USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 572 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 22 THR OG1 : rot 174:sc= -0.544! USER MOD Set 1.2: A 25 ASN : amide:sc= 0.127 K(o=-0.42,f=2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= -0.739 (180deg=-1.01) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -60:sc= -2.75! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -152:sc= -0.293 (180deg=-0.901) USER MOD Single : A 12 THR OG1 : rot 49:sc= 0.238 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0413 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0629) USER MOD Single : A 31 GLN : amide:sc= -0.038 K(o=-0.038,f=-3.3!) USER MOD Single : A 33 LYS NZ :NH3+ 149:sc= -0.158 (180deg=-0.939) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 41 GLN : amide:sc= -1.43 K(o=-1.4,f=-4.3!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0276 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -33:sc= -0.801 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 HIS : no HD1:sc= -1.77 K(o=-1.8,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.647 28.181 2.877 1.00 0.00 N ATOM 2 CA MET A 1 28.867 29.497 2.215 1.00 0.00 C ATOM 3 C MET A 1 28.145 30.592 3.003 1.00 0.00 C ATOM 4 O MET A 1 28.111 31.738 2.603 1.00 0.00 O ATOM 5 CB MET A 1 28.317 29.448 0.788 1.00 0.00 C ATOM 6 CG MET A 1 29.031 28.345 0.003 1.00 0.00 C ATOM 7 SD MET A 1 28.337 28.247 -1.666 1.00 0.00 S ATOM 8 CE MET A 1 29.251 26.781 -2.204 1.00 0.00 C ATOM 0 H1 MET A 1 29.281 27.471 2.458 1.00 0.00 H new ATOM 0 H2 MET A 1 28.847 28.266 3.894 1.00 0.00 H new ATOM 0 H3 MET A 1 27.659 27.885 2.742 1.00 0.00 H new ATOM 0 HA MET A 1 29.935 29.715 2.186 1.00 0.00 H new ATOM 0 HB2 MET A 1 27.244 29.259 0.807 1.00 0.00 H new ATOM 0 HB3 MET A 1 28.463 30.411 0.298 1.00 0.00 H new ATOM 0 HG2 MET A 1 30.100 28.553 -0.048 1.00 0.00 H new ATOM 0 HG3 MET A 1 28.916 27.388 0.513 1.00 0.00 H new ATOM 0 HE1 MET A 1 28.973 26.534 -3.229 1.00 0.00 H new ATOM 0 HE2 MET A 1 30.321 26.982 -2.157 1.00 0.00 H new ATOM 0 HE3 MET A 1 29.010 25.942 -1.551 1.00 0.00 H new ATOM 20 N GLN A 2 27.565 30.246 4.119 1.00 0.00 N ATOM 21 CA GLN A 2 26.845 31.266 4.933 1.00 0.00 C ATOM 22 C GLN A 2 26.712 30.767 6.374 1.00 0.00 C ATOM 23 O GLN A 2 25.629 30.491 6.849 1.00 0.00 O ATOM 24 CB GLN A 2 25.452 31.501 4.340 1.00 0.00 C ATOM 25 CG GLN A 2 24.814 30.154 3.990 1.00 0.00 C ATOM 26 CD GLN A 2 23.390 30.385 3.476 1.00 0.00 C ATOM 27 OE1 GLN A 2 23.191 31.072 2.495 1.00 0.00 O ATOM 28 NE2 GLN A 2 22.388 29.832 4.101 1.00 0.00 N ATOM 0 H GLN A 2 27.558 29.301 4.503 1.00 0.00 H new ATOM 0 HA GLN A 2 27.405 32.201 4.924 1.00 0.00 H new ATOM 0 HB2 GLN A 2 24.827 32.037 5.054 1.00 0.00 H new ATOM 0 HB3 GLN A 2 25.525 32.124 3.449 1.00 0.00 H new ATOM 0 HG2 GLN A 2 25.408 29.644 3.232 1.00 0.00 H new ATOM 0 HG3 GLN A 2 24.795 29.509 4.868 1.00 0.00 H new ATOM 0 HE21 GLN A 2 22.557 29.255 4.925 1.00 0.00 H new ATOM 0 HE22 GLN A 2 21.436 29.976 3.766 1.00 0.00 H new ATOM 37 N ILE A 3 27.808 30.651 7.075 1.00 0.00 N ATOM 38 CA ILE A 3 27.744 30.171 8.483 1.00 0.00 C ATOM 39 C ILE A 3 27.350 31.338 9.394 1.00 0.00 C ATOM 40 O ILE A 3 28.046 32.329 9.486 1.00 0.00 O ATOM 41 CB ILE A 3 29.117 29.623 8.900 1.00 0.00 C ATOM 42 CG1 ILE A 3 29.383 28.294 8.177 1.00 0.00 C ATOM 43 CG2 ILE A 3 29.143 29.379 10.414 1.00 0.00 C ATOM 44 CD1 ILE A 3 29.543 28.526 6.669 1.00 0.00 C ATOM 0 H ILE A 3 28.744 30.868 6.732 1.00 0.00 H new ATOM 0 HA ILE A 3 27.002 29.377 8.570 1.00 0.00 H new ATOM 0 HB ILE A 3 29.884 30.350 8.633 1.00 0.00 H new ATOM 0 HG12 ILE A 3 30.284 27.829 8.577 1.00 0.00 H new ATOM 0 HG13 ILE A 3 28.560 27.603 8.359 1.00 0.00 H new ATOM 0 HG21 ILE A 3 30.119 28.990 10.703 1.00 0.00 H new ATOM 0 HG22 ILE A 3 28.956 30.317 10.937 1.00 0.00 H new ATOM 0 HG23 ILE A 3 28.372 28.656 10.679 1.00 0.00 H new ATOM 0 HD11 ILE A 3 29.731 27.574 6.172 1.00 0.00 H new ATOM 0 HD12 ILE A 3 28.631 28.969 6.270 1.00 0.00 H new ATOM 0 HD13 ILE A 3 30.381 29.200 6.491 1.00 0.00 H new ATOM 56 N PHE A 4 26.238 31.225 10.070 1.00 0.00 N ATOM 57 CA PHE A 4 25.798 32.326 10.976 1.00 0.00 C ATOM 58 C PHE A 4 26.456 32.149 12.346 1.00 0.00 C ATOM 59 O PHE A 4 26.699 31.044 12.791 1.00 0.00 O ATOM 60 CB PHE A 4 24.277 32.278 11.132 1.00 0.00 C ATOM 61 CG PHE A 4 23.626 32.714 9.840 1.00 0.00 C ATOM 62 CD1 PHE A 4 23.294 31.762 8.869 1.00 0.00 C ATOM 63 CD2 PHE A 4 23.354 34.068 9.615 1.00 0.00 C ATOM 64 CE1 PHE A 4 22.691 32.166 7.670 1.00 0.00 C ATOM 65 CE2 PHE A 4 22.752 34.472 8.418 1.00 0.00 C ATOM 66 CZ PHE A 4 22.421 33.520 7.446 1.00 0.00 C ATOM 0 H PHE A 4 25.615 30.418 10.034 1.00 0.00 H new ATOM 0 HA PHE A 4 26.090 33.287 10.552 1.00 0.00 H new ATOM 0 HB2 PHE A 4 23.959 31.268 11.390 1.00 0.00 H new ATOM 0 HB3 PHE A 4 23.963 32.929 11.948 1.00 0.00 H new ATOM 0 HD1 PHE A 4 23.502 30.717 9.044 1.00 0.00 H new ATOM 0 HD2 PHE A 4 23.609 34.802 10.365 1.00 0.00 H new ATOM 0 HE1 PHE A 4 22.435 31.433 6.920 1.00 0.00 H new ATOM 0 HE2 PHE A 4 22.543 35.517 8.244 1.00 0.00 H new ATOM 0 HZ PHE A 4 21.957 33.832 6.522 1.00 0.00 H new ATOM 76 N VAL A 5 26.729 33.230 13.027 1.00 0.00 N ATOM 77 CA VAL A 5 27.352 33.132 14.384 1.00 0.00 C ATOM 78 C VAL A 5 26.782 34.231 15.281 1.00 0.00 C ATOM 79 O VAL A 5 27.095 35.394 15.124 1.00 0.00 O ATOM 80 CB VAL A 5 28.865 33.300 14.262 1.00 0.00 C ATOM 81 CG1 VAL A 5 29.511 33.124 15.637 1.00 0.00 C ATOM 82 CG2 VAL A 5 29.421 32.248 13.299 1.00 0.00 C ATOM 0 H VAL A 5 26.548 34.180 12.703 1.00 0.00 H new ATOM 0 HA VAL A 5 27.132 32.157 14.820 1.00 0.00 H new ATOM 0 HB VAL A 5 29.089 34.296 13.880 1.00 0.00 H new ATOM 0 HG11 VAL A 5 30.591 33.244 15.550 1.00 0.00 H new ATOM 0 HG12 VAL A 5 29.117 33.874 16.323 1.00 0.00 H new ATOM 0 HG13 VAL A 5 29.286 32.128 16.020 1.00 0.00 H new ATOM 0 HG21 VAL A 5 30.501 32.369 13.212 1.00 0.00 H new ATOM 0 HG22 VAL A 5 29.196 31.252 13.680 1.00 0.00 H new ATOM 0 HG23 VAL A 5 28.962 32.374 12.318 1.00 0.00 H new ATOM 92 N LYS A 6 25.945 33.881 16.225 1.00 0.00 N ATOM 93 CA LYS A 6 25.356 34.915 17.130 1.00 0.00 C ATOM 94 C LYS A 6 26.185 35.005 18.414 1.00 0.00 C ATOM 95 O LYS A 6 26.348 34.035 19.129 1.00 0.00 O ATOM 96 CB LYS A 6 23.920 34.520 17.483 1.00 0.00 C ATOM 97 CG LYS A 6 23.051 34.580 16.224 1.00 0.00 C ATOM 98 CD LYS A 6 21.730 33.846 16.472 1.00 0.00 C ATOM 99 CE LYS A 6 20.913 34.593 17.529 1.00 0.00 C ATOM 100 NZ LYS A 6 19.511 34.088 17.521 1.00 0.00 N ATOM 0 H LYS A 6 25.644 32.924 16.408 1.00 0.00 H new ATOM 0 HA LYS A 6 25.359 35.882 16.627 1.00 0.00 H new ATOM 0 HB2 LYS A 6 23.901 33.515 17.904 1.00 0.00 H new ATOM 0 HB3 LYS A 6 23.523 35.192 18.244 1.00 0.00 H new ATOM 0 HG2 LYS A 6 22.856 35.618 15.954 1.00 0.00 H new ATOM 0 HG3 LYS A 6 23.578 34.126 15.385 1.00 0.00 H new ATOM 0 HD2 LYS A 6 21.163 33.775 15.544 1.00 0.00 H new ATOM 0 HD3 LYS A 6 21.926 32.827 16.804 1.00 0.00 H new ATOM 0 HE2 LYS A 6 21.357 34.451 18.514 1.00 0.00 H new ATOM 0 HE3 LYS A 6 20.926 35.664 17.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 18.955 34.595 18.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 19.091 34.245 16.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 19.507 33.070 17.736 1.00 0.00 H new ATOM 114 N THR A 7 26.710 36.163 18.715 1.00 0.00 N ATOM 115 CA THR A 7 27.526 36.316 19.954 1.00 0.00 C ATOM 116 C THR A 7 26.602 36.579 21.146 1.00 0.00 C ATOM 117 O THR A 7 25.431 36.857 20.987 1.00 0.00 O ATOM 118 CB THR A 7 28.489 37.494 19.786 1.00 0.00 C ATOM 119 OG1 THR A 7 27.744 38.678 19.535 1.00 0.00 O ATOM 120 CG2 THR A 7 29.431 37.220 18.614 1.00 0.00 C ATOM 0 H THR A 7 26.609 37.010 18.156 1.00 0.00 H new ATOM 0 HA THR A 7 28.094 35.403 20.130 1.00 0.00 H new ATOM 0 HB THR A 7 29.075 37.620 20.696 1.00 0.00 H new ATOM 0 HG1 THR A 7 27.217 38.565 18.717 1.00 0.00 H new ATOM 0 HG21 THR A 7 30.117 38.059 18.494 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.000 36.311 18.809 1.00 0.00 H new ATOM 0 HG23 THR A 7 28.849 37.094 17.701 1.00 0.00 H new ATOM 128 N LEU A 8 27.122 36.492 22.340 1.00 0.00 N ATOM 129 CA LEU A 8 26.278 36.733 23.544 1.00 0.00 C ATOM 130 C LEU A 8 25.857 38.206 23.588 1.00 0.00 C ATOM 131 O LEU A 8 24.764 38.536 23.999 1.00 0.00 O ATOM 132 CB LEU A 8 27.084 36.384 24.803 1.00 0.00 C ATOM 133 CG LEU A 8 26.252 36.648 26.068 1.00 0.00 C ATOM 134 CD1 LEU A 8 24.962 35.810 26.043 1.00 0.00 C ATOM 135 CD2 LEU A 8 27.086 36.271 27.297 1.00 0.00 C ATOM 0 H LEU A 8 28.097 36.264 22.534 1.00 0.00 H new ATOM 0 HA LEU A 8 25.386 36.108 23.499 1.00 0.00 H new ATOM 0 HB2 LEU A 8 27.384 35.337 24.771 1.00 0.00 H new ATOM 0 HB3 LEU A 8 27.998 36.977 24.832 1.00 0.00 H new ATOM 0 HG LEU A 8 25.981 37.703 26.109 1.00 0.00 H new ATOM 0 HD11 LEU A 8 24.383 36.007 26.945 1.00 0.00 H new ATOM 0 HD12 LEU A 8 24.371 36.077 25.167 1.00 0.00 H new ATOM 0 HD13 LEU A 8 25.217 34.751 26.000 1.00 0.00 H new ATOM 0 HD21 LEU A 8 26.505 36.454 28.201 1.00 0.00 H new ATOM 0 HD22 LEU A 8 27.354 35.216 27.245 1.00 0.00 H new ATOM 0 HD23 LEU A 8 27.993 36.875 27.320 1.00 0.00 H new ATOM 147 N THR A 9 26.720 39.092 23.172 1.00 0.00 N ATOM 148 CA THR A 9 26.371 40.543 23.196 1.00 0.00 C ATOM 149 C THR A 9 25.469 40.873 22.006 1.00 0.00 C ATOM 150 O THR A 9 25.046 41.998 21.826 1.00 0.00 O ATOM 151 CB THR A 9 27.656 41.374 23.113 1.00 0.00 C ATOM 152 OG1 THR A 9 28.532 40.990 24.165 1.00 0.00 O ATOM 153 CG2 THR A 9 27.327 42.865 23.245 1.00 0.00 C ATOM 0 H THR A 9 27.651 38.875 22.817 1.00 0.00 H new ATOM 0 HA THR A 9 25.845 40.777 24.121 1.00 0.00 H new ATOM 0 HB THR A 9 28.134 41.198 22.149 1.00 0.00 H new ATOM 0 HG1 THR A 9 29.356 41.518 24.114 1.00 0.00 H new ATOM 0 HG21 THR A 9 28.247 43.447 23.185 1.00 0.00 H new ATOM 0 HG22 THR A 9 26.656 43.162 22.439 1.00 0.00 H new ATOM 0 HG23 THR A 9 26.844 43.047 24.205 1.00 0.00 H new ATOM 161 N GLY A 10 25.166 39.898 21.189 1.00 0.00 N ATOM 162 CA GLY A 10 24.287 40.148 20.006 1.00 0.00 C ATOM 163 C GLY A 10 25.156 40.440 18.782 1.00 0.00 C ATOM 164 O GLY A 10 24.710 40.348 17.654 1.00 0.00 O ATOM 0 H GLY A 10 25.490 38.936 21.290 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.655 39.280 19.819 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.623 40.989 20.204 1.00 0.00 H new ATOM 168 N LYS A 11 26.395 40.789 18.993 1.00 0.00 N ATOM 169 CA LYS A 11 27.288 41.079 17.836 1.00 0.00 C ATOM 170 C LYS A 11 27.231 39.901 16.861 1.00 0.00 C ATOM 171 O LYS A 11 27.812 38.860 17.096 1.00 0.00 O ATOM 172 CB LYS A 11 28.724 41.274 18.330 1.00 0.00 C ATOM 173 CG LYS A 11 29.566 41.912 17.220 1.00 0.00 C ATOM 174 CD LYS A 11 31.057 41.744 17.537 1.00 0.00 C ATOM 175 CE LYS A 11 31.379 42.404 18.880 1.00 0.00 C ATOM 176 NZ LYS A 11 30.748 43.753 18.937 1.00 0.00 N ATOM 0 H LYS A 11 26.826 40.886 19.912 1.00 0.00 H new ATOM 0 HA LYS A 11 26.960 41.989 17.334 1.00 0.00 H new ATOM 0 HB2 LYS A 11 28.732 41.908 19.216 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.153 40.315 18.620 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.334 41.447 16.262 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.321 42.970 17.128 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.314 40.685 17.571 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.659 42.193 16.747 1.00 0.00 H new ATOM 0 HE2 LYS A 11 31.012 41.785 19.698 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.458 42.490 19.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.304 44.370 19.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 30.719 44.163 17.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 29.780 43.668 19.307 1.00 0.00 H new ATOM 190 N THR A 12 26.519 40.052 15.774 1.00 0.00 N ATOM 191 CA THR A 12 26.406 38.937 14.787 1.00 0.00 C ATOM 192 C THR A 12 27.485 39.078 13.711 1.00 0.00 C ATOM 193 O THR A 12 27.888 40.168 13.356 1.00 0.00 O ATOM 194 CB THR A 12 25.027 38.983 14.126 1.00 0.00 C ATOM 195 OG1 THR A 12 24.023 38.817 15.118 1.00 0.00 O ATOM 196 CG2 THR A 12 24.915 37.862 13.091 1.00 0.00 C ATOM 0 H THR A 12 26.010 40.901 15.527 1.00 0.00 H new ATOM 0 HA THR A 12 26.538 37.987 15.305 1.00 0.00 H new ATOM 0 HB THR A 12 24.894 39.945 13.630 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.196 39.428 15.864 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.932 37.897 12.622 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.685 37.991 12.330 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.048 36.898 13.583 1.00 0.00 H new ATOM 204 N ILE A 13 27.923 37.976 13.162 1.00 0.00 N ATOM 205 CA ILE A 13 28.938 38.016 12.072 1.00 0.00 C ATOM 206 C ILE A 13 28.657 36.855 11.112 1.00 0.00 C ATOM 207 O ILE A 13 28.155 35.822 11.517 1.00 0.00 O ATOM 208 CB ILE A 13 30.351 37.900 12.656 1.00 0.00 C ATOM 209 CG1 ILE A 13 30.502 36.573 13.397 1.00 0.00 C ATOM 210 CG2 ILE A 13 30.594 39.053 13.632 1.00 0.00 C ATOM 211 CD1 ILE A 13 31.879 36.512 14.059 1.00 0.00 C ATOM 0 H ILE A 13 27.616 37.040 13.426 1.00 0.00 H new ATOM 0 HA ILE A 13 28.875 38.963 11.537 1.00 0.00 H new ATOM 0 HB ILE A 13 31.077 37.943 11.844 1.00 0.00 H new ATOM 0 HG12 ILE A 13 29.720 36.474 14.150 1.00 0.00 H new ATOM 0 HG13 ILE A 13 30.383 35.741 12.703 1.00 0.00 H new ATOM 0 HG21 ILE A 13 31.598 38.972 14.048 1.00 0.00 H new ATOM 0 HG22 ILE A 13 30.495 40.002 13.106 1.00 0.00 H new ATOM 0 HG23 ILE A 13 29.862 39.007 14.439 1.00 0.00 H new ATOM 0 HD11 ILE A 13 31.987 35.565 14.588 1.00 0.00 H new ATOM 0 HD12 ILE A 13 32.653 36.592 13.296 1.00 0.00 H new ATOM 0 HD13 ILE A 13 31.980 37.336 14.766 1.00 0.00 H new ATOM 223 N THR A 14 28.965 37.015 9.847 1.00 0.00 N ATOM 224 CA THR A 14 28.712 35.922 8.852 1.00 0.00 C ATOM 225 C THR A 14 30.016 35.579 8.133 1.00 0.00 C ATOM 226 O THR A 14 30.774 36.451 7.758 1.00 0.00 O ATOM 227 CB THR A 14 27.681 36.402 7.826 1.00 0.00 C ATOM 228 OG1 THR A 14 28.186 37.547 7.151 1.00 0.00 O ATOM 229 CG2 THR A 14 26.377 36.760 8.538 1.00 0.00 C ATOM 0 H THR A 14 29.383 37.860 9.458 1.00 0.00 H new ATOM 0 HA THR A 14 28.335 35.038 9.367 1.00 0.00 H new ATOM 0 HB THR A 14 27.490 35.608 7.104 1.00 0.00 H new ATOM 0 HG1 THR A 14 27.529 37.855 6.493 1.00 0.00 H new ATOM 0 HG21 THR A 14 25.645 37.101 7.806 1.00 0.00 H new ATOM 0 HG22 THR A 14 25.991 35.881 9.055 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.564 37.553 9.262 1.00 0.00 H new ATOM 237 N LEU A 15 30.283 34.308 7.940 1.00 0.00 N ATOM 238 CA LEU A 15 31.540 33.881 7.245 1.00 0.00 C ATOM 239 C LEU A 15 31.168 33.079 5.993 1.00 0.00 C ATOM 240 O LEU A 15 30.599 32.010 6.081 1.00 0.00 O ATOM 241 CB LEU A 15 32.361 32.986 8.183 1.00 0.00 C ATOM 242 CG LEU A 15 32.438 33.614 9.580 1.00 0.00 C ATOM 243 CD1 LEU A 15 33.161 32.655 10.526 1.00 0.00 C ATOM 244 CD2 LEU A 15 33.209 34.933 9.509 1.00 0.00 C ATOM 0 H LEU A 15 29.678 33.542 8.237 1.00 0.00 H new ATOM 0 HA LEU A 15 32.124 34.759 6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 15 31.906 31.997 8.245 1.00 0.00 H new ATOM 0 HB3 LEU A 15 33.365 32.850 7.781 1.00 0.00 H new ATOM 0 HG LEU A 15 31.430 33.804 9.948 1.00 0.00 H new ATOM 0 HD11 LEU A 15 33.218 33.098 11.520 1.00 0.00 H new ATOM 0 HD12 LEU A 15 32.613 31.714 10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 15 34.168 32.468 10.154 1.00 0.00 H new ATOM 0 HD21 LEU A 15 33.262 35.377 10.503 1.00 0.00 H new ATOM 0 HD22 LEU A 15 34.218 34.745 9.141 1.00 0.00 H new ATOM 0 HD23 LEU A 15 32.697 35.618 8.833 1.00 0.00 H new ATOM 256 N GLU A 16 31.482 33.583 4.829 1.00 0.00 N ATOM 257 CA GLU A 16 31.139 32.842 3.576 1.00 0.00 C ATOM 258 C GLU A 16 32.303 31.928 3.184 1.00 0.00 C ATOM 259 O GLU A 16 33.364 32.385 2.809 1.00 0.00 O ATOM 260 CB GLU A 16 30.881 33.845 2.449 1.00 0.00 C ATOM 261 CG GLU A 16 29.732 34.773 2.844 1.00 0.00 C ATOM 262 CD GLU A 16 29.446 35.749 1.701 1.00 0.00 C ATOM 263 OE1 GLU A 16 30.392 36.335 1.201 1.00 0.00 O ATOM 264 OE2 GLU A 16 28.289 35.893 1.346 1.00 0.00 O ATOM 0 H GLU A 16 31.960 34.473 4.690 1.00 0.00 H new ATOM 0 HA GLU A 16 30.246 32.240 3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 16 31.781 34.427 2.253 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.636 33.317 1.527 1.00 0.00 H new ATOM 0 HG2 GLU A 16 28.840 34.189 3.069 1.00 0.00 H new ATOM 0 HG3 GLU A 16 29.990 35.323 3.749 1.00 0.00 H new ATOM 271 N VAL A 17 32.105 30.640 3.259 1.00 0.00 N ATOM 272 CA VAL A 17 33.189 29.685 2.886 1.00 0.00 C ATOM 273 C VAL A 17 32.561 28.333 2.538 1.00 0.00 C ATOM 274 O VAL A 17 31.538 27.965 3.079 1.00 0.00 O ATOM 275 CB VAL A 17 34.151 29.496 4.066 1.00 0.00 C ATOM 276 CG1 VAL A 17 34.938 30.785 4.314 1.00 0.00 C ATOM 277 CG2 VAL A 17 33.353 29.137 5.321 1.00 0.00 C ATOM 0 H VAL A 17 31.234 30.205 3.564 1.00 0.00 H new ATOM 0 HA VAL A 17 33.739 30.080 2.032 1.00 0.00 H new ATOM 0 HB VAL A 17 34.849 28.692 3.832 1.00 0.00 H new ATOM 0 HG11 VAL A 17 35.618 30.640 5.154 1.00 0.00 H new ATOM 0 HG12 VAL A 17 35.511 31.039 3.422 1.00 0.00 H new ATOM 0 HG13 VAL A 17 34.246 31.595 4.543 1.00 0.00 H new ATOM 0 HG21 VAL A 17 34.036 29.002 6.160 1.00 0.00 H new ATOM 0 HG22 VAL A 17 32.652 29.940 5.549 1.00 0.00 H new ATOM 0 HG23 VAL A 17 32.802 28.212 5.150 1.00 0.00 H new ATOM 287 N GLU A 18 33.158 27.597 1.632 1.00 0.00 N ATOM 288 CA GLU A 18 32.595 26.267 1.237 1.00 0.00 C ATOM 289 C GLU A 18 32.100 25.519 2.487 1.00 0.00 C ATOM 290 O GLU A 18 32.611 25.716 3.572 1.00 0.00 O ATOM 291 CB GLU A 18 33.691 25.444 0.550 1.00 0.00 C ATOM 292 CG GLU A 18 33.889 25.947 -0.883 1.00 0.00 C ATOM 293 CD GLU A 18 35.012 25.151 -1.552 1.00 0.00 C ATOM 294 OE1 GLU A 18 35.614 24.331 -0.878 1.00 0.00 O ATOM 295 OE2 GLU A 18 35.251 25.376 -2.727 1.00 0.00 O ATOM 0 H GLU A 18 34.015 27.862 1.147 1.00 0.00 H new ATOM 0 HA GLU A 18 31.758 26.414 0.554 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.624 25.526 1.107 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.416 24.389 0.541 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.964 25.838 -1.449 1.00 0.00 H new ATOM 0 HG3 GLU A 18 34.135 27.009 -0.876 1.00 0.00 H new ATOM 302 N PRO A 19 31.103 24.674 2.347 1.00 0.00 N ATOM 303 CA PRO A 19 30.539 23.908 3.500 1.00 0.00 C ATOM 304 C PRO A 19 31.528 22.881 4.063 1.00 0.00 C ATOM 305 O PRO A 19 31.498 22.556 5.229 1.00 0.00 O ATOM 306 CB PRO A 19 29.298 23.215 2.906 1.00 0.00 C ATOM 307 CG PRO A 19 29.580 23.113 1.443 1.00 0.00 C ATOM 308 CD PRO A 19 30.405 24.350 1.088 1.00 0.00 C ATOM 0 HA PRO A 19 30.307 24.557 4.344 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.145 22.231 3.349 1.00 0.00 H new ATOM 0 HB3 PRO A 19 28.394 23.794 3.095 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.128 22.199 1.214 1.00 0.00 H new ATOM 0 HG3 PRO A 19 28.654 23.083 0.868 1.00 0.00 H new ATOM 0 HD2 PRO A 19 31.108 24.145 0.281 1.00 0.00 H new ATOM 0 HD3 PRO A 19 29.772 25.173 0.757 1.00 0.00 H new ATOM 316 N SER A 20 32.406 22.365 3.251 1.00 0.00 N ATOM 317 CA SER A 20 33.380 21.359 3.764 1.00 0.00 C ATOM 318 C SER A 20 34.458 22.064 4.592 1.00 0.00 C ATOM 319 O SER A 20 35.525 21.528 4.824 1.00 0.00 O ATOM 320 CB SER A 20 34.020 20.615 2.589 1.00 0.00 C ATOM 321 OG SER A 20 34.243 21.524 1.520 1.00 0.00 O ATOM 0 H SER A 20 32.493 22.593 2.261 1.00 0.00 H new ATOM 0 HA SER A 20 32.860 20.640 4.397 1.00 0.00 H new ATOM 0 HB2 SER A 20 34.962 20.164 2.900 1.00 0.00 H new ATOM 0 HB3 SER A 20 33.371 19.803 2.261 1.00 0.00 H new ATOM 0 HG SER A 20 34.654 21.050 0.768 1.00 0.00 H new ATOM 327 N ASP A 21 34.185 23.257 5.046 1.00 0.00 N ATOM 328 CA ASP A 21 35.184 23.993 5.866 1.00 0.00 C ATOM 329 C ASP A 21 35.622 23.109 7.039 1.00 0.00 C ATOM 330 O ASP A 21 35.259 21.955 7.126 1.00 0.00 O ATOM 331 CB ASP A 21 34.543 25.285 6.394 1.00 0.00 C ATOM 332 CG ASP A 21 33.055 25.048 6.661 1.00 0.00 C ATOM 333 OD1 ASP A 21 32.344 24.747 5.717 1.00 0.00 O ATOM 334 OD2 ASP A 21 32.652 25.171 7.806 1.00 0.00 O ATOM 0 H ASP A 21 33.309 23.754 4.883 1.00 0.00 H new ATOM 0 HA ASP A 21 36.055 24.243 5.261 1.00 0.00 H new ATOM 0 HB2 ASP A 21 35.041 25.602 7.310 1.00 0.00 H new ATOM 0 HB3 ASP A 21 34.669 26.088 5.668 1.00 0.00 H new ATOM 339 N THR A 22 36.395 23.651 7.945 1.00 0.00 N ATOM 340 CA THR A 22 36.861 22.850 9.123 1.00 0.00 C ATOM 341 C THR A 22 36.766 23.707 10.386 1.00 0.00 C ATOM 342 O THR A 22 36.991 24.900 10.359 1.00 0.00 O ATOM 343 CB THR A 22 38.316 22.428 8.905 1.00 0.00 C ATOM 344 OG1 THR A 22 39.144 23.583 8.884 1.00 0.00 O ATOM 345 CG2 THR A 22 38.442 21.685 7.576 1.00 0.00 C ATOM 0 H THR A 22 36.726 24.616 7.922 1.00 0.00 H new ATOM 0 HA THR A 22 36.236 21.964 9.234 1.00 0.00 H new ATOM 0 HB THR A 22 38.628 21.770 9.716 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.084 23.311 8.842 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.479 21.386 7.423 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.807 20.799 7.593 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.130 22.339 6.762 1.00 0.00 H new ATOM 353 N ILE A 23 36.429 23.104 11.493 1.00 0.00 N ATOM 354 CA ILE A 23 36.316 23.885 12.758 1.00 0.00 C ATOM 355 C ILE A 23 37.581 24.723 12.954 1.00 0.00 C ATOM 356 O ILE A 23 37.606 25.653 13.733 1.00 0.00 O ATOM 357 CB ILE A 23 36.150 22.928 13.946 1.00 0.00 C ATOM 358 CG1 ILE A 23 35.002 21.942 13.680 1.00 0.00 C ATOM 359 CG2 ILE A 23 35.843 23.734 15.210 1.00 0.00 C ATOM 360 CD1 ILE A 23 33.736 22.694 13.257 1.00 0.00 C ATOM 0 H ILE A 23 36.228 22.108 11.577 1.00 0.00 H new ATOM 0 HA ILE A 23 35.447 24.541 12.699 1.00 0.00 H new ATOM 0 HB ILE A 23 37.075 22.367 14.080 1.00 0.00 H new ATOM 0 HG12 ILE A 23 35.292 21.239 12.899 1.00 0.00 H new ATOM 0 HG13 ILE A 23 34.802 21.357 14.578 1.00 0.00 H new ATOM 0 HG21 ILE A 23 35.725 23.055 16.055 1.00 0.00 H new ATOM 0 HG22 ILE A 23 36.663 24.423 15.410 1.00 0.00 H new ATOM 0 HG23 ILE A 23 34.922 24.299 15.067 1.00 0.00 H new ATOM 0 HD11 ILE A 23 32.933 21.980 13.073 1.00 0.00 H new ATOM 0 HD12 ILE A 23 33.437 23.379 14.051 1.00 0.00 H new ATOM 0 HD13 ILE A 23 33.935 23.259 12.346 1.00 0.00 H new ATOM 372 N GLU A 24 38.635 24.405 12.253 1.00 0.00 N ATOM 373 CA GLU A 24 39.895 25.187 12.401 1.00 0.00 C ATOM 374 C GLU A 24 39.845 26.416 11.490 1.00 0.00 C ATOM 375 O GLU A 24 40.330 27.475 11.834 1.00 0.00 O ATOM 376 CB GLU A 24 41.085 24.307 12.012 1.00 0.00 C ATOM 377 CG GLU A 24 40.895 22.905 12.595 1.00 0.00 C ATOM 378 CD GLU A 24 40.675 23.005 14.106 1.00 0.00 C ATOM 379 OE1 GLU A 24 41.658 23.052 14.827 1.00 0.00 O ATOM 380 OE2 GLU A 24 39.526 23.036 14.515 1.00 0.00 O ATOM 0 H GLU A 24 38.678 23.637 11.584 1.00 0.00 H new ATOM 0 HA GLU A 24 40.005 25.511 13.436 1.00 0.00 H new ATOM 0 HB2 GLU A 24 41.171 24.253 10.927 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.011 24.745 12.384 1.00 0.00 H new ATOM 0 HG2 GLU A 24 40.042 22.417 12.124 1.00 0.00 H new ATOM 0 HG3 GLU A 24 41.770 22.290 12.384 1.00 0.00 H new ATOM 387 N ASN A 25 39.259 26.284 10.332 1.00 0.00 N ATOM 388 CA ASN A 25 39.171 27.434 9.407 1.00 0.00 C ATOM 389 C ASN A 25 38.152 28.434 9.955 1.00 0.00 C ATOM 390 O ASN A 25 38.303 29.632 9.816 1.00 0.00 O ATOM 391 CB ASN A 25 38.720 26.918 8.039 1.00 0.00 C ATOM 392 CG ASN A 25 39.916 26.335 7.281 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.787 27.063 6.846 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.995 25.046 7.102 1.00 0.00 N ATOM 0 H ASN A 25 38.837 25.421 9.990 1.00 0.00 H new ATOM 0 HA ASN A 25 40.138 27.928 9.311 1.00 0.00 H new ATOM 0 HB2 ASN A 25 37.951 26.156 8.164 1.00 0.00 H new ATOM 0 HB3 ASN A 25 38.274 27.729 7.464 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.787 24.649 6.597 1.00 0.00 H new ATOM 0 HD22 ASN A 25 39.264 24.435 7.467 1.00 0.00 H new ATOM 401 N VAL A 26 37.118 27.947 10.582 1.00 0.00 N ATOM 402 CA VAL A 26 36.091 28.864 11.145 1.00 0.00 C ATOM 403 C VAL A 26 36.646 29.526 12.405 1.00 0.00 C ATOM 404 O VAL A 26 36.815 30.728 12.466 1.00 0.00 O ATOM 405 CB VAL A 26 34.841 28.058 11.502 1.00 0.00 C ATOM 406 CG1 VAL A 26 33.692 29.011 11.827 1.00 0.00 C ATOM 407 CG2 VAL A 26 34.451 27.173 10.317 1.00 0.00 C ATOM 0 H VAL A 26 36.940 26.953 10.728 1.00 0.00 H new ATOM 0 HA VAL A 26 35.836 29.630 10.412 1.00 0.00 H new ATOM 0 HB VAL A 26 35.048 27.433 12.371 1.00 0.00 H new ATOM 0 HG11 VAL A 26 32.802 28.435 12.081 1.00 0.00 H new ATOM 0 HG12 VAL A 26 33.970 29.641 12.672 1.00 0.00 H new ATOM 0 HG13 VAL A 26 33.483 29.638 10.960 1.00 0.00 H new ATOM 0 HG21 VAL A 26 33.560 26.598 10.570 1.00 0.00 H new ATOM 0 HG22 VAL A 26 34.245 27.798 9.448 1.00 0.00 H new ATOM 0 HG23 VAL A 26 35.270 26.491 10.087 1.00 0.00 H new ATOM 417 N LYS A 27 36.929 28.750 13.416 1.00 0.00 N ATOM 418 CA LYS A 27 37.469 29.326 14.675 1.00 0.00 C ATOM 419 C LYS A 27 38.614 30.292 14.359 1.00 0.00 C ATOM 420 O LYS A 27 38.792 31.293 15.022 1.00 0.00 O ATOM 421 CB LYS A 27 37.979 28.188 15.559 1.00 0.00 C ATOM 422 CG LYS A 27 36.787 27.381 16.077 1.00 0.00 C ATOM 423 CD LYS A 27 37.256 26.357 17.124 1.00 0.00 C ATOM 424 CE LYS A 27 37.724 27.065 18.406 1.00 0.00 C ATOM 425 NZ LYS A 27 37.554 26.144 19.565 1.00 0.00 N ATOM 0 H LYS A 27 36.808 27.737 13.421 1.00 0.00 H new ATOM 0 HA LYS A 27 36.683 29.874 15.195 1.00 0.00 H new ATOM 0 HB2 LYS A 27 38.651 27.544 14.992 1.00 0.00 H new ATOM 0 HB3 LYS A 27 38.552 28.589 16.395 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.049 28.051 16.518 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.298 26.868 15.249 1.00 0.00 H new ATOM 0 HD2 LYS A 27 36.442 25.671 17.358 1.00 0.00 H new ATOM 0 HD3 LYS A 27 38.070 25.759 16.715 1.00 0.00 H new ATOM 0 HE2 LYS A 27 38.769 27.361 18.312 1.00 0.00 H new ATOM 0 HE3 LYS A 27 37.148 27.977 18.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 37.869 26.619 20.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 36.551 25.883 19.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 38.122 25.286 19.413 1.00 0.00 H new ATOM 439 N ALA A 28 39.390 30.004 13.353 1.00 0.00 N ATOM 440 CA ALA A 28 40.518 30.916 13.005 1.00 0.00 C ATOM 441 C ALA A 28 39.954 32.230 12.461 1.00 0.00 C ATOM 442 O ALA A 28 40.224 33.296 12.978 1.00 0.00 O ATOM 443 CB ALA A 28 41.400 30.255 11.944 1.00 0.00 C ATOM 0 H ALA A 28 39.294 29.181 12.758 1.00 0.00 H new ATOM 0 HA ALA A 28 41.116 31.117 13.894 1.00 0.00 H new ATOM 0 HB1 ALA A 28 42.224 30.921 11.690 1.00 0.00 H new ATOM 0 HB2 ALA A 28 41.798 29.318 12.334 1.00 0.00 H new ATOM 0 HB3 ALA A 28 40.807 30.054 11.052 1.00 0.00 H new ATOM 449 N LYS A 29 39.177 32.163 11.417 1.00 0.00 N ATOM 450 CA LYS A 29 38.600 33.407 10.834 1.00 0.00 C ATOM 451 C LYS A 29 37.846 34.182 11.919 1.00 0.00 C ATOM 452 O LYS A 29 37.761 35.388 11.883 1.00 0.00 O ATOM 453 CB LYS A 29 37.641 33.035 9.698 1.00 0.00 C ATOM 454 CG LYS A 29 38.451 32.658 8.446 1.00 0.00 C ATOM 455 CD LYS A 29 37.610 31.762 7.537 1.00 0.00 C ATOM 456 CE LYS A 29 38.446 31.331 6.329 1.00 0.00 C ATOM 457 NZ LYS A 29 38.590 32.479 5.389 1.00 0.00 N ATOM 0 H LYS A 29 38.916 31.299 10.941 1.00 0.00 H new ATOM 0 HA LYS A 29 39.401 34.033 10.441 1.00 0.00 H new ATOM 0 HB2 LYS A 29 37.009 32.200 10.000 1.00 0.00 H new ATOM 0 HB3 LYS A 29 36.979 33.873 9.477 1.00 0.00 H new ATOM 0 HG2 LYS A 29 38.749 33.559 7.909 1.00 0.00 H new ATOM 0 HG3 LYS A 29 39.366 32.142 8.735 1.00 0.00 H new ATOM 0 HD2 LYS A 29 37.269 30.885 8.088 1.00 0.00 H new ATOM 0 HD3 LYS A 29 36.720 32.296 7.205 1.00 0.00 H new ATOM 0 HE2 LYS A 29 39.428 30.990 6.656 1.00 0.00 H new ATOM 0 HE3 LYS A 29 37.969 30.491 5.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.023 32.150 4.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 37.653 32.882 5.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.194 33.207 5.820 1.00 0.00 H new ATOM 471 N ILE A 30 37.316 33.502 12.893 1.00 0.00 N ATOM 472 CA ILE A 30 36.584 34.210 13.980 1.00 0.00 C ATOM 473 C ILE A 30 37.603 34.804 14.958 1.00 0.00 C ATOM 474 O ILE A 30 37.683 36.003 15.136 1.00 0.00 O ATOM 475 CB ILE A 30 35.667 33.218 14.697 1.00 0.00 C ATOM 476 CG1 ILE A 30 34.520 32.840 13.756 1.00 0.00 C ATOM 477 CG2 ILE A 30 35.096 33.865 15.964 1.00 0.00 C ATOM 478 CD1 ILE A 30 33.696 31.706 14.368 1.00 0.00 C ATOM 0 H ILE A 30 37.357 32.487 12.985 1.00 0.00 H new ATOM 0 HA ILE A 30 35.975 35.015 13.568 1.00 0.00 H new ATOM 0 HB ILE A 30 36.231 32.328 14.975 1.00 0.00 H new ATOM 0 HG12 ILE A 30 33.884 33.707 13.577 1.00 0.00 H new ATOM 0 HG13 ILE A 30 34.918 32.531 12.789 1.00 0.00 H new ATOM 0 HG21 ILE A 30 34.443 33.155 16.472 1.00 0.00 H new ATOM 0 HG22 ILE A 30 35.913 34.147 16.628 1.00 0.00 H new ATOM 0 HG23 ILE A 30 34.525 34.753 15.693 1.00 0.00 H new ATOM 0 HD11 ILE A 30 32.882 31.443 13.693 1.00 0.00 H new ATOM 0 HD12 ILE A 30 34.334 30.836 14.524 1.00 0.00 H new ATOM 0 HD13 ILE A 30 33.284 32.030 15.324 1.00 0.00 H new ATOM 490 N GLN A 31 38.362 33.956 15.601 1.00 0.00 N ATOM 491 CA GLN A 31 39.377 34.415 16.592 1.00 0.00 C ATOM 492 C GLN A 31 40.039 35.719 16.124 1.00 0.00 C ATOM 493 O GLN A 31 40.269 36.620 16.902 1.00 0.00 O ATOM 494 CB GLN A 31 40.444 33.329 16.734 1.00 0.00 C ATOM 495 CG GLN A 31 41.317 33.630 17.946 1.00 0.00 C ATOM 496 CD GLN A 31 42.584 32.774 17.893 1.00 0.00 C ATOM 497 OE1 GLN A 31 42.822 31.966 18.767 1.00 0.00 O ATOM 498 NE2 GLN A 31 43.412 32.920 16.895 1.00 0.00 N ATOM 0 H GLN A 31 38.319 32.944 15.478 1.00 0.00 H new ATOM 0 HA GLN A 31 38.888 34.599 17.549 1.00 0.00 H new ATOM 0 HB2 GLN A 31 39.972 32.353 16.846 1.00 0.00 H new ATOM 0 HB3 GLN A 31 41.056 33.286 15.833 1.00 0.00 H new ATOM 0 HG2 GLN A 31 41.581 34.687 17.963 1.00 0.00 H new ATOM 0 HG3 GLN A 31 40.766 33.425 18.864 1.00 0.00 H new ATOM 0 HE21 GLN A 31 43.211 33.599 16.161 1.00 0.00 H new ATOM 0 HE22 GLN A 31 44.260 32.355 16.849 1.00 0.00 H new ATOM 507 N ASP A 32 40.341 35.828 14.862 1.00 0.00 N ATOM 508 CA ASP A 32 40.985 37.082 14.360 1.00 0.00 C ATOM 509 C ASP A 32 39.988 38.251 14.456 1.00 0.00 C ATOM 510 O ASP A 32 40.271 39.281 15.031 1.00 0.00 O ATOM 511 CB ASP A 32 41.404 36.891 12.901 1.00 0.00 C ATOM 512 CG ASP A 32 42.490 35.816 12.820 1.00 0.00 C ATOM 513 OD1 ASP A 32 42.138 34.658 12.666 1.00 0.00 O ATOM 514 OD2 ASP A 32 43.654 36.169 12.912 1.00 0.00 O ATOM 0 H ASP A 32 40.173 35.111 14.157 1.00 0.00 H new ATOM 0 HA ASP A 32 41.863 37.304 14.967 1.00 0.00 H new ATOM 0 HB2 ASP A 32 40.543 36.600 12.299 1.00 0.00 H new ATOM 0 HB3 ASP A 32 41.776 37.830 12.492 1.00 0.00 H new ATOM 519 N LYS A 33 38.832 38.093 13.872 1.00 0.00 N ATOM 520 CA LYS A 33 37.821 39.184 13.898 1.00 0.00 C ATOM 521 C LYS A 33 37.443 39.545 15.341 1.00 0.00 C ATOM 522 O LYS A 33 37.302 40.705 15.673 1.00 0.00 O ATOM 523 CB LYS A 33 36.574 38.736 13.146 1.00 0.00 C ATOM 524 CG LYS A 33 36.917 38.438 11.677 1.00 0.00 C ATOM 525 CD LYS A 33 37.529 39.678 11.001 1.00 0.00 C ATOM 526 CE LYS A 33 37.218 39.673 9.500 1.00 0.00 C ATOM 527 NZ LYS A 33 35.748 39.795 9.295 1.00 0.00 N ATOM 0 H LYS A 33 38.544 37.250 13.376 1.00 0.00 H new ATOM 0 HA LYS A 33 38.249 40.065 13.421 1.00 0.00 H new ATOM 0 HB2 LYS A 33 36.157 37.846 13.617 1.00 0.00 H new ATOM 0 HB3 LYS A 33 35.811 39.512 13.198 1.00 0.00 H new ATOM 0 HG2 LYS A 33 37.618 37.605 11.623 1.00 0.00 H new ATOM 0 HG3 LYS A 33 36.017 38.133 11.143 1.00 0.00 H new ATOM 0 HD2 LYS A 33 37.131 40.584 11.459 1.00 0.00 H new ATOM 0 HD3 LYS A 33 38.608 39.690 11.156 1.00 0.00 H new ATOM 0 HE2 LYS A 33 37.734 40.498 9.009 1.00 0.00 H new ATOM 0 HE3 LYS A 33 37.584 38.752 9.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 35.562 40.299 8.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 35.324 38.846 9.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 35.330 40.325 10.086 1.00 0.00 H new ATOM 541 N GLU A 34 37.269 38.580 16.203 1.00 0.00 N ATOM 542 CA GLU A 34 36.892 38.903 17.616 1.00 0.00 C ATOM 543 C GLU A 34 38.155 39.081 18.464 1.00 0.00 C ATOM 544 O GLU A 34 38.156 39.788 19.453 1.00 0.00 O ATOM 545 CB GLU A 34 36.045 37.767 18.194 1.00 0.00 C ATOM 546 CG GLU A 34 34.965 37.374 17.185 1.00 0.00 C ATOM 547 CD GLU A 34 34.067 36.295 17.792 1.00 0.00 C ATOM 548 OE1 GLU A 34 34.594 35.422 18.462 1.00 0.00 O ATOM 549 OE2 GLU A 34 32.869 36.358 17.575 1.00 0.00 O ATOM 0 H GLU A 34 37.370 37.587 15.995 1.00 0.00 H new ATOM 0 HA GLU A 34 36.317 39.829 17.629 1.00 0.00 H new ATOM 0 HB2 GLU A 34 36.676 36.908 18.421 1.00 0.00 H new ATOM 0 HB3 GLU A 34 35.586 38.082 19.131 1.00 0.00 H new ATOM 0 HG2 GLU A 34 34.371 38.247 16.914 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.426 37.005 16.268 1.00 0.00 H new ATOM 556 N GLY A 35 39.230 38.449 18.086 1.00 0.00 N ATOM 557 CA GLY A 35 40.494 38.585 18.868 1.00 0.00 C ATOM 558 C GLY A 35 40.344 37.883 20.218 1.00 0.00 C ATOM 559 O GLY A 35 41.151 38.050 21.110 1.00 0.00 O ATOM 0 H GLY A 35 39.290 37.843 17.268 1.00 0.00 H new ATOM 0 HA2 GLY A 35 41.325 38.151 18.312 1.00 0.00 H new ATOM 0 HA3 GLY A 35 40.728 39.639 19.019 1.00 0.00 H new ATOM 563 N ILE A 36 39.309 37.107 20.374 1.00 0.00 N ATOM 564 CA ILE A 36 39.082 36.393 21.655 1.00 0.00 C ATOM 565 C ILE A 36 39.781 35.020 21.616 1.00 0.00 C ATOM 566 O ILE A 36 39.581 34.264 20.688 1.00 0.00 O ATOM 567 CB ILE A 36 37.588 36.189 21.820 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.898 37.551 21.748 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.322 35.543 23.175 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.392 37.355 21.791 1.00 0.00 C ATOM 0 H ILE A 36 38.603 36.937 19.658 1.00 0.00 H new ATOM 0 HA ILE A 36 39.485 36.973 22.485 1.00 0.00 H new ATOM 0 HB ILE A 36 37.202 35.542 21.032 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.218 38.178 22.580 1.00 0.00 H new ATOM 0 HG13 ILE A 36 37.183 38.068 20.831 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.250 35.393 23.302 1.00 0.00 H new ATOM 0 HG22 ILE A 36 37.832 34.581 23.226 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.694 36.193 23.967 1.00 0.00 H new ATOM 0 HD11 ILE A 36 34.897 38.325 21.740 1.00 0.00 H new ATOM 0 HD12 ILE A 36 35.080 36.744 20.944 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.116 36.856 22.720 1.00 0.00 H new ATOM 582 N PRO A 37 40.591 34.680 22.600 1.00 0.00 N ATOM 583 CA PRO A 37 41.293 33.363 22.623 1.00 0.00 C ATOM 584 C PRO A 37 40.354 32.222 23.081 1.00 0.00 C ATOM 585 O PRO A 37 39.722 32.332 24.112 1.00 0.00 O ATOM 586 CB PRO A 37 42.413 33.585 23.647 1.00 0.00 C ATOM 587 CG PRO A 37 41.848 34.576 24.609 1.00 0.00 C ATOM 588 CD PRO A 37 40.930 35.491 23.788 1.00 0.00 C ATOM 0 HA PRO A 37 41.653 33.063 21.639 1.00 0.00 H new ATOM 0 HB2 PRO A 37 42.683 32.655 24.148 1.00 0.00 H new ATOM 0 HB3 PRO A 37 43.317 33.965 23.171 1.00 0.00 H new ATOM 0 HG2 PRO A 37 41.292 34.076 25.402 1.00 0.00 H new ATOM 0 HG3 PRO A 37 42.641 35.149 25.089 1.00 0.00 H new ATOM 0 HD2 PRO A 37 40.038 35.770 24.349 1.00 0.00 H new ATOM 0 HD3 PRO A 37 41.434 36.417 23.509 1.00 0.00 H new ATOM 596 N PRO A 38 40.258 31.136 22.340 1.00 0.00 N ATOM 597 CA PRO A 38 39.379 29.988 22.710 1.00 0.00 C ATOM 598 C PRO A 38 39.360 29.704 24.217 1.00 0.00 C ATOM 599 O PRO A 38 38.402 29.177 24.745 1.00 0.00 O ATOM 600 CB PRO A 38 40.001 28.830 21.951 1.00 0.00 C ATOM 601 CG PRO A 38 40.467 29.457 20.686 1.00 0.00 C ATOM 602 CD PRO A 38 40.957 30.862 21.068 1.00 0.00 C ATOM 0 HA PRO A 38 38.335 30.177 22.462 1.00 0.00 H new ATOM 0 HB2 PRO A 38 40.826 28.383 22.506 1.00 0.00 H new ATOM 0 HB3 PRO A 38 39.277 28.037 21.763 1.00 0.00 H new ATOM 0 HG2 PRO A 38 41.269 28.874 20.233 1.00 0.00 H new ATOM 0 HG3 PRO A 38 39.660 29.510 19.956 1.00 0.00 H new ATOM 0 HD2 PRO A 38 42.040 30.890 21.191 1.00 0.00 H new ATOM 0 HD3 PRO A 38 40.704 31.597 20.304 1.00 0.00 H new ATOM 610 N ASP A 39 40.414 30.037 24.909 1.00 0.00 N ATOM 611 CA ASP A 39 40.452 29.775 26.374 1.00 0.00 C ATOM 612 C ASP A 39 39.320 30.532 27.066 1.00 0.00 C ATOM 613 O ASP A 39 38.668 30.022 27.957 1.00 0.00 O ATOM 614 CB ASP A 39 41.796 30.239 26.940 1.00 0.00 C ATOM 615 CG ASP A 39 42.901 29.288 26.477 1.00 0.00 C ATOM 616 OD1 ASP A 39 42.571 28.226 25.977 1.00 0.00 O ATOM 617 OD2 ASP A 39 44.060 29.637 26.631 1.00 0.00 O ATOM 0 H ASP A 39 41.249 30.478 24.524 1.00 0.00 H new ATOM 0 HA ASP A 39 40.330 28.706 26.551 1.00 0.00 H new ATOM 0 HB2 ASP A 39 42.012 31.254 26.607 1.00 0.00 H new ATOM 0 HB3 ASP A 39 41.755 30.263 28.029 1.00 0.00 H new ATOM 622 N GLN A 40 39.087 31.750 26.669 1.00 0.00 N ATOM 623 CA GLN A 40 38.008 32.562 27.298 1.00 0.00 C ATOM 624 C GLN A 40 36.708 32.415 26.503 1.00 0.00 C ATOM 625 O GLN A 40 35.700 32.999 26.844 1.00 0.00 O ATOM 626 CB GLN A 40 38.435 34.027 27.295 1.00 0.00 C ATOM 627 CG GLN A 40 39.732 34.178 28.089 1.00 0.00 C ATOM 628 CD GLN A 40 40.060 35.663 28.258 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.052 36.412 27.302 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.350 36.123 29.444 1.00 0.00 N ATOM 0 H GLN A 40 39.603 32.224 25.928 1.00 0.00 H new ATOM 0 HA GLN A 40 37.840 32.217 28.318 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.580 34.373 26.272 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.653 34.646 27.734 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.630 33.704 29.065 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.547 33.671 27.573 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.357 35.494 30.247 1.00 0.00 H new ATOM 0 HE22 GLN A 40 40.570 37.111 29.568 1.00 0.00 H new ATOM 639 N GLN A 41 36.725 31.651 25.436 1.00 0.00 N ATOM 640 CA GLN A 41 35.501 31.474 24.599 1.00 0.00 C ATOM 641 C GLN A 41 35.219 29.977 24.415 1.00 0.00 C ATOM 642 O GLN A 41 36.112 29.191 24.165 1.00 0.00 O ATOM 643 CB GLN A 41 35.750 32.145 23.238 1.00 0.00 C ATOM 644 CG GLN A 41 34.761 31.631 22.188 1.00 0.00 C ATOM 645 CD GLN A 41 34.826 32.521 20.944 1.00 0.00 C ATOM 646 OE1 GLN A 41 34.766 32.034 19.832 1.00 0.00 O ATOM 647 NE2 GLN A 41 34.946 33.813 21.084 1.00 0.00 N ATOM 0 H GLN A 41 37.544 31.139 25.109 1.00 0.00 H new ATOM 0 HA GLN A 41 34.636 31.930 25.081 1.00 0.00 H new ATOM 0 HB2 GLN A 41 35.652 33.226 23.337 1.00 0.00 H new ATOM 0 HB3 GLN A 41 36.771 31.946 22.911 1.00 0.00 H new ATOM 0 HG2 GLN A 41 34.998 30.601 21.923 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.750 31.631 22.595 1.00 0.00 H new ATOM 0 HE21 GLN A 41 34.996 34.222 22.017 1.00 0.00 H new ATOM 0 HE22 GLN A 41 34.989 34.413 20.261 1.00 0.00 H new ATOM 656 N ARG A 42 33.973 29.587 24.507 1.00 0.00 N ATOM 657 CA ARG A 42 33.590 28.157 24.309 1.00 0.00 C ATOM 658 C ARG A 42 32.402 28.137 23.351 1.00 0.00 C ATOM 659 O ARG A 42 31.423 28.822 23.564 1.00 0.00 O ATOM 660 CB ARG A 42 33.179 27.541 25.650 1.00 0.00 C ATOM 661 CG ARG A 42 34.427 27.252 26.497 1.00 0.00 C ATOM 662 CD ARG A 42 35.192 26.032 25.953 1.00 0.00 C ATOM 663 NE ARG A 42 35.978 25.414 27.059 1.00 0.00 N ATOM 664 CZ ARG A 42 35.397 24.601 27.901 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.085 24.061 28.867 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.127 24.331 27.773 1.00 0.00 N ATOM 0 H ARG A 42 33.193 30.210 24.714 1.00 0.00 H new ATOM 0 HA ARG A 42 34.425 27.584 23.907 1.00 0.00 H new ATOM 0 HB2 ARG A 42 32.516 28.221 26.184 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.622 26.619 25.481 1.00 0.00 H new ATOM 0 HG2 ARG A 42 35.080 28.125 26.498 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.135 27.071 27.531 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.494 25.306 25.537 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.856 26.335 25.144 1.00 0.00 H new ATOM 0 HE ARG A 42 36.971 25.626 27.159 1.00 0.00 H new ATOM 0 HH11 ARG A 42 37.078 24.273 28.966 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.631 23.427 29.524 1.00 0.00 H new ATOM 0 HH21 ARG A 42 33.589 24.754 27.017 1.00 0.00 H new ATOM 0 HH22 ARG A 42 33.672 23.697 28.429 1.00 0.00 H new ATOM 680 N LEU A 43 32.474 27.391 22.283 1.00 0.00 N ATOM 681 CA LEU A 43 31.338 27.384 21.315 1.00 0.00 C ATOM 682 C LEU A 43 30.308 26.326 21.694 1.00 0.00 C ATOM 683 O LEU A 43 30.641 25.241 22.127 1.00 0.00 O ATOM 684 CB LEU A 43 31.862 27.072 19.916 1.00 0.00 C ATOM 685 CG LEU A 43 33.090 27.931 19.601 1.00 0.00 C ATOM 686 CD1 LEU A 43 33.372 27.839 18.108 1.00 0.00 C ATOM 687 CD2 LEU A 43 32.819 29.390 19.965 1.00 0.00 C ATOM 0 H LEU A 43 33.262 26.791 22.039 1.00 0.00 H new ATOM 0 HA LEU A 43 30.867 28.367 21.336 1.00 0.00 H new ATOM 0 HB2 LEU A 43 32.122 26.016 19.845 1.00 0.00 H new ATOM 0 HB3 LEU A 43 31.081 27.258 19.179 1.00 0.00 H new ATOM 0 HG LEU A 43 33.943 27.573 20.178 1.00 0.00 H new ATOM 0 HD11 LEU A 43 34.244 28.445 17.864 1.00 0.00 H new ATOM 0 HD12 LEU A 43 33.565 26.801 17.837 1.00 0.00 H new ATOM 0 HD13 LEU A 43 32.509 28.205 17.552 1.00 0.00 H new ATOM 0 HD21 LEU A 43 33.699 29.991 19.737 1.00 0.00 H new ATOM 0 HD22 LEU A 43 31.969 29.757 19.389 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.595 29.464 21.029 1.00 0.00 H new ATOM 699 N ILE A 44 29.052 26.637 21.501 1.00 0.00 N ATOM 700 CA ILE A 44 27.952 25.671 21.809 1.00 0.00 C ATOM 701 C ILE A 44 27.101 25.509 20.549 1.00 0.00 C ATOM 702 O ILE A 44 26.757 26.478 19.895 1.00 0.00 O ATOM 703 CB ILE A 44 27.078 26.228 22.937 1.00 0.00 C ATOM 704 CG1 ILE A 44 27.915 26.412 24.217 1.00 0.00 C ATOM 705 CG2 ILE A 44 25.911 25.265 23.212 1.00 0.00 C ATOM 706 CD1 ILE A 44 28.577 25.090 24.644 1.00 0.00 C ATOM 0 H ILE A 44 28.736 27.536 21.136 1.00 0.00 H new ATOM 0 HA ILE A 44 28.368 24.713 22.120 1.00 0.00 H new ATOM 0 HB ILE A 44 26.683 27.197 22.633 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.682 27.168 24.048 1.00 0.00 H new ATOM 0 HG13 ILE A 44 27.278 26.779 25.022 1.00 0.00 H new ATOM 0 HG21 ILE A 44 25.291 25.664 24.015 1.00 0.00 H new ATOM 0 HG22 ILE A 44 25.309 25.155 22.310 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.304 24.292 23.507 1.00 0.00 H new ATOM 0 HD11 ILE A 44 29.161 25.252 25.550 1.00 0.00 H new ATOM 0 HD12 ILE A 44 27.807 24.343 24.837 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.233 24.738 23.848 1.00 0.00 H new ATOM 718 N PHE A 45 26.769 24.295 20.186 1.00 0.00 N ATOM 719 CA PHE A 45 25.955 24.075 18.959 1.00 0.00 C ATOM 720 C PHE A 45 25.034 22.864 19.165 1.00 0.00 C ATOM 721 O PHE A 45 25.478 21.736 19.229 1.00 0.00 O ATOM 722 CB PHE A 45 26.903 23.808 17.782 1.00 0.00 C ATOM 723 CG PHE A 45 26.118 23.329 16.583 1.00 0.00 C ATOM 724 CD1 PHE A 45 25.595 24.252 15.675 1.00 0.00 C ATOM 725 CD2 PHE A 45 25.918 21.959 16.385 1.00 0.00 C ATOM 726 CE1 PHE A 45 24.867 23.807 14.565 1.00 0.00 C ATOM 727 CE2 PHE A 45 25.190 21.511 15.276 1.00 0.00 C ATOM 728 CZ PHE A 45 24.664 22.436 14.364 1.00 0.00 C ATOM 0 H PHE A 45 27.029 23.447 20.690 1.00 0.00 H new ATOM 0 HA PHE A 45 25.346 24.955 18.752 1.00 0.00 H new ATOM 0 HB2 PHE A 45 27.448 24.718 17.530 1.00 0.00 H new ATOM 0 HB3 PHE A 45 27.644 23.060 18.064 1.00 0.00 H new ATOM 0 HD1 PHE A 45 25.752 25.309 15.829 1.00 0.00 H new ATOM 0 HD2 PHE A 45 26.325 21.247 17.087 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.462 24.521 13.864 1.00 0.00 H new ATOM 0 HE2 PHE A 45 25.034 20.453 15.124 1.00 0.00 H new ATOM 0 HZ PHE A 45 24.103 22.092 13.508 1.00 0.00 H new ATOM 738 N ALA A 46 23.754 23.096 19.252 1.00 0.00 N ATOM 739 CA ALA A 46 22.792 21.969 19.432 1.00 0.00 C ATOM 740 C ALA A 46 23.118 21.164 20.694 1.00 0.00 C ATOM 741 O ALA A 46 22.799 19.996 20.786 1.00 0.00 O ATOM 742 CB ALA A 46 22.862 21.047 18.212 1.00 0.00 C ATOM 0 H ALA A 46 23.329 24.022 19.206 1.00 0.00 H new ATOM 0 HA ALA A 46 21.789 22.383 19.536 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.161 20.222 18.339 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.602 21.610 17.315 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.873 20.652 18.112 1.00 0.00 H new ATOM 748 N GLY A 47 23.737 21.766 21.677 1.00 0.00 N ATOM 749 CA GLY A 47 24.054 21.015 22.931 1.00 0.00 C ATOM 750 C GLY A 47 25.405 20.305 22.798 1.00 0.00 C ATOM 751 O GLY A 47 25.818 19.579 23.681 1.00 0.00 O ATOM 0 H GLY A 47 24.036 22.741 21.667 1.00 0.00 H new ATOM 0 HA2 GLY A 47 24.078 21.701 23.778 1.00 0.00 H new ATOM 0 HA3 GLY A 47 23.270 20.285 23.134 1.00 0.00 H new ATOM 755 N LYS A 48 26.098 20.509 21.706 1.00 0.00 N ATOM 756 CA LYS A 48 27.431 19.855 21.507 1.00 0.00 C ATOM 757 C LYS A 48 28.450 20.922 21.110 1.00 0.00 C ATOM 758 O LYS A 48 28.108 21.913 20.503 1.00 0.00 O ATOM 759 CB LYS A 48 27.326 18.819 20.392 1.00 0.00 C ATOM 760 CG LYS A 48 26.226 17.810 20.732 1.00 0.00 C ATOM 761 CD LYS A 48 25.929 16.934 19.509 1.00 0.00 C ATOM 762 CE LYS A 48 27.108 15.995 19.235 1.00 0.00 C ATOM 763 NZ LYS A 48 26.680 14.927 18.289 1.00 0.00 N ATOM 0 H LYS A 48 25.796 21.106 20.936 1.00 0.00 H new ATOM 0 HA LYS A 48 27.744 19.365 22.429 1.00 0.00 H new ATOM 0 HB2 LYS A 48 27.103 19.310 19.445 1.00 0.00 H new ATOM 0 HB3 LYS A 48 28.279 18.305 20.268 1.00 0.00 H new ATOM 0 HG2 LYS A 48 26.538 17.187 21.570 1.00 0.00 H new ATOM 0 HG3 LYS A 48 25.322 18.334 21.043 1.00 0.00 H new ATOM 0 HD2 LYS A 48 25.023 16.352 19.680 1.00 0.00 H new ATOM 0 HD3 LYS A 48 25.745 17.563 18.638 1.00 0.00 H new ATOM 0 HE2 LYS A 48 27.943 16.555 18.815 1.00 0.00 H new ATOM 0 HE3 LYS A 48 27.458 15.552 20.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 27.479 14.288 18.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 25.896 14.387 18.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 26.366 15.359 17.397 1.00 0.00 H new ATOM 777 N GLN A 49 29.704 20.731 21.435 1.00 0.00 N ATOM 778 CA GLN A 49 30.739 21.737 21.067 1.00 0.00 C ATOM 779 C GLN A 49 31.433 21.296 19.777 1.00 0.00 C ATOM 780 O GLN A 49 31.304 20.166 19.351 1.00 0.00 O ATOM 781 CB GLN A 49 31.767 21.837 22.186 1.00 0.00 C ATOM 782 CG GLN A 49 31.051 21.975 23.531 1.00 0.00 C ATOM 783 CD GLN A 49 32.087 22.104 24.649 1.00 0.00 C ATOM 784 OE1 GLN A 49 33.084 22.780 24.496 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.891 21.478 25.778 1.00 0.00 N ATOM 0 H GLN A 49 30.054 19.918 21.941 1.00 0.00 H new ATOM 0 HA GLN A 49 30.269 22.709 20.917 1.00 0.00 H new ATOM 0 HB2 GLN A 49 32.402 20.951 22.190 1.00 0.00 H new ATOM 0 HB3 GLN A 49 32.418 22.695 22.020 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.400 22.850 23.521 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.416 21.107 23.708 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.054 20.910 25.907 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.575 21.557 26.530 1.00 0.00 H new ATOM 794 N LEU A 50 32.172 22.177 19.150 1.00 0.00 N ATOM 795 CA LEU A 50 32.880 21.807 17.885 1.00 0.00 C ATOM 796 C LEU A 50 34.343 21.488 18.203 1.00 0.00 C ATOM 797 O LEU A 50 35.100 22.347 18.613 1.00 0.00 O ATOM 798 CB LEU A 50 32.814 22.986 16.910 1.00 0.00 C ATOM 799 CG LEU A 50 31.400 23.569 16.904 1.00 0.00 C ATOM 800 CD1 LEU A 50 31.317 24.696 15.872 1.00 0.00 C ATOM 801 CD2 LEU A 50 30.392 22.474 16.544 1.00 0.00 C ATOM 0 H LEU A 50 32.316 23.138 19.460 1.00 0.00 H new ATOM 0 HA LEU A 50 32.406 20.934 17.436 1.00 0.00 H new ATOM 0 HB2 LEU A 50 33.533 23.752 17.201 1.00 0.00 H new ATOM 0 HB3 LEU A 50 33.087 22.657 15.907 1.00 0.00 H new ATOM 0 HG LEU A 50 31.168 23.962 17.894 1.00 0.00 H new ATOM 0 HD11 LEU A 50 30.309 25.112 15.867 1.00 0.00 H new ATOM 0 HD12 LEU A 50 32.031 25.478 16.129 1.00 0.00 H new ATOM 0 HD13 LEU A 50 31.551 24.302 14.883 1.00 0.00 H new ATOM 0 HD21 LEU A 50 29.386 22.893 16.541 1.00 0.00 H new ATOM 0 HD22 LEU A 50 30.623 22.077 15.555 1.00 0.00 H new ATOM 0 HD23 LEU A 50 30.449 21.671 17.279 1.00 0.00 H new ATOM 813 N GLU A 51 34.749 20.257 18.025 1.00 0.00 N ATOM 814 CA GLU A 51 36.163 19.879 18.324 1.00 0.00 C ATOM 815 C GLU A 51 37.005 19.987 17.051 1.00 0.00 C ATOM 816 O GLU A 51 36.492 19.965 15.950 1.00 0.00 O ATOM 817 CB GLU A 51 36.201 18.436 18.834 1.00 0.00 C ATOM 818 CG GLU A 51 35.334 18.316 20.088 1.00 0.00 C ATOM 819 CD GLU A 51 35.423 16.891 20.638 1.00 0.00 C ATOM 820 OE1 GLU A 51 36.059 16.071 19.999 1.00 0.00 O ATOM 821 OE2 GLU A 51 34.850 16.645 21.687 1.00 0.00 O ATOM 0 H GLU A 51 34.161 19.496 17.685 1.00 0.00 H new ATOM 0 HA GLU A 51 36.566 20.550 19.082 1.00 0.00 H new ATOM 0 HB2 GLU A 51 35.839 17.757 18.062 1.00 0.00 H new ATOM 0 HB3 GLU A 51 37.227 18.145 19.059 1.00 0.00 H new ATOM 0 HG2 GLU A 51 35.667 19.029 20.842 1.00 0.00 H new ATOM 0 HG3 GLU A 51 34.299 18.562 19.852 1.00 0.00 H new ATOM 828 N ASP A 52 38.297 20.105 17.196 1.00 0.00 N ATOM 829 CA ASP A 52 39.179 20.218 16.000 1.00 0.00 C ATOM 830 C ASP A 52 39.268 18.862 15.295 1.00 0.00 C ATOM 831 O ASP A 52 39.060 17.825 15.895 1.00 0.00 O ATOM 832 CB ASP A 52 40.578 20.654 16.439 1.00 0.00 C ATOM 833 CG ASP A 52 40.520 22.079 16.991 1.00 0.00 C ATOM 834 OD1 ASP A 52 39.482 22.705 16.856 1.00 0.00 O ATOM 835 OD2 ASP A 52 41.516 22.521 17.540 1.00 0.00 O ATOM 0 H ASP A 52 38.781 20.128 18.094 1.00 0.00 H new ATOM 0 HA ASP A 52 38.764 20.956 15.314 1.00 0.00 H new ATOM 0 HB2 ASP A 52 40.960 19.973 17.200 1.00 0.00 H new ATOM 0 HB3 ASP A 52 41.266 20.608 15.595 1.00 0.00 H new ATOM 840 N GLY A 53 39.577 18.858 14.026 1.00 0.00 N ATOM 841 CA GLY A 53 39.682 17.570 13.282 1.00 0.00 C ATOM 842 C GLY A 53 38.289 17.117 12.841 1.00 0.00 C ATOM 843 O GLY A 53 37.899 15.985 13.048 1.00 0.00 O ATOM 0 H GLY A 53 39.762 19.694 13.471 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.328 17.692 12.413 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.140 16.809 13.915 1.00 0.00 H new ATOM 847 N ARG A 54 37.534 17.993 12.235 1.00 0.00 N ATOM 848 CA ARG A 54 36.165 17.608 11.784 1.00 0.00 C ATOM 849 C ARG A 54 35.691 18.564 10.685 1.00 0.00 C ATOM 850 O ARG A 54 35.961 19.749 10.718 1.00 0.00 O ATOM 851 CB ARG A 54 35.206 17.675 12.974 1.00 0.00 C ATOM 852 CG ARG A 54 33.853 17.074 12.584 1.00 0.00 C ATOM 853 CD ARG A 54 33.013 16.854 13.843 1.00 0.00 C ATOM 854 NE ARG A 54 33.575 15.716 14.624 1.00 0.00 N ATOM 855 CZ ARG A 54 33.045 15.386 15.770 1.00 0.00 C ATOM 856 NH1 ARG A 54 33.534 14.385 16.451 1.00 0.00 N ATOM 857 NH2 ARG A 54 32.025 16.055 16.234 1.00 0.00 N ATOM 0 H ARG A 54 37.804 18.956 12.033 1.00 0.00 H new ATOM 0 HA ARG A 54 36.185 16.593 11.387 1.00 0.00 H new ATOM 0 HB2 ARG A 54 35.625 17.132 13.821 1.00 0.00 H new ATOM 0 HB3 ARG A 54 35.077 18.710 13.291 1.00 0.00 H new ATOM 0 HG2 ARG A 54 33.331 17.740 11.897 1.00 0.00 H new ATOM 0 HG3 ARG A 54 34.000 16.129 12.061 1.00 0.00 H new ATOM 0 HD2 ARG A 54 33.007 17.758 14.451 1.00 0.00 H new ATOM 0 HD3 ARG A 54 31.978 16.646 13.571 1.00 0.00 H new ATOM 0 HE ARG A 54 34.374 15.195 14.263 1.00 0.00 H new ATOM 0 HH11 ARG A 54 34.330 13.861 16.087 1.00 0.00 H new ATOM 0 HH12 ARG A 54 33.120 14.127 17.347 1.00 0.00 H new ATOM 0 HH21 ARG A 54 31.642 16.836 15.701 1.00 0.00 H new ATOM 0 HH22 ARG A 54 31.611 15.797 17.130 1.00 0.00 H new ATOM 871 N THR A 55 34.946 18.055 9.731 1.00 0.00 N ATOM 872 CA THR A 55 34.392 18.907 8.634 1.00 0.00 C ATOM 873 C THR A 55 32.871 18.725 8.638 1.00 0.00 C ATOM 874 O THR A 55 32.385 17.687 9.038 1.00 0.00 O ATOM 875 CB THR A 55 34.968 18.445 7.289 1.00 0.00 C ATOM 876 OG1 THR A 55 36.344 18.792 7.223 1.00 0.00 O ATOM 877 CG2 THR A 55 34.217 19.113 6.131 1.00 0.00 C ATOM 0 H THR A 55 34.696 17.068 9.667 1.00 0.00 H new ATOM 0 HA THR A 55 34.654 19.955 8.783 1.00 0.00 H new ATOM 0 HB THR A 55 34.854 17.364 7.206 1.00 0.00 H new ATOM 0 HG1 THR A 55 36.715 18.497 6.365 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.636 18.776 5.183 1.00 0.00 H new ATOM 0 HG22 THR A 55 33.162 18.843 6.178 1.00 0.00 H new ATOM 0 HG23 THR A 55 34.318 20.196 6.208 1.00 0.00 H new ATOM 885 N LEU A 56 32.108 19.706 8.221 1.00 0.00 N ATOM 886 CA LEU A 56 30.616 19.554 8.228 1.00 0.00 C ATOM 887 C LEU A 56 30.221 18.153 7.731 1.00 0.00 C ATOM 888 O LEU A 56 29.351 17.505 8.289 1.00 0.00 O ATOM 889 CB LEU A 56 29.992 20.627 7.318 1.00 0.00 C ATOM 890 CG LEU A 56 29.819 21.948 8.085 1.00 0.00 C ATOM 891 CD1 LEU A 56 31.191 22.549 8.415 1.00 0.00 C ATOM 892 CD2 LEU A 56 29.026 22.934 7.223 1.00 0.00 C ATOM 0 H LEU A 56 32.451 20.603 7.877 1.00 0.00 H new ATOM 0 HA LEU A 56 30.248 19.678 9.246 1.00 0.00 H new ATOM 0 HB2 LEU A 56 30.626 20.786 6.446 1.00 0.00 H new ATOM 0 HB3 LEU A 56 29.025 20.283 6.951 1.00 0.00 H new ATOM 0 HG LEU A 56 29.282 21.754 9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 56 31.057 23.484 8.958 1.00 0.00 H new ATOM 0 HD12 LEU A 56 31.756 21.849 9.031 1.00 0.00 H new ATOM 0 HD13 LEU A 56 31.736 22.741 7.491 1.00 0.00 H new ATOM 0 HD21 LEU A 56 28.902 23.872 7.764 1.00 0.00 H new ATOM 0 HD22 LEU A 56 29.565 23.120 6.294 1.00 0.00 H new ATOM 0 HD23 LEU A 56 28.046 22.513 6.996 1.00 0.00 H new ATOM 904 N SER A 57 30.870 17.660 6.711 1.00 0.00 N ATOM 905 CA SER A 57 30.530 16.294 6.225 1.00 0.00 C ATOM 906 C SER A 57 30.666 15.327 7.401 1.00 0.00 C ATOM 907 O SER A 57 29.742 14.622 7.756 1.00 0.00 O ATOM 908 CB SER A 57 31.495 15.888 5.110 1.00 0.00 C ATOM 909 OG SER A 57 31.170 14.578 4.662 1.00 0.00 O ATOM 0 H SER A 57 31.612 18.138 6.199 1.00 0.00 H new ATOM 0 HA SER A 57 29.514 16.273 5.832 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.431 16.594 4.282 1.00 0.00 H new ATOM 0 HB3 SER A 57 32.522 15.916 5.474 1.00 0.00 H new ATOM 0 HG SER A 57 31.785 14.315 3.946 1.00 0.00 H new ATOM 915 N ASP A 58 31.815 15.305 8.014 1.00 0.00 N ATOM 916 CA ASP A 58 32.027 14.403 9.180 1.00 0.00 C ATOM 917 C ASP A 58 31.023 14.765 10.278 1.00 0.00 C ATOM 918 O ASP A 58 30.567 13.920 11.021 1.00 0.00 O ATOM 919 CB ASP A 58 33.451 14.575 9.710 1.00 0.00 C ATOM 920 CG ASP A 58 34.441 13.946 8.726 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.997 13.219 7.853 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.626 14.203 8.863 1.00 0.00 O ATOM 0 H ASP A 58 32.621 15.875 7.757 1.00 0.00 H new ATOM 0 HA ASP A 58 31.882 13.367 8.875 1.00 0.00 H new ATOM 0 HB2 ASP A 58 33.676 15.633 9.842 1.00 0.00 H new ATOM 0 HB3 ASP A 58 33.546 14.104 10.689 1.00 0.00 H new ATOM 927 N TYR A 59 30.673 16.022 10.380 1.00 0.00 N ATOM 928 CA TYR A 59 29.696 16.446 11.422 1.00 0.00 C ATOM 929 C TYR A 59 28.295 15.980 11.000 1.00 0.00 C ATOM 930 O TYR A 59 27.313 16.221 11.674 1.00 0.00 O ATOM 931 CB TYR A 59 29.752 17.987 11.563 1.00 0.00 C ATOM 932 CG TYR A 59 29.798 18.395 13.026 1.00 0.00 C ATOM 933 CD1 TYR A 59 30.942 19.019 13.547 1.00 0.00 C ATOM 934 CD2 TYR A 59 28.700 18.146 13.858 1.00 0.00 C ATOM 935 CE1 TYR A 59 30.985 19.392 14.894 1.00 0.00 C ATOM 936 CE2 TYR A 59 28.744 18.520 15.207 1.00 0.00 C ATOM 937 CZ TYR A 59 29.888 19.144 15.724 1.00 0.00 C ATOM 938 OH TYR A 59 29.930 19.512 17.053 1.00 0.00 O ATOM 0 H TYR A 59 31.023 16.772 9.785 1.00 0.00 H new ATOM 0 HA TYR A 59 29.937 16.001 12.387 1.00 0.00 H new ATOM 0 HB2 TYR A 59 30.631 18.372 11.046 1.00 0.00 H new ATOM 0 HB3 TYR A 59 28.880 18.432 11.084 1.00 0.00 H new ATOM 0 HD1 TYR A 59 31.790 19.211 12.907 1.00 0.00 H new ATOM 0 HD2 TYR A 59 27.819 17.665 13.460 1.00 0.00 H new ATOM 0 HE1 TYR A 59 31.866 19.872 15.293 1.00 0.00 H new ATOM 0 HE2 TYR A 59 27.897 18.328 15.849 1.00 0.00 H new ATOM 0 HH TYR A 59 30.847 19.427 17.387 1.00 0.00 H new ATOM 948 N ASN A 60 28.213 15.282 9.901 1.00 0.00 N ATOM 949 CA ASN A 60 26.897 14.753 9.436 1.00 0.00 C ATOM 950 C ASN A 60 25.836 15.855 9.415 1.00 0.00 C ATOM 951 O ASN A 60 24.852 15.789 10.124 1.00 0.00 O ATOM 952 CB ASN A 60 26.444 13.635 10.379 1.00 0.00 C ATOM 953 CG ASN A 60 27.523 12.553 10.443 1.00 0.00 C ATOM 954 OD1 ASN A 60 28.048 12.265 11.501 1.00 0.00 O ATOM 955 ND2 ASN A 60 27.879 11.937 9.349 1.00 0.00 N ATOM 0 H ASN A 60 29.005 15.053 9.301 1.00 0.00 H new ATOM 0 HA ASN A 60 27.016 14.371 8.422 1.00 0.00 H new ATOM 0 HB2 ASN A 60 26.258 14.038 11.375 1.00 0.00 H new ATOM 0 HB3 ASN A 60 25.505 13.207 10.028 1.00 0.00 H new ATOM 0 HD21 ASN A 60 28.598 11.214 9.382 1.00 0.00 H new ATOM 0 HD22 ASN A 60 27.439 12.179 8.461 1.00 0.00 H new ATOM 962 N ILE A 61 26.010 16.861 8.603 1.00 0.00 N ATOM 963 CA ILE A 61 24.986 17.945 8.544 1.00 0.00 C ATOM 964 C ILE A 61 23.647 17.329 8.131 1.00 0.00 C ATOM 965 O ILE A 61 23.594 16.456 7.286 1.00 0.00 O ATOM 966 CB ILE A 61 25.406 18.999 7.517 1.00 0.00 C ATOM 967 CG1 ILE A 61 25.927 18.308 6.251 1.00 0.00 C ATOM 968 CG2 ILE A 61 26.508 19.879 8.108 1.00 0.00 C ATOM 969 CD1 ILE A 61 25.970 19.312 5.098 1.00 0.00 C ATOM 0 H ILE A 61 26.810 16.980 7.982 1.00 0.00 H new ATOM 0 HA ILE A 61 24.893 18.421 9.520 1.00 0.00 H new ATOM 0 HB ILE A 61 24.545 19.617 7.263 1.00 0.00 H new ATOM 0 HG12 ILE A 61 26.923 17.902 6.430 1.00 0.00 H new ATOM 0 HG13 ILE A 61 25.282 17.468 5.991 1.00 0.00 H new ATOM 0 HG21 ILE A 61 26.806 20.629 7.376 1.00 0.00 H new ATOM 0 HG22 ILE A 61 26.136 20.375 9.005 1.00 0.00 H new ATOM 0 HG23 ILE A 61 27.368 19.261 8.365 1.00 0.00 H new ATOM 0 HD11 ILE A 61 26.341 18.819 4.200 1.00 0.00 H new ATOM 0 HD12 ILE A 61 24.967 19.697 4.913 1.00 0.00 H new ATOM 0 HD13 ILE A 61 26.633 20.137 5.358 1.00 0.00 H new ATOM 1066 N LEU A 67 23.056 26.958 9.114 1.00 0.00 N ATOM 1067 CA LEU A 67 23.918 26.568 10.262 1.00 0.00 C ATOM 1068 C LEU A 67 24.049 27.751 11.222 1.00 0.00 C ATOM 1069 O LEU A 67 24.535 28.803 10.859 1.00 0.00 O ATOM 1070 CB LEU A 67 25.306 26.177 9.749 1.00 0.00 C ATOM 1071 CG LEU A 67 25.172 25.235 8.549 1.00 0.00 C ATOM 1072 CD1 LEU A 67 26.563 24.873 8.031 1.00 0.00 C ATOM 1073 CD2 LEU A 67 24.435 23.959 8.974 1.00 0.00 C ATOM 0 HA LEU A 67 23.470 25.721 10.782 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.862 27.070 9.461 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.873 25.691 10.543 1.00 0.00 H new ATOM 0 HG LEU A 67 24.606 25.731 7.760 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.470 24.202 7.177 1.00 0.00 H new ATOM 0 HD12 LEU A 67 27.085 25.780 7.725 1.00 0.00 H new ATOM 0 HD13 LEU A 67 27.128 24.378 8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 67 24.341 23.291 8.118 1.00 0.00 H new ATOM 0 HD22 LEU A 67 24.997 23.460 9.764 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.442 24.218 9.343 1.00 0.00 H new ATOM 1085 N HIS A 68 23.618 27.582 12.449 1.00 0.00 N ATOM 1086 CA HIS A 68 23.708 28.687 13.457 1.00 0.00 C ATOM 1087 C HIS A 68 24.646 28.261 14.587 1.00 0.00 C ATOM 1088 O HIS A 68 24.538 27.173 15.115 1.00 0.00 O ATOM 1089 CB HIS A 68 22.318 28.962 14.031 1.00 0.00 C ATOM 1090 CG HIS A 68 21.814 27.734 14.736 1.00 0.00 C ATOM 1091 ND1 HIS A 68 22.166 27.436 16.045 1.00 0.00 N ATOM 1092 CD2 HIS A 68 20.986 26.716 14.329 1.00 0.00 C ATOM 1093 CE1 HIS A 68 21.555 26.281 16.377 1.00 0.00 C ATOM 1094 NE2 HIS A 68 20.826 25.805 15.367 1.00 0.00 N ATOM 0 H HIS A 68 23.204 26.718 12.799 1.00 0.00 H new ATOM 0 HA HIS A 68 24.092 29.589 12.980 1.00 0.00 H new ATOM 0 HB2 HIS A 68 22.359 29.801 14.725 1.00 0.00 H new ATOM 0 HB3 HIS A 68 21.632 29.243 13.232 1.00 0.00 H new ATOM 0 HD2 HIS A 68 20.530 26.636 13.353 1.00 0.00 H new ATOM 0 HE1 HIS A 68 21.645 25.801 17.340 1.00 0.00 H new ATOM 0 HE2 HIS A 68 20.268 24.951 15.358 1.00 0.00 H new ATOM 1103 N LEU A 69 25.552 29.124 14.975 1.00 0.00 N ATOM 1104 CA LEU A 69 26.504 28.807 16.088 1.00 0.00 C ATOM 1105 C LEU A 69 26.365 29.913 17.139 1.00 0.00 C ATOM 1106 O LEU A 69 25.935 31.005 16.827 1.00 0.00 O ATOM 1107 CB LEU A 69 27.946 28.798 15.545 1.00 0.00 C ATOM 1108 CG LEU A 69 28.316 27.409 14.996 1.00 0.00 C ATOM 1109 CD1 LEU A 69 27.477 27.077 13.747 1.00 0.00 C ATOM 1110 CD2 LEU A 69 29.807 27.401 14.636 1.00 0.00 C ATOM 0 H LEU A 69 25.675 30.049 14.562 1.00 0.00 H new ATOM 0 HA LEU A 69 26.283 27.830 16.519 1.00 0.00 H new ATOM 0 HB2 LEU A 69 28.047 29.544 14.757 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.640 29.077 16.338 1.00 0.00 H new ATOM 0 HG LEU A 69 28.109 26.656 15.756 1.00 0.00 H new ATOM 0 HD11 LEU A 69 27.754 26.091 13.374 1.00 0.00 H new ATOM 0 HD12 LEU A 69 26.419 27.082 14.008 1.00 0.00 H new ATOM 0 HD13 LEU A 69 27.664 27.823 12.974 1.00 0.00 H new ATOM 0 HD21 LEU A 69 30.082 26.421 14.245 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.003 28.161 13.880 1.00 0.00 H new ATOM 0 HD23 LEU A 69 30.398 27.615 15.527 1.00 0.00 H new ATOM 1122 N VAL A 70 26.721 29.656 18.377 1.00 0.00 N ATOM 1123 CA VAL A 70 26.603 30.720 19.425 1.00 0.00 C ATOM 1124 C VAL A 70 27.853 30.699 20.307 1.00 0.00 C ATOM 1125 O VAL A 70 28.187 29.694 20.901 1.00 0.00 O ATOM 1126 CB VAL A 70 25.370 30.445 20.289 1.00 0.00 C ATOM 1127 CG1 VAL A 70 25.252 31.522 21.369 1.00 0.00 C ATOM 1128 CG2 VAL A 70 24.118 30.465 19.410 1.00 0.00 C ATOM 0 H VAL A 70 27.086 28.762 18.705 1.00 0.00 H new ATOM 0 HA VAL A 70 26.506 31.695 18.948 1.00 0.00 H new ATOM 0 HB VAL A 70 25.468 29.467 20.761 1.00 0.00 H new ATOM 0 HG11 VAL A 70 24.374 31.326 21.984 1.00 0.00 H new ATOM 0 HG12 VAL A 70 26.144 31.509 21.995 1.00 0.00 H new ATOM 0 HG13 VAL A 70 25.154 32.500 20.898 1.00 0.00 H new ATOM 0 HG21 VAL A 70 23.239 30.269 20.024 1.00 0.00 H new ATOM 0 HG22 VAL A 70 24.020 31.443 18.938 1.00 0.00 H new ATOM 0 HG23 VAL A 70 24.201 29.697 18.641 1.00 0.00 H new ATOM 1138 N LEU A 71 28.552 31.801 20.398 1.00 0.00 N ATOM 1139 CA LEU A 71 29.782 31.841 21.238 1.00 0.00 C ATOM 1140 C LEU A 71 29.381 32.051 22.698 1.00 0.00 C ATOM 1141 O LEU A 71 28.404 32.715 22.988 1.00 0.00 O ATOM 1142 CB LEU A 71 30.662 33.019 20.787 1.00 0.00 C ATOM 1143 CG LEU A 71 31.448 32.647 19.526 1.00 0.00 C ATOM 1144 CD1 LEU A 71 30.504 32.061 18.473 1.00 0.00 C ATOM 1145 CD2 LEU A 71 32.118 33.902 18.959 1.00 0.00 C ATOM 0 H LEU A 71 28.322 32.675 19.925 1.00 0.00 H new ATOM 0 HA LEU A 71 30.332 30.906 21.133 1.00 0.00 H new ATOM 0 HB2 LEU A 71 30.039 33.892 20.591 1.00 0.00 H new ATOM 0 HB3 LEU A 71 31.352 33.292 21.586 1.00 0.00 H new ATOM 0 HG LEU A 71 32.204 31.905 19.782 1.00 0.00 H new ATOM 0 HD11 LEU A 71 31.072 31.800 17.580 1.00 0.00 H new ATOM 0 HD12 LEU A 71 30.024 31.168 18.872 1.00 0.00 H new ATOM 0 HD13 LEU A 71 29.743 32.798 18.216 1.00 0.00 H new ATOM 0 HD21 LEU A 71 32.678 33.641 18.061 1.00 0.00 H new ATOM 0 HD22 LEU A 71 31.356 34.640 18.709 1.00 0.00 H new ATOM 0 HD23 LEU A 71 32.797 34.319 19.702 1.00 0.00 H new ATOM 1157 N ARG A 72 30.136 31.509 23.624 1.00 0.00 N ATOM 1158 CA ARG A 72 29.822 31.689 25.077 1.00 0.00 C ATOM 1159 C ARG A 72 31.080 32.222 25.767 1.00 0.00 C ATOM 1160 O ARG A 72 32.182 31.982 25.317 1.00 0.00 O ATOM 1161 CB ARG A 72 29.439 30.333 25.687 1.00 0.00 C ATOM 1162 CG ARG A 72 28.771 30.535 27.062 1.00 0.00 C ATOM 1163 CD ARG A 72 27.265 30.767 26.895 1.00 0.00 C ATOM 1164 NE ARG A 72 26.726 31.428 28.117 1.00 0.00 N ATOM 1165 CZ ARG A 72 26.486 30.722 29.188 1.00 0.00 C ATOM 1166 NH1 ARG A 72 26.015 31.302 30.259 1.00 0.00 N ATOM 1167 NH2 ARG A 72 26.718 29.438 29.190 1.00 0.00 N ATOM 0 H ARG A 72 30.964 30.945 23.433 1.00 0.00 H new ATOM 0 HA ARG A 72 28.992 32.384 25.207 1.00 0.00 H new ATOM 0 HB2 ARG A 72 28.759 29.805 25.019 1.00 0.00 H new ATOM 0 HB3 ARG A 72 30.327 29.711 25.794 1.00 0.00 H new ATOM 0 HG2 ARG A 72 28.943 29.660 27.689 1.00 0.00 H new ATOM 0 HG3 ARG A 72 29.222 31.386 27.571 1.00 0.00 H new ATOM 0 HD2 ARG A 72 27.077 31.388 26.019 1.00 0.00 H new ATOM 0 HD3 ARG A 72 26.756 29.818 26.728 1.00 0.00 H new ATOM 0 HE ARG A 72 26.545 32.432 28.116 1.00 0.00 H new ATOM 0 HH11 ARG A 72 25.835 32.306 30.258 1.00 0.00 H new ATOM 0 HH12 ARG A 72 25.827 30.751 31.097 1.00 0.00 H new ATOM 0 HH21 ARG A 72 27.087 28.985 28.354 1.00 0.00 H new ATOM 0 HH22 ARG A 72 26.530 28.887 30.028 1.00 0.00 H new ATOM 1181 N LEU A 73 30.939 32.944 26.851 1.00 0.00 N ATOM 1182 CA LEU A 73 32.144 33.486 27.555 1.00 0.00 C ATOM 1183 C LEU A 73 32.504 32.565 28.724 1.00 0.00 C ATOM 1184 O LEU A 73 31.684 32.274 29.573 1.00 0.00 O ATOM 1185 CB LEU A 73 31.827 34.889 28.092 1.00 0.00 C ATOM 1186 CG LEU A 73 31.919 35.914 26.956 1.00 0.00 C ATOM 1187 CD1 LEU A 73 30.838 35.627 25.910 1.00 0.00 C ATOM 1188 CD2 LEU A 73 31.716 37.320 27.528 1.00 0.00 C ATOM 0 H LEU A 73 30.044 33.182 27.279 1.00 0.00 H new ATOM 0 HA LEU A 73 32.982 33.540 26.860 1.00 0.00 H new ATOM 0 HB2 LEU A 73 30.828 34.904 28.528 1.00 0.00 H new ATOM 0 HB3 LEU A 73 32.525 35.150 28.887 1.00 0.00 H new ATOM 0 HG LEU A 73 32.900 35.846 26.485 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.908 36.358 25.105 1.00 0.00 H new ATOM 0 HD12 LEU A 73 30.981 34.626 25.504 1.00 0.00 H new ATOM 0 HD13 LEU A 73 29.855 35.693 26.376 1.00 0.00 H new ATOM 0 HD21 LEU A 73 31.781 38.053 26.724 1.00 0.00 H new ATOM 0 HD22 LEU A 73 30.735 37.383 27.999 1.00 0.00 H new ATOM 0 HD23 LEU A 73 32.488 37.526 28.269 1.00 0.00 H new