USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 983 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 ASN : amide:sc= 0.588 K(o=1.2,f=-3.2!) USER MOD Set 1.2: A 122 THR OG1 : rot 125:sc= 0.645 USER MOD Set 2.1: A 83 MET CE :methyl 157:sc= -0.192 (180deg=-1.2) USER MOD Set 2.2: A 85 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 63 THR OG1 : rot -66:sc= 0.823 USER MOD Set 3.2: A 76 LYS NZ :NH3+ -179:sc=-0.00728 (180deg=0) USER MOD Set 3.3: A 140 LYS NZ :NH3+ -124:sc= -1.38 (180deg=-2.12) USER MOD Set 4.1: A 62 HIS : no HE2:sc= -0.345 K(o=-11,f=-2.7) USER MOD Set 4.2: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 4.3: A 71 GLN : amide:sc= -10.8! C(o=-11!,f=-2.7!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 127:sc= -0.0729 (180deg=-0.559) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 164:sc= -0.0034 (180deg=-0.192) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 166:sc= -0.0102 (180deg=-0.342) USER MOD Single : A 30 TYR OH : rot -69:sc= -2.47! USER MOD Single : A 35 THR OG1 : rot -75:sc= 0.22 USER MOD Single : A 38 GLN : amide:sc= -11.8! C(o=-12!,f=-6.8!) USER MOD Single : A 40 ASN : amide:sc= -0.91 K(o=-0.91,f=-2.1!) USER MOD Single : A 44 SER OG : rot 23:sc= 0.424 USER MOD Single : A 49 ASN : amide:sc= -1.62 K(o=-1.6,f=-0.8) USER MOD Single : A 51 SER OG : rot 180:sc= 0.0632 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.455 USER MOD Single : A 69 ASN : amide:sc= -5.15! K(o=-5.1!,f=-0.85) USER MOD Single : A 73 THR OG1 : rot 67:sc= 0.384 USER MOD Single : A 74 ASN : amide:sc= -2.27 X(o=-2.3,f=-2.8!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -156:sc= -0.175 (180deg=-0.847) USER MOD Single : A 82 SER OG : rot 61:sc= -0.133 USER MOD Single : A 87 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.122) USER MOD Single : A 90 ASN : amide:sc= -1.14! C(o=-1.1!,f=-1.4!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -159:sc= -0.03 (180deg=-0.687) USER MOD Single : A 95 TYR OH : rot -130:sc= -0.0481 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 158:sc= 0 (180deg=-0.351) USER MOD Single : A 98 THR OG1 : rot -14:sc= 0.775 USER MOD Single : A 99 SER OG : rot 180:sc= -0.48 USER MOD Single : A 119 LYS NZ :NH3+ 149:sc= -0.288 (180deg=-3.81!) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 125 THR OG1 : rot 104:sc= 0.0586 USER MOD Single : A 126 CYS SG : rot -66:sc= -0.762! USER MOD Single : A 129 TYR OH : rot 141:sc= -2! USER MOD Single : A 130 ASN : amide:sc= -1.04 K(o=-1,f=-14!) USER MOD Single : A 132 LYS NZ :NH3+ 167:sc= -0.012 (180deg=-0.303) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -114:sc= -1.65 (180deg=-4.2!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.596 10.656 0.673 1.00 0.00 N ATOM 101 CA ILE A 7 11.106 10.659 0.799 1.00 0.00 C ATOM 102 C ILE A 7 10.630 12.118 0.905 1.00 0.00 C ATOM 103 O ILE A 7 10.627 12.687 1.978 1.00 0.00 O ATOM 104 CB ILE A 7 10.689 9.910 2.073 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.366 8.537 2.113 1.00 0.00 C ATOM 106 CG2 ILE A 7 9.165 9.723 2.083 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.814 7.726 3.283 1.00 0.00 C ATOM 0 HA ILE A 7 10.663 10.170 -0.069 1.00 0.00 H new ATOM 0 HB ILE A 7 10.994 10.490 2.944 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.192 8.007 1.176 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.445 8.655 2.217 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.870 9.191 2.987 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.679 10.698 2.060 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.863 9.147 1.208 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.297 6.749 3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.011 8.253 4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.739 7.595 3.160 1.00 0.00 H new ATOM 119 N PRO A 8 10.240 12.734 -0.192 1.00 0.00 N ATOM 120 CA PRO A 8 9.773 14.152 -0.185 1.00 0.00 C ATOM 121 C PRO A 8 8.813 14.451 0.972 1.00 0.00 C ATOM 122 O PRO A 8 8.308 13.555 1.620 1.00 0.00 O ATOM 123 CB PRO A 8 9.068 14.299 -1.537 1.00 0.00 C ATOM 124 CG PRO A 8 9.788 13.349 -2.436 1.00 0.00 C ATOM 125 CD PRO A 8 10.198 12.163 -1.555 1.00 0.00 C ATOM 0 HA PRO A 8 10.596 14.853 -0.044 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.009 14.050 -1.462 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.130 15.322 -1.908 1.00 0.00 H new ATOM 0 HG2 PRO A 8 9.146 13.024 -3.255 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.661 13.822 -2.885 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.480 11.346 -1.624 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.167 11.761 -1.851 1.00 0.00 H new ATOM 133 N LYS A 9 8.565 15.711 1.233 1.00 0.00 N ATOM 134 CA LYS A 9 7.640 16.104 2.345 1.00 0.00 C ATOM 135 C LYS A 9 6.394 16.762 1.751 1.00 0.00 C ATOM 136 O LYS A 9 5.399 16.949 2.424 1.00 0.00 O ATOM 137 CB LYS A 9 8.345 17.107 3.270 1.00 0.00 C ATOM 138 CG LYS A 9 9.697 16.538 3.761 1.00 0.00 C ATOM 139 CD LYS A 9 10.839 16.985 2.835 1.00 0.00 C ATOM 140 CE LYS A 9 12.180 16.533 3.416 1.00 0.00 C ATOM 141 NZ LYS A 9 13.286 17.246 2.716 1.00 0.00 N ATOM 0 H LYS A 9 8.968 16.494 0.718 1.00 0.00 H new ATOM 0 HA LYS A 9 7.358 15.218 2.914 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.510 18.045 2.740 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.707 17.332 4.125 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.893 16.877 4.778 1.00 0.00 H new ATOM 0 HG3 LYS A 9 9.650 15.449 3.791 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.701 16.561 1.840 1.00 0.00 H new ATOM 0 HD3 LYS A 9 10.827 18.069 2.724 1.00 0.00 H new ATOM 0 HE2 LYS A 9 12.216 16.743 4.485 1.00 0.00 H new ATOM 0 HE3 LYS A 9 12.295 15.455 3.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.199 16.941 3.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 13.254 17.024 1.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 13.177 18.272 2.850 1.00 0.00 H new ATOM 155 N ASP A 10 6.439 17.114 0.494 1.00 0.00 N ATOM 156 CA ASP A 10 5.257 17.760 -0.142 1.00 0.00 C ATOM 157 C ASP A 10 4.202 16.693 -0.441 1.00 0.00 C ATOM 158 O ASP A 10 4.334 15.914 -1.364 1.00 0.00 O ATOM 159 CB ASP A 10 5.688 18.438 -1.446 1.00 0.00 C ATOM 160 CG ASP A 10 6.401 19.756 -1.130 1.00 0.00 C ATOM 161 OD1 ASP A 10 7.339 19.726 -0.351 1.00 0.00 O ATOM 162 OD2 ASP A 10 5.997 20.771 -1.673 1.00 0.00 O ATOM 0 H ASP A 10 7.244 16.982 -0.119 1.00 0.00 H new ATOM 0 HA ASP A 10 4.838 18.508 0.531 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.351 17.780 -2.008 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.818 18.626 -2.075 1.00 0.00 H new ATOM 167 N LYS A 11 3.156 16.651 0.336 1.00 0.00 N ATOM 168 CA LYS A 11 2.094 15.636 0.105 1.00 0.00 C ATOM 169 C LYS A 11 1.560 15.759 -1.324 1.00 0.00 C ATOM 170 O LYS A 11 0.829 14.911 -1.796 1.00 0.00 O ATOM 171 CB LYS A 11 0.955 15.869 1.102 1.00 0.00 C ATOM 172 CG LYS A 11 1.531 16.132 2.519 1.00 0.00 C ATOM 173 CD LYS A 11 0.702 15.391 3.572 1.00 0.00 C ATOM 174 CE LYS A 11 1.175 15.790 4.970 1.00 0.00 C ATOM 175 NZ LYS A 11 0.849 17.225 5.212 1.00 0.00 N ATOM 0 H LYS A 11 2.991 17.278 1.123 1.00 0.00 H new ATOM 0 HA LYS A 11 2.507 14.637 0.244 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.351 16.718 0.783 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.297 15.000 1.124 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.569 15.802 2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.527 17.202 2.729 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -0.355 15.630 3.452 1.00 0.00 H new ATOM 0 HD3 LYS A 11 0.802 14.314 3.437 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.693 15.164 5.721 1.00 0.00 H new ATOM 0 HE3 LYS A 11 2.249 15.629 5.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.317 17.315 6.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.729 17.775 5.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.273 17.588 4.426 1.00 0.00 H new ATOM 189 N SER A 12 1.916 16.813 -2.016 1.00 0.00 N ATOM 190 CA SER A 12 1.428 17.004 -3.419 1.00 0.00 C ATOM 191 C SER A 12 2.540 16.640 -4.405 1.00 0.00 C ATOM 192 O SER A 12 2.622 17.188 -5.486 1.00 0.00 O ATOM 193 CB SER A 12 1.036 18.468 -3.621 1.00 0.00 C ATOM 194 OG SER A 12 0.098 18.844 -2.621 1.00 0.00 O ATOM 0 H SER A 12 2.526 17.553 -1.669 1.00 0.00 H new ATOM 0 HA SER A 12 0.565 16.362 -3.593 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.919 19.104 -3.565 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.604 18.608 -4.612 1.00 0.00 H new ATOM 0 HG SER A 12 -0.155 19.783 -2.746 1.00 0.00 H new ATOM 200 N LYS A 13 3.394 15.715 -4.044 1.00 0.00 N ATOM 201 CA LYS A 13 4.506 15.310 -4.960 1.00 0.00 C ATOM 202 C LYS A 13 4.715 13.796 -4.860 1.00 0.00 C ATOM 203 O LYS A 13 4.590 13.207 -3.804 1.00 0.00 O ATOM 204 CB LYS A 13 5.804 16.034 -4.546 1.00 0.00 C ATOM 205 CG LYS A 13 5.833 17.495 -5.088 1.00 0.00 C ATOM 206 CD LYS A 13 6.954 17.676 -6.126 1.00 0.00 C ATOM 207 CE LYS A 13 6.595 16.930 -7.414 1.00 0.00 C ATOM 208 NZ LYS A 13 5.546 17.690 -8.149 1.00 0.00 N ATOM 0 H LYS A 13 3.369 15.221 -3.152 1.00 0.00 H new ATOM 0 HA LYS A 13 4.252 15.579 -5.985 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.886 16.045 -3.459 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.666 15.486 -4.925 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.871 17.738 -5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.982 18.190 -4.262 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.099 18.736 -6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.896 17.299 -5.727 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.480 16.813 -8.039 1.00 0.00 H new ATOM 0 HE3 LYS A 13 6.236 15.928 -7.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 5.492 17.348 -9.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.626 17.552 -7.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.786 18.702 -8.148 1.00 0.00 H new ATOM 222 N VAL A 14 5.031 13.164 -5.957 1.00 0.00 N ATOM 223 CA VAL A 14 5.249 11.690 -5.940 1.00 0.00 C ATOM 224 C VAL A 14 6.394 11.340 -4.987 1.00 0.00 C ATOM 225 O VAL A 14 7.313 12.108 -4.787 1.00 0.00 O ATOM 226 CB VAL A 14 5.600 11.211 -7.353 1.00 0.00 C ATOM 227 CG1 VAL A 14 6.004 9.734 -7.317 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.383 11.376 -8.263 1.00 0.00 C ATOM 0 H VAL A 14 5.148 13.607 -6.868 1.00 0.00 H new ATOM 0 HA VAL A 14 4.338 11.199 -5.599 1.00 0.00 H new ATOM 0 HB VAL A 14 6.431 11.804 -7.735 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.252 9.400 -8.324 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.872 9.610 -6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 14 5.176 9.140 -6.931 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.632 11.036 -9.268 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.555 10.784 -7.874 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.094 12.426 -8.297 1.00 0.00 H new ATOM 238 N ALA A 15 6.344 10.168 -4.415 1.00 0.00 N ATOM 239 CA ALA A 15 7.421 9.720 -3.486 1.00 0.00 C ATOM 240 C ALA A 15 7.612 8.216 -3.670 1.00 0.00 C ATOM 241 O ALA A 15 8.269 7.557 -2.889 1.00 0.00 O ATOM 242 CB ALA A 15 7.014 10.016 -2.042 1.00 0.00 C ATOM 0 H ALA A 15 5.592 9.493 -4.554 1.00 0.00 H new ATOM 0 HA ALA A 15 8.350 10.248 -3.702 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.804 9.687 -1.367 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.856 11.088 -1.921 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.092 9.485 -1.808 1.00 0.00 H new ATOM 248 N GLY A 16 7.031 7.676 -4.706 1.00 0.00 N ATOM 249 CA GLY A 16 7.158 6.218 -4.969 1.00 0.00 C ATOM 250 C GLY A 16 6.148 5.818 -6.042 1.00 0.00 C ATOM 251 O GLY A 16 5.268 6.580 -6.392 1.00 0.00 O ATOM 0 H GLY A 16 6.469 8.188 -5.386 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.170 5.981 -5.297 1.00 0.00 H new ATOM 0 HA3 GLY A 16 6.979 5.653 -4.054 1.00 0.00 H new ATOM 255 N TYR A 17 6.261 4.629 -6.574 1.00 0.00 N ATOM 256 CA TYR A 17 5.301 4.192 -7.633 1.00 0.00 C ATOM 257 C TYR A 17 5.132 2.672 -7.574 1.00 0.00 C ATOM 258 O TYR A 17 6.071 1.921 -7.756 1.00 0.00 O ATOM 259 CB TYR A 17 5.844 4.619 -9.021 1.00 0.00 C ATOM 260 CG TYR A 17 4.981 5.714 -9.622 1.00 0.00 C ATOM 261 CD1 TYR A 17 3.677 5.421 -10.039 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.487 7.013 -9.767 1.00 0.00 C ATOM 263 CE1 TYR A 17 2.878 6.426 -10.599 1.00 0.00 C ATOM 264 CE2 TYR A 17 4.687 8.017 -10.327 1.00 0.00 C ATOM 265 CZ TYR A 17 3.383 7.723 -10.743 1.00 0.00 C ATOM 266 OH TYR A 17 2.595 8.712 -11.295 1.00 0.00 O ATOM 0 H TYR A 17 6.973 3.943 -6.323 1.00 0.00 H new ATOM 0 HA TYR A 17 4.330 4.660 -7.470 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.871 4.971 -8.922 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.865 3.758 -9.689 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.287 4.420 -9.929 1.00 0.00 H new ATOM 0 HD2 TYR A 17 6.493 7.240 -9.447 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.872 6.200 -10.920 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.076 9.018 -10.438 1.00 0.00 H new ATOM 0 HH TYR A 17 3.097 9.553 -11.321 1.00 0.00 H new ATOM 276 N ILE A 18 3.929 2.220 -7.342 1.00 0.00 N ATOM 277 CA ILE A 18 3.669 0.752 -7.293 1.00 0.00 C ATOM 278 C ILE A 18 3.094 0.329 -8.643 1.00 0.00 C ATOM 279 O ILE A 18 2.315 1.046 -9.239 1.00 0.00 O ATOM 280 CB ILE A 18 2.658 0.447 -6.184 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.421 -1.065 -6.111 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.336 1.155 -6.486 1.00 0.00 C ATOM 283 CD1 ILE A 18 1.717 -1.410 -4.796 1.00 0.00 C ATOM 0 H ILE A 18 3.111 2.808 -7.183 1.00 0.00 H new ATOM 0 HA ILE A 18 4.591 0.209 -7.087 1.00 0.00 H new ATOM 0 HB ILE A 18 3.049 0.801 -5.230 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.814 -1.390 -6.956 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.371 -1.596 -6.177 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.618 0.937 -5.696 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.503 2.231 -6.538 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.944 0.802 -7.440 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.549 -2.486 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.340 -1.100 -3.957 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.760 -0.890 -4.748 1.00 0.00 H new ATOM 295 N GLU A 19 3.474 -0.817 -9.144 1.00 0.00 N ATOM 296 CA GLU A 19 2.946 -1.258 -10.471 1.00 0.00 C ATOM 297 C GLU A 19 2.788 -2.780 -10.497 1.00 0.00 C ATOM 298 O GLU A 19 3.652 -3.516 -10.061 1.00 0.00 O ATOM 299 CB GLU A 19 3.927 -0.836 -11.570 1.00 0.00 C ATOM 300 CG GLU A 19 4.446 0.576 -11.289 1.00 0.00 C ATOM 301 CD GLU A 19 5.331 1.034 -12.447 1.00 0.00 C ATOM 302 OE1 GLU A 19 4.787 1.389 -13.479 1.00 0.00 O ATOM 303 OE2 GLU A 19 6.541 1.022 -12.285 1.00 0.00 O ATOM 0 H GLU A 19 4.123 -1.464 -8.696 1.00 0.00 H new ATOM 0 HA GLU A 19 1.974 -0.795 -10.639 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.760 -1.537 -11.615 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.433 -0.865 -12.541 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.610 1.264 -11.162 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.012 0.588 -10.358 1.00 0.00 H new ATOM 310 N ILE A 20 1.688 -3.257 -11.023 1.00 0.00 N ATOM 311 CA ILE A 20 1.454 -4.731 -11.106 1.00 0.00 C ATOM 312 C ILE A 20 0.704 -5.025 -12.422 1.00 0.00 C ATOM 313 O ILE A 20 -0.333 -4.443 -12.673 1.00 0.00 O ATOM 314 CB ILE A 20 0.604 -5.185 -9.899 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.502 -5.256 -8.661 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.001 -6.573 -10.164 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.655 -5.498 -7.411 1.00 0.00 C ATOM 0 H ILE A 20 0.935 -2.683 -11.402 1.00 0.00 H new ATOM 0 HA ILE A 20 2.401 -5.271 -11.089 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.205 -4.472 -9.741 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.231 -6.058 -8.777 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.063 -4.328 -8.555 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.597 -6.880 -9.305 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.635 -6.530 -11.049 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.800 -7.294 -10.326 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.303 -5.547 -6.536 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.057 -4.681 -7.290 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.114 -6.439 -7.515 1.00 0.00 H new ATOM 329 N PRO A 21 1.203 -5.907 -13.266 1.00 0.00 N ATOM 330 CA PRO A 21 0.523 -6.229 -14.554 1.00 0.00 C ATOM 331 C PRO A 21 -0.708 -7.112 -14.333 1.00 0.00 C ATOM 332 O PRO A 21 -1.743 -6.915 -14.937 1.00 0.00 O ATOM 333 CB PRO A 21 1.599 -6.968 -15.359 1.00 0.00 C ATOM 334 CG PRO A 21 2.464 -7.619 -14.329 1.00 0.00 C ATOM 335 CD PRO A 21 2.445 -6.694 -13.105 1.00 0.00 C ATOM 0 HA PRO A 21 0.150 -5.340 -15.063 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.156 -7.706 -16.028 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.172 -6.279 -15.979 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.087 -8.609 -14.074 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.480 -7.751 -14.701 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.438 -7.263 -12.175 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.324 -6.050 -13.078 1.00 0.00 H new ATOM 343 N ASP A 22 -0.605 -8.077 -13.463 1.00 0.00 N ATOM 344 CA ASP A 22 -1.771 -8.962 -13.198 1.00 0.00 C ATOM 345 C ASP A 22 -2.999 -8.100 -12.897 1.00 0.00 C ATOM 346 O ASP A 22 -4.117 -8.575 -12.916 1.00 0.00 O ATOM 347 CB ASP A 22 -1.471 -9.861 -11.996 1.00 0.00 C ATOM 348 CG ASP A 22 -0.097 -10.510 -12.171 1.00 0.00 C ATOM 349 OD1 ASP A 22 0.891 -9.835 -11.930 1.00 0.00 O ATOM 350 OD2 ASP A 22 -0.055 -11.670 -12.544 1.00 0.00 O ATOM 0 H ASP A 22 0.235 -8.290 -12.925 1.00 0.00 H new ATOM 0 HA ASP A 22 -1.964 -9.583 -14.073 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.494 -9.276 -11.077 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.238 -10.630 -11.903 1.00 0.00 H new ATOM 355 N ALA A 23 -2.798 -6.834 -12.611 1.00 0.00 N ATOM 356 CA ALA A 23 -3.955 -5.934 -12.299 1.00 0.00 C ATOM 357 C ALA A 23 -3.761 -4.576 -12.992 1.00 0.00 C ATOM 358 O ALA A 23 -4.417 -3.614 -12.661 1.00 0.00 O ATOM 359 CB ALA A 23 -4.034 -5.738 -10.777 1.00 0.00 C ATOM 0 H ALA A 23 -1.882 -6.386 -12.580 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.880 -6.383 -12.661 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.873 -5.084 -10.537 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.177 -6.704 -10.293 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.108 -5.286 -10.420 1.00 0.00 H new ATOM 365 N ASP A 24 -2.870 -4.490 -13.944 1.00 0.00 N ATOM 366 CA ASP A 24 -2.642 -3.193 -14.658 1.00 0.00 C ATOM 367 C ASP A 24 -2.579 -2.042 -13.647 1.00 0.00 C ATOM 368 O ASP A 24 -3.242 -1.034 -13.788 1.00 0.00 O ATOM 369 CB ASP A 24 -3.774 -2.949 -15.669 1.00 0.00 C ATOM 370 CG ASP A 24 -5.081 -2.626 -14.942 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.786 -3.559 -14.591 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.356 -1.453 -14.750 1.00 0.00 O ATOM 0 H ASP A 24 -2.286 -5.264 -14.261 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.694 -3.242 -15.193 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.507 -2.126 -16.332 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.907 -3.832 -16.295 1.00 0.00 H new ATOM 377 N ILE A 25 -1.781 -2.195 -12.625 1.00 0.00 N ATOM 378 CA ILE A 25 -1.653 -1.127 -11.584 1.00 0.00 C ATOM 379 C ILE A 25 -0.503 -0.189 -11.938 1.00 0.00 C ATOM 380 O ILE A 25 0.519 -0.595 -12.454 1.00 0.00 O ATOM 381 CB ILE A 25 -1.366 -1.785 -10.235 1.00 0.00 C ATOM 382 CG1 ILE A 25 -2.463 -2.812 -9.922 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.306 -0.739 -9.122 1.00 0.00 C ATOM 384 CD1 ILE A 25 -3.849 -2.148 -9.924 1.00 0.00 C ATOM 0 H ILE A 25 -1.206 -3.021 -12.463 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.579 -0.554 -11.536 1.00 0.00 H new ATOM 0 HB ILE A 25 -0.399 -2.285 -10.290 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.438 -3.614 -10.660 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -2.274 -3.267 -8.950 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.101 -1.231 -8.171 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.514 -0.022 -9.338 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.261 -0.217 -9.062 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.611 -2.895 -9.700 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.877 -1.363 -9.169 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.043 -1.715 -10.905 1.00 0.00 H new ATOM 396 N LYS A 26 -0.671 1.068 -11.649 1.00 0.00 N ATOM 397 CA LYS A 26 0.392 2.065 -11.937 1.00 0.00 C ATOM 398 C LYS A 26 -0.001 3.375 -11.253 1.00 0.00 C ATOM 399 O LYS A 26 -0.597 4.241 -11.864 1.00 0.00 O ATOM 400 CB LYS A 26 0.505 2.274 -13.451 1.00 0.00 C ATOM 401 CG LYS A 26 -0.890 2.233 -14.079 1.00 0.00 C ATOM 402 CD LYS A 26 -0.806 2.677 -15.540 1.00 0.00 C ATOM 403 CE LYS A 26 -2.138 2.396 -16.237 1.00 0.00 C ATOM 404 NZ LYS A 26 -3.231 3.125 -15.533 1.00 0.00 N ATOM 0 H LYS A 26 -1.512 1.452 -11.219 1.00 0.00 H new ATOM 0 HA LYS A 26 1.357 1.720 -11.565 1.00 0.00 H new ATOM 0 HB2 LYS A 26 0.982 3.231 -13.662 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.135 1.500 -13.889 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.298 1.224 -14.017 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.568 2.885 -13.528 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.572 3.740 -15.595 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.000 2.147 -16.046 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -2.089 2.711 -17.279 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -2.342 1.325 -16.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.083 3.132 -16.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.442 2.649 -14.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.931 4.103 -15.345 1.00 0.00 H new ATOM 418 N GLU A 27 0.280 3.516 -9.980 1.00 0.00 N ATOM 419 CA GLU A 27 -0.130 4.757 -9.258 1.00 0.00 C ATOM 420 C GLU A 27 0.953 5.177 -8.234 1.00 0.00 C ATOM 421 O GLU A 27 1.649 4.342 -7.693 1.00 0.00 O ATOM 422 CB GLU A 27 -1.437 4.437 -8.517 1.00 0.00 C ATOM 423 CG GLU A 27 -2.647 4.753 -9.405 1.00 0.00 C ATOM 424 CD GLU A 27 -2.869 6.265 -9.453 1.00 0.00 C ATOM 425 OE1 GLU A 27 -2.227 6.913 -10.263 1.00 0.00 O ATOM 426 OE2 GLU A 27 -3.678 6.751 -8.679 1.00 0.00 O ATOM 0 H GLU A 27 0.774 2.827 -9.413 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.262 5.578 -9.963 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.452 3.385 -8.232 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.492 5.018 -7.596 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.483 4.368 -10.411 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.536 4.257 -9.015 1.00 0.00 H new ATOM 433 N PRO A 28 1.082 6.469 -7.956 1.00 0.00 N ATOM 434 CA PRO A 28 2.080 6.992 -6.969 1.00 0.00 C ATOM 435 C PRO A 28 1.551 7.001 -5.526 1.00 0.00 C ATOM 436 O PRO A 28 0.365 6.899 -5.286 1.00 0.00 O ATOM 437 CB PRO A 28 2.288 8.425 -7.448 1.00 0.00 C ATOM 438 CG PRO A 28 0.933 8.840 -7.913 1.00 0.00 C ATOM 439 CD PRO A 28 0.310 7.587 -8.551 1.00 0.00 C ATOM 0 HA PRO A 28 2.980 6.378 -6.934 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.650 9.067 -6.645 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.021 8.476 -8.253 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.327 9.199 -7.081 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.999 9.655 -8.634 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.753 7.507 -8.321 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.401 7.603 -9.637 1.00 0.00 H new ATOM 447 N VAL A 29 2.437 7.151 -4.571 1.00 0.00 N ATOM 448 CA VAL A 29 2.030 7.205 -3.128 1.00 0.00 C ATOM 449 C VAL A 29 2.620 8.476 -2.501 1.00 0.00 C ATOM 450 O VAL A 29 3.816 8.689 -2.524 1.00 0.00 O ATOM 451 CB VAL A 29 2.577 5.977 -2.395 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.901 5.856 -1.029 1.00 0.00 C ATOM 453 CG2 VAL A 29 2.286 4.720 -3.216 1.00 0.00 C ATOM 0 H VAL A 29 3.440 7.240 -4.731 1.00 0.00 H new ATOM 0 HA VAL A 29 0.943 7.216 -3.048 1.00 0.00 H new ATOM 0 HB VAL A 29 3.653 6.085 -2.262 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.290 4.982 -0.507 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.106 6.751 -0.441 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.825 5.749 -1.164 1.00 0.00 H new ATOM 0 HG21 VAL A 29 2.676 3.846 -2.694 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.209 4.613 -3.349 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.765 4.803 -4.191 1.00 0.00 H new ATOM 463 N TYR A 30 1.792 9.332 -1.953 1.00 0.00 N ATOM 464 CA TYR A 30 2.316 10.595 -1.346 1.00 0.00 C ATOM 465 C TYR A 30 2.822 10.329 0.085 1.00 0.00 C ATOM 466 O TYR A 30 2.310 9.468 0.772 1.00 0.00 O ATOM 467 CB TYR A 30 1.189 11.637 -1.293 1.00 0.00 C ATOM 468 CG TYR A 30 0.342 11.538 -2.539 1.00 0.00 C ATOM 469 CD1 TYR A 30 0.875 11.915 -3.776 1.00 0.00 C ATOM 470 CD2 TYR A 30 -0.979 11.076 -2.457 1.00 0.00 C ATOM 471 CE1 TYR A 30 0.090 11.831 -4.932 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.764 10.991 -3.609 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.230 11.368 -4.849 1.00 0.00 C ATOM 474 OH TYR A 30 -2.004 11.286 -5.989 1.00 0.00 O ATOM 0 H TYR A 30 0.781 9.211 -1.900 1.00 0.00 H new ATOM 0 HA TYR A 30 3.141 10.965 -1.955 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.572 11.474 -0.409 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.611 12.638 -1.208 1.00 0.00 H new ATOM 0 HD1 TYR A 30 1.893 12.271 -3.839 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -1.390 10.785 -1.502 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.501 12.123 -5.887 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.782 10.635 -3.545 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.210 12.189 -6.310 1.00 0.00 H new ATOM 484 N PRO A 31 3.804 11.078 0.545 1.00 0.00 N ATOM 485 CA PRO A 31 4.353 10.926 1.925 1.00 0.00 C ATOM 486 C PRO A 31 3.430 11.550 2.972 1.00 0.00 C ATOM 487 O PRO A 31 3.427 12.748 3.170 1.00 0.00 O ATOM 488 CB PRO A 31 5.678 11.684 1.856 1.00 0.00 C ATOM 489 CG PRO A 31 5.422 12.770 0.870 1.00 0.00 C ATOM 490 CD PRO A 31 4.513 12.148 -0.189 1.00 0.00 C ATOM 0 HA PRO A 31 4.461 9.882 2.220 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.958 12.087 2.829 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.492 11.035 1.533 1.00 0.00 H new ATOM 0 HG2 PRO A 31 4.944 13.627 1.344 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.352 13.128 0.429 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.818 12.880 -0.601 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.087 11.748 -1.025 1.00 0.00 H new ATOM 498 N GLY A 32 2.645 10.757 3.642 1.00 0.00 N ATOM 499 CA GLY A 32 1.733 11.335 4.666 1.00 0.00 C ATOM 500 C GLY A 32 0.824 10.256 5.246 1.00 0.00 C ATOM 501 O GLY A 32 0.872 9.108 4.851 1.00 0.00 O ATOM 0 H GLY A 32 2.594 9.745 3.528 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.317 11.793 5.464 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.129 12.125 4.219 1.00 0.00 H new ATOM 505 N PRO A 33 -0.010 10.636 6.178 1.00 0.00 N ATOM 506 CA PRO A 33 -0.966 9.704 6.830 1.00 0.00 C ATOM 507 C PRO A 33 -2.149 9.406 5.916 1.00 0.00 C ATOM 508 O PRO A 33 -2.875 10.295 5.525 1.00 0.00 O ATOM 509 CB PRO A 33 -1.409 10.468 8.084 1.00 0.00 C ATOM 510 CG PRO A 33 -1.297 11.912 7.708 1.00 0.00 C ATOM 511 CD PRO A 33 -0.135 12.007 6.709 1.00 0.00 C ATOM 0 HA PRO A 33 -0.526 8.734 7.060 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.430 10.210 8.365 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.774 10.231 8.937 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.224 12.271 7.261 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.107 12.529 8.586 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.347 12.725 5.916 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.785 12.332 7.196 1.00 0.00 H new ATOM 519 N ALA A 34 -2.327 8.164 5.557 1.00 0.00 N ATOM 520 CA ALA A 34 -3.454 7.793 4.644 1.00 0.00 C ATOM 521 C ALA A 34 -4.737 8.535 5.042 1.00 0.00 C ATOM 522 O ALA A 34 -5.539 8.046 5.812 1.00 0.00 O ATOM 523 CB ALA A 34 -3.690 6.280 4.709 1.00 0.00 C ATOM 0 H ALA A 34 -1.740 7.385 5.856 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.189 8.079 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.511 6.011 4.044 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.785 5.757 4.399 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.942 5.995 5.730 1.00 0.00 H new ATOM 529 N THR A 35 -4.928 9.713 4.505 1.00 0.00 N ATOM 530 CA THR A 35 -6.152 10.519 4.814 1.00 0.00 C ATOM 531 C THR A 35 -6.995 10.636 3.535 1.00 0.00 C ATOM 532 O THR A 35 -6.466 10.588 2.442 1.00 0.00 O ATOM 533 CB THR A 35 -5.723 11.919 5.274 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.639 12.364 4.471 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.284 11.870 6.740 1.00 0.00 C ATOM 0 H THR A 35 -4.279 10.158 3.856 1.00 0.00 H new ATOM 0 HA THR A 35 -6.735 10.040 5.600 1.00 0.00 H new ATOM 0 HB THR A 35 -6.563 12.607 5.173 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.820 11.899 4.741 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.980 12.866 7.062 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.114 11.526 7.357 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.445 11.183 6.846 1.00 0.00 H new ATOM 543 N PRO A 36 -8.292 10.791 3.658 1.00 0.00 N ATOM 544 CA PRO A 36 -9.194 10.914 2.472 1.00 0.00 C ATOM 545 C PRO A 36 -8.953 12.219 1.701 1.00 0.00 C ATOM 546 O PRO A 36 -8.958 12.240 0.485 1.00 0.00 O ATOM 547 CB PRO A 36 -10.608 10.878 3.078 1.00 0.00 C ATOM 548 CG PRO A 36 -10.434 11.339 4.490 1.00 0.00 C ATOM 549 CD PRO A 36 -9.045 10.864 4.923 1.00 0.00 C ATOM 0 HA PRO A 36 -9.025 10.121 1.743 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.289 11.530 2.531 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.029 9.873 3.040 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.514 12.424 4.558 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.207 10.921 5.135 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.584 11.560 5.624 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -9.090 9.895 5.419 1.00 0.00 H new ATOM 557 N GLU A 37 -8.737 13.304 2.394 1.00 0.00 N ATOM 558 CA GLU A 37 -8.494 14.595 1.691 1.00 0.00 C ATOM 559 C GLU A 37 -7.221 14.475 0.849 1.00 0.00 C ATOM 560 O GLU A 37 -7.005 15.226 -0.081 1.00 0.00 O ATOM 561 CB GLU A 37 -8.346 15.721 2.721 1.00 0.00 C ATOM 562 CG GLU A 37 -7.036 15.554 3.507 1.00 0.00 C ATOM 563 CD GLU A 37 -5.869 16.175 2.732 1.00 0.00 C ATOM 564 OE1 GLU A 37 -6.074 17.203 2.108 1.00 0.00 O ATOM 565 OE2 GLU A 37 -4.788 15.613 2.778 1.00 0.00 O ATOM 0 H GLU A 37 -8.718 13.352 3.413 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.335 14.826 1.038 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.356 16.688 2.217 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.194 15.710 3.406 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.127 16.029 4.484 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.842 14.496 3.684 1.00 0.00 H new ATOM 572 N GLN A 38 -6.380 13.525 1.166 1.00 0.00 N ATOM 573 CA GLN A 38 -5.120 13.333 0.389 1.00 0.00 C ATOM 574 C GLN A 38 -5.355 12.247 -0.667 1.00 0.00 C ATOM 575 O GLN A 38 -5.296 12.496 -1.855 1.00 0.00 O ATOM 576 CB GLN A 38 -3.998 12.903 1.352 1.00 0.00 C ATOM 577 CG GLN A 38 -2.824 12.278 0.582 1.00 0.00 C ATOM 578 CD GLN A 38 -2.467 13.146 -0.627 1.00 0.00 C ATOM 579 OE1 GLN A 38 -1.782 14.141 -0.495 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.905 12.806 -1.806 1.00 0.00 N ATOM 0 H GLN A 38 -6.514 12.869 1.936 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.830 14.261 -0.104 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -3.648 13.766 1.918 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.388 12.185 2.074 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -1.959 12.181 1.238 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -3.089 11.273 0.253 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.480 11.971 -1.915 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.673 13.375 -2.620 1.00 0.00 H new ATOM 589 N LEU A 39 -5.622 11.043 -0.236 1.00 0.00 N ATOM 590 CA LEU A 39 -5.862 9.931 -1.197 1.00 0.00 C ATOM 591 C LEU A 39 -6.794 10.391 -2.317 1.00 0.00 C ATOM 592 O LEU A 39 -6.903 9.750 -3.344 1.00 0.00 O ATOM 593 CB LEU A 39 -6.519 8.761 -0.467 1.00 0.00 C ATOM 594 CG LEU A 39 -5.586 8.215 0.625 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.399 7.431 1.658 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.533 7.285 0.009 1.00 0.00 C ATOM 0 H LEU A 39 -5.684 10.782 0.748 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.906 9.624 -1.621 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.459 9.085 -0.021 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.759 7.970 -1.178 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.088 9.056 1.107 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.732 7.046 2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.140 8.088 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.905 6.599 1.168 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.879 6.906 0.794 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.030 6.450 -0.485 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.941 7.838 -0.720 1.00 0.00 H new ATOM 608 N ASN A 40 -7.462 11.494 -2.142 1.00 0.00 N ATOM 609 CA ASN A 40 -8.371 11.974 -3.213 1.00 0.00 C ATOM 610 C ASN A 40 -7.524 12.266 -4.450 1.00 0.00 C ATOM 611 O ASN A 40 -7.992 12.226 -5.570 1.00 0.00 O ATOM 612 CB ASN A 40 -9.068 13.260 -2.748 1.00 0.00 C ATOM 613 CG ASN A 40 -10.362 12.920 -1.998 1.00 0.00 C ATOM 614 OD1 ASN A 40 -11.013 11.938 -2.294 1.00 0.00 O ATOM 615 ND2 ASN A 40 -10.763 13.701 -1.034 1.00 0.00 N ATOM 0 H ASN A 40 -7.418 12.080 -1.309 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.128 11.224 -3.441 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.402 13.829 -2.099 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.292 13.892 -3.607 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.623 13.487 -0.529 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -10.217 14.526 -0.785 1.00 0.00 H new ATOM 622 N ARG A 41 -6.273 12.549 -4.240 1.00 0.00 N ATOM 623 CA ARG A 41 -5.362 12.838 -5.381 1.00 0.00 C ATOM 624 C ARG A 41 -4.766 11.524 -5.876 1.00 0.00 C ATOM 625 O ARG A 41 -4.166 11.458 -6.931 1.00 0.00 O ATOM 626 CB ARG A 41 -4.240 13.764 -4.906 1.00 0.00 C ATOM 627 CG ARG A 41 -4.830 15.133 -4.532 1.00 0.00 C ATOM 628 CD ARG A 41 -3.863 15.891 -3.614 1.00 0.00 C ATOM 629 NE ARG A 41 -4.570 17.058 -2.988 1.00 0.00 N ATOM 630 CZ ARG A 41 -5.154 17.976 -3.713 1.00 0.00 C ATOM 631 NH1 ARG A 41 -4.980 18.015 -5.005 1.00 0.00 N ATOM 632 NH2 ARG A 41 -5.873 18.897 -3.130 1.00 0.00 N ATOM 0 H ARG A 41 -5.837 12.593 -3.319 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.911 13.322 -6.189 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.733 13.327 -4.046 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.493 13.880 -5.691 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.019 15.715 -5.434 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.789 15.000 -4.032 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.484 15.225 -2.839 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.002 16.239 -4.185 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.595 17.137 -1.971 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.383 17.325 -5.460 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.441 18.736 -5.560 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.976 18.897 -2.115 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -6.331 19.616 -3.689 1.00 0.00 H new ATOM 646 N GLY A 42 -4.932 10.470 -5.121 1.00 0.00 N ATOM 647 CA GLY A 42 -4.378 9.152 -5.547 1.00 0.00 C ATOM 648 C GLY A 42 -4.156 8.247 -4.330 1.00 0.00 C ATOM 649 O GLY A 42 -4.994 8.141 -3.457 1.00 0.00 O ATOM 0 H GLY A 42 -5.427 10.465 -4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.063 8.671 -6.246 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.436 9.300 -6.075 1.00 0.00 H new ATOM 653 N VAL A 43 -3.029 7.580 -4.281 1.00 0.00 N ATOM 654 CA VAL A 43 -2.725 6.657 -3.141 1.00 0.00 C ATOM 655 C VAL A 43 -1.769 7.349 -2.158 1.00 0.00 C ATOM 656 O VAL A 43 -1.091 8.299 -2.498 1.00 0.00 O ATOM 657 CB VAL A 43 -2.058 5.391 -3.701 1.00 0.00 C ATOM 658 CG1 VAL A 43 -2.127 4.253 -2.683 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.767 4.961 -4.986 1.00 0.00 C ATOM 0 H VAL A 43 -2.298 7.636 -4.990 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.645 6.395 -2.618 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.012 5.615 -3.912 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.650 3.365 -3.097 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.611 4.550 -1.770 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -3.170 4.032 -2.455 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.292 4.063 -5.381 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.815 4.752 -4.771 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.700 5.761 -5.723 1.00 0.00 H new ATOM 669 N SER A 44 -1.707 6.869 -0.944 1.00 0.00 N ATOM 670 CA SER A 44 -0.798 7.475 0.072 1.00 0.00 C ATOM 671 C SER A 44 -0.388 6.388 1.066 1.00 0.00 C ATOM 672 O SER A 44 -1.107 5.430 1.275 1.00 0.00 O ATOM 673 CB SER A 44 -1.529 8.599 0.808 1.00 0.00 C ATOM 674 OG SER A 44 -0.581 9.395 1.508 1.00 0.00 O ATOM 0 H SER A 44 -2.253 6.075 -0.610 1.00 0.00 H new ATOM 0 HA SER A 44 0.086 7.888 -0.414 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.084 9.213 0.099 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.256 8.181 1.505 1.00 0.00 H new ATOM 0 HG SER A 44 0.300 9.298 1.090 1.00 0.00 H new ATOM 680 N PHE A 45 0.758 6.509 1.678 1.00 0.00 N ATOM 681 CA PHE A 45 1.182 5.455 2.642 1.00 0.00 C ATOM 682 C PHE A 45 0.164 5.355 3.779 1.00 0.00 C ATOM 683 O PHE A 45 -0.691 6.203 3.936 1.00 0.00 O ATOM 684 CB PHE A 45 2.560 5.784 3.215 1.00 0.00 C ATOM 685 CG PHE A 45 3.620 5.572 2.153 1.00 0.00 C ATOM 686 CD1 PHE A 45 3.845 4.293 1.622 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.375 6.656 1.695 1.00 0.00 C ATOM 688 CE1 PHE A 45 4.825 4.105 0.638 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.354 6.469 0.715 1.00 0.00 C ATOM 690 CZ PHE A 45 5.580 5.193 0.185 1.00 0.00 C ATOM 0 H PHE A 45 1.412 7.282 1.555 1.00 0.00 H new ATOM 0 HA PHE A 45 1.236 4.501 2.117 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.582 6.817 3.563 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.766 5.152 4.079 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.263 3.453 1.972 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.201 7.642 2.100 1.00 0.00 H new ATOM 0 HE1 PHE A 45 4.998 3.120 0.229 1.00 0.00 H new ATOM 0 HE2 PHE A 45 5.936 7.309 0.367 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.336 5.048 -0.573 1.00 0.00 H new ATOM 700 N ALA A 46 0.252 4.325 4.578 1.00 0.00 N ATOM 701 CA ALA A 46 -0.709 4.172 5.709 1.00 0.00 C ATOM 702 C ALA A 46 -0.243 5.021 6.891 1.00 0.00 C ATOM 703 O ALA A 46 -0.944 5.174 7.870 1.00 0.00 O ATOM 704 CB ALA A 46 -0.777 2.705 6.131 1.00 0.00 C ATOM 0 H ALA A 46 0.947 3.583 4.496 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.698 4.502 5.390 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.480 2.596 6.957 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.111 2.099 5.289 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.211 2.372 6.449 1.00 0.00 H new ATOM 710 N GLU A 47 0.938 5.577 6.809 1.00 0.00 N ATOM 711 CA GLU A 47 1.447 6.417 7.935 1.00 0.00 C ATOM 712 C GLU A 47 2.439 7.457 7.407 1.00 0.00 C ATOM 713 O GLU A 47 3.110 7.250 6.415 1.00 0.00 O ATOM 714 CB GLU A 47 2.145 5.524 8.957 1.00 0.00 C ATOM 715 CG GLU A 47 1.122 4.605 9.630 1.00 0.00 C ATOM 716 CD GLU A 47 1.743 3.980 10.882 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.950 4.077 11.032 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.000 3.418 11.669 1.00 0.00 O ATOM 0 H GLU A 47 1.571 5.486 6.014 1.00 0.00 H new ATOM 0 HA GLU A 47 0.608 6.930 8.405 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.915 4.928 8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.645 6.137 9.707 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.230 5.171 9.897 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.808 3.824 8.938 1.00 0.00 H new ATOM 725 N GLU A 48 2.525 8.579 8.068 1.00 0.00 N ATOM 726 CA GLU A 48 3.455 9.658 7.626 1.00 0.00 C ATOM 727 C GLU A 48 4.916 9.187 7.684 1.00 0.00 C ATOM 728 O GLU A 48 5.730 9.574 6.869 1.00 0.00 O ATOM 729 CB GLU A 48 3.282 10.872 8.545 1.00 0.00 C ATOM 730 CG GLU A 48 3.788 10.532 9.949 1.00 0.00 C ATOM 731 CD GLU A 48 3.321 11.604 10.935 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.700 12.557 10.493 1.00 0.00 O ATOM 733 OE2 GLU A 48 3.592 11.455 12.114 1.00 0.00 O ATOM 0 H GLU A 48 1.984 8.797 8.905 1.00 0.00 H new ATOM 0 HA GLU A 48 3.218 9.921 6.595 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.833 11.724 8.146 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.232 11.162 8.587 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.414 9.555 10.255 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.876 10.472 9.950 1.00 0.00 H new ATOM 740 N ASN A 49 5.265 8.383 8.655 1.00 0.00 N ATOM 741 CA ASN A 49 6.686 7.924 8.775 1.00 0.00 C ATOM 742 C ASN A 49 6.918 6.646 7.963 1.00 0.00 C ATOM 743 O ASN A 49 7.898 5.955 8.152 1.00 0.00 O ATOM 744 CB ASN A 49 7.001 7.647 10.246 1.00 0.00 C ATOM 745 CG ASN A 49 8.476 7.269 10.389 1.00 0.00 C ATOM 746 OD1 ASN A 49 8.823 6.417 11.182 1.00 0.00 O ATOM 747 ND2 ASN A 49 9.365 7.871 9.648 1.00 0.00 N ATOM 0 H ASN A 49 4.631 8.024 9.369 1.00 0.00 H new ATOM 0 HA ASN A 49 7.338 8.706 8.387 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.780 8.528 10.848 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.370 6.840 10.618 1.00 0.00 H new ATOM 0 HD21 ASN A 49 10.351 7.626 9.735 1.00 0.00 H new ATOM 0 HD22 ASN A 49 9.074 8.587 8.982 1.00 0.00 H new ATOM 754 N GLU A 50 6.035 6.325 7.062 1.00 0.00 N ATOM 755 CA GLU A 50 6.227 5.092 6.247 1.00 0.00 C ATOM 756 C GLU A 50 7.493 5.221 5.402 1.00 0.00 C ATOM 757 O GLU A 50 7.496 5.816 4.343 1.00 0.00 O ATOM 758 CB GLU A 50 5.014 4.885 5.336 1.00 0.00 C ATOM 759 CG GLU A 50 5.116 3.530 4.624 1.00 0.00 C ATOM 760 CD GLU A 50 6.110 3.625 3.463 1.00 0.00 C ATOM 761 OE1 GLU A 50 6.144 4.661 2.821 1.00 0.00 O ATOM 762 OE2 GLU A 50 6.818 2.658 3.236 1.00 0.00 O ATOM 0 H GLU A 50 5.191 6.859 6.854 1.00 0.00 H new ATOM 0 HA GLU A 50 6.329 4.234 6.911 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.097 4.928 5.923 1.00 0.00 H new ATOM 0 HB3 GLU A 50 4.960 5.688 4.601 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.438 2.763 5.328 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.136 3.230 4.252 1.00 0.00 H new ATOM 769 N SER A 51 8.566 4.648 5.865 1.00 0.00 N ATOM 770 CA SER A 51 9.846 4.695 5.110 1.00 0.00 C ATOM 771 C SER A 51 9.956 3.414 4.284 1.00 0.00 C ATOM 772 O SER A 51 9.590 2.350 4.736 1.00 0.00 O ATOM 773 CB SER A 51 11.016 4.779 6.103 1.00 0.00 C ATOM 774 OG SER A 51 10.679 4.058 7.280 1.00 0.00 O ATOM 0 H SER A 51 8.611 4.141 6.749 1.00 0.00 H new ATOM 0 HA SER A 51 9.876 5.566 4.455 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.920 4.366 5.655 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.228 5.820 6.347 1.00 0.00 H new ATOM 0 HG SER A 51 11.422 4.106 7.917 1.00 0.00 H new ATOM 780 N LEU A 52 10.464 3.490 3.086 1.00 0.00 N ATOM 781 CA LEU A 52 10.592 2.257 2.272 1.00 0.00 C ATOM 782 C LEU A 52 11.513 1.299 3.016 1.00 0.00 C ATOM 783 O LEU A 52 11.739 0.181 2.602 1.00 0.00 O ATOM 784 CB LEU A 52 11.186 2.588 0.893 1.00 0.00 C ATOM 785 CG LEU A 52 12.360 3.602 1.030 1.00 0.00 C ATOM 786 CD1 LEU A 52 13.522 3.190 0.117 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.897 5.011 0.623 1.00 0.00 C ATOM 0 H LEU A 52 10.793 4.347 2.641 1.00 0.00 H new ATOM 0 HA LEU A 52 9.612 1.805 2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.541 1.675 0.416 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.412 3.005 0.248 1.00 0.00 H new ATOM 0 HG LEU A 52 12.686 3.606 2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.338 3.906 0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 52 13.872 2.197 0.400 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.183 3.174 -0.919 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.727 5.710 0.723 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.557 4.997 -0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 52 11.078 5.326 1.269 1.00 0.00 H new ATOM 799 N ASP A 53 12.050 1.741 4.123 1.00 0.00 N ATOM 800 CA ASP A 53 12.964 0.877 4.914 1.00 0.00 C ATOM 801 C ASP A 53 12.166 0.099 5.963 1.00 0.00 C ATOM 802 O ASP A 53 12.638 -0.882 6.502 1.00 0.00 O ATOM 803 CB ASP A 53 14.005 1.749 5.618 1.00 0.00 C ATOM 804 CG ASP A 53 14.935 2.376 4.578 1.00 0.00 C ATOM 805 OD1 ASP A 53 14.622 2.287 3.403 1.00 0.00 O ATOM 806 OD2 ASP A 53 15.945 2.936 4.975 1.00 0.00 O ATOM 0 H ASP A 53 11.891 2.670 4.512 1.00 0.00 H new ATOM 0 HA ASP A 53 13.462 0.175 4.245 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.510 2.529 6.196 1.00 0.00 H new ATOM 0 HB3 ASP A 53 14.582 1.149 6.322 1.00 0.00 H new ATOM 811 N ASP A 54 10.964 0.521 6.269 1.00 0.00 N ATOM 812 CA ASP A 54 10.175 -0.218 7.294 1.00 0.00 C ATOM 813 C ASP A 54 9.951 -1.664 6.827 1.00 0.00 C ATOM 814 O ASP A 54 9.319 -1.913 5.820 1.00 0.00 O ATOM 815 CB ASP A 54 8.824 0.470 7.501 1.00 0.00 C ATOM 816 CG ASP A 54 8.117 0.616 6.157 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.705 0.235 5.162 1.00 0.00 O ATOM 818 OD2 ASP A 54 6.999 1.106 6.145 1.00 0.00 O ATOM 0 H ASP A 54 10.503 1.333 5.859 1.00 0.00 H new ATOM 0 HA ASP A 54 10.724 -0.223 8.236 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.208 -0.112 8.187 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.969 1.450 7.956 1.00 0.00 H new ATOM 823 N GLN A 55 10.470 -2.619 7.552 1.00 0.00 N ATOM 824 CA GLN A 55 10.290 -4.049 7.154 1.00 0.00 C ATOM 825 C GLN A 55 8.831 -4.304 6.770 1.00 0.00 C ATOM 826 O GLN A 55 8.511 -5.300 6.151 1.00 0.00 O ATOM 827 CB GLN A 55 10.670 -4.950 8.330 1.00 0.00 C ATOM 828 CG GLN A 55 10.036 -4.406 9.611 1.00 0.00 C ATOM 829 CD GLN A 55 10.122 -5.463 10.715 1.00 0.00 C ATOM 830 OE1 GLN A 55 11.194 -5.764 11.202 1.00 0.00 O ATOM 831 NE2 GLN A 55 9.029 -6.040 11.135 1.00 0.00 N ATOM 0 H GLN A 55 11.012 -2.472 8.404 1.00 0.00 H new ATOM 0 HA GLN A 55 10.928 -4.268 6.298 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.329 -5.969 8.147 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.754 -4.990 8.436 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.548 -3.496 9.924 1.00 0.00 H new ATOM 0 HG3 GLN A 55 8.995 -4.140 9.429 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.129 -5.787 10.726 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.075 -6.744 11.872 1.00 0.00 H new ATOM 840 N ASN A 56 7.943 -3.410 7.132 1.00 0.00 N ATOM 841 CA ASN A 56 6.494 -3.591 6.795 1.00 0.00 C ATOM 842 C ASN A 56 5.936 -2.294 6.209 1.00 0.00 C ATOM 843 O ASN A 56 5.745 -1.317 6.906 1.00 0.00 O ATOM 844 CB ASN A 56 5.721 -3.948 8.067 1.00 0.00 C ATOM 845 CG ASN A 56 4.237 -4.111 7.735 1.00 0.00 C ATOM 846 OD1 ASN A 56 3.888 -4.675 6.717 1.00 0.00 O ATOM 847 ND2 ASN A 56 3.341 -3.640 8.559 1.00 0.00 N ATOM 0 H ASN A 56 8.160 -2.558 7.649 1.00 0.00 H new ATOM 0 HA ASN A 56 6.389 -4.392 6.063 1.00 0.00 H new ATOM 0 HB2 ASN A 56 6.112 -4.871 8.496 1.00 0.00 H new ATOM 0 HB3 ASN A 56 5.853 -3.168 8.816 1.00 0.00 H new ATOM 0 HD21 ASN A 56 2.349 -3.746 8.348 1.00 0.00 H new ATOM 0 HD22 ASN A 56 3.633 -3.166 9.414 1.00 0.00 H new ATOM 854 N ILE A 57 5.663 -2.284 4.930 1.00 0.00 N ATOM 855 CA ILE A 57 5.103 -1.059 4.284 1.00 0.00 C ATOM 856 C ILE A 57 3.586 -1.213 4.158 1.00 0.00 C ATOM 857 O ILE A 57 3.099 -2.096 3.480 1.00 0.00 O ATOM 858 CB ILE A 57 5.706 -0.893 2.885 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.218 -0.653 2.991 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.055 0.305 2.193 1.00 0.00 C ATOM 861 CD1 ILE A 57 7.880 -0.940 1.641 1.00 0.00 C ATOM 0 H ILE A 57 5.804 -3.075 4.302 1.00 0.00 H new ATOM 0 HA ILE A 57 5.343 -0.185 4.890 1.00 0.00 H new ATOM 0 HB ILE A 57 5.525 -1.800 2.308 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.413 0.377 3.291 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.645 -1.296 3.761 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.482 0.426 1.197 1.00 0.00 H new ATOM 0 HG22 ILE A 57 3.981 0.138 2.110 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.237 1.206 2.778 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.954 -0.769 1.719 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.697 -1.977 1.359 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.461 -0.279 0.882 1.00 0.00 H new ATOM 873 N SER A 58 2.835 -0.356 4.805 1.00 0.00 N ATOM 874 CA SER A 58 1.341 -0.435 4.732 1.00 0.00 C ATOM 875 C SER A 58 0.827 0.736 3.892 1.00 0.00 C ATOM 876 O SER A 58 0.971 1.883 4.262 1.00 0.00 O ATOM 877 CB SER A 58 0.764 -0.354 6.152 1.00 0.00 C ATOM 878 OG SER A 58 1.564 0.525 6.932 1.00 0.00 O ATOM 0 H SER A 58 3.195 0.401 5.386 1.00 0.00 H new ATOM 0 HA SER A 58 1.033 -1.375 4.274 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.265 0.004 6.119 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.743 -1.345 6.606 1.00 0.00 H new ATOM 0 HG SER A 58 1.198 0.581 7.840 1.00 0.00 H new ATOM 884 N ILE A 59 0.240 0.453 2.754 1.00 0.00 N ATOM 885 CA ILE A 59 -0.279 1.546 1.870 1.00 0.00 C ATOM 886 C ILE A 59 -1.802 1.605 1.956 1.00 0.00 C ATOM 887 O ILE A 59 -2.445 0.707 2.461 1.00 0.00 O ATOM 888 CB ILE A 59 0.125 1.268 0.415 1.00 0.00 C ATOM 889 CG1 ILE A 59 1.641 1.080 0.334 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.300 2.442 -0.478 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.023 0.545 -1.048 1.00 0.00 C ATOM 0 H ILE A 59 0.097 -0.492 2.397 1.00 0.00 H new ATOM 0 HA ILE A 59 0.144 2.496 2.198 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.372 0.361 0.070 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.145 2.029 0.519 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.973 0.387 1.107 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.010 2.238 -1.509 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.381 2.568 -0.423 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.190 3.354 -0.137 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.104 0.413 -1.101 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.531 -0.413 -1.216 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.706 1.254 -1.813 1.00 0.00 H new ATOM 903 N ALA A 60 -2.381 2.659 1.444 1.00 0.00 N ATOM 904 CA ALA A 60 -3.866 2.807 1.458 1.00 0.00 C ATOM 905 C ALA A 60 -4.301 3.289 0.075 1.00 0.00 C ATOM 906 O ALA A 60 -3.786 4.266 -0.428 1.00 0.00 O ATOM 907 CB ALA A 60 -4.268 3.837 2.515 1.00 0.00 C ATOM 0 H ALA A 60 -1.880 3.435 1.010 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.344 1.857 1.697 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.353 3.944 2.524 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.928 3.504 3.496 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.810 4.798 2.279 1.00 0.00 H new ATOM 913 N GLY A 61 -5.227 2.609 -0.562 1.00 0.00 N ATOM 914 CA GLY A 61 -5.654 3.043 -1.931 1.00 0.00 C ATOM 915 C GLY A 61 -7.159 2.859 -2.110 1.00 0.00 C ATOM 916 O GLY A 61 -7.777 2.014 -1.493 1.00 0.00 O ATOM 0 H GLY A 61 -5.700 1.782 -0.198 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.390 4.089 -2.085 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.120 2.465 -2.685 1.00 0.00 H new ATOM 920 N HIS A 62 -7.748 3.650 -2.965 1.00 0.00 N ATOM 921 CA HIS A 62 -9.217 3.535 -3.211 1.00 0.00 C ATOM 922 C HIS A 62 -9.496 2.266 -4.021 1.00 0.00 C ATOM 923 O HIS A 62 -8.624 1.447 -4.228 1.00 0.00 O ATOM 924 CB HIS A 62 -9.708 4.756 -4.001 1.00 0.00 C ATOM 925 CG HIS A 62 -9.844 5.940 -3.083 1.00 0.00 C ATOM 926 ND1 HIS A 62 -11.078 6.407 -2.655 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.911 6.764 -2.509 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.855 7.469 -1.860 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.550 7.730 -1.737 1.00 0.00 N ATOM 0 H HIS A 62 -7.275 4.374 -3.506 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.740 3.488 -2.256 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -9.008 4.986 -4.804 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.668 4.535 -4.469 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -11.988 6.016 -2.899 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.842 6.677 -2.636 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.635 8.041 -1.380 1.00 0.00 H new ATOM 937 N THR A 63 -10.704 2.104 -4.491 1.00 0.00 N ATOM 938 CA THR A 63 -11.029 0.897 -5.296 1.00 0.00 C ATOM 939 C THR A 63 -12.395 1.072 -5.973 1.00 0.00 C ATOM 940 O THR A 63 -13.367 0.446 -5.603 1.00 0.00 O ATOM 941 CB THR A 63 -11.050 -0.339 -4.396 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.686 -1.411 -5.079 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.809 -0.034 -3.107 1.00 0.00 C ATOM 0 H THR A 63 -11.477 2.755 -4.351 1.00 0.00 H new ATOM 0 HA THR A 63 -10.266 0.766 -6.063 1.00 0.00 H new ATOM 0 HB THR A 63 -10.026 -0.618 -4.149 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.632 -1.195 -5.218 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.819 -0.920 -2.472 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.318 0.784 -2.580 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.833 0.252 -3.347 1.00 0.00 H new ATOM 951 N PHE A 64 -12.475 1.918 -6.969 1.00 0.00 N ATOM 952 CA PHE A 64 -13.778 2.130 -7.671 1.00 0.00 C ATOM 953 C PHE A 64 -13.916 1.099 -8.799 1.00 0.00 C ATOM 954 O PHE A 64 -13.175 1.111 -9.759 1.00 0.00 O ATOM 955 CB PHE A 64 -13.818 3.555 -8.258 1.00 0.00 C ATOM 956 CG PHE A 64 -14.313 4.536 -7.211 1.00 0.00 C ATOM 957 CD1 PHE A 64 -13.684 4.600 -5.960 1.00 0.00 C ATOM 958 CD2 PHE A 64 -15.397 5.379 -7.492 1.00 0.00 C ATOM 959 CE1 PHE A 64 -14.138 5.506 -4.994 1.00 0.00 C ATOM 960 CE2 PHE A 64 -15.851 6.284 -6.524 1.00 0.00 C ATOM 961 CZ PHE A 64 -15.221 6.346 -5.276 1.00 0.00 C ATOM 0 H PHE A 64 -11.696 2.471 -7.326 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.601 2.010 -6.967 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.824 3.845 -8.598 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.473 3.580 -9.129 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -12.849 3.951 -5.741 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -15.883 5.331 -8.456 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -13.652 5.557 -4.031 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -16.686 6.933 -6.741 1.00 0.00 H new ATOM 0 HZ PHE A 64 -15.571 7.043 -4.529 1.00 0.00 H new ATOM 971 N ILE A 65 -14.863 0.209 -8.681 1.00 0.00 N ATOM 972 CA ILE A 65 -15.058 -0.830 -9.733 1.00 0.00 C ATOM 973 C ILE A 65 -15.334 -0.171 -11.075 1.00 0.00 C ATOM 974 O ILE A 65 -15.212 -0.784 -12.117 1.00 0.00 O ATOM 975 CB ILE A 65 -16.255 -1.703 -9.361 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.157 -2.116 -7.889 1.00 0.00 C ATOM 977 CG2 ILE A 65 -16.267 -2.945 -10.245 1.00 0.00 C ATOM 978 CD1 ILE A 65 -14.760 -2.671 -7.598 1.00 0.00 C ATOM 0 H ILE A 65 -15.514 0.156 -7.897 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.154 -1.435 -9.805 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.176 -1.140 -9.512 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -16.359 -1.259 -7.247 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.912 -2.869 -7.662 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -17.120 -3.570 -9.982 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -16.344 -2.647 -11.291 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -15.345 -3.507 -10.095 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -14.696 -2.963 -6.550 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -14.575 -3.540 -8.229 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -14.013 -1.905 -7.808 1.00 0.00 H new ATOM 990 N ASP A 66 -15.720 1.068 -11.062 1.00 0.00 N ATOM 991 CA ASP A 66 -16.021 1.764 -12.335 1.00 0.00 C ATOM 992 C ASP A 66 -14.730 2.325 -12.916 1.00 0.00 C ATOM 993 O ASP A 66 -14.735 3.133 -13.822 1.00 0.00 O ATOM 994 CB ASP A 66 -17.014 2.896 -12.069 1.00 0.00 C ATOM 995 CG ASP A 66 -17.647 3.345 -13.388 1.00 0.00 C ATOM 996 OD1 ASP A 66 -18.593 2.704 -13.817 1.00 0.00 O ATOM 997 OD2 ASP A 66 -17.176 4.322 -13.946 1.00 0.00 O ATOM 0 H ASP A 66 -15.841 1.631 -10.220 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.460 1.065 -13.047 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.788 2.560 -11.379 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -16.506 3.735 -11.594 1.00 0.00 H new ATOM 1002 N ARG A 67 -13.620 1.883 -12.400 1.00 0.00 N ATOM 1003 CA ARG A 67 -12.305 2.362 -12.910 1.00 0.00 C ATOM 1004 C ARG A 67 -11.255 1.265 -12.702 1.00 0.00 C ATOM 1005 O ARG A 67 -10.421 1.359 -11.825 1.00 0.00 O ATOM 1006 CB ARG A 67 -11.884 3.632 -12.155 1.00 0.00 C ATOM 1007 CG ARG A 67 -12.779 4.813 -12.567 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.099 6.137 -12.203 1.00 0.00 C ATOM 1009 NE ARG A 67 -11.921 6.243 -10.715 1.00 0.00 N ATOM 1010 CZ ARG A 67 -12.937 6.236 -9.893 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -14.159 6.250 -10.348 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -12.726 6.259 -8.607 1.00 0.00 N ATOM 0 H ARG A 67 -13.565 1.205 -11.640 1.00 0.00 H new ATOM 0 HA ARG A 67 -12.389 2.593 -13.972 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -11.958 3.467 -11.080 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -10.841 3.864 -12.370 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -12.973 4.777 -13.639 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -13.744 4.741 -12.066 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -11.130 6.203 -12.697 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -12.699 6.972 -12.564 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.978 6.323 -10.335 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.329 6.267 -11.354 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.945 6.244 -9.698 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -11.772 6.282 -8.247 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -13.515 6.254 -7.961 1.00 0.00 H new ATOM 1026 N PRO A 68 -11.306 0.229 -13.508 1.00 0.00 N ATOM 1027 CA PRO A 68 -10.355 -0.935 -13.432 1.00 0.00 C ATOM 1028 C PRO A 68 -8.870 -0.531 -13.419 1.00 0.00 C ATOM 1029 O PRO A 68 -7.996 -1.352 -13.611 1.00 0.00 O ATOM 1030 CB PRO A 68 -10.688 -1.743 -14.695 1.00 0.00 C ATOM 1031 CG PRO A 68 -12.118 -1.427 -14.964 1.00 0.00 C ATOM 1032 CD PRO A 68 -12.289 0.043 -14.589 1.00 0.00 C ATOM 0 HA PRO A 68 -10.480 -1.485 -12.499 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.052 -1.454 -15.532 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -10.539 -2.811 -14.535 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.367 -1.596 -16.012 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -12.778 -2.062 -14.373 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -12.087 0.701 -15.435 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.303 0.258 -14.253 1.00 0.00 H new ATOM 1040 N ASN A 69 -8.575 0.717 -13.183 1.00 0.00 N ATOM 1041 CA ASN A 69 -7.155 1.165 -13.142 1.00 0.00 C ATOM 1042 C ASN A 69 -7.053 2.351 -12.186 1.00 0.00 C ATOM 1043 O ASN A 69 -6.720 3.451 -12.581 1.00 0.00 O ATOM 1044 CB ASN A 69 -6.711 1.593 -14.542 1.00 0.00 C ATOM 1045 CG ASN A 69 -7.796 2.464 -15.177 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -7.874 2.573 -16.385 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -8.644 3.094 -14.409 1.00 0.00 N ATOM 0 H ASN A 69 -9.263 1.452 -13.015 1.00 0.00 H new ATOM 0 HA ASN A 69 -6.514 0.352 -12.802 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.773 2.146 -14.485 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -6.526 0.715 -15.161 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -9.371 3.677 -14.823 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -8.579 3.003 -13.395 1.00 0.00 H new ATOM 1054 N TYR A 70 -7.362 2.148 -10.928 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.305 3.282 -9.958 1.00 0.00 C ATOM 1056 C TYR A 70 -6.957 2.782 -8.551 1.00 0.00 C ATOM 1057 O TYR A 70 -7.807 2.323 -7.815 1.00 0.00 O ATOM 1058 CB TYR A 70 -8.672 3.972 -9.925 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.567 5.278 -9.169 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -7.804 6.327 -9.694 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -9.232 5.439 -7.944 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -7.704 7.537 -8.997 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -9.130 6.650 -7.247 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.366 7.698 -7.774 1.00 0.00 C ATOM 1065 OH TYR A 70 -8.266 8.891 -7.086 1.00 0.00 O ATOM 0 H TYR A 70 -7.649 1.252 -10.535 1.00 0.00 H new ATOM 0 HA TYR A 70 -6.531 3.980 -10.277 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.022 4.156 -10.941 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.406 3.323 -9.448 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -7.292 6.203 -10.637 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -9.822 4.630 -7.539 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -7.116 8.347 -9.403 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.641 6.775 -6.304 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.786 8.835 -6.257 1.00 0.00 H new ATOM 1075 N GLN A 71 -5.716 2.911 -8.164 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.295 2.496 -6.790 1.00 0.00 C ATOM 1077 C GLN A 71 -5.531 0.995 -6.551 1.00 0.00 C ATOM 1078 O GLN A 71 -5.043 0.155 -7.280 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.076 3.329 -5.767 1.00 0.00 C ATOM 1080 CG GLN A 71 -6.135 4.787 -6.246 1.00 0.00 C ATOM 1081 CD GLN A 71 -6.507 5.711 -5.082 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -7.320 6.600 -5.237 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -5.946 5.540 -3.917 1.00 0.00 N ATOM 0 H GLN A 71 -4.968 3.289 -8.745 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.225 2.672 -6.681 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.084 2.931 -5.649 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.595 3.273 -4.791 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -5.170 5.081 -6.659 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -6.868 4.885 -7.047 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -5.263 4.794 -3.784 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -6.190 6.152 -3.139 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.249 0.654 -5.506 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.490 -0.790 -5.178 1.00 0.00 C ATOM 1094 C PHE A 72 -7.795 -1.273 -5.822 1.00 0.00 C ATOM 1095 O PHE A 72 -8.534 -2.044 -5.246 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.580 -0.936 -3.649 1.00 0.00 C ATOM 1097 CG PHE A 72 -6.864 -2.373 -3.257 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -5.866 -3.342 -3.384 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -8.122 -2.734 -2.754 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -6.116 -4.667 -3.015 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -8.374 -4.061 -2.383 1.00 0.00 C ATOM 1102 CZ PHE A 72 -7.371 -5.027 -2.514 1.00 0.00 C ATOM 0 H PHE A 72 -6.681 1.317 -4.862 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.671 -1.395 -5.567 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.646 -0.609 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.367 -0.288 -3.264 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.896 -3.066 -3.769 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.897 -1.989 -2.653 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.341 -5.412 -3.117 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -9.343 -4.338 -1.996 1.00 0.00 H new ATOM 0 HZ PHE A 72 -7.566 -6.050 -2.228 1.00 0.00 H new ATOM 1112 N THR A 73 -8.076 -0.842 -7.022 1.00 0.00 N ATOM 1113 CA THR A 73 -9.325 -1.301 -7.699 1.00 0.00 C ATOM 1114 C THR A 73 -9.079 -2.678 -8.320 1.00 0.00 C ATOM 1115 O THR A 73 -9.686 -3.665 -7.957 1.00 0.00 O ATOM 1116 CB THR A 73 -9.692 -0.332 -8.837 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.063 0.931 -8.307 1.00 0.00 O ATOM 1118 CG2 THR A 73 -10.858 -0.912 -9.650 1.00 0.00 C ATOM 0 H THR A 73 -7.499 -0.196 -7.561 1.00 0.00 H new ATOM 0 HA THR A 73 -10.130 -1.341 -6.965 1.00 0.00 H new ATOM 0 HB THR A 73 -8.824 -0.202 -9.484 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.280 1.357 -7.899 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.117 -0.225 -10.456 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.564 -1.873 -10.073 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.722 -1.051 -9.000 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.206 -2.721 -9.288 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.906 -3.993 -10.000 1.00 0.00 C ATOM 1128 C ASN A 74 -6.920 -4.840 -9.196 1.00 0.00 C ATOM 1129 O ASN A 74 -6.874 -6.047 -9.333 1.00 0.00 O ATOM 1130 CB ASN A 74 -7.298 -3.637 -11.359 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.475 -4.794 -12.342 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -7.164 -5.927 -12.035 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -7.967 -4.546 -13.523 1.00 0.00 N ATOM 0 H ASN A 74 -7.679 -1.913 -9.621 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.820 -4.573 -10.127 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -7.775 -2.740 -11.754 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.238 -3.410 -11.242 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.092 -5.305 -14.193 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.227 -3.593 -13.777 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.128 -4.230 -8.358 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.154 -5.023 -7.558 1.00 0.00 C ATOM 1142 C LEU A 75 -5.922 -6.100 -6.778 1.00 0.00 C ATOM 1143 O LEU A 75 -5.346 -6.948 -6.125 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.388 -4.082 -6.615 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.367 -4.842 -5.738 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.557 -5.845 -6.578 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.392 -3.832 -5.096 1.00 0.00 C ATOM 0 H LEU A 75 -6.113 -3.223 -8.193 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.428 -5.514 -8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.868 -3.325 -7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.096 -3.557 -5.974 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.915 -5.387 -4.969 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.846 -6.366 -5.937 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.234 -6.569 -7.033 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.017 -5.312 -7.360 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.671 -4.366 -4.477 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.865 -3.287 -5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.951 -3.129 -4.478 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.226 -6.093 -6.872 1.00 0.00 N ATOM 1160 CA LYS A 76 -8.040 -7.129 -6.181 1.00 0.00 C ATOM 1161 C LYS A 76 -8.148 -8.330 -7.119 1.00 0.00 C ATOM 1162 O LYS A 76 -8.411 -9.443 -6.709 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.442 -6.581 -5.907 1.00 0.00 C ATOM 1164 CG LYS A 76 -9.397 -5.577 -4.751 1.00 0.00 C ATOM 1165 CD LYS A 76 -10.662 -4.712 -4.772 1.00 0.00 C ATOM 1166 CE LYS A 76 -11.899 -5.614 -4.781 1.00 0.00 C ATOM 1167 NZ LYS A 76 -13.102 -4.810 -4.420 1.00 0.00 N ATOM 0 H LYS A 76 -7.763 -5.407 -7.403 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.577 -7.411 -5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.834 -6.099 -6.803 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -10.120 -7.399 -5.663 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.321 -6.105 -3.800 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.512 -4.947 -4.837 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -10.682 -4.058 -3.900 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -10.661 -4.070 -5.653 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.029 -6.061 -5.767 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.770 -6.433 -4.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -13.940 -5.425 -4.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.969 -4.390 -3.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -13.237 -4.053 -5.121 1.00 0.00 H new ATOM 1181 N ALA A 77 -7.944 -8.094 -8.389 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.028 -9.190 -9.392 1.00 0.00 C ATOM 1183 C ALA A 77 -6.719 -9.978 -9.391 1.00 0.00 C ATOM 1184 O ALA A 77 -6.706 -11.183 -9.548 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.250 -8.578 -10.778 1.00 0.00 C ATOM 0 H ALA A 77 -7.720 -7.177 -8.775 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.854 -9.857 -9.144 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.313 -9.373 -11.521 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.178 -8.006 -10.779 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.417 -7.918 -11.022 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.617 -9.302 -9.220 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.297 -9.996 -9.209 1.00 0.00 C ATOM 1193 C ALA A 78 -4.376 -11.255 -8.340 1.00 0.00 C ATOM 1194 O ALA A 78 -5.348 -11.485 -7.649 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.243 -9.052 -8.636 1.00 0.00 C ATOM 0 H ALA A 78 -5.573 -8.292 -9.086 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.029 -10.281 -10.226 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.275 -9.552 -8.624 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.182 -8.157 -9.255 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.519 -8.772 -7.619 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.354 -12.072 -8.369 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.361 -13.321 -7.547 1.00 0.00 C ATOM 1203 C LYS A 79 -1.947 -13.601 -7.034 1.00 0.00 C ATOM 1204 O LYS A 79 -0.999 -12.940 -7.410 1.00 0.00 O ATOM 1205 CB LYS A 79 -3.824 -14.493 -8.414 1.00 0.00 C ATOM 1206 CG LYS A 79 -5.262 -14.251 -8.878 1.00 0.00 C ATOM 1207 CD LYS A 79 -5.804 -15.514 -9.555 1.00 0.00 C ATOM 1208 CE LYS A 79 -5.022 -15.796 -10.843 1.00 0.00 C ATOM 1209 NZ LYS A 79 -5.817 -16.707 -11.714 1.00 0.00 N ATOM 0 H LYS A 79 -2.513 -11.928 -8.928 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.038 -13.198 -6.702 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.166 -14.603 -9.276 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.765 -15.423 -7.848 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.889 -13.985 -8.027 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.294 -13.412 -9.573 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.722 -16.363 -8.877 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.863 -15.389 -9.783 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.814 -14.863 -11.367 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.060 -16.250 -10.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.288 -16.900 -12.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.994 -17.601 -11.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.725 -16.257 -11.950 1.00 0.00 H new ATOM 1223 N LYS A 80 -1.796 -14.578 -6.179 1.00 0.00 N ATOM 1224 CA LYS A 80 -0.440 -14.897 -5.647 1.00 0.00 C ATOM 1225 C LYS A 80 0.548 -15.003 -6.810 1.00 0.00 C ATOM 1226 O LYS A 80 0.176 -15.305 -7.927 1.00 0.00 O ATOM 1227 CB LYS A 80 -0.482 -16.229 -4.885 1.00 0.00 C ATOM 1228 CG LYS A 80 -1.359 -16.093 -3.624 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.956 -17.141 -2.576 1.00 0.00 C ATOM 1230 CE LYS A 80 -1.303 -18.543 -3.081 1.00 0.00 C ATOM 1231 NZ LYS A 80 -2.766 -18.625 -3.348 1.00 0.00 N ATOM 0 H LYS A 80 -2.551 -15.167 -5.827 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.122 -14.106 -4.968 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -0.879 -17.013 -5.530 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.528 -16.528 -4.604 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -1.253 -15.092 -3.206 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.409 -16.219 -3.888 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.113 -17.072 -2.373 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.472 -16.945 -1.636 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.743 -18.763 -3.990 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.015 -19.290 -2.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.074 -19.617 -3.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.280 -18.062 -2.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.967 -18.254 -4.298 1.00 0.00 H new ATOM 1245 N GLY A 81 1.805 -14.750 -6.561 1.00 0.00 N ATOM 1246 CA GLY A 81 2.816 -14.827 -7.655 1.00 0.00 C ATOM 1247 C GLY A 81 2.846 -13.495 -8.407 1.00 0.00 C ATOM 1248 O GLY A 81 3.788 -13.188 -9.112 1.00 0.00 O ATOM 0 H GLY A 81 2.176 -14.493 -5.646 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.800 -15.047 -7.242 1.00 0.00 H new ATOM 0 HA3 GLY A 81 2.568 -15.639 -8.339 1.00 0.00 H new ATOM 1252 N SER A 82 1.825 -12.698 -8.250 1.00 0.00 N ATOM 1253 CA SER A 82 1.792 -11.381 -8.938 1.00 0.00 C ATOM 1254 C SER A 82 2.950 -10.539 -8.421 1.00 0.00 C ATOM 1255 O SER A 82 2.870 -9.939 -7.367 1.00 0.00 O ATOM 1256 CB SER A 82 0.468 -10.677 -8.636 1.00 0.00 C ATOM 1257 OG SER A 82 0.575 -9.304 -8.993 1.00 0.00 O ATOM 0 H SER A 82 1.010 -12.905 -7.672 1.00 0.00 H new ATOM 0 HA SER A 82 1.881 -11.518 -10.016 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.343 -11.147 -9.192 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.225 -10.772 -7.578 1.00 0.00 H new ATOM 0 HG SER A 82 0.757 -9.229 -9.953 1.00 0.00 H new ATOM 1263 N MET A 83 4.034 -10.502 -9.136 1.00 0.00 N ATOM 1264 CA MET A 83 5.191 -9.709 -8.655 1.00 0.00 C ATOM 1265 C MET A 83 4.754 -8.266 -8.410 1.00 0.00 C ATOM 1266 O MET A 83 3.655 -7.880 -8.743 1.00 0.00 O ATOM 1267 CB MET A 83 6.314 -9.743 -9.693 1.00 0.00 C ATOM 1268 CG MET A 83 6.803 -11.181 -9.874 1.00 0.00 C ATOM 1269 SD MET A 83 7.946 -11.256 -11.276 1.00 0.00 S ATOM 1270 CE MET A 83 9.236 -10.197 -10.576 1.00 0.00 C ATOM 0 H MET A 83 4.169 -10.982 -10.026 1.00 0.00 H new ATOM 0 HA MET A 83 5.559 -10.138 -7.723 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.956 -9.348 -10.644 1.00 0.00 H new ATOM 0 HB3 MET A 83 7.138 -9.106 -9.373 1.00 0.00 H new ATOM 0 HG2 MET A 83 7.300 -11.525 -8.967 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.956 -11.846 -10.045 1.00 0.00 H new ATOM 0 HE1 MET A 83 10.188 -10.416 -11.059 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.978 -9.151 -10.741 1.00 0.00 H new ATOM 0 HE3 MET A 83 9.320 -10.385 -9.506 1.00 0.00 H new ATOM 1280 N VAL A 84 5.610 -7.467 -7.823 1.00 0.00 N ATOM 1281 CA VAL A 84 5.246 -6.043 -7.544 1.00 0.00 C ATOM 1282 C VAL A 84 6.476 -5.154 -7.739 1.00 0.00 C ATOM 1283 O VAL A 84 7.441 -5.248 -7.006 1.00 0.00 O ATOM 1284 CB VAL A 84 4.768 -5.920 -6.096 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.120 -4.551 -5.884 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.749 -7.023 -5.797 1.00 0.00 C ATOM 0 H VAL A 84 6.546 -7.740 -7.524 1.00 0.00 H new ATOM 0 HA VAL A 84 4.455 -5.730 -8.225 1.00 0.00 H new ATOM 0 HB VAL A 84 5.620 -6.023 -5.424 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.780 -4.465 -4.852 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.848 -3.767 -6.092 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.269 -4.443 -6.556 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.409 -6.934 -4.765 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.897 -6.923 -6.469 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.214 -7.998 -5.943 1.00 0.00 H new ATOM 1296 N TYR A 85 6.452 -4.289 -8.720 1.00 0.00 N ATOM 1297 CA TYR A 85 7.621 -3.390 -8.956 1.00 0.00 C ATOM 1298 C TYR A 85 7.384 -2.052 -8.254 1.00 0.00 C ATOM 1299 O TYR A 85 6.643 -1.216 -8.732 1.00 0.00 O ATOM 1300 CB TYR A 85 7.782 -3.153 -10.460 1.00 0.00 C ATOM 1301 CG TYR A 85 8.268 -4.423 -11.119 1.00 0.00 C ATOM 1302 CD1 TYR A 85 7.381 -5.487 -11.325 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.604 -4.540 -11.521 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.830 -6.666 -11.933 1.00 0.00 C ATOM 1305 CE2 TYR A 85 10.053 -5.718 -12.130 1.00 0.00 C ATOM 1306 CZ TYR A 85 9.165 -6.782 -12.336 1.00 0.00 C ATOM 1307 OH TYR A 85 9.609 -7.943 -12.934 1.00 0.00 O ATOM 0 H TYR A 85 5.674 -4.166 -9.368 1.00 0.00 H new ATOM 0 HA TYR A 85 8.524 -3.854 -8.560 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.831 -2.846 -10.895 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.490 -2.344 -10.638 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.350 -5.398 -11.015 1.00 0.00 H new ATOM 0 HD2 TYR A 85 10.289 -3.721 -11.361 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.145 -7.486 -12.091 1.00 0.00 H new ATOM 0 HE2 TYR A 85 11.083 -5.807 -12.441 1.00 0.00 H new ATOM 0 HH TYR A 85 10.560 -7.855 -13.152 1.00 0.00 H new ATOM 1317 N PHE A 86 8.016 -1.835 -7.126 1.00 0.00 N ATOM 1318 CA PHE A 86 7.836 -0.541 -6.396 1.00 0.00 C ATOM 1319 C PHE A 86 9.001 0.384 -6.750 1.00 0.00 C ATOM 1320 O PHE A 86 10.135 0.133 -6.396 1.00 0.00 O ATOM 1321 CB PHE A 86 7.802 -0.809 -4.883 1.00 0.00 C ATOM 1322 CG PHE A 86 7.877 0.498 -4.117 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.902 1.485 -4.316 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.917 0.719 -3.201 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.968 2.689 -3.604 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.980 1.923 -2.489 1.00 0.00 C ATOM 1327 CZ PHE A 86 8.006 2.908 -2.691 1.00 0.00 C ATOM 0 H PHE A 86 8.649 -2.498 -6.679 1.00 0.00 H new ATOM 0 HA PHE A 86 6.898 -0.067 -6.685 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.887 -1.340 -4.621 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.636 -1.452 -4.602 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.099 1.317 -5.019 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.669 -0.040 -3.045 1.00 0.00 H new ATOM 0 HE1 PHE A 86 6.217 3.449 -3.760 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.780 2.092 -1.784 1.00 0.00 H new ATOM 0 HZ PHE A 86 8.056 3.837 -2.142 1.00 0.00 H new ATOM 1337 N LYS A 87 8.729 1.449 -7.464 1.00 0.00 N ATOM 1338 CA LYS A 87 9.821 2.392 -7.866 1.00 0.00 C ATOM 1339 C LYS A 87 9.830 3.611 -6.945 1.00 0.00 C ATOM 1340 O LYS A 87 8.798 4.085 -6.513 1.00 0.00 O ATOM 1341 CB LYS A 87 9.588 2.851 -9.306 1.00 0.00 C ATOM 1342 CG LYS A 87 10.727 3.778 -9.734 1.00 0.00 C ATOM 1343 CD LYS A 87 10.647 4.030 -11.241 1.00 0.00 C ATOM 1344 CE LYS A 87 11.534 5.221 -11.610 1.00 0.00 C ATOM 1345 NZ LYS A 87 12.960 4.882 -11.338 1.00 0.00 N ATOM 0 H LYS A 87 7.796 1.707 -7.787 1.00 0.00 H new ATOM 0 HA LYS A 87 10.780 1.879 -7.789 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.537 1.989 -9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.633 3.370 -9.384 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.663 4.722 -9.194 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.688 3.330 -9.481 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.968 3.142 -11.786 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.616 4.228 -11.533 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.403 5.473 -12.662 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.241 6.098 -11.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.574 5.626 -11.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 13.110 4.811 -10.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 13.192 3.972 -11.785 1.00 0.00 H new ATOM 1359 N VAL A 88 10.993 4.126 -6.645 1.00 0.00 N ATOM 1360 CA VAL A 88 11.076 5.319 -5.757 1.00 0.00 C ATOM 1361 C VAL A 88 12.505 5.872 -5.769 1.00 0.00 C ATOM 1362 O VAL A 88 13.467 5.130 -5.763 1.00 0.00 O ATOM 1363 CB VAL A 88 10.696 4.919 -4.330 1.00 0.00 C ATOM 1364 CG1 VAL A 88 11.659 3.844 -3.824 1.00 0.00 C ATOM 1365 CG2 VAL A 88 10.777 6.147 -3.418 1.00 0.00 C ATOM 0 H VAL A 88 11.889 3.770 -6.978 1.00 0.00 H new ATOM 0 HA VAL A 88 10.389 6.085 -6.116 1.00 0.00 H new ATOM 0 HB VAL A 88 9.679 4.526 -4.323 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.386 3.561 -2.807 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.601 2.970 -4.472 1.00 0.00 H new ATOM 0 HG13 VAL A 88 12.677 4.235 -3.831 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.506 5.863 -2.401 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.794 6.540 -3.427 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.089 6.912 -3.776 1.00 0.00 H new ATOM 1375 N GLY A 89 12.651 7.169 -5.783 1.00 0.00 N ATOM 1376 CA GLY A 89 14.016 7.768 -5.790 1.00 0.00 C ATOM 1377 C GLY A 89 14.752 7.373 -7.074 1.00 0.00 C ATOM 1378 O GLY A 89 14.412 7.813 -8.155 1.00 0.00 O ATOM 0 H GLY A 89 11.883 7.840 -5.790 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.947 8.854 -5.720 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.577 7.427 -4.920 1.00 0.00 H new ATOM 1382 N ASN A 90 15.761 6.546 -6.959 1.00 0.00 N ATOM 1383 CA ASN A 90 16.535 6.114 -8.166 1.00 0.00 C ATOM 1384 C ASN A 90 16.822 4.613 -8.072 1.00 0.00 C ATOM 1385 O ASN A 90 17.925 4.164 -8.310 1.00 0.00 O ATOM 1386 CB ASN A 90 17.860 6.880 -8.222 1.00 0.00 C ATOM 1387 CG ASN A 90 18.670 6.414 -9.432 1.00 0.00 C ATOM 1388 OD1 ASN A 90 19.702 5.789 -9.282 1.00 0.00 O ATOM 1389 ND2 ASN A 90 18.246 6.692 -10.635 1.00 0.00 N ATOM 0 H ASN A 90 16.084 6.149 -6.077 1.00 0.00 H new ATOM 0 HA ASN A 90 15.955 6.322 -9.065 1.00 0.00 H new ATOM 0 HB2 ASN A 90 17.670 7.951 -8.289 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.427 6.714 -7.306 1.00 0.00 H new ATOM 0 HD21 ASN A 90 18.780 6.385 -11.448 1.00 0.00 H new ATOM 0 HD22 ASN A 90 17.380 7.216 -10.762 1.00 0.00 H new ATOM 1396 N GLU A 91 15.833 3.834 -7.728 1.00 0.00 N ATOM 1397 CA GLU A 91 16.044 2.364 -7.619 1.00 0.00 C ATOM 1398 C GLU A 91 14.683 1.662 -7.610 1.00 0.00 C ATOM 1399 O GLU A 91 13.746 2.122 -6.986 1.00 0.00 O ATOM 1400 CB GLU A 91 16.802 2.052 -6.321 1.00 0.00 C ATOM 1401 CG GLU A 91 17.435 0.659 -6.408 1.00 0.00 C ATOM 1402 CD GLU A 91 16.336 -0.402 -6.491 1.00 0.00 C ATOM 1403 OE1 GLU A 91 15.521 -0.454 -5.586 1.00 0.00 O ATOM 1404 OE2 GLU A 91 16.330 -1.144 -7.460 1.00 0.00 O ATOM 0 H GLU A 91 14.887 4.153 -7.518 1.00 0.00 H new ATOM 0 HA GLU A 91 16.629 2.009 -8.467 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.575 2.802 -6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.121 2.099 -5.472 1.00 0.00 H new ATOM 0 HG2 GLU A 91 18.081 0.597 -7.284 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.063 0.479 -5.535 1.00 0.00 H new ATOM 1411 N THR A 92 14.566 0.554 -8.304 1.00 0.00 N ATOM 1412 CA THR A 92 13.265 -0.190 -8.354 1.00 0.00 C ATOM 1413 C THR A 92 13.425 -1.558 -7.691 1.00 0.00 C ATOM 1414 O THR A 92 14.281 -2.339 -8.057 1.00 0.00 O ATOM 1415 CB THR A 92 12.851 -0.383 -9.814 1.00 0.00 C ATOM 1416 OG1 THR A 92 12.923 0.862 -10.493 1.00 0.00 O ATOM 1417 CG2 THR A 92 11.419 -0.918 -9.873 1.00 0.00 C ATOM 0 H THR A 92 15.322 0.130 -8.842 1.00 0.00 H new ATOM 0 HA THR A 92 12.502 0.381 -7.824 1.00 0.00 H new ATOM 0 HB THR A 92 13.522 -1.096 -10.292 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.660 0.740 -11.429 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.124 -1.055 -10.913 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.366 -1.874 -9.352 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.745 -0.207 -9.396 1.00 0.00 H new ATOM 1425 N ARG A 93 12.597 -1.858 -6.720 1.00 0.00 N ATOM 1426 CA ARG A 93 12.684 -3.185 -6.029 1.00 0.00 C ATOM 1427 C ARG A 93 11.607 -4.113 -6.601 1.00 0.00 C ATOM 1428 O ARG A 93 10.765 -3.700 -7.375 1.00 0.00 O ATOM 1429 CB ARG A 93 12.476 -3.002 -4.507 1.00 0.00 C ATOM 1430 CG ARG A 93 11.604 -1.761 -4.228 1.00 0.00 C ATOM 1431 CD ARG A 93 12.485 -0.511 -4.096 1.00 0.00 C ATOM 1432 NE ARG A 93 13.079 -0.472 -2.729 1.00 0.00 N ATOM 1433 CZ ARG A 93 14.085 0.320 -2.475 1.00 0.00 C ATOM 1434 NH1 ARG A 93 14.568 1.085 -3.416 1.00 0.00 N ATOM 1435 NH2 ARG A 93 14.608 0.347 -1.280 1.00 0.00 N ATOM 0 H ARG A 93 11.863 -1.240 -6.375 1.00 0.00 H new ATOM 0 HA ARG A 93 13.669 -3.623 -6.193 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.001 -3.890 -4.089 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.441 -2.895 -4.012 1.00 0.00 H new ATOM 0 HG2 ARG A 93 10.885 -1.624 -5.036 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.031 -1.909 -3.313 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.274 -0.526 -4.848 1.00 0.00 H new ATOM 0 HD3 ARG A 93 11.893 0.387 -4.274 1.00 0.00 H new ATOM 0 HE ARG A 93 12.699 -1.065 -1.991 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.159 1.064 -4.350 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.354 1.704 -3.217 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.231 -0.251 -0.545 1.00 0.00 H new ATOM 0 HH22 ARG A 93 15.394 0.966 -1.081 1.00 0.00 H new ATOM 1449 N LYS A 94 11.628 -5.367 -6.225 1.00 0.00 N ATOM 1450 CA LYS A 94 10.608 -6.331 -6.741 1.00 0.00 C ATOM 1451 C LYS A 94 10.197 -7.283 -5.616 1.00 0.00 C ATOM 1452 O LYS A 94 10.972 -7.580 -4.728 1.00 0.00 O ATOM 1453 CB LYS A 94 11.207 -7.137 -7.897 1.00 0.00 C ATOM 1454 CG LYS A 94 12.389 -7.963 -7.386 1.00 0.00 C ATOM 1455 CD LYS A 94 13.176 -8.520 -8.574 1.00 0.00 C ATOM 1456 CE LYS A 94 14.130 -9.613 -8.088 1.00 0.00 C ATOM 1457 NZ LYS A 94 14.770 -9.180 -6.814 1.00 0.00 N ATOM 0 H LYS A 94 12.310 -5.766 -5.580 1.00 0.00 H new ATOM 0 HA LYS A 94 9.734 -5.784 -7.094 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.450 -7.793 -8.327 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.535 -6.466 -8.691 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.037 -7.344 -6.765 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.031 -8.779 -6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.491 -8.925 -9.319 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.738 -7.721 -9.058 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.586 -10.545 -7.936 1.00 0.00 H new ATOM 0 HE3 LYS A 94 14.892 -9.808 -8.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.648 -9.718 -6.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.990 -8.165 -6.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.119 -9.355 -6.022 1.00 0.00 H new ATOM 1471 N TYR A 95 8.980 -7.763 -5.648 1.00 0.00 N ATOM 1472 CA TYR A 95 8.502 -8.698 -4.583 1.00 0.00 C ATOM 1473 C TYR A 95 7.676 -9.810 -5.227 1.00 0.00 C ATOM 1474 O TYR A 95 7.488 -9.833 -6.428 1.00 0.00 O ATOM 1475 CB TYR A 95 7.625 -7.936 -3.583 1.00 0.00 C ATOM 1476 CG TYR A 95 8.391 -6.760 -3.020 1.00 0.00 C ATOM 1477 CD1 TYR A 95 8.649 -5.642 -3.824 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.841 -6.785 -1.692 1.00 0.00 C ATOM 1479 CE1 TYR A 95 9.355 -4.551 -3.301 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.547 -5.695 -1.171 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.804 -4.578 -1.975 1.00 0.00 C ATOM 1482 OH TYR A 95 10.501 -3.503 -1.461 1.00 0.00 O ATOM 0 H TYR A 95 8.293 -7.547 -6.370 1.00 0.00 H new ATOM 0 HA TYR A 95 9.360 -9.124 -4.063 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.716 -7.588 -4.074 1.00 0.00 H new ATOM 0 HB3 TYR A 95 7.317 -8.601 -2.776 1.00 0.00 H new ATOM 0 HD1 TYR A 95 8.304 -5.621 -4.847 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.643 -7.646 -1.071 1.00 0.00 H new ATOM 0 HE1 TYR A 95 9.553 -3.689 -3.921 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.894 -5.715 -0.148 1.00 0.00 H new ATOM 0 HH TYR A 95 11.321 -3.821 -1.029 1.00 0.00 H new ATOM 1492 N LYS A 96 7.183 -10.734 -4.438 1.00 0.00 N ATOM 1493 CA LYS A 96 6.366 -11.856 -5.000 1.00 0.00 C ATOM 1494 C LYS A 96 5.120 -12.073 -4.141 1.00 0.00 C ATOM 1495 O LYS A 96 5.191 -12.580 -3.038 1.00 0.00 O ATOM 1496 CB LYS A 96 7.205 -13.135 -5.008 1.00 0.00 C ATOM 1497 CG LYS A 96 6.537 -14.184 -5.901 1.00 0.00 C ATOM 1498 CD LYS A 96 7.362 -15.471 -5.881 1.00 0.00 C ATOM 1499 CE LYS A 96 6.747 -16.490 -6.842 1.00 0.00 C ATOM 1500 NZ LYS A 96 7.447 -17.798 -6.694 1.00 0.00 N ATOM 0 H LYS A 96 7.311 -10.760 -3.426 1.00 0.00 H new ATOM 0 HA LYS A 96 6.062 -11.606 -6.016 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.210 -12.920 -5.372 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.309 -13.520 -3.993 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.524 -14.383 -5.551 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.454 -13.809 -6.921 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.392 -15.259 -6.170 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.392 -15.880 -4.871 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.684 -16.608 -6.632 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.831 -16.134 -7.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.029 -18.491 -7.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.456 -17.679 -6.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.344 -18.138 -5.716 1.00 0.00 H new ATOM 1514 N MET A 97 3.976 -11.704 -4.647 1.00 0.00 N ATOM 1515 CA MET A 97 2.715 -11.900 -3.881 1.00 0.00 C ATOM 1516 C MET A 97 2.663 -13.344 -3.375 1.00 0.00 C ATOM 1517 O MET A 97 2.852 -14.276 -4.132 1.00 0.00 O ATOM 1518 CB MET A 97 1.533 -11.635 -4.814 1.00 0.00 C ATOM 1519 CG MET A 97 0.241 -11.524 -4.010 1.00 0.00 C ATOM 1520 SD MET A 97 -1.152 -11.380 -5.159 1.00 0.00 S ATOM 1521 CE MET A 97 -1.216 -9.572 -5.221 1.00 0.00 C ATOM 0 H MET A 97 3.861 -11.272 -5.564 1.00 0.00 H new ATOM 0 HA MET A 97 2.672 -11.218 -3.032 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.702 -10.715 -5.374 1.00 0.00 H new ATOM 0 HB3 MET A 97 1.448 -12.441 -5.543 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.116 -12.400 -3.374 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.279 -10.655 -3.353 1.00 0.00 H new ATOM 0 HE1 MET A 97 -1.718 -9.257 -6.136 1.00 0.00 H new ATOM 0 HE2 MET A 97 -1.766 -9.198 -4.357 1.00 0.00 H new ATOM 0 HE3 MET A 97 -0.202 -9.171 -5.207 1.00 0.00 H new ATOM 1531 N THR A 98 2.423 -13.551 -2.107 1.00 0.00 N ATOM 1532 CA THR A 98 2.380 -14.952 -1.590 1.00 0.00 C ATOM 1533 C THR A 98 1.605 -15.018 -0.269 1.00 0.00 C ATOM 1534 O THR A 98 1.501 -16.063 0.341 1.00 0.00 O ATOM 1535 CB THR A 98 3.816 -15.449 -1.371 1.00 0.00 C ATOM 1536 OG1 THR A 98 4.494 -15.482 -2.619 1.00 0.00 O ATOM 1537 CG2 THR A 98 3.804 -16.858 -0.763 1.00 0.00 C ATOM 0 H THR A 98 2.257 -12.821 -1.414 1.00 0.00 H new ATOM 0 HA THR A 98 1.872 -15.584 -2.319 1.00 0.00 H new ATOM 0 HB THR A 98 4.327 -14.772 -0.686 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.843 -15.405 -3.347 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.829 -17.198 -0.613 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.285 -16.836 0.195 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.290 -17.542 -1.439 1.00 0.00 H new ATOM 1545 N SER A 99 1.046 -13.924 0.180 1.00 0.00 N ATOM 1546 CA SER A 99 0.275 -13.952 1.455 1.00 0.00 C ATOM 1547 C SER A 99 -0.828 -12.909 1.357 1.00 0.00 C ATOM 1548 O SER A 99 -0.579 -11.750 1.107 1.00 0.00 O ATOM 1549 CB SER A 99 1.204 -13.631 2.622 1.00 0.00 C ATOM 1550 OG SER A 99 0.428 -13.365 3.783 1.00 0.00 O ATOM 0 H SER A 99 1.091 -13.015 -0.281 1.00 0.00 H new ATOM 0 HA SER A 99 -0.158 -14.938 1.622 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.878 -14.468 2.805 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.825 -12.768 2.380 1.00 0.00 H new ATOM 0 HG SER A 99 1.023 -13.160 4.534 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.057 -13.316 1.507 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.188 -12.351 1.380 1.00 0.00 C ATOM 1558 C ILE A 100 -4.246 -12.658 2.443 1.00 0.00 C ATOM 1559 O ILE A 100 -4.348 -13.768 2.927 1.00 0.00 O ATOM 1560 CB ILE A 100 -3.798 -12.506 -0.020 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -2.835 -11.956 -1.080 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.117 -11.736 -0.101 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.302 -12.381 -2.476 1.00 0.00 C ATOM 0 H ILE A 100 -2.329 -14.277 1.713 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.832 -11.331 1.523 1.00 0.00 H new ATOM 0 HB ILE A 100 -3.977 -13.565 -0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.792 -10.869 -1.016 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -1.827 -12.326 -0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.544 -11.850 -1.097 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.813 -12.128 0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.934 -10.680 0.096 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.615 -11.988 -3.225 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.322 -13.469 -2.537 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.302 -11.989 -2.660 1.00 0.00 H new ATOM 1842 N ASP A 118 10.966 -11.351 6.226 1.00 0.00 N ATOM 1843 CA ASP A 118 11.677 -10.430 5.277 1.00 0.00 C ATOM 1844 C ASP A 118 10.792 -9.230 4.937 1.00 0.00 C ATOM 1845 O ASP A 118 9.607 -9.220 5.202 1.00 0.00 O ATOM 1846 CB ASP A 118 11.994 -11.194 3.990 1.00 0.00 C ATOM 1847 CG ASP A 118 12.750 -12.480 4.330 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.743 -12.390 5.035 1.00 0.00 O ATOM 1849 OD2 ASP A 118 12.325 -13.530 3.881 1.00 0.00 O ATOM 0 HA ASP A 118 12.594 -10.074 5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.072 -11.432 3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.593 -10.573 3.325 1.00 0.00 H new ATOM 1854 N LYS A 119 11.367 -8.225 4.328 1.00 0.00 N ATOM 1855 CA LYS A 119 10.577 -7.024 3.938 1.00 0.00 C ATOM 1856 C LYS A 119 9.292 -7.487 3.254 1.00 0.00 C ATOM 1857 O LYS A 119 9.202 -8.599 2.777 1.00 0.00 O ATOM 1858 CB LYS A 119 11.400 -6.160 2.974 1.00 0.00 C ATOM 1859 CG LYS A 119 10.806 -4.750 2.909 1.00 0.00 C ATOM 1860 CD LYS A 119 11.690 -3.868 2.024 1.00 0.00 C ATOM 1861 CE LYS A 119 11.008 -2.517 1.803 1.00 0.00 C ATOM 1862 NZ LYS A 119 10.525 -1.983 3.108 1.00 0.00 N ATOM 0 H LYS A 119 12.357 -8.187 4.084 1.00 0.00 H new ATOM 0 HA LYS A 119 10.333 -6.432 4.820 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.437 -6.113 3.307 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.404 -6.609 1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 119 9.793 -4.788 2.508 1.00 0.00 H new ATOM 0 HG3 LYS A 119 10.736 -4.326 3.911 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.663 -3.723 2.494 1.00 0.00 H new ATOM 0 HD3 LYS A 119 11.868 -4.358 1.067 1.00 0.00 H new ATOM 0 HE2 LYS A 119 11.707 -1.815 1.347 1.00 0.00 H new ATOM 0 HE3 LYS A 119 10.172 -2.628 1.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 10.554 -0.944 3.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 9.548 -2.300 3.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 11.136 -2.333 3.874 1.00 0.00 H new ATOM 1876 N GLN A 120 8.284 -6.666 3.234 1.00 0.00 N ATOM 1877 CA GLN A 120 7.000 -7.094 2.617 1.00 0.00 C ATOM 1878 C GLN A 120 6.180 -5.863 2.215 1.00 0.00 C ATOM 1879 O GLN A 120 6.421 -4.769 2.684 1.00 0.00 O ATOM 1880 CB GLN A 120 6.223 -7.947 3.636 1.00 0.00 C ATOM 1881 CG GLN A 120 6.435 -7.392 5.054 1.00 0.00 C ATOM 1882 CD GLN A 120 5.956 -8.397 6.090 1.00 0.00 C ATOM 1883 OE1 GLN A 120 4.831 -8.851 6.050 1.00 0.00 O ATOM 1884 NE2 GLN A 120 6.785 -8.764 7.027 1.00 0.00 N ATOM 0 H GLN A 120 8.292 -5.720 3.616 1.00 0.00 H new ATOM 0 HA GLN A 120 7.194 -7.684 1.721 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.161 -7.945 3.390 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.559 -8.983 3.588 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.491 -7.172 5.212 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.893 -6.454 5.170 1.00 0.00 H new ATOM 0 HE21 GLN A 120 7.729 -8.378 7.053 1.00 0.00 H new ATOM 0 HE22 GLN A 120 6.490 -9.438 7.734 1.00 0.00 H new ATOM 1893 N LEU A 121 5.212 -6.041 1.346 1.00 0.00 N ATOM 1894 CA LEU A 121 4.360 -4.889 0.897 1.00 0.00 C ATOM 1895 C LEU A 121 2.917 -5.096 1.356 1.00 0.00 C ATOM 1896 O LEU A 121 2.173 -5.860 0.771 1.00 0.00 O ATOM 1897 CB LEU A 121 4.371 -4.803 -0.631 1.00 0.00 C ATOM 1898 CG LEU A 121 5.809 -4.700 -1.158 1.00 0.00 C ATOM 1899 CD1 LEU A 121 5.781 -4.478 -2.677 1.00 0.00 C ATOM 1900 CD2 LEU A 121 6.537 -3.528 -0.477 1.00 0.00 C ATOM 0 H LEU A 121 4.973 -6.939 0.926 1.00 0.00 H new ATOM 0 HA LEU A 121 4.760 -3.972 1.329 1.00 0.00 H new ATOM 0 HB2 LEU A 121 3.886 -5.683 -1.053 1.00 0.00 H new ATOM 0 HB3 LEU A 121 3.796 -3.936 -0.956 1.00 0.00 H new ATOM 0 HG LEU A 121 6.340 -5.625 -0.934 1.00 0.00 H new ATOM 0 HD11 LEU A 121 6.802 -4.405 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 121 5.277 -5.316 -3.158 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.245 -3.555 -2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 121 7.556 -3.463 -0.857 1.00 0.00 H new ATOM 0 HD22 LEU A 121 6.010 -2.598 -0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 121 6.561 -3.691 0.600 1.00 0.00 H new ATOM 1912 N THR A 122 2.508 -4.401 2.384 1.00 0.00 N ATOM 1913 CA THR A 122 1.102 -4.526 2.875 1.00 0.00 C ATOM 1914 C THR A 122 0.292 -3.350 2.328 1.00 0.00 C ATOM 1915 O THR A 122 0.820 -2.277 2.115 1.00 0.00 O ATOM 1916 CB THR A 122 1.093 -4.490 4.405 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.782 -5.626 4.907 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.350 -4.502 4.911 1.00 0.00 C ATOM 0 H THR A 122 3.090 -3.748 2.909 1.00 0.00 H new ATOM 0 HA THR A 122 0.667 -5.467 2.538 1.00 0.00 H new ATOM 0 HB THR A 122 1.588 -3.582 4.750 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.494 -5.335 5.515 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.354 -4.476 6.001 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.878 -3.630 4.526 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.848 -5.409 4.568 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.984 -3.535 2.090 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.818 -2.412 1.549 1.00 0.00 C ATOM 1928 C LEU A 123 -3.202 -2.439 2.195 1.00 0.00 C ATOM 1929 O LEU A 123 -3.658 -3.456 2.686 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.956 -2.560 0.022 1.00 0.00 C ATOM 1931 CG LEU A 123 -2.644 -1.306 -0.598 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -2.002 -0.960 -1.951 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -4.140 -1.578 -0.829 1.00 0.00 C ATOM 0 H LEU A 123 -1.484 -4.410 2.246 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.334 -1.462 1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -0.971 -2.698 -0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.539 -3.452 -0.210 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.519 -0.476 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -2.492 -0.082 -2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.942 -0.750 -1.808 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -2.116 -1.802 -2.634 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -4.608 -0.694 -1.262 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.256 -2.421 -1.511 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.618 -1.812 0.122 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.872 -1.314 2.183 1.00 0.00 N ATOM 1946 CA ILE A 124 -5.239 -1.213 2.778 1.00 0.00 C ATOM 1947 C ILE A 124 -6.170 -0.584 1.741 1.00 0.00 C ATOM 1948 O ILE A 124 -5.750 0.207 0.923 1.00 0.00 O ATOM 1949 CB ILE A 124 -5.180 -0.296 4.007 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -4.215 -0.881 5.055 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.580 -0.153 4.615 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.724 0.234 5.982 1.00 0.00 C ATOM 0 H ILE A 124 -3.522 -0.446 1.778 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.600 -2.200 3.067 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.819 0.686 3.700 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.718 -1.655 5.635 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -3.368 -1.355 4.559 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.533 0.499 5.487 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.255 0.278 3.876 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.948 -1.134 4.915 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.041 -0.183 6.723 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.205 0.992 5.396 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.576 0.688 6.489 1.00 0.00 H new ATOM 1964 N THR A 125 -7.432 -0.914 1.758 1.00 0.00 N ATOM 1965 CA THR A 125 -8.362 -0.300 0.763 1.00 0.00 C ATOM 1966 C THR A 125 -8.935 0.987 1.356 1.00 0.00 C ATOM 1967 O THR A 125 -8.861 1.218 2.545 1.00 0.00 O ATOM 1968 CB THR A 125 -9.505 -1.264 0.451 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.535 -1.105 1.417 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.989 -2.700 0.481 1.00 0.00 C ATOM 0 H THR A 125 -7.858 -1.574 2.409 1.00 0.00 H new ATOM 0 HA THR A 125 -7.820 -0.083 -0.157 1.00 0.00 H new ATOM 0 HB THR A 125 -9.902 -1.047 -0.541 1.00 0.00 H new ATOM 0 HG1 THR A 125 -11.275 -0.596 1.025 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.807 -3.385 0.258 1.00 0.00 H new ATOM 0 HG22 THR A 125 -8.202 -2.820 -0.264 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.589 -2.922 1.470 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.502 1.832 0.539 1.00 0.00 N ATOM 1979 CA CYS A 126 -10.069 3.110 1.062 1.00 0.00 C ATOM 1980 C CYS A 126 -11.307 3.491 0.243 1.00 0.00 C ATOM 1981 O CYS A 126 -11.240 4.300 -0.660 1.00 0.00 O ATOM 1982 CB CYS A 126 -9.005 4.211 0.951 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.969 4.193 2.434 1.00 0.00 S ATOM 0 H CYS A 126 -9.598 1.694 -0.467 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.358 2.990 2.106 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.392 4.052 0.064 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.483 5.184 0.839 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.682 4.535 3.466 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.438 2.914 0.559 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.693 3.235 -0.189 1.00 0.00 C ATOM 1991 C ASP A 127 -14.846 3.382 0.806 1.00 0.00 C ATOM 1992 O ASP A 127 -15.015 2.575 1.697 1.00 0.00 O ATOM 1993 CB ASP A 127 -14.006 2.101 -1.168 1.00 0.00 C ATOM 1994 CG ASP A 127 -14.024 0.769 -0.418 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -13.129 0.550 0.382 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -14.932 -0.010 -0.656 1.00 0.00 O ATOM 0 H ASP A 127 -12.548 2.230 1.308 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.564 4.165 -0.742 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.970 2.275 -1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.258 2.074 -1.961 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.636 4.412 0.658 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.782 4.628 1.588 1.00 0.00 C ATOM 2003 C ASP A 128 -16.255 5.001 2.979 1.00 0.00 C ATOM 2004 O ASP A 128 -16.479 4.301 3.944 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.629 3.346 1.675 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.623 2.643 0.316 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -18.062 3.252 -0.647 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -17.179 1.509 0.259 1.00 0.00 O ATOM 0 H ASP A 128 -15.536 5.117 -0.072 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.403 5.441 1.212 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -17.229 2.683 2.442 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.650 3.590 1.966 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.560 6.098 3.092 1.00 0.00 N ATOM 2014 CA TYR A 129 -15.030 6.495 4.426 1.00 0.00 C ATOM 2015 C TYR A 129 -16.201 6.746 5.381 1.00 0.00 C ATOM 2016 O TYR A 129 -17.098 7.511 5.088 1.00 0.00 O ATOM 2017 CB TYR A 129 -14.181 7.766 4.288 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.584 8.137 5.627 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.364 8.781 6.595 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.244 7.841 5.894 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.798 9.128 7.829 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.678 8.186 7.125 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.456 8.830 8.094 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.900 9.171 9.310 1.00 0.00 O ATOM 0 H TYR A 129 -15.337 6.733 2.325 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.405 5.696 4.825 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.387 7.606 3.559 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.796 8.585 3.915 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.400 9.010 6.391 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.644 7.344 5.146 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.398 9.626 8.577 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.642 7.956 7.328 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.299 8.456 9.607 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.206 6.101 6.523 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.330 6.299 7.488 1.00 0.00 C ATOM 2036 C ASN A 130 -17.040 7.518 8.369 1.00 0.00 C ATOM 2037 O ASN A 130 -16.065 7.559 9.093 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.462 5.054 8.367 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.599 5.251 9.369 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -19.320 6.228 9.306 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -18.793 4.356 10.299 1.00 0.00 N ATOM 0 H ASN A 130 -15.483 5.449 6.826 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.258 6.462 6.941 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.657 4.179 7.748 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.527 4.869 8.895 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.549 4.476 10.973 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -18.188 3.536 10.352 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.882 8.517 8.305 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.664 9.744 9.128 1.00 0.00 C ATOM 2050 C GLU A 131 -18.237 9.537 10.532 1.00 0.00 C ATOM 2051 O GLU A 131 -18.190 10.421 11.364 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.366 10.931 8.462 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.774 10.517 8.032 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.589 11.764 7.684 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -20.360 12.321 6.624 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.429 12.141 8.485 1.00 0.00 O ATOM 0 H GLU A 131 -18.714 8.536 7.716 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.595 9.943 9.203 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.418 11.771 9.155 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.794 11.266 7.597 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.722 9.852 7.170 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.262 9.963 8.833 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.775 8.382 10.804 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.347 8.129 12.157 1.00 0.00 C ATOM 2065 C LYS A 132 -18.220 7.775 13.128 1.00 0.00 C ATOM 2066 O LYS A 132 -18.081 8.371 14.178 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.340 6.968 12.083 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.519 7.361 11.192 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.524 6.210 11.139 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.828 6.700 10.506 1.00 0.00 C ATOM 2071 NZ LYS A 132 -23.552 7.208 9.133 1.00 0.00 N ATOM 0 H LYS A 132 -18.844 7.602 10.150 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.861 9.024 12.507 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.849 6.080 11.684 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.694 6.714 13.082 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.999 8.259 11.581 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.167 7.597 10.188 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.115 5.382 10.560 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.714 5.833 12.144 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -24.553 5.887 10.466 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -24.267 7.489 11.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -24.449 7.334 8.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -23.057 8.120 9.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -22.957 6.524 8.623 1.00 0.00 H new ATOM 2085 N THR A 133 -17.410 6.809 12.784 1.00 0.00 N ATOM 2086 CA THR A 133 -16.284 6.410 13.682 1.00 0.00 C ATOM 2087 C THR A 133 -15.011 7.139 13.254 1.00 0.00 C ATOM 2088 O THR A 133 -13.999 7.089 13.926 1.00 0.00 O ATOM 2089 CB THR A 133 -16.063 4.900 13.576 1.00 0.00 C ATOM 2090 OG1 THR A 133 -15.633 4.578 12.260 1.00 0.00 O ATOM 2091 CG2 THR A 133 -17.371 4.168 13.880 1.00 0.00 C ATOM 0 H THR A 133 -17.479 6.277 11.917 1.00 0.00 H new ATOM 0 HA THR A 133 -16.527 6.673 14.711 1.00 0.00 H new ATOM 0 HB THR A 133 -15.302 4.592 14.294 1.00 0.00 H new ATOM 0 HG1 THR A 133 -15.489 3.611 12.190 1.00 0.00 H new ATOM 0 HG21 THR A 133 -17.212 3.092 13.804 1.00 0.00 H new ATOM 0 HG22 THR A 133 -17.701 4.416 14.889 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.134 4.473 13.164 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.050 7.818 12.139 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.839 8.550 11.670 1.00 0.00 C ATOM 2101 C GLY A 134 -12.801 7.546 11.169 1.00 0.00 C ATOM 2102 O GLY A 134 -11.621 7.678 11.427 1.00 0.00 O ATOM 0 H GLY A 134 -15.867 7.897 11.534 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.106 9.243 10.872 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.423 9.145 12.483 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.231 6.537 10.454 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.271 5.516 9.935 1.00 0.00 C ATOM 2108 C VAL A 135 -12.760 4.992 8.585 1.00 0.00 C ATOM 2109 O VAL A 135 -13.915 5.133 8.237 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.198 4.342 10.921 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -10.915 3.541 10.680 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.204 4.875 12.356 1.00 0.00 C ATOM 0 H VAL A 135 -14.207 6.376 10.207 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.288 5.972 9.821 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.061 3.694 10.770 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -10.868 2.709 11.383 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -10.913 3.156 9.660 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.050 4.188 10.825 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.152 4.040 13.055 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.343 5.527 12.506 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.121 5.438 12.531 1.00 0.00 H new ATOM 2122 N TRP A 136 -11.897 4.370 7.832 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.325 3.822 6.524 1.00 0.00 C ATOM 2124 C TRP A 136 -13.322 2.692 6.770 1.00 0.00 C ATOM 2125 O TRP A 136 -12.988 1.674 7.343 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.100 3.296 5.764 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.416 4.439 5.089 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.249 4.995 5.479 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.853 5.181 3.918 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.947 6.035 4.620 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.901 6.185 3.639 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.972 5.076 3.080 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -10.052 7.060 2.568 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -12.131 5.955 1.994 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -11.171 6.946 1.738 1.00 0.00 C ATOM 0 H TRP A 136 -10.916 4.220 8.069 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.799 4.600 5.925 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.415 2.801 6.452 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.405 2.552 5.028 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.651 4.680 6.321 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.116 6.621 4.703 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.716 4.316 3.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.310 7.822 2.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.996 5.867 1.354 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -11.296 7.619 0.902 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.550 2.878 6.351 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.601 1.834 6.557 1.00 0.00 C ATOM 2148 C GLU A 137 -15.006 0.437 6.344 1.00 0.00 C ATOM 2149 O GLU A 137 -14.635 -0.240 7.282 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.741 2.055 5.562 1.00 0.00 C ATOM 2151 CG GLU A 137 -17.777 0.938 5.713 1.00 0.00 C ATOM 2152 CD GLU A 137 -19.072 1.344 5.007 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.628 2.368 5.372 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -19.487 0.625 4.112 1.00 0.00 O ATOM 0 H GLU A 137 -14.872 3.718 5.870 1.00 0.00 H new ATOM 0 HA GLU A 137 -15.980 1.909 7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.208 3.024 5.738 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.351 2.069 4.544 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -17.393 0.011 5.287 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -17.970 0.747 6.769 1.00 0.00 H new ATOM 2161 N LYS A 138 -14.899 0.009 5.116 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.312 -1.334 4.842 1.00 0.00 C ATOM 2163 C LYS A 138 -12.785 -1.210 4.828 1.00 0.00 C ATOM 2164 O LYS A 138 -12.247 -0.183 4.465 1.00 0.00 O ATOM 2165 CB LYS A 138 -14.808 -1.837 3.482 1.00 0.00 C ATOM 2166 CG LYS A 138 -14.571 -3.345 3.376 1.00 0.00 C ATOM 2167 CD LYS A 138 -14.861 -3.815 1.946 1.00 0.00 C ATOM 2168 CE LYS A 138 -16.342 -3.597 1.605 1.00 0.00 C ATOM 2169 NZ LYS A 138 -16.546 -2.193 1.148 1.00 0.00 N ATOM 0 H LYS A 138 -15.193 0.531 4.290 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.615 -2.042 5.614 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -15.869 -1.616 3.366 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.285 -1.319 2.678 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -13.541 -3.581 3.645 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.213 -3.874 4.080 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.234 -3.268 1.242 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -14.609 -4.871 1.844 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.653 -4.293 0.826 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.961 -3.800 2.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -17.140 -1.687 1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -15.625 -1.716 1.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.016 -2.195 0.220 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.077 -2.235 5.231 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.583 -2.146 5.247 1.00 0.00 C ATOM 2185 C ARG A 139 -9.961 -3.519 4.970 1.00 0.00 C ATOM 2186 O ARG A 139 -9.422 -4.150 5.857 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.117 -1.668 6.625 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.621 -0.247 6.883 1.00 0.00 C ATOM 2189 CD ARG A 139 -9.994 0.290 8.173 1.00 0.00 C ATOM 2190 NE ARG A 139 -10.583 -0.421 9.342 1.00 0.00 N ATOM 2191 CZ ARG A 139 -10.002 -0.352 10.509 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.900 0.331 10.650 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -10.523 -0.968 11.535 1.00 0.00 N ATOM 0 H ARG A 139 -12.464 -3.124 5.548 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.269 -1.444 4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -10.489 -2.341 7.398 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -9.029 -1.692 6.679 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -10.364 0.400 6.044 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -11.708 -0.244 6.966 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.914 0.147 8.153 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.172 1.362 8.258 1.00 0.00 H new ATOM 0 HE ARG A 139 -11.441 -0.962 9.231 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.492 0.812 9.848 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.446 0.385 11.562 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.384 -1.503 11.425 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -10.069 -0.914 12.447 1.00 0.00 H new ATOM 2207 N LYS A 140 -10.004 -3.980 3.750 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.383 -5.300 3.441 1.00 0.00 C ATOM 2209 C LYS A 140 -7.864 -5.111 3.374 1.00 0.00 C ATOM 2210 O LYS A 140 -7.386 -4.005 3.198 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.910 -5.823 2.099 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.423 -5.561 1.990 1.00 0.00 C ATOM 2213 CD LYS A 140 -12.060 -6.538 0.991 1.00 0.00 C ATOM 2214 CE LYS A 140 -11.535 -6.256 -0.418 1.00 0.00 C ATOM 2215 NZ LYS A 140 -11.807 -4.836 -0.779 1.00 0.00 N ATOM 0 H LYS A 140 -10.439 -3.505 2.959 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.634 -6.026 4.214 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.387 -5.333 1.278 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.710 -6.891 2.012 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.890 -5.674 2.968 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.599 -4.534 1.669 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -11.830 -7.565 1.276 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -13.145 -6.437 1.011 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -10.464 -6.455 -0.464 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -12.014 -6.922 -1.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -12.354 -4.801 -1.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.351 -4.382 -0.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -10.906 -4.332 -0.909 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.091 -6.167 3.532 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.598 -6.010 3.497 1.00 0.00 C ATOM 2231 C ILE A 141 -4.932 -7.179 2.757 1.00 0.00 C ATOM 2232 O ILE A 141 -5.435 -8.286 2.711 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.050 -5.953 4.938 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -5.751 -7.022 5.824 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -5.255 -4.547 5.516 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -7.002 -6.456 6.517 1.00 0.00 C ATOM 0 H ILE A 141 -7.426 -7.119 3.682 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.369 -5.086 2.967 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.982 -6.172 4.924 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -6.031 -7.877 5.209 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -5.052 -7.386 6.577 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.866 -4.512 6.534 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -4.726 -3.820 4.900 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -6.319 -4.309 5.525 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -7.463 -7.233 7.126 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -6.718 -5.617 7.153 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -7.713 -6.116 5.764 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.774 -6.921 2.197 1.00 0.00 N ATOM 2249 CA PHE A 142 -3.005 -7.978 1.466 1.00 0.00 C ATOM 2250 C PHE A 142 -1.535 -7.866 1.904 1.00 0.00 C ATOM 2251 O PHE A 142 -1.164 -6.927 2.582 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.174 -7.759 -0.066 1.00 0.00 C ATOM 2253 CG PHE A 142 -1.897 -7.242 -0.715 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -1.322 -6.045 -0.271 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -1.294 -7.961 -1.757 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -0.149 -5.567 -0.866 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -0.120 -7.482 -2.351 1.00 0.00 C ATOM 2258 CZ PHE A 142 0.452 -6.285 -1.906 1.00 0.00 C ATOM 0 H PHE A 142 -3.322 -6.007 2.216 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.369 -8.979 1.696 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -3.464 -8.698 -0.536 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -3.983 -7.050 -0.243 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.784 -5.490 0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -1.735 -8.885 -2.102 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.293 -4.643 -0.522 1.00 0.00 H new ATOM 0 HE2 PHE A 142 0.344 -8.037 -3.153 1.00 0.00 H new ATOM 0 HZ PHE A 142 1.357 -5.915 -2.365 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.690 -8.794 1.532 1.00 0.00 N ATOM 2269 CA VAL A 143 0.736 -8.677 1.959 1.00 0.00 C ATOM 2270 C VAL A 143 1.649 -9.583 1.109 1.00 0.00 C ATOM 2271 O VAL A 143 1.545 -10.798 1.124 1.00 0.00 O ATOM 2272 CB VAL A 143 0.841 -9.039 3.452 1.00 0.00 C ATOM 2273 CG1 VAL A 143 0.019 -10.293 3.746 1.00 0.00 C ATOM 2274 CG2 VAL A 143 2.304 -9.287 3.835 1.00 0.00 C ATOM 0 H VAL A 143 -0.918 -9.610 0.964 1.00 0.00 H new ATOM 0 HA VAL A 143 1.072 -7.651 1.808 1.00 0.00 H new ATOM 0 HB VAL A 143 0.453 -8.207 4.039 1.00 0.00 H new ATOM 0 HG11 VAL A 143 0.100 -10.541 4.804 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -1.026 -10.110 3.495 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.396 -11.123 3.149 1.00 0.00 H new ATOM 0 HG21 VAL A 143 2.365 -9.542 4.893 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.702 -10.109 3.240 1.00 0.00 H new ATOM 0 HG23 VAL A 143 2.888 -8.386 3.645 1.00 0.00 H new ATOM 2284 N ALA A 144 2.567 -8.989 0.387 1.00 0.00 N ATOM 2285 CA ALA A 144 3.522 -9.787 -0.440 1.00 0.00 C ATOM 2286 C ALA A 144 4.820 -9.951 0.358 1.00 0.00 C ATOM 2287 O ALA A 144 4.946 -9.431 1.449 1.00 0.00 O ATOM 2288 CB ALA A 144 3.813 -9.046 -1.747 1.00 0.00 C ATOM 0 H ALA A 144 2.696 -7.978 0.335 1.00 0.00 H new ATOM 0 HA ALA A 144 3.096 -10.762 -0.676 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.510 -9.630 -2.349 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.884 -8.906 -2.300 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.252 -8.074 -1.524 1.00 0.00 H new ATOM 2294 N THR A 145 5.791 -10.658 -0.163 1.00 0.00 N ATOM 2295 CA THR A 145 7.072 -10.829 0.595 1.00 0.00 C ATOM 2296 C THR A 145 8.250 -10.928 -0.377 1.00 0.00 C ATOM 2297 O THR A 145 8.248 -11.722 -1.298 1.00 0.00 O ATOM 2298 CB THR A 145 7.004 -12.101 1.447 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.135 -12.152 2.305 1.00 0.00 O ATOM 2300 CG2 THR A 145 6.991 -13.337 0.545 1.00 0.00 C ATOM 0 H THR A 145 5.755 -11.121 -1.071 1.00 0.00 H new ATOM 0 HA THR A 145 7.216 -9.964 1.243 1.00 0.00 H new ATOM 0 HB THR A 145 6.090 -12.086 2.041 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.094 -12.964 2.853 1.00 0.00 H new ATOM 0 HG21 THR A 145 6.943 -14.236 1.160 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.122 -13.299 -0.111 1.00 0.00 H new ATOM 0 HG23 THR A 145 7.900 -13.358 -0.057 1.00 0.00 H new ATOM 2308 N GLU A 146 9.260 -10.125 -0.171 1.00 0.00 N ATOM 2309 CA GLU A 146 10.447 -10.172 -1.069 1.00 0.00 C ATOM 2310 C GLU A 146 11.123 -11.537 -0.941 1.00 0.00 C ATOM 2311 O GLU A 146 11.597 -11.906 0.115 1.00 0.00 O ATOM 2312 CB GLU A 146 11.435 -9.072 -0.673 1.00 0.00 C ATOM 2313 CG GLU A 146 12.613 -9.071 -1.651 1.00 0.00 C ATOM 2314 CD GLU A 146 13.558 -7.916 -1.314 1.00 0.00 C ATOM 2315 OE1 GLU A 146 13.802 -7.701 -0.138 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.022 -7.269 -2.237 1.00 0.00 O ATOM 0 H GLU A 146 9.313 -9.438 0.582 1.00 0.00 H new ATOM 0 HA GLU A 146 10.130 -10.016 -2.100 1.00 0.00 H new ATOM 0 HB2 GLU A 146 10.939 -8.101 -0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 146 11.792 -9.237 0.344 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.147 -10.020 -1.594 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.250 -8.971 -2.674 1.00 0.00 H new ATOM 2323 N VAL A 147 11.171 -12.293 -2.005 1.00 0.00 N ATOM 2324 CA VAL A 147 11.820 -13.642 -1.941 1.00 0.00 C ATOM 2325 C VAL A 147 13.290 -13.512 -2.361 1.00 0.00 C ATOM 2326 O VAL A 147 13.888 -12.460 -2.242 1.00 0.00 O ATOM 2327 CB VAL A 147 11.083 -14.616 -2.886 1.00 0.00 C ATOM 2328 CG1 VAL A 147 11.163 -16.052 -2.342 1.00 0.00 C ATOM 2329 CG2 VAL A 147 9.613 -14.201 -2.994 1.00 0.00 C ATOM 0 H VAL A 147 10.790 -12.038 -2.916 1.00 0.00 H new ATOM 0 HA VAL A 147 11.768 -14.030 -0.924 1.00 0.00 H new ATOM 0 HB VAL A 147 11.555 -14.581 -3.868 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.639 -16.727 -3.019 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.207 -16.354 -2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 147 10.699 -16.094 -1.356 1.00 0.00 H new ATOM 0 HG21 VAL A 147 9.089 -14.886 -3.660 1.00 0.00 H new ATOM 0 HG22 VAL A 147 9.153 -14.232 -2.007 1.00 0.00 H new ATOM 0 HG23 VAL A 147 9.549 -13.188 -3.392 1.00 0.00 H new