USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=18 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 67 SER OG : rot -82:sc= 0.0937 USER MOD Set 1.3: A 70 GLN : amide:sc= -0.652 X(o=-0.56,f=-0.49) USER MOD Set 2.1: A 21 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 49 MET CE :methyl -177:sc= -0.719 (180deg=-0.738) USER MOD Single : A 3 GLN : amide:sc= -1.36! K(o=-1.4!,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -1.63! K(o=-1.6!,f=0) USER MOD Single : A 22 CYS SG : rot 65:sc= -0.636 USER MOD Single : A 25 HIS : no HD1:sc= -1.72! C(o=-1.7!,f=-3.2!) 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+ -161:sc= -0.0886 (180deg=-0.541) USER MOD Single : A 52 LYS NZ :NH3+ -159:sc= -0.121 (180deg=-0.817) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= -3.41! K(o=-3.4!,f=-1) USER MOD Single : A 66 MET CE :methyl 145:sc= -0.878 (180deg=-3.93!) USER MOD Single : A 73 LYS NZ :NH3+ -117:sc= -3.55 (180deg=-5.97!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 61:sc= -0.188! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 42:sc= 0.245 USER MOD Single : A 105 LYS NZ :NH3+ -130:sc= -4.49! (180deg=-6.11!) USER MOD ----------------------------------------------------------------- ATOM 10 N VAL A 2 -52.055 -31.588 59.841 1.00 0.00 N ATOM 11 CA VAL A 2 -51.771 -32.517 60.987 1.00 0.00 C ATOM 12 C VAL A 2 -52.525 -33.813 60.714 1.00 0.00 C ATOM 13 O VAL A 2 -53.562 -33.799 60.081 1.00 0.00 O ATOM 14 CB VAL A 2 -52.278 -31.895 62.302 1.00 0.00 C ATOM 15 CG1 VAL A 2 -53.802 -31.653 62.237 1.00 0.00 C ATOM 16 CG2 VAL A 2 -52.021 -32.883 63.450 1.00 0.00 C ATOM 0 HA VAL A 2 -50.700 -32.699 61.080 1.00 0.00 H new ATOM 0 HB VAL A 2 -51.758 -30.950 62.460 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -54.141 -31.213 63.175 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -54.028 -30.973 61.415 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -54.314 -32.601 62.075 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -52.376 -32.453 64.387 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -52.552 -33.815 63.254 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -50.952 -33.083 63.525 1.00 0.00 H new ATOM 26 N GLN A 3 -52.001 -34.913 61.188 1.00 0.00 N ATOM 27 CA GLN A 3 -52.686 -36.231 60.966 1.00 0.00 C ATOM 28 C GLN A 3 -53.022 -36.812 62.332 1.00 0.00 C ATOM 29 O GLN A 3 -52.342 -36.550 63.304 1.00 0.00 O ATOM 30 CB GLN A 3 -51.748 -37.172 60.224 1.00 0.00 C ATOM 31 CG GLN A 3 -51.385 -36.531 58.884 1.00 0.00 C ATOM 32 CD GLN A 3 -50.448 -37.468 58.119 1.00 0.00 C ATOM 33 OE1 GLN A 3 -50.044 -37.191 57.007 1.00 0.00 O ATOM 34 NE2 GLN A 3 -50.078 -38.587 58.680 1.00 0.00 N ATOM 0 H GLN A 3 -51.131 -34.961 61.718 1.00 0.00 H new ATOM 0 HA GLN A 3 -53.591 -36.101 60.373 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -50.849 -37.355 60.813 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -52.227 -38.138 60.065 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -52.286 -36.342 58.301 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -50.903 -35.567 59.046 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -50.414 -38.825 59.613 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -49.453 -39.223 58.185 1.00 0.00 H new ATOM 43 N VAL A 4 -54.073 -37.591 62.366 1.00 0.00 N ATOM 44 CA VAL A 4 -54.538 -38.245 63.633 1.00 0.00 C ATOM 45 C VAL A 4 -54.737 -39.738 63.382 1.00 0.00 C ATOM 46 O VAL A 4 -55.759 -40.149 62.869 1.00 0.00 O ATOM 47 CB VAL A 4 -55.869 -37.628 64.075 1.00 0.00 C ATOM 48 CG1 VAL A 4 -56.393 -38.330 65.348 1.00 0.00 C ATOM 49 CG2 VAL A 4 -55.597 -36.184 64.433 1.00 0.00 C ATOM 0 H VAL A 4 -54.644 -37.808 61.549 1.00 0.00 H new ATOM 0 HA VAL A 4 -53.792 -38.095 64.413 1.00 0.00 H new ATOM 0 HB VAL A 4 -56.603 -37.729 63.276 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -57.339 -37.880 65.649 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -56.544 -39.390 65.143 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -55.666 -38.216 66.152 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -56.524 -35.708 64.754 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -54.868 -36.141 65.242 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -55.203 -35.661 63.561 1.00 0.00 H new ATOM 59 N GLU A 5 -53.762 -40.525 63.744 1.00 0.00 N ATOM 60 CA GLU A 5 -53.857 -42.009 63.545 1.00 0.00 C ATOM 61 C GLU A 5 -54.199 -42.568 64.923 1.00 0.00 C ATOM 62 O GLU A 5 -53.428 -42.440 65.850 1.00 0.00 O ATOM 63 CB GLU A 5 -52.501 -42.536 63.065 1.00 0.00 C ATOM 64 CG GLU A 5 -52.500 -44.075 62.962 1.00 0.00 C ATOM 65 CD GLU A 5 -53.494 -44.565 61.903 1.00 0.00 C ATOM 66 OE1 GLU A 5 -54.680 -44.513 62.184 1.00 0.00 O ATOM 67 OE2 GLU A 5 -53.001 -44.968 60.862 1.00 0.00 O ATOM 0 H GLU A 5 -52.894 -40.206 64.173 1.00 0.00 H new ATOM 0 HA GLU A 5 -54.602 -42.296 62.802 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -52.265 -42.105 62.092 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -51.720 -42.215 63.754 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -51.498 -44.424 62.712 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -52.755 -44.506 63.930 1.00 0.00 H new ATOM 74 N THR A 6 -55.346 -43.184 65.042 1.00 0.00 N ATOM 75 CA THR A 6 -55.749 -43.750 66.370 1.00 0.00 C ATOM 76 C THR A 6 -55.313 -45.202 66.520 1.00 0.00 C ATOM 77 O THR A 6 -55.133 -45.924 65.559 1.00 0.00 O ATOM 78 CB THR A 6 -57.271 -43.650 66.497 1.00 0.00 C ATOM 79 OG1 THR A 6 -57.537 -42.259 66.388 1.00 0.00 O ATOM 80 CG2 THR A 6 -57.746 -44.013 67.912 1.00 0.00 C ATOM 0 H THR A 6 -56.018 -43.321 64.287 1.00 0.00 H new ATOM 0 HA THR A 6 -55.258 -43.179 67.158 1.00 0.00 H new ATOM 0 HB THR A 6 -57.749 -44.301 65.765 1.00 0.00 H new ATOM 0 HG1 THR A 6 -58.502 -42.104 66.458 1.00 0.00 H new ATOM 0 HG21 THR A 6 -58.832 -43.930 67.964 1.00 0.00 H new ATOM 0 HG22 THR A 6 -57.448 -45.035 68.145 1.00 0.00 H new ATOM 0 HG23 THR A 6 -57.296 -43.331 68.633 1.00 0.00 H new ATOM 88 N ILE A 7 -55.158 -45.578 67.761 1.00 0.00 N ATOM 89 CA ILE A 7 -54.736 -46.963 68.128 1.00 0.00 C ATOM 90 C ILE A 7 -55.809 -47.514 69.057 1.00 0.00 C ATOM 91 O ILE A 7 -56.323 -48.594 68.846 1.00 0.00 O ATOM 92 CB ILE A 7 -53.391 -46.923 68.866 1.00 0.00 C ATOM 93 CG1 ILE A 7 -52.363 -46.218 67.954 1.00 0.00 C ATOM 94 CG2 ILE A 7 -52.961 -48.392 69.100 1.00 0.00 C ATOM 95 CD1 ILE A 7 -51.118 -45.827 68.756 1.00 0.00 C ATOM 0 H ILE A 7 -55.311 -44.964 68.561 1.00 0.00 H new ATOM 0 HA ILE A 7 -54.620 -47.584 67.240 1.00 0.00 H new ATOM 0 HB ILE A 7 -53.460 -46.389 69.814 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -52.082 -46.878 67.133 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -52.811 -45.329 67.509 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -52.006 -48.412 69.624 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -53.715 -48.901 69.700 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -52.859 -48.899 68.140 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -50.403 -45.331 68.099 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -51.402 -45.149 69.561 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -50.662 -46.722 69.179 1.00 0.00 H new ATOM 107 N SER A 8 -56.131 -46.755 70.076 1.00 0.00 N ATOM 108 CA SER A 8 -57.182 -47.208 71.060 1.00 0.00 C ATOM 109 C SER A 8 -58.350 -46.218 71.151 1.00 0.00 C ATOM 110 O SER A 8 -58.390 -45.409 72.056 1.00 0.00 O ATOM 111 CB SER A 8 -56.549 -47.355 72.439 1.00 0.00 C ATOM 112 OG SER A 8 -55.479 -48.263 72.227 1.00 0.00 O ATOM 0 H SER A 8 -55.717 -45.844 70.274 1.00 0.00 H new ATOM 0 HA SER A 8 -57.575 -48.162 70.709 1.00 0.00 H new ATOM 0 HB2 SER A 8 -56.192 -46.398 72.819 1.00 0.00 H new ATOM 0 HB3 SER A 8 -57.262 -47.741 73.167 1.00 0.00 H new ATOM 0 HG SER A 8 -55.008 -48.417 73.073 1.00 0.00 H new ATOM 118 N PRO A 9 -59.273 -46.293 70.224 1.00 0.00 N ATOM 119 CA PRO A 9 -60.470 -45.422 70.225 1.00 0.00 C ATOM 120 C PRO A 9 -61.006 -45.162 71.634 1.00 0.00 C ATOM 121 O PRO A 9 -60.660 -45.844 72.579 1.00 0.00 O ATOM 122 CB PRO A 9 -61.429 -46.166 69.304 1.00 0.00 C ATOM 123 CG PRO A 9 -60.454 -46.699 68.227 1.00 0.00 C ATOM 124 CD PRO A 9 -59.277 -47.233 69.068 1.00 0.00 C ATOM 0 HA PRO A 9 -60.279 -44.409 69.872 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -61.954 -46.971 69.819 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -62.189 -45.508 68.882 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -60.908 -47.484 67.623 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -60.138 -45.912 67.542 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -59.434 -48.265 69.381 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -58.337 -47.207 68.517 1.00 0.00 H new ATOM 132 N GLY A 10 -61.851 -44.171 71.735 1.00 0.00 N ATOM 133 CA GLY A 10 -62.470 -43.790 73.047 1.00 0.00 C ATOM 134 C GLY A 10 -63.982 -43.907 72.879 1.00 0.00 C ATOM 135 O GLY A 10 -64.441 -44.399 71.867 1.00 0.00 O ATOM 0 H GLY A 10 -62.147 -43.594 70.948 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -62.119 -44.446 73.844 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -62.191 -42.774 73.324 1.00 0.00 H new ATOM 139 N ASP A 11 -64.723 -43.463 73.861 1.00 0.00 N ATOM 140 CA ASP A 11 -66.206 -43.546 73.762 1.00 0.00 C ATOM 141 C ASP A 11 -66.724 -43.225 72.354 1.00 0.00 C ATOM 142 O ASP A 11 -67.474 -43.988 71.778 1.00 0.00 O ATOM 143 CB ASP A 11 -66.801 -42.580 74.807 1.00 0.00 C ATOM 144 CG ASP A 11 -66.094 -41.222 74.762 1.00 0.00 C ATOM 145 OD1 ASP A 11 -66.234 -40.553 73.754 1.00 0.00 O ATOM 146 OD2 ASP A 11 -65.446 -40.932 75.755 1.00 0.00 O ATOM 0 H ASP A 11 -64.365 -43.049 74.722 1.00 0.00 H new ATOM 0 HA ASP A 11 -66.520 -44.571 73.962 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -67.866 -42.446 74.619 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -66.705 -43.012 75.803 1.00 0.00 H new ATOM 151 N GLY A 12 -66.312 -42.101 71.827 1.00 0.00 N ATOM 152 CA GLY A 12 -66.753 -41.687 70.457 1.00 0.00 C ATOM 153 C GLY A 12 -67.870 -40.659 70.600 1.00 0.00 C ATOM 154 O GLY A 12 -68.466 -40.232 69.632 1.00 0.00 O ATOM 0 H GLY A 12 -65.683 -41.445 72.290 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -65.916 -41.263 69.902 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -67.104 -42.552 69.894 1.00 0.00 H new ATOM 158 N ARG A 13 -68.122 -40.289 71.831 1.00 0.00 N ATOM 159 CA ARG A 13 -69.191 -39.290 72.157 1.00 0.00 C ATOM 160 C ARG A 13 -68.668 -38.056 72.899 1.00 0.00 C ATOM 161 O ARG A 13 -69.163 -36.970 72.671 1.00 0.00 O ATOM 162 CB ARG A 13 -70.252 -39.986 73.005 1.00 0.00 C ATOM 163 CG ARG A 13 -70.791 -41.178 72.210 1.00 0.00 C ATOM 164 CD ARG A 13 -71.906 -41.847 73.014 1.00 0.00 C ATOM 165 NE ARG A 13 -73.006 -40.844 73.198 1.00 0.00 N ATOM 166 CZ ARG A 13 -74.213 -41.065 72.742 1.00 0.00 C ATOM 167 NH1 ARG A 13 -74.710 -42.269 72.827 1.00 0.00 N ATOM 168 NH2 ARG A 13 -74.882 -40.074 72.218 1.00 0.00 N ATOM 0 H ARG A 13 -67.620 -40.646 72.644 1.00 0.00 H new ATOM 0 HA ARG A 13 -69.602 -38.927 71.215 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -69.824 -40.321 73.950 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -71.059 -39.294 73.248 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -71.170 -40.846 71.244 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -69.991 -41.891 72.010 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -72.277 -42.729 72.492 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -71.531 -42.183 73.980 1.00 0.00 H new ATOM 0 HE ARG A 13 -72.809 -39.972 73.689 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -74.159 -43.020 73.244 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -75.649 -42.459 72.477 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -74.463 -39.145 72.169 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -75.824 -40.228 71.858 1.00 0.00 H new ATOM 182 N THR A 14 -67.695 -38.207 73.769 1.00 0.00 N ATOM 183 CA THR A 14 -67.164 -37.011 74.520 1.00 0.00 C ATOM 184 C THR A 14 -65.778 -36.572 74.060 1.00 0.00 C ATOM 185 O THR A 14 -64.902 -37.377 73.812 1.00 0.00 O ATOM 186 CB THR A 14 -67.074 -37.351 75.994 1.00 0.00 C ATOM 187 OG1 THR A 14 -68.378 -37.793 76.344 1.00 0.00 O ATOM 188 CG2 THR A 14 -66.859 -36.091 76.844 1.00 0.00 C ATOM 0 H THR A 14 -67.247 -39.095 73.993 1.00 0.00 H new ATOM 0 HA THR A 14 -67.856 -36.192 74.325 1.00 0.00 H new ATOM 0 HB THR A 14 -66.264 -38.061 76.161 1.00 0.00 H new ATOM 0 HG1 THR A 14 -68.398 -38.035 77.293 1.00 0.00 H new ATOM 0 HG21 THR A 14 -66.799 -36.368 77.896 1.00 0.00 H new ATOM 0 HG22 THR A 14 -65.932 -35.603 76.543 1.00 0.00 H new ATOM 0 HG23 THR A 14 -67.694 -35.406 76.697 1.00 0.00 H new ATOM 196 N PHE A 15 -65.624 -35.275 73.963 1.00 0.00 N ATOM 197 CA PHE A 15 -64.330 -34.654 73.534 1.00 0.00 C ATOM 198 C PHE A 15 -64.041 -33.521 74.528 1.00 0.00 C ATOM 199 O PHE A 15 -64.874 -33.264 75.374 1.00 0.00 O ATOM 200 CB PHE A 15 -64.495 -34.101 72.124 1.00 0.00 C ATOM 201 CG PHE A 15 -64.890 -35.247 71.191 1.00 0.00 C ATOM 202 CD1 PHE A 15 -66.172 -35.757 71.221 1.00 0.00 C ATOM 203 CD2 PHE A 15 -63.970 -35.777 70.311 1.00 0.00 C ATOM 204 CE1 PHE A 15 -66.531 -36.789 70.378 1.00 0.00 C ATOM 205 CE2 PHE A 15 -64.325 -36.809 69.465 1.00 0.00 C ATOM 206 CZ PHE A 15 -65.607 -37.314 69.498 1.00 0.00 C ATOM 0 H PHE A 15 -66.362 -34.601 74.169 1.00 0.00 H new ATOM 0 HA PHE A 15 -63.510 -35.372 73.525 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -65.258 -33.323 72.110 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -63.565 -33.642 71.787 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -66.898 -35.347 71.907 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -62.965 -35.382 70.283 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -67.535 -37.186 70.407 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -63.599 -37.220 68.779 1.00 0.00 H new ATOM 0 HZ PHE A 15 -65.888 -38.120 68.836 1.00 0.00 H new ATOM 216 N PRO A 16 -62.913 -32.855 74.447 1.00 0.00 N ATOM 217 CA PRO A 16 -62.757 -31.567 75.167 1.00 0.00 C ATOM 218 C PRO A 16 -63.700 -30.515 74.569 1.00 0.00 C ATOM 219 O PRO A 16 -63.946 -30.513 73.378 1.00 0.00 O ATOM 220 CB PRO A 16 -61.273 -31.214 75.001 1.00 0.00 C ATOM 221 CG PRO A 16 -60.614 -32.572 74.644 1.00 0.00 C ATOM 222 CD PRO A 16 -61.662 -33.235 73.729 1.00 0.00 C ATOM 0 HA PRO A 16 -63.023 -31.618 76.223 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -61.122 -30.476 74.214 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -60.856 -30.794 75.916 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -59.661 -32.436 74.134 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -60.417 -33.171 75.533 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -61.632 -32.846 72.711 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -61.532 -34.315 73.662 1.00 0.00 H new ATOM 230 N LYS A 17 -64.213 -29.638 75.396 1.00 0.00 N ATOM 231 CA LYS A 17 -65.138 -28.569 74.933 1.00 0.00 C ATOM 232 C LYS A 17 -64.576 -27.168 75.202 1.00 0.00 C ATOM 233 O LYS A 17 -63.596 -26.982 75.898 1.00 0.00 O ATOM 234 CB LYS A 17 -66.423 -28.765 75.666 1.00 0.00 C ATOM 235 CG LYS A 17 -67.038 -30.099 75.240 1.00 0.00 C ATOM 236 CD LYS A 17 -68.371 -30.285 75.968 1.00 0.00 C ATOM 237 CE LYS A 17 -68.977 -31.620 75.530 1.00 0.00 C ATOM 238 NZ LYS A 17 -70.286 -31.829 76.209 1.00 0.00 N ATOM 0 H LYS A 17 -64.021 -29.622 76.398 1.00 0.00 H new ATOM 0 HA LYS A 17 -65.278 -28.639 73.854 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -66.248 -28.757 76.742 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -67.110 -27.947 75.449 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -67.192 -30.116 74.161 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -66.361 -30.919 75.478 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -68.219 -30.273 77.047 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -69.049 -29.465 75.733 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -69.113 -31.630 74.449 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -68.296 -32.436 75.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -70.692 -32.737 75.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -70.145 -31.838 77.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -70.936 -31.058 75.955 1.00 0.00 H new ATOM 252 N ARG A 18 -65.253 -26.209 74.628 1.00 0.00 N ATOM 253 CA ARG A 18 -64.875 -24.789 74.760 1.00 0.00 C ATOM 254 C ARG A 18 -65.348 -24.249 76.106 1.00 0.00 C ATOM 255 O ARG A 18 -66.513 -23.963 76.297 1.00 0.00 O ATOM 256 CB ARG A 18 -65.517 -23.985 73.622 1.00 0.00 C ATOM 257 CG ARG A 18 -65.087 -22.515 73.753 1.00 0.00 C ATOM 258 CD ARG A 18 -65.633 -21.722 72.565 1.00 0.00 C ATOM 259 NE ARG A 18 -65.226 -20.290 72.752 1.00 0.00 N ATOM 260 CZ ARG A 18 -64.467 -19.673 71.882 1.00 0.00 C ATOM 261 NH1 ARG A 18 -63.663 -20.378 71.133 1.00 0.00 N ATOM 262 NH2 ARG A 18 -64.541 -18.373 71.792 1.00 0.00 N ATOM 0 H ARG A 18 -66.081 -26.368 74.054 1.00 0.00 H new ATOM 0 HA ARG A 18 -63.790 -24.696 74.704 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -65.208 -24.384 72.656 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -66.603 -24.066 73.668 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -65.461 -22.096 74.687 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -64.000 -22.443 73.784 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -65.237 -22.114 71.628 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -66.718 -21.808 72.513 1.00 0.00 H new ATOM 0 HE ARG A 18 -65.549 -19.785 73.577 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -63.633 -21.393 71.231 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -63.064 -19.914 70.450 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -65.182 -17.856 72.394 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -63.958 -17.874 71.120 1.00 0.00 H new ATOM 276 N GLY A 19 -64.418 -24.121 77.013 1.00 0.00 N ATOM 277 CA GLY A 19 -64.734 -23.606 78.382 1.00 0.00 C ATOM 278 C GLY A 19 -64.168 -24.585 79.406 1.00 0.00 C ATOM 279 O GLY A 19 -64.133 -24.301 80.586 1.00 0.00 O ATOM 0 H GLY A 19 -63.436 -24.354 76.863 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -64.301 -22.616 78.524 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -65.812 -23.504 78.510 1.00 0.00 H new ATOM 283 N GLN A 20 -63.731 -25.727 78.934 1.00 0.00 N ATOM 284 CA GLN A 20 -63.151 -26.765 79.853 1.00 0.00 C ATOM 285 C GLN A 20 -61.670 -26.961 79.527 1.00 0.00 C ATOM 286 O GLN A 20 -61.149 -26.384 78.595 1.00 0.00 O ATOM 287 CB GLN A 20 -63.905 -28.079 79.654 1.00 0.00 C ATOM 288 CG GLN A 20 -65.376 -27.854 80.015 1.00 0.00 C ATOM 289 CD GLN A 20 -66.138 -29.172 79.847 1.00 0.00 C ATOM 290 OE1 GLN A 20 -67.334 -29.241 80.048 1.00 0.00 O ATOM 291 NE2 GLN A 20 -65.482 -30.238 79.481 1.00 0.00 N ATOM 0 H GLN A 20 -63.750 -25.989 77.948 1.00 0.00 H new ATOM 0 HA GLN A 20 -63.248 -26.442 80.890 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -63.815 -28.414 78.621 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -63.476 -28.861 80.281 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -65.461 -27.498 81.042 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -65.808 -27.085 79.374 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -64.478 -30.185 79.311 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -65.973 -31.124 79.365 1.00 0.00 H new ATOM 300 N THR A 21 -61.025 -27.783 80.309 1.00 0.00 N ATOM 301 CA THR A 21 -59.569 -28.069 80.107 1.00 0.00 C ATOM 302 C THR A 21 -59.460 -29.530 79.669 1.00 0.00 C ATOM 303 O THR A 21 -60.385 -30.299 79.838 1.00 0.00 O ATOM 304 CB THR A 21 -58.850 -27.850 81.433 1.00 0.00 C ATOM 305 OG1 THR A 21 -59.143 -26.501 81.765 1.00 0.00 O ATOM 306 CG2 THR A 21 -57.333 -27.862 81.262 1.00 0.00 C ATOM 0 H THR A 21 -61.450 -28.278 81.093 1.00 0.00 H new ATOM 0 HA THR A 21 -59.120 -27.420 79.355 1.00 0.00 H new ATOM 0 HB THR A 21 -59.152 -28.614 82.149 1.00 0.00 H new ATOM 0 HG1 THR A 21 -58.715 -26.273 82.617 1.00 0.00 H new ATOM 0 HG21 THR A 21 -56.857 -27.703 82.229 1.00 0.00 H new ATOM 0 HG22 THR A 21 -57.020 -28.825 80.857 1.00 0.00 H new ATOM 0 HG23 THR A 21 -57.038 -27.067 80.577 1.00 0.00 H new ATOM 314 N CYS A 22 -58.327 -29.870 79.122 1.00 0.00 N ATOM 315 CA CYS A 22 -58.066 -31.260 78.644 1.00 0.00 C ATOM 316 C CYS A 22 -56.955 -31.778 79.554 1.00 0.00 C ATOM 317 O CYS A 22 -56.082 -31.020 79.917 1.00 0.00 O ATOM 318 CB CYS A 22 -57.601 -31.177 77.175 1.00 0.00 C ATOM 319 SG CYS A 22 -58.334 -29.842 76.201 1.00 0.00 S ATOM 0 H CYS A 22 -57.549 -29.226 78.982 1.00 0.00 H new ATOM 0 HA CYS A 22 -58.935 -31.917 78.680 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -56.517 -31.061 77.161 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -57.826 -32.125 76.687 1.00 0.00 H new ATOM 0 HG CYS A 22 -57.955 -28.695 76.682 1.00 0.00 H new ATOM 325 N VAL A 23 -57.013 -33.036 79.896 1.00 0.00 N ATOM 326 CA VAL A 23 -55.977 -33.662 80.781 1.00 0.00 C ATOM 327 C VAL A 23 -55.356 -34.731 79.895 1.00 0.00 C ATOM 328 O VAL A 23 -55.945 -35.777 79.698 1.00 0.00 O ATOM 329 CB VAL A 23 -56.653 -34.290 81.995 1.00 0.00 C ATOM 330 CG1 VAL A 23 -55.581 -34.883 82.901 1.00 0.00 C ATOM 331 CG2 VAL A 23 -57.390 -33.187 82.754 1.00 0.00 C ATOM 0 H VAL A 23 -57.750 -33.674 79.595 1.00 0.00 H new ATOM 0 HA VAL A 23 -55.241 -32.955 81.163 1.00 0.00 H new ATOM 0 HB VAL A 23 -57.349 -35.070 81.686 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -56.052 -35.336 83.774 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -55.023 -35.643 82.355 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -54.901 -34.095 83.224 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -57.882 -33.613 83.628 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -56.677 -32.427 83.074 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -58.137 -32.733 82.102 1.00 0.00 H new ATOM 341 N VAL A 24 -54.185 -34.430 79.382 1.00 0.00 N ATOM 342 CA VAL A 24 -53.445 -35.376 78.473 1.00 0.00 C ATOM 343 C VAL A 24 -52.032 -35.778 78.940 1.00 0.00 C ATOM 344 O VAL A 24 -51.358 -35.042 79.632 1.00 0.00 O ATOM 345 CB VAL A 24 -53.284 -34.716 77.088 1.00 0.00 C ATOM 346 CG1 VAL A 24 -54.590 -34.048 76.666 1.00 0.00 C ATOM 347 CG2 VAL A 24 -52.243 -33.545 77.113 1.00 0.00 C ATOM 0 H VAL A 24 -53.698 -33.551 79.557 1.00 0.00 H new ATOM 0 HA VAL A 24 -54.049 -36.283 78.463 1.00 0.00 H new ATOM 0 HB VAL A 24 -52.972 -35.515 76.415 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -54.463 -33.586 75.687 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -55.381 -34.796 76.614 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -54.860 -33.284 77.395 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -52.161 -33.109 76.117 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -52.572 -32.781 77.818 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -51.271 -33.929 77.422 1.00 0.00 H new ATOM 357 N HIS A 25 -51.639 -36.957 78.525 1.00 0.00 N ATOM 358 CA HIS A 25 -50.284 -37.518 78.854 1.00 0.00 C ATOM 359 C HIS A 25 -49.764 -37.950 77.499 1.00 0.00 C ATOM 360 O HIS A 25 -50.429 -38.663 76.775 1.00 0.00 O ATOM 361 CB HIS A 25 -50.372 -38.741 79.787 1.00 0.00 C ATOM 362 CG HIS A 25 -49.028 -39.476 79.812 1.00 0.00 C ATOM 363 ND1 HIS A 25 -48.497 -40.085 78.803 1.00 0.00 N ATOM 364 CD2 HIS A 25 -48.121 -39.656 80.839 1.00 0.00 C ATOM 365 CE1 HIS A 25 -47.362 -40.602 79.156 1.00 0.00 C ATOM 366 NE2 HIS A 25 -47.089 -40.359 80.414 1.00 0.00 N ATOM 0 H HIS A 25 -52.217 -37.575 77.955 1.00 0.00 H new ATOM 0 HA HIS A 25 -49.654 -36.796 79.374 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -50.641 -38.422 80.794 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -51.158 -39.414 79.445 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -48.240 -39.276 81.843 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -46.720 -41.164 78.494 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -46.266 -40.647 80.944 1.00 0.00 H new ATOM 374 N TYR A 26 -48.578 -37.510 77.171 1.00 0.00 N ATOM 375 CA TYR A 26 -47.974 -37.867 75.847 1.00 0.00 C ATOM 376 C TYR A 26 -46.482 -38.188 75.875 1.00 0.00 C ATOM 377 O TYR A 26 -45.810 -38.095 76.883 1.00 0.00 O ATOM 378 CB TYR A 26 -48.202 -36.706 74.956 1.00 0.00 C ATOM 379 CG TYR A 26 -47.525 -35.516 75.649 1.00 0.00 C ATOM 380 CD1 TYR A 26 -46.164 -35.275 75.533 1.00 0.00 C ATOM 381 CD2 TYR A 26 -48.291 -34.663 76.413 1.00 0.00 C ATOM 382 CE1 TYR A 26 -45.589 -34.189 76.177 1.00 0.00 C ATOM 383 CE2 TYR A 26 -47.725 -33.590 77.045 1.00 0.00 C ATOM 384 CZ TYR A 26 -46.372 -33.339 76.935 1.00 0.00 C ATOM 385 OH TYR A 26 -45.809 -32.253 77.576 1.00 0.00 O ATOM 0 H TYR A 26 -47.997 -36.916 77.763 1.00 0.00 H new ATOM 0 HA TYR A 26 -48.450 -38.787 75.507 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -47.775 -36.880 73.968 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -49.267 -36.523 74.815 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -45.550 -35.935 74.939 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -49.351 -34.844 76.514 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -44.528 -34.008 76.086 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -48.344 -32.932 77.637 1.00 0.00 H new ATOM 0 HH TYR A 26 -46.505 -31.763 78.062 1.00 0.00 H new ATOM 395 N THR A 27 -46.031 -38.567 74.709 1.00 0.00 N ATOM 396 CA THR A 27 -44.607 -38.921 74.471 1.00 0.00 C ATOM 397 C THR A 27 -44.265 -38.157 73.185 1.00 0.00 C ATOM 398 O THR A 27 -44.905 -38.364 72.172 1.00 0.00 O ATOM 399 CB THR A 27 -44.483 -40.414 74.250 1.00 0.00 C ATOM 400 OG1 THR A 27 -45.032 -40.995 75.425 1.00 0.00 O ATOM 401 CG2 THR A 27 -43.013 -40.837 74.269 1.00 0.00 C ATOM 0 H THR A 27 -46.620 -38.648 73.880 1.00 0.00 H new ATOM 0 HA THR A 27 -43.948 -38.669 75.302 1.00 0.00 H new ATOM 0 HB THR A 27 -44.953 -40.701 73.310 1.00 0.00 H new ATOM 0 HG1 THR A 27 -44.989 -41.972 75.358 1.00 0.00 H new ATOM 0 HG21 THR A 27 -42.942 -41.913 74.109 1.00 0.00 H new ATOM 0 HG22 THR A 27 -42.474 -40.316 73.478 1.00 0.00 H new ATOM 0 HG23 THR A 27 -42.574 -40.584 75.234 1.00 0.00 H new ATOM 409 N GLY A 28 -43.282 -37.294 73.227 1.00 0.00 N ATOM 410 CA GLY A 28 -42.902 -36.515 71.999 1.00 0.00 C ATOM 411 C GLY A 28 -41.611 -37.075 71.404 1.00 0.00 C ATOM 412 O GLY A 28 -40.593 -37.148 72.062 1.00 0.00 O ATOM 0 H GLY A 28 -42.723 -37.092 74.056 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -43.704 -36.567 71.263 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -42.769 -35.463 72.252 1.00 0.00 H new ATOM 416 N MET A 29 -41.695 -37.460 70.156 1.00 0.00 N ATOM 417 CA MET A 29 -40.520 -38.034 69.440 1.00 0.00 C ATOM 418 C MET A 29 -40.543 -37.550 67.995 1.00 0.00 C ATOM 419 O MET A 29 -41.451 -36.861 67.575 1.00 0.00 O ATOM 420 CB MET A 29 -40.637 -39.572 69.561 1.00 0.00 C ATOM 421 CG MET A 29 -39.400 -40.301 69.012 1.00 0.00 C ATOM 422 SD MET A 29 -39.279 -42.070 69.377 1.00 0.00 S ATOM 423 CE MET A 29 -40.282 -42.672 67.996 1.00 0.00 C ATOM 0 H MET A 29 -42.545 -37.399 69.595 1.00 0.00 H new ATOM 0 HA MET A 29 -39.566 -37.718 69.863 1.00 0.00 H new ATOM 0 HB2 MET A 29 -40.779 -39.841 70.608 1.00 0.00 H new ATOM 0 HB3 MET A 29 -41.523 -39.909 69.022 1.00 0.00 H new ATOM 0 HG2 MET A 29 -39.381 -40.174 67.930 1.00 0.00 H new ATOM 0 HG3 MET A 29 -38.511 -39.809 69.407 1.00 0.00 H new ATOM 0 HE1 MET A 29 -40.337 -43.760 68.034 1.00 0.00 H new ATOM 0 HE2 MET A 29 -41.287 -42.255 68.067 1.00 0.00 H new ATOM 0 HE3 MET A 29 -39.827 -42.364 67.055 1.00 0.00 H new ATOM 694 N PHE A 46 -50.049 -33.381 81.583 1.00 0.00 N ATOM 695 CA PHE A 46 -50.149 -31.988 81.070 1.00 0.00 C ATOM 696 C PHE A 46 -51.620 -31.579 80.987 1.00 0.00 C ATOM 697 O PHE A 46 -52.465 -32.380 80.640 1.00 0.00 O ATOM 698 CB PHE A 46 -49.503 -32.014 79.749 1.00 0.00 C ATOM 699 CG PHE A 46 -49.405 -30.647 79.108 1.00 0.00 C ATOM 700 CD1 PHE A 46 -48.577 -29.714 79.677 1.00 0.00 C ATOM 701 CD2 PHE A 46 -50.122 -30.331 77.979 1.00 0.00 C ATOM 702 CE1 PHE A 46 -48.459 -28.455 79.130 1.00 0.00 C ATOM 703 CE2 PHE A 46 -50.010 -29.075 77.424 1.00 0.00 C ATOM 704 CZ PHE A 46 -49.179 -28.135 77.998 1.00 0.00 C ATOM 0 HA PHE A 46 -49.664 -31.257 81.717 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -48.502 -32.434 79.849 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -50.063 -32.678 79.091 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -48.012 -29.968 80.562 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -50.772 -31.066 77.528 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -47.807 -27.724 79.585 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -50.574 -28.826 76.537 1.00 0.00 H new ATOM 0 HZ PHE A 46 -49.093 -27.151 77.562 1.00 0.00 H new ATOM 714 N LYS A 47 -51.911 -30.339 81.304 1.00 0.00 N ATOM 715 CA LYS A 47 -53.331 -29.839 81.259 1.00 0.00 C ATOM 716 C LYS A 47 -53.484 -28.504 80.513 1.00 0.00 C ATOM 717 O LYS A 47 -52.891 -27.520 80.910 1.00 0.00 O ATOM 718 CB LYS A 47 -53.834 -29.660 82.685 1.00 0.00 C ATOM 719 CG LYS A 47 -53.713 -31.004 83.418 1.00 0.00 C ATOM 720 CD LYS A 47 -54.400 -30.950 84.799 1.00 0.00 C ATOM 721 CE LYS A 47 -53.696 -29.959 85.740 1.00 0.00 C ATOM 722 NZ LYS A 47 -52.245 -30.285 85.835 1.00 0.00 N ATOM 0 H LYS A 47 -51.223 -29.644 81.595 1.00 0.00 H new ATOM 0 HA LYS A 47 -53.913 -30.581 80.713 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -53.252 -28.895 83.199 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -54.871 -29.323 82.681 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -54.164 -31.792 82.815 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -52.661 -31.260 83.542 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -55.443 -30.659 84.676 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -54.397 -31.944 85.247 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -53.825 -28.941 85.371 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -54.151 -29.999 86.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -51.845 -29.843 86.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -52.124 -31.316 85.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -51.752 -29.923 84.994 1.00 0.00 H new ATOM 736 N PHE A 48 -54.261 -28.465 79.454 1.00 0.00 N ATOM 737 CA PHE A 48 -54.431 -27.160 78.708 1.00 0.00 C ATOM 738 C PHE A 48 -55.876 -26.922 78.273 1.00 0.00 C ATOM 739 O PHE A 48 -56.712 -27.793 78.379 1.00 0.00 O ATOM 740 CB PHE A 48 -53.517 -27.142 77.461 1.00 0.00 C ATOM 741 CG PHE A 48 -54.012 -28.059 76.329 1.00 0.00 C ATOM 742 CD1 PHE A 48 -53.847 -29.433 76.380 1.00 0.00 C ATOM 743 CD2 PHE A 48 -54.632 -27.498 75.224 1.00 0.00 C ATOM 744 CE1 PHE A 48 -54.295 -30.224 75.338 1.00 0.00 C ATOM 745 CE2 PHE A 48 -55.078 -28.291 74.187 1.00 0.00 C ATOM 746 CZ PHE A 48 -54.908 -29.654 74.245 1.00 0.00 C ATOM 0 H PHE A 48 -54.778 -29.259 79.075 1.00 0.00 H new ATOM 0 HA PHE A 48 -54.153 -26.361 79.395 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -53.445 -26.121 77.087 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -52.512 -27.446 77.752 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -53.368 -29.887 77.235 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -54.768 -26.428 75.174 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -54.163 -31.295 75.382 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -55.560 -27.842 73.331 1.00 0.00 H new ATOM 0 HZ PHE A 48 -55.255 -30.277 73.434 1.00 0.00 H new ATOM 756 N MET A 49 -56.146 -25.736 77.785 1.00 0.00 N ATOM 757 CA MET A 49 -57.534 -25.387 77.331 1.00 0.00 C ATOM 758 C MET A 49 -57.635 -25.102 75.832 1.00 0.00 C ATOM 759 O MET A 49 -56.679 -24.716 75.190 1.00 0.00 O ATOM 760 CB MET A 49 -57.968 -24.192 78.118 1.00 0.00 C ATOM 761 CG MET A 49 -59.357 -23.692 77.693 1.00 0.00 C ATOM 762 SD MET A 49 -60.096 -22.387 78.707 1.00 0.00 S ATOM 763 CE MET A 49 -60.870 -23.466 79.937 1.00 0.00 C ATOM 0 H MET A 49 -55.461 -24.987 77.680 1.00 0.00 H new ATOM 0 HA MET A 49 -58.182 -26.246 77.504 1.00 0.00 H new ATOM 0 HB2 MET A 49 -57.983 -24.443 79.179 1.00 0.00 H new ATOM 0 HB3 MET A 49 -57.240 -23.391 77.990 1.00 0.00 H new ATOM 0 HG2 MET A 49 -59.289 -23.329 76.668 1.00 0.00 H new ATOM 0 HG3 MET A 49 -60.038 -24.543 77.685 1.00 0.00 H new ATOM 0 HE1 MET A 49 -61.437 -22.862 80.645 1.00 0.00 H new ATOM 0 HE2 MET A 49 -61.541 -24.165 79.437 1.00 0.00 H new ATOM 0 HE3 MET A 49 -60.099 -24.022 80.470 1.00 0.00 H new ATOM 773 N LEU A 50 -58.822 -25.310 75.319 1.00 0.00 N ATOM 774 CA LEU A 50 -59.140 -25.094 73.884 1.00 0.00 C ATOM 775 C LEU A 50 -59.641 -23.672 73.619 1.00 0.00 C ATOM 776 O LEU A 50 -60.634 -23.245 74.173 1.00 0.00 O ATOM 777 CB LEU A 50 -60.198 -26.117 73.520 1.00 0.00 C ATOM 778 CG LEU A 50 -60.768 -25.912 72.112 1.00 0.00 C ATOM 779 CD1 LEU A 50 -59.669 -26.023 71.070 1.00 0.00 C ATOM 780 CD2 LEU A 50 -61.794 -27.000 71.858 1.00 0.00 C ATOM 0 H LEU A 50 -59.617 -25.636 75.869 1.00 0.00 H new ATOM 0 HA LEU A 50 -58.245 -25.214 73.274 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -59.769 -27.117 73.591 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -61.010 -26.067 74.246 1.00 0.00 H new ATOM 0 HG LEU A 50 -61.217 -24.921 72.042 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -60.093 -25.875 70.077 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -58.911 -25.263 71.258 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -59.213 -27.011 71.126 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -62.216 -26.877 70.861 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -61.315 -27.976 71.931 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -62.590 -26.930 72.600 1.00 0.00 H new ATOM 792 N GLY A 51 -58.939 -22.969 72.774 1.00 0.00 N ATOM 793 CA GLY A 51 -59.336 -21.565 72.432 1.00 0.00 C ATOM 794 C GLY A 51 -58.554 -20.549 73.263 1.00 0.00 C ATOM 795 O GLY A 51 -58.897 -19.383 73.299 1.00 0.00 O ATOM 0 H GLY A 51 -58.101 -23.305 72.300 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -59.160 -21.383 71.372 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -60.404 -21.434 72.605 1.00 0.00 H new ATOM 799 N LYS A 52 -57.518 -21.002 73.920 1.00 0.00 N ATOM 800 CA LYS A 52 -56.680 -20.094 74.767 1.00 0.00 C ATOM 801 C LYS A 52 -55.243 -20.169 74.237 1.00 0.00 C ATOM 802 O LYS A 52 -54.303 -19.873 74.945 1.00 0.00 O ATOM 803 CB LYS A 52 -56.797 -20.603 76.209 1.00 0.00 C ATOM 804 CG LYS A 52 -56.246 -19.578 77.200 1.00 0.00 C ATOM 805 CD LYS A 52 -56.494 -20.108 78.614 1.00 0.00 C ATOM 806 CE LYS A 52 -55.905 -19.118 79.620 1.00 0.00 C ATOM 807 NZ LYS A 52 -54.438 -18.982 79.389 1.00 0.00 N ATOM 0 H LYS A 52 -57.211 -21.975 73.907 1.00 0.00 H new ATOM 0 HA LYS A 52 -56.998 -19.052 74.736 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -57.841 -20.813 76.441 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -56.253 -21.542 76.312 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -55.180 -19.421 77.033 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -56.736 -18.614 77.063 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -57.563 -20.233 78.788 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -56.034 -21.089 78.736 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -56.391 -18.148 79.517 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -56.093 -19.463 80.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -53.984 -18.615 80.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -54.036 -19.912 79.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -54.270 -18.324 78.601 1.00 0.00 H new ATOM 821 N GLN A 53 -55.141 -20.555 72.989 1.00 0.00 N ATOM 822 CA GLN A 53 -53.824 -20.693 72.291 1.00 0.00 C ATOM 823 C GLN A 53 -52.643 -20.908 73.239 1.00 0.00 C ATOM 824 O GLN A 53 -51.794 -20.055 73.408 1.00 0.00 O ATOM 825 CB GLN A 53 -53.595 -19.433 71.457 1.00 0.00 C ATOM 826 CG GLN A 53 -54.736 -19.318 70.440 1.00 0.00 C ATOM 827 CD GLN A 53 -54.527 -18.062 69.594 1.00 0.00 C ATOM 828 OE1 GLN A 53 -53.523 -17.905 68.928 1.00 0.00 O ATOM 829 NE2 GLN A 53 -55.454 -17.143 69.593 1.00 0.00 N ATOM 0 H GLN A 53 -55.945 -20.788 72.406 1.00 0.00 H new ATOM 0 HA GLN A 53 -53.873 -21.587 71.669 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -53.567 -18.552 72.099 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -52.634 -19.485 70.946 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -54.761 -20.201 69.802 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -55.695 -19.269 70.955 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -56.299 -17.270 70.150 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -55.334 -16.298 69.035 1.00 0.00 H new ATOM 838 N GLU A 54 -52.637 -22.071 73.837 1.00 0.00 N ATOM 839 CA GLU A 54 -51.561 -22.461 74.801 1.00 0.00 C ATOM 840 C GLU A 54 -50.668 -23.477 74.099 1.00 0.00 C ATOM 841 O GLU A 54 -49.469 -23.495 74.292 1.00 0.00 O ATOM 842 CB GLU A 54 -52.166 -23.119 76.045 1.00 0.00 C ATOM 843 CG GLU A 54 -53.113 -22.153 76.762 1.00 0.00 C ATOM 844 CD GLU A 54 -52.339 -20.900 77.178 1.00 0.00 C ATOM 845 OE1 GLU A 54 -51.392 -21.078 77.927 1.00 0.00 O ATOM 846 OE2 GLU A 54 -52.739 -19.840 76.725 1.00 0.00 O ATOM 0 H GLU A 54 -53.351 -22.786 73.694 1.00 0.00 H new ATOM 0 HA GLU A 54 -51.003 -21.578 75.111 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -52.707 -24.021 75.759 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -51.370 -23.426 76.723 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -53.940 -21.882 76.106 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -53.546 -22.634 77.639 1.00 0.00 H new ATOM 853 N VAL A 55 -51.275 -24.310 73.289 1.00 0.00 N ATOM 854 CA VAL A 55 -50.492 -25.356 72.543 1.00 0.00 C ATOM 855 C VAL A 55 -50.583 -25.121 71.038 1.00 0.00 C ATOM 856 O VAL A 55 -51.540 -24.562 70.539 1.00 0.00 O ATOM 857 CB VAL A 55 -51.059 -26.744 72.872 1.00 0.00 C ATOM 858 CG1 VAL A 55 -51.044 -26.946 74.378 1.00 0.00 C ATOM 859 CG2 VAL A 55 -52.504 -26.890 72.389 1.00 0.00 C ATOM 0 H VAL A 55 -52.279 -24.314 73.109 1.00 0.00 H new ATOM 0 HA VAL A 55 -49.447 -25.295 72.847 1.00 0.00 H new ATOM 0 HB VAL A 55 -50.440 -27.485 72.366 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -51.446 -27.931 74.617 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -50.020 -26.873 74.745 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -51.655 -26.179 74.854 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -52.872 -27.885 72.639 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -53.128 -26.139 72.875 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -52.542 -26.750 71.309 1.00 0.00 H new ATOM 869 N ILE A 56 -49.564 -25.561 70.351 1.00 0.00 N ATOM 870 CA ILE A 56 -49.541 -25.392 68.869 1.00 0.00 C ATOM 871 C ILE A 56 -50.869 -25.866 68.275 1.00 0.00 C ATOM 872 O ILE A 56 -51.734 -26.341 68.984 1.00 0.00 O ATOM 873 CB ILE A 56 -48.375 -26.222 68.282 1.00 0.00 C ATOM 874 CG1 ILE A 56 -48.327 -27.564 69.061 1.00 0.00 C ATOM 875 CG2 ILE A 56 -47.065 -25.425 68.475 1.00 0.00 C ATOM 876 CD1 ILE A 56 -47.445 -28.602 68.371 1.00 0.00 C ATOM 0 H ILE A 56 -48.749 -26.028 70.749 1.00 0.00 H new ATOM 0 HA ILE A 56 -49.399 -24.340 68.622 1.00 0.00 H new ATOM 0 HB ILE A 56 -48.507 -26.421 67.218 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -47.952 -27.384 70.069 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -49.338 -27.959 69.163 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -46.230 -25.994 68.067 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -47.141 -24.469 67.956 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -46.899 -25.249 69.538 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -47.443 -29.523 68.954 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -47.834 -28.804 67.373 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -46.427 -28.220 68.293 1.00 0.00 H new ATOM 888 N ARG A 57 -51.008 -25.727 66.983 1.00 0.00 N ATOM 889 CA ARG A 57 -52.254 -26.155 66.315 1.00 0.00 C ATOM 890 C ARG A 57 -52.287 -27.681 66.319 1.00 0.00 C ATOM 891 O ARG A 57 -53.199 -28.251 66.883 1.00 0.00 O ATOM 892 CB ARG A 57 -52.244 -25.588 64.893 1.00 0.00 C ATOM 893 CG ARG A 57 -53.595 -25.848 64.227 1.00 0.00 C ATOM 894 CD ARG A 57 -53.591 -25.153 62.861 1.00 0.00 C ATOM 895 NE ARG A 57 -53.374 -23.685 63.091 1.00 0.00 N ATOM 896 CZ ARG A 57 -54.239 -22.791 62.681 1.00 0.00 C ATOM 897 NH1 ARG A 57 -55.016 -23.079 61.673 1.00 0.00 N ATOM 898 NH2 ARG A 57 -54.294 -21.640 63.295 1.00 0.00 N ATOM 0 H ARG A 57 -50.301 -25.331 66.364 1.00 0.00 H new ATOM 0 HA ARG A 57 -53.145 -25.790 66.825 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -52.040 -24.518 64.919 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -51.446 -26.050 64.312 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -53.762 -26.919 64.109 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -54.406 -25.465 64.847 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -52.803 -25.561 62.228 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -54.535 -25.323 62.344 1.00 0.00 H new ATOM 0 HE ARG A 57 -52.533 -23.377 63.578 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -54.944 -23.989 61.217 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -55.695 -22.394 61.341 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -53.670 -21.450 64.079 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -54.961 -20.931 62.990 1.00 0.00 H new ATOM 912 N GLY A 58 -51.304 -28.279 65.684 1.00 0.00 N ATOM 913 CA GLY A 58 -51.163 -29.765 65.595 1.00 0.00 C ATOM 914 C GLY A 58 -51.869 -30.487 66.736 1.00 0.00 C ATOM 915 O GLY A 58 -52.473 -31.525 66.558 1.00 0.00 O ATOM 0 H GLY A 58 -50.562 -27.770 65.203 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -51.570 -30.109 64.644 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -50.105 -30.028 65.602 1.00 0.00 H new ATOM 919 N TRP A 59 -51.761 -29.895 67.896 1.00 0.00 N ATOM 920 CA TRP A 59 -52.399 -30.475 69.113 1.00 0.00 C ATOM 921 C TRP A 59 -53.864 -30.031 69.113 1.00 0.00 C ATOM 922 O TRP A 59 -54.750 -30.837 68.912 1.00 0.00 O ATOM 923 CB TRP A 59 -51.690 -29.928 70.387 1.00 0.00 C ATOM 924 CG TRP A 59 -50.698 -30.906 71.041 1.00 0.00 C ATOM 925 CD1 TRP A 59 -49.721 -31.564 70.379 1.00 0.00 C ATOM 926 CD2 TRP A 59 -50.619 -31.218 72.355 1.00 0.00 C ATOM 927 NE1 TRP A 59 -49.091 -32.238 71.324 1.00 0.00 N ATOM 928 CE2 TRP A 59 -49.563 -32.098 72.567 1.00 0.00 C ATOM 929 CE3 TRP A 59 -51.401 -30.813 73.430 1.00 0.00 C ATOM 930 CZ2 TRP A 59 -49.326 -32.541 73.868 1.00 0.00 C ATOM 931 CZ3 TRP A 59 -51.148 -31.264 74.685 1.00 0.00 C ATOM 932 CH2 TRP A 59 -50.111 -32.128 74.909 1.00 0.00 C ATOM 0 H TRP A 59 -51.252 -29.025 68.053 1.00 0.00 H new ATOM 0 HA TRP A 59 -52.321 -31.562 69.111 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -51.158 -29.013 70.126 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -52.449 -29.657 71.121 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -49.505 -31.543 69.321 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -48.289 -32.833 71.117 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -52.221 -30.130 73.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -48.509 -33.222 74.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -51.767 -30.940 75.509 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -49.912 -32.484 75.909 1.00 0.00 H new ATOM 943 N GLU A 60 -54.050 -28.747 69.348 1.00 0.00 N ATOM 944 CA GLU A 60 -55.412 -28.111 69.393 1.00 0.00 C ATOM 945 C GLU A 60 -56.367 -28.851 68.457 1.00 0.00 C ATOM 946 O GLU A 60 -57.374 -29.388 68.872 1.00 0.00 O ATOM 947 CB GLU A 60 -55.239 -26.648 68.987 1.00 0.00 C ATOM 948 CG GLU A 60 -56.503 -25.803 69.260 1.00 0.00 C ATOM 949 CD GLU A 60 -57.716 -26.301 68.465 1.00 0.00 C ATOM 950 OE1 GLU A 60 -58.349 -27.225 68.946 1.00 0.00 O ATOM 951 OE2 GLU A 60 -57.936 -25.721 67.414 1.00 0.00 O ATOM 0 H GLU A 60 -53.286 -28.093 69.516 1.00 0.00 H new ATOM 0 HA GLU A 60 -55.845 -28.166 70.392 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -54.396 -26.221 69.531 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -54.993 -26.596 67.926 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -56.733 -25.830 70.325 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -56.305 -24.762 69.003 1.00 0.00 H new ATOM 958 N GLU A 61 -55.999 -28.861 67.205 1.00 0.00 N ATOM 959 CA GLU A 61 -56.830 -29.548 66.206 1.00 0.00 C ATOM 960 C GLU A 61 -56.711 -31.026 66.562 1.00 0.00 C ATOM 961 O GLU A 61 -57.692 -31.723 66.731 1.00 0.00 O ATOM 962 CB GLU A 61 -56.269 -29.270 64.808 1.00 0.00 C ATOM 963 CG GLU A 61 -57.026 -30.081 63.738 1.00 0.00 C ATOM 964 CD GLU A 61 -58.501 -29.668 63.675 1.00 0.00 C ATOM 965 OE1 GLU A 61 -59.209 -29.994 64.614 1.00 0.00 O ATOM 966 OE2 GLU A 61 -58.837 -29.046 62.681 1.00 0.00 O ATOM 0 H GLU A 61 -55.155 -28.419 66.841 1.00 0.00 H new ATOM 0 HA GLU A 61 -57.869 -29.218 66.206 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -56.347 -28.206 64.586 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -55.209 -29.524 64.780 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -56.560 -29.928 62.764 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -56.952 -31.145 63.963 1.00 0.00 H new ATOM 973 N GLY A 62 -55.482 -31.458 66.667 1.00 0.00 N ATOM 974 CA GLY A 62 -55.225 -32.872 67.011 1.00 0.00 C ATOM 975 C GLY A 62 -56.032 -33.300 68.231 1.00 0.00 C ATOM 976 O GLY A 62 -57.136 -33.781 68.108 1.00 0.00 O ATOM 0 H GLY A 62 -54.649 -30.886 66.528 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -55.480 -33.507 66.163 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -54.162 -33.013 67.207 1.00 0.00 H new ATOM 980 N VAL A 63 -55.442 -33.105 69.383 1.00 0.00 N ATOM 981 CA VAL A 63 -56.101 -33.472 70.668 1.00 0.00 C ATOM 982 C VAL A 63 -57.623 -33.334 70.623 1.00 0.00 C ATOM 983 O VAL A 63 -58.331 -34.228 71.038 1.00 0.00 O ATOM 984 CB VAL A 63 -55.522 -32.591 71.772 1.00 0.00 C ATOM 985 CG1 VAL A 63 -56.125 -33.074 73.104 1.00 0.00 C ATOM 986 CG2 VAL A 63 -53.970 -32.699 71.809 1.00 0.00 C ATOM 0 H VAL A 63 -54.512 -32.698 69.486 1.00 0.00 H new ATOM 0 HA VAL A 63 -55.900 -34.526 70.862 1.00 0.00 H new ATOM 0 HB VAL A 63 -55.769 -31.545 71.592 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -55.735 -32.467 73.921 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -57.210 -32.979 73.068 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -55.857 -34.118 73.267 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -53.580 -32.063 72.603 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -53.682 -33.733 71.998 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -53.560 -32.377 70.852 1.00 0.00 H new ATOM 996 N ALA A 64 -58.116 -32.224 70.144 1.00 0.00 N ATOM 997 CA ALA A 64 -59.603 -32.059 70.078 1.00 0.00 C ATOM 998 C ALA A 64 -60.258 -33.309 69.496 1.00 0.00 C ATOM 999 O ALA A 64 -61.076 -33.987 70.084 1.00 0.00 O ATOM 1000 CB ALA A 64 -59.943 -30.887 69.177 1.00 0.00 C ATOM 0 H ALA A 64 -57.568 -31.435 69.800 1.00 0.00 H new ATOM 0 HA ALA A 64 -59.972 -31.889 71.089 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -61.025 -30.767 69.129 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -59.495 -29.978 69.578 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -59.554 -31.073 68.176 1.00 0.00 H new ATOM 1006 N GLN A 65 -59.800 -33.516 68.301 1.00 0.00 N ATOM 1007 CA GLN A 65 -60.201 -34.627 67.415 1.00 0.00 C ATOM 1008 C GLN A 65 -60.152 -35.937 68.196 1.00 0.00 C ATOM 1009 O GLN A 65 -60.640 -36.949 67.737 1.00 0.00 O ATOM 1010 CB GLN A 65 -59.227 -34.535 66.225 1.00 0.00 C ATOM 1011 CG GLN A 65 -59.714 -35.239 64.968 1.00 0.00 C ATOM 1012 CD GLN A 65 -58.770 -34.843 63.810 1.00 0.00 C ATOM 1013 OE1 GLN A 65 -58.842 -35.396 62.732 1.00 0.00 O ATOM 1014 NE2 GLN A 65 -57.875 -33.895 63.980 1.00 0.00 N ATOM 0 H GLN A 65 -59.105 -32.903 67.874 1.00 0.00 H new ATOM 0 HA GLN A 65 -61.225 -34.576 67.044 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -59.050 -33.484 65.995 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -58.269 -34.963 66.520 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -59.712 -36.320 65.110 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -60.740 -34.949 64.741 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -57.800 -33.419 64.879 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -57.255 -33.635 63.213 1.00 0.00 H new ATOM 1023 N MET A 66 -59.561 -35.904 69.370 1.00 0.00 N ATOM 1024 CA MET A 66 -59.492 -37.176 70.186 1.00 0.00 C ATOM 1025 C MET A 66 -60.639 -37.151 71.208 1.00 0.00 C ATOM 1026 O MET A 66 -61.119 -36.093 71.564 1.00 0.00 O ATOM 1027 CB MET A 66 -58.160 -37.250 70.933 1.00 0.00 C ATOM 1028 CG MET A 66 -57.020 -37.143 69.921 1.00 0.00 C ATOM 1029 SD MET A 66 -55.334 -37.132 70.583 1.00 0.00 S ATOM 1030 CE MET A 66 -55.258 -38.854 71.132 1.00 0.00 C ATOM 0 H MET A 66 -59.133 -35.081 69.794 1.00 0.00 H new ATOM 0 HA MET A 66 -59.577 -38.041 69.529 1.00 0.00 H new ATOM 0 HB2 MET A 66 -58.092 -36.444 71.664 1.00 0.00 H new ATOM 0 HB3 MET A 66 -58.088 -38.188 71.484 1.00 0.00 H new ATOM 0 HG2 MET A 66 -57.105 -37.977 69.225 1.00 0.00 H new ATOM 0 HG3 MET A 66 -57.164 -36.230 69.344 1.00 0.00 H new ATOM 0 HE1 MET A 66 -54.248 -39.237 70.988 1.00 0.00 H new ATOM 0 HE2 MET A 66 -55.521 -38.911 72.188 1.00 0.00 H new ATOM 0 HE3 MET A 66 -55.959 -39.453 70.551 1.00 0.00 H new ATOM 1040 N SER A 67 -61.060 -38.306 71.671 1.00 0.00 N ATOM 1041 CA SER A 67 -62.187 -38.381 72.673 1.00 0.00 C ATOM 1042 C SER A 67 -61.803 -39.040 74.002 1.00 0.00 C ATOM 1043 O SER A 67 -60.978 -39.930 74.071 1.00 0.00 O ATOM 1044 CB SER A 67 -63.333 -39.170 72.046 1.00 0.00 C ATOM 1045 OG SER A 67 -62.735 -40.418 71.731 1.00 0.00 O ATOM 0 H SER A 67 -60.672 -39.209 71.399 1.00 0.00 H new ATOM 0 HA SER A 67 -62.468 -37.355 72.910 1.00 0.00 H new ATOM 0 HB2 SER A 67 -64.167 -39.287 72.738 1.00 0.00 H new ATOM 0 HB3 SER A 67 -63.723 -38.675 71.157 1.00 0.00 H new ATOM 0 HG SER A 67 -62.255 -40.345 70.879 1.00 0.00 H new ATOM 1051 N VAL A 68 -62.448 -38.547 75.024 1.00 0.00 N ATOM 1052 CA VAL A 68 -62.225 -39.044 76.410 1.00 0.00 C ATOM 1053 C VAL A 68 -61.981 -40.546 76.502 1.00 0.00 C ATOM 1054 O VAL A 68 -62.916 -41.323 76.535 1.00 0.00 O ATOM 1055 CB VAL A 68 -63.448 -38.658 77.250 1.00 0.00 C ATOM 1056 CG1 VAL A 68 -63.292 -39.114 78.702 1.00 0.00 C ATOM 1057 CG2 VAL A 68 -63.594 -37.136 77.236 1.00 0.00 C ATOM 0 H VAL A 68 -63.139 -37.800 74.952 1.00 0.00 H new ATOM 0 HA VAL A 68 -61.312 -38.581 76.784 1.00 0.00 H new ATOM 0 HB VAL A 68 -64.325 -39.144 76.822 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -64.176 -38.825 79.271 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -63.179 -40.198 78.733 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -62.410 -38.644 79.138 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -64.461 -36.848 77.830 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -62.698 -36.681 77.657 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -63.727 -36.793 76.210 1.00 0.00 H new ATOM 1067 N GLY A 69 -60.736 -40.942 76.543 1.00 0.00 N ATOM 1068 CA GLY A 69 -60.413 -42.401 76.636 1.00 0.00 C ATOM 1069 C GLY A 69 -59.832 -42.852 75.309 1.00 0.00 C ATOM 1070 O GLY A 69 -59.717 -44.032 75.038 1.00 0.00 O ATOM 0 H GLY A 69 -59.928 -40.321 76.516 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -59.701 -42.581 77.442 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -61.311 -42.973 76.870 1.00 0.00 H new ATOM 1074 N GLN A 70 -59.473 -41.891 74.498 1.00 0.00 N ATOM 1075 CA GLN A 70 -58.881 -42.213 73.154 1.00 0.00 C ATOM 1076 C GLN A 70 -57.409 -41.856 73.143 1.00 0.00 C ATOM 1077 O GLN A 70 -56.999 -40.830 73.648 1.00 0.00 O ATOM 1078 CB GLN A 70 -59.582 -41.400 72.046 1.00 0.00 C ATOM 1079 CG GLN A 70 -58.899 -41.677 70.686 1.00 0.00 C ATOM 1080 CD GLN A 70 -59.691 -41.003 69.563 1.00 0.00 C ATOM 1081 OE1 GLN A 70 -60.891 -41.159 69.448 1.00 0.00 O ATOM 1082 NE2 GLN A 70 -59.051 -40.246 68.711 1.00 0.00 N ATOM 0 H GLN A 70 -59.562 -40.896 74.703 1.00 0.00 H new ATOM 0 HA GLN A 70 -59.016 -43.279 72.970 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -60.637 -41.669 71.996 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -59.535 -40.336 72.277 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -57.876 -41.301 70.699 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -58.841 -42.751 70.509 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -58.044 -40.112 68.804 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -59.559 -39.789 67.953 1.00 0.00 H new ATOM 1091 N ARG A 71 -56.641 -42.735 72.553 1.00 0.00 N ATOM 1092 CA ARG A 71 -55.167 -42.529 72.445 1.00 0.00 C ATOM 1093 C ARG A 71 -54.830 -42.680 70.985 1.00 0.00 C ATOM 1094 O ARG A 71 -55.326 -43.551 70.290 1.00 0.00 O ATOM 1095 CB ARG A 71 -54.432 -43.572 73.277 1.00 0.00 C ATOM 1096 CG ARG A 71 -52.882 -43.499 73.088 1.00 0.00 C ATOM 1097 CD ARG A 71 -52.387 -44.519 72.038 1.00 0.00 C ATOM 1098 NE ARG A 71 -52.557 -45.897 72.604 1.00 0.00 N ATOM 1099 CZ ARG A 71 -51.529 -46.680 72.815 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -50.458 -46.530 72.085 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -51.609 -47.587 73.751 1.00 0.00 N ATOM 0 H ARG A 71 -56.980 -43.601 72.135 1.00 0.00 H new ATOM 0 HA ARG A 71 -54.868 -41.549 72.817 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -54.674 -43.430 74.330 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -54.783 -44.566 73.001 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -52.600 -42.492 72.779 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -52.389 -43.690 74.041 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -52.953 -44.416 71.112 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -51.341 -44.335 71.794 1.00 0.00 H new ATOM 0 HE ARG A 71 -53.494 -46.232 72.830 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -50.430 -45.811 71.362 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -49.649 -47.132 72.237 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -52.462 -47.676 74.303 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -50.818 -48.206 73.930 1.00 0.00 H new ATOM 1115 N ALA A 72 -53.959 -41.795 70.591 1.00 0.00 N ATOM 1116 CA ALA A 72 -53.488 -41.756 69.168 1.00 0.00 C ATOM 1117 C ALA A 72 -52.034 -41.374 68.996 1.00 0.00 C ATOM 1118 O ALA A 72 -51.325 -41.082 69.936 1.00 0.00 O ATOM 1119 CB ALA A 72 -54.320 -40.751 68.382 1.00 0.00 C ATOM 0 H ALA A 72 -53.545 -41.086 71.197 1.00 0.00 H new ATOM 0 HA ALA A 72 -53.604 -42.776 68.801 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -53.976 -40.724 67.348 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -55.369 -41.047 68.408 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -54.211 -39.762 68.827 1.00 0.00 H new ATOM 1125 N LYS A 73 -51.680 -41.400 67.740 1.00 0.00 N ATOM 1126 CA LYS A 73 -50.314 -41.066 67.254 1.00 0.00 C ATOM 1127 C LYS A 73 -50.547 -39.960 66.226 1.00 0.00 C ATOM 1128 O LYS A 73 -50.984 -40.212 65.121 1.00 0.00 O ATOM 1129 CB LYS A 73 -49.683 -42.303 66.595 1.00 0.00 C ATOM 1130 CG LYS A 73 -48.265 -41.943 66.109 1.00 0.00 C ATOM 1131 CD LYS A 73 -47.638 -43.081 65.272 1.00 0.00 C ATOM 1132 CE LYS A 73 -47.372 -44.338 66.117 1.00 0.00 C ATOM 1133 NZ LYS A 73 -48.640 -45.052 66.428 1.00 0.00 N ATOM 0 H LYS A 73 -52.324 -41.655 66.991 1.00 0.00 H new ATOM 0 HA LYS A 73 -49.637 -40.753 68.049 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -49.639 -43.128 67.306 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -50.295 -42.637 65.757 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -48.306 -41.033 65.511 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -47.629 -41.731 66.969 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -48.304 -43.333 64.447 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -46.702 -42.735 64.833 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -46.698 -45.005 65.580 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -46.872 -44.058 67.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -48.794 -45.054 67.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -49.434 -44.570 65.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -48.580 -46.032 66.085 1.00 0.00 H new ATOM 1147 N LEU A 74 -50.249 -38.753 66.617 1.00 0.00 N ATOM 1148 CA LEU A 74 -50.449 -37.600 65.682 1.00 0.00 C ATOM 1149 C LEU A 74 -49.108 -37.225 65.069 1.00 0.00 C ATOM 1150 O LEU A 74 -48.078 -37.328 65.702 1.00 0.00 O ATOM 1151 CB LEU A 74 -50.995 -36.391 66.434 1.00 0.00 C ATOM 1152 CG LEU A 74 -52.375 -36.681 67.085 1.00 0.00 C ATOM 1153 CD1 LEU A 74 -52.247 -37.359 68.458 1.00 0.00 C ATOM 1154 CD2 LEU A 74 -53.135 -35.373 67.268 1.00 0.00 C ATOM 0 H LEU A 74 -49.878 -38.511 67.536 1.00 0.00 H new ATOM 0 HA LEU A 74 -51.160 -37.892 64.909 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -50.286 -36.095 67.207 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -51.088 -35.550 65.747 1.00 0.00 H new ATOM 0 HG LEU A 74 -52.906 -37.359 66.417 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -53.240 -37.539 68.869 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -51.722 -38.308 68.348 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -51.687 -36.711 69.133 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -54.104 -35.576 67.725 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -52.562 -34.706 67.913 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -53.284 -34.900 66.297 1.00 0.00 H new ATOM 1166 N THR A 75 -49.161 -36.795 63.836 1.00 0.00 N ATOM 1167 CA THR A 75 -47.924 -36.388 63.091 1.00 0.00 C ATOM 1168 C THR A 75 -48.110 -34.938 62.663 1.00 0.00 C ATOM 1169 O THR A 75 -48.846 -34.649 61.738 1.00 0.00 O ATOM 1170 CB THR A 75 -47.752 -37.280 61.862 1.00 0.00 C ATOM 1171 OG1 THR A 75 -47.706 -38.598 62.391 1.00 0.00 O ATOM 1172 CG2 THR A 75 -46.365 -37.082 61.251 1.00 0.00 C ATOM 0 H THR A 75 -50.024 -36.706 63.300 1.00 0.00 H new ATOM 0 HA THR A 75 -47.037 -36.491 63.717 1.00 0.00 H new ATOM 0 HB THR A 75 -48.533 -37.078 61.129 1.00 0.00 H new ATOM 0 HG1 THR A 75 -47.597 -39.241 61.659 1.00 0.00 H new ATOM 0 HG21 THR A 75 -46.258 -37.724 60.377 1.00 0.00 H new ATOM 0 HG22 THR A 75 -46.244 -36.040 60.954 1.00 0.00 H new ATOM 0 HG23 THR A 75 -45.603 -37.340 61.987 1.00 0.00 H new ATOM 1180 N ILE A 76 -47.439 -34.053 63.355 1.00 0.00 N ATOM 1181 CA ILE A 76 -47.521 -32.603 63.057 1.00 0.00 C ATOM 1182 C ILE A 76 -46.390 -32.137 62.151 1.00 0.00 C ATOM 1183 O ILE A 76 -45.262 -32.568 62.275 1.00 0.00 O ATOM 1184 CB ILE A 76 -47.454 -31.900 64.385 1.00 0.00 C ATOM 1185 CG1 ILE A 76 -48.396 -32.626 65.409 1.00 0.00 C ATOM 1186 CG2 ILE A 76 -47.836 -30.420 64.163 1.00 0.00 C ATOM 1187 CD1 ILE A 76 -47.648 -33.572 66.344 1.00 0.00 C ATOM 0 H ILE A 76 -46.823 -34.288 64.133 1.00 0.00 H new ATOM 0 HA ILE A 76 -48.444 -32.379 62.522 1.00 0.00 H new ATOM 0 HB ILE A 76 -46.449 -31.932 64.806 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -48.922 -31.878 66.003 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -49.153 -33.188 64.862 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -47.795 -29.887 65.113 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -47.137 -29.965 63.461 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -48.846 -30.362 63.758 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -48.355 -34.043 67.027 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -47.144 -34.340 65.757 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -46.910 -33.010 66.916 1.00 0.00 H new ATOM 1199 N SER A 77 -46.738 -31.246 61.259 1.00 0.00 N ATOM 1200 CA SER A 77 -45.755 -30.671 60.278 1.00 0.00 C ATOM 1201 C SER A 77 -45.565 -29.178 60.613 1.00 0.00 C ATOM 1202 O SER A 77 -46.461 -28.575 61.169 1.00 0.00 O ATOM 1203 CB SER A 77 -46.360 -30.886 58.881 1.00 0.00 C ATOM 1204 OG SER A 77 -47.689 -30.411 59.034 1.00 0.00 O ATOM 0 H SER A 77 -47.686 -30.881 61.164 1.00 0.00 H new ATOM 0 HA SER A 77 -44.774 -31.144 60.319 1.00 0.00 H new ATOM 0 HB2 SER A 77 -45.818 -30.330 58.116 1.00 0.00 H new ATOM 0 HB3 SER A 77 -46.337 -31.936 58.588 1.00 0.00 H new ATOM 0 HG SER A 77 -47.671 -29.463 59.283 1.00 0.00 H new ATOM 1210 N PRO A 78 -44.433 -28.602 60.283 1.00 0.00 N ATOM 1211 CA PRO A 78 -44.103 -27.215 60.703 1.00 0.00 C ATOM 1212 C PRO A 78 -45.301 -26.265 60.621 1.00 0.00 C ATOM 1213 O PRO A 78 -45.570 -25.515 61.535 1.00 0.00 O ATOM 1214 CB PRO A 78 -42.913 -26.823 59.783 1.00 0.00 C ATOM 1215 CG PRO A 78 -42.916 -27.912 58.683 1.00 0.00 C ATOM 1216 CD PRO A 78 -43.340 -29.168 59.448 1.00 0.00 C ATOM 0 HA PRO A 78 -43.832 -27.146 61.756 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -43.047 -25.828 59.360 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -41.971 -26.812 60.331 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -43.613 -27.673 57.880 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -41.933 -28.029 58.227 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -43.688 -29.961 58.787 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -42.530 -29.585 60.047 1.00 0.00 H new ATOM 1224 N ASP A 79 -45.985 -26.324 59.514 1.00 0.00 N ATOM 1225 CA ASP A 79 -47.170 -25.461 59.298 1.00 0.00 C ATOM 1226 C ASP A 79 -48.102 -25.377 60.511 1.00 0.00 C ATOM 1227 O ASP A 79 -48.689 -24.346 60.775 1.00 0.00 O ATOM 1228 CB ASP A 79 -47.919 -26.003 58.062 1.00 0.00 C ATOM 1229 CG ASP A 79 -48.039 -27.530 58.127 1.00 0.00 C ATOM 1230 OD1 ASP A 79 -46.999 -28.146 58.289 1.00 0.00 O ATOM 1231 OD2 ASP A 79 -49.159 -27.997 58.004 1.00 0.00 O ATOM 0 H ASP A 79 -45.765 -26.947 58.737 1.00 0.00 H new ATOM 0 HA ASP A 79 -46.828 -24.438 59.139 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -48.912 -25.557 58.008 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -47.390 -25.713 57.154 1.00 0.00 H new ATOM 1236 N TYR A 80 -48.224 -26.468 61.230 1.00 0.00 N ATOM 1237 CA TYR A 80 -49.109 -26.524 62.437 1.00 0.00 C ATOM 1238 C TYR A 80 -48.313 -26.465 63.747 1.00 0.00 C ATOM 1239 O TYR A 80 -48.789 -26.919 64.769 1.00 0.00 O ATOM 1240 CB TYR A 80 -49.916 -27.842 62.352 1.00 0.00 C ATOM 1241 CG TYR A 80 -51.166 -27.687 61.461 1.00 0.00 C ATOM 1242 CD1 TYR A 80 -51.079 -27.150 60.191 1.00 0.00 C ATOM 1243 CD2 TYR A 80 -52.405 -28.088 61.928 1.00 0.00 C ATOM 1244 CE1 TYR A 80 -52.208 -27.015 59.407 1.00 0.00 C ATOM 1245 CE2 TYR A 80 -53.532 -27.952 61.144 1.00 0.00 C ATOM 1246 CZ TYR A 80 -53.441 -27.414 59.877 1.00 0.00 C ATOM 1247 OH TYR A 80 -54.567 -27.279 59.091 1.00 0.00 O ATOM 0 H TYR A 80 -47.736 -27.340 61.026 1.00 0.00 H new ATOM 0 HA TYR A 80 -49.768 -25.656 62.445 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -49.281 -28.633 61.954 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -50.218 -28.149 63.353 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -50.120 -26.833 59.808 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -52.491 -28.512 62.917 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -52.124 -26.593 58.416 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -54.492 -28.269 61.525 1.00 0.00 H new ATOM 0 HH TYR A 80 -55.349 -27.612 59.580 1.00 0.00 H new ATOM 1457 N THR A 96 -40.625 -32.727 61.487 1.00 0.00 N ATOM 1458 CA THR A 96 -41.966 -33.304 61.819 1.00 0.00 C ATOM 1459 C THR A 96 -41.911 -33.882 63.234 1.00 0.00 C ATOM 1460 O THR A 96 -40.905 -34.441 63.623 1.00 0.00 O ATOM 1461 CB THR A 96 -42.291 -34.423 60.827 1.00 0.00 C ATOM 1462 OG1 THR A 96 -42.275 -33.774 59.564 1.00 0.00 O ATOM 1463 CG2 THR A 96 -43.737 -34.913 60.976 1.00 0.00 C ATOM 0 HA THR A 96 -42.733 -32.532 61.760 1.00 0.00 H new ATOM 0 HB THR A 96 -41.602 -35.256 60.965 1.00 0.00 H new ATOM 0 HG1 THR A 96 -41.519 -33.151 59.526 1.00 0.00 H new ATOM 0 HG21 THR A 96 -43.928 -35.707 60.254 1.00 0.00 H new ATOM 0 HG22 THR A 96 -43.889 -35.295 61.985 1.00 0.00 H new ATOM 0 HG23 THR A 96 -44.422 -34.085 60.794 1.00 0.00 H new ATOM 1471 N LEU A 97 -42.972 -33.752 63.991 1.00 0.00 N ATOM 1472 CA LEU A 97 -42.997 -34.293 65.369 1.00 0.00 C ATOM 1473 C LEU A 97 -44.026 -35.419 65.350 1.00 0.00 C ATOM 1474 O LEU A 97 -44.898 -35.459 64.504 1.00 0.00 O ATOM 1475 CB LEU A 97 -43.449 -33.214 66.310 1.00 0.00 C ATOM 1476 CG LEU A 97 -42.681 -31.917 66.106 1.00 0.00 C ATOM 1477 CD1 LEU A 97 -43.037 -30.913 67.202 1.00 0.00 C ATOM 1478 CD2 LEU A 97 -41.163 -32.134 66.212 1.00 0.00 C ATOM 0 H LEU A 97 -43.831 -33.285 63.700 1.00 0.00 H new ATOM 0 HA LEU A 97 -42.018 -34.646 65.692 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -44.514 -33.031 66.166 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -43.320 -33.553 67.338 1.00 0.00 H new ATOM 0 HG LEU A 97 -42.950 -31.554 65.114 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -42.480 -29.989 67.044 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -44.106 -30.703 67.169 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -42.779 -31.330 68.175 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -40.648 -31.185 66.061 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -40.920 -32.525 67.200 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -40.843 -32.846 65.451 1.00 0.00 H new ATOM 1490 N VAL A 98 -43.900 -36.310 66.293 1.00 0.00 N ATOM 1491 CA VAL A 98 -44.839 -37.465 66.394 1.00 0.00 C ATOM 1492 C VAL A 98 -45.247 -37.631 67.849 1.00 0.00 C ATOM 1493 O VAL A 98 -44.514 -38.218 68.620 1.00 0.00 O ATOM 1494 CB VAL A 98 -44.140 -38.725 65.909 1.00 0.00 C ATOM 1495 CG1 VAL A 98 -45.137 -39.898 65.967 1.00 0.00 C ATOM 1496 CG2 VAL A 98 -43.707 -38.519 64.456 1.00 0.00 C ATOM 0 H VAL A 98 -43.175 -36.287 67.010 1.00 0.00 H new ATOM 0 HA VAL A 98 -45.722 -37.289 65.780 1.00 0.00 H new ATOM 0 HB VAL A 98 -43.272 -38.938 66.533 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -44.648 -40.809 65.621 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -45.477 -40.036 66.993 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -45.992 -39.680 65.327 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -43.204 -39.416 64.096 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -44.584 -38.322 63.839 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -43.024 -37.671 64.396 1.00 0.00 H new ATOM 1506 N PHE A 99 -46.391 -37.127 68.230 1.00 0.00 N ATOM 1507 CA PHE A 99 -46.782 -37.298 69.660 1.00 0.00 C ATOM 1508 C PHE A 99 -47.633 -38.563 69.727 1.00 0.00 C ATOM 1509 O PHE A 99 -48.238 -38.972 68.757 1.00 0.00 O ATOM 1510 CB PHE A 99 -47.668 -36.167 70.191 1.00 0.00 C ATOM 1511 CG PHE A 99 -46.904 -34.857 70.380 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -46.366 -34.240 69.290 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -46.770 -34.266 71.623 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -45.707 -33.041 69.420 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -46.108 -33.062 71.763 1.00 0.00 C ATOM 1516 CZ PHE A 99 -45.574 -32.446 70.653 1.00 0.00 C ATOM 0 H PHE A 99 -47.051 -36.622 67.638 1.00 0.00 H new ATOM 0 HA PHE A 99 -45.868 -37.323 70.254 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -48.495 -36.004 69.500 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -48.104 -36.469 71.143 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -46.458 -34.697 68.316 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -47.187 -34.751 72.493 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -45.290 -32.562 68.547 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -46.010 -32.606 72.737 1.00 0.00 H new ATOM 0 HZ PHE A 99 -45.055 -31.504 70.750 1.00 0.00 H new ATOM 1526 N ASP A 100 -47.647 -39.145 70.889 1.00 0.00 N ATOM 1527 CA ASP A 100 -48.439 -40.383 71.141 1.00 0.00 C ATOM 1528 C ASP A 100 -49.255 -39.803 72.281 1.00 0.00 C ATOM 1529 O ASP A 100 -48.850 -39.905 73.419 1.00 0.00 O ATOM 1530 CB ASP A 100 -47.538 -41.518 71.626 1.00 0.00 C ATOM 1531 CG ASP A 100 -46.387 -41.696 70.635 1.00 0.00 C ATOM 1532 OD1 ASP A 100 -45.672 -40.724 70.461 1.00 0.00 O ATOM 1533 OD2 ASP A 100 -46.291 -42.795 70.111 1.00 0.00 O ATOM 0 H ASP A 100 -47.128 -38.807 71.700 1.00 0.00 H new ATOM 0 HA ASP A 100 -48.982 -40.820 70.303 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -47.149 -41.292 72.619 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -48.109 -42.443 71.710 1.00 0.00 H new ATOM 1538 N VAL A 101 -50.390 -39.206 71.998 1.00 0.00 N ATOM 1539 CA VAL A 101 -51.193 -38.605 73.120 1.00 0.00 C ATOM 1540 C VAL A 101 -52.355 -39.462 73.565 1.00 0.00 C ATOM 1541 O VAL A 101 -52.961 -40.185 72.803 1.00 0.00 O ATOM 1542 CB VAL A 101 -51.773 -37.244 72.688 1.00 0.00 C ATOM 1543 CG1 VAL A 101 -52.352 -36.496 73.918 1.00 0.00 C ATOM 1544 CG2 VAL A 101 -50.716 -36.398 71.991 1.00 0.00 C ATOM 0 H VAL A 101 -50.790 -39.108 71.065 1.00 0.00 H new ATOM 0 HA VAL A 101 -50.496 -38.510 73.953 1.00 0.00 H new ATOM 0 HB VAL A 101 -52.579 -37.423 71.977 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -52.759 -35.536 73.601 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -53.143 -37.095 74.369 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -51.561 -36.331 74.649 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -51.151 -35.443 71.696 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -49.883 -36.223 72.672 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -50.357 -36.922 71.105 1.00 0.00 H new ATOM 1554 N GLU A 102 -52.614 -39.328 74.836 1.00 0.00 N ATOM 1555 CA GLU A 102 -53.724 -40.066 75.503 1.00 0.00 C ATOM 1556 C GLU A 102 -54.621 -39.027 76.191 1.00 0.00 C ATOM 1557 O GLU A 102 -54.209 -38.440 77.171 1.00 0.00 O ATOM 1558 CB GLU A 102 -53.131 -41.023 76.537 1.00 0.00 C ATOM 1559 CG GLU A 102 -54.268 -41.798 77.216 1.00 0.00 C ATOM 1560 CD GLU A 102 -53.681 -42.770 78.247 1.00 0.00 C ATOM 1561 OE1 GLU A 102 -52.466 -42.783 78.360 1.00 0.00 O ATOM 1562 OE2 GLU A 102 -54.489 -43.446 78.861 1.00 0.00 O ATOM 0 H GLU A 102 -52.085 -38.718 75.459 1.00 0.00 H new ATOM 0 HA GLU A 102 -54.305 -40.645 74.785 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -52.440 -41.715 76.056 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -52.560 -40.467 77.280 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -54.954 -41.105 77.703 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -54.844 -42.346 76.471 1.00 0.00 H new ATOM 1569 N LEU A 103 -55.814 -38.794 75.692 1.00 0.00 N ATOM 1570 CA LEU A 103 -56.694 -37.782 76.369 1.00 0.00 C ATOM 1571 C LEU A 103 -57.253 -38.568 77.540 1.00 0.00 C ATOM 1572 O LEU A 103 -57.965 -39.542 77.377 1.00 0.00 O ATOM 1573 CB LEU A 103 -57.823 -37.325 75.410 1.00 0.00 C ATOM 1574 CG LEU A 103 -58.881 -36.420 76.125 1.00 0.00 C ATOM 1575 CD1 LEU A 103 -58.277 -35.095 76.668 1.00 0.00 C ATOM 1576 CD2 LEU A 103 -59.972 -36.056 75.103 1.00 0.00 C ATOM 0 H LEU A 103 -56.210 -39.246 74.868 1.00 0.00 H new ATOM 0 HA LEU A 103 -56.176 -36.872 76.671 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -57.387 -36.779 74.574 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -58.320 -38.201 74.994 1.00 0.00 H new ATOM 0 HG LEU A 103 -59.272 -36.982 76.973 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -59.059 -34.510 77.153 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -57.493 -35.322 77.390 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -57.855 -34.522 75.842 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -60.721 -35.424 75.580 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -59.523 -35.519 74.268 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -60.445 -36.967 74.736 1.00 0.00 H new ATOM 1588 N LEU A 104 -56.901 -38.094 78.707 1.00 0.00 N ATOM 1589 CA LEU A 104 -57.334 -38.748 79.973 1.00 0.00 C ATOM 1590 C LEU A 104 -58.667 -38.282 80.523 1.00 0.00 C ATOM 1591 O LEU A 104 -59.551 -39.079 80.766 1.00 0.00 O ATOM 1592 CB LEU A 104 -56.250 -38.508 81.025 1.00 0.00 C ATOM 1593 CG LEU A 104 -54.871 -38.967 80.480 1.00 0.00 C ATOM 1594 CD1 LEU A 104 -53.773 -38.314 81.282 1.00 0.00 C ATOM 1595 CD2 LEU A 104 -54.692 -40.486 80.632 1.00 0.00 C ATOM 0 H LEU A 104 -56.321 -37.265 78.836 1.00 0.00 H new ATOM 0 HA LEU A 104 -57.474 -39.803 79.739 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -56.213 -37.451 81.287 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -56.490 -39.054 81.937 1.00 0.00 H new ATOM 0 HG LEU A 104 -54.824 -38.689 79.427 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -52.804 -38.635 80.901 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -53.855 -37.230 81.197 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -53.865 -38.604 82.329 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -53.717 -40.778 80.242 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -54.757 -40.756 81.686 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -55.475 -41.002 80.076 1.00 0.00 H new ATOM 1607 N LYS A 105 -58.799 -37.001 80.714 1.00 0.00 N ATOM 1608 CA LYS A 105 -60.074 -36.472 81.256 1.00 0.00 C ATOM 1609 C LYS A 105 -60.155 -34.960 81.043 1.00 0.00 C ATOM 1610 O LYS A 105 -59.241 -34.350 80.527 1.00 0.00 O ATOM 1611 CB LYS A 105 -60.112 -36.864 82.759 1.00 0.00 C ATOM 1612 CG LYS A 105 -61.437 -36.523 83.500 1.00 0.00 C ATOM 1613 CD LYS A 105 -62.696 -37.206 82.907 1.00 0.00 C ATOM 1614 CE LYS A 105 -62.612 -38.740 83.025 1.00 0.00 C ATOM 1615 NZ LYS A 105 -61.638 -39.303 82.049 1.00 0.00 N ATOM 0 H LYS A 105 -58.082 -36.302 80.519 1.00 0.00 H new ATOM 0 HA LYS A 105 -60.940 -36.892 80.744 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -59.933 -37.936 82.843 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -59.290 -36.363 83.270 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -61.339 -36.814 84.546 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -61.582 -35.443 83.482 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -63.585 -36.848 83.426 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -62.804 -36.926 81.859 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -62.316 -39.014 84.038 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -63.596 -39.175 82.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -62.083 -40.084 81.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -61.347 -38.560 81.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -60.803 -39.658 82.557 1.00 0.00 H new ATOM 1629 N LEU A 106 -61.256 -34.373 81.439 1.00 0.00 N ATOM 1630 CA LEU A 106 -61.438 -32.894 81.283 1.00 0.00 C ATOM 1631 C LEU A 106 -61.595 -32.335 82.695 1.00 0.00 C ATOM 1632 O LEU A 106 -62.031 -33.023 83.596 1.00 0.00 O ATOM 1633 CB LEU A 106 -62.714 -32.586 80.487 1.00 0.00 C ATOM 1634 CG LEU A 106 -62.797 -33.437 79.223 1.00 0.00 C ATOM 1635 CD1 LEU A 106 -64.102 -33.092 78.499 1.00 0.00 C ATOM 1636 CD2 LEU A 106 -61.623 -33.167 78.281 1.00 0.00 C ATOM 0 H LEU A 106 -62.044 -34.858 81.868 1.00 0.00 H new ATOM 0 HA LEU A 106 -60.593 -32.457 80.752 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -63.588 -32.771 81.111 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -62.732 -31.530 80.219 1.00 0.00 H new ATOM 0 HG LEU A 106 -62.764 -34.488 79.508 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -64.183 -33.689 77.591 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -64.948 -33.307 79.152 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -64.105 -32.034 78.239 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -61.718 -33.792 77.393 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -61.626 -32.117 77.988 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -60.687 -33.399 78.790 1.00 0.00 H new ATOM 1648 N GLU A 107 -61.238 -31.090 82.858 1.00 0.00 N ATOM 1649 CA GLU A 107 -61.353 -30.435 84.206 1.00 0.00 C ATOM 1650 C GLU A 107 -61.984 -29.049 84.025 1.00 0.00 C ATOM 1651 O GLU A 107 -62.088 -28.661 82.874 1.00 0.00 O ATOM 1652 CB GLU A 107 -59.941 -30.336 84.815 1.00 0.00 C ATOM 1653 CG GLU A 107 -60.021 -29.817 86.259 1.00 0.00 C ATOM 1654 CD GLU A 107 -58.626 -29.859 86.893 1.00 0.00 C ATOM 1655 OE1 GLU A 107 -57.714 -30.271 86.193 1.00 0.00 O ATOM 1656 OE2 GLU A 107 -58.555 -29.473 88.048 1.00 0.00 O ATOM 1657 OXT GLU A 107 -62.325 -28.459 85.037 1.00 0.00 O ATOM 0 H GLU A 107 -60.870 -30.492 82.118 1.00 0.00 H new ATOM 0 HA GLU A 107 -61.985 -31.014 84.880 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -59.461 -31.314 84.799 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -59.324 -29.668 84.214 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -60.407 -28.798 86.270 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -60.714 -30.427 86.838 1.00 0.00 H new