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 6 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 66 MET CE :methyl 175:sc= -1.23 (180deg=-0.843) USER MOD Set 1.3: A 70 GLN : amide:sc= -8.63! C(o=-9.9!,f=-24!) USER MOD Single : A 3 GLN : amide:sc= -0.7 X(o=-0.7,f=-0.7) 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+ -157:sc= -0.0256 (180deg=-0.29) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot 140:sc= 0.227 USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) 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+ -155:sc= -0.113 (180deg=-0.819) USER MOD Single : A 49 MET CE :methyl -171:sc= -0.285 (180deg=-0.429) USER MOD Single : A 52 LYS NZ :NH3+ 164:sc= -0.0515 (180deg=-0.424) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= -2.94! K(o=-2.9!,f=-1) USER MOD Single : A 67 SER OG : rot 180:sc=-0.00866 USER MOD Single : A 73 LYS NZ :NH3+ 162:sc= -0.155 (180deg=-0.62) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 86:sc= 1.11 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 42:sc= 0.322 USER MOD Single : A 105 LYS NZ :NH3+ -132:sc= -1.63 (180deg=-4.08!) USER MOD ----------------------------------------------------------------- ATOM 10 N VAL A 2 -51.970 -31.633 59.910 1.00 0.00 N ATOM 11 CA VAL A 2 -51.846 -32.604 61.050 1.00 0.00 C ATOM 12 C VAL A 2 -52.730 -33.806 60.741 1.00 0.00 C ATOM 13 O VAL A 2 -53.782 -33.675 60.147 1.00 0.00 O ATOM 14 CB VAL A 2 -52.318 -31.931 62.354 1.00 0.00 C ATOM 15 CG1 VAL A 2 -53.802 -31.521 62.245 1.00 0.00 C ATOM 16 CG2 VAL A 2 -52.174 -32.912 63.540 1.00 0.00 C ATOM 0 HA VAL A 2 -50.810 -32.918 61.174 1.00 0.00 H new ATOM 0 HB VAL A 2 -51.701 -31.047 62.518 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -54.118 -31.048 63.175 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -53.926 -30.819 61.420 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -54.412 -32.406 62.063 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -52.510 -32.427 64.456 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -52.781 -33.798 63.355 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -51.129 -33.204 63.646 1.00 0.00 H new ATOM 26 N GLN A 3 -52.278 -34.959 61.152 1.00 0.00 N ATOM 27 CA GLN A 3 -53.048 -36.220 60.914 1.00 0.00 C ATOM 28 C GLN A 3 -53.310 -36.843 62.278 1.00 0.00 C ATOM 29 O GLN A 3 -52.571 -36.625 63.217 1.00 0.00 O ATOM 30 CB GLN A 3 -52.209 -37.162 60.055 1.00 0.00 C ATOM 31 CG GLN A 3 -53.008 -38.435 59.769 1.00 0.00 C ATOM 32 CD GLN A 3 -52.156 -39.361 58.899 1.00 0.00 C ATOM 33 OE1 GLN A 3 -51.085 -39.785 59.286 1.00 0.00 O ATOM 34 NE2 GLN A 3 -52.594 -39.695 57.716 1.00 0.00 N ATOM 0 H GLN A 3 -51.397 -35.086 61.649 1.00 0.00 H new ATOM 0 HA GLN A 3 -53.987 -36.026 60.396 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -51.936 -36.673 59.120 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -51.280 -37.410 60.568 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -53.275 -38.932 60.702 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -53.940 -38.190 59.260 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -53.492 -39.342 57.386 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -52.038 -40.309 57.121 1.00 0.00 H new ATOM 43 N VAL A 4 -54.363 -37.611 62.355 1.00 0.00 N ATOM 44 CA VAL A 4 -54.741 -38.290 63.635 1.00 0.00 C ATOM 45 C VAL A 4 -54.892 -39.781 63.350 1.00 0.00 C ATOM 46 O VAL A 4 -55.776 -40.193 62.624 1.00 0.00 O ATOM 47 CB VAL A 4 -56.067 -37.740 64.125 1.00 0.00 C ATOM 48 CG1 VAL A 4 -56.405 -38.330 65.497 1.00 0.00 C ATOM 49 CG2 VAL A 4 -55.969 -36.226 64.204 1.00 0.00 C ATOM 0 H VAL A 4 -54.990 -37.802 61.573 1.00 0.00 H new ATOM 0 HA VAL A 4 -53.979 -38.119 64.395 1.00 0.00 H new ATOM 0 HB VAL A 4 -56.862 -38.016 63.433 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -57.359 -37.929 65.840 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -56.474 -39.415 65.419 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -55.623 -38.066 66.209 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -56.917 -35.818 64.555 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -55.175 -35.948 64.897 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -55.745 -35.824 63.216 1.00 0.00 H new ATOM 59 N GLU A 5 -54.025 -40.561 63.928 1.00 0.00 N ATOM 60 CA GLU A 5 -54.060 -42.050 63.734 1.00 0.00 C ATOM 61 C GLU A 5 -54.387 -42.660 65.094 1.00 0.00 C ATOM 62 O GLU A 5 -53.572 -42.641 65.993 1.00 0.00 O ATOM 63 CB GLU A 5 -52.686 -42.522 63.250 1.00 0.00 C ATOM 64 CG GLU A 5 -52.364 -41.861 61.903 1.00 0.00 C ATOM 65 CD GLU A 5 -53.269 -42.431 60.806 1.00 0.00 C ATOM 66 OE1 GLU A 5 -53.970 -43.382 61.110 1.00 0.00 O ATOM 67 OE2 GLU A 5 -53.201 -41.880 59.720 1.00 0.00 O ATOM 0 H GLU A 5 -53.278 -40.231 64.539 1.00 0.00 H new ATOM 0 HA GLU A 5 -54.802 -42.348 62.994 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -51.922 -42.267 63.985 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -52.678 -43.607 63.146 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -52.503 -40.782 61.976 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -51.318 -42.031 61.647 1.00 0.00 H new ATOM 74 N THR A 6 -55.571 -43.197 65.230 1.00 0.00 N ATOM 75 CA THR A 6 -55.948 -43.802 66.544 1.00 0.00 C ATOM 76 C THR A 6 -55.438 -45.234 66.674 1.00 0.00 C ATOM 77 O THR A 6 -55.238 -45.938 65.705 1.00 0.00 O ATOM 78 CB THR A 6 -57.473 -43.784 66.670 1.00 0.00 C ATOM 79 OG1 THR A 6 -57.810 -42.406 66.600 1.00 0.00 O ATOM 80 CG2 THR A 6 -57.914 -44.210 68.077 1.00 0.00 C ATOM 0 H THR A 6 -56.284 -43.244 64.502 1.00 0.00 H new ATOM 0 HA THR A 6 -55.489 -43.217 67.341 1.00 0.00 H new ATOM 0 HB THR A 6 -57.924 -44.434 65.920 1.00 0.00 H new ATOM 0 HG1 THR A 6 -58.782 -42.303 66.672 1.00 0.00 H new ATOM 0 HG21 THR A 6 -59.002 -44.188 68.139 1.00 0.00 H new ATOM 0 HG22 THR A 6 -57.559 -45.220 68.279 1.00 0.00 H new ATOM 0 HG23 THR A 6 -57.495 -43.524 68.813 1.00 0.00 H new ATOM 88 N ILE A 7 -55.246 -45.612 67.910 1.00 0.00 N ATOM 89 CA ILE A 7 -54.748 -46.978 68.261 1.00 0.00 C ATOM 90 C ILE A 7 -55.770 -47.607 69.204 1.00 0.00 C ATOM 91 O ILE A 7 -56.218 -48.718 69.001 1.00 0.00 O ATOM 92 CB ILE A 7 -53.391 -46.870 68.975 1.00 0.00 C ATOM 93 CG1 ILE A 7 -52.410 -46.097 68.063 1.00 0.00 C ATOM 94 CG2 ILE A 7 -52.874 -48.312 69.193 1.00 0.00 C ATOM 95 CD1 ILE A 7 -51.190 -45.624 68.870 1.00 0.00 C ATOM 0 H ILE A 7 -55.419 -45.012 68.717 1.00 0.00 H new ATOM 0 HA ILE A 7 -54.621 -47.583 67.363 1.00 0.00 H new ATOM 0 HB ILE A 7 -53.480 -46.346 69.927 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -52.086 -46.736 67.242 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -52.915 -45.239 67.619 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -51.909 -48.280 69.699 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -53.586 -48.865 69.805 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -52.762 -48.808 68.229 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -50.508 -45.082 68.215 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -51.519 -44.967 69.675 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -50.676 -46.487 69.293 1.00 0.00 H new ATOM 107 N SER A 8 -56.116 -46.865 70.229 1.00 0.00 N ATOM 108 CA SER A 8 -57.112 -47.358 71.247 1.00 0.00 C ATOM 109 C SER A 8 -58.325 -46.428 71.385 1.00 0.00 C ATOM 110 O SER A 8 -58.377 -45.648 72.312 1.00 0.00 O ATOM 111 CB SER A 8 -56.411 -47.472 72.598 1.00 0.00 C ATOM 112 OG SER A 8 -57.430 -47.959 73.458 1.00 0.00 O ATOM 0 H SER A 8 -55.750 -45.930 70.410 1.00 0.00 H new ATOM 0 HA SER A 8 -57.484 -48.325 70.909 1.00 0.00 H new ATOM 0 HB2 SER A 8 -55.562 -48.155 72.554 1.00 0.00 H new ATOM 0 HB3 SER A 8 -56.028 -46.509 72.934 1.00 0.00 H new ATOM 0 HG SER A 8 -57.070 -48.068 74.363 1.00 0.00 H new ATOM 118 N PRO A 9 -59.267 -46.521 70.480 1.00 0.00 N ATOM 119 CA PRO A 9 -60.490 -45.680 70.501 1.00 0.00 C ATOM 120 C PRO A 9 -61.038 -45.418 71.914 1.00 0.00 C ATOM 121 O PRO A 9 -60.654 -46.060 72.870 1.00 0.00 O ATOM 122 CB PRO A 9 -61.440 -46.446 69.591 1.00 0.00 C ATOM 123 CG PRO A 9 -60.468 -46.965 68.503 1.00 0.00 C ATOM 124 CD PRO A 9 -59.264 -47.464 69.329 1.00 0.00 C ATOM 0 HA PRO A 9 -60.313 -44.662 70.154 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -61.943 -47.259 70.114 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -62.217 -45.805 69.175 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -60.913 -47.766 67.912 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -60.182 -46.176 67.807 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -59.389 -48.499 69.649 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -58.333 -47.415 68.764 1.00 0.00 H new ATOM 132 N GLY A 10 -61.932 -44.466 71.994 1.00 0.00 N ATOM 133 CA GLY A 10 -62.578 -44.079 73.294 1.00 0.00 C ATOM 134 C GLY A 10 -64.078 -44.246 73.064 1.00 0.00 C ATOM 135 O GLY A 10 -64.471 -44.837 72.077 1.00 0.00 O ATOM 0 H GLY A 10 -62.252 -43.923 71.192 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -62.232 -44.714 74.110 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -62.333 -43.052 73.564 1.00 0.00 H new ATOM 139 N ASP A 11 -64.907 -43.744 73.944 1.00 0.00 N ATOM 140 CA ASP A 11 -66.368 -43.904 73.724 1.00 0.00 C ATOM 141 C ASP A 11 -66.744 -43.546 72.280 1.00 0.00 C ATOM 142 O ASP A 11 -67.281 -44.348 71.543 1.00 0.00 O ATOM 143 CB ASP A 11 -67.098 -43.001 74.718 1.00 0.00 C ATOM 144 CG ASP A 11 -66.579 -41.573 74.572 1.00 0.00 C ATOM 145 OD1 ASP A 11 -65.376 -41.418 74.702 1.00 0.00 O ATOM 146 OD2 ASP A 11 -67.419 -40.721 74.342 1.00 0.00 O ATOM 0 H ASP A 11 -64.638 -43.240 74.789 1.00 0.00 H new ATOM 0 HA ASP A 11 -66.658 -44.943 73.883 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -68.172 -43.031 74.534 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -66.939 -43.357 75.736 1.00 0.00 H new ATOM 151 N GLY A 12 -66.437 -42.325 71.928 1.00 0.00 N ATOM 152 CA GLY A 12 -66.728 -41.803 70.557 1.00 0.00 C ATOM 153 C GLY A 12 -67.894 -40.833 70.682 1.00 0.00 C ATOM 154 O GLY A 12 -68.660 -40.634 69.760 1.00 0.00 O ATOM 0 H GLY A 12 -65.986 -41.651 72.547 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -65.853 -41.302 70.143 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -66.978 -42.620 69.880 1.00 0.00 H new ATOM 158 N ARG A 13 -67.992 -40.248 71.849 1.00 0.00 N ATOM 159 CA ARG A 13 -69.085 -39.268 72.145 1.00 0.00 C ATOM 160 C ARG A 13 -68.570 -38.004 72.835 1.00 0.00 C ATOM 161 O ARG A 13 -69.090 -36.935 72.584 1.00 0.00 O ATOM 162 CB ARG A 13 -70.126 -39.950 73.035 1.00 0.00 C ATOM 163 CG ARG A 13 -70.624 -41.204 72.310 1.00 0.00 C ATOM 164 CD ARG A 13 -71.679 -41.891 73.180 1.00 0.00 C ATOM 165 NE ARG A 13 -72.824 -40.937 73.357 1.00 0.00 N ATOM 166 CZ ARG A 13 -74.031 -41.238 72.947 1.00 0.00 C ATOM 167 NH1 ARG A 13 -74.381 -42.493 72.886 1.00 0.00 N ATOM 168 NH2 ARG A 13 -74.842 -40.272 72.613 1.00 0.00 N ATOM 0 H ARG A 13 -67.349 -40.411 72.624 1.00 0.00 H new ATOM 0 HA ARG A 13 -69.523 -38.957 71.197 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -69.689 -40.215 73.998 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -70.956 -39.273 73.238 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -71.049 -40.937 71.342 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -69.794 -41.883 72.117 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -72.020 -42.813 72.709 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -71.257 -42.164 74.147 1.00 0.00 H new ATOM 0 HE ARG A 13 -72.659 -40.036 73.806 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -73.719 -43.221 73.155 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -75.317 -42.747 72.569 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -74.532 -39.302 72.674 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -75.786 -40.487 72.291 1.00 0.00 H new ATOM 182 N THR A 14 -67.572 -38.114 73.685 1.00 0.00 N ATOM 183 CA THR A 14 -67.048 -36.887 74.388 1.00 0.00 C ATOM 184 C THR A 14 -65.664 -36.471 73.905 1.00 0.00 C ATOM 185 O THR A 14 -64.797 -37.287 73.668 1.00 0.00 O ATOM 186 CB THR A 14 -66.952 -37.168 75.868 1.00 0.00 C ATOM 187 OG1 THR A 14 -68.250 -37.607 76.241 1.00 0.00 O ATOM 188 CG2 THR A 14 -66.738 -35.877 76.671 1.00 0.00 C ATOM 0 H THR A 14 -67.101 -38.987 73.922 1.00 0.00 H new ATOM 0 HA THR A 14 -67.744 -36.077 74.168 1.00 0.00 H new ATOM 0 HB THR A 14 -66.137 -37.866 76.057 1.00 0.00 H new ATOM 0 HG1 THR A 14 -68.263 -37.812 77.199 1.00 0.00 H new ATOM 0 HG21 THR A 14 -66.673 -36.115 77.733 1.00 0.00 H new ATOM 0 HG22 THR A 14 -65.813 -35.398 76.350 1.00 0.00 H new ATOM 0 HG23 THR A 14 -67.575 -35.200 76.502 1.00 0.00 H new ATOM 196 N PHE A 15 -65.504 -35.178 73.772 1.00 0.00 N ATOM 197 CA PHE A 15 -64.212 -34.572 73.314 1.00 0.00 C ATOM 198 C PHE A 15 -63.894 -33.433 74.300 1.00 0.00 C ATOM 199 O PHE A 15 -64.692 -33.187 75.182 1.00 0.00 O ATOM 200 CB PHE A 15 -64.434 -34.044 71.915 1.00 0.00 C ATOM 201 CG PHE A 15 -64.995 -35.193 71.088 1.00 0.00 C ATOM 202 CD1 PHE A 15 -66.353 -35.434 71.081 1.00 0.00 C ATOM 203 CD2 PHE A 15 -64.155 -35.994 70.347 1.00 0.00 C ATOM 204 CE1 PHE A 15 -66.871 -36.474 70.334 1.00 0.00 C ATOM 205 CE2 PHE A 15 -64.669 -37.034 69.599 1.00 0.00 C ATOM 206 CZ PHE A 15 -66.028 -37.275 69.592 1.00 0.00 C ATOM 0 H PHE A 15 -66.237 -34.496 73.968 1.00 0.00 H new ATOM 0 HA PHE A 15 -63.383 -35.279 73.293 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -65.127 -33.203 71.926 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -63.499 -33.681 71.487 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -67.014 -34.807 71.662 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -63.091 -35.808 70.351 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -67.935 -36.660 70.331 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -64.007 -37.660 69.019 1.00 0.00 H new ATOM 0 HZ PHE A 15 -66.430 -38.089 69.007 1.00 0.00 H new ATOM 216 N PRO A 16 -62.778 -32.753 74.167 1.00 0.00 N ATOM 217 CA PRO A 16 -62.585 -31.448 74.856 1.00 0.00 C ATOM 218 C PRO A 16 -63.532 -30.383 74.283 1.00 0.00 C ATOM 219 O PRO A 16 -63.724 -30.313 73.085 1.00 0.00 O ATOM 220 CB PRO A 16 -61.103 -31.103 74.631 1.00 0.00 C ATOM 221 CG PRO A 16 -60.468 -32.460 74.249 1.00 0.00 C ATOM 222 CD PRO A 16 -61.563 -33.141 73.399 1.00 0.00 C ATOM 0 HA PRO A 16 -62.820 -31.492 75.919 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -60.979 -30.365 73.838 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -60.648 -30.686 75.529 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -59.545 -32.327 73.684 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -60.219 -33.050 75.131 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -61.584 -32.770 72.374 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -61.434 -34.222 73.344 1.00 0.00 H new ATOM 230 N LYS A 17 -64.106 -29.573 75.137 1.00 0.00 N ATOM 231 CA LYS A 17 -65.034 -28.504 74.697 1.00 0.00 C ATOM 232 C LYS A 17 -64.478 -27.144 75.129 1.00 0.00 C ATOM 233 O LYS A 17 -63.632 -27.032 75.998 1.00 0.00 O ATOM 234 CB LYS A 17 -66.348 -28.738 75.357 1.00 0.00 C ATOM 235 CG LYS A 17 -66.908 -30.149 75.066 1.00 0.00 C ATOM 236 CD LYS A 17 -67.040 -30.459 73.557 1.00 0.00 C ATOM 237 CE LYS A 17 -67.869 -29.382 72.840 1.00 0.00 C ATOM 238 NZ LYS A 17 -69.173 -29.194 73.536 1.00 0.00 N ATOM 0 H LYS A 17 -63.961 -29.615 76.146 1.00 0.00 H new ATOM 0 HA LYS A 17 -65.147 -28.514 73.613 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -66.240 -28.608 76.434 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -67.062 -27.989 75.016 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -66.257 -30.892 75.526 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -67.886 -30.247 75.536 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -66.049 -30.519 73.107 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -67.510 -31.433 73.423 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -67.319 -28.441 72.821 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -68.039 -29.673 71.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -69.865 -28.788 72.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -69.520 -30.113 73.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -69.046 -28.550 74.343 1.00 0.00 H new ATOM 252 N ARG A 18 -64.999 -26.129 74.498 1.00 0.00 N ATOM 253 CA ARG A 18 -64.560 -24.757 74.806 1.00 0.00 C ATOM 254 C ARG A 18 -65.092 -24.387 76.183 1.00 0.00 C ATOM 255 O ARG A 18 -66.273 -24.497 76.442 1.00 0.00 O ATOM 256 CB ARG A 18 -65.120 -23.785 73.769 1.00 0.00 C ATOM 257 CG ARG A 18 -64.650 -24.200 72.376 1.00 0.00 C ATOM 258 CD ARG A 18 -65.141 -23.146 71.381 1.00 0.00 C ATOM 259 NE ARG A 18 -66.632 -23.044 71.513 1.00 0.00 N ATOM 260 CZ ARG A 18 -67.426 -23.264 70.497 1.00 0.00 C ATOM 261 NH1 ARG A 18 -67.545 -24.480 70.039 1.00 0.00 N ATOM 262 NH2 ARG A 18 -68.072 -22.258 69.974 1.00 0.00 N ATOM 0 H ARG A 18 -65.717 -26.201 73.777 1.00 0.00 H new ATOM 0 HA ARG A 18 -63.472 -24.701 74.788 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -66.209 -23.780 73.810 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -64.788 -22.770 73.989 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -63.563 -24.275 72.347 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -65.045 -25.182 72.117 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -64.673 -22.183 71.584 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -64.867 -23.425 70.364 1.00 0.00 H new ATOM 0 HE ARG A 18 -67.036 -22.797 72.416 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -67.023 -25.242 70.473 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -68.160 -24.669 69.247 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -67.953 -21.321 70.358 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -68.696 -22.409 69.181 1.00 0.00 H new ATOM 276 N GLY A 19 -64.216 -23.954 77.052 1.00 0.00 N ATOM 277 CA GLY A 19 -64.646 -23.570 78.432 1.00 0.00 C ATOM 278 C GLY A 19 -63.983 -24.498 79.445 1.00 0.00 C ATOM 279 O GLY A 19 -63.820 -24.139 80.594 1.00 0.00 O ATOM 0 H GLY A 19 -63.219 -23.849 76.866 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -64.371 -22.535 78.636 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -65.731 -23.635 78.518 1.00 0.00 H new ATOM 283 N GLN A 20 -63.608 -25.680 79.015 1.00 0.00 N ATOM 284 CA GLN A 20 -62.948 -26.650 79.961 1.00 0.00 C ATOM 285 C GLN A 20 -61.482 -26.825 79.585 1.00 0.00 C ATOM 286 O GLN A 20 -61.011 -26.275 78.610 1.00 0.00 O ATOM 287 CB GLN A 20 -63.618 -28.017 79.871 1.00 0.00 C ATOM 288 CG GLN A 20 -65.106 -27.917 80.191 1.00 0.00 C ATOM 289 CD GLN A 20 -65.670 -29.339 80.157 1.00 0.00 C ATOM 290 OE1 GLN A 20 -65.326 -30.174 80.971 1.00 0.00 O ATOM 291 NE2 GLN A 20 -66.533 -29.662 79.234 1.00 0.00 N ATOM 0 H GLN A 20 -63.727 -26.017 78.060 1.00 0.00 H new ATOM 0 HA GLN A 20 -63.040 -26.252 80.972 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -63.484 -28.427 78.870 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -63.139 -28.708 80.565 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -65.260 -27.465 81.171 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -65.615 -27.283 79.464 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -66.828 -28.969 78.547 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -66.913 -30.608 79.200 1.00 0.00 H new ATOM 300 N THR A 21 -60.793 -27.600 80.379 1.00 0.00 N ATOM 301 CA THR A 21 -59.347 -27.860 80.122 1.00 0.00 C ATOM 302 C THR A 21 -59.286 -29.308 79.645 1.00 0.00 C ATOM 303 O THR A 21 -60.247 -30.039 79.768 1.00 0.00 O ATOM 304 CB THR A 21 -58.583 -27.671 81.426 1.00 0.00 C ATOM 305 OG1 THR A 21 -58.847 -26.323 81.785 1.00 0.00 O ATOM 306 CG2 THR A 21 -57.068 -27.701 81.204 1.00 0.00 C ATOM 0 H THR A 21 -61.173 -28.068 81.202 1.00 0.00 H new ATOM 0 HA THR A 21 -58.906 -27.190 79.384 1.00 0.00 H new ATOM 0 HB THR A 21 -58.871 -28.441 82.141 1.00 0.00 H new ATOM 0 HG1 THR A 21 -58.389 -26.113 82.626 1.00 0.00 H new ATOM 0 HG21 THR A 21 -56.558 -27.563 82.157 1.00 0.00 H new ATOM 0 HG22 THR A 21 -56.782 -28.661 80.775 1.00 0.00 H new ATOM 0 HG23 THR A 21 -56.784 -26.900 80.521 1.00 0.00 H new ATOM 314 N CYS A 22 -58.160 -29.679 79.111 1.00 0.00 N ATOM 315 CA CYS A 22 -57.948 -31.058 78.602 1.00 0.00 C ATOM 316 C CYS A 22 -56.902 -31.605 79.559 1.00 0.00 C ATOM 317 O CYS A 22 -56.097 -30.854 80.067 1.00 0.00 O ATOM 318 CB CYS A 22 -57.415 -30.960 77.170 1.00 0.00 C ATOM 319 SG CYS A 22 -58.195 -29.687 76.151 1.00 0.00 S ATOM 0 H CYS A 22 -57.353 -29.064 79.003 1.00 0.00 H new ATOM 0 HA CYS A 22 -58.837 -31.687 78.565 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -56.343 -30.766 77.210 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -57.547 -31.926 76.682 1.00 0.00 H new ATOM 0 HG CYS A 22 -57.290 -29.094 75.430 1.00 0.00 H new ATOM 325 N VAL A 23 -56.946 -32.885 79.782 1.00 0.00 N ATOM 326 CA VAL A 23 -55.977 -33.562 80.697 1.00 0.00 C ATOM 327 C VAL A 23 -55.352 -34.628 79.810 1.00 0.00 C ATOM 328 O VAL A 23 -55.972 -35.646 79.574 1.00 0.00 O ATOM 329 CB VAL A 23 -56.775 -34.145 81.859 1.00 0.00 C ATOM 330 CG1 VAL A 23 -55.841 -34.816 82.852 1.00 0.00 C ATOM 331 CG2 VAL A 23 -57.463 -32.975 82.561 1.00 0.00 C ATOM 0 H VAL A 23 -57.631 -33.511 79.359 1.00 0.00 H new ATOM 0 HA VAL A 23 -55.208 -32.925 81.135 1.00 0.00 H new ATOM 0 HB VAL A 23 -57.491 -34.881 81.493 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -56.422 -35.228 83.677 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -55.297 -35.619 82.355 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -55.133 -34.083 83.238 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -58.047 -33.348 83.402 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -56.710 -32.275 82.924 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -58.123 -32.466 81.858 1.00 0.00 H new ATOM 341 N VAL A 24 -54.150 -34.363 79.338 1.00 0.00 N ATOM 342 CA VAL A 24 -53.416 -35.326 78.435 1.00 0.00 C ATOM 343 C VAL A 24 -52.054 -35.836 78.937 1.00 0.00 C ATOM 344 O VAL A 24 -51.341 -35.153 79.642 1.00 0.00 O ATOM 345 CB VAL A 24 -53.153 -34.644 77.060 1.00 0.00 C ATOM 346 CG1 VAL A 24 -54.421 -33.950 76.595 1.00 0.00 C ATOM 347 CG2 VAL A 24 -52.051 -33.506 77.086 1.00 0.00 C ATOM 0 H VAL A 24 -53.636 -33.506 79.543 1.00 0.00 H new ATOM 0 HA VAL A 24 -54.077 -36.191 78.387 1.00 0.00 H new ATOM 0 HB VAL A 24 -52.815 -35.452 76.410 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -54.242 -33.471 75.632 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -55.220 -34.684 76.492 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -54.713 -33.196 77.327 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -51.935 -33.089 76.086 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -52.357 -32.719 77.775 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -51.101 -33.927 77.416 1.00 0.00 H new ATOM 357 N HIS A 25 -51.754 -37.046 78.526 1.00 0.00 N ATOM 358 CA HIS A 25 -50.461 -37.730 78.887 1.00 0.00 C ATOM 359 C HIS A 25 -49.901 -38.173 77.543 1.00 0.00 C ATOM 360 O HIS A 25 -50.479 -39.002 76.866 1.00 0.00 O ATOM 361 CB HIS A 25 -50.694 -38.975 79.783 1.00 0.00 C ATOM 362 CG HIS A 25 -49.463 -39.892 79.791 1.00 0.00 C ATOM 363 ND1 HIS A 25 -48.318 -39.597 80.311 1.00 0.00 N ATOM 364 CD2 HIS A 25 -49.289 -41.167 79.280 1.00 0.00 C ATOM 365 CE1 HIS A 25 -47.497 -40.585 80.147 1.00 0.00 C ATOM 366 NE2 HIS A 25 -48.059 -41.583 79.511 1.00 0.00 N ATOM 0 H HIS A 25 -52.369 -37.608 77.937 1.00 0.00 H new ATOM 0 HA HIS A 25 -49.800 -37.070 79.449 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -50.920 -38.657 80.801 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -51.561 -39.529 79.422 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -50.049 -41.737 78.767 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -46.474 -40.586 80.492 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -47.641 -42.477 79.253 1.00 0.00 H new ATOM 374 N TYR A 26 -48.783 -37.605 77.174 1.00 0.00 N ATOM 375 CA TYR A 26 -48.137 -37.951 75.865 1.00 0.00 C ATOM 376 C TYR A 26 -46.643 -38.247 75.977 1.00 0.00 C ATOM 377 O TYR A 26 -46.022 -38.132 77.015 1.00 0.00 O ATOM 378 CB TYR A 26 -48.343 -36.778 74.939 1.00 0.00 C ATOM 379 CG TYR A 26 -47.644 -35.591 75.601 1.00 0.00 C ATOM 380 CD1 TYR A 26 -48.262 -34.921 76.628 1.00 0.00 C ATOM 381 CD2 TYR A 26 -46.387 -35.196 75.201 1.00 0.00 C ATOM 382 CE1 TYR A 26 -47.631 -33.872 77.244 1.00 0.00 C ATOM 383 CE2 TYR A 26 -45.752 -34.143 75.825 1.00 0.00 C ATOM 384 CZ TYR A 26 -46.372 -33.469 76.855 1.00 0.00 C ATOM 385 OH TYR A 26 -45.744 -32.414 77.485 1.00 0.00 O ATOM 0 H TYR A 26 -48.282 -36.909 77.726 1.00 0.00 H new ATOM 0 HA TYR A 26 -48.599 -38.865 75.492 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -47.921 -36.980 73.954 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -49.404 -36.576 74.796 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -49.248 -35.221 76.951 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -45.895 -35.715 74.392 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -48.129 -33.352 78.049 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -44.764 -33.845 75.505 1.00 0.00 H new ATOM 0 HH TYR A 26 -44.863 -32.270 77.081 1.00 0.00 H new ATOM 395 N THR A 27 -46.139 -38.630 74.839 1.00 0.00 N ATOM 396 CA THR A 27 -44.705 -38.965 74.668 1.00 0.00 C ATOM 397 C THR A 27 -44.379 -38.232 73.366 1.00 0.00 C ATOM 398 O THR A 27 -44.941 -38.543 72.332 1.00 0.00 O ATOM 399 CB THR A 27 -44.552 -40.466 74.511 1.00 0.00 C ATOM 400 OG1 THR A 27 -45.116 -41.002 75.699 1.00 0.00 O ATOM 401 CG2 THR A 27 -43.077 -40.873 74.577 1.00 0.00 C ATOM 0 H THR A 27 -46.690 -38.727 73.986 1.00 0.00 H new ATOM 0 HA THR A 27 -44.058 -38.684 75.499 1.00 0.00 H new ATOM 0 HB THR A 27 -44.996 -40.797 73.572 1.00 0.00 H new ATOM 0 HG1 THR A 27 -45.058 -41.980 75.676 1.00 0.00 H new ATOM 0 HG21 THR A 27 -42.992 -41.954 74.462 1.00 0.00 H new ATOM 0 HG22 THR A 27 -42.527 -40.379 73.776 1.00 0.00 H new ATOM 0 HG23 THR A 27 -42.661 -40.577 75.540 1.00 0.00 H new ATOM 409 N GLY A 28 -43.493 -37.272 73.427 1.00 0.00 N ATOM 410 CA GLY A 28 -43.126 -36.507 72.190 1.00 0.00 C ATOM 411 C GLY A 28 -41.782 -36.990 71.657 1.00 0.00 C ATOM 412 O GLY A 28 -40.801 -37.067 72.368 1.00 0.00 O ATOM 0 H GLY A 28 -43.007 -36.983 74.276 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -43.896 -36.638 71.430 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -43.076 -35.441 72.413 1.00 0.00 H new ATOM 416 N MET A 29 -41.795 -37.303 70.389 1.00 0.00 N ATOM 417 CA MET A 29 -40.583 -37.800 69.678 1.00 0.00 C ATOM 418 C MET A 29 -40.483 -37.009 68.373 1.00 0.00 C ATOM 419 O MET A 29 -41.350 -36.218 68.057 1.00 0.00 O ATOM 420 CB MET A 29 -40.790 -39.307 69.441 1.00 0.00 C ATOM 421 CG MET A 29 -39.548 -39.977 68.842 1.00 0.00 C ATOM 422 SD MET A 29 -39.578 -41.784 68.743 1.00 0.00 S ATOM 423 CE MET A 29 -39.012 -42.093 70.433 1.00 0.00 C ATOM 0 H MET A 29 -42.624 -37.232 69.799 1.00 0.00 H new ATOM 0 HA MET A 29 -39.656 -37.665 70.235 1.00 0.00 H new ATOM 0 HB2 MET A 29 -41.041 -39.790 70.385 1.00 0.00 H new ATOM 0 HB3 MET A 29 -41.638 -39.454 68.772 1.00 0.00 H new ATOM 0 HG2 MET A 29 -39.398 -39.582 67.837 1.00 0.00 H new ATOM 0 HG3 MET A 29 -38.681 -39.681 69.433 1.00 0.00 H new ATOM 0 HE1 MET A 29 -38.952 -43.168 70.606 1.00 0.00 H new ATOM 0 HE2 MET A 29 -38.027 -41.647 70.574 1.00 0.00 H new ATOM 0 HE3 MET A 29 -39.715 -41.650 71.139 1.00 0.00 H new ATOM 694 N PHE A 46 -49.928 -33.733 81.893 1.00 0.00 N ATOM 695 CA PHE A 46 -50.102 -32.346 81.351 1.00 0.00 C ATOM 696 C PHE A 46 -51.568 -31.925 81.138 1.00 0.00 C ATOM 697 O PHE A 46 -52.415 -32.754 80.871 1.00 0.00 O ATOM 698 CB PHE A 46 -49.351 -32.350 80.077 1.00 0.00 C ATOM 699 CG PHE A 46 -49.211 -31.015 79.373 1.00 0.00 C ATOM 700 CD1 PHE A 46 -48.510 -30.027 80.015 1.00 0.00 C ATOM 701 CD2 PHE A 46 -49.764 -30.773 78.131 1.00 0.00 C ATOM 702 CE1 PHE A 46 -48.350 -28.785 79.444 1.00 0.00 C ATOM 703 CE2 PHE A 46 -49.605 -29.527 77.559 1.00 0.00 C ATOM 704 CZ PHE A 46 -48.902 -28.535 78.210 1.00 0.00 C ATOM 0 HA PHE A 46 -49.734 -31.612 82.067 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -48.352 -32.741 80.271 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -49.839 -33.046 79.395 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -48.077 -30.226 80.984 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -50.313 -31.547 77.615 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -47.796 -28.015 79.960 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -50.036 -29.326 76.589 1.00 0.00 H new ATOM 0 HZ PHE A 46 -48.785 -27.564 77.751 1.00 0.00 H new ATOM 714 N LYS A 47 -51.839 -30.643 81.257 1.00 0.00 N ATOM 715 CA LYS A 47 -53.244 -30.130 81.065 1.00 0.00 C ATOM 716 C LYS A 47 -53.294 -28.753 80.356 1.00 0.00 C ATOM 717 O LYS A 47 -52.588 -27.848 80.753 1.00 0.00 O ATOM 718 CB LYS A 47 -53.957 -29.965 82.425 1.00 0.00 C ATOM 719 CG LYS A 47 -53.817 -31.224 83.323 1.00 0.00 C ATOM 720 CD LYS A 47 -52.550 -31.139 84.200 1.00 0.00 C ATOM 721 CE LYS A 47 -52.502 -32.376 85.100 1.00 0.00 C ATOM 722 NZ LYS A 47 -53.697 -32.404 85.988 1.00 0.00 N ATOM 0 H LYS A 47 -51.148 -29.926 81.479 1.00 0.00 H new ATOM 0 HA LYS A 47 -53.740 -30.873 80.441 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -53.543 -29.102 82.947 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -55.014 -29.759 82.256 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -54.697 -31.322 83.958 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -53.773 -32.117 82.699 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -51.659 -31.090 83.575 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -52.566 -30.231 84.803 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -52.470 -33.279 84.490 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -51.592 -32.364 85.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -53.480 -32.952 86.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -53.954 -31.432 86.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -54.492 -32.847 85.486 1.00 0.00 H new ATOM 736 N PHE A 48 -54.109 -28.594 79.333 1.00 0.00 N ATOM 737 CA PHE A 48 -54.183 -27.254 78.633 1.00 0.00 C ATOM 738 C PHE A 48 -55.615 -26.947 78.192 1.00 0.00 C ATOM 739 O PHE A 48 -56.457 -27.818 78.189 1.00 0.00 O ATOM 740 CB PHE A 48 -53.258 -27.249 77.388 1.00 0.00 C ATOM 741 CG PHE A 48 -53.848 -28.099 76.249 1.00 0.00 C ATOM 742 CD1 PHE A 48 -54.868 -27.627 75.443 1.00 0.00 C ATOM 743 CD2 PHE A 48 -53.355 -29.356 76.020 1.00 0.00 C ATOM 744 CE1 PHE A 48 -55.372 -28.418 74.426 1.00 0.00 C ATOM 745 CE2 PHE A 48 -53.847 -30.146 75.016 1.00 0.00 C ATOM 746 CZ PHE A 48 -54.856 -29.680 74.217 1.00 0.00 C ATOM 0 H PHE A 48 -54.719 -29.318 78.954 1.00 0.00 H new ATOM 0 HA PHE A 48 -53.857 -26.490 79.338 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -53.114 -26.225 77.043 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -52.276 -27.634 77.661 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -55.272 -26.639 75.608 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -52.560 -29.733 76.646 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -56.168 -28.048 73.797 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -53.440 -31.133 74.855 1.00 0.00 H new ATOM 0 HZ PHE A 48 -55.248 -30.300 73.424 1.00 0.00 H new ATOM 756 N MET A 49 -55.886 -25.719 77.815 1.00 0.00 N ATOM 757 CA MET A 49 -57.265 -25.348 77.376 1.00 0.00 C ATOM 758 C MET A 49 -57.389 -24.933 75.912 1.00 0.00 C ATOM 759 O MET A 49 -56.483 -24.384 75.316 1.00 0.00 O ATOM 760 CB MET A 49 -57.691 -24.264 78.304 1.00 0.00 C ATOM 761 CG MET A 49 -59.070 -23.711 77.949 1.00 0.00 C ATOM 762 SD MET A 49 -59.174 -22.531 76.578 1.00 0.00 S ATOM 763 CE MET A 49 -59.591 -21.031 77.505 1.00 0.00 C ATOM 0 H MET A 49 -55.208 -24.957 77.793 1.00 0.00 H new ATOM 0 HA MET A 49 -57.913 -26.223 77.425 1.00 0.00 H new ATOM 0 HB2 MET A 49 -57.706 -24.647 79.325 1.00 0.00 H new ATOM 0 HB3 MET A 49 -56.959 -23.456 78.277 1.00 0.00 H new ATOM 0 HG2 MET A 49 -59.720 -24.554 77.716 1.00 0.00 H new ATOM 0 HG3 MET A 49 -59.478 -23.230 78.838 1.00 0.00 H new ATOM 0 HE1 MET A 49 -59.851 -20.234 76.809 1.00 0.00 H new ATOM 0 HE2 MET A 49 -60.439 -21.232 78.160 1.00 0.00 H new ATOM 0 HE3 MET A 49 -58.734 -20.724 78.105 1.00 0.00 H new ATOM 773 N LEU A 50 -58.552 -25.229 75.385 1.00 0.00 N ATOM 774 CA LEU A 50 -58.914 -24.931 73.976 1.00 0.00 C ATOM 775 C LEU A 50 -59.570 -23.556 73.826 1.00 0.00 C ATOM 776 O LEU A 50 -60.599 -23.287 74.416 1.00 0.00 O ATOM 777 CB LEU A 50 -59.862 -26.035 73.540 1.00 0.00 C ATOM 778 CG LEU A 50 -60.476 -25.799 72.156 1.00 0.00 C ATOM 779 CD1 LEU A 50 -59.397 -25.845 71.096 1.00 0.00 C ATOM 780 CD2 LEU A 50 -61.462 -26.914 71.894 1.00 0.00 C ATOM 0 H LEU A 50 -59.297 -25.688 75.908 1.00 0.00 H new ATOM 0 HA LEU A 50 -58.020 -24.899 73.353 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -59.325 -26.983 73.534 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -60.663 -26.127 74.274 1.00 0.00 H new ATOM 0 HG LEU A 50 -60.963 -24.825 72.125 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -59.843 -25.676 70.116 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -58.657 -25.070 71.296 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -58.913 -26.822 71.111 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -61.917 -26.774 70.914 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -60.943 -27.872 71.920 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -62.238 -26.901 72.660 1.00 0.00 H new ATOM 792 N GLY A 51 -58.966 -22.715 73.030 1.00 0.00 N ATOM 793 CA GLY A 51 -59.509 -21.338 72.796 1.00 0.00 C ATOM 794 C GLY A 51 -58.468 -20.297 73.189 1.00 0.00 C ATOM 795 O GLY A 51 -58.476 -19.184 72.703 1.00 0.00 O ATOM 0 H GLY A 51 -58.106 -22.924 72.523 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -59.779 -21.217 71.747 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -60.419 -21.193 73.378 1.00 0.00 H new ATOM 799 N LYS A 52 -57.583 -20.687 74.073 1.00 0.00 N ATOM 800 CA LYS A 52 -56.499 -19.777 74.563 1.00 0.00 C ATOM 801 C LYS A 52 -55.133 -20.292 74.097 1.00 0.00 C ATOM 802 O LYS A 52 -54.161 -20.192 74.817 1.00 0.00 O ATOM 803 CB LYS A 52 -56.651 -19.774 76.077 1.00 0.00 C ATOM 804 CG LYS A 52 -55.723 -18.797 76.843 1.00 0.00 C ATOM 805 CD LYS A 52 -55.771 -17.343 76.326 1.00 0.00 C ATOM 806 CE LYS A 52 -57.211 -16.822 76.328 1.00 0.00 C ATOM 807 NZ LYS A 52 -57.791 -16.952 77.695 1.00 0.00 N ATOM 0 H LYS A 52 -57.566 -21.620 74.485 1.00 0.00 H new ATOM 0 HA LYS A 52 -56.572 -18.763 74.171 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -57.685 -19.529 76.320 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -56.468 -20.784 76.444 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -55.997 -18.805 77.898 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -54.698 -19.161 76.777 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -55.147 -16.707 76.953 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -55.362 -17.296 75.317 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -57.231 -15.779 76.012 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -57.812 -17.383 75.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -58.646 -16.365 77.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -58.038 -17.946 77.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -57.094 -16.636 78.399 1.00 0.00 H new ATOM 821 N GLN A 53 -55.135 -20.819 72.895 1.00 0.00 N ATOM 822 CA GLN A 53 -53.925 -21.385 72.221 1.00 0.00 C ATOM 823 C GLN A 53 -52.698 -21.476 73.117 1.00 0.00 C ATOM 824 O GLN A 53 -51.687 -20.842 72.886 1.00 0.00 O ATOM 825 CB GLN A 53 -53.609 -20.517 71.004 1.00 0.00 C ATOM 826 CG GLN A 53 -54.829 -20.530 70.080 1.00 0.00 C ATOM 827 CD GLN A 53 -54.540 -19.666 68.852 1.00 0.00 C ATOM 828 OE1 GLN A 53 -54.260 -18.488 68.956 1.00 0.00 O ATOM 829 NE2 GLN A 53 -54.599 -20.214 67.668 1.00 0.00 N ATOM 0 H GLN A 53 -55.978 -20.881 72.324 1.00 0.00 H new ATOM 0 HA GLN A 53 -54.161 -22.411 71.940 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -53.377 -19.498 71.313 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -52.732 -20.899 70.482 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -55.058 -21.551 69.775 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -55.704 -20.151 70.608 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -54.833 -21.202 67.575 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -54.411 -19.654 66.837 1.00 0.00 H new ATOM 838 N GLU A 54 -52.837 -22.282 74.132 1.00 0.00 N ATOM 839 CA GLU A 54 -51.716 -22.471 75.093 1.00 0.00 C ATOM 840 C GLU A 54 -50.802 -23.504 74.462 1.00 0.00 C ATOM 841 O GLU A 54 -49.605 -23.496 74.669 1.00 0.00 O ATOM 842 CB GLU A 54 -52.244 -22.996 76.428 1.00 0.00 C ATOM 843 CG GLU A 54 -53.230 -21.982 77.007 1.00 0.00 C ATOM 844 CD GLU A 54 -53.623 -22.431 78.416 1.00 0.00 C ATOM 845 OE1 GLU A 54 -52.712 -22.523 79.221 1.00 0.00 O ATOM 846 OE2 GLU A 54 -54.807 -22.656 78.604 1.00 0.00 O ATOM 0 H GLU A 54 -53.680 -22.819 74.338 1.00 0.00 H new ATOM 0 HA GLU A 54 -51.198 -21.533 75.290 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -52.734 -23.959 76.286 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -51.419 -23.157 77.122 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -52.778 -20.991 77.038 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -54.114 -21.909 76.373 1.00 0.00 H new ATOM 853 N VAL A 55 -51.393 -24.384 73.692 1.00 0.00 N ATOM 854 CA VAL A 55 -50.585 -25.451 73.011 1.00 0.00 C ATOM 855 C VAL A 55 -50.745 -25.278 71.503 1.00 0.00 C ATOM 856 O VAL A 55 -51.752 -24.796 71.025 1.00 0.00 O ATOM 857 CB VAL A 55 -51.086 -26.837 73.498 1.00 0.00 C ATOM 858 CG1 VAL A 55 -50.894 -26.864 75.013 1.00 0.00 C ATOM 859 CG2 VAL A 55 -52.572 -27.169 73.214 1.00 0.00 C ATOM 0 H VAL A 55 -52.395 -24.413 73.504 1.00 0.00 H new ATOM 0 HA VAL A 55 -49.525 -25.375 73.253 1.00 0.00 H new ATOM 0 HB VAL A 55 -50.512 -27.579 72.943 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -51.233 -27.823 75.406 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -49.838 -26.728 75.248 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -51.473 -26.060 75.468 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -52.803 -28.162 73.600 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -53.209 -26.432 73.703 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -52.751 -27.147 72.139 1.00 0.00 H new ATOM 869 N ILE A 56 -49.727 -25.681 70.793 1.00 0.00 N ATOM 870 CA ILE A 56 -49.762 -25.552 69.304 1.00 0.00 C ATOM 871 C ILE A 56 -51.061 -26.038 68.665 1.00 0.00 C ATOM 872 O ILE A 56 -51.992 -26.437 69.336 1.00 0.00 O ATOM 873 CB ILE A 56 -48.554 -26.317 68.698 1.00 0.00 C ATOM 874 CG1 ILE A 56 -48.568 -27.791 69.172 1.00 0.00 C ATOM 875 CG2 ILE A 56 -47.238 -25.565 69.038 1.00 0.00 C ATOM 876 CD1 ILE A 56 -47.201 -28.444 69.070 1.00 0.00 C ATOM 0 H ILE A 56 -48.875 -26.092 71.175 1.00 0.00 H new ATOM 0 HA ILE A 56 -49.703 -24.487 69.082 1.00 0.00 H new ATOM 0 HB ILE A 56 -48.626 -26.346 67.611 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -48.912 -27.834 70.205 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -49.283 -28.356 68.574 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -46.391 -26.103 68.612 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -47.276 -24.559 68.621 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -47.123 -25.505 70.120 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -47.264 -29.476 69.414 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -46.866 -28.427 68.033 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -46.490 -27.898 69.690 1.00 0.00 H new ATOM 888 N ARG A 57 -51.082 -25.989 67.354 1.00 0.00 N ATOM 889 CA ARG A 57 -52.258 -26.411 66.556 1.00 0.00 C ATOM 890 C ARG A 57 -52.270 -27.921 66.402 1.00 0.00 C ATOM 891 O ARG A 57 -53.212 -28.555 66.830 1.00 0.00 O ATOM 892 CB ARG A 57 -52.185 -25.734 65.179 1.00 0.00 C ATOM 893 CG ARG A 57 -53.418 -26.052 64.309 1.00 0.00 C ATOM 894 CD ARG A 57 -54.668 -25.340 64.851 1.00 0.00 C ATOM 895 NE ARG A 57 -55.764 -25.518 63.842 1.00 0.00 N ATOM 896 CZ ARG A 57 -56.333 -24.491 63.264 1.00 0.00 C ATOM 897 NH1 ARG A 57 -55.589 -23.491 62.878 1.00 0.00 N ATOM 898 NH2 ARG A 57 -57.628 -24.500 63.095 1.00 0.00 N ATOM 0 H ARG A 57 -50.297 -25.660 66.792 1.00 0.00 H new ATOM 0 HA ARG A 57 -53.176 -26.114 67.063 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -52.103 -24.655 65.310 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -51.283 -26.062 64.662 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -53.233 -25.740 63.281 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -53.587 -27.129 64.290 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -54.961 -25.760 65.813 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -54.465 -24.281 65.014 1.00 0.00 H new ATOM 0 HE ARG A 57 -56.072 -26.460 63.601 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -54.581 -23.518 63.028 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -56.016 -22.682 62.426 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -58.178 -25.299 63.412 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -58.089 -23.709 62.647 1.00 0.00 H new ATOM 912 N GLY A 58 -51.247 -28.464 65.789 1.00 0.00 N ATOM 913 CA GLY A 58 -51.143 -29.944 65.593 1.00 0.00 C ATOM 914 C GLY A 58 -51.720 -30.699 66.800 1.00 0.00 C ATOM 915 O GLY A 58 -52.181 -31.818 66.703 1.00 0.00 O ATOM 0 H GLY A 58 -50.464 -27.933 65.409 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -51.678 -30.233 64.688 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -50.099 -30.223 65.449 1.00 0.00 H new ATOM 919 N TRP A 59 -51.667 -30.030 67.925 1.00 0.00 N ATOM 920 CA TRP A 59 -52.186 -30.602 69.205 1.00 0.00 C ATOM 921 C TRP A 59 -53.650 -30.172 69.353 1.00 0.00 C ATOM 922 O TRP A 59 -54.563 -30.943 69.143 1.00 0.00 O ATOM 923 CB TRP A 59 -51.379 -30.037 70.408 1.00 0.00 C ATOM 924 CG TRP A 59 -50.392 -31.042 71.010 1.00 0.00 C ATOM 925 CD1 TRP A 59 -49.498 -31.726 70.285 1.00 0.00 C ATOM 926 CD2 TRP A 59 -50.225 -31.363 72.307 1.00 0.00 C ATOM 927 NE1 TRP A 59 -48.821 -32.422 71.177 1.00 0.00 N ATOM 928 CE2 TRP A 59 -49.184 -32.279 72.451 1.00 0.00 C ATOM 929 CE3 TRP A 59 -50.921 -30.927 73.416 1.00 0.00 C ATOM 930 CZ2 TRP A 59 -48.872 -32.731 73.736 1.00 0.00 C ATOM 931 CZ3 TRP A 59 -50.588 -31.392 74.640 1.00 0.00 C ATOM 932 CH2 TRP A 59 -49.581 -32.280 74.801 1.00 0.00 C ATOM 0 H TRP A 59 -51.277 -29.091 68.011 1.00 0.00 H new ATOM 0 HA TRP A 59 -52.092 -31.688 69.190 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -50.831 -29.152 70.084 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -52.075 -29.715 71.183 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -49.362 -31.711 69.214 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -48.056 -33.040 70.905 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -51.728 -30.218 73.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -48.068 -33.438 73.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -51.136 -31.048 75.505 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -49.338 -32.635 75.791 1.00 0.00 H new ATOM 943 N GLU A 60 -53.799 -28.920 69.720 1.00 0.00 N ATOM 944 CA GLU A 60 -55.143 -28.292 69.929 1.00 0.00 C ATOM 945 C GLU A 60 -56.152 -28.877 68.945 1.00 0.00 C ATOM 946 O GLU A 60 -57.217 -29.332 69.306 1.00 0.00 O ATOM 947 CB GLU A 60 -54.969 -26.802 69.733 1.00 0.00 C ATOM 948 CG GLU A 60 -56.235 -26.051 70.139 1.00 0.00 C ATOM 949 CD GLU A 60 -56.042 -24.552 69.862 1.00 0.00 C ATOM 950 OE1 GLU A 60 -54.963 -24.206 69.406 1.00 0.00 O ATOM 951 OE2 GLU A 60 -56.991 -23.830 70.122 1.00 0.00 O ATOM 0 H GLU A 60 -53.017 -28.288 69.889 1.00 0.00 H new ATOM 0 HA GLU A 60 -55.527 -28.492 70.929 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -54.125 -26.449 70.326 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -54.735 -26.593 68.689 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -57.092 -26.429 69.581 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -56.446 -26.214 71.196 1.00 0.00 H new ATOM 958 N GLU A 61 -55.743 -28.842 67.708 1.00 0.00 N ATOM 959 CA GLU A 61 -56.566 -29.365 66.606 1.00 0.00 C ATOM 960 C GLU A 61 -56.526 -30.887 66.717 1.00 0.00 C ATOM 961 O GLU A 61 -57.550 -31.538 66.777 1.00 0.00 O ATOM 962 CB GLU A 61 -55.969 -28.901 65.271 1.00 0.00 C ATOM 963 CG GLU A 61 -56.724 -29.517 64.076 1.00 0.00 C ATOM 964 CD GLU A 61 -58.189 -29.069 64.062 1.00 0.00 C ATOM 965 OE1 GLU A 61 -58.917 -29.528 64.927 1.00 0.00 O ATOM 966 OE2 GLU A 61 -58.496 -28.287 63.177 1.00 0.00 O ATOM 0 H GLU A 61 -54.844 -28.459 67.417 1.00 0.00 H new ATOM 0 HA GLU A 61 -57.594 -29.007 66.657 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -56.012 -27.814 65.209 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -54.917 -29.182 65.223 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -56.241 -29.222 63.145 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -56.673 -30.604 64.131 1.00 0.00 H new ATOM 973 N GLY A 62 -55.334 -31.424 66.741 1.00 0.00 N ATOM 974 CA GLY A 62 -55.212 -32.891 66.849 1.00 0.00 C ATOM 975 C GLY A 62 -55.980 -33.360 68.083 1.00 0.00 C ATOM 976 O GLY A 62 -57.094 -33.827 67.978 1.00 0.00 O ATOM 0 H GLY A 62 -54.454 -30.910 66.691 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -55.608 -33.369 65.953 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -54.163 -33.178 66.926 1.00 0.00 H new ATOM 980 N VAL A 63 -55.353 -33.222 69.221 1.00 0.00 N ATOM 981 CA VAL A 63 -55.977 -33.631 70.515 1.00 0.00 C ATOM 982 C VAL A 63 -57.498 -33.451 70.520 1.00 0.00 C ATOM 983 O VAL A 63 -58.218 -34.342 70.918 1.00 0.00 O ATOM 984 CB VAL A 63 -55.338 -32.810 71.635 1.00 0.00 C ATOM 985 CG1 VAL A 63 -55.951 -33.282 72.964 1.00 0.00 C ATOM 986 CG2 VAL A 63 -53.809 -33.077 71.648 1.00 0.00 C ATOM 0 H VAL A 63 -54.414 -32.834 69.310 1.00 0.00 H new ATOM 0 HA VAL A 63 -55.797 -34.696 70.664 1.00 0.00 H new ATOM 0 HB VAL A 63 -55.515 -31.744 71.488 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -55.516 -32.715 73.787 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -57.029 -33.123 72.944 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -55.743 -34.343 73.104 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -53.345 -32.495 72.444 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -53.626 -34.138 71.820 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -53.381 -32.786 70.689 1.00 0.00 H new ATOM 996 N ALA A 64 -57.979 -32.311 70.105 1.00 0.00 N ATOM 997 CA ALA A 64 -59.464 -32.119 70.094 1.00 0.00 C ATOM 998 C ALA A 64 -60.164 -33.326 69.480 1.00 0.00 C ATOM 999 O ALA A 64 -60.971 -34.020 70.066 1.00 0.00 O ATOM 1000 CB ALA A 64 -59.829 -30.907 69.256 1.00 0.00 C ATOM 0 H ALA A 64 -57.426 -31.518 69.779 1.00 0.00 H new ATOM 0 HA ALA A 64 -59.783 -31.986 71.128 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -60.911 -30.778 69.255 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -59.358 -30.019 69.676 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -59.481 -31.053 68.234 1.00 0.00 H new ATOM 1006 N GLN A 65 -59.757 -33.472 68.258 1.00 0.00 N ATOM 1007 CA GLN A 65 -60.213 -34.527 67.333 1.00 0.00 C ATOM 1008 C GLN A 65 -60.154 -35.875 68.053 1.00 0.00 C ATOM 1009 O GLN A 65 -60.685 -36.857 67.572 1.00 0.00 O ATOM 1010 CB GLN A 65 -59.284 -34.379 66.108 1.00 0.00 C ATOM 1011 CG GLN A 65 -59.840 -35.004 64.835 1.00 0.00 C ATOM 1012 CD GLN A 65 -58.946 -34.546 63.660 1.00 0.00 C ATOM 1013 OE1 GLN A 65 -59.117 -34.979 62.537 1.00 0.00 O ATOM 1014 NE2 GLN A 65 -57.986 -33.673 63.869 1.00 0.00 N ATOM 0 H GLN A 65 -59.070 -32.847 67.836 1.00 0.00 H new ATOM 0 HA GLN A 65 -61.248 -34.450 67.001 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -59.099 -33.320 65.930 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -58.322 -34.837 66.336 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -59.843 -36.091 64.912 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -60.872 -34.693 64.675 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -57.830 -33.301 64.806 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -57.397 -33.368 63.094 1.00 0.00 H new ATOM 1023 N MET A 66 -59.508 -35.908 69.199 1.00 0.00 N ATOM 1024 CA MET A 66 -59.429 -37.214 69.957 1.00 0.00 C ATOM 1025 C MET A 66 -60.534 -37.168 71.022 1.00 0.00 C ATOM 1026 O MET A 66 -60.995 -36.100 71.372 1.00 0.00 O ATOM 1027 CB MET A 66 -58.082 -37.365 70.677 1.00 0.00 C ATOM 1028 CG MET A 66 -56.931 -37.338 69.671 1.00 0.00 C ATOM 1029 SD MET A 66 -55.251 -37.295 70.347 1.00 0.00 S ATOM 1030 CE MET A 66 -55.550 -38.291 71.828 1.00 0.00 C ATOM 0 H MET A 66 -59.042 -35.113 69.637 1.00 0.00 H new ATOM 0 HA MET A 66 -59.540 -38.048 69.264 1.00 0.00 H new ATOM 0 HB2 MET A 66 -57.958 -36.560 71.402 1.00 0.00 H new ATOM 0 HB3 MET A 66 -58.064 -38.302 71.234 1.00 0.00 H new ATOM 0 HG2 MET A 66 -57.017 -38.218 69.033 1.00 0.00 H new ATOM 0 HG3 MET A 66 -57.061 -36.466 69.030 1.00 0.00 H new ATOM 0 HE1 MET A 66 -54.607 -38.462 72.348 1.00 0.00 H new ATOM 0 HE2 MET A 66 -56.238 -37.764 72.488 1.00 0.00 H new ATOM 0 HE3 MET A 66 -55.985 -39.248 71.541 1.00 0.00 H new ATOM 1040 N SER A 67 -60.940 -38.308 71.529 1.00 0.00 N ATOM 1041 CA SER A 67 -62.027 -38.344 72.575 1.00 0.00 C ATOM 1042 C SER A 67 -61.567 -38.900 73.919 1.00 0.00 C ATOM 1043 O SER A 67 -60.608 -39.635 74.033 1.00 0.00 O ATOM 1044 CB SER A 67 -63.171 -39.207 72.053 1.00 0.00 C ATOM 1045 OG SER A 67 -62.561 -40.472 71.852 1.00 0.00 O ATOM 0 H SER A 67 -60.568 -39.221 71.266 1.00 0.00 H new ATOM 0 HA SER A 67 -62.336 -37.314 72.751 1.00 0.00 H new ATOM 0 HB2 SER A 67 -63.990 -39.265 72.770 1.00 0.00 H new ATOM 0 HB3 SER A 67 -63.585 -38.809 71.127 1.00 0.00 H new ATOM 0 HG SER A 67 -63.227 -41.106 71.513 1.00 0.00 H new ATOM 1051 N VAL A 68 -62.321 -38.492 74.901 1.00 0.00 N ATOM 1052 CA VAL A 68 -62.083 -38.890 76.309 1.00 0.00 C ATOM 1053 C VAL A 68 -61.896 -40.387 76.529 1.00 0.00 C ATOM 1054 O VAL A 68 -62.858 -41.122 76.633 1.00 0.00 O ATOM 1055 CB VAL A 68 -63.266 -38.378 77.135 1.00 0.00 C ATOM 1056 CG1 VAL A 68 -63.118 -38.738 78.613 1.00 0.00 C ATOM 1057 CG2 VAL A 68 -63.335 -36.856 77.006 1.00 0.00 C ATOM 0 H VAL A 68 -63.123 -37.875 74.775 1.00 0.00 H new ATOM 0 HA VAL A 68 -61.137 -38.447 76.620 1.00 0.00 H new ATOM 0 HB VAL A 68 -64.174 -38.847 76.757 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -63.976 -38.358 79.168 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -63.067 -39.822 78.720 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -62.205 -38.291 79.007 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -64.174 -36.479 77.590 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -62.409 -36.417 77.377 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -63.471 -36.585 75.959 1.00 0.00 H new ATOM 1067 N GLY A 69 -60.665 -40.819 76.597 1.00 0.00 N ATOM 1068 CA GLY A 69 -60.385 -42.275 76.815 1.00 0.00 C ATOM 1069 C GLY A 69 -59.758 -42.856 75.561 1.00 0.00 C ATOM 1070 O GLY A 69 -59.531 -44.047 75.470 1.00 0.00 O ATOM 0 H GLY A 69 -59.838 -40.228 76.511 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -59.715 -42.405 77.665 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -61.308 -42.803 77.053 1.00 0.00 H new ATOM 1074 N GLN A 70 -59.487 -42.002 74.606 1.00 0.00 N ATOM 1075 CA GLN A 70 -58.863 -42.480 73.322 1.00 0.00 C ATOM 1076 C GLN A 70 -57.402 -42.078 73.233 1.00 0.00 C ATOM 1077 O GLN A 70 -56.980 -41.055 73.742 1.00 0.00 O ATOM 1078 CB GLN A 70 -59.645 -41.877 72.130 1.00 0.00 C ATOM 1079 CG GLN A 70 -59.071 -42.353 70.760 1.00 0.00 C ATOM 1080 CD GLN A 70 -57.999 -41.398 70.230 1.00 0.00 C ATOM 1081 OE1 GLN A 70 -56.941 -41.241 70.800 1.00 0.00 O ATOM 1082 NE2 GLN A 70 -58.238 -40.736 69.131 1.00 0.00 N ATOM 0 H GLN A 70 -59.667 -40.999 74.654 1.00 0.00 H new ATOM 0 HA GLN A 70 -58.911 -43.569 73.295 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -60.695 -42.162 72.203 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -59.605 -40.789 72.182 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -58.646 -43.351 70.871 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -59.880 -42.430 70.034 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -59.125 -40.861 68.643 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -57.538 -40.094 68.760 1.00 0.00 H new ATOM 1091 N ARG A 71 -56.664 -42.932 72.565 1.00 0.00 N ATOM 1092 CA ARG A 71 -55.199 -42.712 72.367 1.00 0.00 C ATOM 1093 C ARG A 71 -54.851 -42.815 70.894 1.00 0.00 C ATOM 1094 O ARG A 71 -55.357 -43.654 70.171 1.00 0.00 O ATOM 1095 CB ARG A 71 -54.450 -43.751 73.135 1.00 0.00 C ATOM 1096 CG ARG A 71 -52.969 -43.423 73.148 1.00 0.00 C ATOM 1097 CD ARG A 71 -52.285 -44.512 73.968 1.00 0.00 C ATOM 1098 NE ARG A 71 -52.440 -45.809 73.228 1.00 0.00 N ATOM 1099 CZ ARG A 71 -51.398 -46.500 72.840 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -50.684 -46.059 71.842 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -51.109 -47.608 73.466 1.00 0.00 N ATOM 0 H ARG A 71 -57.024 -43.787 72.142 1.00 0.00 H new ATOM 0 HA ARG A 71 -54.927 -41.718 72.721 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -54.828 -43.803 74.156 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -54.609 -44.731 72.686 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -52.570 -43.394 72.134 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -52.794 -42.441 73.587 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -51.230 -44.277 74.111 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -52.733 -44.582 74.959 1.00 0.00 H new ATOM 0 HE ARG A 71 -53.376 -46.159 73.023 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -50.941 -45.188 71.377 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -49.869 -46.585 71.527 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -51.691 -47.922 74.243 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -50.301 -48.160 73.179 1.00 0.00 H new ATOM 1115 N ALA A 72 -53.966 -41.931 70.525 1.00 0.00 N ATOM 1116 CA ALA A 72 -53.491 -41.855 69.105 1.00 0.00 C ATOM 1117 C ALA A 72 -52.031 -41.480 68.919 1.00 0.00 C ATOM 1118 O ALA A 72 -51.290 -41.230 69.848 1.00 0.00 O ATOM 1119 CB ALA A 72 -54.330 -40.830 68.358 1.00 0.00 C ATOM 0 H ALA A 72 -53.543 -41.247 71.152 1.00 0.00 H new ATOM 0 HA ALA A 72 -53.599 -42.868 68.717 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -53.992 -40.767 67.324 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -55.377 -41.131 68.380 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -54.223 -39.855 68.834 1.00 0.00 H new ATOM 1125 N LYS A 73 -51.711 -41.465 67.654 1.00 0.00 N ATOM 1126 CA LYS A 73 -50.355 -41.126 67.143 1.00 0.00 C ATOM 1127 C LYS A 73 -50.623 -40.019 66.118 1.00 0.00 C ATOM 1128 O LYS A 73 -51.098 -40.274 65.029 1.00 0.00 O ATOM 1129 CB LYS A 73 -49.733 -42.352 66.473 1.00 0.00 C ATOM 1130 CG LYS A 73 -48.351 -41.947 65.935 1.00 0.00 C ATOM 1131 CD LYS A 73 -47.573 -43.173 65.410 1.00 0.00 C ATOM 1132 CE LYS A 73 -48.265 -43.800 64.189 1.00 0.00 C ATOM 1133 NZ LYS A 73 -48.493 -42.764 63.141 1.00 0.00 N ATOM 0 H LYS A 73 -52.377 -41.688 66.914 1.00 0.00 H new ATOM 0 HA LYS A 73 -49.661 -40.812 67.923 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -49.640 -43.170 67.187 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -50.369 -42.707 65.662 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -48.470 -41.218 65.133 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -47.779 -41.461 66.725 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -46.560 -42.874 65.141 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -47.487 -43.917 66.202 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -47.651 -44.606 63.787 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -49.216 -44.242 64.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -48.670 -43.228 62.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -49.316 -42.183 63.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -47.652 -42.157 63.064 1.00 0.00 H new ATOM 1147 N LEU A 74 -50.313 -38.811 66.495 1.00 0.00 N ATOM 1148 CA LEU A 74 -50.539 -37.647 65.579 1.00 0.00 C ATOM 1149 C LEU A 74 -49.227 -37.326 64.850 1.00 0.00 C ATOM 1150 O LEU A 74 -48.149 -37.536 65.369 1.00 0.00 O ATOM 1151 CB LEU A 74 -50.987 -36.428 66.416 1.00 0.00 C ATOM 1152 CG LEU A 74 -51.917 -36.866 67.551 1.00 0.00 C ATOM 1153 CD1 LEU A 74 -52.340 -35.632 68.345 1.00 0.00 C ATOM 1154 CD2 LEU A 74 -53.156 -37.546 67.001 1.00 0.00 C ATOM 0 H LEU A 74 -49.911 -38.573 67.402 1.00 0.00 H new ATOM 0 HA LEU A 74 -51.311 -37.886 64.847 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -50.114 -35.923 66.829 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -51.499 -35.709 65.776 1.00 0.00 H new ATOM 0 HG LEU A 74 -51.385 -37.572 68.189 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -53.003 -35.931 69.157 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -51.457 -35.145 68.759 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -52.862 -34.938 67.687 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -53.802 -37.848 67.826 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -53.694 -36.853 66.354 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -52.864 -38.426 66.428 1.00 0.00 H new ATOM 1166 N THR A 75 -49.362 -36.819 63.653 1.00 0.00 N ATOM 1167 CA THR A 75 -48.174 -36.449 62.815 1.00 0.00 C ATOM 1168 C THR A 75 -48.379 -34.984 62.454 1.00 0.00 C ATOM 1169 O THR A 75 -49.289 -34.652 61.720 1.00 0.00 O ATOM 1170 CB THR A 75 -48.146 -37.302 61.547 1.00 0.00 C ATOM 1171 OG1 THR A 75 -48.102 -38.639 62.023 1.00 0.00 O ATOM 1172 CG2 THR A 75 -46.811 -37.122 60.820 1.00 0.00 C ATOM 0 H THR A 75 -50.263 -36.641 63.209 1.00 0.00 H new ATOM 0 HA THR A 75 -47.233 -36.612 63.341 1.00 0.00 H new ATOM 0 HB THR A 75 -48.982 -37.051 60.895 1.00 0.00 H new ATOM 0 HG1 THR A 75 -48.083 -39.257 61.262 1.00 0.00 H new ATOM 0 HG21 THR A 75 -46.802 -37.734 59.918 1.00 0.00 H new ATOM 0 HG22 THR A 75 -46.683 -36.074 60.548 1.00 0.00 H new ATOM 0 HG23 THR A 75 -45.996 -37.429 61.475 1.00 0.00 H new ATOM 1180 N ILE A 76 -47.539 -34.123 62.968 1.00 0.00 N ATOM 1181 CA ILE A 76 -47.663 -32.656 62.680 1.00 0.00 C ATOM 1182 C ILE A 76 -46.595 -32.204 61.699 1.00 0.00 C ATOM 1183 O ILE A 76 -45.469 -32.660 61.733 1.00 0.00 O ATOM 1184 CB ILE A 76 -47.475 -31.847 63.973 1.00 0.00 C ATOM 1185 CG1 ILE A 76 -48.310 -32.486 65.104 1.00 0.00 C ATOM 1186 CG2 ILE A 76 -47.923 -30.388 63.663 1.00 0.00 C ATOM 1187 CD1 ILE A 76 -47.925 -31.882 66.454 1.00 0.00 C ATOM 0 H ILE A 76 -46.764 -34.373 63.582 1.00 0.00 H new ATOM 0 HA ILE A 76 -48.654 -32.488 62.257 1.00 0.00 H new ATOM 0 HB ILE A 76 -46.438 -31.843 64.309 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -49.372 -32.326 64.916 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -48.148 -33.564 65.121 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -47.807 -29.774 64.556 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -47.308 -29.981 62.860 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -48.969 -30.386 63.355 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -48.522 -32.342 67.242 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -46.868 -32.065 66.646 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -48.111 -30.808 66.438 1.00 0.00 H new ATOM 1199 N SER A 77 -47.006 -31.289 60.862 1.00 0.00 N ATOM 1200 CA SER A 77 -46.116 -30.702 59.812 1.00 0.00 C ATOM 1201 C SER A 77 -45.855 -29.253 60.254 1.00 0.00 C ATOM 1202 O SER A 77 -46.693 -28.666 60.909 1.00 0.00 O ATOM 1203 CB SER A 77 -46.878 -30.768 58.485 1.00 0.00 C ATOM 1204 OG SER A 77 -48.104 -30.126 58.801 1.00 0.00 O ATOM 0 H SER A 77 -47.953 -30.911 60.862 1.00 0.00 H new ATOM 0 HA SER A 77 -45.167 -31.224 59.686 1.00 0.00 H new ATOM 0 HB2 SER A 77 -46.345 -30.254 57.685 1.00 0.00 H new ATOM 0 HB3 SER A 77 -47.031 -31.796 58.156 1.00 0.00 H new ATOM 0 HG SER A 77 -48.005 -29.158 58.686 1.00 0.00 H new ATOM 1210 N PRO A 78 -44.723 -28.697 59.905 1.00 0.00 N ATOM 1211 CA PRO A 78 -44.302 -27.374 60.431 1.00 0.00 C ATOM 1212 C PRO A 78 -45.426 -26.327 60.434 1.00 0.00 C ATOM 1213 O PRO A 78 -45.740 -25.743 61.452 1.00 0.00 O ATOM 1214 CB PRO A 78 -43.090 -27.005 59.538 1.00 0.00 C ATOM 1215 CG PRO A 78 -43.232 -27.938 58.314 1.00 0.00 C ATOM 1216 CD PRO A 78 -43.721 -29.237 58.947 1.00 0.00 C ATOM 0 HA PRO A 78 -44.036 -27.406 61.488 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -43.114 -25.955 59.245 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -42.146 -27.169 60.058 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -43.943 -27.548 57.586 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -42.284 -28.072 57.793 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -44.165 -29.915 58.218 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -42.921 -29.785 59.445 1.00 0.00 H new ATOM 1224 N ASP A 79 -45.989 -26.128 59.275 1.00 0.00 N ATOM 1225 CA ASP A 79 -47.094 -25.144 59.091 1.00 0.00 C ATOM 1226 C ASP A 79 -48.101 -25.095 60.244 1.00 0.00 C ATOM 1227 O ASP A 79 -48.853 -24.148 60.368 1.00 0.00 O ATOM 1228 CB ASP A 79 -47.804 -25.485 57.771 1.00 0.00 C ATOM 1229 CG ASP A 79 -48.211 -26.960 57.760 1.00 0.00 C ATOM 1230 OD1 ASP A 79 -47.343 -27.758 58.075 1.00 0.00 O ATOM 1231 OD2 ASP A 79 -49.361 -27.203 57.431 1.00 0.00 O ATOM 0 H ASP A 79 -45.721 -26.621 58.423 1.00 0.00 H new ATOM 0 HA ASP A 79 -46.651 -24.148 59.071 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -48.685 -24.855 57.650 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -47.144 -25.275 56.929 1.00 0.00 H new ATOM 1236 N TYR A 80 -48.099 -26.112 61.065 1.00 0.00 N ATOM 1237 CA TYR A 80 -49.036 -26.198 62.233 1.00 0.00 C ATOM 1238 C TYR A 80 -48.384 -25.962 63.604 1.00 0.00 C ATOM 1239 O TYR A 80 -49.047 -25.439 64.479 1.00 0.00 O ATOM 1240 CB TYR A 80 -49.707 -27.610 62.180 1.00 0.00 C ATOM 1241 CG TYR A 80 -50.992 -27.590 61.325 1.00 0.00 C ATOM 1242 CD1 TYR A 80 -50.967 -27.089 60.041 1.00 0.00 C ATOM 1243 CD2 TYR A 80 -52.186 -28.066 61.838 1.00 0.00 C ATOM 1244 CE1 TYR A 80 -52.117 -27.057 59.278 1.00 0.00 C ATOM 1245 CE2 TYR A 80 -53.336 -28.035 61.075 1.00 0.00 C ATOM 1246 CZ TYR A 80 -53.308 -27.530 59.791 1.00 0.00 C ATOM 1247 OH TYR A 80 -54.459 -27.498 59.031 1.00 0.00 O ATOM 0 H TYR A 80 -47.471 -26.910 60.975 1.00 0.00 H new ATOM 0 HA TYR A 80 -49.761 -25.389 62.140 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -49.004 -28.333 61.767 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -49.946 -27.939 63.191 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -50.040 -26.718 59.629 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -52.218 -28.464 62.841 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -52.085 -26.660 58.274 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -54.263 -28.408 61.485 1.00 0.00 H new ATOM 0 HH TYR A 80 -55.203 -27.871 59.548 1.00 0.00 H new ATOM 1457 N THR A 96 -40.537 -32.644 60.948 1.00 0.00 N ATOM 1458 CA THR A 96 -41.897 -33.163 61.319 1.00 0.00 C ATOM 1459 C THR A 96 -41.905 -33.691 62.763 1.00 0.00 C ATOM 1460 O THR A 96 -40.951 -34.331 63.159 1.00 0.00 O ATOM 1461 CB THR A 96 -42.228 -34.280 60.330 1.00 0.00 C ATOM 1462 OG1 THR A 96 -42.199 -33.626 59.070 1.00 0.00 O ATOM 1463 CG2 THR A 96 -43.669 -34.774 60.438 1.00 0.00 C ATOM 0 HA THR A 96 -42.642 -32.369 61.270 1.00 0.00 H new ATOM 0 HB THR A 96 -41.548 -35.116 60.493 1.00 0.00 H new ATOM 0 HG1 THR A 96 -41.435 -33.013 59.037 1.00 0.00 H new ATOM 0 HG21 THR A 96 -43.838 -35.566 59.709 1.00 0.00 H new ATOM 0 HG22 THR A 96 -43.847 -35.161 61.441 1.00 0.00 H new ATOM 0 HG23 THR A 96 -44.352 -33.948 60.241 1.00 0.00 H new ATOM 1471 N LEU A 97 -42.938 -33.440 63.535 1.00 0.00 N ATOM 1472 CA LEU A 97 -42.970 -33.939 64.936 1.00 0.00 C ATOM 1473 C LEU A 97 -43.997 -35.072 64.993 1.00 0.00 C ATOM 1474 O LEU A 97 -44.928 -35.110 64.214 1.00 0.00 O ATOM 1475 CB LEU A 97 -43.426 -32.821 65.864 1.00 0.00 C ATOM 1476 CG LEU A 97 -42.695 -31.489 65.660 1.00 0.00 C ATOM 1477 CD1 LEU A 97 -43.241 -30.500 66.676 1.00 0.00 C ATOM 1478 CD2 LEU A 97 -41.183 -31.565 65.872 1.00 0.00 C ATOM 0 H LEU A 97 -43.760 -32.909 63.248 1.00 0.00 H new ATOM 0 HA LEU A 97 -41.982 -34.282 65.243 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -44.495 -32.660 65.721 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -43.287 -33.143 66.896 1.00 0.00 H new ATOM 0 HG LEU A 97 -42.863 -31.194 64.624 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -42.739 -29.540 66.556 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -44.312 -30.371 66.519 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -43.064 -30.878 67.683 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -40.743 -30.581 65.708 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -40.974 -31.891 66.891 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -40.752 -32.277 65.168 1.00 0.00 H new ATOM 1490 N VAL A 98 -43.808 -35.977 65.918 1.00 0.00 N ATOM 1491 CA VAL A 98 -44.752 -37.126 66.071 1.00 0.00 C ATOM 1492 C VAL A 98 -45.085 -37.262 67.554 1.00 0.00 C ATOM 1493 O VAL A 98 -44.210 -37.451 68.376 1.00 0.00 O ATOM 1494 CB VAL A 98 -44.087 -38.402 65.575 1.00 0.00 C ATOM 1495 CG1 VAL A 98 -45.100 -39.557 65.687 1.00 0.00 C ATOM 1496 CG2 VAL A 98 -43.711 -38.220 64.103 1.00 0.00 C ATOM 0 H VAL A 98 -43.033 -35.970 66.581 1.00 0.00 H new ATOM 0 HA VAL A 98 -45.659 -36.956 65.491 1.00 0.00 H new ATOM 0 HB VAL A 98 -43.197 -38.620 66.166 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -44.640 -40.480 65.335 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -45.403 -39.676 66.727 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -45.976 -39.333 65.078 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -43.233 -39.128 63.735 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -44.610 -38.021 63.520 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -43.022 -37.382 64.005 1.00 0.00 H new ATOM 1506 N PHE A 99 -46.347 -37.162 67.868 1.00 0.00 N ATOM 1507 CA PHE A 99 -46.794 -37.282 69.292 1.00 0.00 C ATOM 1508 C PHE A 99 -47.648 -38.539 69.451 1.00 0.00 C ATOM 1509 O PHE A 99 -48.300 -38.979 68.527 1.00 0.00 O ATOM 1510 CB PHE A 99 -47.651 -36.082 69.689 1.00 0.00 C ATOM 1511 CG PHE A 99 -46.798 -34.833 69.909 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -46.343 -34.090 68.845 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -46.493 -34.433 71.194 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -45.593 -32.956 69.070 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -45.745 -33.300 71.425 1.00 0.00 C ATOM 1516 CZ PHE A 99 -45.291 -32.555 70.347 1.00 0.00 C ATOM 0 H PHE A 99 -47.097 -37.001 67.196 1.00 0.00 H new ATOM 0 HA PHE A 99 -45.908 -37.329 69.925 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -48.389 -35.887 68.911 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -48.202 -36.313 70.601 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -46.573 -34.395 67.835 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -46.846 -35.017 72.031 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -45.239 -32.376 68.231 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -45.514 -32.995 72.435 1.00 0.00 H new ATOM 0 HZ PHE A 99 -44.703 -31.664 70.512 1.00 0.00 H new ATOM 1526 N ASP A 100 -47.610 -39.075 70.638 1.00 0.00 N ATOM 1527 CA ASP A 100 -48.395 -40.302 70.978 1.00 0.00 C ATOM 1528 C ASP A 100 -49.199 -39.752 72.146 1.00 0.00 C ATOM 1529 O ASP A 100 -48.723 -39.771 73.263 1.00 0.00 O ATOM 1530 CB ASP A 100 -47.473 -41.419 71.443 1.00 0.00 C ATOM 1531 CG ASP A 100 -46.416 -41.679 70.368 1.00 0.00 C ATOM 1532 OD1 ASP A 100 -46.833 -42.015 69.272 1.00 0.00 O ATOM 1533 OD2 ASP A 100 -45.254 -41.524 70.707 1.00 0.00 O ATOM 0 H ASP A 100 -47.054 -38.706 71.409 1.00 0.00 H new ATOM 0 HA ASP A 100 -48.975 -40.733 70.162 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -46.994 -41.144 72.382 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -48.047 -42.326 71.632 1.00 0.00 H new ATOM 1538 N VAL A 101 -50.395 -39.271 71.899 1.00 0.00 N ATOM 1539 CA VAL A 101 -51.214 -38.699 73.028 1.00 0.00 C ATOM 1540 C VAL A 101 -52.393 -39.551 73.459 1.00 0.00 C ATOM 1541 O VAL A 101 -52.985 -40.286 72.694 1.00 0.00 O ATOM 1542 CB VAL A 101 -51.765 -37.324 72.619 1.00 0.00 C ATOM 1543 CG1 VAL A 101 -52.404 -36.606 73.837 1.00 0.00 C ATOM 1544 CG2 VAL A 101 -50.690 -36.485 71.941 1.00 0.00 C ATOM 0 H VAL A 101 -50.838 -39.247 70.981 1.00 0.00 H new ATOM 0 HA VAL A 101 -50.529 -38.645 73.874 1.00 0.00 H new ATOM 0 HB VAL A 101 -52.557 -37.468 71.884 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -52.788 -35.634 73.526 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -53.222 -37.211 74.228 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -51.652 -36.467 74.613 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -51.106 -35.517 71.662 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -49.857 -36.337 72.628 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -50.337 -36.999 71.047 1.00 0.00 H new ATOM 1554 N GLU A 102 -52.683 -39.396 74.722 1.00 0.00 N ATOM 1555 CA GLU A 102 -53.807 -40.115 75.380 1.00 0.00 C ATOM 1556 C GLU A 102 -54.676 -39.053 76.059 1.00 0.00 C ATOM 1557 O GLU A 102 -54.303 -38.560 77.107 1.00 0.00 O ATOM 1558 CB GLU A 102 -53.245 -41.086 76.419 1.00 0.00 C ATOM 1559 CG GLU A 102 -54.409 -41.841 77.066 1.00 0.00 C ATOM 1560 CD GLU A 102 -53.848 -42.829 78.091 1.00 0.00 C ATOM 1561 OE1 GLU A 102 -53.078 -43.673 77.661 1.00 0.00 O ATOM 1562 OE2 GLU A 102 -54.222 -42.683 79.243 1.00 0.00 O ATOM 0 H GLU A 102 -52.166 -38.777 75.346 1.00 0.00 H new ATOM 0 HA GLU A 102 -54.394 -40.687 74.661 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -52.556 -41.787 75.947 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -52.679 -40.543 77.176 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -55.090 -41.141 77.550 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -54.984 -42.371 76.306 1.00 0.00 H new ATOM 1569 N LEU A 103 -55.800 -38.695 75.482 1.00 0.00 N ATOM 1570 CA LEU A 103 -56.627 -37.655 76.179 1.00 0.00 C ATOM 1571 C LEU A 103 -57.197 -38.440 77.342 1.00 0.00 C ATOM 1572 O LEU A 103 -57.801 -39.482 77.165 1.00 0.00 O ATOM 1573 CB LEU A 103 -57.758 -37.137 75.256 1.00 0.00 C ATOM 1574 CG LEU A 103 -58.787 -36.239 76.027 1.00 0.00 C ATOM 1575 CD1 LEU A 103 -58.144 -34.933 76.597 1.00 0.00 C ATOM 1576 CD2 LEU A 103 -59.893 -35.833 75.039 1.00 0.00 C ATOM 0 H LEU A 103 -56.168 -39.056 74.602 1.00 0.00 H new ATOM 0 HA LEU A 103 -56.066 -36.769 76.475 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -57.323 -36.566 74.436 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -58.279 -37.985 74.812 1.00 0.00 H new ATOM 0 HG LEU A 103 -59.168 -36.816 76.870 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -58.903 -34.352 77.120 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -57.345 -35.194 77.291 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -57.735 -34.342 75.778 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -60.625 -35.206 75.549 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -59.454 -35.277 74.210 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -60.385 -36.727 74.656 1.00 0.00 H new ATOM 1588 N LEU A 104 -56.997 -37.914 78.520 1.00 0.00 N ATOM 1589 CA LEU A 104 -57.491 -38.594 79.753 1.00 0.00 C ATOM 1590 C LEU A 104 -58.858 -38.094 80.163 1.00 0.00 C ATOM 1591 O LEU A 104 -59.782 -38.864 80.338 1.00 0.00 O ATOM 1592 CB LEU A 104 -56.491 -38.340 80.873 1.00 0.00 C ATOM 1593 CG LEU A 104 -55.081 -38.810 80.415 1.00 0.00 C ATOM 1594 CD1 LEU A 104 -54.030 -38.120 81.241 1.00 0.00 C ATOM 1595 CD2 LEU A 104 -54.908 -40.327 80.624 1.00 0.00 C ATOM 0 H LEU A 104 -56.508 -37.034 78.683 1.00 0.00 H new ATOM 0 HA LEU A 104 -57.585 -39.661 79.551 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -56.470 -37.280 81.125 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -56.791 -38.876 81.774 1.00 0.00 H new ATOM 0 HG LEU A 104 -54.978 -38.569 79.357 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -53.041 -38.449 80.921 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -54.114 -37.041 81.109 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -54.172 -38.369 82.293 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -53.913 -40.628 80.295 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -55.029 -40.565 81.681 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -55.660 -40.862 80.044 1.00 0.00 H new ATOM 1607 N LYS A 105 -58.962 -36.807 80.310 1.00 0.00 N ATOM 1608 CA LYS A 105 -60.272 -36.249 80.712 1.00 0.00 C ATOM 1609 C LYS A 105 -60.248 -34.725 80.652 1.00 0.00 C ATOM 1610 O LYS A 105 -59.304 -34.127 80.176 1.00 0.00 O ATOM 1611 CB LYS A 105 -60.600 -36.783 82.163 1.00 0.00 C ATOM 1612 CG LYS A 105 -61.901 -37.616 82.138 1.00 0.00 C ATOM 1613 CD LYS A 105 -62.128 -38.379 83.462 1.00 0.00 C ATOM 1614 CE LYS A 105 -62.297 -37.423 84.655 1.00 0.00 C ATOM 1615 NZ LYS A 105 -60.984 -36.860 85.077 1.00 0.00 N ATOM 0 H LYS A 105 -58.211 -36.130 80.172 1.00 0.00 H new ATOM 0 HA LYS A 105 -61.056 -36.570 80.026 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -59.775 -37.393 82.530 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -60.708 -35.945 82.852 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -62.749 -36.958 81.950 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -61.860 -38.327 81.313 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -63.015 -39.007 83.372 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -61.284 -39.044 83.647 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -62.974 -36.613 84.384 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -62.754 -37.954 85.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -60.885 -36.945 86.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -60.216 -37.384 84.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -60.933 -35.857 84.806 1.00 0.00 H new ATOM 1629 N LEU A 106 -61.302 -34.123 81.140 1.00 0.00 N ATOM 1630 CA LEU A 106 -61.396 -32.627 81.138 1.00 0.00 C ATOM 1631 C LEU A 106 -61.490 -32.136 82.580 1.00 0.00 C ATOM 1632 O LEU A 106 -61.958 -32.831 83.459 1.00 0.00 O ATOM 1633 CB LEU A 106 -62.658 -32.185 80.383 1.00 0.00 C ATOM 1634 CG LEU A 106 -62.826 -32.972 79.082 1.00 0.00 C ATOM 1635 CD1 LEU A 106 -64.119 -32.499 78.412 1.00 0.00 C ATOM 1636 CD2 LEU A 106 -61.654 -32.720 78.127 1.00 0.00 C ATOM 0 H LEU A 106 -62.107 -34.603 81.542 1.00 0.00 H new ATOM 0 HA LEU A 106 -60.515 -32.210 80.650 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -63.534 -32.331 81.015 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -62.599 -31.119 80.162 1.00 0.00 H new ATOM 0 HG LEU A 106 -62.858 -34.038 79.309 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -64.266 -33.044 77.479 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -64.962 -32.684 79.077 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -64.050 -31.432 78.202 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -61.801 -33.293 77.211 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -61.602 -31.658 77.887 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -60.724 -33.030 78.603 1.00 0.00 H new ATOM 1648 N GLU A 107 -61.034 -30.929 82.776 1.00 0.00 N ATOM 1649 CA GLU A 107 -61.061 -30.299 84.138 1.00 0.00 C ATOM 1650 C GLU A 107 -61.624 -28.881 84.020 1.00 0.00 C ATOM 1651 O GLU A 107 -62.563 -28.614 84.751 1.00 0.00 O ATOM 1652 CB GLU A 107 -59.622 -30.291 84.698 1.00 0.00 C ATOM 1653 CG GLU A 107 -59.606 -29.635 86.085 1.00 0.00 C ATOM 1654 CD GLU A 107 -59.664 -28.108 85.977 1.00 0.00 C ATOM 1655 OE1 GLU A 107 -59.489 -27.624 84.871 1.00 0.00 O ATOM 1656 OE2 GLU A 107 -59.876 -27.509 87.020 1.00 0.00 O ATOM 1657 OXT GLU A 107 -61.083 -28.151 83.206 1.00 0.00 O ATOM 0 H GLU A 107 -60.637 -30.340 82.043 1.00 0.00 H new ATOM 0 HA GLU A 107 -61.699 -30.861 84.820 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -59.242 -31.311 84.764 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -58.962 -29.748 84.021 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -60.454 -29.993 86.669 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -58.703 -29.930 86.619 1.00 0.00 H new