USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 944 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 33 GLN : amide:sc= -0.0062 K(o=-0.29,f=-3.2!) USER MOD Set 1.2: A 88 MET CE :methyl 144:sc= -0.0654 (180deg=-2.47!) USER MOD Set 1.3: A 118 MET CE :methyl 175:sc= -0.215 (180deg=-0.212) USER MOD Set 2.1: A 8 LYS NZ :NH3+ -98:sc= 1.86! (180deg=0.97) USER MOD Set 2.2: A 23 TYR OH : rot 37:sc= 1.68 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.318 K(o=-0.32,f=-3.2!) USER MOD Single : A 15 ASN : amide:sc= -0.261 K(o=-0.26,f=-3!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 159:sc= 1.23 (180deg=0.526) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 7:sc= -1.57! USER MOD Single : A 35 SER OG : rot 180:sc= -0.608 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 144:sc= 0.351 (180deg=-2.96!) USER MOD Single : A 40 GLN : amide:sc= -3.55! K(o=-3.6!,f=-0.25) USER MOD Single : A 43 SER OG : rot 180:sc= -0.0935 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -69:sc= 1.18 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -143:sc= -0.277 (180deg=-1.86!) USER MOD Single : A 55 THR OG1 : rot 74:sc= 0.949 USER MOD Single : A 60 SER OG : rot 150:sc= -1.93! USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 52:sc= 1.21 USER MOD Single : A 64 LYS NZ :NH3+ 161:sc= -0.0794 (180deg=-0.463) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= -0.746 USER MOD Single : A 76 THR OG1 : rot 139:sc= 0.565 USER MOD Single : A 78 THR OG1 : rot -41:sc= 0.0924 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0248 K(o=-0.025,f=-0.71) USER MOD Single : A 83 ASN : amide:sc= -1.41 K(o=-1.4,f=-2!) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.246 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.58) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ -159:sc= -0.0734 (180deg=-0.409) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 MET CE :methyl -123:sc= -1.77 (180deg=-3.51!) USER MOD Single : A 117 GLN : amide:sc= -2.63! K(o=-2.6!,f=-2) USER MOD Single : A 122 MET CE :methyl -104:sc= -0.418 (180deg=-2.32) USER MOD Single : A 123 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0504) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -149:sc= 0.00517 (180deg=-0.00457) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 13.379 -0.883 13.574 1.00 0.00 N ATOM 62 CA GLU A 5 12.252 -0.864 12.661 1.00 0.00 C ATOM 63 C GLU A 5 12.106 0.527 12.051 1.00 0.00 C ATOM 64 O GLU A 5 11.707 1.474 12.733 1.00 0.00 O ATOM 65 CB GLU A 5 10.961 -1.262 13.388 1.00 0.00 C ATOM 66 CG GLU A 5 10.998 -2.636 14.051 1.00 0.00 C ATOM 67 CD GLU A 5 11.807 -2.677 15.337 1.00 0.00 C ATOM 68 OE1 GLU A 5 12.188 -1.603 15.852 1.00 0.00 O ATOM 69 OE2 GLU A 5 12.078 -3.793 15.833 1.00 0.00 O ATOM 0 HA GLU A 5 12.433 -1.587 11.865 1.00 0.00 H new ATOM 0 HB2 GLU A 5 10.743 -0.513 14.149 1.00 0.00 H new ATOM 0 HB3 GLU A 5 10.137 -1.240 12.674 1.00 0.00 H new ATOM 0 HG2 GLU A 5 9.977 -2.953 14.265 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.415 -3.357 13.348 1.00 0.00 H new ATOM 76 N GLU A 6 12.442 0.652 10.779 1.00 0.00 N ATOM 77 CA GLU A 6 12.451 1.952 10.130 1.00 0.00 C ATOM 78 C GLU A 6 11.249 2.110 9.204 1.00 0.00 C ATOM 79 O GLU A 6 10.886 1.184 8.476 1.00 0.00 O ATOM 80 CB GLU A 6 13.752 2.145 9.352 1.00 0.00 C ATOM 81 CG GLU A 6 14.017 3.592 8.971 1.00 0.00 C ATOM 82 CD GLU A 6 13.972 4.513 10.174 1.00 0.00 C ATOM 83 OE1 GLU A 6 14.875 4.428 11.026 1.00 0.00 O ATOM 84 OE2 GLU A 6 13.025 5.323 10.276 1.00 0.00 O ATOM 0 H GLU A 6 12.711 -0.126 10.177 1.00 0.00 H new ATOM 0 HA GLU A 6 12.385 2.719 10.902 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.584 1.777 9.952 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.719 1.539 8.447 1.00 0.00 H new ATOM 0 HG2 GLU A 6 14.993 3.668 8.493 1.00 0.00 H new ATOM 0 HG3 GLU A 6 13.277 3.915 8.239 1.00 0.00 H new ATOM 91 N SER A 7 10.637 3.284 9.246 1.00 0.00 N ATOM 92 CA SER A 7 9.466 3.574 8.439 1.00 0.00 C ATOM 93 C SER A 7 9.873 4.297 7.154 1.00 0.00 C ATOM 94 O SER A 7 10.410 5.407 7.196 1.00 0.00 O ATOM 95 CB SER A 7 8.484 4.429 9.250 1.00 0.00 C ATOM 96 OG SER A 7 7.264 4.626 8.558 1.00 0.00 O ATOM 0 H SER A 7 10.938 4.058 9.838 1.00 0.00 H new ATOM 0 HA SER A 7 8.979 2.639 8.163 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.286 3.946 10.207 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.938 5.395 9.469 1.00 0.00 H new ATOM 0 HG SER A 7 6.662 5.173 9.105 1.00 0.00 H new ATOM 102 N LYS A 8 9.637 3.656 6.019 1.00 0.00 N ATOM 103 CA LYS A 8 9.972 4.239 4.731 1.00 0.00 C ATOM 104 C LYS A 8 8.727 4.289 3.851 1.00 0.00 C ATOM 105 O LYS A 8 8.155 3.254 3.509 1.00 0.00 O ATOM 106 CB LYS A 8 11.087 3.421 4.073 1.00 0.00 C ATOM 107 CG LYS A 8 11.685 4.055 2.827 1.00 0.00 C ATOM 108 CD LYS A 8 13.007 3.392 2.467 1.00 0.00 C ATOM 109 CE LYS A 8 13.638 4.012 1.231 1.00 0.00 C ATOM 110 NZ LYS A 8 12.989 3.560 -0.027 1.00 0.00 N ATOM 0 H LYS A 8 9.214 2.730 5.965 1.00 0.00 H new ATOM 0 HA LYS A 8 10.332 5.259 4.867 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.882 3.263 4.802 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.694 2.439 3.812 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.987 3.962 1.995 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.841 5.121 2.994 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.696 3.478 3.307 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.844 2.328 2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.573 5.098 1.300 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.697 3.757 1.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 13.546 2.789 -0.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.029 3.219 0.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.937 4.355 -0.696 1.00 0.00 H new ATOM 124 N LYS A 9 8.295 5.495 3.507 1.00 0.00 N ATOM 125 CA LYS A 9 7.055 5.674 2.765 1.00 0.00 C ATOM 126 C LYS A 9 7.301 6.277 1.388 1.00 0.00 C ATOM 127 O LYS A 9 8.131 7.179 1.227 1.00 0.00 O ATOM 128 CB LYS A 9 6.091 6.575 3.547 1.00 0.00 C ATOM 129 CG LYS A 9 4.707 6.677 2.921 1.00 0.00 C ATOM 130 CD LYS A 9 3.797 7.618 3.697 1.00 0.00 C ATOM 131 CE LYS A 9 4.142 9.077 3.445 1.00 0.00 C ATOM 132 NZ LYS A 9 3.263 9.999 4.214 1.00 0.00 N ATOM 0 H LYS A 9 8.784 6.362 3.730 1.00 0.00 H new ATOM 0 HA LYS A 9 6.613 4.686 2.632 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.993 6.193 4.563 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.521 7.574 3.622 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.799 7.028 1.893 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.254 5.686 2.880 1.00 0.00 H new ATOM 0 HD2 LYS A 9 2.760 7.436 3.414 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.878 7.405 4.763 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.182 9.256 3.718 1.00 0.00 H new ATOM 0 HE3 LYS A 9 4.050 9.292 2.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 3.532 10.983 4.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.273 9.847 3.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.369 9.812 5.231 1.00 0.00 H new ATOM 146 N PHE A 10 6.578 5.769 0.403 1.00 0.00 N ATOM 147 CA PHE A 10 6.541 6.369 -0.920 1.00 0.00 C ATOM 148 C PHE A 10 5.082 6.605 -1.291 1.00 0.00 C ATOM 149 O PHE A 10 4.185 6.089 -0.620 1.00 0.00 O ATOM 150 CB PHE A 10 7.228 5.470 -1.964 1.00 0.00 C ATOM 151 CG PHE A 10 6.384 4.321 -2.450 1.00 0.00 C ATOM 152 CD1 PHE A 10 6.384 3.107 -1.784 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.588 4.461 -3.579 1.00 0.00 C ATOM 154 CE1 PHE A 10 5.607 2.057 -2.237 1.00 0.00 C ATOM 155 CE2 PHE A 10 4.810 3.417 -4.032 1.00 0.00 C ATOM 156 CZ PHE A 10 4.817 2.214 -3.361 1.00 0.00 C ATOM 0 H PHE A 10 6.002 4.932 0.498 1.00 0.00 H new ATOM 0 HA PHE A 10 7.086 7.313 -0.907 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.514 6.082 -2.820 1.00 0.00 H new ATOM 0 HB3 PHE A 10 8.148 5.073 -1.534 1.00 0.00 H new ATOM 0 HD1 PHE A 10 6.996 2.979 -0.903 1.00 0.00 H new ATOM 0 HD2 PHE A 10 5.578 5.401 -4.110 1.00 0.00 H new ATOM 0 HE1 PHE A 10 5.617 1.113 -1.712 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.196 3.542 -4.912 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.207 1.395 -3.712 1.00 0.00 H new ATOM 166 N SER A 11 4.832 7.375 -2.334 1.00 0.00 N ATOM 167 CA SER A 11 3.469 7.630 -2.758 1.00 0.00 C ATOM 168 C SER A 11 3.431 7.976 -4.235 1.00 0.00 C ATOM 169 O SER A 11 4.039 8.952 -4.674 1.00 0.00 O ATOM 170 CB SER A 11 2.848 8.762 -1.931 1.00 0.00 C ATOM 171 OG SER A 11 1.450 8.862 -2.158 1.00 0.00 O ATOM 0 H SER A 11 5.549 7.831 -2.899 1.00 0.00 H new ATOM 0 HA SER A 11 2.885 6.724 -2.596 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.034 8.585 -0.872 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.328 9.707 -2.186 1.00 0.00 H new ATOM 0 HG SER A 11 1.082 9.591 -1.616 1.00 0.00 H new ATOM 177 N ALA A 12 2.734 7.157 -5.003 1.00 0.00 N ATOM 178 CA ALA A 12 2.551 7.420 -6.414 1.00 0.00 C ATOM 179 C ALA A 12 1.070 7.576 -6.718 1.00 0.00 C ATOM 180 O ALA A 12 0.247 6.783 -6.256 1.00 0.00 O ATOM 181 CB ALA A 12 3.164 6.306 -7.247 1.00 0.00 C ATOM 0 H ALA A 12 2.286 6.303 -4.670 1.00 0.00 H new ATOM 0 HA ALA A 12 3.059 8.348 -6.674 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.017 6.520 -8.306 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.231 6.238 -7.035 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.684 5.359 -6.998 1.00 0.00 H new ATOM 187 N ASN A 13 0.729 8.611 -7.467 1.00 0.00 N ATOM 188 CA ASN A 13 -0.654 8.852 -7.843 1.00 0.00 C ATOM 189 C ASN A 13 -0.919 8.194 -9.188 1.00 0.00 C ATOM 190 O ASN A 13 -0.611 8.749 -10.243 1.00 0.00 O ATOM 191 CB ASN A 13 -0.948 10.357 -7.891 1.00 0.00 C ATOM 192 CG ASN A 13 -2.427 10.680 -8.055 1.00 0.00 C ATOM 193 OD1 ASN A 13 -3.174 9.961 -8.719 1.00 0.00 O ATOM 194 ND2 ASN A 13 -2.863 11.766 -7.437 1.00 0.00 N ATOM 0 H ASN A 13 1.391 9.298 -7.827 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.319 8.418 -7.097 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.582 10.820 -6.975 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.393 10.802 -8.717 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.846 12.030 -7.502 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.216 12.339 -6.895 1.00 0.00 H new ATOM 201 N LEU A 14 -1.464 6.991 -9.137 1.00 0.00 N ATOM 202 CA LEU A 14 -1.625 6.169 -10.322 1.00 0.00 C ATOM 203 C LEU A 14 -2.994 6.357 -10.951 1.00 0.00 C ATOM 204 O LEU A 14 -3.998 5.840 -10.455 1.00 0.00 O ATOM 205 CB LEU A 14 -1.393 4.696 -9.972 1.00 0.00 C ATOM 206 CG LEU A 14 0.033 4.171 -10.194 1.00 0.00 C ATOM 207 CD1 LEU A 14 1.070 5.212 -9.806 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.253 2.899 -9.391 1.00 0.00 C ATOM 0 H LEU A 14 -1.805 6.559 -8.278 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.882 6.484 -11.055 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.656 4.545 -8.925 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.079 4.090 -10.563 1.00 0.00 H new ATOM 0 HG LEU A 14 0.149 3.953 -11.256 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.069 4.811 -9.974 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.932 6.107 -10.412 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.954 5.466 -8.752 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.267 2.535 -9.556 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.111 3.109 -8.331 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.461 2.139 -9.710 1.00 0.00 H new ATOM 220 N ASN A 15 -3.026 7.151 -12.018 1.00 0.00 N ATOM 221 CA ASN A 15 -4.211 7.300 -12.866 1.00 0.00 C ATOM 222 C ASN A 15 -5.385 7.913 -12.101 1.00 0.00 C ATOM 223 O ASN A 15 -6.535 7.827 -12.535 1.00 0.00 O ATOM 224 CB ASN A 15 -4.624 5.944 -13.465 1.00 0.00 C ATOM 225 CG ASN A 15 -3.548 5.321 -14.346 1.00 0.00 C ATOM 226 OD1 ASN A 15 -2.352 5.521 -14.136 1.00 0.00 O ATOM 227 ND2 ASN A 15 -3.966 4.558 -15.342 1.00 0.00 N ATOM 0 H ASN A 15 -2.230 7.712 -12.322 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.945 7.982 -13.674 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.864 5.255 -12.655 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.533 6.076 -14.052 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.290 4.115 -15.964 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.965 4.413 -15.489 1.00 0.00 H new ATOM 234 N GLY A 16 -5.091 8.553 -10.977 1.00 0.00 N ATOM 235 CA GLY A 16 -6.134 9.174 -10.182 1.00 0.00 C ATOM 236 C GLY A 16 -6.271 8.533 -8.819 1.00 0.00 C ATOM 237 O GLY A 16 -6.924 9.074 -7.930 1.00 0.00 O ATOM 0 H GLY A 16 -4.148 8.654 -10.601 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -5.914 10.235 -10.062 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.084 9.103 -10.712 1.00 0.00 H new ATOM 241 N THR A 17 -5.653 7.377 -8.659 1.00 0.00 N ATOM 242 CA THR A 17 -5.703 6.655 -7.404 1.00 0.00 C ATOM 243 C THR A 17 -4.346 6.706 -6.710 1.00 0.00 C ATOM 244 O THR A 17 -3.351 6.210 -7.241 1.00 0.00 O ATOM 245 CB THR A 17 -6.108 5.190 -7.649 1.00 0.00 C ATOM 246 OG1 THR A 17 -7.248 5.147 -8.516 1.00 0.00 O ATOM 247 CG2 THR A 17 -6.441 4.489 -6.344 1.00 0.00 C ATOM 0 H THR A 17 -5.108 6.917 -9.388 1.00 0.00 H new ATOM 0 HA THR A 17 -6.447 7.127 -6.762 1.00 0.00 H new ATOM 0 HB THR A 17 -5.266 4.675 -8.112 1.00 0.00 H new ATOM 0 HG1 THR A 17 -7.504 4.214 -8.673 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.724 3.456 -6.548 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.569 4.505 -5.690 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.270 5.002 -5.856 1.00 0.00 H new ATOM 255 N GLU A 18 -4.296 7.321 -5.535 1.00 0.00 N ATOM 256 CA GLU A 18 -3.047 7.417 -4.796 1.00 0.00 C ATOM 257 C GLU A 18 -2.729 6.089 -4.143 1.00 0.00 C ATOM 258 O GLU A 18 -3.623 5.408 -3.651 1.00 0.00 O ATOM 259 CB GLU A 18 -3.106 8.475 -3.692 1.00 0.00 C ATOM 260 CG GLU A 18 -3.675 9.812 -4.113 1.00 0.00 C ATOM 261 CD GLU A 18 -3.154 10.940 -3.241 1.00 0.00 C ATOM 262 OE1 GLU A 18 -3.645 11.097 -2.105 1.00 0.00 O ATOM 263 OE2 GLU A 18 -2.226 11.654 -3.672 1.00 0.00 O ATOM 0 H GLU A 18 -5.098 7.756 -5.078 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.279 7.699 -5.516 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.705 8.086 -2.869 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.099 8.632 -3.306 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.416 10.007 -5.154 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.763 9.780 -4.055 1.00 0.00 H new ATOM 270 N ILE A 19 -1.469 5.715 -4.147 1.00 0.00 N ATOM 271 CA ILE A 19 -1.028 4.595 -3.346 1.00 0.00 C ATOM 272 C ILE A 19 0.131 5.031 -2.463 1.00 0.00 C ATOM 273 O ILE A 19 1.264 5.195 -2.925 1.00 0.00 O ATOM 274 CB ILE A 19 -0.631 3.370 -4.201 1.00 0.00 C ATOM 275 CG1 ILE A 19 -1.829 2.915 -5.046 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.148 2.236 -3.306 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.621 1.584 -5.738 1.00 0.00 C ATOM 0 H ILE A 19 -0.735 6.167 -4.693 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.868 4.279 -2.727 1.00 0.00 H new ATOM 0 HB ILE A 19 0.184 3.651 -4.869 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.708 2.847 -4.405 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.041 3.675 -5.798 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.128 1.380 -3.921 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.719 2.567 -2.735 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.945 1.948 -2.621 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.510 1.331 -6.315 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.762 1.651 -6.406 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.440 0.810 -4.992 1.00 0.00 H new ATOM 289 N ALA A 20 -0.181 5.280 -1.201 1.00 0.00 N ATOM 290 CA ALA A 20 0.812 5.703 -0.234 1.00 0.00 C ATOM 291 C ALA A 20 1.220 4.528 0.634 1.00 0.00 C ATOM 292 O ALA A 20 0.509 4.150 1.566 1.00 0.00 O ATOM 293 CB ALA A 20 0.271 6.841 0.619 1.00 0.00 C ATOM 0 H ALA A 20 -1.124 5.194 -0.823 1.00 0.00 H new ATOM 0 HA ALA A 20 1.692 6.066 -0.765 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.029 7.147 1.340 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.016 7.686 -0.021 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.620 6.506 1.149 1.00 0.00 H new ATOM 299 N ILE A 21 2.354 3.938 0.311 1.00 0.00 N ATOM 300 CA ILE A 21 2.817 2.763 1.019 1.00 0.00 C ATOM 301 C ILE A 21 3.898 3.117 2.017 1.00 0.00 C ATOM 302 O ILE A 21 4.966 3.610 1.652 1.00 0.00 O ATOM 303 CB ILE A 21 3.347 1.686 0.056 1.00 0.00 C ATOM 304 CG1 ILE A 21 2.215 1.185 -0.840 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.973 0.536 0.833 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.607 0.043 -1.748 1.00 0.00 C ATOM 0 H ILE A 21 2.971 4.254 -0.437 1.00 0.00 H new ATOM 0 HA ILE A 21 1.955 2.360 1.550 1.00 0.00 H new ATOM 0 HB ILE A 21 4.120 2.126 -0.574 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.383 0.867 -0.212 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.855 2.013 -1.450 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.342 -0.216 0.136 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.801 0.911 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.224 0.088 1.486 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.749 -0.254 -2.351 1.00 0.00 H new ATOM 0 HD12 ILE A 21 3.418 0.361 -2.403 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.938 -0.803 -1.146 1.00 0.00 H new ATOM 318 N THR A 22 3.598 2.878 3.277 1.00 0.00 N ATOM 319 CA THR A 22 4.560 3.046 4.339 1.00 0.00 C ATOM 320 C THR A 22 5.036 1.674 4.792 1.00 0.00 C ATOM 321 O THR A 22 4.319 0.965 5.500 1.00 0.00 O ATOM 322 CB THR A 22 3.931 3.794 5.530 1.00 0.00 C ATOM 323 OG1 THR A 22 3.119 4.869 5.047 1.00 0.00 O ATOM 324 CG2 THR A 22 5.002 4.342 6.456 1.00 0.00 C ATOM 0 H THR A 22 2.680 2.562 3.590 1.00 0.00 H new ATOM 0 HA THR A 22 5.401 3.634 3.970 1.00 0.00 H new ATOM 0 HB THR A 22 3.317 3.090 6.092 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.718 5.343 5.806 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.531 4.865 7.288 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.606 3.520 6.840 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.639 5.035 5.906 1.00 0.00 H new ATOM 332 N TYR A 23 6.210 1.264 4.351 1.00 0.00 N ATOM 333 CA TYR A 23 6.705 -0.046 4.713 1.00 0.00 C ATOM 334 C TYR A 23 7.778 0.055 5.785 1.00 0.00 C ATOM 335 O TYR A 23 8.731 0.828 5.675 1.00 0.00 O ATOM 336 CB TYR A 23 7.197 -0.836 3.488 1.00 0.00 C ATOM 337 CG TYR A 23 8.189 -0.118 2.595 1.00 0.00 C ATOM 338 CD1 TYR A 23 9.558 -0.224 2.812 1.00 0.00 C ATOM 339 CD2 TYR A 23 7.754 0.646 1.518 1.00 0.00 C ATOM 340 CE1 TYR A 23 10.463 0.416 1.986 1.00 0.00 C ATOM 341 CE2 TYR A 23 8.652 1.285 0.684 1.00 0.00 C ATOM 342 CZ TYR A 23 10.006 1.168 0.924 1.00 0.00 C ATOM 343 OH TYR A 23 10.906 1.803 0.096 1.00 0.00 O ATOM 0 H TYR A 23 6.828 1.810 3.751 1.00 0.00 H new ATOM 0 HA TYR A 23 5.869 -0.607 5.131 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.654 -1.762 3.836 1.00 0.00 H new ATOM 0 HB3 TYR A 23 6.331 -1.114 2.887 1.00 0.00 H new ATOM 0 HD1 TYR A 23 9.920 -0.816 3.639 1.00 0.00 H new ATOM 0 HD2 TYR A 23 6.695 0.742 1.330 1.00 0.00 H new ATOM 0 HE1 TYR A 23 11.523 0.328 2.171 1.00 0.00 H new ATOM 0 HE2 TYR A 23 8.296 1.872 -0.150 1.00 0.00 H new ATOM 0 HH TYR A 23 11.694 1.234 -0.029 1.00 0.00 H new ATOM 353 N VAL A 24 7.576 -0.709 6.843 1.00 0.00 N ATOM 354 CA VAL A 24 8.519 -0.785 7.938 1.00 0.00 C ATOM 355 C VAL A 24 9.428 -1.982 7.733 1.00 0.00 C ATOM 356 O VAL A 24 8.973 -3.131 7.722 1.00 0.00 O ATOM 357 CB VAL A 24 7.796 -0.904 9.297 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.797 -1.013 10.436 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.871 0.282 9.513 1.00 0.00 C ATOM 0 H VAL A 24 6.750 -1.295 6.965 1.00 0.00 H new ATOM 0 HA VAL A 24 9.107 0.133 7.951 1.00 0.00 H new ATOM 0 HB VAL A 24 7.196 -1.814 9.284 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.263 -1.096 11.383 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.418 -1.897 10.291 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.428 -0.125 10.452 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.370 0.182 10.476 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.452 1.204 9.501 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.126 0.312 8.718 1.00 0.00 H new ATOM 369 N TYR A 25 10.701 -1.710 7.544 1.00 0.00 N ATOM 370 CA TYR A 25 11.664 -2.754 7.264 1.00 0.00 C ATOM 371 C TYR A 25 12.705 -2.820 8.364 1.00 0.00 C ATOM 372 O TYR A 25 12.868 -1.874 9.138 1.00 0.00 O ATOM 373 CB TYR A 25 12.345 -2.501 5.913 1.00 0.00 C ATOM 374 CG TYR A 25 13.208 -1.254 5.882 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.641 0.008 5.750 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.592 -1.341 5.991 1.00 0.00 C ATOM 377 CE1 TYR A 25 13.426 1.144 5.724 1.00 0.00 C ATOM 378 CE2 TYR A 25 15.384 -0.207 5.967 1.00 0.00 C ATOM 379 CZ TYR A 25 14.796 1.032 5.834 1.00 0.00 C ATOM 380 OH TYR A 25 15.579 2.164 5.807 1.00 0.00 O ATOM 0 H TYR A 25 11.095 -0.770 7.579 1.00 0.00 H new ATOM 0 HA TYR A 25 11.137 -3.707 7.221 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.962 -3.364 5.661 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.580 -2.420 5.141 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.568 0.102 5.666 1.00 0.00 H new ATOM 0 HD2 TYR A 25 15.056 -2.310 6.096 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.969 2.117 5.618 1.00 0.00 H new ATOM 0 HE2 TYR A 25 16.457 -0.292 6.052 1.00 0.00 H new ATOM 0 HH TYR A 25 16.522 1.912 5.897 1.00 0.00 H new ATOM 390 N LYS A 26 13.394 -3.942 8.437 1.00 0.00 N ATOM 391 CA LYS A 26 14.487 -4.104 9.370 1.00 0.00 C ATOM 392 C LYS A 26 15.633 -4.816 8.664 1.00 0.00 C ATOM 393 O LYS A 26 15.566 -6.017 8.401 1.00 0.00 O ATOM 394 CB LYS A 26 14.026 -4.891 10.597 1.00 0.00 C ATOM 395 CG LYS A 26 14.737 -4.484 11.872 1.00 0.00 C ATOM 396 CD LYS A 26 14.170 -5.199 13.084 1.00 0.00 C ATOM 397 CE LYS A 26 14.731 -4.615 14.367 1.00 0.00 C ATOM 398 NZ LYS A 26 14.262 -5.351 15.570 1.00 0.00 N ATOM 0 H LYS A 26 13.212 -4.760 7.855 1.00 0.00 H new ATOM 0 HA LYS A 26 14.829 -3.128 9.714 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.953 -4.752 10.727 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.190 -5.954 10.421 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.800 -4.707 11.783 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.648 -3.407 12.010 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.083 -5.115 13.086 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.407 -6.261 13.029 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.820 -4.639 14.330 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.438 -3.568 14.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 14.913 -5.173 16.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 13.308 -5.026 15.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.237 -6.370 15.365 1.00 0.00 H new ATOM 412 N GLY A 27 16.668 -4.062 8.325 1.00 0.00 N ATOM 413 CA GLY A 27 17.743 -4.607 7.524 1.00 0.00 C ATOM 414 C GLY A 27 17.342 -4.693 6.066 1.00 0.00 C ATOM 415 O GLY A 27 17.081 -3.673 5.430 1.00 0.00 O ATOM 0 H GLY A 27 16.782 -3.084 8.590 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.630 -3.981 7.625 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.009 -5.598 7.891 1.00 0.00 H new ATOM 419 N ASP A 28 17.272 -5.906 5.538 1.00 0.00 N ATOM 420 CA ASP A 28 16.805 -6.110 4.171 1.00 0.00 C ATOM 421 C ASP A 28 15.438 -6.785 4.193 1.00 0.00 C ATOM 422 O ASP A 28 14.885 -7.155 3.160 1.00 0.00 O ATOM 423 CB ASP A 28 17.804 -6.959 3.376 1.00 0.00 C ATOM 424 CG ASP A 28 17.678 -6.759 1.874 1.00 0.00 C ATOM 425 OD1 ASP A 28 16.858 -7.449 1.233 1.00 0.00 O ATOM 426 OD2 ASP A 28 18.417 -5.912 1.328 1.00 0.00 O ATOM 0 H ASP A 28 17.531 -6.761 6.031 1.00 0.00 H new ATOM 0 HA ASP A 28 16.720 -5.140 3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.818 -6.708 3.688 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.649 -8.012 3.613 1.00 0.00 H new ATOM 431 N LYS A 29 14.884 -6.925 5.384 1.00 0.00 N ATOM 432 CA LYS A 29 13.613 -7.606 5.548 1.00 0.00 C ATOM 433 C LYS A 29 12.499 -6.607 5.826 1.00 0.00 C ATOM 434 O LYS A 29 12.468 -5.980 6.884 1.00 0.00 O ATOM 435 CB LYS A 29 13.699 -8.609 6.698 1.00 0.00 C ATOM 436 CG LYS A 29 12.540 -9.590 6.745 1.00 0.00 C ATOM 437 CD LYS A 29 12.675 -10.543 7.920 1.00 0.00 C ATOM 438 CE LYS A 29 13.924 -11.398 7.806 1.00 0.00 C ATOM 439 NZ LYS A 29 14.215 -12.116 9.072 1.00 0.00 N ATOM 0 H LYS A 29 15.294 -6.577 6.251 1.00 0.00 H new ATOM 0 HA LYS A 29 13.388 -8.135 4.622 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.631 -9.167 6.612 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.740 -8.064 7.641 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.600 -9.043 6.823 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.503 -10.158 5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.707 -9.974 8.849 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.796 -11.186 7.970 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.799 -12.120 6.999 1.00 0.00 H new ATOM 0 HE3 LYS A 29 14.773 -10.768 7.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 15.075 -12.690 8.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 14.359 -11.426 9.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.415 -12.736 9.311 1.00 0.00 H new ATOM 453 N VAL A 30 11.601 -6.440 4.867 1.00 0.00 N ATOM 454 CA VAL A 30 10.419 -5.622 5.079 1.00 0.00 C ATOM 455 C VAL A 30 9.400 -6.440 5.862 1.00 0.00 C ATOM 456 O VAL A 30 8.978 -7.507 5.416 1.00 0.00 O ATOM 457 CB VAL A 30 9.797 -5.141 3.751 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.715 -4.105 4.012 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.865 -4.577 2.825 1.00 0.00 C ATOM 0 H VAL A 30 11.668 -6.858 3.939 1.00 0.00 H new ATOM 0 HA VAL A 30 10.711 -4.731 5.635 1.00 0.00 H new ATOM 0 HB VAL A 30 9.341 -6.000 3.259 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.288 -3.778 3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.932 -4.544 4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.148 -3.249 4.530 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.402 -4.245 1.896 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.356 -3.732 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.602 -5.350 2.607 1.00 0.00 H new ATOM 469 N LEU A 31 9.028 -5.957 7.035 1.00 0.00 N ATOM 470 CA LEU A 31 8.225 -6.749 7.956 1.00 0.00 C ATOM 471 C LEU A 31 6.765 -6.322 7.974 1.00 0.00 C ATOM 472 O LEU A 31 5.892 -7.097 8.357 1.00 0.00 O ATOM 473 CB LEU A 31 8.829 -6.676 9.359 1.00 0.00 C ATOM 474 CG LEU A 31 10.178 -7.385 9.494 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.803 -7.123 10.853 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.004 -8.877 9.269 1.00 0.00 C ATOM 0 H LEU A 31 9.267 -5.025 7.373 1.00 0.00 H new ATOM 0 HA LEU A 31 8.241 -7.781 7.605 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.951 -5.629 9.637 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.127 -7.114 10.069 1.00 0.00 H new ATOM 0 HG LEU A 31 10.852 -6.986 8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.760 -7.640 10.919 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.959 -6.052 10.981 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.139 -7.489 11.636 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.969 -9.375 9.367 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.312 -9.278 10.009 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.606 -9.050 8.269 1.00 0.00 H new ATOM 488 N LYS A 32 6.485 -5.100 7.556 1.00 0.00 N ATOM 489 CA LYS A 32 5.110 -4.628 7.525 1.00 0.00 C ATOM 490 C LYS A 32 4.930 -3.546 6.472 1.00 0.00 C ATOM 491 O LYS A 32 5.751 -2.644 6.353 1.00 0.00 O ATOM 492 CB LYS A 32 4.693 -4.106 8.902 1.00 0.00 C ATOM 493 CG LYS A 32 3.224 -3.729 8.992 1.00 0.00 C ATOM 494 CD LYS A 32 2.826 -3.359 10.412 1.00 0.00 C ATOM 495 CE LYS A 32 3.633 -2.185 10.939 1.00 0.00 C ATOM 496 NZ LYS A 32 3.268 -1.847 12.338 1.00 0.00 N ATOM 0 H LYS A 32 7.179 -4.424 7.237 1.00 0.00 H new ATOM 0 HA LYS A 32 4.469 -5.469 7.261 1.00 0.00 H new ATOM 0 HB2 LYS A 32 4.910 -4.868 9.651 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.299 -3.234 9.149 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.022 -2.890 8.327 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.612 -4.563 8.648 1.00 0.00 H new ATOM 0 HD2 LYS A 32 1.765 -3.111 10.439 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.969 -4.220 11.065 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.696 -2.423 10.888 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.470 -1.316 10.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.840 -1.041 12.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.260 -1.596 12.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.448 -2.667 12.952 1.00 0.00 H new ATOM 510 N GLN A 33 3.856 -3.649 5.710 1.00 0.00 N ATOM 511 CA GLN A 33 3.557 -2.683 4.671 1.00 0.00 C ATOM 512 C GLN A 33 2.185 -2.066 4.888 1.00 0.00 C ATOM 513 O GLN A 33 1.166 -2.728 4.711 1.00 0.00 O ATOM 514 CB GLN A 33 3.600 -3.355 3.297 1.00 0.00 C ATOM 515 CG GLN A 33 3.102 -2.464 2.174 1.00 0.00 C ATOM 516 CD GLN A 33 3.010 -3.181 0.843 1.00 0.00 C ATOM 517 OE1 GLN A 33 1.990 -3.782 0.519 1.00 0.00 O ATOM 518 NE2 GLN A 33 4.069 -3.105 0.058 1.00 0.00 N ATOM 0 H GLN A 33 3.171 -4.400 5.794 1.00 0.00 H new ATOM 0 HA GLN A 33 4.309 -1.896 4.714 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.624 -3.660 3.082 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.997 -4.262 3.326 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.120 -2.072 2.438 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.770 -1.608 2.074 1.00 0.00 H new ATOM 0 HE21 GLN A 33 4.897 -2.595 0.366 1.00 0.00 H new ATOM 0 HE22 GLN A 33 4.059 -3.556 -0.857 1.00 0.00 H new ATOM 527 N SER A 34 2.149 -0.810 5.288 1.00 0.00 N ATOM 528 CA SER A 34 0.889 -0.099 5.364 1.00 0.00 C ATOM 529 C SER A 34 0.635 0.648 4.061 1.00 0.00 C ATOM 530 O SER A 34 1.125 1.760 3.853 1.00 0.00 O ATOM 531 CB SER A 34 0.848 0.840 6.575 1.00 0.00 C ATOM 532 OG SER A 34 2.052 1.569 6.713 1.00 0.00 O ATOM 0 H SER A 34 2.967 -0.266 5.562 1.00 0.00 H new ATOM 0 HA SER A 34 0.088 -0.824 5.504 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.013 1.533 6.470 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.668 0.259 7.480 1.00 0.00 H new ATOM 0 HG SER A 34 2.624 1.406 5.934 1.00 0.00 H new ATOM 538 N SER A 35 -0.107 0.011 3.175 1.00 0.00 N ATOM 539 CA SER A 35 -0.419 0.560 1.872 1.00 0.00 C ATOM 540 C SER A 35 -1.793 1.204 1.902 1.00 0.00 C ATOM 541 O SER A 35 -2.794 0.541 2.170 1.00 0.00 O ATOM 542 CB SER A 35 -0.378 -0.543 0.809 1.00 0.00 C ATOM 543 OG SER A 35 -0.684 -0.034 -0.477 1.00 0.00 O ATOM 0 H SER A 35 -0.513 -0.910 3.342 1.00 0.00 H new ATOM 0 HA SER A 35 0.324 1.316 1.619 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.611 -1.000 0.795 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.088 -1.328 1.070 1.00 0.00 H new ATOM 0 HG SER A 35 -0.648 -0.761 -1.134 1.00 0.00 H new ATOM 549 N GLU A 36 -1.841 2.496 1.658 1.00 0.00 N ATOM 550 CA GLU A 36 -3.100 3.214 1.641 1.00 0.00 C ATOM 551 C GLU A 36 -3.435 3.648 0.224 1.00 0.00 C ATOM 552 O GLU A 36 -2.753 4.492 -0.363 1.00 0.00 O ATOM 553 CB GLU A 36 -3.039 4.413 2.582 1.00 0.00 C ATOM 554 CG GLU A 36 -4.261 5.321 2.511 1.00 0.00 C ATOM 555 CD GLU A 36 -3.900 6.776 2.276 1.00 0.00 C ATOM 556 OE1 GLU A 36 -3.117 7.336 3.073 1.00 0.00 O ATOM 557 OE2 GLU A 36 -4.399 7.369 1.294 1.00 0.00 O ATOM 0 H GLU A 36 -1.022 3.073 1.468 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.891 2.551 1.991 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.925 4.053 3.605 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.150 4.999 2.350 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.915 4.980 1.709 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -4.825 5.237 3.440 1.00 0.00 H new ATOM 564 N THR A 37 -4.475 3.050 -0.319 1.00 0.00 N ATOM 565 CA THR A 37 -4.915 3.342 -1.664 1.00 0.00 C ATOM 566 C THR A 37 -6.079 4.337 -1.628 1.00 0.00 C ATOM 567 O THR A 37 -7.166 4.019 -1.151 1.00 0.00 O ATOM 568 CB THR A 37 -5.330 2.036 -2.376 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.274 1.069 -2.273 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.650 2.276 -3.839 1.00 0.00 C ATOM 0 H THR A 37 -5.038 2.348 0.161 1.00 0.00 H new ATOM 0 HA THR A 37 -4.095 3.793 -2.223 1.00 0.00 H new ATOM 0 HB THR A 37 -6.229 1.662 -1.887 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.543 0.242 -2.725 1.00 0.00 H new ATOM 0 HG21 THR A 37 -5.938 1.335 -4.308 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.471 2.988 -3.920 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.771 2.678 -4.343 1.00 0.00 H new ATOM 578 N LYS A 38 -5.833 5.552 -2.098 1.00 0.00 N ATOM 579 CA LYS A 38 -6.834 6.609 -2.050 1.00 0.00 C ATOM 580 C LYS A 38 -7.618 6.685 -3.354 1.00 0.00 C ATOM 581 O LYS A 38 -7.081 7.071 -4.393 1.00 0.00 O ATOM 582 CB LYS A 38 -6.185 7.961 -1.752 1.00 0.00 C ATOM 583 CG LYS A 38 -7.200 9.073 -1.534 1.00 0.00 C ATOM 584 CD LYS A 38 -6.548 10.414 -1.223 1.00 0.00 C ATOM 585 CE LYS A 38 -5.809 10.414 0.113 1.00 0.00 C ATOM 586 NZ LYS A 38 -4.480 9.750 0.028 1.00 0.00 N ATOM 0 H LYS A 38 -4.946 5.831 -2.518 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.527 6.367 -1.244 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.559 7.869 -0.865 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.529 8.233 -2.579 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.819 9.173 -2.425 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.863 8.798 -0.714 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.849 10.667 -2.020 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.312 11.191 -1.211 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.677 11.442 0.452 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.418 9.907 0.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.804 10.246 0.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.566 8.760 0.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.140 9.779 -0.954 1.00 0.00 H new ATOM 600 N ILE A 39 -8.887 6.317 -3.287 1.00 0.00 N ATOM 601 CA ILE A 39 -9.765 6.371 -4.443 1.00 0.00 C ATOM 602 C ILE A 39 -10.623 7.630 -4.380 1.00 0.00 C ATOM 603 O ILE A 39 -11.372 7.833 -3.428 1.00 0.00 O ATOM 604 CB ILE A 39 -10.696 5.131 -4.542 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.892 3.829 -4.668 1.00 0.00 C ATOM 606 CG2 ILE A 39 -11.647 5.269 -5.723 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.408 3.271 -3.348 1.00 0.00 C ATOM 0 H ILE A 39 -9.334 5.975 -2.436 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.128 6.382 -5.327 1.00 0.00 H new ATOM 0 HB ILE A 39 -11.275 5.084 -3.620 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -10.510 3.079 -5.162 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.031 4.007 -5.312 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.291 4.391 -5.776 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -12.260 6.161 -5.594 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -11.072 5.353 -6.645 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.849 2.352 -3.524 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -8.762 4.000 -2.860 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.264 3.058 -2.707 1.00 0.00 H new ATOM 619 N GLN A 40 -10.499 8.482 -5.384 1.00 0.00 N ATOM 620 CA GLN A 40 -11.287 9.705 -5.443 1.00 0.00 C ATOM 621 C GLN A 40 -12.736 9.374 -5.803 1.00 0.00 C ATOM 622 O GLN A 40 -12.984 8.511 -6.648 1.00 0.00 O ATOM 623 CB GLN A 40 -10.694 10.662 -6.483 1.00 0.00 C ATOM 624 CG GLN A 40 -11.199 12.093 -6.367 1.00 0.00 C ATOM 625 CD GLN A 40 -10.449 12.907 -5.322 1.00 0.00 C ATOM 626 OE1 GLN A 40 -10.327 14.123 -5.447 1.00 0.00 O ATOM 627 NE2 GLN A 40 -9.931 12.248 -4.297 1.00 0.00 N ATOM 0 H GLN A 40 -9.861 8.351 -6.169 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.265 10.188 -4.466 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -9.608 10.662 -6.385 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -10.924 10.286 -7.480 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -11.108 12.584 -7.336 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -12.260 12.079 -6.116 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -10.053 11.238 -4.226 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.410 12.751 -3.578 1.00 0.00 H new ATOM 636 N PHE A 41 -13.690 10.057 -5.171 1.00 0.00 N ATOM 637 CA PHE A 41 -15.110 9.824 -5.444 1.00 0.00 C ATOM 638 C PHE A 41 -15.436 10.089 -6.913 1.00 0.00 C ATOM 639 O PHE A 41 -16.316 9.450 -7.491 1.00 0.00 O ATOM 640 CB PHE A 41 -15.992 10.695 -4.543 1.00 0.00 C ATOM 641 CG PHE A 41 -16.229 10.117 -3.172 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.186 9.588 -2.430 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.502 10.114 -2.623 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.407 9.066 -1.170 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.728 9.592 -1.364 1.00 0.00 C ATOM 646 CZ PHE A 41 -16.678 9.069 -0.637 1.00 0.00 C ATOM 0 H PHE A 41 -13.508 10.774 -4.469 1.00 0.00 H new ATOM 0 HA PHE A 41 -15.320 8.777 -5.226 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.528 11.676 -4.437 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.954 10.848 -5.032 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.187 9.583 -2.841 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.327 10.525 -3.186 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.584 8.656 -0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -18.725 9.593 -0.949 1.00 0.00 H new ATOM 0 HZ PHE A 41 -16.852 8.663 0.348 1.00 0.00 H new ATOM 656 N ALA A 42 -14.696 11.010 -7.517 1.00 0.00 N ATOM 657 CA ALA A 42 -14.886 11.348 -8.920 1.00 0.00 C ATOM 658 C ALA A 42 -14.405 10.227 -9.841 1.00 0.00 C ATOM 659 O ALA A 42 -14.812 10.151 -10.999 1.00 0.00 O ATOM 660 CB ALA A 42 -14.157 12.640 -9.245 1.00 0.00 C ATOM 0 H ALA A 42 -13.956 11.538 -7.054 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.954 11.481 -9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.304 12.886 -10.297 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.551 13.446 -8.625 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -13.092 12.517 -9.047 1.00 0.00 H new ATOM 666 N SER A 43 -13.547 9.359 -9.323 1.00 0.00 N ATOM 667 CA SER A 43 -12.993 8.266 -10.113 1.00 0.00 C ATOM 668 C SER A 43 -13.835 6.999 -9.964 1.00 0.00 C ATOM 669 O SER A 43 -13.936 6.193 -10.888 1.00 0.00 O ATOM 670 CB SER A 43 -11.553 7.991 -9.677 1.00 0.00 C ATOM 671 OG SER A 43 -10.787 9.186 -9.686 1.00 0.00 O ATOM 0 H SER A 43 -13.219 9.390 -8.358 1.00 0.00 H new ATOM 0 HA SER A 43 -13.005 8.560 -11.163 1.00 0.00 H new ATOM 0 HB2 SER A 43 -11.548 7.558 -8.677 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.100 7.258 -10.344 1.00 0.00 H new ATOM 0 HG SER A 43 -9.870 8.989 -9.403 1.00 0.00 H new ATOM 677 N ILE A 44 -14.437 6.834 -8.795 1.00 0.00 N ATOM 678 CA ILE A 44 -15.257 5.661 -8.517 1.00 0.00 C ATOM 679 C ILE A 44 -16.703 5.883 -8.964 1.00 0.00 C ATOM 680 O ILE A 44 -17.421 4.935 -9.287 1.00 0.00 O ATOM 681 CB ILE A 44 -15.206 5.294 -7.011 1.00 0.00 C ATOM 682 CG1 ILE A 44 -16.125 4.110 -6.699 1.00 0.00 C ATOM 683 CG2 ILE A 44 -15.572 6.493 -6.152 1.00 0.00 C ATOM 684 CD1 ILE A 44 -16.109 3.701 -5.241 1.00 0.00 C ATOM 0 H ILE A 44 -14.374 7.497 -8.023 1.00 0.00 H new ATOM 0 HA ILE A 44 -14.848 4.827 -9.088 1.00 0.00 H new ATOM 0 HB ILE A 44 -14.184 4.999 -6.775 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -17.145 4.367 -6.985 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -15.827 3.258 -7.310 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.530 6.213 -5.099 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.868 7.304 -6.340 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -16.581 6.823 -6.399 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.782 2.857 -5.092 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -15.097 3.413 -4.955 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.436 4.539 -4.625 1.00 0.00 H new ATOM 696 N GLY A 45 -17.115 7.143 -9.010 1.00 0.00 N ATOM 697 CA GLY A 45 -18.481 7.456 -9.370 1.00 0.00 C ATOM 698 C GLY A 45 -19.408 7.307 -8.187 1.00 0.00 C ATOM 699 O GLY A 45 -20.534 6.827 -8.317 1.00 0.00 O ATOM 0 H GLY A 45 -16.528 7.951 -8.805 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.534 8.476 -9.750 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -18.807 6.798 -10.175 1.00 0.00 H new ATOM 703 N ALA A 46 -18.919 7.705 -7.023 1.00 0.00 N ATOM 704 CA ALA A 46 -19.686 7.594 -5.797 1.00 0.00 C ATOM 705 C ALA A 46 -20.228 8.949 -5.375 1.00 0.00 C ATOM 706 O ALA A 46 -19.499 9.940 -5.357 1.00 0.00 O ATOM 707 CB ALA A 46 -18.834 6.997 -4.688 1.00 0.00 C ATOM 0 H ALA A 46 -17.990 8.109 -6.904 1.00 0.00 H new ATOM 0 HA ALA A 46 -20.530 6.930 -5.984 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.425 6.921 -3.776 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.495 6.004 -4.984 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.970 7.637 -4.508 1.00 0.00 H new ATOM 713 N THR A 47 -21.511 8.989 -5.058 1.00 0.00 N ATOM 714 CA THR A 47 -22.135 10.204 -4.564 1.00 0.00 C ATOM 715 C THR A 47 -22.102 10.224 -3.039 1.00 0.00 C ATOM 716 O THR A 47 -21.961 11.278 -2.415 1.00 0.00 O ATOM 717 CB THR A 47 -23.592 10.302 -5.048 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.653 10.043 -6.458 1.00 0.00 O ATOM 719 CG2 THR A 47 -24.173 11.676 -4.757 1.00 0.00 C ATOM 0 H THR A 47 -22.142 8.191 -5.134 1.00 0.00 H new ATOM 0 HA THR A 47 -21.578 11.057 -4.951 1.00 0.00 H new ATOM 0 HB THR A 47 -24.181 9.558 -4.511 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.583 10.105 -6.762 1.00 0.00 H new ATOM 0 HG21 THR A 47 -25.204 11.717 -5.110 1.00 0.00 H new ATOM 0 HG22 THR A 47 -24.149 11.861 -3.683 1.00 0.00 H new ATOM 0 HG23 THR A 47 -23.584 12.436 -5.269 1.00 0.00 H new ATOM 727 N THR A 48 -22.223 9.044 -2.450 1.00 0.00 N ATOM 728 CA THR A 48 -22.217 8.901 -1.008 1.00 0.00 C ATOM 729 C THR A 48 -21.112 7.945 -0.580 1.00 0.00 C ATOM 730 O THR A 48 -20.489 7.289 -1.423 1.00 0.00 O ATOM 731 CB THR A 48 -23.574 8.375 -0.499 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.921 7.167 -1.191 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.671 9.413 -0.688 1.00 0.00 C ATOM 0 H THR A 48 -22.327 8.165 -2.957 1.00 0.00 H new ATOM 0 HA THR A 48 -22.038 9.885 -0.574 1.00 0.00 H new ATOM 0 HB THR A 48 -23.480 8.169 0.567 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.133 7.374 -2.125 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.616 9.014 -0.320 1.00 0.00 H new ATOM 0 HG22 THR A 48 -24.417 10.316 -0.132 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.766 9.653 -1.747 1.00 0.00 H new ATOM 741 N LYS A 49 -20.868 7.849 0.720 1.00 0.00 N ATOM 742 CA LYS A 49 -19.849 6.939 1.218 1.00 0.00 C ATOM 743 C LYS A 49 -20.329 5.494 1.123 1.00 0.00 C ATOM 744 O LYS A 49 -19.522 4.571 0.995 1.00 0.00 O ATOM 745 CB LYS A 49 -19.434 7.296 2.652 1.00 0.00 C ATOM 746 CG LYS A 49 -20.578 7.351 3.653 1.00 0.00 C ATOM 747 CD LYS A 49 -20.084 7.782 5.027 1.00 0.00 C ATOM 748 CE LYS A 49 -19.432 9.156 4.979 1.00 0.00 C ATOM 749 NZ LYS A 49 -18.868 9.560 6.294 1.00 0.00 N ATOM 0 H LYS A 49 -21.355 8.383 1.440 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.965 7.044 0.590 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -18.703 6.564 2.997 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -18.934 8.264 2.640 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.339 8.048 3.302 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.051 6.371 3.724 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.920 7.799 5.727 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.368 7.051 5.403 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -18.639 9.153 4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -20.168 9.894 4.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -18.435 10.502 6.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.628 9.589 7.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.146 8.872 6.588 1.00 0.00 H new ATOM 763 N GLU A 50 -21.647 5.302 1.161 1.00 0.00 N ATOM 764 CA GLU A 50 -22.232 3.985 0.945 1.00 0.00 C ATOM 765 C GLU A 50 -22.046 3.548 -0.502 1.00 0.00 C ATOM 766 O GLU A 50 -21.818 2.370 -0.771 1.00 0.00 O ATOM 767 CB GLU A 50 -23.716 3.974 1.317 1.00 0.00 C ATOM 768 CG GLU A 50 -23.964 3.960 2.818 1.00 0.00 C ATOM 769 CD GLU A 50 -23.387 2.729 3.490 1.00 0.00 C ATOM 770 OE1 GLU A 50 -23.965 1.636 3.332 1.00 0.00 O ATOM 771 OE2 GLU A 50 -22.358 2.851 4.187 1.00 0.00 O ATOM 0 H GLU A 50 -22.326 6.042 1.339 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.714 3.278 1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.197 4.851 0.885 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.188 3.099 0.870 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -23.525 4.853 3.264 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -25.037 4.004 3.006 1.00 0.00 H new ATOM 778 N ASP A 51 -22.133 4.498 -1.435 1.00 0.00 N ATOM 779 CA ASP A 51 -21.844 4.209 -2.841 1.00 0.00 C ATOM 780 C ASP A 51 -20.427 3.699 -2.985 1.00 0.00 C ATOM 781 O ASP A 51 -20.171 2.710 -3.677 1.00 0.00 O ATOM 782 CB ASP A 51 -22.000 5.448 -3.721 1.00 0.00 C ATOM 783 CG ASP A 51 -23.436 5.817 -3.979 1.00 0.00 C ATOM 784 OD1 ASP A 51 -24.230 4.921 -4.326 1.00 0.00 O ATOM 785 OD2 ASP A 51 -23.771 7.015 -3.860 1.00 0.00 O ATOM 0 H ASP A 51 -22.398 5.464 -1.246 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.560 3.454 -3.166 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -21.496 6.289 -3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.500 5.274 -4.674 1.00 0.00 H new ATOM 790 N ALA A 52 -19.510 4.394 -2.326 1.00 0.00 N ATOM 791 CA ALA A 52 -18.111 4.020 -2.329 1.00 0.00 C ATOM 792 C ALA A 52 -17.939 2.609 -1.780 1.00 0.00 C ATOM 793 O ALA A 52 -17.322 1.761 -2.418 1.00 0.00 O ATOM 794 CB ALA A 52 -17.300 5.025 -1.527 1.00 0.00 C ATOM 0 H ALA A 52 -19.718 5.229 -1.778 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.742 4.028 -3.355 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.249 4.734 -1.536 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.406 6.015 -1.970 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.662 5.047 -0.499 1.00 0.00 H new ATOM 800 N ALA A 53 -18.529 2.356 -0.615 1.00 0.00 N ATOM 801 CA ALA A 53 -18.463 1.042 0.013 1.00 0.00 C ATOM 802 C ALA A 53 -19.064 -0.030 -0.887 1.00 0.00 C ATOM 803 O ALA A 53 -18.480 -1.090 -1.068 1.00 0.00 O ATOM 804 CB ALA A 53 -19.174 1.055 1.358 1.00 0.00 C ATOM 0 H ALA A 53 -19.060 3.048 -0.086 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.412 0.803 0.172 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.114 0.065 1.811 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.698 1.784 2.014 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.220 1.325 1.214 1.00 0.00 H new ATOM 810 N LYS A 54 -20.219 0.271 -1.472 1.00 0.00 N ATOM 811 CA LYS A 54 -20.935 -0.686 -2.315 1.00 0.00 C ATOM 812 C LYS A 54 -20.063 -1.163 -3.477 1.00 0.00 C ATOM 813 O LYS A 54 -20.253 -2.263 -4.001 1.00 0.00 O ATOM 814 CB LYS A 54 -22.232 -0.056 -2.849 1.00 0.00 C ATOM 815 CG LYS A 54 -23.133 -1.038 -3.583 1.00 0.00 C ATOM 816 CD LYS A 54 -24.490 -0.435 -3.934 1.00 0.00 C ATOM 817 CE LYS A 54 -24.442 0.440 -5.185 1.00 0.00 C ATOM 818 NZ LYS A 54 -23.846 1.781 -4.936 1.00 0.00 N ATOM 0 H LYS A 54 -20.683 1.175 -1.378 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.184 -1.553 -1.703 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.785 0.377 -2.015 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -21.977 0.763 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -22.638 -1.367 -4.497 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.281 -1.923 -2.964 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -25.211 -1.238 -4.085 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.847 0.160 -3.093 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.865 -0.070 -5.956 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -25.453 0.564 -5.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -24.348 2.495 -5.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -23.931 2.017 -3.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -22.842 1.770 -5.206 1.00 0.00 H new ATOM 832 N THR A 55 -19.101 -0.341 -3.861 1.00 0.00 N ATOM 833 CA THR A 55 -18.228 -0.659 -4.977 1.00 0.00 C ATOM 834 C THR A 55 -16.886 -1.219 -4.491 1.00 0.00 C ATOM 835 O THR A 55 -16.299 -2.089 -5.132 1.00 0.00 O ATOM 836 CB THR A 55 -17.971 0.593 -5.832 1.00 0.00 C ATOM 837 OG1 THR A 55 -19.176 1.367 -5.935 1.00 0.00 O ATOM 838 CG2 THR A 55 -17.490 0.215 -7.224 1.00 0.00 C ATOM 0 H THR A 55 -18.905 0.555 -3.414 1.00 0.00 H new ATOM 0 HA THR A 55 -18.729 -1.418 -5.578 1.00 0.00 H new ATOM 0 HB THR A 55 -17.194 1.183 -5.346 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.350 1.817 -5.082 1.00 0.00 H new ATOM 0 HG21 THR A 55 -17.316 1.119 -7.807 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.562 -0.351 -7.147 1.00 0.00 H new ATOM 0 HG23 THR A 55 -18.247 -0.395 -7.717 1.00 0.00 H new ATOM 846 N LEU A 56 -16.414 -0.725 -3.351 1.00 0.00 N ATOM 847 CA LEU A 56 -15.087 -1.077 -2.853 1.00 0.00 C ATOM 848 C LEU A 56 -15.102 -2.349 -2.005 1.00 0.00 C ATOM 849 O LEU A 56 -14.100 -3.058 -1.935 1.00 0.00 O ATOM 850 CB LEU A 56 -14.496 0.082 -2.045 1.00 0.00 C ATOM 851 CG LEU A 56 -14.257 1.373 -2.835 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.659 2.445 -1.936 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.351 1.110 -4.031 1.00 0.00 C ATOM 0 H LEU A 56 -16.930 -0.079 -2.754 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.461 -1.272 -3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.165 0.302 -1.213 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.549 -0.242 -1.614 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.217 1.732 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.496 3.355 -2.514 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.344 2.655 -1.114 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.708 2.095 -1.535 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.193 2.039 -4.579 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.392 0.726 -3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.819 0.376 -4.687 1.00 0.00 H new ATOM 865 N GLU A 57 -16.233 -2.642 -1.368 1.00 0.00 N ATOM 866 CA GLU A 57 -16.347 -3.834 -0.522 1.00 0.00 C ATOM 867 C GLU A 57 -16.019 -5.126 -1.283 1.00 0.00 C ATOM 868 O GLU A 57 -15.314 -5.983 -0.751 1.00 0.00 O ATOM 869 CB GLU A 57 -17.729 -3.940 0.124 1.00 0.00 C ATOM 870 CG GLU A 57 -17.935 -2.952 1.253 1.00 0.00 C ATOM 871 CD GLU A 57 -19.011 -3.396 2.218 1.00 0.00 C ATOM 872 OE1 GLU A 57 -18.913 -4.530 2.735 1.00 0.00 O ATOM 873 OE2 GLU A 57 -19.947 -2.615 2.484 1.00 0.00 O ATOM 0 H GLU A 57 -17.080 -2.076 -1.419 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.604 -3.715 0.267 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.492 -3.777 -0.637 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.869 -4.952 0.505 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.997 -2.821 1.793 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -18.202 -1.980 0.838 1.00 0.00 H new ATOM 880 N PRO A 58 -16.550 -5.310 -2.515 1.00 0.00 N ATOM 881 CA PRO A 58 -16.145 -6.409 -3.401 1.00 0.00 C ATOM 882 C PRO A 58 -14.630 -6.635 -3.434 1.00 0.00 C ATOM 883 O PRO A 58 -14.165 -7.767 -3.559 1.00 0.00 O ATOM 884 CB PRO A 58 -16.633 -5.943 -4.771 1.00 0.00 C ATOM 885 CG PRO A 58 -17.828 -5.096 -4.490 1.00 0.00 C ATOM 886 CD PRO A 58 -17.641 -4.513 -3.111 1.00 0.00 C ATOM 0 HA PRO A 58 -16.559 -7.361 -3.069 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -15.862 -5.376 -5.292 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -16.891 -6.790 -5.407 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.923 -4.305 -5.234 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.741 -5.689 -4.537 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.379 -3.456 -3.160 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.555 -4.588 -2.521 1.00 0.00 H new ATOM 894 N LEU A 59 -13.866 -5.556 -3.310 1.00 0.00 N ATOM 895 CA LEU A 59 -12.410 -5.637 -3.345 1.00 0.00 C ATOM 896 C LEU A 59 -11.846 -5.933 -1.957 1.00 0.00 C ATOM 897 O LEU A 59 -10.987 -6.799 -1.799 1.00 0.00 O ATOM 898 CB LEU A 59 -11.796 -4.335 -3.885 1.00 0.00 C ATOM 899 CG LEU A 59 -12.012 -4.055 -5.381 1.00 0.00 C ATOM 900 CD1 LEU A 59 -13.457 -3.678 -5.673 1.00 0.00 C ATOM 901 CD2 LEU A 59 -11.072 -2.957 -5.852 1.00 0.00 C ATOM 0 H LEU A 59 -14.232 -4.612 -3.184 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.145 -6.454 -4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.207 -3.500 -3.317 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -10.724 -4.355 -3.691 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.790 -4.971 -5.929 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -13.575 -3.487 -6.740 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.113 -4.496 -5.376 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.719 -2.781 -5.112 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.235 -2.769 -6.913 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.266 -2.045 -5.287 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.040 -3.269 -5.694 1.00 0.00 H new ATOM 913 N SER A 60 -12.347 -5.227 -0.951 1.00 0.00 N ATOM 914 CA SER A 60 -11.834 -5.358 0.410 1.00 0.00 C ATOM 915 C SER A 60 -12.154 -6.731 1.002 1.00 0.00 C ATOM 916 O SER A 60 -11.411 -7.249 1.837 1.00 0.00 O ATOM 917 CB SER A 60 -12.405 -4.250 1.293 1.00 0.00 C ATOM 918 OG SER A 60 -13.823 -4.264 1.278 1.00 0.00 O ATOM 0 H SER A 60 -13.109 -4.556 -1.051 1.00 0.00 H new ATOM 0 HA SER A 60 -10.749 -5.262 0.371 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.048 -4.375 2.315 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.044 -3.282 0.946 1.00 0.00 H new ATOM 0 HG SER A 60 -14.163 -3.932 2.135 1.00 0.00 H new ATOM 924 N ALA A 61 -13.249 -7.328 0.545 1.00 0.00 N ATOM 925 CA ALA A 61 -13.665 -8.645 1.021 1.00 0.00 C ATOM 926 C ALA A 61 -12.688 -9.734 0.582 1.00 0.00 C ATOM 927 O ALA A 61 -12.788 -10.883 1.011 1.00 0.00 O ATOM 928 CB ALA A 61 -15.068 -8.966 0.528 1.00 0.00 C ATOM 0 H ALA A 61 -13.867 -6.921 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.668 -8.619 2.111 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -15.365 -9.950 0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.765 -8.216 0.902 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -15.081 -8.962 -0.562 1.00 0.00 H new ATOM 934 N LYS A 62 -11.739 -9.367 -0.270 1.00 0.00 N ATOM 935 CA LYS A 62 -10.743 -10.307 -0.756 1.00 0.00 C ATOM 936 C LYS A 62 -9.519 -10.324 0.158 1.00 0.00 C ATOM 937 O LYS A 62 -8.590 -11.100 -0.054 1.00 0.00 O ATOM 938 CB LYS A 62 -10.338 -9.951 -2.190 1.00 0.00 C ATOM 939 CG LYS A 62 -11.500 -10.004 -3.170 1.00 0.00 C ATOM 940 CD LYS A 62 -11.090 -9.552 -4.562 1.00 0.00 C ATOM 941 CE LYS A 62 -12.279 -9.558 -5.509 1.00 0.00 C ATOM 942 NZ LYS A 62 -11.923 -9.093 -6.877 1.00 0.00 N ATOM 0 H LYS A 62 -11.640 -8.421 -0.638 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.180 -11.305 -0.752 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.907 -8.950 -2.201 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.559 -10.637 -2.522 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.888 -11.022 -3.218 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -12.310 -9.371 -2.807 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.665 -8.549 -4.512 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.311 -10.210 -4.947 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.688 -10.567 -5.567 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -13.064 -8.919 -5.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.768 -9.116 -7.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -11.558 -8.120 -6.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.193 -9.717 -7.277 1.00 0.00 H new ATOM 956 N TYR A 63 -9.530 -9.472 1.183 1.00 0.00 N ATOM 957 CA TYR A 63 -8.438 -9.427 2.155 1.00 0.00 C ATOM 958 C TYR A 63 -8.687 -10.384 3.310 1.00 0.00 C ATOM 959 O TYR A 63 -7.889 -10.450 4.243 1.00 0.00 O ATOM 960 CB TYR A 63 -8.255 -8.019 2.727 1.00 0.00 C ATOM 961 CG TYR A 63 -7.647 -7.020 1.774 1.00 0.00 C ATOM 962 CD1 TYR A 63 -8.430 -6.304 0.880 1.00 0.00 C ATOM 963 CD2 TYR A 63 -6.284 -6.780 1.790 1.00 0.00 C ATOM 964 CE1 TYR A 63 -7.867 -5.378 0.023 1.00 0.00 C ATOM 965 CE2 TYR A 63 -5.713 -5.857 0.943 1.00 0.00 C ATOM 966 CZ TYR A 63 -6.508 -5.155 0.058 1.00 0.00 C ATOM 967 OH TYR A 63 -5.944 -4.227 -0.787 1.00 0.00 O ATOM 0 H TYR A 63 -10.281 -8.805 1.361 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.536 -9.723 1.620 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.226 -7.645 3.051 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.625 -8.082 3.615 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.496 -6.473 0.854 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.657 -7.326 2.479 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.489 -4.832 -0.671 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.648 -5.682 0.970 1.00 0.00 H new ATOM 0 HH TYR A 63 -6.424 -3.377 -0.706 1.00 0.00 H new ATOM 977 N LYS A 64 -9.789 -11.120 3.244 1.00 0.00 N ATOM 978 CA LYS A 64 -10.199 -11.990 4.341 1.00 0.00 C ATOM 979 C LYS A 64 -9.098 -12.987 4.725 1.00 0.00 C ATOM 980 O LYS A 64 -8.803 -13.934 3.987 1.00 0.00 O ATOM 981 CB LYS A 64 -11.497 -12.728 3.992 1.00 0.00 C ATOM 982 CG LYS A 64 -11.446 -13.504 2.686 1.00 0.00 C ATOM 983 CD LYS A 64 -12.689 -14.355 2.497 1.00 0.00 C ATOM 984 CE LYS A 64 -12.585 -15.225 1.255 1.00 0.00 C ATOM 985 NZ LYS A 64 -11.403 -16.128 1.307 1.00 0.00 N ATOM 0 H LYS A 64 -10.417 -11.132 2.440 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.380 -11.354 5.208 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.737 -13.418 4.801 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.310 -12.003 3.939 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.349 -12.809 1.852 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -10.562 -14.141 2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -12.836 -14.986 3.373 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.564 -13.710 2.419 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -13.492 -15.820 1.152 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -12.518 -14.590 0.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -11.532 -16.908 0.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -10.546 -15.593 1.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.303 -16.514 2.267 1.00 0.00 H new ATOM 999 N ASN A 65 -8.475 -12.723 5.873 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.494 -13.623 6.481 1.00 0.00 C ATOM 1001 C ASN A 65 -6.310 -13.911 5.557 1.00 0.00 C ATOM 1002 O ASN A 65 -5.856 -15.053 5.458 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.158 -14.939 6.909 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.176 -14.750 8.019 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -10.364 -14.550 7.765 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -8.719 -14.811 9.261 1.00 0.00 N ATOM 0 H ASN A 65 -8.638 -11.872 6.412 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.104 -13.111 7.361 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.647 -15.391 6.046 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -7.390 -15.637 7.242 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.359 -14.690 10.046 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.727 -14.979 9.432 1.00 0.00 H new ATOM 1013 N ILE A 66 -5.796 -12.880 4.890 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.578 -13.039 4.094 1.00 0.00 C ATOM 1015 C ILE A 66 -3.361 -13.030 5.011 1.00 0.00 C ATOM 1016 O ILE A 66 -2.382 -13.738 4.787 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.414 -11.918 3.044 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.658 -11.826 2.158 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.171 -12.162 2.193 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -5.510 -10.860 1.001 1.00 0.00 C ATOM 0 H ILE A 66 -6.194 -11.941 4.883 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.660 -13.990 3.567 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.294 -10.970 3.569 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.888 -12.817 1.766 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.507 -11.520 2.769 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.070 -11.363 1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.289 -12.179 2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.264 -13.118 1.678 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -6.430 -10.848 0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -5.311 -9.860 1.385 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.682 -11.176 0.366 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.454 -12.230 6.056 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.374 -12.039 7.007 1.00 0.00 C ATOM 1034 C ALA A 67 -2.889 -11.183 8.141 1.00 0.00 C ATOM 1035 O ALA A 67 -4.096 -11.156 8.394 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.185 -11.360 6.334 1.00 0.00 C ATOM 0 H ALA A 67 -4.291 -11.688 6.271 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.039 -13.004 7.386 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.384 -11.224 7.061 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.828 -11.981 5.513 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.492 -10.388 5.947 1.00 0.00 H new ATOM 1042 N GLY A 68 -1.997 -10.472 8.810 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.425 -9.444 9.731 1.00 0.00 C ATOM 1044 C GLY A 68 -2.889 -8.217 8.971 1.00 0.00 C ATOM 1045 O GLY A 68 -2.433 -7.106 9.226 1.00 0.00 O ATOM 0 H GLY A 68 -0.987 -10.588 8.732 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.234 -9.821 10.356 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.604 -9.179 10.397 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.804 -8.429 8.033 1.00 0.00 N ATOM 1050 CA VAL A 69 -4.231 -7.377 7.128 1.00 0.00 C ATOM 1051 C VAL A 69 -5.277 -6.488 7.791 1.00 0.00 C ATOM 1052 O VAL A 69 -6.418 -6.891 8.021 1.00 0.00 O ATOM 1053 CB VAL A 69 -4.764 -7.941 5.777 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -3.645 -8.576 4.968 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -5.876 -8.950 5.991 1.00 0.00 C ATOM 0 H VAL A 69 -4.265 -9.326 7.881 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.352 -6.774 6.899 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.168 -7.096 5.219 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -4.047 -8.961 4.031 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.880 -7.829 4.756 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.204 -9.395 5.537 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -6.222 -9.321 5.026 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.502 -9.783 6.587 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.705 -8.473 6.514 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.859 -5.278 8.106 1.00 0.00 N ATOM 1066 CA GLU A 70 -5.720 -4.310 8.756 1.00 0.00 C ATOM 1067 C GLU A 70 -6.376 -3.445 7.693 1.00 0.00 C ATOM 1068 O GLU A 70 -5.735 -2.572 7.110 1.00 0.00 O ATOM 1069 CB GLU A 70 -4.903 -3.440 9.713 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.721 -2.757 10.787 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.877 -1.887 11.692 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -4.262 -2.425 12.635 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -4.825 -0.661 11.469 1.00 0.00 O ATOM 0 H GLU A 70 -3.915 -4.939 7.919 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.487 -4.828 9.332 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.144 -4.060 10.190 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.377 -2.680 9.135 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -6.493 -2.147 10.318 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.231 -3.512 11.386 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.636 -3.723 7.417 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.364 -3.012 6.379 1.00 0.00 C ATOM 1082 C GLU A 71 -9.177 -1.874 6.979 1.00 0.00 C ATOM 1083 O GLU A 71 -10.000 -2.087 7.871 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.267 -3.984 5.614 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.151 -3.325 4.563 1.00 0.00 C ATOM 1086 CD GLU A 71 -11.626 -3.425 4.900 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -12.143 -2.532 5.602 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -12.274 -4.397 4.467 1.00 0.00 O ATOM 0 H GLU A 71 -8.180 -4.439 7.898 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.648 -2.580 5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.644 -4.735 5.128 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.902 -4.510 6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.874 -2.275 4.466 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -9.970 -3.793 3.595 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.908 -0.666 6.512 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.676 0.502 6.906 1.00 0.00 C ATOM 1097 C LYS A 72 -10.213 1.212 5.678 1.00 0.00 C ATOM 1098 O LYS A 72 -9.496 1.982 5.039 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.818 1.484 7.706 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.311 0.949 9.030 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.496 2.005 9.754 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.006 1.512 11.098 1.00 0.00 C ATOM 1103 NZ LYS A 72 -6.189 2.539 11.795 1.00 0.00 N ATOM 0 H LYS A 72 -8.155 -0.468 5.853 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.500 0.159 7.531 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.963 1.778 7.097 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.401 2.386 7.893 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.153 0.642 9.651 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.700 0.063 8.861 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.643 2.291 9.139 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.103 2.900 9.894 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.859 1.242 11.720 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.413 0.608 10.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -5.871 2.166 12.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -5.361 2.778 11.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.762 3.393 11.949 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.457 0.939 5.325 1.00 0.00 N ATOM 1118 CA LEU A 73 -12.105 1.693 4.271 1.00 0.00 C ATOM 1119 C LEU A 73 -12.651 2.976 4.869 1.00 0.00 C ATOM 1120 O LEU A 73 -13.716 2.989 5.482 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.229 0.883 3.622 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.769 -0.308 2.779 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.968 -1.049 2.211 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.854 0.159 1.657 1.00 0.00 C ATOM 0 H LEU A 73 -12.031 0.210 5.748 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.380 1.922 3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.892 0.518 4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.818 1.549 2.991 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.211 -0.991 3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.624 -1.894 1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.592 -1.412 3.028 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.549 -0.373 1.583 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.535 -0.700 1.066 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.391 0.860 1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.980 0.652 2.082 1.00 0.00 H new ATOM 1136 N THR A 74 -11.908 4.052 4.699 1.00 0.00 N ATOM 1137 CA THR A 74 -12.234 5.287 5.376 1.00 0.00 C ATOM 1138 C THR A 74 -12.721 6.339 4.391 1.00 0.00 C ATOM 1139 O THR A 74 -11.949 6.869 3.594 1.00 0.00 O ATOM 1140 CB THR A 74 -11.016 5.817 6.154 1.00 0.00 C ATOM 1141 OG1 THR A 74 -10.013 4.795 6.242 1.00 0.00 O ATOM 1142 CG2 THR A 74 -11.423 6.231 7.554 1.00 0.00 C ATOM 0 H THR A 74 -11.082 4.095 4.103 1.00 0.00 H new ATOM 0 HA THR A 74 -13.038 5.077 6.081 1.00 0.00 H new ATOM 0 HB THR A 74 -10.618 6.682 5.624 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.239 5.138 6.736 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.551 6.603 8.091 1.00 0.00 H new ATOM 0 HG22 THR A 74 -12.177 7.016 7.497 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.835 5.371 8.082 1.00 0.00 H new ATOM 1150 N TYR A 75 -14.007 6.633 4.449 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.609 7.589 3.538 1.00 0.00 C ATOM 1152 C TYR A 75 -14.730 8.937 4.226 1.00 0.00 C ATOM 1153 O TYR A 75 -15.615 9.143 5.054 1.00 0.00 O ATOM 1154 CB TYR A 75 -15.983 7.090 3.091 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.001 5.616 2.757 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.422 5.139 1.590 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.588 4.700 3.622 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.426 3.791 1.291 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.597 3.351 3.330 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.015 2.903 2.164 1.00 0.00 C ATOM 1161 OH TYR A 75 -16.015 1.562 1.874 1.00 0.00 O ATOM 0 H TYR A 75 -14.656 6.222 5.120 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.978 7.698 2.656 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.708 7.286 3.881 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.302 7.658 2.217 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -14.960 5.834 0.904 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -17.044 5.049 4.537 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -14.970 3.435 0.379 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -17.057 2.651 4.011 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.469 1.072 2.591 1.00 0.00 H new ATOM 1171 N THR A 76 -13.827 9.844 3.893 1.00 0.00 N ATOM 1172 CA THR A 76 -13.761 11.125 4.572 1.00 0.00 C ATOM 1173 C THR A 76 -14.813 12.090 4.042 1.00 0.00 C ATOM 1174 O THR A 76 -15.599 12.653 4.806 1.00 0.00 O ATOM 1175 CB THR A 76 -12.356 11.737 4.430 1.00 0.00 C ATOM 1176 OG1 THR A 76 -11.372 10.722 4.683 1.00 0.00 O ATOM 1177 CG2 THR A 76 -12.159 12.888 5.407 1.00 0.00 C ATOM 0 H THR A 76 -13.131 9.717 3.158 1.00 0.00 H new ATOM 0 HA THR A 76 -13.966 10.952 5.628 1.00 0.00 H new ATOM 0 HB THR A 76 -12.247 12.125 3.417 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.636 10.813 4.042 1.00 0.00 H new ATOM 0 HG21 THR A 76 -11.158 13.302 5.285 1.00 0.00 H new ATOM 0 HG22 THR A 76 -12.899 13.664 5.209 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.279 12.524 6.427 1.00 0.00 H new ATOM 1185 N ASP A 77 -14.835 12.249 2.731 1.00 0.00 N ATOM 1186 CA ASP A 77 -15.788 13.142 2.071 1.00 0.00 C ATOM 1187 C ASP A 77 -15.647 13.056 0.554 1.00 0.00 C ATOM 1188 O ASP A 77 -16.525 12.542 -0.129 1.00 0.00 O ATOM 1189 CB ASP A 77 -15.592 14.592 2.533 1.00 0.00 C ATOM 1190 CG ASP A 77 -16.527 15.565 1.843 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -17.678 15.723 2.302 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -16.104 16.195 0.847 1.00 0.00 O ATOM 0 H ASP A 77 -14.201 11.770 2.092 1.00 0.00 H new ATOM 0 HA ASP A 77 -16.792 12.821 2.350 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -15.748 14.649 3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.561 14.891 2.344 1.00 0.00 H new ATOM 1197 N THR A 78 -14.527 13.542 0.036 1.00 0.00 N ATOM 1198 CA THR A 78 -14.314 13.574 -1.403 1.00 0.00 C ATOM 1199 C THR A 78 -13.391 12.437 -1.846 1.00 0.00 C ATOM 1200 O THR A 78 -13.195 12.200 -3.042 1.00 0.00 O ATOM 1201 CB THR A 78 -13.732 14.936 -1.848 1.00 0.00 C ATOM 1202 OG1 THR A 78 -13.852 15.090 -3.264 1.00 0.00 O ATOM 1203 CG2 THR A 78 -12.268 15.072 -1.448 1.00 0.00 C ATOM 0 H THR A 78 -13.756 13.918 0.588 1.00 0.00 H new ATOM 0 HA THR A 78 -15.284 13.440 -1.882 1.00 0.00 H new ATOM 0 HB THR A 78 -14.303 15.716 -1.345 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.638 14.241 -3.705 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.890 16.040 -1.776 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.178 14.995 -0.364 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.687 14.278 -1.917 1.00 0.00 H new ATOM 1211 N TYR A 79 -12.838 11.718 -0.879 1.00 0.00 N ATOM 1212 CA TYR A 79 -11.934 10.623 -1.184 1.00 0.00 C ATOM 1213 C TYR A 79 -12.145 9.460 -0.230 1.00 0.00 C ATOM 1214 O TYR A 79 -12.490 9.647 0.941 1.00 0.00 O ATOM 1215 CB TYR A 79 -10.470 11.084 -1.149 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.005 11.639 0.183 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -9.483 10.805 1.165 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.076 13.000 0.449 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -9.049 11.313 2.374 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.642 13.515 1.655 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.129 12.668 2.614 1.00 0.00 C ATOM 1222 OH TYR A 79 -8.698 13.180 3.816 1.00 0.00 O ATOM 0 H TYR A 79 -12.999 11.873 0.116 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.160 10.284 -2.195 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -9.833 10.241 -1.417 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -10.327 11.847 -1.914 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -9.416 9.743 0.980 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -10.477 13.667 -0.300 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.649 10.651 3.128 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.704 14.576 1.846 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.823 14.152 3.821 1.00 0.00 H new ATOM 1232 N ALA A 80 -11.964 8.264 -0.758 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.040 7.051 0.024 1.00 0.00 C ATOM 1234 C ALA A 80 -10.645 6.490 0.225 1.00 0.00 C ATOM 1235 O ALA A 80 -9.939 6.195 -0.740 1.00 0.00 O ATOM 1236 CB ALA A 80 -12.932 6.031 -0.666 1.00 0.00 C ATOM 0 H ALA A 80 -11.760 8.109 -1.745 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.475 7.278 0.997 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.979 5.123 -0.065 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.935 6.443 -0.780 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.523 5.795 -1.648 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.241 6.365 1.471 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.922 5.865 1.795 1.00 0.00 C ATOM 1244 C GLN A 81 -8.975 4.390 2.138 1.00 0.00 C ATOM 1245 O GLN A 81 -9.535 4.004 3.164 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.323 6.645 2.965 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.496 7.844 2.540 1.00 0.00 C ATOM 1248 CD GLN A 81 -7.008 8.655 3.724 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -7.700 8.779 4.734 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -5.804 9.189 3.620 1.00 0.00 N ATOM 0 H GLN A 81 -10.812 6.605 2.282 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.289 5.999 0.918 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -9.130 6.983 3.615 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.698 5.975 3.555 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.640 7.504 1.958 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.093 8.481 1.887 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -5.262 9.063 2.765 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -5.416 9.727 4.395 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.424 3.573 1.261 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.252 2.162 1.535 1.00 0.00 C ATOM 1261 C GLU A 82 -6.935 1.969 2.275 1.00 0.00 C ATOM 1262 O GLU A 82 -5.909 1.647 1.674 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.267 1.350 0.233 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.253 -0.157 0.434 1.00 0.00 C ATOM 1265 CD GLU A 82 -7.996 -0.918 -0.854 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -8.760 -0.733 -1.823 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -7.020 -1.699 -0.902 1.00 0.00 O ATOM 0 H GLU A 82 -8.085 3.867 0.345 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.076 1.805 2.153 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.154 1.620 -0.339 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.402 1.633 -0.367 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.485 -0.415 1.163 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.209 -0.472 0.853 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.954 2.237 3.571 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.756 2.119 4.387 1.00 0.00 C ATOM 1276 C ASN A 83 -5.558 0.670 4.789 1.00 0.00 C ATOM 1277 O ASN A 83 -6.248 0.159 5.668 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.853 3.008 5.632 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.611 2.941 6.505 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.696 3.023 7.728 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.445 2.818 5.888 1.00 0.00 N ATOM 0 H ASN A 83 -7.785 2.537 4.080 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.899 2.452 3.802 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.019 4.040 5.323 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.721 2.708 6.220 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.582 2.789 6.430 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.411 2.752 4.871 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.631 0.003 4.125 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.427 -1.420 4.354 1.00 0.00 C ATOM 1290 C VAL A 84 -3.089 -1.679 5.032 1.00 0.00 C ATOM 1291 O VAL A 84 -2.059 -1.170 4.611 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.498 -2.224 3.039 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.430 -3.715 3.321 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.766 -1.885 2.268 1.00 0.00 C ATOM 0 H VAL A 84 -4.012 0.417 3.429 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.232 -1.753 5.009 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.640 -1.949 2.425 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.481 -4.266 2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.493 -3.947 3.827 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.267 -4.004 3.957 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.796 -2.463 1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.637 -2.128 2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.774 -0.821 2.031 1.00 0.00 H new ATOM 1304 N THR A 85 -3.114 -2.462 6.091 1.00 0.00 N ATOM 1305 CA THR A 85 -1.904 -2.807 6.815 1.00 0.00 C ATOM 1306 C THR A 85 -1.574 -4.282 6.607 1.00 0.00 C ATOM 1307 O THR A 85 -2.225 -5.150 7.179 1.00 0.00 O ATOM 1308 CB THR A 85 -2.091 -2.526 8.313 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.645 -1.216 8.489 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.789 -2.627 9.080 1.00 0.00 C ATOM 0 H THR A 85 -3.965 -2.875 6.473 1.00 0.00 H new ATOM 0 HA THR A 85 -1.082 -2.200 6.436 1.00 0.00 H new ATOM 0 HB THR A 85 -2.769 -3.283 8.708 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.766 -1.038 9.445 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.971 -2.420 10.135 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.380 -3.632 8.972 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.077 -1.902 8.686 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.594 -4.564 5.764 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.212 -5.940 5.476 1.00 0.00 C ATOM 1320 C ILE A 86 1.066 -6.307 6.218 1.00 0.00 C ATOM 1321 O ILE A 86 2.149 -5.831 5.874 1.00 0.00 O ATOM 1322 CB ILE A 86 0.017 -6.194 3.963 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -1.127 -5.633 3.112 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.182 -7.684 3.698 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.910 -4.199 2.669 1.00 0.00 C ATOM 0 H ILE A 86 -0.048 -3.860 5.267 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.044 -6.560 5.809 1.00 0.00 H new ATOM 0 HB ILE A 86 0.930 -5.672 3.677 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.254 -6.261 2.230 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.054 -5.692 3.682 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.342 -7.849 2.632 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.040 -8.060 4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.717 -8.212 4.016 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.760 -3.870 2.071 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.813 -3.558 3.545 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.000 -4.136 2.072 1.00 0.00 H new ATOM 1337 N ASP A 87 0.938 -7.127 7.247 1.00 0.00 N ATOM 1338 CA ASP A 87 2.107 -7.647 7.945 1.00 0.00 C ATOM 1339 C ASP A 87 2.849 -8.632 7.054 1.00 0.00 C ATOM 1340 O ASP A 87 2.338 -9.707 6.740 1.00 0.00 O ATOM 1341 CB ASP A 87 1.715 -8.336 9.257 1.00 0.00 C ATOM 1342 CG ASP A 87 1.292 -7.361 10.336 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.168 -6.842 11.058 1.00 0.00 O ATOM 1344 OD2 ASP A 87 0.083 -7.119 10.480 1.00 0.00 O ATOM 0 H ASP A 87 0.043 -7.447 7.618 1.00 0.00 H new ATOM 0 HA ASP A 87 2.756 -6.804 8.183 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.899 -9.033 9.065 1.00 0.00 H new ATOM 0 HB3 ASP A 87 2.559 -8.925 9.618 1.00 0.00 H new ATOM 1349 N MET A 88 4.058 -8.265 6.652 1.00 0.00 N ATOM 1350 CA MET A 88 4.872 -9.115 5.792 1.00 0.00 C ATOM 1351 C MET A 88 5.618 -10.153 6.617 1.00 0.00 C ATOM 1352 O MET A 88 6.468 -10.881 6.106 1.00 0.00 O ATOM 1353 CB MET A 88 5.865 -8.283 4.979 1.00 0.00 C ATOM 1354 CG MET A 88 5.226 -7.485 3.856 1.00 0.00 C ATOM 1355 SD MET A 88 6.441 -6.602 2.859 1.00 0.00 S ATOM 1356 CE MET A 88 5.394 -5.892 1.594 1.00 0.00 C ATOM 0 H MET A 88 4.499 -7.381 6.908 1.00 0.00 H new ATOM 0 HA MET A 88 4.203 -9.627 5.100 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.383 -7.597 5.649 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.619 -8.947 4.556 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.655 -8.158 3.216 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.519 -6.771 4.279 1.00 0.00 H new ATOM 0 HE1 MET A 88 5.768 -4.905 1.324 1.00 0.00 H new ATOM 0 HE2 MET A 88 5.399 -6.535 0.714 1.00 0.00 H new ATOM 0 HE3 MET A 88 4.376 -5.803 1.972 1.00 0.00 H new ATOM 1366 N GLU A 89 5.290 -10.214 7.896 1.00 0.00 N ATOM 1367 CA GLU A 89 5.869 -11.202 8.785 1.00 0.00 C ATOM 1368 C GLU A 89 5.183 -12.542 8.570 1.00 0.00 C ATOM 1369 O GLU A 89 5.790 -13.601 8.731 1.00 0.00 O ATOM 1370 CB GLU A 89 5.724 -10.761 10.242 1.00 0.00 C ATOM 1371 CG GLU A 89 6.386 -9.426 10.545 1.00 0.00 C ATOM 1372 CD GLU A 89 6.287 -9.052 12.008 1.00 0.00 C ATOM 1373 OE1 GLU A 89 7.106 -9.552 12.808 1.00 0.00 O ATOM 1374 OE2 GLU A 89 5.385 -8.276 12.371 1.00 0.00 O ATOM 0 H GLU A 89 4.622 -9.586 8.343 1.00 0.00 H new ATOM 0 HA GLU A 89 6.931 -11.302 8.562 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.664 -10.695 10.489 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.155 -11.525 10.888 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.436 -9.470 10.254 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.920 -8.647 9.941 1.00 0.00 H new ATOM 1381 N LYS A 90 3.915 -12.480 8.184 1.00 0.00 N ATOM 1382 CA LYS A 90 3.123 -13.673 7.933 1.00 0.00 C ATOM 1383 C LYS A 90 2.138 -13.423 6.798 1.00 0.00 C ATOM 1384 O LYS A 90 0.959 -13.189 7.037 1.00 0.00 O ATOM 1385 CB LYS A 90 2.354 -14.079 9.193 1.00 0.00 C ATOM 1386 CG LYS A 90 1.553 -15.363 9.034 1.00 0.00 C ATOM 1387 CD LYS A 90 0.595 -15.564 10.192 1.00 0.00 C ATOM 1388 CE LYS A 90 -0.268 -16.797 9.994 1.00 0.00 C ATOM 1389 NZ LYS A 90 -1.227 -16.981 11.111 1.00 0.00 N ATOM 0 H LYS A 90 3.411 -11.606 8.037 1.00 0.00 H new ATOM 0 HA LYS A 90 3.800 -14.480 7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.059 -14.201 10.015 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.677 -13.271 9.471 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.994 -15.332 8.099 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.233 -16.212 8.971 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.159 -15.659 11.120 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.042 -14.686 10.295 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.815 -16.711 9.055 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.369 -17.678 9.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.799 -17.833 10.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.704 -17.088 12.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.851 -16.152 11.173 1.00 0.00 H new ATOM 1403 N VAL A 91 2.626 -13.432 5.571 1.00 0.00 N ATOM 1404 CA VAL A 91 1.752 -13.226 4.424 1.00 0.00 C ATOM 1405 C VAL A 91 1.316 -14.556 3.844 1.00 0.00 C ATOM 1406 O VAL A 91 2.146 -15.435 3.607 1.00 0.00 O ATOM 1407 CB VAL A 91 2.428 -12.449 3.277 1.00 0.00 C ATOM 1408 CG1 VAL A 91 1.393 -11.698 2.451 1.00 0.00 C ATOM 1409 CG2 VAL A 91 3.503 -11.512 3.784 1.00 0.00 C ATOM 0 H VAL A 91 3.609 -13.577 5.341 1.00 0.00 H new ATOM 0 HA VAL A 91 0.910 -12.648 4.805 1.00 0.00 H new ATOM 0 HB VAL A 91 2.918 -13.179 2.633 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.892 -11.157 1.647 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.683 -12.407 2.025 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.861 -10.992 3.089 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.953 -10.985 2.943 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.062 -10.790 4.471 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.270 -12.086 4.305 1.00 0.00 H new ATOM 1419 N ASP A 92 0.027 -14.715 3.610 1.00 0.00 N ATOM 1420 CA ASP A 92 -0.428 -15.826 2.797 1.00 0.00 C ATOM 1421 C ASP A 92 -0.312 -15.406 1.341 1.00 0.00 C ATOM 1422 O ASP A 92 -1.267 -14.907 0.747 1.00 0.00 O ATOM 1423 CB ASP A 92 -1.868 -16.227 3.131 1.00 0.00 C ATOM 1424 CG ASP A 92 -2.224 -17.608 2.613 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -2.357 -17.781 1.379 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.384 -18.535 3.443 1.00 0.00 O ATOM 0 H ASP A 92 -0.709 -14.104 3.963 1.00 0.00 H new ATOM 0 HA ASP A 92 0.189 -16.702 2.998 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -2.007 -16.201 4.212 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.553 -15.495 2.704 1.00 0.00 H new ATOM 1431 N PHE A 93 0.889 -15.557 0.793 1.00 0.00 N ATOM 1432 CA PHE A 93 1.197 -15.083 -0.553 1.00 0.00 C ATOM 1433 C PHE A 93 0.333 -15.776 -1.604 1.00 0.00 C ATOM 1434 O PHE A 93 0.151 -15.260 -2.706 1.00 0.00 O ATOM 1435 CB PHE A 93 2.680 -15.293 -0.871 1.00 0.00 C ATOM 1436 CG PHE A 93 3.588 -14.180 -0.430 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.827 -13.099 -1.262 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.217 -14.225 0.800 1.00 0.00 C ATOM 1439 CE1 PHE A 93 4.675 -12.081 -0.873 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.071 -13.212 1.195 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.298 -12.137 0.358 1.00 0.00 C ATOM 0 H PHE A 93 1.672 -16.008 1.265 1.00 0.00 H new ATOM 0 HA PHE A 93 0.974 -14.017 -0.583 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.010 -16.219 -0.400 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.790 -15.427 -1.947 1.00 0.00 H new ATOM 0 HD1 PHE A 93 3.344 -13.052 -2.227 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.039 -15.061 1.460 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.851 -11.242 -1.530 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.560 -13.261 2.157 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.961 -11.342 0.666 1.00 0.00 H new ATOM 1451 N LYS A 94 -0.205 -16.939 -1.262 1.00 0.00 N ATOM 1452 CA LYS A 94 -1.101 -17.646 -2.164 1.00 0.00 C ATOM 1453 C LYS A 94 -2.461 -16.953 -2.217 1.00 0.00 C ATOM 1454 O LYS A 94 -3.062 -16.827 -3.286 1.00 0.00 O ATOM 1455 CB LYS A 94 -1.262 -19.107 -1.743 1.00 0.00 C ATOM 1456 CG LYS A 94 0.035 -19.895 -1.795 1.00 0.00 C ATOM 1457 CD LYS A 94 -0.218 -21.392 -1.743 1.00 0.00 C ATOM 1458 CE LYS A 94 -0.966 -21.863 -2.980 1.00 0.00 C ATOM 1459 NZ LYS A 94 -1.198 -23.328 -2.964 1.00 0.00 N ATOM 0 H LYS A 94 -0.038 -17.409 -0.373 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.661 -17.628 -3.161 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.661 -19.144 -0.729 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.996 -19.586 -2.391 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.575 -19.648 -2.709 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.672 -19.604 -0.960 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.731 -21.922 -1.664 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.794 -21.636 -0.851 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.923 -21.345 -3.044 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.398 -21.595 -3.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.711 -23.608 -3.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.284 -23.824 -2.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.762 -23.581 -2.128 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.942 -16.504 -1.062 1.00 0.00 N ATOM 1474 CA ALA A 95 -4.167 -15.715 -1.000 1.00 0.00 C ATOM 1475 C ALA A 95 -3.914 -14.312 -1.538 1.00 0.00 C ATOM 1476 O ALA A 95 -4.826 -13.642 -2.024 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.698 -15.651 0.426 1.00 0.00 C ATOM 0 H ALA A 95 -2.503 -16.673 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.921 -16.199 -1.620 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.612 -15.057 0.448 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.912 -16.659 0.780 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.951 -15.190 1.072 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.655 -13.886 -1.459 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.231 -12.589 -1.980 1.00 0.00 C ATOM 1485 C LEU A 96 -2.506 -12.501 -3.479 1.00 0.00 C ATOM 1486 O LEU A 96 -2.729 -11.420 -4.018 1.00 0.00 O ATOM 1487 CB LEU A 96 -0.737 -12.384 -1.728 1.00 0.00 C ATOM 1488 CG LEU A 96 -0.227 -10.961 -1.950 1.00 0.00 C ATOM 1489 CD1 LEU A 96 -0.490 -10.111 -0.720 1.00 0.00 C ATOM 1490 CD2 LEU A 96 1.255 -10.969 -2.294 1.00 0.00 C ATOM 0 H LEU A 96 -1.903 -14.428 -1.034 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.797 -11.812 -1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.515 -12.676 -0.702 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.180 -13.058 -2.379 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.766 -10.526 -2.792 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.122 -9.099 -0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.561 -10.079 -0.522 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.024 -10.544 0.138 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.598 -9.946 -2.448 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.816 -11.421 -1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.414 -11.546 -3.205 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.514 -13.656 -4.137 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.749 -13.735 -5.576 1.00 0.00 C ATOM 1504 C GLN A 97 -4.175 -13.332 -5.947 1.00 0.00 C ATOM 1505 O GLN A 97 -4.529 -13.279 -7.125 1.00 0.00 O ATOM 1506 CB GLN A 97 -2.452 -15.144 -6.083 1.00 0.00 C ATOM 1507 CG GLN A 97 -0.967 -15.444 -6.184 1.00 0.00 C ATOM 1508 CD GLN A 97 -0.275 -14.546 -7.190 1.00 0.00 C ATOM 1509 OE1 GLN A 97 0.209 -13.466 -6.851 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -0.241 -14.977 -8.440 1.00 0.00 N ATOM 0 H GLN A 97 -2.359 -14.560 -3.691 1.00 0.00 H new ATOM 0 HA GLN A 97 -2.073 -13.027 -6.056 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -2.918 -15.869 -5.415 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.910 -15.274 -7.064 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.504 -15.317 -5.205 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -0.826 -16.486 -6.471 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -0.654 -15.878 -8.680 1.00 0.00 H new ATOM 0 HE22 GLN A 97 0.198 -14.408 -9.164 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.991 -13.061 -4.941 1.00 0.00 N ATOM 1520 CA GLY A 98 -6.323 -12.562 -5.194 1.00 0.00 C ATOM 1521 C GLY A 98 -6.338 -11.054 -5.342 1.00 0.00 C ATOM 1522 O GLY A 98 -7.251 -10.492 -5.947 1.00 0.00 O ATOM 0 H GLY A 98 -4.754 -13.178 -3.956 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -6.717 -13.021 -6.101 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.982 -12.854 -4.377 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.313 -10.397 -4.805 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.252 -8.937 -4.804 1.00 0.00 C ATOM 1528 C ILE A 99 -3.941 -8.420 -5.394 1.00 0.00 C ATOM 1529 O ILE A 99 -3.674 -7.218 -5.361 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.390 -8.368 -3.374 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -4.272 -8.913 -2.476 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.761 -8.693 -2.795 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -4.209 -8.259 -1.114 1.00 0.00 C ATOM 0 H ILE A 99 -4.513 -10.852 -4.365 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.085 -8.602 -5.421 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.295 -7.283 -3.420 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -4.413 -9.986 -2.347 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.315 -8.775 -2.979 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.837 -8.283 -1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.535 -8.254 -3.425 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.893 -9.774 -2.758 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -3.394 -8.697 -0.537 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.036 -7.189 -1.232 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.151 -8.419 -0.590 1.00 0.00 H new ATOM 1648 N ASP A 108 8.463 -10.333 -8.374 1.00 0.00 N ATOM 1649 CA ASP A 108 8.650 -9.684 -7.082 1.00 0.00 C ATOM 1650 C ASP A 108 7.868 -10.432 -6.010 1.00 0.00 C ATOM 1651 O ASP A 108 8.424 -10.848 -4.987 1.00 0.00 O ATOM 1652 CB ASP A 108 8.196 -8.218 -7.175 1.00 0.00 C ATOM 1653 CG ASP A 108 8.075 -7.534 -5.825 1.00 0.00 C ATOM 1654 OD1 ASP A 108 9.116 -7.228 -5.203 1.00 0.00 O ATOM 1655 OD2 ASP A 108 6.930 -7.288 -5.393 1.00 0.00 O ATOM 0 HA ASP A 108 9.705 -9.703 -6.808 1.00 0.00 H new ATOM 0 HB2 ASP A 108 8.905 -7.665 -7.791 1.00 0.00 H new ATOM 0 HB3 ASP A 108 7.232 -8.176 -7.682 1.00 0.00 H new ATOM 1660 N ALA A 109 6.587 -10.646 -6.282 1.00 0.00 N ATOM 1661 CA ALA A 109 5.708 -11.356 -5.363 1.00 0.00 C ATOM 1662 C ALA A 109 6.112 -12.822 -5.220 1.00 0.00 C ATOM 1663 O ALA A 109 6.111 -13.368 -4.116 1.00 0.00 O ATOM 1664 CB ALA A 109 4.264 -11.246 -5.831 1.00 0.00 C ATOM 0 H ALA A 109 6.131 -10.335 -7.140 1.00 0.00 H new ATOM 0 HA ALA A 109 5.802 -10.891 -4.382 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.615 -11.780 -5.137 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.972 -10.196 -5.866 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.170 -11.683 -6.825 1.00 0.00 H new ATOM 1670 N LYS A 110 6.467 -13.455 -6.336 1.00 0.00 N ATOM 1671 CA LYS A 110 6.816 -14.876 -6.330 1.00 0.00 C ATOM 1672 C LYS A 110 8.106 -15.130 -5.551 1.00 0.00 C ATOM 1673 O LYS A 110 8.226 -16.127 -4.838 1.00 0.00 O ATOM 1674 CB LYS A 110 6.975 -15.407 -7.757 1.00 0.00 C ATOM 1675 CG LYS A 110 5.712 -15.323 -8.600 1.00 0.00 C ATOM 1676 CD LYS A 110 5.910 -15.993 -9.950 1.00 0.00 C ATOM 1677 CE LYS A 110 4.698 -15.814 -10.849 1.00 0.00 C ATOM 1678 NZ LYS A 110 4.815 -16.617 -12.096 1.00 0.00 N ATOM 0 H LYS A 110 6.521 -13.010 -7.252 1.00 0.00 H new ATOM 0 HA LYS A 110 5.999 -15.404 -5.839 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.768 -14.848 -8.254 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.299 -16.447 -7.711 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.886 -15.799 -8.072 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.437 -14.278 -8.746 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.790 -15.575 -10.438 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.101 -17.056 -9.804 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.798 -16.109 -10.309 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.586 -14.760 -11.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.970 -16.470 -12.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.660 -16.318 -12.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.896 -17.625 -11.853 1.00 0.00 H new ATOM 1692 N LYS A 111 9.069 -14.229 -5.699 1.00 0.00 N ATOM 1693 CA LYS A 111 10.359 -14.369 -5.032 1.00 0.00 C ATOM 1694 C LYS A 111 10.241 -14.101 -3.542 1.00 0.00 C ATOM 1695 O LYS A 111 10.983 -14.666 -2.738 1.00 0.00 O ATOM 1696 CB LYS A 111 11.374 -13.400 -5.632 1.00 0.00 C ATOM 1697 CG LYS A 111 12.503 -14.073 -6.390 1.00 0.00 C ATOM 1698 CD LYS A 111 11.995 -14.876 -7.574 1.00 0.00 C ATOM 1699 CE LYS A 111 13.142 -15.281 -8.483 1.00 0.00 C ATOM 1700 NZ LYS A 111 13.753 -14.100 -9.151 1.00 0.00 N ATOM 0 H LYS A 111 8.982 -13.392 -6.276 1.00 0.00 H new ATOM 0 HA LYS A 111 10.695 -15.395 -5.180 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.855 -12.718 -6.306 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.799 -12.795 -4.831 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.206 -13.317 -6.740 1.00 0.00 H new ATOM 0 HG3 LYS A 111 13.051 -14.730 -5.715 1.00 0.00 H new ATOM 0 HD2 LYS A 111 11.475 -15.766 -7.219 1.00 0.00 H new ATOM 0 HD3 LYS A 111 11.271 -14.286 -8.136 1.00 0.00 H new ATOM 0 HE2 LYS A 111 13.901 -15.804 -7.901 1.00 0.00 H new ATOM 0 HE3 LYS A 111 12.780 -15.980 -9.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.266 -14.409 -10.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 13.006 -13.429 -9.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.415 -13.635 -8.497 1.00 0.00 H new ATOM 1714 N GLY A 112 9.304 -13.243 -3.181 1.00 0.00 N ATOM 1715 CA GLY A 112 9.186 -12.817 -1.808 1.00 0.00 C ATOM 1716 C GLY A 112 9.770 -11.439 -1.623 1.00 0.00 C ATOM 1717 O GLY A 112 10.979 -11.243 -1.791 1.00 0.00 O ATOM 0 H GLY A 112 8.621 -12.833 -3.818 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.137 -12.815 -1.512 1.00 0.00 H new ATOM 0 HA3 GLY A 112 9.700 -13.525 -1.157 1.00 0.00 H new ATOM 1721 N ILE A 113 8.917 -10.482 -1.295 1.00 0.00 N ATOM 1722 CA ILE A 113 9.323 -9.091 -1.206 1.00 0.00 C ATOM 1723 C ILE A 113 10.378 -8.880 -0.125 1.00 0.00 C ATOM 1724 O ILE A 113 10.191 -9.242 1.035 1.00 0.00 O ATOM 1725 CB ILE A 113 8.119 -8.142 -0.971 1.00 0.00 C ATOM 1726 CG1 ILE A 113 7.344 -7.893 -2.275 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.592 -6.815 -0.399 1.00 0.00 C ATOM 1728 CD1 ILE A 113 6.756 -9.134 -2.914 1.00 0.00 C ATOM 0 H ILE A 113 7.932 -10.646 -1.085 1.00 0.00 H new ATOM 0 HA ILE A 113 9.763 -8.840 -2.171 1.00 0.00 H new ATOM 0 HB ILE A 113 7.452 -8.626 -0.258 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.537 -7.189 -2.072 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.012 -7.414 -2.992 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.735 -6.161 -0.240 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.097 -6.988 0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.283 -6.344 -1.097 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.229 -8.858 -3.827 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.557 -9.834 -3.154 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.059 -9.605 -2.221 1.00 0.00 H new ATOM 1740 N THR A 114 11.494 -8.312 -0.541 1.00 0.00 N ATOM 1741 CA THR A 114 12.574 -7.956 0.353 1.00 0.00 C ATOM 1742 C THR A 114 12.940 -6.493 0.133 1.00 0.00 C ATOM 1743 O THR A 114 12.409 -5.861 -0.782 1.00 0.00 O ATOM 1744 CB THR A 114 13.797 -8.854 0.104 1.00 0.00 C ATOM 1745 OG1 THR A 114 13.662 -9.491 -1.176 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.933 -9.909 1.190 1.00 0.00 C ATOM 0 H THR A 114 11.676 -8.084 -1.518 1.00 0.00 H new ATOM 0 HA THR A 114 12.252 -8.101 1.384 1.00 0.00 H new ATOM 0 HB THR A 114 14.693 -8.234 0.121 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.440 -10.064 -1.340 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.806 -10.529 0.988 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.050 -9.422 2.158 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.040 -10.534 1.204 1.00 0.00 H new ATOM 1754 N MET A 115 13.830 -5.958 0.953 1.00 0.00 N ATOM 1755 CA MET A 115 14.208 -4.555 0.834 1.00 0.00 C ATOM 1756 C MET A 115 14.940 -4.324 -0.478 1.00 0.00 C ATOM 1757 O MET A 115 14.719 -3.319 -1.155 1.00 0.00 O ATOM 1758 CB MET A 115 15.083 -4.123 2.008 1.00 0.00 C ATOM 1759 CG MET A 115 15.274 -2.619 2.089 1.00 0.00 C ATOM 1760 SD MET A 115 13.710 -1.748 2.299 1.00 0.00 S ATOM 1761 CE MET A 115 14.272 -0.050 2.323 1.00 0.00 C ATOM 0 H MET A 115 14.301 -6.466 1.702 1.00 0.00 H new ATOM 0 HA MET A 115 13.300 -3.953 0.848 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.635 -4.476 2.937 1.00 0.00 H new ATOM 0 HB3 MET A 115 16.058 -4.603 1.922 1.00 0.00 H new ATOM 0 HG2 MET A 115 15.935 -2.382 2.923 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.766 -2.267 1.182 1.00 0.00 H new ATOM 0 HE1 MET A 115 13.950 0.427 3.249 1.00 0.00 H new ATOM 0 HE2 MET A 115 15.360 -0.026 2.262 1.00 0.00 H new ATOM 0 HE3 MET A 115 13.849 0.485 1.473 1.00 0.00 H new ATOM 1771 N ALA A 116 15.803 -5.272 -0.840 1.00 0.00 N ATOM 1772 CA ALA A 116 16.500 -5.229 -2.117 1.00 0.00 C ATOM 1773 C ALA A 116 15.503 -5.098 -3.263 1.00 0.00 C ATOM 1774 O ALA A 116 15.639 -4.216 -4.125 1.00 0.00 O ATOM 1775 CB ALA A 116 17.357 -6.473 -2.295 1.00 0.00 C ATOM 0 H ALA A 116 16.034 -6.080 -0.262 1.00 0.00 H new ATOM 0 HA ALA A 116 17.153 -4.356 -2.127 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.872 -6.426 -3.255 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.092 -6.527 -1.491 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.723 -7.359 -2.267 1.00 0.00 H new ATOM 1781 N GLN A 117 14.486 -5.966 -3.261 1.00 0.00 N ATOM 1782 CA GLN A 117 13.434 -5.888 -4.260 1.00 0.00 C ATOM 1783 C GLN A 117 12.750 -4.544 -4.195 1.00 0.00 C ATOM 1784 O GLN A 117 12.880 -3.782 -5.114 1.00 0.00 O ATOM 1785 CB GLN A 117 12.412 -7.022 -4.140 1.00 0.00 C ATOM 1786 CG GLN A 117 12.897 -8.304 -4.791 1.00 0.00 C ATOM 1787 CD GLN A 117 11.819 -9.356 -4.986 1.00 0.00 C ATOM 1788 OE1 GLN A 117 11.923 -10.202 -5.876 1.00 0.00 O ATOM 1789 NE2 GLN A 117 10.765 -9.292 -4.193 1.00 0.00 N ATOM 0 H GLN A 117 14.376 -6.720 -2.583 1.00 0.00 H new ATOM 0 HA GLN A 117 13.911 -6.004 -5.233 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.201 -7.209 -3.087 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.474 -6.714 -4.603 1.00 0.00 H new ATOM 0 HG2 GLN A 117 13.332 -8.063 -5.761 1.00 0.00 H new ATOM 0 HG3 GLN A 117 13.695 -8.728 -4.181 1.00 0.00 H new ATOM 0 HE21 GLN A 117 10.715 -8.577 -3.467 1.00 0.00 H new ATOM 0 HE22 GLN A 117 10.000 -9.958 -4.306 1.00 0.00 H new ATOM 1798 N MET A 118 12.078 -4.245 -3.088 1.00 0.00 N ATOM 1799 CA MET A 118 11.332 -2.990 -2.939 1.00 0.00 C ATOM 1800 C MET A 118 12.052 -1.786 -3.547 1.00 0.00 C ATOM 1801 O MET A 118 11.484 -1.089 -4.382 1.00 0.00 O ATOM 1802 CB MET A 118 11.016 -2.723 -1.467 1.00 0.00 C ATOM 1803 CG MET A 118 9.710 -3.355 -1.025 1.00 0.00 C ATOM 1804 SD MET A 118 8.289 -2.625 -1.862 1.00 0.00 S ATOM 1805 CE MET A 118 7.040 -3.869 -1.567 1.00 0.00 C ATOM 0 H MET A 118 12.032 -4.856 -2.273 1.00 0.00 H new ATOM 0 HA MET A 118 10.404 -3.118 -3.496 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.828 -3.107 -0.850 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.969 -1.647 -1.299 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.739 -4.426 -1.227 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.596 -3.237 0.053 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.081 -3.519 -1.948 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.318 -4.792 -2.076 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.958 -4.056 -0.496 1.00 0.00 H new ATOM 1815 N GLU A 119 13.303 -1.563 -3.168 1.00 0.00 N ATOM 1816 CA GLU A 119 14.047 -0.404 -3.657 1.00 0.00 C ATOM 1817 C GLU A 119 14.182 -0.413 -5.186 1.00 0.00 C ATOM 1818 O GLU A 119 13.855 0.575 -5.850 1.00 0.00 O ATOM 1819 CB GLU A 119 15.427 -0.349 -3.004 1.00 0.00 C ATOM 1820 CG GLU A 119 15.376 -0.206 -1.489 1.00 0.00 C ATOM 1821 CD GLU A 119 14.672 1.060 -1.038 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.340 2.107 -0.928 1.00 0.00 O ATOM 1823 OE2 GLU A 119 13.451 1.016 -0.777 1.00 0.00 O ATOM 0 H GLU A 119 13.823 -2.163 -2.528 1.00 0.00 H new ATOM 0 HA GLU A 119 13.483 0.488 -3.383 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.977 -1.256 -3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.985 0.489 -3.422 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.865 -1.070 -1.065 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.392 -0.211 -1.094 1.00 0.00 H new ATOM 1830 N LEU A 120 14.641 -1.528 -5.751 1.00 0.00 N ATOM 1831 CA LEU A 120 14.864 -1.608 -7.200 1.00 0.00 C ATOM 1832 C LEU A 120 13.542 -1.729 -7.964 1.00 0.00 C ATOM 1833 O LEU A 120 13.431 -1.321 -9.117 1.00 0.00 O ATOM 1834 CB LEU A 120 15.766 -2.798 -7.530 1.00 0.00 C ATOM 1835 CG LEU A 120 17.164 -2.744 -6.914 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.957 -3.992 -7.277 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.896 -1.490 -7.371 1.00 0.00 C ATOM 0 H LEU A 120 14.865 -2.381 -5.238 1.00 0.00 H new ATOM 0 HA LEU A 120 15.353 -0.685 -7.513 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.274 -3.711 -7.195 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.866 -2.869 -8.613 1.00 0.00 H new ATOM 0 HG LEU A 120 17.064 -2.708 -5.829 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.949 -3.935 -6.830 1.00 0.00 H new ATOM 0 HD12 LEU A 120 17.439 -4.874 -6.901 1.00 0.00 H new ATOM 0 HD13 LEU A 120 18.051 -4.061 -8.361 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.890 -1.466 -6.924 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.987 -1.497 -8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.336 -0.608 -7.059 1.00 0.00 H new ATOM 1849 N VAL A 121 12.553 -2.273 -7.290 1.00 0.00 N ATOM 1850 CA VAL A 121 11.249 -2.563 -7.859 1.00 0.00 C ATOM 1851 C VAL A 121 10.400 -1.296 -7.915 1.00 0.00 C ATOM 1852 O VAL A 121 9.690 -1.056 -8.896 1.00 0.00 O ATOM 1853 CB VAL A 121 10.559 -3.683 -7.032 1.00 0.00 C ATOM 1854 CG1 VAL A 121 9.074 -3.772 -7.286 1.00 0.00 C ATOM 1855 CG2 VAL A 121 11.194 -5.031 -7.333 1.00 0.00 C ATOM 0 H VAL A 121 12.632 -2.533 -6.307 1.00 0.00 H new ATOM 0 HA VAL A 121 11.367 -2.919 -8.882 1.00 0.00 H new ATOM 0 HB VAL A 121 10.702 -3.421 -5.984 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.649 -4.572 -6.680 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.602 -2.826 -7.021 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.897 -3.982 -8.341 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.700 -5.805 -6.746 1.00 0.00 H new ATOM 0 HG22 VAL A 121 11.086 -5.255 -8.394 1.00 0.00 H new ATOM 0 HG23 VAL A 121 12.253 -5.000 -7.075 1.00 0.00 H new ATOM 1865 N MET A 122 10.500 -0.463 -6.879 1.00 0.00 N ATOM 1866 CA MET A 122 9.862 0.849 -6.902 1.00 0.00 C ATOM 1867 C MET A 122 10.481 1.683 -8.013 1.00 0.00 C ATOM 1868 O MET A 122 9.781 2.377 -8.752 1.00 0.00 O ATOM 1869 CB MET A 122 10.026 1.590 -5.566 1.00 0.00 C ATOM 1870 CG MET A 122 9.373 0.919 -4.361 1.00 0.00 C ATOM 1871 SD MET A 122 7.607 0.627 -4.566 1.00 0.00 S ATOM 1872 CE MET A 122 7.599 -1.036 -5.230 1.00 0.00 C ATOM 0 H MET A 122 11.012 -0.672 -6.022 1.00 0.00 H new ATOM 0 HA MET A 122 8.796 0.702 -7.075 1.00 0.00 H new ATOM 0 HB2 MET A 122 11.091 1.707 -5.363 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.610 2.592 -5.672 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.870 -0.032 -4.172 1.00 0.00 H new ATOM 0 HG3 MET A 122 9.530 1.541 -3.480 1.00 0.00 H new ATOM 0 HE1 MET A 122 7.396 -0.999 -6.300 1.00 0.00 H new ATOM 0 HE2 MET A 122 8.571 -1.500 -5.061 1.00 0.00 H new ATOM 0 HE3 MET A 122 6.826 -1.622 -4.733 1.00 0.00 H new ATOM 1882 N LYS A 123 11.804 1.591 -8.127 1.00 0.00 N ATOM 1883 CA LYS A 123 12.548 2.303 -9.156 1.00 0.00 C ATOM 1884 C LYS A 123 12.155 1.803 -10.547 1.00 0.00 C ATOM 1885 O LYS A 123 12.040 2.584 -11.489 1.00 0.00 O ATOM 1886 CB LYS A 123 14.054 2.111 -8.936 1.00 0.00 C ATOM 1887 CG LYS A 123 14.929 3.091 -9.702 1.00 0.00 C ATOM 1888 CD LYS A 123 14.710 4.517 -9.222 1.00 0.00 C ATOM 1889 CE LYS A 123 15.705 5.485 -9.843 1.00 0.00 C ATOM 1890 NZ LYS A 123 15.613 5.512 -11.326 1.00 0.00 N ATOM 0 H LYS A 123 12.385 1.023 -7.511 1.00 0.00 H new ATOM 0 HA LYS A 123 12.307 3.364 -9.089 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.269 2.206 -7.872 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.325 1.096 -9.227 1.00 0.00 H new ATOM 0 HG2 LYS A 123 15.977 2.820 -9.578 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.707 3.025 -10.767 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.696 4.831 -9.469 1.00 0.00 H new ATOM 0 HD3 LYS A 123 14.799 4.552 -8.136 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.527 6.487 -9.452 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.716 5.203 -9.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.223 6.268 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.923 4.596 -11.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.628 5.691 -11.610 1.00 0.00 H new ATOM 1904 N ALA A 124 11.947 0.493 -10.659 1.00 0.00 N ATOM 1905 CA ALA A 124 11.569 -0.129 -11.924 1.00 0.00 C ATOM 1906 C ALA A 124 10.206 0.368 -12.400 1.00 0.00 C ATOM 1907 O ALA A 124 10.044 0.744 -13.562 1.00 0.00 O ATOM 1908 CB ALA A 124 11.562 -1.644 -11.781 1.00 0.00 C ATOM 0 H ALA A 124 12.035 -0.162 -9.882 1.00 0.00 H new ATOM 0 HA ALA A 124 12.307 0.153 -12.675 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.279 -2.098 -12.731 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.557 -1.987 -11.497 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.845 -1.934 -11.012 1.00 0.00 H new ATOM 1914 N ALA A 125 9.231 0.377 -11.497 1.00 0.00 N ATOM 1915 CA ALA A 125 7.890 0.842 -11.830 1.00 0.00 C ATOM 1916 C ALA A 125 7.871 2.352 -12.019 1.00 0.00 C ATOM 1917 O ALA A 125 7.107 2.882 -12.826 1.00 0.00 O ATOM 1918 CB ALA A 125 6.902 0.438 -10.748 1.00 0.00 C ATOM 0 H ALA A 125 9.344 0.068 -10.531 1.00 0.00 H new ATOM 0 HA ALA A 125 7.594 0.373 -12.769 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.906 0.793 -11.013 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.887 -0.648 -10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.203 0.878 -9.798 1.00 0.00 H new ATOM 1924 N GLY A 126 8.722 3.038 -11.275 1.00 0.00 N ATOM 1925 CA GLY A 126 8.771 4.478 -11.352 1.00 0.00 C ATOM 1926 C GLY A 126 7.945 5.126 -10.266 1.00 0.00 C ATOM 1927 O GLY A 126 7.271 6.132 -10.500 1.00 0.00 O ATOM 0 H GLY A 126 9.381 2.621 -10.618 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.805 4.811 -11.270 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.408 4.802 -12.327 1.00 0.00 H new ATOM 1931 N PHE A 127 7.982 4.536 -9.083 1.00 0.00 N ATOM 1932 CA PHE A 127 7.290 5.088 -7.933 1.00 0.00 C ATOM 1933 C PHE A 127 8.159 6.150 -7.276 1.00 0.00 C ATOM 1934 O PHE A 127 9.385 6.048 -7.282 1.00 0.00 O ATOM 1935 CB PHE A 127 6.942 3.991 -6.925 1.00 0.00 C ATOM 1936 CG PHE A 127 5.940 2.992 -7.431 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.737 3.411 -7.974 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.193 1.634 -7.350 1.00 0.00 C ATOM 1939 CE1 PHE A 127 3.807 2.494 -8.427 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.268 0.713 -7.802 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.073 1.143 -8.341 1.00 0.00 C ATOM 0 H PHE A 127 8.487 3.670 -8.895 1.00 0.00 H new ATOM 0 HA PHE A 127 6.358 5.541 -8.272 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.855 3.465 -6.646 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.552 4.455 -6.019 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.523 4.467 -8.044 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.126 1.290 -6.928 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.873 2.835 -8.848 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.480 -0.344 -7.733 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.348 0.424 -8.694 1.00 0.00 H new ATOM 1951 N LYS A 128 7.526 7.164 -6.715 1.00 0.00 N ATOM 1952 CA LYS A 128 8.255 8.282 -6.146 1.00 0.00 C ATOM 1953 C LYS A 128 8.271 8.202 -4.626 1.00 0.00 C ATOM 1954 O LYS A 128 7.223 8.096 -3.983 1.00 0.00 O ATOM 1955 CB LYS A 128 7.637 9.596 -6.617 1.00 0.00 C ATOM 1956 CG LYS A 128 8.409 10.832 -6.182 1.00 0.00 C ATOM 1957 CD LYS A 128 7.952 12.057 -6.952 1.00 0.00 C ATOM 1958 CE LYS A 128 8.186 11.885 -8.444 1.00 0.00 C ATOM 1959 NZ LYS A 128 7.661 13.030 -9.227 1.00 0.00 N ATOM 0 H LYS A 128 6.511 7.236 -6.641 1.00 0.00 H new ATOM 0 HA LYS A 128 9.289 8.239 -6.489 1.00 0.00 H new ATOM 0 HB2 LYS A 128 7.571 9.585 -7.705 1.00 0.00 H new ATOM 0 HB3 LYS A 128 6.618 9.664 -6.236 1.00 0.00 H new ATOM 0 HG2 LYS A 128 8.268 10.996 -5.114 1.00 0.00 H new ATOM 0 HG3 LYS A 128 9.476 10.674 -6.342 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.893 12.234 -6.765 1.00 0.00 H new ATOM 0 HD3 LYS A 128 8.489 12.936 -6.595 1.00 0.00 H new ATOM 0 HE2 LYS A 128 9.254 11.777 -8.633 1.00 0.00 H new ATOM 0 HE3 LYS A 128 7.708 10.966 -8.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 7.842 12.871 -10.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 6.637 13.119 -9.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.135 13.904 -8.924 1.00 0.00 H new ATOM 1973 N GLU A 129 9.470 8.243 -4.064 1.00 0.00 N ATOM 1974 CA GLU A 129 9.647 8.164 -2.626 1.00 0.00 C ATOM 1975 C GLU A 129 9.210 9.454 -1.951 1.00 0.00 C ATOM 1976 O GLU A 129 9.382 10.545 -2.495 1.00 0.00 O ATOM 1977 CB GLU A 129 11.108 7.896 -2.278 1.00 0.00 C ATOM 1978 CG GLU A 129 11.666 6.617 -2.867 1.00 0.00 C ATOM 1979 CD GLU A 129 13.089 6.377 -2.420 1.00 0.00 C ATOM 1980 OE1 GLU A 129 13.278 5.797 -1.336 1.00 0.00 O ATOM 1981 OE2 GLU A 129 14.022 6.797 -3.130 1.00 0.00 O ATOM 0 H GLU A 129 10.340 8.331 -4.589 1.00 0.00 H new ATOM 0 HA GLU A 129 9.028 7.342 -2.266 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.711 8.735 -2.625 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.209 7.857 -1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 129 11.042 5.775 -2.567 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.629 6.670 -3.955 1.00 0.00 H new ATOM 1988 N VAL A 130 8.642 9.319 -0.767 1.00 0.00 N ATOM 1989 CA VAL A 130 8.307 10.469 0.051 1.00 0.00 C ATOM 1990 C VAL A 130 9.335 10.613 1.167 1.00 0.00 C ATOM 1991 O VAL A 130 9.680 11.723 1.567 1.00 0.00 O ATOM 1992 CB VAL A 130 6.891 10.341 0.657 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.543 11.561 1.496 1.00 0.00 C ATOM 1994 CG2 VAL A 130 5.858 10.137 -0.437 1.00 0.00 C ATOM 0 H VAL A 130 8.402 8.420 -0.349 1.00 0.00 H new ATOM 0 HA VAL A 130 8.319 11.355 -0.584 1.00 0.00 H new ATOM 0 HB VAL A 130 6.883 9.468 1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.542 11.444 1.910 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.262 11.661 2.309 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.575 12.454 0.871 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.868 10.049 0.010 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.875 10.989 -1.117 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.089 9.227 -0.990 1.00 0.00 H new ATOM 2004 N LYS A 131 9.824 9.465 1.652 1.00 0.00 N ATOM 2005 CA LYS A 131 10.793 9.417 2.751 1.00 0.00 C ATOM 2006 C LYS A 131 10.233 10.101 3.996 1.00 0.00 C ATOM 2007 O LYS A 131 10.986 10.562 4.851 1.00 0.00 O ATOM 2008 CB LYS A 131 12.127 10.062 2.346 1.00 0.00 C ATOM 2009 CG LYS A 131 12.906 9.281 1.292 1.00 0.00 C ATOM 2010 CD LYS A 131 14.302 9.860 1.098 1.00 0.00 C ATOM 2011 CE LYS A 131 15.134 9.046 0.113 1.00 0.00 C ATOM 2012 NZ LYS A 131 14.608 9.130 -1.275 1.00 0.00 N ATOM 0 H LYS A 131 9.560 8.547 1.294 1.00 0.00 H new ATOM 0 HA LYS A 131 10.979 8.368 2.982 1.00 0.00 H new ATOM 0 HB2 LYS A 131 11.932 11.066 1.968 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.749 10.171 3.234 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.981 8.236 1.592 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.365 9.303 0.346 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.221 10.886 0.740 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.814 9.897 2.059 1.00 0.00 H new ATOM 0 HE2 LYS A 131 16.164 9.401 0.131 1.00 0.00 H new ATOM 0 HE3 LYS A 131 15.151 8.003 0.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 14.811 8.242 -1.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 13.580 9.285 -1.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.065 9.921 -1.772 1.00 0.00 H new