40 9.318 10.911 -2.166 1.00 0.00 C ATOM 1019 OE1 GLN B 40 10.039 11.756 -2.697 1.00 0.00 O ATOM 1020 NE2 GLN B 40 9.761 9.699 -1.844 1.00 0.00 N ATOM 0 H GLN B 40 5.575 10.267 -3.225 1.00 0.00 H new ATOM 0 HA GLN B 40 7.851 8.697 -2.802 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.122 10.371 -0.943 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.627 9.635 -0.429 1.00 0.00 H new ATOM 0 HG2 GLN B 40 7.370 11.594 -2.737 1.00 0.00 H new ATOM 0 HG3 GLN B 40 7.836 12.036 -1.106 1.00 0.00 H new ATOM 0 HE21 GLN B 40 9.132 9.026 -1.405 1.00 0.00 H new ATOM 0 HE22 GLN B 40 10.729 9.442 -2.036 1.00 0.00 H new ATOM 1029 N GLN B 41 5.226 7.676 -1.054 1.00 0.00 N ATOM 1030 CA GLN B 41 4.676 6.515 -0.359 1.00 0.00 C ATOM 1031 C GLN B 41 4.193 5.463 -1.355 1.00 0.00 C ATOM 1032 O GLN B 41 3.562 5.791 -2.359 1.00 0.00 O ATOM 1033 CB GLN B 41 3.526 6.932 0.561 1.00 0.00 C ATOM 1034 CG GLN B 41 2.294 7.424 -0.180 1.00 0.00 C ATOM 1035 CD GLN B 41 1.159 7.792 0.755 1.00 0.00 C ATOM 1036 OE1 GLN B 41 0.684 6.962 1.530 1.00 0.00 O ATOM 1037 NE2 GLN B 41 0.716 9.042 0.685 1.00 0.00 N ATOM 0 H GLN B 41 4.616 8.494 -1.061 1.00 0.00 H new ATOM 0 HA GLN B 41 5.471 6.080 0.247 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.248 6.084 1.186 1.00 0.00 H new ATOM 0 HB3 GLN B 41 3.875 7.719 1.229 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.560 8.293 -0.782 1.00 0.00 H new ATOM 0 HG3 GLN B 41 1.956 6.650 -0.869 1.00 0.00 H new ATOM 0 HE21 GLN B 41 1.139 9.697 0.028 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -0.047 9.347 1.289 1.00 0.00 H new ATOM 1046 N ARG B 42 4.491 4.198 -1.071 1.00 0.00 N ATOM 1047 CA ARG B 42 4.080 3.107 -1.947 1.00 0.00 C ATOM 1048 C ARG B 42 3.190 2.112 -1.209 1.00 0.00 C ATOM 1049 O ARG B 42 3.599 1.519 -0.210 1.00 0.00 O ATOM 1050 CB ARG B 42 5.307 2.386 -2.510 1.00 0.00 C ATOM 1051 CG ARG B 42 6.191 3.267 -3.377 1.00 0.00 C ATOM 1052 CD ARG B 42 5.448 3.770 -4.605 1.00 0.00 C ATOM 1053 NE ARG B 42 6.282 4.631 -5.440 1.00 0.00 N ATOM 1054 CZ ARG B 42 7.389 4.222 -6.056 1.00 0.00 C ATOM 1055 NH1 ARG B 42 7.784 2.959 -5.954 1.00 0.00 N ATOM 1056 NH2 ARG B 42 8.098 5.076 -6.782 1.00 0.00 N ATOM 0 H ARG B 42 5.013 3.905 -0.245 1.00 0.00 H new ATOM 0 HA ARG B 42 3.507 3.537 -2.768 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.899 1.996 -1.682 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.976 1.529 -3.097 1.00 0.00 H new ATOM 0 HG2 ARG B 42 6.545 4.116 -2.792 1.00 0.00 H new ATOM 0 HG3 ARG B 42 7.072 2.705 -3.689 1.00 0.00 H new ATOM 0 HD2 ARG B 42 5.104 2.919 -5.193 1.00 0.00 H new ATOM 0 HD3 ARG B 42 4.561 4.320 -4.291 1.00 0.00 H new ATOM 0 HE ARG B 42 5.999 5.604 -5.558 1.00 0.00 H new ATOM 0 HH11 ARG B 42 7.239 2.297 -5.402 1.00 0.00 H new ATOM 0 HH12 ARG B 42 8.633 2.650 -6.428 1.00 0.00 H new ATOM 0 HH21 ARG B 42 7.795 6.046 -6.868 1.00 0.00 H new ATOM 0 HH22 ARG B 42 8.946 4.763 -7.254 1.00 0.00 H new ATOM 1070 N LEU B 43 1.975 1.929 -1.715 1.00 0.00 N ATOM 1071 CA LEU B 43 1.023 1.001 -1.116 1.00 0.00 C ATOM 1072 C LEU B 43 1.219 -0.408 -1.665 1.00 0.00 C ATOM 1073 O LEU B 43 1.415 -0.598 -2.867 1.00 0.00 O ATOM 1074 CB LEU B 43 -0.415 1.471 -1.363 1.00 0.00 C ATOM 1075 CG LEU B 43 -0.900 2.615 -0.464 1.00 0.00 C ATOM 1076 CD1 LEU B 43 -0.937 2.170 0.990 1.00 0.00 C ATOM 1077 CD2 LEU B 43 -0.016 3.846 -0.618 1.00 0.00 C ATOM 0 H LEU B 43 1.625 2.413 -2.542 1.00 0.00 H new ATOM 0 HA LEU B 43 1.204 0.979 -0.041 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -0.502 1.787 -2.402 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -1.084 0.621 -1.232 1.00 0.00 H new ATOM 0 HG LEU B 43 -1.910 2.882 -0.775 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.283 2.994 1.614 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.617 1.325 1.095 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.063 1.872 1.305 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -0.383 4.641 0.031 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.008 3.596 -0.341 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -0.039 4.183 -1.654 1.00 0.00 H new ATOM 1089 N ILE B 44 1.167 -1.393 -0.776 1.00 0.00 N ATOM 1090 CA ILE B 44 1.344 -2.785 -1.168 1.00 0.00 C ATOM 1091 C ILE B 44 0.351 -3.693 -0.451 1.00 0.00 C ATOM 1092 O ILE B 44 0.087 -3.530 0.742 1.00 0.00 O ATOM 1093 CB ILE B 44 2.778 -3.272 -0.875 1.00 0.00 C ATOM 1094 CG1 ILE B 44 3.796 -2.424 -1.646 1.00 0.00 C ATOM 1095 CG2 ILE B 44 2.923 -4.745 -1.235 1.00 0.00 C ATOM 1096 CD1 ILE B 44 5.236 -2.801 -1.372 1.00 0.00 C ATOM 0 H ILE B 44 1.004 -1.253 0.221 1.00 0.00 H new ATOM 0 HA ILE B 44 1.163 -2.836 -2.242 1.00 0.00 H new ATOM 0 HB ILE B 44 2.974 -3.159 0.191 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.601 -2.521 -2.714 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.650 -1.375 -1.390 1.00 0.00 H new ATOM 0 HG21 ILE B 44 3.940 -5.073 -1.022 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.221 -5.334 -0.645 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.711 -4.883 -2.295 1.00 0.00 H new ATOM 0 HD11 ILE B 44 5.897 -2.158 -1.953 1.00 0.00 H new ATOM 0 HD12 ILE B 44 5.449 -2.676 -0.310 1.00 0.00 H new ATOM 0 HD13 ILE B 44 5.400 -3.841 -1.655 1.00 0.00 H new ATOM 1108 N PHE B 45 -0.194 -4.652 -1.193 1.00 0.00 N ATOM 1109 CA PHE B 45 -1.160 -5.596 -0.646 1.00 0.00 C ATOM 1110 C PHE B 45 -1.131 -6.906 -1.423 1.00 0.00 C ATOM 1111 O PHE B 45 -0.968 -6.910 -2.644 1.00 0.00 O ATOM 1112 CB PHE B 45 -2.569 -4.999 -0.685 1.00 0.00 C ATOM 1113 CG PHE B 45 -3.633 -5.930 -0.173 1.00 0.00 C ATOM 1114 CD1 PHE B 45 -3.500 -6.549 1.060 1.00 0.00 C ATOM 1115 CD2 PHE B 45 -4.767 -6.183 -0.927 1.00 0.00 C ATOM 1116 CE1 PHE B 45 -4.479 -7.405 1.530 1.00 0.00 C ATOM 1117 CE2 PHE B 45 -5.749 -7.038 -0.461 1.00 0.00 C ATOM 1118 CZ PHE B 45 -5.604 -7.649 0.769 1.00 0.00 C ATOM 0 H PHE B 45 0.019 -4.795 -2.180 1.00 0.00 H new ATOM 0 HA PHE B 45 -0.889 -5.798 0.390 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -2.583 -4.084 -0.093 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -2.807 -4.718 -1.711 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -2.622 -6.361 1.660 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -4.886 -5.707 -1.889 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -4.363 -7.882 2.492 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -6.628 -7.228 -1.058 1.00 0.00 H new ATOM 0 HZ PHE B 45 -6.370 -8.317 1.135 1.00 0.00 H new ATOM 1128 N ALA B 46 -1.281 -8.016 -0.705 1.00 0.00 N ATOM 1129 CA ALA B 46 -1.267 -9.336 -1.321 1.00 0.00 C ATOM 1130 C ALA B 46 -0.033 -9.508 -2.199 1.00 0.00 C ATOM 1131 O ALA B 46 -0.093 -10.121 -3.265 1.00 0.00 O ATOM 1132 CB ALA B 46 -2.536 -9.555 -2.132 1.00 0.00 C ATOM 0 H ALA B 46 -1.414 -8.025 0.306 1.00 0.00 H new ATOM 0 HA ALA B 46 -1.228 -10.085 -0.530 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -2.511 -10.546 -2.586 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -3.404 -9.478 -1.477 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -2.603 -8.799 -2.914 1.00 0.00 H new ATOM 1138 N GLY B 47 1.085 -8.955 -1.740 1.00 0.00 N ATOM 1139 CA GLY B 47 2.323 -9.047 -2.487 1.00 0.00 C ATOM 1140 C GLY B 47 2.215 -8.423 -3.864 1.00 0.00 C ATOM 1141 O GLY B 47 2.748 -8.957 -4.837 1.00 0.00 O ATOM 0 H GLY B 47 1.154 -8.443 -0.860 1.00 0.00 H new ATOM 0 HA2 GLY B 47 3.118 -8.553 -1.929 1.00 0.00 H new ATOM 0 HA3 GLY B 47 2.607 -10.095 -2.587 1.00 0.00 H new ATOM 1145 N LYS B 48 1.523 -7.288 -3.947 1.00 0.00 N ATOM 1146 CA LYS B 48 1.350 -6.593 -5.219 1.00 0.00 C ATOM 1147 C LYS B 48 1.297 -5.082 -5.019 1.00 0.00 C ATOM 1148 O LYS B 48 0.532 -4.580 -4.194 1.00 0.00 O ATOM 1149 CB LYS B 48 0.066 -7.059 -5.911 1.00 0.00 C ATOM 1150 CG LYS B 48 0.030 -8.551 -6.205 1.00 0.00 C ATOM 1151 CD LYS B 48 -1.267 -8.955 -6.890 1.00 0.00 C ATOM 1152 CE LYS B 48 -1.422 -8.278 -8.243 1.00 0.00 C ATOM 1153 NZ LYS B 48 -0.306 -8.621 -9.167 1.00 0.00 N ATOM 0 H LYS B 48 1.075 -6.833 -3.152 1.00 0.00 H new ATOM 0 HA LYS B 48 2.209 -6.832 -5.846 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -0.787 -6.802 -5.283 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -0.050 -6.512 -6.846 1.00 0.00 H new ATOM 0 HG2 LYS B 48 0.876 -8.818 -6.839 1.00 0.00 H new ATOM 0 HG3 LYS B 48 0.140 -9.109 -5.275 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.289 -10.037 -7.020 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -2.112 -8.693 -6.253 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -2.369 -8.576 -8.692 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -1.461 -7.197 -8.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -0.560 -8.343 -10.136 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 0.554 -8.114 -8.876 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -0.131 -9.646 -9.135 1.00 0.00 H new ATOM 1167 N GLN B 49 2.110 -4.363 -5.789 1.00 0.00 N ATOM 1168 CA GLN B 49 2.152 -2.906 -5.713 1.00 0.00 C ATOM 1169 C GLN B 49 0.906 -2.306 -6.356 1.00 0.00 C ATOM 1170 O GLN B 49 0.561 -2.645 -7.488 1.00 0.00 O ATOM 1171 CB GLN B 49 3.411 -2.380 -6.410 1.00 0.00 C ATOM 1172 CG GLN B 49 3.499 -0.863 -6.467 1.00 0.00 C ATOM 1173 CD GLN B 49 3.515 -0.225 -5.092 1.00 0.00 C ATOM 1174 OE1 GLN B 49 4.374 -0.530 -4.264 1.00 0.00 O ATOM 1175 NE2 GLN B 49 2.567 0.671 -4.846 1.00 0.00 N ATOM 0 H GLN B 49 2.749 -4.767 -6.474 1.00 0.00 H new ATOM 0 HA GLN B 49 2.179 -2.611 -4.664 1.00 0.00 H new ATOM 0 HB2 GLN B 49 4.289 -2.765 -5.891 1.00 0.00 H new ATOM 0 HB3 GLN B 49 3.443 -2.774 -7.426 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.401 -0.576 -7.007 1.00 0.00 H new ATOM 0 HG3 GLN B 49 2.652 -0.475 -7.033 1.00 0.00 H new ATOM 0 HE21 GLN B 49 1.876 0.892 -5.563 1.00 0.00 H new ATOM 0 HE22 GLN B 49 2.530 1.138 -3.940 1.00 0.00 H new ATOM 1184 N LEU B 50 0.230 -1.418 -5.633 1.00 0.00 N ATOM 1185 CA LEU B 50 -0.978 -0.787 -6.154 1.00 0.00 C ATOM 1186 C LEU B 50 -0.657 0.122 -7.337 1.00 0.00 C ATOM 1187 O LEU B 50 0.084 1.096 -7.204 1.00 0.00 O ATOM 1188 CB LEU B 50 -1.694 0.009 -5.057 1.00 0.00 C ATOM 1189 CG LEU B 50 -2.432 -0.833 -4.010 1.00 0.00 C ATOM 1190 CD1 LEU B 50 -1.459 -1.682 -3.205 1.00 0.00 C ATOM 1191 CD2 LEU B 50 -3.247 0.061 -3.089 1.00 0.00 C ATOM 0 H LEU B 50 0.495 -1.121 -4.694 1.00 0.00 H new ATOM 0 HA LEU B 50 -1.641 -1.580 -6.500 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -0.960 0.632 -4.546 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -2.410 0.682 -5.528 1.00 0.00 H new ATOM 0 HG LEU B 50 -3.111 -1.506 -4.534 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -2.010 -2.269 -2.470 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -0.921 -2.353 -3.875 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -0.748 -1.034 -2.693 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -3.765 -0.552 -2.351 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -2.583 0.759 -2.579 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -3.978 0.618 -3.676 1.00 0.00 H new ATOM 1203 N GLU B 51 -1.227 -0.206 -8.493 1.00 0.00 N ATOM 1204 CA GLU B 51 -1.013 0.575 -9.707 1.00 0.00 C ATOM 1205 C GLU B 51 -2.016 1.718 -9.800 1.00 0.00 C ATOM 1206 O GLU B 51 -3.209 1.525 -9.575 1.00 0.00 O ATOM 1207 CB GLU B 51 -1.140 -0.318 -10.941 1.00 0.00 C ATOM 1208 CG GLU B 51 -0.195 -1.510 -10.931 1.00 0.00 C ATOM 1209 CD GLU B 51 -0.328 -2.375 -12.170 1.00 0.00 C ATOM 1210 OE1 GLU B 51 -1.168 -2.050 -13.036 1.00 0.00 O ATOM 1211 OE2 GLU B 51 0.408 -3.379 -12.274 1.00 0.00 O ATOM 0 H GLU B 51 -1.843 -1.010 -8.614 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.007 0.993 -9.666 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -2.166 -0.679 -11.014 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -0.948 0.279 -11.832 1.00 0.00 H new ATOM 0 HG2 GLU B 51 0.832 -1.153 -10.851 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -0.392 -2.117 -10.047 1.00 0.00 H new ATOM 1218 N ASP B 52 -1.529 2.906 -10.143 1.00 0.00 N ATOM 1219 CA ASP B 52 -2.393 4.072 -10.272 1.00 0.00 C ATOM 1220 C ASP B 52 -3.439 3.849 -11.360 1.00 0.00 C ATOM 1221 O ASP B 52 -3.119 3.390 -12.458 1.00 0.00 O ATOM 1222 CB ASP B 52 -1.564 5.319 -10.589 1.00 0.00 C ATOM 1223 CG ASP B 52 -0.551 5.635 -9.506 1.00 0.00 C ATOM 1224 OD1 ASP B 52 -0.494 4.888 -8.506 1.00 0.00 O ATOM 1225 OD2 ASP B 52 0.187 6.632 -9.656 1.00 0.00 O ATOM 0 H ASP B 52 -0.544 3.086 -10.336 1.00 0.00 H new ATOM 0 HA ASP B 52 -2.906 4.222 -9.322 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -1.045 5.175 -11.536 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -2.231 6.171 -10.718 1.00 0.00 H new ATOM 1230 N GLY B 53 -4.688 4.178 -11.048 1.00 0.00 N ATOM 1231 CA GLY B 53 -5.766 4.011 -12.006 1.00 0.00 C ATOM 1232 C GLY B 53 -6.229 2.570 -12.138 1.00 0.00 C ATOM 1233 O GLY B 53 -6.478 2.093 -13.245 1.00 0.00 O ATOM 0 H GLY B 53 -4.974 4.559 -10.146 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -6.610 4.631 -11.705 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -5.437 4.371 -12.981 1.00 0.00 H new ATOM 1237 N ARG B 54 -6.354 1.878 -11.008 1.00 0.00 N ATOM 1238 CA ARG B 54 -6.799 0.489 -11.006 1.00 0.00 C ATOM 1239 C ARG B 54 -7.896 0.269 -9.967 1.00 0.00 C ATOM 1240 O ARG B 54 -7.791 0.728 -8.831 1.00 0.00 O ATOM 1241 CB ARG B 54 -5.623 -0.447 -10.726 1.00 0.00 C ATOM 1242 CG ARG B 54 -4.511 -0.355 -11.759 1.00 0.00 C ATOM 1243 CD ARG B 54 -5.000 -0.747 -13.144 1.00 0.00 C ATOM 1244 NE ARG B 54 -3.939 -0.663 -14.143 1.00 0.00 N ATOM 1245 CZ ARG B 54 -4.105 -0.975 -15.424 1.00 0.00 C ATOM 1246 NH1 ARG B 54 -5.285 -1.397 -15.860 1.00 0.00 N ATOM 1247 NH2 ARG B 54 -3.091 -0.867 -16.271 1.00 0.00 N ATOM 0 H ARG B 54 -6.153 2.257 -10.083 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.206 0.265 -11.992 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -5.213 -0.218 -9.742 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -5.988 -1.473 -10.688 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -4.121 0.662 -11.785 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -3.687 -1.005 -11.466 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -5.392 -1.764 -13.116 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -5.824 -0.096 -13.435 1.00 0.00 H new ATOM 0 HE ARG B 54 -3.018 -0.347 -13.841 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -6.068 -1.483 -15.211 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -5.410 -1.636 -16.844 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -2.182 -0.544 -15.940 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -3.220 -1.107 -17.254 1.00 0.00 H new ATOM 1261 N THR B 55 -8.951 -0.432 -10.370 1.00 0.00 N ATOM 1262 CA THR B 55 -10.073 -0.713 -9.479 1.00 0.00 C ATOM 1263 C THR B 55 -9.666 -1.652 -8.348 1.00 0.00 C ATOM 1264 O THR B 55 -8.929 -2.614 -8.561 1.00 0.00 O ATOM 1265 CB THR B 55 -11.252 -1.338 -10.245 1.00 0.00 C ATOM 1266 OG1 THR B 55 -10.839 -2.561 -10.866 1.00 0.00 O ATOM 1267 CG2 THR B 55 -11.780 -0.381 -11.303 1.00 0.00 C ATOM 0 H THR B 55 -9.053 -0.817 -11.309 1.00 0.00 H new ATOM 0 HA THR B 55 -10.383 0.243 -9.057 1.00 0.00 H new ATOM 0 HB THR B 55 -12.051 -1.543 -9.532 1.00 0.00 H new ATOM 0 HG1 THR B 55 -11.595 -2.954 -11.350 1.00 0.00 H new ATOM 0 HG21 THR B 55 -12.613 -0.846 -11.831 1.00 0.00 H new ATOM 0 HG22 THR B 55 -12.120 0.538 -10.825 1.00 0.00 H new ATOM 0 HG23 THR B 55 -10.986 -0.148 -12.012 1.00 0.00 H new ATOM 1275 N LEU B 56 -10.155 -1.366 -7.144 1.00 0.00 N ATOM 1276 CA LEU B 56 -9.846 -2.186 -5.978 1.00 0.00 C ATOM 1277 C LEU B 56 -10.404 -3.597 -6.143 1.00 0.00 C ATOM 1278 O LEU B 56 -9.800 -4.570 -5.691 1.00 0.00 O ATOM 1279 CB LEU B 56 -10.419 -1.548 -4.708 1.00 0.00 C ATOM 1280 CG LEU B 56 -9.992 -0.100 -4.453 1.00 0.00 C ATOM 1281 CD1 LEU B 56 -10.635 0.430 -3.180 1.00 0.00 C ATOM 1282 CD2 LEU B 56 -8.478 0.005 -4.367 1.00 0.00 C ATOM 0 H LEU B 56 -10.767 -0.573 -6.951 1.00 0.00 H new ATOM 0 HA LEU B 56 -8.761 -2.248 -5.888 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -11.507 -1.584 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -10.122 -2.153 -3.851 1.00 0.00 H new ATOM 0 HG LEU B 56 -10.331 0.509 -5.291 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -10.320 1.460 -3.015 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.720 0.394 -3.278 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -10.326 -0.184 -2.334 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -8.195 1.042 -4.185 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -8.116 -0.618 -3.550 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -8.036 -0.333 -5.304 1.00 0.00 H new ATOM 1294 N SER B 57 -11.564 -3.696 -6.789 1.00 0.00 N ATOM 1295 CA SER B 57 -12.216 -4.985 -7.012 1.00 0.00 C ATOM 1296 C SER B 57 -11.261 -5.982 -7.658 1.00 0.00 C ATOM 1297 O SER B 57 -11.219 -7.151 -7.273 1.00 0.00 O ATOM 1298 CB SER B 57 -13.454 -4.809 -7.893 1.00 0.00 C ATOM 1299 OG SER B 57 -14.099 -6.051 -8.117 1.00 0.00 O ATOM 0 H SER B 57 -12.073 -2.897 -7.168 1.00 0.00 H new ATOM 0 HA SER B 57 -12.518 -5.378 -6.041 1.00 0.00 H new ATOM 0 HB2 SER B 57 -14.148 -4.116 -7.417 1.00 0.00 H new ATOM 0 HB3 SER B 57 -13.166 -4.367 -8.847 1.00 0.00 H new ATOM 0 HG SER B 57 -14.888 -5.913 -8.681 1.00 0.00 H new ATOM 1305 N ASP B 58 -10.495 -5.515 -8.640 1.00 0.00 N ATOM 1306 CA ASP B 58 -9.538 -6.370 -9.335 1.00 0.00 C ATOM 1307 C ASP B 58 -8.580 -7.016 -8.341 1.00 0.00 C ATOM 1308 O ASP B 58 -8.259 -8.200 -8.449 1.00 0.00 O ATOM 1309 CB ASP B 58 -8.754 -5.560 -10.368 1.00 0.00 C ATOM 1310 CG ASP B 58 -7.757 -6.409 -11.132 1.00 0.00 C ATOM 1311 OD1 ASP B 58 -8.188 -7.372 -11.801 1.00 0.00 O ATOM 1312 OD2 ASP B 58 -6.547 -6.110 -11.063 1.00 0.00 O ATOM 0 H ASP B 58 -10.518 -4.551 -8.972 1.00 0.00 H new ATOM 0 HA ASP B 58 -10.090 -7.156 -9.850 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -9.450 -5.101 -11.070 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -8.227 -4.749 -9.866 1.00 0.00 H new ATOM 1317 N TYR B 59 -8.132 -6.228 -7.370 1.00 0.00 N ATOM 1318 CA TYR B 59 -7.217 -6.712 -6.344 1.00 0.00 C ATOM 1319 C TYR B 59 -7.956 -7.583 -5.333 1.00 0.00 C ATOM 1320 O TYR B 59 -7.356 -8.436 -4.679 1.00 0.00 O ATOM 1321 CB TYR B 59 -6.541 -5.539 -5.623 1.00 0.00 C ATOM 1322 CG TYR B 59 -5.709 -4.650 -6.524 1.00 0.00 C ATOM 1323 CD1 TYR B 59 -6.275 -4.003 -7.616 1.00 0.00 C ATOM 1324 CD2 TYR B 59 -4.354 -4.459 -6.280 1.00 0.00 C ATOM 1325 CE1 TYR B 59 -5.516 -3.193 -8.438 1.00 0.00 C ATOM 1326 CE2 TYR B 59 -3.588 -3.649 -7.098 1.00 0.00 C ATOM 1327 CZ TYR B 59 -4.175 -3.019 -8.176 1.00 0.00 C ATOM 1328 OH TYR B 59 -3.417 -2.212 -8.993 1.00 0.00 O ATOM 0 H TYR B 59 -8.390 -5.246 -7.272 1.00 0.00 H new ATOM 0 HA TYR B 59 -6.450 -7.312 -6.834 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -7.308 -4.933 -5.142 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -5.903 -5.933 -4.832 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -7.326 -4.136 -7.825 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -3.892 -4.952 -5.437 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -5.972 -2.698 -9.283 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -2.536 -3.510 -6.894 1.00 0.00 H new ATOM 0 HH TYR B 59 -2.605 -2.690 -9.263 1.00 0.00 H new ATOM 1338 N ASN B 60 -9.262 -7.347 -5.203 1.00 0.00 N ATOM 1339 CA ASN B 60 -10.097 -8.092 -4.263 1.00 0.00 C ATOM 1340 C ASN B 60 -9.691 -7.783 -2.825 1.00 0.00 C ATOM 1341 O ASN B 60 -9.585 -8.681 -1.989 1.00 0.00 O ATOM 1342 CB ASN B 60 -10.001 -9.599 -4.526 1.00 0.00 C ATOM 1343 CG ASN B 60 -10.477 -9.980 -5.914 1.00 0.00 C ATOM 1344 OD1 ASN B 60 -9.939 -9.514 -6.918 1.00 0.00 O ATOM 1345 ND2 ASN B 60 -11.492 -10.834 -5.978 1.00 0.00 N ATOM 0 H ASN B 60 -9.766 -6.642 -5.741 1.00 0.00 H new ATOM 0 HA ASN B 60 -11.131 -7.781 -4.410 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -8.967 -9.921 -4.399 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -10.594 -10.132 -3.783 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -11.855 -11.128 -6.885 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -11.909 -11.196 -5.120 1.00 0.00 H new ATOM 1352 N ILE B 61 -9.461 -6.502 -2.548 1.00 0.00 N ATOM 1353 CA ILE B 61 -9.062 -6.062 -1.216 1.00 0.00 C ATOM 1354 C ILE B 61 -10.185 -6.276 -0.204 1.00 0.00 C ATOM 1355 O ILE B 61 -11.316 -5.838 -0.415 1.00 0.00 O ATOM 1356 CB ILE B 61 -8.664 -4.572 -1.218 1.00 0.00 C ATOM 1357 CG1 ILE B 61 -7.560 -4.320 -2.249 1.00 0.00 C ATOM 1358 CG2 ILE B 61 -8.211 -4.142 0.171 1.00 0.00 C ATOM 1359 CD1 ILE B 61 -7.181 -2.861 -2.395 1.00 0.00 C ATOM 0 H ILE B 61 -9.545 -5.749 -3.231 1.00 0.00 H new ATOM 0 HA ILE B 61 -8.200 -6.664 -0.927 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.535 -3.977 -1.493 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -6.675 -4.889 -1.966 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -7.887 -4.700 -3.217 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -7.933 -3.088 0.153 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -9.024 -4.291 0.881 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -7.351 -4.739 0.474 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.394 -2.763 -3.142 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.053 -2.288 -2.709 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -6.823 -2.481 -1.438 1.00 0.00 H new ATOM 1371 N GLN B 62 -9.860 -6.945 0.898 1.00 0.00 N ATOM 1372 CA GLN B 62 -10.834 -7.214 1.950 1.00 0.00 C ATOM 1373 C GLN B 62 -11.069 -5.968 2.800 1.00 0.00 C ATOM 1374 O GLN B 62 -10.153 -5.176 3.020 1.00 0.00 O ATOM 1375 CB GLN B 62 -10.358 -8.369 2.836 1.00 0.00 C ATOM 1376 CG GLN B 62 -10.118 -9.664 2.076 1.00 0.00 C ATOM 1377 CD GLN B 62 -11.364 -10.170 1.376 1.00 0.00 C ATOM 1378 OE1 GLN B 62 -12.380 -10.445 2.015 1.00 0.00 O ATOM 1379 NE2 GLN B 62 -11.293 -10.297 0.056 1.00 0.00 N ATOM 0 H GLN B 62 -8.927 -7.312 1.086 1.00 0.00 H new ATOM 0 HA GLN B 62 -11.775 -7.495 1.477 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -9.435 -8.075 3.336 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -11.100 -8.547 3.615 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -9.330 -9.508 1.339 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -9.760 -10.426 2.768 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -10.431 -10.058 -0.434 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -12.101 -10.634 -0.468 1.00 0.00 H new ATOM 1388 N LYS B 63 -12.298 -5.796 3.275 1.00 0.00 N ATOM 1389 CA LYS B 63 -12.636 -4.642 4.101 1.00 0.00 C ATOM 1390 C LYS B 63 -11.890 -4.699 5.433 1.00 0.00 C ATOM 1391 O LYS B 63 -11.755 -5.764 6.035 1.00 0.00 O ATOM 1392 CB LYS B 63 -14.148 -4.575 4.343 1.00 0.00 C ATOM 1393 CG LYS B 63 -14.688 -5.730 5.167 1.00 0.00 C ATOM 1394 CD LYS B 63 -16.197 -5.644 5.330 1.00 0.00 C ATOM 1395 CE LYS B 63 -16.731 -6.788 6.176 1.00 0.00 C ATOM 1396 NZ LYS B 63 -16.435 -8.115 5.569 1.00 0.00 N ATOM 0 H LYS B 63 -13.073 -6.437 3.104 1.00 0.00 H new ATOM 0 HA LYS B 63 -12.330 -3.741 3.569 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.385 -3.639 4.848 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -14.660 -4.556 3.381 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.426 -6.673 4.687 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -14.215 -5.730 6.149 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -16.461 -4.693 5.793 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -16.672 -5.663 4.349 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -16.291 -6.739 7.172 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -17.808 -6.677 6.298 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -16.996 -8.849 6.048 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -16.680 -8.097 4.558 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -15.423 -8.328 5.676 1.00 0.00 H new ATOM 1410 N GLU B 64 -11.403 -3.543 5.877 1.00 0.00 N ATOM 1411 CA GLU B 64 -10.660 -3.437 7.132 1.00 0.00 C ATOM 1412 C GLU B 64 -9.331 -4.181 7.044 1.00 0.00 C ATOM 1413 O GLU B 64 -8.905 -4.831 7.999 1.00 0.00 O ATOM 1414 CB GLU B 64 -11.489 -3.985 8.297 1.00 0.00 C ATOM 1415 CG GLU B 64 -12.815 -3.268 8.496 1.00 0.00 C ATOM 1416 CD GLU B 64 -13.616 -3.835 9.652 1.00 0.00 C ATOM 1417 OE1 GLU B 64 -13.134 -4.790 10.298 1.00 0.00 O ATOM 1418 OE2 GLU B 64 -14.727 -3.325 9.912 1.00 0.00 O ATOM 0 H GLU B 64 -11.511 -2.658 5.381 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.455 -2.381 7.310 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -11.681 -5.044 8.128 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -10.904 -3.910 9.214 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -12.628 -2.209 8.673 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -13.403 -3.339 7.581 1.00 0.00 H new ATOM 1425 N SER B 65 -8.679 -4.076 5.890 1.00 0.00 N ATOM 1426 CA SER B 65 -7.397 -4.733 5.673 1.00 0.00 C ATOM 1427 C SER B 65 -6.234 -3.766 5.863 1.00 0.00 C ATOM 1428 O SER B 65 -6.369 -2.558 5.646 1.00 0.00 O ATOM 1429 CB SER B 65 -7.338 -5.351 4.276 1.00 0.00 C ATOM 1430 OG SER B 65 -8.253 -6.426 4.157 1.00 0.00 O ATOM 0 H SER B 65 -9.019 -3.541 5.091 1.00 0.00 H new ATOM 0 HA SER B 65 -7.306 -5.524 6.417 1.00 0.00 H new ATOM 0 HB2 SER B 65 -7.565 -4.591 3.528 1.00 0.00 H new ATOM 0 HB3 SER B 65 -6.327 -5.705 4.074 1.00 0.00 H new ATOM 0 HG SER B 65 -9.165 -6.074 4.096 1.00 0.00 H new ATOM 1436 N THR B 66 -5.094 -4.314 6.269 1.00 0.00 N ATOM 1437 CA THR B 66 -3.891 -3.523 6.488 1.00 0.00 C ATOM 1438 C THR B 66 -3.036 -3.478 5.224 1.00 0.00 C ATOM 1439 O THR B 66 -2.743 -4.513 4.627 1.00 0.00 O ATOM 1440 CB THR B 66 -3.053 -4.097 7.646 1.00 0.00 C ATOM 1441 OG1 THR B 66 -3.828 -4.118 8.849 1.00 0.00 O ATOM 1442 CG2 THR B 66 -1.793 -3.277 7.867 1.00 0.00 C ATOM 0 H THR B 66 -4.979 -5.310 6.454 1.00 0.00 H new ATOM 0 HA THR B 66 -4.208 -2.513 6.746 1.00 0.00 H new ATOM 0 HB THR B 66 -2.763 -5.114 7.381 1.00 0.00 H new ATOM 0 HG1 THR B 66 -3.288 -4.486 9.580 1.00 0.00 H new ATOM 0 HG21 THR B 66 -1.220 -3.704 8.690 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.188 -3.288 6.960 1.00 0.00 H new ATOM 0 HG23 THR B 66 -2.065 -2.250 8.109 1.00 0.00 H new ATOM 1450 N LEU B 67 -2.637 -2.275 4.821 1.00 0.00 N ATOM 1451 CA LEU B 67 -1.814 -2.101 3.627 1.00 0.00 C ATOM 1452 C LEU B 67 -0.383 -1.725 4.004 1.00 0.00 C ATOM 1453 O LEU B 67 -0.163 -0.797 4.779 1.00 0.00 O ATOM 1454 CB LEU B 67 -2.417 -1.019 2.727 1.00 0.00 C ATOM 1455 CG LEU B 67 -3.863 -1.270 2.289 1.00 0.00 C ATOM 1456 CD1 LEU B 67 -4.407 -0.074 1.524 1.00 0.00 C ATOM 1457 CD2 LEU B 67 -3.952 -2.528 1.437 1.00 0.00 C ATOM 0 H LEU B 67 -2.870 -1.407 5.303 1.00 0.00 H new ATOM 0 HA LEU B 67 -1.791 -3.047 3.086 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -2.373 -0.065 3.253 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -1.796 -0.921 1.837 1.00 0.00 H new ATOM 0 HG LEU B 67 -4.470 -1.413 3.183 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -5.435 -0.272 1.222 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -4.380 0.809 2.162 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -3.796 0.100 0.638 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -4.987 -2.690 1.135 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -3.329 -2.412 0.550 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -3.604 -3.384 2.015 1.00 0.00 H new ATOM 1469 N HIS B 68 0.589 -2.445 3.452 1.00 0.00 N ATOM 1470 CA HIS B 68 1.994 -2.168 3.743 1.00 0.00 C ATOM 1471 C HIS B 68 2.509 -0.995 2.914 1.00 0.00 C ATOM 1472 O HIS B 68 2.365 -0.973 1.692 1.00 0.00 O ATOM 1473 CB HIS B 68 2.846 -3.413 3.494 1.00 0.00 C ATOM 1474 CG HIS B 68 2.571 -4.519 4.465 1.00 0.00 C ATOM 1475 ND1 HIS B 68 2.761 -4.388 5.825 1.00 0.00 N ATOM 1476 CD2 HIS B 68 2.112 -5.776 4.271 1.00 0.00 C ATOM 1477 CE1 HIS B 68 2.430 -5.518 6.424 1.00 0.00 C ATOM 1478 NE2 HIS B 68 2.033 -6.377 5.503 1.00 0.00 N ATOM 0 H HIS B 68 0.433 -3.219 2.806 1.00 0.00 H new ATOM 0 HA HIS B 68 2.072 -1.895 4.795 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.664 -3.773 2.482 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.900 -3.142 3.551 1.00 0.00 H new ATOM 0 HD2 HIS B 68 1.855 -6.224 3.323 1.00 0.00 H new ATOM 0 HE1 HIS B 68 2.476 -5.707 7.486 1.00 0.00 H new ATOM 0 HE2 HIS B 68 1.719 -7.331 5.678 1.00 0.00 H new ATOM 1487 N LEU B 69 3.102 -0.019 3.595 1.00 0.00 N ATOM 1488 CA LEU B 69 3.635 1.169 2.935 1.00 0.00 C ATOM 1489 C LEU B 69 5.154 1.085 2.782 1.00 0.00 C ATOM 1490 O LEU B 69 5.837 0.482 3.610 1.00 0.00 O ATOM 1491 CB LEU B 69 3.268 2.418 3.736 1.00 0.00 C ATOM 1492 CG LEU B 69 3.507 3.743 3.015 1.00 0.00 C ATOM 1493 CD1 LEU B 69 2.534 3.899 1.859 1.00 0.00 C ATOM 1494 CD2 LEU B 69 3.374 4.904 3.984 1.00 0.00 C ATOM 0 H LEU B 69 3.226 -0.028 4.607 1.00 0.00 H new ATOM 0 HA LEU B 69 3.194 1.228 1.940 1.00 0.00 H new ATOM 0 HB2 LEU B 69 2.215 2.357 4.012 1.00 0.00 H new ATOM 0 HB3 LEU B 69 3.841 2.418 4.663 1.00 0.00 H new ATOM 0 HG LEU B 69 4.521 3.743 2.615 1.00 0.00 H new ATOM 0 HD11 LEU B 69 2.717 4.848 1.355 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.674 3.080 1.153 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.512 3.881 2.238 1.00 0.00 H new ATOM 0 HD21 LEU B 69 3.547 5.841 3.455 1.00 0.00 H new ATOM 0 HD22 LEU B 69 2.371 4.908 4.411 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.108 4.797 4.783 1.00 0.00 H new ATOM 1506 N VAL B 70 5.676 1.711 1.728 1.00 0.00 N ATOM 1507 CA VAL B 70 7.115 1.730 1.475 1.00 0.00 C ATOM 1508 C VAL B 70 7.533 3.108 0.974 1.00 0.00 C ATOM 1509 O VAL B 70 7.060 3.569 -0.065 1.00 0.00 O ATOM 1510 CB VAL B 70 7.536 0.669 0.434 1.00 0.00 C ATOM 1511 CG1 VAL B 70 9.052 0.608 0.311 1.00 0.00 C ATOM 1512 CG2 VAL B 70 6.975 -0.699 0.792 1.00 0.00 C ATOM 0 H VAL B 70 5.122 2.213 1.034 1.00 0.00 H new ATOM 0 HA VAL B 70 7.613 1.498 2.417 1.00 0.00 H new ATOM 0 HB VAL B 70 7.123 0.963 -0.531 1.00 0.00 H new ATOM 0 HG11 VAL B 70 9.327 -0.145 -0.427 1.00 0.00 H new ATOM 0 HG12 VAL B 70 9.431 1.580 -0.004 1.00 0.00 H new ATOM 0 HG13 VAL B 70 9.485 0.345 1.276 1.00 0.00 H new ATOM 0 HG21 VAL B 70 7.286 -1.427 0.043 1.00 0.00 H new ATOM 0 HG22 VAL B 70 7.350 -1.001 1.770 1.00 0.00 H new ATOM 0 HG23 VAL B 70 5.886 -0.650 0.820 1.00 0.00 H new ATOM 1522 N LEU B 71 8.409 3.769 1.725 1.00 0.00 N ATOM 1523 CA LEU B 71 8.873 5.104 1.359 1.00 0.00 C ATOM 1524 C LEU B 71 9.944 5.045 0.276 1.00 0.00 C ATOM 1525 O LEU B 71 10.922 4.305 0.391 1.00 0.00 O ATOM 1526 CB LEU B 71 9.411 5.847 2.588 1.00 0.00 C ATOM 1527 CG LEU B 71 8.367 6.201 3.656 1.00 0.00 C ATOM 1528 CD1 LEU B 71 7.239 7.024 3.053 1.00 0.00 C ATOM 1529 CD2 LEU B 71 7.820 4.943 4.318 1.00 0.00 C ATOM 0 H LEU B 71 8.811 3.404 2.588 1.00 0.00 H new ATOM 0 HA LEU B 71 8.017 5.649 0.962 1.00 0.00 H new ATOM 0 HB2 LEU B 71 10.185 5.235 3.051 1.00 0.00 H new ATOM 0 HB3 LEU B 71 9.890 6.767 2.254 1.00 0.00 H new ATOM 0 HG LEU B 71 8.857 6.802 4.422 1.00 0.00 H new ATOM 0 HD11 LEU B 71 6.510 7.264 3.827 1.00 0.00 H new ATOM 0 HD12 LEU B 71 7.644 7.947 2.637 1.00 0.00 H new ATOM 0 HD13 LEU B 71 6.754 6.452 2.262 1.00 0.00 H new ATOM 0 HD21 LEU B 71 7.082 5.220 5.071 1.00 0.00 H new ATOM 0 HD22 LEU B 71 7.350 4.310 3.565 1.00 0.00 H new ATOM 0 HD23 LEU B 71 8.636 4.398 4.793 1.00 0.00 H new ATOM 1541 N ARG B 72 9.749 5.838 -0.773 1.00 0.00 N ATOM 1542 CA ARG B 72 10.691 5.895 -1.885 1.00 0.00 C ATOM 1543 C ARG B 72 11.978 6.601 -1.465 1.00 0.00 C ATOM 1544 O ARG B 72 12.001 7.823 -1.313 1.00 0.00 O ATOM 1545 CB ARG B 72 10.051 6.624 -3.070 1.00 0.00 C ATOM 1546 CG ARG B 72 10.954 6.734 -4.288 1.00 0.00 C ATOM 1547 CD ARG B 72 10.259 7.458 -5.429 1.00 0.00 C ATOM 1548 NE ARG B 72 9.880 8.819 -5.061 1.00 0.00 N ATOM 1549 CZ ARG B 72 9.212 9.642 -5.863 1.00 0.00 C ATOM 1550 NH1 ARG B 72 8.836 9.239 -7.070 1.00 0.00 N ATOM 1551 NH2 ARG B 72 8.916 10.868 -5.456 1.00 0.00 N ATOM 0 H ARG B 72 8.942 6.453 -0.876 1.00 0.00 H new ATOM 0 HA ARG B 72 10.941 4.877 -2.184 1.00 0.00 H new ATOM 0 HB2 ARG B 72 9.137 6.102 -3.354 1.00 0.00 H new ATOM 0 HB3 ARG B 72 9.761 7.626 -2.754 1.00 0.00 H new ATOM 0 HG2 ARG B 72 11.867 7.266 -4.020 1.00 0.00 H new ATOM 0 HG3 ARG B 72 11.251 5.737 -4.614 1.00 0.00 H new ATOM 0 HD2 ARG B 72 10.919 7.487 -6.296 1.00 0.00 H new ATOM 0 HD3 ARG B 72 9.370 6.901 -5.724 1.00 0.00 H new ATOM 0 HE ARG B 72 10.143 9.158 -4.135 1.00 0.00 H new ATOM 0 HH11 ARG B 72 9.059 8.295 -7.385 1.00 0.00 H new ATOM 0 HH12 ARG B 72 8.324 9.873 -7.683 1.00 0.00 H new ATOM 0 HH21 ARG B 72 9.201 11.180 -4.528 1.00 0.00 H new ATOM 0 HH22 ARG B 72 8.403 11.500 -6.071 1.00 0.00 H new