USER MOD reduce.3.24.130724 H: found=0, std=0, add=658, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 656 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 28 MET CE :methyl -135:sc= -3.45! (180deg=-1.43) USER MOD Set 1.2: A 33 SER OG : rot -150:sc= -2.94! 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 46:sc= 0.426 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 124:sc= 1.31 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -150:sc= -0.682 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -3.64! K(o=-3.6!,f=-0.39) USER MOD Single : A 45 GLN : amide:sc= -0.648 K(o=-0.65,f=-2.9!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 12:sc= -6.32! USER MOD Single : A 51 TYR OH : rot -158:sc= -2.04! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -162:sc= -1.21 USER MOD Single : A 65 THR OG1 : rot -145:sc= -7.87! USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 75:sc= 1.17 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.060 -0.880 7.464 1.00 0.00 N ATOM 2 CA GLY A 1 27.311 -1.569 7.730 1.00 0.00 C ATOM 3 C GLY A 1 27.598 -2.619 6.655 1.00 0.00 C ATOM 4 O GLY A 1 27.533 -2.326 5.463 1.00 0.00 O ATOM 0 H1 GLY A 1 25.888 -0.173 8.207 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.115 -0.405 6.540 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.280 -1.568 7.454 1.00 0.00 H new ATOM 0 HA2 GLY A 1 28.127 -0.847 7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.266 -2.048 8.708 1.00 0.00 H new ATOM 8 N SER A 2 27.910 -3.822 7.117 1.00 0.00 N ATOM 9 CA SER A 2 28.207 -4.917 6.209 1.00 0.00 C ATOM 10 C SER A 2 26.980 -5.236 5.354 1.00 0.00 C ATOM 11 O SER A 2 27.042 -5.177 4.126 1.00 0.00 O ATOM 12 CB SER A 2 28.656 -6.162 6.977 1.00 0.00 C ATOM 13 OG SER A 2 29.937 -5.986 7.578 1.00 0.00 O ATOM 0 H SER A 2 27.963 -4.062 8.107 1.00 0.00 H new ATOM 0 HA SER A 2 29.025 -4.609 5.558 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.923 -6.396 7.749 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.688 -7.015 6.299 1.00 0.00 H new ATOM 0 HG SER A 2 30.187 -6.802 8.060 1.00 0.00 H new ATOM 19 N SER A 3 25.892 -5.566 6.035 1.00 0.00 N ATOM 20 CA SER A 3 24.652 -5.893 5.352 1.00 0.00 C ATOM 21 C SER A 3 24.275 -4.770 4.384 1.00 0.00 C ATOM 22 O SER A 3 24.267 -3.599 4.760 1.00 0.00 O ATOM 23 CB SER A 3 23.520 -6.135 6.353 1.00 0.00 C ATOM 24 OG SER A 3 22.527 -7.014 5.833 1.00 0.00 O ATOM 0 H SER A 3 25.844 -5.614 7.053 1.00 0.00 H new ATOM 0 HA SER A 3 24.804 -6.813 4.788 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.931 -6.555 7.271 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.059 -5.183 6.617 1.00 0.00 H new ATOM 0 HG SER A 3 21.823 -7.145 6.502 1.00 0.00 H new ATOM 30 N GLY A 4 23.972 -5.167 3.157 1.00 0.00 N ATOM 31 CA GLY A 4 23.595 -4.208 2.132 1.00 0.00 C ATOM 32 C GLY A 4 22.824 -4.890 1.001 1.00 0.00 C ATOM 33 O GLY A 4 21.923 -5.689 1.252 1.00 0.00 O ATOM 0 H GLY A 4 23.980 -6.139 2.849 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.982 -3.422 2.572 1.00 0.00 H new ATOM 0 HA3 GLY A 4 24.488 -3.729 1.731 1.00 0.00 H new ATOM 37 N SER A 5 23.205 -4.550 -0.221 1.00 0.00 N ATOM 38 CA SER A 5 22.561 -5.119 -1.393 1.00 0.00 C ATOM 39 C SER A 5 21.086 -4.715 -1.426 1.00 0.00 C ATOM 40 O SER A 5 20.402 -4.760 -0.405 1.00 0.00 O ATOM 41 CB SER A 5 22.694 -6.644 -1.408 1.00 0.00 C ATOM 42 OG SER A 5 22.248 -7.206 -2.639 1.00 0.00 O ATOM 0 H SER A 5 23.952 -3.887 -0.426 1.00 0.00 H new ATOM 0 HA SER A 5 23.058 -4.729 -2.281 1.00 0.00 H new ATOM 0 HB2 SER A 5 23.735 -6.919 -1.240 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.116 -7.067 -0.586 1.00 0.00 H new ATOM 0 HG SER A 5 22.350 -8.180 -2.610 1.00 0.00 H new ATOM 48 N SER A 6 20.638 -4.329 -2.612 1.00 0.00 N ATOM 49 CA SER A 6 19.256 -3.917 -2.792 1.00 0.00 C ATOM 50 C SER A 6 18.330 -5.130 -2.682 1.00 0.00 C ATOM 51 O SER A 6 18.214 -5.915 -3.622 1.00 0.00 O ATOM 52 CB SER A 6 19.061 -3.221 -4.141 1.00 0.00 C ATOM 53 OG SER A 6 19.521 -4.020 -5.226 1.00 0.00 O ATOM 0 H SER A 6 21.207 -4.293 -3.457 1.00 0.00 H new ATOM 0 HA SER A 6 19.006 -3.205 -2.006 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.004 -2.993 -4.282 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.595 -2.271 -4.139 1.00 0.00 H new ATOM 0 HG SER A 6 19.197 -4.938 -5.116 1.00 0.00 H new ATOM 59 N GLY A 7 17.694 -5.245 -1.526 1.00 0.00 N ATOM 60 CA GLY A 7 16.781 -6.349 -1.281 1.00 0.00 C ATOM 61 C GLY A 7 16.012 -6.145 0.026 1.00 0.00 C ATOM 62 O GLY A 7 16.458 -5.408 0.904 1.00 0.00 O ATOM 0 H GLY A 7 17.793 -4.592 -0.748 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.079 -6.436 -2.110 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.339 -7.284 -1.237 1.00 0.00 H new ATOM 66 N GLY A 8 14.870 -6.812 0.114 1.00 0.00 N ATOM 67 CA GLY A 8 14.035 -6.713 1.299 1.00 0.00 C ATOM 68 C GLY A 8 13.207 -5.426 1.280 1.00 0.00 C ATOM 69 O GLY A 8 13.376 -4.563 2.140 1.00 0.00 O ATOM 0 H GLY A 8 14.504 -7.423 -0.616 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.371 -7.576 1.354 1.00 0.00 H new ATOM 0 HA3 GLY A 8 14.660 -6.734 2.192 1.00 0.00 H new ATOM 73 N THR A 9 12.331 -5.338 0.290 1.00 0.00 N ATOM 74 CA THR A 9 11.477 -4.172 0.148 1.00 0.00 C ATOM 75 C THR A 9 10.183 -4.544 -0.579 1.00 0.00 C ATOM 76 O THR A 9 10.065 -5.641 -1.122 1.00 0.00 O ATOM 77 CB THR A 9 12.280 -3.081 -0.561 1.00 0.00 C ATOM 78 OG1 THR A 9 12.956 -3.772 -1.608 1.00 0.00 O ATOM 79 CG2 THR A 9 13.410 -2.526 0.309 1.00 0.00 C ATOM 0 H THR A 9 12.194 -6.056 -0.422 1.00 0.00 H new ATOM 0 HA THR A 9 11.168 -3.788 1.120 1.00 0.00 H new ATOM 0 HB THR A 9 11.612 -2.269 -0.850 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.500 -3.138 -2.120 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.948 -1.755 -0.242 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.991 -2.096 1.219 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.097 -3.331 0.571 1.00 0.00 H new ATOM 87 N VAL A 10 9.245 -3.608 -0.567 1.00 0.00 N ATOM 88 CA VAL A 10 7.964 -3.824 -1.218 1.00 0.00 C ATOM 89 C VAL A 10 7.570 -2.562 -1.988 1.00 0.00 C ATOM 90 O VAL A 10 7.760 -1.448 -1.501 1.00 0.00 O ATOM 91 CB VAL A 10 6.917 -4.247 -0.187 1.00 0.00 C ATOM 92 CG1 VAL A 10 5.519 -4.285 -0.809 1.00 0.00 C ATOM 93 CG2 VAL A 10 7.276 -5.596 0.438 1.00 0.00 C ATOM 0 H VAL A 10 9.347 -2.698 -0.117 1.00 0.00 H new ATOM 0 HA VAL A 10 8.035 -4.637 -1.940 1.00 0.00 H new ATOM 0 HB VAL A 10 6.910 -3.501 0.608 1.00 0.00 H new ATOM 0 HG11 VAL A 10 4.793 -4.589 -0.055 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.260 -3.295 -1.183 1.00 0.00 H new ATOM 0 HG13 VAL A 10 5.506 -4.999 -1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.515 -5.873 1.168 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.326 -6.356 -0.341 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.244 -5.521 0.934 1.00 0.00 H new ATOM 103 N LYS A 11 7.028 -2.778 -3.178 1.00 0.00 N ATOM 104 CA LYS A 11 6.605 -1.671 -4.019 1.00 0.00 C ATOM 105 C LYS A 11 5.188 -1.250 -3.626 1.00 0.00 C ATOM 106 O LYS A 11 4.276 -2.075 -3.597 1.00 0.00 O ATOM 107 CB LYS A 11 6.750 -2.037 -5.498 1.00 0.00 C ATOM 108 CG LYS A 11 8.217 -2.266 -5.865 1.00 0.00 C ATOM 109 CD LYS A 11 8.360 -3.417 -6.863 1.00 0.00 C ATOM 110 CE LYS A 11 9.831 -3.685 -7.185 1.00 0.00 C ATOM 111 NZ LYS A 11 9.959 -4.388 -8.481 1.00 0.00 N ATOM 0 H LYS A 11 6.872 -3.703 -3.579 1.00 0.00 H new ATOM 0 HA LYS A 11 7.249 -0.806 -3.863 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.173 -2.937 -5.712 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.337 -1.240 -6.116 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.635 -1.355 -6.293 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.790 -2.487 -4.965 1.00 0.00 H new ATOM 0 HD2 LYS A 11 7.904 -4.318 -6.452 1.00 0.00 H new ATOM 0 HD3 LYS A 11 7.821 -3.177 -7.780 1.00 0.00 H new ATOM 0 HE2 LYS A 11 10.379 -2.743 -7.220 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.279 -4.285 -6.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 10.964 -4.562 -8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 9.453 -5.295 -8.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 9.550 -3.801 -9.236 1.00 0.00 H new ATOM 125 N VAL A 12 5.046 0.035 -3.334 1.00 0.00 N ATOM 126 CA VAL A 12 3.755 0.576 -2.944 1.00 0.00 C ATOM 127 C VAL A 12 3.254 1.525 -4.035 1.00 0.00 C ATOM 128 O VAL A 12 3.815 2.602 -4.230 1.00 0.00 O ATOM 129 CB VAL A 12 3.861 1.244 -1.572 1.00 0.00 C ATOM 130 CG1 VAL A 12 2.583 2.016 -1.239 1.00 0.00 C ATOM 131 CG2 VAL A 12 4.180 0.217 -0.485 1.00 0.00 C ATOM 0 H VAL A 12 5.804 0.717 -3.360 1.00 0.00 H new ATOM 0 HA VAL A 12 3.020 -0.223 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 12 4.684 1.958 -1.609 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.684 2.481 -0.259 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.417 2.787 -1.991 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.736 1.330 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.250 0.719 0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.389 -0.532 -0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.129 -0.269 -0.711 1.00 0.00 H new ATOM 141 N TYR A 13 2.204 1.091 -4.716 1.00 0.00 N ATOM 142 CA TYR A 13 1.622 1.888 -5.782 1.00 0.00 C ATOM 143 C TYR A 13 0.746 3.007 -5.213 1.00 0.00 C ATOM 144 O TYR A 13 -0.258 2.740 -4.554 1.00 0.00 O ATOM 145 CB TYR A 13 0.745 0.932 -6.593 1.00 0.00 C ATOM 146 CG TYR A 13 1.534 -0.048 -7.464 1.00 0.00 C ATOM 147 CD1 TYR A 13 2.422 0.428 -8.406 1.00 0.00 C ATOM 148 CD2 TYR A 13 1.356 -1.407 -7.307 1.00 0.00 C ATOM 149 CE1 TYR A 13 3.165 -0.495 -9.226 1.00 0.00 C ATOM 150 CE2 TYR A 13 2.098 -2.330 -8.126 1.00 0.00 C ATOM 151 CZ TYR A 13 2.966 -1.828 -9.045 1.00 0.00 C ATOM 152 OH TYR A 13 3.667 -2.699 -9.819 1.00 0.00 O ATOM 0 H TYR A 13 1.741 0.197 -4.550 1.00 0.00 H new ATOM 0 HA TYR A 13 2.403 2.352 -6.385 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.113 0.366 -5.909 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.082 1.516 -7.231 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.560 1.492 -8.529 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.660 -1.779 -6.570 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.864 -0.136 -9.967 1.00 0.00 H new ATOM 0 HE2 TYR A 13 1.968 -3.396 -8.013 1.00 0.00 H new ATOM 0 HH TYR A 13 4.167 -3.316 -9.246 1.00 0.00 H new ATOM 162 N LEU A 14 1.157 4.235 -5.489 1.00 0.00 N ATOM 163 CA LEU A 14 0.422 5.395 -5.014 1.00 0.00 C ATOM 164 C LEU A 14 -0.638 5.781 -6.047 1.00 0.00 C ATOM 165 O LEU A 14 -0.543 5.397 -7.212 1.00 0.00 O ATOM 166 CB LEU A 14 1.384 6.533 -4.665 1.00 0.00 C ATOM 167 CG LEU A 14 1.924 6.540 -3.233 1.00 0.00 C ATOM 168 CD1 LEU A 14 3.156 7.440 -3.116 1.00 0.00 C ATOM 169 CD2 LEU A 14 0.831 6.931 -2.237 1.00 0.00 C ATOM 0 H LEU A 14 1.990 4.453 -6.036 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.105 5.159 -4.090 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.230 6.490 -5.351 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.875 7.480 -4.845 1.00 0.00 H new ATOM 0 HG LEU A 14 2.240 5.528 -2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.520 7.427 -2.089 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.938 7.075 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.889 8.460 -3.394 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.241 6.928 -1.227 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.461 7.928 -2.476 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.011 6.216 -2.297 1.00 0.00 H new ATOM 181 N PRO A 15 -1.649 6.556 -5.572 1.00 0.00 N ATOM 182 CA PRO A 15 -2.725 6.998 -6.441 1.00 0.00 C ATOM 183 C PRO A 15 -2.255 8.121 -7.369 1.00 0.00 C ATOM 184 O PRO A 15 -2.660 9.272 -7.212 1.00 0.00 O ATOM 185 CB PRO A 15 -3.838 7.433 -5.501 1.00 0.00 C ATOM 186 CG PRO A 15 -3.178 7.656 -4.150 1.00 0.00 C ATOM 187 CD PRO A 15 -1.793 7.031 -4.199 1.00 0.00 C ATOM 0 HA PRO A 15 -3.072 6.212 -7.112 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.316 8.345 -5.858 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -4.614 6.671 -5.436 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -3.108 8.721 -3.930 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -3.773 7.205 -3.356 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -1.021 7.759 -3.949 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -1.703 6.212 -3.485 1.00 0.00 H new ATOM 195 N ASN A 16 -1.407 7.746 -8.316 1.00 0.00 N ATOM 196 CA ASN A 16 -0.878 8.706 -9.269 1.00 0.00 C ATOM 197 C ASN A 16 0.179 8.024 -10.140 1.00 0.00 C ATOM 198 O ASN A 16 1.293 8.527 -10.280 1.00 0.00 O ATOM 199 CB ASN A 16 -0.212 9.883 -8.553 1.00 0.00 C ATOM 200 CG ASN A 16 -0.461 11.193 -9.303 1.00 0.00 C ATOM 201 OD1 ASN A 16 -1.493 11.829 -9.168 1.00 0.00 O ATOM 202 ND2 ASN A 16 0.540 11.560 -10.098 1.00 0.00 N ATOM 0 H ASN A 16 -1.074 6.790 -8.443 1.00 0.00 H new ATOM 0 HA ASN A 16 -1.708 9.073 -9.873 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -0.600 9.962 -7.537 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.860 9.704 -8.472 1.00 0.00 H new ATOM 0 HD21 ASN A 16 0.471 12.421 -10.641 1.00 0.00 H new ATOM 0 HD22 ASN A 16 1.377 10.981 -10.165 1.00 0.00 H new ATOM 209 N LYS A 17 -0.208 6.889 -10.704 1.00 0.00 N ATOM 210 CA LYS A 17 0.692 6.133 -11.558 1.00 0.00 C ATOM 211 C LYS A 17 2.106 6.187 -10.976 1.00 0.00 C ATOM 212 O LYS A 17 3.088 6.147 -11.716 1.00 0.00 O ATOM 213 CB LYS A 17 0.602 6.628 -13.003 1.00 0.00 C ATOM 214 CG LYS A 17 1.651 7.708 -13.278 1.00 0.00 C ATOM 215 CD LYS A 17 1.196 8.639 -14.404 1.00 0.00 C ATOM 216 CE LYS A 17 1.174 10.095 -13.935 1.00 0.00 C ATOM 217 NZ LYS A 17 -0.175 10.463 -13.450 1.00 0.00 N ATOM 0 H LYS A 17 -1.133 6.475 -10.586 1.00 0.00 H new ATOM 0 HA LYS A 17 0.399 5.084 -11.586 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.747 5.792 -13.687 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -0.394 7.027 -13.193 1.00 0.00 H new ATOM 0 HG2 LYS A 17 1.828 8.287 -12.372 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.598 7.240 -13.548 1.00 0.00 H new ATOM 0 HD2 LYS A 17 1.866 8.538 -15.258 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.202 8.347 -14.743 1.00 0.00 H new ATOM 0 HE2 LYS A 17 1.905 10.238 -13.139 1.00 0.00 H new ATOM 0 HE3 LYS A 17 1.464 10.752 -14.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -0.172 11.454 -13.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -0.865 10.346 -14.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -0.437 9.848 -12.654 1.00 0.00 H new ATOM 231 N GLN A 18 2.165 6.276 -9.655 1.00 0.00 N ATOM 232 CA GLN A 18 3.442 6.336 -8.966 1.00 0.00 C ATOM 233 C GLN A 18 3.601 5.131 -8.037 1.00 0.00 C ATOM 234 O GLN A 18 2.625 4.451 -7.724 1.00 0.00 O ATOM 235 CB GLN A 18 3.587 7.648 -8.192 1.00 0.00 C ATOM 236 CG GLN A 18 4.032 8.783 -9.115 1.00 0.00 C ATOM 237 CD GLN A 18 5.087 9.660 -8.437 1.00 0.00 C ATOM 238 OE1 GLN A 18 4.783 10.597 -7.718 1.00 0.00 O ATOM 239 NE2 GLN A 18 6.340 9.304 -8.707 1.00 0.00 N ATOM 0 H GLN A 18 1.349 6.308 -9.044 1.00 0.00 H new ATOM 0 HA GLN A 18 4.236 6.303 -9.712 1.00 0.00 H new ATOM 0 HB2 GLN A 18 2.636 7.906 -7.725 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.313 7.522 -7.389 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.437 8.368 -10.038 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.171 9.391 -9.390 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.524 8.508 -9.318 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.117 9.827 -8.303 1.00 0.00 H new ATOM 248 N ARG A 19 4.838 4.903 -7.621 1.00 0.00 N ATOM 249 CA ARG A 19 5.137 3.792 -6.734 1.00 0.00 C ATOM 250 C ARG A 19 6.316 4.141 -5.824 1.00 0.00 C ATOM 251 O ARG A 19 7.191 4.917 -6.205 1.00 0.00 O ATOM 252 CB ARG A 19 5.472 2.528 -7.528 1.00 0.00 C ATOM 253 CG ARG A 19 6.562 2.805 -8.565 1.00 0.00 C ATOM 254 CD ARG A 19 7.528 1.623 -8.675 1.00 0.00 C ATOM 255 NE ARG A 19 8.925 2.098 -8.560 1.00 0.00 N ATOM 256 CZ ARG A 19 9.966 1.306 -8.270 1.00 0.00 C ATOM 257 NH1 ARG A 19 9.775 -0.004 -8.063 1.00 0.00 N ATOM 258 NH2 ARG A 19 11.199 1.825 -8.186 1.00 0.00 N ATOM 0 H ARG A 19 5.645 5.469 -7.882 1.00 0.00 H new ATOM 0 HA ARG A 19 4.250 3.603 -6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.803 1.744 -6.847 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.576 2.159 -8.027 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.105 2.997 -9.536 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.112 3.704 -8.288 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.317 0.896 -7.891 1.00 0.00 H new ATOM 0 HD3 ARG A 19 7.386 1.114 -9.628 1.00 0.00 H new ATOM 0 HE ARG A 19 9.107 3.090 -8.711 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.837 -0.399 -8.126 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.568 -0.606 -7.842 1.00 0.00 H new ATOM 0 HH21 ARG A 19 11.344 2.822 -8.343 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.992 1.223 -7.965 1.00 0.00 H new ATOM 272 N THR A 20 6.302 3.551 -4.638 1.00 0.00 N ATOM 273 CA THR A 20 7.359 3.791 -3.670 1.00 0.00 C ATOM 274 C THR A 20 7.749 2.486 -2.972 1.00 0.00 C ATOM 275 O THR A 20 6.893 1.788 -2.431 1.00 0.00 O ATOM 276 CB THR A 20 6.879 4.876 -2.705 1.00 0.00 C ATOM 277 OG1 THR A 20 8.076 5.353 -2.095 1.00 0.00 O ATOM 278 CG2 THR A 20 6.069 4.307 -1.539 1.00 0.00 C ATOM 0 H THR A 20 5.575 2.907 -4.325 1.00 0.00 H new ATOM 0 HA THR A 20 8.267 4.147 -4.156 1.00 0.00 H new ATOM 0 HB THR A 20 6.273 5.601 -3.248 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.857 6.062 -1.455 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.753 5.120 -0.885 1.00 0.00 H new ATOM 0 HG22 THR A 20 5.191 3.789 -1.925 1.00 0.00 H new ATOM 0 HG23 THR A 20 6.685 3.606 -0.976 1.00 0.00 H new ATOM 286 N VAL A 21 9.041 2.197 -3.008 1.00 0.00 N ATOM 287 CA VAL A 21 9.555 0.988 -2.385 1.00 0.00 C ATOM 288 C VAL A 21 9.788 1.247 -0.895 1.00 0.00 C ATOM 289 O VAL A 21 10.506 2.175 -0.528 1.00 0.00 O ATOM 290 CB VAL A 21 10.815 0.519 -3.115 1.00 0.00 C ATOM 291 CG1 VAL A 21 10.991 -0.996 -2.985 1.00 0.00 C ATOM 292 CG2 VAL A 21 10.788 0.944 -4.585 1.00 0.00 C ATOM 0 H VAL A 21 9.748 2.778 -3.458 1.00 0.00 H new ATOM 0 HA VAL A 21 8.829 0.179 -2.464 1.00 0.00 H new ATOM 0 HB VAL A 21 11.673 0.998 -2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 21 11.894 -1.304 -3.513 1.00 0.00 H new ATOM 0 HG12 VAL A 21 11.077 -1.263 -1.932 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.128 -1.501 -3.418 1.00 0.00 H new ATOM 0 HG21 VAL A 21 11.695 0.598 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 21 9.918 0.506 -5.074 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.732 2.031 -4.649 1.00 0.00 H new ATOM 302 N VAL A 22 9.167 0.409 -0.078 1.00 0.00 N ATOM 303 CA VAL A 22 9.299 0.535 1.364 1.00 0.00 C ATOM 304 C VAL A 22 9.961 -0.726 1.923 1.00 0.00 C ATOM 305 O VAL A 22 9.831 -1.806 1.350 1.00 0.00 O ATOM 306 CB VAL A 22 7.932 0.821 1.990 1.00 0.00 C ATOM 307 CG1 VAL A 22 8.081 1.282 3.442 1.00 0.00 C ATOM 308 CG2 VAL A 22 7.155 1.849 1.165 1.00 0.00 C ATOM 0 H VAL A 22 8.571 -0.359 -0.387 1.00 0.00 H new ATOM 0 HA VAL A 22 9.941 1.378 1.618 1.00 0.00 H new ATOM 0 HB VAL A 22 7.362 -0.108 1.990 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.096 1.479 3.864 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.575 0.503 4.022 1.00 0.00 H new ATOM 0 HG13 VAL A 22 8.678 2.193 3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.188 2.034 1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.720 2.780 1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 22 7.004 1.466 0.156 1.00 0.00 H new ATOM 318 N THR A 23 10.656 -0.546 3.037 1.00 0.00 N ATOM 319 CA THR A 23 11.339 -1.655 3.680 1.00 0.00 C ATOM 320 C THR A 23 10.328 -2.583 4.358 1.00 0.00 C ATOM 321 O THR A 23 9.257 -2.143 4.772 1.00 0.00 O ATOM 322 CB THR A 23 12.374 -1.077 4.647 1.00 0.00 C ATOM 323 OG1 THR A 23 13.148 -0.194 3.838 1.00 0.00 O ATOM 324 CG2 THR A 23 13.381 -2.125 5.123 1.00 0.00 C ATOM 0 H THR A 23 10.761 0.351 3.510 1.00 0.00 H new ATOM 0 HA THR A 23 11.863 -2.272 2.950 1.00 0.00 H new ATOM 0 HB THR A 23 11.865 -0.646 5.509 1.00 0.00 H new ATOM 0 HG1 THR A 23 13.843 0.227 4.386 1.00 0.00 H new ATOM 0 HG21 THR A 23 14.092 -1.662 5.807 1.00 0.00 H new ATOM 0 HG22 THR A 23 12.854 -2.929 5.637 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.915 -2.532 4.265 1.00 0.00 H new ATOM 332 N VAL A 24 10.704 -3.850 4.448 1.00 0.00 N ATOM 333 CA VAL A 24 9.844 -4.843 5.068 1.00 0.00 C ATOM 334 C VAL A 24 10.294 -5.073 6.512 1.00 0.00 C ATOM 335 O VAL A 24 11.355 -5.647 6.751 1.00 0.00 O ATOM 336 CB VAL A 24 9.839 -6.125 4.233 1.00 0.00 C ATOM 337 CG1 VAL A 24 8.569 -6.940 4.486 1.00 0.00 C ATOM 338 CG2 VAL A 24 10.001 -5.810 2.744 1.00 0.00 C ATOM 0 H VAL A 24 11.593 -4.212 4.102 1.00 0.00 H new ATOM 0 HA VAL A 24 8.814 -4.488 5.102 1.00 0.00 H new ATOM 0 HB VAL A 24 10.692 -6.729 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.591 -7.846 3.880 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.514 -7.210 5.541 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.696 -6.345 4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.994 -6.738 2.173 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.178 -5.175 2.415 1.00 0.00 H new ATOM 0 HG23 VAL A 24 10.946 -5.292 2.583 1.00 0.00 H new ATOM 348 N ARG A 25 9.466 -4.611 7.437 1.00 0.00 N ATOM 349 CA ARG A 25 9.766 -4.759 8.851 1.00 0.00 C ATOM 350 C ARG A 25 8.816 -5.773 9.492 1.00 0.00 C ATOM 351 O ARG A 25 8.248 -6.618 8.803 1.00 0.00 O ATOM 352 CB ARG A 25 9.642 -3.421 9.583 1.00 0.00 C ATOM 353 CG ARG A 25 10.232 -2.283 8.748 1.00 0.00 C ATOM 354 CD ARG A 25 11.082 -1.351 9.614 1.00 0.00 C ATOM 355 NE ARG A 25 12.333 -1.003 8.905 1.00 0.00 N ATOM 356 CZ ARG A 25 13.418 -0.492 9.504 1.00 0.00 C ATOM 357 NH1 ARG A 25 13.411 -0.267 10.824 1.00 0.00 N ATOM 358 NH2 ARG A 25 14.510 -0.206 8.781 1.00 0.00 N ATOM 0 H ARG A 25 8.587 -4.134 7.235 1.00 0.00 H new ATOM 0 HA ARG A 25 10.793 -5.114 8.937 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.593 -3.215 9.796 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.157 -3.478 10.542 1.00 0.00 H new ATOM 0 HG2 ARG A 25 10.842 -2.695 7.944 1.00 0.00 H new ATOM 0 HG3 ARG A 25 9.428 -1.716 8.279 1.00 0.00 H new ATOM 0 HD2 ARG A 25 10.522 -0.445 9.846 1.00 0.00 H new ATOM 0 HD3 ARG A 25 11.314 -1.834 10.563 1.00 0.00 H new ATOM 0 HE ARG A 25 12.372 -1.162 7.898 1.00 0.00 H new ATOM 0 HH11 ARG A 25 12.580 -0.484 11.374 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.237 0.122 11.279 1.00 0.00 H new ATOM 0 HH21 ARG A 25 14.515 -0.377 7.775 1.00 0.00 H new ATOM 0 HH22 ARG A 25 15.336 0.183 9.236 1.00 0.00 H new ATOM 372 N ASP A 26 8.673 -5.654 10.804 1.00 0.00 N ATOM 373 CA ASP A 26 7.802 -6.550 11.546 1.00 0.00 C ATOM 374 C ASP A 26 7.175 -5.791 12.717 1.00 0.00 C ATOM 375 O ASP A 26 5.965 -5.857 12.927 1.00 0.00 O ATOM 376 CB ASP A 26 8.585 -7.734 12.115 1.00 0.00 C ATOM 377 CG ASP A 26 7.726 -8.859 12.695 1.00 0.00 C ATOM 378 OD1 ASP A 26 6.912 -8.547 13.591 1.00 0.00 O ATOM 379 OD2 ASP A 26 7.903 -10.006 12.230 1.00 0.00 O ATOM 0 H ASP A 26 9.146 -4.951 11.372 1.00 0.00 H new ATOM 0 HA ASP A 26 7.037 -6.919 10.863 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.214 -8.147 11.326 1.00 0.00 H new ATOM 0 HB3 ASP A 26 9.252 -7.368 12.895 1.00 0.00 H new ATOM 384 N GLY A 27 8.027 -5.087 13.448 1.00 0.00 N ATOM 385 CA GLY A 27 7.571 -4.316 14.593 1.00 0.00 C ATOM 386 C GLY A 27 6.855 -3.041 14.145 1.00 0.00 C ATOM 387 O GLY A 27 7.257 -1.937 14.510 1.00 0.00 O ATOM 0 H GLY A 27 9.030 -5.034 13.270 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.897 -4.922 15.199 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.421 -4.057 15.224 1.00 0.00 H new ATOM 391 N MET A 28 5.806 -3.234 13.359 1.00 0.00 N ATOM 392 CA MET A 28 5.030 -2.113 12.857 1.00 0.00 C ATOM 393 C MET A 28 3.837 -2.598 12.030 1.00 0.00 C ATOM 394 O MET A 28 3.842 -3.720 11.526 1.00 0.00 O ATOM 395 CB MET A 28 5.922 -1.221 11.993 1.00 0.00 C ATOM 396 CG MET A 28 6.084 -1.804 10.587 1.00 0.00 C ATOM 397 SD MET A 28 7.388 -0.949 9.718 1.00 0.00 S ATOM 398 CE MET A 28 6.548 0.575 9.320 1.00 0.00 C ATOM 0 H MET A 28 5.475 -4.151 13.057 1.00 0.00 H new ATOM 0 HA MET A 28 4.651 -1.547 13.708 1.00 0.00 H new ATOM 0 HB2 MET A 28 5.490 -0.222 11.929 1.00 0.00 H new ATOM 0 HB3 MET A 28 6.900 -1.116 12.462 1.00 0.00 H new ATOM 0 HG2 MET A 28 6.314 -2.868 10.650 1.00 0.00 H new ATOM 0 HG3 MET A 28 5.148 -1.712 10.036 1.00 0.00 H new ATOM 0 HE1 MET A 28 6.748 0.840 8.282 1.00 0.00 H new ATOM 0 HE2 MET A 28 5.475 0.447 9.461 1.00 0.00 H new ATOM 0 HE3 MET A 28 6.907 1.370 9.973 1.00 0.00 H new ATOM 408 N SER A 29 2.845 -1.728 11.915 1.00 0.00 N ATOM 409 CA SER A 29 1.648 -2.054 11.158 1.00 0.00 C ATOM 410 C SER A 29 1.721 -1.420 9.767 1.00 0.00 C ATOM 411 O SER A 29 2.723 -0.799 9.415 1.00 0.00 O ATOM 412 CB SER A 29 0.389 -1.586 11.889 1.00 0.00 C ATOM 413 OG SER A 29 0.105 -0.212 11.638 1.00 0.00 O ATOM 0 H SER A 29 2.845 -0.798 12.333 1.00 0.00 H new ATOM 0 HA SER A 29 1.593 -3.138 11.055 1.00 0.00 H new ATOM 0 HB2 SER A 29 -0.459 -2.195 11.576 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.514 -1.740 12.961 1.00 0.00 H new ATOM 0 HG SER A 29 -0.351 0.175 12.414 1.00 0.00 H new ATOM 419 N VAL A 30 0.646 -1.598 9.014 1.00 0.00 N ATOM 420 CA VAL A 30 0.575 -1.051 7.669 1.00 0.00 C ATOM 421 C VAL A 30 0.364 0.462 7.749 1.00 0.00 C ATOM 422 O VAL A 30 0.856 1.207 6.903 1.00 0.00 O ATOM 423 CB VAL A 30 -0.517 -1.765 6.871 1.00 0.00 C ATOM 424 CG1 VAL A 30 -0.748 -1.079 5.523 1.00 0.00 C ATOM 425 CG2 VAL A 30 -0.179 -3.246 6.681 1.00 0.00 C ATOM 0 H VAL A 30 -0.183 -2.113 9.309 1.00 0.00 H new ATOM 0 HA VAL A 30 1.511 -1.221 7.138 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.443 -1.703 7.442 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.529 -1.606 4.975 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.055 -0.046 5.688 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.175 -1.095 4.944 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.972 -3.730 6.111 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.764 -3.338 6.142 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.088 -3.726 7.655 1.00 0.00 H new ATOM 435 N TYR A 31 -0.368 0.872 8.775 1.00 0.00 N ATOM 436 CA TYR A 31 -0.650 2.283 8.977 1.00 0.00 C ATOM 437 C TYR A 31 0.644 3.082 9.147 1.00 0.00 C ATOM 438 O TYR A 31 0.918 3.998 8.373 1.00 0.00 O ATOM 439 CB TYR A 31 -1.462 2.370 10.270 1.00 0.00 C ATOM 440 CG TYR A 31 -1.468 3.760 10.909 1.00 0.00 C ATOM 441 CD1 TYR A 31 -2.387 4.704 10.500 1.00 0.00 C ATOM 442 CD2 TYR A 31 -0.553 4.069 11.896 1.00 0.00 C ATOM 443 CE1 TYR A 31 -2.392 6.013 11.102 1.00 0.00 C ATOM 444 CE2 TYR A 31 -0.558 5.378 12.497 1.00 0.00 C ATOM 445 CZ TYR A 31 -1.477 6.285 12.071 1.00 0.00 C ATOM 446 OH TYR A 31 -1.482 7.520 12.639 1.00 0.00 O ATOM 0 H TYR A 31 -0.774 0.251 9.475 1.00 0.00 H new ATOM 0 HA TYR A 31 -1.183 2.694 8.120 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.490 2.073 10.062 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -1.062 1.653 10.987 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.103 4.462 9.728 1.00 0.00 H new ATOM 0 HD2 TYR A 31 0.166 3.330 12.217 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -3.106 6.761 10.791 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.153 5.633 13.269 1.00 0.00 H new ATOM 0 HH TYR A 31 -0.775 7.572 13.316 1.00 0.00 H new ATOM 456 N ASP A 32 1.405 2.705 10.164 1.00 0.00 N ATOM 457 CA ASP A 32 2.663 3.375 10.445 1.00 0.00 C ATOM 458 C ASP A 32 3.608 3.197 9.255 1.00 0.00 C ATOM 459 O ASP A 32 4.532 3.987 9.068 1.00 0.00 O ATOM 460 CB ASP A 32 3.341 2.778 11.680 1.00 0.00 C ATOM 461 CG ASP A 32 2.728 3.194 13.019 1.00 0.00 C ATOM 462 OD1 ASP A 32 3.174 4.235 13.547 1.00 0.00 O ATOM 463 OD2 ASP A 32 1.828 2.462 13.483 1.00 0.00 O ATOM 0 H ASP A 32 1.175 1.944 10.803 1.00 0.00 H new ATOM 0 HA ASP A 32 2.451 4.429 10.624 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.308 1.691 11.604 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.392 3.066 11.674 1.00 0.00 H new ATOM 468 N SER A 33 3.343 2.155 8.480 1.00 0.00 N ATOM 469 CA SER A 33 4.158 1.864 7.313 1.00 0.00 C ATOM 470 C SER A 33 3.763 2.784 6.156 1.00 0.00 C ATOM 471 O SER A 33 4.573 3.582 5.689 1.00 0.00 O ATOM 472 CB SER A 33 4.020 0.398 6.897 1.00 0.00 C ATOM 473 OG SER A 33 5.130 -0.386 7.325 1.00 0.00 O ATOM 0 H SER A 33 2.575 1.502 8.638 1.00 0.00 H new ATOM 0 HA SER A 33 5.202 2.044 7.571 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.102 -0.013 7.318 1.00 0.00 H new ATOM 0 HB3 SER A 33 3.929 0.336 5.813 1.00 0.00 H new ATOM 0 HG SER A 33 5.272 -1.124 6.696 1.00 0.00 H new ATOM 479 N LEU A 34 2.518 2.640 5.727 1.00 0.00 N ATOM 480 CA LEU A 34 2.005 3.448 4.633 1.00 0.00 C ATOM 481 C LEU A 34 1.889 4.904 5.091 1.00 0.00 C ATOM 482 O LEU A 34 1.735 5.806 4.269 1.00 0.00 O ATOM 483 CB LEU A 34 0.694 2.864 4.103 1.00 0.00 C ATOM 484 CG LEU A 34 0.822 1.875 2.942 1.00 0.00 C ATOM 485 CD1 LEU A 34 1.541 2.516 1.754 1.00 0.00 C ATOM 486 CD2 LEU A 34 1.502 0.582 3.395 1.00 0.00 C ATOM 0 H LEU A 34 1.849 1.976 6.117 1.00 0.00 H new ATOM 0 HA LEU A 34 2.697 3.432 3.791 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.183 2.364 4.926 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.055 3.687 3.784 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.181 1.610 2.607 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.619 1.793 0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.977 3.384 1.413 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.540 2.829 2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.580 -0.103 2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.499 0.808 3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.912 0.118 4.185 1.00 0.00 H new ATOM 498 N ASP A 35 1.968 5.087 6.401 1.00 0.00 N ATOM 499 CA ASP A 35 1.874 6.417 6.978 1.00 0.00 C ATOM 500 C ASP A 35 2.683 7.396 6.125 1.00 0.00 C ATOM 501 O ASP A 35 2.146 8.388 5.634 1.00 0.00 O ATOM 502 CB ASP A 35 2.443 6.443 8.397 1.00 0.00 C ATOM 503 CG ASP A 35 2.679 7.841 8.973 1.00 0.00 C ATOM 504 OD1 ASP A 35 1.808 8.706 8.740 1.00 0.00 O ATOM 505 OD2 ASP A 35 3.726 8.012 9.635 1.00 0.00 O ATOM 0 H ASP A 35 2.096 4.336 7.079 1.00 0.00 H new ATOM 0 HA ASP A 35 0.821 6.699 7.007 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.761 5.905 9.056 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.388 5.899 8.404 1.00 0.00 H new ATOM 510 N LYS A 36 3.962 7.084 5.976 1.00 0.00 N ATOM 511 CA LYS A 36 4.851 7.924 5.192 1.00 0.00 C ATOM 512 C LYS A 36 4.375 7.945 3.738 1.00 0.00 C ATOM 513 O LYS A 36 4.082 9.007 3.192 1.00 0.00 O ATOM 514 CB LYS A 36 6.303 7.469 5.357 1.00 0.00 C ATOM 515 CG LYS A 36 7.211 8.650 5.707 1.00 0.00 C ATOM 516 CD LYS A 36 8.527 8.578 4.930 1.00 0.00 C ATOM 517 CE LYS A 36 8.599 9.679 3.870 1.00 0.00 C ATOM 518 NZ LYS A 36 9.953 9.737 3.275 1.00 0.00 N ATOM 0 H LYS A 36 4.404 6.261 6.385 1.00 0.00 H new ATOM 0 HA LYS A 36 4.820 8.952 5.553 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.364 6.714 6.140 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.648 7.001 4.435 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.701 9.586 5.479 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.416 8.651 6.778 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.366 8.676 5.619 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.619 7.602 4.453 1.00 0.00 H new ATOM 0 HE2 LYS A 36 7.861 9.491 3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.351 10.641 4.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.985 10.489 2.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.651 9.938 4.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.176 8.824 2.829 1.00 0.00 H new ATOM 532 N ALA A 37 4.313 6.758 3.152 1.00 0.00 N ATOM 533 CA ALA A 37 3.878 6.627 1.772 1.00 0.00 C ATOM 534 C ALA A 37 2.720 7.593 1.513 1.00 0.00 C ATOM 535 O ALA A 37 2.547 8.074 0.394 1.00 0.00 O ATOM 536 CB ALA A 37 3.496 5.172 1.493 1.00 0.00 C ATOM 0 H ALA A 37 4.557 5.879 3.608 1.00 0.00 H new ATOM 0 HA ALA A 37 4.686 6.889 1.089 1.00 0.00 H new ATOM 0 HB1 ALA A 37 3.170 5.074 0.458 1.00 0.00 H new ATOM 0 HB2 ALA A 37 4.360 4.530 1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.686 4.874 2.159 1.00 0.00 H new ATOM 542 N LEU A 38 1.957 7.848 2.566 1.00 0.00 N ATOM 543 CA LEU A 38 0.821 8.748 2.466 1.00 0.00 C ATOM 544 C LEU A 38 1.281 10.178 2.756 1.00 0.00 C ATOM 545 O LEU A 38 1.212 11.045 1.886 1.00 0.00 O ATOM 546 CB LEU A 38 -0.319 8.274 3.370 1.00 0.00 C ATOM 547 CG LEU A 38 -0.936 6.919 3.016 1.00 0.00 C ATOM 548 CD1 LEU A 38 -2.234 6.689 3.792 1.00 0.00 C ATOM 549 CD2 LEU A 38 -1.141 6.788 1.505 1.00 0.00 C ATOM 0 H LEU A 38 2.103 7.447 3.492 1.00 0.00 H new ATOM 0 HA LEU A 38 0.418 8.742 1.453 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.052 8.226 4.394 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -1.108 9.026 3.352 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.238 6.137 3.315 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.652 5.719 3.522 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.027 6.710 4.862 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.949 7.474 3.546 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.581 5.816 1.280 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.808 7.577 1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.180 6.877 0.998 1.00 0.00 H new ATOM 561 N LYS A 39 1.741 10.380 3.982 1.00 0.00 N ATOM 562 CA LYS A 39 2.213 11.690 4.398 1.00 0.00 C ATOM 563 C LYS A 39 2.991 12.335 3.249 1.00 0.00 C ATOM 564 O LYS A 39 2.706 13.467 2.860 1.00 0.00 O ATOM 565 CB LYS A 39 3.012 11.584 5.698 1.00 0.00 C ATOM 566 CG LYS A 39 2.096 11.256 6.879 1.00 0.00 C ATOM 567 CD LYS A 39 2.346 12.211 8.048 1.00 0.00 C ATOM 568 CE LYS A 39 1.579 11.764 9.295 1.00 0.00 C ATOM 569 NZ LYS A 39 1.261 12.927 10.153 1.00 0.00 N ATOM 0 H LYS A 39 1.797 9.658 4.701 1.00 0.00 H new ATOM 0 HA LYS A 39 1.371 12.345 4.621 1.00 0.00 H new ATOM 0 HB2 LYS A 39 3.774 10.811 5.599 1.00 0.00 H new ATOM 0 HB3 LYS A 39 3.533 12.523 5.887 1.00 0.00 H new ATOM 0 HG2 LYS A 39 1.054 11.324 6.566 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.266 10.229 7.201 1.00 0.00 H new ATOM 0 HD2 LYS A 39 3.413 12.251 8.268 1.00 0.00 H new ATOM 0 HD3 LYS A 39 2.040 13.220 7.770 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.659 11.259 9.001 1.00 0.00 H new ATOM 0 HE3 LYS A 39 2.174 11.043 9.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 0.741 12.606 10.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 2.143 13.392 10.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 0.675 13.601 9.620 1.00 0.00 H new ATOM 583 N VAL A 40 3.959 11.588 2.739 1.00 0.00 N ATOM 584 CA VAL A 40 4.780 12.073 1.643 1.00 0.00 C ATOM 585 C VAL A 40 3.902 12.847 0.658 1.00 0.00 C ATOM 586 O VAL A 40 4.251 13.953 0.247 1.00 0.00 O ATOM 587 CB VAL A 40 5.525 10.906 0.991 1.00 0.00 C ATOM 588 CG1 VAL A 40 4.547 9.837 0.500 1.00 0.00 C ATOM 589 CG2 VAL A 40 6.420 11.396 -0.150 1.00 0.00 C ATOM 0 H VAL A 40 4.193 10.650 3.065 1.00 0.00 H new ATOM 0 HA VAL A 40 5.541 12.762 2.011 1.00 0.00 H new ATOM 0 HB VAL A 40 6.165 10.452 1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 40 5.102 9.019 0.041 1.00 0.00 H new ATOM 0 HG12 VAL A 40 3.971 9.456 1.343 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.870 10.273 -0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.938 10.547 -0.596 1.00 0.00 H new ATOM 0 HG22 VAL A 40 5.808 11.887 -0.907 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.152 12.104 0.240 1.00 0.00 H new ATOM 599 N ARG A 41 2.781 12.235 0.306 1.00 0.00 N ATOM 600 CA ARG A 41 1.851 12.853 -0.623 1.00 0.00 C ATOM 601 C ARG A 41 0.860 13.743 0.131 1.00 0.00 C ATOM 602 O ARG A 41 0.303 14.680 -0.440 1.00 0.00 O ATOM 603 CB ARG A 41 1.077 11.796 -1.413 1.00 0.00 C ATOM 604 CG ARG A 41 2.015 10.985 -2.309 1.00 0.00 C ATOM 605 CD ARG A 41 1.292 10.508 -3.570 1.00 0.00 C ATOM 606 NE ARG A 41 0.590 11.642 -4.211 1.00 0.00 N ATOM 607 CZ ARG A 41 -0.469 11.509 -5.021 1.00 0.00 C ATOM 608 NH1 ARG A 41 -0.955 10.290 -5.294 1.00 0.00 N ATOM 609 NH2 ARG A 41 -1.043 12.594 -5.558 1.00 0.00 N ATOM 0 H ARG A 41 2.496 11.317 0.648 1.00 0.00 H new ATOM 0 HA ARG A 41 2.431 13.458 -1.320 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.559 11.129 -0.724 1.00 0.00 H new ATOM 0 HB3 ARG A 41 0.314 12.279 -2.023 1.00 0.00 H new ATOM 0 HG2 ARG A 41 2.875 11.594 -2.587 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.398 10.126 -1.758 1.00 0.00 H new ATOM 0 HD2 ARG A 41 2.008 10.072 -4.267 1.00 0.00 H new ATOM 0 HD3 ARG A 41 0.578 9.725 -3.315 1.00 0.00 H new ATOM 0 HE ARG A 41 0.934 12.584 -4.025 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -0.519 9.464 -4.885 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -1.761 10.189 -5.911 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -0.674 13.522 -5.350 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.849 12.492 -6.175 1.00 0.00 H new ATOM 623 N GLY A 42 0.671 13.420 1.401 1.00 0.00 N ATOM 624 CA GLY A 42 -0.243 14.178 2.239 1.00 0.00 C ATOM 625 C GLY A 42 -1.588 13.461 2.372 1.00 0.00 C ATOM 626 O GLY A 42 -2.561 14.044 2.847 1.00 0.00 O ATOM 0 H GLY A 42 1.135 12.643 1.871 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.196 14.320 3.226 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.396 15.169 1.812 1.00 0.00 H new ATOM 630 N LEU A 43 -1.598 12.207 1.946 1.00 0.00 N ATOM 631 CA LEU A 43 -2.807 11.404 2.012 1.00 0.00 C ATOM 632 C LEU A 43 -3.145 11.118 3.477 1.00 0.00 C ATOM 633 O LEU A 43 -2.324 11.349 4.363 1.00 0.00 O ATOM 634 CB LEU A 43 -2.661 10.144 1.157 1.00 0.00 C ATOM 635 CG LEU A 43 -2.770 10.343 -0.356 1.00 0.00 C ATOM 636 CD1 LEU A 43 -2.171 9.154 -1.110 1.00 0.00 C ATOM 637 CD2 LEU A 43 -4.218 10.614 -0.770 1.00 0.00 C ATOM 0 H LEU A 43 -0.788 11.727 1.554 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.651 11.951 1.591 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.694 9.691 1.375 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.424 9.429 1.465 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.187 11.223 -0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.261 9.321 -2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.119 9.049 -0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.706 8.244 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.268 10.752 -1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.843 9.768 -0.483 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.576 11.515 -0.272 1.00 0.00 H new ATOM 649 N ASN A 44 -4.354 10.618 3.685 1.00 0.00 N ATOM 650 CA ASN A 44 -4.810 10.298 5.027 1.00 0.00 C ATOM 651 C ASN A 44 -5.086 8.796 5.123 1.00 0.00 C ATOM 652 O ASN A 44 -5.045 8.089 4.117 1.00 0.00 O ATOM 653 CB ASN A 44 -6.107 11.039 5.360 1.00 0.00 C ATOM 654 CG ASN A 44 -6.250 11.244 6.869 1.00 0.00 C ATOM 655 OD1 ASN A 44 -5.820 12.239 7.430 1.00 0.00 O ATOM 656 ND2 ASN A 44 -6.876 10.251 7.493 1.00 0.00 N ATOM 0 H ASN A 44 -5.032 10.427 2.947 1.00 0.00 H new ATOM 0 HA ASN A 44 -4.032 10.600 5.728 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -6.118 12.005 4.856 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -6.960 10.474 4.984 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -7.021 10.294 8.502 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -7.211 9.446 6.963 1.00 0.00 H new ATOM 663 N GLN A 45 -5.362 8.354 6.341 1.00 0.00 N ATOM 664 CA GLN A 45 -5.645 6.949 6.581 1.00 0.00 C ATOM 665 C GLN A 45 -7.147 6.736 6.778 1.00 0.00 C ATOM 666 O GLN A 45 -7.561 5.990 7.664 1.00 0.00 O ATOM 667 CB GLN A 45 -4.855 6.428 7.783 1.00 0.00 C ATOM 668 CG GLN A 45 -3.380 6.234 7.427 1.00 0.00 C ATOM 669 CD GLN A 45 -2.531 7.393 7.956 1.00 0.00 C ATOM 670 OE1 GLN A 45 -2.978 8.522 8.070 1.00 0.00 O ATOM 671 NE2 GLN A 45 -1.285 7.050 8.270 1.00 0.00 N ATOM 0 H GLN A 45 -5.396 8.944 7.172 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.329 6.380 5.706 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.943 7.130 8.613 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -5.279 5.482 8.119 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.021 5.294 7.847 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -3.270 6.162 6.345 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.976 6.085 8.150 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.639 7.751 8.631 1.00 0.00 H new ATOM 680 N ASP A 46 -7.923 7.405 5.938 1.00 0.00 N ATOM 681 CA ASP A 46 -9.370 7.299 6.009 1.00 0.00 C ATOM 682 C ASP A 46 -9.956 7.417 4.600 1.00 0.00 C ATOM 683 O ASP A 46 -10.810 6.622 4.210 1.00 0.00 O ATOM 684 CB ASP A 46 -9.964 8.421 6.864 1.00 0.00 C ATOM 685 CG ASP A 46 -10.159 8.074 8.341 1.00 0.00 C ATOM 686 OD1 ASP A 46 -11.178 7.415 8.639 1.00 0.00 O ATOM 687 OD2 ASP A 46 -9.284 8.476 9.138 1.00 0.00 O ATOM 0 H ASP A 46 -7.576 8.023 5.204 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.616 6.336 6.457 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.314 9.293 6.794 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.928 8.707 6.443 1.00 0.00 H new ATOM 692 N CYS A 47 -9.474 8.416 3.876 1.00 0.00 N ATOM 693 CA CYS A 47 -9.939 8.649 2.519 1.00 0.00 C ATOM 694 C CYS A 47 -8.997 7.921 1.557 1.00 0.00 C ATOM 695 O CYS A 47 -8.917 8.268 0.380 1.00 0.00 O ATOM 696 CB CYS A 47 -10.035 10.142 2.202 1.00 0.00 C ATOM 697 SG CYS A 47 -11.601 10.822 2.861 1.00 0.00 S ATOM 0 H CYS A 47 -8.766 9.074 4.203 1.00 0.00 H new ATOM 0 HA CYS A 47 -10.949 8.255 2.406 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -9.187 10.670 2.639 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.987 10.297 1.124 1.00 0.00 H new ATOM 0 HG CYS A 47 -11.672 12.091 2.588 1.00 0.00 H new ATOM 703 N CYS A 48 -8.309 6.925 2.094 1.00 0.00 N ATOM 704 CA CYS A 48 -7.376 6.145 1.298 1.00 0.00 C ATOM 705 C CYS A 48 -7.488 4.680 1.725 1.00 0.00 C ATOM 706 O CYS A 48 -7.928 4.385 2.835 1.00 0.00 O ATOM 707 CB CYS A 48 -5.945 6.669 1.429 1.00 0.00 C ATOM 708 SG CYS A 48 -5.788 8.280 0.573 1.00 0.00 S ATOM 0 H CYS A 48 -8.379 6.640 3.071 1.00 0.00 H new ATOM 0 HA CYS A 48 -7.631 6.236 0.242 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -5.684 6.780 2.482 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -5.245 5.951 1.001 1.00 0.00 H new ATOM 0 HG CYS A 48 -6.971 8.731 0.277 1.00 0.00 H new ATOM 714 N VAL A 49 -7.082 3.801 0.821 1.00 0.00 N ATOM 715 CA VAL A 49 -7.132 2.374 1.090 1.00 0.00 C ATOM 716 C VAL A 49 -5.888 1.704 0.500 1.00 0.00 C ATOM 717 O VAL A 49 -5.233 2.267 -0.375 1.00 0.00 O ATOM 718 CB VAL A 49 -8.438 1.785 0.555 1.00 0.00 C ATOM 719 CG1 VAL A 49 -8.652 2.167 -0.911 1.00 0.00 C ATOM 720 CG2 VAL A 49 -8.470 0.266 0.736 1.00 0.00 C ATOM 0 H VAL A 49 -6.717 4.049 -0.099 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.124 2.188 2.164 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.258 2.208 1.135 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.588 1.735 -1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.695 3.252 -1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.826 1.786 -1.511 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.409 -0.127 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.637 -0.183 0.194 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.386 0.024 1.795 1.00 0.00 H new ATOM 730 N VAL A 50 -5.602 0.513 1.003 1.00 0.00 N ATOM 731 CA VAL A 50 -4.449 -0.239 0.537 1.00 0.00 C ATOM 732 C VAL A 50 -4.891 -1.650 0.142 1.00 0.00 C ATOM 733 O VAL A 50 -5.480 -2.368 0.949 1.00 0.00 O ATOM 734 CB VAL A 50 -3.353 -0.233 1.605 1.00 0.00 C ATOM 735 CG1 VAL A 50 -2.058 -0.840 1.064 1.00 0.00 C ATOM 736 CG2 VAL A 50 -3.115 1.182 2.137 1.00 0.00 C ATOM 0 H VAL A 50 -6.149 0.050 1.729 1.00 0.00 H new ATOM 0 HA VAL A 50 -4.022 0.228 -0.350 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.691 -0.852 2.436 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.295 -0.824 1.843 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.240 -1.870 0.756 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.714 -0.260 0.207 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.332 1.159 2.895 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.808 1.832 1.318 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.035 1.564 2.578 1.00 0.00 H new ATOM 746 N TYR A 51 -4.590 -2.004 -1.098 1.00 0.00 N ATOM 747 CA TYR A 51 -4.949 -3.316 -1.610 1.00 0.00 C ATOM 748 C TYR A 51 -3.722 -4.226 -1.695 1.00 0.00 C ATOM 749 O TYR A 51 -2.629 -3.771 -2.029 1.00 0.00 O ATOM 750 CB TYR A 51 -5.495 -3.084 -3.020 1.00 0.00 C ATOM 751 CG TYR A 51 -6.389 -1.848 -3.146 1.00 0.00 C ATOM 752 CD1 TYR A 51 -7.351 -1.592 -2.190 1.00 0.00 C ATOM 753 CD2 TYR A 51 -6.233 -0.990 -4.215 1.00 0.00 C ATOM 754 CE1 TYR A 51 -8.192 -0.429 -2.308 1.00 0.00 C ATOM 755 CE2 TYR A 51 -7.074 0.173 -4.333 1.00 0.00 C ATOM 756 CZ TYR A 51 -8.012 0.396 -3.374 1.00 0.00 C ATOM 757 OH TYR A 51 -8.806 1.495 -3.485 1.00 0.00 O ATOM 0 H TYR A 51 -4.101 -1.405 -1.764 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.675 -3.798 -0.955 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -4.658 -2.986 -3.711 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.062 -3.963 -3.328 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -7.473 -2.264 -1.353 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -5.480 -1.190 -4.963 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -8.948 -0.217 -1.567 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.962 0.853 -5.165 1.00 0.00 H new ATOM 0 HH TYR A 51 -8.826 1.791 -4.419 1.00 0.00 H new ATOM 767 N ARG A 52 -3.944 -5.495 -1.386 1.00 0.00 N ATOM 768 CA ARG A 52 -2.870 -6.473 -1.423 1.00 0.00 C ATOM 769 C ARG A 52 -3.075 -7.443 -2.588 1.00 0.00 C ATOM 770 O ARG A 52 -4.176 -7.955 -2.788 1.00 0.00 O ATOM 771 CB ARG A 52 -2.800 -7.265 -0.115 1.00 0.00 C ATOM 772 CG ARG A 52 -2.842 -6.329 1.095 1.00 0.00 C ATOM 773 CD ARG A 52 -2.955 -7.123 2.398 1.00 0.00 C ATOM 774 NE ARG A 52 -2.018 -8.268 2.376 1.00 0.00 N ATOM 775 CZ ARG A 52 -2.129 -9.345 3.166 1.00 0.00 C ATOM 776 NH1 ARG A 52 -3.137 -9.431 4.044 1.00 0.00 N ATOM 777 NH2 ARG A 52 -1.232 -10.336 3.077 1.00 0.00 N ATOM 0 H ARG A 52 -4.852 -5.869 -1.109 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.934 -5.932 -1.557 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -3.632 -7.967 -0.066 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.884 -7.855 -0.091 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.942 -5.715 1.116 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -3.689 -5.649 1.004 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.733 -6.477 3.247 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -3.976 -7.481 2.528 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.239 -8.236 1.718 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.820 -8.677 4.111 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.221 -10.251 4.645 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.465 -10.271 2.408 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -1.316 -11.156 3.678 1.00 0.00 H new ATOM 791 N LEU A 53 -1.999 -7.667 -3.327 1.00 0.00 N ATOM 792 CA LEU A 53 -2.047 -8.567 -4.466 1.00 0.00 C ATOM 793 C LEU A 53 -1.995 -10.014 -3.971 1.00 0.00 C ATOM 794 O LEU A 53 -0.940 -10.497 -3.565 1.00 0.00 O ATOM 795 CB LEU A 53 -0.945 -8.221 -5.470 1.00 0.00 C ATOM 796 CG LEU A 53 -1.363 -7.337 -6.647 1.00 0.00 C ATOM 797 CD1 LEU A 53 -1.641 -8.179 -7.893 1.00 0.00 C ATOM 798 CD2 LEU A 53 -2.555 -6.454 -6.273 1.00 0.00 C ATOM 0 H LEU A 53 -1.088 -7.240 -3.159 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.987 -8.448 -5.005 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.137 -7.721 -4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -0.537 -9.151 -5.867 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.533 -6.672 -6.887 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.936 -7.526 -8.715 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.740 -8.727 -8.170 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.445 -8.885 -7.683 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.832 -5.836 -7.127 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.399 -7.083 -5.991 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.284 -5.813 -5.434 1.00 0.00 H new ATOM 810 N ILE A 54 -3.148 -10.664 -4.022 1.00 0.00 N ATOM 811 CA ILE A 54 -3.248 -12.046 -3.583 1.00 0.00 C ATOM 812 C ILE A 54 -3.802 -12.900 -4.725 1.00 0.00 C ATOM 813 O ILE A 54 -5.007 -12.905 -4.973 1.00 0.00 O ATOM 814 CB ILE A 54 -4.063 -12.141 -2.292 1.00 0.00 C ATOM 815 CG1 ILE A 54 -3.253 -11.641 -1.094 1.00 0.00 C ATOM 816 CG2 ILE A 54 -4.586 -13.563 -2.077 1.00 0.00 C ATOM 817 CD1 ILE A 54 -3.808 -10.314 -0.573 1.00 0.00 C ATOM 0 H ILE A 54 -4.021 -10.260 -4.361 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.262 -12.441 -3.339 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.932 -11.489 -2.388 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -3.275 -12.386 -0.299 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -2.210 -11.515 -1.383 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -5.162 -13.603 -1.152 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.224 -13.847 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -3.745 -14.254 -2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.215 -9.981 0.278 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.762 -9.565 -1.363 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -4.844 -10.450 -0.262 1.00 0.00 H new ATOM 829 N LYS A 55 -2.896 -13.602 -5.390 1.00 0.00 N ATOM 830 CA LYS A 55 -3.280 -14.458 -6.500 1.00 0.00 C ATOM 831 C LYS A 55 -3.405 -13.614 -7.770 1.00 0.00 C ATOM 832 O LYS A 55 -2.791 -13.925 -8.790 1.00 0.00 O ATOM 833 CB LYS A 55 -4.546 -15.245 -6.157 1.00 0.00 C ATOM 834 CG LYS A 55 -4.358 -16.737 -6.437 1.00 0.00 C ATOM 835 CD LYS A 55 -4.069 -17.505 -5.146 1.00 0.00 C ATOM 836 CE LYS A 55 -5.365 -17.827 -4.399 1.00 0.00 C ATOM 837 NZ LYS A 55 -5.160 -18.960 -3.469 1.00 0.00 N ATOM 0 H LYS A 55 -1.898 -13.596 -5.182 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.510 -15.206 -6.689 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.797 -15.097 -5.106 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -5.384 -14.865 -6.741 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -5.255 -17.138 -6.910 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -3.537 -16.878 -7.140 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -3.540 -18.429 -5.379 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -3.413 -16.915 -4.506 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -5.700 -16.950 -3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.152 -18.072 -5.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -6.049 -19.165 -2.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.862 -19.800 -4.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -4.424 -18.712 -2.777 1.00 0.00 H new ATOM 851 N GLY A 56 -4.205 -12.562 -7.667 1.00 0.00 N ATOM 852 CA GLY A 56 -4.418 -11.671 -8.794 1.00 0.00 C ATOM 853 C GLY A 56 -5.661 -10.805 -8.580 1.00 0.00 C ATOM 854 O GLY A 56 -6.429 -10.573 -9.513 1.00 0.00 O ATOM 0 H GLY A 56 -4.713 -12.307 -6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.544 -11.033 -8.928 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -4.530 -12.255 -9.708 1.00 0.00 H new ATOM 858 N ARG A 57 -5.820 -10.349 -7.347 1.00 0.00 N ATOM 859 CA ARG A 57 -6.956 -9.513 -6.998 1.00 0.00 C ATOM 860 C ARG A 57 -6.580 -8.547 -5.873 1.00 0.00 C ATOM 861 O ARG A 57 -5.814 -8.900 -4.978 1.00 0.00 O ATOM 862 CB ARG A 57 -8.149 -10.362 -6.554 1.00 0.00 C ATOM 863 CG ARG A 57 -8.879 -10.956 -7.761 1.00 0.00 C ATOM 864 CD ARG A 57 -9.679 -9.883 -8.501 1.00 0.00 C ATOM 865 NE ARG A 57 -11.127 -10.081 -8.268 1.00 0.00 N ATOM 866 CZ ARG A 57 -12.079 -9.243 -8.701 1.00 0.00 C ATOM 867 NH1 ARG A 57 -11.742 -8.145 -9.392 1.00 0.00 N ATOM 868 NH2 ARG A 57 -13.368 -9.503 -8.443 1.00 0.00 N ATOM 0 H ARG A 57 -5.181 -10.543 -6.576 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.237 -8.948 -7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.806 -11.164 -5.901 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.839 -9.750 -5.972 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.157 -11.409 -8.440 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.548 -11.750 -7.431 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.379 -8.893 -8.158 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.464 -9.929 -9.569 1.00 0.00 H new ATOM 0 HE ARG A 57 -11.419 -10.907 -7.745 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.761 -7.947 -9.588 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.467 -7.507 -9.721 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -13.624 -10.339 -7.917 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -14.093 -8.865 -8.772 1.00 0.00 H new ATOM 882 N LYS A 58 -7.136 -7.347 -5.956 1.00 0.00 N ATOM 883 CA LYS A 58 -6.868 -6.328 -4.955 1.00 0.00 C ATOM 884 C LYS A 58 -7.558 -6.711 -3.645 1.00 0.00 C ATOM 885 O LYS A 58 -8.784 -6.676 -3.552 1.00 0.00 O ATOM 886 CB LYS A 58 -7.265 -4.946 -5.479 1.00 0.00 C ATOM 887 CG LYS A 58 -6.133 -4.324 -6.299 1.00 0.00 C ATOM 888 CD LYS A 58 -6.250 -4.708 -7.775 1.00 0.00 C ATOM 889 CE LYS A 58 -5.754 -3.576 -8.677 1.00 0.00 C ATOM 890 NZ LYS A 58 -5.480 -4.082 -10.041 1.00 0.00 N ATOM 0 H LYS A 58 -7.770 -7.058 -6.700 1.00 0.00 H new ATOM 0 HA LYS A 58 -5.800 -6.270 -4.747 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -8.161 -5.030 -6.094 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.513 -4.293 -4.642 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.160 -3.239 -6.199 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.171 -4.656 -5.908 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.670 -5.611 -7.967 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.288 -4.939 -8.013 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.501 -2.783 -8.720 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.849 -3.138 -8.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.144 -3.301 -10.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.751 -4.822 -9.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.352 -4.479 -10.446 1.00 0.00 H new ATOM 904 N THR A 59 -6.742 -7.068 -2.665 1.00 0.00 N ATOM 905 CA THR A 59 -7.259 -7.457 -1.364 1.00 0.00 C ATOM 906 C THR A 59 -7.021 -6.345 -0.341 1.00 0.00 C ATOM 907 O THR A 59 -5.945 -6.259 0.248 1.00 0.00 O ATOM 908 CB THR A 59 -6.611 -8.788 -0.977 1.00 0.00 C ATOM 909 OG1 THR A 59 -7.231 -9.740 -1.836 1.00 0.00 O ATOM 910 CG2 THR A 59 -7.005 -9.244 0.430 1.00 0.00 C ATOM 0 H THR A 59 -5.726 -7.096 -2.746 1.00 0.00 H new ATOM 0 HA THR A 59 -8.339 -7.601 -1.394 1.00 0.00 H new ATOM 0 HB THR A 59 -5.527 -8.694 -1.038 1.00 0.00 H new ATOM 0 HG1 THR A 59 -6.867 -10.631 -1.653 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.518 -10.193 0.655 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.691 -8.494 1.157 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.086 -9.370 0.482 1.00 0.00 H new ATOM 918 N VAL A 60 -8.043 -5.522 -0.162 1.00 0.00 N ATOM 919 CA VAL A 60 -7.959 -4.418 0.780 1.00 0.00 C ATOM 920 C VAL A 60 -7.287 -4.902 2.067 1.00 0.00 C ATOM 921 O VAL A 60 -7.422 -6.065 2.443 1.00 0.00 O ATOM 922 CB VAL A 60 -9.350 -3.826 1.018 1.00 0.00 C ATOM 923 CG1 VAL A 60 -9.323 -2.803 2.155 1.00 0.00 C ATOM 924 CG2 VAL A 60 -9.909 -3.207 -0.264 1.00 0.00 C ATOM 0 H VAL A 60 -8.934 -5.597 -0.653 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.344 -3.615 0.374 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.014 -4.638 1.314 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.324 -2.398 2.304 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.988 -3.287 3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.638 -1.994 1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.898 -2.794 -0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -9.245 -2.412 -0.604 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -9.983 -3.973 -1.036 1.00 0.00 H new ATOM 934 N THR A 61 -6.577 -3.984 2.706 1.00 0.00 N ATOM 935 CA THR A 61 -5.883 -4.302 3.943 1.00 0.00 C ATOM 936 C THR A 61 -6.319 -3.351 5.059 1.00 0.00 C ATOM 937 O THR A 61 -6.778 -2.242 4.790 1.00 0.00 O ATOM 938 CB THR A 61 -4.379 -4.263 3.665 1.00 0.00 C ATOM 939 OG1 THR A 61 -3.825 -5.160 4.623 1.00 0.00 O ATOM 940 CG2 THR A 61 -3.754 -2.911 4.015 1.00 0.00 C ATOM 0 H THR A 61 -6.467 -3.020 2.391 1.00 0.00 H new ATOM 0 HA THR A 61 -6.138 -5.302 4.293 1.00 0.00 H new ATOM 0 HB THR A 61 -4.199 -4.485 2.613 1.00 0.00 H new ATOM 0 HG1 THR A 61 -2.864 -4.989 4.714 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.686 -2.937 3.799 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.225 -2.128 3.421 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.905 -2.704 5.074 1.00 0.00 H new ATOM 948 N ALA A 62 -6.161 -3.820 6.288 1.00 0.00 N ATOM 949 CA ALA A 62 -6.533 -3.025 7.446 1.00 0.00 C ATOM 950 C ALA A 62 -5.345 -2.160 7.868 1.00 0.00 C ATOM 951 O ALA A 62 -4.194 -2.577 7.747 1.00 0.00 O ATOM 952 CB ALA A 62 -7.009 -3.950 8.568 1.00 0.00 C ATOM 0 H ALA A 62 -5.780 -4.741 6.507 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.358 -2.355 7.203 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.288 -3.354 9.437 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.873 -4.521 8.227 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.206 -4.635 8.840 1.00 0.00 H new ATOM 958 N TRP A 63 -5.663 -0.969 8.354 1.00 0.00 N ATOM 959 CA TRP A 63 -4.636 -0.041 8.795 1.00 0.00 C ATOM 960 C TRP A 63 -4.030 -0.586 10.090 1.00 0.00 C ATOM 961 O TRP A 63 -2.925 -0.204 10.471 1.00 0.00 O ATOM 962 CB TRP A 63 -5.203 1.372 8.948 1.00 0.00 C ATOM 963 CG TRP A 63 -5.623 2.021 7.628 1.00 0.00 C ATOM 964 CD1 TRP A 63 -6.855 2.371 7.236 1.00 0.00 C ATOM 965 CD2 TRP A 63 -4.754 2.386 6.535 1.00 0.00 C ATOM 966 NE1 TRP A 63 -6.845 2.932 5.975 1.00 0.00 N ATOM 967 CE2 TRP A 63 -5.526 2.942 5.535 1.00 0.00 C ATOM 968 CE3 TRP A 63 -3.361 2.251 6.395 1.00 0.00 C ATOM 969 CZ2 TRP A 63 -4.996 3.406 4.326 1.00 0.00 C ATOM 970 CZ3 TRP A 63 -2.847 2.720 5.180 1.00 0.00 C ATOM 971 CH2 TRP A 63 -3.611 3.282 4.164 1.00 0.00 C ATOM 0 H TRP A 63 -6.618 -0.625 8.452 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.845 0.042 8.049 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -6.065 1.336 9.614 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -4.455 2.002 9.429 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.745 2.232 7.832 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.656 3.276 5.461 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.737 1.820 7.164 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -5.622 3.837 3.559 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -1.782 2.639 5.021 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -3.139 3.621 3.254 1.00 0.00 H new ATOM 982 N ASP A 64 -4.781 -1.471 10.730 1.00 0.00 N ATOM 983 CA ASP A 64 -4.331 -2.072 11.974 1.00 0.00 C ATOM 984 C ASP A 64 -3.748 -3.456 11.685 1.00 0.00 C ATOM 985 O ASP A 64 -3.794 -4.343 12.535 1.00 0.00 O ATOM 986 CB ASP A 64 -5.494 -2.244 12.954 1.00 0.00 C ATOM 987 CG ASP A 64 -5.802 -1.018 13.814 1.00 0.00 C ATOM 988 OD1 ASP A 64 -6.045 0.051 13.213 1.00 0.00 O ATOM 989 OD2 ASP A 64 -5.787 -1.176 15.054 1.00 0.00 O ATOM 0 H ASP A 64 -5.697 -1.786 10.411 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.582 -1.415 12.415 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.389 -2.507 12.390 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -5.273 -3.084 13.612 1.00 0.00 H new ATOM 994 N THR A 65 -3.212 -3.597 10.481 1.00 0.00 N ATOM 995 CA THR A 65 -2.619 -4.859 10.069 1.00 0.00 C ATOM 996 C THR A 65 -1.093 -4.780 10.142 1.00 0.00 C ATOM 997 O THR A 65 -0.515 -3.706 9.987 1.00 0.00 O ATOM 998 CB THR A 65 -3.144 -5.193 8.671 1.00 0.00 C ATOM 999 OG1 THR A 65 -4.499 -4.752 8.695 1.00 0.00 O ATOM 1000 CG2 THR A 65 -3.247 -6.701 8.430 1.00 0.00 C ATOM 0 H THR A 65 -3.176 -2.859 9.778 1.00 0.00 H new ATOM 0 HA THR A 65 -2.904 -5.668 10.741 1.00 0.00 H new ATOM 0 HB THR A 65 -2.489 -4.749 7.921 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.049 -5.356 8.155 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.624 -6.884 7.424 1.00 0.00 H new ATOM 0 HG22 THR A 65 -2.262 -7.155 8.536 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.929 -7.140 9.158 1.00 0.00 H new ATOM 1008 N ALA A 66 -0.484 -5.933 10.378 1.00 0.00 N ATOM 1009 CA ALA A 66 0.964 -6.008 10.474 1.00 0.00 C ATOM 1010 C ALA A 66 1.569 -5.922 9.071 1.00 0.00 C ATOM 1011 O ALA A 66 0.882 -6.162 8.079 1.00 0.00 O ATOM 1012 CB ALA A 66 1.361 -7.294 11.202 1.00 0.00 C ATOM 0 H ALA A 66 -0.967 -6.822 10.506 1.00 0.00 H new ATOM 0 HA ALA A 66 1.354 -5.171 11.053 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.447 -7.351 11.274 1.00 0.00 H new ATOM 0 HB2 ALA A 66 0.930 -7.293 12.203 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.989 -8.156 10.648 1.00 0.00 H new ATOM 1018 N ILE A 67 2.847 -5.577 9.033 1.00 0.00 N ATOM 1019 CA ILE A 67 3.552 -5.456 7.768 1.00 0.00 C ATOM 1020 C ILE A 67 4.621 -6.547 7.678 1.00 0.00 C ATOM 1021 O ILE A 67 5.593 -6.408 6.937 1.00 0.00 O ATOM 1022 CB ILE A 67 4.104 -4.039 7.596 1.00 0.00 C ATOM 1023 CG1 ILE A 67 4.521 -3.785 6.146 1.00 0.00 C ATOM 1024 CG2 ILE A 67 5.248 -3.773 8.576 1.00 0.00 C ATOM 1025 CD1 ILE A 67 3.479 -2.934 5.417 1.00 0.00 C ATOM 0 H ILE A 67 3.413 -5.377 9.858 1.00 0.00 H new ATOM 0 HA ILE A 67 2.867 -5.611 6.934 1.00 0.00 H new ATOM 0 HB ILE A 67 3.308 -3.332 7.831 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.487 -3.281 6.125 1.00 0.00 H new ATOM 0 HG13 ILE A 67 4.646 -4.736 5.628 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.622 -2.759 8.432 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.885 -3.885 9.598 1.00 0.00 H new ATOM 0 HG23 ILE A 67 6.053 -4.485 8.397 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.800 -2.768 4.389 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.520 -3.452 5.419 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.374 -1.975 5.923 1.00 0.00 H new ATOM 1037 N ALA A 68 4.405 -7.607 8.442 1.00 0.00 N ATOM 1038 CA ALA A 68 5.338 -8.721 8.458 1.00 0.00 C ATOM 1039 C ALA A 68 5.090 -9.605 7.234 1.00 0.00 C ATOM 1040 O ALA A 68 5.989 -9.812 6.421 1.00 0.00 O ATOM 1041 CB ALA A 68 5.192 -9.491 9.773 1.00 0.00 C ATOM 0 H ALA A 68 3.597 -7.718 9.055 1.00 0.00 H new ATOM 0 HA ALA A 68 6.366 -8.362 8.403 1.00 0.00 H new ATOM 0 HB1 ALA A 68 5.892 -10.327 9.785 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.406 -8.826 10.610 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.174 -9.869 9.862 1.00 0.00 H new ATOM 1047 N PRO A 69 3.833 -10.117 7.140 1.00 0.00 N ATOM 1048 CA PRO A 69 3.456 -10.975 6.029 1.00 0.00 C ATOM 1049 C PRO A 69 3.257 -10.159 4.750 1.00 0.00 C ATOM 1050 O PRO A 69 2.227 -10.278 4.088 1.00 0.00 O ATOM 1051 CB PRO A 69 2.189 -11.678 6.488 1.00 0.00 C ATOM 1052 CG PRO A 69 1.647 -10.850 7.642 1.00 0.00 C ATOM 1053 CD PRO A 69 2.743 -9.894 8.085 1.00 0.00 C ATOM 0 HA PRO A 69 4.229 -11.701 5.776 1.00 0.00 H new ATOM 0 HB2 PRO A 69 1.462 -11.742 5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 69 2.402 -12.699 6.806 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.761 -10.297 7.332 1.00 0.00 H new ATOM 0 HG3 PRO A 69 1.347 -11.496 8.467 1.00 0.00 H new ATOM 0 HD2 PRO A 69 2.401 -8.859 8.058 1.00 0.00 H new ATOM 0 HD3 PRO A 69 3.058 -10.099 9.108 1.00 0.00 H new ATOM 1061 N LEU A 70 4.259 -9.349 4.441 1.00 0.00 N ATOM 1062 CA LEU A 70 4.207 -8.514 3.253 1.00 0.00 C ATOM 1063 C LEU A 70 5.596 -8.457 2.614 1.00 0.00 C ATOM 1064 O LEU A 70 5.955 -7.460 1.989 1.00 0.00 O ATOM 1065 CB LEU A 70 3.628 -7.138 3.590 1.00 0.00 C ATOM 1066 CG LEU A 70 2.198 -7.127 4.134 1.00 0.00 C ATOM 1067 CD1 LEU A 70 1.236 -7.815 3.163 1.00 0.00 C ATOM 1068 CD2 LEU A 70 2.138 -7.744 5.533 1.00 0.00 C ATOM 0 H LEU A 70 5.112 -9.253 4.993 1.00 0.00 H new ATOM 0 HA LEU A 70 3.533 -8.945 2.513 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.278 -6.662 4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.658 -6.523 2.691 1.00 0.00 H new ATOM 0 HG LEU A 70 1.876 -6.090 4.225 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.227 -7.793 3.574 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.250 -7.293 2.206 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.546 -8.850 3.016 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.110 -7.724 5.896 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.488 -8.776 5.491 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.773 -7.173 6.210 1.00 0.00 H new ATOM 1080 N ASP A 71 6.339 -9.538 2.794 1.00 0.00 N ATOM 1081 CA ASP A 71 7.681 -9.624 2.243 1.00 0.00 C ATOM 1082 C ASP A 71 7.614 -9.467 0.722 1.00 0.00 C ATOM 1083 O ASP A 71 7.951 -8.411 0.188 1.00 0.00 O ATOM 1084 CB ASP A 71 8.317 -10.981 2.550 1.00 0.00 C ATOM 1085 CG ASP A 71 9.301 -11.488 1.493 1.00 0.00 C ATOM 1086 OD1 ASP A 71 10.377 -10.864 1.373 1.00 0.00 O ATOM 1087 OD2 ASP A 71 8.954 -12.489 0.829 1.00 0.00 O ATOM 0 H ASP A 71 6.038 -10.362 3.314 1.00 0.00 H new ATOM 0 HA ASP A 71 8.282 -8.834 2.694 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.836 -10.914 3.506 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.523 -11.719 2.670 1.00 0.00 H new ATOM 1092 N GLY A 72 7.177 -10.532 0.068 1.00 0.00 N ATOM 1093 CA GLY A 72 7.062 -10.526 -1.381 1.00 0.00 C ATOM 1094 C GLY A 72 5.617 -10.269 -1.815 1.00 0.00 C ATOM 1095 O GLY A 72 4.806 -11.193 -1.864 1.00 0.00 O ATOM 0 H GLY A 72 6.898 -11.406 0.514 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.713 -9.758 -1.798 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.401 -11.482 -1.780 1.00 0.00 H new ATOM 1099 N GLU A 73 5.339 -9.009 -2.117 1.00 0.00 N ATOM 1100 CA GLU A 73 4.006 -8.619 -2.545 1.00 0.00 C ATOM 1101 C GLU A 73 4.017 -7.182 -3.071 1.00 0.00 C ATOM 1102 O GLU A 73 5.078 -6.574 -3.204 1.00 0.00 O ATOM 1103 CB GLU A 73 2.996 -8.779 -1.407 1.00 0.00 C ATOM 1104 CG GLU A 73 3.171 -7.678 -0.360 1.00 0.00 C ATOM 1105 CD GLU A 73 2.338 -6.445 -0.716 1.00 0.00 C ATOM 1106 OE1 GLU A 73 1.160 -6.643 -1.083 1.00 0.00 O ATOM 1107 OE2 GLU A 73 2.899 -5.332 -0.614 1.00 0.00 O ATOM 0 H GLU A 73 6.014 -8.245 -2.074 1.00 0.00 H new ATOM 0 HA GLU A 73 3.698 -9.280 -3.355 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.983 -8.747 -1.808 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.122 -9.755 -0.938 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.873 -8.052 0.619 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.223 -7.402 -0.289 1.00 0.00 H new ATOM 1114 N GLU A 74 2.824 -6.681 -3.355 1.00 0.00 N ATOM 1115 CA GLU A 74 2.683 -5.327 -3.863 1.00 0.00 C ATOM 1116 C GLU A 74 1.372 -4.710 -3.372 1.00 0.00 C ATOM 1117 O GLU A 74 0.290 -5.160 -3.749 1.00 0.00 O ATOM 1118 CB GLU A 74 2.762 -5.304 -5.391 1.00 0.00 C ATOM 1119 CG GLU A 74 4.182 -4.987 -5.862 1.00 0.00 C ATOM 1120 CD GLU A 74 4.375 -5.383 -7.328 1.00 0.00 C ATOM 1121 OE1 GLU A 74 4.130 -6.570 -7.631 1.00 0.00 O ATOM 1122 OE2 GLU A 74 4.764 -4.489 -8.110 1.00 0.00 O ATOM 0 H GLU A 74 1.946 -7.188 -3.243 1.00 0.00 H new ATOM 0 HA GLU A 74 3.509 -4.728 -3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.450 -6.269 -5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.070 -4.559 -5.783 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.380 -3.922 -5.740 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.902 -5.518 -5.240 1.00 0.00 H new ATOM 1129 N LEU A 75 1.510 -3.690 -2.539 1.00 0.00 N ATOM 1130 CA LEU A 75 0.350 -3.007 -1.992 1.00 0.00 C ATOM 1131 C LEU A 75 -0.018 -1.831 -2.900 1.00 0.00 C ATOM 1132 O LEU A 75 0.860 -1.166 -3.447 1.00 0.00 O ATOM 1133 CB LEU A 75 0.601 -2.605 -0.538 1.00 0.00 C ATOM 1134 CG LEU A 75 0.794 -3.756 0.452 1.00 0.00 C ATOM 1135 CD1 LEU A 75 2.127 -3.626 1.191 1.00 0.00 C ATOM 1136 CD2 LEU A 75 -0.390 -3.854 1.417 1.00 0.00 C ATOM 0 H LEU A 75 2.408 -3.319 -2.229 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.510 -3.676 -1.969 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.487 -1.971 -0.505 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.238 -1.998 -0.200 1.00 0.00 H new ATOM 0 HG LEU A 75 0.828 -4.689 -0.111 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.239 -4.456 1.888 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.945 -3.644 0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.148 -2.685 1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.227 -4.680 2.110 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.481 -2.923 1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.306 -4.029 0.853 1.00 0.00 H new ATOM 1148 N ILE A 76 -1.318 -1.611 -3.031 1.00 0.00 N ATOM 1149 CA ILE A 76 -1.813 -0.528 -3.863 1.00 0.00 C ATOM 1150 C ILE A 76 -2.577 0.471 -2.991 1.00 0.00 C ATOM 1151 O ILE A 76 -3.637 0.149 -2.455 1.00 0.00 O ATOM 1152 CB ILE A 76 -2.635 -1.080 -5.029 1.00 0.00 C ATOM 1153 CG1 ILE A 76 -1.731 -1.732 -6.077 1.00 0.00 C ATOM 1154 CG2 ILE A 76 -3.525 0.007 -5.636 1.00 0.00 C ATOM 1155 CD1 ILE A 76 -2.548 -2.578 -7.056 1.00 0.00 C ATOM 0 H ILE A 76 -2.043 -2.164 -2.575 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.983 0.013 -4.317 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.294 -1.858 -4.644 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.187 -0.961 -6.623 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -0.988 -2.358 -5.583 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -4.099 -0.412 -6.463 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -4.208 0.385 -4.875 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.903 0.824 -6.003 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -1.881 -3.030 -7.790 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.072 -3.363 -6.510 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.274 -1.945 -7.566 1.00 0.00 H new ATOM 1167 N VAL A 77 -2.009 1.662 -2.875 1.00 0.00 N ATOM 1168 CA VAL A 77 -2.623 2.710 -2.077 1.00 0.00 C ATOM 1169 C VAL A 77 -3.492 3.589 -2.979 1.00 0.00 C ATOM 1170 O VAL A 77 -2.978 4.288 -3.851 1.00 0.00 O ATOM 1171 CB VAL A 77 -1.545 3.499 -1.331 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -2.172 4.570 -0.435 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -0.644 2.565 -0.522 1.00 0.00 C ATOM 0 H VAL A 77 -1.130 1.925 -3.320 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.275 2.279 -1.317 1.00 0.00 H new ATOM 0 HB VAL A 77 -0.925 4.003 -2.072 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.385 5.117 0.084 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.752 5.262 -1.046 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.827 4.095 0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 77 0.114 3.151 -0.001 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.245 2.020 0.206 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -0.157 1.857 -1.193 1.00 0.00 H new ATOM 1183 N GLU A 78 -4.793 3.525 -2.738 1.00 0.00 N ATOM 1184 CA GLU A 78 -5.738 4.307 -3.517 1.00 0.00 C ATOM 1185 C GLU A 78 -6.433 5.340 -2.628 1.00 0.00 C ATOM 1186 O GLU A 78 -6.433 5.211 -1.405 1.00 0.00 O ATOM 1187 CB GLU A 78 -6.759 3.402 -4.209 1.00 0.00 C ATOM 1188 CG GLU A 78 -6.436 3.247 -5.696 1.00 0.00 C ATOM 1189 CD GLU A 78 -7.715 3.117 -6.525 1.00 0.00 C ATOM 1190 OE1 GLU A 78 -8.442 2.126 -6.295 1.00 0.00 O ATOM 1191 OE2 GLU A 78 -7.937 4.010 -7.370 1.00 0.00 O ATOM 0 H GLU A 78 -5.215 2.944 -2.014 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.187 4.838 -4.294 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.765 2.423 -3.731 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.759 3.820 -4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.862 4.108 -6.039 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.810 2.367 -5.846 1.00 0.00 H new ATOM 1198 N VAL A 79 -7.010 6.340 -3.277 1.00 0.00 N ATOM 1199 CA VAL A 79 -7.708 7.394 -2.561 1.00 0.00 C ATOM 1200 C VAL A 79 -9.208 7.291 -2.845 1.00 0.00 C ATOM 1201 O VAL A 79 -9.634 7.399 -3.993 1.00 0.00 O ATOM 1202 CB VAL A 79 -7.121 8.757 -2.933 1.00 0.00 C ATOM 1203 CG1 VAL A 79 -7.005 8.908 -4.451 1.00 0.00 C ATOM 1204 CG2 VAL A 79 -7.949 9.894 -2.331 1.00 0.00 C ATOM 0 H VAL A 79 -7.008 6.443 -4.292 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.572 7.280 -1.486 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.117 8.815 -2.513 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.585 9.885 -4.688 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.354 8.128 -4.846 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.993 8.818 -4.902 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.510 10.852 -2.611 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -8.970 9.839 -2.708 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.958 9.802 -1.245 1.00 0.00 H new ATOM 1214 N LEU A 80 -9.967 7.084 -1.779 1.00 0.00 N ATOM 1215 CA LEU A 80 -11.410 6.965 -1.899 1.00 0.00 C ATOM 1216 C LEU A 80 -11.970 8.237 -2.539 1.00 0.00 C ATOM 1217 O LEU A 80 -12.083 9.270 -1.880 1.00 0.00 O ATOM 1218 CB LEU A 80 -12.035 6.632 -0.543 1.00 0.00 C ATOM 1219 CG LEU A 80 -11.624 5.294 0.075 1.00 0.00 C ATOM 1220 CD1 LEU A 80 -11.909 5.274 1.578 1.00 0.00 C ATOM 1221 CD2 LEU A 80 -12.294 4.126 -0.651 1.00 0.00 C ATOM 0 H LEU A 80 -9.610 6.996 -0.828 1.00 0.00 H new ATOM 0 HA LEU A 80 -11.671 6.135 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -11.779 7.427 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.119 6.641 -0.653 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.548 5.176 -0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.608 4.312 1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -11.348 6.071 2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -12.975 5.425 1.748 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -11.985 3.187 -0.192 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -13.377 4.226 -0.579 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -11.998 4.132 -1.700 1.00 0.00 H new ATOM 1233 N SER A 81 -12.306 8.121 -3.815 1.00 0.00 N ATOM 1234 CA SER A 81 -12.852 9.248 -4.551 1.00 0.00 C ATOM 1235 C SER A 81 -13.303 8.796 -5.942 1.00 0.00 C ATOM 1236 O SER A 81 -12.994 7.685 -6.368 1.00 0.00 O ATOM 1237 CB SER A 81 -11.827 10.378 -4.667 1.00 0.00 C ATOM 1238 OG SER A 81 -12.347 11.620 -4.201 1.00 0.00 O ATOM 0 H SER A 81 -12.211 7.263 -4.358 1.00 0.00 H new ATOM 0 HA SER A 81 -13.713 9.629 -4.003 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.936 10.120 -4.094 1.00 0.00 H new ATOM 0 HB3 SER A 81 -11.518 10.482 -5.707 1.00 0.00 H new ATOM 0 HG SER A 81 -11.662 12.315 -4.290 1.00 0.00 H new ATOM 1244 N GLY A 82 -14.026 9.682 -6.611 1.00 0.00 N ATOM 1245 CA GLY A 82 -14.523 9.388 -7.944 1.00 0.00 C ATOM 1246 C GLY A 82 -15.759 10.231 -8.267 1.00 0.00 C ATOM 1247 O GLY A 82 -16.504 10.616 -7.368 1.00 0.00 O ATOM 0 H GLY A 82 -14.279 10.604 -6.255 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.742 9.585 -8.679 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.771 8.329 -8.018 1.00 0.00 H new ATOM 1251 N PRO A 83 -15.943 10.498 -9.588 1.00 0.00 N ATOM 1252 CA PRO A 83 -17.075 11.288 -10.041 1.00 0.00 C ATOM 1253 C PRO A 83 -18.368 10.472 -9.991 1.00 0.00 C ATOM 1254 O PRO A 83 -18.925 10.119 -11.029 1.00 0.00 O ATOM 1255 CB PRO A 83 -16.708 11.733 -11.447 1.00 0.00 C ATOM 1256 CG PRO A 83 -15.599 10.798 -11.903 1.00 0.00 C ATOM 1257 CD PRO A 83 -15.081 10.058 -10.681 1.00 0.00 C ATOM 0 HA PRO A 83 -17.268 12.150 -9.403 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -17.569 11.672 -12.113 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -16.372 12.770 -11.454 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -15.975 10.093 -12.645 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -14.795 11.362 -12.377 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -15.137 8.978 -10.819 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -14.037 10.301 -10.484 1.00 0.00 H new ATOM 1265 N SER A 84 -18.809 10.195 -8.772 1.00 0.00 N ATOM 1266 CA SER A 84 -20.026 9.426 -8.573 1.00 0.00 C ATOM 1267 C SER A 84 -20.058 8.856 -7.153 1.00 0.00 C ATOM 1268 O SER A 84 -19.012 8.628 -6.548 1.00 0.00 O ATOM 1269 CB SER A 84 -20.140 8.299 -9.601 1.00 0.00 C ATOM 1270 OG SER A 84 -20.928 8.679 -10.725 1.00 0.00 O ATOM 0 H SER A 84 -18.345 10.489 -7.913 1.00 0.00 H new ATOM 0 HA SER A 84 -20.878 10.092 -8.709 1.00 0.00 H new ATOM 0 HB2 SER A 84 -19.143 8.013 -9.937 1.00 0.00 H new ATOM 0 HB3 SER A 84 -20.581 7.421 -9.129 1.00 0.00 H new ATOM 0 HG SER A 84 -20.414 9.290 -11.293 1.00 0.00 H new ATOM 1276 N SER A 85 -21.270 8.642 -6.663 1.00 0.00 N ATOM 1277 CA SER A 85 -21.452 8.102 -5.327 1.00 0.00 C ATOM 1278 C SER A 85 -20.739 8.988 -4.303 1.00 0.00 C ATOM 1279 O SER A 85 -19.911 9.821 -4.668 1.00 0.00 O ATOM 1280 CB SER A 85 -20.935 6.666 -5.237 1.00 0.00 C ATOM 1281 OG SER A 85 -21.917 5.776 -4.715 1.00 0.00 O ATOM 0 H SER A 85 -22.136 8.833 -7.168 1.00 0.00 H new ATOM 0 HA SER A 85 -22.519 8.089 -5.107 1.00 0.00 H new ATOM 0 HB2 SER A 85 -20.630 6.328 -6.227 1.00 0.00 H new ATOM 0 HB3 SER A 85 -20.048 6.639 -4.604 1.00 0.00 H new ATOM 0 HG SER A 85 -21.548 4.869 -4.675 1.00 0.00 H new ATOM 1287 N GLY A 86 -21.087 8.779 -3.042 1.00 0.00 N ATOM 1288 CA GLY A 86 -20.491 9.548 -1.963 1.00 0.00 C ATOM 1289 C GLY A 86 -21.566 10.114 -1.034 1.00 0.00 C ATOM 1290 O GLY A 86 -22.739 9.763 -1.150 1.00 0.00 O ATOM 0 H GLY A 86 -21.775 8.088 -2.743 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -19.810 8.915 -1.394 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -19.898 10.363 -2.377 1.00 0.00 H new TER 1294 GLY A 86