USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 983 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 70 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 71 GLN : amide:sc= -7.07! C(o=-7.1!,f=-18!) USER MOD Set 2.1: A 55 GLN : amide:sc= -10.5! C(o=-17!,f=-4.6!) USER MOD Set 2.2: A 120 GLN : amide:sc= -6.51! K(o=-17!,f=-5.5) USER MOD Set 3.1: A 38 GLN : amide:sc= -5.49! C(o=-8.2!,f=-3!) USER MOD Set 3.2: A 44 SER OG : rot -46:sc= -2.7! USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -155:sc= -0.192 (180deg=-1.12) USER MOD Single : A 12 SER OG : rot -10:sc= -0.101! USER MOD Single : A 13 LYS NZ :NH3+ 172:sc= -2.39 (180deg=-2.56!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 141:sc= -3.56! USER MOD Single : A 35 THR OG1 : rot -82:sc= 0.88 USER MOD Single : A 40 ASN : amide:sc= -2.58! C(o=-2.6!,f=-4.4!) USER MOD Single : A 49 ASN : amide:sc= -1.12 X(o=-1.1,f=-0.73) USER MOD Single : A 51 SER OG : rot 180:sc= 0.0285 USER MOD Single : A 56 ASN : amide:sc= -0.122 X(o=-0.12,f=-0.11) USER MOD Single : A 58 SER OG : rot -170:sc= -3.57 USER MOD Single : A 62 HIS : no HD1:sc= -3.25! C(o=-3.2!,f=-4.7!) USER MOD Single : A 63 THR OG1 : rot -66:sc= 0.102 USER MOD Single : A 69 ASN : amide:sc= -4.71! C(o=-4.7!,f=-2.9!) USER MOD Single : A 73 THR OG1 : rot 61:sc= 0.411 USER MOD Single : A 74 ASN : amide:sc= -4.23! C(o=-4.2!,f=-9.7!) USER MOD Single : A 76 LYS NZ :NH3+ -127:sc= -0.893 (180deg=-2.56!) USER MOD Single : A 79 LYS NZ :NH3+ 143:sc= -0.28 (180deg=-1.28!) USER MOD Single : A 80 LYS NZ :NH3+ -156:sc= -1.88! (180deg=-2.69!) USER MOD Single : A 82 SER OG : rot -120:sc= -1.04 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 138:sc= -3.34! (180deg=-5.94!) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -140:sc= -0.26 (180deg=-1.43!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -151:sc= -0.207 (180deg=-1.36!) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -55:sc= 1.18 USER MOD Single : A 99 SER OG : rot -0:sc= 0.726 USER MOD Single : A 119 LYS NZ :NH3+ -162:sc= -0.0489 (180deg=-0.675) USER MOD Single : A 122 THR OG1 : rot 83:sc= 0.0597 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.163 USER MOD Single : A 126 CYS SG : rot 21:sc= -1.08! USER MOD Single : A 129 TYR OH : rot 180:sc= -1.11 USER MOD Single : A 130 ASN : amide:sc= -3.12 K(o=-3.1,f=-13!) USER MOD Single : A 132 LYS NZ :NH3+ -162:sc= -0.0129 (180deg=-0.301) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ -159:sc= -0.0359 (180deg=-0.315) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.389 10.984 2.402 1.00 0.00 N ATOM 101 CA ILE A 7 10.939 11.075 2.062 1.00 0.00 C ATOM 102 C ILE A 7 10.589 12.564 1.854 1.00 0.00 C ATOM 103 O ILE A 7 10.727 13.345 2.774 1.00 0.00 O ATOM 104 CB ILE A 7 10.097 10.518 3.234 1.00 0.00 C ATOM 105 CG1 ILE A 7 10.766 9.281 3.858 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.701 10.138 2.737 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.790 8.119 2.863 1.00 0.00 C ATOM 0 HA ILE A 7 10.726 10.499 1.161 1.00 0.00 H new ATOM 0 HB ILE A 7 10.022 11.296 3.994 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.783 9.526 4.163 1.00 0.00 H new ATOM 0 HG13 ILE A 7 10.227 8.985 4.758 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.113 9.746 3.567 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.208 11.020 2.327 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.786 9.377 1.962 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.267 7.255 3.325 1.00 0.00 H new ATOM 0 HD12 ILE A 7 9.769 7.862 2.579 1.00 0.00 H new ATOM 0 HD13 ILE A 7 11.350 8.412 1.975 1.00 0.00 H new ATOM 119 N PRO A 8 10.145 12.979 0.681 1.00 0.00 N ATOM 120 CA PRO A 8 9.793 14.411 0.441 1.00 0.00 C ATOM 121 C PRO A 8 8.919 14.994 1.554 1.00 0.00 C ATOM 122 O PRO A 8 8.642 14.355 2.548 1.00 0.00 O ATOM 123 CB PRO A 8 9.012 14.385 -0.876 1.00 0.00 C ATOM 124 CG PRO A 8 9.540 13.194 -1.610 1.00 0.00 C ATOM 125 CD PRO A 8 9.935 12.165 -0.539 1.00 0.00 C ATOM 0 HA PRO A 8 10.684 15.038 0.412 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.940 14.297 -0.699 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.167 15.301 -1.446 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.785 12.785 -2.282 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.399 13.465 -2.224 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.152 11.421 -0.392 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.839 11.625 -0.819 1.00 0.00 H new ATOM 133 N LYS A 9 8.471 16.208 1.371 1.00 0.00 N ATOM 134 CA LYS A 9 7.599 16.868 2.386 1.00 0.00 C ATOM 135 C LYS A 9 6.265 17.233 1.731 1.00 0.00 C ATOM 136 O LYS A 9 5.246 17.327 2.386 1.00 0.00 O ATOM 137 CB LYS A 9 8.289 18.139 2.884 1.00 0.00 C ATOM 138 CG LYS A 9 7.328 18.909 3.787 1.00 0.00 C ATOM 139 CD LYS A 9 8.093 19.982 4.569 1.00 0.00 C ATOM 140 CE LYS A 9 7.168 20.605 5.615 1.00 0.00 C ATOM 141 NZ LYS A 9 7.954 21.509 6.500 1.00 0.00 N ATOM 0 H LYS A 9 8.675 16.778 0.550 1.00 0.00 H new ATOM 0 HA LYS A 9 7.423 16.195 3.226 1.00 0.00 H new ATOM 0 HB2 LYS A 9 9.196 17.884 3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.590 18.759 2.039 1.00 0.00 H new ATOM 0 HG2 LYS A 9 6.545 19.373 3.187 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.837 18.224 4.478 1.00 0.00 H new ATOM 0 HD2 LYS A 9 8.964 19.542 5.054 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.461 20.750 3.889 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.371 21.163 5.124 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.692 19.823 6.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.324 21.932 7.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.700 20.964 6.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.388 22.263 5.929 1.00 0.00 H new ATOM 155 N ASP A 10 6.264 17.441 0.443 1.00 0.00 N ATOM 156 CA ASP A 10 4.998 17.800 -0.254 1.00 0.00 C ATOM 157 C ASP A 10 4.131 16.549 -0.409 1.00 0.00 C ATOM 158 O ASP A 10 4.359 15.722 -1.271 1.00 0.00 O ATOM 159 CB ASP A 10 5.326 18.379 -1.632 1.00 0.00 C ATOM 160 CG ASP A 10 4.029 18.734 -2.362 1.00 0.00 C ATOM 161 OD1 ASP A 10 3.432 19.738 -2.011 1.00 0.00 O ATOM 162 OD2 ASP A 10 3.656 17.996 -3.259 1.00 0.00 O ATOM 0 H ASP A 10 7.086 17.378 -0.157 1.00 0.00 H new ATOM 0 HA ASP A 10 4.454 18.543 0.329 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.950 19.267 -1.526 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.897 17.656 -2.215 1.00 0.00 H new ATOM 167 N LYS A 11 3.138 16.406 0.425 1.00 0.00 N ATOM 168 CA LYS A 11 2.248 15.216 0.349 1.00 0.00 C ATOM 169 C LYS A 11 1.616 15.122 -1.042 1.00 0.00 C ATOM 170 O LYS A 11 0.885 14.197 -1.336 1.00 0.00 O ATOM 171 CB LYS A 11 1.147 15.351 1.404 1.00 0.00 C ATOM 172 CG LYS A 11 1.759 15.792 2.761 1.00 0.00 C ATOM 173 CD LYS A 11 1.113 15.019 3.916 1.00 0.00 C ATOM 174 CE LYS A 11 -0.364 15.402 4.028 1.00 0.00 C ATOM 175 NZ LYS A 11 -0.484 16.883 4.143 1.00 0.00 N ATOM 0 H LYS A 11 2.904 17.070 1.163 1.00 0.00 H new ATOM 0 HA LYS A 11 2.831 14.314 0.533 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.406 16.080 1.076 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.628 14.400 1.522 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.835 15.618 2.755 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.610 16.862 2.903 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.209 13.946 3.748 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.629 15.243 4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.910 15.049 3.153 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.811 14.921 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.373 17.123 4.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.319 17.255 4.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.482 17.306 3.193 1.00 0.00 H new ATOM 189 N SER A 12 1.889 16.078 -1.897 1.00 0.00 N ATOM 190 CA SER A 12 1.306 16.065 -3.279 1.00 0.00 C ATOM 191 C SER A 12 2.434 15.918 -4.304 1.00 0.00 C ATOM 192 O SER A 12 2.459 16.594 -5.315 1.00 0.00 O ATOM 193 CB SER A 12 0.563 17.384 -3.521 1.00 0.00 C ATOM 194 OG SER A 12 1.460 18.339 -4.074 1.00 0.00 O ATOM 0 H SER A 12 2.495 16.873 -1.696 1.00 0.00 H new ATOM 0 HA SER A 12 0.613 15.229 -3.381 1.00 0.00 H new ATOM 0 HB2 SER A 12 -0.276 17.222 -4.198 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.149 17.758 -2.584 1.00 0.00 H new ATOM 0 HG SER A 12 2.376 17.995 -4.023 1.00 0.00 H new ATOM 200 N LYS A 13 3.370 15.038 -4.054 1.00 0.00 N ATOM 201 CA LYS A 13 4.503 14.842 -5.015 1.00 0.00 C ATOM 202 C LYS A 13 4.863 13.357 -5.087 1.00 0.00 C ATOM 203 O LYS A 13 4.916 12.664 -4.089 1.00 0.00 O ATOM 204 CB LYS A 13 5.718 15.647 -4.537 1.00 0.00 C ATOM 205 CG LYS A 13 6.769 15.756 -5.663 1.00 0.00 C ATOM 206 CD LYS A 13 6.465 16.953 -6.586 1.00 0.00 C ATOM 207 CE LYS A 13 6.547 18.287 -5.811 1.00 0.00 C ATOM 208 NZ LYS A 13 7.411 18.129 -4.607 1.00 0.00 N ATOM 0 H LYS A 13 3.400 14.445 -3.225 1.00 0.00 H new ATOM 0 HA LYS A 13 4.206 15.187 -6.006 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.403 16.643 -4.227 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.160 15.167 -3.664 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.762 15.870 -5.229 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.779 14.835 -6.246 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.173 16.966 -7.415 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.471 16.840 -7.018 1.00 0.00 H new ATOM 0 HE2 LYS A 13 6.950 19.067 -6.457 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.548 18.605 -5.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.570 19.059 -4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.943 17.500 -3.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.324 17.718 -4.887 1.00 0.00 H new ATOM 222 N VAL A 14 5.091 12.863 -6.274 1.00 0.00 N ATOM 223 CA VAL A 14 5.426 11.421 -6.446 1.00 0.00 C ATOM 224 C VAL A 14 6.717 11.056 -5.710 1.00 0.00 C ATOM 225 O VAL A 14 7.804 11.394 -6.137 1.00 0.00 O ATOM 226 CB VAL A 14 5.610 11.119 -7.935 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.714 9.605 -8.137 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.416 11.663 -8.725 1.00 0.00 C ATOM 0 H VAL A 14 5.059 13.402 -7.139 1.00 0.00 H new ATOM 0 HA VAL A 14 4.608 10.833 -6.029 1.00 0.00 H new ATOM 0 HB VAL A 14 6.522 11.598 -8.292 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.845 9.388 -9.197 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.568 9.221 -7.579 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.803 9.127 -7.779 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.551 11.446 -9.785 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.500 11.190 -8.372 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.346 12.741 -8.582 1.00 0.00 H new ATOM 238 N ALA A 15 6.610 10.326 -4.631 1.00 0.00 N ATOM 239 CA ALA A 15 7.829 9.890 -3.894 1.00 0.00 C ATOM 240 C ALA A 15 8.210 8.504 -4.414 1.00 0.00 C ATOM 241 O ALA A 15 9.227 7.943 -4.055 1.00 0.00 O ATOM 242 CB ALA A 15 7.526 9.811 -2.395 1.00 0.00 C ATOM 0 H ALA A 15 5.727 10.013 -4.228 1.00 0.00 H new ATOM 0 HA ALA A 15 8.644 10.597 -4.047 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.420 9.492 -1.859 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.218 10.792 -2.034 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.724 9.093 -2.223 1.00 0.00 H new ATOM 248 N GLY A 16 7.387 7.956 -5.271 1.00 0.00 N ATOM 249 CA GLY A 16 7.670 6.609 -5.840 1.00 0.00 C ATOM 250 C GLY A 16 6.554 6.227 -6.818 1.00 0.00 C ATOM 251 O GLY A 16 5.718 7.038 -7.166 1.00 0.00 O ATOM 0 H GLY A 16 6.525 8.389 -5.602 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.632 6.613 -6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.737 5.871 -5.041 1.00 0.00 H new ATOM 255 N TYR A 17 6.533 4.999 -7.265 1.00 0.00 N ATOM 256 CA TYR A 17 5.473 4.563 -8.227 1.00 0.00 C ATOM 257 C TYR A 17 5.193 3.070 -8.021 1.00 0.00 C ATOM 258 O TYR A 17 6.090 2.251 -8.080 1.00 0.00 O ATOM 259 CB TYR A 17 5.972 4.806 -9.677 1.00 0.00 C ATOM 260 CG TYR A 17 5.161 5.888 -10.365 1.00 0.00 C ATOM 261 CD1 TYR A 17 3.846 5.625 -10.769 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.730 7.144 -10.614 1.00 0.00 C ATOM 263 CE1 TYR A 17 3.101 6.616 -11.419 1.00 0.00 C ATOM 264 CE2 TYR A 17 4.983 8.135 -11.263 1.00 0.00 C ATOM 265 CZ TYR A 17 3.669 7.872 -11.665 1.00 0.00 C ATOM 266 OH TYR A 17 2.933 8.849 -12.305 1.00 0.00 O ATOM 0 H TYR A 17 7.205 4.276 -7.006 1.00 0.00 H new ATOM 0 HA TYR A 17 4.558 5.131 -8.058 1.00 0.00 H new ATOM 0 HB2 TYR A 17 7.023 5.093 -9.659 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.904 3.880 -10.247 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.406 4.657 -10.579 1.00 0.00 H new ATOM 0 HD2 TYR A 17 6.745 7.348 -10.305 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.087 6.412 -11.731 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.422 9.103 -11.453 1.00 0.00 H new ATOM 0 HH TYR A 17 3.475 9.660 -12.396 1.00 0.00 H new ATOM 276 N ILE A 18 3.954 2.705 -7.809 1.00 0.00 N ATOM 277 CA ILE A 18 3.619 1.258 -7.632 1.00 0.00 C ATOM 278 C ILE A 18 3.127 0.725 -8.979 1.00 0.00 C ATOM 279 O ILE A 18 2.430 1.411 -9.700 1.00 0.00 O ATOM 280 CB ILE A 18 2.517 1.114 -6.570 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.297 -0.375 -6.237 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.213 1.716 -7.104 1.00 0.00 C ATOM 283 CD1 ILE A 18 3.349 -0.861 -5.230 1.00 0.00 C ATOM 0 H ILE A 18 3.161 3.344 -7.751 1.00 0.00 H new ATOM 0 HA ILE A 18 4.492 0.695 -7.302 1.00 0.00 H new ATOM 0 HB ILE A 18 2.821 1.641 -5.665 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.298 -0.518 -5.826 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.355 -0.970 -7.148 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.431 1.615 -6.352 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.365 2.772 -7.329 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.914 1.191 -8.011 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.179 -1.914 -5.006 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.345 -0.737 -5.656 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.271 -0.278 -4.312 1.00 0.00 H new ATOM 295 N GLU A 19 3.491 -0.479 -9.345 1.00 0.00 N ATOM 296 CA GLU A 19 3.044 -1.017 -10.668 1.00 0.00 C ATOM 297 C GLU A 19 2.821 -2.530 -10.591 1.00 0.00 C ATOM 298 O GLU A 19 3.651 -3.269 -10.103 1.00 0.00 O ATOM 299 CB GLU A 19 4.119 -0.729 -11.720 1.00 0.00 C ATOM 300 CG GLU A 19 4.652 0.695 -11.547 1.00 0.00 C ATOM 301 CD GLU A 19 5.642 1.008 -12.669 1.00 0.00 C ATOM 302 OE1 GLU A 19 6.792 0.621 -12.543 1.00 0.00 O ATOM 303 OE2 GLU A 19 5.235 1.631 -13.637 1.00 0.00 O ATOM 0 H GLU A 19 4.073 -1.108 -8.791 1.00 0.00 H new ATOM 0 HA GLU A 19 2.106 -0.534 -10.940 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.935 -1.446 -11.624 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.703 -0.852 -12.720 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.828 1.408 -11.565 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.140 0.797 -10.578 1.00 0.00 H new ATOM 310 N ILE A 20 1.706 -2.992 -11.099 1.00 0.00 N ATOM 311 CA ILE A 20 1.409 -4.454 -11.093 1.00 0.00 C ATOM 312 C ILE A 20 0.643 -4.788 -12.391 1.00 0.00 C ATOM 313 O ILE A 20 -0.417 -4.241 -12.628 1.00 0.00 O ATOM 314 CB ILE A 20 0.537 -4.796 -9.870 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.420 -4.845 -8.619 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.132 -6.164 -10.069 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.548 -4.944 -7.367 1.00 0.00 C ATOM 0 H ILE A 20 0.982 -2.411 -11.522 1.00 0.00 H new ATOM 0 HA ILE A 20 2.331 -5.033 -11.039 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.233 -4.033 -9.754 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.093 -5.701 -8.672 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.043 -3.952 -8.568 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.747 -6.398 -9.200 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.759 -6.136 -10.960 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.634 -6.930 -10.188 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.184 -4.978 -6.482 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.107 -4.074 -7.310 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -0.056 -5.850 -7.415 1.00 0.00 H new ATOM 329 N PRO A 21 1.151 -5.665 -13.234 1.00 0.00 N ATOM 330 CA PRO A 21 0.456 -6.023 -14.502 1.00 0.00 C ATOM 331 C PRO A 21 -0.715 -6.974 -14.248 1.00 0.00 C ATOM 332 O PRO A 21 -1.758 -6.873 -14.862 1.00 0.00 O ATOM 333 CB PRO A 21 1.552 -6.701 -15.334 1.00 0.00 C ATOM 334 CG PRO A 21 2.471 -7.316 -14.326 1.00 0.00 C ATOM 335 CD PRO A 21 2.419 -6.414 -13.085 1.00 0.00 C ATOM 0 HA PRO A 21 0.019 -5.158 -15.001 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.133 -7.456 -16.000 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.077 -5.979 -15.960 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.157 -8.331 -14.082 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.487 -7.382 -14.716 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.430 -7.000 -12.166 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.276 -5.742 -13.045 1.00 0.00 H new ATOM 343 N ASP A 22 -0.550 -7.890 -13.335 1.00 0.00 N ATOM 344 CA ASP A 22 -1.649 -8.842 -13.027 1.00 0.00 C ATOM 345 C ASP A 22 -2.935 -8.060 -12.762 1.00 0.00 C ATOM 346 O ASP A 22 -4.023 -8.595 -12.838 1.00 0.00 O ATOM 347 CB ASP A 22 -1.278 -9.657 -11.789 1.00 0.00 C ATOM 348 CG ASP A 22 -0.133 -10.610 -12.133 1.00 0.00 C ATOM 349 OD1 ASP A 22 0.654 -10.271 -13.001 1.00 0.00 O ATOM 350 OD2 ASP A 22 -0.062 -11.665 -11.522 1.00 0.00 O ATOM 0 H ASP A 22 0.301 -8.019 -12.788 1.00 0.00 H new ATOM 0 HA ASP A 22 -1.802 -9.515 -13.871 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.981 -8.992 -10.978 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.143 -10.221 -11.439 1.00 0.00 H new ATOM 355 N ALA A 23 -2.815 -6.792 -12.446 1.00 0.00 N ATOM 356 CA ALA A 23 -4.024 -5.952 -12.167 1.00 0.00 C ATOM 357 C ALA A 23 -3.941 -4.654 -12.975 1.00 0.00 C ATOM 358 O ALA A 23 -4.767 -3.778 -12.838 1.00 0.00 O ATOM 359 CB ALA A 23 -4.065 -5.617 -10.682 1.00 0.00 C ATOM 0 H ALA A 23 -1.925 -6.300 -12.369 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.924 -6.499 -12.449 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.942 -5.006 -10.471 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.117 -6.539 -10.102 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.165 -5.067 -10.408 1.00 0.00 H new ATOM 365 N ASP A 24 -2.949 -4.539 -13.814 1.00 0.00 N ATOM 366 CA ASP A 24 -2.777 -3.316 -14.657 1.00 0.00 C ATOM 367 C ASP A 24 -2.703 -2.044 -13.792 1.00 0.00 C ATOM 368 O ASP A 24 -3.050 -0.969 -14.237 1.00 0.00 O ATOM 369 CB ASP A 24 -3.922 -3.215 -15.690 1.00 0.00 C ATOM 370 CG ASP A 24 -5.181 -2.590 -15.076 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.229 -1.375 -14.973 1.00 0.00 O ATOM 372 OD2 ASP A 24 -6.081 -3.337 -14.732 1.00 0.00 O ATOM 0 H ASP A 24 -2.235 -5.254 -13.955 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.831 -3.402 -15.192 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.595 -2.616 -16.540 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.157 -4.208 -16.072 1.00 0.00 H new ATOM 377 N ILE A 25 -2.212 -2.139 -12.579 1.00 0.00 N ATOM 378 CA ILE A 25 -2.086 -0.909 -11.733 1.00 0.00 C ATOM 379 C ILE A 25 -0.761 -0.226 -12.069 1.00 0.00 C ATOM 380 O ILE A 25 0.248 -0.859 -12.299 1.00 0.00 O ATOM 381 CB ILE A 25 -2.153 -1.268 -10.221 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.601 -1.155 -9.714 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.278 -0.320 -9.382 1.00 0.00 C ATOM 384 CD1 ILE A 25 -4.525 -2.046 -10.539 1.00 0.00 C ATOM 0 H ILE A 25 -1.896 -3.005 -12.142 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.914 -0.232 -11.943 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.787 -2.289 -10.113 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.649 -1.444 -8.664 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.935 -0.119 -9.775 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.346 -0.597 -8.330 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.241 -0.395 -9.710 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.626 0.705 -9.510 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.546 -1.955 -10.168 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.490 -1.738 -11.584 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.200 -3.083 -10.456 1.00 0.00 H new ATOM 396 N LYS A 26 -0.782 1.068 -12.089 1.00 0.00 N ATOM 397 CA LYS A 26 0.439 1.859 -12.392 1.00 0.00 C ATOM 398 C LYS A 26 0.144 3.296 -11.978 1.00 0.00 C ATOM 399 O LYS A 26 -0.330 4.093 -12.762 1.00 0.00 O ATOM 400 CB LYS A 26 0.768 1.789 -13.892 1.00 0.00 C ATOM 401 CG LYS A 26 -0.517 1.836 -14.730 1.00 0.00 C ATOM 402 CD LYS A 26 -0.166 1.633 -16.208 1.00 0.00 C ATOM 403 CE LYS A 26 -1.368 1.996 -17.088 1.00 0.00 C ATOM 404 NZ LYS A 26 -1.257 1.286 -18.393 1.00 0.00 N ATOM 0 H LYS A 26 -1.614 1.628 -11.904 1.00 0.00 H new ATOM 0 HA LYS A 26 1.301 1.466 -11.853 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.418 2.620 -14.166 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.316 0.871 -14.107 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.209 1.062 -14.399 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.020 2.793 -14.592 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.691 2.252 -16.475 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.123 0.597 -16.382 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -2.296 1.718 -16.588 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.403 3.073 -17.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -2.071 1.531 -18.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.378 1.572 -18.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.244 0.259 -18.229 1.00 0.00 H new ATOM 418 N GLU A 27 0.367 3.618 -10.731 1.00 0.00 N ATOM 419 CA GLU A 27 0.039 4.988 -10.239 1.00 0.00 C ATOM 420 C GLU A 27 1.103 5.472 -9.240 1.00 0.00 C ATOM 421 O GLU A 27 1.829 4.685 -8.668 1.00 0.00 O ATOM 422 CB GLU A 27 -1.327 4.895 -9.538 1.00 0.00 C ATOM 423 CG GLU A 27 -2.460 5.176 -10.532 1.00 0.00 C ATOM 424 CD GLU A 27 -3.795 5.210 -9.789 1.00 0.00 C ATOM 425 OE1 GLU A 27 -3.964 6.082 -8.953 1.00 0.00 O ATOM 426 OE2 GLU A 27 -4.625 4.366 -10.071 1.00 0.00 O ATOM 0 H GLU A 27 0.763 2.990 -10.031 1.00 0.00 H new ATOM 0 HA GLU A 27 0.014 5.697 -11.067 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.453 3.903 -9.104 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.370 5.610 -8.716 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.288 6.127 -11.036 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.481 4.406 -11.303 1.00 0.00 H new ATOM 433 N PRO A 28 1.181 6.767 -9.019 1.00 0.00 N ATOM 434 CA PRO A 28 2.156 7.359 -8.058 1.00 0.00 C ATOM 435 C PRO A 28 1.681 7.239 -6.603 1.00 0.00 C ATOM 436 O PRO A 28 0.504 7.096 -6.332 1.00 0.00 O ATOM 437 CB PRO A 28 2.213 8.826 -8.484 1.00 0.00 C ATOM 438 CG PRO A 28 0.841 9.116 -8.994 1.00 0.00 C ATOM 439 CD PRO A 28 0.360 7.822 -9.663 1.00 0.00 C ATOM 0 HA PRO A 28 3.121 6.854 -8.084 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.471 9.474 -7.646 1.00 0.00 H new ATOM 0 HB3 PRO A 28 2.966 8.987 -9.255 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.175 9.407 -8.181 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.855 9.942 -9.705 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.705 7.658 -9.498 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.515 7.847 -10.742 1.00 0.00 H new ATOM 447 N VAL A 29 2.592 7.307 -5.669 1.00 0.00 N ATOM 448 CA VAL A 29 2.225 7.211 -4.222 1.00 0.00 C ATOM 449 C VAL A 29 2.999 8.285 -3.448 1.00 0.00 C ATOM 450 O VAL A 29 4.198 8.192 -3.277 1.00 0.00 O ATOM 451 CB VAL A 29 2.606 5.818 -3.697 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.838 5.520 -2.406 1.00 0.00 C ATOM 453 CG2 VAL A 29 2.254 4.765 -4.753 1.00 0.00 C ATOM 0 H VAL A 29 3.589 7.427 -5.848 1.00 0.00 H new ATOM 0 HA VAL A 29 1.154 7.363 -4.092 1.00 0.00 H new ATOM 0 HB VAL A 29 3.676 5.791 -3.492 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.113 4.531 -2.039 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.087 6.268 -1.654 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.767 5.548 -2.605 1.00 0.00 H new ATOM 0 HG21 VAL A 29 2.523 3.775 -4.384 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.184 4.798 -4.957 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.805 4.972 -5.671 1.00 0.00 H new ATOM 463 N TYR A 30 2.330 9.315 -2.988 1.00 0.00 N ATOM 464 CA TYR A 30 3.047 10.397 -2.238 1.00 0.00 C ATOM 465 C TYR A 30 3.147 10.001 -0.757 1.00 0.00 C ATOM 466 O TYR A 30 2.485 9.086 -0.311 1.00 0.00 O ATOM 467 CB TYR A 30 2.291 11.750 -2.378 1.00 0.00 C ATOM 468 CG TYR A 30 1.108 11.596 -3.304 1.00 0.00 C ATOM 469 CD1 TYR A 30 -0.113 11.126 -2.807 1.00 0.00 C ATOM 470 CD2 TYR A 30 1.234 11.925 -4.657 1.00 0.00 C ATOM 471 CE1 TYR A 30 -1.210 10.983 -3.664 1.00 0.00 C ATOM 472 CE2 TYR A 30 0.141 11.784 -5.516 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.082 11.313 -5.020 1.00 0.00 C ATOM 474 OH TYR A 30 -2.160 11.172 -5.869 1.00 0.00 O ATOM 0 H TYR A 30 1.325 9.454 -3.098 1.00 0.00 H new ATOM 0 HA TYR A 30 4.047 10.519 -2.654 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.953 12.089 -1.399 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.966 12.514 -2.764 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.209 10.873 -1.761 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.177 12.288 -5.038 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.152 10.619 -3.282 1.00 0.00 H new ATOM 0 HE2 TYR A 30 0.239 12.038 -6.561 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.179 11.921 -6.501 1.00 0.00 H new ATOM 484 N PRO A 31 3.962 10.690 0.002 1.00 0.00 N ATOM 485 CA PRO A 31 4.136 10.406 1.449 1.00 0.00 C ATOM 486 C PRO A 31 3.095 11.126 2.308 1.00 0.00 C ATOM 487 O PRO A 31 2.877 12.312 2.169 1.00 0.00 O ATOM 488 CB PRO A 31 5.531 10.950 1.725 1.00 0.00 C ATOM 489 CG PRO A 31 5.628 12.153 0.843 1.00 0.00 C ATOM 490 CD PRO A 31 4.823 11.814 -0.422 1.00 0.00 C ATOM 0 HA PRO A 31 4.013 9.350 1.689 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.657 11.213 2.775 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.301 10.216 1.486 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.223 13.035 1.339 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.667 12.375 0.597 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.232 12.665 -0.761 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.475 11.530 -1.248 1.00 0.00 H new ATOM 498 N GLY A 32 2.454 10.422 3.197 1.00 0.00 N ATOM 499 CA GLY A 32 1.436 11.081 4.058 1.00 0.00 C ATOM 500 C GLY A 32 0.618 10.027 4.800 1.00 0.00 C ATOM 501 O GLY A 32 0.686 8.851 4.501 1.00 0.00 O ATOM 0 H GLY A 32 2.590 9.425 3.364 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.926 11.743 4.773 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.778 11.701 3.448 1.00 0.00 H new ATOM 505 N PRO A 33 -0.163 10.451 5.759 1.00 0.00 N ATOM 506 CA PRO A 33 -1.025 9.538 6.554 1.00 0.00 C ATOM 507 C PRO A 33 -2.275 9.138 5.775 1.00 0.00 C ATOM 508 O PRO A 33 -3.050 9.977 5.370 1.00 0.00 O ATOM 509 CB PRO A 33 -1.385 10.378 7.783 1.00 0.00 C ATOM 510 CG PRO A 33 -1.390 11.788 7.283 1.00 0.00 C ATOM 511 CD PRO A 33 -0.314 11.855 6.190 1.00 0.00 C ATOM 0 HA PRO A 33 -0.531 8.600 6.807 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.358 10.096 8.186 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.657 10.243 8.583 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.368 12.057 6.884 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.171 12.488 8.089 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.622 12.496 5.364 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.623 12.258 6.575 1.00 0.00 H new ATOM 519 N ALA A 34 -2.460 7.861 5.558 1.00 0.00 N ATOM 520 CA ALA A 34 -3.656 7.375 4.791 1.00 0.00 C ATOM 521 C ALA A 34 -4.904 8.184 5.181 1.00 0.00 C ATOM 522 O ALA A 34 -5.642 7.816 6.073 1.00 0.00 O ATOM 523 CB ALA A 34 -3.879 5.877 5.092 1.00 0.00 C ATOM 0 H ALA A 34 -1.831 7.125 5.880 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.478 7.509 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.747 5.520 4.537 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.998 5.310 4.792 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -4.051 5.742 6.160 1.00 0.00 H new ATOM 529 N THR A 35 -5.136 9.280 4.504 1.00 0.00 N ATOM 530 CA THR A 35 -6.328 10.139 4.800 1.00 0.00 C ATOM 531 C THR A 35 -7.112 10.354 3.497 1.00 0.00 C ATOM 532 O THR A 35 -6.548 10.310 2.421 1.00 0.00 O ATOM 533 CB THR A 35 -5.846 11.493 5.341 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.682 11.894 4.632 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.514 11.366 6.831 1.00 0.00 C ATOM 0 H THR A 35 -4.543 9.622 3.748 1.00 0.00 H new ATOM 0 HA THR A 35 -6.968 9.660 5.541 1.00 0.00 H new ATOM 0 HB THR A 35 -6.632 12.236 5.209 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.896 11.452 5.016 1.00 0.00 H new ATOM 0 HG21 THR A 35 -5.172 12.329 7.211 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.405 11.056 7.377 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.728 10.623 6.967 1.00 0.00 H new ATOM 543 N PRO A 36 -8.401 10.582 3.582 1.00 0.00 N ATOM 544 CA PRO A 36 -9.252 10.803 2.373 1.00 0.00 C ATOM 545 C PRO A 36 -8.870 12.088 1.629 1.00 0.00 C ATOM 546 O PRO A 36 -8.794 12.113 0.418 1.00 0.00 O ATOM 547 CB PRO A 36 -10.682 10.889 2.938 1.00 0.00 C ATOM 548 CG PRO A 36 -10.509 11.289 4.369 1.00 0.00 C ATOM 549 CD PRO A 36 -9.193 10.660 4.824 1.00 0.00 C ATOM 0 HA PRO A 36 -9.135 10.008 1.637 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.278 11.621 2.393 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.197 9.932 2.855 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.479 12.374 4.470 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.342 10.935 4.977 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.697 11.270 5.579 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -9.350 9.675 5.263 1.00 0.00 H new ATOM 557 N GLU A 37 -8.630 13.154 2.342 1.00 0.00 N ATOM 558 CA GLU A 37 -8.257 14.429 1.666 1.00 0.00 C ATOM 559 C GLU A 37 -6.952 14.235 0.889 1.00 0.00 C ATOM 560 O GLU A 37 -6.654 14.967 -0.035 1.00 0.00 O ATOM 561 CB GLU A 37 -8.087 15.535 2.716 1.00 0.00 C ATOM 562 CG GLU A 37 -6.814 15.292 3.542 1.00 0.00 C ATOM 563 CD GLU A 37 -5.596 15.869 2.812 1.00 0.00 C ATOM 564 OE1 GLU A 37 -5.434 17.077 2.835 1.00 0.00 O ATOM 565 OE2 GLU A 37 -4.848 15.091 2.242 1.00 0.00 O ATOM 0 H GLU A 37 -8.676 13.198 3.360 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.044 14.718 0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.031 16.507 2.225 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -8.956 15.559 3.373 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.913 15.756 4.523 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.676 14.223 3.707 1.00 0.00 H new ATOM 572 N GLN A 38 -6.168 13.253 1.255 1.00 0.00 N ATOM 573 CA GLN A 38 -4.876 13.008 0.541 1.00 0.00 C ATOM 574 C GLN A 38 -5.090 11.938 -0.541 1.00 0.00 C ATOM 575 O GLN A 38 -5.052 12.219 -1.722 1.00 0.00 O ATOM 576 CB GLN A 38 -3.820 12.532 1.567 1.00 0.00 C ATOM 577 CG GLN A 38 -2.435 13.103 1.222 1.00 0.00 C ATOM 578 CD GLN A 38 -2.130 12.869 -0.258 1.00 0.00 C ATOM 579 OE1 GLN A 38 -1.609 13.738 -0.929 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.436 11.724 -0.801 1.00 0.00 N ATOM 0 H GLN A 38 -6.367 12.608 2.020 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.527 13.924 0.065 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.110 12.848 2.569 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -3.779 11.443 1.576 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.406 14.170 1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.672 12.628 1.839 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.873 10.994 -0.239 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.238 11.558 -1.788 1.00 0.00 H new ATOM 589 N LEU A 39 -5.309 10.712 -0.142 1.00 0.00 N ATOM 590 CA LEU A 39 -5.522 9.619 -1.134 1.00 0.00 C ATOM 591 C LEU A 39 -6.496 10.087 -2.216 1.00 0.00 C ATOM 592 O LEU A 39 -6.583 9.504 -3.278 1.00 0.00 O ATOM 593 CB LEU A 39 -6.111 8.387 -0.442 1.00 0.00 C ATOM 594 CG LEU A 39 -5.238 7.968 0.750 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.041 7.052 1.677 1.00 0.00 C ATOM 596 CD2 LEU A 39 -3.998 7.213 0.256 1.00 0.00 C ATOM 0 H LEU A 39 -5.349 10.420 0.835 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.562 9.363 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.123 8.604 -0.100 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.185 7.564 -1.153 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.927 8.863 1.289 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.420 6.755 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.920 7.583 2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.355 6.164 1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.386 6.921 1.109 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.308 6.322 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.417 7.859 -0.403 1.00 0.00 H new ATOM 608 N ASN A 40 -7.222 11.140 -1.963 1.00 0.00 N ATOM 609 CA ASN A 40 -8.175 11.638 -2.991 1.00 0.00 C ATOM 610 C ASN A 40 -7.365 12.044 -4.216 1.00 0.00 C ATOM 611 O ASN A 40 -7.848 12.047 -5.330 1.00 0.00 O ATOM 612 CB ASN A 40 -8.934 12.857 -2.440 1.00 0.00 C ATOM 613 CG ASN A 40 -10.224 12.410 -1.745 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.428 11.235 -1.513 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.107 13.307 -1.398 1.00 0.00 N ATOM 0 H ASN A 40 -7.197 11.674 -1.094 1.00 0.00 H new ATOM 0 HA ASN A 40 -8.899 10.866 -3.253 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.303 13.399 -1.736 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.170 13.545 -3.252 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.968 13.021 -0.932 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -10.936 14.293 -1.593 1.00 0.00 H new ATOM 622 N ARG A 41 -6.124 12.370 -4.008 1.00 0.00 N ATOM 623 CA ARG A 41 -5.254 12.762 -5.148 1.00 0.00 C ATOM 624 C ARG A 41 -4.752 11.484 -5.816 1.00 0.00 C ATOM 625 O ARG A 41 -4.261 11.502 -6.927 1.00 0.00 O ATOM 626 CB ARG A 41 -4.056 13.587 -4.635 1.00 0.00 C ATOM 627 CG ARG A 41 -4.452 15.064 -4.437 1.00 0.00 C ATOM 628 CD ARG A 41 -5.221 15.254 -3.108 1.00 0.00 C ATOM 629 NE ARG A 41 -6.449 16.083 -3.339 1.00 0.00 N ATOM 630 CZ ARG A 41 -6.400 17.197 -4.025 1.00 0.00 C ATOM 631 NH1 ARG A 41 -5.257 17.661 -4.451 1.00 0.00 N ATOM 632 NH2 ARG A 41 -7.498 17.860 -4.264 1.00 0.00 N ATOM 0 H ARG A 41 -5.672 12.382 -3.094 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.813 13.370 -5.859 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.700 13.172 -3.692 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.231 13.519 -5.345 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.558 15.688 -4.437 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.071 15.394 -5.271 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.500 14.283 -2.698 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.578 15.738 -2.373 1.00 0.00 H new ATOM 0 HE ARG A 41 -7.341 15.773 -2.954 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.394 17.155 -4.250 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.226 18.530 -4.985 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -8.391 17.510 -3.917 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.463 18.728 -4.798 1.00 0.00 H new ATOM 646 N GLY A 42 -4.876 10.370 -5.143 1.00 0.00 N ATOM 647 CA GLY A 42 -4.411 9.084 -5.740 1.00 0.00 C ATOM 648 C GLY A 42 -4.086 8.072 -4.638 1.00 0.00 C ATOM 649 O GLY A 42 -4.965 7.556 -3.976 1.00 0.00 O ATOM 0 H GLY A 42 -5.278 10.295 -4.209 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.182 8.681 -6.397 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.528 9.259 -6.354 1.00 0.00 H new ATOM 653 N VAL A 43 -2.823 7.773 -4.452 1.00 0.00 N ATOM 654 CA VAL A 43 -2.406 6.776 -3.412 1.00 0.00 C ATOM 655 C VAL A 43 -1.370 7.409 -2.472 1.00 0.00 C ATOM 656 O VAL A 43 -0.651 8.317 -2.843 1.00 0.00 O ATOM 657 CB VAL A 43 -1.779 5.570 -4.124 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.670 4.378 -3.167 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.639 5.184 -5.332 1.00 0.00 C ATOM 0 H VAL A 43 -2.053 8.181 -4.982 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.271 6.463 -2.827 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.778 5.842 -4.458 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.223 3.532 -3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.045 4.650 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.664 4.103 -2.814 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.193 4.327 -5.837 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.643 4.925 -4.996 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.694 6.025 -6.023 1.00 0.00 H new ATOM 669 N SER A 44 -1.287 6.928 -1.259 1.00 0.00 N ATOM 670 CA SER A 44 -0.298 7.481 -0.284 1.00 0.00 C ATOM 671 C SER A 44 0.043 6.391 0.735 1.00 0.00 C ATOM 672 O SER A 44 -0.747 5.501 0.979 1.00 0.00 O ATOM 673 CB SER A 44 -0.909 8.685 0.436 1.00 0.00 C ATOM 674 OG SER A 44 -1.621 9.477 -0.503 1.00 0.00 O ATOM 0 H SER A 44 -1.866 6.170 -0.899 1.00 0.00 H new ATOM 0 HA SER A 44 0.605 7.799 -0.805 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.578 8.349 1.228 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.126 9.277 0.910 1.00 0.00 H new ATOM 0 HG SER A 44 -1.075 9.601 -1.307 1.00 0.00 H new ATOM 680 N PHE A 45 1.205 6.433 1.335 1.00 0.00 N ATOM 681 CA PHE A 45 1.539 5.367 2.322 1.00 0.00 C ATOM 682 C PHE A 45 0.476 5.332 3.410 1.00 0.00 C ATOM 683 O PHE A 45 -0.314 6.243 3.560 1.00 0.00 O ATOM 684 CB PHE A 45 2.900 5.612 2.988 1.00 0.00 C ATOM 685 CG PHE A 45 4.029 5.562 1.972 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.155 4.475 1.092 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.952 6.615 1.911 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.197 4.449 0.159 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.990 6.589 0.976 1.00 0.00 C ATOM 690 CZ PHE A 45 6.112 5.506 0.098 1.00 0.00 C ATOM 0 H PHE A 45 1.922 7.143 1.188 1.00 0.00 H new ATOM 0 HA PHE A 45 1.579 4.421 1.781 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.896 6.583 3.482 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.070 4.862 3.760 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.448 3.660 1.135 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.861 7.450 2.590 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.295 3.611 -0.516 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.697 7.404 0.931 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.912 5.486 -0.627 1.00 0.00 H new ATOM 700 N ALA A 46 0.462 4.282 4.178 1.00 0.00 N ATOM 701 CA ALA A 46 -0.538 4.171 5.273 1.00 0.00 C ATOM 702 C ALA A 46 -0.074 5.016 6.458 1.00 0.00 C ATOM 703 O ALA A 46 -0.771 5.163 7.442 1.00 0.00 O ATOM 704 CB ALA A 46 -0.669 2.712 5.702 1.00 0.00 C ATOM 0 H ALA A 46 1.102 3.492 4.095 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.507 4.528 4.924 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.402 2.633 6.505 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.994 2.111 4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.296 2.349 6.055 1.00 0.00 H new ATOM 710 N GLU A 47 1.102 5.575 6.365 1.00 0.00 N ATOM 711 CA GLU A 47 1.622 6.420 7.481 1.00 0.00 C ATOM 712 C GLU A 47 2.567 7.487 6.920 1.00 0.00 C ATOM 713 O GLU A 47 3.262 7.270 5.948 1.00 0.00 O ATOM 714 CB GLU A 47 2.378 5.543 8.479 1.00 0.00 C ATOM 715 CG GLU A 47 1.386 4.684 9.268 1.00 0.00 C ATOM 716 CD GLU A 47 2.119 3.972 10.407 1.00 0.00 C ATOM 717 OE1 GLU A 47 3.339 3.951 10.379 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.449 3.461 11.289 1.00 0.00 O ATOM 0 H GLU A 47 1.727 5.484 5.564 1.00 0.00 H new ATOM 0 HA GLU A 47 0.786 6.905 7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.087 4.905 7.952 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.956 6.167 9.161 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.588 5.308 9.669 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.918 3.952 8.609 1.00 0.00 H new ATOM 725 N GLU A 48 2.581 8.643 7.525 1.00 0.00 N ATOM 726 CA GLU A 48 3.460 9.745 7.036 1.00 0.00 C ATOM 727 C GLU A 48 4.940 9.343 7.106 1.00 0.00 C ATOM 728 O GLU A 48 5.728 9.698 6.250 1.00 0.00 O ATOM 729 CB GLU A 48 3.233 10.987 7.903 1.00 0.00 C ATOM 730 CG GLU A 48 3.787 10.748 9.311 1.00 0.00 C ATOM 731 CD GLU A 48 3.279 11.843 10.249 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.073 11.962 10.389 1.00 0.00 O ATOM 733 OE2 GLU A 48 4.104 12.545 10.810 1.00 0.00 O ATOM 0 H GLU A 48 2.017 8.874 8.343 1.00 0.00 H new ATOM 0 HA GLU A 48 3.209 9.955 5.996 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.722 11.850 7.452 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.168 11.215 7.955 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.476 9.769 9.675 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.877 10.749 9.290 1.00 0.00 H new ATOM 740 N ASN A 49 5.335 8.638 8.134 1.00 0.00 N ATOM 741 CA ASN A 49 6.775 8.253 8.277 1.00 0.00 C ATOM 742 C ASN A 49 7.060 6.914 7.589 1.00 0.00 C ATOM 743 O ASN A 49 8.084 6.301 7.819 1.00 0.00 O ATOM 744 CB ASN A 49 7.112 8.134 9.764 1.00 0.00 C ATOM 745 CG ASN A 49 8.623 7.972 9.935 1.00 0.00 C ATOM 746 OD1 ASN A 49 9.362 8.934 9.858 1.00 0.00 O ATOM 747 ND2 ASN A 49 9.117 6.787 10.167 1.00 0.00 N ATOM 0 H ASN A 49 4.724 8.311 8.882 1.00 0.00 H new ATOM 0 HA ASN A 49 7.388 9.020 7.805 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.768 9.020 10.297 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.593 7.279 10.198 1.00 0.00 H new ATOM 0 HD21 ASN A 49 10.123 6.668 10.284 1.00 0.00 H new ATOM 0 HD22 ASN A 49 8.497 5.980 10.232 1.00 0.00 H new ATOM 754 N GLU A 50 6.181 6.453 6.747 1.00 0.00 N ATOM 755 CA GLU A 50 6.435 5.155 6.057 1.00 0.00 C ATOM 756 C GLU A 50 7.693 5.268 5.200 1.00 0.00 C ATOM 757 O GLU A 50 7.665 5.777 4.096 1.00 0.00 O ATOM 758 CB GLU A 50 5.243 4.801 5.167 1.00 0.00 C ATOM 759 CG GLU A 50 5.336 3.331 4.753 1.00 0.00 C ATOM 760 CD GLU A 50 4.982 2.443 5.947 1.00 0.00 C ATOM 761 OE1 GLU A 50 3.816 2.399 6.302 1.00 0.00 O ATOM 762 OE2 GLU A 50 5.884 1.823 6.485 1.00 0.00 O ATOM 0 H GLU A 50 5.303 6.913 6.506 1.00 0.00 H new ATOM 0 HA GLU A 50 6.573 4.373 6.804 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.310 4.981 5.701 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.233 5.439 4.283 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.657 3.132 3.924 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.343 3.104 4.403 1.00 0.00 H new ATOM 769 N SER A 51 8.800 4.791 5.700 1.00 0.00 N ATOM 770 CA SER A 51 10.069 4.857 4.922 1.00 0.00 C ATOM 771 C SER A 51 10.213 3.575 4.102 1.00 0.00 C ATOM 772 O SER A 51 9.836 2.504 4.534 1.00 0.00 O ATOM 773 CB SER A 51 11.253 4.983 5.886 1.00 0.00 C ATOM 774 OG SER A 51 11.064 4.093 6.979 1.00 0.00 O ATOM 0 H SER A 51 8.880 4.356 6.619 1.00 0.00 H new ATOM 0 HA SER A 51 10.052 5.721 4.258 1.00 0.00 H new ATOM 0 HB2 SER A 51 12.184 4.751 5.369 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.336 6.008 6.247 1.00 0.00 H new ATOM 0 HG SER A 51 11.820 4.169 7.597 1.00 0.00 H new ATOM 780 N LEU A 52 10.755 3.674 2.921 1.00 0.00 N ATOM 781 CA LEU A 52 10.921 2.466 2.084 1.00 0.00 C ATOM 782 C LEU A 52 11.786 1.477 2.857 1.00 0.00 C ATOM 783 O LEU A 52 11.978 0.347 2.454 1.00 0.00 O ATOM 784 CB LEU A 52 11.605 2.834 0.752 1.00 0.00 C ATOM 785 CG LEU A 52 11.066 4.173 0.189 1.00 0.00 C ATOM 786 CD1 LEU A 52 9.536 4.235 0.319 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.719 5.396 0.892 1.00 0.00 C ATOM 0 H LEU A 52 11.089 4.543 2.503 1.00 0.00 H new ATOM 0 HA LEU A 52 9.950 2.026 1.858 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.682 2.909 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.439 2.039 0.025 1.00 0.00 H new ATOM 0 HG LEU A 52 11.333 4.217 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 52 9.175 5.182 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 52 9.090 3.412 -0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 52 9.257 4.155 1.370 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.316 6.316 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.502 5.361 1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 52 12.798 5.370 0.740 1.00 0.00 H new ATOM 799 N ASP A 53 12.313 1.907 3.975 1.00 0.00 N ATOM 800 CA ASP A 53 13.174 1.013 4.797 1.00 0.00 C ATOM 801 C ASP A 53 12.335 0.363 5.900 1.00 0.00 C ATOM 802 O ASP A 53 12.763 -0.577 6.541 1.00 0.00 O ATOM 803 CB ASP A 53 14.298 1.834 5.436 1.00 0.00 C ATOM 804 CG ASP A 53 15.400 0.896 5.934 1.00 0.00 C ATOM 805 OD1 ASP A 53 15.722 -0.038 5.218 1.00 0.00 O ATOM 806 OD2 ASP A 53 15.901 1.127 7.021 1.00 0.00 O ATOM 0 H ASP A 53 12.181 2.845 4.353 1.00 0.00 H new ATOM 0 HA ASP A 53 13.601 0.239 4.160 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.706 2.538 4.710 1.00 0.00 H new ATOM 0 HB3 ASP A 53 13.906 2.423 6.265 1.00 0.00 H new ATOM 811 N ASP A 54 11.147 0.854 6.136 1.00 0.00 N ATOM 812 CA ASP A 54 10.304 0.255 7.204 1.00 0.00 C ATOM 813 C ASP A 54 10.067 -1.224 6.894 1.00 0.00 C ATOM 814 O ASP A 54 9.290 -1.566 6.027 1.00 0.00 O ATOM 815 CB ASP A 54 8.961 0.987 7.263 1.00 0.00 C ATOM 816 CG ASP A 54 8.201 0.563 8.521 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.833 0.037 9.422 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.000 0.773 8.562 1.00 0.00 O ATOM 0 H ASP A 54 10.729 1.639 5.637 1.00 0.00 H new ATOM 0 HA ASP A 54 10.810 0.348 8.165 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.123 2.065 7.269 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.371 0.758 6.375 1.00 0.00 H new ATOM 823 N GLN A 55 10.732 -2.102 7.602 1.00 0.00 N ATOM 824 CA GLN A 55 10.547 -3.568 7.360 1.00 0.00 C ATOM 825 C GLN A 55 9.054 -3.874 7.215 1.00 0.00 C ATOM 826 O GLN A 55 8.668 -4.902 6.691 1.00 0.00 O ATOM 827 CB GLN A 55 11.132 -4.350 8.547 1.00 0.00 C ATOM 828 CG GLN A 55 10.704 -5.828 8.481 1.00 0.00 C ATOM 829 CD GLN A 55 9.322 -6.000 9.119 1.00 0.00 C ATOM 830 OE1 GLN A 55 9.090 -5.549 10.223 1.00 0.00 O ATOM 831 NE2 GLN A 55 8.389 -6.636 8.465 1.00 0.00 N ATOM 0 H GLN A 55 11.397 -1.867 8.339 1.00 0.00 H new ATOM 0 HA GLN A 55 11.061 -3.863 6.445 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.220 -4.279 8.536 1.00 0.00 H new ATOM 0 HB3 GLN A 55 10.793 -3.908 9.484 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.679 -6.162 7.444 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.433 -6.450 8.999 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.584 -7.015 7.538 1.00 0.00 H new ATOM 0 HE22 GLN A 55 7.465 -6.754 8.881 1.00 0.00 H new ATOM 840 N ASN A 56 8.217 -2.973 7.664 1.00 0.00 N ATOM 841 CA ASN A 56 6.739 -3.170 7.558 1.00 0.00 C ATOM 842 C ASN A 56 6.138 -2.003 6.773 1.00 0.00 C ATOM 843 O ASN A 56 5.793 -0.981 7.332 1.00 0.00 O ATOM 844 CB ASN A 56 6.135 -3.205 8.968 1.00 0.00 C ATOM 845 CG ASN A 56 4.607 -3.110 8.886 1.00 0.00 C ATOM 846 OD1 ASN A 56 3.999 -2.326 9.585 1.00 0.00 O ATOM 847 ND2 ASN A 56 3.960 -3.881 8.055 1.00 0.00 N ATOM 0 H ASN A 56 8.499 -2.098 8.105 1.00 0.00 H new ATOM 0 HA ASN A 56 6.522 -4.107 7.046 1.00 0.00 H new ATOM 0 HB2 ASN A 56 6.424 -4.126 9.474 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.528 -2.379 9.561 1.00 0.00 H new ATOM 0 HD21 ASN A 56 2.943 -3.825 7.993 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.471 -4.540 7.467 1.00 0.00 H new ATOM 854 N ILE A 57 5.997 -2.147 5.481 1.00 0.00 N ATOM 855 CA ILE A 57 5.403 -1.046 4.669 1.00 0.00 C ATOM 856 C ILE A 57 3.906 -1.297 4.538 1.00 0.00 C ATOM 857 O ILE A 57 3.458 -2.425 4.467 1.00 0.00 O ATOM 858 CB ILE A 57 6.033 -1.017 3.274 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.538 -0.758 3.400 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.389 0.104 2.449 1.00 0.00 C ATOM 861 CD1 ILE A 57 8.205 -0.914 2.030 1.00 0.00 C ATOM 0 H ILE A 57 6.267 -2.978 4.955 1.00 0.00 H new ATOM 0 HA ILE A 57 5.590 -0.090 5.159 1.00 0.00 H new ATOM 0 HB ILE A 57 5.869 -1.974 2.779 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.713 0.245 3.788 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.979 -1.456 4.111 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.836 0.127 1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.318 -0.078 2.361 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.555 1.061 2.944 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.275 -0.729 2.123 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.043 -1.926 1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.773 -0.198 1.331 1.00 0.00 H new ATOM 873 N SER A 58 3.123 -0.254 4.507 1.00 0.00 N ATOM 874 CA SER A 58 1.647 -0.421 4.383 1.00 0.00 C ATOM 875 C SER A 58 1.099 0.685 3.487 1.00 0.00 C ATOM 876 O SER A 58 1.071 1.841 3.856 1.00 0.00 O ATOM 877 CB SER A 58 1.011 -0.336 5.773 1.00 0.00 C ATOM 878 OG SER A 58 -0.354 0.037 5.646 1.00 0.00 O ATOM 0 H SER A 58 3.444 0.713 4.563 1.00 0.00 H new ATOM 0 HA SER A 58 1.413 -1.391 3.944 1.00 0.00 H new ATOM 0 HB2 SER A 58 1.091 -1.297 6.281 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.543 0.393 6.384 1.00 0.00 H new ATOM 0 HG SER A 58 -0.720 0.245 6.531 1.00 0.00 H new ATOM 884 N ILE A 59 0.677 0.344 2.299 1.00 0.00 N ATOM 885 CA ILE A 59 0.146 1.380 1.365 1.00 0.00 C ATOM 886 C ILE A 59 -1.377 1.452 1.469 1.00 0.00 C ATOM 887 O ILE A 59 -2.025 0.547 1.955 1.00 0.00 O ATOM 888 CB ILE A 59 0.534 1.019 -0.071 1.00 0.00 C ATOM 889 CG1 ILE A 59 2.060 0.939 -0.184 1.00 0.00 C ATOM 890 CG2 ILE A 59 0.005 2.091 -1.029 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.444 0.337 -1.539 1.00 0.00 C ATOM 0 H ILE A 59 0.677 -0.608 1.934 1.00 0.00 H new ATOM 0 HA ILE A 59 0.570 2.348 1.633 1.00 0.00 H new ATOM 0 HB ILE A 59 0.100 0.054 -0.332 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.495 1.933 -0.080 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.463 0.328 0.624 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.281 1.834 -2.051 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.081 2.146 -0.950 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.437 3.057 -0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.530 0.281 -1.618 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.022 -0.664 -1.625 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.054 0.965 -2.340 1.00 0.00 H new ATOM 903 N ALA A 60 -1.945 2.529 0.996 1.00 0.00 N ATOM 904 CA ALA A 60 -3.430 2.703 1.030 1.00 0.00 C ATOM 905 C ALA A 60 -3.876 3.209 -0.341 1.00 0.00 C ATOM 906 O ALA A 60 -3.293 4.128 -0.881 1.00 0.00 O ATOM 907 CB ALA A 60 -3.799 3.729 2.104 1.00 0.00 C ATOM 0 H ALA A 60 -1.436 3.309 0.580 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.921 1.758 1.263 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.881 3.856 2.129 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.452 3.379 3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.327 4.684 1.873 1.00 0.00 H new ATOM 913 N GLY A 61 -4.890 2.614 -0.925 1.00 0.00 N ATOM 914 CA GLY A 61 -5.335 3.073 -2.284 1.00 0.00 C ATOM 915 C GLY A 61 -6.857 3.007 -2.409 1.00 0.00 C ATOM 916 O GLY A 61 -7.502 2.130 -1.871 1.00 0.00 O ATOM 0 H GLY A 61 -5.423 1.841 -0.528 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -4.996 4.094 -2.457 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.875 2.450 -3.051 1.00 0.00 H new ATOM 920 N HIS A 62 -7.428 3.933 -3.134 1.00 0.00 N ATOM 921 CA HIS A 62 -8.911 3.934 -3.319 1.00 0.00 C ATOM 922 C HIS A 62 -9.306 2.788 -4.265 1.00 0.00 C ATOM 923 O HIS A 62 -8.503 1.939 -4.598 1.00 0.00 O ATOM 924 CB HIS A 62 -9.360 5.289 -3.915 1.00 0.00 C ATOM 925 CG HIS A 62 -9.694 6.263 -2.813 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.909 6.227 -2.147 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.995 7.309 -2.261 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.906 7.222 -1.241 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.763 7.912 -1.268 1.00 0.00 N ATOM 0 H HIS A 62 -6.932 4.689 -3.606 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.400 3.791 -2.355 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.568 5.698 -4.543 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.230 5.142 -4.555 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -8.002 7.617 -2.553 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.728 7.436 -0.574 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.507 8.710 -0.686 1.00 0.00 H new ATOM 937 N THR A 63 -10.540 2.764 -4.697 1.00 0.00 N ATOM 938 CA THR A 63 -10.992 1.681 -5.619 1.00 0.00 C ATOM 939 C THR A 63 -12.342 2.059 -6.233 1.00 0.00 C ATOM 940 O THR A 63 -13.385 1.806 -5.664 1.00 0.00 O ATOM 941 CB THR A 63 -11.144 0.372 -4.839 1.00 0.00 C ATOM 942 OG1 THR A 63 -12.108 -0.452 -5.483 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.605 0.670 -3.412 1.00 0.00 C ATOM 0 H THR A 63 -11.255 3.449 -4.451 1.00 0.00 H new ATOM 0 HA THR A 63 -10.253 1.553 -6.410 1.00 0.00 H new ATOM 0 HB THR A 63 -10.183 -0.142 -4.808 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.990 -0.029 -5.426 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.712 -0.265 -2.861 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.868 1.301 -2.916 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.565 1.186 -3.440 1.00 0.00 H new ATOM 951 N PHE A 64 -12.332 2.656 -7.396 1.00 0.00 N ATOM 952 CA PHE A 64 -13.616 3.044 -8.054 1.00 0.00 C ATOM 953 C PHE A 64 -14.100 1.878 -8.924 1.00 0.00 C ATOM 954 O PHE A 64 -13.485 1.526 -9.911 1.00 0.00 O ATOM 955 CB PHE A 64 -13.386 4.293 -8.923 1.00 0.00 C ATOM 956 CG PHE A 64 -13.468 5.538 -8.062 1.00 0.00 C ATOM 957 CD1 PHE A 64 -12.572 5.712 -7.001 1.00 0.00 C ATOM 958 CD2 PHE A 64 -14.440 6.516 -8.324 1.00 0.00 C ATOM 959 CE1 PHE A 64 -12.645 6.859 -6.201 1.00 0.00 C ATOM 960 CE2 PHE A 64 -14.512 7.662 -7.523 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.615 7.834 -6.463 1.00 0.00 C ATOM 0 H PHE A 64 -11.489 2.892 -7.920 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.371 3.271 -7.301 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.410 4.237 -9.406 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.132 4.338 -9.716 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -11.823 4.960 -6.799 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -15.132 6.385 -9.143 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -11.953 6.991 -5.382 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -15.261 8.414 -7.723 1.00 0.00 H new ATOM 0 HZ PHE A 64 -13.671 8.719 -5.847 1.00 0.00 H new ATOM 971 N ILE A 65 -15.197 1.274 -8.556 1.00 0.00 N ATOM 972 CA ILE A 65 -15.729 0.123 -9.346 1.00 0.00 C ATOM 973 C ILE A 65 -16.057 0.569 -10.767 1.00 0.00 C ATOM 974 O ILE A 65 -15.975 -0.199 -11.705 1.00 0.00 O ATOM 975 CB ILE A 65 -17.015 -0.399 -8.702 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.833 -0.531 -7.193 1.00 0.00 C ATOM 977 CG2 ILE A 65 -17.361 -1.768 -9.288 1.00 0.00 C ATOM 978 CD1 ILE A 65 -18.133 -1.054 -6.586 1.00 0.00 C ATOM 0 H ILE A 65 -15.751 1.528 -7.738 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.971 -0.660 -9.365 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.821 0.306 -8.905 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -16.011 -1.212 -6.970 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.575 0.434 -6.758 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -18.277 -2.139 -8.829 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.506 -1.677 -10.365 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.547 -2.465 -9.089 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -18.017 -1.153 -5.507 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.942 -0.356 -6.801 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -18.370 -2.027 -7.016 1.00 0.00 H new ATOM 990 N ASP A 66 -16.454 1.798 -10.931 1.00 0.00 N ATOM 991 CA ASP A 66 -16.817 2.287 -12.284 1.00 0.00 C ATOM 992 C ASP A 66 -15.557 2.732 -13.013 1.00 0.00 C ATOM 993 O ASP A 66 -15.607 3.414 -14.018 1.00 0.00 O ATOM 994 CB ASP A 66 -17.784 3.464 -12.151 1.00 0.00 C ATOM 995 CG ASP A 66 -18.289 3.873 -13.536 1.00 0.00 C ATOM 996 OD1 ASP A 66 -18.258 3.040 -14.427 1.00 0.00 O ATOM 997 OD2 ASP A 66 -18.699 5.012 -13.683 1.00 0.00 O ATOM 0 H ASP A 66 -16.542 2.486 -10.183 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.296 1.489 -12.851 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.624 3.187 -11.514 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.284 4.306 -11.672 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.424 2.339 -12.510 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.137 2.718 -13.159 1.00 0.00 C ATOM 1004 C ARG A 67 -12.092 1.632 -12.864 1.00 0.00 C ATOM 1005 O ARG A 67 -11.210 1.820 -12.052 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.667 4.076 -12.606 1.00 0.00 C ATOM 1007 CG ARG A 67 -11.725 4.768 -13.614 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.542 5.570 -14.636 1.00 0.00 C ATOM 1009 NE ARG A 67 -11.618 6.297 -15.551 1.00 0.00 N ATOM 1010 CZ ARG A 67 -12.069 6.797 -16.669 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.328 6.658 -16.983 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -11.261 7.434 -17.473 1.00 0.00 N ATOM 0 H ARG A 67 -14.331 1.767 -11.671 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.271 2.805 -14.237 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -13.529 4.713 -12.407 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -12.152 3.931 -11.657 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -11.038 5.430 -13.086 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.118 4.022 -14.127 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -13.186 4.902 -15.208 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.193 6.277 -14.122 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.634 6.404 -15.304 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -13.958 6.159 -16.355 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -13.682 7.048 -17.856 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.277 7.541 -17.227 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -11.614 7.825 -18.347 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.209 0.497 -13.514 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.281 -0.675 -13.330 1.00 0.00 C ATOM 1028 C PRO A 68 -9.787 -0.332 -13.477 1.00 0.00 C ATOM 1029 O PRO A 68 -8.977 -1.187 -13.774 1.00 0.00 O ATOM 1030 CB PRO A 68 -11.719 -1.651 -14.434 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.152 -1.318 -14.680 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.260 0.196 -14.501 1.00 0.00 C ATOM 0 HA PRO A 68 -11.356 -1.071 -12.317 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.121 -1.523 -15.337 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.601 -2.687 -14.117 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.457 -1.617 -15.683 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -13.802 -1.843 -13.980 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.094 0.725 -15.440 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.246 0.489 -14.141 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.412 0.897 -13.262 1.00 0.00 N ATOM 1041 CA ASN A 69 -7.976 1.279 -13.376 1.00 0.00 C ATOM 1042 C ASN A 69 -7.710 2.456 -12.438 1.00 0.00 C ATOM 1043 O ASN A 69 -7.381 3.542 -12.870 1.00 0.00 O ATOM 1044 CB ASN A 69 -7.669 1.690 -14.818 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.088 0.569 -15.770 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -7.255 -0.148 -16.287 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.355 0.384 -16.026 1.00 0.00 N ATOM 0 H ASN A 69 -10.042 1.659 -13.011 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.341 0.436 -13.104 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -8.200 2.609 -15.066 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -6.605 1.897 -14.929 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -9.644 -0.362 -16.659 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.056 0.985 -15.593 1.00 0.00 H new ATOM 1054 N TYR A 70 -7.864 2.258 -11.151 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.632 3.383 -10.197 1.00 0.00 C ATOM 1056 C TYR A 70 -7.154 2.855 -8.840 1.00 0.00 C ATOM 1057 O TYR A 70 -7.936 2.431 -8.015 1.00 0.00 O ATOM 1058 CB TYR A 70 -8.938 4.156 -10.005 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.653 5.483 -9.335 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -7.998 6.498 -10.044 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -9.043 5.699 -8.007 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -7.736 7.728 -9.428 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -8.780 6.928 -7.391 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.127 7.943 -8.100 1.00 0.00 C ATOM 1065 OH TYR A 70 -7.869 9.154 -7.491 1.00 0.00 O ATOM 0 H TYR A 70 -8.138 1.373 -10.724 1.00 0.00 H new ATOM 0 HA TYR A 70 -6.863 4.037 -10.608 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.419 4.321 -10.969 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.631 3.573 -9.398 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -7.695 6.332 -11.067 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -9.547 4.917 -7.458 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -7.233 8.511 -9.976 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.081 7.093 -6.367 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.206 9.136 -6.571 1.00 0.00 H new ATOM 1075 N GLN A 71 -5.871 2.913 -8.600 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.316 2.459 -7.292 1.00 0.00 C ATOM 1077 C GLN A 71 -5.636 0.981 -7.029 1.00 0.00 C ATOM 1078 O GLN A 71 -5.263 0.111 -7.791 1.00 0.00 O ATOM 1079 CB GLN A 71 -5.903 3.332 -6.178 1.00 0.00 C ATOM 1080 CG GLN A 71 -5.849 4.798 -6.617 1.00 0.00 C ATOM 1081 CD GLN A 71 -6.129 5.709 -5.423 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -5.860 5.352 -4.293 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -6.662 6.882 -5.627 1.00 0.00 N ATOM 0 H GLN A 71 -5.177 3.259 -9.262 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.231 2.559 -7.316 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -6.932 3.038 -5.971 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.340 3.194 -5.255 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -4.869 5.025 -7.037 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -6.582 4.979 -7.403 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -6.888 7.182 -6.576 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -6.853 7.500 -4.838 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.297 0.691 -5.936 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.615 -0.728 -5.587 1.00 0.00 C ATOM 1094 C PHE A 72 -8.008 -1.096 -6.138 1.00 0.00 C ATOM 1095 O PHE A 72 -8.763 -1.837 -5.550 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.534 -0.861 -4.041 1.00 0.00 C ATOM 1097 CG PHE A 72 -7.326 -2.046 -3.524 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -6.787 -3.337 -3.579 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -8.610 -1.850 -2.999 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -7.532 -4.427 -3.117 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -9.353 -2.939 -2.535 1.00 0.00 C ATOM 1102 CZ PHE A 72 -8.815 -4.229 -2.596 1.00 0.00 C ATOM 0 H PHE A 72 -6.633 1.382 -5.265 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.905 -1.423 -6.037 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.491 -0.965 -3.741 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.908 0.053 -3.580 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.795 -3.491 -3.978 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.027 -0.855 -2.953 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.116 -5.423 -3.163 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.342 -2.785 -2.130 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.390 -5.072 -2.241 1.00 0.00 H new ATOM 1112 N THR A 73 -8.354 -0.597 -7.289 1.00 0.00 N ATOM 1113 CA THR A 73 -9.687 -0.941 -7.856 1.00 0.00 C ATOM 1114 C THR A 73 -9.741 -2.428 -8.223 1.00 0.00 C ATOM 1115 O THR A 73 -10.613 -3.146 -7.776 1.00 0.00 O ATOM 1116 CB THR A 73 -9.964 -0.107 -9.108 1.00 0.00 C ATOM 1117 OG1 THR A 73 -9.953 1.273 -8.771 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.338 -0.490 -9.669 1.00 0.00 C ATOM 0 H THR A 73 -7.781 0.027 -7.857 1.00 0.00 H new ATOM 0 HA THR A 73 -10.443 -0.725 -7.102 1.00 0.00 H new ATOM 0 HB THR A 73 -9.196 -0.298 -9.857 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.072 1.516 -8.417 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.544 0.100 -10.562 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.344 -1.550 -9.925 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.105 -0.293 -8.920 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.835 -2.893 -9.060 1.00 0.00 N ATOM 1127 CA ASN A 74 -8.857 -4.336 -9.486 1.00 0.00 C ATOM 1128 C ASN A 74 -7.668 -5.109 -8.905 1.00 0.00 C ATOM 1129 O ASN A 74 -7.469 -6.261 -9.229 1.00 0.00 O ATOM 1130 CB ASN A 74 -8.852 -4.409 -11.025 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.430 -4.269 -11.574 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -6.815 -5.247 -11.938 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -6.882 -3.089 -11.656 1.00 0.00 N ATOM 0 H ASN A 74 -8.083 -2.336 -9.466 1.00 0.00 H new ATOM 0 HA ASN A 74 -9.764 -4.802 -9.101 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -9.280 -5.358 -11.349 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.483 -3.619 -11.433 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -5.937 -2.990 -12.026 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.399 -2.264 -11.350 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.888 -4.523 -8.037 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.760 -5.306 -7.454 1.00 0.00 C ATOM 1142 C LEU A 75 -6.372 -6.537 -6.786 1.00 0.00 C ATOM 1143 O LEU A 75 -5.701 -7.504 -6.485 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.987 -4.452 -6.426 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.603 -4.070 -6.978 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.978 -2.982 -6.095 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.681 -5.315 -7.024 1.00 0.00 C ATOM 0 H LEU A 75 -6.978 -3.560 -7.712 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.049 -5.601 -8.226 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.554 -3.551 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.874 -5.007 -5.495 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.718 -3.686 -7.992 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.998 -2.713 -6.488 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.621 -2.102 -6.092 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.870 -3.357 -5.077 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.705 -5.030 -7.417 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.564 -5.719 -6.018 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.125 -6.073 -7.670 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.660 -6.503 -6.586 1.00 0.00 N ATOM 1160 CA LYS A 76 -8.353 -7.663 -5.975 1.00 0.00 C ATOM 1161 C LYS A 76 -8.501 -8.713 -7.073 1.00 0.00 C ATOM 1162 O LYS A 76 -8.807 -9.864 -6.827 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.735 -7.229 -5.441 1.00 0.00 C ATOM 1164 CG LYS A 76 -10.246 -6.021 -6.236 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.719 -5.749 -5.886 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.619 -6.902 -6.373 1.00 0.00 C ATOM 1167 NZ LYS A 76 -12.816 -7.877 -5.263 1.00 0.00 N ATOM 0 H LYS A 76 -8.263 -5.715 -6.822 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.790 -8.066 -5.133 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.442 -8.055 -5.523 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.663 -6.975 -4.383 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.641 -5.143 -6.009 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -10.146 -6.209 -7.305 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.825 -5.629 -4.808 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.039 -4.813 -6.344 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -13.581 -6.512 -6.705 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -12.163 -7.397 -7.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.566 -8.832 -5.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.208 -7.616 -4.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -13.811 -7.864 -4.962 1.00 0.00 H new ATOM 1181 N ALA A 77 -8.252 -8.307 -8.288 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.331 -9.241 -9.436 1.00 0.00 C ATOM 1183 C ALA A 77 -7.023 -10.021 -9.487 1.00 0.00 C ATOM 1184 O ALA A 77 -6.974 -11.162 -9.903 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.498 -8.431 -10.723 1.00 0.00 C ATOM 0 H ALA A 77 -7.993 -7.351 -8.533 1.00 0.00 H new ATOM 0 HA ALA A 77 -9.175 -9.922 -9.331 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.557 -9.109 -11.574 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.412 -7.840 -10.665 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.644 -7.766 -10.848 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.962 -9.399 -9.050 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.638 -10.086 -9.048 1.00 0.00 C ATOM 1193 C ALA A 78 -4.786 -11.447 -8.367 1.00 0.00 C ATOM 1194 O ALA A 78 -5.858 -11.819 -7.933 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.627 -9.241 -8.269 1.00 0.00 C ATOM 0 H ALA A 78 -5.954 -8.443 -8.694 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.290 -10.218 -10.072 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.659 -9.742 -8.267 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.529 -8.264 -8.742 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.972 -9.115 -7.243 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.717 -12.196 -8.262 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.791 -13.538 -7.601 1.00 0.00 C ATOM 1203 C LYS A 79 -2.543 -13.744 -6.740 1.00 0.00 C ATOM 1204 O LYS A 79 -1.500 -13.175 -6.996 1.00 0.00 O ATOM 1205 CB LYS A 79 -3.859 -14.635 -8.673 1.00 0.00 C ATOM 1206 CG LYS A 79 -5.260 -14.676 -9.314 1.00 0.00 C ATOM 1207 CD LYS A 79 -6.217 -15.522 -8.460 1.00 0.00 C ATOM 1208 CE LYS A 79 -7.546 -15.693 -9.199 1.00 0.00 C ATOM 1209 NZ LYS A 79 -7.291 -16.244 -10.561 1.00 0.00 N ATOM 0 H LYS A 79 -2.793 -11.936 -8.606 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.682 -13.589 -6.975 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.107 -14.450 -9.440 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.628 -15.602 -8.227 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.651 -13.663 -9.414 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.195 -15.093 -10.319 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.774 -16.497 -8.256 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.384 -15.040 -7.497 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -8.201 -16.362 -8.641 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -8.059 -14.734 -9.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -8.048 -16.911 -10.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -7.270 -15.467 -11.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.377 -16.739 -10.569 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.645 -14.547 -5.717 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.471 -14.787 -4.833 1.00 0.00 C ATOM 1225 C LYS A 80 -0.255 -15.181 -5.679 1.00 0.00 C ATOM 1226 O LYS A 80 -0.004 -16.345 -5.922 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.800 -15.910 -3.842 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.804 -15.874 -2.679 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.965 -17.130 -1.816 1.00 0.00 C ATOM 1230 CE LYS A 80 -2.414 -17.245 -1.333 1.00 0.00 C ATOM 1231 NZ LYS A 80 -2.927 -15.894 -0.971 1.00 0.00 N ATOM 0 H LYS A 80 -3.494 -15.049 -5.455 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.240 -13.875 -4.283 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.817 -15.792 -3.467 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.755 -16.877 -4.344 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.214 -15.814 -3.063 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.970 -14.983 -2.074 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.692 -18.015 -2.391 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.290 -17.084 -0.962 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.035 -17.684 -2.114 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.469 -17.909 -0.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.707 -15.990 -0.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.161 -15.335 -0.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.271 -15.413 -1.826 1.00 0.00 H new ATOM 1245 N GLY A 81 0.503 -14.216 -6.125 1.00 0.00 N ATOM 1246 CA GLY A 81 1.707 -14.521 -6.952 1.00 0.00 C ATOM 1247 C GLY A 81 2.063 -13.299 -7.800 1.00 0.00 C ATOM 1248 O GLY A 81 3.149 -13.192 -8.333 1.00 0.00 O ATOM 0 H GLY A 81 0.340 -13.224 -5.951 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.546 -14.788 -6.309 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.512 -15.379 -7.595 1.00 0.00 H new ATOM 1252 N SER A 82 1.155 -12.369 -7.917 1.00 0.00 N ATOM 1253 CA SER A 82 1.433 -11.148 -8.711 1.00 0.00 C ATOM 1254 C SER A 82 2.583 -10.406 -8.050 1.00 0.00 C ATOM 1255 O SER A 82 2.511 -10.038 -6.895 1.00 0.00 O ATOM 1256 CB SER A 82 0.189 -10.259 -8.729 1.00 0.00 C ATOM 1257 OG SER A 82 0.555 -8.949 -9.138 1.00 0.00 O ATOM 0 H SER A 82 0.228 -12.407 -7.493 1.00 0.00 H new ATOM 0 HA SER A 82 1.694 -11.411 -9.736 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.556 -10.670 -9.410 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.266 -10.230 -7.739 1.00 0.00 H new ATOM 0 HG SER A 82 0.331 -8.310 -8.429 1.00 0.00 H new ATOM 1263 N MET A 83 3.652 -10.191 -8.754 1.00 0.00 N ATOM 1264 CA MET A 83 4.791 -9.484 -8.123 1.00 0.00 C ATOM 1265 C MET A 83 4.424 -8.014 -7.919 1.00 0.00 C ATOM 1266 O MET A 83 3.307 -7.609 -8.164 1.00 0.00 O ATOM 1267 CB MET A 83 6.031 -9.598 -9.012 1.00 0.00 C ATOM 1268 CG MET A 83 6.589 -11.021 -8.935 1.00 0.00 C ATOM 1269 SD MET A 83 7.709 -11.306 -10.328 1.00 0.00 S ATOM 1270 CE MET A 83 9.208 -10.664 -9.544 1.00 0.00 C ATOM 0 H MET A 83 3.786 -10.470 -9.726 1.00 0.00 H new ATOM 0 HA MET A 83 5.010 -9.938 -7.156 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.776 -9.352 -10.043 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.788 -8.882 -8.691 1.00 0.00 H new ATOM 0 HG2 MET A 83 7.119 -11.165 -7.993 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.774 -11.744 -8.956 1.00 0.00 H new ATOM 0 HE1 MET A 83 10.044 -10.743 -10.239 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.058 -9.619 -9.274 1.00 0.00 H new ATOM 0 HE3 MET A 83 9.426 -11.243 -8.646 1.00 0.00 H new ATOM 1280 N VAL A 84 5.350 -7.214 -7.462 1.00 0.00 N ATOM 1281 CA VAL A 84 5.045 -5.768 -7.230 1.00 0.00 C ATOM 1282 C VAL A 84 6.291 -4.928 -7.517 1.00 0.00 C ATOM 1283 O VAL A 84 7.251 -4.958 -6.773 1.00 0.00 O ATOM 1284 CB VAL A 84 4.632 -5.571 -5.770 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.093 -4.154 -5.573 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.542 -6.580 -5.405 1.00 0.00 C ATOM 0 H VAL A 84 6.304 -7.497 -7.239 1.00 0.00 H new ATOM 0 HA VAL A 84 4.236 -5.456 -7.891 1.00 0.00 H new ATOM 0 HB VAL A 84 5.501 -5.722 -5.129 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.800 -4.018 -4.532 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.867 -3.431 -5.830 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.227 -4.001 -6.217 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.249 -6.439 -4.365 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.676 -6.429 -6.050 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.923 -7.592 -5.540 1.00 0.00 H new ATOM 1296 N TYR A 85 6.287 -4.168 -8.584 1.00 0.00 N ATOM 1297 CA TYR A 85 7.477 -3.324 -8.899 1.00 0.00 C ATOM 1298 C TYR A 85 7.286 -1.937 -8.281 1.00 0.00 C ATOM 1299 O TYR A 85 6.571 -1.106 -8.806 1.00 0.00 O ATOM 1300 CB TYR A 85 7.619 -3.191 -10.417 1.00 0.00 C ATOM 1301 CG TYR A 85 7.853 -4.555 -11.021 1.00 0.00 C ATOM 1302 CD1 TYR A 85 9.157 -5.045 -11.159 1.00 0.00 C ATOM 1303 CD2 TYR A 85 6.767 -5.329 -11.443 1.00 0.00 C ATOM 1304 CE1 TYR A 85 9.374 -6.310 -11.718 1.00 0.00 C ATOM 1305 CE2 TYR A 85 6.983 -6.594 -12.002 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.287 -7.085 -12.140 1.00 0.00 C ATOM 1307 OH TYR A 85 8.500 -8.331 -12.691 1.00 0.00 O ATOM 0 H TYR A 85 5.515 -4.097 -9.246 1.00 0.00 H new ATOM 0 HA TYR A 85 8.375 -3.787 -8.491 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.719 -2.744 -10.840 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.449 -2.527 -10.659 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.996 -4.447 -10.834 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.761 -4.950 -11.337 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.380 -6.688 -11.824 1.00 0.00 H new ATOM 0 HE2 TYR A 85 6.144 -7.191 -12.327 1.00 0.00 H new ATOM 0 HH TYR A 85 7.639 -8.735 -12.929 1.00 0.00 H new ATOM 1317 N PHE A 86 7.928 -1.680 -7.171 1.00 0.00 N ATOM 1318 CA PHE A 86 7.802 -0.345 -6.509 1.00 0.00 C ATOM 1319 C PHE A 86 9.016 0.505 -6.892 1.00 0.00 C ATOM 1320 O PHE A 86 10.135 0.208 -6.521 1.00 0.00 O ATOM 1321 CB PHE A 86 7.747 -0.548 -4.987 1.00 0.00 C ATOM 1322 CG PHE A 86 7.923 0.774 -4.264 1.00 0.00 C ATOM 1323 CD1 PHE A 86 7.089 1.860 -4.566 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.920 0.909 -3.287 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.253 3.075 -3.892 1.00 0.00 C ATOM 1326 CE2 PHE A 86 9.081 2.125 -2.614 1.00 0.00 C ATOM 1327 CZ PHE A 86 8.248 3.208 -2.918 1.00 0.00 C ATOM 0 H PHE A 86 8.538 -2.341 -6.691 1.00 0.00 H new ATOM 0 HA PHE A 86 6.893 0.162 -6.831 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.793 -0.996 -4.709 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.528 -1.243 -4.679 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.321 1.759 -5.318 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.564 0.074 -3.054 1.00 0.00 H new ATOM 0 HE1 PHE A 86 6.610 3.911 -4.124 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.848 2.228 -1.860 1.00 0.00 H new ATOM 0 HZ PHE A 86 8.374 4.147 -2.400 1.00 0.00 H new ATOM 1337 N LYS A 87 8.812 1.550 -7.653 1.00 0.00 N ATOM 1338 CA LYS A 87 9.964 2.404 -8.081 1.00 0.00 C ATOM 1339 C LYS A 87 10.178 3.557 -7.102 1.00 0.00 C ATOM 1340 O LYS A 87 9.248 4.093 -6.532 1.00 0.00 O ATOM 1341 CB LYS A 87 9.690 2.974 -9.477 1.00 0.00 C ATOM 1342 CG LYS A 87 9.234 1.849 -10.416 1.00 0.00 C ATOM 1343 CD LYS A 87 9.426 2.280 -11.876 1.00 0.00 C ATOM 1344 CE LYS A 87 8.732 3.624 -12.120 1.00 0.00 C ATOM 1345 NZ LYS A 87 9.595 4.729 -11.612 1.00 0.00 N ATOM 0 H LYS A 87 7.900 1.849 -7.997 1.00 0.00 H new ATOM 0 HA LYS A 87 10.862 1.786 -8.099 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.923 3.747 -9.421 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.590 3.446 -9.870 1.00 0.00 H new ATOM 0 HG2 LYS A 87 9.806 0.943 -10.217 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.186 1.612 -10.232 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.489 2.364 -12.103 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.016 1.523 -12.544 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.540 3.758 -13.185 1.00 0.00 H new ATOM 0 HE3 LYS A 87 7.765 3.643 -11.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.587 5.516 -12.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.232 5.059 -10.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.569 4.383 -11.495 1.00 0.00 H new ATOM 1359 N VAL A 88 11.413 3.944 -6.920 1.00 0.00 N ATOM 1360 CA VAL A 88 11.743 5.070 -5.999 1.00 0.00 C ATOM 1361 C VAL A 88 12.835 5.917 -6.649 1.00 0.00 C ATOM 1362 O VAL A 88 13.594 5.437 -7.469 1.00 0.00 O ATOM 1363 CB VAL A 88 12.260 4.511 -4.670 1.00 0.00 C ATOM 1364 CG1 VAL A 88 12.795 5.653 -3.800 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.121 3.808 -3.933 1.00 0.00 C ATOM 0 H VAL A 88 12.220 3.520 -7.378 1.00 0.00 H new ATOM 0 HA VAL A 88 10.855 5.674 -5.812 1.00 0.00 H new ATOM 0 HB VAL A 88 13.062 3.800 -4.869 1.00 0.00 H new ATOM 0 HG11 VAL A 88 13.162 5.250 -2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 88 13.610 6.156 -4.321 1.00 0.00 H new ATOM 0 HG13 VAL A 88 11.995 6.367 -3.604 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.490 3.411 -2.987 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.319 4.520 -3.739 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.740 2.991 -4.546 1.00 0.00 H new ATOM 1375 N GLY A 89 12.929 7.166 -6.292 1.00 0.00 N ATOM 1376 CA GLY A 89 13.980 8.031 -6.895 1.00 0.00 C ATOM 1377 C GLY A 89 15.358 7.560 -6.421 1.00 0.00 C ATOM 1378 O GLY A 89 16.221 8.356 -6.107 1.00 0.00 O ATOM 0 H GLY A 89 12.325 7.625 -5.610 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.923 7.988 -7.983 1.00 0.00 H new ATOM 0 HA3 GLY A 89 13.820 9.070 -6.608 1.00 0.00 H new ATOM 1382 N ASN A 90 15.571 6.271 -6.363 1.00 0.00 N ATOM 1383 CA ASN A 90 16.891 5.759 -5.905 1.00 0.00 C ATOM 1384 C ASN A 90 17.082 4.311 -6.369 1.00 0.00 C ATOM 1385 O ASN A 90 18.181 3.896 -6.677 1.00 0.00 O ATOM 1386 CB ASN A 90 16.953 5.815 -4.376 1.00 0.00 C ATOM 1387 CG ASN A 90 18.296 5.259 -3.899 1.00 0.00 C ATOM 1388 OD1 ASN A 90 19.340 5.738 -4.293 1.00 0.00 O ATOM 1389 ND2 ASN A 90 18.315 4.260 -3.059 1.00 0.00 N ATOM 0 H ASN A 90 14.889 5.555 -6.613 1.00 0.00 H new ATOM 0 HA ASN A 90 17.682 6.377 -6.330 1.00 0.00 H new ATOM 0 HB2 ASN A 90 16.831 6.843 -4.034 1.00 0.00 H new ATOM 0 HB3 ASN A 90 16.135 5.237 -3.947 1.00 0.00 H new ATOM 0 HD21 ASN A 90 19.206 3.883 -2.735 1.00 0.00 H new ATOM 0 HD22 ASN A 90 17.439 3.856 -2.727 1.00 0.00 H new ATOM 1396 N GLU A 91 16.027 3.539 -6.422 1.00 0.00 N ATOM 1397 CA GLU A 91 16.168 2.119 -6.862 1.00 0.00 C ATOM 1398 C GLU A 91 14.781 1.492 -7.019 1.00 0.00 C ATOM 1399 O GLU A 91 13.792 2.030 -6.561 1.00 0.00 O ATOM 1400 CB GLU A 91 16.963 1.334 -5.812 1.00 0.00 C ATOM 1401 CG GLU A 91 17.212 -0.093 -6.311 1.00 0.00 C ATOM 1402 CD GLU A 91 18.329 -0.738 -5.488 1.00 0.00 C ATOM 1403 OE1 GLU A 91 18.053 -1.156 -4.376 1.00 0.00 O ATOM 1404 OE2 GLU A 91 19.443 -0.802 -5.984 1.00 0.00 O ATOM 0 H GLU A 91 15.079 3.829 -6.181 1.00 0.00 H new ATOM 0 HA GLU A 91 16.693 2.087 -7.817 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.913 1.831 -5.615 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.414 1.309 -4.870 1.00 0.00 H new ATOM 0 HG2 GLU A 91 16.299 -0.682 -6.228 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.487 -0.077 -7.366 1.00 0.00 H new ATOM 1411 N THR A 92 14.704 0.353 -7.664 1.00 0.00 N ATOM 1412 CA THR A 92 13.386 -0.330 -7.863 1.00 0.00 C ATOM 1413 C THR A 92 13.304 -1.560 -6.957 1.00 0.00 C ATOM 1414 O THR A 92 14.133 -2.446 -7.017 1.00 0.00 O ATOM 1415 CB THR A 92 13.257 -0.766 -9.328 1.00 0.00 C ATOM 1416 OG1 THR A 92 11.965 -1.319 -9.542 1.00 0.00 O ATOM 1417 CG2 THR A 92 14.324 -1.817 -9.659 1.00 0.00 C ATOM 0 H THR A 92 15.504 -0.137 -8.064 1.00 0.00 H new ATOM 0 HA THR A 92 12.578 0.358 -7.613 1.00 0.00 H new ATOM 0 HB THR A 92 13.399 0.101 -9.974 1.00 0.00 H new ATOM 0 HG1 THR A 92 11.879 -1.597 -10.478 1.00 0.00 H new ATOM 0 HG21 THR A 92 14.225 -2.121 -10.701 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.315 -1.393 -9.497 1.00 0.00 H new ATOM 0 HG23 THR A 92 14.192 -2.686 -9.014 1.00 0.00 H new ATOM 1425 N ARG A 93 12.303 -1.624 -6.117 1.00 0.00 N ATOM 1426 CA ARG A 93 12.158 -2.799 -5.207 1.00 0.00 C ATOM 1427 C ARG A 93 11.250 -3.835 -5.881 1.00 0.00 C ATOM 1428 O ARG A 93 10.500 -3.517 -6.781 1.00 0.00 O ATOM 1429 CB ARG A 93 11.537 -2.348 -3.873 1.00 0.00 C ATOM 1430 CG ARG A 93 12.020 -0.935 -3.517 1.00 0.00 C ATOM 1431 CD ARG A 93 13.552 -0.854 -3.597 1.00 0.00 C ATOM 1432 NE ARG A 93 14.036 0.189 -2.650 1.00 0.00 N ATOM 1433 CZ ARG A 93 15.300 0.245 -2.329 1.00 0.00 C ATOM 1434 NH1 ARG A 93 16.144 -0.606 -2.846 1.00 0.00 N ATOM 1435 NH2 ARG A 93 15.721 1.154 -1.493 1.00 0.00 N ATOM 0 H ARG A 93 11.579 -0.912 -6.022 1.00 0.00 H new ATOM 0 HA ARG A 93 13.135 -3.239 -5.009 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.450 -2.361 -3.946 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.812 -3.045 -3.081 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.576 -0.210 -4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.688 -0.673 -2.512 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.993 -1.820 -3.350 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.863 -0.612 -4.613 1.00 0.00 H new ATOM 0 HE ARG A 93 13.379 0.860 -2.252 1.00 0.00 H new ATOM 0 HH11 ARG A 93 15.816 -1.315 -3.501 1.00 0.00 H new ATOM 0 HH12 ARG A 93 17.132 -0.562 -2.595 1.00 0.00 H new ATOM 0 HH21 ARG A 93 15.062 1.821 -1.090 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.709 1.198 -1.242 1.00 0.00 H new ATOM 1449 N LYS A 94 11.307 -5.071 -5.455 1.00 0.00 N ATOM 1450 CA LYS A 94 10.440 -6.119 -6.078 1.00 0.00 C ATOM 1451 C LYS A 94 9.999 -7.127 -5.012 1.00 0.00 C ATOM 1452 O LYS A 94 10.811 -7.764 -4.372 1.00 0.00 O ATOM 1453 CB LYS A 94 11.213 -6.844 -7.189 1.00 0.00 C ATOM 1454 CG LYS A 94 12.624 -7.215 -6.705 1.00 0.00 C ATOM 1455 CD LYS A 94 13.446 -7.794 -7.868 1.00 0.00 C ATOM 1456 CE LYS A 94 13.091 -9.270 -8.091 1.00 0.00 C ATOM 1457 NZ LYS A 94 13.295 -10.032 -6.828 1.00 0.00 N ATOM 0 H LYS A 94 11.914 -5.400 -4.705 1.00 0.00 H new ATOM 0 HA LYS A 94 9.559 -5.643 -6.509 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.675 -7.744 -7.487 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.280 -6.206 -8.070 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.122 -6.333 -6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.560 -7.943 -5.897 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.252 -7.225 -8.777 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.510 -7.698 -7.653 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.055 -9.359 -8.418 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.712 -9.688 -8.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.717 -10.957 -7.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.931 -9.500 -6.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.379 -10.172 -6.355 1.00 0.00 H new ATOM 1471 N TYR A 95 8.709 -7.272 -4.824 1.00 0.00 N ATOM 1472 CA TYR A 95 8.181 -8.238 -3.807 1.00 0.00 C ATOM 1473 C TYR A 95 7.415 -9.352 -4.521 1.00 0.00 C ATOM 1474 O TYR A 95 7.251 -9.332 -5.726 1.00 0.00 O ATOM 1475 CB TYR A 95 7.227 -7.511 -2.855 1.00 0.00 C ATOM 1476 CG TYR A 95 7.906 -6.293 -2.274 1.00 0.00 C ATOM 1477 CD1 TYR A 95 7.864 -5.073 -2.960 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.570 -6.382 -1.045 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.488 -3.942 -2.417 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.194 -5.252 -0.502 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.153 -4.033 -1.188 1.00 0.00 C ATOM 1482 OH TYR A 95 9.769 -2.920 -0.652 1.00 0.00 O ATOM 0 H TYR A 95 7.992 -6.758 -5.336 1.00 0.00 H new ATOM 0 HA TYR A 95 9.013 -8.659 -3.242 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.324 -7.214 -3.388 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.918 -8.182 -2.054 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.351 -5.004 -3.908 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.601 -7.323 -0.515 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.456 -3.001 -2.946 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.707 -5.321 0.446 1.00 0.00 H new ATOM 0 HH TYR A 95 10.183 -3.156 0.205 1.00 0.00 H new ATOM 1492 N LYS A 96 6.939 -10.323 -3.781 1.00 0.00 N ATOM 1493 CA LYS A 96 6.173 -11.450 -4.400 1.00 0.00 C ATOM 1494 C LYS A 96 4.946 -11.760 -3.544 1.00 0.00 C ATOM 1495 O LYS A 96 5.050 -12.321 -2.469 1.00 0.00 O ATOM 1496 CB LYS A 96 7.062 -12.694 -4.472 1.00 0.00 C ATOM 1497 CG LYS A 96 6.378 -13.764 -5.326 1.00 0.00 C ATOM 1498 CD LYS A 96 7.222 -15.039 -5.322 1.00 0.00 C ATOM 1499 CE LYS A 96 6.397 -16.199 -5.883 1.00 0.00 C ATOM 1500 NZ LYS A 96 5.175 -16.387 -5.052 1.00 0.00 N ATOM 0 H LYS A 96 7.049 -10.384 -2.769 1.00 0.00 H new ATOM 0 HA LYS A 96 5.859 -11.165 -5.404 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.031 -12.437 -4.900 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.249 -13.079 -3.469 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.382 -13.974 -4.936 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.251 -13.403 -6.347 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.121 -14.895 -5.922 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.549 -15.268 -4.308 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.119 -15.995 -6.917 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.991 -17.113 -5.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 4.885 -17.385 -5.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 5.378 -16.115 -4.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 4.407 -15.792 -5.424 1.00 0.00 H new ATOM 1514 N MET A 97 3.782 -11.404 -4.015 1.00 0.00 N ATOM 1515 CA MET A 97 2.543 -11.685 -3.238 1.00 0.00 C ATOM 1516 C MET A 97 2.548 -13.153 -2.803 1.00 0.00 C ATOM 1517 O MET A 97 2.578 -14.049 -3.623 1.00 0.00 O ATOM 1518 CB MET A 97 1.323 -11.410 -4.122 1.00 0.00 C ATOM 1519 CG MET A 97 0.069 -11.281 -3.254 1.00 0.00 C ATOM 1520 SD MET A 97 0.044 -9.651 -2.469 1.00 0.00 S ATOM 1521 CE MET A 97 -0.856 -8.782 -3.777 1.00 0.00 C ATOM 0 H MET A 97 3.636 -10.930 -4.906 1.00 0.00 H new ATOM 0 HA MET A 97 2.501 -11.046 -2.356 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.476 -10.494 -4.693 1.00 0.00 H new ATOM 0 HB3 MET A 97 1.196 -12.218 -4.843 1.00 0.00 H new ATOM 0 HG2 MET A 97 -0.824 -11.416 -3.864 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.058 -12.063 -2.494 1.00 0.00 H new ATOM 0 HE1 MET A 97 -0.986 -7.737 -3.496 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.291 -8.840 -4.708 1.00 0.00 H new ATOM 0 HE3 MET A 97 -1.833 -9.245 -3.916 1.00 0.00 H new ATOM 1531 N THR A 98 2.528 -13.411 -1.521 1.00 0.00 N ATOM 1532 CA THR A 98 2.541 -14.827 -1.041 1.00 0.00 C ATOM 1533 C THR A 98 1.701 -14.949 0.231 1.00 0.00 C ATOM 1534 O THR A 98 1.839 -15.891 0.987 1.00 0.00 O ATOM 1535 CB THR A 98 3.981 -15.247 -0.741 1.00 0.00 C ATOM 1536 OG1 THR A 98 3.980 -16.516 -0.101 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.636 -14.213 0.175 1.00 0.00 C ATOM 0 H THR A 98 2.503 -12.704 -0.786 1.00 0.00 H new ATOM 0 HA THR A 98 2.123 -15.474 -1.812 1.00 0.00 H new ATOM 0 HB THR A 98 4.542 -15.310 -1.673 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.416 -16.478 0.700 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.662 -14.514 0.388 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.637 -13.240 -0.317 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.076 -14.147 1.108 1.00 0.00 H new ATOM 1545 N SER A 99 0.828 -14.011 0.474 1.00 0.00 N ATOM 1546 CA SER A 99 -0.018 -14.082 1.695 1.00 0.00 C ATOM 1547 C SER A 99 -1.111 -13.021 1.598 1.00 0.00 C ATOM 1548 O SER A 99 -0.833 -11.841 1.512 1.00 0.00 O ATOM 1549 CB SER A 99 0.841 -13.821 2.928 1.00 0.00 C ATOM 1550 OG SER A 99 1.701 -14.931 3.146 1.00 0.00 O ATOM 0 H SER A 99 0.665 -13.199 -0.121 1.00 0.00 H new ATOM 0 HA SER A 99 -0.468 -15.071 1.777 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.428 -12.913 2.790 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.207 -13.661 3.800 1.00 0.00 H new ATOM 0 HG SER A 99 1.539 -15.610 2.458 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.353 -13.434 1.596 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.480 -12.455 1.486 1.00 0.00 C ATOM 1558 C ILE A 100 -4.560 -12.794 2.518 1.00 0.00 C ATOM 1559 O ILE A 100 -4.734 -13.934 2.896 1.00 0.00 O ATOM 1560 CB ILE A 100 -4.080 -12.543 0.081 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.052 -12.070 -0.951 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.327 -11.659 -0.003 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.518 -12.469 -2.353 1.00 0.00 C ATOM 0 H ILE A 100 -2.637 -14.411 1.666 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.108 -11.447 1.671 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.353 -13.578 -0.127 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.931 -10.988 -0.890 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.078 -12.512 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.752 -11.724 -1.005 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.063 -11.998 0.726 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.055 -10.625 0.210 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.787 -12.133 -3.089 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.617 -13.553 -2.409 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.482 -12.006 -2.562 1.00 0.00 H new ATOM 1842 N ASP A 118 11.753 -10.390 7.046 1.00 0.00 N ATOM 1843 CA ASP A 118 12.252 -9.792 5.765 1.00 0.00 C ATOM 1844 C ASP A 118 11.327 -8.665 5.306 1.00 0.00 C ATOM 1845 O ASP A 118 10.138 -8.679 5.552 1.00 0.00 O ATOM 1846 CB ASP A 118 12.288 -10.880 4.690 1.00 0.00 C ATOM 1847 CG ASP A 118 13.026 -10.356 3.456 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.740 -9.376 3.589 1.00 0.00 O ATOM 1849 OD2 ASP A 118 12.865 -10.944 2.399 1.00 0.00 O ATOM 0 HA ASP A 118 13.250 -9.385 5.927 1.00 0.00 H new ATOM 0 HB2 ASP A 118 12.787 -11.769 5.075 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.273 -11.175 4.422 1.00 0.00 H new ATOM 1854 N LYS A 119 11.876 -7.693 4.624 1.00 0.00 N ATOM 1855 CA LYS A 119 11.054 -6.554 4.118 1.00 0.00 C ATOM 1856 C LYS A 119 9.770 -7.109 3.499 1.00 0.00 C ATOM 1857 O LYS A 119 9.779 -8.139 2.854 1.00 0.00 O ATOM 1858 CB LYS A 119 11.843 -5.774 3.050 1.00 0.00 C ATOM 1859 CG LYS A 119 13.314 -5.646 3.463 1.00 0.00 C ATOM 1860 CD LYS A 119 13.412 -5.078 4.880 1.00 0.00 C ATOM 1861 CE LYS A 119 14.869 -4.728 5.188 1.00 0.00 C ATOM 1862 NZ LYS A 119 15.754 -5.834 4.725 1.00 0.00 N ATOM 0 H LYS A 119 12.868 -7.640 4.394 1.00 0.00 H new ATOM 0 HA LYS A 119 10.812 -5.882 4.942 1.00 0.00 H new ATOM 0 HB2 LYS A 119 11.771 -6.285 2.090 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.408 -4.783 2.918 1.00 0.00 H new ATOM 0 HG2 LYS A 119 13.799 -6.621 3.419 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.841 -4.996 2.765 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.786 -4.190 4.972 1.00 0.00 H new ATOM 0 HD3 LYS A 119 13.041 -5.806 5.602 1.00 0.00 H new ATOM 0 HE2 LYS A 119 15.143 -3.797 4.692 1.00 0.00 H new ATOM 0 HE3 LYS A 119 14.998 -4.569 6.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 16.681 -5.754 5.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 15.323 -6.749 4.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 15.877 -5.772 3.694 1.00 0.00 H new ATOM 1876 N GLN A 120 8.662 -6.454 3.702 1.00 0.00 N ATOM 1877 CA GLN A 120 7.383 -6.973 3.138 1.00 0.00 C ATOM 1878 C GLN A 120 6.416 -5.818 2.881 1.00 0.00 C ATOM 1879 O GLN A 120 6.685 -4.681 3.218 1.00 0.00 O ATOM 1880 CB GLN A 120 6.758 -7.976 4.116 1.00 0.00 C ATOM 1881 CG GLN A 120 6.816 -7.430 5.550 1.00 0.00 C ATOM 1882 CD GLN A 120 6.601 -8.566 6.543 1.00 0.00 C ATOM 1883 OE1 GLN A 120 5.601 -9.254 6.498 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.514 -8.790 7.448 1.00 0.00 N ATOM 0 H GLN A 120 8.585 -5.586 4.231 1.00 0.00 H new ATOM 0 HA GLN A 120 7.587 -7.475 2.192 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.723 -8.171 3.836 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.288 -8.927 4.060 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.781 -6.955 5.730 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.053 -6.664 5.689 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.352 -8.209 7.482 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.390 -9.546 8.122 1.00 0.00 H new ATOM 1893 N LEU A 121 5.299 -6.108 2.261 1.00 0.00 N ATOM 1894 CA LEU A 121 4.298 -5.045 1.934 1.00 0.00 C ATOM 1895 C LEU A 121 2.940 -5.391 2.554 1.00 0.00 C ATOM 1896 O LEU A 121 2.631 -6.538 2.802 1.00 0.00 O ATOM 1897 CB LEU A 121 4.154 -4.987 0.408 1.00 0.00 C ATOM 1898 CG LEU A 121 3.183 -3.872 -0.008 1.00 0.00 C ATOM 1899 CD1 LEU A 121 3.702 -2.503 0.466 1.00 0.00 C ATOM 1900 CD2 LEU A 121 3.052 -3.878 -1.536 1.00 0.00 C ATOM 0 H LEU A 121 5.035 -7.047 1.964 1.00 0.00 H new ATOM 0 HA LEU A 121 4.630 -4.086 2.331 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.129 -4.814 -0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 121 3.794 -5.946 0.036 1.00 0.00 H new ATOM 0 HG LEU A 121 2.210 -4.048 0.451 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.002 -1.724 0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.795 -2.505 1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 121 4.677 -2.309 0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 121 2.365 -3.091 -1.845 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.030 -3.704 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.668 -4.844 -1.865 1.00 0.00 H new ATOM 1912 N THR A 122 2.123 -4.396 2.785 1.00 0.00 N ATOM 1913 CA THR A 122 0.765 -4.633 3.365 1.00 0.00 C ATOM 1914 C THR A 122 -0.213 -3.666 2.691 1.00 0.00 C ATOM 1915 O THR A 122 -0.422 -2.560 3.146 1.00 0.00 O ATOM 1916 CB THR A 122 0.792 -4.382 4.877 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.955 -4.981 5.432 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.454 -4.991 5.522 1.00 0.00 C ATOM 0 H THR A 122 2.341 -3.418 2.595 1.00 0.00 H new ATOM 0 HA THR A 122 0.455 -5.664 3.194 1.00 0.00 H new ATOM 0 HB THR A 122 0.807 -3.309 5.067 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.721 -4.381 5.312 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.432 -4.811 6.597 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.346 -4.532 5.095 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.473 -6.065 5.334 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.794 -4.067 1.594 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.732 -3.160 0.874 1.00 0.00 C ATOM 1928 C LEU A 123 -3.008 -2.954 1.693 1.00 0.00 C ATOM 1929 O LEU A 123 -3.438 -3.817 2.431 1.00 0.00 O ATOM 1930 CB LEU A 123 -2.090 -3.769 -0.491 1.00 0.00 C ATOM 1931 CG LEU A 123 -2.615 -2.669 -1.442 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -1.442 -1.994 -2.168 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -3.561 -3.286 -2.481 1.00 0.00 C ATOM 0 H LEU A 123 -0.660 -4.983 1.165 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.247 -2.195 0.730 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.213 -4.248 -0.926 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.847 -4.543 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 123 -3.152 -1.926 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -1.823 -1.221 -2.835 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.772 -1.543 -1.436 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -0.897 -2.738 -2.749 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -3.928 -2.506 -3.148 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -3.024 -4.037 -3.061 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.404 -3.754 -1.973 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.616 -1.803 1.558 1.00 0.00 N ATOM 1946 CA ILE A 124 -4.871 -1.502 2.313 1.00 0.00 C ATOM 1947 C ILE A 124 -5.830 -0.748 1.395 1.00 0.00 C ATOM 1948 O ILE A 124 -5.423 0.087 0.614 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.550 -0.602 3.510 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.677 -1.354 4.517 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -5.852 -0.170 4.191 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.131 -0.356 5.535 1.00 0.00 C ATOM 0 H ILE A 124 -3.293 -1.050 0.950 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.317 -2.435 2.657 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.011 0.277 3.156 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.260 -2.126 5.020 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.857 -1.857 4.004 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.622 0.470 5.043 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.470 0.379 3.480 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.392 -1.052 4.536 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.507 -0.880 6.259 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.536 0.399 5.021 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.960 0.126 6.053 1.00 0.00 H new ATOM 1964 N THR A 125 -7.101 -1.021 1.481 1.00 0.00 N ATOM 1965 CA THR A 125 -8.071 -0.291 0.611 1.00 0.00 C ATOM 1966 C THR A 125 -8.551 0.962 1.349 1.00 0.00 C ATOM 1967 O THR A 125 -8.510 1.032 2.561 1.00 0.00 O ATOM 1968 CB THR A 125 -9.276 -1.187 0.313 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.282 -0.977 1.295 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.848 -2.653 0.342 1.00 0.00 C ATOM 0 H THR A 125 -7.511 -1.712 2.110 1.00 0.00 H new ATOM 0 HA THR A 125 -7.585 -0.016 -0.325 1.00 0.00 H new ATOM 0 HB THR A 125 -9.668 -0.940 -0.673 1.00 0.00 H new ATOM 0 HG1 THR A 125 -11.053 -1.550 1.101 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.708 -3.288 0.129 1.00 0.00 H new ATOM 0 HG22 THR A 125 -8.078 -2.822 -0.410 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.452 -2.897 1.328 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.010 1.952 0.630 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.495 3.199 1.295 1.00 0.00 C ATOM 1980 C CYS A 126 -10.618 3.818 0.460 1.00 0.00 C ATOM 1981 O CYS A 126 -10.382 4.633 -0.409 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.336 4.192 1.422 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.306 3.732 2.838 1.00 0.00 S ATOM 0 H CYS A 126 -9.070 1.952 -0.388 1.00 0.00 H new ATOM 0 HA CYS A 126 -9.875 2.960 2.288 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -7.740 4.192 0.509 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -8.721 5.203 1.551 1.00 0.00 H new ATOM 0 HG CYS A 126 -7.508 2.482 3.134 1.00 0.00 H new ATOM 1989 N ASP A 127 -11.841 3.440 0.720 1.00 0.00 N ATOM 1990 CA ASP A 127 -12.986 4.005 -0.053 1.00 0.00 C ATOM 1991 C ASP A 127 -14.219 4.065 0.850 1.00 0.00 C ATOM 1992 O ASP A 127 -14.411 3.227 1.707 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.281 3.110 -1.258 1.00 0.00 C ATOM 1994 CG ASP A 127 -14.448 3.695 -2.054 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -14.707 4.878 -1.904 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -15.063 2.951 -2.801 1.00 0.00 O ATOM 0 H ASP A 127 -12.098 2.762 1.437 1.00 0.00 H new ATOM 0 HA ASP A 127 -12.735 5.007 -0.401 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -12.397 3.032 -1.892 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.524 2.101 -0.924 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.050 5.056 0.672 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.264 5.176 1.526 1.00 0.00 C ATOM 2003 C ASP A 128 -15.829 5.337 2.982 1.00 0.00 C ATOM 2004 O ASP A 128 -16.104 4.503 3.818 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.129 3.917 1.379 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.129 3.466 -0.082 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -16.817 4.282 -0.934 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -17.441 2.312 -0.326 1.00 0.00 O ATOM 0 H ASP A 128 -14.940 5.788 -0.029 1.00 0.00 H new ATOM 0 HA ASP A 128 -16.848 6.043 1.217 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -16.743 3.121 2.016 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.148 4.123 1.707 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.143 6.401 3.289 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.684 6.604 4.688 1.00 0.00 C ATOM 2015 C TYR A 129 -15.899 6.741 5.611 1.00 0.00 C ATOM 2016 O TYR A 129 -16.737 7.600 5.423 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.821 7.868 4.757 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.301 8.066 6.162 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.132 8.598 7.154 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -11.979 7.724 6.468 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.639 8.787 8.452 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.486 7.910 7.761 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.314 8.443 8.756 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.826 8.631 10.032 1.00 0.00 O ATOM 0 H TYR A 129 -14.881 7.137 2.633 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.091 5.748 5.011 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -12.987 7.787 4.060 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.407 8.735 4.452 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.152 8.863 6.920 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.338 7.315 5.701 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.280 9.198 9.218 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.466 7.643 7.994 1.00 0.00 H new ATOM 0 HH TYR A 129 -10.891 8.340 10.071 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.010 5.893 6.605 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.179 5.975 7.529 1.00 0.00 C ATOM 2036 C ASN A 130 -16.893 6.996 8.634 1.00 0.00 C ATOM 2037 O ASN A 130 -15.934 6.879 9.371 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.415 4.601 8.162 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.673 4.643 9.028 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -19.429 5.592 8.980 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -18.931 3.642 9.825 1.00 0.00 N ATOM 0 H ASN A 130 -15.343 5.151 6.814 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.062 6.284 6.971 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.522 3.845 7.384 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.554 4.316 8.767 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.768 3.657 10.408 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -18.296 2.845 9.865 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.723 8.002 8.751 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.511 9.042 9.803 1.00 0.00 C ATOM 2050 C GLU A 131 -18.296 8.668 11.061 1.00 0.00 C ATOM 2051 O GLU A 131 -18.475 9.472 11.955 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.002 10.395 9.284 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.394 10.234 8.671 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.019 11.613 8.455 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.485 12.363 7.654 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.019 11.896 9.093 1.00 0.00 O ATOM 0 H GLU A 131 -18.542 8.148 8.160 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.449 9.103 10.043 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.034 11.119 10.098 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.308 10.784 8.539 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.326 9.701 7.722 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.025 9.636 9.328 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.764 7.452 11.143 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.536 7.031 12.349 1.00 0.00 C ATOM 2065 C LYS A 132 -18.561 6.667 13.470 1.00 0.00 C ATOM 2066 O LYS A 132 -18.882 6.753 14.639 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.399 5.814 12.010 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.474 6.215 10.996 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.101 4.957 10.393 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.198 5.355 9.403 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.349 5.946 10.143 1.00 0.00 N ATOM 0 H LYS A 132 -18.646 6.733 10.429 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.179 7.849 12.672 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.778 5.017 11.601 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.865 5.423 12.914 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -22.240 6.819 11.482 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.036 6.829 10.209 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -21.338 4.365 9.888 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.519 4.332 11.182 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -22.808 6.074 8.682 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.526 4.483 8.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.194 5.934 9.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.531 5.390 11.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -24.126 6.927 10.406 1.00 0.00 H new ATOM 2085 N THR A 133 -17.367 6.264 13.120 1.00 0.00 N ATOM 2086 CA THR A 133 -16.354 5.892 14.157 1.00 0.00 C ATOM 2087 C THR A 133 -14.974 6.368 13.704 1.00 0.00 C ATOM 2088 O THR A 133 -13.972 6.092 14.334 1.00 0.00 O ATOM 2089 CB THR A 133 -16.333 4.371 14.328 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.272 3.754 13.050 1.00 0.00 O ATOM 2091 CG2 THR A 133 -17.599 3.919 15.055 1.00 0.00 C ATOM 0 H THR A 133 -17.047 6.176 12.156 1.00 0.00 H new ATOM 0 HA THR A 133 -16.613 6.361 15.106 1.00 0.00 H new ATOM 0 HB THR A 133 -15.460 4.083 14.913 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.257 2.780 13.157 1.00 0.00 H new ATOM 0 HG21 THR A 133 -17.582 2.836 15.176 1.00 0.00 H new ATOM 0 HG22 THR A 133 -17.644 4.393 16.036 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.475 4.206 14.473 1.00 0.00 H new ATOM 2099 N GLY A 134 -14.914 7.082 12.613 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.600 7.578 12.116 1.00 0.00 C ATOM 2101 C GLY A 134 -12.754 6.397 11.635 1.00 0.00 C ATOM 2102 O GLY A 134 -11.626 6.221 12.052 1.00 0.00 O ATOM 0 H GLY A 134 -15.719 7.343 12.044 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.752 8.286 11.301 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.078 8.113 12.909 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.290 5.581 10.762 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.516 4.404 10.258 1.00 0.00 C ATOM 2108 C VAL A 135 -12.902 4.111 8.807 1.00 0.00 C ATOM 2109 O VAL A 135 -14.059 4.170 8.441 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.851 3.173 11.109 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.784 2.096 10.898 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.894 3.562 12.588 1.00 0.00 C ATOM 0 H VAL A 135 -14.229 5.678 10.377 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.451 4.628 10.319 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.824 2.785 10.808 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -12.024 1.222 11.504 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.757 1.812 9.846 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.810 2.486 11.194 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -13.132 2.684 13.188 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.923 3.955 12.889 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.657 4.325 12.742 1.00 0.00 H new ATOM 2122 N TRP A 136 -11.951 3.774 7.982 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.287 3.455 6.572 1.00 0.00 C ATOM 2124 C TRP A 136 -13.330 2.336 6.566 1.00 0.00 C ATOM 2125 O TRP A 136 -13.070 1.234 7.007 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.015 3.008 5.831 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.276 4.213 5.336 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.115 4.685 5.844 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.642 5.110 4.251 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.748 5.815 5.135 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.655 6.115 4.142 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.725 5.143 3.360 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.738 7.121 3.181 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.814 6.155 2.389 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.821 7.142 2.300 1.00 0.00 C ATOM 0 H TRP A 136 -10.962 3.707 8.223 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.691 4.333 6.067 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.378 2.426 6.498 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.277 2.360 4.995 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.565 4.252 6.667 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -7.907 6.360 5.325 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.494 4.387 3.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -8.971 7.878 3.118 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.652 6.173 1.707 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.894 7.917 1.551 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.515 2.624 6.085 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.605 1.600 6.055 1.00 0.00 C ATOM 2148 C GLU A 137 -15.029 0.232 5.674 1.00 0.00 C ATOM 2149 O GLU A 137 -14.683 -0.566 6.522 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.667 2.014 5.026 1.00 0.00 C ATOM 2151 CG GLU A 137 -17.808 0.988 4.992 1.00 0.00 C ATOM 2152 CD GLU A 137 -18.473 0.910 6.369 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.233 1.808 6.690 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -18.209 -0.047 7.078 1.00 0.00 O ATOM 0 H GLU A 137 -14.776 3.535 5.708 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.059 1.532 7.044 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.062 2.998 5.278 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.213 2.096 4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -18.543 1.272 4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -17.421 0.009 4.708 1.00 0.00 H new ATOM 2161 N LYS A 138 -14.913 -0.038 4.403 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.347 -1.347 3.966 1.00 0.00 C ATOM 2163 C LYS A 138 -12.823 -1.263 4.033 1.00 0.00 C ATOM 2164 O LYS A 138 -12.244 -0.215 3.820 1.00 0.00 O ATOM 2165 CB LYS A 138 -14.783 -1.640 2.528 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.285 -1.928 2.498 1.00 0.00 C ATOM 2167 CD LYS A 138 -16.678 -2.454 1.116 1.00 0.00 C ATOM 2168 CE LYS A 138 -18.146 -2.883 1.133 1.00 0.00 C ATOM 2169 NZ LYS A 138 -18.502 -3.485 -0.183 1.00 0.00 N ATOM 0 H LYS A 138 -15.185 0.591 3.647 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.706 -2.146 4.615 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -14.552 -0.790 1.886 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.230 -2.494 2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.541 -2.661 3.264 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.844 -1.021 2.726 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -16.522 -1.681 0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -16.044 -3.298 0.842 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -18.316 -3.604 1.933 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -18.785 -2.024 1.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.500 -3.777 -0.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -18.354 -2.784 -0.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.900 -4.315 -0.359 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.159 -2.345 4.342 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.673 -2.289 4.432 1.00 0.00 C ATOM 2185 C ARG A 139 -10.074 -3.689 4.278 1.00 0.00 C ATOM 2186 O ARG A 139 -9.611 -4.277 5.235 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.283 -1.724 5.802 1.00 0.00 C ATOM 2188 CG ARG A 139 -8.776 -1.424 5.841 1.00 0.00 C ATOM 2189 CD ARG A 139 -8.300 -1.357 7.295 1.00 0.00 C ATOM 2190 NE ARG A 139 -8.969 -0.224 7.992 1.00 0.00 N ATOM 2191 CZ ARG A 139 -8.964 -0.168 9.296 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.389 -1.115 9.987 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.534 0.833 9.908 1.00 0.00 N ATOM 0 H ARG A 139 -12.577 -3.256 4.534 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.290 -1.653 3.634 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -10.848 -0.814 6.003 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.540 -2.438 6.585 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -8.227 -2.198 5.304 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -8.570 -0.480 5.337 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.525 -2.294 7.805 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.218 -1.228 7.328 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.431 0.507 7.451 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.944 -1.898 9.508 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.385 -1.072 11.006 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -9.984 1.572 9.368 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -9.530 0.877 10.927 1.00 0.00 H new ATOM 2207 N LYS A 140 -10.042 -4.219 3.085 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.428 -5.564 2.910 1.00 0.00 C ATOM 2209 C LYS A 140 -7.911 -5.389 2.985 1.00 0.00 C ATOM 2210 O LYS A 140 -7.407 -4.281 2.883 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.818 -6.162 1.553 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.248 -6.707 1.618 1.00 0.00 C ATOM 2213 CD LYS A 140 -12.196 -5.614 2.124 1.00 0.00 C ATOM 2214 CE LYS A 140 -13.641 -5.998 1.798 1.00 0.00 C ATOM 2215 NZ LYS A 140 -13.885 -5.822 0.339 1.00 0.00 N ATOM 0 H LYS A 140 -10.408 -3.786 2.237 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.780 -6.243 3.687 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.744 -5.402 0.775 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.126 -6.961 1.285 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.563 -7.047 0.631 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.288 -7.572 2.281 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -12.077 -5.485 3.200 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -11.949 -4.660 1.659 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -13.827 -7.032 2.086 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -14.331 -5.378 2.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -14.907 -5.731 0.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -13.400 -4.964 0.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -13.519 -6.648 -0.176 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.179 -6.460 3.185 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.687 -6.346 3.295 1.00 0.00 C ATOM 2231 C ILE A 141 -5.004 -7.426 2.448 1.00 0.00 C ATOM 2232 O ILE A 141 -5.560 -8.470 2.171 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.260 -6.534 4.764 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.175 -5.732 5.718 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -3.805 -6.082 4.936 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -5.859 -4.233 5.657 1.00 0.00 C ATOM 0 H ILE A 141 -7.548 -7.406 3.277 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.390 -5.360 2.937 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.350 -7.590 5.017 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.219 -5.898 5.451 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -6.046 -6.093 6.739 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.503 -6.215 5.975 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.160 -6.679 4.291 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.716 -5.030 4.664 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.518 -3.694 6.338 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -4.822 -4.068 5.949 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.012 -3.870 4.641 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.782 -7.170 2.061 1.00 0.00 N ATOM 2249 CA PHE A 142 -2.999 -8.152 1.254 1.00 0.00 C ATOM 2250 C PHE A 142 -1.554 -8.098 1.749 1.00 0.00 C ATOM 2251 O PHE A 142 -1.159 -7.139 2.378 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.060 -7.772 -0.228 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.506 -7.628 -0.651 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.241 -6.501 -0.260 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -5.112 -8.623 -1.429 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.580 -6.370 -0.647 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.451 -8.491 -1.816 1.00 0.00 C ATOM 2258 CZ PHE A 142 -7.186 -7.365 -1.425 1.00 0.00 C ATOM 0 H PHE A 142 -3.285 -6.305 2.274 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.406 -9.157 1.364 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.525 -6.837 -0.397 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.567 -8.535 -0.831 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.775 -5.733 0.340 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.546 -9.492 -1.730 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -7.146 -5.501 -0.346 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.917 -9.258 -2.416 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.219 -7.264 -1.723 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.759 -9.112 1.504 1.00 0.00 N ATOM 2269 CA VAL A 143 0.653 -9.079 2.009 1.00 0.00 C ATOM 2270 C VAL A 143 1.607 -9.787 1.043 1.00 0.00 C ATOM 2271 O VAL A 143 1.260 -10.758 0.392 1.00 0.00 O ATOM 2272 CB VAL A 143 0.718 -9.777 3.370 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.110 -9.591 3.977 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.328 -9.172 4.310 1.00 0.00 C ATOM 0 H VAL A 143 -1.020 -9.950 0.984 1.00 0.00 H new ATOM 0 HA VAL A 143 0.959 -8.036 2.096 1.00 0.00 H new ATOM 0 HB VAL A 143 0.517 -10.840 3.237 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.154 -10.089 4.946 1.00 0.00 H new ATOM 0 HG12 VAL A 143 2.858 -10.024 3.312 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.312 -8.528 4.106 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.279 -9.671 5.278 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.129 -8.108 4.440 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.322 -9.306 3.883 1.00 0.00 H new ATOM 2284 N ALA A 144 2.822 -9.305 0.970 1.00 0.00 N ATOM 2285 CA ALA A 144 3.850 -9.919 0.081 1.00 0.00 C ATOM 2286 C ALA A 144 5.202 -9.844 0.799 1.00 0.00 C ATOM 2287 O ALA A 144 5.380 -9.041 1.692 1.00 0.00 O ATOM 2288 CB ALA A 144 3.920 -9.136 -1.235 1.00 0.00 C ATOM 0 H ALA A 144 3.149 -8.497 1.500 1.00 0.00 H new ATOM 0 HA ALA A 144 3.595 -10.956 -0.139 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.671 -9.584 -1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.948 -9.166 -1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.190 -8.100 -1.028 1.00 0.00 H new ATOM 2294 N THR A 145 6.154 -10.670 0.428 1.00 0.00 N ATOM 2295 CA THR A 145 7.495 -10.632 1.110 1.00 0.00 C ATOM 2296 C THR A 145 8.612 -10.596 0.063 1.00 0.00 C ATOM 2297 O THR A 145 8.530 -11.225 -0.972 1.00 0.00 O ATOM 2298 CB THR A 145 7.645 -11.863 2.029 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.479 -11.522 3.127 1.00 0.00 O ATOM 2300 CG2 THR A 145 8.264 -13.052 1.279 1.00 0.00 C ATOM 0 H THR A 145 6.064 -11.366 -0.313 1.00 0.00 H new ATOM 0 HA THR A 145 7.568 -9.732 1.720 1.00 0.00 H new ATOM 0 HB THR A 145 6.653 -12.156 2.374 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.578 -12.299 3.716 1.00 0.00 H new ATOM 0 HG21 THR A 145 8.355 -13.902 1.956 1.00 0.00 H new ATOM 0 HG22 THR A 145 7.625 -13.324 0.439 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.251 -12.775 0.909 1.00 0.00 H new ATOM 2308 N GLU A 146 9.659 -9.867 0.335 1.00 0.00 N ATOM 2309 CA GLU A 146 10.788 -9.795 -0.630 1.00 0.00 C ATOM 2310 C GLU A 146 11.358 -11.199 -0.830 1.00 0.00 C ATOM 2311 O GLU A 146 11.549 -11.937 0.116 1.00 0.00 O ATOM 2312 CB GLU A 146 11.872 -8.865 -0.073 1.00 0.00 C ATOM 2313 CG GLU A 146 12.802 -8.405 -1.202 1.00 0.00 C ATOM 2314 CD GLU A 146 13.573 -9.602 -1.760 1.00 0.00 C ATOM 2315 OE1 GLU A 146 13.879 -10.498 -0.989 1.00 0.00 O ATOM 2316 OE2 GLU A 146 13.850 -9.601 -2.948 1.00 0.00 O ATOM 0 H GLU A 146 9.780 -9.318 1.186 1.00 0.00 H new ATOM 0 HA GLU A 146 10.440 -9.404 -1.586 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.410 -8.000 0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.447 -9.383 0.694 1.00 0.00 H new ATOM 0 HG2 GLU A 146 12.221 -7.934 -1.995 1.00 0.00 H new ATOM 0 HG3 GLU A 146 13.499 -7.655 -0.828 1.00 0.00 H new ATOM 2323 N VAL A 147 11.630 -11.576 -2.054 1.00 0.00 N ATOM 2324 CA VAL A 147 12.190 -12.941 -2.323 1.00 0.00 C ATOM 2325 C VAL A 147 13.318 -12.820 -3.356 1.00 0.00 C ATOM 2326 O VAL A 147 13.581 -11.755 -3.879 1.00 0.00 O ATOM 2327 CB VAL A 147 11.073 -13.859 -2.870 1.00 0.00 C ATOM 2328 CG1 VAL A 147 11.350 -15.323 -2.501 1.00 0.00 C ATOM 2329 CG2 VAL A 147 9.729 -13.437 -2.271 1.00 0.00 C ATOM 0 H VAL A 147 11.489 -10.998 -2.882 1.00 0.00 H new ATOM 0 HA VAL A 147 12.582 -13.371 -1.401 1.00 0.00 H new ATOM 0 HB VAL A 147 11.045 -13.766 -3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.553 -15.954 -2.894 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.303 -15.632 -2.930 1.00 0.00 H new ATOM 0 HG13 VAL A 147 11.390 -15.423 -1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 147 8.940 -14.083 -2.656 1.00 0.00 H new ATOM 0 HG22 VAL A 147 9.771 -13.523 -1.185 1.00 0.00 H new ATOM 0 HG23 VAL A 147 9.517 -12.403 -2.545 1.00 0.00 H new