USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 600 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 21 THR OG1 : rot 104:sc= 0.0275 USER MOD Set 1.2: A 49 MET CE :methyl -160:sc= 0 (180deg=-0.323) USER MOD Set 2.1: A 6 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 70 GLN : amide:sc= -0.0104 X(o=-0.01,f=-0.048) USER MOD Single : A 3 GLN : amide:sc= 0.123 K(o=0.12,f=-7.2!) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -160:sc= -0.107 (180deg=-0.741) USER MOD Single : A 20 GLN : amide:sc= -2.55! K(o=-2.5!,f=-0.27) USER MOD Single : A 22 CYS SG : rot 151:sc= -1.32 USER MOD Single : A 25 HIS : no HD1:sc= -2.11! C(o=-2.1!,f=-4.6!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -109:sc= -2.8! (180deg=-5.59!) USER MOD Single : A 52 LYS NZ :NH3+ 161:sc= -0.111 (180deg=-0.691) USER MOD Single : A 53 GLN : amide:sc= -7.65! C(o=-7.6!,f=-4.5!) USER MOD Single : A 65 GLN : amide:sc= -2.74! K(o=-2.7!,f=-0.83) USER MOD Single : A 66 MET CE :methyl 153:sc= -0.338 (180deg=-2.49!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 161:sc= -0.216 (180deg=-0.78) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 48:sc= 0.464 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 31:sc= 0.447 USER MOD Single : A 105 LYS NZ :NH3+ 155:sc= -0.102 (180deg=-0.732) USER MOD ----------------------------------------------------------------- ATOM 10 N VAL A 2 -52.110 -31.737 60.021 1.00 0.00 N ATOM 11 CA VAL A 2 -51.873 -32.760 61.095 1.00 0.00 C ATOM 12 C VAL A 2 -52.730 -33.979 60.771 1.00 0.00 C ATOM 13 O VAL A 2 -53.783 -33.859 60.178 1.00 0.00 O ATOM 14 CB VAL A 2 -52.285 -32.167 62.456 1.00 0.00 C ATOM 15 CG1 VAL A 2 -53.789 -31.814 62.448 1.00 0.00 C ATOM 16 CG2 VAL A 2 -52.035 -33.189 63.586 1.00 0.00 C ATOM 0 HA VAL A 2 -50.822 -33.044 61.142 1.00 0.00 H new ATOM 0 HB VAL A 2 -51.689 -31.271 62.628 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -54.070 -31.396 63.415 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -53.987 -31.082 61.665 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -54.373 -32.715 62.259 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -52.331 -32.755 64.541 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -52.621 -34.089 63.399 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -50.976 -33.446 63.617 1.00 0.00 H new ATOM 26 N GLN A 3 -52.268 -35.136 61.167 1.00 0.00 N ATOM 27 CA GLN A 3 -53.024 -36.402 60.909 1.00 0.00 C ATOM 28 C GLN A 3 -53.265 -37.062 62.260 1.00 0.00 C ATOM 29 O GLN A 3 -52.546 -36.824 63.211 1.00 0.00 O ATOM 30 CB GLN A 3 -52.169 -37.293 60.004 1.00 0.00 C ATOM 31 CG GLN A 3 -52.819 -38.670 59.792 1.00 0.00 C ATOM 32 CD GLN A 3 -54.169 -38.548 59.073 1.00 0.00 C ATOM 33 OE1 GLN A 3 -55.146 -38.069 59.613 1.00 0.00 O ATOM 34 NE2 GLN A 3 -54.262 -38.974 57.843 1.00 0.00 N ATOM 0 H GLN A 3 -51.387 -35.261 61.665 1.00 0.00 H new ATOM 0 HA GLN A 3 -53.979 -36.223 60.415 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -52.027 -36.804 59.040 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -51.181 -37.420 60.446 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -52.151 -39.303 59.209 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -52.961 -39.159 60.756 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -53.448 -39.378 57.380 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -55.149 -38.903 57.344 1.00 0.00 H new ATOM 43 N VAL A 4 -54.278 -37.883 62.316 1.00 0.00 N ATOM 44 CA VAL A 4 -54.636 -38.604 63.582 1.00 0.00 C ATOM 45 C VAL A 4 -54.684 -40.100 63.277 1.00 0.00 C ATOM 46 O VAL A 4 -55.516 -40.558 62.519 1.00 0.00 O ATOM 47 CB VAL A 4 -56.009 -38.150 64.056 1.00 0.00 C ATOM 48 CG1 VAL A 4 -56.329 -38.786 65.417 1.00 0.00 C ATOM 49 CG2 VAL A 4 -56.021 -36.634 64.166 1.00 0.00 C ATOM 0 H VAL A 4 -54.887 -38.092 61.525 1.00 0.00 H new ATOM 0 HA VAL A 4 -53.900 -38.392 64.357 1.00 0.00 H new ATOM 0 HB VAL A 4 -56.768 -38.465 63.340 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -57.313 -38.457 65.750 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -56.323 -39.872 65.322 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -55.578 -38.482 66.146 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -57.002 -36.302 64.505 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -55.263 -36.315 64.881 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -55.807 -36.197 63.191 1.00 0.00 H new ATOM 59 N GLU A 5 -53.788 -40.829 63.878 1.00 0.00 N ATOM 60 CA GLU A 5 -53.721 -42.315 63.672 1.00 0.00 C ATOM 61 C GLU A 5 -54.044 -42.946 65.021 1.00 0.00 C ATOM 62 O GLU A 5 -53.170 -43.198 65.828 1.00 0.00 O ATOM 63 CB GLU A 5 -52.312 -42.699 63.218 1.00 0.00 C ATOM 64 CG GLU A 5 -52.014 -41.973 61.904 1.00 0.00 C ATOM 65 CD GLU A 5 -50.606 -42.347 61.438 1.00 0.00 C ATOM 66 OE1 GLU A 5 -49.692 -42.045 62.188 1.00 0.00 O ATOM 67 OE2 GLU A 5 -50.528 -42.914 60.360 1.00 0.00 O ATOM 0 H GLU A 5 -53.084 -40.458 64.516 1.00 0.00 H new ATOM 0 HA GLU A 5 -54.420 -42.656 62.909 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -51.580 -42.424 63.978 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -52.239 -43.778 63.081 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -52.747 -42.249 61.146 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -52.091 -40.895 62.044 1.00 0.00 H new ATOM 74 N THR A 6 -55.310 -43.189 65.231 1.00 0.00 N ATOM 75 CA THR A 6 -55.724 -43.798 66.524 1.00 0.00 C ATOM 76 C THR A 6 -55.278 -45.249 66.654 1.00 0.00 C ATOM 77 O THR A 6 -55.057 -45.946 65.684 1.00 0.00 O ATOM 78 CB THR A 6 -57.251 -43.706 66.628 1.00 0.00 C ATOM 79 OG1 THR A 6 -57.521 -42.315 66.553 1.00 0.00 O ATOM 80 CG2 THR A 6 -57.746 -44.106 68.022 1.00 0.00 C ATOM 0 H THR A 6 -56.064 -42.995 64.573 1.00 0.00 H new ATOM 0 HA THR A 6 -55.243 -43.251 67.335 1.00 0.00 H new ATOM 0 HB THR A 6 -57.714 -44.339 65.871 1.00 0.00 H new ATOM 0 HG1 THR A 6 -58.488 -42.166 66.611 1.00 0.00 H new ATOM 0 HG21 THR A 6 -58.833 -44.029 68.058 1.00 0.00 H new ATOM 0 HG22 THR A 6 -57.448 -45.133 68.233 1.00 0.00 H new ATOM 0 HG23 THR A 6 -57.310 -43.441 68.768 1.00 0.00 H new ATOM 88 N ILE A 7 -55.162 -45.653 67.892 1.00 0.00 N ATOM 89 CA ILE A 7 -54.735 -47.041 68.245 1.00 0.00 C ATOM 90 C ILE A 7 -55.827 -47.640 69.129 1.00 0.00 C ATOM 91 O ILE A 7 -56.319 -48.721 68.877 1.00 0.00 O ATOM 92 CB ILE A 7 -53.409 -46.991 69.019 1.00 0.00 C ATOM 93 CG1 ILE A 7 -52.362 -46.253 68.151 1.00 0.00 C ATOM 94 CG2 ILE A 7 -52.960 -48.455 69.246 1.00 0.00 C ATOM 95 CD1 ILE A 7 -51.156 -45.837 69.005 1.00 0.00 C ATOM 0 H ILE A 7 -55.352 -45.059 68.699 1.00 0.00 H new ATOM 0 HA ILE A 7 -54.589 -47.644 67.349 1.00 0.00 H new ATOM 0 HB ILE A 7 -53.516 -46.471 69.971 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -52.034 -46.900 67.337 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -52.814 -45.372 67.695 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -52.018 -48.466 69.795 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -53.721 -48.984 69.820 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -52.825 -48.948 68.283 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -50.429 -45.319 68.380 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -51.487 -45.172 69.803 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -50.695 -46.724 69.440 1.00 0.00 H new ATOM 107 N SER A 8 -56.181 -46.911 70.159 1.00 0.00 N ATOM 108 CA SER A 8 -57.244 -47.381 71.116 1.00 0.00 C ATOM 109 C SER A 8 -58.411 -46.391 71.221 1.00 0.00 C ATOM 110 O SER A 8 -58.467 -45.621 72.157 1.00 0.00 O ATOM 111 CB SER A 8 -56.621 -47.562 72.497 1.00 0.00 C ATOM 112 OG SER A 8 -57.707 -48.012 73.292 1.00 0.00 O ATOM 0 H SER A 8 -55.778 -46.001 70.384 1.00 0.00 H new ATOM 0 HA SER A 8 -57.641 -48.323 70.737 1.00 0.00 H new ATOM 0 HB2 SER A 8 -55.808 -48.288 72.479 1.00 0.00 H new ATOM 0 HB3 SER A 8 -56.206 -46.628 72.876 1.00 0.00 H new ATOM 0 HG SER A 8 -57.400 -48.160 74.211 1.00 0.00 H new ATOM 118 N PRO A 9 -59.312 -46.423 70.272 1.00 0.00 N ATOM 119 CA PRO A 9 -60.496 -45.531 70.272 1.00 0.00 C ATOM 120 C PRO A 9 -61.067 -45.302 71.675 1.00 0.00 C ATOM 121 O PRO A 9 -60.760 -46.015 72.610 1.00 0.00 O ATOM 122 CB PRO A 9 -61.442 -46.229 69.304 1.00 0.00 C ATOM 123 CG PRO A 9 -60.448 -46.748 68.236 1.00 0.00 C ATOM 124 CD PRO A 9 -59.304 -47.331 69.093 1.00 0.00 C ATOM 0 HA PRO A 9 -60.277 -44.510 69.958 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -61.995 -47.039 69.780 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -62.179 -45.545 68.883 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -60.900 -47.505 67.595 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -60.098 -45.947 67.585 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -59.491 -48.367 69.374 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -58.349 -47.311 68.568 1.00 0.00 H new ATOM 132 N GLY A 10 -61.894 -44.296 71.773 1.00 0.00 N ATOM 133 CA GLY A 10 -62.549 -43.930 73.070 1.00 0.00 C ATOM 134 C GLY A 10 -64.049 -43.961 72.796 1.00 0.00 C ATOM 135 O GLY A 10 -64.459 -44.441 71.758 1.00 0.00 O ATOM 0 H GLY A 10 -62.151 -43.695 70.990 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -62.280 -44.634 73.857 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -62.232 -42.942 73.404 1.00 0.00 H new ATOM 139 N ASP A 11 -64.834 -43.462 73.714 1.00 0.00 N ATOM 140 CA ASP A 11 -66.309 -43.460 73.504 1.00 0.00 C ATOM 141 C ASP A 11 -66.698 -43.129 72.055 1.00 0.00 C ATOM 142 O ASP A 11 -67.284 -43.937 71.362 1.00 0.00 O ATOM 143 CB ASP A 11 -66.932 -42.437 74.475 1.00 0.00 C ATOM 144 CG ASP A 11 -66.175 -41.102 74.447 1.00 0.00 C ATOM 145 OD1 ASP A 11 -65.116 -41.066 73.845 1.00 0.00 O ATOM 146 OD2 ASP A 11 -66.709 -40.183 75.046 1.00 0.00 O ATOM 0 H ASP A 11 -64.518 -43.058 74.596 1.00 0.00 H new ATOM 0 HA ASP A 11 -66.689 -44.462 73.701 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -67.976 -42.270 74.209 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -66.922 -42.841 75.487 1.00 0.00 H new ATOM 151 N GLY A 12 -66.358 -41.941 71.631 1.00 0.00 N ATOM 152 CA GLY A 12 -66.674 -41.484 70.241 1.00 0.00 C ATOM 153 C GLY A 12 -67.841 -40.517 70.377 1.00 0.00 C ATOM 154 O GLY A 12 -68.514 -40.174 69.426 1.00 0.00 O ATOM 0 H GLY A 12 -65.865 -41.253 72.199 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -65.813 -40.996 69.785 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -66.937 -42.327 69.603 1.00 0.00 H new ATOM 158 N ARG A 13 -68.033 -40.107 71.604 1.00 0.00 N ATOM 159 CA ARG A 13 -69.126 -39.158 71.974 1.00 0.00 C ATOM 160 C ARG A 13 -68.613 -37.928 72.728 1.00 0.00 C ATOM 161 O ARG A 13 -69.093 -36.839 72.487 1.00 0.00 O ATOM 162 CB ARG A 13 -70.128 -39.919 72.833 1.00 0.00 C ATOM 163 CG ARG A 13 -70.718 -41.047 71.980 1.00 0.00 C ATOM 164 CD ARG A 13 -71.620 -41.909 72.863 1.00 0.00 C ATOM 165 NE ARG A 13 -70.754 -42.576 73.892 1.00 0.00 N ATOM 166 CZ ARG A 13 -70.673 -43.881 73.972 1.00 0.00 C ATOM 167 NH1 ARG A 13 -71.775 -44.576 74.026 1.00 0.00 N ATOM 168 NH2 ARG A 13 -69.497 -44.447 73.994 1.00 0.00 N ATOM 0 H ARG A 13 -67.456 -40.402 72.392 1.00 0.00 H new ATOM 0 HA ARG A 13 -69.588 -38.784 71.060 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -69.640 -40.326 73.719 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -70.916 -39.252 73.181 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -71.288 -40.633 71.148 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -69.920 -41.652 71.550 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -72.382 -41.296 73.344 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -72.143 -42.654 72.263 1.00 0.00 H new ATOM 0 HE ARG A 13 -70.218 -42.001 74.542 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -72.678 -44.102 74.006 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -71.734 -45.593 74.089 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -68.654 -43.874 73.949 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -69.421 -45.462 74.056 1.00 0.00 H new ATOM 182 N THR A 14 -67.659 -38.089 73.619 1.00 0.00 N ATOM 183 CA THR A 14 -67.137 -36.899 74.382 1.00 0.00 C ATOM 184 C THR A 14 -65.734 -36.490 73.949 1.00 0.00 C ATOM 185 O THR A 14 -64.863 -37.311 73.745 1.00 0.00 O ATOM 186 CB THR A 14 -67.090 -37.240 75.851 1.00 0.00 C ATOM 187 OG1 THR A 14 -68.405 -37.669 76.171 1.00 0.00 O ATOM 188 CG2 THR A 14 -66.875 -35.986 76.709 1.00 0.00 C ATOM 0 H THR A 14 -67.222 -38.981 73.851 1.00 0.00 H new ATOM 0 HA THR A 14 -67.811 -36.067 74.178 1.00 0.00 H new ATOM 0 HB THR A 14 -66.294 -37.962 76.035 1.00 0.00 H new ATOM 0 HG1 THR A 14 -68.448 -37.911 77.120 1.00 0.00 H new ATOM 0 HG21 THR A 14 -66.846 -36.266 77.762 1.00 0.00 H new ATOM 0 HG22 THR A 14 -65.932 -35.514 76.433 1.00 0.00 H new ATOM 0 HG23 THR A 14 -67.694 -35.286 76.542 1.00 0.00 H new ATOM 196 N PHE A 15 -65.566 -35.198 73.823 1.00 0.00 N ATOM 197 CA PHE A 15 -64.260 -34.594 73.413 1.00 0.00 C ATOM 198 C PHE A 15 -63.965 -33.482 74.427 1.00 0.00 C ATOM 199 O PHE A 15 -64.786 -33.250 75.290 1.00 0.00 O ATOM 200 CB PHE A 15 -64.429 -34.026 72.025 1.00 0.00 C ATOM 201 CG PHE A 15 -64.942 -35.146 71.129 1.00 0.00 C ATOM 202 CD1 PHE A 15 -66.293 -35.423 71.074 1.00 0.00 C ATOM 203 CD2 PHE A 15 -64.062 -35.885 70.370 1.00 0.00 C ATOM 204 CE1 PHE A 15 -66.762 -36.435 70.261 1.00 0.00 C ATOM 205 CE2 PHE A 15 -64.527 -36.897 69.556 1.00 0.00 C ATOM 206 CZ PHE A 15 -65.878 -37.173 69.500 1.00 0.00 C ATOM 0 H PHE A 15 -66.304 -34.515 73.993 1.00 0.00 H new ATOM 0 HA PHE A 15 -63.442 -35.314 73.397 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -65.131 -33.192 72.035 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -63.481 -33.640 71.651 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -66.985 -34.846 71.669 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -63.004 -35.671 70.412 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -67.820 -36.649 70.220 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -63.833 -37.474 68.962 1.00 0.00 H new ATOM 0 HZ PHE A 15 -66.243 -37.965 68.862 1.00 0.00 H new ATOM 216 N PRO A 16 -62.843 -32.810 74.337 1.00 0.00 N ATOM 217 CA PRO A 16 -62.694 -31.506 75.032 1.00 0.00 C ATOM 218 C PRO A 16 -63.583 -30.452 74.355 1.00 0.00 C ATOM 219 O PRO A 16 -63.785 -30.491 73.158 1.00 0.00 O ATOM 220 CB PRO A 16 -61.194 -31.186 74.929 1.00 0.00 C ATOM 221 CG PRO A 16 -60.545 -32.546 74.553 1.00 0.00 C ATOM 222 CD PRO A 16 -61.592 -33.201 73.628 1.00 0.00 C ATOM 0 HA PRO A 16 -63.011 -31.523 76.075 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -60.999 -30.427 74.171 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -60.802 -30.803 75.871 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -59.591 -32.408 74.045 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -60.351 -33.156 75.435 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -61.551 -32.812 72.611 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -61.471 -34.282 73.561 1.00 0.00 H new ATOM 230 N LYS A 17 -64.100 -29.529 75.128 1.00 0.00 N ATOM 231 CA LYS A 17 -64.972 -28.454 74.595 1.00 0.00 C ATOM 232 C LYS A 17 -64.385 -27.082 74.929 1.00 0.00 C ATOM 233 O LYS A 17 -63.474 -26.945 75.723 1.00 0.00 O ATOM 234 CB LYS A 17 -66.303 -28.607 75.236 1.00 0.00 C ATOM 235 CG LYS A 17 -66.909 -29.952 74.836 1.00 0.00 C ATOM 236 CD LYS A 17 -68.280 -30.089 75.502 1.00 0.00 C ATOM 237 CE LYS A 17 -68.880 -31.439 75.108 1.00 0.00 C ATOM 238 NZ LYS A 17 -69.023 -31.519 73.627 1.00 0.00 N ATOM 0 H LYS A 17 -63.945 -29.481 76.135 1.00 0.00 H new ATOM 0 HA LYS A 17 -65.053 -28.529 73.511 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -66.206 -28.548 76.320 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -66.961 -27.794 74.930 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -67.007 -30.015 73.752 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -66.255 -30.768 75.145 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -68.183 -30.020 76.585 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -68.936 -29.277 75.188 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -68.242 -32.248 75.464 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -69.853 -31.567 75.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -69.717 -32.255 73.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -69.348 -30.602 73.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -68.104 -31.756 73.202 1.00 0.00 H new ATOM 252 N ARG A 18 -64.947 -26.083 74.305 1.00 0.00 N ATOM 253 CA ARG A 18 -64.480 -24.703 74.532 1.00 0.00 C ATOM 254 C ARG A 18 -64.933 -24.256 75.917 1.00 0.00 C ATOM 255 O ARG A 18 -66.095 -24.332 76.260 1.00 0.00 O ATOM 256 CB ARG A 18 -65.068 -23.798 73.429 1.00 0.00 C ATOM 257 CG ARG A 18 -66.599 -23.890 73.397 1.00 0.00 C ATOM 258 CD ARG A 18 -67.104 -23.081 72.199 1.00 0.00 C ATOM 259 NE ARG A 18 -68.602 -23.166 72.183 1.00 0.00 N ATOM 260 CZ ARG A 18 -69.348 -22.096 72.294 1.00 0.00 C ATOM 261 NH1 ARG A 18 -69.262 -21.169 71.380 1.00 0.00 N ATOM 262 NH2 ARG A 18 -70.153 -21.992 73.315 1.00 0.00 N ATOM 0 H ARG A 18 -65.717 -26.174 73.642 1.00 0.00 H new ATOM 0 HA ARG A 18 -63.393 -24.642 74.488 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -64.766 -22.765 73.603 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -64.663 -24.090 72.460 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -66.915 -24.930 73.314 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -67.022 -23.501 74.323 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -66.782 -22.043 72.277 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -66.690 -23.475 71.271 1.00 0.00 H new ATOM 0 HE ARG A 18 -69.049 -24.077 72.083 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -68.621 -21.285 70.595 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -69.836 -20.329 71.450 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -70.194 -22.737 74.010 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -70.742 -21.166 73.418 1.00 0.00 H new ATOM 276 N GLY A 19 -63.996 -23.798 76.705 1.00 0.00 N ATOM 277 CA GLY A 19 -64.332 -23.334 78.088 1.00 0.00 C ATOM 278 C GLY A 19 -63.727 -24.300 79.105 1.00 0.00 C ATOM 279 O GLY A 19 -63.559 -23.957 80.259 1.00 0.00 O ATOM 0 H GLY A 19 -63.011 -23.724 76.452 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -63.946 -22.328 78.250 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -65.413 -23.285 78.215 1.00 0.00 H new ATOM 283 N GLN A 20 -63.408 -25.497 78.669 1.00 0.00 N ATOM 284 CA GLN A 20 -62.809 -26.515 79.603 1.00 0.00 C ATOM 285 C GLN A 20 -61.334 -26.786 79.297 1.00 0.00 C ATOM 286 O GLN A 20 -60.773 -26.274 78.349 1.00 0.00 O ATOM 287 CB GLN A 20 -63.606 -27.809 79.474 1.00 0.00 C ATOM 288 CG GLN A 20 -65.063 -27.520 79.852 1.00 0.00 C ATOM 289 CD GLN A 20 -65.873 -28.813 79.750 1.00 0.00 C ATOM 290 OE1 GLN A 20 -67.063 -28.836 80.000 1.00 0.00 O ATOM 291 NE2 GLN A 20 -65.268 -29.909 79.387 1.00 0.00 N ATOM 0 H GLN A 20 -63.535 -25.816 77.709 1.00 0.00 H new ATOM 0 HA GLN A 20 -62.858 -26.123 80.619 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -63.547 -28.190 78.455 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -63.190 -28.577 80.126 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -65.117 -27.122 80.865 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -65.480 -26.762 79.189 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -64.270 -29.895 79.176 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -65.792 -30.781 79.314 1.00 0.00 H new ATOM 300 N THR A 21 -60.749 -27.607 80.126 1.00 0.00 N ATOM 301 CA THR A 21 -59.307 -27.979 79.978 1.00 0.00 C ATOM 302 C THR A 21 -59.244 -29.447 79.539 1.00 0.00 C ATOM 303 O THR A 21 -60.198 -30.184 79.699 1.00 0.00 O ATOM 304 CB THR A 21 -58.642 -27.793 81.332 1.00 0.00 C ATOM 305 OG1 THR A 21 -58.995 -26.467 81.700 1.00 0.00 O ATOM 306 CG2 THR A 21 -57.122 -27.726 81.234 1.00 0.00 C ATOM 0 H THR A 21 -61.218 -28.047 80.918 1.00 0.00 H new ATOM 0 HA THR A 21 -58.797 -27.362 79.238 1.00 0.00 H new ATOM 0 HB THR A 21 -58.938 -28.607 81.994 1.00 0.00 H new ATOM 0 HG1 THR A 21 -59.706 -26.493 82.374 1.00 0.00 H new ATOM 0 HG21 THR A 21 -56.699 -27.593 82.230 1.00 0.00 H new ATOM 0 HG22 THR A 21 -56.744 -28.652 80.800 1.00 0.00 H new ATOM 0 HG23 THR A 21 -56.835 -26.886 80.602 1.00 0.00 H new ATOM 314 N CYS A 22 -58.113 -29.818 79.008 1.00 0.00 N ATOM 315 CA CYS A 22 -57.882 -31.213 78.527 1.00 0.00 C ATOM 316 C CYS A 22 -56.852 -31.768 79.498 1.00 0.00 C ATOM 317 O CYS A 22 -56.009 -31.037 79.973 1.00 0.00 O ATOM 318 CB CYS A 22 -57.297 -31.184 77.112 1.00 0.00 C ATOM 319 SG CYS A 22 -58.192 -30.263 75.838 1.00 0.00 S ATOM 0 H CYS A 22 -57.315 -29.195 78.883 1.00 0.00 H new ATOM 0 HA CYS A 22 -58.795 -31.807 78.490 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -56.290 -30.772 77.176 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -57.198 -32.215 76.771 1.00 0.00 H new ATOM 0 HG CYS A 22 -57.351 -29.817 74.953 1.00 0.00 H new ATOM 325 N VAL A 23 -56.947 -33.039 79.768 1.00 0.00 N ATOM 326 CA VAL A 23 -55.997 -33.717 80.702 1.00 0.00 C ATOM 327 C VAL A 23 -55.435 -34.819 79.821 1.00 0.00 C ATOM 328 O VAL A 23 -56.081 -35.826 79.605 1.00 0.00 O ATOM 329 CB VAL A 23 -56.788 -34.256 81.883 1.00 0.00 C ATOM 330 CG1 VAL A 23 -55.813 -34.807 82.887 1.00 0.00 C ATOM 331 CG2 VAL A 23 -57.512 -33.071 82.522 1.00 0.00 C ATOM 0 H VAL A 23 -57.659 -33.653 79.373 1.00 0.00 H new ATOM 0 HA VAL A 23 -55.213 -33.092 81.129 1.00 0.00 H new ATOM 0 HB VAL A 23 -57.491 -35.028 81.571 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -56.358 -35.200 83.745 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -55.232 -35.607 82.429 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -55.142 -34.014 83.216 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -58.093 -33.418 83.377 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -56.781 -32.334 82.855 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -58.179 -32.615 81.791 1.00 0.00 H new ATOM 341 N VAL A 24 -54.238 -34.576 79.343 1.00 0.00 N ATOM 342 CA VAL A 24 -53.512 -35.525 78.437 1.00 0.00 C ATOM 343 C VAL A 24 -52.143 -35.966 78.954 1.00 0.00 C ATOM 344 O VAL A 24 -51.472 -35.243 79.659 1.00 0.00 O ATOM 345 CB VAL A 24 -53.284 -34.847 77.070 1.00 0.00 C ATOM 346 CG1 VAL A 24 -54.578 -34.189 76.598 1.00 0.00 C ATOM 347 CG2 VAL A 24 -52.205 -33.706 77.111 1.00 0.00 C ATOM 0 H VAL A 24 -53.715 -33.726 79.552 1.00 0.00 H new ATOM 0 HA VAL A 24 -54.144 -36.411 78.373 1.00 0.00 H new ATOM 0 HB VAL A 24 -52.943 -35.640 76.404 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -54.412 -33.711 75.632 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -55.356 -34.946 76.500 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -54.891 -33.439 77.325 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -52.095 -33.273 76.117 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -52.520 -32.932 77.811 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -51.250 -34.120 77.434 1.00 0.00 H new ATOM 357 N HIS A 25 -51.781 -37.161 78.565 1.00 0.00 N ATOM 358 CA HIS A 25 -50.464 -37.762 78.957 1.00 0.00 C ATOM 359 C HIS A 25 -49.892 -38.259 77.640 1.00 0.00 C ATOM 360 O HIS A 25 -50.426 -39.162 77.024 1.00 0.00 O ATOM 361 CB HIS A 25 -50.659 -38.935 79.930 1.00 0.00 C ATOM 362 CG HIS A 25 -49.366 -39.753 80.032 1.00 0.00 C ATOM 363 ND1 HIS A 25 -48.776 -40.340 79.043 1.00 0.00 N ATOM 364 CD2 HIS A 25 -48.570 -40.046 81.126 1.00 0.00 C ATOM 365 CE1 HIS A 25 -47.712 -40.944 79.465 1.00 0.00 C ATOM 366 NE2 HIS A 25 -47.545 -40.789 80.756 1.00 0.00 N ATOM 0 H HIS A 25 -52.357 -37.763 77.976 1.00 0.00 H new ATOM 0 HA HIS A 25 -49.815 -37.050 79.468 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -50.940 -38.559 80.914 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -51.475 -39.571 79.587 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -48.761 -39.714 82.136 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -47.043 -41.507 78.831 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -46.795 -41.158 81.340 1.00 0.00 H new ATOM 374 N TYR A 26 -48.813 -37.650 77.224 1.00 0.00 N ATOM 375 CA TYR A 26 -48.156 -38.044 75.938 1.00 0.00 C ATOM 376 C TYR A 26 -46.654 -38.257 76.062 1.00 0.00 C ATOM 377 O TYR A 26 -46.038 -38.063 77.090 1.00 0.00 O ATOM 378 CB TYR A 26 -48.408 -36.950 74.927 1.00 0.00 C ATOM 379 CG TYR A 26 -47.703 -35.684 75.412 1.00 0.00 C ATOM 380 CD1 TYR A 26 -48.325 -34.911 76.356 1.00 0.00 C ATOM 381 CD2 TYR A 26 -46.460 -35.309 74.934 1.00 0.00 C ATOM 382 CE1 TYR A 26 -47.729 -33.777 76.829 1.00 0.00 C ATOM 383 CE2 TYR A 26 -45.850 -34.164 75.407 1.00 0.00 C ATOM 384 CZ TYR A 26 -46.485 -33.386 76.364 1.00 0.00 C ATOM 385 OH TYR A 26 -45.887 -32.239 76.845 1.00 0.00 O ATOM 0 H TYR A 26 -48.353 -36.889 77.724 1.00 0.00 H new ATOM 0 HA TYR A 26 -48.585 -38.998 75.632 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -48.032 -37.243 73.947 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -49.478 -36.772 74.818 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -49.296 -35.201 76.730 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -45.965 -35.914 74.188 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -48.233 -33.179 77.574 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -44.879 -33.874 75.032 1.00 0.00 H new ATOM 0 HH TYR A 26 -45.017 -32.117 76.410 1.00 0.00 H new ATOM 395 N THR A 27 -46.140 -38.665 74.940 1.00 0.00 N ATOM 396 CA THR A 27 -44.695 -38.931 74.785 1.00 0.00 C ATOM 397 C THR A 27 -44.416 -38.358 73.399 1.00 0.00 C ATOM 398 O THR A 27 -45.029 -38.773 72.435 1.00 0.00 O ATOM 399 CB THR A 27 -44.452 -40.415 74.811 1.00 0.00 C ATOM 400 OG1 THR A 27 -44.927 -40.827 76.084 1.00 0.00 O ATOM 401 CG2 THR A 27 -42.948 -40.671 74.860 1.00 0.00 C ATOM 0 H THR A 27 -46.687 -38.830 74.095 1.00 0.00 H new ATOM 0 HA THR A 27 -44.066 -38.503 75.566 1.00 0.00 H new ATOM 0 HB THR A 27 -44.911 -40.911 73.956 1.00 0.00 H new ATOM 0 HG1 THR A 27 -44.805 -41.794 76.181 1.00 0.00 H new ATOM 0 HG21 THR A 27 -42.762 -41.745 74.879 1.00 0.00 H new ATOM 0 HG22 THR A 27 -42.476 -40.237 73.979 1.00 0.00 H new ATOM 0 HG23 THR A 27 -42.530 -40.214 75.757 1.00 0.00 H new ATOM 409 N GLY A 28 -43.516 -37.419 73.301 1.00 0.00 N ATOM 410 CA GLY A 28 -43.218 -36.832 71.955 1.00 0.00 C ATOM 411 C GLY A 28 -41.993 -37.515 71.364 1.00 0.00 C ATOM 412 O GLY A 28 -41.132 -37.987 72.078 1.00 0.00 O ATOM 0 H GLY A 28 -42.979 -37.035 74.078 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -44.074 -36.960 71.293 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -43.042 -35.760 72.045 1.00 0.00 H new ATOM 416 N MET A 29 -41.959 -37.549 70.060 1.00 0.00 N ATOM 417 CA MET A 29 -40.825 -38.180 69.334 1.00 0.00 C ATOM 418 C MET A 29 -40.624 -37.370 68.054 1.00 0.00 C ATOM 419 O MET A 29 -41.443 -36.540 67.712 1.00 0.00 O ATOM 420 CB MET A 29 -41.206 -39.635 69.035 1.00 0.00 C ATOM 421 CG MET A 29 -39.966 -40.421 68.597 1.00 0.00 C ATOM 422 SD MET A 29 -40.179 -42.196 68.306 1.00 0.00 S ATOM 423 CE MET A 29 -40.635 -42.098 66.557 1.00 0.00 C ATOM 0 H MET A 29 -42.684 -37.158 69.458 1.00 0.00 H new ATOM 0 HA MET A 29 -39.898 -38.186 69.908 1.00 0.00 H new ATOM 0 HB2 MET A 29 -41.644 -40.095 69.921 1.00 0.00 H new ATOM 0 HB3 MET A 29 -41.963 -39.668 68.252 1.00 0.00 H new ATOM 0 HG2 MET A 29 -39.586 -39.971 67.680 1.00 0.00 H new ATOM 0 HG3 MET A 29 -39.197 -40.292 69.358 1.00 0.00 H new ATOM 0 HE1 MET A 29 -40.814 -43.101 66.171 1.00 0.00 H new ATOM 0 HE2 MET A 29 -41.541 -41.501 66.450 1.00 0.00 H new ATOM 0 HE3 MET A 29 -39.825 -41.632 65.995 1.00 0.00 H new ATOM 694 N PHE A 46 -49.724 -33.718 81.722 1.00 0.00 N ATOM 695 CA PHE A 46 -49.947 -32.365 81.129 1.00 0.00 C ATOM 696 C PHE A 46 -51.432 -31.991 81.038 1.00 0.00 C ATOM 697 O PHE A 46 -52.277 -32.840 80.834 1.00 0.00 O ATOM 698 CB PHE A 46 -49.336 -32.395 79.779 1.00 0.00 C ATOM 699 CG PHE A 46 -49.274 -31.012 79.150 1.00 0.00 C ATOM 700 CD1 PHE A 46 -48.389 -30.105 79.676 1.00 0.00 C ATOM 701 CD2 PHE A 46 -50.071 -30.649 78.087 1.00 0.00 C ATOM 702 CE1 PHE A 46 -48.292 -28.833 79.153 1.00 0.00 C ATOM 703 CE2 PHE A 46 -49.980 -29.381 77.559 1.00 0.00 C ATOM 704 CZ PHE A 46 -49.091 -28.470 78.090 1.00 0.00 C ATOM 0 HA PHE A 46 -49.495 -31.606 81.767 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -48.330 -32.808 79.846 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -49.912 -33.060 79.135 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -47.762 -30.390 80.508 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -50.768 -31.360 77.667 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -47.594 -28.125 79.574 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -50.607 -29.099 76.726 1.00 0.00 H new ATOM 0 HZ PHE A 46 -49.021 -27.476 77.674 1.00 0.00 H new ATOM 714 N LYS A 47 -51.722 -30.720 81.192 1.00 0.00 N ATOM 715 CA LYS A 47 -53.143 -30.234 81.124 1.00 0.00 C ATOM 716 C LYS A 47 -53.242 -28.858 80.439 1.00 0.00 C ATOM 717 O LYS A 47 -52.573 -27.941 80.871 1.00 0.00 O ATOM 718 CB LYS A 47 -53.690 -30.121 82.541 1.00 0.00 C ATOM 719 CG LYS A 47 -53.432 -31.439 83.273 1.00 0.00 C ATOM 720 CD LYS A 47 -54.211 -31.500 84.600 1.00 0.00 C ATOM 721 CE LYS A 47 -53.798 -30.365 85.552 1.00 0.00 C ATOM 722 NZ LYS A 47 -54.351 -29.060 85.091 1.00 0.00 N ATOM 0 H LYS A 47 -51.030 -29.990 81.364 1.00 0.00 H new ATOM 0 HA LYS A 47 -53.721 -30.947 80.536 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -53.209 -29.296 83.067 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -54.758 -29.905 82.518 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -53.725 -32.275 82.637 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -52.365 -31.546 83.469 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -55.280 -31.435 84.398 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -54.035 -32.462 85.082 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -54.155 -30.581 86.559 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -52.711 -30.306 85.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -53.579 -28.465 84.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -55.046 -29.225 84.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -54.814 -28.578 85.888 1.00 0.00 H new ATOM 736 N PHE A 48 -54.043 -28.697 79.405 1.00 0.00 N ATOM 737 CA PHE A 48 -54.133 -27.334 78.750 1.00 0.00 C ATOM 738 C PHE A 48 -55.556 -26.908 78.384 1.00 0.00 C ATOM 739 O PHE A 48 -56.493 -27.673 78.472 1.00 0.00 O ATOM 740 CB PHE A 48 -53.254 -27.309 77.477 1.00 0.00 C ATOM 741 CG PHE A 48 -53.794 -28.187 76.338 1.00 0.00 C ATOM 742 CD1 PHE A 48 -53.700 -29.565 76.387 1.00 0.00 C ATOM 743 CD2 PHE A 48 -54.380 -27.592 75.234 1.00 0.00 C ATOM 744 CE1 PHE A 48 -54.186 -30.331 75.344 1.00 0.00 C ATOM 745 CE2 PHE A 48 -54.863 -28.358 74.196 1.00 0.00 C ATOM 746 CZ PHE A 48 -54.764 -29.729 74.253 1.00 0.00 C ATOM 0 H PHE A 48 -54.626 -29.425 78.992 1.00 0.00 H new ATOM 0 HA PHE A 48 -53.776 -26.620 79.493 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -53.171 -26.281 77.124 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -52.248 -27.640 77.734 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -53.246 -30.044 77.242 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -54.459 -26.516 75.186 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -54.111 -31.408 75.387 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -55.318 -27.883 73.339 1.00 0.00 H new ATOM 0 HZ PHE A 48 -55.141 -30.332 73.440 1.00 0.00 H new ATOM 756 N MET A 49 -55.671 -25.671 77.971 1.00 0.00 N ATOM 757 CA MET A 49 -56.999 -25.088 77.584 1.00 0.00 C ATOM 758 C MET A 49 -57.182 -24.837 76.085 1.00 0.00 C ATOM 759 O MET A 49 -56.279 -24.411 75.394 1.00 0.00 O ATOM 760 CB MET A 49 -57.134 -23.807 78.358 1.00 0.00 C ATOM 761 CG MET A 49 -58.358 -22.962 77.957 1.00 0.00 C ATOM 762 SD MET A 49 -60.001 -23.696 78.141 1.00 0.00 S ATOM 763 CE MET A 49 -60.225 -23.309 79.895 1.00 0.00 C ATOM 0 H MET A 49 -54.886 -25.025 77.883 1.00 0.00 H new ATOM 0 HA MET A 49 -57.778 -25.812 77.822 1.00 0.00 H new ATOM 0 HB2 MET A 49 -57.199 -24.041 79.421 1.00 0.00 H new ATOM 0 HB3 MET A 49 -56.232 -23.212 78.217 1.00 0.00 H new ATOM 0 HG2 MET A 49 -58.336 -22.044 78.544 1.00 0.00 H new ATOM 0 HG3 MET A 49 -58.237 -22.675 76.912 1.00 0.00 H new ATOM 0 HE1 MET A 49 -60.992 -23.959 80.316 1.00 0.00 H new ATOM 0 HE2 MET A 49 -59.285 -23.466 80.425 1.00 0.00 H new ATOM 0 HE3 MET A 49 -60.533 -22.269 80.002 1.00 0.00 H new ATOM 773 N LEU A 50 -58.380 -25.120 75.634 1.00 0.00 N ATOM 774 CA LEU A 50 -58.775 -24.946 74.214 1.00 0.00 C ATOM 775 C LEU A 50 -59.363 -23.548 73.996 1.00 0.00 C ATOM 776 O LEU A 50 -60.326 -23.168 74.632 1.00 0.00 O ATOM 777 CB LEU A 50 -59.797 -26.025 73.916 1.00 0.00 C ATOM 778 CG LEU A 50 -60.468 -25.835 72.549 1.00 0.00 C ATOM 779 CD1 LEU A 50 -59.432 -25.779 71.441 1.00 0.00 C ATOM 780 CD2 LEU A 50 -61.393 -27.021 72.289 1.00 0.00 C ATOM 0 H LEU A 50 -59.128 -25.480 76.226 1.00 0.00 H new ATOM 0 HA LEU A 50 -57.919 -25.036 73.546 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -59.311 -27.000 73.947 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -60.559 -26.024 74.695 1.00 0.00 H new ATOM 0 HG LEU A 50 -61.025 -24.898 72.559 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -59.932 -25.644 70.482 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -58.755 -24.943 71.618 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -58.864 -26.709 71.426 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -61.877 -26.899 71.320 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -60.812 -27.943 72.291 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -62.152 -27.069 73.070 1.00 0.00 H new ATOM 792 N GLY A 51 -58.769 -22.809 73.098 1.00 0.00 N ATOM 793 CA GLY A 51 -59.251 -21.422 72.794 1.00 0.00 C ATOM 794 C GLY A 51 -58.302 -20.418 73.442 1.00 0.00 C ATOM 795 O GLY A 51 -58.632 -19.264 73.638 1.00 0.00 O ATOM 0 H GLY A 51 -57.960 -23.107 72.553 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -59.289 -21.264 71.716 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -60.264 -21.283 73.173 1.00 0.00 H new ATOM 799 N LYS A 52 -57.130 -20.901 73.762 1.00 0.00 N ATOM 800 CA LYS A 52 -56.071 -20.061 74.410 1.00 0.00 C ATOM 801 C LYS A 52 -54.810 -20.082 73.546 1.00 0.00 C ATOM 802 O LYS A 52 -53.966 -19.213 73.654 1.00 0.00 O ATOM 803 CB LYS A 52 -55.773 -20.633 75.798 1.00 0.00 C ATOM 804 CG LYS A 52 -54.714 -19.766 76.485 1.00 0.00 C ATOM 805 CD LYS A 52 -54.478 -20.316 77.893 1.00 0.00 C ATOM 806 CE LYS A 52 -53.412 -19.461 78.580 1.00 0.00 C ATOM 807 NZ LYS A 52 -53.873 -18.045 78.661 1.00 0.00 N ATOM 0 H LYS A 52 -56.853 -21.869 73.598 1.00 0.00 H new ATOM 0 HA LYS A 52 -56.411 -19.030 74.509 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -56.683 -20.658 76.397 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -55.419 -21.660 75.712 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -53.786 -19.777 75.913 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -55.046 -18.729 76.534 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -55.405 -20.297 78.466 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -54.155 -21.356 77.843 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -53.213 -19.846 79.580 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -52.475 -19.517 78.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -53.324 -17.542 79.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -53.735 -17.582 77.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -54.882 -18.022 78.912 1.00 0.00 H new ATOM 821 N GLN A 53 -54.709 -21.078 72.709 1.00 0.00 N ATOM 822 CA GLN A 53 -53.514 -21.183 71.830 1.00 0.00 C ATOM 823 C GLN A 53 -52.269 -21.148 72.716 1.00 0.00 C ATOM 824 O GLN A 53 -51.494 -20.213 72.696 1.00 0.00 O ATOM 825 CB GLN A 53 -53.511 -20.007 70.854 1.00 0.00 C ATOM 826 CG GLN A 53 -54.866 -19.916 70.125 1.00 0.00 C ATOM 827 CD GLN A 53 -55.129 -21.177 69.292 1.00 0.00 C ATOM 828 OE1 GLN A 53 -55.335 -22.256 69.809 1.00 0.00 O ATOM 829 NE2 GLN A 53 -55.131 -21.080 67.991 1.00 0.00 N ATOM 0 H GLN A 53 -55.400 -21.820 72.597 1.00 0.00 H new ATOM 0 HA GLN A 53 -53.528 -22.111 71.258 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -53.316 -19.079 71.392 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -52.707 -20.129 70.128 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -55.666 -19.784 70.853 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -54.876 -19.039 69.477 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -54.959 -20.178 67.547 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -55.305 -21.906 67.418 1.00 0.00 H new ATOM 838 N GLU A 54 -52.127 -22.201 73.479 1.00 0.00 N ATOM 839 CA GLU A 54 -50.972 -22.357 74.420 1.00 0.00 C ATOM 840 C GLU A 54 -50.089 -23.463 73.845 1.00 0.00 C ATOM 841 O GLU A 54 -48.879 -23.415 73.950 1.00 0.00 O ATOM 842 CB GLU A 54 -51.517 -22.746 75.804 1.00 0.00 C ATOM 843 CG GLU A 54 -50.397 -22.714 76.862 1.00 0.00 C ATOM 844 CD GLU A 54 -49.371 -23.819 76.600 1.00 0.00 C ATOM 845 OE1 GLU A 54 -49.795 -24.963 76.618 1.00 0.00 O ATOM 846 OE2 GLU A 54 -48.224 -23.454 76.397 1.00 0.00 O ATOM 0 H GLU A 54 -52.782 -22.983 73.490 1.00 0.00 H new ATOM 0 HA GLU A 54 -50.396 -21.438 74.530 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -52.315 -22.061 76.091 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -51.954 -23.744 75.761 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -49.904 -21.742 76.847 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -50.826 -22.838 77.856 1.00 0.00 H new ATOM 853 N VAL A 55 -50.718 -24.443 73.246 1.00 0.00 N ATOM 854 CA VAL A 55 -49.957 -25.585 72.641 1.00 0.00 C ATOM 855 C VAL A 55 -49.997 -25.411 71.124 1.00 0.00 C ATOM 856 O VAL A 55 -50.880 -24.768 70.594 1.00 0.00 O ATOM 857 CB VAL A 55 -50.628 -26.905 73.037 1.00 0.00 C ATOM 858 CG1 VAL A 55 -50.715 -26.987 74.555 1.00 0.00 C ATOM 859 CG2 VAL A 55 -52.057 -27.004 72.481 1.00 0.00 C ATOM 0 H VAL A 55 -51.732 -24.504 73.148 1.00 0.00 H new ATOM 0 HA VAL A 55 -48.925 -25.600 72.993 1.00 0.00 H new ATOM 0 HB VAL A 55 -50.028 -27.717 72.625 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -51.192 -27.924 74.842 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -49.712 -26.945 74.980 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -51.304 -26.150 74.931 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -52.500 -27.953 72.783 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -52.657 -26.183 72.872 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -52.029 -26.946 71.393 1.00 0.00 H new ATOM 869 N ILE A 56 -49.040 -25.988 70.451 1.00 0.00 N ATOM 870 CA ILE A 56 -49.033 -25.847 68.969 1.00 0.00 C ATOM 871 C ILE A 56 -50.394 -26.216 68.390 1.00 0.00 C ATOM 872 O ILE A 56 -51.279 -26.654 69.098 1.00 0.00 O ATOM 873 CB ILE A 56 -47.921 -26.743 68.414 1.00 0.00 C ATOM 874 CG1 ILE A 56 -48.186 -28.184 68.898 1.00 0.00 C ATOM 875 CG2 ILE A 56 -46.585 -26.172 68.958 1.00 0.00 C ATOM 876 CD1 ILE A 56 -47.125 -29.150 68.359 1.00 0.00 C ATOM 0 H ILE A 56 -48.280 -26.538 70.851 1.00 0.00 H new ATOM 0 HA ILE A 56 -48.840 -24.813 68.685 1.00 0.00 H new ATOM 0 HB ILE A 56 -47.882 -26.763 67.325 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -48.187 -28.211 69.988 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -49.175 -28.505 68.570 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -45.755 -26.776 68.591 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -46.463 -25.144 68.618 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -46.597 -26.195 70.048 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -47.336 -30.158 68.716 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -47.143 -29.139 67.269 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -46.140 -28.840 68.708 1.00 0.00 H new ATOM 888 N ARG A 57 -50.535 -26.031 67.105 1.00 0.00 N ATOM 889 CA ARG A 57 -51.814 -26.348 66.434 1.00 0.00 C ATOM 890 C ARG A 57 -52.063 -27.848 66.413 1.00 0.00 C ATOM 891 O ARG A 57 -53.009 -28.311 67.020 1.00 0.00 O ATOM 892 CB ARG A 57 -51.757 -25.799 64.997 1.00 0.00 C ATOM 893 CG ARG A 57 -53.118 -25.931 64.284 1.00 0.00 C ATOM 894 CD ARG A 57 -54.072 -24.819 64.751 1.00 0.00 C ATOM 895 NE ARG A 57 -53.431 -23.505 64.417 1.00 0.00 N ATOM 896 CZ ARG A 57 -53.091 -22.650 65.348 1.00 0.00 C ATOM 897 NH1 ARG A 57 -53.866 -22.500 66.388 1.00 0.00 N ATOM 898 NH2 ARG A 57 -51.984 -21.972 65.204 1.00 0.00 N ATOM 0 H ARG A 57 -49.806 -25.669 66.490 1.00 0.00 H new ATOM 0 HA ARG A 57 -52.635 -25.886 66.983 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -51.457 -24.751 65.019 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -50.996 -26.337 64.432 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -52.979 -25.871 63.205 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -53.554 -26.907 64.495 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -55.039 -24.911 64.256 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -54.254 -24.895 65.823 1.00 0.00 H new ATOM 0 HE ARG A 57 -53.256 -23.272 63.440 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -54.724 -23.046 66.467 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -53.613 -21.837 67.121 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -51.403 -22.114 64.378 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -51.701 -21.301 65.918 1.00 0.00 H new ATOM 912 N GLY A 58 -51.212 -28.552 65.707 1.00 0.00 N ATOM 913 CA GLY A 58 -51.311 -30.042 65.585 1.00 0.00 C ATOM 914 C GLY A 58 -51.952 -30.682 66.812 1.00 0.00 C ATOM 915 O GLY A 58 -52.667 -31.656 66.719 1.00 0.00 O ATOM 0 H GLY A 58 -50.430 -28.144 65.195 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -51.895 -30.294 64.700 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -50.315 -30.459 65.439 1.00 0.00 H new ATOM 919 N TRP A 59 -51.663 -30.095 67.945 1.00 0.00 N ATOM 920 CA TRP A 59 -52.229 -30.621 69.219 1.00 0.00 C ATOM 921 C TRP A 59 -53.683 -30.168 69.268 1.00 0.00 C ATOM 922 O TRP A 59 -54.595 -30.958 69.136 1.00 0.00 O ATOM 923 CB TRP A 59 -51.465 -30.019 70.432 1.00 0.00 C ATOM 924 CG TRP A 59 -50.566 -31.036 71.124 1.00 0.00 C ATOM 925 CD1 TRP A 59 -49.626 -31.748 70.479 1.00 0.00 C ATOM 926 CD2 TRP A 59 -50.533 -31.338 72.441 1.00 0.00 C ATOM 927 NE1 TRP A 59 -49.057 -32.443 71.438 1.00 0.00 N ATOM 928 CE2 TRP A 59 -49.530 -32.271 72.664 1.00 0.00 C ATOM 929 CE3 TRP A 59 -51.299 -30.896 73.510 1.00 0.00 C ATOM 930 CZ2 TRP A 59 -49.306 -32.737 73.949 1.00 0.00 C ATOM 931 CZ3 TRP A 59 -51.066 -31.368 74.762 1.00 0.00 C ATOM 932 CH2 TRP A 59 -50.073 -32.282 74.976 1.00 0.00 C ATOM 0 H TRP A 59 -51.061 -29.277 68.041 1.00 0.00 H new ATOM 0 HA TRP A 59 -52.142 -31.707 69.264 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -50.861 -29.177 70.094 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -52.184 -29.627 71.151 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -49.394 -31.749 69.424 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -48.287 -33.085 71.248 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -52.084 -30.173 73.346 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -48.525 -33.459 74.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -51.666 -31.020 75.590 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -49.894 -32.649 75.976 1.00 0.00 H new ATOM 943 N GLU A 60 -53.828 -28.878 69.464 1.00 0.00 N ATOM 944 CA GLU A 60 -55.172 -28.222 69.547 1.00 0.00 C ATOM 945 C GLU A 60 -56.160 -28.935 68.622 1.00 0.00 C ATOM 946 O GLU A 60 -57.204 -29.401 69.028 1.00 0.00 O ATOM 947 CB GLU A 60 -54.962 -26.757 69.164 1.00 0.00 C ATOM 948 CG GLU A 60 -56.215 -25.930 69.471 1.00 0.00 C ATOM 949 CD GLU A 60 -57.362 -26.329 68.539 1.00 0.00 C ATOM 950 OE1 GLU A 60 -57.170 -26.163 67.346 1.00 0.00 O ATOM 951 OE2 GLU A 60 -58.362 -26.777 69.075 1.00 0.00 O ATOM 0 H GLU A 60 -53.045 -28.234 69.573 1.00 0.00 H new ATOM 0 HA GLU A 60 -55.599 -28.282 70.548 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -54.110 -26.352 69.711 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -54.724 -26.684 68.103 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -56.512 -26.081 70.509 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -55.995 -24.869 69.354 1.00 0.00 H new ATOM 958 N GLU A 61 -55.759 -28.995 67.382 1.00 0.00 N ATOM 959 CA GLU A 61 -56.581 -29.650 66.354 1.00 0.00 C ATOM 960 C GLU A 61 -56.553 -31.154 66.637 1.00 0.00 C ATOM 961 O GLU A 61 -57.582 -31.789 66.757 1.00 0.00 O ATOM 962 CB GLU A 61 -55.984 -29.345 64.973 1.00 0.00 C ATOM 963 CG GLU A 61 -56.850 -29.975 63.870 1.00 0.00 C ATOM 964 CD GLU A 61 -58.201 -29.256 63.793 1.00 0.00 C ATOM 965 OE1 GLU A 61 -58.331 -28.251 64.472 1.00 0.00 O ATOM 966 OE2 GLU A 61 -59.029 -29.758 63.049 1.00 0.00 O ATOM 0 H GLU A 61 -54.879 -28.607 67.042 1.00 0.00 H new ATOM 0 HA GLU A 61 -57.610 -29.290 66.370 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -55.922 -28.267 64.826 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -54.967 -29.734 64.914 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -56.337 -29.908 62.910 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -57.003 -31.034 64.076 1.00 0.00 H new ATOM 973 N GLY A 62 -55.366 -31.693 66.737 1.00 0.00 N ATOM 974 CA GLY A 62 -55.243 -33.142 67.010 1.00 0.00 C ATOM 975 C GLY A 62 -55.982 -33.537 68.288 1.00 0.00 C ATOM 976 O GLY A 62 -57.045 -34.119 68.230 1.00 0.00 O ATOM 0 H GLY A 62 -54.484 -31.189 66.641 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -55.643 -33.707 66.168 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -54.190 -33.408 67.101 1.00 0.00 H new ATOM 980 N VAL A 63 -55.403 -33.221 69.417 1.00 0.00 N ATOM 981 CA VAL A 63 -56.050 -33.564 70.718 1.00 0.00 C ATOM 982 C VAL A 63 -57.570 -33.383 70.675 1.00 0.00 C ATOM 983 O VAL A 63 -58.303 -34.255 71.090 1.00 0.00 O ATOM 984 CB VAL A 63 -55.460 -32.682 71.814 1.00 0.00 C ATOM 985 CG1 VAL A 63 -56.066 -33.145 73.152 1.00 0.00 C ATOM 986 CG2 VAL A 63 -53.917 -32.827 71.843 1.00 0.00 C ATOM 0 H VAL A 63 -54.507 -32.739 69.494 1.00 0.00 H new ATOM 0 HA VAL A 63 -55.854 -34.616 70.924 1.00 0.00 H new ATOM 0 HB VAL A 63 -55.692 -31.633 71.632 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -55.667 -32.536 73.963 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -57.150 -33.037 73.117 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -55.811 -34.191 73.325 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -53.507 -32.193 72.629 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -53.653 -33.866 72.040 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -53.505 -32.524 70.880 1.00 0.00 H new ATOM 996 N ALA A 64 -58.029 -32.260 70.198 1.00 0.00 N ATOM 997 CA ALA A 64 -59.510 -32.052 70.134 1.00 0.00 C ATOM 998 C ALA A 64 -60.198 -33.276 69.540 1.00 0.00 C ATOM 999 O ALA A 64 -61.034 -33.937 70.120 1.00 0.00 O ATOM 1000 CB ALA A 64 -59.823 -30.862 69.246 1.00 0.00 C ATOM 0 H ALA A 64 -57.458 -31.488 69.854 1.00 0.00 H new ATOM 0 HA ALA A 64 -59.871 -31.881 71.148 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -60.902 -30.714 69.202 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -59.351 -29.969 69.655 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -59.441 -31.047 68.242 1.00 0.00 H new ATOM 1006 N GLN A 65 -59.748 -33.483 68.341 1.00 0.00 N ATOM 1007 CA GLN A 65 -60.191 -34.576 67.460 1.00 0.00 C ATOM 1008 C GLN A 65 -60.107 -35.905 68.206 1.00 0.00 C ATOM 1009 O GLN A 65 -60.579 -36.915 67.725 1.00 0.00 O ATOM 1010 CB GLN A 65 -59.284 -34.459 66.226 1.00 0.00 C ATOM 1011 CG GLN A 65 -59.835 -35.165 64.996 1.00 0.00 C ATOM 1012 CD GLN A 65 -58.954 -34.761 63.795 1.00 0.00 C ATOM 1013 OE1 GLN A 65 -59.110 -35.271 62.704 1.00 0.00 O ATOM 1014 NE2 GLN A 65 -58.020 -33.851 63.949 1.00 0.00 N ATOM 0 H GLN A 65 -59.038 -32.889 67.913 1.00 0.00 H new ATOM 0 HA GLN A 65 -61.234 -34.519 67.147 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -59.135 -33.405 65.993 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -58.305 -34.874 66.465 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -59.820 -36.246 65.136 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -60.873 -34.880 64.823 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -57.878 -33.415 64.860 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -57.436 -33.580 63.158 1.00 0.00 H new ATOM 1023 N MET A 66 -59.505 -35.890 69.375 1.00 0.00 N ATOM 1024 CA MET A 66 -59.406 -37.182 70.154 1.00 0.00 C ATOM 1025 C MET A 66 -60.546 -37.152 71.179 1.00 0.00 C ATOM 1026 O MET A 66 -60.994 -36.089 71.559 1.00 0.00 O ATOM 1027 CB MET A 66 -58.076 -37.271 70.909 1.00 0.00 C ATOM 1028 CG MET A 66 -56.918 -37.174 69.920 1.00 0.00 C ATOM 1029 SD MET A 66 -55.251 -37.217 70.624 1.00 0.00 S ATOM 1030 CE MET A 66 -55.272 -38.937 71.191 1.00 0.00 C ATOM 0 H MET A 66 -59.089 -35.071 69.817 1.00 0.00 H new ATOM 0 HA MET A 66 -59.468 -38.035 69.478 1.00 0.00 H new ATOM 0 HB2 MET A 66 -58.009 -36.468 71.643 1.00 0.00 H new ATOM 0 HB3 MET A 66 -58.020 -38.211 71.458 1.00 0.00 H new ATOM 0 HG2 MET A 66 -57.009 -37.993 69.207 1.00 0.00 H new ATOM 0 HG3 MET A 66 -57.027 -36.247 69.357 1.00 0.00 H new ATOM 0 HE1 MET A 66 -54.254 -39.325 71.214 1.00 0.00 H new ATOM 0 HE2 MET A 66 -55.701 -38.985 72.192 1.00 0.00 H new ATOM 0 HE3 MET A 66 -55.874 -39.538 70.509 1.00 0.00 H new ATOM 1040 N SER A 67 -60.996 -38.302 71.620 1.00 0.00 N ATOM 1041 CA SER A 67 -62.120 -38.358 72.623 1.00 0.00 C ATOM 1042 C SER A 67 -61.718 -38.969 73.964 1.00 0.00 C ATOM 1043 O SER A 67 -60.838 -39.800 74.069 1.00 0.00 O ATOM 1044 CB SER A 67 -63.254 -39.184 72.028 1.00 0.00 C ATOM 1045 OG SER A 67 -62.659 -40.457 71.825 1.00 0.00 O ATOM 0 H SER A 67 -60.635 -39.211 71.330 1.00 0.00 H new ATOM 0 HA SER A 67 -62.421 -37.330 72.825 1.00 0.00 H new ATOM 0 HB2 SER A 67 -64.107 -39.242 72.704 1.00 0.00 H new ATOM 0 HB3 SER A 67 -63.616 -38.756 71.093 1.00 0.00 H new ATOM 0 HG SER A 67 -63.320 -41.070 71.440 1.00 0.00 H new ATOM 1051 N VAL A 68 -62.419 -38.499 74.956 1.00 0.00 N ATOM 1052 CA VAL A 68 -62.205 -38.946 76.353 1.00 0.00 C ATOM 1053 C VAL A 68 -62.060 -40.456 76.516 1.00 0.00 C ATOM 1054 O VAL A 68 -63.042 -41.169 76.565 1.00 0.00 O ATOM 1055 CB VAL A 68 -63.386 -38.422 77.173 1.00 0.00 C ATOM 1056 CG1 VAL A 68 -63.304 -38.856 78.633 1.00 0.00 C ATOM 1057 CG2 VAL A 68 -63.387 -36.893 77.111 1.00 0.00 C ATOM 0 H VAL A 68 -63.155 -37.801 74.849 1.00 0.00 H new ATOM 0 HA VAL A 68 -61.253 -38.545 76.701 1.00 0.00 H new ATOM 0 HB VAL A 68 -64.302 -38.835 76.750 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -64.162 -38.462 79.178 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -63.306 -39.945 78.690 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -62.385 -38.472 79.076 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -64.224 -36.506 77.692 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -62.453 -36.512 77.523 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -63.485 -36.571 76.074 1.00 0.00 H new ATOM 1067 N GLY A 69 -60.842 -40.925 76.597 1.00 0.00 N ATOM 1068 CA GLY A 69 -60.606 -42.395 76.762 1.00 0.00 C ATOM 1069 C GLY A 69 -59.963 -42.951 75.502 1.00 0.00 C ATOM 1070 O GLY A 69 -59.875 -44.149 75.319 1.00 0.00 O ATOM 0 H GLY A 69 -59.998 -40.354 76.556 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -59.961 -42.576 77.622 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -61.549 -42.906 76.957 1.00 0.00 H new ATOM 1074 N GLN A 70 -59.522 -42.063 74.649 1.00 0.00 N ATOM 1075 CA GLN A 70 -58.864 -42.504 73.366 1.00 0.00 C ATOM 1076 C GLN A 70 -57.379 -42.204 73.386 1.00 0.00 C ATOM 1077 O GLN A 70 -56.912 -41.284 74.030 1.00 0.00 O ATOM 1078 CB GLN A 70 -59.508 -41.763 72.167 1.00 0.00 C ATOM 1079 CG GLN A 70 -58.733 -42.056 70.861 1.00 0.00 C ATOM 1080 CD GLN A 70 -59.498 -41.461 69.676 1.00 0.00 C ATOM 1081 OE1 GLN A 70 -60.647 -41.778 69.440 1.00 0.00 O ATOM 1082 NE2 GLN A 70 -58.894 -40.596 68.905 1.00 0.00 N ATOM 0 H GLN A 70 -59.585 -41.053 74.778 1.00 0.00 H new ATOM 0 HA GLN A 70 -59.006 -43.580 73.266 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -60.547 -42.074 72.057 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -59.515 -40.690 72.358 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -57.732 -41.628 70.915 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -58.613 -43.131 70.729 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -57.930 -40.326 69.099 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -59.387 -40.190 68.110 1.00 0.00 H new ATOM 1091 N ARG A 71 -56.671 -43.025 72.650 1.00 0.00 N ATOM 1092 CA ARG A 71 -55.190 -42.882 72.540 1.00 0.00 C ATOM 1093 C ARG A 71 -54.825 -42.957 71.072 1.00 0.00 C ATOM 1094 O ARG A 71 -55.383 -43.722 70.309 1.00 0.00 O ATOM 1095 CB ARG A 71 -54.523 -44.000 73.297 1.00 0.00 C ATOM 1096 CG ARG A 71 -53.040 -43.701 73.448 1.00 0.00 C ATOM 1097 CD ARG A 71 -52.438 -44.810 74.302 1.00 0.00 C ATOM 1098 NE ARG A 71 -52.491 -46.087 73.519 1.00 0.00 N ATOM 1099 CZ ARG A 71 -53.122 -47.144 73.964 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -53.325 -47.274 75.247 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -53.527 -48.039 73.104 1.00 0.00 N ATOM 0 H ARG A 71 -57.064 -43.799 72.114 1.00 0.00 H new ATOM 0 HA ARG A 71 -54.860 -41.932 72.960 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -54.983 -44.113 74.279 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -54.662 -44.944 72.769 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -52.555 -43.661 72.473 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -52.890 -42.729 73.919 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -51.408 -44.569 74.567 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -52.991 -44.913 75.235 1.00 0.00 H new ATOM 0 HE ARG A 71 -52.022 -46.134 72.614 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -52.993 -46.556 75.891 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -53.816 -48.093 75.605 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -53.350 -47.906 72.108 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -54.021 -48.871 73.428 1.00 0.00 H new ATOM 1115 N ALA A 72 -53.865 -42.139 70.744 1.00 0.00 N ATOM 1116 CA ALA A 72 -53.384 -42.072 69.324 1.00 0.00 C ATOM 1117 C ALA A 72 -51.920 -41.712 69.129 1.00 0.00 C ATOM 1118 O ALA A 72 -51.163 -41.481 70.050 1.00 0.00 O ATOM 1119 CB ALA A 72 -54.212 -41.044 68.572 1.00 0.00 C ATOM 0 H ALA A 72 -53.389 -41.512 71.393 1.00 0.00 H new ATOM 0 HA ALA A 72 -53.498 -43.088 68.946 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -53.870 -40.987 67.538 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -55.262 -41.337 68.592 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -54.099 -40.069 69.045 1.00 0.00 H new ATOM 1125 N LYS A 73 -51.617 -41.691 67.859 1.00 0.00 N ATOM 1126 CA LYS A 73 -50.266 -41.363 67.326 1.00 0.00 C ATOM 1127 C LYS A 73 -50.565 -40.253 66.311 1.00 0.00 C ATOM 1128 O LYS A 73 -51.079 -40.507 65.240 1.00 0.00 O ATOM 1129 CB LYS A 73 -49.677 -42.599 66.644 1.00 0.00 C ATOM 1130 CG LYS A 73 -48.319 -42.230 66.041 1.00 0.00 C ATOM 1131 CD LYS A 73 -47.738 -43.470 65.358 1.00 0.00 C ATOM 1132 CE LYS A 73 -46.383 -43.102 64.751 1.00 0.00 C ATOM 1133 NZ LYS A 73 -45.458 -42.637 65.823 1.00 0.00 N ATOM 0 H LYS A 73 -52.297 -41.902 67.128 1.00 0.00 H new ATOM 0 HA LYS A 73 -49.543 -41.056 68.082 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -49.562 -43.409 67.364 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -50.351 -42.958 65.866 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -48.432 -41.419 65.321 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -47.643 -41.874 66.819 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -47.623 -44.280 66.078 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -48.416 -43.827 64.583 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -45.957 -43.965 64.240 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -46.510 -42.319 64.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -44.476 -42.696 65.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -45.681 -41.652 66.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -45.571 -43.239 66.664 1.00 0.00 H new ATOM 1147 N LEU A 74 -50.239 -39.040 66.661 1.00 0.00 N ATOM 1148 CA LEU A 74 -50.504 -37.887 65.734 1.00 0.00 C ATOM 1149 C LEU A 74 -49.203 -37.484 65.030 1.00 0.00 C ATOM 1150 O LEU A 74 -48.119 -37.695 65.537 1.00 0.00 O ATOM 1151 CB LEU A 74 -51.034 -36.697 66.558 1.00 0.00 C ATOM 1152 CG LEU A 74 -52.009 -37.171 67.645 1.00 0.00 C ATOM 1153 CD1 LEU A 74 -52.473 -35.959 68.444 1.00 0.00 C ATOM 1154 CD2 LEU A 74 -53.222 -37.836 67.019 1.00 0.00 C ATOM 0 H LEU A 74 -49.800 -38.790 67.547 1.00 0.00 H new ATOM 0 HA LEU A 74 -51.241 -38.177 64.985 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -50.199 -36.169 67.019 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -51.535 -35.988 65.899 1.00 0.00 H new ATOM 0 HG LEU A 74 -51.503 -37.890 68.289 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -53.167 -36.279 69.221 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -51.612 -35.475 68.904 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -52.973 -35.255 67.779 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -53.902 -38.166 67.804 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -53.734 -37.124 66.371 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -52.902 -38.696 66.431 1.00 0.00 H new ATOM 1166 N THR A 75 -49.352 -36.906 63.866 1.00 0.00 N ATOM 1167 CA THR A 75 -48.172 -36.452 63.060 1.00 0.00 C ATOM 1168 C THR A 75 -48.418 -34.976 62.767 1.00 0.00 C ATOM 1169 O THR A 75 -49.458 -34.620 62.252 1.00 0.00 O ATOM 1170 CB THR A 75 -48.107 -37.244 61.756 1.00 0.00 C ATOM 1171 OG1 THR A 75 -48.004 -38.598 62.173 1.00 0.00 O ATOM 1172 CG2 THR A 75 -46.781 -36.975 61.038 1.00 0.00 C ATOM 0 H THR A 75 -50.256 -36.725 63.430 1.00 0.00 H new ATOM 0 HA THR A 75 -47.231 -36.604 63.588 1.00 0.00 H new ATOM 0 HB THR A 75 -48.954 -36.999 61.114 1.00 0.00 H new ATOM 0 HG1 THR A 75 -47.959 -39.180 61.386 1.00 0.00 H new ATOM 0 HG21 THR A 75 -46.747 -37.546 60.110 1.00 0.00 H new ATOM 0 HG22 THR A 75 -46.698 -35.912 60.813 1.00 0.00 H new ATOM 0 HG23 THR A 75 -45.952 -37.276 61.679 1.00 0.00 H new ATOM 1180 N ILE A 76 -47.469 -34.135 63.090 1.00 0.00 N ATOM 1181 CA ILE A 76 -47.628 -32.664 62.843 1.00 0.00 C ATOM 1182 C ILE A 76 -46.593 -32.224 61.829 1.00 0.00 C ATOM 1183 O ILE A 76 -45.465 -32.671 61.856 1.00 0.00 O ATOM 1184 CB ILE A 76 -47.395 -31.894 64.143 1.00 0.00 C ATOM 1185 CG1 ILE A 76 -48.253 -32.567 65.239 1.00 0.00 C ATOM 1186 CG2 ILE A 76 -47.793 -30.416 63.891 1.00 0.00 C ATOM 1187 CD1 ILE A 76 -48.075 -31.912 66.609 1.00 0.00 C ATOM 0 H ILE A 76 -46.583 -34.404 63.518 1.00 0.00 H new ATOM 0 HA ILE A 76 -48.634 -32.465 62.474 1.00 0.00 H new ATOM 0 HB ILE A 76 -46.356 -31.909 64.471 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -49.304 -32.521 64.952 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -47.987 -33.622 65.307 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -47.638 -29.837 64.802 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -47.178 -30.005 63.091 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -48.843 -30.366 63.603 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -48.700 -32.424 67.341 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -47.030 -31.981 66.912 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -48.368 -30.864 66.552 1.00 0.00 H new ATOM 1199 N SER A 77 -47.028 -31.340 60.971 1.00 0.00 N ATOM 1200 CA SER A 77 -46.159 -30.778 59.888 1.00 0.00 C ATOM 1201 C SER A 77 -45.899 -29.309 60.257 1.00 0.00 C ATOM 1202 O SER A 77 -46.720 -28.710 60.923 1.00 0.00 O ATOM 1203 CB SER A 77 -46.941 -30.922 58.573 1.00 0.00 C ATOM 1204 OG SER A 77 -48.183 -30.302 58.872 1.00 0.00 O ATOM 0 H SER A 77 -47.979 -30.971 60.974 1.00 0.00 H new ATOM 0 HA SER A 77 -45.201 -31.285 59.776 1.00 0.00 H new ATOM 0 HB2 SER A 77 -46.432 -30.429 57.745 1.00 0.00 H new ATOM 0 HB3 SER A 77 -47.069 -31.967 58.292 1.00 0.00 H new ATOM 0 HG SER A 77 -48.021 -29.437 59.304 1.00 0.00 H new ATOM 1210 N PRO A 78 -44.791 -28.745 59.840 1.00 0.00 N ATOM 1211 CA PRO A 78 -44.387 -27.390 60.291 1.00 0.00 C ATOM 1212 C PRO A 78 -45.568 -26.419 60.360 1.00 0.00 C ATOM 1213 O PRO A 78 -45.825 -25.811 61.380 1.00 0.00 O ATOM 1214 CB PRO A 78 -43.276 -26.988 59.286 1.00 0.00 C ATOM 1215 CG PRO A 78 -43.427 -28.011 58.132 1.00 0.00 C ATOM 1216 CD PRO A 78 -43.810 -29.296 58.868 1.00 0.00 C ATOM 0 HA PRO A 78 -44.017 -27.368 61.316 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -43.408 -25.965 58.933 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -42.287 -27.043 59.741 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -44.195 -27.708 57.420 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -42.500 -28.127 57.570 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -44.251 -30.041 58.206 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -42.957 -29.768 59.356 1.00 0.00 H new ATOM 1224 N ASP A 79 -46.256 -26.300 59.258 1.00 0.00 N ATOM 1225 CA ASP A 79 -47.429 -25.392 59.176 1.00 0.00 C ATOM 1226 C ASP A 79 -48.247 -25.379 60.468 1.00 0.00 C ATOM 1227 O ASP A 79 -48.778 -24.364 60.871 1.00 0.00 O ATOM 1228 CB ASP A 79 -48.280 -25.850 57.983 1.00 0.00 C ATOM 1229 CG ASP A 79 -48.496 -27.366 58.050 1.00 0.00 C ATOM 1230 OD1 ASP A 79 -48.015 -27.944 59.011 1.00 0.00 O ATOM 1231 OD2 ASP A 79 -49.132 -27.856 57.131 1.00 0.00 O ATOM 0 H ASP A 79 -46.049 -26.805 58.396 1.00 0.00 H new ATOM 0 HA ASP A 79 -47.088 -24.366 59.036 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -49.241 -25.336 57.992 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -47.785 -25.585 57.049 1.00 0.00 H new ATOM 1236 N TYR A 80 -48.325 -26.530 61.087 1.00 0.00 N ATOM 1237 CA TYR A 80 -49.089 -26.700 62.359 1.00 0.00 C ATOM 1238 C TYR A 80 -48.171 -26.709 63.590 1.00 0.00 C ATOM 1239 O TYR A 80 -48.641 -26.533 64.697 1.00 0.00 O ATOM 1240 CB TYR A 80 -49.881 -28.023 62.256 1.00 0.00 C ATOM 1241 CG TYR A 80 -51.194 -27.837 61.458 1.00 0.00 C ATOM 1242 CD1 TYR A 80 -51.231 -27.182 60.239 1.00 0.00 C ATOM 1243 CD2 TYR A 80 -52.380 -28.337 61.968 1.00 0.00 C ATOM 1244 CE1 TYR A 80 -52.420 -27.031 59.554 1.00 0.00 C ATOM 1245 CE2 TYR A 80 -53.568 -28.185 61.282 1.00 0.00 C ATOM 1246 CZ TYR A 80 -53.596 -27.531 60.069 1.00 0.00 C ATOM 1247 OH TYR A 80 -54.783 -27.378 59.383 1.00 0.00 O ATOM 0 H TYR A 80 -47.877 -27.383 60.752 1.00 0.00 H new ATOM 0 HA TYR A 80 -49.764 -25.854 62.491 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -49.264 -28.781 61.773 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -50.111 -28.390 63.256 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -50.319 -26.784 59.819 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -52.376 -28.854 62.916 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -52.428 -26.516 58.605 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -54.482 -28.581 61.699 1.00 0.00 H new ATOM 0 HH TYR A 80 -55.511 -27.792 59.892 1.00 0.00 H new ATOM 1457 N THR A 96 -40.757 -31.307 61.733 1.00 0.00 N ATOM 1458 CA THR A 96 -41.969 -32.175 61.883 1.00 0.00 C ATOM 1459 C THR A 96 -41.965 -32.760 63.299 1.00 0.00 C ATOM 1460 O THR A 96 -40.919 -33.151 63.778 1.00 0.00 O ATOM 1461 CB THR A 96 -41.898 -33.312 60.862 1.00 0.00 C ATOM 1462 OG1 THR A 96 -41.671 -32.641 59.632 1.00 0.00 O ATOM 1463 CG2 THR A 96 -43.266 -33.960 60.646 1.00 0.00 C ATOM 0 HA THR A 96 -42.878 -31.597 61.717 1.00 0.00 H new ATOM 0 HB THR A 96 -41.166 -34.054 61.181 1.00 0.00 H new ATOM 0 HG1 THR A 96 -41.155 -31.824 59.795 1.00 0.00 H new ATOM 0 HG21 THR A 96 -43.177 -34.763 59.915 1.00 0.00 H new ATOM 0 HG22 THR A 96 -43.629 -34.367 61.590 1.00 0.00 H new ATOM 0 HG23 THR A 96 -43.969 -33.212 60.280 1.00 0.00 H new ATOM 1471 N LEU A 97 -43.098 -32.824 63.962 1.00 0.00 N ATOM 1472 CA LEU A 97 -43.157 -33.386 65.336 1.00 0.00 C ATOM 1473 C LEU A 97 -44.079 -34.615 65.302 1.00 0.00 C ATOM 1474 O LEU A 97 -44.924 -34.733 64.438 1.00 0.00 O ATOM 1475 CB LEU A 97 -43.767 -32.368 66.278 1.00 0.00 C ATOM 1476 CG LEU A 97 -43.169 -30.971 66.207 1.00 0.00 C ATOM 1477 CD1 LEU A 97 -43.856 -30.130 67.273 1.00 0.00 C ATOM 1478 CD2 LEU A 97 -41.692 -30.952 66.548 1.00 0.00 C ATOM 0 H LEU A 97 -43.994 -32.503 63.596 1.00 0.00 H new ATOM 0 HA LEU A 97 -42.154 -33.647 65.675 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -44.834 -32.299 66.069 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -43.666 -32.737 67.299 1.00 0.00 H new ATOM 0 HG LEU A 97 -43.305 -30.602 65.190 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -43.453 -29.118 67.254 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -44.928 -30.098 67.076 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -43.680 -30.572 68.254 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -41.316 -29.931 66.482 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -41.548 -31.327 67.561 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -41.148 -31.585 65.846 1.00 0.00 H new ATOM 1490 N VAL A 98 -43.902 -35.505 66.244 1.00 0.00 N ATOM 1491 CA VAL A 98 -44.754 -36.731 66.311 1.00 0.00 C ATOM 1492 C VAL A 98 -45.127 -36.945 67.775 1.00 0.00 C ATOM 1493 O VAL A 98 -44.275 -36.931 68.641 1.00 0.00 O ATOM 1494 CB VAL A 98 -43.973 -37.930 65.802 1.00 0.00 C ATOM 1495 CG1 VAL A 98 -44.886 -39.174 65.864 1.00 0.00 C ATOM 1496 CG2 VAL A 98 -43.581 -37.677 64.344 1.00 0.00 C ATOM 0 H VAL A 98 -43.196 -35.434 66.977 1.00 0.00 H new ATOM 0 HA VAL A 98 -45.646 -36.615 65.696 1.00 0.00 H new ATOM 0 HB VAL A 98 -43.081 -38.087 66.408 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -44.340 -40.045 65.501 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -45.199 -39.345 66.894 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -45.765 -39.012 65.240 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -43.019 -38.531 63.965 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -44.481 -37.539 63.744 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -42.964 -36.781 64.283 1.00 0.00 H new ATOM 1506 N PHE A 99 -46.394 -37.139 68.031 1.00 0.00 N ATOM 1507 CA PHE A 99 -46.866 -37.364 69.436 1.00 0.00 C ATOM 1508 C PHE A 99 -47.625 -38.688 69.560 1.00 0.00 C ATOM 1509 O PHE A 99 -48.167 -39.211 68.609 1.00 0.00 O ATOM 1510 CB PHE A 99 -47.804 -36.232 69.864 1.00 0.00 C ATOM 1511 CG PHE A 99 -47.027 -34.942 70.154 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -46.577 -34.143 69.128 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -46.784 -34.564 71.462 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -45.894 -32.979 69.412 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -46.104 -33.400 71.748 1.00 0.00 C ATOM 1516 CZ PHE A 99 -45.656 -32.603 70.712 1.00 0.00 C ATOM 0 H PHE A 99 -47.130 -37.152 67.325 1.00 0.00 H new ATOM 0 HA PHE A 99 -45.985 -37.391 70.077 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -48.537 -36.048 69.079 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -48.358 -36.533 70.753 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -46.758 -34.427 68.102 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -47.132 -35.190 72.271 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -45.542 -32.356 68.603 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -45.923 -33.113 72.773 1.00 0.00 H new ATOM 0 HZ PHE A 99 -45.121 -31.689 70.923 1.00 0.00 H new ATOM 1526 N ASP A 100 -47.620 -39.172 70.771 1.00 0.00 N ATOM 1527 CA ASP A 100 -48.304 -40.446 71.143 1.00 0.00 C ATOM 1528 C ASP A 100 -49.145 -39.934 72.303 1.00 0.00 C ATOM 1529 O ASP A 100 -48.692 -39.963 73.427 1.00 0.00 O ATOM 1530 CB ASP A 100 -47.276 -41.474 71.616 1.00 0.00 C ATOM 1531 CG ASP A 100 -46.274 -41.755 70.491 1.00 0.00 C ATOM 1532 OD1 ASP A 100 -46.439 -41.153 69.443 1.00 0.00 O ATOM 1533 OD2 ASP A 100 -45.396 -42.562 70.749 1.00 0.00 O ATOM 0 H ASP A 100 -47.149 -38.716 71.552 1.00 0.00 H new ATOM 0 HA ASP A 100 -48.861 -40.945 70.350 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -46.754 -41.102 72.497 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -47.777 -42.396 71.909 1.00 0.00 H new ATOM 1538 N VAL A 101 -50.349 -39.477 72.044 1.00 0.00 N ATOM 1539 CA VAL A 101 -51.206 -38.939 73.166 1.00 0.00 C ATOM 1540 C VAL A 101 -52.340 -39.828 73.646 1.00 0.00 C ATOM 1541 O VAL A 101 -52.901 -40.620 72.917 1.00 0.00 O ATOM 1542 CB VAL A 101 -51.827 -37.608 72.719 1.00 0.00 C ATOM 1543 CG1 VAL A 101 -52.486 -36.864 73.896 1.00 0.00 C ATOM 1544 CG2 VAL A 101 -50.788 -36.756 72.007 1.00 0.00 C ATOM 0 H VAL A 101 -50.776 -39.451 71.118 1.00 0.00 H new ATOM 0 HA VAL A 101 -50.520 -38.852 74.009 1.00 0.00 H new ATOM 0 HB VAL A 101 -52.626 -37.821 72.009 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -52.914 -35.927 73.540 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -53.274 -37.484 74.323 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -51.736 -36.654 74.659 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -51.241 -35.815 71.695 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -49.958 -36.553 72.684 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -50.419 -37.289 71.131 1.00 0.00 H new ATOM 1554 N GLU A 102 -52.628 -39.638 74.908 1.00 0.00 N ATOM 1555 CA GLU A 102 -53.711 -40.385 75.604 1.00 0.00 C ATOM 1556 C GLU A 102 -54.609 -39.333 76.293 1.00 0.00 C ATOM 1557 O GLU A 102 -54.271 -38.869 77.364 1.00 0.00 O ATOM 1558 CB GLU A 102 -53.072 -41.316 76.636 1.00 0.00 C ATOM 1559 CG GLU A 102 -54.115 -42.328 77.100 1.00 0.00 C ATOM 1560 CD GLU A 102 -53.513 -43.200 78.204 1.00 0.00 C ATOM 1561 OE1 GLU A 102 -52.525 -43.847 77.901 1.00 0.00 O ATOM 1562 OE2 GLU A 102 -54.078 -43.165 79.285 1.00 0.00 O ATOM 0 H GLU A 102 -52.137 -38.971 75.503 1.00 0.00 H new ATOM 0 HA GLU A 102 -54.304 -40.989 74.917 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -52.215 -41.830 76.201 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -52.701 -40.741 77.484 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -55.001 -41.812 77.470 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -54.434 -42.949 76.263 1.00 0.00 H new ATOM 1569 N LEU A 103 -55.717 -38.957 75.696 1.00 0.00 N ATOM 1570 CA LEU A 103 -56.582 -37.934 76.377 1.00 0.00 C ATOM 1571 C LEU A 103 -57.244 -38.653 77.542 1.00 0.00 C ATOM 1572 O LEU A 103 -58.008 -39.585 77.364 1.00 0.00 O ATOM 1573 CB LEU A 103 -57.658 -37.393 75.393 1.00 0.00 C ATOM 1574 CG LEU A 103 -58.730 -36.491 76.104 1.00 0.00 C ATOM 1575 CD1 LEU A 103 -58.115 -35.204 76.729 1.00 0.00 C ATOM 1576 CD2 LEU A 103 -59.772 -36.064 75.050 1.00 0.00 C ATOM 0 H LEU A 103 -56.054 -39.300 74.796 1.00 0.00 H new ATOM 0 HA LEU A 103 -55.997 -37.079 76.716 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -57.169 -36.818 74.607 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -58.158 -38.233 74.910 1.00 0.00 H new ATOM 0 HG LEU A 103 -59.172 -37.073 76.912 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -58.902 -34.620 77.206 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -57.368 -35.482 77.472 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -57.645 -34.608 75.947 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -60.529 -35.436 75.520 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -59.278 -35.504 74.256 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -60.247 -36.950 74.628 1.00 0.00 H new ATOM 1588 N LEU A 104 -56.925 -38.179 78.718 1.00 0.00 N ATOM 1589 CA LEU A 104 -57.480 -38.787 79.956 1.00 0.00 C ATOM 1590 C LEU A 104 -58.860 -38.269 80.328 1.00 0.00 C ATOM 1591 O LEU A 104 -59.796 -39.034 80.448 1.00 0.00 O ATOM 1592 CB LEU A 104 -56.500 -38.516 81.100 1.00 0.00 C ATOM 1593 CG LEU A 104 -55.054 -38.699 80.598 1.00 0.00 C ATOM 1594 CD1 LEU A 104 -54.078 -38.555 81.749 1.00 0.00 C ATOM 1595 CD2 LEU A 104 -54.804 -40.033 79.890 1.00 0.00 C ATOM 0 H LEU A 104 -56.298 -37.389 78.871 1.00 0.00 H new ATOM 0 HA LEU A 104 -57.602 -39.854 79.772 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -56.639 -37.503 81.479 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -56.696 -39.196 81.929 1.00 0.00 H new ATOM 0 HG LEU A 104 -54.898 -37.915 79.857 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -53.060 -38.686 81.382 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -54.179 -37.563 82.190 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -54.292 -39.312 82.504 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -53.764 -40.084 79.567 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -55.012 -40.854 80.576 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -55.458 -40.112 79.021 1.00 0.00 H new ATOM 1607 N LYS A 105 -58.974 -36.985 80.505 1.00 0.00 N ATOM 1608 CA LYS A 105 -60.292 -36.419 80.871 1.00 0.00 C ATOM 1609 C LYS A 105 -60.224 -34.894 80.747 1.00 0.00 C ATOM 1610 O LYS A 105 -59.263 -34.351 80.241 1.00 0.00 O ATOM 1611 CB LYS A 105 -60.621 -36.879 82.329 1.00 0.00 C ATOM 1612 CG LYS A 105 -62.150 -36.986 82.534 1.00 0.00 C ATOM 1613 CD LYS A 105 -62.470 -37.743 83.839 1.00 0.00 C ATOM 1614 CE LYS A 105 -62.063 -36.921 85.071 1.00 0.00 C ATOM 1615 NZ LYS A 105 -62.738 -35.592 85.039 1.00 0.00 N ATOM 0 H LYS A 105 -58.216 -36.309 80.412 1.00 0.00 H new ATOM 0 HA LYS A 105 -61.085 -36.768 80.210 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -60.154 -37.844 82.526 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -60.202 -36.170 83.043 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -62.589 -35.989 82.569 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -62.601 -37.503 81.687 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -63.536 -37.964 83.882 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -61.946 -38.699 83.846 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -62.335 -37.455 85.981 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -60.981 -36.789 85.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -62.819 -35.221 86.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -62.179 -34.932 84.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -63.687 -35.695 84.627 1.00 0.00 H new ATOM 1629 N LEU A 106 -61.248 -34.220 81.198 1.00 0.00 N ATOM 1630 CA LEU A 106 -61.278 -32.724 81.126 1.00 0.00 C ATOM 1631 C LEU A 106 -61.314 -32.217 82.566 1.00 0.00 C ATOM 1632 O LEU A 106 -61.716 -32.926 83.467 1.00 0.00 O ATOM 1633 CB LEU A 106 -62.543 -32.263 80.394 1.00 0.00 C ATOM 1634 CG LEU A 106 -62.758 -33.089 79.124 1.00 0.00 C ATOM 1635 CD1 LEU A 106 -64.060 -32.634 78.471 1.00 0.00 C ATOM 1636 CD2 LEU A 106 -61.619 -32.879 78.126 1.00 0.00 C ATOM 0 H LEU A 106 -62.075 -34.644 81.618 1.00 0.00 H new ATOM 0 HA LEU A 106 -60.410 -32.341 80.589 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -63.407 -32.363 81.051 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -62.458 -31.207 80.138 1.00 0.00 H new ATOM 0 HG LEU A 106 -62.793 -34.144 79.395 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -64.232 -33.211 77.563 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -64.888 -32.790 79.163 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -63.991 -31.575 78.221 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -61.801 -33.479 77.235 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -61.567 -31.826 77.850 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -60.676 -33.182 78.581 1.00 0.00 H new ATOM 1648 N GLU A 107 -60.894 -30.994 82.758 1.00 0.00 N ATOM 1649 CA GLU A 107 -60.891 -30.399 84.141 1.00 0.00 C ATOM 1650 C GLU A 107 -61.484 -28.989 84.110 1.00 0.00 C ATOM 1651 O GLU A 107 -62.480 -28.809 84.791 1.00 0.00 O ATOM 1652 CB GLU A 107 -59.447 -30.355 84.666 1.00 0.00 C ATOM 1653 CG GLU A 107 -59.464 -29.838 86.111 1.00 0.00 C ATOM 1654 CD GLU A 107 -58.037 -29.816 86.666 1.00 0.00 C ATOM 1655 OE1 GLU A 107 -57.150 -30.198 85.919 1.00 0.00 O ATOM 1656 OE2 GLU A 107 -57.918 -29.416 87.813 1.00 0.00 O ATOM 1657 OXT GLU A 107 -60.908 -28.173 83.410 1.00 0.00 O ATOM 0 H GLU A 107 -60.552 -30.376 82.022 1.00 0.00 H new ATOM 0 HA GLU A 107 -61.500 -31.014 84.803 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -59.000 -31.348 84.625 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -58.837 -29.705 84.039 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -59.893 -28.837 86.145 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -60.095 -30.476 86.729 1.00 0.00 H new