USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 897 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 65 ASN : amide:sc= -0.996 X(o=-4,f=-3.6!) USER MOD Set 1.2: A 95 HIS : no HD1:sc= -3.02! C(o=-4!,f=-9.8!) USER MOD Set 2.1: A 45 THR OG1 : rot -71:sc= 0.0629 USER MOD Set 2.2: A 84 GLN : amide:sc= -1.71 K(o=-1.6,f=-0.24) USER MOD Set 3.1: A 83 TYR OH : rot 180:sc= 0.466 USER MOD Set 3.2: A 101 TYR OH : rot 136:sc= 0.276 USER MOD Single : A 1 GLY N :NH3+ 132:sc= 0.00761 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.313 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -163:sc= -2.1 (180deg=-3.43!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 80:sc= -3.14! USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 150:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.606 X(o=-0.61,f=-0.74) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.0057) USER MOD Single : A 67 SER OG : rot 158:sc= 0.138 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 160:sc= 0 USER MOD Single : A 73 CYS SG : rot 180:sc= -3.97! USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.0619 X(o=-0.062,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -174:sc= 0.848 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -174:sc= -0.0129 (180deg=-0.056) USER MOD Single : A 100 THR OG1 : rot 43:sc= 0.206 USER MOD Single : A 108 ASN : amide:sc= -0.735 X(o=-0.73,f=-0.82!) USER MOD Single : A 109 SER OG : rot -3:sc= 1.22 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.153 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= -1.41 K(o=-1.4,f=-4!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0201 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.805 -6.167 30.882 1.00 0.00 N ATOM 2 CA GLY A 1 5.902 -5.115 30.456 1.00 0.00 C ATOM 3 C GLY A 1 5.114 -5.492 29.217 1.00 0.00 C ATOM 4 O GLY A 1 5.641 -6.139 28.312 1.00 0.00 O ATOM 0 H1 GLY A 1 7.746 -5.764 31.065 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.441 -6.606 31.752 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.876 -6.887 30.135 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.210 -4.884 31.266 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.474 -4.208 30.257 1.00 0.00 H new ATOM 8 N SER A 2 3.848 -5.090 29.177 1.00 0.00 N ATOM 9 CA SER A 2 2.985 -5.395 28.042 1.00 0.00 C ATOM 10 C SER A 2 3.503 -4.728 26.771 1.00 0.00 C ATOM 11 O SER A 2 4.492 -3.996 26.800 1.00 0.00 O ATOM 12 CB SER A 2 1.553 -4.936 28.325 1.00 0.00 C ATOM 13 OG SER A 2 1.421 -3.537 28.144 1.00 0.00 O ATOM 0 H SER A 2 3.397 -4.552 29.917 1.00 0.00 H new ATOM 0 HA SER A 2 2.990 -6.475 27.893 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.863 -5.458 27.663 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.278 -5.201 29.346 1.00 0.00 H new ATOM 0 HG SER A 2 0.497 -3.269 28.329 1.00 0.00 H new ATOM 19 N SER A 3 2.826 -4.986 25.657 1.00 0.00 N ATOM 20 CA SER A 3 3.218 -4.415 24.374 1.00 0.00 C ATOM 21 C SER A 3 2.244 -3.322 23.945 1.00 0.00 C ATOM 22 O SER A 3 1.070 -3.343 24.311 1.00 0.00 O ATOM 23 CB SER A 3 3.281 -5.507 23.303 1.00 0.00 C ATOM 24 OG SER A 3 4.101 -5.109 22.218 1.00 0.00 O ATOM 0 H SER A 3 2.003 -5.587 25.617 1.00 0.00 H new ATOM 0 HA SER A 3 4.207 -3.971 24.489 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.670 -6.427 23.739 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.276 -5.726 22.942 1.00 0.00 H new ATOM 0 HG SER A 3 4.127 -5.824 21.548 1.00 0.00 H new ATOM 30 N GLY A 4 2.742 -2.367 23.166 1.00 0.00 N ATOM 31 CA GLY A 4 1.904 -1.278 22.699 1.00 0.00 C ATOM 32 C GLY A 4 1.911 -0.094 23.646 1.00 0.00 C ATOM 33 O GLY A 4 1.551 -0.224 24.816 1.00 0.00 O ATOM 0 H GLY A 4 3.711 -2.328 22.850 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.247 -0.955 21.716 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.882 -1.636 22.578 1.00 0.00 H new ATOM 37 N SER A 5 2.322 1.064 23.140 1.00 0.00 N ATOM 38 CA SER A 5 2.380 2.275 23.951 1.00 0.00 C ATOM 39 C SER A 5 1.022 2.968 23.989 1.00 0.00 C ATOM 40 O SER A 5 0.327 3.052 22.977 1.00 0.00 O ATOM 41 CB SER A 5 3.439 3.232 23.400 1.00 0.00 C ATOM 42 OG SER A 5 3.931 4.088 24.417 1.00 0.00 O ATOM 0 H SER A 5 2.620 1.190 22.173 1.00 0.00 H new ATOM 0 HA SER A 5 2.652 1.990 24.968 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.262 2.661 22.971 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.011 3.828 22.594 1.00 0.00 H new ATOM 0 HG SER A 5 4.607 4.689 24.040 1.00 0.00 H new ATOM 48 N SER A 6 0.650 3.464 25.165 1.00 0.00 N ATOM 49 CA SER A 6 -0.626 4.147 25.338 1.00 0.00 C ATOM 50 C SER A 6 -0.501 5.287 26.344 1.00 0.00 C ATOM 51 O SER A 6 0.391 5.286 27.192 1.00 0.00 O ATOM 52 CB SER A 6 -1.699 3.159 25.801 1.00 0.00 C ATOM 53 OG SER A 6 -1.325 2.532 27.016 1.00 0.00 O ATOM 0 H SER A 6 1.215 3.405 26.012 1.00 0.00 H new ATOM 0 HA SER A 6 -0.918 4.566 24.375 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.646 3.682 25.934 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.858 2.403 25.032 1.00 0.00 H new ATOM 0 HG SER A 6 -2.028 1.907 27.291 1.00 0.00 H new ATOM 59 N GLY A 7 -1.401 6.260 26.243 1.00 0.00 N ATOM 60 CA GLY A 7 -1.375 7.393 27.149 1.00 0.00 C ATOM 61 C GLY A 7 -2.312 8.503 26.717 1.00 0.00 C ATOM 62 O GLY A 7 -3.128 8.320 25.813 1.00 0.00 O ATOM 0 H GLY A 7 -2.148 6.284 25.549 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.649 7.060 28.150 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.359 7.783 27.209 1.00 0.00 H new ATOM 66 N HIS A 8 -2.199 9.657 27.366 1.00 0.00 N ATOM 67 CA HIS A 8 -3.044 10.801 27.044 1.00 0.00 C ATOM 68 C HIS A 8 -2.819 11.256 25.606 1.00 0.00 C ATOM 69 O HIS A 8 -1.936 12.070 25.332 1.00 0.00 O ATOM 70 CB HIS A 8 -2.764 11.956 28.006 1.00 0.00 C ATOM 71 CG HIS A 8 -3.667 13.134 27.807 1.00 0.00 C ATOM 72 ND1 HIS A 8 -5.021 13.014 27.579 1.00 0.00 N ATOM 73 CD2 HIS A 8 -3.402 14.462 27.805 1.00 0.00 C ATOM 74 CE1 HIS A 8 -5.551 14.217 27.443 1.00 0.00 C ATOM 75 NE2 HIS A 8 -4.590 15.113 27.577 1.00 0.00 N ATOM 0 H HIS A 8 -1.531 9.825 28.118 1.00 0.00 H new ATOM 0 HA HIS A 8 -4.084 10.493 27.150 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -2.868 11.598 29.030 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -1.730 12.277 27.884 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -2.437 14.923 27.955 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -6.593 14.431 27.254 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -4.710 16.124 27.520 1.00 0.00 H new ATOM 83 N PHE A 9 -3.622 10.726 24.689 1.00 0.00 N ATOM 84 CA PHE A 9 -3.508 11.076 23.278 1.00 0.00 C ATOM 85 C PHE A 9 -4.586 12.079 22.879 1.00 0.00 C ATOM 86 O PHE A 9 -5.739 11.726 22.634 1.00 0.00 O ATOM 87 CB PHE A 9 -3.617 9.821 22.409 1.00 0.00 C ATOM 88 CG PHE A 9 -2.903 9.940 21.093 1.00 0.00 C ATOM 89 CD1 PHE A 9 -3.484 10.619 20.034 1.00 0.00 C ATOM 90 CD2 PHE A 9 -1.652 9.371 20.914 1.00 0.00 C ATOM 91 CE1 PHE A 9 -2.830 10.731 18.822 1.00 0.00 C ATOM 92 CE2 PHE A 9 -0.993 9.480 19.704 1.00 0.00 C ATOM 93 CZ PHE A 9 -1.583 10.160 18.656 1.00 0.00 C ATOM 0 H PHE A 9 -4.359 10.052 24.898 1.00 0.00 H new ATOM 0 HA PHE A 9 -2.532 11.535 23.120 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -3.211 8.972 22.958 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.670 9.607 22.224 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.459 11.066 20.157 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -1.187 8.836 21.729 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -3.293 11.264 18.005 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -0.018 9.034 19.578 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.071 10.245 17.709 1.00 0.00 H new ATOM 103 N PRO A 10 -4.202 13.363 22.811 1.00 0.00 N ATOM 104 CA PRO A 10 -5.120 14.445 22.442 1.00 0.00 C ATOM 105 C PRO A 10 -5.524 14.387 20.973 1.00 0.00 C ATOM 106 O PRO A 10 -4.875 13.720 20.167 1.00 0.00 O ATOM 107 CB PRO A 10 -4.307 15.711 22.723 1.00 0.00 C ATOM 108 CG PRO A 10 -2.885 15.281 22.610 1.00 0.00 C ATOM 109 CD PRO A 10 -2.843 13.857 23.090 1.00 0.00 C ATOM 0 HA PRO A 10 -6.057 14.391 22.997 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -4.541 16.499 22.007 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.523 16.108 23.715 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.535 15.356 21.580 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.236 15.916 23.214 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -2.088 13.276 22.560 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -2.604 13.798 24.152 1.00 0.00 H new ATOM 117 N ALA A 11 -6.599 15.089 20.631 1.00 0.00 N ATOM 118 CA ALA A 11 -7.087 15.119 19.258 1.00 0.00 C ATOM 119 C ALA A 11 -7.364 16.549 18.805 1.00 0.00 C ATOM 120 O ALA A 11 -8.176 17.254 19.404 1.00 0.00 O ATOM 121 CB ALA A 11 -8.342 14.269 19.126 1.00 0.00 C ATOM 0 H ALA A 11 -7.149 15.645 21.286 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.312 14.705 18.613 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -8.696 14.300 18.096 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.114 13.239 19.400 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.116 14.658 19.787 1.00 0.00 H new ATOM 127 N ARG A 12 -6.682 16.970 17.744 1.00 0.00 N ATOM 128 CA ARG A 12 -6.854 18.317 17.212 1.00 0.00 C ATOM 129 C ARG A 12 -7.978 18.355 16.182 1.00 0.00 C ATOM 130 O ARG A 12 -8.501 17.316 15.778 1.00 0.00 O ATOM 131 CB ARG A 12 -5.550 18.807 16.579 1.00 0.00 C ATOM 132 CG ARG A 12 -4.524 19.288 17.592 1.00 0.00 C ATOM 133 CD ARG A 12 -4.742 20.748 17.956 1.00 0.00 C ATOM 134 NE ARG A 12 -4.053 21.650 17.038 1.00 0.00 N ATOM 135 CZ ARG A 12 -4.071 22.973 17.155 1.00 0.00 C ATOM 136 NH1 ARG A 12 -4.739 23.545 18.147 1.00 0.00 N ATOM 137 NH2 ARG A 12 -3.418 23.727 16.279 1.00 0.00 N ATOM 0 H ARG A 12 -6.006 16.399 17.237 1.00 0.00 H new ATOM 0 HA ARG A 12 -7.120 18.977 18.038 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.116 17.999 15.990 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.774 19.620 15.888 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.584 18.675 18.491 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -3.521 19.159 17.185 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -5.810 20.968 17.947 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -4.388 20.925 18.972 1.00 0.00 H new ATOM 0 HE ARG A 12 -3.529 21.242 16.264 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.241 22.969 18.823 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -4.751 24.561 18.234 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -2.902 23.290 15.515 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -3.432 24.743 16.370 1.00 0.00 H new ATOM 151 N VAL A 13 -8.346 19.561 15.760 1.00 0.00 N ATOM 152 CA VAL A 13 -9.408 19.735 14.776 1.00 0.00 C ATOM 153 C VAL A 13 -8.850 19.729 13.358 1.00 0.00 C ATOM 154 O VAL A 13 -7.881 20.427 13.057 1.00 0.00 O ATOM 155 CB VAL A 13 -10.178 21.049 15.008 1.00 0.00 C ATOM 156 CG1 VAL A 13 -9.224 22.233 15.010 1.00 0.00 C ATOM 157 CG2 VAL A 13 -11.259 21.226 13.952 1.00 0.00 C ATOM 0 H VAL A 13 -7.924 20.431 16.084 1.00 0.00 H new ATOM 0 HA VAL A 13 -10.092 18.895 14.897 1.00 0.00 H new ATOM 0 HB VAL A 13 -10.660 21.000 15.984 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.786 23.152 15.175 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -8.490 22.108 15.806 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -8.711 22.289 14.050 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.793 22.159 14.131 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.801 21.254 12.963 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.959 20.392 14.004 1.00 0.00 H new ATOM 167 N LYS A 14 -9.468 18.938 12.487 1.00 0.00 N ATOM 168 CA LYS A 14 -9.035 18.842 11.098 1.00 0.00 C ATOM 169 C LYS A 14 -8.492 20.179 10.604 1.00 0.00 C ATOM 170 O LYS A 14 -8.986 21.240 10.984 1.00 0.00 O ATOM 171 CB LYS A 14 -10.197 18.392 10.210 1.00 0.00 C ATOM 172 CG LYS A 14 -11.305 19.424 10.089 1.00 0.00 C ATOM 173 CD LYS A 14 -12.362 19.237 11.164 1.00 0.00 C ATOM 174 CE LYS A 14 -13.240 18.029 10.879 1.00 0.00 C ATOM 175 NZ LYS A 14 -13.944 17.553 12.102 1.00 0.00 N ATOM 0 H LYS A 14 -10.271 18.354 12.719 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.236 18.103 11.043 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.815 18.163 9.215 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -10.614 17.469 10.612 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -10.881 20.425 10.165 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.768 19.348 9.105 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.879 19.116 12.134 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.981 20.132 11.226 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.973 18.286 10.115 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -12.628 17.222 10.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.532 16.728 11.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.244 17.284 12.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.548 18.314 12.473 1.00 0.00 H new ATOM 189 N VAL A 15 -7.472 20.120 9.753 1.00 0.00 N ATOM 190 CA VAL A 15 -6.863 21.325 9.205 1.00 0.00 C ATOM 191 C VAL A 15 -6.478 21.131 7.743 1.00 0.00 C ATOM 192 O VAL A 15 -6.057 20.046 7.341 1.00 0.00 O ATOM 193 CB VAL A 15 -5.611 21.735 10.003 1.00 0.00 C ATOM 194 CG1 VAL A 15 -4.538 20.662 9.903 1.00 0.00 C ATOM 195 CG2 VAL A 15 -5.084 23.076 9.515 1.00 0.00 C ATOM 0 H VAL A 15 -7.050 19.250 9.429 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.608 22.117 9.280 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.888 21.840 11.052 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.661 20.970 10.473 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.922 19.725 10.306 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.260 20.521 8.858 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.199 23.350 10.090 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.822 23.002 8.459 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.852 23.838 9.646 1.00 0.00 H new ATOM 205 N GLU A 16 -6.626 22.189 6.951 1.00 0.00 N ATOM 206 CA GLU A 16 -6.294 22.133 5.533 1.00 0.00 C ATOM 207 C GLU A 16 -4.892 21.567 5.324 1.00 0.00 C ATOM 208 O GLU A 16 -3.964 21.843 6.084 1.00 0.00 O ATOM 209 CB GLU A 16 -6.391 23.526 4.908 1.00 0.00 C ATOM 210 CG GLU A 16 -7.810 23.934 4.549 1.00 0.00 C ATOM 211 CD GLU A 16 -8.390 23.098 3.425 1.00 0.00 C ATOM 212 OE1 GLU A 16 -7.708 22.936 2.392 1.00 0.00 O ATOM 213 OE2 GLU A 16 -9.528 22.606 3.579 1.00 0.00 O ATOM 0 H GLU A 16 -6.973 23.094 7.268 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.011 21.473 5.045 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.977 24.256 5.603 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.775 23.556 4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -8.445 23.842 5.430 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -7.820 24.984 4.258 1.00 0.00 H new ATOM 220 N PRO A 17 -4.733 20.755 4.268 1.00 0.00 N ATOM 221 CA PRO A 17 -3.449 20.133 3.934 1.00 0.00 C ATOM 222 C PRO A 17 -2.427 21.147 3.431 1.00 0.00 C ATOM 223 O PRO A 17 -2.701 21.912 2.508 1.00 0.00 O ATOM 224 CB PRO A 17 -3.812 19.144 2.823 1.00 0.00 C ATOM 225 CG PRO A 17 -5.046 19.705 2.205 1.00 0.00 C ATOM 226 CD PRO A 17 -5.796 20.382 3.319 1.00 0.00 C ATOM 0 HA PRO A 17 -2.984 19.667 4.803 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -3.008 19.057 2.092 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.988 18.146 3.224 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.799 20.413 1.414 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.648 18.918 1.751 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -6.342 21.256 2.963 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -6.526 19.714 3.776 1.00 0.00 H new ATOM 234 N ALA A 18 -1.248 21.146 4.045 1.00 0.00 N ATOM 235 CA ALA A 18 -0.184 22.064 3.658 1.00 0.00 C ATOM 236 C ALA A 18 0.733 21.434 2.616 1.00 0.00 C ATOM 237 O ALA A 18 1.846 21.907 2.386 1.00 0.00 O ATOM 238 CB ALA A 18 0.616 22.490 4.880 1.00 0.00 C ATOM 0 H ALA A 18 -1.006 20.519 4.813 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.644 22.946 3.213 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.407 23.175 4.576 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.043 22.989 5.591 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.058 21.611 5.350 1.00 0.00 H new ATOM 244 N VAL A 19 0.259 20.362 1.987 1.00 0.00 N ATOM 245 CA VAL A 19 1.036 19.667 0.969 1.00 0.00 C ATOM 246 C VAL A 19 0.138 19.142 -0.146 1.00 0.00 C ATOM 247 O VAL A 19 -1.064 18.954 0.048 1.00 0.00 O ATOM 248 CB VAL A 19 1.827 18.491 1.572 1.00 0.00 C ATOM 249 CG1 VAL A 19 0.891 17.352 1.943 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.899 18.017 0.602 1.00 0.00 C ATOM 0 H VAL A 19 -0.660 19.957 2.166 1.00 0.00 H new ATOM 0 HA VAL A 19 1.736 20.393 0.556 1.00 0.00 H new ATOM 0 HB VAL A 19 2.319 18.835 2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.468 16.530 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.165 17.702 2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.368 17.006 1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.448 17.186 1.044 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.431 17.690 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.587 18.836 0.392 1.00 0.00 H new ATOM 260 N ASP A 20 0.728 18.907 -1.312 1.00 0.00 N ATOM 261 CA ASP A 20 -0.019 18.402 -2.459 1.00 0.00 C ATOM 262 C ASP A 20 -0.235 16.896 -2.346 1.00 0.00 C ATOM 263 O ASP A 20 -1.366 16.428 -2.205 1.00 0.00 O ATOM 264 CB ASP A 20 0.718 18.728 -3.758 1.00 0.00 C ATOM 265 CG ASP A 20 -0.131 18.466 -4.987 1.00 0.00 C ATOM 266 OD1 ASP A 20 -0.910 19.362 -5.372 1.00 0.00 O ATOM 267 OD2 ASP A 20 -0.015 17.364 -5.563 1.00 0.00 O ATOM 0 H ASP A 20 1.721 19.058 -1.489 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.993 18.891 -2.471 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.022 19.775 -3.747 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.629 18.132 -3.815 1.00 0.00 H new ATOM 272 N THR A 21 0.857 16.140 -2.409 1.00 0.00 N ATOM 273 CA THR A 21 0.787 14.687 -2.316 1.00 0.00 C ATOM 274 C THR A 21 -0.446 14.149 -3.032 1.00 0.00 C ATOM 275 O THR A 21 -1.073 13.193 -2.575 1.00 0.00 O ATOM 276 CB THR A 21 0.761 14.219 -0.849 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.244 14.936 -0.123 1.00 0.00 O ATOM 278 CG2 THR A 21 2.116 14.427 -0.189 1.00 0.00 C ATOM 0 H THR A 21 1.800 16.510 -2.524 1.00 0.00 H new ATOM 0 HA THR A 21 1.683 14.296 -2.798 1.00 0.00 H new ATOM 0 HB THR A 21 0.528 13.154 -0.836 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.255 14.631 0.808 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.072 14.089 0.846 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.874 13.856 -0.726 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.374 15.486 -0.214 1.00 0.00 H new ATOM 286 N SER A 22 -0.789 14.769 -4.156 1.00 0.00 N ATOM 287 CA SER A 22 -1.951 14.353 -4.934 1.00 0.00 C ATOM 288 C SER A 22 -1.522 13.622 -6.203 1.00 0.00 C ATOM 289 O SER A 22 -2.345 13.028 -6.899 1.00 0.00 O ATOM 290 CB SER A 22 -2.809 15.566 -5.296 1.00 0.00 C ATOM 291 OG SER A 22 -3.802 15.800 -4.313 1.00 0.00 O ATOM 0 H SER A 22 -0.280 15.561 -4.549 1.00 0.00 H new ATOM 0 HA SER A 22 -2.540 13.669 -4.323 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.175 16.447 -5.394 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.282 15.404 -6.264 1.00 0.00 H new ATOM 0 HG SER A 22 -4.336 16.582 -4.567 1.00 0.00 H new ATOM 297 N ARG A 23 -0.227 13.672 -6.497 1.00 0.00 N ATOM 298 CA ARG A 23 0.313 13.016 -7.683 1.00 0.00 C ATOM 299 C ARG A 23 1.354 11.969 -7.298 1.00 0.00 C ATOM 300 O ARG A 23 2.329 11.756 -8.019 1.00 0.00 O ATOM 301 CB ARG A 23 0.936 14.049 -8.623 1.00 0.00 C ATOM 302 CG ARG A 23 -0.030 15.139 -9.058 1.00 0.00 C ATOM 303 CD ARG A 23 0.701 16.430 -9.391 1.00 0.00 C ATOM 304 NE ARG A 23 -0.161 17.600 -9.244 1.00 0.00 N ATOM 305 CZ ARG A 23 0.245 18.845 -9.470 1.00 0.00 C ATOM 306 NH1 ARG A 23 1.493 19.080 -9.851 1.00 0.00 N ATOM 307 NH2 ARG A 23 -0.598 19.858 -9.314 1.00 0.00 N ATOM 0 H ARG A 23 0.468 14.159 -5.931 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.508 12.515 -8.197 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.791 14.510 -8.127 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.317 13.539 -9.508 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.592 14.802 -9.929 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.754 15.324 -8.264 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.568 16.534 -8.739 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.075 16.381 -10.414 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.127 17.453 -8.952 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.144 18.304 -9.971 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.802 20.037 -10.024 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.559 19.681 -9.020 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -0.285 20.813 -9.488 1.00 0.00 H new ATOM 321 N ILE A 24 1.139 11.319 -6.159 1.00 0.00 N ATOM 322 CA ILE A 24 2.058 10.294 -5.680 1.00 0.00 C ATOM 323 C ILE A 24 1.706 8.927 -6.258 1.00 0.00 C ATOM 324 O ILE A 24 0.586 8.442 -6.098 1.00 0.00 O ATOM 325 CB ILE A 24 2.051 10.206 -4.143 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.777 11.409 -3.538 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.694 8.906 -3.684 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.845 11.377 -2.027 1.00 0.00 C ATOM 0 H ILE A 24 0.337 11.484 -5.551 1.00 0.00 H new ATOM 0 HA ILE A 24 3.055 10.582 -6.015 1.00 0.00 H new ATOM 0 HB ILE A 24 1.017 10.219 -3.798 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.790 11.451 -3.938 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.272 12.323 -3.852 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.682 8.859 -2.595 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.137 8.061 -4.090 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.724 8.865 -4.037 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.373 12.260 -1.668 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.835 11.367 -1.617 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.376 10.481 -1.706 1.00 0.00 H new ATOM 340 N LYS A 25 2.672 8.309 -6.930 1.00 0.00 N ATOM 341 CA LYS A 25 2.467 6.996 -7.530 1.00 0.00 C ATOM 342 C LYS A 25 3.256 5.926 -6.781 1.00 0.00 C ATOM 343 O LYS A 25 4.331 6.195 -6.246 1.00 0.00 O ATOM 344 CB LYS A 25 2.884 7.015 -9.002 1.00 0.00 C ATOM 345 CG LYS A 25 1.829 7.598 -9.926 1.00 0.00 C ATOM 346 CD LYS A 25 2.415 7.967 -11.279 1.00 0.00 C ATOM 347 CE LYS A 25 1.491 8.896 -12.051 1.00 0.00 C ATOM 348 NZ LYS A 25 2.238 9.728 -13.036 1.00 0.00 N ATOM 0 H LYS A 25 3.605 8.697 -7.073 1.00 0.00 H new ATOM 0 HA LYS A 25 1.406 6.755 -7.462 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.803 7.593 -9.103 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.111 5.997 -9.320 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.024 6.876 -10.062 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.389 8.483 -9.465 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.383 8.449 -11.139 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.591 7.062 -11.860 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.736 8.307 -12.572 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.963 9.546 -11.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 1.573 10.348 -13.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.942 10.309 -12.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.721 9.109 -13.718 1.00 0.00 H new ATOM 362 N VAL A 26 2.714 4.713 -6.747 1.00 0.00 N ATOM 363 CA VAL A 26 3.369 3.602 -6.066 1.00 0.00 C ATOM 364 C VAL A 26 3.380 2.352 -6.938 1.00 0.00 C ATOM 365 O VAL A 26 2.328 1.840 -7.322 1.00 0.00 O ATOM 366 CB VAL A 26 2.675 3.276 -4.730 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.675 4.493 -3.817 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.257 2.782 -4.973 1.00 0.00 C ATOM 0 H VAL A 26 1.823 4.474 -7.183 1.00 0.00 H new ATOM 0 HA VAL A 26 4.395 3.912 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 26 3.233 2.481 -4.236 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.181 4.244 -2.878 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.702 4.797 -3.616 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.142 5.311 -4.301 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.782 2.556 -4.018 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.686 3.554 -5.489 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.286 1.881 -5.586 1.00 0.00 H new ATOM 378 N PHE A 27 4.577 1.865 -7.249 1.00 0.00 N ATOM 379 CA PHE A 27 4.726 0.674 -8.077 1.00 0.00 C ATOM 380 C PHE A 27 5.505 -0.409 -7.337 1.00 0.00 C ATOM 381 O PHE A 27 6.496 -0.127 -6.665 1.00 0.00 O ATOM 382 CB PHE A 27 5.435 1.023 -9.387 1.00 0.00 C ATOM 383 CG PHE A 27 6.671 1.854 -9.197 1.00 0.00 C ATOM 384 CD1 PHE A 27 7.904 1.252 -9.007 1.00 0.00 C ATOM 385 CD2 PHE A 27 6.600 3.238 -9.208 1.00 0.00 C ATOM 386 CE1 PHE A 27 9.043 2.014 -8.830 1.00 0.00 C ATOM 387 CE2 PHE A 27 7.736 4.006 -9.032 1.00 0.00 C ATOM 388 CZ PHE A 27 8.960 3.393 -8.844 1.00 0.00 C ATOM 0 H PHE A 27 5.458 2.277 -6.940 1.00 0.00 H new ATOM 0 HA PHE A 27 3.730 0.291 -8.302 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.703 0.101 -9.903 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.742 1.560 -10.034 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.976 0.174 -8.997 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.646 3.722 -9.356 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.998 1.532 -8.681 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.667 5.084 -9.041 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.849 3.990 -8.708 1.00 0.00 H new ATOM 398 N GLY A 28 5.049 -1.651 -7.466 1.00 0.00 N ATOM 399 CA GLY A 28 5.714 -2.758 -6.804 1.00 0.00 C ATOM 400 C GLY A 28 4.736 -3.729 -6.173 1.00 0.00 C ATOM 401 O GLY A 28 3.548 -3.439 -6.026 1.00 0.00 O ATOM 0 H GLY A 28 4.231 -1.910 -8.017 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.334 -3.289 -7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.382 -2.369 -6.035 1.00 0.00 H new ATOM 405 N PRO A 29 5.235 -4.912 -5.787 1.00 0.00 N ATOM 406 CA PRO A 29 4.413 -5.953 -5.163 1.00 0.00 C ATOM 407 C PRO A 29 3.967 -5.572 -3.755 1.00 0.00 C ATOM 408 O PRO A 29 2.827 -5.820 -3.366 1.00 0.00 O ATOM 409 CB PRO A 29 5.348 -7.164 -5.118 1.00 0.00 C ATOM 410 CG PRO A 29 6.720 -6.584 -5.112 1.00 0.00 C ATOM 411 CD PRO A 29 6.641 -5.326 -5.931 1.00 0.00 C ATOM 0 HA PRO A 29 3.490 -6.130 -5.716 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.170 -7.769 -4.229 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.197 -7.813 -5.980 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.048 -6.368 -4.095 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.441 -7.282 -5.538 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.325 -4.562 -5.561 1.00 0.00 H new ATOM 0 HD3 PRO A 29 6.901 -5.508 -6.974 1.00 0.00 H new ATOM 419 N GLY A 30 4.875 -4.968 -2.994 1.00 0.00 N ATOM 420 CA GLY A 30 4.556 -4.562 -1.638 1.00 0.00 C ATOM 421 C GLY A 30 3.288 -3.735 -1.564 1.00 0.00 C ATOM 422 O GLY A 30 2.709 -3.570 -0.490 1.00 0.00 O ATOM 0 H GLY A 30 5.826 -4.753 -3.293 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.445 -5.448 -1.013 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.386 -3.986 -1.230 1.00 0.00 H new ATOM 426 N ILE A 31 2.856 -3.212 -2.707 1.00 0.00 N ATOM 427 CA ILE A 31 1.649 -2.397 -2.766 1.00 0.00 C ATOM 428 C ILE A 31 0.642 -2.977 -3.753 1.00 0.00 C ATOM 429 O ILE A 31 -0.555 -2.710 -3.662 1.00 0.00 O ATOM 430 CB ILE A 31 1.970 -0.946 -3.170 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.858 -0.006 -2.700 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.155 -0.844 -4.676 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.821 0.184 -1.200 1.00 0.00 C ATOM 0 H ILE A 31 3.324 -3.338 -3.604 1.00 0.00 H new ATOM 0 HA ILE A 31 1.216 -2.400 -1.766 1.00 0.00 H new ATOM 0 HB ILE A 31 2.901 -0.648 -2.688 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.988 0.965 -3.178 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.103 -0.399 -3.032 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.381 0.188 -4.946 1.00 0.00 H new ATOM 0 HG22 ILE A 31 2.977 -1.489 -4.986 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.239 -1.158 -5.177 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.008 0.862 -0.939 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.660 -0.779 -0.715 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.768 0.606 -0.863 1.00 0.00 H new ATOM 445 N GLU A 32 1.137 -3.774 -4.695 1.00 0.00 N ATOM 446 CA GLU A 32 0.279 -4.393 -5.699 1.00 0.00 C ATOM 447 C GLU A 32 -0.288 -5.715 -5.190 1.00 0.00 C ATOM 448 O GLU A 32 -1.499 -5.934 -5.213 1.00 0.00 O ATOM 449 CB GLU A 32 1.059 -4.626 -6.995 1.00 0.00 C ATOM 450 CG GLU A 32 1.377 -3.347 -7.752 1.00 0.00 C ATOM 451 CD GLU A 32 0.290 -2.967 -8.738 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.777 -2.495 -8.293 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.507 -3.141 -9.955 1.00 0.00 O ATOM 0 H GLU A 32 2.126 -4.006 -4.784 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.550 -3.714 -5.899 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.991 -5.141 -6.761 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.483 -5.288 -7.642 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.517 -2.533 -7.040 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.320 -3.470 -8.286 1.00 0.00 H new ATOM 460 N GLY A 33 0.597 -6.595 -4.730 1.00 0.00 N ATOM 461 CA GLY A 33 0.166 -7.884 -4.222 1.00 0.00 C ATOM 462 C GLY A 33 0.574 -9.029 -5.128 1.00 0.00 C ATOM 463 O GLY A 33 -0.246 -9.879 -5.475 1.00 0.00 O ATOM 0 H GLY A 33 1.604 -6.438 -4.700 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.590 -8.041 -3.230 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.918 -7.883 -4.109 1.00 0.00 H new ATOM 467 N LYS A 34 1.845 -9.053 -5.513 1.00 0.00 N ATOM 468 CA LYS A 34 2.362 -10.101 -6.385 1.00 0.00 C ATOM 469 C LYS A 34 3.134 -11.144 -5.583 1.00 0.00 C ATOM 470 O LYS A 34 2.693 -12.285 -5.443 1.00 0.00 O ATOM 471 CB LYS A 34 3.267 -9.498 -7.462 1.00 0.00 C ATOM 472 CG LYS A 34 2.819 -8.126 -7.933 1.00 0.00 C ATOM 473 CD LYS A 34 3.121 -7.917 -9.408 1.00 0.00 C ATOM 474 CE LYS A 34 2.237 -6.836 -10.010 1.00 0.00 C ATOM 475 NZ LYS A 34 2.614 -5.478 -9.527 1.00 0.00 N ATOM 0 H LYS A 34 2.537 -8.358 -5.234 1.00 0.00 H new ATOM 0 HA LYS A 34 1.514 -10.591 -6.864 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.283 -9.426 -7.073 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.300 -10.174 -8.317 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.749 -8.012 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.320 -7.357 -7.345 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.169 -7.642 -9.531 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.972 -8.853 -9.947 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.312 -6.869 -11.097 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.196 -7.035 -9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.837 -4.814 -9.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.798 -5.512 -8.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 3.471 -5.159 -10.022 1.00 0.00 H new ATOM 489 N ASP A 35 4.287 -10.745 -5.057 1.00 0.00 N ATOM 490 CA ASP A 35 5.119 -11.644 -4.266 1.00 0.00 C ATOM 491 C ASP A 35 5.047 -11.289 -2.784 1.00 0.00 C ATOM 492 O ASP A 35 5.998 -11.512 -2.035 1.00 0.00 O ATOM 493 CB ASP A 35 6.569 -11.587 -4.748 1.00 0.00 C ATOM 494 CG ASP A 35 6.757 -12.245 -6.100 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.546 -11.565 -7.126 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.116 -13.441 -6.132 1.00 0.00 O ATOM 0 H ASP A 35 4.667 -9.804 -5.164 1.00 0.00 H new ATOM 0 HA ASP A 35 4.741 -12.658 -4.396 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.889 -10.547 -4.806 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.211 -12.077 -4.016 1.00 0.00 H new ATOM 501 N VAL A 36 3.913 -10.734 -2.368 1.00 0.00 N ATOM 502 CA VAL A 36 3.717 -10.348 -0.976 1.00 0.00 C ATOM 503 C VAL A 36 3.208 -11.521 -0.147 1.00 0.00 C ATOM 504 O VAL A 36 2.676 -11.337 0.948 1.00 0.00 O ATOM 505 CB VAL A 36 2.723 -9.177 -0.853 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.628 -8.707 0.590 1.00 0.00 C ATOM 507 CG2 VAL A 36 3.133 -8.033 -1.769 1.00 0.00 C ATOM 0 H VAL A 36 3.116 -10.542 -2.975 1.00 0.00 H new ATOM 0 HA VAL A 36 4.688 -10.032 -0.595 1.00 0.00 H new ATOM 0 HB VAL A 36 1.737 -9.525 -1.162 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.922 -7.880 0.657 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.285 -9.529 1.219 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.609 -8.375 0.930 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.420 -7.214 -1.670 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.128 -7.684 -1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.145 -8.380 -2.802 1.00 0.00 H new ATOM 517 N PHE A 37 3.375 -12.729 -0.676 1.00 0.00 N ATOM 518 CA PHE A 37 2.932 -13.934 0.016 1.00 0.00 C ATOM 519 C PHE A 37 3.299 -13.878 1.496 1.00 0.00 C ATOM 520 O PHE A 37 4.080 -13.026 1.921 1.00 0.00 O ATOM 521 CB PHE A 37 3.552 -15.175 -0.629 1.00 0.00 C ATOM 522 CG PHE A 37 3.613 -15.105 -2.128 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.502 -14.719 -2.862 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.779 -15.425 -2.804 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.554 -14.653 -4.242 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.838 -15.360 -4.183 1.00 0.00 C ATOM 527 CZ PHE A 37 3.723 -14.975 -4.903 1.00 0.00 C ATOM 0 H PHE A 37 3.814 -12.899 -1.581 1.00 0.00 H new ATOM 0 HA PHE A 37 1.847 -13.993 -0.068 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.560 -15.312 -0.238 1.00 0.00 H new ATOM 0 HB3 PHE A 37 2.975 -16.053 -0.338 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.585 -14.467 -2.350 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.653 -15.729 -2.246 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.682 -14.350 -4.802 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.754 -15.610 -4.697 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.766 -14.926 -5.981 1.00 0.00 H new ATOM 537 N ARG A 38 2.730 -14.792 2.275 1.00 0.00 N ATOM 538 CA ARG A 38 2.996 -14.847 3.708 1.00 0.00 C ATOM 539 C ARG A 38 4.442 -15.251 3.977 1.00 0.00 C ATOM 540 O ARG A 38 5.000 -16.098 3.280 1.00 0.00 O ATOM 541 CB ARG A 38 2.044 -15.833 4.387 1.00 0.00 C ATOM 542 CG ARG A 38 2.208 -15.895 5.897 1.00 0.00 C ATOM 543 CD ARG A 38 1.017 -16.570 6.559 1.00 0.00 C ATOM 544 NE ARG A 38 1.214 -16.742 7.996 1.00 0.00 N ATOM 545 CZ ARG A 38 0.233 -17.030 8.844 1.00 0.00 C ATOM 546 NH1 ARG A 38 -1.008 -17.178 8.400 1.00 0.00 N ATOM 547 NH2 ARG A 38 0.492 -17.171 10.137 1.00 0.00 N ATOM 0 H ARG A 38 2.082 -15.504 1.938 1.00 0.00 H new ATOM 0 HA ARG A 38 2.832 -13.852 4.121 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.017 -15.553 4.153 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.207 -16.827 3.971 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.120 -16.440 6.143 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.323 -14.886 6.293 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.120 -15.975 6.385 1.00 0.00 H new ATOM 0 HD3 ARG A 38 0.849 -17.543 6.097 1.00 0.00 H new ATOM 0 HE ARG A 38 2.157 -16.635 8.369 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -1.210 -17.071 7.406 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -1.760 -17.399 9.053 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.445 -17.058 10.481 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -0.262 -17.392 10.787 1.00 0.00 H new ATOM 561 N GLU A 39 5.043 -14.640 4.993 1.00 0.00 N ATOM 562 CA GLU A 39 6.425 -14.936 5.353 1.00 0.00 C ATOM 563 C GLU A 39 7.363 -14.665 4.181 1.00 0.00 C ATOM 564 O GLU A 39 8.327 -15.397 3.962 1.00 0.00 O ATOM 565 CB GLU A 39 6.558 -16.393 5.800 1.00 0.00 C ATOM 566 CG GLU A 39 5.871 -16.689 7.123 1.00 0.00 C ATOM 567 CD GLU A 39 5.785 -18.175 7.416 1.00 0.00 C ATOM 568 OE1 GLU A 39 6.827 -18.857 7.328 1.00 0.00 O ATOM 569 OE2 GLU A 39 4.677 -18.654 7.734 1.00 0.00 O ATOM 0 H GLU A 39 4.595 -13.937 5.581 1.00 0.00 H new ATOM 0 HA GLU A 39 6.706 -14.283 6.179 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.139 -17.040 5.030 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.616 -16.643 5.885 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.414 -16.194 7.929 1.00 0.00 H new ATOM 0 HG3 GLU A 39 4.866 -16.266 7.109 1.00 0.00 H new ATOM 576 N ALA A 40 7.071 -13.607 3.430 1.00 0.00 N ATOM 577 CA ALA A 40 7.888 -13.238 2.281 1.00 0.00 C ATOM 578 C ALA A 40 8.295 -11.770 2.345 1.00 0.00 C ATOM 579 O ALA A 40 7.523 -10.920 2.791 1.00 0.00 O ATOM 580 CB ALA A 40 7.140 -13.524 0.987 1.00 0.00 C ATOM 0 H ALA A 40 6.275 -12.991 3.597 1.00 0.00 H new ATOM 0 HA ALA A 40 8.796 -13.841 2.304 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.762 -13.243 0.137 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.905 -14.587 0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.216 -12.947 0.966 1.00 0.00 H new ATOM 586 N THR A 41 9.512 -11.477 1.898 1.00 0.00 N ATOM 587 CA THR A 41 10.021 -10.111 1.907 1.00 0.00 C ATOM 588 C THR A 41 9.524 -9.331 0.695 1.00 0.00 C ATOM 589 O THR A 41 9.992 -9.539 -0.425 1.00 0.00 O ATOM 590 CB THR A 41 11.561 -10.086 1.923 1.00 0.00 C ATOM 591 OG1 THR A 41 12.053 -10.901 2.993 1.00 0.00 O ATOM 592 CG2 THR A 41 12.078 -8.664 2.083 1.00 0.00 C ATOM 0 H THR A 41 10.164 -12.167 1.525 1.00 0.00 H new ATOM 0 HA THR A 41 9.648 -9.640 2.816 1.00 0.00 H new ATOM 0 HB THR A 41 11.919 -10.481 0.972 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.033 -10.881 2.995 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.168 -8.672 2.092 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.726 -8.053 1.252 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.711 -8.247 3.021 1.00 0.00 H new ATOM 600 N THR A 42 8.573 -8.431 0.926 1.00 0.00 N ATOM 601 CA THR A 42 8.013 -7.620 -0.148 1.00 0.00 C ATOM 602 C THR A 42 8.129 -6.133 0.169 1.00 0.00 C ATOM 603 O THR A 42 8.018 -5.724 1.325 1.00 0.00 O ATOM 604 CB THR A 42 6.533 -7.966 -0.398 1.00 0.00 C ATOM 605 OG1 THR A 42 6.034 -7.210 -1.508 1.00 0.00 O ATOM 606 CG2 THR A 42 5.693 -7.677 0.837 1.00 0.00 C ATOM 0 H THR A 42 8.175 -8.246 1.847 1.00 0.00 H new ATOM 0 HA THR A 42 8.588 -7.843 -1.047 1.00 0.00 H new ATOM 0 HB THR A 42 6.465 -9.030 -0.623 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.317 -7.633 -2.346 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.652 -7.929 0.636 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.057 -8.275 1.672 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.768 -6.619 1.089 1.00 0.00 H new ATOM 614 N ASP A 43 8.352 -5.329 -0.865 1.00 0.00 N ATOM 615 CA ASP A 43 8.482 -3.886 -0.697 1.00 0.00 C ATOM 616 C ASP A 43 8.015 -3.150 -1.948 1.00 0.00 C ATOM 617 O ASP A 43 7.980 -3.718 -3.039 1.00 0.00 O ATOM 618 CB ASP A 43 9.932 -3.516 -0.383 1.00 0.00 C ATOM 619 CG ASP A 43 10.858 -3.752 -1.561 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.351 -3.904 -2.693 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.088 -3.783 -1.352 1.00 0.00 O ATOM 0 H ASP A 43 8.446 -5.652 -1.828 1.00 0.00 H new ATOM 0 HA ASP A 43 7.850 -3.583 0.138 1.00 0.00 H new ATOM 0 HB2 ASP A 43 9.981 -2.467 -0.090 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.277 -4.101 0.469 1.00 0.00 H new ATOM 626 N PHE A 44 7.655 -1.881 -1.782 1.00 0.00 N ATOM 627 CA PHE A 44 7.187 -1.067 -2.898 1.00 0.00 C ATOM 628 C PHE A 44 8.035 0.194 -3.044 1.00 0.00 C ATOM 629 O PHE A 44 8.916 0.462 -2.226 1.00 0.00 O ATOM 630 CB PHE A 44 5.719 -0.686 -2.699 1.00 0.00 C ATOM 631 CG PHE A 44 5.452 0.017 -1.399 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.151 -0.704 -0.255 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.504 1.400 -1.321 1.00 0.00 C ATOM 634 CE1 PHE A 44 4.904 -0.058 0.942 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.259 2.051 -0.127 1.00 0.00 C ATOM 636 CZ PHE A 44 4.960 1.320 1.007 1.00 0.00 C ATOM 0 H PHE A 44 7.678 -1.395 -0.886 1.00 0.00 H new ATOM 0 HA PHE A 44 7.282 -1.657 -3.810 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.404 -0.044 -3.521 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.108 -1.588 -2.747 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.109 -1.782 -0.299 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.739 1.976 -2.204 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.667 -0.631 1.826 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.301 3.129 -0.080 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.770 1.826 1.942 1.00 0.00 H new ATOM 646 N THR A 45 7.764 0.964 -4.093 1.00 0.00 N ATOM 647 CA THR A 45 8.501 2.195 -4.349 1.00 0.00 C ATOM 648 C THR A 45 7.556 3.380 -4.507 1.00 0.00 C ATOM 649 O THR A 45 6.597 3.323 -5.277 1.00 0.00 O ATOM 650 CB THR A 45 9.373 2.075 -5.614 1.00 0.00 C ATOM 651 OG1 THR A 45 10.171 0.888 -5.548 1.00 0.00 O ATOM 652 CG2 THR A 45 10.274 3.291 -5.767 1.00 0.00 C ATOM 0 H THR A 45 7.039 0.756 -4.780 1.00 0.00 H new ATOM 0 HA THR A 45 9.146 2.362 -3.486 1.00 0.00 H new ATOM 0 HB THR A 45 8.713 2.020 -6.480 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.874 1.003 -4.874 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.880 3.184 -6.667 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.662 4.190 -5.847 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.926 3.372 -4.898 1.00 0.00 H new ATOM 660 N VAL A 46 7.833 4.454 -3.774 1.00 0.00 N ATOM 661 CA VAL A 46 7.007 5.654 -3.835 1.00 0.00 C ATOM 662 C VAL A 46 7.678 6.741 -4.667 1.00 0.00 C ATOM 663 O VAL A 46 8.796 7.164 -4.370 1.00 0.00 O ATOM 664 CB VAL A 46 6.716 6.207 -2.428 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.975 7.532 -2.517 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.923 5.197 -1.612 1.00 0.00 C ATOM 0 H VAL A 46 8.623 4.517 -3.131 1.00 0.00 H new ATOM 0 HA VAL A 46 6.067 5.367 -4.306 1.00 0.00 H new ATOM 0 HB VAL A 46 7.666 6.383 -1.923 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.778 7.907 -1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.584 8.254 -3.061 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.031 7.386 -3.041 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.726 5.605 -0.620 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.978 4.987 -2.112 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.496 4.275 -1.518 1.00 0.00 H new ATOM 676 N ASP A 47 6.989 7.190 -5.711 1.00 0.00 N ATOM 677 CA ASP A 47 7.517 8.229 -6.586 1.00 0.00 C ATOM 678 C ASP A 47 6.955 9.596 -6.208 1.00 0.00 C ATOM 679 O ASP A 47 5.741 9.799 -6.203 1.00 0.00 O ATOM 680 CB ASP A 47 7.186 7.914 -8.046 1.00 0.00 C ATOM 681 CG ASP A 47 8.221 8.465 -9.007 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.412 9.699 -9.028 1.00 0.00 O ATOM 683 OD2 ASP A 47 8.839 7.663 -9.737 1.00 0.00 O ATOM 0 H ASP A 47 6.063 6.850 -5.971 1.00 0.00 H new ATOM 0 HA ASP A 47 8.600 8.255 -6.465 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.114 6.834 -8.174 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.209 8.330 -8.292 1.00 0.00 H new ATOM 688 N SER A 48 7.846 10.529 -5.889 1.00 0.00 N ATOM 689 CA SER A 48 7.438 11.876 -5.505 1.00 0.00 C ATOM 690 C SER A 48 8.279 12.925 -6.226 1.00 0.00 C ATOM 691 O SER A 48 9.499 12.796 -6.328 1.00 0.00 O ATOM 692 CB SER A 48 7.566 12.057 -3.991 1.00 0.00 C ATOM 693 OG SER A 48 6.994 10.962 -3.296 1.00 0.00 O ATOM 0 H SER A 48 8.855 10.377 -5.889 1.00 0.00 H new ATOM 0 HA SER A 48 6.396 12.010 -5.794 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.618 12.154 -3.721 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.073 12.981 -3.689 1.00 0.00 H new ATOM 0 HG SER A 48 7.090 11.101 -2.331 1.00 0.00 H new ATOM 699 N ARG A 49 7.616 13.963 -6.726 1.00 0.00 N ATOM 700 CA ARG A 49 8.300 15.035 -7.439 1.00 0.00 C ATOM 701 C ARG A 49 8.210 16.347 -6.666 1.00 0.00 C ATOM 702 O ARG A 49 9.188 16.829 -6.095 1.00 0.00 O ATOM 703 CB ARG A 49 7.701 15.210 -8.836 1.00 0.00 C ATOM 704 CG ARG A 49 8.467 14.476 -9.924 1.00 0.00 C ATOM 705 CD ARG A 49 9.896 14.983 -10.038 1.00 0.00 C ATOM 706 NE ARG A 49 10.499 14.637 -11.322 1.00 0.00 N ATOM 707 CZ ARG A 49 11.808 14.652 -11.547 1.00 0.00 C ATOM 708 NH1 ARG A 49 12.647 14.994 -10.579 1.00 0.00 N ATOM 709 NH2 ARG A 49 12.281 14.325 -12.743 1.00 0.00 N ATOM 0 H ARG A 49 6.606 14.084 -6.650 1.00 0.00 H new ATOM 0 HA ARG A 49 9.351 14.762 -7.534 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.670 14.855 -8.827 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.671 16.272 -9.078 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.475 13.408 -9.707 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.957 14.604 -10.879 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.908 16.066 -9.912 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.495 14.562 -9.231 1.00 0.00 H new ATOM 0 HE ARG A 49 9.881 14.369 -12.088 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.288 15.247 -9.658 1.00 0.00 H new ATOM 0 HH12 ARG A 49 13.652 15.005 -10.755 1.00 0.00 H new ATOM 0 HH21 ARG A 49 11.639 14.062 -13.491 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.286 14.337 -12.915 1.00 0.00 H new ATOM 723 N PRO A 50 7.007 16.941 -6.647 1.00 0.00 N ATOM 724 CA PRO A 50 6.760 18.205 -5.948 1.00 0.00 C ATOM 725 C PRO A 50 6.817 18.050 -4.432 1.00 0.00 C ATOM 726 O PRO A 50 6.569 19.002 -3.690 1.00 0.00 O ATOM 727 CB PRO A 50 5.346 18.587 -6.394 1.00 0.00 C ATOM 728 CG PRO A 50 4.701 17.293 -6.754 1.00 0.00 C ATOM 729 CD PRO A 50 5.796 16.423 -7.305 1.00 0.00 C ATOM 0 HA PRO A 50 7.514 18.956 -6.185 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.802 19.092 -5.596 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.369 19.268 -7.245 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.238 16.832 -5.882 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.913 17.442 -7.492 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.630 15.371 -7.071 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.864 16.501 -8.390 1.00 0.00 H new ATOM 737 N LEU A 51 7.145 16.846 -3.977 1.00 0.00 N ATOM 738 CA LEU A 51 7.235 16.567 -2.548 1.00 0.00 C ATOM 739 C LEU A 51 8.690 16.479 -2.101 1.00 0.00 C ATOM 740 O LEU A 51 9.065 17.016 -1.058 1.00 0.00 O ATOM 741 CB LEU A 51 6.508 15.262 -2.217 1.00 0.00 C ATOM 742 CG LEU A 51 5.246 14.971 -3.030 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.514 13.763 -2.466 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.333 16.188 -3.051 1.00 0.00 C ATOM 0 H LEU A 51 7.353 16.047 -4.577 1.00 0.00 H new ATOM 0 HA LEU A 51 6.759 17.388 -2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.205 14.436 -2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.240 15.277 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 51 5.541 14.745 -4.055 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.619 13.571 -3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.167 12.891 -2.504 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.231 13.959 -1.432 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.440 15.963 -3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.046 16.445 -2.031 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.859 17.029 -3.503 1.00 0.00 H new ATOM 756 N THR A 52 9.509 15.800 -2.898 1.00 0.00 N ATOM 757 CA THR A 52 10.924 15.643 -2.586 1.00 0.00 C ATOM 758 C THR A 52 11.755 15.498 -3.856 1.00 0.00 C ATOM 759 O THR A 52 11.258 15.038 -4.883 1.00 0.00 O ATOM 760 CB THR A 52 11.168 14.419 -1.684 1.00 0.00 C ATOM 761 OG1 THR A 52 12.408 14.566 -0.983 1.00 0.00 O ATOM 762 CG2 THR A 52 11.192 13.138 -2.505 1.00 0.00 C ATOM 0 H THR A 52 9.216 15.350 -3.765 1.00 0.00 H new ATOM 0 HA THR A 52 11.232 16.544 -2.055 1.00 0.00 H new ATOM 0 HB THR A 52 10.351 14.356 -0.966 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.352 14.105 -0.120 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.366 12.287 -1.846 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.236 13.014 -3.014 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.991 13.194 -3.244 1.00 0.00 H new ATOM 770 N GLN A 53 13.021 15.893 -3.777 1.00 0.00 N ATOM 771 CA GLN A 53 13.921 15.807 -4.922 1.00 0.00 C ATOM 772 C GLN A 53 15.180 15.023 -4.567 1.00 0.00 C ATOM 773 O GLN A 53 15.713 14.278 -5.389 1.00 0.00 O ATOM 774 CB GLN A 53 14.298 17.207 -5.408 1.00 0.00 C ATOM 775 CG GLN A 53 13.098 18.080 -5.739 1.00 0.00 C ATOM 776 CD GLN A 53 12.510 18.752 -4.514 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.215 19.428 -3.764 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.211 18.571 -4.305 1.00 0.00 N ATOM 0 H GLN A 53 13.447 16.276 -2.933 1.00 0.00 H new ATOM 0 HA GLN A 53 13.401 15.281 -5.722 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.895 17.700 -4.641 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.927 17.118 -6.294 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.396 18.842 -6.459 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.331 17.471 -6.218 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.665 18.003 -4.952 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.760 19.000 -3.497 1.00 0.00 H new ATOM 787 N VAL A 54 15.651 15.196 -3.336 1.00 0.00 N ATOM 788 CA VAL A 54 16.848 14.504 -2.871 1.00 0.00 C ATOM 789 C VAL A 54 16.522 13.552 -1.725 1.00 0.00 C ATOM 790 O VAL A 54 17.297 13.414 -0.780 1.00 0.00 O ATOM 791 CB VAL A 54 17.927 15.499 -2.406 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.250 16.492 -3.513 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.477 16.222 -1.145 1.00 0.00 C ATOM 0 H VAL A 54 15.222 15.809 -2.643 1.00 0.00 H new ATOM 0 HA VAL A 54 17.232 13.933 -3.716 1.00 0.00 H new ATOM 0 HB VAL A 54 18.835 14.942 -2.174 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.014 17.187 -3.166 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.618 15.955 -4.388 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.350 17.046 -3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.252 16.921 -0.830 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.556 16.768 -1.348 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.301 15.495 -0.352 1.00 0.00 H new ATOM 803 N GLY A 55 15.369 12.897 -1.817 1.00 0.00 N ATOM 804 CA GLY A 55 14.961 11.966 -0.781 1.00 0.00 C ATOM 805 C GLY A 55 14.585 12.664 0.511 1.00 0.00 C ATOM 806 O GLY A 55 14.897 13.838 0.704 1.00 0.00 O ATOM 0 H GLY A 55 14.710 12.994 -2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.111 11.382 -1.136 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.772 11.264 -0.588 1.00 0.00 H new ATOM 810 N GLY A 56 13.910 11.940 1.399 1.00 0.00 N ATOM 811 CA GLY A 56 13.500 12.514 2.667 1.00 0.00 C ATOM 812 C GLY A 56 13.178 11.457 3.705 1.00 0.00 C ATOM 813 O GLY A 56 13.321 10.262 3.448 1.00 0.00 O ATOM 0 H GLY A 56 13.640 10.966 1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.294 13.159 3.044 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.624 13.144 2.511 1.00 0.00 H new ATOM 817 N ASP A 57 12.744 11.898 4.880 1.00 0.00 N ATOM 818 CA ASP A 57 12.401 10.981 5.961 1.00 0.00 C ATOM 819 C ASP A 57 11.045 11.335 6.564 1.00 0.00 C ATOM 820 O ASP A 57 10.870 11.309 7.783 1.00 0.00 O ATOM 821 CB ASP A 57 13.479 11.013 7.046 1.00 0.00 C ATOM 822 CG ASP A 57 13.376 9.838 7.999 1.00 0.00 C ATOM 823 OD1 ASP A 57 13.361 8.685 7.520 1.00 0.00 O ATOM 824 OD2 ASP A 57 13.308 10.072 9.224 1.00 0.00 O ATOM 0 H ASP A 57 12.621 12.884 5.109 1.00 0.00 H new ATOM 0 HA ASP A 57 12.343 9.975 5.546 1.00 0.00 H new ATOM 0 HB2 ASP A 57 14.463 11.011 6.577 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.396 11.942 7.609 1.00 0.00 H new ATOM 829 N HIS A 58 10.088 11.666 5.703 1.00 0.00 N ATOM 830 CA HIS A 58 8.747 12.026 6.151 1.00 0.00 C ATOM 831 C HIS A 58 7.716 11.026 5.635 1.00 0.00 C ATOM 832 O HIS A 58 6.559 11.377 5.404 1.00 0.00 O ATOM 833 CB HIS A 58 8.390 13.435 5.678 1.00 0.00 C ATOM 834 CG HIS A 58 8.856 14.514 6.605 1.00 0.00 C ATOM 835 ND1 HIS A 58 7.996 15.272 7.371 1.00 0.00 N ATOM 836 CD2 HIS A 58 10.102 14.960 6.889 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.692 16.139 8.084 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.973 15.970 7.811 1.00 0.00 N ATOM 0 H HIS A 58 10.216 11.692 4.691 1.00 0.00 H new ATOM 0 HA HIS A 58 8.736 12.003 7.241 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.827 13.600 4.693 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.308 13.508 5.564 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.026 14.590 6.469 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.283 16.863 8.773 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.741 16.503 8.218 1.00 0.00 H new ATOM 846 N ILE A 59 8.144 9.781 5.456 1.00 0.00 N ATOM 847 CA ILE A 59 7.258 8.732 4.968 1.00 0.00 C ATOM 848 C ILE A 59 7.005 7.682 6.044 1.00 0.00 C ATOM 849 O ILE A 59 7.941 7.164 6.655 1.00 0.00 O ATOM 850 CB ILE A 59 7.837 8.042 3.719 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.954 9.041 2.566 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.968 6.859 3.316 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.641 9.696 2.198 1.00 0.00 C ATOM 0 H ILE A 59 9.099 9.474 5.642 1.00 0.00 H new ATOM 0 HA ILE A 59 6.316 9.212 4.704 1.00 0.00 H new ATOM 0 HB ILE A 59 8.834 7.671 3.956 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.673 9.814 2.837 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.353 8.528 1.691 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.390 6.382 2.432 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.931 6.139 4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.959 7.207 3.093 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.800 10.391 1.374 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.925 8.932 1.895 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.250 10.238 3.060 1.00 0.00 H new ATOM 865 N LYS A 60 5.734 7.369 6.270 1.00 0.00 N ATOM 866 CA LYS A 60 5.356 6.377 7.270 1.00 0.00 C ATOM 867 C LYS A 60 4.228 5.488 6.756 1.00 0.00 C ATOM 868 O LYS A 60 3.268 5.971 6.157 1.00 0.00 O ATOM 869 CB LYS A 60 4.923 7.069 8.566 1.00 0.00 C ATOM 870 CG LYS A 60 4.656 6.105 9.709 1.00 0.00 C ATOM 871 CD LYS A 60 5.916 5.834 10.515 1.00 0.00 C ATOM 872 CE LYS A 60 6.694 4.655 9.953 1.00 0.00 C ATOM 873 NZ LYS A 60 7.668 4.111 10.940 1.00 0.00 N ATOM 0 H LYS A 60 4.947 7.788 5.774 1.00 0.00 H new ATOM 0 HA LYS A 60 6.225 5.751 7.471 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.698 7.773 8.869 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.021 7.651 8.374 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.887 6.517 10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.268 5.167 9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.548 6.722 10.514 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.649 5.634 11.553 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.999 3.869 9.658 1.00 0.00 H new ATOM 0 HE3 LYS A 60 7.224 4.966 9.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 8.178 3.309 10.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 8.347 4.853 11.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 7.160 3.790 11.789 1.00 0.00 H new ATOM 887 N ALA A 61 4.351 4.187 6.995 1.00 0.00 N ATOM 888 CA ALA A 61 3.341 3.231 6.558 1.00 0.00 C ATOM 889 C ALA A 61 2.867 2.365 7.720 1.00 0.00 C ATOM 890 O ALA A 61 3.621 2.095 8.656 1.00 0.00 O ATOM 891 CB ALA A 61 3.888 2.360 5.437 1.00 0.00 C ATOM 0 H ALA A 61 5.140 3.770 7.489 1.00 0.00 H new ATOM 0 HA ALA A 61 2.484 3.791 6.183 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.123 1.651 5.121 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.171 2.989 4.593 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.762 1.815 5.793 1.00 0.00 H new ATOM 897 N HIS A 62 1.612 1.931 7.655 1.00 0.00 N ATOM 898 CA HIS A 62 1.036 1.095 8.703 1.00 0.00 C ATOM 899 C HIS A 62 0.160 -0.001 8.104 1.00 0.00 C ATOM 900 O HIS A 62 -0.917 0.274 7.574 1.00 0.00 O ATOM 901 CB HIS A 62 0.217 1.947 9.672 1.00 0.00 C ATOM 902 CG HIS A 62 -0.136 1.237 10.943 1.00 0.00 C ATOM 903 ND1 HIS A 62 0.257 1.682 12.188 1.00 0.00 N ATOM 904 CD2 HIS A 62 -0.851 0.108 11.158 1.00 0.00 C ATOM 905 CE1 HIS A 62 -0.199 0.856 13.112 1.00 0.00 C ATOM 906 NE2 HIS A 62 -0.875 -0.107 12.514 1.00 0.00 N ATOM 0 H HIS A 62 0.975 2.144 6.888 1.00 0.00 H new ATOM 0 HA HIS A 62 1.854 0.624 9.248 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.779 2.849 9.914 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.700 2.266 9.177 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -1.316 -0.509 10.403 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.045 0.952 14.177 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -1.340 -0.885 12.983 1.00 0.00 H new ATOM 914 N ILE A 63 0.629 -1.241 8.191 1.00 0.00 N ATOM 915 CA ILE A 63 -0.112 -2.377 7.657 1.00 0.00 C ATOM 916 C ILE A 63 -1.161 -2.864 8.651 1.00 0.00 C ATOM 917 O ILE A 63 -0.947 -2.828 9.862 1.00 0.00 O ATOM 918 CB ILE A 63 0.826 -3.546 7.304 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.858 -3.104 6.264 1.00 0.00 C ATOM 920 CG2 ILE A 63 0.024 -4.733 6.792 1.00 0.00 C ATOM 921 CD1 ILE A 63 3.159 -3.872 6.340 1.00 0.00 C ATOM 0 H ILE A 63 1.519 -1.485 8.626 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.607 -2.033 6.749 1.00 0.00 H new ATOM 0 HB ILE A 63 1.356 -3.853 8.206 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.432 -3.224 5.268 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.064 -2.042 6.397 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.701 -5.551 6.547 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.675 -5.059 7.562 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.530 -4.440 5.900 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.843 -3.506 5.574 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.607 -3.732 7.324 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.966 -4.932 6.177 1.00 0.00 H new ATOM 933 N ALA A 64 -2.296 -3.320 8.129 1.00 0.00 N ATOM 934 CA ALA A 64 -3.377 -3.818 8.970 1.00 0.00 C ATOM 935 C ALA A 64 -3.898 -5.157 8.458 1.00 0.00 C ATOM 936 O ALA A 64 -4.558 -5.221 7.422 1.00 0.00 O ATOM 937 CB ALA A 64 -4.506 -2.801 9.037 1.00 0.00 C ATOM 0 H ALA A 64 -2.490 -3.354 7.128 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.982 -3.971 9.974 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.306 -3.187 9.669 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.131 -1.868 9.457 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.891 -2.619 8.034 1.00 0.00 H new ATOM 943 N ASN A 65 -3.596 -6.224 9.191 1.00 0.00 N ATOM 944 CA ASN A 65 -4.033 -7.562 8.810 1.00 0.00 C ATOM 945 C ASN A 65 -5.544 -7.705 8.964 1.00 0.00 C ATOM 946 O ASN A 65 -6.177 -7.031 9.778 1.00 0.00 O ATOM 947 CB ASN A 65 -3.321 -8.616 9.660 1.00 0.00 C ATOM 948 CG ASN A 65 -1.908 -8.887 9.180 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.615 -8.784 7.989 1.00 0.00 O ATOM 950 ND2 ASN A 65 -1.025 -9.237 10.108 1.00 0.00 N ATOM 0 H ASN A 65 -3.050 -6.188 10.052 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.776 -7.716 7.762 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.292 -8.283 10.698 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.893 -9.543 9.639 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.059 -9.433 9.845 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.313 -9.310 11.084 1.00 0.00 H new ATOM 957 N PRO A 66 -6.138 -8.603 8.165 1.00 0.00 N ATOM 958 CA PRO A 66 -7.582 -8.857 8.194 1.00 0.00 C ATOM 959 C PRO A 66 -8.021 -9.560 9.474 1.00 0.00 C ATOM 960 O PRO A 66 -9.206 -9.828 9.671 1.00 0.00 O ATOM 961 CB PRO A 66 -7.807 -9.763 6.981 1.00 0.00 C ATOM 962 CG PRO A 66 -6.497 -10.437 6.763 1.00 0.00 C ATOM 963 CD PRO A 66 -5.446 -9.441 7.171 1.00 0.00 C ATOM 0 HA PRO A 66 -8.159 -7.933 8.165 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.599 -10.488 7.170 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.106 -9.186 6.106 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.423 -11.348 7.357 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.376 -10.727 5.719 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.571 -9.932 7.598 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.098 -8.853 6.322 1.00 0.00 H new ATOM 971 N SER A 67 -7.058 -9.855 10.341 1.00 0.00 N ATOM 972 CA SER A 67 -7.346 -10.530 11.602 1.00 0.00 C ATOM 973 C SER A 67 -7.311 -9.545 12.766 1.00 0.00 C ATOM 974 O SER A 67 -7.851 -9.814 13.838 1.00 0.00 O ATOM 975 CB SER A 67 -6.340 -11.658 11.842 1.00 0.00 C ATOM 976 OG SER A 67 -6.608 -12.768 11.003 1.00 0.00 O ATOM 0 H SER A 67 -6.072 -9.638 10.194 1.00 0.00 H new ATOM 0 HA SER A 67 -8.348 -10.954 11.538 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.330 -11.294 11.657 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.380 -11.969 12.886 1.00 0.00 H new ATOM 0 HG SER A 67 -5.794 -13.303 10.899 1.00 0.00 H new ATOM 982 N GLY A 68 -6.669 -8.401 12.546 1.00 0.00 N ATOM 983 CA GLY A 68 -6.574 -7.393 13.585 1.00 0.00 C ATOM 984 C GLY A 68 -5.139 -7.035 13.917 1.00 0.00 C ATOM 985 O GLY A 68 -4.873 -5.987 14.505 1.00 0.00 O ATOM 0 H GLY A 68 -6.214 -8.155 11.667 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.104 -6.496 13.266 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -7.072 -7.755 14.484 1.00 0.00 H new ATOM 989 N ALA A 69 -4.211 -7.910 13.542 1.00 0.00 N ATOM 990 CA ALA A 69 -2.796 -7.681 13.803 1.00 0.00 C ATOM 991 C ALA A 69 -2.220 -6.648 12.840 1.00 0.00 C ATOM 992 O ALA A 69 -2.905 -6.185 11.928 1.00 0.00 O ATOM 993 CB ALA A 69 -2.023 -8.988 13.702 1.00 0.00 C ATOM 0 H ALA A 69 -4.414 -8.784 13.057 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.697 -7.290 14.816 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.967 -8.802 13.899 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.410 -9.697 14.434 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.138 -9.402 12.700 1.00 0.00 H new ATOM 999 N SER A 70 -0.958 -6.289 13.050 1.00 0.00 N ATOM 1000 CA SER A 70 -0.291 -5.307 12.203 1.00 0.00 C ATOM 1001 C SER A 70 1.141 -5.735 11.897 1.00 0.00 C ATOM 1002 O SER A 70 1.890 -6.127 12.793 1.00 0.00 O ATOM 1003 CB SER A 70 -0.291 -3.935 12.881 1.00 0.00 C ATOM 1004 OG SER A 70 0.337 -3.993 14.150 1.00 0.00 O ATOM 0 H SER A 70 -0.376 -6.663 13.800 1.00 0.00 H new ATOM 0 HA SER A 70 -0.840 -5.241 11.264 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.226 -3.213 12.249 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.316 -3.582 12.995 1.00 0.00 H new ATOM 0 HG SER A 70 0.326 -3.104 14.562 1.00 0.00 H new ATOM 1010 N THR A 71 1.515 -5.658 10.624 1.00 0.00 N ATOM 1011 CA THR A 71 2.856 -6.039 10.197 1.00 0.00 C ATOM 1012 C THR A 71 3.820 -4.862 10.299 1.00 0.00 C ATOM 1013 O THR A 71 3.445 -3.718 10.047 1.00 0.00 O ATOM 1014 CB THR A 71 2.857 -6.565 8.750 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.965 -7.679 8.633 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.257 -6.982 8.326 1.00 0.00 C ATOM 0 H THR A 71 0.908 -5.335 9.870 1.00 0.00 H new ATOM 0 HA THR A 71 3.186 -6.835 10.865 1.00 0.00 H new ATOM 0 HB THR A 71 2.521 -5.761 8.095 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.721 -7.805 7.692 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.232 -7.350 7.300 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.926 -6.124 8.387 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.617 -7.771 8.986 1.00 0.00 H new ATOM 1024 N GLU A 72 5.064 -5.152 10.669 1.00 0.00 N ATOM 1025 CA GLU A 72 6.081 -4.117 10.804 1.00 0.00 C ATOM 1026 C GLU A 72 6.549 -3.632 9.435 1.00 0.00 C ATOM 1027 O GLU A 72 6.778 -4.432 8.527 1.00 0.00 O ATOM 1028 CB GLU A 72 7.273 -4.643 11.606 1.00 0.00 C ATOM 1029 CG GLU A 72 8.115 -3.546 12.236 1.00 0.00 C ATOM 1030 CD GLU A 72 9.328 -4.088 12.967 1.00 0.00 C ATOM 1031 OE1 GLU A 72 9.313 -5.281 13.337 1.00 0.00 O ATOM 1032 OE2 GLU A 72 10.291 -3.321 13.169 1.00 0.00 O ATOM 0 H GLU A 72 5.391 -6.095 10.880 1.00 0.00 H new ATOM 0 HA GLU A 72 5.638 -3.275 11.336 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.908 -5.305 12.391 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.905 -5.243 10.951 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.442 -2.854 11.460 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.500 -2.976 12.933 1.00 0.00 H new ATOM 1039 N CYS A 73 6.687 -2.319 9.294 1.00 0.00 N ATOM 1040 CA CYS A 73 7.126 -1.726 8.036 1.00 0.00 C ATOM 1041 C CYS A 73 8.521 -1.126 8.175 1.00 0.00 C ATOM 1042 O CYS A 73 8.880 -0.601 9.230 1.00 0.00 O ATOM 1043 CB CYS A 73 6.138 -0.651 7.582 1.00 0.00 C ATOM 1044 SG CYS A 73 4.468 -1.269 7.268 1.00 0.00 S ATOM 0 H CYS A 73 6.501 -1.644 10.036 1.00 0.00 H new ATOM 0 HA CYS A 73 7.163 -2.515 7.285 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.089 0.127 8.344 1.00 0.00 H new ATOM 0 HB3 CYS A 73 6.518 -0.184 6.673 1.00 0.00 H new ATOM 0 HG CYS A 73 3.705 -0.286 6.891 1.00 0.00 H new ATOM 1050 N PHE A 74 9.305 -1.207 7.105 1.00 0.00 N ATOM 1051 CA PHE A 74 10.662 -0.674 7.108 1.00 0.00 C ATOM 1052 C PHE A 74 10.865 0.305 5.955 1.00 0.00 C ATOM 1053 O PHE A 74 10.958 -0.096 4.795 1.00 0.00 O ATOM 1054 CB PHE A 74 11.680 -1.812 7.011 1.00 0.00 C ATOM 1055 CG PHE A 74 11.587 -2.798 8.140 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.486 -3.632 8.260 1.00 0.00 C ATOM 1057 CD2 PHE A 74 12.599 -2.891 9.082 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.397 -4.541 9.297 1.00 0.00 C ATOM 1059 CE2 PHE A 74 12.515 -3.798 10.121 1.00 0.00 C ATOM 1060 CZ PHE A 74 11.413 -4.623 10.230 1.00 0.00 C ATOM 0 H PHE A 74 9.023 -1.637 6.224 1.00 0.00 H new ATOM 0 HA PHE A 74 10.813 -0.139 8.046 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.536 -2.338 6.067 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.684 -1.389 6.990 1.00 0.00 H new ATOM 0 HD1 PHE A 74 9.688 -3.571 7.534 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.463 -2.248 9.003 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.535 -5.186 9.378 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.311 -3.862 10.848 1.00 0.00 H new ATOM 0 HZ PHE A 74 11.345 -5.331 11.043 1.00 0.00 H new ATOM 1070 N VAL A 75 10.931 1.591 6.284 1.00 0.00 N ATOM 1071 CA VAL A 75 11.123 2.628 5.277 1.00 0.00 C ATOM 1072 C VAL A 75 12.593 2.756 4.893 1.00 0.00 C ATOM 1073 O VAL A 75 13.469 2.813 5.757 1.00 0.00 O ATOM 1074 CB VAL A 75 10.612 3.994 5.774 1.00 0.00 C ATOM 1075 CG1 VAL A 75 10.884 5.075 4.739 1.00 0.00 C ATOM 1076 CG2 VAL A 75 9.129 3.920 6.102 1.00 0.00 C ATOM 0 H VAL A 75 10.854 1.940 7.239 1.00 0.00 H new ATOM 0 HA VAL A 75 10.547 2.330 4.401 1.00 0.00 H new ATOM 0 HB VAL A 75 11.150 4.254 6.686 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.516 6.033 5.108 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.957 5.144 4.558 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.374 4.824 3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 75 8.785 4.893 6.452 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.572 3.638 5.208 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.965 3.176 6.882 1.00 0.00 H new ATOM 1086 N THR A 76 12.857 2.803 3.591 1.00 0.00 N ATOM 1087 CA THR A 76 14.221 2.924 3.092 1.00 0.00 C ATOM 1088 C THR A 76 14.317 3.990 2.007 1.00 0.00 C ATOM 1089 O THR A 76 13.839 3.797 0.889 1.00 0.00 O ATOM 1090 CB THR A 76 14.733 1.585 2.526 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.708 0.581 3.547 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.147 1.732 1.986 1.00 0.00 C ATOM 0 H THR A 76 12.144 2.759 2.863 1.00 0.00 H new ATOM 0 HA THR A 76 14.843 3.214 3.939 1.00 0.00 H new ATOM 0 HB THR A 76 14.078 1.287 1.707 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.033 -0.267 3.180 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.487 0.774 1.592 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.157 2.476 1.190 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.812 2.051 2.789 1.00 0.00 H new ATOM 1100 N ASP A 77 14.937 5.116 2.345 1.00 0.00 N ATOM 1101 CA ASP A 77 15.098 6.214 1.398 1.00 0.00 C ATOM 1102 C ASP A 77 16.356 6.027 0.557 1.00 0.00 C ATOM 1103 O ASP A 77 17.455 5.877 1.091 1.00 0.00 O ATOM 1104 CB ASP A 77 15.158 7.550 2.140 1.00 0.00 C ATOM 1105 CG ASP A 77 15.942 7.458 3.435 1.00 0.00 C ATOM 1106 OD1 ASP A 77 17.183 7.587 3.388 1.00 0.00 O ATOM 1107 OD2 ASP A 77 15.313 7.258 4.495 1.00 0.00 O ATOM 0 H ASP A 77 15.336 5.292 3.267 1.00 0.00 H new ATOM 0 HA ASP A 77 14.236 6.216 0.731 1.00 0.00 H new ATOM 0 HB2 ASP A 77 15.615 8.301 1.495 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.145 7.889 2.355 1.00 0.00 H new ATOM 1112 N ASN A 78 16.188 6.035 -0.761 1.00 0.00 N ATOM 1113 CA ASN A 78 17.311 5.865 -1.676 1.00 0.00 C ATOM 1114 C ASN A 78 18.081 7.171 -1.842 1.00 0.00 C ATOM 1115 O ASN A 78 19.115 7.214 -2.507 1.00 0.00 O ATOM 1116 CB ASN A 78 16.815 5.375 -3.039 1.00 0.00 C ATOM 1117 CG ASN A 78 16.223 3.981 -2.972 1.00 0.00 C ATOM 1118 OD1 ASN A 78 16.939 2.985 -3.071 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.908 3.904 -2.804 1.00 0.00 N ATOM 0 H ASN A 78 15.285 6.157 -1.220 1.00 0.00 H new ATOM 0 HA ASN A 78 17.984 5.120 -1.252 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.064 6.068 -3.420 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.643 5.381 -3.748 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.453 2.993 -2.752 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.353 4.756 -2.727 1.00 0.00 H new ATOM 1126 N ALA A 79 17.569 8.235 -1.231 1.00 0.00 N ATOM 1127 CA ALA A 79 18.209 9.542 -1.308 1.00 0.00 C ATOM 1128 C ALA A 79 18.234 10.057 -2.743 1.00 0.00 C ATOM 1129 O ALA A 79 19.142 10.791 -3.134 1.00 0.00 O ATOM 1130 CB ALA A 79 19.621 9.472 -0.746 1.00 0.00 C ATOM 0 H ALA A 79 16.713 8.217 -0.677 1.00 0.00 H new ATOM 0 HA ALA A 79 17.625 10.241 -0.709 1.00 0.00 H new ATOM 0 HB1 ALA A 79 20.087 10.455 -0.810 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.582 9.156 0.296 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.206 8.755 -1.321 1.00 0.00 H new ATOM 1136 N ASP A 80 17.232 9.668 -3.524 1.00 0.00 N ATOM 1137 CA ASP A 80 17.139 10.091 -4.917 1.00 0.00 C ATOM 1138 C ASP A 80 15.828 10.826 -5.175 1.00 0.00 C ATOM 1139 O ASP A 80 15.747 11.682 -6.055 1.00 0.00 O ATOM 1140 CB ASP A 80 17.252 8.883 -5.848 1.00 0.00 C ATOM 1141 CG ASP A 80 17.139 9.266 -7.310 1.00 0.00 C ATOM 1142 OD1 ASP A 80 17.661 10.337 -7.685 1.00 0.00 O ATOM 1143 OD2 ASP A 80 16.529 8.495 -8.079 1.00 0.00 O ATOM 0 H ASP A 80 16.473 9.060 -3.216 1.00 0.00 H new ATOM 0 HA ASP A 80 17.964 10.774 -5.119 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.207 8.386 -5.679 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.470 8.164 -5.602 1.00 0.00 H new ATOM 1148 N GLY A 81 14.802 10.485 -4.401 1.00 0.00 N ATOM 1149 CA GLY A 81 13.507 11.122 -4.562 1.00 0.00 C ATOM 1150 C GLY A 81 12.357 10.176 -4.280 1.00 0.00 C ATOM 1151 O GLY A 81 11.220 10.608 -4.085 1.00 0.00 O ATOM 0 H GLY A 81 14.844 9.779 -3.666 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.441 11.979 -3.892 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.418 11.505 -5.579 1.00 0.00 H new ATOM 1155 N THR A 82 12.650 8.879 -4.260 1.00 0.00 N ATOM 1156 CA THR A 82 11.632 7.869 -4.003 1.00 0.00 C ATOM 1157 C THR A 82 11.908 7.128 -2.700 1.00 0.00 C ATOM 1158 O THR A 82 13.016 7.184 -2.166 1.00 0.00 O ATOM 1159 CB THR A 82 11.550 6.847 -5.153 1.00 0.00 C ATOM 1160 OG1 THR A 82 12.784 6.127 -5.256 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.251 7.542 -6.473 1.00 0.00 C ATOM 0 H THR A 82 13.585 8.504 -4.419 1.00 0.00 H new ATOM 0 HA THR A 82 10.680 8.394 -3.925 1.00 0.00 H new ATOM 0 HB THR A 82 10.740 6.151 -4.935 1.00 0.00 H new ATOM 0 HG1 THR A 82 12.724 5.478 -5.988 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.198 6.801 -7.271 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.298 8.066 -6.401 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.043 8.258 -6.695 1.00 0.00 H new ATOM 1169 N TYR A 83 10.895 6.435 -2.192 1.00 0.00 N ATOM 1170 CA TYR A 83 11.029 5.684 -0.950 1.00 0.00 C ATOM 1171 C TYR A 83 10.798 4.194 -1.186 1.00 0.00 C ATOM 1172 O TYR A 83 10.067 3.806 -2.097 1.00 0.00 O ATOM 1173 CB TYR A 83 10.041 6.205 0.095 1.00 0.00 C ATOM 1174 CG TYR A 83 10.092 7.705 0.281 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.419 8.556 -0.586 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.815 8.271 1.325 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.464 9.927 -0.420 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.864 9.640 1.499 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.187 10.464 0.624 1.00 0.00 C ATOM 1180 OH TYR A 83 10.235 11.829 0.794 1.00 0.00 O ATOM 0 H TYR A 83 9.972 6.378 -2.622 1.00 0.00 H new ATOM 0 HA TYR A 83 12.045 5.822 -0.580 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.031 5.918 -0.197 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.247 5.722 1.050 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.851 8.139 -1.404 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.347 7.629 2.011 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.936 10.574 -1.104 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.429 10.063 2.316 1.00 0.00 H new ATOM 0 HH TYR A 83 10.786 12.042 1.576 1.00 0.00 H new ATOM 1190 N GLN A 84 11.426 3.366 -0.357 1.00 0.00 N ATOM 1191 CA GLN A 84 11.289 1.920 -0.475 1.00 0.00 C ATOM 1192 C GLN A 84 10.901 1.299 0.863 1.00 0.00 C ATOM 1193 O GLN A 84 11.728 1.178 1.767 1.00 0.00 O ATOM 1194 CB GLN A 84 12.595 1.302 -0.977 1.00 0.00 C ATOM 1195 CG GLN A 84 12.460 -0.156 -1.388 1.00 0.00 C ATOM 1196 CD GLN A 84 12.078 -0.318 -2.846 1.00 0.00 C ATOM 1197 OE1 GLN A 84 12.690 0.280 -3.731 1.00 0.00 O ATOM 1198 NE2 GLN A 84 11.060 -1.131 -3.103 1.00 0.00 N ATOM 0 H GLN A 84 12.034 3.672 0.403 1.00 0.00 H new ATOM 0 HA GLN A 84 10.497 1.713 -1.195 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.957 1.879 -1.828 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.349 1.382 -0.194 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.403 -0.670 -1.204 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.708 -0.637 -0.763 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.581 -1.606 -2.338 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.757 -1.280 -4.065 1.00 0.00 H new ATOM 1207 N VAL A 85 9.636 0.907 0.983 1.00 0.00 N ATOM 1208 CA VAL A 85 9.138 0.298 2.211 1.00 0.00 C ATOM 1209 C VAL A 85 9.040 -1.217 2.072 1.00 0.00 C ATOM 1210 O VAL A 85 8.355 -1.726 1.185 1.00 0.00 O ATOM 1211 CB VAL A 85 7.755 0.857 2.594 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.221 0.158 3.835 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.831 2.361 2.810 1.00 0.00 C ATOM 0 H VAL A 85 8.938 1.000 0.245 1.00 0.00 H new ATOM 0 HA VAL A 85 9.852 0.543 2.998 1.00 0.00 H new ATOM 0 HB VAL A 85 7.064 0.665 1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.243 0.566 4.090 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.128 -0.910 3.639 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.908 0.316 4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.845 2.740 3.080 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.536 2.578 3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.167 2.844 1.892 1.00 0.00 H new ATOM 1223 N GLU A 86 9.729 -1.933 2.955 1.00 0.00 N ATOM 1224 CA GLU A 86 9.720 -3.391 2.930 1.00 0.00 C ATOM 1225 C GLU A 86 9.072 -3.952 4.193 1.00 0.00 C ATOM 1226 O GLU A 86 9.324 -3.473 5.299 1.00 0.00 O ATOM 1227 CB GLU A 86 11.145 -3.930 2.793 1.00 0.00 C ATOM 1228 CG GLU A 86 11.216 -5.444 2.694 1.00 0.00 C ATOM 1229 CD GLU A 86 12.586 -5.989 3.050 1.00 0.00 C ATOM 1230 OE1 GLU A 86 12.870 -6.135 4.257 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.373 -6.269 2.122 1.00 0.00 O ATOM 0 H GLU A 86 10.300 -1.527 3.696 1.00 0.00 H new ATOM 0 HA GLU A 86 9.134 -3.711 2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.606 -3.494 1.906 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.732 -3.602 3.651 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.471 -5.883 3.358 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.960 -5.750 1.680 1.00 0.00 H new ATOM 1238 N TYR A 87 8.235 -4.970 4.019 1.00 0.00 N ATOM 1239 CA TYR A 87 7.548 -5.595 5.143 1.00 0.00 C ATOM 1240 C TYR A 87 7.271 -7.068 4.860 1.00 0.00 C ATOM 1241 O TYR A 87 7.134 -7.477 3.706 1.00 0.00 O ATOM 1242 CB TYR A 87 6.237 -4.864 5.436 1.00 0.00 C ATOM 1243 CG TYR A 87 5.191 -5.041 4.359 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.323 -6.126 4.377 1.00 0.00 C ATOM 1245 CD2 TYR A 87 5.070 -4.123 3.323 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.366 -6.292 3.394 1.00 0.00 C ATOM 1247 CE2 TYR A 87 4.115 -4.280 2.337 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.266 -5.366 2.377 1.00 0.00 C ATOM 1249 OH TYR A 87 2.314 -5.527 1.397 1.00 0.00 O ATOM 0 H TYR A 87 8.016 -5.379 3.111 1.00 0.00 H new ATOM 0 HA TYR A 87 8.196 -5.528 6.017 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.835 -5.222 6.384 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.443 -3.801 5.559 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.398 -6.852 5.173 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.734 -3.272 3.288 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.700 -7.142 3.422 1.00 0.00 H new ATOM 0 HE2 TYR A 87 4.034 -3.556 1.539 1.00 0.00 H new ATOM 0 HH TYR A 87 2.437 -4.843 0.706 1.00 0.00 H new ATOM 1259 N THR A 88 7.187 -7.863 5.922 1.00 0.00 N ATOM 1260 CA THR A 88 6.926 -9.290 5.791 1.00 0.00 C ATOM 1261 C THR A 88 5.655 -9.688 6.533 1.00 0.00 C ATOM 1262 O THR A 88 5.653 -9.887 7.748 1.00 0.00 O ATOM 1263 CB THR A 88 8.103 -10.128 6.326 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.340 -9.614 5.821 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.953 -11.588 5.926 1.00 0.00 C ATOM 0 H THR A 88 7.296 -7.541 6.884 1.00 0.00 H new ATOM 0 HA THR A 88 6.800 -9.491 4.727 1.00 0.00 H new ATOM 0 HB THR A 88 8.101 -10.064 7.414 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.083 -10.151 6.167 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.795 -12.160 6.315 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.025 -11.984 6.337 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.931 -11.667 4.839 1.00 0.00 H new ATOM 1273 N PRO A 89 4.547 -9.807 5.787 1.00 0.00 N ATOM 1274 CA PRO A 89 3.248 -10.183 6.353 1.00 0.00 C ATOM 1275 C PRO A 89 3.215 -11.637 6.811 1.00 0.00 C ATOM 1276 O PRO A 89 3.526 -12.548 6.043 1.00 0.00 O ATOM 1277 CB PRO A 89 2.277 -9.966 5.190 1.00 0.00 C ATOM 1278 CG PRO A 89 3.115 -10.108 3.966 1.00 0.00 C ATOM 1279 CD PRO A 89 4.476 -9.584 4.333 1.00 0.00 C ATOM 0 HA PRO A 89 3.006 -9.600 7.241 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.471 -10.699 5.205 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.813 -8.981 5.240 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.170 -11.150 3.649 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.691 -9.544 3.135 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.267 -10.117 3.806 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.581 -8.528 4.083 1.00 0.00 H new ATOM 1287 N PHE A 90 2.834 -11.849 8.067 1.00 0.00 N ATOM 1288 CA PHE A 90 2.760 -13.193 8.627 1.00 0.00 C ATOM 1289 C PHE A 90 1.324 -13.708 8.617 1.00 0.00 C ATOM 1290 O PHE A 90 0.916 -14.455 9.506 1.00 0.00 O ATOM 1291 CB PHE A 90 3.308 -13.204 10.056 1.00 0.00 C ATOM 1292 CG PHE A 90 2.903 -12.003 10.862 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.631 -11.913 11.404 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.794 -10.964 11.078 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.255 -10.810 12.147 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.423 -9.858 11.820 1.00 0.00 C ATOM 1297 CZ PHE A 90 2.152 -9.781 12.354 1.00 0.00 C ATOM 0 H PHE A 90 2.572 -11.107 8.716 1.00 0.00 H new ATOM 0 HA PHE A 90 3.368 -13.852 8.007 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.962 -14.105 10.562 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.396 -13.257 10.019 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.925 -12.714 11.244 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.789 -11.019 10.662 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.261 -10.753 12.565 1.00 0.00 H new ATOM 0 HE2 PHE A 90 4.127 -9.055 11.982 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.860 -8.917 12.933 1.00 0.00 H new ATOM 1307 N GLU A 91 0.564 -13.304 7.605 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.827 -13.723 7.480 1.00 0.00 C ATOM 1309 C GLU A 91 -1.298 -13.624 6.032 1.00 0.00 C ATOM 1310 O GLU A 91 -1.066 -12.619 5.359 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.724 -12.869 8.379 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.764 -13.340 9.823 1.00 0.00 C ATOM 1313 CD GLU A 91 -3.072 -13.000 10.511 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -3.475 -11.819 10.469 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -3.692 -13.916 11.092 1.00 0.00 O ATOM 0 H GLU A 91 0.888 -12.687 6.860 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.895 -14.764 7.795 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.374 -11.837 8.352 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.737 -12.873 7.976 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.611 -14.419 9.854 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.940 -12.885 10.373 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.959 -14.674 5.557 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.464 -14.707 4.190 1.00 0.00 C ATOM 1324 C LYS A 92 -3.841 -14.057 4.102 1.00 0.00 C ATOM 1325 O LYS A 92 -4.850 -14.668 4.452 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.536 -16.150 3.685 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.264 -16.944 3.930 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.453 -18.415 3.599 1.00 0.00 C ATOM 1329 CE LYS A 92 -0.322 -19.263 4.162 1.00 0.00 C ATOM 1330 NZ LYS A 92 -0.613 -19.726 5.547 1.00 0.00 N ATOM 0 H LYS A 92 -2.158 -15.515 6.100 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.775 -14.143 3.562 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.370 -16.656 4.172 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.749 -16.142 2.616 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.456 -16.535 3.324 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.964 -16.840 4.973 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.404 -18.761 4.003 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.501 -18.542 2.518 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.160 -20.126 3.517 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.602 -18.685 4.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.221 -20.213 5.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.843 -18.907 6.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.420 -20.381 5.532 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.875 -12.814 3.630 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.134 -12.104 3.504 1.00 0.00 C ATOM 1346 C GLY A 93 -4.952 -10.690 2.989 1.00 0.00 C ATOM 1347 O GLY A 93 -3.840 -10.282 2.650 1.00 0.00 O ATOM 0 H GLY A 93 -3.054 -12.287 3.333 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.791 -12.652 2.828 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.629 -12.073 4.475 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.047 -9.939 2.928 1.00 0.00 N ATOM 1352 CA LEU A 94 -6.004 -8.562 2.448 1.00 0.00 C ATOM 1353 C LEU A 94 -5.801 -7.588 3.605 1.00 0.00 C ATOM 1354 O LEU A 94 -6.643 -7.484 4.497 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.294 -8.221 1.700 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.521 -6.740 1.393 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.319 -6.155 0.668 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -8.786 -6.554 0.568 1.00 0.00 C ATOM 0 H LEU A 94 -6.975 -10.260 3.205 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.160 -8.468 1.765 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.301 -8.772 0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.138 -8.583 2.288 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.645 -6.208 2.336 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.499 -5.101 0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.433 -6.254 1.294 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.163 -6.690 -0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.932 -5.494 0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.691 -7.099 -0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.642 -6.935 1.124 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.679 -6.876 3.582 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.367 -5.908 4.628 1.00 0.00 C ATOM 1372 C HIS A 95 -4.614 -4.483 4.141 1.00 0.00 C ATOM 1373 O HIS A 95 -4.641 -4.223 2.938 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.913 -6.061 5.077 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.382 -7.453 4.921 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.043 -8.568 5.392 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.247 -7.907 4.341 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.336 -9.648 5.110 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.241 -9.274 4.471 1.00 0.00 N ATOM 0 H HIS A 95 -3.971 -6.951 2.851 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.024 -6.102 5.476 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.290 -5.376 4.502 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.831 -5.765 6.123 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.487 -7.306 3.864 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.607 -10.663 5.359 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.511 -9.899 4.130 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.795 -3.564 5.084 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.039 -2.165 4.751 1.00 0.00 C ATOM 1389 C VAL A 96 -3.821 -1.305 5.065 1.00 0.00 C ATOM 1390 O VAL A 96 -3.533 -1.017 6.226 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.256 -1.611 5.515 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.464 -0.139 5.194 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.504 -2.418 5.187 1.00 0.00 C ATOM 0 H VAL A 96 -4.777 -3.763 6.084 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.242 -2.125 3.681 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.063 -1.701 6.584 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.328 0.235 5.743 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.578 0.425 5.484 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.635 -0.021 4.124 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.354 -2.013 5.736 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.703 -2.362 4.117 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.350 -3.458 5.473 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.108 -0.895 4.020 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.920 -0.065 4.183 1.00 0.00 C ATOM 1405 C VAL A 97 -2.259 1.414 4.035 1.00 0.00 C ATOM 1406 O VAL A 97 -2.655 1.865 2.961 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.831 -0.436 3.160 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.349 0.518 3.265 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.382 -1.876 3.359 1.00 0.00 C ATOM 0 H VAL A 97 -3.333 -1.124 3.052 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.541 -0.249 5.188 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.252 -0.345 2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.108 0.240 2.534 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.012 1.536 3.069 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.773 0.463 4.268 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.388 -2.121 2.628 1.00 0.00 H new ATOM 0 HG22 VAL A 97 0.021 -1.996 4.365 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.233 -2.544 3.228 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.099 2.164 5.121 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.389 3.593 5.111 1.00 0.00 C ATOM 1421 C GLU A 98 -1.101 4.409 5.033 1.00 0.00 C ATOM 1422 O GLU A 98 -0.290 4.400 5.959 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.179 3.985 6.361 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.663 3.677 6.265 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.321 3.543 7.624 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -5.440 4.567 8.330 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.717 2.414 7.983 1.00 0.00 O ATOM 0 H GLU A 98 -1.770 1.806 6.018 1.00 0.00 H new ATOM 0 HA GLU A 98 -2.990 3.809 4.228 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.763 3.462 7.222 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.049 5.052 6.543 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.159 4.468 5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.803 2.752 5.705 1.00 0.00 H new ATOM 1434 N VAL A 99 -0.920 5.113 3.920 1.00 0.00 N ATOM 1435 CA VAL A 99 0.268 5.934 3.720 1.00 0.00 C ATOM 1436 C VAL A 99 -0.043 7.411 3.936 1.00 0.00 C ATOM 1437 O VAL A 99 -1.068 7.916 3.477 1.00 0.00 O ATOM 1438 CB VAL A 99 0.849 5.745 2.306 1.00 0.00 C ATOM 1439 CG1 VAL A 99 2.236 6.363 2.212 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.889 4.269 1.940 1.00 0.00 C ATOM 0 H VAL A 99 -1.581 5.131 3.143 1.00 0.00 H new ATOM 0 HA VAL A 99 1.005 5.609 4.454 1.00 0.00 H new ATOM 0 HB VAL A 99 0.200 6.255 1.594 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.631 6.220 1.206 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.175 7.429 2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.898 5.883 2.933 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.302 4.154 0.938 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.515 3.734 2.654 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.121 3.860 1.965 1.00 0.00 H new ATOM 1450 N THR A 100 0.850 8.101 4.639 1.00 0.00 N ATOM 1451 CA THR A 100 0.672 9.521 4.918 1.00 0.00 C ATOM 1452 C THR A 100 1.978 10.285 4.734 1.00 0.00 C ATOM 1453 O THR A 100 2.953 10.049 5.447 1.00 0.00 O ATOM 1454 CB THR A 100 0.152 9.752 6.349 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.953 9.022 7.285 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.301 9.320 6.474 1.00 0.00 C ATOM 0 H THR A 100 1.704 7.699 5.026 1.00 0.00 H new ATOM 0 HA THR A 100 -0.066 9.892 4.207 1.00 0.00 H new ATOM 0 HB THR A 100 0.218 10.818 6.567 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.899 9.114 7.047 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.646 9.493 7.494 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.913 9.897 5.781 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.387 8.260 6.237 1.00 0.00 H new ATOM 1464 N TYR A 101 1.990 11.203 3.774 1.00 0.00 N ATOM 1465 CA TYR A 101 3.178 12.002 3.495 1.00 0.00 C ATOM 1466 C TYR A 101 3.112 13.345 4.214 1.00 0.00 C ATOM 1467 O TYR A 101 2.234 14.165 3.943 1.00 0.00 O ATOM 1468 CB TYR A 101 3.327 12.224 1.989 1.00 0.00 C ATOM 1469 CG TYR A 101 4.688 12.745 1.586 1.00 0.00 C ATOM 1470 CD1 TYR A 101 5.140 13.981 2.031 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.521 12.002 0.759 1.00 0.00 C ATOM 1472 CE1 TYR A 101 6.382 14.462 1.664 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.765 12.474 0.389 1.00 0.00 C ATOM 1474 CZ TYR A 101 7.191 13.705 0.844 1.00 0.00 C ATOM 1475 OH TYR A 101 8.429 14.179 0.476 1.00 0.00 O ATOM 0 H TYR A 101 1.191 11.413 3.176 1.00 0.00 H new ATOM 0 HA TYR A 101 4.047 11.456 3.863 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.139 11.283 1.471 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.564 12.928 1.657 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.510 14.576 2.675 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.190 11.039 0.399 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.717 15.426 2.018 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.401 11.883 -0.253 1.00 0.00 H new ATOM 0 HH TYR A 101 9.091 13.460 0.553 1.00 0.00 H new ATOM 1485 N ASP A 102 4.047 13.564 5.132 1.00 0.00 N ATOM 1486 CA ASP A 102 4.098 14.809 5.890 1.00 0.00 C ATOM 1487 C ASP A 102 2.823 15.001 6.706 1.00 0.00 C ATOM 1488 O ASP A 102 2.284 16.105 6.783 1.00 0.00 O ATOM 1489 CB ASP A 102 4.300 15.997 4.949 1.00 0.00 C ATOM 1490 CG ASP A 102 5.728 16.107 4.454 1.00 0.00 C ATOM 1491 OD1 ASP A 102 6.340 15.057 4.166 1.00 0.00 O ATOM 1492 OD2 ASP A 102 6.235 17.244 4.354 1.00 0.00 O ATOM 0 H ASP A 102 4.780 12.896 5.369 1.00 0.00 H new ATOM 0 HA ASP A 102 4.943 14.753 6.577 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.629 15.899 4.095 1.00 0.00 H new ATOM 0 HB3 ASP A 102 4.026 16.917 5.466 1.00 0.00 H new ATOM 1497 N ASP A 103 2.345 13.919 7.311 1.00 0.00 N ATOM 1498 CA ASP A 103 1.134 13.968 8.121 1.00 0.00 C ATOM 1499 C ASP A 103 -0.093 14.219 7.249 1.00 0.00 C ATOM 1500 O ASP A 103 -1.027 14.910 7.656 1.00 0.00 O ATOM 1501 CB ASP A 103 1.250 15.060 9.185 1.00 0.00 C ATOM 1502 CG ASP A 103 2.618 15.089 9.838 1.00 0.00 C ATOM 1503 OD1 ASP A 103 3.139 14.004 10.170 1.00 0.00 O ATOM 1504 OD2 ASP A 103 3.167 16.196 10.018 1.00 0.00 O ATOM 0 H ASP A 103 2.778 12.997 7.256 1.00 0.00 H new ATOM 0 HA ASP A 103 1.017 13.003 8.614 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.047 16.030 8.730 1.00 0.00 H new ATOM 0 HB3 ASP A 103 0.489 14.901 9.949 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.083 13.654 6.045 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.194 13.816 5.115 1.00 0.00 C ATOM 1511 C VAL A 104 -1.338 12.596 4.213 1.00 0.00 C ATOM 1512 O VAL A 104 -0.390 12.162 3.557 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.014 15.070 4.239 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.150 15.188 3.235 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -0.925 16.317 5.106 1.00 0.00 C ATOM 0 H VAL A 104 0.683 13.080 5.691 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.096 13.928 5.716 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.081 14.974 3.685 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.005 16.080 2.625 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.161 14.307 2.593 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.099 15.262 3.766 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.798 17.194 4.471 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.840 16.421 5.689 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.073 16.231 5.780 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.552 12.027 4.177 1.00 0.00 N ATOM 1526 CA PRO A 105 -2.850 10.848 3.358 1.00 0.00 C ATOM 1527 C PRO A 105 -2.846 11.163 1.866 1.00 0.00 C ATOM 1528 O PRO A 105 -3.019 12.314 1.465 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.254 10.444 3.815 1.00 0.00 C ATOM 1530 CG PRO A 105 -4.859 11.702 4.335 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.727 12.490 4.933 1.00 0.00 C ATOM 0 HA PRO A 105 -2.103 10.064 3.485 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.837 10.036 2.989 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.213 9.676 4.587 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.344 12.261 3.535 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.623 11.488 5.082 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.880 13.563 4.819 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.621 12.294 6.000 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.647 10.134 1.049 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.622 10.302 -0.398 1.00 0.00 C ATOM 1541 C ILE A 106 -3.935 9.850 -1.027 1.00 0.00 C ATOM 1542 O ILE A 106 -4.703 9.087 -0.440 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.462 9.514 -1.036 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.169 8.250 -0.227 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.220 10.387 -1.134 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.061 7.402 -0.811 1.00 0.00 C ATOM 0 H ILE A 106 -2.501 9.175 1.365 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.477 11.365 -0.590 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.754 9.217 -2.043 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -0.900 8.534 0.791 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.078 7.651 -0.162 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.591 9.816 -1.587 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.437 11.260 -1.749 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.077 10.711 -0.136 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.092 6.523 -0.186 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.336 7.088 -1.818 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.860 7.984 -0.851 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.201 10.328 -2.251 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.421 9.985 -2.988 1.00 0.00 C ATOM 1560 C PRO A 107 -5.431 8.531 -3.447 1.00 0.00 C ATOM 1561 O PRO A 107 -6.365 8.087 -4.113 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.384 10.927 -4.194 1.00 0.00 C ATOM 1563 CG PRO A 107 -3.941 11.240 -4.386 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.331 11.242 -3.011 1.00 0.00 C ATOM 0 HA PRO A 107 -6.314 10.095 -2.372 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.808 10.453 -5.080 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.964 11.831 -4.008 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.462 10.497 -5.024 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.813 12.208 -4.871 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.299 10.892 -3.029 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.322 12.242 -2.577 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.384 7.794 -3.087 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.273 6.390 -3.463 1.00 0.00 C ATOM 1574 C ASN A 108 -4.466 5.485 -2.250 1.00 0.00 C ATOM 1575 O ASN A 108 -4.686 4.282 -2.389 1.00 0.00 O ATOM 1576 CB ASN A 108 -2.911 6.119 -4.105 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.485 7.227 -5.049 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.518 7.942 -4.788 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.208 7.373 -6.153 1.00 0.00 N ATOM 0 H ASN A 108 -3.601 8.146 -2.536 1.00 0.00 H new ATOM 0 HA ASN A 108 -5.058 6.170 -4.186 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.161 6.003 -3.323 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.951 5.176 -4.650 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.970 8.101 -6.826 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.002 6.757 -6.328 1.00 0.00 H new ATOM 1586 N SER A 109 -4.382 6.073 -1.061 1.00 0.00 N ATOM 1587 CA SER A 109 -4.544 5.320 0.177 1.00 0.00 C ATOM 1588 C SER A 109 -5.951 5.496 0.740 1.00 0.00 C ATOM 1589 O SER A 109 -6.653 6.460 0.434 1.00 0.00 O ATOM 1590 CB SER A 109 -3.509 5.769 1.211 1.00 0.00 C ATOM 1591 OG SER A 109 -2.271 5.106 1.014 1.00 0.00 O ATOM 0 H SER A 109 -4.203 7.068 -0.929 1.00 0.00 H new ATOM 0 HA SER A 109 -4.390 4.264 -0.046 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.363 6.847 1.140 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.880 5.563 2.215 1.00 0.00 H new ATOM 0 HG SER A 109 -2.360 4.458 0.284 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.373 4.542 1.583 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.546 3.390 1.954 1.00 0.00 C ATOM 1599 C PRO A 110 -5.354 2.418 0.795 1.00 0.00 C ATOM 1600 O PRO A 110 -5.970 2.565 -0.261 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.344 2.728 3.080 1.00 0.00 C ATOM 1602 CG PRO A 110 -7.756 3.135 2.834 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.691 4.514 2.239 1.00 0.00 C ATOM 0 HA PRO A 110 -4.539 3.688 2.245 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.235 1.644 3.058 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.000 3.063 4.059 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.250 2.440 2.155 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.329 3.137 3.761 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.498 4.682 1.526 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -7.775 5.286 3.004 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.496 1.424 0.999 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.222 0.427 -0.030 1.00 0.00 C ATOM 1613 C PHE A 111 -4.692 -0.955 0.413 1.00 0.00 C ATOM 1614 O PHE A 111 -4.894 -1.204 1.602 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.726 0.391 -0.350 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.281 1.498 -1.261 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.541 1.442 -2.621 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.601 2.596 -0.758 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.133 2.459 -3.462 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.191 3.617 -1.594 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.456 3.548 -2.948 1.00 0.00 C ATOM 0 H PHE A 111 -3.978 1.287 1.867 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.772 0.708 -0.928 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.162 0.449 0.581 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.484 -0.567 -0.810 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.069 0.593 -3.028 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.389 2.654 0.299 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.343 2.403 -4.520 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.664 4.468 -1.189 1.00 0.00 H new ATOM 0 HZ PHE A 111 -1.135 4.344 -3.603 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.866 -1.852 -0.552 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.312 -3.210 -0.264 1.00 0.00 C ATOM 1633 C LYS A 112 -4.366 -4.236 -0.880 1.00 0.00 C ATOM 1634 O LYS A 112 -4.334 -4.413 -2.098 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.731 -3.426 -0.794 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.816 -3.076 0.210 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.124 -2.728 -0.481 1.00 0.00 C ATOM 1638 CE LYS A 112 -9.220 -1.240 -0.778 1.00 0.00 C ATOM 1639 NZ LYS A 112 -9.566 -0.453 0.439 1.00 0.00 N ATOM 0 H LYS A 112 -4.705 -1.663 -1.541 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.310 -3.344 0.818 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.870 -2.823 -1.691 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.844 -4.469 -1.090 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.973 -3.917 0.886 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.490 -2.233 0.820 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.207 -3.291 -1.410 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.961 -3.029 0.149 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -8.270 -0.888 -1.180 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.974 -1.071 -1.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -9.622 0.556 0.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.484 -0.771 0.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -8.833 -0.594 1.164 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.597 -4.910 -0.031 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.652 -5.920 -0.492 1.00 0.00 C ATOM 1655 C VAL A 113 -3.217 -7.325 -0.310 1.00 0.00 C ATOM 1656 O VAL A 113 -3.167 -7.888 0.782 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.311 -5.817 0.257 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.355 -6.906 -0.207 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.697 -4.439 0.063 1.00 0.00 C ATOM 0 H VAL A 113 -3.610 -4.775 0.980 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.482 -5.734 -1.553 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.497 -5.960 1.321 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.587 -6.817 0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.795 -7.884 -0.011 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.172 -6.798 -1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.250 -4.384 0.599 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.524 -4.264 -0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.377 -3.680 0.449 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.754 -7.885 -1.389 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.327 -9.225 -1.350 1.00 0.00 C ATOM 1671 C ALA A 114 -3.238 -10.289 -1.431 1.00 0.00 C ATOM 1672 O ALA A 114 -2.830 -10.693 -2.520 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.328 -9.405 -2.481 1.00 0.00 C ATOM 0 H ALA A 114 -3.804 -7.431 -2.301 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.846 -9.344 -0.399 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.747 -10.410 -2.439 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.129 -8.673 -2.378 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.826 -9.261 -3.438 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.769 -10.740 -0.271 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.728 -11.758 -0.211 1.00 0.00 C ATOM 1681 C VAL A 115 -2.280 -13.132 -0.577 1.00 0.00 C ATOM 1682 O VAL A 115 -3.360 -13.518 -0.130 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.092 -11.829 1.190 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.102 -12.981 1.270 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.416 -10.510 1.535 1.00 0.00 C ATOM 0 H VAL A 115 -3.094 -10.416 0.640 1.00 0.00 H new ATOM 0 HA VAL A 115 -0.964 -11.472 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.882 -12.009 1.920 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.337 -13.015 2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.619 -13.919 1.069 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.686 -12.835 0.531 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.028 -10.578 2.528 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.363 -10.298 0.803 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.154 -9.708 1.522 1.00 0.00 H new ATOM 1695 N THR A 116 -1.530 -13.867 -1.392 1.00 0.00 N ATOM 1696 CA THR A 116 -1.944 -15.198 -1.818 1.00 0.00 C ATOM 1697 C THR A 116 -0.884 -16.239 -1.477 1.00 0.00 C ATOM 1698 O THR A 116 0.281 -15.905 -1.268 1.00 0.00 O ATOM 1699 CB THR A 116 -2.221 -15.242 -3.333 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.603 -16.565 -3.723 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.993 -14.810 -4.120 1.00 0.00 C ATOM 0 H THR A 116 -0.633 -13.563 -1.770 1.00 0.00 H new ATOM 0 HA THR A 116 -2.864 -15.430 -1.281 1.00 0.00 H new ATOM 0 HB THR A 116 -3.035 -14.551 -3.552 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.779 -16.584 -4.687 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.212 -14.849 -5.187 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.723 -13.791 -3.842 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.163 -15.480 -3.896 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.298 -17.501 -1.422 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.382 -18.591 -1.105 1.00 0.00 C ATOM 1711 C GLU A 117 0.752 -18.662 -2.124 1.00 0.00 C ATOM 1712 O GLU A 117 0.526 -18.935 -3.302 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.133 -19.924 -1.068 1.00 0.00 C ATOM 1714 CG GLU A 117 -1.956 -20.124 0.194 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.489 -21.537 0.325 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -3.401 -21.902 -0.446 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -1.993 -22.279 1.199 1.00 0.00 O ATOM 0 H GLU A 117 -2.260 -17.794 -1.593 1.00 0.00 H new ATOM 0 HA GLU A 117 0.047 -18.397 -0.122 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.791 -19.985 -1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.414 -20.739 -1.156 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.343 -19.889 1.064 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.791 -19.423 0.194 1.00 0.00 H new ATOM 1724 N GLY A 118 1.973 -18.415 -1.660 1.00 0.00 N ATOM 1725 CA GLY A 118 3.125 -18.455 -2.542 1.00 0.00 C ATOM 1726 C GLY A 118 4.227 -19.352 -2.016 1.00 0.00 C ATOM 1727 O GLY A 118 4.496 -20.413 -2.581 1.00 0.00 O ATOM 0 H GLY A 118 2.185 -18.188 -0.689 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.813 -18.806 -3.526 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.514 -17.445 -2.672 1.00 0.00 H new ATOM 1731 N CYS A 119 4.868 -18.926 -0.934 1.00 0.00 N ATOM 1732 CA CYS A 119 5.950 -19.698 -0.333 1.00 0.00 C ATOM 1733 C CYS A 119 5.400 -20.879 0.461 1.00 0.00 C ATOM 1734 O CYS A 119 4.563 -20.707 1.346 1.00 0.00 O ATOM 1735 CB CYS A 119 6.797 -18.806 0.577 1.00 0.00 C ATOM 1736 SG CYS A 119 8.495 -19.383 0.803 1.00 0.00 S ATOM 0 H CYS A 119 4.658 -18.051 -0.455 1.00 0.00 H new ATOM 0 HA CYS A 119 6.577 -20.084 -1.137 1.00 0.00 H new ATOM 0 HB2 CYS A 119 6.819 -17.798 0.162 1.00 0.00 H new ATOM 0 HB3 CYS A 119 6.315 -18.738 1.552 1.00 0.00 H new ATOM 0 HG CYS A 119 9.132 -18.563 1.585 1.00 0.00 H new ATOM 1742 N GLN A 120 5.877 -22.076 0.137 1.00 0.00 N ATOM 1743 CA GLN A 120 5.430 -23.285 0.819 1.00 0.00 C ATOM 1744 C GLN A 120 5.969 -23.336 2.245 1.00 0.00 C ATOM 1745 O GLN A 120 7.151 -23.102 2.497 1.00 0.00 O ATOM 1746 CB GLN A 120 5.880 -24.527 0.047 1.00 0.00 C ATOM 1747 CG GLN A 120 5.100 -25.782 0.406 1.00 0.00 C ATOM 1748 CD GLN A 120 3.720 -25.811 -0.220 1.00 0.00 C ATOM 1749 OE1 GLN A 120 2.707 -25.772 0.480 1.00 0.00 O ATOM 1750 NE2 GLN A 120 3.672 -25.879 -1.545 1.00 0.00 N ATOM 0 H GLN A 120 6.572 -22.235 -0.592 1.00 0.00 H new ATOM 0 HA GLN A 120 4.341 -23.267 0.862 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.776 -24.338 -1.021 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.939 -24.700 0.239 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.660 -26.659 0.081 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.005 -25.848 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 120 4.536 -25.909 -2.086 1.00 0.00 H new ATOM 0 HE22 GLN A 120 2.771 -25.901 -2.022 1.00 0.00 H new ATOM 1759 N PRO A 121 5.083 -23.650 3.202 1.00 0.00 N ATOM 1760 CA PRO A 121 5.446 -23.739 4.619 1.00 0.00 C ATOM 1761 C PRO A 121 6.338 -24.941 4.914 1.00 0.00 C ATOM 1762 O PRO A 121 7.324 -24.830 5.642 1.00 0.00 O ATOM 1763 CB PRO A 121 4.095 -23.890 5.323 1.00 0.00 C ATOM 1764 CG PRO A 121 3.198 -24.490 4.297 1.00 0.00 C ATOM 1765 CD PRO A 121 3.658 -23.942 2.974 1.00 0.00 C ATOM 0 HA PRO A 121 6.019 -22.872 4.948 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.176 -24.530 6.201 1.00 0.00 H new ATOM 0 HB3 PRO A 121 3.717 -22.927 5.665 1.00 0.00 H new ATOM 0 HG2 PRO A 121 3.261 -25.578 4.312 1.00 0.00 H new ATOM 0 HG3 PRO A 121 2.157 -24.228 4.487 1.00 0.00 H new ATOM 0 HD2 PRO A 121 3.520 -24.665 2.170 1.00 0.00 H new ATOM 0 HD3 PRO A 121 3.104 -23.046 2.696 1.00 0.00 H new ATOM 1773 N SER A 122 5.984 -26.088 4.345 1.00 0.00 N ATOM 1774 CA SER A 122 6.751 -27.312 4.550 1.00 0.00 C ATOM 1775 C SER A 122 7.861 -27.438 3.511 1.00 0.00 C ATOM 1776 O SER A 122 7.626 -27.280 2.313 1.00 0.00 O ATOM 1777 CB SER A 122 5.831 -28.533 4.481 1.00 0.00 C ATOM 1778 OG SER A 122 5.415 -28.783 3.150 1.00 0.00 O ATOM 0 H SER A 122 5.171 -26.196 3.738 1.00 0.00 H new ATOM 0 HA SER A 122 7.207 -27.265 5.539 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.351 -29.407 4.873 1.00 0.00 H new ATOM 0 HB3 SER A 122 4.958 -28.371 5.114 1.00 0.00 H new ATOM 0 HG SER A 122 4.830 -29.569 3.132 1.00 0.00 H new ATOM 1784 N SER A 123 9.072 -27.723 3.980 1.00 0.00 N ATOM 1785 CA SER A 123 10.220 -27.867 3.093 1.00 0.00 C ATOM 1786 C SER A 123 11.034 -29.105 3.455 1.00 0.00 C ATOM 1787 O SER A 123 10.975 -29.594 4.583 1.00 0.00 O ATOM 1788 CB SER A 123 11.106 -26.621 3.165 1.00 0.00 C ATOM 1789 OG SER A 123 11.532 -26.374 4.494 1.00 0.00 O ATOM 0 H SER A 123 9.283 -27.859 4.969 1.00 0.00 H new ATOM 0 HA SER A 123 9.849 -27.982 2.075 1.00 0.00 H new ATOM 0 HB2 SER A 123 11.975 -26.751 2.520 1.00 0.00 H new ATOM 0 HB3 SER A 123 10.556 -25.758 2.790 1.00 0.00 H new ATOM 0 HG SER A 123 12.098 -25.574 4.513 1.00 0.00 H new ATOM 1795 N GLY A 124 11.796 -29.608 2.488 1.00 0.00 N ATOM 1796 CA GLY A 124 12.612 -30.785 2.723 1.00 0.00 C ATOM 1797 C GLY A 124 13.867 -30.472 3.513 1.00 0.00 C ATOM 1798 O GLY A 124 14.187 -29.314 3.779 1.00 0.00 O ATOM 0 H GLY A 124 11.863 -29.221 1.546 1.00 0.00 H new ATOM 0 HA2 GLY A 124 12.024 -31.529 3.260 1.00 0.00 H new ATOM 0 HA3 GLY A 124 12.890 -31.228 1.766 1.00 0.00 H new ATOM 1802 N PRO A 125 14.602 -31.524 3.904 1.00 0.00 N ATOM 1803 CA PRO A 125 15.841 -31.381 4.675 1.00 0.00 C ATOM 1804 C PRO A 125 16.970 -30.773 3.851 1.00 0.00 C ATOM 1805 O PRO A 125 17.783 -31.492 3.268 1.00 0.00 O ATOM 1806 CB PRO A 125 16.181 -32.820 5.070 1.00 0.00 C ATOM 1807 CG PRO A 125 15.534 -33.663 4.025 1.00 0.00 C ATOM 1808 CD PRO A 125 14.282 -32.933 3.623 1.00 0.00 C ATOM 0 HA PRO A 125 15.717 -30.710 5.525 1.00 0.00 H new ATOM 0 HB2 PRO A 125 17.259 -32.979 5.096 1.00 0.00 H new ATOM 0 HB3 PRO A 125 15.800 -33.059 6.063 1.00 0.00 H new ATOM 0 HG2 PRO A 125 16.196 -33.802 3.171 1.00 0.00 H new ATOM 0 HG3 PRO A 125 15.301 -34.655 4.413 1.00 0.00 H new ATOM 0 HD2 PRO A 125 14.047 -33.089 2.570 1.00 0.00 H new ATOM 0 HD3 PRO A 125 13.419 -33.271 4.196 1.00 0.00 H new ATOM 1816 N SER A 126 17.016 -29.446 3.806 1.00 0.00 N ATOM 1817 CA SER A 126 18.045 -28.741 3.050 1.00 0.00 C ATOM 1818 C SER A 126 19.377 -28.763 3.793 1.00 0.00 C ATOM 1819 O SER A 126 19.442 -29.144 4.962 1.00 0.00 O ATOM 1820 CB SER A 126 17.617 -27.296 2.790 1.00 0.00 C ATOM 1821 OG SER A 126 17.408 -26.599 4.006 1.00 0.00 O ATOM 0 H SER A 126 16.352 -28.837 4.284 1.00 0.00 H new ATOM 0 HA SER A 126 18.173 -29.252 2.096 1.00 0.00 H new ATOM 0 HB2 SER A 126 18.381 -26.787 2.202 1.00 0.00 H new ATOM 0 HB3 SER A 126 16.701 -27.285 2.199 1.00 0.00 H new ATOM 0 HG SER A 126 17.137 -25.677 3.812 1.00 0.00 H new ATOM 1827 N SER A 127 20.438 -28.352 3.106 1.00 0.00 N ATOM 1828 CA SER A 127 21.770 -28.327 3.699 1.00 0.00 C ATOM 1829 C SER A 127 22.690 -27.385 2.929 1.00 0.00 C ATOM 1830 O SER A 127 22.382 -26.976 1.810 1.00 0.00 O ATOM 1831 CB SER A 127 22.367 -29.736 3.722 1.00 0.00 C ATOM 1832 OG SER A 127 23.552 -29.775 4.499 1.00 0.00 O ATOM 0 H SER A 127 20.401 -28.032 2.138 1.00 0.00 H new ATOM 0 HA SER A 127 21.679 -27.962 4.722 1.00 0.00 H new ATOM 0 HB2 SER A 127 21.638 -30.437 4.129 1.00 0.00 H new ATOM 0 HB3 SER A 127 22.585 -30.059 2.704 1.00 0.00 H new ATOM 0 HG SER A 127 23.913 -30.686 4.499 1.00 0.00 H new ATOM 1838 N GLY A 128 23.822 -27.045 3.538 1.00 0.00 N ATOM 1839 CA GLY A 128 24.770 -26.153 2.896 1.00 0.00 C ATOM 1840 C GLY A 128 24.901 -24.828 3.619 1.00 0.00 C ATOM 1841 O GLY A 128 23.900 -24.199 3.963 1.00 0.00 O ATOM 0 H GLY A 128 24.099 -27.371 4.464 1.00 0.00 H new ATOM 0 HA2 GLY A 128 25.746 -26.637 2.851 1.00 0.00 H new ATOM 0 HA3 GLY A 128 24.456 -25.973 1.868 1.00 0.00 H new TER 1845 GLY A 128