USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1131 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 83 THR OG1 : rot 87:sc= 0.038 USER MOD Set 1.2: A 101 LYS NZ :NH3+ 163:sc= 1.06 (180deg=0.517) USER MOD Set 2.1: A 17 TYR OH : rot 180:sc= 0.46 USER MOD Set 2.2: A 110 ASN : amide:sc= 0.483 X(o=0.94,f=0.69) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 MET CE :methyl -160:sc= -0.38 (180deg=-1.09) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 168:sc= -0.0623 (180deg=-0.248) USER MOD Single : A 10 LYS NZ :NH3+ 168:sc= -0.0044 (180deg=-0.172) USER MOD Single : A 13 CYS SG : rot 86:sc= 0.0546 USER MOD Single : A 18 ASN : amide:sc= -0.344 X(o=-0.34,f=-0.0089) USER MOD Single : A 25 SER OG : rot -87:sc= 0.0369 USER MOD Single : A 31 THR OG1 : rot -51:sc= 0.706 USER MOD Single : A 33 LYS NZ :NH3+ 178:sc=-0.00353 (180deg=-0.011) USER MOD Single : A 34 TYR OH : rot 42:sc= 1.82 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0149 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0169 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 48 TYR OH : rot 151:sc= 1.26 USER MOD Single : A 49 GLN : amide:sc= 0.398 X(o=0.4,f=0) USER MOD Single : A 50 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.2!) USER MOD Single : A 53 GLN : amide:sc= 0.0405 X(o=0.04,f=-0.053) USER MOD Single : A 54 GLN : amide:sc= 0.474 K(o=0.47,f=-0.44) USER MOD Single : A 55 CYS SG : rot 65:sc= 0.186 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.606 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0929 USER MOD Single : A 73 MET CE :methyl -126:sc= 0 (180deg=-0.0396) USER MOD Single : A 74 SER OG : rot 161:sc= 1.29 USER MOD Single : A 75 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0197) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 156:sc= 1.11 (180deg=0.41) USER MOD Single : A 88 ASN : amide:sc= -0.0205 K(o=-0.021,f=-1.6!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.271 K(o=-0.27,f=-1.7!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 97:sc= 0.795 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 150:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -0.358 K(o=-0.36,f=-4!) USER MOD Single : A 113 LYS NZ :NH3+ 146:sc= 1.02 (180deg=-0.26) USER MOD Single : A 118 SER OG : rot 98:sc= 1.14 USER MOD Single : A 121 LYS NZ :NH3+ 168:sc= 0.786 (180deg=0.416) USER MOD Single : A 129 LYS NZ :NH3+ -135:sc= -0.266 (180deg=-0.62) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000789) USER MOD Single : A 139 ASN : amide:sc= -0.069 X(o=-0.069,f=0) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.552 -9.351 -5.674 1.00 0.00 N ATOM 2 CA GLY A 1 -2.645 -10.365 -6.230 1.00 0.00 C ATOM 3 C GLY A 1 -3.248 -11.753 -6.084 1.00 0.00 C ATOM 4 O GLY A 1 -4.383 -11.990 -6.513 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.126 -8.408 -5.781 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.459 -9.381 -6.182 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.713 -9.545 -4.665 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.454 -10.153 -7.282 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.684 -10.323 -5.717 1.00 0.00 H new ATOM 7 N ILE A 2 -2.507 -12.682 -5.480 1.00 0.00 N ATOM 8 CA ILE A 2 -2.974 -13.992 -5.036 1.00 0.00 C ATOM 9 C ILE A 2 -2.466 -14.137 -3.594 1.00 0.00 C ATOM 10 O ILE A 2 -1.485 -13.498 -3.217 1.00 0.00 O ATOM 11 CB ILE A 2 -2.440 -15.123 -5.965 1.00 0.00 C ATOM 12 CG1 ILE A 2 -2.663 -14.826 -7.467 1.00 0.00 C ATOM 13 CG2 ILE A 2 -3.060 -16.490 -5.600 1.00 0.00 C ATOM 14 CD1 ILE A 2 -2.125 -15.912 -8.407 1.00 0.00 C ATOM 0 H ILE A 2 -1.518 -12.533 -5.278 1.00 0.00 H new ATOM 0 HA ILE A 2 -4.060 -14.076 -5.078 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.364 -15.163 -5.798 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -3.731 -14.701 -7.647 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -2.185 -13.878 -7.714 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -2.667 -17.257 -6.267 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -2.808 -16.740 -4.570 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -4.144 -16.438 -5.706 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.321 -15.628 -9.441 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -1.051 -16.022 -8.258 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -2.620 -16.859 -8.191 1.00 0.00 H new ATOM 26 N ARG A 3 -3.125 -14.968 -2.785 1.00 0.00 N ATOM 27 CA ARG A 3 -2.741 -15.306 -1.417 1.00 0.00 C ATOM 28 C ARG A 3 -2.605 -16.819 -1.447 1.00 0.00 C ATOM 29 O ARG A 3 -3.621 -17.488 -1.643 1.00 0.00 O ATOM 30 CB ARG A 3 -3.802 -14.836 -0.400 1.00 0.00 C ATOM 31 CG ARG A 3 -3.937 -13.308 -0.312 1.00 0.00 C ATOM 32 CD ARG A 3 -5.098 -12.877 0.596 1.00 0.00 C ATOM 33 NE ARG A 3 -4.809 -13.075 2.026 1.00 0.00 N ATOM 34 CZ ARG A 3 -4.392 -12.143 2.892 1.00 0.00 C ATOM 35 NH1 ARG A 3 -4.091 -10.899 2.524 1.00 0.00 N ATOM 36 NH2 ARG A 3 -4.264 -12.466 4.167 1.00 0.00 N ATOM 0 H ARG A 3 -3.978 -15.444 -3.080 1.00 0.00 H new ATOM 0 HA ARG A 3 -1.821 -14.815 -1.099 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -4.768 -15.262 -0.672 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -3.547 -15.227 0.585 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -3.007 -12.884 0.066 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -4.090 -12.901 -1.311 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -5.321 -11.825 0.418 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -5.991 -13.442 0.329 1.00 0.00 H new ATOM 0 HE ARG A 3 -4.940 -14.017 2.394 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -4.174 -10.622 1.546 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -3.777 -10.223 3.220 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -4.482 -13.413 4.478 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -3.947 -11.768 4.841 1.00 0.00 H new ATOM 50 N MET A 4 -1.393 -17.355 -1.362 1.00 0.00 N ATOM 51 CA MET A 4 -1.123 -18.785 -1.464 1.00 0.00 C ATOM 52 C MET A 4 -0.754 -19.347 -0.093 1.00 0.00 C ATOM 53 O MET A 4 -0.658 -18.608 0.892 1.00 0.00 O ATOM 54 CB MET A 4 -0.017 -19.025 -2.507 1.00 0.00 C ATOM 55 CG MET A 4 -0.245 -20.259 -3.388 1.00 0.00 C ATOM 56 SD MET A 4 -1.249 -19.978 -4.879 1.00 0.00 S ATOM 57 CE MET A 4 -2.941 -19.923 -4.229 1.00 0.00 C ATOM 0 H MET A 4 -0.552 -16.796 -1.217 1.00 0.00 H new ATOM 0 HA MET A 4 -2.017 -19.311 -1.799 1.00 0.00 H new ATOM 0 HB2 MET A 4 0.062 -18.145 -3.146 1.00 0.00 H new ATOM 0 HB3 MET A 4 0.937 -19.131 -1.991 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.725 -20.651 -3.692 1.00 0.00 H new ATOM 0 HG3 MET A 4 -0.726 -21.030 -2.786 1.00 0.00 H new ATOM 0 HE1 MET A 4 -3.648 -20.113 -5.037 1.00 0.00 H new ATOM 0 HE2 MET A 4 -3.059 -20.684 -3.457 1.00 0.00 H new ATOM 0 HE3 MET A 4 -3.135 -18.939 -3.801 1.00 0.00 H new ATOM 67 N ALA A 5 -0.557 -20.667 -0.024 1.00 0.00 N ATOM 68 CA ALA A 5 -0.146 -21.403 1.163 1.00 0.00 C ATOM 69 C ALA A 5 1.348 -21.209 1.457 1.00 0.00 C ATOM 70 O ALA A 5 2.100 -22.164 1.662 1.00 0.00 O ATOM 71 CB ALA A 5 -0.539 -22.876 0.996 1.00 0.00 C ATOM 0 H ALA A 5 -0.687 -21.274 -0.834 1.00 0.00 H new ATOM 0 HA ALA A 5 -0.665 -21.011 2.038 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -0.235 -23.436 1.880 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -1.619 -22.952 0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -0.042 -23.288 0.117 1.00 0.00 H new ATOM 77 N THR A 6 1.762 -19.956 1.517 1.00 0.00 N ATOM 78 CA THR A 6 3.096 -19.465 1.838 1.00 0.00 C ATOM 79 C THR A 6 2.979 -18.755 3.194 1.00 0.00 C ATOM 80 O THR A 6 1.868 -18.588 3.714 1.00 0.00 O ATOM 81 CB THR A 6 3.530 -18.526 0.698 1.00 0.00 C ATOM 82 OG1 THR A 6 3.127 -19.020 -0.563 1.00 0.00 O ATOM 83 CG2 THR A 6 5.037 -18.265 0.610 1.00 0.00 C ATOM 0 H THR A 6 1.120 -19.187 1.326 1.00 0.00 H new ATOM 0 HA THR A 6 3.851 -20.247 1.920 1.00 0.00 H new ATOM 0 HB THR A 6 3.035 -17.588 0.947 1.00 0.00 H new ATOM 0 HG1 THR A 6 3.416 -18.400 -1.265 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.242 -17.593 -0.223 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.382 -17.808 1.538 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.561 -19.208 0.453 1.00 0.00 H new ATOM 91 N LYS A 7 4.094 -18.351 3.802 1.00 0.00 N ATOM 92 CA LYS A 7 4.095 -17.730 5.129 1.00 0.00 C ATOM 93 C LYS A 7 5.091 -16.593 5.204 1.00 0.00 C ATOM 94 O LYS A 7 5.816 -16.315 4.254 1.00 0.00 O ATOM 95 CB LYS A 7 4.401 -18.812 6.182 1.00 0.00 C ATOM 96 CG LYS A 7 3.159 -19.444 6.827 1.00 0.00 C ATOM 97 CD LYS A 7 2.699 -18.693 8.089 1.00 0.00 C ATOM 98 CE LYS A 7 1.579 -19.426 8.846 1.00 0.00 C ATOM 99 NZ LYS A 7 1.928 -20.819 9.221 1.00 0.00 N ATOM 0 H LYS A 7 5.022 -18.444 3.390 1.00 0.00 H new ATOM 0 HA LYS A 7 3.113 -17.300 5.327 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.992 -19.599 5.714 1.00 0.00 H new ATOM 0 HB3 LYS A 7 5.018 -18.373 6.966 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.346 -19.459 6.101 1.00 0.00 H new ATOM 0 HG3 LYS A 7 3.376 -20.481 7.085 1.00 0.00 H new ATOM 0 HD2 LYS A 7 3.551 -18.555 8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 7 2.351 -17.699 7.808 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.335 -18.866 9.749 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.682 -19.439 8.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 1.225 -21.184 9.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 1.934 -21.417 8.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 2.870 -20.834 9.661 1.00 0.00 H new ATOM 113 N ILE A 8 5.160 -15.945 6.358 1.00 0.00 N ATOM 114 CA ILE A 8 6.062 -14.839 6.630 1.00 0.00 C ATOM 115 C ILE A 8 6.870 -15.141 7.883 1.00 0.00 C ATOM 116 O ILE A 8 6.379 -15.820 8.792 1.00 0.00 O ATOM 117 CB ILE A 8 5.269 -13.526 6.802 1.00 0.00 C ATOM 118 CG1 ILE A 8 4.570 -13.353 8.169 1.00 0.00 C ATOM 119 CG2 ILE A 8 4.279 -13.289 5.653 1.00 0.00 C ATOM 120 CD1 ILE A 8 3.457 -14.346 8.528 1.00 0.00 C ATOM 0 H ILE A 8 4.570 -16.184 7.155 1.00 0.00 H new ATOM 0 HA ILE A 8 6.742 -14.716 5.787 1.00 0.00 H new ATOM 0 HB ILE A 8 6.039 -12.755 6.769 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.333 -13.408 8.946 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.149 -12.348 8.206 1.00 0.00 H new ATOM 0 HG21 ILE A 8 3.745 -12.353 5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 8 4.823 -13.234 4.710 1.00 0.00 H new ATOM 0 HG23 ILE A 8 3.565 -14.112 5.612 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.058 -14.105 9.513 1.00 0.00 H new ATOM 0 HD12 ILE A 8 2.660 -14.282 7.788 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.862 -15.358 8.539 1.00 0.00 H new ATOM 132 N ASP A 9 8.085 -14.613 7.960 1.00 0.00 N ATOM 133 CA ASP A 9 8.900 -14.749 9.158 1.00 0.00 C ATOM 134 C ASP A 9 8.590 -13.455 9.892 1.00 0.00 C ATOM 135 O ASP A 9 9.254 -12.439 9.700 1.00 0.00 O ATOM 136 CB ASP A 9 10.394 -14.938 8.894 1.00 0.00 C ATOM 137 CG ASP A 9 11.044 -15.357 10.213 1.00 0.00 C ATOM 138 OD1 ASP A 9 10.806 -14.695 11.253 1.00 0.00 O ATOM 139 OD2 ASP A 9 11.647 -16.451 10.218 1.00 0.00 O ATOM 0 H ASP A 9 8.527 -14.087 7.206 1.00 0.00 H new ATOM 0 HA ASP A 9 8.666 -15.652 9.722 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.555 -15.697 8.129 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.838 -14.014 8.524 1.00 0.00 H new ATOM 144 N LYS A 10 7.483 -13.433 10.635 1.00 0.00 N ATOM 145 CA LYS A 10 7.043 -12.217 11.295 1.00 0.00 C ATOM 146 C LYS A 10 8.043 -11.702 12.313 1.00 0.00 C ATOM 147 O LYS A 10 8.054 -10.498 12.530 1.00 0.00 O ATOM 148 CB LYS A 10 5.637 -12.379 11.885 1.00 0.00 C ATOM 149 CG LYS A 10 5.661 -13.119 13.227 1.00 0.00 C ATOM 150 CD LYS A 10 4.258 -13.298 13.801 1.00 0.00 C ATOM 151 CE LYS A 10 3.424 -14.367 13.090 1.00 0.00 C ATOM 152 NZ LYS A 10 4.005 -15.714 13.251 1.00 0.00 N ATOM 0 H LYS A 10 6.882 -14.242 10.791 1.00 0.00 H new ATOM 0 HA LYS A 10 6.985 -11.446 10.527 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.185 -11.396 12.020 1.00 0.00 H new ATOM 0 HB3 LYS A 10 5.009 -12.925 11.181 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.127 -14.095 13.095 1.00 0.00 H new ATOM 0 HG3 LYS A 10 6.276 -12.565 13.936 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.339 -13.558 14.856 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.731 -12.346 13.747 1.00 0.00 H new ATOM 0 HE2 LYS A 10 2.409 -14.359 13.487 1.00 0.00 H new ATOM 0 HE3 LYS A 10 3.353 -14.126 12.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.318 -16.428 12.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.870 -15.790 12.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.238 -15.874 14.252 1.00 0.00 H new ATOM 166 N GLU A 11 8.838 -12.560 12.946 1.00 0.00 N ATOM 167 CA GLU A 11 9.823 -12.123 13.919 1.00 0.00 C ATOM 168 C GLU A 11 10.922 -11.364 13.182 1.00 0.00 C ATOM 169 O GLU A 11 11.141 -10.177 13.440 1.00 0.00 O ATOM 170 CB GLU A 11 10.391 -13.339 14.670 1.00 0.00 C ATOM 171 CG GLU A 11 9.430 -13.928 15.719 1.00 0.00 C ATOM 172 CD GLU A 11 9.587 -13.245 17.078 1.00 0.00 C ATOM 173 OE1 GLU A 11 10.649 -13.439 17.716 1.00 0.00 O ATOM 174 OE2 GLU A 11 8.672 -12.502 17.502 1.00 0.00 O ATOM 0 H GLU A 11 8.815 -13.569 12.798 1.00 0.00 H new ATOM 0 HA GLU A 11 9.366 -11.464 14.657 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.644 -14.115 13.947 1.00 0.00 H new ATOM 0 HB3 GLU A 11 11.318 -13.048 15.164 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.402 -13.818 15.373 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.618 -14.996 15.825 1.00 0.00 H new ATOM 181 N ALA A 12 11.579 -12.035 12.234 1.00 0.00 N ATOM 182 CA ALA A 12 12.700 -11.470 11.510 1.00 0.00 C ATOM 183 C ALA A 12 12.267 -10.274 10.663 1.00 0.00 C ATOM 184 O ALA A 12 12.969 -9.262 10.610 1.00 0.00 O ATOM 185 CB ALA A 12 13.338 -12.571 10.661 1.00 0.00 C ATOM 0 H ALA A 12 11.342 -12.986 11.952 1.00 0.00 H new ATOM 0 HA ALA A 12 13.440 -11.092 12.215 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.184 -12.161 10.109 1.00 0.00 H new ATOM 0 HB2 ALA A 12 13.683 -13.376 11.309 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.602 -12.961 9.958 1.00 0.00 H new ATOM 191 N CYS A 13 11.102 -10.356 10.012 1.00 0.00 N ATOM 192 CA CYS A 13 10.644 -9.261 9.176 1.00 0.00 C ATOM 193 C CYS A 13 10.156 -8.091 10.033 1.00 0.00 C ATOM 194 O CYS A 13 10.341 -6.942 9.623 1.00 0.00 O ATOM 195 CB CYS A 13 9.595 -9.725 8.164 1.00 0.00 C ATOM 196 SG CYS A 13 10.293 -11.012 7.091 1.00 0.00 S ATOM 0 H CYS A 13 10.474 -11.159 10.051 1.00 0.00 H new ATOM 0 HA CYS A 13 11.491 -8.901 8.593 1.00 0.00 H new ATOM 0 HB2 CYS A 13 8.720 -10.111 8.686 1.00 0.00 H new ATOM 0 HB3 CYS A 13 9.260 -8.880 7.562 1.00 0.00 H new ATOM 0 HG CYS A 13 10.165 -12.172 7.665 1.00 0.00 H new ATOM 202 N ARG A 14 9.565 -8.340 11.216 1.00 0.00 N ATOM 203 CA ARG A 14 9.178 -7.236 12.093 1.00 0.00 C ATOM 204 C ARG A 14 10.433 -6.504 12.529 1.00 0.00 C ATOM 205 O ARG A 14 10.364 -5.288 12.613 1.00 0.00 O ATOM 206 CB ARG A 14 8.354 -7.685 13.314 1.00 0.00 C ATOM 207 CG ARG A 14 7.966 -6.517 14.241 1.00 0.00 C ATOM 208 CD ARG A 14 7.348 -6.992 15.560 1.00 0.00 C ATOM 209 NE ARG A 14 6.517 -5.941 16.162 1.00 0.00 N ATOM 210 CZ ARG A 14 6.900 -4.848 16.833 1.00 0.00 C ATOM 211 NH1 ARG A 14 8.181 -4.616 17.119 1.00 0.00 N ATOM 212 NH2 ARG A 14 5.965 -3.979 17.205 1.00 0.00 N ATOM 0 H ARG A 14 9.352 -9.271 11.574 1.00 0.00 H new ATOM 0 HA ARG A 14 8.523 -6.573 11.528 1.00 0.00 H new ATOM 0 HB2 ARG A 14 7.449 -8.185 12.970 1.00 0.00 H new ATOM 0 HB3 ARG A 14 8.927 -8.418 13.882 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.851 -5.917 14.454 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.258 -5.868 13.725 1.00 0.00 H new ATOM 0 HD2 ARG A 14 6.743 -7.881 15.383 1.00 0.00 H new ATOM 0 HD3 ARG A 14 8.139 -7.277 16.254 1.00 0.00 H new ATOM 0 HE ARG A 14 5.510 -6.060 16.054 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.897 -5.280 16.825 1.00 0.00 H new ATOM 0 HH12 ARG A 14 8.445 -3.775 17.632 1.00 0.00 H new ATOM 0 HH21 ARG A 14 4.986 -4.155 16.978 1.00 0.00 H new ATOM 0 HH22 ARG A 14 6.226 -3.137 17.718 1.00 0.00 H new ATOM 226 N ALA A 15 11.557 -7.182 12.782 1.00 0.00 N ATOM 227 CA ALA A 15 12.763 -6.506 13.231 1.00 0.00 C ATOM 228 C ALA A 15 13.221 -5.471 12.196 1.00 0.00 C ATOM 229 O ALA A 15 13.492 -4.328 12.558 1.00 0.00 O ATOM 230 CB ALA A 15 13.859 -7.528 13.546 1.00 0.00 C ATOM 0 H ALA A 15 11.650 -8.193 12.682 1.00 0.00 H new ATOM 0 HA ALA A 15 12.544 -5.965 14.151 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.756 -7.008 13.881 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.515 -8.200 14.332 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.087 -8.105 12.650 1.00 0.00 H new ATOM 236 N ALA A 16 13.271 -5.827 10.910 1.00 0.00 N ATOM 237 CA ALA A 16 13.624 -4.870 9.863 1.00 0.00 C ATOM 238 C ALA A 16 12.630 -3.714 9.803 1.00 0.00 C ATOM 239 O ALA A 16 13.038 -2.553 9.804 1.00 0.00 O ATOM 240 CB ALA A 16 13.651 -5.565 8.504 1.00 0.00 C ATOM 0 H ALA A 16 13.072 -6.768 10.571 1.00 0.00 H new ATOM 0 HA ALA A 16 14.610 -4.473 10.103 1.00 0.00 H new ATOM 0 HB1 ALA A 16 13.915 -4.843 7.731 1.00 0.00 H new ATOM 0 HB2 ALA A 16 14.390 -6.366 8.520 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.667 -5.983 8.289 1.00 0.00 H new ATOM 246 N TYR A 17 11.335 -4.037 9.743 1.00 0.00 N ATOM 247 CA TYR A 17 10.259 -3.056 9.752 1.00 0.00 C ATOM 248 C TYR A 17 10.431 -2.089 10.929 1.00 0.00 C ATOM 249 O TYR A 17 10.382 -0.876 10.752 1.00 0.00 O ATOM 250 CB TYR A 17 8.909 -3.794 9.768 1.00 0.00 C ATOM 251 CG TYR A 17 7.743 -2.969 10.276 1.00 0.00 C ATOM 252 CD1 TYR A 17 7.227 -1.913 9.504 1.00 0.00 C ATOM 253 CD2 TYR A 17 7.216 -3.221 11.557 1.00 0.00 C ATOM 254 CE1 TYR A 17 6.220 -1.080 10.021 1.00 0.00 C ATOM 255 CE2 TYR A 17 6.184 -2.416 12.069 1.00 0.00 C ATOM 256 CZ TYR A 17 5.695 -1.329 11.310 1.00 0.00 C ATOM 257 OH TYR A 17 4.726 -0.520 11.817 1.00 0.00 O ATOM 0 H TYR A 17 11.006 -5.001 9.686 1.00 0.00 H new ATOM 0 HA TYR A 17 10.290 -2.445 8.850 1.00 0.00 H new ATOM 0 HB2 TYR A 17 8.684 -4.133 8.757 1.00 0.00 H new ATOM 0 HB3 TYR A 17 9.004 -4.685 10.389 1.00 0.00 H new ATOM 0 HD1 TYR A 17 7.607 -1.741 8.508 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.606 -4.036 12.148 1.00 0.00 H new ATOM 0 HE1 TYR A 17 5.848 -0.252 9.435 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.765 -2.628 13.042 1.00 0.00 H new ATOM 0 HH TYR A 17 4.476 -0.831 12.712 1.00 0.00 H new ATOM 267 N ASN A 18 10.684 -2.626 12.120 1.00 0.00 N ATOM 268 CA ASN A 18 10.861 -1.909 13.367 1.00 0.00 C ATOM 269 C ASN A 18 12.031 -0.938 13.277 1.00 0.00 C ATOM 270 O ASN A 18 11.833 0.211 13.658 1.00 0.00 O ATOM 271 CB ASN A 18 11.037 -2.924 14.514 1.00 0.00 C ATOM 272 CG ASN A 18 11.529 -2.371 15.840 1.00 0.00 C ATOM 273 OD1 ASN A 18 12.179 -3.079 16.601 1.00 0.00 O ATOM 274 ND2 ASN A 18 11.193 -1.146 16.190 1.00 0.00 N ATOM 0 H ASN A 18 10.775 -3.635 12.241 1.00 0.00 H new ATOM 0 HA ASN A 18 9.975 -1.308 13.572 1.00 0.00 H new ATOM 0 HB2 ASN A 18 10.079 -3.416 14.684 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.736 -3.693 14.185 1.00 0.00 H new ATOM 0 HD21 ASN A 18 11.474 -0.780 17.100 1.00 0.00 H new ATOM 0 HD22 ASN A 18 10.652 -0.563 15.551 1.00 0.00 H new ATOM 281 N LEU A 19 13.216 -1.351 12.814 1.00 0.00 N ATOM 282 CA LEU A 19 14.331 -0.434 12.625 1.00 0.00 C ATOM 283 C LEU A 19 13.974 0.670 11.647 1.00 0.00 C ATOM 284 O LEU A 19 14.152 1.843 11.951 1.00 0.00 O ATOM 285 CB LEU A 19 15.574 -1.187 12.149 1.00 0.00 C ATOM 286 CG LEU A 19 16.384 -1.872 13.259 1.00 0.00 C ATOM 287 CD1 LEU A 19 15.641 -2.541 14.421 1.00 0.00 C ATOM 288 CD2 LEU A 19 17.311 -2.878 12.583 1.00 0.00 C ATOM 0 H LEU A 19 13.422 -2.318 12.564 1.00 0.00 H new ATOM 0 HA LEU A 19 14.551 0.026 13.588 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.268 -1.942 11.425 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.225 -0.488 11.624 1.00 0.00 H new ATOM 0 HG LEU A 19 16.893 -1.056 13.772 1.00 0.00 H new ATOM 0 HD11 LEU A 19 16.363 -2.975 15.113 1.00 0.00 H new ATOM 0 HD12 LEU A 19 15.039 -1.798 14.944 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.992 -3.327 14.034 1.00 0.00 H new ATOM 0 HD21 LEU A 19 17.907 -3.389 13.339 1.00 0.00 H new ATOM 0 HD22 LEU A 19 16.717 -3.609 12.035 1.00 0.00 H new ATOM 0 HD23 LEU A 19 17.972 -2.356 11.892 1.00 0.00 H new ATOM 300 N VAL A 20 13.461 0.323 10.473 1.00 0.00 N ATOM 301 CA VAL A 20 13.119 1.322 9.472 1.00 0.00 C ATOM 302 C VAL A 20 12.046 2.280 10.027 1.00 0.00 C ATOM 303 O VAL A 20 12.078 3.467 9.704 1.00 0.00 O ATOM 304 CB VAL A 20 12.761 0.584 8.172 1.00 0.00 C ATOM 305 CG1 VAL A 20 12.206 1.482 7.073 1.00 0.00 C ATOM 306 CG2 VAL A 20 14.006 -0.093 7.595 1.00 0.00 C ATOM 0 H VAL A 20 13.274 -0.640 10.193 1.00 0.00 H new ATOM 0 HA VAL A 20 13.954 1.979 9.229 1.00 0.00 H new ATOM 0 HB VAL A 20 11.987 -0.128 8.459 1.00 0.00 H new ATOM 0 HG11 VAL A 20 11.980 0.881 6.192 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.296 1.967 7.425 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.945 2.241 6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 20 13.743 -0.614 6.674 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.764 0.661 7.382 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.399 -0.809 8.317 1.00 0.00 H new ATOM 316 N ARG A 21 11.162 1.828 10.923 1.00 0.00 N ATOM 317 CA ARG A 21 10.157 2.659 11.582 1.00 0.00 C ATOM 318 C ARG A 21 10.746 3.556 12.674 1.00 0.00 C ATOM 319 O ARG A 21 10.281 4.679 12.837 1.00 0.00 O ATOM 320 CB ARG A 21 9.080 1.739 12.207 1.00 0.00 C ATOM 321 CG ARG A 21 7.856 2.492 12.773 1.00 0.00 C ATOM 322 CD ARG A 21 7.984 2.850 14.271 1.00 0.00 C ATOM 323 NE ARG A 21 7.814 4.294 14.530 1.00 0.00 N ATOM 324 CZ ARG A 21 8.482 5.022 15.436 1.00 0.00 C ATOM 325 NH1 ARG A 21 9.215 4.432 16.380 1.00 0.00 N ATOM 326 NH2 ARG A 21 8.412 6.347 15.415 1.00 0.00 N ATOM 0 H ARG A 21 11.127 0.851 11.215 1.00 0.00 H new ATOM 0 HA ARG A 21 9.728 3.315 10.825 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.740 1.031 11.451 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.536 1.156 13.007 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.708 3.408 12.201 1.00 0.00 H new ATOM 0 HG3 ARG A 21 6.966 1.879 12.630 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.238 2.293 14.838 1.00 0.00 H new ATOM 0 HD3 ARG A 21 8.962 2.533 14.634 1.00 0.00 H new ATOM 0 HE ARG A 21 7.121 4.785 13.965 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.273 3.414 16.419 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.718 4.998 17.063 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.848 6.817 14.707 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.922 6.896 16.107 1.00 0.00 H new ATOM 340 N ASP A 22 11.709 3.061 13.450 1.00 0.00 N ATOM 341 CA ASP A 22 12.275 3.779 14.589 1.00 0.00 C ATOM 342 C ASP A 22 13.075 5.014 14.188 1.00 0.00 C ATOM 343 O ASP A 22 14.085 4.903 13.499 1.00 0.00 O ATOM 344 CB ASP A 22 13.151 2.818 15.407 1.00 0.00 C ATOM 345 CG ASP A 22 13.346 3.307 16.840 1.00 0.00 C ATOM 346 OD1 ASP A 22 13.528 4.521 17.074 1.00 0.00 O ATOM 347 OD2 ASP A 22 13.145 2.460 17.741 1.00 0.00 O ATOM 0 H ASP A 22 12.122 2.140 13.303 1.00 0.00 H new ATOM 0 HA ASP A 22 11.441 4.141 15.191 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.692 1.830 15.420 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.122 2.712 14.924 1.00 0.00 H new ATOM 352 N ASP A 23 12.700 6.179 14.717 1.00 0.00 N ATOM 353 CA ASP A 23 13.392 7.449 14.506 1.00 0.00 C ATOM 354 C ASP A 23 14.849 7.395 14.961 1.00 0.00 C ATOM 355 O ASP A 23 15.697 8.064 14.374 1.00 0.00 O ATOM 356 CB ASP A 23 12.680 8.562 15.286 1.00 0.00 C ATOM 357 CG ASP A 23 11.455 9.084 14.550 1.00 0.00 C ATOM 358 OD1 ASP A 23 11.612 9.872 13.598 1.00 0.00 O ATOM 359 OD2 ASP A 23 10.314 8.724 14.922 1.00 0.00 O ATOM 0 H ASP A 23 11.883 6.267 15.321 1.00 0.00 H new ATOM 0 HA ASP A 23 13.373 7.651 13.435 1.00 0.00 H new ATOM 0 HB2 ASP A 23 12.381 8.184 16.264 1.00 0.00 H new ATOM 0 HB3 ASP A 23 13.375 9.383 15.460 1.00 0.00 H new ATOM 364 N GLY A 24 15.150 6.609 15.999 1.00 0.00 N ATOM 365 CA GLY A 24 16.493 6.476 16.541 1.00 0.00 C ATOM 366 C GLY A 24 17.346 5.489 15.749 1.00 0.00 C ATOM 367 O GLY A 24 18.554 5.418 15.975 1.00 0.00 O ATOM 0 H GLY A 24 14.456 6.044 16.487 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.979 7.452 16.543 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.432 6.148 17.579 1.00 0.00 H new ATOM 371 N SER A 25 16.755 4.705 14.843 1.00 0.00 N ATOM 372 CA SER A 25 17.524 3.810 14.004 1.00 0.00 C ATOM 373 C SER A 25 18.088 4.631 12.853 1.00 0.00 C ATOM 374 O SER A 25 17.341 5.241 12.076 1.00 0.00 O ATOM 375 CB SER A 25 16.626 2.682 13.494 1.00 0.00 C ATOM 376 OG SER A 25 17.241 1.932 12.465 1.00 0.00 O ATOM 0 H SER A 25 15.749 4.679 14.679 1.00 0.00 H new ATOM 0 HA SER A 25 18.341 3.351 14.561 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.372 2.020 14.322 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.691 3.103 13.125 1.00 0.00 H new ATOM 0 HG SER A 25 17.069 2.360 11.601 1.00 0.00 H new ATOM 382 N ALA A 26 19.417 4.585 12.723 1.00 0.00 N ATOM 383 CA ALA A 26 20.129 5.222 11.629 1.00 0.00 C ATOM 384 C ALA A 26 19.851 4.466 10.325 1.00 0.00 C ATOM 385 O ALA A 26 20.006 5.040 9.254 1.00 0.00 O ATOM 386 CB ALA A 26 21.632 5.243 11.927 1.00 0.00 C ATOM 0 H ALA A 26 20.026 4.100 13.382 1.00 0.00 H new ATOM 0 HA ALA A 26 19.783 6.250 11.521 1.00 0.00 H new ATOM 0 HB1 ALA A 26 22.160 5.722 11.102 1.00 0.00 H new ATOM 0 HB2 ALA A 26 21.813 5.800 12.846 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.994 4.222 12.045 1.00 0.00 H new ATOM 392 N VAL A 27 19.482 3.180 10.393 1.00 0.00 N ATOM 393 CA VAL A 27 19.107 2.412 9.217 1.00 0.00 C ATOM 394 C VAL A 27 17.804 3.023 8.715 1.00 0.00 C ATOM 395 O VAL A 27 16.820 3.063 9.459 1.00 0.00 O ATOM 396 CB VAL A 27 18.970 0.917 9.576 1.00 0.00 C ATOM 397 CG1 VAL A 27 18.108 0.125 8.584 1.00 0.00 C ATOM 398 CG2 VAL A 27 20.367 0.282 9.650 1.00 0.00 C ATOM 0 H VAL A 27 19.438 2.652 11.265 1.00 0.00 H new ATOM 0 HA VAL A 27 19.862 2.455 8.432 1.00 0.00 H new ATOM 0 HB VAL A 27 18.464 0.872 10.540 1.00 0.00 H new ATOM 0 HG11 VAL A 27 18.056 -0.917 8.899 1.00 0.00 H new ATOM 0 HG12 VAL A 27 17.103 0.547 8.557 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.552 0.182 7.590 1.00 0.00 H new ATOM 0 HG21 VAL A 27 20.274 -0.774 9.903 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.863 0.381 8.685 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.957 0.788 10.415 1.00 0.00 H new ATOM 408 N ILE A 28 17.804 3.445 7.451 1.00 0.00 N ATOM 409 CA ILE A 28 16.649 4.019 6.778 1.00 0.00 C ATOM 410 C ILE A 28 16.100 3.032 5.742 1.00 0.00 C ATOM 411 O ILE A 28 14.922 3.125 5.398 1.00 0.00 O ATOM 412 CB ILE A 28 16.970 5.415 6.184 1.00 0.00 C ATOM 413 CG1 ILE A 28 17.709 5.372 4.822 1.00 0.00 C ATOM 414 CG2 ILE A 28 17.732 6.313 7.173 1.00 0.00 C ATOM 415 CD1 ILE A 28 16.722 5.650 3.682 1.00 0.00 C ATOM 0 H ILE A 28 18.630 3.394 6.855 1.00 0.00 H new ATOM 0 HA ILE A 28 15.860 4.189 7.510 1.00 0.00 H new ATOM 0 HB ILE A 28 15.991 5.855 5.995 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.510 6.112 4.810 1.00 0.00 H new ATOM 0 HG13 ILE A 28 18.174 4.396 4.682 1.00 0.00 H new ATOM 0 HG21 ILE A 28 17.932 7.278 6.708 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.130 6.460 8.070 1.00 0.00 H new ATOM 0 HG23 ILE A 28 18.675 5.838 7.443 1.00 0.00 H new ATOM 0 HD11 ILE A 28 17.249 5.618 2.728 1.00 0.00 H new ATOM 0 HD12 ILE A 28 15.937 4.894 3.688 1.00 0.00 H new ATOM 0 HD13 ILE A 28 16.277 6.636 3.818 1.00 0.00 H new ATOM 427 N TRP A 29 16.925 2.099 5.242 1.00 0.00 N ATOM 428 CA TRP A 29 16.529 1.122 4.245 1.00 0.00 C ATOM 429 C TRP A 29 16.953 -0.274 4.670 1.00 0.00 C ATOM 430 O TRP A 29 18.050 -0.471 5.195 1.00 0.00 O ATOM 431 CB TRP A 29 17.116 1.471 2.859 1.00 0.00 C ATOM 432 CG TRP A 29 18.591 1.335 2.617 1.00 0.00 C ATOM 433 CD1 TRP A 29 19.459 2.359 2.446 1.00 0.00 C ATOM 434 CD2 TRP A 29 19.359 0.113 2.357 1.00 0.00 C ATOM 435 NE1 TRP A 29 20.710 1.851 2.180 1.00 0.00 N ATOM 436 CE2 TRP A 29 20.716 0.478 2.133 1.00 0.00 C ATOM 437 CE3 TRP A 29 19.053 -1.263 2.243 1.00 0.00 C ATOM 438 CZ2 TRP A 29 21.733 -0.466 1.935 1.00 0.00 C ATOM 439 CZ3 TRP A 29 20.057 -2.220 1.996 1.00 0.00 C ATOM 440 CH2 TRP A 29 21.400 -1.828 1.865 1.00 0.00 C ATOM 0 H TRP A 29 17.899 2.010 5.531 1.00 0.00 H new ATOM 0 HA TRP A 29 15.442 1.145 4.164 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.607 0.847 2.124 1.00 0.00 H new ATOM 0 HB3 TRP A 29 16.845 2.504 2.642 1.00 0.00 H new ATOM 0 HD1 TRP A 29 19.210 3.408 2.508 1.00 0.00 H new ATOM 0 HE1 TRP A 29 21.538 2.428 2.034 1.00 0.00 H new ATOM 0 HE3 TRP A 29 18.028 -1.587 2.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 22.761 -0.149 1.837 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 19.792 -3.263 1.907 1.00 0.00 H new ATOM 0 HH2 TRP A 29 22.170 -2.569 1.712 1.00 0.00 H new ATOM 451 N VAL A 30 16.073 -1.242 4.444 1.00 0.00 N ATOM 452 CA VAL A 30 16.340 -2.663 4.688 1.00 0.00 C ATOM 453 C VAL A 30 15.786 -3.399 3.473 1.00 0.00 C ATOM 454 O VAL A 30 14.826 -2.939 2.856 1.00 0.00 O ATOM 455 CB VAL A 30 15.750 -3.188 6.017 1.00 0.00 C ATOM 456 CG1 VAL A 30 16.095 -4.672 6.233 1.00 0.00 C ATOM 457 CG2 VAL A 30 16.277 -2.453 7.252 1.00 0.00 C ATOM 0 H VAL A 30 15.137 -1.064 4.080 1.00 0.00 H new ATOM 0 HA VAL A 30 17.410 -2.832 4.808 1.00 0.00 H new ATOM 0 HB VAL A 30 14.677 -3.025 5.918 1.00 0.00 H new ATOM 0 HG11 VAL A 30 15.666 -5.012 7.176 1.00 0.00 H new ATOM 0 HG12 VAL A 30 15.686 -5.264 5.414 1.00 0.00 H new ATOM 0 HG13 VAL A 30 17.178 -4.793 6.262 1.00 0.00 H new ATOM 0 HG21 VAL A 30 15.821 -2.874 8.148 1.00 0.00 H new ATOM 0 HG22 VAL A 30 17.360 -2.567 7.309 1.00 0.00 H new ATOM 0 HG23 VAL A 30 16.027 -1.395 7.180 1.00 0.00 H new ATOM 467 N THR A 31 16.374 -4.532 3.110 1.00 0.00 N ATOM 468 CA THR A 31 15.886 -5.358 2.018 1.00 0.00 C ATOM 469 C THR A 31 15.173 -6.585 2.595 1.00 0.00 C ATOM 470 O THR A 31 15.381 -6.941 3.757 1.00 0.00 O ATOM 471 CB THR A 31 17.019 -5.666 1.020 1.00 0.00 C ATOM 472 OG1 THR A 31 18.185 -6.142 1.657 1.00 0.00 O ATOM 473 CG2 THR A 31 17.427 -4.429 0.213 1.00 0.00 C ATOM 0 H THR A 31 17.206 -4.904 3.568 1.00 0.00 H new ATOM 0 HA THR A 31 15.141 -4.826 1.427 1.00 0.00 H new ATOM 0 HB THR A 31 16.610 -6.434 0.364 1.00 0.00 H new ATOM 0 HG1 THR A 31 18.436 -5.530 2.380 1.00 0.00 H new ATOM 0 HG21 THR A 31 18.228 -4.693 -0.477 1.00 0.00 H new ATOM 0 HG22 THR A 31 16.569 -4.063 -0.350 1.00 0.00 H new ATOM 0 HG23 THR A 31 17.775 -3.650 0.892 1.00 0.00 H new ATOM 481 N PHE A 32 14.320 -7.229 1.802 1.00 0.00 N ATOM 482 CA PHE A 32 13.626 -8.455 2.155 1.00 0.00 C ATOM 483 C PHE A 32 13.968 -9.453 1.062 1.00 0.00 C ATOM 484 O PHE A 32 13.769 -9.173 -0.124 1.00 0.00 O ATOM 485 CB PHE A 32 12.108 -8.231 2.284 1.00 0.00 C ATOM 486 CG PHE A 32 11.681 -7.517 3.556 1.00 0.00 C ATOM 487 CD1 PHE A 32 12.026 -8.064 4.805 1.00 0.00 C ATOM 488 CD2 PHE A 32 10.925 -6.328 3.510 1.00 0.00 C ATOM 489 CE1 PHE A 32 11.681 -7.403 5.993 1.00 0.00 C ATOM 490 CE2 PHE A 32 10.542 -5.692 4.708 1.00 0.00 C ATOM 491 CZ PHE A 32 10.936 -6.215 5.950 1.00 0.00 C ATOM 0 H PHE A 32 14.088 -6.897 0.866 1.00 0.00 H new ATOM 0 HA PHE A 32 13.940 -8.824 3.131 1.00 0.00 H new ATOM 0 HB2 PHE A 32 11.765 -7.653 1.426 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.606 -9.197 2.239 1.00 0.00 H new ATOM 0 HD1 PHE A 32 12.561 -9.001 4.850 1.00 0.00 H new ATOM 0 HD2 PHE A 32 10.640 -5.905 2.558 1.00 0.00 H new ATOM 0 HE1 PHE A 32 11.990 -7.810 6.944 1.00 0.00 H new ATOM 0 HE2 PHE A 32 9.941 -4.796 4.670 1.00 0.00 H new ATOM 0 HZ PHE A 32 10.668 -5.707 6.865 1.00 0.00 H new ATOM 501 N LYS A 33 14.519 -10.598 1.458 1.00 0.00 N ATOM 502 CA LYS A 33 14.854 -11.690 0.572 1.00 0.00 C ATOM 503 C LYS A 33 13.701 -12.677 0.690 1.00 0.00 C ATOM 504 O LYS A 33 12.798 -12.521 1.517 1.00 0.00 O ATOM 505 CB LYS A 33 16.177 -12.331 1.031 1.00 0.00 C ATOM 506 CG LYS A 33 17.411 -11.422 0.943 1.00 0.00 C ATOM 507 CD LYS A 33 18.139 -11.505 -0.407 1.00 0.00 C ATOM 508 CE LYS A 33 19.296 -12.518 -0.415 1.00 0.00 C ATOM 509 NZ LYS A 33 18.852 -13.927 -0.336 1.00 0.00 N ATOM 0 H LYS A 33 14.748 -10.789 2.434 1.00 0.00 H new ATOM 0 HA LYS A 33 14.990 -11.367 -0.460 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.063 -12.662 2.063 1.00 0.00 H new ATOM 0 HB3 LYS A 33 16.358 -13.222 0.429 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.106 -10.391 1.119 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.106 -11.689 1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 33 17.422 -11.777 -1.182 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.527 -10.519 -0.663 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.881 -12.381 -1.324 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.958 -12.307 0.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 19.680 -14.555 -0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 18.347 -14.082 0.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.216 -14.136 -1.132 1.00 0.00 H new ATOM 523 N TYR A 34 13.753 -13.730 -0.110 1.00 0.00 N ATOM 524 CA TYR A 34 12.765 -14.782 -0.074 1.00 0.00 C ATOM 525 C TYR A 34 13.516 -16.079 0.083 1.00 0.00 C ATOM 526 O TYR A 34 14.378 -16.385 -0.745 1.00 0.00 O ATOM 527 CB TYR A 34 11.979 -14.786 -1.388 1.00 0.00 C ATOM 528 CG TYR A 34 10.947 -13.690 -1.456 1.00 0.00 C ATOM 529 CD1 TYR A 34 11.319 -12.347 -1.661 1.00 0.00 C ATOM 530 CD2 TYR A 34 9.603 -14.018 -1.234 1.00 0.00 C ATOM 531 CE1 TYR A 34 10.343 -11.340 -1.606 1.00 0.00 C ATOM 532 CE2 TYR A 34 8.625 -13.022 -1.221 1.00 0.00 C ATOM 533 CZ TYR A 34 8.989 -11.672 -1.400 1.00 0.00 C ATOM 534 OH TYR A 34 8.047 -10.696 -1.343 1.00 0.00 O ATOM 0 H TYR A 34 14.487 -13.874 -0.803 1.00 0.00 H new ATOM 0 HA TYR A 34 12.061 -14.640 0.746 1.00 0.00 H new ATOM 0 HB2 TYR A 34 12.673 -14.677 -2.221 1.00 0.00 H new ATOM 0 HB3 TYR A 34 11.486 -15.751 -1.508 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.350 -12.094 -1.859 1.00 0.00 H new ATOM 0 HD2 TYR A 34 9.322 -15.048 -1.072 1.00 0.00 H new ATOM 0 HE1 TYR A 34 10.631 -10.306 -1.722 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.588 -13.286 -1.074 1.00 0.00 H new ATOM 0 HH TYR A 34 8.226 -10.027 -2.037 1.00 0.00 H new ATOM 544 N ASP A 35 13.190 -16.843 1.113 1.00 0.00 N ATOM 545 CA ASP A 35 13.761 -18.158 1.339 1.00 0.00 C ATOM 546 C ASP A 35 12.598 -19.110 1.137 1.00 0.00 C ATOM 547 O ASP A 35 11.583 -18.946 1.801 1.00 0.00 O ATOM 548 CB ASP A 35 14.318 -18.264 2.760 1.00 0.00 C ATOM 549 CG ASP A 35 14.872 -19.667 2.987 1.00 0.00 C ATOM 550 OD1 ASP A 35 14.079 -20.622 3.161 1.00 0.00 O ATOM 551 OD2 ASP A 35 16.116 -19.820 2.919 1.00 0.00 O ATOM 0 H ASP A 35 12.513 -16.563 1.823 1.00 0.00 H new ATOM 0 HA ASP A 35 14.593 -18.376 0.670 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.103 -17.523 2.910 1.00 0.00 H new ATOM 0 HB3 ASP A 35 13.534 -18.049 3.486 1.00 0.00 H new ATOM 556 N GLY A 36 12.733 -20.071 0.225 1.00 0.00 N ATOM 557 CA GLY A 36 11.736 -21.045 -0.195 1.00 0.00 C ATOM 558 C GLY A 36 10.271 -20.671 0.035 1.00 0.00 C ATOM 559 O GLY A 36 9.631 -20.085 -0.844 1.00 0.00 O ATOM 0 H GLY A 36 13.612 -20.196 -0.277 1.00 0.00 H new ATOM 0 HA2 GLY A 36 11.875 -21.237 -1.259 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.934 -21.981 0.327 1.00 0.00 H new ATOM 563 N SER A 37 9.747 -21.010 1.211 1.00 0.00 N ATOM 564 CA SER A 37 8.358 -20.850 1.635 1.00 0.00 C ATOM 565 C SER A 37 8.022 -19.547 2.382 1.00 0.00 C ATOM 566 O SER A 37 6.875 -19.392 2.818 1.00 0.00 O ATOM 567 CB SER A 37 8.014 -22.074 2.493 1.00 0.00 C ATOM 568 OG SER A 37 8.907 -22.200 3.590 1.00 0.00 O ATOM 0 H SER A 37 10.320 -21.432 1.942 1.00 0.00 H new ATOM 0 HA SER A 37 7.751 -20.777 0.733 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.992 -21.988 2.861 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.057 -22.975 1.880 1.00 0.00 H new ATOM 0 HG SER A 37 8.664 -22.987 4.121 1.00 0.00 H new ATOM 574 N THR A 38 8.965 -18.617 2.572 1.00 0.00 N ATOM 575 CA THR A 38 8.706 -17.418 3.350 1.00 0.00 C ATOM 576 C THR A 38 9.528 -16.189 2.927 1.00 0.00 C ATOM 577 O THR A 38 10.344 -16.238 2.001 1.00 0.00 O ATOM 578 CB THR A 38 8.853 -17.818 4.832 1.00 0.00 C ATOM 579 OG1 THR A 38 8.165 -16.899 5.644 1.00 0.00 O ATOM 580 CG2 THR A 38 10.297 -17.918 5.324 1.00 0.00 C ATOM 0 H THR A 38 9.911 -18.679 2.195 1.00 0.00 H new ATOM 0 HA THR A 38 7.694 -17.060 3.162 1.00 0.00 H new ATOM 0 HB THR A 38 8.428 -18.819 4.905 1.00 0.00 H new ATOM 0 HG1 THR A 38 8.260 -17.158 6.584 1.00 0.00 H new ATOM 0 HG21 THR A 38 10.304 -18.204 6.376 1.00 0.00 H new ATOM 0 HG22 THR A 38 10.829 -18.669 4.740 1.00 0.00 H new ATOM 0 HG23 THR A 38 10.789 -16.952 5.207 1.00 0.00 H new ATOM 588 N ILE A 39 9.224 -15.068 3.586 1.00 0.00 N ATOM 589 CA ILE A 39 9.868 -13.760 3.483 1.00 0.00 C ATOM 590 C ILE A 39 10.926 -13.717 4.582 1.00 0.00 C ATOM 591 O ILE A 39 10.611 -14.096 5.714 1.00 0.00 O ATOM 592 CB ILE A 39 8.859 -12.610 3.760 1.00 0.00 C ATOM 593 CG1 ILE A 39 7.463 -12.777 3.124 1.00 0.00 C ATOM 594 CG2 ILE A 39 9.474 -11.253 3.364 1.00 0.00 C ATOM 595 CD1 ILE A 39 7.509 -12.957 1.614 1.00 0.00 C ATOM 0 H ILE A 39 8.458 -15.053 4.260 1.00 0.00 H new ATOM 0 HA ILE A 39 10.278 -13.629 2.482 1.00 0.00 H new ATOM 0 HB ILE A 39 8.677 -12.651 4.834 1.00 0.00 H new ATOM 0 HG12 ILE A 39 6.968 -13.639 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 39 6.856 -11.903 3.361 1.00 0.00 H new ATOM 0 HG21 ILE A 39 8.757 -10.457 3.563 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.379 -11.080 3.946 1.00 0.00 H new ATOM 0 HG23 ILE A 39 9.721 -11.262 2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.495 -13.069 1.230 1.00 0.00 H new ATOM 0 HD12 ILE A 39 7.976 -12.084 1.158 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.089 -13.847 1.371 1.00 0.00 H new ATOM 607 N VAL A 40 12.129 -13.225 4.283 1.00 0.00 N ATOM 608 CA VAL A 40 13.188 -13.060 5.286 1.00 0.00 C ATOM 609 C VAL A 40 13.868 -11.689 5.133 1.00 0.00 C ATOM 610 O VAL A 40 13.757 -11.096 4.062 1.00 0.00 O ATOM 611 CB VAL A 40 14.179 -14.236 5.204 1.00 0.00 C ATOM 612 CG1 VAL A 40 13.475 -15.588 5.135 1.00 0.00 C ATOM 613 CG2 VAL A 40 15.096 -14.177 3.989 1.00 0.00 C ATOM 0 H VAL A 40 12.398 -12.930 3.344 1.00 0.00 H new ATOM 0 HA VAL A 40 12.753 -13.078 6.285 1.00 0.00 H new ATOM 0 HB VAL A 40 14.762 -14.139 6.120 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.219 -16.383 5.079 1.00 0.00 H new ATOM 0 HG12 VAL A 40 12.864 -15.726 6.027 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.839 -15.622 4.250 1.00 0.00 H new ATOM 0 HG21 VAL A 40 15.766 -15.036 3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.496 -14.193 3.079 1.00 0.00 H new ATOM 0 HG23 VAL A 40 15.683 -13.259 4.020 1.00 0.00 H new ATOM 623 N PRO A 41 14.559 -11.135 6.146 1.00 0.00 N ATOM 624 CA PRO A 41 15.286 -9.878 5.984 1.00 0.00 C ATOM 625 C PRO A 41 16.564 -10.104 5.163 1.00 0.00 C ATOM 626 O PRO A 41 17.123 -11.203 5.154 1.00 0.00 O ATOM 627 CB PRO A 41 15.598 -9.404 7.406 1.00 0.00 C ATOM 628 CG PRO A 41 15.695 -10.710 8.193 1.00 0.00 C ATOM 629 CD PRO A 41 14.645 -11.598 7.521 1.00 0.00 C ATOM 0 HA PRO A 41 14.708 -9.129 5.442 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.529 -8.838 7.447 1.00 0.00 H new ATOM 0 HB3 PRO A 41 14.813 -8.756 7.796 1.00 0.00 H new ATOM 0 HG2 PRO A 41 16.692 -11.146 8.130 1.00 0.00 H new ATOM 0 HG3 PRO A 41 15.479 -10.560 9.251 1.00 0.00 H new ATOM 0 HD2 PRO A 41 14.935 -12.648 7.563 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.681 -11.513 8.023 1.00 0.00 H new ATOM 637 N GLY A 42 17.050 -9.049 4.515 1.00 0.00 N ATOM 638 CA GLY A 42 18.282 -8.996 3.740 1.00 0.00 C ATOM 639 C GLY A 42 19.216 -7.940 4.328 1.00 0.00 C ATOM 640 O GLY A 42 19.192 -7.687 5.537 1.00 0.00 O ATOM 0 H GLY A 42 16.562 -8.153 4.519 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.770 -9.971 3.747 1.00 0.00 H new ATOM 0 HA3 GLY A 42 18.059 -8.759 2.700 1.00 0.00 H new ATOM 644 N GLU A 43 20.081 -7.372 3.491 1.00 0.00 N ATOM 645 CA GLU A 43 20.994 -6.287 3.853 1.00 0.00 C ATOM 646 C GLU A 43 20.212 -5.045 4.298 1.00 0.00 C ATOM 647 O GLU A 43 19.018 -4.908 4.004 1.00 0.00 O ATOM 648 CB GLU A 43 21.884 -5.898 2.659 1.00 0.00 C ATOM 649 CG GLU A 43 22.565 -7.042 1.898 1.00 0.00 C ATOM 650 CD GLU A 43 23.589 -7.858 2.690 1.00 0.00 C ATOM 651 OE1 GLU A 43 23.398 -8.118 3.900 1.00 0.00 O ATOM 652 OE2 GLU A 43 24.579 -8.308 2.070 1.00 0.00 O ATOM 0 H GLU A 43 20.170 -7.660 2.517 1.00 0.00 H new ATOM 0 HA GLU A 43 21.616 -6.646 4.673 1.00 0.00 H new ATOM 0 HB2 GLU A 43 21.275 -5.335 1.951 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.659 -5.222 3.020 1.00 0.00 H new ATOM 0 HG2 GLU A 43 21.793 -7.720 1.534 1.00 0.00 H new ATOM 0 HG3 GLU A 43 23.062 -6.624 1.022 1.00 0.00 H new ATOM 659 N GLN A 44 20.905 -4.105 4.941 1.00 0.00 N ATOM 660 CA GLN A 44 20.355 -2.854 5.450 1.00 0.00 C ATOM 661 C GLN A 44 21.388 -1.734 5.321 1.00 0.00 C ATOM 662 O GLN A 44 22.582 -2.021 5.210 1.00 0.00 O ATOM 663 CB GLN A 44 19.914 -3.062 6.909 1.00 0.00 C ATOM 664 CG GLN A 44 21.041 -3.424 7.894 1.00 0.00 C ATOM 665 CD GLN A 44 20.511 -3.858 9.263 1.00 0.00 C ATOM 666 OE1 GLN A 44 19.444 -3.449 9.718 1.00 0.00 O ATOM 667 NE2 GLN A 44 21.234 -4.706 9.973 1.00 0.00 N ATOM 0 H GLN A 44 21.903 -4.200 5.127 1.00 0.00 H new ATOM 0 HA GLN A 44 19.484 -2.558 4.865 1.00 0.00 H new ATOM 0 HB2 GLN A 44 19.429 -2.150 7.258 1.00 0.00 H new ATOM 0 HB3 GLN A 44 19.164 -3.852 6.935 1.00 0.00 H new ATOM 0 HG2 GLN A 44 21.644 -4.227 7.471 1.00 0.00 H new ATOM 0 HG3 GLN A 44 21.699 -2.564 8.019 1.00 0.00 H new ATOM 0 HE21 GLN A 44 22.121 -5.052 9.606 1.00 0.00 H new ATOM 0 HE22 GLN A 44 20.906 -5.015 10.888 1.00 0.00 H new ATOM 676 N GLY A 45 20.953 -0.475 5.394 1.00 0.00 N ATOM 677 CA GLY A 45 21.832 0.675 5.266 1.00 0.00 C ATOM 678 C GLY A 45 21.145 1.983 5.657 1.00 0.00 C ATOM 679 O GLY A 45 19.955 2.026 5.984 1.00 0.00 O ATOM 0 H GLY A 45 19.975 -0.229 5.545 1.00 0.00 H new ATOM 0 HA2 GLY A 45 22.711 0.528 5.894 1.00 0.00 H new ATOM 0 HA3 GLY A 45 22.184 0.747 4.237 1.00 0.00 H new ATOM 683 N ALA A 46 21.930 3.060 5.623 1.00 0.00 N ATOM 684 CA ALA A 46 21.548 4.416 6.015 1.00 0.00 C ATOM 685 C ALA A 46 21.812 5.433 4.896 1.00 0.00 C ATOM 686 O ALA A 46 21.453 6.598 5.025 1.00 0.00 O ATOM 687 CB ALA A 46 22.352 4.797 7.264 1.00 0.00 C ATOM 0 H ALA A 46 22.898 3.007 5.305 1.00 0.00 H new ATOM 0 HA ALA A 46 20.477 4.434 6.219 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.084 5.806 7.576 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.127 4.097 8.069 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.417 4.759 7.037 1.00 0.00 H new ATOM 693 N GLU A 47 22.445 5.006 3.804 1.00 0.00 N ATOM 694 CA GLU A 47 22.840 5.816 2.663 1.00 0.00 C ATOM 695 C GLU A 47 22.456 4.965 1.444 1.00 0.00 C ATOM 696 O GLU A 47 22.582 3.738 1.488 1.00 0.00 O ATOM 697 CB GLU A 47 24.324 6.186 2.850 1.00 0.00 C ATOM 698 CG GLU A 47 24.961 6.956 1.685 1.00 0.00 C ATOM 699 CD GLU A 47 25.746 6.027 0.761 1.00 0.00 C ATOM 700 OE1 GLU A 47 25.227 4.926 0.468 1.00 0.00 O ATOM 701 OE2 GLU A 47 26.851 6.392 0.312 1.00 0.00 O ATOM 0 H GLU A 47 22.709 4.027 3.690 1.00 0.00 H new ATOM 0 HA GLU A 47 22.351 6.782 2.539 1.00 0.00 H new ATOM 0 HB2 GLU A 47 24.420 6.785 3.755 1.00 0.00 H new ATOM 0 HB3 GLU A 47 24.892 5.270 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 47 24.183 7.465 1.116 1.00 0.00 H new ATOM 0 HG3 GLU A 47 25.625 7.727 2.077 1.00 0.00 H new ATOM 708 N TYR A 48 21.959 5.588 0.371 1.00 0.00 N ATOM 709 CA TYR A 48 21.455 4.881 -0.807 1.00 0.00 C ATOM 710 C TYR A 48 22.493 4.454 -1.860 1.00 0.00 C ATOM 711 O TYR A 48 22.182 3.608 -2.694 1.00 0.00 O ATOM 712 CB TYR A 48 20.393 5.774 -1.467 1.00 0.00 C ATOM 713 CG TYR A 48 19.457 5.055 -2.424 1.00 0.00 C ATOM 714 CD1 TYR A 48 18.433 4.224 -1.930 1.00 0.00 C ATOM 715 CD2 TYR A 48 19.598 5.231 -3.813 1.00 0.00 C ATOM 716 CE1 TYR A 48 17.571 3.556 -2.819 1.00 0.00 C ATOM 717 CE2 TYR A 48 18.733 4.575 -4.706 1.00 0.00 C ATOM 718 CZ TYR A 48 17.721 3.724 -4.213 1.00 0.00 C ATOM 719 OH TYR A 48 16.893 3.067 -5.069 1.00 0.00 O ATOM 0 H TYR A 48 21.895 6.603 0.296 1.00 0.00 H new ATOM 0 HA TYR A 48 21.061 3.935 -0.436 1.00 0.00 H new ATOM 0 HB2 TYR A 48 19.798 6.244 -0.684 1.00 0.00 H new ATOM 0 HB3 TYR A 48 20.898 6.574 -2.008 1.00 0.00 H new ATOM 0 HD1 TYR A 48 18.309 4.099 -0.864 1.00 0.00 H new ATOM 0 HD2 TYR A 48 20.376 5.875 -4.196 1.00 0.00 H new ATOM 0 HE1 TYR A 48 16.793 2.913 -2.434 1.00 0.00 H new ATOM 0 HE2 TYR A 48 18.843 4.722 -5.770 1.00 0.00 H new ATOM 0 HH TYR A 48 16.791 3.590 -5.891 1.00 0.00 H new ATOM 729 N GLN A 49 23.727 4.956 -1.852 1.00 0.00 N ATOM 730 CA GLN A 49 24.764 4.539 -2.799 1.00 0.00 C ATOM 731 C GLN A 49 25.033 3.035 -2.638 1.00 0.00 C ATOM 732 O GLN A 49 25.263 2.317 -3.618 1.00 0.00 O ATOM 733 CB GLN A 49 26.025 5.357 -2.506 1.00 0.00 C ATOM 734 CG GLN A 49 27.073 5.375 -3.612 1.00 0.00 C ATOM 735 CD GLN A 49 28.329 6.176 -3.238 1.00 0.00 C ATOM 736 OE1 GLN A 49 29.167 6.427 -4.093 1.00 0.00 O ATOM 737 NE2 GLN A 49 28.521 6.594 -1.991 1.00 0.00 N ATOM 0 H GLN A 49 24.038 5.665 -1.188 1.00 0.00 H new ATOM 0 HA GLN A 49 24.447 4.714 -3.827 1.00 0.00 H new ATOM 0 HB2 GLN A 49 25.728 6.384 -2.295 1.00 0.00 H new ATOM 0 HB3 GLN A 49 26.487 4.966 -1.599 1.00 0.00 H new ATOM 0 HG2 GLN A 49 27.360 4.351 -3.849 1.00 0.00 H new ATOM 0 HG3 GLN A 49 26.633 5.800 -4.514 1.00 0.00 H new ATOM 0 HE21 GLN A 49 27.827 6.389 -1.272 1.00 0.00 H new ATOM 0 HE22 GLN A 49 29.362 7.120 -1.753 1.00 0.00 H new ATOM 746 N HIS A 50 24.966 2.553 -1.394 1.00 0.00 N ATOM 747 CA HIS A 50 25.105 1.147 -1.051 1.00 0.00 C ATOM 748 C HIS A 50 23.882 0.325 -1.483 1.00 0.00 C ATOM 749 O HIS A 50 24.016 -0.886 -1.667 1.00 0.00 O ATOM 750 CB HIS A 50 25.334 1.021 0.460 1.00 0.00 C ATOM 751 CG HIS A 50 26.675 1.564 0.887 1.00 0.00 C ATOM 752 ND1 HIS A 50 27.011 2.892 1.023 1.00 0.00 N ATOM 753 CD2 HIS A 50 27.801 0.827 1.132 1.00 0.00 C ATOM 754 CE1 HIS A 50 28.312 2.953 1.346 1.00 0.00 C ATOM 755 NE2 HIS A 50 28.835 1.718 1.432 1.00 0.00 N ATOM 0 H HIS A 50 24.810 3.150 -0.582 1.00 0.00 H new ATOM 0 HA HIS A 50 25.962 0.744 -1.591 1.00 0.00 H new ATOM 0 HB2 HIS A 50 24.544 1.554 0.990 1.00 0.00 H new ATOM 0 HB3 HIS A 50 25.261 -0.027 0.749 1.00 0.00 H new ATOM 0 HD1 HIS A 50 26.384 3.687 0.900 1.00 0.00 H new ATOM 0 HD2 HIS A 50 27.877 -0.250 1.099 1.00 0.00 H new ATOM 0 HE1 HIS A 50 28.862 3.867 1.514 1.00 0.00 H new ATOM 763 N PHE A 51 22.711 0.954 -1.661 1.00 0.00 N ATOM 764 CA PHE A 51 21.491 0.306 -2.143 1.00 0.00 C ATOM 765 C PHE A 51 21.681 -0.123 -3.594 1.00 0.00 C ATOM 766 O PHE A 51 21.315 -1.243 -3.954 1.00 0.00 O ATOM 767 CB PHE A 51 20.287 1.260 -2.051 1.00 0.00 C ATOM 768 CG PHE A 51 18.929 0.588 -2.133 1.00 0.00 C ATOM 769 CD1 PHE A 51 18.418 0.165 -3.374 1.00 0.00 C ATOM 770 CD2 PHE A 51 18.142 0.440 -0.978 1.00 0.00 C ATOM 771 CE1 PHE A 51 17.134 -0.398 -3.453 1.00 0.00 C ATOM 772 CE2 PHE A 51 16.853 -0.116 -1.058 1.00 0.00 C ATOM 773 CZ PHE A 51 16.347 -0.526 -2.303 1.00 0.00 C ATOM 0 H PHE A 51 22.587 1.948 -1.469 1.00 0.00 H new ATOM 0 HA PHE A 51 21.295 -0.564 -1.517 1.00 0.00 H new ATOM 0 HB2 PHE A 51 20.348 1.808 -1.111 1.00 0.00 H new ATOM 0 HB3 PHE A 51 20.362 1.994 -2.854 1.00 0.00 H new ATOM 0 HD1 PHE A 51 19.015 0.274 -4.268 1.00 0.00 H new ATOM 0 HD2 PHE A 51 18.531 0.756 -0.021 1.00 0.00 H new ATOM 0 HE1 PHE A 51 16.752 -0.734 -4.406 1.00 0.00 H new ATOM 0 HE2 PHE A 51 16.254 -0.227 -0.166 1.00 0.00 H new ATOM 0 HZ PHE A 51 15.352 -0.940 -2.372 1.00 0.00 H new ATOM 783 N ILE A 52 22.274 0.756 -4.416 1.00 0.00 N ATOM 784 CA ILE A 52 22.453 0.531 -5.849 1.00 0.00 C ATOM 785 C ILE A 52 23.175 -0.804 -6.038 1.00 0.00 C ATOM 786 O ILE A 52 22.730 -1.652 -6.804 1.00 0.00 O ATOM 787 CB ILE A 52 23.243 1.674 -6.534 1.00 0.00 C ATOM 788 CG1 ILE A 52 22.931 3.100 -6.044 1.00 0.00 C ATOM 789 CG2 ILE A 52 23.024 1.615 -8.055 1.00 0.00 C ATOM 790 CD1 ILE A 52 21.473 3.541 -6.104 1.00 0.00 C ATOM 0 H ILE A 52 22.645 1.651 -4.096 1.00 0.00 H new ATOM 0 HA ILE A 52 21.471 0.509 -6.323 1.00 0.00 H new ATOM 0 HB ILE A 52 24.281 1.492 -6.256 1.00 0.00 H new ATOM 0 HG12 ILE A 52 23.271 3.187 -5.012 1.00 0.00 H new ATOM 0 HG13 ILE A 52 23.523 3.800 -6.634 1.00 0.00 H new ATOM 0 HG21 ILE A 52 23.581 2.420 -8.534 1.00 0.00 H new ATOM 0 HG22 ILE A 52 23.373 0.655 -8.436 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.962 1.728 -8.274 1.00 0.00 H new ATOM 0 HD11 ILE A 52 21.386 4.562 -5.732 1.00 0.00 H new ATOM 0 HD12 ILE A 52 21.122 3.499 -7.135 1.00 0.00 H new ATOM 0 HD13 ILE A 52 20.866 2.877 -5.488 1.00 0.00 H new ATOM 802 N GLN A 53 24.252 -1.013 -5.275 1.00 0.00 N ATOM 803 CA GLN A 53 25.097 -2.193 -5.383 1.00 0.00 C ATOM 804 C GLN A 53 24.359 -3.480 -4.999 1.00 0.00 C ATOM 805 O GLN A 53 24.790 -4.561 -5.396 1.00 0.00 O ATOM 806 CB GLN A 53 26.373 -2.047 -4.534 1.00 0.00 C ATOM 807 CG GLN A 53 27.055 -0.668 -4.565 1.00 0.00 C ATOM 808 CD GLN A 53 27.198 -0.058 -5.962 1.00 0.00 C ATOM 809 OE1 GLN A 53 27.523 -0.729 -6.939 1.00 0.00 O ATOM 810 NE2 GLN A 53 26.935 1.234 -6.081 1.00 0.00 N ATOM 0 H GLN A 53 24.560 -0.356 -4.558 1.00 0.00 H new ATOM 0 HA GLN A 53 25.377 -2.272 -6.434 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.125 -2.283 -3.499 1.00 0.00 H new ATOM 0 HB3 GLN A 53 27.094 -2.793 -4.868 1.00 0.00 H new ATOM 0 HG2 GLN A 53 26.484 0.019 -3.940 1.00 0.00 H new ATOM 0 HG3 GLN A 53 28.046 -0.757 -4.119 1.00 0.00 H new ATOM 0 HE21 GLN A 53 26.666 1.777 -5.261 1.00 0.00 H new ATOM 0 HE22 GLN A 53 27.001 1.686 -6.993 1.00 0.00 H new ATOM 819 N GLN A 54 23.295 -3.412 -4.188 1.00 0.00 N ATOM 820 CA GLN A 54 22.518 -4.606 -3.858 1.00 0.00 C ATOM 821 C GLN A 54 21.590 -5.001 -5.006 1.00 0.00 C ATOM 822 O GLN A 54 21.217 -6.172 -5.094 1.00 0.00 O ATOM 823 CB GLN A 54 21.696 -4.431 -2.569 1.00 0.00 C ATOM 824 CG GLN A 54 22.483 -3.964 -1.333 1.00 0.00 C ATOM 825 CD GLN A 54 23.928 -4.480 -1.247 1.00 0.00 C ATOM 826 OE1 GLN A 54 24.211 -5.667 -1.400 1.00 0.00 O ATOM 827 NE2 GLN A 54 24.883 -3.590 -1.033 1.00 0.00 N ATOM 0 H GLN A 54 22.958 -2.552 -3.755 1.00 0.00 H new ATOM 0 HA GLN A 54 23.242 -5.404 -3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 54 20.900 -3.712 -2.763 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.217 -5.381 -2.334 1.00 0.00 H new ATOM 0 HG2 GLN A 54 22.502 -2.874 -1.324 1.00 0.00 H new ATOM 0 HG3 GLN A 54 21.947 -4.281 -0.439 1.00 0.00 H new ATOM 0 HE21 GLN A 54 24.644 -2.606 -0.907 1.00 0.00 H new ATOM 0 HE22 GLN A 54 25.858 -3.887 -0.994 1.00 0.00 H new ATOM 836 N CYS A 55 21.213 -4.057 -5.871 1.00 0.00 N ATOM 837 CA CYS A 55 20.377 -4.338 -7.019 1.00 0.00 C ATOM 838 C CYS A 55 21.247 -5.067 -8.039 1.00 0.00 C ATOM 839 O CYS A 55 22.206 -4.507 -8.576 1.00 0.00 O ATOM 840 CB CYS A 55 19.804 -3.030 -7.573 1.00 0.00 C ATOM 841 SG CYS A 55 18.903 -2.156 -6.255 1.00 0.00 S ATOM 0 H CYS A 55 21.484 -3.077 -5.787 1.00 0.00 H new ATOM 0 HA CYS A 55 19.525 -4.966 -6.758 1.00 0.00 H new ATOM 0 HB2 CYS A 55 20.608 -2.402 -7.957 1.00 0.00 H new ATOM 0 HB3 CYS A 55 19.136 -3.238 -8.409 1.00 0.00 H new ATOM 0 HG CYS A 55 19.737 -1.793 -5.326 1.00 0.00 H new ATOM 847 N THR A 56 20.928 -6.328 -8.289 1.00 0.00 N ATOM 848 CA THR A 56 21.664 -7.209 -9.170 1.00 0.00 C ATOM 849 C THR A 56 20.966 -7.317 -10.531 1.00 0.00 C ATOM 850 O THR A 56 19.958 -6.658 -10.782 1.00 0.00 O ATOM 851 CB THR A 56 22.027 -8.479 -8.381 1.00 0.00 C ATOM 852 OG1 THR A 56 20.964 -8.850 -7.527 1.00 0.00 O ATOM 853 CG2 THR A 56 23.250 -8.224 -7.501 1.00 0.00 C ATOM 0 H THR A 56 20.117 -6.779 -7.865 1.00 0.00 H new ATOM 0 HA THR A 56 22.635 -6.826 -9.482 1.00 0.00 H new ATOM 0 HB THR A 56 22.230 -9.269 -9.104 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.209 -9.660 -7.033 1.00 0.00 H new ATOM 0 HG21 THR A 56 23.496 -9.131 -6.948 1.00 0.00 H new ATOM 0 HG22 THR A 56 24.096 -7.940 -8.127 1.00 0.00 H new ATOM 0 HG23 THR A 56 23.032 -7.419 -6.799 1.00 0.00 H new ATOM 861 N ASP A 57 21.550 -8.070 -11.455 1.00 0.00 N ATOM 862 CA ASP A 57 21.114 -8.223 -12.837 1.00 0.00 C ATOM 863 C ASP A 57 19.814 -8.996 -13.100 1.00 0.00 C ATOM 864 O ASP A 57 18.804 -8.359 -13.391 1.00 0.00 O ATOM 865 CB ASP A 57 22.291 -8.760 -13.658 1.00 0.00 C ATOM 866 CG ASP A 57 22.825 -10.084 -13.125 1.00 0.00 C ATOM 867 OD1 ASP A 57 23.491 -10.076 -12.061 1.00 0.00 O ATOM 868 OD2 ASP A 57 22.515 -11.134 -13.725 1.00 0.00 O ATOM 0 H ASP A 57 22.385 -8.619 -11.249 1.00 0.00 H new ATOM 0 HA ASP A 57 20.820 -7.224 -13.159 1.00 0.00 H new ATOM 0 HB2 ASP A 57 21.977 -8.890 -14.694 1.00 0.00 H new ATOM 0 HB3 ASP A 57 23.094 -8.023 -13.659 1.00 0.00 H new ATOM 873 N ASP A 58 19.797 -10.331 -13.022 1.00 0.00 N ATOM 874 CA ASP A 58 18.615 -11.139 -13.358 1.00 0.00 C ATOM 875 C ASP A 58 17.679 -11.413 -12.184 1.00 0.00 C ATOM 876 O ASP A 58 16.484 -11.620 -12.379 1.00 0.00 O ATOM 877 CB ASP A 58 19.077 -12.471 -13.973 1.00 0.00 C ATOM 878 CG ASP A 58 17.923 -13.432 -14.296 1.00 0.00 C ATOM 879 OD1 ASP A 58 17.248 -13.262 -15.331 1.00 0.00 O ATOM 880 OD2 ASP A 58 17.746 -14.436 -13.563 1.00 0.00 O ATOM 0 H ASP A 58 20.601 -10.884 -12.724 1.00 0.00 H new ATOM 0 HA ASP A 58 18.033 -10.551 -14.067 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.634 -12.266 -14.887 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.765 -12.961 -13.284 1.00 0.00 H new ATOM 885 N VAL A 59 18.185 -11.443 -10.956 1.00 0.00 N ATOM 886 CA VAL A 59 17.392 -11.781 -9.792 1.00 0.00 C ATOM 887 C VAL A 59 16.384 -10.683 -9.441 1.00 0.00 C ATOM 888 O VAL A 59 16.414 -9.568 -9.963 1.00 0.00 O ATOM 889 CB VAL A 59 18.337 -12.165 -8.652 1.00 0.00 C ATOM 890 CG1 VAL A 59 19.262 -13.323 -9.051 1.00 0.00 C ATOM 891 CG2 VAL A 59 19.187 -10.995 -8.184 1.00 0.00 C ATOM 0 H VAL A 59 19.160 -11.232 -10.745 1.00 0.00 H new ATOM 0 HA VAL A 59 16.764 -12.647 -10.003 1.00 0.00 H new ATOM 0 HB VAL A 59 17.695 -12.479 -7.829 1.00 0.00 H new ATOM 0 HG11 VAL A 59 19.919 -13.568 -8.216 1.00 0.00 H new ATOM 0 HG12 VAL A 59 18.662 -14.196 -9.309 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.863 -13.029 -9.911 1.00 0.00 H new ATOM 0 HG21 VAL A 59 19.840 -11.321 -7.374 1.00 0.00 H new ATOM 0 HG22 VAL A 59 19.792 -10.630 -9.014 1.00 0.00 H new ATOM 0 HG23 VAL A 59 18.539 -10.194 -7.828 1.00 0.00 H new ATOM 901 N ARG A 60 15.477 -11.008 -8.521 1.00 0.00 N ATOM 902 CA ARG A 60 14.453 -10.108 -8.009 1.00 0.00 C ATOM 903 C ARG A 60 14.639 -9.993 -6.500 1.00 0.00 C ATOM 904 O ARG A 60 15.017 -10.980 -5.863 1.00 0.00 O ATOM 905 CB ARG A 60 13.045 -10.558 -8.456 1.00 0.00 C ATOM 906 CG ARG A 60 12.379 -11.698 -7.665 1.00 0.00 C ATOM 907 CD ARG A 60 13.033 -13.067 -7.883 1.00 0.00 C ATOM 908 NE ARG A 60 12.487 -14.066 -6.955 1.00 0.00 N ATOM 909 CZ ARG A 60 12.911 -15.328 -6.826 1.00 0.00 C ATOM 910 NH1 ARG A 60 13.809 -15.835 -7.669 1.00 0.00 N ATOM 911 NH2 ARG A 60 12.415 -16.074 -5.845 1.00 0.00 N ATOM 0 H ARG A 60 15.436 -11.936 -8.100 1.00 0.00 H new ATOM 0 HA ARG A 60 14.557 -9.107 -8.427 1.00 0.00 H new ATOM 0 HB2 ARG A 60 12.386 -9.691 -8.415 1.00 0.00 H new ATOM 0 HB3 ARG A 60 13.105 -10.864 -9.500 1.00 0.00 H new ATOM 0 HG2 ARG A 60 12.409 -11.456 -6.603 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.328 -11.759 -7.948 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.870 -13.392 -8.910 1.00 0.00 H new ATOM 0 HD3 ARG A 60 14.111 -12.986 -7.742 1.00 0.00 H new ATOM 0 HE ARG A 60 11.716 -13.771 -6.356 1.00 0.00 H new ATOM 0 HH11 ARG A 60 14.182 -15.259 -8.424 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.124 -16.799 -7.560 1.00 0.00 H new ATOM 0 HH21 ARG A 60 11.723 -15.682 -5.206 1.00 0.00 H new ATOM 0 HH22 ARG A 60 12.726 -17.039 -5.731 1.00 0.00 H new ATOM 925 N LEU A 61 14.383 -8.818 -5.935 1.00 0.00 N ATOM 926 CA LEU A 61 14.575 -8.481 -4.526 1.00 0.00 C ATOM 927 C LEU A 61 13.488 -7.487 -4.135 1.00 0.00 C ATOM 928 O LEU A 61 12.789 -6.950 -4.992 1.00 0.00 O ATOM 929 CB LEU A 61 15.995 -7.901 -4.351 1.00 0.00 C ATOM 930 CG LEU A 61 16.461 -7.504 -2.937 1.00 0.00 C ATOM 931 CD1 LEU A 61 16.485 -8.724 -2.011 1.00 0.00 C ATOM 932 CD2 LEU A 61 17.873 -6.910 -3.004 1.00 0.00 C ATOM 0 H LEU A 61 14.017 -8.033 -6.474 1.00 0.00 H new ATOM 0 HA LEU A 61 14.493 -9.353 -3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 61 16.702 -8.634 -4.739 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.072 -7.018 -4.985 1.00 0.00 H new ATOM 0 HG LEU A 61 15.761 -6.768 -2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.817 -8.421 -1.018 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.484 -9.150 -1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 61 17.171 -9.471 -2.411 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.198 -6.631 -2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.560 -7.650 -3.415 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.866 -6.027 -3.643 1.00 0.00 H new ATOM 944 N PHE A 62 13.306 -7.254 -2.845 1.00 0.00 N ATOM 945 CA PHE A 62 12.356 -6.263 -2.335 1.00 0.00 C ATOM 946 C PHE A 62 13.062 -5.428 -1.265 1.00 0.00 C ATOM 947 O PHE A 62 14.030 -5.903 -0.665 1.00 0.00 O ATOM 948 CB PHE A 62 11.134 -6.948 -1.698 1.00 0.00 C ATOM 949 CG PHE A 62 10.043 -7.570 -2.558 1.00 0.00 C ATOM 950 CD1 PHE A 62 10.310 -8.541 -3.546 1.00 0.00 C ATOM 951 CD2 PHE A 62 8.705 -7.294 -2.223 1.00 0.00 C ATOM 952 CE1 PHE A 62 9.256 -9.226 -4.178 1.00 0.00 C ATOM 953 CE2 PHE A 62 7.656 -7.994 -2.834 1.00 0.00 C ATOM 954 CZ PHE A 62 7.927 -8.965 -3.808 1.00 0.00 C ATOM 0 H PHE A 62 13.815 -7.748 -2.112 1.00 0.00 H new ATOM 0 HA PHE A 62 12.014 -5.640 -3.162 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.514 -7.735 -1.047 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.652 -6.209 -1.058 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.332 -8.760 -3.819 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.484 -6.535 -1.487 1.00 0.00 H new ATOM 0 HE1 PHE A 62 9.469 -9.953 -4.948 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.634 -7.784 -2.553 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.118 -9.510 -4.271 1.00 0.00 H new ATOM 964 N ALA A 63 12.583 -4.211 -0.978 1.00 0.00 N ATOM 965 CA ALA A 63 13.130 -3.391 0.087 1.00 0.00 C ATOM 966 C ALA A 63 12.047 -2.568 0.754 1.00 0.00 C ATOM 967 O ALA A 63 11.049 -2.226 0.134 1.00 0.00 O ATOM 968 CB ALA A 63 14.235 -2.478 -0.448 1.00 0.00 C ATOM 0 H ALA A 63 11.809 -3.777 -1.481 1.00 0.00 H new ATOM 0 HA ALA A 63 13.559 -4.059 0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.632 -1.872 0.366 1.00 0.00 H new ATOM 0 HB2 ALA A 63 15.035 -3.085 -0.872 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.826 -1.826 -1.220 1.00 0.00 H new ATOM 974 N PHE A 64 12.264 -2.221 2.010 1.00 0.00 N ATOM 975 CA PHE A 64 11.399 -1.366 2.798 1.00 0.00 C ATOM 976 C PHE A 64 12.275 -0.187 3.181 1.00 0.00 C ATOM 977 O PHE A 64 13.342 -0.380 3.772 1.00 0.00 O ATOM 978 CB PHE A 64 10.862 -2.168 3.983 1.00 0.00 C ATOM 979 CG PHE A 64 10.002 -1.382 4.947 1.00 0.00 C ATOM 980 CD1 PHE A 64 8.791 -0.820 4.508 1.00 0.00 C ATOM 981 CD2 PHE A 64 10.391 -1.240 6.291 1.00 0.00 C ATOM 982 CE1 PHE A 64 7.977 -0.120 5.413 1.00 0.00 C ATOM 983 CE2 PHE A 64 9.597 -0.489 7.176 1.00 0.00 C ATOM 984 CZ PHE A 64 8.403 0.088 6.732 1.00 0.00 C ATOM 0 H PHE A 64 13.082 -2.541 2.529 1.00 0.00 H new ATOM 0 HA PHE A 64 10.513 -1.002 2.277 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.280 -3.007 3.601 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.706 -2.588 4.531 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.487 -0.926 3.477 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.299 -1.707 6.643 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.019 0.260 5.091 1.00 0.00 H new ATOM 0 HE2 PHE A 64 9.910 -0.358 8.201 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.811 0.692 7.403 1.00 0.00 H new ATOM 994 N VAL A 65 11.839 1.025 2.838 1.00 0.00 N ATOM 995 CA VAL A 65 12.629 2.227 3.054 1.00 0.00 C ATOM 996 C VAL A 65 11.754 3.336 3.643 1.00 0.00 C ATOM 997 O VAL A 65 10.610 3.512 3.215 1.00 0.00 O ATOM 998 CB VAL A 65 13.215 2.651 1.685 1.00 0.00 C ATOM 999 CG1 VAL A 65 14.170 3.838 1.818 1.00 0.00 C ATOM 1000 CG2 VAL A 65 13.964 1.490 1.004 1.00 0.00 C ATOM 0 H VAL A 65 10.932 1.196 2.405 1.00 0.00 H new ATOM 0 HA VAL A 65 13.435 2.039 3.763 1.00 0.00 H new ATOM 0 HB VAL A 65 12.364 2.943 1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.559 4.104 0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.636 4.690 2.239 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.997 3.568 2.475 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.361 1.825 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.785 1.162 1.642 1.00 0.00 H new ATOM 0 HG23 VAL A 65 13.277 0.660 0.841 1.00 0.00 H new ATOM 1010 N ARG A 66 12.289 4.079 4.616 1.00 0.00 N ATOM 1011 CA ARG A 66 11.678 5.244 5.264 1.00 0.00 C ATOM 1012 C ARG A 66 11.781 6.404 4.281 1.00 0.00 C ATOM 1013 O ARG A 66 12.898 6.789 3.936 1.00 0.00 O ATOM 1014 CB ARG A 66 12.421 5.498 6.591 1.00 0.00 C ATOM 1015 CG ARG A 66 11.954 6.703 7.427 1.00 0.00 C ATOM 1016 CD ARG A 66 12.986 7.082 8.511 1.00 0.00 C ATOM 1017 NE ARG A 66 13.339 5.945 9.378 1.00 0.00 N ATOM 1018 CZ ARG A 66 14.416 5.792 10.160 1.00 0.00 C ATOM 1019 NH1 ARG A 66 15.315 6.756 10.334 1.00 0.00 N ATOM 1020 NH2 ARG A 66 14.604 4.643 10.778 1.00 0.00 N ATOM 0 H ARG A 66 13.213 3.872 4.995 1.00 0.00 H new ATOM 0 HA ARG A 66 10.626 5.101 5.510 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.333 4.603 7.207 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.480 5.629 6.368 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.785 7.557 6.771 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.000 6.470 7.899 1.00 0.00 H new ATOM 0 HD2 ARG A 66 13.888 7.463 8.032 1.00 0.00 H new ATOM 0 HD3 ARG A 66 12.585 7.890 9.123 1.00 0.00 H new ATOM 0 HE ARG A 66 12.675 5.171 9.384 1.00 0.00 H new ATOM 0 HH11 ARG A 66 15.198 7.653 9.863 1.00 0.00 H new ATOM 0 HH12 ARG A 66 16.121 6.598 10.938 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.934 3.884 10.658 1.00 0.00 H new ATOM 0 HH22 ARG A 66 15.420 4.513 11.376 1.00 0.00 H new ATOM 1034 N PHE A 67 10.654 6.960 3.827 1.00 0.00 N ATOM 1035 CA PHE A 67 10.656 8.010 2.813 1.00 0.00 C ATOM 1036 C PHE A 67 9.747 9.143 3.289 1.00 0.00 C ATOM 1037 O PHE A 67 8.751 8.903 3.971 1.00 0.00 O ATOM 1038 CB PHE A 67 10.194 7.410 1.479 1.00 0.00 C ATOM 1039 CG PHE A 67 10.620 8.194 0.253 1.00 0.00 C ATOM 1040 CD1 PHE A 67 9.964 9.374 -0.144 1.00 0.00 C ATOM 1041 CD2 PHE A 67 11.719 7.728 -0.492 1.00 0.00 C ATOM 1042 CE1 PHE A 67 10.439 10.105 -1.248 1.00 0.00 C ATOM 1043 CE2 PHE A 67 12.187 8.446 -1.601 1.00 0.00 C ATOM 1044 CZ PHE A 67 11.555 9.643 -1.969 1.00 0.00 C ATOM 0 H PHE A 67 9.724 6.695 4.151 1.00 0.00 H new ATOM 0 HA PHE A 67 11.654 8.421 2.661 1.00 0.00 H new ATOM 0 HB2 PHE A 67 10.583 6.395 1.398 1.00 0.00 H new ATOM 0 HB3 PHE A 67 9.107 7.335 1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 67 9.096 9.718 0.399 1.00 0.00 H new ATOM 0 HD2 PHE A 67 12.207 6.808 -0.206 1.00 0.00 H new ATOM 0 HE1 PHE A 67 9.947 11.020 -1.542 1.00 0.00 H new ATOM 0 HE2 PHE A 67 13.029 8.080 -2.169 1.00 0.00 H new ATOM 0 HZ PHE A 67 11.926 10.212 -2.809 1.00 0.00 H new ATOM 1054 N THR A 68 10.029 10.376 2.881 1.00 0.00 N ATOM 1055 CA THR A 68 9.290 11.538 3.344 1.00 0.00 C ATOM 1056 C THR A 68 8.461 12.153 2.212 1.00 0.00 C ATOM 1057 O THR A 68 9.007 12.641 1.220 1.00 0.00 O ATOM 1058 CB THR A 68 10.324 12.522 3.920 1.00 0.00 C ATOM 1059 OG1 THR A 68 11.051 11.914 4.971 1.00 0.00 O ATOM 1060 CG2 THR A 68 9.658 13.763 4.503 1.00 0.00 C ATOM 0 H THR A 68 10.776 10.594 2.221 1.00 0.00 H new ATOM 0 HA THR A 68 8.569 11.266 4.115 1.00 0.00 H new ATOM 0 HB THR A 68 10.978 12.802 3.094 1.00 0.00 H new ATOM 0 HG1 THR A 68 11.706 12.550 5.327 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.421 14.433 4.900 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.096 14.275 3.722 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.981 13.470 5.305 1.00 0.00 H new ATOM 1068 N THR A 69 7.130 12.089 2.319 1.00 0.00 N ATOM 1069 CA THR A 69 6.176 12.706 1.394 1.00 0.00 C ATOM 1070 C THR A 69 4.870 12.891 2.182 1.00 0.00 C ATOM 1071 O THR A 69 4.402 11.939 2.815 1.00 0.00 O ATOM 1072 CB THR A 69 5.966 11.873 0.107 1.00 0.00 C ATOM 1073 OG1 THR A 69 7.167 11.306 -0.369 1.00 0.00 O ATOM 1074 CG2 THR A 69 5.366 12.712 -1.027 1.00 0.00 C ATOM 0 H THR A 69 6.672 11.588 3.080 1.00 0.00 H new ATOM 0 HA THR A 69 6.557 13.663 1.038 1.00 0.00 H new ATOM 0 HB THR A 69 5.275 11.080 0.392 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.985 10.789 -1.181 1.00 0.00 H new ATOM 0 HG21 THR A 69 5.235 12.088 -1.911 1.00 0.00 H new ATOM 0 HG22 THR A 69 4.399 13.107 -0.715 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.037 13.539 -1.262 1.00 0.00 H new ATOM 1082 N GLY A 70 4.256 14.070 2.164 1.00 0.00 N ATOM 1083 CA GLY A 70 2.981 14.339 2.817 1.00 0.00 C ATOM 1084 C GLY A 70 3.032 15.708 3.473 1.00 0.00 C ATOM 1085 O GLY A 70 4.092 16.144 3.931 1.00 0.00 O ATOM 0 H GLY A 70 4.641 14.883 1.684 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.171 14.302 2.088 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.773 13.573 3.564 1.00 0.00 H new ATOM 1089 N ASP A 71 1.881 16.364 3.587 1.00 0.00 N ATOM 1090 CA ASP A 71 1.782 17.721 4.107 1.00 0.00 C ATOM 1091 C ASP A 71 0.803 17.700 5.268 1.00 0.00 C ATOM 1092 O ASP A 71 -0.263 17.082 5.182 1.00 0.00 O ATOM 1093 CB ASP A 71 1.348 18.710 3.014 1.00 0.00 C ATOM 1094 CG ASP A 71 2.157 18.550 1.727 1.00 0.00 C ATOM 1095 OD1 ASP A 71 3.408 18.565 1.762 1.00 0.00 O ATOM 1096 OD2 ASP A 71 1.530 18.268 0.678 1.00 0.00 O ATOM 0 H ASP A 71 0.983 15.963 3.318 1.00 0.00 H new ATOM 0 HA ASP A 71 2.757 18.064 4.452 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.290 18.564 2.795 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.459 19.729 3.385 1.00 0.00 H new ATOM 1101 N ALA A 72 1.273 18.176 6.413 1.00 0.00 N ATOM 1102 CA ALA A 72 0.526 18.359 7.643 1.00 0.00 C ATOM 1103 C ALA A 72 1.104 19.589 8.343 1.00 0.00 C ATOM 1104 O ALA A 72 2.102 20.141 7.869 1.00 0.00 O ATOM 1105 CB ALA A 72 0.650 17.113 8.517 1.00 0.00 C ATOM 0 H ALA A 72 2.247 18.461 6.510 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.535 18.509 7.444 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.087 17.258 9.439 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.253 16.251 7.980 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.699 16.939 8.756 1.00 0.00 H new ATOM 1111 N MET A 73 0.570 19.970 9.505 1.00 0.00 N ATOM 1112 CA MET A 73 1.112 21.068 10.301 1.00 0.00 C ATOM 1113 C MET A 73 2.516 20.739 10.845 1.00 0.00 C ATOM 1114 O MET A 73 3.173 21.610 11.415 1.00 0.00 O ATOM 1115 CB MET A 73 0.215 21.345 11.518 1.00 0.00 C ATOM 1116 CG MET A 73 -1.206 21.790 11.179 1.00 0.00 C ATOM 1117 SD MET A 73 -2.072 22.632 12.536 1.00 0.00 S ATOM 1118 CE MET A 73 -2.220 21.283 13.740 1.00 0.00 C ATOM 0 H MET A 73 -0.249 19.525 9.919 1.00 0.00 H new ATOM 0 HA MET A 73 1.160 21.933 9.640 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.162 20.442 12.126 1.00 0.00 H new ATOM 0 HB3 MET A 73 0.685 22.114 12.130 1.00 0.00 H new ATOM 0 HG2 MET A 73 -1.169 22.458 10.318 1.00 0.00 H new ATOM 0 HG3 MET A 73 -1.786 20.917 10.881 1.00 0.00 H new ATOM 0 HE1 MET A 73 -3.264 21.168 14.031 1.00 0.00 H new ATOM 0 HE2 MET A 73 -1.864 20.355 13.292 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.621 21.514 14.621 1.00 0.00 H new ATOM 1128 N SER A 74 2.984 19.505 10.659 1.00 0.00 N ATOM 1129 CA SER A 74 4.229 18.962 11.159 1.00 0.00 C ATOM 1130 C SER A 74 4.802 17.966 10.152 1.00 0.00 C ATOM 1131 O SER A 74 4.195 17.677 9.111 1.00 0.00 O ATOM 1132 CB SER A 74 3.938 18.286 12.502 1.00 0.00 C ATOM 1133 OG SER A 74 3.557 19.238 13.480 1.00 0.00 O ATOM 0 H SER A 74 2.461 18.818 10.116 1.00 0.00 H new ATOM 0 HA SER A 74 4.969 19.750 11.299 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.144 17.550 12.378 1.00 0.00 H new ATOM 0 HB3 SER A 74 4.823 17.746 12.840 1.00 0.00 H new ATOM 0 HG SER A 74 3.095 18.784 14.216 1.00 0.00 H new ATOM 1139 N LYS A 75 5.994 17.445 10.461 1.00 0.00 N ATOM 1140 CA LYS A 75 6.664 16.438 9.648 1.00 0.00 C ATOM 1141 C LYS A 75 5.746 15.237 9.464 1.00 0.00 C ATOM 1142 O LYS A 75 5.036 14.838 10.392 1.00 0.00 O ATOM 1143 CB LYS A 75 7.994 15.968 10.273 1.00 0.00 C ATOM 1144 CG LYS A 75 8.918 17.092 10.770 1.00 0.00 C ATOM 1145 CD LYS A 75 8.768 17.372 12.275 1.00 0.00 C ATOM 1146 CE LYS A 75 9.492 18.662 12.685 1.00 0.00 C ATOM 1147 NZ LYS A 75 8.790 19.888 12.235 1.00 0.00 N ATOM 0 H LYS A 75 6.521 17.716 11.291 1.00 0.00 H new ATOM 0 HA LYS A 75 6.893 16.897 8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.770 15.307 11.110 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.534 15.375 9.535 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.953 16.825 10.557 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.703 18.004 10.213 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.711 17.452 12.527 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.169 16.533 12.843 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.594 18.686 13.770 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.500 18.654 12.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.288 20.726 12.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.775 19.917 11.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.815 19.882 12.596 1.00 0.00 H new ATOM 1161 N ARG A 76 5.788 14.632 8.285 1.00 0.00 N ATOM 1162 CA ARG A 76 5.061 13.418 7.942 1.00 0.00 C ATOM 1163 C ARG A 76 6.114 12.387 7.579 1.00 0.00 C ATOM 1164 O ARG A 76 7.253 12.736 7.254 1.00 0.00 O ATOM 1165 CB ARG A 76 4.094 13.654 6.767 1.00 0.00 C ATOM 1166 CG ARG A 76 2.885 14.551 7.095 1.00 0.00 C ATOM 1167 CD ARG A 76 1.620 13.787 7.528 1.00 0.00 C ATOM 1168 NE ARG A 76 1.414 13.781 8.988 1.00 0.00 N ATOM 1169 CZ ARG A 76 0.244 13.840 9.643 1.00 0.00 C ATOM 1170 NH1 ARG A 76 -0.912 13.987 9.002 1.00 0.00 N ATOM 1171 NH2 ARG A 76 0.225 13.755 10.967 1.00 0.00 N ATOM 0 H ARG A 76 6.351 14.987 7.512 1.00 0.00 H new ATOM 0 HA ARG A 76 4.446 13.083 8.777 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.649 14.103 5.943 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.728 12.689 6.417 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.167 15.242 7.890 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.648 15.154 6.218 1.00 0.00 H new ATOM 0 HD2 ARG A 76 0.751 14.235 7.047 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.686 12.759 7.173 1.00 0.00 H new ATOM 0 HE ARG A 76 2.254 13.726 9.564 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.926 14.058 7.985 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -1.785 14.028 9.528 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.098 13.645 11.484 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.662 13.799 11.468 1.00 0.00 H new ATOM 1185 N SER A 77 5.715 11.129 7.583 1.00 0.00 N ATOM 1186 CA SER A 77 6.564 10.009 7.249 1.00 0.00 C ATOM 1187 C SER A 77 5.730 9.045 6.417 1.00 0.00 C ATOM 1188 O SER A 77 4.494 9.011 6.510 1.00 0.00 O ATOM 1189 CB SER A 77 7.077 9.405 8.561 1.00 0.00 C ATOM 1190 OG SER A 77 7.836 8.230 8.352 1.00 0.00 O ATOM 0 H SER A 77 4.763 10.854 7.826 1.00 0.00 H new ATOM 0 HA SER A 77 7.438 10.284 6.659 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.688 10.141 9.083 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.230 9.177 9.209 1.00 0.00 H new ATOM 0 HG SER A 77 8.143 7.881 9.215 1.00 0.00 H new ATOM 1196 N LYS A 78 6.403 8.297 5.553 1.00 0.00 N ATOM 1197 CA LYS A 78 5.862 7.253 4.707 1.00 0.00 C ATOM 1198 C LYS A 78 6.937 6.190 4.568 1.00 0.00 C ATOM 1199 O LYS A 78 8.068 6.343 5.032 1.00 0.00 O ATOM 1200 CB LYS A 78 5.502 7.828 3.324 1.00 0.00 C ATOM 1201 CG LYS A 78 4.152 8.546 3.346 1.00 0.00 C ATOM 1202 CD LYS A 78 3.720 8.910 1.923 1.00 0.00 C ATOM 1203 CE LYS A 78 2.273 9.403 1.844 1.00 0.00 C ATOM 1204 NZ LYS A 78 1.966 10.474 2.810 1.00 0.00 N ATOM 0 H LYS A 78 7.407 8.415 5.419 1.00 0.00 H new ATOM 0 HA LYS A 78 4.955 6.832 5.141 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.279 8.523 3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 78 5.474 7.022 2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 78 3.400 7.907 3.809 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.222 9.448 3.954 1.00 0.00 H new ATOM 0 HD2 LYS A 78 4.383 9.683 1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 78 3.836 8.038 1.280 1.00 0.00 H new ATOM 0 HE2 LYS A 78 2.075 9.766 0.835 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.601 8.563 2.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 1.160 11.033 2.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.726 10.053 3.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.795 11.092 2.918 1.00 0.00 H new ATOM 1218 N PHE A 79 6.578 5.111 3.891 1.00 0.00 N ATOM 1219 CA PHE A 79 7.496 4.044 3.574 1.00 0.00 C ATOM 1220 C PHE A 79 7.171 3.603 2.168 1.00 0.00 C ATOM 1221 O PHE A 79 5.988 3.446 1.840 1.00 0.00 O ATOM 1222 CB PHE A 79 7.392 2.875 4.541 1.00 0.00 C ATOM 1223 CG PHE A 79 7.656 3.252 5.978 1.00 0.00 C ATOM 1224 CD1 PHE A 79 8.981 3.368 6.424 1.00 0.00 C ATOM 1225 CD2 PHE A 79 6.594 3.571 6.840 1.00 0.00 C ATOM 1226 CE1 PHE A 79 9.255 3.885 7.699 1.00 0.00 C ATOM 1227 CE2 PHE A 79 6.870 4.057 8.126 1.00 0.00 C ATOM 1228 CZ PHE A 79 8.197 4.239 8.553 1.00 0.00 C ATOM 0 H PHE A 79 5.631 4.956 3.546 1.00 0.00 H new ATOM 0 HA PHE A 79 8.522 4.402 3.659 1.00 0.00 H new ATOM 0 HB2 PHE A 79 6.395 2.440 4.466 1.00 0.00 H new ATOM 0 HB3 PHE A 79 8.100 2.103 4.241 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.793 3.058 5.783 1.00 0.00 H new ATOM 0 HD2 PHE A 79 5.572 3.443 6.515 1.00 0.00 H new ATOM 0 HE1 PHE A 79 10.277 4.011 8.024 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.056 4.294 8.795 1.00 0.00 H new ATOM 0 HZ PHE A 79 8.402 4.648 9.531 1.00 0.00 H new ATOM 1238 N ALA A 80 8.212 3.426 1.363 1.00 0.00 N ATOM 1239 CA ALA A 80 8.116 2.953 0.001 1.00 0.00 C ATOM 1240 C ALA A 80 8.578 1.506 -0.011 1.00 0.00 C ATOM 1241 O ALA A 80 9.727 1.222 0.343 1.00 0.00 O ATOM 1242 CB ALA A 80 8.980 3.827 -0.919 1.00 0.00 C ATOM 0 H ALA A 80 9.171 3.615 1.655 1.00 0.00 H new ATOM 0 HA ALA A 80 7.092 3.014 -0.367 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.902 3.464 -1.944 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.632 4.859 -0.872 1.00 0.00 H new ATOM 0 HB3 ALA A 80 10.020 3.779 -0.595 1.00 0.00 H new ATOM 1248 N LEU A 81 7.661 0.582 -0.313 1.00 0.00 N ATOM 1249 CA LEU A 81 8.028 -0.820 -0.454 1.00 0.00 C ATOM 1250 C LEU A 81 8.531 -0.882 -1.891 1.00 0.00 C ATOM 1251 O LEU A 81 7.779 -0.657 -2.832 1.00 0.00 O ATOM 1252 CB LEU A 81 6.826 -1.738 -0.172 1.00 0.00 C ATOM 1253 CG LEU A 81 7.021 -3.256 -0.399 1.00 0.00 C ATOM 1254 CD1 LEU A 81 6.850 -3.711 -1.855 1.00 0.00 C ATOM 1255 CD2 LEU A 81 8.328 -3.820 0.161 1.00 0.00 C ATOM 0 H LEU A 81 6.672 0.781 -0.462 1.00 0.00 H new ATOM 0 HA LEU A 81 8.780 -1.168 0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.524 -1.588 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.996 -1.408 -0.797 1.00 0.00 H new ATOM 0 HG LEU A 81 6.200 -3.677 0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.004 -4.788 -1.920 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.844 -3.467 -2.197 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.580 -3.201 -2.484 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.380 -4.889 -0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 81 9.173 -3.319 -0.312 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.364 -3.654 1.238 1.00 0.00 H new ATOM 1267 N ILE A 82 9.807 -1.136 -2.081 1.00 0.00 N ATOM 1268 CA ILE A 82 10.443 -1.158 -3.385 1.00 0.00 C ATOM 1269 C ILE A 82 10.479 -2.606 -3.811 1.00 0.00 C ATOM 1270 O ILE A 82 10.700 -3.499 -2.990 1.00 0.00 O ATOM 1271 CB ILE A 82 11.843 -0.530 -3.276 1.00 0.00 C ATOM 1272 CG1 ILE A 82 11.710 1.009 -3.220 1.00 0.00 C ATOM 1273 CG2 ILE A 82 12.823 -0.925 -4.395 1.00 0.00 C ATOM 1274 CD1 ILE A 82 12.534 1.553 -2.060 1.00 0.00 C ATOM 0 H ILE A 82 10.449 -1.338 -1.315 1.00 0.00 H new ATOM 0 HA ILE A 82 9.904 -0.576 -4.132 1.00 0.00 H new ATOM 0 HB ILE A 82 12.276 -0.928 -2.358 1.00 0.00 H new ATOM 0 HG12 ILE A 82 12.051 1.448 -4.158 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.664 1.289 -3.099 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.781 -0.432 -4.230 1.00 0.00 H new ATOM 0 HG22 ILE A 82 12.965 -2.006 -4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 82 12.418 -0.617 -5.359 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.438 2.638 -2.023 1.00 0.00 H new ATOM 0 HD12 ILE A 82 12.173 1.125 -1.125 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.581 1.286 -2.201 1.00 0.00 H new ATOM 1286 N THR A 83 10.273 -2.833 -5.099 1.00 0.00 N ATOM 1287 CA THR A 83 10.372 -4.160 -5.653 1.00 0.00 C ATOM 1288 C THR A 83 11.373 -4.020 -6.795 1.00 0.00 C ATOM 1289 O THR A 83 11.169 -3.185 -7.679 1.00 0.00 O ATOM 1290 CB THR A 83 9.001 -4.611 -6.173 1.00 0.00 C ATOM 1291 OG1 THR A 83 7.938 -4.186 -5.334 1.00 0.00 O ATOM 1292 CG2 THR A 83 8.997 -6.138 -6.148 1.00 0.00 C ATOM 0 H THR A 83 10.036 -2.108 -5.776 1.00 0.00 H new ATOM 0 HA THR A 83 10.689 -4.905 -4.923 1.00 0.00 H new ATOM 0 HB THR A 83 8.852 -4.185 -7.165 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.654 -3.286 -5.597 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.037 -6.505 -6.511 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.795 -6.514 -6.788 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.156 -6.486 -5.127 1.00 0.00 H new ATOM 1300 N TRP A 84 12.442 -4.804 -6.757 1.00 0.00 N ATOM 1301 CA TRP A 84 13.444 -4.871 -7.795 1.00 0.00 C ATOM 1302 C TRP A 84 13.140 -6.158 -8.547 1.00 0.00 C ATOM 1303 O TRP A 84 13.085 -7.226 -7.934 1.00 0.00 O ATOM 1304 CB TRP A 84 14.863 -4.919 -7.206 1.00 0.00 C ATOM 1305 CG TRP A 84 15.880 -5.288 -8.243 1.00 0.00 C ATOM 1306 CD1 TRP A 84 16.369 -6.532 -8.458 1.00 0.00 C ATOM 1307 CD2 TRP A 84 16.388 -4.468 -9.336 1.00 0.00 C ATOM 1308 NE1 TRP A 84 17.089 -6.548 -9.635 1.00 0.00 N ATOM 1309 CE2 TRP A 84 17.083 -5.313 -10.247 1.00 0.00 C ATOM 1310 CE3 TRP A 84 16.282 -3.104 -9.675 1.00 0.00 C ATOM 1311 CZ2 TRP A 84 17.583 -4.842 -11.469 1.00 0.00 C ATOM 1312 CZ3 TRP A 84 16.824 -2.613 -10.877 1.00 0.00 C ATOM 1313 CH2 TRP A 84 17.449 -3.482 -11.784 1.00 0.00 C ATOM 0 H TRP A 84 12.636 -5.429 -5.974 1.00 0.00 H new ATOM 0 HA TRP A 84 13.413 -3.992 -8.438 1.00 0.00 H new ATOM 0 HB2 TRP A 84 15.113 -3.948 -6.780 1.00 0.00 H new ATOM 0 HB3 TRP A 84 14.895 -5.642 -6.391 1.00 0.00 H new ATOM 0 HD1 TRP A 84 16.219 -7.381 -7.808 1.00 0.00 H new ATOM 0 HE1 TRP A 84 17.566 -7.370 -10.005 1.00 0.00 H new ATOM 0 HE3 TRP A 84 15.778 -2.426 -9.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 18.065 -5.518 -12.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 16.758 -1.559 -11.103 1.00 0.00 H new ATOM 0 HH2 TRP A 84 17.826 -3.104 -12.723 1.00 0.00 H new ATOM 1324 N ILE A 85 12.939 -6.078 -9.854 1.00 0.00 N ATOM 1325 CA ILE A 85 12.736 -7.236 -10.702 1.00 0.00 C ATOM 1326 C ILE A 85 13.793 -7.078 -11.779 1.00 0.00 C ATOM 1327 O ILE A 85 13.690 -6.140 -12.561 1.00 0.00 O ATOM 1328 CB ILE A 85 11.313 -7.280 -11.311 1.00 0.00 C ATOM 1329 CG1 ILE A 85 10.137 -7.091 -10.323 1.00 0.00 C ATOM 1330 CG2 ILE A 85 11.145 -8.590 -12.101 1.00 0.00 C ATOM 1331 CD1 ILE A 85 9.871 -8.248 -9.354 1.00 0.00 C ATOM 0 H ILE A 85 12.913 -5.192 -10.360 1.00 0.00 H new ATOM 0 HA ILE A 85 12.824 -8.171 -10.148 1.00 0.00 H new ATOM 0 HB ILE A 85 11.251 -6.405 -11.958 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.323 -6.191 -9.738 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.230 -6.913 -10.901 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.145 -8.629 -12.533 1.00 0.00 H new ATOM 0 HG22 ILE A 85 11.887 -8.632 -12.899 1.00 0.00 H new ATOM 0 HG23 ILE A 85 11.284 -9.439 -11.432 1.00 0.00 H new ATOM 0 HD11 ILE A 85 9.025 -7.999 -8.713 1.00 0.00 H new ATOM 0 HD12 ILE A 85 9.644 -9.152 -9.920 1.00 0.00 H new ATOM 0 HD13 ILE A 85 10.754 -8.418 -8.739 1.00 0.00 H new ATOM 1343 N GLY A 86 14.828 -7.913 -11.809 1.00 0.00 N ATOM 1344 CA GLY A 86 15.799 -7.837 -12.885 1.00 0.00 C ATOM 1345 C GLY A 86 15.039 -7.955 -14.203 1.00 0.00 C ATOM 1346 O GLY A 86 14.270 -8.898 -14.381 1.00 0.00 O ATOM 0 H GLY A 86 15.010 -8.636 -11.113 1.00 0.00 H new ATOM 0 HA2 GLY A 86 16.346 -6.895 -12.841 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.534 -8.637 -12.794 1.00 0.00 H new ATOM 1350 N GLU A 87 15.221 -7.018 -15.136 1.00 0.00 N ATOM 1351 CA GLU A 87 14.476 -6.988 -16.401 1.00 0.00 C ATOM 1352 C GLU A 87 14.641 -8.283 -17.224 1.00 0.00 C ATOM 1353 O GLU A 87 13.899 -8.527 -18.179 1.00 0.00 O ATOM 1354 CB GLU A 87 14.913 -5.744 -17.198 1.00 0.00 C ATOM 1355 CG GLU A 87 13.978 -5.349 -18.351 1.00 0.00 C ATOM 1356 CD GLU A 87 12.561 -5.010 -17.879 1.00 0.00 C ATOM 1357 OE1 GLU A 87 12.369 -3.973 -17.213 1.00 0.00 O ATOM 1358 OE2 GLU A 87 11.614 -5.766 -18.191 1.00 0.00 O ATOM 0 H GLU A 87 15.891 -6.255 -15.037 1.00 0.00 H new ATOM 0 HA GLU A 87 13.411 -6.926 -16.177 1.00 0.00 H new ATOM 0 HB2 GLU A 87 14.994 -4.901 -16.511 1.00 0.00 H new ATOM 0 HB3 GLU A 87 15.909 -5.922 -17.603 1.00 0.00 H new ATOM 0 HG2 GLU A 87 14.397 -4.489 -18.874 1.00 0.00 H new ATOM 0 HG3 GLU A 87 13.930 -6.167 -19.070 1.00 0.00 H new ATOM 1365 N ASN A 88 15.592 -9.140 -16.854 1.00 0.00 N ATOM 1366 CA ASN A 88 15.883 -10.391 -17.528 1.00 0.00 C ATOM 1367 C ASN A 88 14.956 -11.510 -17.052 1.00 0.00 C ATOM 1368 O ASN A 88 14.660 -12.388 -17.870 1.00 0.00 O ATOM 1369 CB ASN A 88 17.342 -10.805 -17.271 1.00 0.00 C ATOM 1370 CG ASN A 88 18.374 -9.901 -17.931 1.00 0.00 C ATOM 1371 OD1 ASN A 88 18.161 -8.705 -18.118 1.00 0.00 O ATOM 1372 ND2 ASN A 88 19.531 -10.423 -18.280 1.00 0.00 N ATOM 0 H ASN A 88 16.197 -8.971 -16.050 1.00 0.00 H new ATOM 0 HA ASN A 88 15.723 -10.234 -18.595 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.520 -10.816 -16.196 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.487 -11.824 -17.629 1.00 0.00 H new ATOM 0 HD21 ASN A 88 20.248 -9.835 -18.705 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.710 -11.415 -18.126 1.00 0.00 H new ATOM 1379 N VAL A 89 14.472 -11.523 -15.802 1.00 0.00 N ATOM 1380 CA VAL A 89 13.656 -12.634 -15.312 1.00 0.00 C ATOM 1381 C VAL A 89 12.246 -12.593 -15.902 1.00 0.00 C ATOM 1382 O VAL A 89 11.648 -11.533 -16.099 1.00 0.00 O ATOM 1383 CB VAL A 89 13.697 -12.733 -13.769 1.00 0.00 C ATOM 1384 CG1 VAL A 89 13.196 -11.505 -12.996 1.00 0.00 C ATOM 1385 CG2 VAL A 89 12.961 -13.965 -13.226 1.00 0.00 C ATOM 0 H VAL A 89 14.632 -10.782 -15.120 1.00 0.00 H new ATOM 0 HA VAL A 89 14.092 -13.567 -15.669 1.00 0.00 H new ATOM 0 HB VAL A 89 14.769 -12.812 -13.589 1.00 0.00 H new ATOM 0 HG11 VAL A 89 13.273 -11.693 -11.925 1.00 0.00 H new ATOM 0 HG12 VAL A 89 13.803 -10.638 -13.257 1.00 0.00 H new ATOM 0 HG13 VAL A 89 12.156 -11.311 -13.256 1.00 0.00 H new ATOM 0 HG21 VAL A 89 13.026 -13.977 -12.138 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.914 -13.925 -13.527 1.00 0.00 H new ATOM 0 HG23 VAL A 89 13.420 -14.869 -13.627 1.00 0.00 H new ATOM 1395 N SER A 90 11.697 -13.772 -16.175 1.00 0.00 N ATOM 1396 CA SER A 90 10.350 -14.004 -16.658 1.00 0.00 C ATOM 1397 C SER A 90 9.851 -15.289 -15.989 1.00 0.00 C ATOM 1398 O SER A 90 10.556 -15.907 -15.184 1.00 0.00 O ATOM 1399 CB SER A 90 10.347 -14.054 -18.194 1.00 0.00 C ATOM 1400 OG SER A 90 9.029 -13.977 -18.712 1.00 0.00 O ATOM 0 H SER A 90 12.217 -14.641 -16.056 1.00 0.00 H new ATOM 0 HA SER A 90 9.667 -13.196 -16.397 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.943 -13.230 -18.587 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.818 -14.977 -18.530 1.00 0.00 H new ATOM 0 HG SER A 90 9.060 -14.009 -19.691 1.00 0.00 H new ATOM 1406 N GLY A 91 8.599 -15.653 -16.243 1.00 0.00 N ATOM 1407 CA GLY A 91 8.045 -16.892 -15.736 1.00 0.00 C ATOM 1408 C GLY A 91 7.629 -16.762 -14.276 1.00 0.00 C ATOM 1409 O GLY A 91 7.336 -15.663 -13.783 1.00 0.00 O ATOM 0 H GLY A 91 7.949 -15.100 -16.801 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.182 -17.179 -16.337 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.782 -17.689 -15.836 1.00 0.00 H new ATOM 1413 N LEU A 92 7.580 -17.905 -13.592 1.00 0.00 N ATOM 1414 CA LEU A 92 7.125 -18.020 -12.216 1.00 0.00 C ATOM 1415 C LEU A 92 7.950 -17.174 -11.256 1.00 0.00 C ATOM 1416 O LEU A 92 7.354 -16.531 -10.403 1.00 0.00 O ATOM 1417 CB LEU A 92 7.067 -19.496 -11.797 1.00 0.00 C ATOM 1418 CG LEU A 92 6.497 -19.717 -10.376 1.00 0.00 C ATOM 1419 CD1 LEU A 92 5.633 -20.984 -10.344 1.00 0.00 C ATOM 1420 CD2 LEU A 92 7.608 -19.864 -9.326 1.00 0.00 C ATOM 0 H LEU A 92 7.864 -18.798 -13.995 1.00 0.00 H new ATOM 0 HA LEU A 92 6.114 -17.616 -12.163 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.455 -20.044 -12.514 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.071 -19.918 -11.846 1.00 0.00 H new ATOM 0 HG LEU A 92 5.900 -18.838 -10.134 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.237 -21.129 -9.339 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.807 -20.879 -11.047 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.240 -21.845 -10.623 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.162 -20.017 -8.343 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.235 -20.719 -9.577 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.216 -18.960 -9.311 1.00 0.00 H new ATOM 1432 N GLN A 93 9.284 -17.124 -11.362 1.00 0.00 N ATOM 1433 CA GLN A 93 10.078 -16.368 -10.382 1.00 0.00 C ATOM 1434 C GLN A 93 9.713 -14.881 -10.390 1.00 0.00 C ATOM 1435 O GLN A 93 9.746 -14.230 -9.348 1.00 0.00 O ATOM 1436 CB GLN A 93 11.588 -16.538 -10.576 1.00 0.00 C ATOM 1437 CG GLN A 93 12.036 -18.004 -10.631 1.00 0.00 C ATOM 1438 CD GLN A 93 12.075 -18.486 -12.074 1.00 0.00 C ATOM 1439 OE1 GLN A 93 11.151 -19.145 -12.546 1.00 0.00 O ATOM 1440 NE2 GLN A 93 13.109 -18.133 -12.808 1.00 0.00 N ATOM 0 H GLN A 93 9.825 -17.584 -12.094 1.00 0.00 H new ATOM 0 HA GLN A 93 9.825 -16.790 -9.409 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.886 -16.040 -11.499 1.00 0.00 H new ATOM 0 HB3 GLN A 93 12.110 -16.037 -9.761 1.00 0.00 H new ATOM 0 HG2 GLN A 93 13.022 -18.108 -10.178 1.00 0.00 H new ATOM 0 HG3 GLN A 93 11.352 -18.623 -10.051 1.00 0.00 H new ATOM 0 HE21 GLN A 93 13.864 -17.586 -12.395 1.00 0.00 H new ATOM 0 HE22 GLN A 93 13.155 -18.406 -13.790 1.00 0.00 H new ATOM 1449 N ARG A 94 9.360 -14.346 -11.561 1.00 0.00 N ATOM 1450 CA ARG A 94 8.895 -12.974 -11.716 1.00 0.00 C ATOM 1451 C ARG A 94 7.484 -12.915 -11.121 1.00 0.00 C ATOM 1452 O ARG A 94 7.207 -12.052 -10.285 1.00 0.00 O ATOM 1453 CB ARG A 94 8.953 -12.636 -13.219 1.00 0.00 C ATOM 1454 CG ARG A 94 8.784 -11.167 -13.606 1.00 0.00 C ATOM 1455 CD ARG A 94 7.426 -10.554 -13.243 1.00 0.00 C ATOM 1456 NE ARG A 94 7.068 -9.491 -14.192 1.00 0.00 N ATOM 1457 CZ ARG A 94 5.872 -9.269 -14.743 1.00 0.00 C ATOM 1458 NH1 ARG A 94 4.798 -9.959 -14.374 1.00 0.00 N ATOM 1459 NH2 ARG A 94 5.740 -8.354 -15.691 1.00 0.00 N ATOM 0 H ARG A 94 9.391 -14.865 -12.439 1.00 0.00 H new ATOM 0 HA ARG A 94 9.505 -12.235 -11.197 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.911 -12.981 -13.607 1.00 0.00 H new ATOM 0 HB3 ARG A 94 8.178 -13.211 -13.726 1.00 0.00 H new ATOM 0 HG2 ARG A 94 9.569 -10.586 -13.122 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.934 -11.070 -14.681 1.00 0.00 H new ATOM 0 HD2 ARG A 94 6.658 -11.328 -13.249 1.00 0.00 H new ATOM 0 HD3 ARG A 94 7.462 -10.149 -12.232 1.00 0.00 H new ATOM 0 HE ARG A 94 7.816 -8.852 -14.460 1.00 0.00 H new ATOM 0 HH11 ARG A 94 4.876 -10.678 -13.654 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.896 -9.770 -14.810 1.00 0.00 H new ATOM 0 HH21 ARG A 94 6.552 -7.819 -16.000 1.00 0.00 H new ATOM 0 HH22 ARG A 94 4.827 -8.184 -16.112 1.00 0.00 H new ATOM 1473 N ALA A 95 6.607 -13.841 -11.526 1.00 0.00 N ATOM 1474 CA ALA A 95 5.204 -13.904 -11.124 1.00 0.00 C ATOM 1475 C ALA A 95 5.011 -14.066 -9.617 1.00 0.00 C ATOM 1476 O ALA A 95 3.987 -13.611 -9.110 1.00 0.00 O ATOM 1477 CB ALA A 95 4.497 -15.056 -11.835 1.00 0.00 C ATOM 0 H ALA A 95 6.868 -14.592 -12.165 1.00 0.00 H new ATOM 0 HA ALA A 95 4.769 -12.947 -11.412 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.453 -15.089 -11.524 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.550 -14.906 -12.913 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.983 -15.997 -11.575 1.00 0.00 H new ATOM 1483 N LYS A 96 5.973 -14.664 -8.897 1.00 0.00 N ATOM 1484 CA LYS A 96 5.952 -14.804 -7.440 1.00 0.00 C ATOM 1485 C LYS A 96 5.572 -13.500 -6.799 1.00 0.00 C ATOM 1486 O LYS A 96 4.737 -13.501 -5.914 1.00 0.00 O ATOM 1487 CB LYS A 96 7.315 -15.250 -6.875 1.00 0.00 C ATOM 1488 CG LYS A 96 7.576 -16.752 -6.964 1.00 0.00 C ATOM 1489 CD LYS A 96 8.958 -17.146 -6.417 1.00 0.00 C ATOM 1490 CE LYS A 96 8.898 -18.618 -6.001 1.00 0.00 C ATOM 1491 NZ LYS A 96 10.206 -19.208 -5.656 1.00 0.00 N ATOM 0 H LYS A 96 6.804 -15.072 -9.325 1.00 0.00 H new ATOM 0 HA LYS A 96 5.215 -15.574 -7.210 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.106 -14.724 -7.410 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.379 -14.944 -5.831 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.804 -17.285 -6.408 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.497 -17.070 -8.004 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.726 -16.995 -7.176 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.224 -16.520 -5.566 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.232 -18.714 -5.143 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.456 -19.195 -6.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.077 -20.204 -5.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 10.840 -19.151 -6.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 10.624 -18.685 -4.860 1.00 0.00 H new ATOM 1505 N THR A 97 6.092 -12.392 -7.299 1.00 0.00 N ATOM 1506 CA THR A 97 5.848 -11.066 -6.776 1.00 0.00 C ATOM 1507 C THR A 97 4.341 -10.785 -6.658 1.00 0.00 C ATOM 1508 O THR A 97 3.899 -10.233 -5.654 1.00 0.00 O ATOM 1509 CB THR A 97 6.545 -10.097 -7.745 1.00 0.00 C ATOM 1510 OG1 THR A 97 7.876 -10.509 -7.995 1.00 0.00 O ATOM 1511 CG2 THR A 97 6.540 -8.668 -7.235 1.00 0.00 C ATOM 0 H THR A 97 6.715 -12.395 -8.106 1.00 0.00 H new ATOM 0 HA THR A 97 6.243 -10.951 -5.767 1.00 0.00 H new ATOM 0 HB THR A 97 5.976 -10.121 -8.674 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.909 -11.021 -8.830 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.044 -8.023 -7.955 1.00 0.00 H new ATOM 0 HG22 THR A 97 5.511 -8.332 -7.104 1.00 0.00 H new ATOM 0 HG23 THR A 97 7.061 -8.621 -6.279 1.00 0.00 H new ATOM 1519 N GLY A 98 3.530 -11.218 -7.627 1.00 0.00 N ATOM 1520 CA GLY A 98 2.085 -11.004 -7.615 1.00 0.00 C ATOM 1521 C GLY A 98 1.339 -11.907 -6.627 1.00 0.00 C ATOM 1522 O GLY A 98 0.144 -11.704 -6.399 1.00 0.00 O ATOM 0 H GLY A 98 3.862 -11.729 -8.445 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.883 -9.962 -7.366 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.693 -11.174 -8.618 1.00 0.00 H new ATOM 1526 N THR A 99 2.007 -12.905 -6.055 1.00 0.00 N ATOM 1527 CA THR A 99 1.490 -13.828 -5.049 1.00 0.00 C ATOM 1528 C THR A 99 2.189 -13.606 -3.693 1.00 0.00 C ATOM 1529 O THR A 99 1.677 -13.996 -2.644 1.00 0.00 O ATOM 1530 CB THR A 99 1.751 -15.245 -5.598 1.00 0.00 C ATOM 1531 OG1 THR A 99 1.179 -15.380 -6.892 1.00 0.00 O ATOM 1532 CG2 THR A 99 1.200 -16.360 -4.712 1.00 0.00 C ATOM 0 H THR A 99 2.979 -13.102 -6.295 1.00 0.00 H new ATOM 0 HA THR A 99 0.426 -13.673 -4.869 1.00 0.00 H new ATOM 0 HB THR A 99 2.835 -15.354 -5.628 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.351 -16.282 -7.233 1.00 0.00 H new ATOM 0 HG21 THR A 99 1.422 -17.327 -5.164 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.663 -16.304 -3.727 1.00 0.00 H new ATOM 0 HG23 THR A 99 0.121 -16.246 -4.612 1.00 0.00 H new ATOM 1540 N ASP A 100 3.310 -12.890 -3.698 1.00 0.00 N ATOM 1541 CA ASP A 100 4.181 -12.643 -2.565 1.00 0.00 C ATOM 1542 C ASP A 100 4.035 -11.246 -2.004 1.00 0.00 C ATOM 1543 O ASP A 100 4.197 -11.068 -0.802 1.00 0.00 O ATOM 1544 CB ASP A 100 5.628 -12.841 -3.025 1.00 0.00 C ATOM 1545 CG ASP A 100 6.037 -14.323 -3.142 1.00 0.00 C ATOM 1546 OD1 ASP A 100 5.192 -15.228 -2.951 1.00 0.00 O ATOM 1547 OD2 ASP A 100 7.224 -14.598 -3.419 1.00 0.00 O ATOM 0 H ASP A 100 3.651 -12.441 -4.548 1.00 0.00 H new ATOM 0 HA ASP A 100 3.905 -13.339 -1.773 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.763 -12.357 -3.992 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.296 -12.342 -2.323 1.00 0.00 H new ATOM 1552 N LYS A 101 3.677 -10.241 -2.806 1.00 0.00 N ATOM 1553 CA LYS A 101 3.471 -8.898 -2.272 1.00 0.00 C ATOM 1554 C LYS A 101 2.480 -8.865 -1.127 1.00 0.00 C ATOM 1555 O LYS A 101 2.683 -8.092 -0.196 1.00 0.00 O ATOM 1556 CB LYS A 101 3.096 -7.904 -3.370 1.00 0.00 C ATOM 1557 CG LYS A 101 4.367 -7.447 -4.074 1.00 0.00 C ATOM 1558 CD LYS A 101 4.072 -6.530 -5.249 1.00 0.00 C ATOM 1559 CE LYS A 101 5.375 -5.787 -5.528 1.00 0.00 C ATOM 1560 NZ LYS A 101 5.187 -4.690 -6.478 1.00 0.00 N ATOM 0 H LYS A 101 3.526 -10.331 -3.811 1.00 0.00 H new ATOM 0 HA LYS A 101 4.429 -8.585 -1.857 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.416 -8.369 -4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.573 -7.049 -2.942 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.009 -6.928 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.920 -8.318 -4.425 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.752 -7.101 -6.121 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.267 -5.834 -5.011 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.775 -5.393 -4.594 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.114 -6.485 -5.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.999 -4.042 -6.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.112 -5.074 -7.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.316 -4.173 -6.243 1.00 0.00 H new ATOM 1574 N THR A 102 1.467 -9.725 -1.131 1.00 0.00 N ATOM 1575 CA THR A 102 0.529 -9.803 -0.031 1.00 0.00 C ATOM 1576 C THR A 102 1.221 -10.255 1.266 1.00 0.00 C ATOM 1577 O THR A 102 0.816 -9.818 2.332 1.00 0.00 O ATOM 1578 CB THR A 102 -0.609 -10.746 -0.443 1.00 0.00 C ATOM 1579 OG1 THR A 102 -1.759 -10.543 0.349 1.00 0.00 O ATOM 1580 CG2 THR A 102 -0.182 -12.210 -0.358 1.00 0.00 C ATOM 0 H THR A 102 1.279 -10.379 -1.891 1.00 0.00 H new ATOM 0 HA THR A 102 0.118 -8.816 0.183 1.00 0.00 H new ATOM 0 HB THR A 102 -0.851 -10.512 -1.480 1.00 0.00 H new ATOM 0 HG1 THR A 102 -2.559 -10.753 -0.176 1.00 0.00 H new ATOM 0 HG21 THR A 102 -1.013 -12.849 -0.657 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.665 -12.381 -1.023 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.107 -12.446 0.666 1.00 0.00 H new ATOM 1588 N LEU A 103 2.231 -11.127 1.202 1.00 0.00 N ATOM 1589 CA LEU A 103 2.923 -11.713 2.345 1.00 0.00 C ATOM 1590 C LEU A 103 3.706 -10.638 3.066 1.00 0.00 C ATOM 1591 O LEU A 103 3.459 -10.350 4.232 1.00 0.00 O ATOM 1592 CB LEU A 103 3.853 -12.823 1.861 1.00 0.00 C ATOM 1593 CG LEU A 103 3.115 -14.075 1.378 1.00 0.00 C ATOM 1594 CD1 LEU A 103 4.174 -15.124 1.097 1.00 0.00 C ATOM 1595 CD2 LEU A 103 2.091 -14.664 2.361 1.00 0.00 C ATOM 0 H LEU A 103 2.602 -11.456 0.311 1.00 0.00 H new ATOM 0 HA LEU A 103 2.198 -12.141 3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.471 -12.440 1.049 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.528 -13.099 2.671 1.00 0.00 H new ATOM 0 HG LEU A 103 2.532 -13.783 0.505 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.696 -16.039 0.748 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.856 -14.756 0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.732 -15.331 2.010 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.628 -15.546 1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.594 -14.944 3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.323 -13.920 2.576 1.00 0.00 H new ATOM 1607 N VAL A 104 4.661 -10.043 2.363 1.00 0.00 N ATOM 1608 CA VAL A 104 5.427 -8.930 2.894 1.00 0.00 C ATOM 1609 C VAL A 104 4.467 -7.786 3.262 1.00 0.00 C ATOM 1610 O VAL A 104 4.686 -7.154 4.295 1.00 0.00 O ATOM 1611 CB VAL A 104 6.601 -8.600 1.937 1.00 0.00 C ATOM 1612 CG1 VAL A 104 6.248 -8.712 0.445 1.00 0.00 C ATOM 1613 CG2 VAL A 104 7.229 -7.228 2.214 1.00 0.00 C ATOM 0 H VAL A 104 4.923 -10.318 1.416 1.00 0.00 H new ATOM 0 HA VAL A 104 5.925 -9.170 3.833 1.00 0.00 H new ATOM 0 HB VAL A 104 7.336 -9.374 2.157 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.123 -8.465 -0.156 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.930 -9.730 0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.440 -8.020 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.045 -7.053 1.513 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.474 -6.451 2.093 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.615 -7.204 3.233 1.00 0.00 H new ATOM 1623 N LYS A 105 3.349 -7.575 2.543 1.00 0.00 N ATOM 1624 CA LYS A 105 2.403 -6.536 2.954 1.00 0.00 C ATOM 1625 C LYS A 105 1.785 -6.889 4.305 1.00 0.00 C ATOM 1626 O LYS A 105 1.684 -6.010 5.150 1.00 0.00 O ATOM 1627 CB LYS A 105 1.314 -6.305 1.901 1.00 0.00 C ATOM 1628 CG LYS A 105 0.504 -5.038 2.193 1.00 0.00 C ATOM 1629 CD LYS A 105 -0.820 -5.067 1.433 1.00 0.00 C ATOM 1630 CE LYS A 105 -1.550 -3.752 1.695 1.00 0.00 C ATOM 1631 NZ LYS A 105 -2.963 -3.833 1.304 1.00 0.00 N ATOM 0 H LYS A 105 3.089 -8.093 1.704 1.00 0.00 H new ATOM 0 HA LYS A 105 2.957 -5.603 3.052 1.00 0.00 H new ATOM 0 HB2 LYS A 105 1.772 -6.225 0.915 1.00 0.00 H new ATOM 0 HB3 LYS A 105 0.646 -7.166 1.873 1.00 0.00 H new ATOM 0 HG2 LYS A 105 0.315 -4.958 3.263 1.00 0.00 H new ATOM 0 HG3 LYS A 105 1.077 -4.157 1.904 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -0.643 -5.197 0.365 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -1.428 -5.911 1.760 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -1.478 -3.499 2.753 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -1.064 -2.948 1.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -3.429 -2.923 1.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -3.030 -4.050 0.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -3.432 -4.584 1.850 1.00 0.00 H new ATOM 1645 N GLU A 106 1.412 -8.149 4.540 1.00 0.00 N ATOM 1646 CA GLU A 106 0.796 -8.586 5.789 1.00 0.00 C ATOM 1647 C GLU A 106 1.681 -8.289 6.996 1.00 0.00 C ATOM 1648 O GLU A 106 1.159 -8.179 8.104 1.00 0.00 O ATOM 1649 CB GLU A 106 0.470 -10.084 5.759 1.00 0.00 C ATOM 1650 CG GLU A 106 -0.692 -10.464 4.830 1.00 0.00 C ATOM 1651 CD GLU A 106 -1.969 -10.781 5.596 1.00 0.00 C ATOM 1652 OE1 GLU A 106 -1.943 -11.636 6.512 1.00 0.00 O ATOM 1653 OE2 GLU A 106 -3.037 -10.222 5.253 1.00 0.00 O ATOM 0 H GLU A 106 1.531 -8.900 3.860 1.00 0.00 H new ATOM 0 HA GLU A 106 -0.130 -8.020 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 106 1.360 -10.631 5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 106 0.232 -10.411 6.771 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.882 -9.645 4.136 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -0.407 -11.329 4.231 1.00 0.00 H new ATOM 1660 N VAL A 107 3.002 -8.201 6.826 1.00 0.00 N ATOM 1661 CA VAL A 107 3.910 -7.829 7.900 1.00 0.00 C ATOM 1662 C VAL A 107 3.943 -6.300 7.964 1.00 0.00 C ATOM 1663 O VAL A 107 3.556 -5.691 8.964 1.00 0.00 O ATOM 1664 CB VAL A 107 5.313 -8.427 7.646 1.00 0.00 C ATOM 1665 CG1 VAL A 107 6.331 -7.918 8.682 1.00 0.00 C ATOM 1666 CG2 VAL A 107 5.278 -9.955 7.724 1.00 0.00 C ATOM 0 H VAL A 107 3.467 -8.387 5.937 1.00 0.00 H new ATOM 0 HA VAL A 107 3.571 -8.225 8.857 1.00 0.00 H new ATOM 0 HB VAL A 107 5.615 -8.111 6.647 1.00 0.00 H new ATOM 0 HG11 VAL A 107 7.308 -8.356 8.478 1.00 0.00 H new ATOM 0 HG12 VAL A 107 6.400 -6.832 8.621 1.00 0.00 H new ATOM 0 HG13 VAL A 107 6.007 -8.205 9.682 1.00 0.00 H new ATOM 0 HG21 VAL A 107 6.277 -10.352 7.542 1.00 0.00 H new ATOM 0 HG22 VAL A 107 4.941 -10.261 8.714 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.591 -10.342 6.971 1.00 0.00 H new ATOM 1676 N VAL A 108 4.393 -5.702 6.869 1.00 0.00 N ATOM 1677 CA VAL A 108 4.646 -4.297 6.615 1.00 0.00 C ATOM 1678 C VAL A 108 3.357 -3.472 6.376 1.00 0.00 C ATOM 1679 O VAL A 108 3.403 -2.502 5.628 1.00 0.00 O ATOM 1680 CB VAL A 108 5.721 -4.206 5.500 1.00 0.00 C ATOM 1681 CG1 VAL A 108 6.447 -2.858 5.479 1.00 0.00 C ATOM 1682 CG2 VAL A 108 6.885 -5.214 5.655 1.00 0.00 C ATOM 0 H VAL A 108 4.614 -6.259 6.044 1.00 0.00 H new ATOM 0 HA VAL A 108 5.047 -3.815 7.506 1.00 0.00 H new ATOM 0 HB VAL A 108 5.128 -4.395 4.605 1.00 0.00 H new ATOM 0 HG11 VAL A 108 7.186 -2.855 4.678 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.725 -2.059 5.309 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.947 -2.699 6.435 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.591 -5.083 4.835 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.394 -5.040 6.603 1.00 0.00 H new ATOM 0 HG23 VAL A 108 6.491 -6.230 5.636 1.00 0.00 H new ATOM 1692 N GLN A 109 2.183 -3.857 6.901 1.00 0.00 N ATOM 1693 CA GLN A 109 0.913 -3.151 6.635 1.00 0.00 C ATOM 1694 C GLN A 109 1.022 -1.632 6.872 1.00 0.00 C ATOM 1695 O GLN A 109 0.302 -0.857 6.233 1.00 0.00 O ATOM 1696 CB GLN A 109 -0.223 -3.718 7.508 1.00 0.00 C ATOM 1697 CG GLN A 109 -0.747 -5.116 7.132 1.00 0.00 C ATOM 1698 CD GLN A 109 -1.515 -5.203 5.806 1.00 0.00 C ATOM 1699 OE1 GLN A 109 -1.376 -6.155 5.045 1.00 0.00 O ATOM 1700 NE2 GLN A 109 -2.409 -4.276 5.500 1.00 0.00 N ATOM 0 H GLN A 109 2.084 -4.662 7.519 1.00 0.00 H new ATOM 0 HA GLN A 109 0.687 -3.314 5.581 1.00 0.00 H new ATOM 0 HB2 GLN A 109 0.124 -3.750 8.541 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -1.060 -3.020 7.475 1.00 0.00 H new ATOM 0 HG2 GLN A 109 0.099 -5.801 7.086 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -1.399 -5.467 7.932 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -2.544 -3.474 6.116 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -2.963 -4.363 4.648 1.00 0.00 H new ATOM 1709 N ASN A 110 1.933 -1.195 7.748 1.00 0.00 N ATOM 1710 CA ASN A 110 2.215 0.208 8.002 1.00 0.00 C ATOM 1711 C ASN A 110 3.295 0.652 7.017 1.00 0.00 C ATOM 1712 O ASN A 110 4.472 0.783 7.353 1.00 0.00 O ATOM 1713 CB ASN A 110 2.630 0.443 9.456 1.00 0.00 C ATOM 1714 CG ASN A 110 3.125 1.874 9.686 1.00 0.00 C ATOM 1715 OD1 ASN A 110 2.579 2.838 9.152 1.00 0.00 O ATOM 1716 ND2 ASN A 110 4.165 2.048 10.482 1.00 0.00 N ATOM 0 H ASN A 110 2.504 -1.827 8.309 1.00 0.00 H new ATOM 0 HA ASN A 110 1.316 0.806 7.852 1.00 0.00 H new ATOM 0 HB2 ASN A 110 1.783 0.242 10.112 1.00 0.00 H new ATOM 0 HB3 ASN A 110 3.417 -0.261 9.727 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.521 2.988 10.658 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.612 1.243 10.921 1.00 0.00 H new ATOM 1723 N PHE A 111 2.878 0.821 5.769 1.00 0.00 N ATOM 1724 CA PHE A 111 3.664 1.326 4.657 1.00 0.00 C ATOM 1725 C PHE A 111 2.715 2.232 3.885 1.00 0.00 C ATOM 1726 O PHE A 111 1.492 2.116 4.039 1.00 0.00 O ATOM 1727 CB PHE A 111 4.248 0.216 3.764 1.00 0.00 C ATOM 1728 CG PHE A 111 3.291 -0.371 2.739 1.00 0.00 C ATOM 1729 CD1 PHE A 111 2.088 -0.968 3.151 1.00 0.00 C ATOM 1730 CD2 PHE A 111 3.573 -0.262 1.363 1.00 0.00 C ATOM 1731 CE1 PHE A 111 1.142 -1.390 2.207 1.00 0.00 C ATOM 1732 CE2 PHE A 111 2.639 -0.713 0.415 1.00 0.00 C ATOM 1733 CZ PHE A 111 1.412 -1.258 0.835 1.00 0.00 C ATOM 0 H PHE A 111 1.923 0.594 5.492 1.00 0.00 H new ATOM 0 HA PHE A 111 4.545 1.857 5.018 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.115 0.615 3.238 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.606 -0.590 4.404 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.890 -1.103 4.204 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.508 0.169 1.036 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.205 -1.817 2.534 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.864 -0.641 -0.639 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.681 -1.574 0.106 1.00 0.00 H new ATOM 1743 N ALA A 112 3.246 3.124 3.052 1.00 0.00 N ATOM 1744 CA ALA A 112 2.375 4.053 2.362 1.00 0.00 C ATOM 1745 C ALA A 112 1.887 3.414 1.063 1.00 0.00 C ATOM 1746 O ALA A 112 0.706 3.092 0.946 1.00 0.00 O ATOM 1747 CB ALA A 112 3.139 5.360 2.156 1.00 0.00 C ATOM 0 H ALA A 112 4.241 3.218 2.847 1.00 0.00 H new ATOM 0 HA ALA A 112 1.482 4.286 2.943 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.502 6.076 1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.430 5.768 3.124 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.031 5.170 1.560 1.00 0.00 H new ATOM 1753 N LYS A 113 2.799 3.190 0.117 1.00 0.00 N ATOM 1754 CA LYS A 113 2.644 2.576 -1.200 1.00 0.00 C ATOM 1755 C LYS A 113 3.973 1.973 -1.615 1.00 0.00 C ATOM 1756 O LYS A 113 4.956 2.036 -0.877 1.00 0.00 O ATOM 1757 CB LYS A 113 2.029 3.513 -2.270 1.00 0.00 C ATOM 1758 CG LYS A 113 0.494 3.592 -2.204 1.00 0.00 C ATOM 1759 CD LYS A 113 -0.123 4.782 -1.460 1.00 0.00 C ATOM 1760 CE LYS A 113 -1.586 4.504 -1.066 1.00 0.00 C ATOM 1761 NZ LYS A 113 -1.762 3.294 -0.232 1.00 0.00 N ATOM 0 H LYS A 113 3.769 3.464 0.273 1.00 0.00 H new ATOM 0 HA LYS A 113 1.903 1.781 -1.120 1.00 0.00 H new ATOM 0 HB2 LYS A 113 2.442 4.514 -2.146 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.325 3.166 -3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.114 3.600 -3.225 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.130 2.677 -1.736 1.00 0.00 H new ATOM 0 HD2 LYS A 113 0.462 4.996 -0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -0.077 5.670 -2.090 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -1.977 5.366 -0.525 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -2.183 4.399 -1.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -2.540 3.446 0.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -1.985 2.482 -0.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -0.884 3.103 0.292 1.00 0.00 H new ATOM 1775 N GLU A 114 3.972 1.312 -2.759 1.00 0.00 N ATOM 1776 CA GLU A 114 5.113 0.585 -3.286 1.00 0.00 C ATOM 1777 C GLU A 114 5.572 1.111 -4.644 1.00 0.00 C ATOM 1778 O GLU A 114 4.831 1.830 -5.324 1.00 0.00 O ATOM 1779 CB GLU A 114 4.733 -0.897 -3.327 1.00 0.00 C ATOM 1780 CG GLU A 114 3.607 -1.160 -4.326 1.00 0.00 C ATOM 1781 CD GLU A 114 3.029 -2.550 -4.164 1.00 0.00 C ATOM 1782 OE1 GLU A 114 2.360 -2.811 -3.136 1.00 0.00 O ATOM 1783 OE2 GLU A 114 3.223 -3.343 -5.108 1.00 0.00 O ATOM 0 H GLU A 114 3.153 1.265 -3.365 1.00 0.00 H new ATOM 0 HA GLU A 114 5.976 0.730 -2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.607 -1.490 -3.598 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.423 -1.222 -2.334 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.819 -0.420 -4.189 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.985 -1.039 -5.341 1.00 0.00 H new ATOM 1790 N PHE A 115 6.771 0.713 -5.068 1.00 0.00 N ATOM 1791 CA PHE A 115 7.404 1.178 -6.291 1.00 0.00 C ATOM 1792 C PHE A 115 7.929 -0.102 -6.957 1.00 0.00 C ATOM 1793 O PHE A 115 8.329 -1.040 -6.255 1.00 0.00 O ATOM 1794 CB PHE A 115 8.561 2.116 -5.884 1.00 0.00 C ATOM 1795 CG PHE A 115 9.036 3.117 -6.921 1.00 0.00 C ATOM 1796 CD1 PHE A 115 9.564 2.737 -8.164 1.00 0.00 C ATOM 1797 CD2 PHE A 115 8.931 4.488 -6.612 1.00 0.00 C ATOM 1798 CE1 PHE A 115 9.986 3.709 -9.089 1.00 0.00 C ATOM 1799 CE2 PHE A 115 9.350 5.461 -7.529 1.00 0.00 C ATOM 1800 CZ PHE A 115 9.872 5.070 -8.769 1.00 0.00 C ATOM 0 H PHE A 115 7.340 0.041 -4.553 1.00 0.00 H new ATOM 0 HA PHE A 115 6.746 1.726 -6.965 1.00 0.00 H new ATOM 0 HB2 PHE A 115 8.252 2.669 -4.997 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.412 1.499 -5.595 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.647 1.689 -8.413 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.524 4.792 -5.659 1.00 0.00 H new ATOM 0 HE1 PHE A 115 10.396 3.409 -10.042 1.00 0.00 H new ATOM 0 HE2 PHE A 115 9.271 6.509 -7.281 1.00 0.00 H new ATOM 0 HZ PHE A 115 10.188 5.819 -9.481 1.00 0.00 H new ATOM 1810 N VAL A 116 7.956 -0.164 -8.286 1.00 0.00 N ATOM 1811 CA VAL A 116 8.510 -1.296 -9.025 1.00 0.00 C ATOM 1812 C VAL A 116 9.594 -0.740 -9.939 1.00 0.00 C ATOM 1813 O VAL A 116 9.355 0.255 -10.627 1.00 0.00 O ATOM 1814 CB VAL A 116 7.410 -2.064 -9.784 1.00 0.00 C ATOM 1815 CG1 VAL A 116 7.994 -3.351 -10.386 1.00 0.00 C ATOM 1816 CG2 VAL A 116 6.251 -2.434 -8.845 1.00 0.00 C ATOM 0 H VAL A 116 7.591 0.576 -8.886 1.00 0.00 H new ATOM 0 HA VAL A 116 8.948 -2.033 -8.351 1.00 0.00 H new ATOM 0 HB VAL A 116 7.032 -1.418 -10.576 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.212 -3.890 -10.921 1.00 0.00 H new ATOM 0 HG12 VAL A 116 8.798 -3.097 -11.077 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.387 -3.980 -9.588 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.488 -2.975 -9.405 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.624 -3.064 -8.037 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.818 -1.526 -8.426 1.00 0.00 H new ATOM 1826 N ILE A 117 10.777 -1.344 -9.899 1.00 0.00 N ATOM 1827 CA ILE A 117 11.959 -0.920 -10.626 1.00 0.00 C ATOM 1828 C ILE A 117 12.563 -2.156 -11.296 1.00 0.00 C ATOM 1829 O ILE A 117 12.590 -3.229 -10.684 1.00 0.00 O ATOM 1830 CB ILE A 117 12.951 -0.278 -9.633 1.00 0.00 C ATOM 1831 CG1 ILE A 117 12.412 1.053 -9.067 1.00 0.00 C ATOM 1832 CG2 ILE A 117 14.291 0.005 -10.318 1.00 0.00 C ATOM 1833 CD1 ILE A 117 12.204 1.049 -7.547 1.00 0.00 C ATOM 0 H ILE A 117 10.941 -2.177 -9.334 1.00 0.00 H new ATOM 0 HA ILE A 117 11.718 -0.181 -11.390 1.00 0.00 H new ATOM 0 HB ILE A 117 13.083 -0.989 -8.817 1.00 0.00 H new ATOM 0 HG12 ILE A 117 13.106 1.853 -9.326 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.464 1.284 -9.552 1.00 0.00 H new ATOM 0 HG21 ILE A 117 14.977 0.457 -9.602 1.00 0.00 H new ATOM 0 HG22 ILE A 117 14.715 -0.929 -10.687 1.00 0.00 H new ATOM 0 HG23 ILE A 117 14.136 0.688 -11.153 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.824 2.020 -7.229 1.00 0.00 H new ATOM 0 HD12 ILE A 117 11.486 0.273 -7.280 1.00 0.00 H new ATOM 0 HD13 ILE A 117 13.154 0.851 -7.050 1.00 0.00 H new ATOM 1845 N SER A 118 13.061 -2.003 -12.524 1.00 0.00 N ATOM 1846 CA SER A 118 13.752 -3.082 -13.227 1.00 0.00 C ATOM 1847 C SER A 118 14.989 -2.611 -14.001 1.00 0.00 C ATOM 1848 O SER A 118 15.725 -3.436 -14.552 1.00 0.00 O ATOM 1849 CB SER A 118 12.765 -3.894 -14.072 1.00 0.00 C ATOM 1850 OG SER A 118 11.906 -3.115 -14.883 1.00 0.00 O ATOM 0 H SER A 118 12.997 -1.134 -13.055 1.00 0.00 H new ATOM 0 HA SER A 118 14.158 -3.757 -12.474 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.328 -4.575 -14.711 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.158 -4.509 -13.408 1.00 0.00 H new ATOM 0 HG SER A 118 12.260 -3.081 -15.796 1.00 0.00 H new ATOM 1856 N ASP A 119 15.279 -1.305 -13.999 1.00 0.00 N ATOM 1857 CA ASP A 119 16.442 -0.715 -14.655 1.00 0.00 C ATOM 1858 C ASP A 119 17.197 0.183 -13.680 1.00 0.00 C ATOM 1859 O ASP A 119 16.593 0.771 -12.785 1.00 0.00 O ATOM 1860 CB ASP A 119 16.010 0.072 -15.896 1.00 0.00 C ATOM 1861 CG ASP A 119 17.213 0.771 -16.524 1.00 0.00 C ATOM 1862 OD1 ASP A 119 18.252 0.116 -16.760 1.00 0.00 O ATOM 1863 OD2 ASP A 119 17.164 1.997 -16.736 1.00 0.00 O ATOM 0 H ASP A 119 14.694 -0.615 -13.528 1.00 0.00 H new ATOM 0 HA ASP A 119 17.111 -1.515 -14.974 1.00 0.00 H new ATOM 0 HB2 ASP A 119 15.552 -0.601 -16.621 1.00 0.00 H new ATOM 0 HB3 ASP A 119 15.254 0.808 -15.623 1.00 0.00 H new ATOM 1868 N ARG A 120 18.512 0.329 -13.861 1.00 0.00 N ATOM 1869 CA ARG A 120 19.343 1.182 -13.017 1.00 0.00 C ATOM 1870 C ARG A 120 18.842 2.624 -13.040 1.00 0.00 C ATOM 1871 O ARG A 120 18.705 3.233 -11.989 1.00 0.00 O ATOM 1872 CB ARG A 120 20.807 1.088 -13.472 1.00 0.00 C ATOM 1873 CG ARG A 120 21.765 1.839 -12.531 1.00 0.00 C ATOM 1874 CD ARG A 120 23.216 1.758 -13.017 1.00 0.00 C ATOM 1875 NE ARG A 120 23.423 2.484 -14.283 1.00 0.00 N ATOM 1876 CZ ARG A 120 23.700 1.981 -15.497 1.00 0.00 C ATOM 1877 NH1 ARG A 120 23.645 0.669 -15.726 1.00 0.00 N ATOM 1878 NH2 ARG A 120 24.001 2.816 -16.489 1.00 0.00 N ATOM 0 H ARG A 120 19.030 -0.145 -14.601 1.00 0.00 H new ATOM 0 HA ARG A 120 19.278 0.835 -11.986 1.00 0.00 H new ATOM 0 HB2 ARG A 120 21.101 0.040 -13.524 1.00 0.00 H new ATOM 0 HB3 ARG A 120 20.898 1.495 -14.479 1.00 0.00 H new ATOM 0 HG2 ARG A 120 21.462 2.884 -12.462 1.00 0.00 H new ATOM 0 HG3 ARG A 120 21.693 1.419 -11.528 1.00 0.00 H new ATOM 0 HD2 ARG A 120 23.876 2.169 -12.253 1.00 0.00 H new ATOM 0 HD3 ARG A 120 23.494 0.713 -13.150 1.00 0.00 H new ATOM 0 HE ARG A 120 23.346 3.500 -14.230 1.00 0.00 H new ATOM 0 HH11 ARG A 120 23.389 0.030 -14.973 1.00 0.00 H new ATOM 0 HH12 ARG A 120 23.858 0.304 -16.654 1.00 0.00 H new ATOM 0 HH21 ARG A 120 24.019 3.822 -16.321 1.00 0.00 H new ATOM 0 HH22 ARG A 120 24.214 2.450 -17.417 1.00 0.00 H new ATOM 1892 N LYS A 121 18.524 3.172 -14.214 1.00 0.00 N ATOM 1893 CA LYS A 121 18.108 4.562 -14.346 1.00 0.00 C ATOM 1894 C LYS A 121 16.770 4.791 -13.641 1.00 0.00 C ATOM 1895 O LYS A 121 16.446 5.936 -13.325 1.00 0.00 O ATOM 1896 CB LYS A 121 18.131 5.043 -15.810 1.00 0.00 C ATOM 1897 CG LYS A 121 19.549 5.069 -16.429 1.00 0.00 C ATOM 1898 CD LYS A 121 20.097 3.725 -16.946 1.00 0.00 C ATOM 1899 CE LYS A 121 19.448 3.321 -18.273 1.00 0.00 C ATOM 1900 NZ LYS A 121 19.586 1.875 -18.545 1.00 0.00 N ATOM 0 H LYS A 121 18.549 2.662 -15.097 1.00 0.00 H new ATOM 0 HA LYS A 121 18.840 5.190 -13.838 1.00 0.00 H new ATOM 0 HB2 LYS A 121 17.494 4.392 -16.408 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.702 6.044 -15.862 1.00 0.00 H new ATOM 0 HG2 LYS A 121 19.547 5.778 -17.257 1.00 0.00 H new ATOM 0 HG3 LYS A 121 20.241 5.455 -15.681 1.00 0.00 H new ATOM 0 HD2 LYS A 121 21.177 3.798 -17.076 1.00 0.00 H new ATOM 0 HD3 LYS A 121 19.918 2.949 -16.202 1.00 0.00 H new ATOM 0 HE2 LYS A 121 18.391 3.586 -18.254 1.00 0.00 H new ATOM 0 HE3 LYS A 121 19.904 3.887 -19.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 18.967 1.610 -19.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 20.574 1.661 -18.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 19.315 1.335 -17.699 1.00 0.00 H new ATOM 1914 N GLU A 122 15.972 3.739 -13.459 1.00 0.00 N ATOM 1915 CA GLU A 122 14.706 3.716 -12.740 1.00 0.00 C ATOM 1916 C GLU A 122 14.935 3.553 -11.223 1.00 0.00 C ATOM 1917 O GLU A 122 14.068 3.890 -10.426 1.00 0.00 O ATOM 1918 CB GLU A 122 13.823 2.627 -13.360 1.00 0.00 C ATOM 1919 CG GLU A 122 12.405 2.541 -12.787 1.00 0.00 C ATOM 1920 CD GLU A 122 11.547 1.650 -13.682 1.00 0.00 C ATOM 1921 OE1 GLU A 122 11.795 0.426 -13.758 1.00 0.00 O ATOM 1922 OE2 GLU A 122 10.705 2.203 -14.431 1.00 0.00 O ATOM 0 H GLU A 122 16.212 2.822 -13.836 1.00 0.00 H new ATOM 0 HA GLU A 122 14.181 4.666 -12.841 1.00 0.00 H new ATOM 0 HB2 GLU A 122 13.755 2.803 -14.434 1.00 0.00 H new ATOM 0 HB3 GLU A 122 14.313 1.663 -13.225 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.434 2.137 -11.775 1.00 0.00 H new ATOM 0 HG3 GLU A 122 11.967 3.537 -12.720 1.00 0.00 H new ATOM 1929 N LEU A 123 16.074 3.001 -10.805 1.00 0.00 N ATOM 1930 CA LEU A 123 16.464 2.803 -9.411 1.00 0.00 C ATOM 1931 C LEU A 123 16.955 4.099 -8.747 1.00 0.00 C ATOM 1932 O LEU A 123 16.937 4.196 -7.522 1.00 0.00 O ATOM 1933 CB LEU A 123 17.518 1.673 -9.385 1.00 0.00 C ATOM 1934 CG LEU A 123 17.822 0.924 -8.076 1.00 0.00 C ATOM 1935 CD1 LEU A 123 18.941 1.588 -7.280 1.00 0.00 C ATOM 1936 CD2 LEU A 123 16.592 0.629 -7.212 1.00 0.00 C ATOM 0 H LEU A 123 16.781 2.665 -11.459 1.00 0.00 H new ATOM 0 HA LEU A 123 15.599 2.511 -8.816 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.210 0.928 -10.119 1.00 0.00 H new ATOM 0 HB3 LEU A 123 18.457 2.100 -9.738 1.00 0.00 H new ATOM 0 HG LEU A 123 18.181 -0.056 -8.392 1.00 0.00 H new ATOM 0 HD11 LEU A 123 19.120 1.024 -6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 123 19.852 1.607 -7.879 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.652 2.608 -7.027 1.00 0.00 H new ATOM 0 HD21 LEU A 123 16.899 0.099 -6.310 1.00 0.00 H new ATOM 0 HD22 LEU A 123 16.108 1.566 -6.936 1.00 0.00 H new ATOM 0 HD23 LEU A 123 15.892 0.012 -7.775 1.00 0.00 H new ATOM 1948 N GLU A 124 17.424 5.078 -9.524 1.00 0.00 N ATOM 1949 CA GLU A 124 18.002 6.322 -9.014 1.00 0.00 C ATOM 1950 C GLU A 124 17.027 7.205 -8.217 1.00 0.00 C ATOM 1951 O GLU A 124 16.022 7.688 -8.744 1.00 0.00 O ATOM 1952 CB GLU A 124 18.551 7.167 -10.179 1.00 0.00 C ATOM 1953 CG GLU A 124 19.613 6.493 -11.063 1.00 0.00 C ATOM 1954 CD GLU A 124 20.857 5.979 -10.324 1.00 0.00 C ATOM 1955 OE1 GLU A 124 21.070 6.396 -9.165 1.00 0.00 O ATOM 1956 OE2 GLU A 124 21.609 5.204 -10.959 1.00 0.00 O ATOM 0 H GLU A 124 17.412 5.027 -10.543 1.00 0.00 H new ATOM 0 HA GLU A 124 18.788 6.004 -8.329 1.00 0.00 H new ATOM 0 HB2 GLU A 124 17.715 7.462 -10.813 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.978 8.082 -9.768 1.00 0.00 H new ATOM 0 HG2 GLU A 124 19.149 5.655 -11.584 1.00 0.00 H new ATOM 0 HG3 GLU A 124 19.932 7.205 -11.824 1.00 0.00 H new ATOM 1963 N GLU A 125 17.393 7.530 -6.972 1.00 0.00 N ATOM 1964 CA GLU A 125 16.671 8.433 -6.074 1.00 0.00 C ATOM 1965 C GLU A 125 16.239 9.800 -6.583 1.00 0.00 C ATOM 1966 O GLU A 125 15.300 10.374 -6.018 1.00 0.00 O ATOM 1967 CB GLU A 125 17.458 8.657 -4.771 1.00 0.00 C ATOM 1968 CG GLU A 125 17.307 7.584 -3.692 1.00 0.00 C ATOM 1969 CD GLU A 125 16.187 7.961 -2.701 1.00 0.00 C ATOM 1970 OE1 GLU A 125 15.692 9.116 -2.718 1.00 0.00 O ATOM 1971 OE2 GLU A 125 15.819 7.117 -1.851 1.00 0.00 O ATOM 0 H GLU A 125 18.239 7.153 -6.545 1.00 0.00 H new ATOM 0 HA GLU A 125 15.740 7.881 -5.943 1.00 0.00 H new ATOM 0 HB2 GLU A 125 18.515 8.743 -5.021 1.00 0.00 H new ATOM 0 HB3 GLU A 125 17.152 9.613 -4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 125 17.081 6.624 -4.156 1.00 0.00 H new ATOM 0 HG3 GLU A 125 18.249 7.465 -3.156 1.00 0.00 H new ATOM 1978 N ASP A 126 16.910 10.365 -7.584 1.00 0.00 N ATOM 1979 CA ASP A 126 16.574 11.706 -8.013 1.00 0.00 C ATOM 1980 C ASP A 126 15.166 11.820 -8.567 1.00 0.00 C ATOM 1981 O ASP A 126 14.378 12.624 -8.056 1.00 0.00 O ATOM 1982 CB ASP A 126 17.603 12.298 -8.970 1.00 0.00 C ATOM 1983 CG ASP A 126 17.243 13.767 -9.163 1.00 0.00 C ATOM 1984 OD1 ASP A 126 17.346 14.532 -8.179 1.00 0.00 O ATOM 1985 OD2 ASP A 126 16.761 14.147 -10.257 1.00 0.00 O ATOM 0 H ASP A 126 17.671 9.922 -8.099 1.00 0.00 H new ATOM 0 HA ASP A 126 16.601 12.309 -7.106 1.00 0.00 H new ATOM 0 HB2 ASP A 126 18.609 12.198 -8.563 1.00 0.00 H new ATOM 0 HB3 ASP A 126 17.591 11.770 -9.923 1.00 0.00 H new ATOM 1990 N PHE A 127 14.815 11.029 -9.587 1.00 0.00 N ATOM 1991 CA PHE A 127 13.476 11.179 -10.139 1.00 0.00 C ATOM 1992 C PHE A 127 12.473 10.477 -9.221 1.00 0.00 C ATOM 1993 O PHE A 127 11.320 10.897 -9.193 1.00 0.00 O ATOM 1994 CB PHE A 127 13.341 10.633 -11.562 1.00 0.00 C ATOM 1995 CG PHE A 127 13.132 9.141 -11.603 1.00 0.00 C ATOM 1996 CD1 PHE A 127 14.194 8.249 -11.387 1.00 0.00 C ATOM 1997 CD2 PHE A 127 11.810 8.662 -11.697 1.00 0.00 C ATOM 1998 CE1 PHE A 127 13.921 6.879 -11.291 1.00 0.00 C ATOM 1999 CE2 PHE A 127 11.542 7.290 -11.610 1.00 0.00 C ATOM 2000 CZ PHE A 127 12.602 6.398 -11.405 1.00 0.00 C ATOM 0 H PHE A 127 15.404 10.319 -10.023 1.00 0.00 H new ATOM 0 HA PHE A 127 13.271 12.248 -10.196 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.503 11.125 -12.056 1.00 0.00 H new ATOM 0 HB3 PHE A 127 14.238 10.884 -12.128 1.00 0.00 H new ATOM 0 HD1 PHE A 127 15.206 8.614 -11.296 1.00 0.00 H new ATOM 0 HD2 PHE A 127 10.997 9.359 -11.837 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.731 6.183 -11.128 1.00 0.00 H new ATOM 0 HE2 PHE A 127 10.530 6.924 -11.700 1.00 0.00 H new ATOM 0 HZ PHE A 127 12.408 5.338 -11.334 1.00 0.00 H new ATOM 2010 N ILE A 128 12.900 9.458 -8.457 1.00 0.00 N ATOM 2011 CA ILE A 128 12.057 8.690 -7.535 1.00 0.00 C ATOM 2012 C ILE A 128 11.334 9.657 -6.604 1.00 0.00 C ATOM 2013 O ILE A 128 10.147 9.483 -6.350 1.00 0.00 O ATOM 2014 CB ILE A 128 12.886 7.625 -6.773 1.00 0.00 C ATOM 2015 CG1 ILE A 128 13.146 6.422 -7.704 1.00 0.00 C ATOM 2016 CG2 ILE A 128 12.233 7.161 -5.454 1.00 0.00 C ATOM 2017 CD1 ILE A 128 13.960 5.284 -7.081 1.00 0.00 C ATOM 0 H ILE A 128 13.869 9.139 -8.466 1.00 0.00 H new ATOM 0 HA ILE A 128 11.306 8.133 -8.095 1.00 0.00 H new ATOM 0 HB ILE A 128 13.827 8.094 -6.487 1.00 0.00 H new ATOM 0 HG12 ILE A 128 12.187 6.024 -8.034 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.667 6.776 -8.593 1.00 0.00 H new ATOM 0 HG21 ILE A 128 12.869 6.416 -4.976 1.00 0.00 H new ATOM 0 HG22 ILE A 128 12.111 8.015 -4.788 1.00 0.00 H new ATOM 0 HG23 ILE A 128 11.257 6.723 -5.665 1.00 0.00 H new ATOM 0 HD11 ILE A 128 14.089 4.486 -7.812 1.00 0.00 H new ATOM 0 HD12 ILE A 128 14.937 5.660 -6.777 1.00 0.00 H new ATOM 0 HD13 ILE A 128 13.434 4.895 -6.209 1.00 0.00 H new ATOM 2029 N LYS A 129 12.013 10.704 -6.131 1.00 0.00 N ATOM 2030 CA LYS A 129 11.397 11.734 -5.304 1.00 0.00 C ATOM 2031 C LYS A 129 10.175 12.346 -5.980 1.00 0.00 C ATOM 2032 O LYS A 129 9.133 12.474 -5.339 1.00 0.00 O ATOM 2033 CB LYS A 129 12.449 12.803 -4.986 1.00 0.00 C ATOM 2034 CG LYS A 129 13.367 12.385 -3.837 1.00 0.00 C ATOM 2035 CD LYS A 129 14.451 13.446 -3.609 1.00 0.00 C ATOM 2036 CE LYS A 129 15.651 12.846 -2.875 1.00 0.00 C ATOM 2037 NZ LYS A 129 16.401 11.924 -3.750 1.00 0.00 N ATOM 0 H LYS A 129 13.005 10.858 -6.312 1.00 0.00 H new ATOM 0 HA LYS A 129 11.043 11.282 -4.378 1.00 0.00 H new ATOM 0 HB2 LYS A 129 13.048 12.997 -5.876 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.949 13.737 -4.729 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.783 12.250 -2.927 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.830 11.425 -4.064 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.772 13.856 -4.566 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.041 14.273 -3.030 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.309 13.645 -2.534 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.309 12.313 -1.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.629 11.056 -3.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.822 11.685 -4.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.281 12.381 -4.062 1.00 0.00 H new ATOM 2051 N SER A 130 10.293 12.757 -7.239 1.00 0.00 N ATOM 2052 CA SER A 130 9.192 13.332 -7.991 1.00 0.00 C ATOM 2053 C SER A 130 8.157 12.268 -8.367 1.00 0.00 C ATOM 2054 O SER A 130 6.964 12.560 -8.333 1.00 0.00 O ATOM 2055 CB SER A 130 9.751 14.047 -9.216 1.00 0.00 C ATOM 2056 OG SER A 130 8.741 14.690 -9.968 1.00 0.00 O ATOM 0 H SER A 130 11.164 12.698 -7.767 1.00 0.00 H new ATOM 0 HA SER A 130 8.667 14.059 -7.370 1.00 0.00 H new ATOM 0 HB2 SER A 130 10.490 14.783 -8.899 1.00 0.00 H new ATOM 0 HB3 SER A 130 10.270 13.327 -9.849 1.00 0.00 H new ATOM 0 HG SER A 130 9.144 15.136 -10.742 1.00 0.00 H new ATOM 2062 N GLU A 131 8.565 11.040 -8.684 1.00 0.00 N ATOM 2063 CA GLU A 131 7.640 9.950 -8.973 1.00 0.00 C ATOM 2064 C GLU A 131 6.767 9.713 -7.743 1.00 0.00 C ATOM 2065 O GLU A 131 5.546 9.656 -7.857 1.00 0.00 O ATOM 2066 CB GLU A 131 8.428 8.703 -9.399 1.00 0.00 C ATOM 2067 CG GLU A 131 7.570 7.450 -9.651 1.00 0.00 C ATOM 2068 CD GLU A 131 6.358 7.677 -10.555 1.00 0.00 C ATOM 2069 OE1 GLU A 131 6.454 8.473 -11.514 1.00 0.00 O ATOM 2070 OE2 GLU A 131 5.300 7.039 -10.341 1.00 0.00 O ATOM 0 H GLU A 131 9.548 10.775 -8.747 1.00 0.00 H new ATOM 0 HA GLU A 131 6.981 10.202 -9.804 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.983 8.935 -10.308 1.00 0.00 H new ATOM 0 HB3 GLU A 131 9.162 8.474 -8.627 1.00 0.00 H new ATOM 0 HG2 GLU A 131 8.199 6.679 -10.096 1.00 0.00 H new ATOM 0 HG3 GLU A 131 7.224 7.064 -8.692 1.00 0.00 H new ATOM 2077 N LEU A 132 7.373 9.661 -6.555 1.00 0.00 N ATOM 2078 CA LEU A 132 6.666 9.529 -5.289 1.00 0.00 C ATOM 2079 C LEU A 132 5.834 10.775 -4.998 1.00 0.00 C ATOM 2080 O LEU A 132 4.879 10.672 -4.239 1.00 0.00 O ATOM 2081 CB LEU A 132 7.636 9.175 -4.152 1.00 0.00 C ATOM 2082 CG LEU A 132 8.127 7.714 -4.258 1.00 0.00 C ATOM 2083 CD1 LEU A 132 9.292 7.487 -3.302 1.00 0.00 C ATOM 2084 CD2 LEU A 132 7.023 6.692 -3.945 1.00 0.00 C ATOM 0 H LEU A 132 8.386 9.711 -6.449 1.00 0.00 H new ATOM 0 HA LEU A 132 5.964 8.699 -5.364 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.491 9.850 -4.179 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.142 9.325 -3.192 1.00 0.00 H new ATOM 0 HG LEU A 132 8.439 7.563 -5.291 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.633 6.455 -3.382 1.00 0.00 H new ATOM 0 HD12 LEU A 132 10.110 8.160 -3.559 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.968 7.683 -2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 132 7.425 5.683 -4.035 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.660 6.848 -2.929 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.200 6.819 -4.648 1.00 0.00 H new ATOM 2096 N LYS A 133 6.158 11.951 -5.551 1.00 0.00 N ATOM 2097 CA LYS A 133 5.327 13.145 -5.382 1.00 0.00 C ATOM 2098 C LYS A 133 4.077 12.949 -6.236 1.00 0.00 C ATOM 2099 O LYS A 133 2.970 13.180 -5.754 1.00 0.00 O ATOM 2100 CB LYS A 133 6.063 14.440 -5.785 1.00 0.00 C ATOM 2101 CG LYS A 133 7.073 14.902 -4.728 1.00 0.00 C ATOM 2102 CD LYS A 133 6.797 16.324 -4.225 1.00 0.00 C ATOM 2103 CE LYS A 133 7.798 16.643 -3.113 1.00 0.00 C ATOM 2104 NZ LYS A 133 7.590 17.980 -2.533 1.00 0.00 N ATOM 0 H LYS A 133 6.992 12.099 -6.120 1.00 0.00 H new ATOM 0 HA LYS A 133 5.073 13.263 -4.329 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.581 14.279 -6.730 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.332 15.231 -5.953 1.00 0.00 H new ATOM 0 HG2 LYS A 133 7.050 14.212 -3.884 1.00 0.00 H new ATOM 0 HG3 LYS A 133 8.078 14.859 -5.148 1.00 0.00 H new ATOM 0 HD2 LYS A 133 6.894 17.041 -5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.776 16.403 -3.851 1.00 0.00 H new ATOM 0 HE2 LYS A 133 7.714 15.893 -2.327 1.00 0.00 H new ATOM 0 HE3 LYS A 133 8.811 16.577 -3.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 8.293 18.147 -1.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 7.696 18.701 -3.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.634 18.038 -2.128 1.00 0.00 H new ATOM 2118 N LYS A 134 4.218 12.538 -7.500 1.00 0.00 N ATOM 2119 CA LYS A 134 3.094 12.302 -8.408 1.00 0.00 C ATOM 2120 C LYS A 134 2.212 11.196 -7.832 1.00 0.00 C ATOM 2121 O LYS A 134 1.058 11.446 -7.472 1.00 0.00 O ATOM 2122 CB LYS A 134 3.604 11.958 -9.817 1.00 0.00 C ATOM 2123 CG LYS A 134 4.453 13.073 -10.458 1.00 0.00 C ATOM 2124 CD LYS A 134 4.085 13.372 -11.917 1.00 0.00 C ATOM 2125 CE LYS A 134 2.984 14.432 -12.059 1.00 0.00 C ATOM 2126 NZ LYS A 134 1.663 13.988 -11.570 1.00 0.00 N ATOM 0 H LYS A 134 5.127 12.358 -7.925 1.00 0.00 H new ATOM 0 HA LYS A 134 2.494 13.207 -8.501 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.198 11.045 -9.766 1.00 0.00 H new ATOM 0 HB3 LYS A 134 2.750 11.748 -10.461 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.341 13.985 -9.871 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.504 12.789 -10.409 1.00 0.00 H new ATOM 0 HD2 LYS A 134 4.975 13.709 -12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 134 3.757 12.451 -12.398 1.00 0.00 H new ATOM 0 HE2 LYS A 134 3.281 15.327 -11.512 1.00 0.00 H new ATOM 0 HE3 LYS A 134 2.897 14.714 -13.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 0.967 14.747 -11.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 1.365 13.141 -12.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 1.726 13.762 -10.557 1.00 0.00 H new ATOM 2140 N ALA A 135 2.775 10.002 -7.655 1.00 0.00 N ATOM 2141 CA ALA A 135 2.125 8.853 -7.041 1.00 0.00 C ATOM 2142 C ALA A 135 1.828 9.084 -5.549 1.00 0.00 C ATOM 2143 O ALA A 135 1.311 8.180 -4.901 1.00 0.00 O ATOM 2144 CB ALA A 135 3.010 7.612 -7.228 1.00 0.00 C ATOM 0 H ALA A 135 3.732 9.804 -7.947 1.00 0.00 H new ATOM 0 HA ALA A 135 1.165 8.701 -7.534 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.528 6.749 -6.770 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.154 7.425 -8.292 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.977 7.780 -6.755 1.00 0.00 H new ATOM 2150 N GLY A 136 2.152 10.258 -4.997 1.00 0.00 N ATOM 2151 CA GLY A 136 1.972 10.688 -3.620 1.00 0.00 C ATOM 2152 C GLY A 136 0.662 10.201 -3.042 1.00 0.00 C ATOM 2153 O GLY A 136 -0.401 10.683 -3.441 1.00 0.00 O ATOM 0 H GLY A 136 2.585 10.991 -5.559 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.797 10.315 -3.013 1.00 0.00 H new ATOM 0 HA3 GLY A 136 2.007 11.776 -3.572 1.00 0.00 H new ATOM 2157 N GLY A 137 0.747 9.208 -2.157 1.00 0.00 N ATOM 2158 CA GLY A 137 -0.393 8.678 -1.442 1.00 0.00 C ATOM 2159 C GLY A 137 -0.886 9.784 -0.528 1.00 0.00 C ATOM 2160 O GLY A 137 -0.244 10.055 0.494 1.00 0.00 O ATOM 0 H GLY A 137 1.626 8.749 -1.920 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.176 8.371 -2.135 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.113 7.796 -0.866 1.00 0.00 H new ATOM 2164 N ALA A 138 -1.974 10.449 -0.923 1.00 0.00 N ATOM 2165 CA ALA A 138 -2.551 11.542 -0.162 1.00 0.00 C ATOM 2166 C ALA A 138 -2.811 11.052 1.260 1.00 0.00 C ATOM 2167 O ALA A 138 -3.113 9.875 1.478 1.00 0.00 O ATOM 2168 CB ALA A 138 -3.837 12.024 -0.833 1.00 0.00 C ATOM 0 H ALA A 138 -2.477 10.238 -1.785 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.866 12.389 -0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -4.263 12.844 -0.255 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -3.613 12.369 -1.843 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -4.553 11.203 -0.880 1.00 0.00 H new ATOM 2174 N ASN A 139 -2.636 11.931 2.238 1.00 0.00 N ATOM 2175 CA ASN A 139 -2.767 11.580 3.641 1.00 0.00 C ATOM 2176 C ASN A 139 -3.377 12.777 4.337 1.00 0.00 C ATOM 2177 O ASN A 139 -2.800 13.864 4.266 1.00 0.00 O ATOM 2178 CB ASN A 139 -1.389 11.229 4.224 1.00 0.00 C ATOM 2179 CG ASN A 139 -1.504 10.478 5.543 1.00 0.00 C ATOM 2180 OD1 ASN A 139 -1.212 9.288 5.588 1.00 0.00 O ATOM 2181 ND2 ASN A 139 -1.886 11.131 6.628 1.00 0.00 N ATOM 0 H ASN A 139 -2.399 12.910 2.077 1.00 0.00 H new ATOM 0 HA ASN A 139 -3.402 10.705 3.779 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -0.836 10.621 3.508 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -0.816 12.144 4.376 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -1.942 10.645 7.523 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -2.125 12.121 6.570 1.00 0.00 H new ATOM 2188 N TYR A 140 -4.511 12.594 5.001 1.00 0.00 N ATOM 2189 CA TYR A 140 -5.209 13.630 5.740 1.00 0.00 C ATOM 2190 C TYR A 140 -5.586 12.993 7.058 1.00 0.00 C ATOM 2191 O TYR A 140 -6.521 12.193 7.146 1.00 0.00 O ATOM 2192 CB TYR A 140 -6.396 14.174 4.943 1.00 0.00 C ATOM 2193 CG TYR A 140 -5.933 14.960 3.734 1.00 0.00 C ATOM 2194 CD1 TYR A 140 -5.402 16.253 3.904 1.00 0.00 C ATOM 2195 CD2 TYR A 140 -5.984 14.388 2.450 1.00 0.00 C ATOM 2196 CE1 TYR A 140 -4.930 16.977 2.798 1.00 0.00 C ATOM 2197 CE2 TYR A 140 -5.525 15.111 1.337 1.00 0.00 C ATOM 2198 CZ TYR A 140 -4.995 16.407 1.508 1.00 0.00 C ATOM 2199 OH TYR A 140 -4.581 17.101 0.418 1.00 0.00 O ATOM 0 H TYR A 140 -4.983 11.690 5.039 1.00 0.00 H new ATOM 0 HA TYR A 140 -4.593 14.512 5.919 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -7.030 13.348 4.621 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -7.005 14.812 5.583 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -5.358 16.690 4.891 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -6.377 13.391 2.320 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -4.519 17.966 2.933 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -5.578 14.675 0.350 1.00 0.00 H new ATOM 0 HH TYR A 140 -4.698 16.551 -0.384 1.00 0.00 H new ATOM 2209 N ASP A 141 -4.747 13.252 8.054 1.00 0.00 N ATOM 2210 CA ASP A 141 -4.872 12.674 9.376 1.00 0.00 C ATOM 2211 C ASP A 141 -4.382 13.703 10.382 1.00 0.00 C ATOM 2212 O ASP A 141 -3.181 13.792 10.656 1.00 0.00 O ATOM 2213 CB ASP A 141 -4.088 11.356 9.421 1.00 0.00 C ATOM 2214 CG ASP A 141 -4.479 10.504 10.619 1.00 0.00 C ATOM 2215 OD1 ASP A 141 -5.627 10.596 11.107 1.00 0.00 O ATOM 2216 OD2 ASP A 141 -3.686 9.614 10.982 1.00 0.00 O ATOM 0 H ASP A 141 -3.949 13.881 7.959 1.00 0.00 H new ATOM 0 HA ASP A 141 -5.905 12.430 9.625 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -4.267 10.796 8.503 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -3.020 11.570 9.461 1.00 0.00 H new ATOM 2221 N ALA A 142 -5.300 14.558 10.830 1.00 0.00 N ATOM 2222 CA ALA A 142 -5.029 15.670 11.725 1.00 0.00 C ATOM 2223 C ALA A 142 -5.433 15.308 13.154 1.00 0.00 C ATOM 2224 O ALA A 142 -6.612 15.396 13.505 1.00 0.00 O ATOM 2225 CB ALA A 142 -5.742 16.929 11.219 1.00 0.00 C ATOM 0 H ALA A 142 -6.283 14.489 10.568 1.00 0.00 H new ATOM 0 HA ALA A 142 -3.960 15.881 11.738 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -5.536 17.760 11.894 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -5.382 17.175 10.220 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -6.816 16.749 11.183 1.00 0.00 H new ATOM 2231 N GLN A 143 -4.477 14.835 13.955 1.00 0.00 N ATOM 2232 CA GLN A 143 -4.650 14.519 15.367 1.00 0.00 C ATOM 2233 C GLN A 143 -3.316 14.761 16.086 1.00 0.00 C ATOM 2234 O GLN A 143 -2.616 13.808 16.429 1.00 0.00 O ATOM 2235 CB GLN A 143 -5.158 13.075 15.586 1.00 0.00 C ATOM 2236 CG GLN A 143 -6.617 12.856 15.160 1.00 0.00 C ATOM 2237 CD GLN A 143 -7.227 11.593 15.764 1.00 0.00 C ATOM 2238 OE1 GLN A 143 -8.311 11.623 16.336 1.00 0.00 O ATOM 2239 NE2 GLN A 143 -6.589 10.445 15.629 1.00 0.00 N ATOM 0 H GLN A 143 -3.529 14.656 13.623 1.00 0.00 H new ATOM 0 HA GLN A 143 -5.418 15.170 15.785 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -4.521 12.388 15.029 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -5.056 12.821 16.641 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -7.211 13.720 15.459 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -6.668 12.794 14.073 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.687 10.416 15.154 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -6.998 9.587 16.000 1.00 0.00 H new ATOM 2248 N THR A 144 -2.990 16.028 16.353 1.00 0.00 N ATOM 2249 CA THR A 144 -1.744 16.447 17.006 1.00 0.00 C ATOM 2250 C THR A 144 -0.542 16.008 16.156 1.00 0.00 C ATOM 2251 O THR A 144 0.326 15.250 16.591 1.00 0.00 O ATOM 2252 CB THR A 144 -1.705 15.988 18.481 1.00 0.00 C ATOM 2253 OG1 THR A 144 -2.962 16.207 19.098 1.00 0.00 O ATOM 2254 CG2 THR A 144 -0.662 16.751 19.305 1.00 0.00 C ATOM 0 H THR A 144 -3.599 16.811 16.116 1.00 0.00 H new ATOM 0 HA THR A 144 -1.692 17.534 17.061 1.00 0.00 H new ATOM 0 HB THR A 144 -1.447 14.929 18.460 1.00 0.00 H new ATOM 0 HG1 THR A 144 -2.924 15.910 20.031 1.00 0.00 H new ATOM 0 HG21 THR A 144 -0.676 16.390 20.333 1.00 0.00 H new ATOM 0 HG22 THR A 144 0.328 16.591 18.877 1.00 0.00 H new ATOM 0 HG23 THR A 144 -0.895 17.816 19.291 1.00 0.00 H new ATOM 2262 N GLU A 145 -0.556 16.444 14.899 1.00 0.00 N ATOM 2263 CA GLU A 145 0.473 16.199 13.902 1.00 0.00 C ATOM 2264 C GLU A 145 1.818 16.676 14.421 1.00 0.00 C ATOM 2265 O GLU A 145 2.815 15.928 14.279 1.00 0.00 O ATOM 2266 CB GLU A 145 0.101 16.901 12.580 1.00 0.00 C ATOM 2267 CG GLU A 145 -1.322 16.577 12.091 1.00 0.00 C ATOM 2268 CD GLU A 145 -2.378 17.581 12.580 1.00 0.00 C ATOM 2269 OE1 GLU A 145 -2.894 17.412 13.710 1.00 0.00 O ATOM 2270 OE2 GLU A 145 -2.746 18.471 11.778 1.00 0.00 O ATOM 2271 OXT GLU A 145 1.906 17.836 14.874 1.00 0.00 O ATOM 0 H GLU A 145 -1.325 17.005 14.534 1.00 0.00 H new ATOM 0 HA GLU A 145 0.545 15.129 13.707 1.00 0.00 H new ATOM 0 HB2 GLU A 145 0.195 17.979 12.712 1.00 0.00 H new ATOM 0 HB3 GLU A 145 0.816 16.611 11.810 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -1.328 16.556 11.001 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -1.596 15.578 12.430 1.00 0.00 H new TER 2278 GLU A 145