USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=34 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 45 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 84 GLN : amide:sc= -2.28! K(o=-2.3!,f=-0.83) USER MOD Set 2.1: A 83 TYR OH : rot 94:sc= 1.03 USER MOD Set 2.2: A 101 TYR OH : rot 120:sc= -0.0477 USER MOD Set 3.1: A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 82 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 62 HIS : no HD1:sc= -0.887 K(o=-0.89,f=-0.17) USER MOD Set 4.2: A 70 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 65 ASN : amide:sc= -2.02! K(o=-2!,f=-1.2) USER MOD Set 5.2: A 71 THR OG1 : rot 160:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 29:sc= 0.29 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= -0.101 X(o=-0.1,f=-0.019) USER MOD Single : A 14 LYS NZ :NH3+ -123:sc= -0.13 (180deg=-0.653) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.0604 USER MOD Single : A 22 SER OG : rot 68:sc= 0.0205 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 148:sc= -0.318 (180deg=-1.65!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 100:sc= -0.964 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 120:sc= -0.822 USER MOD Single : A 53 GLN : amide:sc= -2.14! X(o=-2.1!,f=-1.7) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 60 LYS NZ :NH3+ -158:sc= -0.643 (180deg=-1.21) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot -119:sc= -1.75 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -172:sc= -0.66 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -135:sc= -0.0147 (180deg=-2.28!) USER MOD Single : A 95 HIS : no HD1:sc= -3.28! C(o=-3.3!,f=-9.1!) USER MOD Single : A 100 THR OG1 : rot 42:sc= 0.242 USER MOD Single : A 108 ASN : amide:sc= -0.19 K(o=-0.19,f=-2.7!) USER MOD Single : A 109 SER OG : rot 15:sc= 0.916 USER MOD Single : A 112 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.024) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.286 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.86) 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 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.328 -10.932 25.918 1.00 0.00 N ATOM 2 CA GLY A 1 6.202 -9.689 26.656 1.00 0.00 C ATOM 3 C GLY A 1 6.067 -8.485 25.745 1.00 0.00 C ATOM 4 O GLY A 1 7.064 -7.870 25.366 1.00 0.00 O ATOM 0 H1 GLY A 1 6.417 -11.725 26.585 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.484 -11.071 25.326 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.173 -10.892 25.313 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.332 -9.745 27.310 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.075 -9.560 27.296 1.00 0.00 H new ATOM 8 N SER A 2 4.831 -8.148 25.390 1.00 0.00 N ATOM 9 CA SER A 2 4.570 -7.012 24.513 1.00 0.00 C ATOM 10 C SER A 2 5.159 -5.730 25.094 1.00 0.00 C ATOM 11 O SER A 2 5.882 -5.002 24.415 1.00 0.00 O ATOM 12 CB SER A 2 3.066 -6.844 24.296 1.00 0.00 C ATOM 13 OG SER A 2 2.795 -5.766 23.417 1.00 0.00 O ATOM 0 H SER A 2 3.995 -8.645 25.696 1.00 0.00 H new ATOM 0 HA SER A 2 5.048 -7.208 23.553 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.649 -7.764 23.887 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.575 -6.669 25.253 1.00 0.00 H new ATOM 0 HG SER A 2 1.827 -5.680 23.293 1.00 0.00 H new ATOM 19 N SER A 3 4.842 -5.461 26.357 1.00 0.00 N ATOM 20 CA SER A 3 5.335 -4.265 27.030 1.00 0.00 C ATOM 21 C SER A 3 5.297 -3.060 26.095 1.00 0.00 C ATOM 22 O SER A 3 6.228 -2.257 26.060 1.00 0.00 O ATOM 23 CB SER A 3 6.762 -4.489 27.534 1.00 0.00 C ATOM 24 OG SER A 3 6.761 -5.022 28.847 1.00 0.00 O ATOM 0 H SER A 3 4.246 -6.055 26.934 1.00 0.00 H new ATOM 0 HA SER A 3 4.684 -4.063 27.881 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.286 -5.169 26.862 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.308 -3.546 27.521 1.00 0.00 H new ATOM 0 HG SER A 3 7.684 -5.158 29.146 1.00 0.00 H new ATOM 30 N GLY A 4 4.211 -2.942 25.336 1.00 0.00 N ATOM 31 CA GLY A 4 4.071 -1.833 24.410 1.00 0.00 C ATOM 32 C GLY A 4 2.809 -1.030 24.654 1.00 0.00 C ATOM 33 O GLY A 4 1.730 -1.595 24.833 1.00 0.00 O ATOM 0 H GLY A 4 3.427 -3.594 25.346 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.938 -1.178 24.499 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.063 -2.215 23.389 1.00 0.00 H new ATOM 37 N SER A 5 2.944 0.292 24.662 1.00 0.00 N ATOM 38 CA SER A 5 1.806 1.175 24.892 1.00 0.00 C ATOM 39 C SER A 5 2.186 2.630 24.633 1.00 0.00 C ATOM 40 O SER A 5 3.100 3.165 25.260 1.00 0.00 O ATOM 41 CB SER A 5 1.292 1.018 26.325 1.00 0.00 C ATOM 42 OG SER A 5 2.316 1.291 27.266 1.00 0.00 O ATOM 0 H SER A 5 3.830 0.775 24.512 1.00 0.00 H new ATOM 0 HA SER A 5 1.015 0.895 24.197 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.453 1.694 26.490 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.919 0.004 26.472 1.00 0.00 H new ATOM 0 HG SER A 5 2.950 1.932 26.883 1.00 0.00 H new ATOM 48 N SER A 6 1.477 3.263 23.704 1.00 0.00 N ATOM 49 CA SER A 6 1.741 4.655 23.358 1.00 0.00 C ATOM 50 C SER A 6 0.657 5.200 22.433 1.00 0.00 C ATOM 51 O SER A 6 -0.127 4.442 21.863 1.00 0.00 O ATOM 52 CB SER A 6 3.111 4.785 22.689 1.00 0.00 C ATOM 53 OG SER A 6 3.100 4.219 21.390 1.00 0.00 O ATOM 0 H SER A 6 0.716 2.834 23.178 1.00 0.00 H new ATOM 0 HA SER A 6 1.737 5.240 24.278 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.391 5.837 22.628 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.866 4.289 23.299 1.00 0.00 H new ATOM 0 HG SER A 6 3.986 4.316 20.983 1.00 0.00 H new ATOM 59 N GLY A 7 0.619 6.521 22.289 1.00 0.00 N ATOM 60 CA GLY A 7 -0.372 7.147 21.433 1.00 0.00 C ATOM 61 C GLY A 7 -0.471 8.642 21.657 1.00 0.00 C ATOM 62 O GLY A 7 -1.533 9.156 22.011 1.00 0.00 O ATOM 0 H GLY A 7 1.257 7.169 22.750 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.120 6.955 20.390 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.345 6.690 21.615 1.00 0.00 H new ATOM 66 N HIS A 8 0.639 9.345 21.453 1.00 0.00 N ATOM 67 CA HIS A 8 0.673 10.792 21.636 1.00 0.00 C ATOM 68 C HIS A 8 -0.115 11.497 20.537 1.00 0.00 C ATOM 69 O HIS A 8 0.403 11.740 19.446 1.00 0.00 O ATOM 70 CB HIS A 8 2.118 11.292 21.646 1.00 0.00 C ATOM 71 CG HIS A 8 3.011 10.525 22.572 1.00 0.00 C ATOM 72 ND1 HIS A 8 3.193 10.865 23.896 1.00 0.00 N ATOM 73 CD2 HIS A 8 3.774 9.427 22.359 1.00 0.00 C ATOM 74 CE1 HIS A 8 4.031 10.011 24.456 1.00 0.00 C ATOM 75 NE2 HIS A 8 4.398 9.128 23.545 1.00 0.00 N ATOM 0 H HIS A 8 1.527 8.936 21.161 1.00 0.00 H new ATOM 0 HA HIS A 8 0.210 11.023 22.595 1.00 0.00 H new ATOM 0 HB2 HIS A 8 2.521 11.234 20.635 1.00 0.00 H new ATOM 0 HB3 HIS A 8 2.128 12.343 21.933 1.00 0.00 H new ATOM 0 HD2 HIS A 8 3.873 8.887 21.429 1.00 0.00 H new ATOM 0 HE1 HIS A 8 4.360 10.031 25.484 1.00 0.00 H new ATOM 0 HE2 HIS A 8 5.040 8.351 23.698 1.00 0.00 H new ATOM 83 N PHE A 9 -1.369 11.823 20.830 1.00 0.00 N ATOM 84 CA PHE A 9 -2.229 12.499 19.866 1.00 0.00 C ATOM 85 C PHE A 9 -3.099 13.547 20.554 1.00 0.00 C ATOM 86 O PHE A 9 -4.041 13.230 21.280 1.00 0.00 O ATOM 87 CB PHE A 9 -3.113 11.484 19.139 1.00 0.00 C ATOM 88 CG PHE A 9 -2.466 10.889 17.921 1.00 0.00 C ATOM 89 CD1 PHE A 9 -2.450 11.581 16.721 1.00 0.00 C ATOM 90 CD2 PHE A 9 -1.874 9.637 17.977 1.00 0.00 C ATOM 91 CE1 PHE A 9 -1.855 11.036 15.598 1.00 0.00 C ATOM 92 CE2 PHE A 9 -1.278 9.088 16.858 1.00 0.00 C ATOM 93 CZ PHE A 9 -1.269 9.788 15.667 1.00 0.00 C ATOM 0 H PHE A 9 -1.813 11.630 21.728 1.00 0.00 H new ATOM 0 HA PHE A 9 -1.592 13.002 19.139 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -3.375 10.682 19.829 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.044 11.969 18.846 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -2.908 12.557 16.662 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -1.879 9.085 18.905 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -1.849 11.586 14.668 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -0.819 8.112 16.914 1.00 0.00 H new ATOM 0 HZ PHE A 9 -0.804 9.360 14.791 1.00 0.00 H new ATOM 103 N PRO A 10 -2.776 14.828 20.322 1.00 0.00 N ATOM 104 CA PRO A 10 -3.514 15.950 20.909 1.00 0.00 C ATOM 105 C PRO A 10 -4.914 16.094 20.321 1.00 0.00 C ATOM 106 O PRO A 10 -5.347 15.270 19.516 1.00 0.00 O ATOM 107 CB PRO A 10 -2.656 17.166 20.552 1.00 0.00 C ATOM 108 CG PRO A 10 -1.911 16.757 19.328 1.00 0.00 C ATOM 109 CD PRO A 10 -1.665 15.280 19.467 1.00 0.00 C ATOM 0 HA PRO A 10 -3.668 15.820 21.980 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.273 18.045 20.365 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -1.975 17.422 21.363 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.488 16.974 18.429 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -0.971 17.303 19.242 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -1.673 14.778 18.499 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.697 15.075 19.924 1.00 0.00 H new ATOM 117 N ALA A 11 -5.616 17.146 20.729 1.00 0.00 N ATOM 118 CA ALA A 11 -6.966 17.399 20.240 1.00 0.00 C ATOM 119 C ALA A 11 -7.014 17.361 18.716 1.00 0.00 C ATOM 120 O ALA A 11 -5.986 17.205 18.057 1.00 0.00 O ATOM 121 CB ALA A 11 -7.470 18.740 20.752 1.00 0.00 C ATOM 0 H ALA A 11 -5.273 17.837 21.397 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.616 16.610 20.618 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -8.479 18.916 20.379 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.482 18.732 21.842 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -6.810 19.534 20.402 1.00 0.00 H new ATOM 127 N ARG A 12 -8.214 17.504 18.163 1.00 0.00 N ATOM 128 CA ARG A 12 -8.396 17.483 16.716 1.00 0.00 C ATOM 129 C ARG A 12 -8.575 18.897 16.171 1.00 0.00 C ATOM 130 O ARG A 12 -9.107 19.774 16.853 1.00 0.00 O ATOM 131 CB ARG A 12 -9.606 16.625 16.345 1.00 0.00 C ATOM 132 CG ARG A 12 -9.402 15.141 16.603 1.00 0.00 C ATOM 133 CD ARG A 12 -9.840 14.754 18.007 1.00 0.00 C ATOM 134 NE ARG A 12 -9.226 13.503 18.446 1.00 0.00 N ATOM 135 CZ ARG A 12 -9.676 12.783 19.467 1.00 0.00 C ATOM 136 NH1 ARG A 12 -10.739 13.187 20.150 1.00 0.00 N ATOM 137 NH2 ARG A 12 -9.064 11.656 19.807 1.00 0.00 N ATOM 0 H ARG A 12 -9.075 17.636 18.695 1.00 0.00 H new ATOM 0 HA ARG A 12 -7.502 17.050 16.268 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -10.472 16.968 16.912 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -9.836 16.774 15.290 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.967 14.563 15.872 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -8.351 14.888 16.466 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -9.576 15.551 18.702 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -10.925 14.654 18.034 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.407 13.164 17.941 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.213 14.052 19.891 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.083 12.632 20.934 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.247 11.342 19.284 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.411 11.104 20.591 1.00 0.00 H new ATOM 151 N VAL A 13 -8.128 19.112 14.938 1.00 0.00 N ATOM 152 CA VAL A 13 -8.239 20.418 14.301 1.00 0.00 C ATOM 153 C VAL A 13 -8.378 20.282 12.789 1.00 0.00 C ATOM 154 O VAL A 13 -7.813 19.372 12.181 1.00 0.00 O ATOM 155 CB VAL A 13 -7.018 21.303 14.616 1.00 0.00 C ATOM 156 CG1 VAL A 13 -7.138 22.647 13.915 1.00 0.00 C ATOM 157 CG2 VAL A 13 -6.868 21.487 16.118 1.00 0.00 C ATOM 0 H VAL A 13 -7.685 18.398 14.360 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.134 20.891 14.704 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.123 20.805 14.243 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -6.267 23.259 14.149 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.193 22.492 12.838 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -8.040 23.155 14.255 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -6.001 22.115 16.323 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.763 21.964 16.517 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.732 20.515 16.592 1.00 0.00 H new ATOM 167 N LYS A 14 -9.132 21.194 12.184 1.00 0.00 N ATOM 168 CA LYS A 14 -9.345 21.179 10.742 1.00 0.00 C ATOM 169 C LYS A 14 -8.685 22.385 10.082 1.00 0.00 C ATOM 170 O LYS A 14 -9.159 23.514 10.215 1.00 0.00 O ATOM 171 CB LYS A 14 -10.842 21.166 10.426 1.00 0.00 C ATOM 172 CG LYS A 14 -11.631 22.223 11.180 1.00 0.00 C ATOM 173 CD LYS A 14 -12.134 21.698 12.514 1.00 0.00 C ATOM 174 CE LYS A 14 -13.456 20.961 12.361 1.00 0.00 C ATOM 175 NZ LYS A 14 -14.542 21.864 11.891 1.00 0.00 N ATOM 0 H LYS A 14 -9.606 21.954 12.671 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.889 20.273 10.342 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.980 21.316 9.355 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.247 20.183 10.665 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.002 23.098 11.346 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.477 22.548 10.574 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.391 21.028 12.946 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.257 22.528 13.210 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.335 20.140 11.654 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.739 20.520 13.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.329 21.844 12.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.177 22.835 11.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.881 21.545 10.961 1.00 0.00 H new ATOM 189 N VAL A 15 -7.590 22.139 9.369 1.00 0.00 N ATOM 190 CA VAL A 15 -6.868 23.206 8.686 1.00 0.00 C ATOM 191 C VAL A 15 -6.256 22.707 7.382 1.00 0.00 C ATOM 192 O VAL A 15 -5.521 21.719 7.368 1.00 0.00 O ATOM 193 CB VAL A 15 -5.752 23.786 9.575 1.00 0.00 C ATOM 194 CG1 VAL A 15 -4.964 24.845 8.819 1.00 0.00 C ATOM 195 CG2 VAL A 15 -6.336 24.359 10.857 1.00 0.00 C ATOM 0 H VAL A 15 -7.184 21.211 9.250 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.593 23.990 8.467 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.069 22.980 9.843 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.180 25.244 9.463 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.514 24.399 7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.633 25.652 8.520 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.533 24.764 11.473 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.042 25.153 10.612 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.852 23.571 11.406 1.00 0.00 H new ATOM 205 N GLU A 16 -6.563 23.397 6.288 1.00 0.00 N ATOM 206 CA GLU A 16 -6.043 23.023 4.978 1.00 0.00 C ATOM 207 C GLU A 16 -4.624 22.473 5.093 1.00 0.00 C ATOM 208 O GLU A 16 -3.820 22.924 5.910 1.00 0.00 O ATOM 209 CB GLU A 16 -6.060 24.227 4.035 1.00 0.00 C ATOM 210 CG GLU A 16 -4.982 25.254 4.340 1.00 0.00 C ATOM 211 CD GLU A 16 -5.232 26.583 3.654 1.00 0.00 C ATOM 212 OE1 GLU A 16 -5.011 26.670 2.429 1.00 0.00 O ATOM 213 OE2 GLU A 16 -5.650 27.537 4.345 1.00 0.00 O ATOM 0 H GLU A 16 -7.169 24.218 6.283 1.00 0.00 H new ATOM 0 HA GLU A 16 -6.685 22.242 4.570 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.937 23.877 3.010 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -7.036 24.709 4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.928 25.410 5.417 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -4.014 24.864 4.026 1.00 0.00 H new ATOM 220 N PRO A 17 -4.308 21.473 4.257 1.00 0.00 N ATOM 221 CA PRO A 17 -2.986 20.839 4.244 1.00 0.00 C ATOM 222 C PRO A 17 -1.903 21.767 3.702 1.00 0.00 C ATOM 223 O PRO A 17 -2.201 22.804 3.111 1.00 0.00 O ATOM 224 CB PRO A 17 -3.177 19.639 3.314 1.00 0.00 C ATOM 225 CG PRO A 17 -4.307 20.026 2.423 1.00 0.00 C ATOM 226 CD PRO A 17 -5.216 20.885 3.258 1.00 0.00 C ATOM 0 HA PRO A 17 -2.653 20.570 5.246 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.273 19.435 2.741 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.409 18.735 3.877 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.947 20.571 1.551 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.832 19.145 2.054 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.705 21.653 2.659 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -6.004 20.297 3.728 1.00 0.00 H new ATOM 234 N ALA A 18 -0.647 21.385 3.908 1.00 0.00 N ATOM 235 CA ALA A 18 0.480 22.182 3.438 1.00 0.00 C ATOM 236 C ALA A 18 1.288 21.424 2.391 1.00 0.00 C ATOM 237 O ALA A 18 2.440 21.762 2.116 1.00 0.00 O ATOM 238 CB ALA A 18 1.368 22.581 4.606 1.00 0.00 C ATOM 0 H ALA A 18 -0.384 20.529 4.397 1.00 0.00 H new ATOM 0 HA ALA A 18 0.086 23.085 2.972 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.205 23.175 4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.790 23.169 5.319 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.747 21.685 5.098 1.00 0.00 H new ATOM 244 N VAL A 19 0.679 20.396 1.808 1.00 0.00 N ATOM 245 CA VAL A 19 1.343 19.590 0.791 1.00 0.00 C ATOM 246 C VAL A 19 0.348 19.098 -0.255 1.00 0.00 C ATOM 247 O VAL A 19 -0.832 18.905 0.038 1.00 0.00 O ATOM 248 CB VAL A 19 2.058 18.377 1.414 1.00 0.00 C ATOM 249 CG1 VAL A 19 1.052 17.441 2.068 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.876 17.643 0.362 1.00 0.00 C ATOM 0 H VAL A 19 -0.274 20.102 2.023 1.00 0.00 H new ATOM 0 HA VAL A 19 2.083 20.231 0.312 1.00 0.00 H new ATOM 0 HB VAL A 19 2.739 18.736 2.186 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.576 16.590 2.503 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.514 17.975 2.852 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.344 17.087 1.319 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.375 16.789 0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.217 17.295 -0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.623 18.319 -0.055 1.00 0.00 H new ATOM 260 N ASP A 20 0.833 18.896 -1.475 1.00 0.00 N ATOM 261 CA ASP A 20 -0.012 18.425 -2.566 1.00 0.00 C ATOM 262 C ASP A 20 -0.257 16.923 -2.453 1.00 0.00 C ATOM 263 O ASP A 20 -1.402 16.472 -2.398 1.00 0.00 O ATOM 264 CB ASP A 20 0.631 18.749 -3.915 1.00 0.00 C ATOM 265 CG ASP A 20 0.629 20.235 -4.215 1.00 0.00 C ATOM 266 OD1 ASP A 20 1.389 20.974 -3.555 1.00 0.00 O ATOM 267 OD2 ASP A 20 -0.131 20.658 -5.110 1.00 0.00 O ATOM 0 H ASP A 20 1.807 19.051 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.971 18.938 -2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.657 18.381 -3.923 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.097 18.221 -4.705 1.00 0.00 H new ATOM 272 N THR A 21 0.825 16.152 -2.420 1.00 0.00 N ATOM 273 CA THR A 21 0.728 14.702 -2.316 1.00 0.00 C ATOM 274 C THR A 21 -0.518 14.182 -3.025 1.00 0.00 C ATOM 275 O THR A 21 -1.220 13.313 -2.508 1.00 0.00 O ATOM 276 CB THR A 21 0.697 14.245 -0.846 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.253 15.025 -0.110 1.00 0.00 O ATOM 278 CG2 THR A 21 2.072 14.378 -0.208 1.00 0.00 C ATOM 0 H THR A 21 1.780 16.508 -2.464 1.00 0.00 H new ATOM 0 HA THR A 21 1.615 14.291 -2.798 1.00 0.00 H new ATOM 0 HB THR A 21 0.402 13.196 -0.821 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.268 14.727 0.823 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.025 14.049 0.830 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.787 13.761 -0.752 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.391 15.420 -0.245 1.00 0.00 H new ATOM 286 N SER A 22 -0.786 14.719 -4.211 1.00 0.00 N ATOM 287 CA SER A 22 -1.949 14.311 -4.989 1.00 0.00 C ATOM 288 C SER A 22 -1.524 13.576 -6.257 1.00 0.00 C ATOM 289 O SER A 22 -2.344 12.947 -6.927 1.00 0.00 O ATOM 290 CB SER A 22 -2.798 15.530 -5.354 1.00 0.00 C ATOM 291 OG SER A 22 -3.797 15.767 -4.377 1.00 0.00 O ATOM 0 H SER A 22 -0.213 15.438 -4.654 1.00 0.00 H new ATOM 0 HA SER A 22 -2.544 13.632 -4.378 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.159 16.408 -5.445 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.266 15.374 -6.326 1.00 0.00 H new ATOM 0 HG SER A 22 -3.375 16.050 -3.539 1.00 0.00 H new ATOM 297 N ARG A 23 -0.238 13.660 -6.579 1.00 0.00 N ATOM 298 CA ARG A 23 0.297 13.004 -7.766 1.00 0.00 C ATOM 299 C ARG A 23 1.303 11.922 -7.383 1.00 0.00 C ATOM 300 O ARG A 23 2.219 11.615 -8.145 1.00 0.00 O ATOM 301 CB ARG A 23 0.962 14.030 -8.685 1.00 0.00 C ATOM 302 CG ARG A 23 0.082 15.230 -8.996 1.00 0.00 C ATOM 303 CD ARG A 23 0.280 16.344 -7.981 1.00 0.00 C ATOM 304 NE ARG A 23 -0.140 17.641 -8.503 1.00 0.00 N ATOM 305 CZ ARG A 23 0.327 18.801 -8.052 1.00 0.00 C ATOM 306 NH1 ARG A 23 1.224 18.824 -7.076 1.00 0.00 N ATOM 307 NH2 ARG A 23 -0.104 19.940 -8.579 1.00 0.00 N ATOM 0 H ARG A 23 0.453 14.176 -6.035 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.532 12.534 -8.295 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.885 14.377 -8.220 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.240 13.542 -9.619 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.311 15.601 -9.995 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.964 14.924 -9.002 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.286 16.116 -7.078 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.331 16.391 -7.695 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.829 17.658 -9.255 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.558 17.950 -6.669 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.581 19.716 -6.732 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -0.794 19.926 -9.330 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.254 20.830 -8.233 1.00 0.00 H new ATOM 321 N ILE A 24 1.124 11.348 -6.198 1.00 0.00 N ATOM 322 CA ILE A 24 2.015 10.301 -5.714 1.00 0.00 C ATOM 323 C ILE A 24 1.636 8.944 -6.299 1.00 0.00 C ATOM 324 O ILE A 24 0.509 8.477 -6.134 1.00 0.00 O ATOM 325 CB ILE A 24 1.994 10.209 -4.177 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.684 11.428 -3.562 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.664 8.924 -3.714 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.806 11.357 -2.056 1.00 0.00 C ATOM 0 H ILE A 24 0.370 11.590 -5.555 1.00 0.00 H new ATOM 0 HA ILE A 24 3.021 10.567 -6.039 1.00 0.00 H new ATOM 0 HB ILE A 24 0.957 10.195 -3.843 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.679 11.529 -3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.127 12.325 -3.831 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.641 8.874 -2.625 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.133 8.067 -4.128 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.699 8.909 -4.056 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.305 12.254 -1.689 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.812 11.287 -1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.389 10.479 -1.779 1.00 0.00 H new ATOM 340 N LYS A 25 2.586 8.314 -6.982 1.00 0.00 N ATOM 341 CA LYS A 25 2.355 7.009 -7.590 1.00 0.00 C ATOM 342 C LYS A 25 3.214 5.939 -6.924 1.00 0.00 C ATOM 343 O LYS A 25 4.384 6.170 -6.619 1.00 0.00 O ATOM 344 CB LYS A 25 2.657 7.061 -9.089 1.00 0.00 C ATOM 345 CG LYS A 25 1.454 7.432 -9.939 1.00 0.00 C ATOM 346 CD LYS A 25 1.842 7.635 -11.394 1.00 0.00 C ATOM 347 CE LYS A 25 0.616 7.727 -12.290 1.00 0.00 C ATOM 348 NZ LYS A 25 0.906 7.266 -13.676 1.00 0.00 N ATOM 0 H LYS A 25 3.524 8.687 -7.128 1.00 0.00 H new ATOM 0 HA LYS A 25 1.306 6.749 -7.446 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.453 7.784 -9.266 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.032 6.089 -9.410 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.701 6.647 -9.868 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.001 8.344 -9.551 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.434 8.545 -11.490 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.473 6.809 -11.722 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.188 7.125 -11.868 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.262 8.758 -12.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.046 7.344 -14.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 1.656 7.857 -14.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.219 6.275 -13.654 1.00 0.00 H new ATOM 362 N VAL A 26 2.626 4.768 -6.701 1.00 0.00 N ATOM 363 CA VAL A 26 3.339 3.662 -6.074 1.00 0.00 C ATOM 364 C VAL A 26 3.300 2.415 -6.951 1.00 0.00 C ATOM 365 O VAL A 26 2.237 1.999 -7.411 1.00 0.00 O ATOM 366 CB VAL A 26 2.746 3.323 -4.693 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.930 4.487 -3.732 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.275 2.954 -4.822 1.00 0.00 C ATOM 0 H VAL A 26 1.658 4.561 -6.945 1.00 0.00 H new ATOM 0 HA VAL A 26 4.373 3.983 -5.949 1.00 0.00 H new ATOM 0 HB VAL A 26 3.279 2.463 -4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.505 4.229 -2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.993 4.700 -3.617 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.424 5.368 -4.127 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.872 2.717 -3.837 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.725 3.794 -5.247 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.173 2.086 -5.474 1.00 0.00 H new ATOM 378 N PHE A 27 4.468 1.823 -7.179 1.00 0.00 N ATOM 379 CA PHE A 27 4.569 0.624 -8.002 1.00 0.00 C ATOM 380 C PHE A 27 5.395 -0.450 -7.300 1.00 0.00 C ATOM 381 O PHE A 27 6.378 -0.149 -6.624 1.00 0.00 O ATOM 382 CB PHE A 27 5.195 0.960 -9.357 1.00 0.00 C ATOM 383 CG PHE A 27 6.410 1.838 -9.255 1.00 0.00 C ATOM 384 CD1 PHE A 27 6.288 3.218 -9.279 1.00 0.00 C ATOM 385 CD2 PHE A 27 7.673 1.283 -9.135 1.00 0.00 C ATOM 386 CE1 PHE A 27 7.403 4.028 -9.185 1.00 0.00 C ATOM 387 CE2 PHE A 27 8.792 2.088 -9.040 1.00 0.00 C ATOM 388 CZ PHE A 27 8.657 3.462 -9.066 1.00 0.00 C ATOM 0 H PHE A 27 5.357 2.154 -6.805 1.00 0.00 H new ATOM 0 HA PHE A 27 3.562 0.238 -8.161 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.468 0.033 -9.862 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.450 1.455 -9.980 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.310 3.666 -9.372 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.785 0.209 -9.115 1.00 0.00 H new ATOM 0 HE1 PHE A 27 7.294 5.102 -9.205 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.771 1.643 -8.945 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.531 4.093 -8.993 1.00 0.00 H new ATOM 398 N GLY A 28 4.987 -1.705 -7.465 1.00 0.00 N ATOM 399 CA GLY A 28 5.700 -2.804 -6.841 1.00 0.00 C ATOM 400 C GLY A 28 4.765 -3.872 -6.307 1.00 0.00 C ATOM 401 O GLY A 28 3.555 -3.671 -6.202 1.00 0.00 O ATOM 0 H GLY A 28 4.176 -1.980 -8.019 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.380 -3.250 -7.566 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.312 -2.420 -6.025 1.00 0.00 H new ATOM 405 N PRO A 29 5.329 -5.038 -5.960 1.00 0.00 N ATOM 406 CA PRO A 29 4.556 -6.164 -5.429 1.00 0.00 C ATOM 407 C PRO A 29 4.024 -5.892 -4.026 1.00 0.00 C ATOM 408 O PRO A 29 2.901 -6.270 -3.693 1.00 0.00 O ATOM 409 CB PRO A 29 5.571 -7.310 -5.402 1.00 0.00 C ATOM 410 CG PRO A 29 6.897 -6.639 -5.302 1.00 0.00 C ATOM 411 CD PRO A 29 6.766 -5.346 -6.058 1.00 0.00 C ATOM 0 HA PRO A 29 3.673 -6.372 -6.033 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.398 -7.973 -4.554 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.503 -7.920 -6.303 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.164 -6.457 -4.261 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.683 -7.262 -5.729 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.377 -4.559 -5.616 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.084 -5.453 -7.095 1.00 0.00 H new ATOM 419 N GLY A 30 4.837 -5.233 -3.206 1.00 0.00 N ATOM 420 CA GLY A 30 4.430 -4.921 -1.849 1.00 0.00 C ATOM 421 C GLY A 30 3.121 -4.158 -1.797 1.00 0.00 C ATOM 422 O GLY A 30 2.430 -4.166 -0.778 1.00 0.00 O ATOM 0 H GLY A 30 5.771 -4.910 -3.458 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.331 -5.846 -1.281 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.210 -4.332 -1.365 1.00 0.00 H new ATOM 426 N ILE A 31 2.781 -3.495 -2.897 1.00 0.00 N ATOM 427 CA ILE A 31 1.547 -2.723 -2.972 1.00 0.00 C ATOM 428 C ILE A 31 0.558 -3.359 -3.944 1.00 0.00 C ATOM 429 O ILE A 31 -0.651 -3.167 -3.827 1.00 0.00 O ATOM 430 CB ILE A 31 1.817 -1.271 -3.410 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.544 -0.432 -3.282 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.338 -1.237 -4.839 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.107 -0.213 -1.850 1.00 0.00 C ATOM 0 H ILE A 31 3.343 -3.477 -3.748 1.00 0.00 H new ATOM 0 HA ILE A 31 1.117 -2.718 -1.970 1.00 0.00 H new ATOM 0 HB ILE A 31 2.578 -0.845 -2.756 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.707 0.536 -3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.262 -0.923 -3.828 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.524 -0.204 -5.134 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.266 -1.805 -4.901 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.598 -1.677 -5.507 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.801 0.389 -1.835 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.088 -1.176 -1.378 1.00 0.00 H new ATOM 0 HD13 ILE A 31 0.895 0.305 -1.304 1.00 0.00 H new ATOM 445 N GLU A 32 1.083 -4.119 -4.900 1.00 0.00 N ATOM 446 CA GLU A 32 0.245 -4.785 -5.891 1.00 0.00 C ATOM 447 C GLU A 32 -0.306 -6.098 -5.343 1.00 0.00 C ATOM 448 O GLU A 32 -1.508 -6.352 -5.402 1.00 0.00 O ATOM 449 CB GLU A 32 1.042 -5.048 -7.171 1.00 0.00 C ATOM 450 CG GLU A 32 1.415 -3.783 -7.926 1.00 0.00 C ATOM 451 CD GLU A 32 0.338 -3.347 -8.900 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.857 -3.489 -8.568 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.691 -2.863 -9.996 1.00 0.00 O ATOM 0 H GLU A 32 2.083 -4.289 -5.009 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.593 -4.128 -6.122 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.952 -5.591 -6.917 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.458 -5.694 -7.827 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.601 -2.980 -7.213 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.345 -3.949 -8.469 1.00 0.00 H new ATOM 460 N GLY A 33 0.584 -6.931 -4.810 1.00 0.00 N ATOM 461 CA GLY A 33 0.168 -8.208 -4.260 1.00 0.00 C ATOM 462 C GLY A 33 0.681 -9.382 -5.070 1.00 0.00 C ATOM 463 O GLY A 33 0.028 -10.423 -5.150 1.00 0.00 O ATOM 0 H GLY A 33 1.585 -6.744 -4.750 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.528 -8.293 -3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.921 -8.246 -4.220 1.00 0.00 H new ATOM 467 N LYS A 34 1.853 -9.216 -5.673 1.00 0.00 N ATOM 468 CA LYS A 34 2.454 -10.270 -6.482 1.00 0.00 C ATOM 469 C LYS A 34 3.293 -11.207 -5.618 1.00 0.00 C ATOM 470 O LYS A 34 2.926 -12.362 -5.404 1.00 0.00 O ATOM 471 CB LYS A 34 3.323 -9.661 -7.585 1.00 0.00 C ATOM 472 CG LYS A 34 2.706 -8.437 -8.240 1.00 0.00 C ATOM 473 CD LYS A 34 1.369 -8.763 -8.882 1.00 0.00 C ATOM 474 CE LYS A 34 1.539 -9.225 -10.321 1.00 0.00 C ATOM 475 NZ LYS A 34 2.033 -10.628 -10.399 1.00 0.00 N ATOM 0 H LYS A 34 2.406 -8.361 -5.617 1.00 0.00 H new ATOM 0 HA LYS A 34 1.650 -10.847 -6.938 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.291 -9.388 -7.164 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.509 -10.417 -8.348 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.571 -7.653 -7.495 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.387 -8.045 -8.995 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.868 -9.541 -8.306 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.727 -7.883 -8.855 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.585 -9.146 -10.843 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.238 -8.565 -10.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.647 -11.085 -11.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.072 -10.628 -10.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.725 -11.152 -9.555 1.00 0.00 H new ATOM 489 N ASP A 35 4.417 -10.701 -5.125 1.00 0.00 N ATOM 490 CA ASP A 35 5.307 -11.492 -4.282 1.00 0.00 C ATOM 491 C ASP A 35 5.156 -11.101 -2.816 1.00 0.00 C ATOM 492 O ASP A 35 6.138 -11.037 -2.075 1.00 0.00 O ATOM 493 CB ASP A 35 6.759 -11.311 -4.725 1.00 0.00 C ATOM 494 CG ASP A 35 7.737 -12.022 -3.810 1.00 0.00 C ATOM 495 OD1 ASP A 35 7.732 -13.270 -3.791 1.00 0.00 O ATOM 496 OD2 ASP A 35 8.507 -11.329 -3.112 1.00 0.00 O ATOM 0 H ASP A 35 4.734 -9.746 -5.294 1.00 0.00 H new ATOM 0 HA ASP A 35 5.032 -12.541 -4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.876 -11.689 -5.741 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.998 -10.248 -4.751 1.00 0.00 H new ATOM 501 N VAL A 36 3.920 -10.840 -2.402 1.00 0.00 N ATOM 502 CA VAL A 36 3.641 -10.454 -1.024 1.00 0.00 C ATOM 503 C VAL A 36 3.167 -11.649 -0.204 1.00 0.00 C ATOM 504 O VAL A 36 2.576 -11.489 0.864 1.00 0.00 O ATOM 505 CB VAL A 36 2.575 -9.344 -0.956 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.570 -8.691 0.418 1.00 0.00 C ATOM 507 CG2 VAL A 36 2.813 -8.311 -2.046 1.00 0.00 C ATOM 0 H VAL A 36 3.096 -10.889 -3.001 1.00 0.00 H new ATOM 0 HA VAL A 36 4.574 -10.077 -0.606 1.00 0.00 H new ATOM 0 HB VAL A 36 1.596 -9.794 -1.121 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.811 -7.910 0.447 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.347 -9.441 1.177 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.548 -8.254 0.617 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.051 -7.534 -1.984 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.798 -7.864 -1.915 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.760 -8.793 -3.022 1.00 0.00 H new ATOM 517 N PHE A 37 3.431 -12.849 -0.711 1.00 0.00 N ATOM 518 CA PHE A 37 3.031 -14.073 -0.027 1.00 0.00 C ATOM 519 C PHE A 37 3.475 -14.050 1.433 1.00 0.00 C ATOM 520 O PHE A 37 4.385 -13.308 1.804 1.00 0.00 O ATOM 521 CB PHE A 37 3.624 -15.295 -0.732 1.00 0.00 C ATOM 522 CG PHE A 37 3.624 -15.180 -2.230 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.441 -15.275 -2.945 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.807 -14.979 -2.922 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.437 -15.170 -4.323 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.809 -14.872 -4.300 1.00 0.00 C ATOM 527 CZ PHE A 37 3.623 -14.969 -5.002 1.00 0.00 C ATOM 0 H PHE A 37 3.920 -13.000 -1.593 1.00 0.00 H new ATOM 0 HA PHE A 37 1.943 -14.137 -0.058 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.647 -15.443 -0.387 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.059 -16.181 -0.443 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.511 -15.433 -2.419 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.738 -14.905 -2.379 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.508 -15.245 -4.868 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.738 -14.713 -4.828 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.623 -14.888 -6.079 1.00 0.00 H new ATOM 537 N ARG A 38 2.825 -14.866 2.256 1.00 0.00 N ATOM 538 CA ARG A 38 3.151 -14.939 3.675 1.00 0.00 C ATOM 539 C ARG A 38 4.616 -15.314 3.878 1.00 0.00 C ATOM 540 O ARG A 38 5.156 -16.154 3.160 1.00 0.00 O ATOM 541 CB ARG A 38 2.250 -15.958 4.376 1.00 0.00 C ATOM 542 CG ARG A 38 2.048 -15.676 5.856 1.00 0.00 C ATOM 543 CD ARG A 38 1.199 -16.751 6.516 1.00 0.00 C ATOM 544 NE ARG A 38 1.526 -16.914 7.930 1.00 0.00 N ATOM 545 CZ ARG A 38 2.523 -17.673 8.371 1.00 0.00 C ATOM 546 NH1 ARG A 38 3.286 -18.335 7.513 1.00 0.00 N ATOM 547 NH2 ARG A 38 2.757 -17.771 9.674 1.00 0.00 N ATOM 0 H ARG A 38 2.069 -15.486 1.964 1.00 0.00 H new ATOM 0 HA ARG A 38 2.982 -13.955 4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.279 -15.972 3.882 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.681 -16.952 4.260 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.017 -15.620 6.353 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.569 -14.705 5.981 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.145 -16.493 6.415 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.347 -17.699 5.998 1.00 0.00 H new ATOM 0 HE ARG A 38 0.958 -16.418 8.617 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.108 -18.262 6.511 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.051 -18.917 7.854 1.00 0.00 H new ATOM 0 HH21 ARG A 38 2.171 -17.263 10.337 1.00 0.00 H new ATOM 0 HH22 ARG A 38 3.523 -18.354 10.012 1.00 0.00 H new ATOM 561 N GLU A 39 5.252 -14.685 4.862 1.00 0.00 N ATOM 562 CA GLU A 39 6.654 -14.952 5.158 1.00 0.00 C ATOM 563 C GLU A 39 7.535 -14.632 3.954 1.00 0.00 C ATOM 564 O GLU A 39 8.552 -15.285 3.724 1.00 0.00 O ATOM 565 CB GLU A 39 6.842 -16.415 5.566 1.00 0.00 C ATOM 566 CG GLU A 39 6.336 -16.727 6.964 1.00 0.00 C ATOM 567 CD GLU A 39 6.753 -18.104 7.442 1.00 0.00 C ATOM 568 OE1 GLU A 39 7.960 -18.415 7.372 1.00 0.00 O ATOM 569 OE2 GLU A 39 5.873 -18.870 7.886 1.00 0.00 O ATOM 0 H GLU A 39 4.818 -13.988 5.467 1.00 0.00 H new ATOM 0 HA GLU A 39 6.953 -14.309 5.986 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.323 -17.053 4.850 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.901 -16.666 5.508 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.713 -15.976 7.659 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.248 -16.656 6.977 1.00 0.00 H new ATOM 576 N ALA A 40 7.136 -13.621 3.188 1.00 0.00 N ATOM 577 CA ALA A 40 7.888 -13.212 2.009 1.00 0.00 C ATOM 578 C ALA A 40 8.323 -11.754 2.113 1.00 0.00 C ATOM 579 O ALA A 40 7.549 -10.893 2.534 1.00 0.00 O ATOM 580 CB ALA A 40 7.059 -13.429 0.752 1.00 0.00 C ATOM 0 H ALA A 40 6.296 -13.070 3.364 1.00 0.00 H new ATOM 0 HA ALA A 40 8.785 -13.828 1.950 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.634 -13.119 -0.121 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.804 -14.485 0.662 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.145 -12.839 0.813 1.00 0.00 H new ATOM 586 N THR A 41 9.566 -11.483 1.728 1.00 0.00 N ATOM 587 CA THR A 41 10.104 -10.130 1.781 1.00 0.00 C ATOM 588 C THR A 41 9.666 -9.317 0.568 1.00 0.00 C ATOM 589 O THR A 41 10.247 -9.431 -0.512 1.00 0.00 O ATOM 590 CB THR A 41 11.643 -10.139 1.850 1.00 0.00 C ATOM 591 OG1 THR A 41 12.081 -11.003 2.904 1.00 0.00 O ATOM 592 CG2 THR A 41 12.183 -8.736 2.080 1.00 0.00 C ATOM 0 H THR A 41 10.219 -12.183 1.376 1.00 0.00 H new ATOM 0 HA THR A 41 9.710 -9.669 2.687 1.00 0.00 H new ATOM 0 HB THR A 41 12.025 -10.506 0.897 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.060 -11.004 2.940 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.272 -8.768 2.125 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.873 -8.088 1.260 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.792 -8.345 3.020 1.00 0.00 H new ATOM 600 N THR A 42 8.638 -8.494 0.752 1.00 0.00 N ATOM 601 CA THR A 42 8.122 -7.662 -0.328 1.00 0.00 C ATOM 602 C THR A 42 8.216 -6.182 0.026 1.00 0.00 C ATOM 603 O THR A 42 8.088 -5.804 1.190 1.00 0.00 O ATOM 604 CB THR A 42 6.657 -8.009 -0.653 1.00 0.00 C ATOM 605 OG1 THR A 42 6.199 -7.216 -1.754 1.00 0.00 O ATOM 606 CG2 THR A 42 5.764 -7.774 0.555 1.00 0.00 C ATOM 0 H THR A 42 8.146 -8.386 1.639 1.00 0.00 H new ATOM 0 HA THR A 42 8.738 -7.863 -1.205 1.00 0.00 H new ATOM 0 HB THR A 42 6.607 -9.064 -0.921 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.233 -7.748 -2.577 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.734 -8.026 0.301 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.098 -8.401 1.382 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.819 -6.726 0.850 1.00 0.00 H new ATOM 614 N ASP A 43 8.437 -5.350 -0.985 1.00 0.00 N ATOM 615 CA ASP A 43 8.546 -3.910 -0.781 1.00 0.00 C ATOM 616 C ASP A 43 8.087 -3.149 -2.021 1.00 0.00 C ATOM 617 O ASP A 43 8.184 -3.651 -3.141 1.00 0.00 O ATOM 618 CB ASP A 43 9.987 -3.529 -0.439 1.00 0.00 C ATOM 619 CG ASP A 43 10.933 -3.733 -1.606 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.542 -3.417 -2.749 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.064 -4.209 -1.376 1.00 0.00 O ATOM 0 H ASP A 43 8.544 -5.648 -1.955 1.00 0.00 H new ATOM 0 HA ASP A 43 7.898 -3.636 0.052 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.019 -2.485 -0.127 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.326 -4.125 0.408 1.00 0.00 H new ATOM 626 N PHE A 44 7.584 -1.937 -1.812 1.00 0.00 N ATOM 627 CA PHE A 44 7.108 -1.107 -2.913 1.00 0.00 C ATOM 628 C PHE A 44 7.965 0.146 -3.060 1.00 0.00 C ATOM 629 O PHE A 44 8.843 0.413 -2.239 1.00 0.00 O ATOM 630 CB PHE A 44 5.646 -0.715 -2.687 1.00 0.00 C ATOM 631 CG PHE A 44 5.410 -0.004 -1.385 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.109 -0.717 -0.236 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.490 1.377 -1.311 1.00 0.00 C ATOM 634 CE1 PHE A 44 4.891 -0.065 0.963 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.273 2.035 -0.114 1.00 0.00 C ATOM 636 CZ PHE A 44 4.974 1.312 1.024 1.00 0.00 C ATOM 0 H PHE A 44 7.495 -1.508 -0.891 1.00 0.00 H new ATOM 0 HA PHE A 44 7.184 -1.687 -3.833 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.319 -0.074 -3.506 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.028 -1.613 -2.719 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.044 -1.794 -0.278 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.725 1.946 -2.198 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.656 -0.632 1.852 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.337 3.112 -0.069 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.805 1.823 1.960 1.00 0.00 H new ATOM 646 N THR A 45 7.706 0.913 -4.115 1.00 0.00 N ATOM 647 CA THR A 45 8.454 2.137 -4.373 1.00 0.00 C ATOM 648 C THR A 45 7.520 3.333 -4.516 1.00 0.00 C ATOM 649 O THR A 45 6.568 3.300 -5.297 1.00 0.00 O ATOM 650 CB THR A 45 9.311 2.014 -5.647 1.00 0.00 C ATOM 651 OG1 THR A 45 10.173 0.874 -5.550 1.00 0.00 O ATOM 652 CG2 THR A 45 10.143 3.269 -5.863 1.00 0.00 C ATOM 0 H THR A 45 6.983 0.708 -4.805 1.00 0.00 H new ATOM 0 HA THR A 45 9.110 2.292 -3.516 1.00 0.00 H new ATOM 0 HB THR A 45 8.641 1.891 -6.498 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.713 0.802 -6.364 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.740 3.159 -6.768 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.483 4.130 -5.966 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.804 3.419 -5.009 1.00 0.00 H new ATOM 660 N VAL A 46 7.797 4.389 -3.758 1.00 0.00 N ATOM 661 CA VAL A 46 6.982 5.596 -3.801 1.00 0.00 C ATOM 662 C VAL A 46 7.712 6.726 -4.519 1.00 0.00 C ATOM 663 O VAL A 46 8.741 7.212 -4.048 1.00 0.00 O ATOM 664 CB VAL A 46 6.597 6.066 -2.386 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.759 7.333 -2.452 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.856 4.964 -1.643 1.00 0.00 C ATOM 0 H VAL A 46 8.580 4.433 -3.106 1.00 0.00 H new ATOM 0 HA VAL A 46 6.075 5.345 -4.351 1.00 0.00 H new ATOM 0 HB VAL A 46 7.511 6.293 -1.837 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.497 7.649 -1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.330 8.122 -2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.849 7.138 -3.019 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.591 5.313 -0.645 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.949 4.703 -2.189 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.496 4.085 -1.563 1.00 0.00 H new ATOM 676 N ASP A 47 7.173 7.141 -5.660 1.00 0.00 N ATOM 677 CA ASP A 47 7.772 8.216 -6.442 1.00 0.00 C ATOM 678 C ASP A 47 7.167 9.564 -6.066 1.00 0.00 C ATOM 679 O ASP A 47 5.948 9.736 -6.086 1.00 0.00 O ATOM 680 CB ASP A 47 7.580 7.955 -7.937 1.00 0.00 C ATOM 681 CG ASP A 47 8.700 8.540 -8.776 1.00 0.00 C ATOM 682 OD1 ASP A 47 9.763 7.893 -8.879 1.00 0.00 O ATOM 683 OD2 ASP A 47 8.513 9.643 -9.329 1.00 0.00 O ATOM 0 H ASP A 47 6.322 6.749 -6.064 1.00 0.00 H new ATOM 0 HA ASP A 47 8.839 8.243 -6.220 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.523 6.880 -8.111 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.629 8.381 -8.258 1.00 0.00 H new ATOM 688 N SER A 48 8.027 10.518 -5.723 1.00 0.00 N ATOM 689 CA SER A 48 7.577 11.850 -5.337 1.00 0.00 C ATOM 690 C SER A 48 8.399 12.926 -6.040 1.00 0.00 C ATOM 691 O SER A 48 9.628 12.860 -6.075 1.00 0.00 O ATOM 692 CB SER A 48 7.676 12.026 -3.821 1.00 0.00 C ATOM 693 OG SER A 48 7.074 10.939 -3.140 1.00 0.00 O ATOM 0 H SER A 48 9.039 10.393 -5.705 1.00 0.00 H new ATOM 0 HA SER A 48 6.536 11.956 -5.640 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.723 12.107 -3.529 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.190 12.957 -3.528 1.00 0.00 H new ATOM 0 HG SER A 48 7.152 11.075 -2.173 1.00 0.00 H new ATOM 699 N ARG A 49 7.711 13.916 -6.599 1.00 0.00 N ATOM 700 CA ARG A 49 8.376 15.006 -7.303 1.00 0.00 C ATOM 701 C ARG A 49 8.183 16.328 -6.565 1.00 0.00 C ATOM 702 O ARG A 49 9.109 16.871 -5.962 1.00 0.00 O ATOM 703 CB ARG A 49 7.837 15.124 -8.730 1.00 0.00 C ATOM 704 CG ARG A 49 8.682 14.395 -9.762 1.00 0.00 C ATOM 705 CD ARG A 49 8.222 12.957 -9.944 1.00 0.00 C ATOM 706 NE ARG A 49 7.193 12.838 -10.973 1.00 0.00 N ATOM 707 CZ ARG A 49 6.350 11.815 -11.054 1.00 0.00 C ATOM 708 NH1 ARG A 49 6.412 10.828 -10.170 1.00 0.00 N ATOM 709 NH2 ARG A 49 5.440 11.777 -12.019 1.00 0.00 N ATOM 0 H ARG A 49 6.694 13.986 -6.578 1.00 0.00 H new ATOM 0 HA ARG A 49 9.442 14.783 -7.341 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.822 14.729 -8.760 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.777 16.178 -9.001 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.626 14.920 -10.716 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.727 14.407 -9.452 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.076 12.334 -10.211 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.835 12.578 -8.998 1.00 0.00 H new ATOM 0 HE ARG A 49 7.117 13.581 -11.668 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.109 10.853 -9.425 1.00 0.00 H new ATOM 0 HH12 ARG A 49 5.763 10.044 -10.235 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.387 12.534 -12.700 1.00 0.00 H new ATOM 0 HH22 ARG A 49 4.793 10.990 -12.080 1.00 0.00 H new ATOM 723 N PRO A 50 6.952 16.859 -6.612 1.00 0.00 N ATOM 724 CA PRO A 50 6.609 18.122 -5.953 1.00 0.00 C ATOM 725 C PRO A 50 6.605 18.001 -4.433 1.00 0.00 C ATOM 726 O PRO A 50 6.198 18.925 -3.728 1.00 0.00 O ATOM 727 CB PRO A 50 5.200 18.420 -6.470 1.00 0.00 C ATOM 728 CG PRO A 50 4.638 17.088 -6.829 1.00 0.00 C ATOM 729 CD PRO A 50 5.801 16.265 -7.312 1.00 0.00 C ATOM 0 HA PRO A 50 7.333 18.906 -6.173 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.595 18.913 -5.709 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.228 19.084 -7.334 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.160 16.621 -5.968 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.877 17.181 -7.604 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.679 15.211 -7.062 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.914 16.325 -8.394 1.00 0.00 H new ATOM 737 N LEU A 51 7.060 16.857 -3.934 1.00 0.00 N ATOM 738 CA LEU A 51 7.109 16.615 -2.497 1.00 0.00 C ATOM 739 C LEU A 51 8.551 16.569 -2.001 1.00 0.00 C ATOM 740 O LEU A 51 8.916 17.262 -1.051 1.00 0.00 O ATOM 741 CB LEU A 51 6.398 15.304 -2.155 1.00 0.00 C ATOM 742 CG LEU A 51 5.161 14.975 -2.991 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.458 13.743 -2.442 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.210 16.162 -3.028 1.00 0.00 C ATOM 0 H LEU A 51 7.400 16.082 -4.504 1.00 0.00 H new ATOM 0 HA LEU A 51 6.598 17.439 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.112 14.488 -2.262 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.105 15.336 -1.106 1.00 0.00 H new ATOM 0 HG LEU A 51 5.482 14.761 -4.010 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.580 13.524 -3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.139 12.893 -2.469 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.150 13.928 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.336 15.909 -3.628 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.896 16.408 -2.014 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.716 17.020 -3.469 1.00 0.00 H new ATOM 756 N THR A 52 9.369 15.748 -2.653 1.00 0.00 N ATOM 757 CA THR A 52 10.772 15.612 -2.280 1.00 0.00 C ATOM 758 C THR A 52 11.671 15.622 -3.511 1.00 0.00 C ATOM 759 O THR A 52 11.198 15.482 -4.638 1.00 0.00 O ATOM 760 CB THR A 52 11.019 14.314 -1.489 1.00 0.00 C ATOM 761 OG1 THR A 52 12.325 14.339 -0.901 1.00 0.00 O ATOM 762 CG2 THR A 52 10.887 13.096 -2.391 1.00 0.00 C ATOM 0 H THR A 52 9.084 15.167 -3.442 1.00 0.00 H new ATOM 0 HA THR A 52 11.016 16.466 -1.648 1.00 0.00 H new ATOM 0 HB THR A 52 10.268 14.246 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.246 14.272 0.074 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.066 12.192 -1.810 1.00 0.00 H new ATOM 0 HG22 THR A 52 9.883 13.063 -2.813 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.618 13.159 -3.197 1.00 0.00 H new ATOM 770 N GLN A 53 12.971 15.789 -3.286 1.00 0.00 N ATOM 771 CA GLN A 53 13.937 15.817 -4.378 1.00 0.00 C ATOM 772 C GLN A 53 15.127 14.913 -4.077 1.00 0.00 C ATOM 773 O GLN A 53 15.627 14.213 -4.957 1.00 0.00 O ATOM 774 CB GLN A 53 14.418 17.248 -4.625 1.00 0.00 C ATOM 775 CG GLN A 53 13.291 18.229 -4.907 1.00 0.00 C ATOM 776 CD GLN A 53 12.654 18.010 -6.265 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.273 18.256 -7.301 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.410 17.545 -6.268 1.00 0.00 N ATOM 0 H GLN A 53 13.379 15.907 -2.358 1.00 0.00 H new ATOM 0 HA GLN A 53 13.442 15.447 -5.276 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.977 17.590 -3.754 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.109 17.250 -5.468 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.529 18.134 -4.133 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.677 19.247 -4.851 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.935 17.355 -5.386 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.930 17.378 -7.152 1.00 0.00 H new ATOM 787 N VAL A 54 15.576 14.932 -2.826 1.00 0.00 N ATOM 788 CA VAL A 54 16.707 14.113 -2.407 1.00 0.00 C ATOM 789 C VAL A 54 16.260 12.992 -1.476 1.00 0.00 C ATOM 790 O VAL A 54 16.949 12.658 -0.513 1.00 0.00 O ATOM 791 CB VAL A 54 17.780 14.959 -1.696 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.277 16.070 -2.609 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.232 15.531 -0.397 1.00 0.00 C ATOM 0 H VAL A 54 15.174 15.506 -2.085 1.00 0.00 H new ATOM 0 HA VAL A 54 17.136 13.681 -3.311 1.00 0.00 H new ATOM 0 HB VAL A 54 18.625 14.314 -1.455 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.034 16.657 -2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.710 15.635 -3.509 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.443 16.716 -2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.003 16.126 0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.369 16.161 -0.612 1.00 0.00 H new ATOM 0 HG23 VAL A 54 16.930 14.716 0.261 1.00 0.00 H new ATOM 803 N GLY A 55 15.099 12.414 -1.769 1.00 0.00 N ATOM 804 CA GLY A 55 14.579 11.336 -0.949 1.00 0.00 C ATOM 805 C GLY A 55 13.625 11.830 0.121 1.00 0.00 C ATOM 806 O GLY A 55 12.421 11.932 -0.109 1.00 0.00 O ATOM 0 H GLY A 55 14.509 12.673 -2.560 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.065 10.615 -1.585 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.409 10.810 -0.477 1.00 0.00 H new ATOM 810 N GLY A 56 14.165 12.137 1.297 1.00 0.00 N ATOM 811 CA GLY A 56 13.340 12.618 2.390 1.00 0.00 C ATOM 812 C GLY A 56 13.167 11.583 3.484 1.00 0.00 C ATOM 813 O GLY A 56 13.396 10.393 3.265 1.00 0.00 O ATOM 0 H GLY A 56 15.159 12.061 1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.789 13.517 2.812 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.361 12.902 2.004 1.00 0.00 H new ATOM 817 N ASP A 57 12.763 12.036 4.666 1.00 0.00 N ATOM 818 CA ASP A 57 12.560 11.141 5.799 1.00 0.00 C ATOM 819 C ASP A 57 11.243 11.448 6.505 1.00 0.00 C ATOM 820 O ASP A 57 11.152 11.377 7.731 1.00 0.00 O ATOM 821 CB ASP A 57 13.722 11.262 6.786 1.00 0.00 C ATOM 822 CG ASP A 57 13.962 9.980 7.559 1.00 0.00 C ATOM 823 OD1 ASP A 57 14.186 8.934 6.916 1.00 0.00 O ATOM 824 OD2 ASP A 57 13.925 10.023 8.806 1.00 0.00 O ATOM 0 H ASP A 57 12.570 13.018 4.864 1.00 0.00 H new ATOM 0 HA ASP A 57 12.519 10.120 5.421 1.00 0.00 H new ATOM 0 HB2 ASP A 57 14.629 11.531 6.244 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.517 12.072 7.486 1.00 0.00 H new ATOM 829 N HIS A 58 10.224 11.790 5.722 1.00 0.00 N ATOM 830 CA HIS A 58 8.911 12.108 6.272 1.00 0.00 C ATOM 831 C HIS A 58 7.861 11.120 5.777 1.00 0.00 C ATOM 832 O HIS A 58 6.687 11.466 5.634 1.00 0.00 O ATOM 833 CB HIS A 58 8.508 13.533 5.892 1.00 0.00 C ATOM 834 CG HIS A 58 8.956 14.566 6.880 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.108 15.143 7.802 1.00 0.00 N ATOM 836 CD2 HIS A 58 10.171 15.125 7.087 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.783 16.013 8.533 1.00 0.00 C ATOM 838 NE2 HIS A 58 10.037 16.021 8.119 1.00 0.00 N ATOM 0 H HIS A 58 10.282 11.854 4.706 1.00 0.00 H new ATOM 0 HA HIS A 58 8.971 12.033 7.358 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.927 13.772 4.914 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.423 13.581 5.795 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.077 14.907 6.542 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.378 16.615 9.333 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.785 16.599 8.503 1.00 0.00 H new ATOM 846 N ILE A 59 8.289 9.890 5.516 1.00 0.00 N ATOM 847 CA ILE A 59 7.385 8.852 5.036 1.00 0.00 C ATOM 848 C ILE A 59 7.077 7.840 6.135 1.00 0.00 C ATOM 849 O ILE A 59 7.931 7.529 6.966 1.00 0.00 O ATOM 850 CB ILE A 59 7.973 8.110 3.822 1.00 0.00 C ATOM 851 CG1 ILE A 59 8.075 9.053 2.621 1.00 0.00 C ATOM 852 CG2 ILE A 59 7.121 6.897 3.479 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.764 9.715 2.259 1.00 0.00 C ATOM 0 H ILE A 59 9.257 9.587 5.629 1.00 0.00 H new ATOM 0 HA ILE A 59 6.464 9.351 4.735 1.00 0.00 H new ATOM 0 HB ILE A 59 8.975 7.765 4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.815 9.824 2.837 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.440 8.493 1.760 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.550 6.383 2.619 1.00 0.00 H new ATOM 0 HG22 ILE A 59 7.095 6.218 4.331 1.00 0.00 H new ATOM 0 HG23 ILE A 59 6.107 7.220 3.241 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.912 10.369 1.399 1.00 0.00 H new ATOM 0 HD12 ILE A 59 6.027 8.951 2.011 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.407 10.303 3.105 1.00 0.00 H new ATOM 865 N LYS A 60 5.851 7.328 6.134 1.00 0.00 N ATOM 866 CA LYS A 60 5.429 6.349 7.128 1.00 0.00 C ATOM 867 C LYS A 60 4.391 5.395 6.546 1.00 0.00 C ATOM 868 O LYS A 60 3.736 5.707 5.552 1.00 0.00 O ATOM 869 CB LYS A 60 4.855 7.056 8.358 1.00 0.00 C ATOM 870 CG LYS A 60 5.036 6.274 9.648 1.00 0.00 C ATOM 871 CD LYS A 60 3.910 6.552 10.631 1.00 0.00 C ATOM 872 CE LYS A 60 3.642 5.350 11.524 1.00 0.00 C ATOM 873 NZ LYS A 60 3.238 4.153 10.737 1.00 0.00 N ATOM 0 H LYS A 60 5.131 7.575 5.455 1.00 0.00 H new ATOM 0 HA LYS A 60 6.303 5.769 7.424 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.333 8.030 8.463 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.792 7.238 8.199 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.072 5.207 9.426 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.991 6.537 10.103 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.167 7.414 11.247 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.003 6.810 10.084 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.538 5.120 12.101 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.857 5.597 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.718 3.494 11.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.627 4.446 9.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.086 3.682 10.362 1.00 0.00 H new ATOM 887 N ALA A 61 4.244 4.233 7.173 1.00 0.00 N ATOM 888 CA ALA A 61 3.283 3.235 6.719 1.00 0.00 C ATOM 889 C ALA A 61 2.789 2.381 7.881 1.00 0.00 C ATOM 890 O ALA A 61 3.492 2.200 8.876 1.00 0.00 O ATOM 891 CB ALA A 61 3.903 2.357 5.642 1.00 0.00 C ATOM 0 H ALA A 61 4.778 3.959 7.997 1.00 0.00 H new ATOM 0 HA ALA A 61 2.425 3.758 6.296 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.174 1.616 5.312 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.201 2.975 4.795 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.779 1.849 6.046 1.00 0.00 H new ATOM 897 N HIS A 62 1.573 1.858 7.750 1.00 0.00 N ATOM 898 CA HIS A 62 0.984 1.022 8.790 1.00 0.00 C ATOM 899 C HIS A 62 0.067 -0.035 8.183 1.00 0.00 C ATOM 900 O HIS A 62 -1.032 0.274 7.722 1.00 0.00 O ATOM 901 CB HIS A 62 0.203 1.882 9.784 1.00 0.00 C ATOM 902 CG HIS A 62 -0.266 1.128 10.990 1.00 0.00 C ATOM 903 ND1 HIS A 62 0.031 1.512 12.280 1.00 0.00 N ATOM 904 CD2 HIS A 62 -1.017 0.007 11.096 1.00 0.00 C ATOM 905 CE1 HIS A 62 -0.515 0.659 13.128 1.00 0.00 C ATOM 906 NE2 HIS A 62 -1.158 -0.264 12.435 1.00 0.00 N ATOM 0 H HIS A 62 0.977 1.999 6.934 1.00 0.00 H new ATOM 0 HA HIS A 62 1.793 0.516 9.317 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.832 2.712 10.107 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.660 2.314 9.278 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -1.429 -0.568 10.279 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.447 0.708 14.205 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -1.675 -1.050 12.830 1.00 0.00 H new ATOM 914 N ILE A 63 0.526 -1.282 8.186 1.00 0.00 N ATOM 915 CA ILE A 63 -0.254 -2.384 7.636 1.00 0.00 C ATOM 916 C ILE A 63 -1.300 -2.869 8.634 1.00 0.00 C ATOM 917 O ILE A 63 -1.083 -2.829 9.844 1.00 0.00 O ATOM 918 CB ILE A 63 0.647 -3.567 7.237 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.640 -3.139 6.154 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.197 -4.738 6.757 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.794 -4.100 5.979 1.00 0.00 C ATOM 0 H ILE A 63 1.434 -1.554 8.563 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.754 -2.003 6.746 1.00 0.00 H new ATOM 0 HB ILE A 63 1.211 -3.886 8.114 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.111 -3.042 5.206 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.033 -2.153 6.402 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.455 -5.566 6.479 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.866 -5.056 7.556 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.785 -4.432 5.892 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.457 -3.733 5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.347 -4.179 6.915 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.411 -5.082 5.700 1.00 0.00 H new ATOM 933 N ALA A 64 -2.435 -3.329 8.117 1.00 0.00 N ATOM 934 CA ALA A 64 -3.513 -3.826 8.962 1.00 0.00 C ATOM 935 C ALA A 64 -4.014 -5.180 8.473 1.00 0.00 C ATOM 936 O ALA A 64 -4.703 -5.268 7.458 1.00 0.00 O ATOM 937 CB ALA A 64 -4.656 -2.822 9.004 1.00 0.00 C ATOM 0 H ALA A 64 -2.631 -3.368 7.117 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.120 -3.956 9.971 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.455 -3.206 9.639 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.295 -1.876 9.408 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.038 -2.664 7.996 1.00 0.00 H new ATOM 943 N ASN A 65 -3.662 -6.235 9.201 1.00 0.00 N ATOM 944 CA ASN A 65 -4.075 -7.586 8.840 1.00 0.00 C ATOM 945 C ASN A 65 -5.587 -7.746 8.973 1.00 0.00 C ATOM 946 O ASN A 65 -6.235 -7.098 9.795 1.00 0.00 O ATOM 947 CB ASN A 65 -3.363 -8.613 9.723 1.00 0.00 C ATOM 948 CG ASN A 65 -1.862 -8.620 9.506 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.354 -7.981 8.584 1.00 0.00 O ATOM 950 ND2 ASN A 65 -1.145 -9.345 10.356 1.00 0.00 N ATOM 0 H ASN A 65 -3.091 -6.180 10.045 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.799 -7.758 7.800 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.575 -8.397 10.770 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.762 -9.606 9.515 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.130 -9.388 10.260 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.609 -9.859 11.105 1.00 0.00 H new ATOM 957 N PRO A 66 -6.163 -8.630 8.144 1.00 0.00 N ATOM 958 CA PRO A 66 -7.604 -8.897 8.150 1.00 0.00 C ATOM 959 C PRO A 66 -8.052 -9.635 9.408 1.00 0.00 C ATOM 960 O PRO A 66 -9.235 -9.927 9.579 1.00 0.00 O ATOM 961 CB PRO A 66 -7.807 -9.776 6.914 1.00 0.00 C ATOM 962 CG PRO A 66 -6.488 -10.432 6.694 1.00 0.00 C ATOM 963 CD PRO A 66 -5.452 -9.437 7.139 1.00 0.00 C ATOM 0 HA PRO A 66 -8.189 -7.977 8.137 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.593 -10.513 7.077 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.102 -9.181 6.050 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.412 -11.357 7.266 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.352 -10.694 5.645 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.578 -9.930 7.565 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.100 -8.825 6.309 1.00 0.00 H new ATOM 971 N SER A 67 -7.098 -9.933 10.284 1.00 0.00 N ATOM 972 CA SER A 67 -7.395 -10.641 11.525 1.00 0.00 C ATOM 973 C SER A 67 -7.329 -9.694 12.719 1.00 0.00 C ATOM 974 O SER A 67 -7.969 -9.924 13.744 1.00 0.00 O ATOM 975 CB SER A 67 -6.414 -11.798 11.723 1.00 0.00 C ATOM 976 OG SER A 67 -6.763 -12.906 10.911 1.00 0.00 O ATOM 0 H SER A 67 -6.114 -9.696 10.158 1.00 0.00 H new ATOM 0 HA SER A 67 -8.407 -11.040 11.455 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.404 -11.468 11.480 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.408 -12.098 12.771 1.00 0.00 H new ATOM 0 HG SER A 67 -6.120 -13.632 11.054 1.00 0.00 H new ATOM 982 N GLY A 68 -6.549 -8.626 12.577 1.00 0.00 N ATOM 983 CA GLY A 68 -6.413 -7.659 13.651 1.00 0.00 C ATOM 984 C GLY A 68 -4.970 -7.271 13.903 1.00 0.00 C ATOM 985 O GLY A 68 -4.687 -6.158 14.344 1.00 0.00 O ATOM 0 H GLY A 68 -6.009 -8.414 11.738 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.989 -6.766 13.407 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.839 -8.073 14.565 1.00 0.00 H new ATOM 989 N ALA A 69 -4.054 -8.193 13.623 1.00 0.00 N ATOM 990 CA ALA A 69 -2.632 -7.941 13.821 1.00 0.00 C ATOM 991 C ALA A 69 -2.118 -6.891 12.843 1.00 0.00 C ATOM 992 O ALA A 69 -2.857 -6.422 11.976 1.00 0.00 O ATOM 993 CB ALA A 69 -1.842 -9.233 13.674 1.00 0.00 C ATOM 0 H ALA A 69 -4.272 -9.121 13.259 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.494 -7.556 14.831 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.782 -9.030 13.824 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.182 -9.954 14.417 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.995 -9.642 12.675 1.00 0.00 H new ATOM 999 N SER A 70 -0.849 -6.524 12.988 1.00 0.00 N ATOM 1000 CA SER A 70 -0.238 -5.525 12.119 1.00 0.00 C ATOM 1001 C SER A 70 1.206 -5.896 11.795 1.00 0.00 C ATOM 1002 O SER A 70 1.977 -6.269 12.679 1.00 0.00 O ATOM 1003 CB SER A 70 -0.285 -4.146 12.781 1.00 0.00 C ATOM 1004 OG SER A 70 -1.602 -3.823 13.192 1.00 0.00 O ATOM 0 H SER A 70 -0.224 -6.903 13.699 1.00 0.00 H new ATOM 0 HA SER A 70 -0.804 -5.494 11.188 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.383 -4.130 13.642 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.077 -3.391 12.083 1.00 0.00 H new ATOM 0 HG SER A 70 -1.605 -2.938 13.613 1.00 0.00 H new ATOM 1010 N THR A 71 1.565 -5.792 10.519 1.00 0.00 N ATOM 1011 CA THR A 71 2.914 -6.117 10.076 1.00 0.00 C ATOM 1012 C THR A 71 3.836 -4.908 10.186 1.00 0.00 C ATOM 1013 O THR A 71 3.407 -3.771 9.997 1.00 0.00 O ATOM 1014 CB THR A 71 2.921 -6.623 8.621 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.992 -7.703 8.474 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.313 -7.086 8.216 1.00 0.00 C ATOM 0 H THR A 71 0.939 -5.485 9.774 1.00 0.00 H new ATOM 0 HA THR A 71 3.279 -6.909 10.730 1.00 0.00 H new ATOM 0 HB THR A 71 2.626 -5.799 7.971 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.759 -7.808 7.528 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.293 -7.439 7.185 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.012 -6.254 8.302 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.632 -7.897 8.871 1.00 0.00 H new ATOM 1024 N GLU A 72 5.105 -5.162 10.491 1.00 0.00 N ATOM 1025 CA GLU A 72 6.086 -4.093 10.626 1.00 0.00 C ATOM 1026 C GLU A 72 6.635 -3.683 9.262 1.00 0.00 C ATOM 1027 O GLU A 72 7.048 -4.528 8.468 1.00 0.00 O ATOM 1028 CB GLU A 72 7.233 -4.534 11.537 1.00 0.00 C ATOM 1029 CG GLU A 72 7.891 -3.388 12.287 1.00 0.00 C ATOM 1030 CD GLU A 72 8.690 -3.858 13.487 1.00 0.00 C ATOM 1031 OE1 GLU A 72 8.138 -4.630 14.301 1.00 0.00 O ATOM 1032 OE2 GLU A 72 9.865 -3.455 13.614 1.00 0.00 O ATOM 0 H GLU A 72 5.477 -6.099 10.649 1.00 0.00 H new ATOM 0 HA GLU A 72 5.588 -3.232 11.072 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.855 -5.259 12.258 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.986 -5.044 10.937 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.548 -2.844 11.608 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.124 -2.687 12.618 1.00 0.00 H new ATOM 1039 N CYS A 73 6.634 -2.381 8.998 1.00 0.00 N ATOM 1040 CA CYS A 73 7.130 -1.858 7.730 1.00 0.00 C ATOM 1041 C CYS A 73 8.441 -1.102 7.929 1.00 0.00 C ATOM 1042 O CYS A 73 8.640 -0.441 8.948 1.00 0.00 O ATOM 1043 CB CYS A 73 6.089 -0.937 7.092 1.00 0.00 C ATOM 1044 SG CYS A 73 5.719 0.543 8.062 1.00 0.00 S ATOM 0 H CYS A 73 6.295 -1.669 9.645 1.00 0.00 H new ATOM 0 HA CYS A 73 7.315 -2.702 7.065 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.443 -0.633 6.107 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.167 -1.499 6.940 1.00 0.00 H new ATOM 0 HG CYS A 73 4.460 0.545 8.387 1.00 0.00 H new ATOM 1050 N PHE A 74 9.332 -1.207 6.949 1.00 0.00 N ATOM 1051 CA PHE A 74 10.625 -0.536 7.017 1.00 0.00 C ATOM 1052 C PHE A 74 10.806 0.417 5.840 1.00 0.00 C ATOM 1053 O PHE A 74 11.091 -0.008 4.720 1.00 0.00 O ATOM 1054 CB PHE A 74 11.757 -1.565 7.033 1.00 0.00 C ATOM 1055 CG PHE A 74 11.418 -2.818 7.790 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.884 -2.748 9.066 1.00 0.00 C ATOM 1057 CD2 PHE A 74 11.633 -4.064 7.224 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.572 -3.900 9.764 1.00 0.00 C ATOM 1059 CE2 PHE A 74 11.323 -5.219 7.917 1.00 0.00 C ATOM 1060 CZ PHE A 74 10.790 -5.136 9.189 1.00 0.00 C ATOM 0 H PHE A 74 9.183 -1.750 6.099 1.00 0.00 H new ATOM 0 HA PHE A 74 10.657 0.044 7.939 1.00 0.00 H new ATOM 0 HB2 PHE A 74 12.013 -1.828 6.007 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.644 -1.111 7.476 1.00 0.00 H new ATOM 0 HD1 PHE A 74 10.710 -1.784 9.520 1.00 0.00 H new ATOM 0 HD2 PHE A 74 12.048 -4.134 6.229 1.00 0.00 H new ATOM 0 HE1 PHE A 74 10.158 -3.833 10.759 1.00 0.00 H new ATOM 0 HE2 PHE A 74 11.497 -6.184 7.465 1.00 0.00 H new ATOM 0 HZ PHE A 74 10.544 -6.036 9.732 1.00 0.00 H new ATOM 1070 N VAL A 75 10.636 1.710 6.101 1.00 0.00 N ATOM 1071 CA VAL A 75 10.781 2.725 5.064 1.00 0.00 C ATOM 1072 C VAL A 75 12.249 3.054 4.818 1.00 0.00 C ATOM 1073 O VAL A 75 12.996 3.351 5.751 1.00 0.00 O ATOM 1074 CB VAL A 75 10.031 4.018 5.436 1.00 0.00 C ATOM 1075 CG1 VAL A 75 8.545 3.743 5.607 1.00 0.00 C ATOM 1076 CG2 VAL A 75 10.618 4.628 6.700 1.00 0.00 C ATOM 0 H VAL A 75 10.398 2.079 7.022 1.00 0.00 H new ATOM 0 HA VAL A 75 10.347 2.312 4.153 1.00 0.00 H new ATOM 0 HB VAL A 75 10.152 4.735 4.624 1.00 0.00 H new ATOM 0 HG11 VAL A 75 8.032 4.668 5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.137 3.354 4.674 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.400 3.010 6.400 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.077 5.541 6.949 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.529 3.918 7.522 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.670 4.863 6.536 1.00 0.00 H new ATOM 1086 N THR A 76 12.659 3.000 3.554 1.00 0.00 N ATOM 1087 CA THR A 76 14.038 3.292 3.185 1.00 0.00 C ATOM 1088 C THR A 76 14.099 4.280 2.025 1.00 0.00 C ATOM 1089 O THR A 76 13.610 3.998 0.931 1.00 0.00 O ATOM 1090 CB THR A 76 14.798 2.010 2.793 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.805 1.091 3.891 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.227 2.332 2.385 1.00 0.00 C ATOM 0 H THR A 76 12.055 2.757 2.769 1.00 0.00 H new ATOM 0 HA THR A 76 14.513 3.734 4.061 1.00 0.00 H new ATOM 0 HB THR A 76 14.288 1.556 1.943 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.288 0.278 3.634 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.744 1.412 2.113 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.218 3.009 1.531 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.745 2.806 3.218 1.00 0.00 H new ATOM 1100 N ASP A 77 14.703 5.437 2.272 1.00 0.00 N ATOM 1101 CA ASP A 77 14.830 6.466 1.247 1.00 0.00 C ATOM 1102 C ASP A 77 16.124 6.292 0.458 1.00 0.00 C ATOM 1103 O ASP A 77 17.201 6.154 1.037 1.00 0.00 O ATOM 1104 CB ASP A 77 14.789 7.857 1.882 1.00 0.00 C ATOM 1105 CG ASP A 77 16.040 8.165 2.681 1.00 0.00 C ATOM 1106 OD1 ASP A 77 16.581 7.237 3.317 1.00 0.00 O ATOM 1107 OD2 ASP A 77 16.477 9.335 2.672 1.00 0.00 O ATOM 0 H ASP A 77 15.112 5.686 3.173 1.00 0.00 H new ATOM 0 HA ASP A 77 13.990 6.364 0.560 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.667 8.607 1.100 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.918 7.931 2.533 1.00 0.00 H new ATOM 1112 N ASN A 78 16.010 6.298 -0.866 1.00 0.00 N ATOM 1113 CA ASN A 78 17.171 6.139 -1.734 1.00 0.00 C ATOM 1114 C ASN A 78 17.903 7.466 -1.913 1.00 0.00 C ATOM 1115 O ASN A 78 18.730 7.614 -2.812 1.00 0.00 O ATOM 1116 CB ASN A 78 16.744 5.591 -3.097 1.00 0.00 C ATOM 1117 CG ASN A 78 16.182 4.186 -3.005 1.00 0.00 C ATOM 1118 OD1 ASN A 78 16.929 3.208 -2.964 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.859 4.079 -2.973 1.00 0.00 N ATOM 0 H ASN A 78 15.126 6.411 -1.361 1.00 0.00 H new ATOM 0 HA ASN A 78 17.851 5.430 -1.262 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.994 6.251 -3.532 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.601 5.593 -3.771 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.423 3.159 -2.912 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.279 4.917 -3.009 1.00 0.00 H new ATOM 1126 N ALA A 79 17.592 8.428 -1.050 1.00 0.00 N ATOM 1127 CA ALA A 79 18.221 9.741 -1.111 1.00 0.00 C ATOM 1128 C ALA A 79 18.271 10.260 -2.545 1.00 0.00 C ATOM 1129 O ALA A 79 19.198 10.977 -2.923 1.00 0.00 O ATOM 1130 CB ALA A 79 19.621 9.684 -0.519 1.00 0.00 C ATOM 0 H ALA A 79 16.908 8.322 -0.301 1.00 0.00 H new ATOM 0 HA ALA A 79 17.618 10.433 -0.523 1.00 0.00 H new ATOM 0 HB1 ALA A 79 20.079 10.672 -0.571 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.563 9.366 0.522 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.226 8.974 -1.083 1.00 0.00 H new ATOM 1136 N ASP A 80 17.271 9.892 -3.337 1.00 0.00 N ATOM 1137 CA ASP A 80 17.202 10.320 -4.730 1.00 0.00 C ATOM 1138 C ASP A 80 15.870 11.005 -5.022 1.00 0.00 C ATOM 1139 O ASP A 80 15.789 11.890 -5.873 1.00 0.00 O ATOM 1140 CB ASP A 80 17.389 9.124 -5.664 1.00 0.00 C ATOM 1141 CG ASP A 80 17.196 9.492 -7.122 1.00 0.00 C ATOM 1142 OD1 ASP A 80 17.716 10.547 -7.542 1.00 0.00 O ATOM 1143 OD2 ASP A 80 16.526 8.724 -7.843 1.00 0.00 O ATOM 0 H ASP A 80 16.497 9.298 -3.039 1.00 0.00 H new ATOM 0 HA ASP A 80 18.005 11.036 -4.904 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.388 8.712 -5.526 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.681 8.341 -5.393 1.00 0.00 H new ATOM 1148 N GLY A 81 14.827 10.589 -4.310 1.00 0.00 N ATOM 1149 CA GLY A 81 13.513 11.172 -4.508 1.00 0.00 C ATOM 1150 C GLY A 81 12.397 10.163 -4.322 1.00 0.00 C ATOM 1151 O GLY A 81 11.226 10.532 -4.227 1.00 0.00 O ATOM 0 H GLY A 81 14.869 9.858 -3.599 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.375 11.995 -3.807 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.454 11.594 -5.511 1.00 0.00 H new ATOM 1155 N THR A 82 12.759 8.885 -4.270 1.00 0.00 N ATOM 1156 CA THR A 82 11.780 7.820 -4.096 1.00 0.00 C ATOM 1157 C THR A 82 11.982 7.097 -2.769 1.00 0.00 C ATOM 1158 O THR A 82 13.058 7.162 -2.174 1.00 0.00 O ATOM 1159 CB THR A 82 11.856 6.794 -5.243 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.096 6.081 -5.181 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.728 7.482 -6.594 1.00 0.00 C ATOM 0 H THR A 82 13.724 8.563 -4.346 1.00 0.00 H new ATOM 0 HA THR A 82 10.797 8.291 -4.104 1.00 0.00 H new ATOM 0 HB THR A 82 11.028 6.094 -5.130 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.136 5.430 -5.912 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.785 6.738 -7.388 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.770 8.000 -6.649 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.537 8.202 -6.714 1.00 0.00 H new ATOM 1169 N TYR A 83 10.942 6.409 -2.311 1.00 0.00 N ATOM 1170 CA TYR A 83 11.006 5.676 -1.053 1.00 0.00 C ATOM 1171 C TYR A 83 10.836 4.177 -1.286 1.00 0.00 C ATOM 1172 O TYR A 83 10.230 3.757 -2.272 1.00 0.00 O ATOM 1173 CB TYR A 83 9.929 6.178 -0.090 1.00 0.00 C ATOM 1174 CG TYR A 83 10.009 7.663 0.186 1.00 0.00 C ATOM 1175 CD1 TYR A 83 10.777 8.154 1.234 1.00 0.00 C ATOM 1176 CD2 TYR A 83 9.317 8.574 -0.602 1.00 0.00 C ATOM 1177 CE1 TYR A 83 10.852 9.509 1.491 1.00 0.00 C ATOM 1178 CE2 TYR A 83 9.388 9.931 -0.354 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.156 10.394 0.694 1.00 0.00 C ATOM 1180 OH TYR A 83 10.229 11.745 0.945 1.00 0.00 O ATOM 0 H TYR A 83 10.045 6.344 -2.792 1.00 0.00 H new ATOM 0 HA TYR A 83 11.988 5.848 -0.612 1.00 0.00 H new ATOM 0 HB2 TYR A 83 8.947 5.946 -0.503 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.015 5.637 0.852 1.00 0.00 H new ATOM 0 HD1 TYR A 83 11.325 7.464 1.859 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.713 8.215 -1.422 1.00 0.00 H new ATOM 0 HE1 TYR A 83 11.452 9.874 2.311 1.00 0.00 H new ATOM 0 HE2 TYR A 83 8.845 10.626 -0.977 1.00 0.00 H new ATOM 0 HH TYR A 83 10.932 12.143 0.390 1.00 0.00 H new ATOM 1190 N GLN A 84 11.376 3.378 -0.372 1.00 0.00 N ATOM 1191 CA GLN A 84 11.284 1.926 -0.478 1.00 0.00 C ATOM 1192 C GLN A 84 10.889 1.307 0.859 1.00 0.00 C ATOM 1193 O GLN A 84 11.698 1.233 1.783 1.00 0.00 O ATOM 1194 CB GLN A 84 12.618 1.343 -0.950 1.00 0.00 C ATOM 1195 CG GLN A 84 12.538 -0.126 -1.333 1.00 0.00 C ATOM 1196 CD GLN A 84 12.198 -0.329 -2.797 1.00 0.00 C ATOM 1197 OE1 GLN A 84 12.946 0.086 -3.682 1.00 0.00 O ATOM 1198 NE2 GLN A 84 11.066 -0.970 -3.058 1.00 0.00 N ATOM 0 H GLN A 84 11.881 3.710 0.449 1.00 0.00 H new ATOM 0 HA GLN A 84 10.512 1.688 -1.210 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.972 1.915 -1.808 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.358 1.464 -0.159 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.492 -0.607 -1.115 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.785 -0.618 -0.717 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.477 -1.296 -2.292 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.785 -1.136 -4.024 1.00 0.00 H new ATOM 1207 N VAL A 85 9.640 0.864 0.953 1.00 0.00 N ATOM 1208 CA VAL A 85 9.137 0.250 2.177 1.00 0.00 C ATOM 1209 C VAL A 85 9.067 -1.267 2.042 1.00 0.00 C ATOM 1210 O VAL A 85 8.394 -1.790 1.154 1.00 0.00 O ATOM 1211 CB VAL A 85 7.741 0.787 2.542 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.254 0.170 3.844 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.763 2.305 2.637 1.00 0.00 C ATOM 0 H VAL A 85 8.957 0.918 0.197 1.00 0.00 H new ATOM 0 HA VAL A 85 9.837 0.509 2.972 1.00 0.00 H new ATOM 0 HB VAL A 85 7.045 0.505 1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.266 0.562 4.085 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.198 -0.913 3.735 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.949 0.418 4.646 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.768 2.668 2.896 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.472 2.611 3.406 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.064 2.725 1.677 1.00 0.00 H new ATOM 1223 N GLU A 86 9.766 -1.968 2.929 1.00 0.00 N ATOM 1224 CA GLU A 86 9.782 -3.426 2.908 1.00 0.00 C ATOM 1225 C GLU A 86 9.109 -3.996 4.153 1.00 0.00 C ATOM 1226 O GLU A 86 9.344 -3.530 5.267 1.00 0.00 O ATOM 1227 CB GLU A 86 11.220 -3.941 2.812 1.00 0.00 C ATOM 1228 CG GLU A 86 11.317 -5.448 2.650 1.00 0.00 C ATOM 1229 CD GLU A 86 12.747 -5.950 2.706 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.408 -5.980 1.648 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.205 -6.313 3.811 1.00 0.00 O ATOM 0 H GLU A 86 10.328 -1.550 3.671 1.00 0.00 H new ATOM 0 HA GLU A 86 9.225 -3.757 2.031 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.713 -3.461 1.967 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.764 -3.645 3.709 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.735 -5.932 3.434 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.872 -5.737 1.698 1.00 0.00 H new ATOM 1238 N TYR A 87 8.269 -5.006 3.954 1.00 0.00 N ATOM 1239 CA TYR A 87 7.558 -5.638 5.059 1.00 0.00 C ATOM 1240 C TYR A 87 7.294 -7.111 4.765 1.00 0.00 C ATOM 1241 O TYR A 87 7.209 -7.521 3.606 1.00 0.00 O ATOM 1242 CB TYR A 87 6.237 -4.914 5.323 1.00 0.00 C ATOM 1243 CG TYR A 87 5.180 -5.180 4.275 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.364 -6.302 4.353 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.998 -4.310 3.208 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.398 -6.549 3.397 1.00 0.00 C ATOM 1247 CE2 TYR A 87 4.033 -4.548 2.248 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.236 -5.669 2.347 1.00 0.00 C ATOM 1249 OH TYR A 87 2.274 -5.912 1.393 1.00 0.00 O ATOM 0 H TYR A 87 8.064 -5.404 3.038 1.00 0.00 H new ATOM 0 HA TYR A 87 8.185 -5.571 5.948 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.855 -5.217 6.298 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.424 -3.841 5.374 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.487 -6.992 5.174 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.622 -3.432 3.127 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.773 -7.427 3.471 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.904 -3.860 1.425 1.00 0.00 H new ATOM 0 HH TYR A 87 2.374 -5.273 0.657 1.00 0.00 H new ATOM 1259 N THR A 88 7.164 -7.905 5.823 1.00 0.00 N ATOM 1260 CA THR A 88 6.909 -9.333 5.681 1.00 0.00 C ATOM 1261 C THR A 88 5.643 -9.743 6.424 1.00 0.00 C ATOM 1262 O THR A 88 5.640 -9.929 7.640 1.00 0.00 O ATOM 1263 CB THR A 88 8.092 -10.169 6.206 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.327 -9.629 5.723 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.963 -11.621 5.770 1.00 0.00 C ATOM 0 H THR A 88 7.231 -7.583 6.788 1.00 0.00 H new ATOM 0 HA THR A 88 6.780 -9.526 4.616 1.00 0.00 H new ATOM 0 HB THR A 88 8.081 -10.130 7.295 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.074 -10.165 6.063 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.809 -12.192 6.152 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.036 -12.038 6.164 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.951 -11.674 4.681 1.00 0.00 H new ATOM 1273 N PRO A 89 4.538 -9.888 5.676 1.00 0.00 N ATOM 1274 CA PRO A 89 3.244 -10.278 6.243 1.00 0.00 C ATOM 1275 C PRO A 89 3.233 -11.728 6.717 1.00 0.00 C ATOM 1276 O PRO A 89 3.535 -12.644 5.952 1.00 0.00 O ATOM 1277 CB PRO A 89 2.273 -10.090 5.075 1.00 0.00 C ATOM 1278 CG PRO A 89 3.117 -10.232 3.855 1.00 0.00 C ATOM 1279 CD PRO A 89 4.468 -9.682 4.220 1.00 0.00 C ATOM 0 HA PRO A 89 2.991 -9.688 7.124 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.479 -10.836 5.096 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.793 -9.112 5.113 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.190 -11.276 3.550 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.686 -9.685 3.017 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.269 -10.208 3.701 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.557 -8.628 3.959 1.00 0.00 H new ATOM 1287 N PHE A 90 2.882 -11.929 7.983 1.00 0.00 N ATOM 1288 CA PHE A 90 2.832 -13.268 8.559 1.00 0.00 C ATOM 1289 C PHE A 90 1.401 -13.799 8.575 1.00 0.00 C ATOM 1290 O PHE A 90 1.010 -14.529 9.486 1.00 0.00 O ATOM 1291 CB PHE A 90 3.400 -13.257 9.979 1.00 0.00 C ATOM 1292 CG PHE A 90 3.005 -12.045 10.774 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.687 -11.850 11.154 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.951 -11.101 11.139 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.320 -10.736 11.886 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.590 -9.986 11.871 1.00 0.00 C ATOM 1297 CZ PHE A 90 2.272 -9.803 12.244 1.00 0.00 C ATOM 0 H PHE A 90 2.628 -11.182 8.629 1.00 0.00 H new ATOM 0 HA PHE A 90 3.439 -13.927 7.938 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.063 -14.151 10.503 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.488 -13.309 9.927 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.938 -12.576 10.875 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.982 -11.238 10.848 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.290 -10.596 12.177 1.00 0.00 H new ATOM 0 HE2 PHE A 90 4.337 -9.258 12.151 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.987 -8.931 12.815 1.00 0.00 H new ATOM 1307 N GLU A 91 0.626 -13.426 7.562 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.762 -13.864 7.461 1.00 0.00 C ATOM 1309 C GLU A 91 -1.277 -13.713 6.033 1.00 0.00 C ATOM 1310 O GLU A 91 -1.137 -12.656 5.418 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.644 -13.063 8.421 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.776 -13.694 9.797 1.00 0.00 C ATOM 1313 CD GLU A 91 -2.170 -15.157 9.732 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -2.898 -15.535 8.791 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -1.749 -15.924 10.624 1.00 0.00 O ATOM 0 H GLU A 91 0.935 -12.822 6.800 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.805 -14.918 7.735 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.231 -12.060 8.529 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.637 -12.954 7.984 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.829 -13.600 10.328 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.521 -13.146 10.374 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.874 -14.779 5.510 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.412 -14.768 4.155 1.00 0.00 C ATOM 1324 C LYS A 92 -3.788 -14.111 4.122 1.00 0.00 C ATOM 1325 O LYS A 92 -4.782 -14.709 4.532 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.502 -16.194 3.608 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.213 -16.984 3.753 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.484 -18.472 3.892 1.00 0.00 C ATOM 1329 CE LYS A 92 -2.095 -18.804 5.245 1.00 0.00 C ATOM 1330 NZ LYS A 92 -1.053 -19.108 6.264 1.00 0.00 N ATOM 0 H LYS A 92 -1.997 -15.662 6.005 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.736 -14.187 3.527 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.302 -16.723 4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.777 -16.153 2.554 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.578 -16.808 2.885 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.664 -16.630 4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.157 -18.796 3.098 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.553 -19.026 3.766 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.702 -17.965 5.585 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.763 -19.659 5.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.329 -19.955 6.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.143 -19.279 5.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.958 -18.302 6.915 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.839 -12.877 3.629 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.099 -12.161 3.550 1.00 0.00 C ATOM 1346 C GLY A 93 -4.935 -10.758 2.999 1.00 0.00 C ATOM 1347 O GLY A 93 -3.842 -10.370 2.585 1.00 0.00 O ATOM 0 H GLY A 93 -3.030 -12.361 3.283 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.791 -12.718 2.918 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.546 -12.108 4.543 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.023 -9.997 2.991 1.00 0.00 N ATOM 1352 CA LEU A 94 -5.996 -8.629 2.485 1.00 0.00 C ATOM 1353 C LEU A 94 -5.797 -7.631 3.622 1.00 0.00 C ATOM 1354 O LEU A 94 -6.642 -7.509 4.509 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.293 -8.315 1.737 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.627 -6.833 1.566 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.667 -6.179 0.585 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -9.066 -6.661 1.102 1.00 0.00 C ATOM 0 H LEU A 94 -6.935 -10.304 3.329 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.156 -8.539 1.796 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.238 -8.771 0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.118 -8.794 2.264 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.517 -6.342 2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.920 -5.124 0.476 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.647 -6.270 0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.744 -6.673 -0.384 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.286 -5.600 0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.203 -7.167 0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.741 -7.093 1.841 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.676 -6.919 3.588 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.367 -5.929 4.615 1.00 0.00 C ATOM 1372 C HIS A 95 -4.617 -4.515 4.098 1.00 0.00 C ATOM 1373 O HIS A 95 -4.645 -4.280 2.890 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.914 -6.070 5.068 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.375 -7.460 4.929 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.056 -8.578 5.362 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.214 -7.911 4.399 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.336 -9.656 5.107 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.214 -9.278 4.522 1.00 0.00 N ATOM 0 H HIS A 95 -3.966 -7.008 2.861 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.024 -6.107 5.467 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.293 -5.389 4.486 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.836 -5.761 6.110 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.433 -7.307 3.961 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.617 -10.673 5.338 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.468 -9.901 4.212 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.799 -3.577 5.022 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.046 -2.186 4.660 1.00 0.00 C ATOM 1389 C VAL A 96 -3.837 -1.312 4.978 1.00 0.00 C ATOM 1390 O VAL A 96 -3.546 -1.036 6.141 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.278 -1.625 5.395 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.481 -0.157 5.054 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.517 -2.438 5.053 1.00 0.00 C ATOM 0 H VAL A 96 -4.780 -3.755 6.026 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.232 -2.167 3.586 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.106 -1.702 6.469 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.356 0.222 5.583 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.601 0.411 5.355 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.632 -0.050 3.980 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.378 -2.028 5.581 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.695 -2.395 3.979 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.367 -3.475 5.354 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.136 -0.880 3.934 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.958 -0.036 4.101 1.00 0.00 C ATOM 1405 C VAL A 97 -2.330 1.441 4.049 1.00 0.00 C ATOM 1406 O VAL A 97 -2.837 1.928 3.040 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.902 -0.327 3.019 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.293 0.602 3.176 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.466 -1.783 3.078 1.00 0.00 C ATOM 0 H VAL A 97 -3.363 -1.100 2.964 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.538 -0.268 5.080 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.349 -0.144 2.042 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.029 0.382 2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.036 1.637 3.080 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.743 0.454 4.158 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.281 -1.971 2.306 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.037 -1.995 4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.329 -2.428 2.913 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.073 2.150 5.145 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.381 3.573 5.223 1.00 0.00 C ATOM 1421 C GLU A 98 -1.108 4.410 5.138 1.00 0.00 C ATOM 1422 O GLU A 98 -0.284 4.402 6.053 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.125 3.885 6.524 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.607 3.558 6.471 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.204 3.330 7.846 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.855 4.085 8.777 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -6.020 2.396 7.990 1.00 0.00 O ATOM 0 H GLU A 98 -1.653 1.762 5.990 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.020 3.828 4.377 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.667 3.324 7.338 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.003 4.943 6.758 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.138 4.373 5.979 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.757 2.667 5.862 1.00 0.00 H new ATOM 1434 N VAL A 99 -0.955 5.132 4.033 1.00 0.00 N ATOM 1435 CA VAL A 99 0.216 5.976 3.827 1.00 0.00 C ATOM 1436 C VAL A 99 -0.110 7.442 4.087 1.00 0.00 C ATOM 1437 O VAL A 99 -1.171 7.933 3.698 1.00 0.00 O ATOM 1438 CB VAL A 99 0.769 5.830 2.397 1.00 0.00 C ATOM 1439 CG1 VAL A 99 2.084 6.582 2.253 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.944 4.362 2.041 1.00 0.00 C ATOM 0 H VAL A 99 -1.627 5.150 3.266 1.00 0.00 H new ATOM 0 HA VAL A 99 0.974 5.644 4.537 1.00 0.00 H new ATOM 0 HB VAL A 99 0.051 6.266 1.702 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.459 6.467 1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.923 7.639 2.463 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.813 6.179 2.956 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.336 4.278 1.027 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.641 3.899 2.739 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.019 3.856 2.101 1.00 0.00 H new ATOM 1450 N THR A 100 0.809 8.140 4.747 1.00 0.00 N ATOM 1451 CA THR A 100 0.619 9.551 5.060 1.00 0.00 C ATOM 1452 C THR A 100 1.920 10.329 4.900 1.00 0.00 C ATOM 1453 O THR A 100 2.896 10.078 5.608 1.00 0.00 O ATOM 1454 CB THR A 100 0.092 9.742 6.494 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.914 9.020 7.419 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.348 9.266 6.610 1.00 0.00 C ATOM 0 H THR A 100 1.693 7.751 5.075 1.00 0.00 H new ATOM 0 HA THR A 100 -0.119 9.935 4.356 1.00 0.00 H new ATOM 0 HB THR A 100 0.127 10.805 6.731 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.857 9.132 7.176 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.698 9.411 7.632 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.976 9.837 5.927 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.403 8.208 6.354 1.00 0.00 H new ATOM 1464 N TYR A 101 1.928 11.275 3.968 1.00 0.00 N ATOM 1465 CA TYR A 101 3.110 12.089 3.714 1.00 0.00 C ATOM 1466 C TYR A 101 3.018 13.426 4.444 1.00 0.00 C ATOM 1467 O TYR A 101 2.204 14.281 4.096 1.00 0.00 O ATOM 1468 CB TYR A 101 3.280 12.326 2.213 1.00 0.00 C ATOM 1469 CG TYR A 101 4.622 12.916 1.841 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.955 14.216 2.200 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.556 12.174 1.129 1.00 0.00 C ATOM 1472 CE1 TYR A 101 6.179 14.760 1.862 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.783 12.708 0.788 1.00 0.00 C ATOM 1474 CZ TYR A 101 7.090 14.002 1.156 1.00 0.00 C ATOM 1475 OH TYR A 101 8.311 14.538 0.817 1.00 0.00 O ATOM 0 H TYR A 101 1.128 11.497 3.375 1.00 0.00 H new ATOM 0 HA TYR A 101 3.979 11.549 4.090 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.150 11.380 1.687 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.491 12.994 1.867 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.244 14.812 2.753 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.318 11.162 0.837 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.421 15.773 2.149 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.498 12.116 0.236 1.00 0.00 H new ATOM 0 HH TYR A 101 9.026 14.001 1.217 1.00 0.00 H new ATOM 1485 N ASP A 102 3.859 13.598 5.458 1.00 0.00 N ATOM 1486 CA ASP A 102 3.875 14.830 6.238 1.00 0.00 C ATOM 1487 C ASP A 102 2.536 15.049 6.935 1.00 0.00 C ATOM 1488 O ASP A 102 1.997 16.157 6.933 1.00 0.00 O ATOM 1489 CB ASP A 102 4.197 16.024 5.338 1.00 0.00 C ATOM 1490 CG ASP A 102 4.536 17.271 6.130 1.00 0.00 C ATOM 1491 OD1 ASP A 102 5.036 17.135 7.266 1.00 0.00 O ATOM 1492 OD2 ASP A 102 4.302 18.384 5.613 1.00 0.00 O ATOM 0 H ASP A 102 4.539 12.900 5.759 1.00 0.00 H new ATOM 0 HA ASP A 102 4.650 14.739 6.999 1.00 0.00 H new ATOM 0 HB2 ASP A 102 5.035 15.770 4.689 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.344 16.229 4.691 1.00 0.00 H new ATOM 1497 N ASP A 103 2.003 13.988 7.530 1.00 0.00 N ATOM 1498 CA ASP A 103 0.727 14.064 8.231 1.00 0.00 C ATOM 1499 C ASP A 103 -0.416 14.315 7.253 1.00 0.00 C ATOM 1500 O ASP A 103 -1.448 14.878 7.619 1.00 0.00 O ATOM 1501 CB ASP A 103 0.766 15.171 9.286 1.00 0.00 C ATOM 1502 CG ASP A 103 2.064 15.181 10.068 1.00 0.00 C ATOM 1503 OD1 ASP A 103 2.504 14.095 10.501 1.00 0.00 O ATOM 1504 OD2 ASP A 103 2.641 16.274 10.248 1.00 0.00 O ATOM 0 H ASP A 103 2.435 13.064 7.541 1.00 0.00 H new ATOM 0 HA ASP A 103 0.554 13.108 8.725 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.631 16.137 8.800 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.069 15.042 9.975 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.225 13.895 6.007 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.240 14.074 4.975 1.00 0.00 C ATOM 1511 C VAL A 104 -1.376 12.823 4.115 1.00 0.00 C ATOM 1512 O VAL A 104 -0.434 12.391 3.451 1.00 0.00 O ATOM 1513 CB VAL A 104 -0.912 15.275 4.068 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -1.911 15.368 2.924 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -0.893 16.563 4.877 1.00 0.00 C ATOM 0 H VAL A 104 0.624 13.428 5.687 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.183 14.263 5.488 1.00 0.00 H new ATOM 0 HB VAL A 104 0.080 15.127 3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.664 16.222 2.294 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.870 14.455 2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.916 15.494 3.328 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.660 17.401 4.221 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.870 16.720 5.333 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.135 16.491 5.657 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.577 12.226 4.125 1.00 0.00 N ATOM 1526 CA PRO A 105 -2.866 11.016 3.349 1.00 0.00 C ATOM 1527 C PRO A 105 -2.903 11.284 1.849 1.00 0.00 C ATOM 1528 O PRO A 105 -3.147 12.411 1.416 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.250 10.595 3.851 1.00 0.00 C ATOM 1530 CG PRO A 105 -4.873 11.854 4.346 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.746 12.686 4.894 1.00 0.00 C ATOM 0 HA PRO A 105 -2.098 10.254 3.482 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.842 10.148 3.052 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.174 9.852 4.645 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.389 12.377 3.541 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.615 11.646 5.117 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.927 13.751 4.751 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.612 12.526 5.964 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.660 10.243 1.060 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.667 10.367 -0.392 1.00 0.00 C ATOM 1541 C ILE A 106 -4.010 9.938 -0.974 1.00 0.00 C ATOM 1542 O ILE A 106 -4.756 9.164 -0.373 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.549 9.525 -1.035 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.473 8.148 -0.372 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.214 10.245 -0.926 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.550 7.184 -1.085 1.00 0.00 C ATOM 0 H ILE A 106 -2.456 9.304 1.402 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.494 11.419 -0.619 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.780 9.387 -2.091 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.135 8.268 0.657 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.474 7.718 -0.331 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.566 9.637 -1.385 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.275 11.205 -1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.026 10.410 0.124 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.545 6.229 -0.560 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.899 7.035 -2.107 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.460 7.593 -1.103 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.326 10.450 -2.173 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.579 10.132 -2.864 1.00 0.00 C ATOM 1560 C PRO A 107 -5.618 8.691 -3.360 1.00 0.00 C ATOM 1561 O PRO A 107 -6.577 8.273 -4.006 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.589 11.105 -4.045 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.153 11.416 -4.292 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.484 11.378 -2.946 1.00 0.00 C ATOM 0 HA PRO A 107 -6.443 10.229 -2.207 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -6.054 10.657 -4.923 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.155 12.007 -3.810 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.707 10.688 -4.970 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.040 12.396 -4.756 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.456 11.023 -3.018 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.448 12.366 -2.487 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.568 7.935 -3.052 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.483 6.540 -3.467 1.00 0.00 C ATOM 1574 C ASN A 108 -4.773 5.605 -2.297 1.00 0.00 C ATOM 1575 O ASN A 108 -5.123 4.441 -2.490 1.00 0.00 O ATOM 1576 CB ASN A 108 -3.097 6.241 -4.042 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.505 7.431 -4.772 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.446 7.937 -4.401 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.189 7.884 -5.817 1.00 0.00 N ATOM 0 H ASN A 108 -3.765 8.266 -2.517 1.00 0.00 H new ATOM 0 HA ASN A 108 -5.234 6.370 -4.239 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.428 5.944 -3.234 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.165 5.395 -4.727 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.840 8.682 -6.347 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.063 7.433 -6.089 1.00 0.00 H new ATOM 1586 N SER A 109 -4.624 6.124 -1.082 1.00 0.00 N ATOM 1587 CA SER A 109 -4.867 5.335 0.121 1.00 0.00 C ATOM 1588 C SER A 109 -6.289 5.545 0.630 1.00 0.00 C ATOM 1589 O SER A 109 -6.958 6.523 0.295 1.00 0.00 O ATOM 1590 CB SER A 109 -3.862 5.709 1.212 1.00 0.00 C ATOM 1591 OG SER A 109 -2.716 4.877 1.156 1.00 0.00 O ATOM 0 H SER A 109 -4.336 7.086 -0.905 1.00 0.00 H new ATOM 0 HA SER A 109 -4.743 4.282 -0.133 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.565 6.751 1.095 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.333 5.619 2.191 1.00 0.00 H new ATOM 0 HG SER A 109 -2.701 4.398 0.301 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.764 4.605 1.461 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.977 3.437 1.866 1.00 0.00 C ATOM 1599 C PRO A 110 -5.764 2.455 0.719 1.00 0.00 C ATOM 1600 O PRO A 110 -6.441 2.527 -0.307 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.831 2.798 2.965 1.00 0.00 C ATOM 1602 CG PRO A 110 -8.223 3.235 2.665 1.00 0.00 C ATOM 1603 CD PRO A 110 -8.106 4.610 2.068 1.00 0.00 C ATOM 0 HA PRO A 110 -4.975 3.714 2.192 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.746 1.711 2.951 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.516 3.130 3.954 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.707 2.548 1.971 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.830 3.253 3.570 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.882 4.793 1.325 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -8.201 5.387 2.827 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.820 1.538 0.900 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.517 0.541 -0.121 1.00 0.00 C ATOM 1613 C PHE A 111 -5.026 -0.836 0.295 1.00 0.00 C ATOM 1614 O PHE A 111 -5.375 -1.057 1.455 1.00 0.00 O ATOM 1615 CB PHE A 111 -3.010 0.484 -0.378 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.517 1.563 -1.300 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.779 1.503 -2.659 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.793 2.636 -0.807 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.328 2.494 -3.511 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.340 3.630 -1.654 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.606 3.558 -3.007 1.00 0.00 C ATOM 0 H PHE A 111 -4.251 1.464 1.744 1.00 0.00 H new ATOM 0 HA PHE A 111 -5.024 0.834 -1.040 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.484 0.562 0.574 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.758 -0.488 -0.802 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.342 0.672 -3.058 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.580 2.697 0.250 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.540 2.436 -4.568 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.778 4.463 -1.258 1.00 0.00 H new ATOM 0 HZ PHE A 111 -1.250 4.333 -3.670 1.00 0.00 H new ATOM 1631 N LYS A 112 -5.065 -1.759 -0.660 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.530 -3.115 -0.394 1.00 0.00 C ATOM 1633 C LYS A 112 -4.572 -4.144 -0.986 1.00 0.00 C ATOM 1634 O LYS A 112 -4.549 -4.361 -2.198 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.933 -3.318 -0.972 1.00 0.00 C ATOM 1636 CG LYS A 112 -8.046 -2.906 -0.024 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.274 -2.427 -0.780 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.200 -3.582 -1.129 1.00 0.00 C ATOM 1639 NZ LYS A 112 -9.822 -4.225 -2.418 1.00 0.00 N ATOM 0 H LYS A 112 -4.780 -1.593 -1.625 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.565 -3.255 0.686 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -7.023 -2.746 -1.895 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.061 -4.368 -1.234 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.315 -3.750 0.611 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.690 -2.113 0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.813 -1.697 -0.176 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.965 -1.919 -1.693 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.172 -4.324 -0.331 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -11.226 -3.219 -1.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.659 -4.292 -3.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.092 -3.654 -2.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.450 -5.179 -2.234 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.784 -4.777 -0.123 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.826 -5.786 -0.560 1.00 0.00 C ATOM 1655 C VAL A 113 -3.355 -7.193 -0.306 1.00 0.00 C ATOM 1656 O VAL A 113 -3.304 -7.692 0.817 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.472 -5.621 0.155 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.507 -6.717 -0.269 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.886 -4.245 -0.126 1.00 0.00 C ATOM 0 H VAL A 113 -3.790 -4.609 0.883 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.682 -5.643 -1.631 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.635 -5.709 1.229 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.444 -6.584 0.247 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.926 -7.690 -0.012 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.347 -6.664 -1.346 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.071 -4.145 0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.737 -4.125 -1.199 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.572 -3.477 0.233 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.861 -7.828 -1.358 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.397 -9.179 -1.250 1.00 0.00 C ATOM 1671 C ALA A 114 -3.279 -10.216 -1.271 1.00 0.00 C ATOM 1672 O ALA A 114 -2.878 -10.689 -2.335 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.389 -9.445 -2.373 1.00 0.00 C ATOM 0 H ALA A 114 -3.911 -7.428 -2.295 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.916 -9.262 -0.295 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.781 -10.458 -2.280 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.210 -8.731 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.887 -9.337 -3.335 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.780 -10.566 -0.090 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.709 -11.548 0.027 1.00 0.00 C ATOM 1681 C VAL A 115 -2.231 -12.962 -0.203 1.00 0.00 C ATOM 1682 O VAL A 115 -3.396 -13.257 0.067 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.033 -11.480 1.409 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.072 -12.645 1.592 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.313 -10.152 1.586 1.00 0.00 C ATOM 0 H VAL A 115 -3.101 -10.184 0.800 1.00 0.00 H new ATOM 0 HA VAL A 115 -0.974 -11.307 -0.741 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.805 -11.553 2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.396 -12.580 2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.619 -13.584 1.512 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.697 -12.607 0.820 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.159 -10.122 2.568 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.449 -10.046 0.814 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.030 -9.335 1.503 1.00 0.00 H new ATOM 1695 N THR A 116 -1.362 -13.834 -0.702 1.00 0.00 N ATOM 1696 CA THR A 116 -1.735 -15.218 -0.969 1.00 0.00 C ATOM 1697 C THR A 116 -0.598 -16.171 -0.620 1.00 0.00 C ATOM 1698 O THR A 116 0.550 -15.753 -0.469 1.00 0.00 O ATOM 1699 CB THR A 116 -2.124 -15.420 -2.446 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.429 -16.798 -2.688 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.999 -14.974 -3.368 1.00 0.00 C ATOM 0 H THR A 116 -0.394 -13.607 -0.930 1.00 0.00 H new ATOM 0 HA THR A 116 -2.597 -15.440 -0.340 1.00 0.00 H new ATOM 0 HB THR A 116 -3.004 -14.812 -2.654 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.677 -16.918 -3.629 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.297 -15.126 -4.405 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.790 -13.917 -3.202 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.103 -15.559 -3.158 1.00 0.00 H new ATOM 1709 N GLU A 117 -0.925 -17.453 -0.493 1.00 0.00 N ATOM 1710 CA GLU A 117 0.071 -18.466 -0.162 1.00 0.00 C ATOM 1711 C GLU A 117 0.600 -19.142 -1.423 1.00 0.00 C ATOM 1712 O GLU A 117 -0.067 -19.993 -2.010 1.00 0.00 O ATOM 1713 CB GLU A 117 -0.528 -19.513 0.780 1.00 0.00 C ATOM 1714 CG GLU A 117 -2.005 -19.774 0.539 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.466 -21.098 1.117 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -2.142 -22.149 0.525 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -3.149 -21.083 2.162 1.00 0.00 O ATOM 0 H GLU A 117 -1.871 -17.815 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 117 0.903 -17.971 0.339 1.00 0.00 H new ATOM 0 HB2 GLU A 117 0.021 -20.448 0.667 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.389 -19.185 1.810 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.589 -18.966 0.980 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.202 -19.762 -0.533 1.00 0.00 H new ATOM 1724 N GLY A 118 1.805 -18.757 -1.833 1.00 0.00 N ATOM 1725 CA GLY A 118 2.403 -19.336 -3.022 1.00 0.00 C ATOM 1726 C GLY A 118 3.645 -20.146 -2.710 1.00 0.00 C ATOM 1727 O GLY A 118 3.754 -21.306 -3.109 1.00 0.00 O ATOM 0 H GLY A 118 2.377 -18.055 -1.363 1.00 0.00 H new ATOM 0 HA2 GLY A 118 1.672 -19.974 -3.519 1.00 0.00 H new ATOM 0 HA3 GLY A 118 2.658 -18.540 -3.721 1.00 0.00 H new ATOM 1731 N CYS A 119 4.585 -19.535 -1.997 1.00 0.00 N ATOM 1732 CA CYS A 119 5.828 -20.208 -1.634 1.00 0.00 C ATOM 1733 C CYS A 119 6.305 -19.761 -0.256 1.00 0.00 C ATOM 1734 O CYS A 119 6.170 -18.593 0.109 1.00 0.00 O ATOM 1735 CB CYS A 119 6.909 -19.925 -2.678 1.00 0.00 C ATOM 1736 SG CYS A 119 8.435 -20.861 -2.432 1.00 0.00 S ATOM 0 H CYS A 119 4.510 -18.576 -1.659 1.00 0.00 H new ATOM 0 HA CYS A 119 5.636 -21.281 -1.602 1.00 0.00 H new ATOM 0 HB2 CYS A 119 6.512 -20.152 -3.667 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.142 -18.860 -2.665 1.00 0.00 H new ATOM 0 HG CYS A 119 9.287 -20.555 -3.365 1.00 0.00 H new ATOM 1742 N GLN A 120 6.862 -20.698 0.504 1.00 0.00 N ATOM 1743 CA GLN A 120 7.356 -20.400 1.843 1.00 0.00 C ATOM 1744 C GLN A 120 8.462 -21.371 2.243 1.00 0.00 C ATOM 1745 O GLN A 120 8.433 -22.556 1.908 1.00 0.00 O ATOM 1746 CB GLN A 120 6.214 -20.464 2.858 1.00 0.00 C ATOM 1747 CG GLN A 120 5.504 -21.808 2.891 1.00 0.00 C ATOM 1748 CD GLN A 120 4.424 -21.872 3.953 1.00 0.00 C ATOM 1749 OE1 GLN A 120 4.456 -21.127 4.933 1.00 0.00 O ATOM 1750 NE2 GLN A 120 3.458 -22.763 3.763 1.00 0.00 N ATOM 0 H GLN A 120 6.982 -21.669 0.216 1.00 0.00 H new ATOM 0 HA GLN A 120 7.768 -19.391 1.834 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.609 -20.246 3.851 1.00 0.00 H new ATOM 0 HB3 GLN A 120 5.488 -19.685 2.626 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.060 -22.004 1.915 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.235 -22.596 3.073 1.00 0.00 H new ATOM 0 HE21 GLN A 120 3.471 -23.360 2.936 1.00 0.00 H new ATOM 0 HE22 GLN A 120 2.703 -22.850 4.444 1.00 0.00 H new ATOM 1759 N PRO A 121 9.462 -20.861 2.977 1.00 0.00 N ATOM 1760 CA PRO A 121 10.597 -21.666 3.438 1.00 0.00 C ATOM 1761 C PRO A 121 10.195 -22.673 4.510 1.00 0.00 C ATOM 1762 O PRO A 121 9.186 -22.498 5.192 1.00 0.00 O ATOM 1763 CB PRO A 121 11.559 -20.625 4.017 1.00 0.00 C ATOM 1764 CG PRO A 121 10.688 -19.481 4.409 1.00 0.00 C ATOM 1765 CD PRO A 121 9.562 -19.458 3.412 1.00 0.00 C ATOM 0 HA PRO A 121 11.027 -22.263 2.633 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.102 -21.022 4.875 1.00 0.00 H new ATOM 0 HB3 PRO A 121 12.304 -20.322 3.281 1.00 0.00 H new ATOM 0 HG2 PRO A 121 10.309 -19.608 5.423 1.00 0.00 H new ATOM 0 HG3 PRO A 121 11.244 -18.543 4.392 1.00 0.00 H new ATOM 0 HD2 PRO A 121 8.633 -19.110 3.863 1.00 0.00 H new ATOM 0 HD3 PRO A 121 9.779 -18.793 2.576 1.00 0.00 H new ATOM 1773 N SER A 122 10.991 -23.728 4.652 1.00 0.00 N ATOM 1774 CA SER A 122 10.716 -24.766 5.639 1.00 0.00 C ATOM 1775 C SER A 122 11.917 -24.977 6.555 1.00 0.00 C ATOM 1776 O SER A 122 12.993 -25.371 6.105 1.00 0.00 O ATOM 1777 CB SER A 122 10.354 -26.079 4.942 1.00 0.00 C ATOM 1778 OG SER A 122 9.545 -26.892 5.774 1.00 0.00 O ATOM 0 H SER A 122 11.831 -23.887 4.096 1.00 0.00 H new ATOM 0 HA SER A 122 9.871 -24.441 6.246 1.00 0.00 H new ATOM 0 HB2 SER A 122 9.827 -25.867 4.012 1.00 0.00 H new ATOM 0 HB3 SER A 122 11.264 -26.617 4.677 1.00 0.00 H new ATOM 0 HG SER A 122 9.326 -27.724 5.305 1.00 0.00 H new ATOM 1784 N SER A 123 11.725 -24.711 7.843 1.00 0.00 N ATOM 1785 CA SER A 123 12.794 -24.868 8.823 1.00 0.00 C ATOM 1786 C SER A 123 12.706 -26.228 9.509 1.00 0.00 C ATOM 1787 O SER A 123 11.678 -26.901 9.450 1.00 0.00 O ATOM 1788 CB SER A 123 12.724 -23.752 9.868 1.00 0.00 C ATOM 1789 OG SER A 123 13.016 -22.492 9.289 1.00 0.00 O ATOM 0 H SER A 123 10.840 -24.386 8.232 1.00 0.00 H new ATOM 0 HA SER A 123 13.747 -24.806 8.298 1.00 0.00 H new ATOM 0 HB2 SER A 123 11.730 -23.729 10.314 1.00 0.00 H new ATOM 0 HB3 SER A 123 13.430 -23.958 10.673 1.00 0.00 H new ATOM 0 HG SER A 123 12.963 -21.796 9.977 1.00 0.00 H new ATOM 1795 N GLY A 124 13.795 -26.626 10.160 1.00 0.00 N ATOM 1796 CA GLY A 124 13.822 -27.904 10.848 1.00 0.00 C ATOM 1797 C GLY A 124 14.228 -27.771 12.303 1.00 0.00 C ATOM 1798 O GLY A 124 13.998 -26.744 12.942 1.00 0.00 O ATOM 0 H GLY A 124 14.658 -26.087 10.223 1.00 0.00 H new ATOM 0 HA2 GLY A 124 12.836 -28.365 10.790 1.00 0.00 H new ATOM 0 HA3 GLY A 124 14.517 -28.572 10.340 1.00 0.00 H new ATOM 1802 N PRO A 125 14.845 -28.829 12.848 1.00 0.00 N ATOM 1803 CA PRO A 125 15.294 -28.851 14.243 1.00 0.00 C ATOM 1804 C PRO A 125 16.473 -27.915 14.487 1.00 0.00 C ATOM 1805 O PRO A 125 17.044 -27.363 13.547 1.00 0.00 O ATOM 1806 CB PRO A 125 15.715 -30.307 14.458 1.00 0.00 C ATOM 1807 CG PRO A 125 16.067 -30.804 13.098 1.00 0.00 C ATOM 1808 CD PRO A 125 15.151 -30.086 12.145 1.00 0.00 C ATOM 0 HA PRO A 125 14.515 -28.513 14.927 1.00 0.00 H new ATOM 0 HB2 PRO A 125 16.564 -30.377 15.137 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.907 -30.892 14.897 1.00 0.00 H new ATOM 0 HG2 PRO A 125 17.112 -30.598 12.865 1.00 0.00 H new ATOM 0 HG3 PRO A 125 15.932 -31.884 13.030 1.00 0.00 H new ATOM 0 HD2 PRO A 125 15.634 -29.902 11.185 1.00 0.00 H new ATOM 0 HD3 PRO A 125 14.249 -30.663 11.943 1.00 0.00 H new ATOM 1816 N SER A 126 16.833 -27.740 15.755 1.00 0.00 N ATOM 1817 CA SER A 126 17.942 -26.868 16.122 1.00 0.00 C ATOM 1818 C SER A 126 18.735 -27.458 17.284 1.00 0.00 C ATOM 1819 O SER A 126 18.172 -27.807 18.321 1.00 0.00 O ATOM 1820 CB SER A 126 17.423 -25.479 16.497 1.00 0.00 C ATOM 1821 OG SER A 126 17.040 -24.749 15.345 1.00 0.00 O ATOM 0 H SER A 126 16.372 -28.191 16.545 1.00 0.00 H new ATOM 0 HA SER A 126 18.604 -26.780 15.261 1.00 0.00 H new ATOM 0 HB2 SER A 126 16.571 -25.575 17.170 1.00 0.00 H new ATOM 0 HB3 SER A 126 18.196 -24.932 17.037 1.00 0.00 H new ATOM 0 HG SER A 126 16.710 -23.866 15.612 1.00 0.00 H new ATOM 1827 N SER A 127 20.048 -27.566 17.101 1.00 0.00 N ATOM 1828 CA SER A 127 20.920 -28.117 18.131 1.00 0.00 C ATOM 1829 C SER A 127 21.645 -27.004 18.882 1.00 0.00 C ATOM 1830 O SER A 127 21.644 -25.850 18.455 1.00 0.00 O ATOM 1831 CB SER A 127 21.937 -29.075 17.509 1.00 0.00 C ATOM 1832 OG SER A 127 22.884 -28.373 16.722 1.00 0.00 O ATOM 0 H SER A 127 20.530 -27.279 16.249 1.00 0.00 H new ATOM 0 HA SER A 127 20.301 -28.666 18.840 1.00 0.00 H new ATOM 0 HB2 SER A 127 22.451 -29.626 18.296 1.00 0.00 H new ATOM 0 HB3 SER A 127 21.419 -29.809 16.892 1.00 0.00 H new ATOM 0 HG SER A 127 23.524 -29.007 16.337 1.00 0.00 H new ATOM 1838 N GLY A 128 22.264 -27.360 20.003 1.00 0.00 N ATOM 1839 CA GLY A 128 22.984 -26.382 20.796 1.00 0.00 C ATOM 1840 C GLY A 128 22.178 -25.121 21.034 1.00 0.00 C ATOM 1841 O GLY A 128 21.908 -24.755 22.178 1.00 0.00 O ATOM 0 H GLY A 128 22.280 -28.309 20.376 1.00 0.00 H new ATOM 0 HA2 GLY A 128 23.253 -26.824 21.755 1.00 0.00 H new ATOM 0 HA3 GLY A 128 23.915 -26.124 20.291 1.00 0.00 H new TER 1845 GLY A 128