USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 924 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 44 TYR OH : rot 180:sc=-0.00224 USER MOD Set 1.2: A 89 THR OG1 : rot 30:sc= 0.424 USER MOD Set 2.1: A 47 TYR OH : rot 163:sc= 1.72 USER MOD Set 2.2: A 108 LYS NZ :NH3+ 150:sc= 1.27 (180deg=0) USER MOD Set 3.1: A 38 MET CE :methyl 142:sc= -0.683 (180deg=-2.38) USER MOD Set 3.2: A 42 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 9 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 0 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl -158:sc= -0.0883 (180deg=-0.498) USER MOD Single : A 3 MET CE :methyl 162:sc= 0 (180deg=-0.255) USER MOD Single : A 4 MET CE :methyl -165:sc= -0.0734 (180deg=-0.446) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.304 X(o=-0.3,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -178:sc= -0.0659 (180deg=-0.0691) USER MOD Single : A 16 LYS NZ :NH3+ 152:sc= -0.106 (180deg=-0.699) USER MOD Single : A 18 GLN : amide:sc= -2.52! C(o=-2.5!,f=-2.9!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -110:sc= -0.729 (180deg=-4.87!) USER MOD Single : A 30 SER OG : rot 180:sc= -0.156 USER MOD Single : A 34 ASN : amide:sc= -9.56! C(o=-9.6!,f=-14!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 30:sc= -3.14 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.302 USER MOD Single : A 61 LYS NZ :NH3+ 147:sc= -0.123 (180deg=-1.42) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 13:sc= 0.73 USER MOD Single : A 68 HIS : no HE2:sc= -3.53! C(o=-3.5!,f=-7.1!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 149:sc= -2.7! (180deg=-4.32!) USER MOD Single : A 72 THR OG1 : rot 50:sc= 0.00142 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.0394 K(o=-0.039,f=-0.85) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.287 USER MOD Single : A 77 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00495) USER MOD Single : A 79 HIS : no HD1:sc= -0.542 X(o=-0.54,f=-0.27) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 39:sc= 0.92 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= -0.0952 USER MOD Single : A 103 ASN : amide:sc= -0.968 K(o=-0.97,f=-0.37) USER MOD Single : A 106 LYS NZ :NH3+ -122:sc= -0.557 (180deg=-1.79!) USER MOD Single : A 107 TYR OH : rot 180:sc= -0.22 USER MOD Single : A 111 SER OG : rot 42:sc= -0.875 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 29.626 7.395 19.857 1.00 0.00 N ATOM 2 CA GLY A 0 29.666 8.059 18.526 1.00 0.00 C ATOM 3 C GLY A 0 29.534 9.566 18.626 1.00 0.00 C ATOM 4 O GLY A 0 28.702 10.075 19.376 1.00 0.00 O ATOM 0 H1 GLY A 0 29.720 6.366 19.735 1.00 0.00 H new ATOM 0 H2 GLY A 0 30.409 7.747 20.444 1.00 0.00 H new ATOM 0 H3 GLY A 0 28.721 7.607 20.324 1.00 0.00 H new ATOM 0 HA2 GLY A 0 30.604 7.812 18.028 1.00 0.00 H new ATOM 0 HA3 GLY A 0 28.861 7.667 17.904 1.00 0.00 H new ATOM 10 N SER A 1 30.357 10.281 17.867 1.00 0.00 N ATOM 11 CA SER A 1 30.330 11.739 17.872 1.00 0.00 C ATOM 12 C SER A 1 28.987 12.260 17.372 1.00 0.00 C ATOM 13 O SER A 1 28.410 13.180 17.952 1.00 0.00 O ATOM 14 CB SER A 1 31.461 12.295 17.006 1.00 0.00 C ATOM 15 OG SER A 1 31.871 13.574 17.459 1.00 0.00 O ATOM 0 H SER A 1 31.051 9.874 17.240 1.00 0.00 H new ATOM 0 HA SER A 1 30.470 12.076 18.899 1.00 0.00 H new ATOM 0 HB2 SER A 1 32.309 11.610 17.026 1.00 0.00 H new ATOM 0 HB3 SER A 1 31.130 12.362 15.970 1.00 0.00 H new ATOM 0 HG SER A 1 32.596 13.906 16.889 1.00 0.00 H new ATOM 21 N MET A 2 28.494 11.665 16.291 1.00 0.00 N ATOM 22 CA MET A 2 27.217 12.068 15.711 1.00 0.00 C ATOM 23 C MET A 2 26.123 11.061 16.051 1.00 0.00 C ATOM 24 O MET A 2 24.990 11.438 16.353 1.00 0.00 O ATOM 25 CB MET A 2 27.344 12.209 14.194 1.00 0.00 C ATOM 26 CG MET A 2 28.463 13.142 13.760 1.00 0.00 C ATOM 27 SD MET A 2 27.954 14.872 13.731 1.00 0.00 S ATOM 28 CE MET A 2 26.848 14.877 12.323 1.00 0.00 C ATOM 0 H MET A 2 28.959 10.902 15.799 1.00 0.00 H new ATOM 0 HA MET A 2 26.942 13.033 16.136 1.00 0.00 H new ATOM 0 HB2 MET A 2 27.515 11.224 13.759 1.00 0.00 H new ATOM 0 HB3 MET A 2 26.400 12.576 13.791 1.00 0.00 H new ATOM 0 HG2 MET A 2 29.309 13.028 14.437 1.00 0.00 H new ATOM 0 HG3 MET A 2 28.808 12.852 12.767 1.00 0.00 H new ATOM 0 HE1 MET A 2 26.759 15.891 11.934 1.00 0.00 H new ATOM 0 HE2 MET A 2 27.245 14.224 11.546 1.00 0.00 H new ATOM 0 HE3 MET A 2 25.866 14.519 12.631 1.00 0.00 H new ATOM 38 N MET A 3 26.469 9.778 15.997 1.00 0.00 N ATOM 39 CA MET A 3 25.515 8.718 16.299 1.00 0.00 C ATOM 40 C MET A 3 24.329 8.764 15.341 1.00 0.00 C ATOM 41 O MET A 3 23.505 9.676 15.403 1.00 0.00 O ATOM 42 CB MET A 3 25.026 8.837 17.742 1.00 0.00 C ATOM 43 CG MET A 3 26.138 9.096 18.744 1.00 0.00 C ATOM 44 SD MET A 3 25.538 9.190 20.441 1.00 0.00 S ATOM 45 CE MET A 3 25.919 10.894 20.842 1.00 0.00 C ATOM 0 H MET A 3 27.401 9.449 15.747 1.00 0.00 H new ATOM 0 HA MET A 3 26.022 7.761 16.174 1.00 0.00 H new ATOM 0 HB2 MET A 3 24.298 9.645 17.804 1.00 0.00 H new ATOM 0 HB3 MET A 3 24.507 7.919 18.017 1.00 0.00 H new ATOM 0 HG2 MET A 3 26.881 8.302 18.669 1.00 0.00 H new ATOM 0 HG3 MET A 3 26.641 10.029 18.489 1.00 0.00 H new ATOM 0 HE1 MET A 3 25.339 11.201 21.712 1.00 0.00 H new ATOM 0 HE2 MET A 3 26.982 10.987 21.063 1.00 0.00 H new ATOM 0 HE3 MET A 3 25.668 11.532 19.995 1.00 0.00 H new ATOM 55 N MET A 4 24.250 7.776 14.456 1.00 0.00 N ATOM 56 CA MET A 4 23.165 7.705 13.484 1.00 0.00 C ATOM 57 C MET A 4 22.375 6.411 13.643 1.00 0.00 C ATOM 58 O MET A 4 22.862 5.329 13.313 1.00 0.00 O ATOM 59 CB MET A 4 23.719 7.806 12.062 1.00 0.00 C ATOM 60 CG MET A 4 24.877 6.861 11.792 1.00 0.00 C ATOM 61 SD MET A 4 25.602 7.098 10.157 1.00 0.00 S ATOM 62 CE MET A 4 24.218 6.662 9.108 1.00 0.00 C ATOM 0 H MET A 4 24.924 7.013 14.392 1.00 0.00 H new ATOM 0 HA MET A 4 22.493 8.544 13.666 1.00 0.00 H new ATOM 0 HB2 MET A 4 22.918 7.597 11.353 1.00 0.00 H new ATOM 0 HB3 MET A 4 24.046 8.830 11.880 1.00 0.00 H new ATOM 0 HG2 MET A 4 25.646 7.009 12.551 1.00 0.00 H new ATOM 0 HG3 MET A 4 24.530 5.832 11.886 1.00 0.00 H new ATOM 0 HE1 MET A 4 24.571 6.499 8.090 1.00 0.00 H new ATOM 0 HE2 MET A 4 23.752 5.750 9.481 1.00 0.00 H new ATOM 0 HE3 MET A 4 23.488 7.471 9.114 1.00 0.00 H new ATOM 72 N ALA A 5 21.151 6.529 14.148 1.00 0.00 N ATOM 73 CA ALA A 5 20.290 5.369 14.350 1.00 0.00 C ATOM 74 C ALA A 5 19.166 5.337 13.320 1.00 0.00 C ATOM 75 O ALA A 5 18.334 6.244 13.267 1.00 0.00 O ATOM 76 CB ALA A 5 19.719 5.375 15.759 1.00 0.00 C ATOM 0 H ALA A 5 20.733 7.417 14.425 1.00 0.00 H new ATOM 0 HA ALA A 5 20.893 4.470 14.220 1.00 0.00 H new ATOM 0 HB1 ALA A 5 19.078 4.504 15.896 1.00 0.00 H new ATOM 0 HB2 ALA A 5 20.534 5.343 16.482 1.00 0.00 H new ATOM 0 HB3 ALA A 5 19.135 6.282 15.911 1.00 0.00 H new ATOM 82 N LEU A 6 19.146 4.289 12.502 1.00 0.00 N ATOM 83 CA LEU A 6 18.123 4.142 11.474 1.00 0.00 C ATOM 84 C LEU A 6 17.378 2.820 11.626 1.00 0.00 C ATOM 85 O LEU A 6 17.673 2.030 12.523 1.00 0.00 O ATOM 86 CB LEU A 6 18.755 4.225 10.083 1.00 0.00 C ATOM 87 CG LEU A 6 19.850 5.283 9.931 1.00 0.00 C ATOM 88 CD1 LEU A 6 20.495 5.191 8.558 1.00 0.00 C ATOM 89 CD2 LEU A 6 19.281 6.675 10.163 1.00 0.00 C ATOM 0 H LEU A 6 19.827 3.530 12.532 1.00 0.00 H new ATOM 0 HA LEU A 6 17.407 4.955 11.593 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.175 3.251 9.833 1.00 0.00 H new ATOM 0 HB3 LEU A 6 17.970 4.430 9.355 1.00 0.00 H new ATOM 0 HG LEU A 6 20.617 5.095 10.682 1.00 0.00 H new ATOM 0 HD11 LEU A 6 21.271 5.951 8.469 1.00 0.00 H new ATOM 0 HD12 LEU A 6 20.938 4.203 8.430 1.00 0.00 H new ATOM 0 HD13 LEU A 6 19.739 5.352 7.789 1.00 0.00 H new ATOM 0 HD21 LEU A 6 20.073 7.415 10.051 1.00 0.00 H new ATOM 0 HD22 LEU A 6 18.494 6.873 9.435 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.867 6.736 11.170 1.00 0.00 H new ATOM 101 N SER A 7 16.411 2.586 10.744 1.00 0.00 N ATOM 102 CA SER A 7 15.623 1.359 10.778 1.00 0.00 C ATOM 103 C SER A 7 14.920 1.131 9.441 1.00 0.00 C ATOM 104 O SER A 7 15.234 1.784 8.447 1.00 0.00 O ATOM 105 CB SER A 7 14.595 1.421 11.912 1.00 0.00 C ATOM 106 OG SER A 7 14.875 0.451 12.907 1.00 0.00 O ATOM 0 H SER A 7 16.154 3.231 9.996 1.00 0.00 H new ATOM 0 HA SER A 7 16.298 0.522 10.959 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.600 2.416 12.358 1.00 0.00 H new ATOM 0 HB3 SER A 7 13.595 1.257 11.510 1.00 0.00 H new ATOM 0 HG SER A 7 14.206 0.512 13.621 1.00 0.00 H new ATOM 112 N LYS A 8 13.970 0.200 9.425 1.00 0.00 N ATOM 113 CA LYS A 8 13.229 -0.113 8.208 1.00 0.00 C ATOM 114 C LYS A 8 11.746 0.209 8.370 1.00 0.00 C ATOM 115 O LYS A 8 11.098 0.679 7.434 1.00 0.00 O ATOM 116 CB LYS A 8 13.403 -1.590 7.846 1.00 0.00 C ATOM 117 CG LYS A 8 14.843 -1.977 7.551 1.00 0.00 C ATOM 118 CD LYS A 8 15.548 -2.488 8.798 1.00 0.00 C ATOM 119 CE LYS A 8 16.447 -3.673 8.484 1.00 0.00 C ATOM 120 NZ LYS A 8 16.431 -4.687 9.573 1.00 0.00 N ATOM 0 H LYS A 8 13.696 -0.349 10.239 1.00 0.00 H new ATOM 0 HA LYS A 8 13.629 0.504 7.403 1.00 0.00 H new ATOM 0 HB2 LYS A 8 13.031 -2.203 8.667 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.788 -1.817 6.975 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.864 -2.746 6.779 1.00 0.00 H new ATOM 0 HG3 LYS A 8 15.379 -1.114 7.156 1.00 0.00 H new ATOM 0 HD2 LYS A 8 16.142 -1.686 9.236 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.807 -2.779 9.542 1.00 0.00 H new ATOM 0 HE2 LYS A 8 16.124 -4.137 7.552 1.00 0.00 H new ATOM 0 HE3 LYS A 8 17.468 -3.323 8.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.057 -5.478 9.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.764 -4.252 10.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.462 -5.040 9.704 1.00 0.00 H new ATOM 134 N THR A 9 11.217 -0.046 9.560 1.00 0.00 N ATOM 135 CA THR A 9 9.809 0.215 9.845 1.00 0.00 C ATOM 136 C THR A 9 9.657 0.984 11.154 1.00 0.00 C ATOM 137 O THR A 9 10.344 0.696 12.134 1.00 0.00 O ATOM 138 CB THR A 9 9.028 -1.099 9.917 1.00 0.00 C ATOM 139 OG1 THR A 9 9.192 -1.711 11.183 1.00 0.00 O ATOM 140 CG2 THR A 9 9.445 -2.105 8.863 1.00 0.00 C ATOM 0 H THR A 9 11.741 -0.434 10.345 1.00 0.00 H new ATOM 0 HA THR A 9 9.405 0.823 9.036 1.00 0.00 H new ATOM 0 HB THR A 9 7.988 -0.825 9.742 1.00 0.00 H new ATOM 0 HG1 THR A 9 8.684 -2.549 11.210 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.852 -3.013 8.972 1.00 0.00 H new ATOM 0 HG22 THR A 9 9.283 -1.682 7.872 1.00 0.00 H new ATOM 0 HG23 THR A 9 10.501 -2.345 8.987 1.00 0.00 H new ATOM 148 N PHE A 10 8.758 1.966 11.166 1.00 0.00 N ATOM 149 CA PHE A 10 8.534 2.773 12.364 1.00 0.00 C ATOM 150 C PHE A 10 7.051 3.027 12.595 1.00 0.00 C ATOM 151 O PHE A 10 6.363 3.542 11.717 1.00 0.00 O ATOM 152 CB PHE A 10 9.248 4.122 12.230 1.00 0.00 C ATOM 153 CG PHE A 10 10.292 4.160 11.150 1.00 0.00 C ATOM 154 CD1 PHE A 10 10.126 4.970 10.038 1.00 0.00 C ATOM 155 CD2 PHE A 10 11.435 3.384 11.245 1.00 0.00 C ATOM 156 CE1 PHE A 10 11.080 5.006 9.040 1.00 0.00 C ATOM 157 CE2 PHE A 10 12.394 3.416 10.248 1.00 0.00 C ATOM 158 CZ PHE A 10 12.215 4.228 9.145 1.00 0.00 C ATOM 0 H PHE A 10 8.177 2.221 10.367 1.00 0.00 H new ATOM 0 HA PHE A 10 8.933 2.217 13.212 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.506 4.895 12.030 1.00 0.00 H new ATOM 0 HB3 PHE A 10 9.717 4.369 13.182 1.00 0.00 H new ATOM 0 HD1 PHE A 10 9.240 5.581 9.951 1.00 0.00 H new ATOM 0 HD2 PHE A 10 11.579 2.748 12.106 1.00 0.00 H new ATOM 0 HE1 PHE A 10 10.938 5.642 8.179 1.00 0.00 H new ATOM 0 HE2 PHE A 10 13.282 2.807 10.332 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.962 4.254 8.366 1.00 0.00 H new ATOM 168 N GLY A 11 6.565 2.701 13.789 1.00 0.00 N ATOM 169 CA GLY A 11 5.168 2.946 14.095 1.00 0.00 C ATOM 170 C GLY A 11 4.291 1.733 13.864 1.00 0.00 C ATOM 171 O GLY A 11 4.780 0.634 13.605 1.00 0.00 O ATOM 0 H GLY A 11 7.107 2.276 14.542 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.079 3.259 15.135 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.806 3.771 13.481 1.00 0.00 H new ATOM 175 N GLN A 12 2.983 1.945 13.941 1.00 0.00 N ATOM 176 CA GLN A 12 2.014 0.882 13.713 1.00 0.00 C ATOM 177 C GLN A 12 2.047 0.460 12.247 1.00 0.00 C ATOM 178 O GLN A 12 2.479 1.225 11.385 1.00 0.00 O ATOM 179 CB GLN A 12 0.607 1.346 14.100 1.00 0.00 C ATOM 180 CG GLN A 12 0.040 2.415 13.179 1.00 0.00 C ATOM 181 CD GLN A 12 -1.022 3.262 13.851 1.00 0.00 C ATOM 182 OE1 GLN A 12 -2.213 2.958 13.778 1.00 0.00 O ATOM 183 NE2 GLN A 12 -0.596 4.333 14.509 1.00 0.00 N ATOM 0 H GLN A 12 2.567 2.850 14.161 1.00 0.00 H new ATOM 0 HA GLN A 12 2.276 0.027 14.336 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -0.063 0.486 14.099 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.629 1.732 15.119 1.00 0.00 H new ATOM 0 HG2 GLN A 12 0.849 3.059 12.835 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -0.386 1.939 12.296 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.401 4.547 14.544 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -1.265 4.942 14.980 1.00 0.00 H new ATOM 192 N LYS A 13 1.605 -0.759 11.965 1.00 0.00 N ATOM 193 CA LYS A 13 1.607 -1.266 10.597 1.00 0.00 C ATOM 194 C LYS A 13 0.580 -0.514 9.752 1.00 0.00 C ATOM 195 O LYS A 13 -0.476 -0.121 10.249 1.00 0.00 O ATOM 196 CB LYS A 13 1.293 -2.769 10.593 1.00 0.00 C ATOM 197 CG LYS A 13 1.091 -3.365 9.205 1.00 0.00 C ATOM 198 CD LYS A 13 2.391 -3.916 8.642 1.00 0.00 C ATOM 199 CE LYS A 13 2.498 -5.418 8.851 1.00 0.00 C ATOM 200 NZ LYS A 13 2.561 -5.774 10.295 1.00 0.00 N ATOM 0 H LYS A 13 1.243 -1.412 12.660 1.00 0.00 H new ATOM 0 HA LYS A 13 2.596 -1.109 10.167 1.00 0.00 H new ATOM 0 HB2 LYS A 13 2.106 -3.299 11.088 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.394 -2.942 11.184 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.348 -4.161 9.254 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.697 -2.602 8.534 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.452 -3.691 7.577 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.235 -3.420 9.121 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.640 -5.910 8.393 1.00 0.00 H new ATOM 0 HE3 LYS A 13 3.388 -5.792 8.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.668 -6.804 10.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 3.374 -5.298 10.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.685 -5.470 10.766 1.00 0.00 H new ATOM 214 N PRO A 14 0.886 -0.286 8.460 1.00 0.00 N ATOM 215 CA PRO A 14 -0.011 0.441 7.557 1.00 0.00 C ATOM 216 C PRO A 14 -1.363 -0.244 7.417 1.00 0.00 C ATOM 217 O PRO A 14 -1.499 -1.436 7.688 1.00 0.00 O ATOM 218 CB PRO A 14 0.731 0.430 6.215 1.00 0.00 C ATOM 219 CG PRO A 14 2.157 0.175 6.563 1.00 0.00 C ATOM 220 CD PRO A 14 2.132 -0.695 7.785 1.00 0.00 C ATOM 0 HA PRO A 14 -0.229 1.443 7.926 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.341 -0.345 5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.616 1.380 5.693 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.677 -0.319 5.742 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.684 1.109 6.759 1.00 0.00 H new ATOM 0 HD2 PRO A 14 2.122 -1.754 7.526 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.005 -0.530 8.416 1.00 0.00 H new ATOM 228 N VAL A 15 -2.365 0.524 7.005 1.00 0.00 N ATOM 229 CA VAL A 15 -3.711 -0.004 6.844 1.00 0.00 C ATOM 230 C VAL A 15 -3.818 -0.909 5.619 1.00 0.00 C ATOM 231 O VAL A 15 -3.636 -0.466 4.477 1.00 0.00 O ATOM 232 CB VAL A 15 -4.752 1.128 6.741 1.00 0.00 C ATOM 233 CG1 VAL A 15 -4.650 2.057 7.943 1.00 0.00 C ATOM 234 CG2 VAL A 15 -4.586 1.901 5.442 1.00 0.00 C ATOM 0 H VAL A 15 -2.269 1.514 6.777 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.922 -0.596 7.734 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.746 0.680 6.739 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.392 2.850 7.854 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.832 1.491 8.857 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.653 2.496 7.980 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.332 2.694 5.393 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.588 2.338 5.404 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.719 1.225 4.597 1.00 0.00 H new ATOM 244 N LYS A 16 -4.126 -2.179 5.874 1.00 0.00 N ATOM 245 CA LYS A 16 -4.281 -3.166 4.817 1.00 0.00 C ATOM 246 C LYS A 16 -5.754 -3.536 4.669 1.00 0.00 C ATOM 247 O LYS A 16 -6.546 -3.328 5.588 1.00 0.00 O ATOM 248 CB LYS A 16 -3.455 -4.419 5.122 1.00 0.00 C ATOM 249 CG LYS A 16 -3.638 -4.948 6.535 1.00 0.00 C ATOM 250 CD LYS A 16 -3.435 -6.454 6.596 1.00 0.00 C ATOM 251 CE LYS A 16 -2.177 -6.818 7.369 1.00 0.00 C ATOM 252 NZ LYS A 16 -2.201 -6.285 8.759 1.00 0.00 N ATOM 0 H LYS A 16 -4.274 -2.547 6.814 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.921 -2.735 3.883 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.725 -5.202 4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.400 -4.195 4.962 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.930 -4.457 7.203 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.638 -4.700 6.891 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.300 -6.920 7.068 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.370 -6.854 5.584 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.071 -7.902 7.399 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.304 -6.427 6.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.630 -6.897 9.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -1.809 -5.322 8.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.181 -6.263 9.105 1.00 0.00 H new ATOM 266 N PHE A 17 -6.124 -4.079 3.516 1.00 0.00 N ATOM 267 CA PHE A 17 -7.510 -4.464 3.276 1.00 0.00 C ATOM 268 C PHE A 17 -7.610 -5.534 2.198 1.00 0.00 C ATOM 269 O PHE A 17 -6.656 -5.782 1.468 1.00 0.00 O ATOM 270 CB PHE A 17 -8.338 -3.245 2.871 1.00 0.00 C ATOM 271 CG PHE A 17 -7.716 -2.428 1.771 1.00 0.00 C ATOM 272 CD1 PHE A 17 -7.893 -2.781 0.441 1.00 0.00 C ATOM 273 CD2 PHE A 17 -6.955 -1.309 2.067 1.00 0.00 C ATOM 274 CE1 PHE A 17 -7.323 -2.030 -0.570 1.00 0.00 C ATOM 275 CE2 PHE A 17 -6.384 -0.557 1.061 1.00 0.00 C ATOM 276 CZ PHE A 17 -6.566 -0.916 -0.259 1.00 0.00 C ATOM 0 H PHE A 17 -5.490 -4.262 2.738 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.904 -4.876 4.205 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.325 -3.578 2.550 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.484 -2.610 3.745 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -8.482 -3.651 0.193 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.807 -1.022 3.098 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.469 -2.313 -1.602 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.794 0.314 1.307 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.118 -0.328 -1.047 1.00 0.00 H new ATOM 286 N GLN A 18 -8.776 -6.158 2.102 1.00 0.00 N ATOM 287 CA GLN A 18 -9.004 -7.196 1.109 1.00 0.00 C ATOM 288 C GLN A 18 -9.826 -6.654 -0.053 1.00 0.00 C ATOM 289 O GLN A 18 -10.890 -6.070 0.147 1.00 0.00 O ATOM 290 CB GLN A 18 -9.717 -8.392 1.741 1.00 0.00 C ATOM 291 CG GLN A 18 -9.298 -9.727 1.155 1.00 0.00 C ATOM 292 CD GLN A 18 -10.478 -10.623 0.842 1.00 0.00 C ATOM 293 OE1 GLN A 18 -11.499 -10.167 0.326 1.00 0.00 O ATOM 294 NE2 GLN A 18 -10.346 -11.904 1.155 1.00 0.00 N ATOM 0 H GLN A 18 -9.578 -5.963 2.701 1.00 0.00 H new ATOM 0 HA GLN A 18 -8.036 -7.524 0.729 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.520 -8.397 2.813 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.793 -8.271 1.615 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.725 -9.556 0.244 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.637 -10.236 1.856 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.482 -12.238 1.581 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.109 -12.556 0.970 1.00 0.00 H new ATOM 303 N LEU A 19 -9.327 -6.849 -1.269 1.00 0.00 N ATOM 304 CA LEU A 19 -10.021 -6.374 -2.460 1.00 0.00 C ATOM 305 C LEU A 19 -10.639 -7.536 -3.234 1.00 0.00 C ATOM 306 O LEU A 19 -11.634 -7.362 -3.939 1.00 0.00 O ATOM 307 CB LEU A 19 -9.061 -5.592 -3.365 1.00 0.00 C ATOM 308 CG LEU A 19 -8.973 -4.087 -3.092 1.00 0.00 C ATOM 309 CD1 LEU A 19 -8.259 -3.384 -4.234 1.00 0.00 C ATOM 310 CD2 LEU A 19 -10.358 -3.487 -2.888 1.00 0.00 C ATOM 0 H LEU A 19 -8.448 -7.331 -1.455 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.823 -5.710 -2.138 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.064 -6.021 -3.263 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.367 -5.738 -4.401 1.00 0.00 H new ATOM 0 HG LEU A 19 -8.401 -3.942 -2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.204 -2.315 -4.026 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.251 -3.786 -4.335 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -8.809 -3.545 -5.161 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -10.267 -2.418 -2.696 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -10.958 -3.645 -3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -10.841 -3.968 -2.038 1.00 0.00 H new ATOM 322 N GLU A 20 -10.046 -8.719 -3.101 1.00 0.00 N ATOM 323 CA GLU A 20 -10.547 -9.903 -3.792 1.00 0.00 C ATOM 324 C GLU A 20 -10.924 -11.000 -2.801 1.00 0.00 C ATOM 325 O GLU A 20 -10.267 -11.178 -1.776 1.00 0.00 O ATOM 326 CB GLU A 20 -9.504 -10.430 -4.778 1.00 0.00 C ATOM 327 CG GLU A 20 -8.810 -9.338 -5.576 1.00 0.00 C ATOM 328 CD GLU A 20 -9.672 -8.804 -6.704 1.00 0.00 C ATOM 329 OE1 GLU A 20 -10.735 -8.217 -6.412 1.00 0.00 O ATOM 330 OE2 GLU A 20 -9.283 -8.972 -7.878 1.00 0.00 O ATOM 0 H GLU A 20 -9.221 -8.883 -2.524 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.442 -9.613 -4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -8.754 -10.999 -4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.987 -11.121 -5.469 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -8.543 -8.519 -4.908 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.880 -9.729 -5.988 1.00 0.00 H new ATOM 337 N ASP A 21 -11.984 -11.732 -3.121 1.00 0.00 N ATOM 338 CA ASP A 21 -12.465 -12.818 -2.271 1.00 0.00 C ATOM 339 C ASP A 21 -11.463 -13.971 -2.201 1.00 0.00 C ATOM 340 O ASP A 21 -11.607 -14.875 -1.378 1.00 0.00 O ATOM 341 CB ASP A 21 -13.810 -13.332 -2.785 1.00 0.00 C ATOM 342 CG ASP A 21 -14.709 -13.819 -1.664 1.00 0.00 C ATOM 343 OD1 ASP A 21 -14.177 -14.211 -0.605 1.00 0.00 O ATOM 344 OD2 ASP A 21 -15.945 -13.807 -1.847 1.00 0.00 O ATOM 0 H ASP A 21 -12.532 -11.593 -3.970 1.00 0.00 H new ATOM 0 HA ASP A 21 -12.586 -12.418 -1.264 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.315 -12.536 -3.332 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.640 -14.146 -3.490 1.00 0.00 H new ATOM 349 N ASP A 22 -10.461 -13.949 -3.077 1.00 0.00 N ATOM 350 CA ASP A 22 -9.459 -15.010 -3.114 1.00 0.00 C ATOM 351 C ASP A 22 -8.382 -14.817 -2.046 1.00 0.00 C ATOM 352 O ASP A 22 -7.471 -15.635 -1.923 1.00 0.00 O ATOM 353 CB ASP A 22 -8.810 -15.073 -4.498 1.00 0.00 C ATOM 354 CG ASP A 22 -9.585 -15.950 -5.460 1.00 0.00 C ATOM 355 OD1 ASP A 22 -8.972 -16.468 -6.417 1.00 0.00 O ATOM 356 OD2 ASP A 22 -10.805 -16.122 -5.257 1.00 0.00 O ATOM 0 H ASP A 22 -10.322 -13.211 -3.768 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.971 -15.949 -2.905 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.736 -14.066 -4.908 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -7.793 -15.454 -4.402 1.00 0.00 H new ATOM 361 N GLY A 23 -8.494 -13.745 -1.264 1.00 0.00 N ATOM 362 CA GLY A 23 -7.524 -13.496 -0.213 1.00 0.00 C ATOM 363 C GLY A 23 -6.479 -12.465 -0.595 1.00 0.00 C ATOM 364 O GLY A 23 -5.369 -12.476 -0.062 1.00 0.00 O ATOM 0 H GLY A 23 -9.235 -13.049 -1.340 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.047 -13.159 0.682 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.026 -14.431 0.042 1.00 0.00 H new ATOM 368 N GLU A 24 -6.828 -11.568 -1.510 1.00 0.00 N ATOM 369 CA GLU A 24 -5.900 -10.529 -1.942 1.00 0.00 C ATOM 370 C GLU A 24 -5.933 -9.349 -0.977 1.00 0.00 C ATOM 371 O GLU A 24 -6.962 -8.690 -0.820 1.00 0.00 O ATOM 372 CB GLU A 24 -6.245 -10.057 -3.356 1.00 0.00 C ATOM 373 CG GLU A 24 -5.786 -11.014 -4.445 1.00 0.00 C ATOM 374 CD GLU A 24 -6.640 -12.265 -4.521 1.00 0.00 C ATOM 375 OE1 GLU A 24 -6.562 -13.095 -3.591 1.00 0.00 O ATOM 376 OE2 GLU A 24 -7.387 -12.413 -5.510 1.00 0.00 O ATOM 0 H GLU A 24 -7.741 -11.539 -1.965 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.895 -10.950 -1.948 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.324 -9.923 -3.432 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.790 -9.081 -3.526 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -5.811 -10.502 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.749 -11.297 -4.262 1.00 0.00 H new ATOM 383 N PHE A 25 -4.802 -9.089 -0.327 1.00 0.00 N ATOM 384 CA PHE A 25 -4.707 -7.993 0.628 1.00 0.00 C ATOM 385 C PHE A 25 -3.789 -6.889 0.117 1.00 0.00 C ATOM 386 O PHE A 25 -2.674 -7.151 -0.336 1.00 0.00 O ATOM 387 CB PHE A 25 -4.202 -8.504 1.978 1.00 0.00 C ATOM 388 CG PHE A 25 -5.303 -8.846 2.940 1.00 0.00 C ATOM 389 CD1 PHE A 25 -5.652 -7.973 3.960 1.00 0.00 C ATOM 390 CD2 PHE A 25 -5.991 -10.043 2.822 1.00 0.00 C ATOM 391 CE1 PHE A 25 -6.667 -8.291 4.843 1.00 0.00 C ATOM 392 CE2 PHE A 25 -7.005 -10.364 3.702 1.00 0.00 C ATOM 393 CZ PHE A 25 -7.345 -9.488 4.714 1.00 0.00 C ATOM 0 H PHE A 25 -3.941 -9.622 -0.445 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.706 -7.576 0.753 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.585 -9.388 1.815 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.560 -7.746 2.427 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.126 -7.036 4.065 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.731 -10.733 2.033 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -6.930 -7.604 5.634 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -7.533 -11.301 3.599 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.139 -9.738 5.403 1.00 0.00 H new ATOM 403 N TYR A 26 -4.264 -5.653 0.206 1.00 0.00 N ATOM 404 CA TYR A 26 -3.495 -4.498 -0.231 1.00 0.00 C ATOM 405 C TYR A 26 -3.328 -3.507 0.910 1.00 0.00 C ATOM 406 O TYR A 26 -4.003 -3.603 1.932 1.00 0.00 O ATOM 407 CB TYR A 26 -4.171 -3.807 -1.412 1.00 0.00 C ATOM 408 CG TYR A 26 -4.219 -4.649 -2.664 1.00 0.00 C ATOM 409 CD1 TYR A 26 -5.199 -5.617 -2.841 1.00 0.00 C ATOM 410 CD2 TYR A 26 -3.279 -4.476 -3.670 1.00 0.00 C ATOM 411 CE1 TYR A 26 -5.240 -6.388 -3.987 1.00 0.00 C ATOM 412 CE2 TYR A 26 -3.313 -5.241 -4.818 1.00 0.00 C ATOM 413 CZ TYR A 26 -4.295 -6.196 -4.972 1.00 0.00 C ATOM 414 OH TYR A 26 -4.332 -6.962 -6.115 1.00 0.00 O ATOM 0 H TYR A 26 -5.185 -5.425 0.580 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.513 -4.852 -0.546 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.188 -3.535 -1.129 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.642 -2.879 -1.629 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -5.941 -5.770 -2.071 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.507 -3.730 -3.552 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -6.008 -7.137 -4.110 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -2.574 -5.092 -5.592 1.00 0.00 H new ATOM 0 HH TYR A 26 -3.597 -6.700 -6.708 1.00 0.00 H new ATOM 424 N MET A 27 -2.427 -2.557 0.723 1.00 0.00 N ATOM 425 CA MET A 27 -2.164 -1.538 1.732 1.00 0.00 C ATOM 426 C MET A 27 -2.148 -0.154 1.099 1.00 0.00 C ATOM 427 O MET A 27 -1.756 -0.001 -0.059 1.00 0.00 O ATOM 428 CB MET A 27 -0.826 -1.808 2.423 1.00 0.00 C ATOM 429 CG MET A 27 -0.804 -3.099 3.221 1.00 0.00 C ATOM 430 SD MET A 27 -0.151 -2.876 4.886 1.00 0.00 S ATOM 431 CE MET A 27 1.248 -3.990 4.847 1.00 0.00 C ATOM 0 H MET A 27 -1.862 -2.468 -0.121 1.00 0.00 H new ATOM 0 HA MET A 27 -2.961 -1.576 2.474 1.00 0.00 H new ATOM 0 HB2 MET A 27 -0.038 -1.842 1.670 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.595 -0.976 3.088 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.815 -3.501 3.283 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.199 -3.837 2.694 1.00 0.00 H new ATOM 0 HE1 MET A 27 1.047 -4.849 5.488 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.413 -4.331 3.825 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.137 -3.470 5.205 1.00 0.00 H new ATOM 441 N ILE A 28 -2.574 0.855 1.856 1.00 0.00 N ATOM 442 CA ILE A 28 -2.592 2.219 1.336 1.00 0.00 C ATOM 443 C ILE A 28 -1.191 2.830 1.359 1.00 0.00 C ATOM 444 O ILE A 28 -0.551 2.915 2.412 1.00 0.00 O ATOM 445 CB ILE A 28 -3.565 3.128 2.110 1.00 0.00 C ATOM 446 CG1 ILE A 28 -4.899 2.413 2.333 1.00 0.00 C ATOM 447 CG2 ILE A 28 -3.788 4.422 1.343 1.00 0.00 C ATOM 448 CD1 ILE A 28 -5.929 3.263 3.046 1.00 0.00 C ATOM 0 H ILE A 28 -2.906 0.757 2.815 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.942 2.153 0.306 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.129 3.361 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -5.301 2.102 1.369 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.724 1.507 2.912 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.477 5.059 1.897 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.837 4.939 1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -4.210 4.196 0.364 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.849 2.692 3.170 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.547 3.553 4.025 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.133 4.157 2.457 1.00 0.00 H new ATOM 460 N GLY A 29 -0.719 3.247 0.186 1.00 0.00 N ATOM 461 CA GLY A 29 0.609 3.827 0.074 1.00 0.00 C ATOM 462 C GLY A 29 0.825 4.997 1.010 1.00 0.00 C ATOM 463 O GLY A 29 1.955 5.277 1.404 1.00 0.00 O ATOM 0 H GLY A 29 -1.235 3.193 -0.692 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.354 3.059 0.284 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.770 4.156 -0.953 1.00 0.00 H new ATOM 467 N SER A 30 -0.254 5.674 1.378 1.00 0.00 N ATOM 468 CA SER A 30 -0.155 6.805 2.289 1.00 0.00 C ATOM 469 C SER A 30 0.380 6.338 3.637 1.00 0.00 C ATOM 470 O SER A 30 1.250 6.978 4.238 1.00 0.00 O ATOM 471 CB SER A 30 -1.521 7.469 2.466 1.00 0.00 C ATOM 472 OG SER A 30 -2.322 6.753 3.391 1.00 0.00 O ATOM 0 H SER A 30 -1.201 5.462 1.063 1.00 0.00 H new ATOM 0 HA SER A 30 0.533 7.537 1.867 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.388 8.494 2.813 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.030 7.521 1.504 1.00 0.00 H new ATOM 0 HG SER A 30 -3.189 7.199 3.487 1.00 0.00 H new ATOM 478 N GLU A 31 -0.134 5.200 4.099 1.00 0.00 N ATOM 479 CA GLU A 31 0.297 4.633 5.365 1.00 0.00 C ATOM 480 C GLU A 31 1.707 4.082 5.237 1.00 0.00 C ATOM 481 O GLU A 31 2.540 4.264 6.123 1.00 0.00 O ATOM 482 CB GLU A 31 -0.664 3.533 5.816 1.00 0.00 C ATOM 483 CG GLU A 31 -1.984 4.065 6.350 1.00 0.00 C ATOM 484 CD GLU A 31 -2.108 3.920 7.853 1.00 0.00 C ATOM 485 OE1 GLU A 31 -1.879 2.804 8.364 1.00 0.00 O ATOM 486 OE2 GLU A 31 -2.435 4.923 8.522 1.00 0.00 O ATOM 0 H GLU A 31 -0.848 4.657 3.613 1.00 0.00 H new ATOM 0 HA GLU A 31 0.294 5.421 6.118 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.862 2.867 4.976 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.182 2.935 6.590 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.082 5.117 6.081 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.806 3.535 5.869 1.00 0.00 H new ATOM 493 N VAL A 32 1.969 3.424 4.115 1.00 0.00 N ATOM 494 CA VAL A 32 3.286 2.862 3.857 1.00 0.00 C ATOM 495 C VAL A 32 4.334 3.966 3.810 1.00 0.00 C ATOM 496 O VAL A 32 5.439 3.814 4.331 1.00 0.00 O ATOM 497 CB VAL A 32 3.317 2.076 2.532 1.00 0.00 C ATOM 498 CG1 VAL A 32 4.658 1.382 2.350 1.00 0.00 C ATOM 499 CG2 VAL A 32 2.177 1.070 2.482 1.00 0.00 C ATOM 0 H VAL A 32 1.288 3.267 3.372 1.00 0.00 H new ATOM 0 HA VAL A 32 3.511 2.175 4.673 1.00 0.00 H new ATOM 0 HB VAL A 32 3.187 2.781 1.711 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.659 0.833 1.408 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.454 2.126 2.336 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.824 0.689 3.175 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.215 0.524 1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.274 0.369 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.225 1.595 2.560 1.00 0.00 H new ATOM 509 N GLY A 33 3.974 5.080 3.183 1.00 0.00 N ATOM 510 CA GLY A 33 4.888 6.199 3.079 1.00 0.00 C ATOM 511 C GLY A 33 5.232 6.790 4.432 1.00 0.00 C ATOM 512 O GLY A 33 6.408 6.958 4.760 1.00 0.00 O ATOM 0 H GLY A 33 3.065 5.227 2.745 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.803 5.873 2.584 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.444 6.971 2.450 1.00 0.00 H new ATOM 516 N ASN A 34 4.213 7.093 5.232 1.00 0.00 N ATOM 517 CA ASN A 34 4.452 7.653 6.557 1.00 0.00 C ATOM 518 C ASN A 34 5.172 6.635 7.435 1.00 0.00 C ATOM 519 O ASN A 34 5.986 6.993 8.285 1.00 0.00 O ATOM 520 CB ASN A 34 3.146 8.123 7.211 1.00 0.00 C ATOM 521 CG ASN A 34 2.196 6.992 7.565 1.00 0.00 C ATOM 522 OD1 ASN A 34 2.614 5.913 7.979 1.00 0.00 O ATOM 523 ND2 ASN A 34 0.902 7.245 7.415 1.00 0.00 N ATOM 0 H ASN A 34 3.230 6.963 4.991 1.00 0.00 H new ATOM 0 HA ASN A 34 5.091 8.530 6.447 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.384 8.682 8.116 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.640 8.812 6.535 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.212 6.530 7.647 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.597 8.154 7.068 1.00 0.00 H new ATOM 530 N TYR A 35 4.870 5.359 7.210 1.00 0.00 N ATOM 531 CA TYR A 35 5.485 4.274 7.965 1.00 0.00 C ATOM 532 C TYR A 35 6.995 4.253 7.752 1.00 0.00 C ATOM 533 O TYR A 35 7.764 4.086 8.697 1.00 0.00 O ATOM 534 CB TYR A 35 4.876 2.942 7.521 1.00 0.00 C ATOM 535 CG TYR A 35 5.154 1.800 8.461 1.00 0.00 C ATOM 536 CD1 TYR A 35 5.379 0.517 7.981 1.00 0.00 C ATOM 537 CD2 TYR A 35 5.187 2.004 9.829 1.00 0.00 C ATOM 538 CE1 TYR A 35 5.631 -0.528 8.845 1.00 0.00 C ATOM 539 CE2 TYR A 35 5.440 0.967 10.698 1.00 0.00 C ATOM 540 CZ TYR A 35 5.662 -0.298 10.203 1.00 0.00 C ATOM 541 OH TYR A 35 5.913 -1.338 11.068 1.00 0.00 O ATOM 0 H TYR A 35 4.199 5.051 6.506 1.00 0.00 H new ATOM 0 HA TYR A 35 5.294 4.431 9.027 1.00 0.00 H new ATOM 0 HB2 TYR A 35 3.797 3.063 7.421 1.00 0.00 H new ATOM 0 HB3 TYR A 35 5.262 2.689 6.533 1.00 0.00 H new ATOM 0 HD1 TYR A 35 5.356 0.335 6.917 1.00 0.00 H new ATOM 0 HD2 TYR A 35 5.011 2.994 10.222 1.00 0.00 H new ATOM 0 HE1 TYR A 35 5.803 -1.522 8.459 1.00 0.00 H new ATOM 0 HE2 TYR A 35 5.464 1.145 11.763 1.00 0.00 H new ATOM 0 HH TYR A 35 5.901 -1.007 11.990 1.00 0.00 H new ATOM 551 N LEU A 36 7.407 4.440 6.505 1.00 0.00 N ATOM 552 CA LEU A 36 8.825 4.459 6.164 1.00 0.00 C ATOM 553 C LEU A 36 9.375 5.887 6.188 1.00 0.00 C ATOM 554 O LEU A 36 10.572 6.103 5.997 1.00 0.00 O ATOM 555 CB LEU A 36 9.055 3.835 4.786 1.00 0.00 C ATOM 556 CG LEU A 36 8.594 2.382 4.650 1.00 0.00 C ATOM 557 CD1 LEU A 36 7.538 2.246 3.559 1.00 0.00 C ATOM 558 CD2 LEU A 36 9.779 1.470 4.364 1.00 0.00 C ATOM 0 H LEU A 36 6.780 4.581 5.713 1.00 0.00 H new ATOM 0 HA LEU A 36 9.356 3.871 6.912 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.536 4.437 4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.119 3.886 4.553 1.00 0.00 H new ATOM 0 HG LEU A 36 8.145 2.079 5.596 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.227 1.204 3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.676 2.865 3.808 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.955 2.571 2.606 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.432 0.441 4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.258 1.777 3.435 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.496 1.538 5.182 1.00 0.00 H new ATOM 570 N ARG A 37 8.493 6.859 6.424 1.00 0.00 N ATOM 571 CA ARG A 37 8.885 8.263 6.477 1.00 0.00 C ATOM 572 C ARG A 37 9.297 8.776 5.101 1.00 0.00 C ATOM 573 O ARG A 37 10.132 9.672 4.986 1.00 0.00 O ATOM 574 CB ARG A 37 10.034 8.464 7.469 1.00 0.00 C ATOM 575 CG ARG A 37 9.996 9.808 8.180 1.00 0.00 C ATOM 576 CD ARG A 37 11.261 10.612 7.928 1.00 0.00 C ATOM 577 NE ARG A 37 11.654 11.398 9.094 1.00 0.00 N ATOM 578 CZ ARG A 37 12.710 12.208 9.123 1.00 0.00 C ATOM 579 NH1 ARG A 37 13.480 12.342 8.050 1.00 0.00 N ATOM 580 NH2 ARG A 37 12.996 12.887 10.225 1.00 0.00 N ATOM 0 H ARG A 37 7.499 6.696 6.582 1.00 0.00 H new ATOM 0 HA ARG A 37 8.019 8.833 6.812 1.00 0.00 H new ATOM 0 HB2 ARG A 37 10.004 7.668 8.213 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.982 8.370 6.939 1.00 0.00 H new ATOM 0 HG2 ARG A 37 9.130 10.376 7.840 1.00 0.00 H new ATOM 0 HG3 ARG A 37 9.872 9.650 9.251 1.00 0.00 H new ATOM 0 HD2 ARG A 37 12.072 9.936 7.657 1.00 0.00 H new ATOM 0 HD3 ARG A 37 11.104 11.277 7.079 1.00 0.00 H new ATOM 0 HE ARG A 37 11.085 11.322 9.937 1.00 0.00 H new ATOM 0 HH11 ARG A 37 13.263 11.823 7.199 1.00 0.00 H new ATOM 0 HH12 ARG A 37 14.288 12.964 8.077 1.00 0.00 H new ATOM 0 HH21 ARG A 37 12.407 12.789 11.052 1.00 0.00 H new ATOM 0 HH22 ARG A 37 13.805 13.507 10.246 1.00 0.00 H new ATOM 594 N MET A 38 8.691 8.217 4.058 1.00 0.00 N ATOM 595 CA MET A 38 8.986 8.636 2.695 1.00 0.00 C ATOM 596 C MET A 38 7.865 9.523 2.165 1.00 0.00 C ATOM 597 O MET A 38 6.695 9.143 2.197 1.00 0.00 O ATOM 598 CB MET A 38 9.169 7.419 1.787 1.00 0.00 C ATOM 599 CG MET A 38 10.526 6.750 1.934 1.00 0.00 C ATOM 600 SD MET A 38 10.742 5.360 0.805 1.00 0.00 S ATOM 601 CE MET A 38 12.367 5.714 0.141 1.00 0.00 C ATOM 0 H MET A 38 7.995 7.475 4.132 1.00 0.00 H new ATOM 0 HA MET A 38 9.915 9.206 2.701 1.00 0.00 H new ATOM 0 HB2 MET A 38 8.388 6.691 2.007 1.00 0.00 H new ATOM 0 HB3 MET A 38 9.035 7.726 0.750 1.00 0.00 H new ATOM 0 HG2 MET A 38 11.310 7.485 1.753 1.00 0.00 H new ATOM 0 HG3 MET A 38 10.646 6.402 2.960 1.00 0.00 H new ATOM 0 HE1 MET A 38 12.919 4.783 0.013 1.00 0.00 H new ATOM 0 HE2 MET A 38 12.265 6.211 -0.824 1.00 0.00 H new ATOM 0 HE3 MET A 38 12.907 6.364 0.829 1.00 0.00 H new ATOM 611 N PHE A 39 8.227 10.707 1.686 1.00 0.00 N ATOM 612 CA PHE A 39 7.245 11.649 1.160 1.00 0.00 C ATOM 613 C PHE A 39 7.615 12.101 -0.248 1.00 0.00 C ATOM 614 O PHE A 39 8.675 11.748 -0.766 1.00 0.00 O ATOM 615 CB PHE A 39 7.126 12.862 2.089 1.00 0.00 C ATOM 616 CG PHE A 39 7.222 12.509 3.548 1.00 0.00 C ATOM 617 CD1 PHE A 39 6.079 12.269 4.295 1.00 0.00 C ATOM 618 CD2 PHE A 39 8.458 12.411 4.170 1.00 0.00 C ATOM 619 CE1 PHE A 39 6.168 11.940 5.635 1.00 0.00 C ATOM 620 CE2 PHE A 39 8.551 12.084 5.509 1.00 0.00 C ATOM 621 CZ PHE A 39 7.404 11.848 6.242 1.00 0.00 C ATOM 0 H PHE A 39 9.191 11.038 1.651 1.00 0.00 H new ATOM 0 HA PHE A 39 6.282 11.141 1.111 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.911 13.577 1.843 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.174 13.359 1.905 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.109 12.340 3.825 1.00 0.00 H new ATOM 0 HD2 PHE A 39 9.358 12.592 3.601 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.270 11.755 6.207 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.519 12.013 5.982 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.475 11.592 7.289 1.00 0.00 H new ATOM 631 N ARG A 40 6.734 12.883 -0.864 1.00 0.00 N ATOM 632 CA ARG A 40 6.967 13.384 -2.214 1.00 0.00 C ATOM 633 C ARG A 40 7.156 12.230 -3.194 1.00 0.00 C ATOM 634 O ARG A 40 8.039 12.267 -4.051 1.00 0.00 O ATOM 635 CB ARG A 40 8.194 14.297 -2.235 1.00 0.00 C ATOM 636 CG ARG A 40 7.876 15.752 -1.932 1.00 0.00 C ATOM 637 CD ARG A 40 9.103 16.635 -2.093 1.00 0.00 C ATOM 638 NE ARG A 40 8.799 18.043 -1.849 1.00 0.00 N ATOM 639 CZ ARG A 40 9.589 19.047 -2.223 1.00 0.00 C ATOM 640 NH1 ARG A 40 10.729 18.803 -2.858 1.00 0.00 N ATOM 641 NH2 ARG A 40 9.238 20.299 -1.962 1.00 0.00 N ATOM 0 H ARG A 40 5.852 13.184 -0.450 1.00 0.00 H new ATOM 0 HA ARG A 40 6.093 13.958 -2.521 1.00 0.00 H new ATOM 0 HB2 ARG A 40 8.919 13.933 -1.507 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.667 14.234 -3.215 1.00 0.00 H new ATOM 0 HG2 ARG A 40 7.086 16.099 -2.598 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.495 15.838 -0.914 1.00 0.00 H new ATOM 0 HD2 ARG A 40 9.879 16.307 -1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.503 16.520 -3.100 1.00 0.00 H new ATOM 0 HE ARG A 40 7.931 18.270 -1.364 1.00 0.00 H new ATOM 0 HH11 ARG A 40 11.004 17.842 -3.062 1.00 0.00 H new ATOM 0 HH12 ARG A 40 11.330 19.576 -3.142 1.00 0.00 H new ATOM 0 HH21 ARG A 40 8.363 20.492 -1.475 1.00 0.00 H new ATOM 0 HH22 ARG A 40 9.843 21.069 -2.248 1.00 0.00 H new ATOM 655 N GLY A 41 6.321 11.205 -3.059 1.00 0.00 N ATOM 656 CA GLY A 41 6.414 10.052 -3.936 1.00 0.00 C ATOM 657 C GLY A 41 7.766 9.370 -3.855 1.00 0.00 C ATOM 658 O GLY A 41 8.156 8.642 -4.768 1.00 0.00 O ATOM 0 H GLY A 41 5.582 11.152 -2.358 1.00 0.00 H new ATOM 0 HA2 GLY A 41 5.634 9.337 -3.675 1.00 0.00 H new ATOM 0 HA3 GLY A 41 6.229 10.365 -4.964 1.00 0.00 H new ATOM 662 N SER A 42 8.483 9.606 -2.760 1.00 0.00 N ATOM 663 CA SER A 42 9.799 9.009 -2.566 1.00 0.00 C ATOM 664 C SER A 42 9.705 7.487 -2.533 1.00 0.00 C ATOM 665 O SER A 42 10.612 6.790 -2.987 1.00 0.00 O ATOM 666 CB SER A 42 10.429 9.521 -1.269 1.00 0.00 C ATOM 667 OG SER A 42 11.708 8.947 -1.061 1.00 0.00 O ATOM 0 H SER A 42 8.175 10.206 -1.995 1.00 0.00 H new ATOM 0 HA SER A 42 10.430 9.299 -3.406 1.00 0.00 H new ATOM 0 HB2 SER A 42 10.516 10.607 -1.308 1.00 0.00 H new ATOM 0 HB3 SER A 42 9.779 9.283 -0.427 1.00 0.00 H new ATOM 0 HG SER A 42 12.089 9.292 -0.227 1.00 0.00 H new ATOM 673 N LEU A 43 8.602 6.978 -1.993 1.00 0.00 N ATOM 674 CA LEU A 43 8.393 5.539 -1.904 1.00 0.00 C ATOM 675 C LEU A 43 8.277 4.922 -3.293 1.00 0.00 C ATOM 676 O LEU A 43 8.974 3.962 -3.616 1.00 0.00 O ATOM 677 CB LEU A 43 7.132 5.232 -1.093 1.00 0.00 C ATOM 678 CG LEU A 43 6.921 3.754 -0.761 1.00 0.00 C ATOM 679 CD1 LEU A 43 7.437 3.441 0.636 1.00 0.00 C ATOM 680 CD2 LEU A 43 5.450 3.383 -0.881 1.00 0.00 C ATOM 0 H LEU A 43 7.841 7.540 -1.611 1.00 0.00 H new ATOM 0 HA LEU A 43 9.255 5.103 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.171 5.796 -0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.265 5.592 -1.647 1.00 0.00 H new ATOM 0 HG LEU A 43 7.485 3.158 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.278 2.385 0.854 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.502 3.666 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.901 4.047 1.366 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.320 2.328 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.865 3.987 -0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.110 3.568 -1.900 1.00 0.00 H new ATOM 692 N TYR A 44 7.395 5.483 -4.113 1.00 0.00 N ATOM 693 CA TYR A 44 7.192 4.987 -5.468 1.00 0.00 C ATOM 694 C TYR A 44 8.449 5.179 -6.310 1.00 0.00 C ATOM 695 O TYR A 44 8.789 4.333 -7.137 1.00 0.00 O ATOM 696 CB TYR A 44 6.008 5.700 -6.124 1.00 0.00 C ATOM 697 CG TYR A 44 4.703 5.507 -5.385 1.00 0.00 C ATOM 698 CD1 TYR A 44 4.313 4.248 -4.944 1.00 0.00 C ATOM 699 CD2 TYR A 44 3.861 6.581 -5.127 1.00 0.00 C ATOM 700 CE1 TYR A 44 3.121 4.065 -4.269 1.00 0.00 C ATOM 701 CE2 TYR A 44 2.668 6.407 -4.451 1.00 0.00 C ATOM 702 CZ TYR A 44 2.302 5.148 -4.025 1.00 0.00 C ATOM 703 OH TYR A 44 1.116 4.971 -3.352 1.00 0.00 O ATOM 0 H TYR A 44 6.810 6.280 -3.863 1.00 0.00 H new ATOM 0 HA TYR A 44 6.975 3.920 -5.410 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.226 6.766 -6.188 1.00 0.00 H new ATOM 0 HB3 TYR A 44 5.895 5.336 -7.145 1.00 0.00 H new ATOM 0 HD1 TYR A 44 4.952 3.398 -5.132 1.00 0.00 H new ATOM 0 HD2 TYR A 44 4.143 7.569 -5.460 1.00 0.00 H new ATOM 0 HE1 TYR A 44 2.832 3.080 -3.934 1.00 0.00 H new ATOM 0 HE2 TYR A 44 2.026 7.253 -4.257 1.00 0.00 H new ATOM 0 HH TYR A 44 0.659 5.833 -3.262 1.00 0.00 H new ATOM 713 N LYS A 45 9.138 6.295 -6.090 1.00 0.00 N ATOM 714 CA LYS A 45 10.360 6.593 -6.826 1.00 0.00 C ATOM 715 C LYS A 45 11.481 5.644 -6.414 1.00 0.00 C ATOM 716 O LYS A 45 12.260 5.186 -7.249 1.00 0.00 O ATOM 717 CB LYS A 45 10.783 8.045 -6.588 1.00 0.00 C ATOM 718 CG LYS A 45 10.944 8.850 -7.868 1.00 0.00 C ATOM 719 CD LYS A 45 12.279 9.576 -7.910 1.00 0.00 C ATOM 720 CE LYS A 45 12.419 10.415 -9.170 1.00 0.00 C ATOM 721 NZ LYS A 45 13.832 10.487 -9.635 1.00 0.00 N ATOM 0 H LYS A 45 8.871 7.006 -5.409 1.00 0.00 H new ATOM 0 HA LYS A 45 10.163 6.454 -7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.042 8.531 -5.954 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.726 8.055 -6.041 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.864 8.186 -8.728 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.133 9.574 -7.947 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.374 10.216 -7.033 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.091 8.850 -7.863 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.798 9.991 -9.959 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.048 11.422 -8.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.885 11.068 -10.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 14.421 10.915 -8.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 14.179 9.529 -9.842 1.00 0.00 H new ATOM 735 N ARG A 46 11.552 5.350 -5.119 1.00 0.00 N ATOM 736 CA ARG A 46 12.574 4.452 -4.593 1.00 0.00 C ATOM 737 C ARG A 46 12.161 2.990 -4.762 1.00 0.00 C ATOM 738 O ARG A 46 12.980 2.086 -4.601 1.00 0.00 O ATOM 739 CB ARG A 46 12.835 4.754 -3.116 1.00 0.00 C ATOM 740 CG ARG A 46 14.080 4.076 -2.570 1.00 0.00 C ATOM 741 CD ARG A 46 15.287 4.999 -2.627 1.00 0.00 C ATOM 742 NE ARG A 46 15.511 5.523 -3.972 1.00 0.00 N ATOM 743 CZ ARG A 46 15.981 4.794 -4.981 1.00 0.00 C ATOM 744 NH1 ARG A 46 16.273 3.511 -4.803 1.00 0.00 N ATOM 745 NH2 ARG A 46 16.157 5.348 -6.173 1.00 0.00 N ATOM 0 H ARG A 46 10.914 5.721 -4.415 1.00 0.00 H new ATOM 0 HA ARG A 46 13.491 4.616 -5.159 1.00 0.00 H new ATOM 0 HB2 ARG A 46 12.931 5.832 -2.985 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.972 4.437 -2.530 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.905 3.767 -1.539 1.00 0.00 H new ATOM 0 HG3 ARG A 46 14.284 3.172 -3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 46 15.143 5.828 -1.934 1.00 0.00 H new ATOM 0 HD3 ARG A 46 16.173 4.458 -2.296 1.00 0.00 H new ATOM 0 HE ARG A 46 15.295 6.504 -4.148 1.00 0.00 H new ATOM 0 HH11 ARG A 46 16.137 3.079 -3.889 1.00 0.00 H new ATOM 0 HH12 ARG A 46 16.633 2.957 -5.580 1.00 0.00 H new ATOM 0 HH21 ARG A 46 15.932 6.333 -6.316 1.00 0.00 H new ATOM 0 HH22 ARG A 46 16.517 4.790 -6.947 1.00 0.00 H new ATOM 759 N TYR A 47 10.889 2.765 -5.087 1.00 0.00 N ATOM 760 CA TYR A 47 10.378 1.413 -5.278 1.00 0.00 C ATOM 761 C TYR A 47 9.515 1.325 -6.539 1.00 0.00 C ATOM 762 O TYR A 47 8.317 1.051 -6.463 1.00 0.00 O ATOM 763 CB TYR A 47 9.559 0.983 -4.058 1.00 0.00 C ATOM 764 CG TYR A 47 10.394 0.680 -2.837 1.00 0.00 C ATOM 765 CD1 TYR A 47 10.569 1.625 -1.836 1.00 0.00 C ATOM 766 CD2 TYR A 47 11.001 -0.559 -2.683 1.00 0.00 C ATOM 767 CE1 TYR A 47 11.328 1.343 -0.715 1.00 0.00 C ATOM 768 CE2 TYR A 47 11.760 -0.850 -1.569 1.00 0.00 C ATOM 769 CZ TYR A 47 11.921 0.105 -0.586 1.00 0.00 C ATOM 770 OH TYR A 47 12.676 -0.178 0.528 1.00 0.00 O ATOM 0 H TYR A 47 10.196 3.501 -5.223 1.00 0.00 H new ATOM 0 HA TYR A 47 11.229 0.743 -5.396 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.848 1.772 -3.813 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.977 0.099 -4.317 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.105 2.595 -1.934 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.876 -1.309 -3.450 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.456 2.089 0.056 1.00 0.00 H new ATOM 0 HE2 TYR A 47 12.225 -1.819 -1.467 1.00 0.00 H new ATOM 0 HH TYR A 47 12.795 -1.148 0.605 1.00 0.00 H new ATOM 780 N PRO A 48 10.113 1.562 -7.721 1.00 0.00 N ATOM 781 CA PRO A 48 9.391 1.516 -9.000 1.00 0.00 C ATOM 782 C PRO A 48 8.817 0.134 -9.305 1.00 0.00 C ATOM 783 O PRO A 48 7.772 0.018 -9.947 1.00 0.00 O ATOM 784 CB PRO A 48 10.457 1.891 -10.037 1.00 0.00 C ATOM 785 CG PRO A 48 11.533 2.566 -9.257 1.00 0.00 C ATOM 786 CD PRO A 48 11.532 1.905 -7.911 1.00 0.00 C ATOM 0 HA PRO A 48 8.530 2.184 -8.994 1.00 0.00 H new ATOM 0 HB2 PRO A 48 10.837 1.007 -10.550 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.049 2.553 -10.801 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.500 2.455 -9.747 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.341 3.635 -9.169 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.168 1.020 -7.894 1.00 0.00 H new ATOM 0 HD3 PRO A 48 11.895 2.574 -7.131 1.00 0.00 H new ATOM 794 N SER A 49 9.500 -0.912 -8.848 1.00 0.00 N ATOM 795 CA SER A 49 9.043 -2.279 -9.084 1.00 0.00 C ATOM 796 C SER A 49 7.892 -2.650 -8.148 1.00 0.00 C ATOM 797 O SER A 49 7.316 -3.732 -8.257 1.00 0.00 O ATOM 798 CB SER A 49 10.198 -3.265 -8.902 1.00 0.00 C ATOM 799 OG SER A 49 10.413 -4.021 -10.079 1.00 0.00 O ATOM 0 H SER A 49 10.367 -0.841 -8.315 1.00 0.00 H new ATOM 0 HA SER A 49 8.680 -2.335 -10.110 1.00 0.00 H new ATOM 0 HB2 SER A 49 11.107 -2.721 -8.644 1.00 0.00 H new ATOM 0 HB3 SER A 49 9.980 -3.935 -8.070 1.00 0.00 H new ATOM 0 HG SER A 49 10.158 -3.489 -10.861 1.00 0.00 H new ATOM 805 N LEU A 50 7.570 -1.751 -7.225 1.00 0.00 N ATOM 806 CA LEU A 50 6.499 -1.981 -6.266 1.00 0.00 C ATOM 807 C LEU A 50 5.131 -1.842 -6.923 1.00 0.00 C ATOM 808 O LEU A 50 4.880 -0.890 -7.662 1.00 0.00 O ATOM 809 CB LEU A 50 6.628 -0.988 -5.115 1.00 0.00 C ATOM 810 CG LEU A 50 6.001 -1.425 -3.795 1.00 0.00 C ATOM 811 CD1 LEU A 50 6.865 -2.476 -3.120 1.00 0.00 C ATOM 812 CD2 LEU A 50 5.815 -0.224 -2.883 1.00 0.00 C ATOM 0 H LEU A 50 8.039 -0.851 -7.121 1.00 0.00 H new ATOM 0 HA LEU A 50 6.587 -2.999 -5.887 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.687 -0.790 -4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.172 -0.046 -5.419 1.00 0.00 H new ATOM 0 HG LEU A 50 5.024 -1.863 -3.999 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.404 -2.777 -2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.958 -3.344 -3.773 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.854 -2.062 -2.923 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.367 -0.547 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.783 0.235 -2.684 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.161 0.502 -3.366 1.00 0.00 H new ATOM 824 N TRP A 51 4.246 -2.793 -6.643 1.00 0.00 N ATOM 825 CA TRP A 51 2.899 -2.770 -7.203 1.00 0.00 C ATOM 826 C TRP A 51 2.080 -1.639 -6.589 1.00 0.00 C ATOM 827 O TRP A 51 1.794 -1.650 -5.393 1.00 0.00 O ATOM 828 CB TRP A 51 2.192 -4.106 -6.957 1.00 0.00 C ATOM 829 CG TRP A 51 0.842 -4.185 -7.603 1.00 0.00 C ATOM 830 CD1 TRP A 51 0.533 -4.767 -8.799 1.00 0.00 C ATOM 831 CD2 TRP A 51 -0.383 -3.662 -7.083 1.00 0.00 C ATOM 832 NE1 TRP A 51 -0.813 -4.634 -9.052 1.00 0.00 N ATOM 833 CE2 TRP A 51 -1.396 -3.960 -8.011 1.00 0.00 C ATOM 834 CE3 TRP A 51 -0.717 -2.972 -5.919 1.00 0.00 C ATOM 835 CZ2 TRP A 51 -2.722 -3.587 -7.806 1.00 0.00 C ATOM 836 CZ3 TRP A 51 -2.027 -2.604 -5.712 1.00 0.00 C ATOM 837 CH2 TRP A 51 -3.018 -2.911 -6.652 1.00 0.00 C ATOM 0 H TRP A 51 4.436 -3.588 -6.033 1.00 0.00 H new ATOM 0 HA TRP A 51 2.984 -2.604 -8.277 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.817 -4.916 -7.334 1.00 0.00 H new ATOM 0 HB3 TRP A 51 2.084 -4.261 -5.883 1.00 0.00 H new ATOM 0 HD1 TRP A 51 1.240 -5.259 -9.450 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -1.298 -4.981 -9.880 1.00 0.00 H new ATOM 0 HE3 TRP A 51 0.042 -2.729 -5.190 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -3.488 -3.822 -8.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -2.294 -2.071 -4.812 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -4.037 -2.608 -6.463 1.00 0.00 H new ATOM 848 N ARG A 52 1.701 -0.666 -7.411 1.00 0.00 N ATOM 849 CA ARG A 52 0.905 0.461 -6.937 1.00 0.00 C ATOM 850 C ARG A 52 -0.169 0.837 -7.953 1.00 0.00 C ATOM 851 O ARG A 52 0.088 0.871 -9.156 1.00 0.00 O ATOM 852 CB ARG A 52 1.805 1.667 -6.660 1.00 0.00 C ATOM 853 CG ARG A 52 2.709 2.033 -7.827 1.00 0.00 C ATOM 854 CD ARG A 52 2.533 3.487 -8.238 1.00 0.00 C ATOM 855 NE ARG A 52 3.485 3.882 -9.274 1.00 0.00 N ATOM 856 CZ ARG A 52 3.334 4.952 -10.051 1.00 0.00 C ATOM 857 NH1 ARG A 52 2.272 5.736 -9.913 1.00 0.00 N ATOM 858 NH2 ARG A 52 4.247 5.239 -10.968 1.00 0.00 N ATOM 0 H ARG A 52 1.931 -0.635 -8.404 1.00 0.00 H new ATOM 0 HA ARG A 52 0.414 0.161 -6.011 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.181 2.526 -6.411 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.421 1.457 -5.786 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.749 1.855 -7.552 1.00 0.00 H new ATOM 0 HG3 ARG A 52 2.489 1.385 -8.676 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.517 3.641 -8.602 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.660 4.128 -7.366 1.00 0.00 H new ATOM 0 HE ARG A 52 4.314 3.304 -9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.567 5.520 -9.209 1.00 0.00 H new ATOM 0 HH12 ARG A 52 2.161 6.555 -10.511 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.065 4.640 -11.078 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.131 6.059 -11.564 1.00 0.00 H new ATOM 872 N ARG A 53 -1.371 1.129 -7.463 1.00 0.00 N ATOM 873 CA ARG A 53 -2.475 1.513 -8.338 1.00 0.00 C ATOM 874 C ARG A 53 -3.497 2.367 -7.588 1.00 0.00 C ATOM 875 O ARG A 53 -3.482 2.432 -6.360 1.00 0.00 O ATOM 876 CB ARG A 53 -3.136 0.265 -8.952 1.00 0.00 C ATOM 877 CG ARG A 53 -4.398 -0.217 -8.243 1.00 0.00 C ATOM 878 CD ARG A 53 -5.287 -1.018 -9.182 1.00 0.00 C ATOM 879 NE ARG A 53 -5.935 -2.138 -8.505 1.00 0.00 N ATOM 880 CZ ARG A 53 -7.049 -2.725 -8.939 1.00 0.00 C ATOM 881 NH1 ARG A 53 -7.643 -2.301 -10.047 1.00 0.00 N ATOM 882 NH2 ARG A 53 -7.567 -3.741 -8.263 1.00 0.00 N ATOM 0 H ARG A 53 -1.605 1.107 -6.470 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.073 2.118 -9.151 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.382 0.478 -9.992 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.409 -0.547 -8.957 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.124 -0.832 -7.386 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -4.951 0.640 -7.857 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.048 -0.363 -9.607 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.690 -1.394 -10.013 1.00 0.00 H new ATOM 0 HE ARG A 53 -5.509 -2.492 -7.648 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.247 -1.521 -10.572 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.496 -2.755 -10.374 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -7.112 -4.072 -7.412 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.420 -4.192 -8.594 1.00 0.00 H new ATOM 896 N LEU A 54 -4.388 3.011 -8.336 1.00 0.00 N ATOM 897 CA LEU A 54 -5.423 3.846 -7.740 1.00 0.00 C ATOM 898 C LEU A 54 -6.719 3.058 -7.577 1.00 0.00 C ATOM 899 O LEU A 54 -7.068 2.239 -8.426 1.00 0.00 O ATOM 900 CB LEU A 54 -5.668 5.086 -8.600 1.00 0.00 C ATOM 901 CG LEU A 54 -4.769 6.279 -8.278 1.00 0.00 C ATOM 902 CD1 LEU A 54 -4.081 6.791 -9.534 1.00 0.00 C ATOM 903 CD2 LEU A 54 -5.571 7.391 -7.617 1.00 0.00 C ATOM 0 H LEU A 54 -4.413 2.970 -9.355 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.082 4.163 -6.755 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.530 4.817 -9.647 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.708 5.391 -8.484 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.001 5.947 -7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.446 7.640 -9.281 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.470 5.997 -9.964 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.833 7.103 -10.259 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.913 8.232 -7.395 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.363 7.718 -8.290 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.011 7.021 -6.691 1.00 0.00 H new ATOM 915 N ALA A 55 -7.426 3.307 -6.479 1.00 0.00 N ATOM 916 CA ALA A 55 -8.679 2.613 -6.206 1.00 0.00 C ATOM 917 C ALA A 55 -9.875 3.392 -6.742 1.00 0.00 C ATOM 918 O ALA A 55 -9.918 4.618 -6.661 1.00 0.00 O ATOM 919 CB ALA A 55 -8.833 2.374 -4.709 1.00 0.00 C ATOM 0 H ALA A 55 -7.153 3.983 -5.765 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.649 1.652 -6.720 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.772 1.855 -4.518 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.003 1.765 -4.350 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.834 3.330 -4.186 1.00 0.00 H new ATOM 925 N THR A 56 -10.854 2.666 -7.275 1.00 0.00 N ATOM 926 CA THR A 56 -12.061 3.285 -7.808 1.00 0.00 C ATOM 927 C THR A 56 -12.922 3.808 -6.667 1.00 0.00 C ATOM 928 O THR A 56 -12.694 3.464 -5.512 1.00 0.00 O ATOM 929 CB THR A 56 -12.858 2.274 -8.633 1.00 0.00 C ATOM 930 OG1 THR A 56 -13.561 1.384 -7.782 1.00 0.00 O ATOM 931 CG2 THR A 56 -11.998 1.442 -9.559 1.00 0.00 C ATOM 0 H THR A 56 -10.834 1.649 -7.349 1.00 0.00 H new ATOM 0 HA THR A 56 -11.772 4.115 -8.452 1.00 0.00 H new ATOM 0 HB THR A 56 -13.541 2.868 -9.240 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.068 0.744 -8.325 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.628 0.746 -10.113 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.478 2.096 -10.258 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.268 0.883 -8.973 1.00 0.00 H new ATOM 939 N VAL A 57 -13.916 4.629 -6.987 1.00 0.00 N ATOM 940 CA VAL A 57 -14.798 5.179 -5.962 1.00 0.00 C ATOM 941 C VAL A 57 -15.388 4.061 -5.108 1.00 0.00 C ATOM 942 O VAL A 57 -15.511 4.190 -3.888 1.00 0.00 O ATOM 943 CB VAL A 57 -15.945 5.998 -6.583 1.00 0.00 C ATOM 944 CG1 VAL A 57 -16.743 6.707 -5.500 1.00 0.00 C ATOM 945 CG2 VAL A 57 -15.400 6.996 -7.594 1.00 0.00 C ATOM 0 H VAL A 57 -14.131 4.927 -7.939 1.00 0.00 H new ATOM 0 HA VAL A 57 -14.195 5.839 -5.338 1.00 0.00 H new ATOM 0 HB VAL A 57 -16.614 5.314 -7.105 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.549 7.280 -5.958 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.165 5.970 -4.817 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -16.088 7.380 -4.947 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.224 7.566 -8.023 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -14.708 7.676 -7.097 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -14.877 6.462 -8.387 1.00 0.00 H new ATOM 955 N GLU A 58 -15.731 2.955 -5.760 1.00 0.00 N ATOM 956 CA GLU A 58 -16.289 1.804 -5.066 1.00 0.00 C ATOM 957 C GLU A 58 -15.220 1.142 -4.205 1.00 0.00 C ATOM 958 O GLU A 58 -15.474 0.759 -3.063 1.00 0.00 O ATOM 959 CB GLU A 58 -16.852 0.797 -6.069 1.00 0.00 C ATOM 960 CG GLU A 58 -18.057 1.313 -6.837 1.00 0.00 C ATOM 961 CD GLU A 58 -17.725 1.669 -8.273 1.00 0.00 C ATOM 962 OE1 GLU A 58 -17.546 2.871 -8.562 1.00 0.00 O ATOM 963 OE2 GLU A 58 -17.644 0.745 -9.111 1.00 0.00 O ATOM 0 H GLU A 58 -15.632 2.833 -6.768 1.00 0.00 H new ATOM 0 HA GLU A 58 -17.100 2.146 -4.423 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -16.069 0.526 -6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.132 -0.113 -5.539 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -18.841 0.556 -6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -18.456 2.192 -6.332 1.00 0.00 H new ATOM 970 N GLU A 59 -14.018 1.018 -4.760 1.00 0.00 N ATOM 971 CA GLU A 59 -12.910 0.411 -4.038 1.00 0.00 C ATOM 972 C GLU A 59 -12.545 1.238 -2.812 1.00 0.00 C ATOM 973 O GLU A 59 -12.264 0.693 -1.748 1.00 0.00 O ATOM 974 CB GLU A 59 -11.692 0.264 -4.953 1.00 0.00 C ATOM 975 CG GLU A 59 -11.728 -0.986 -5.818 1.00 0.00 C ATOM 976 CD GLU A 59 -11.035 -0.792 -7.152 1.00 0.00 C ATOM 977 OE1 GLU A 59 -10.069 -0.003 -7.210 1.00 0.00 O ATOM 978 OE2 GLU A 59 -11.458 -1.430 -8.139 1.00 0.00 O ATOM 0 H GLU A 59 -13.789 1.329 -5.704 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.224 -0.579 -3.707 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.625 1.140 -5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.789 0.247 -4.342 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.253 -1.808 -5.282 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -12.765 -1.275 -5.990 1.00 0.00 H new ATOM 985 N ARG A 60 -12.553 2.558 -2.963 1.00 0.00 N ATOM 986 CA ARG A 60 -12.224 3.449 -1.858 1.00 0.00 C ATOM 987 C ARG A 60 -13.244 3.311 -0.737 1.00 0.00 C ATOM 988 O ARG A 60 -12.877 3.200 0.432 1.00 0.00 O ATOM 989 CB ARG A 60 -12.166 4.904 -2.329 1.00 0.00 C ATOM 990 CG ARG A 60 -11.220 5.139 -3.497 1.00 0.00 C ATOM 991 CD ARG A 60 -10.809 6.600 -3.594 1.00 0.00 C ATOM 992 NE ARG A 60 -11.533 7.302 -4.653 1.00 0.00 N ATOM 993 CZ ARG A 60 -11.034 7.554 -5.863 1.00 0.00 C ATOM 994 NH1 ARG A 60 -9.811 7.150 -6.188 1.00 0.00 N ATOM 995 NH2 ARG A 60 -11.765 8.209 -6.755 1.00 0.00 N ATOM 0 H ARG A 60 -12.783 3.032 -3.836 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.242 3.164 -1.481 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -13.168 5.222 -2.617 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.859 5.534 -1.494 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.333 4.517 -3.379 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -11.703 4.833 -4.425 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.994 7.093 -2.640 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.737 6.664 -3.783 1.00 0.00 H new ATOM 0 HE ARG A 60 -12.481 7.619 -4.453 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.244 6.642 -5.509 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.438 7.348 -7.117 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.707 8.519 -6.514 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.386 8.403 -7.682 1.00 0.00 H new ATOM 1009 N LYS A 61 -14.527 3.309 -1.092 1.00 0.00 N ATOM 1010 CA LYS A 61 -15.575 3.172 -0.090 1.00 0.00 C ATOM 1011 C LYS A 61 -15.381 1.872 0.687 1.00 0.00 C ATOM 1012 O LYS A 61 -15.482 1.849 1.913 1.00 0.00 O ATOM 1013 CB LYS A 61 -16.967 3.241 -0.744 1.00 0.00 C ATOM 1014 CG LYS A 61 -17.578 1.892 -1.097 1.00 0.00 C ATOM 1015 CD LYS A 61 -18.594 2.020 -2.219 1.00 0.00 C ATOM 1016 CE LYS A 61 -19.966 2.404 -1.689 1.00 0.00 C ATOM 1017 NZ LYS A 61 -20.020 3.832 -1.269 1.00 0.00 N ATOM 0 H LYS A 61 -14.860 3.399 -2.052 1.00 0.00 H new ATOM 0 HA LYS A 61 -15.508 4.002 0.613 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -17.644 3.764 -0.069 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -16.896 3.840 -1.652 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.790 1.201 -1.395 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -18.058 1.467 -0.216 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -18.256 2.771 -2.933 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -18.663 1.075 -2.758 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -20.716 2.224 -2.459 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -20.219 1.767 -0.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -20.972 4.211 -1.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -19.804 3.904 -0.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -19.322 4.380 -1.811 1.00 0.00 H new ATOM 1031 N LYS A 62 -15.071 0.796 -0.035 1.00 0.00 N ATOM 1032 CA LYS A 62 -14.829 -0.495 0.592 1.00 0.00 C ATOM 1033 C LYS A 62 -13.530 -0.451 1.396 1.00 0.00 C ATOM 1034 O LYS A 62 -13.406 -1.090 2.440 1.00 0.00 O ATOM 1035 CB LYS A 62 -14.801 -1.613 -0.465 1.00 0.00 C ATOM 1036 CG LYS A 62 -13.407 -2.063 -0.884 1.00 0.00 C ATOM 1037 CD LYS A 62 -13.405 -2.609 -2.303 1.00 0.00 C ATOM 1038 CE LYS A 62 -13.428 -4.128 -2.318 1.00 0.00 C ATOM 1039 NZ LYS A 62 -13.764 -4.665 -3.666 1.00 0.00 N ATOM 0 H LYS A 62 -14.983 0.796 -1.051 1.00 0.00 H new ATOM 0 HA LYS A 62 -15.645 -0.715 1.280 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -15.344 -2.475 -0.076 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -15.338 -1.271 -1.350 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -12.715 -1.223 -0.814 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -13.048 -2.829 -0.197 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -14.272 -2.226 -2.842 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -12.519 -2.253 -2.829 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.455 -4.509 -2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -14.157 -4.487 -1.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.769 -5.704 -3.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -14.703 -4.322 -3.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.054 -4.344 -4.355 1.00 0.00 H new ATOM 1053 N ILE A 63 -12.562 0.311 0.888 1.00 0.00 N ATOM 1054 CA ILE A 63 -11.264 0.451 1.539 1.00 0.00 C ATOM 1055 C ILE A 63 -11.412 1.022 2.949 1.00 0.00 C ATOM 1056 O ILE A 63 -10.775 0.550 3.891 1.00 0.00 O ATOM 1057 CB ILE A 63 -10.317 1.356 0.714 1.00 0.00 C ATOM 1058 CG1 ILE A 63 -9.747 0.581 -0.475 1.00 0.00 C ATOM 1059 CG2 ILE A 63 -9.182 1.897 1.577 1.00 0.00 C ATOM 1060 CD1 ILE A 63 -9.384 1.462 -1.651 1.00 0.00 C ATOM 0 H ILE A 63 -12.655 0.843 0.023 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.830 -0.547 1.605 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.897 2.202 0.345 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -8.860 0.036 -0.152 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.477 -0.161 -0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.533 2.529 0.971 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.596 2.483 2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.604 1.066 1.981 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -8.986 0.846 -2.458 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.273 1.988 -2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.631 2.188 -1.343 1.00 0.00 H new ATOM 1072 N VAL A 64 -12.248 2.045 3.083 1.00 0.00 N ATOM 1073 CA VAL A 64 -12.470 2.687 4.374 1.00 0.00 C ATOM 1074 C VAL A 64 -13.195 1.759 5.345 1.00 0.00 C ATOM 1075 O VAL A 64 -12.791 1.615 6.498 1.00 0.00 O ATOM 1076 CB VAL A 64 -13.280 3.988 4.220 1.00 0.00 C ATOM 1077 CG1 VAL A 64 -13.406 4.707 5.557 1.00 0.00 C ATOM 1078 CG2 VAL A 64 -12.638 4.894 3.179 1.00 0.00 C ATOM 0 H VAL A 64 -12.783 2.448 2.314 1.00 0.00 H new ATOM 0 HA VAL A 64 -11.486 2.923 4.778 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.283 3.730 3.879 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -13.982 5.623 5.425 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -13.914 4.059 6.272 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -12.413 4.954 5.932 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.223 5.809 3.083 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.623 5.143 3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -12.608 4.380 2.218 1.00 0.00 H new ATOM 1088 N ALA A 65 -14.274 1.141 4.876 1.00 0.00 N ATOM 1089 CA ALA A 65 -15.059 0.236 5.709 1.00 0.00 C ATOM 1090 C ALA A 65 -14.323 -1.076 5.966 1.00 0.00 C ATOM 1091 O ALA A 65 -14.413 -1.645 7.054 1.00 0.00 O ATOM 1092 CB ALA A 65 -16.409 -0.035 5.063 1.00 0.00 C ATOM 0 H ALA A 65 -14.625 1.250 3.924 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.213 0.722 6.672 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -16.985 -0.712 5.694 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.952 0.903 4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -16.259 -0.491 4.084 1.00 0.00 H new ATOM 1098 N SER A 66 -13.605 -1.557 4.958 1.00 0.00 N ATOM 1099 CA SER A 66 -12.865 -2.810 5.077 1.00 0.00 C ATOM 1100 C SER A 66 -11.556 -2.615 5.835 1.00 0.00 C ATOM 1101 O SER A 66 -11.261 -3.346 6.781 1.00 0.00 O ATOM 1102 CB SER A 66 -12.580 -3.388 3.690 1.00 0.00 C ATOM 1103 OG SER A 66 -11.903 -4.630 3.785 1.00 0.00 O ATOM 0 H SER A 66 -13.519 -1.100 4.050 1.00 0.00 H new ATOM 0 HA SER A 66 -13.483 -3.509 5.641 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.517 -3.521 3.148 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.977 -2.684 3.116 1.00 0.00 H new ATOM 0 HG SER A 66 -11.734 -4.980 2.885 1.00 0.00 H new ATOM 1109 N SER A 67 -10.770 -1.630 5.413 1.00 0.00 N ATOM 1110 CA SER A 67 -9.489 -1.350 6.052 1.00 0.00 C ATOM 1111 C SER A 67 -9.675 -0.566 7.345 1.00 0.00 C ATOM 1112 O SER A 67 -9.217 -0.983 8.409 1.00 0.00 O ATOM 1113 CB SER A 67 -8.580 -0.565 5.104 1.00 0.00 C ATOM 1114 OG SER A 67 -7.227 -0.957 5.255 1.00 0.00 O ATOM 0 H SER A 67 -10.997 -1.013 4.633 1.00 0.00 H new ATOM 0 HA SER A 67 -9.024 -2.306 6.291 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.896 -0.728 4.074 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.677 0.502 5.302 1.00 0.00 H new ATOM 0 HG SER A 67 -7.182 -1.783 5.781 1.00 0.00 H new ATOM 1120 N HIS A 68 -10.339 0.579 7.243 1.00 0.00 N ATOM 1121 CA HIS A 68 -10.574 1.430 8.401 1.00 0.00 C ATOM 1122 C HIS A 68 -11.916 1.125 9.050 1.00 0.00 C ATOM 1123 O HIS A 68 -12.674 0.280 8.575 1.00 0.00 O ATOM 1124 CB HIS A 68 -10.514 2.900 7.988 1.00 0.00 C ATOM 1125 CG HIS A 68 -9.228 3.265 7.323 1.00 0.00 C ATOM 1126 ND1 HIS A 68 -9.156 4.032 6.180 1.00 0.00 N ATOM 1127 CD2 HIS A 68 -7.952 2.952 7.644 1.00 0.00 C ATOM 1128 CE1 HIS A 68 -7.891 4.172 5.825 1.00 0.00 C ATOM 1129 NE2 HIS A 68 -7.140 3.529 6.700 1.00 0.00 N ATOM 0 H HIS A 68 -10.724 0.939 6.370 1.00 0.00 H new ATOM 0 HA HIS A 68 -9.793 1.227 9.134 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -11.341 3.116 7.312 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -10.652 3.526 8.870 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.955 4.429 5.685 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.631 2.358 8.487 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -7.532 4.719 4.966 1.00 0.00 H new ATOM 1138 N GLY A 69 -12.201 1.822 10.144 1.00 0.00 N ATOM 1139 CA GLY A 69 -13.450 1.616 10.848 1.00 0.00 C ATOM 1140 C GLY A 69 -13.241 1.239 12.302 1.00 0.00 C ATOM 1141 O GLY A 69 -13.842 1.833 13.196 1.00 0.00 O ATOM 0 H GLY A 69 -11.588 2.526 10.555 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -14.048 2.526 10.794 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -14.019 0.831 10.350 1.00 0.00 H new ATOM 1145 N LYS A 70 -12.386 0.249 12.537 1.00 0.00 N ATOM 1146 CA LYS A 70 -12.098 -0.205 13.892 1.00 0.00 C ATOM 1147 C LYS A 70 -11.023 0.662 14.541 1.00 0.00 C ATOM 1148 O LYS A 70 -10.968 0.790 15.764 1.00 0.00 O ATOM 1149 CB LYS A 70 -11.652 -1.671 13.875 1.00 0.00 C ATOM 1150 CG LYS A 70 -12.520 -2.581 14.729 1.00 0.00 C ATOM 1151 CD LYS A 70 -13.745 -3.057 13.964 1.00 0.00 C ATOM 1152 CE LYS A 70 -13.368 -4.027 12.857 1.00 0.00 C ATOM 1153 NZ LYS A 70 -14.373 -5.115 12.705 1.00 0.00 N ATOM 0 H LYS A 70 -11.881 -0.254 11.807 1.00 0.00 H new ATOM 0 HA LYS A 70 -13.011 -0.117 14.481 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.662 -2.033 12.847 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.621 -1.733 14.225 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.936 -3.441 15.056 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.834 -2.049 15.627 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -14.440 -3.540 14.651 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -14.264 -2.199 13.536 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.275 -3.485 11.916 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.392 -4.462 13.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -14.079 -5.755 11.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.444 -5.649 13.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.299 -4.702 12.474 1.00 0.00 H new ATOM 1167 N LYS A 71 -10.169 1.259 13.713 1.00 0.00 N ATOM 1168 CA LYS A 71 -9.097 2.115 14.208 1.00 0.00 C ATOM 1169 C LYS A 71 -9.219 3.524 13.639 1.00 0.00 C ATOM 1170 O LYS A 71 -9.570 3.706 12.473 1.00 0.00 O ATOM 1171 CB LYS A 71 -7.734 1.522 13.843 1.00 0.00 C ATOM 1172 CG LYS A 71 -7.580 1.215 12.361 1.00 0.00 C ATOM 1173 CD LYS A 71 -6.478 2.048 11.724 1.00 0.00 C ATOM 1174 CE LYS A 71 -5.238 1.214 11.444 1.00 0.00 C ATOM 1175 NZ LYS A 71 -5.495 0.164 10.419 1.00 0.00 N ATOM 0 H LYS A 71 -10.199 1.165 12.698 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.183 2.172 15.293 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.952 2.219 14.144 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -7.582 0.606 14.413 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.357 0.156 12.230 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.523 1.408 11.850 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.842 2.484 10.794 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.219 2.876 12.384 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -4.432 1.864 11.103 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -4.900 0.745 12.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -4.623 -0.017 9.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -5.800 -0.712 10.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.241 0.487 9.770 1.00 0.00 H new ATOM 1189 N THR A 72 -8.925 4.519 14.470 1.00 0.00 N ATOM 1190 CA THR A 72 -9.000 5.915 14.051 1.00 0.00 C ATOM 1191 C THR A 72 -7.866 6.728 14.665 1.00 0.00 C ATOM 1192 O THR A 72 -7.810 6.914 15.880 1.00 0.00 O ATOM 1193 CB THR A 72 -10.348 6.517 14.448 1.00 0.00 C ATOM 1194 OG1 THR A 72 -10.753 6.044 15.721 1.00 0.00 O ATOM 1195 CG2 THR A 72 -11.457 6.205 13.468 1.00 0.00 C ATOM 0 H THR A 72 -8.632 4.385 15.438 1.00 0.00 H new ATOM 0 HA THR A 72 -8.901 5.949 12.966 1.00 0.00 H new ATOM 0 HB THR A 72 -10.190 7.595 14.459 1.00 0.00 H new ATOM 0 HG1 THR A 72 -10.016 6.149 16.359 1.00 0.00 H new ATOM 0 HG21 THR A 72 -12.385 6.662 13.811 1.00 0.00 H new ATOM 0 HG22 THR A 72 -11.198 6.602 12.487 1.00 0.00 H new ATOM 0 HG23 THR A 72 -11.589 5.125 13.399 1.00 0.00 H new ATOM 1203 N LYS A 73 -6.963 7.210 13.816 1.00 0.00 N ATOM 1204 CA LYS A 73 -5.829 8.004 14.278 1.00 0.00 C ATOM 1205 C LYS A 73 -5.183 8.758 13.118 1.00 0.00 C ATOM 1206 O LYS A 73 -4.330 8.215 12.415 1.00 0.00 O ATOM 1207 CB LYS A 73 -4.794 7.103 14.955 1.00 0.00 C ATOM 1208 CG LYS A 73 -4.020 7.794 16.065 1.00 0.00 C ATOM 1209 CD LYS A 73 -2.576 7.320 16.118 1.00 0.00 C ATOM 1210 CE LYS A 73 -2.111 7.107 17.549 1.00 0.00 C ATOM 1211 NZ LYS A 73 -0.780 6.442 17.607 1.00 0.00 N ATOM 0 H LYS A 73 -6.994 7.065 12.807 1.00 0.00 H new ATOM 0 HA LYS A 73 -6.197 8.733 15.001 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -5.299 6.228 15.365 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -4.092 6.742 14.204 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.044 8.873 15.910 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -4.503 7.599 17.022 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.477 6.389 15.560 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -1.933 8.053 15.631 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -2.059 8.068 18.061 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -2.843 6.501 18.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.498 6.315 18.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.835 5.514 17.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -0.075 7.032 17.120 1.00 0.00 H new ATOM 1225 N PRO A 74 -5.579 10.025 12.900 1.00 0.00 N ATOM 1226 CA PRO A 74 -5.029 10.847 11.818 1.00 0.00 C ATOM 1227 C PRO A 74 -3.570 11.221 12.061 1.00 0.00 C ATOM 1228 O PRO A 74 -3.237 11.834 13.075 1.00 0.00 O ATOM 1229 CB PRO A 74 -5.911 12.098 11.835 1.00 0.00 C ATOM 1230 CG PRO A 74 -6.434 12.175 13.227 1.00 0.00 C ATOM 1231 CD PRO A 74 -6.591 10.753 13.689 1.00 0.00 C ATOM 0 HA PRO A 74 -5.034 10.320 10.864 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.339 12.989 11.578 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -6.722 12.020 11.111 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -5.747 12.721 13.873 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -7.387 12.703 13.257 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -6.412 10.656 14.760 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -7.596 10.377 13.499 1.00 0.00 H new ATOM 1239 N ASN A 75 -2.705 10.847 11.124 1.00 0.00 N ATOM 1240 CA ASN A 75 -1.281 11.142 11.235 1.00 0.00 C ATOM 1241 C ASN A 75 -0.573 10.922 9.903 1.00 0.00 C ATOM 1242 O ASN A 75 0.569 10.464 9.864 1.00 0.00 O ATOM 1243 CB ASN A 75 -0.642 10.269 12.318 1.00 0.00 C ATOM 1244 CG ASN A 75 0.353 11.035 13.166 1.00 0.00 C ATOM 1245 OD1 ASN A 75 0.897 12.053 12.739 1.00 0.00 O ATOM 1246 ND2 ASN A 75 0.597 10.548 14.378 1.00 0.00 N ATOM 0 H ASN A 75 -2.965 10.339 10.279 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.173 12.191 11.512 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -1.423 9.861 12.959 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -0.140 9.423 11.849 1.00 0.00 H new ATOM 0 HD21 ASN A 75 1.258 11.021 14.994 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.124 9.701 14.692 1.00 0.00 H new ATOM 1253 N THR A 76 -1.259 11.248 8.812 1.00 0.00 N ATOM 1254 CA THR A 76 -0.696 11.085 7.478 1.00 0.00 C ATOM 1255 C THR A 76 -0.338 12.434 6.867 1.00 0.00 C ATOM 1256 O THR A 76 0.829 12.827 6.844 1.00 0.00 O ATOM 1257 CB THR A 76 -1.683 10.345 6.572 1.00 0.00 C ATOM 1258 OG1 THR A 76 -2.973 10.924 6.659 1.00 0.00 O ATOM 1259 CG2 THR A 76 -1.815 8.874 6.907 1.00 0.00 C ATOM 0 H THR A 76 -2.206 11.627 8.827 1.00 0.00 H new ATOM 0 HA THR A 76 0.217 10.496 7.567 1.00 0.00 H new ATOM 0 HB THR A 76 -1.277 10.436 5.565 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.590 10.439 6.072 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.529 8.409 6.228 1.00 0.00 H new ATOM 0 HG22 THR A 76 -0.845 8.388 6.802 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.166 8.765 7.933 1.00 0.00 H new ATOM 1267 N LYS A 77 -1.349 13.139 6.374 1.00 0.00 N ATOM 1268 CA LYS A 77 -1.144 14.447 5.762 1.00 0.00 C ATOM 1269 C LYS A 77 -2.235 15.424 6.186 1.00 0.00 C ATOM 1270 O LYS A 77 -1.954 16.563 6.556 1.00 0.00 O ATOM 1271 CB LYS A 77 -1.120 14.322 4.237 1.00 0.00 C ATOM 1272 CG LYS A 77 -0.033 13.394 3.720 1.00 0.00 C ATOM 1273 CD LYS A 77 1.303 14.108 3.607 1.00 0.00 C ATOM 1274 CE LYS A 77 2.383 13.189 3.058 1.00 0.00 C ATOM 1275 NZ LYS A 77 3.309 13.907 2.140 1.00 0.00 N ATOM 0 H LYS A 77 -2.320 12.827 6.386 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.184 14.833 6.104 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.089 13.959 3.895 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -0.979 15.311 3.802 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.066 12.539 4.389 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.321 13.003 2.744 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.198 14.977 2.957 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.603 14.478 4.587 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.950 12.761 3.885 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.918 12.358 2.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.010 13.238 1.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.767 14.322 1.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.798 14.662 2.661 1.00 0.00 H new ATOM 1289 N ASP A 78 -3.479 14.967 6.129 1.00 0.00 N ATOM 1290 CA ASP A 78 -4.618 15.796 6.507 1.00 0.00 C ATOM 1291 C ASP A 78 -5.736 14.946 7.101 1.00 0.00 C ATOM 1292 O ASP A 78 -5.745 13.724 6.954 1.00 0.00 O ATOM 1293 CB ASP A 78 -5.136 16.571 5.293 1.00 0.00 C ATOM 1294 CG ASP A 78 -5.379 18.035 5.601 1.00 0.00 C ATOM 1295 OD1 ASP A 78 -6.557 18.448 5.631 1.00 0.00 O ATOM 1296 OD2 ASP A 78 -4.390 18.768 5.816 1.00 0.00 O ATOM 0 H ASP A 78 -3.726 14.025 5.824 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.285 16.505 7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.416 16.489 4.479 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.064 16.117 4.945 1.00 0.00 H new ATOM 1301 N HIS A 79 -6.677 15.601 7.773 1.00 0.00 N ATOM 1302 CA HIS A 79 -7.800 14.903 8.390 1.00 0.00 C ATOM 1303 C HIS A 79 -8.695 14.268 7.331 1.00 0.00 C ATOM 1304 O HIS A 79 -9.086 14.919 6.363 1.00 0.00 O ATOM 1305 CB HIS A 79 -8.615 15.868 9.254 1.00 0.00 C ATOM 1306 CG HIS A 79 -8.277 15.798 10.711 1.00 0.00 C ATOM 1307 ND1 HIS A 79 -8.966 16.497 11.679 1.00 0.00 N ATOM 1308 CD2 HIS A 79 -7.315 15.102 11.364 1.00 0.00 C ATOM 1309 CE1 HIS A 79 -8.443 16.237 12.864 1.00 0.00 C ATOM 1310 NE2 HIS A 79 -7.441 15.392 12.700 1.00 0.00 N ATOM 0 H HIS A 79 -6.685 16.612 7.904 1.00 0.00 H new ATOM 0 HA HIS A 79 -7.400 14.111 9.022 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -8.452 16.886 8.900 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -9.675 15.652 9.125 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -6.586 14.443 10.917 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -8.778 16.646 13.806 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -6.855 15.016 13.446 1.00 0.00 H new ATOM 1319 N GLY A 80 -9.016 12.992 7.524 1.00 0.00 N ATOM 1320 CA GLY A 80 -9.862 12.289 6.579 1.00 0.00 C ATOM 1321 C GLY A 80 -10.047 10.830 6.943 1.00 0.00 C ATOM 1322 O GLY A 80 -9.074 10.114 7.182 1.00 0.00 O ATOM 0 H GLY A 80 -8.705 12.433 8.318 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.836 12.776 6.536 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.426 12.359 5.583 1.00 0.00 H new ATOM 1326 N TYR A 81 -11.300 10.387 6.986 1.00 0.00 N ATOM 1327 CA TYR A 81 -11.610 9.002 7.324 1.00 0.00 C ATOM 1328 C TYR A 81 -13.090 8.707 7.115 1.00 0.00 C ATOM 1329 O TYR A 81 -13.458 7.639 6.628 1.00 0.00 O ATOM 1330 CB TYR A 81 -11.216 8.708 8.772 1.00 0.00 C ATOM 1331 CG TYR A 81 -11.990 9.518 9.787 1.00 0.00 C ATOM 1332 CD1 TYR A 81 -13.254 9.119 10.202 1.00 0.00 C ATOM 1333 CD2 TYR A 81 -11.457 10.679 10.330 1.00 0.00 C ATOM 1334 CE1 TYR A 81 -13.966 9.857 11.131 1.00 0.00 C ATOM 1335 CE2 TYR A 81 -12.161 11.422 11.258 1.00 0.00 C ATOM 1336 CZ TYR A 81 -13.415 11.007 11.655 1.00 0.00 C ATOM 1337 OH TYR A 81 -14.119 11.743 12.579 1.00 0.00 O ATOM 0 H TYR A 81 -12.116 10.967 6.791 1.00 0.00 H new ATOM 0 HA TYR A 81 -11.035 8.356 6.661 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -11.369 7.648 8.973 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -10.151 8.906 8.897 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -13.688 8.219 9.793 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -10.475 11.007 10.022 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -14.948 9.534 11.444 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -11.732 12.323 11.670 1.00 0.00 H new ATOM 0 HH TYR A 81 -13.589 12.522 12.849 1.00 0.00 H new ATOM 1347 N THR A 82 -13.936 9.662 7.487 1.00 0.00 N ATOM 1348 CA THR A 82 -15.380 9.506 7.340 1.00 0.00 C ATOM 1349 C THR A 82 -15.748 9.212 5.889 1.00 0.00 C ATOM 1350 O THR A 82 -16.688 8.468 5.615 1.00 0.00 O ATOM 1351 CB THR A 82 -16.102 10.767 7.818 1.00 0.00 C ATOM 1352 OG1 THR A 82 -17.506 10.587 7.772 1.00 0.00 O ATOM 1353 CG2 THR A 82 -15.769 11.995 6.998 1.00 0.00 C ATOM 0 H THR A 82 -13.647 10.552 7.893 1.00 0.00 H new ATOM 0 HA THR A 82 -15.695 8.663 7.954 1.00 0.00 H new ATOM 0 HB THR A 82 -15.757 10.928 8.839 1.00 0.00 H new ATOM 0 HG1 THR A 82 -17.951 11.403 8.083 1.00 0.00 H new ATOM 0 HG21 THR A 82 -16.314 12.853 7.390 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.698 12.190 7.053 1.00 0.00 H new ATOM 0 HG23 THR A 82 -16.055 11.827 5.959 1.00 0.00 H new ATOM 1361 N THR A 83 -14.998 9.803 4.965 1.00 0.00 N ATOM 1362 CA THR A 83 -15.239 9.605 3.542 1.00 0.00 C ATOM 1363 C THR A 83 -14.057 8.900 2.887 1.00 0.00 C ATOM 1364 O THR A 83 -14.118 7.706 2.590 1.00 0.00 O ATOM 1365 CB THR A 83 -15.503 10.947 2.854 1.00 0.00 C ATOM 1366 OG1 THR A 83 -16.621 11.595 3.434 1.00 0.00 O ATOM 1367 CG2 THR A 83 -15.766 10.822 1.369 1.00 0.00 C ATOM 0 H THR A 83 -14.217 10.424 5.177 1.00 0.00 H new ATOM 0 HA THR A 83 -16.121 8.974 3.430 1.00 0.00 H new ATOM 0 HB THR A 83 -14.590 11.526 2.995 1.00 0.00 H new ATOM 0 HG1 THR A 83 -16.773 12.451 2.983 1.00 0.00 H new ATOM 0 HG21 THR A 83 -15.945 11.811 0.947 1.00 0.00 H new ATOM 0 HG22 THR A 83 -14.901 10.371 0.883 1.00 0.00 H new ATOM 0 HG23 THR A 83 -16.642 10.194 1.206 1.00 0.00 H new ATOM 1375 N LEU A 84 -12.979 9.645 2.669 1.00 0.00 N ATOM 1376 CA LEU A 84 -11.773 9.098 2.052 1.00 0.00 C ATOM 1377 C LEU A 84 -12.113 8.275 0.811 1.00 0.00 C ATOM 1378 O LEU A 84 -11.679 7.131 0.672 1.00 0.00 O ATOM 1379 CB LEU A 84 -11.010 8.234 3.060 1.00 0.00 C ATOM 1380 CG LEU A 84 -9.643 7.741 2.585 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -8.563 8.757 2.922 1.00 0.00 C ATOM 1382 CD2 LEU A 84 -9.320 6.391 3.206 1.00 0.00 C ATOM 0 H LEU A 84 -12.914 10.634 2.911 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.143 9.933 1.745 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -10.874 8.807 3.977 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.624 7.369 3.312 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.676 7.623 1.502 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.597 8.389 2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.788 9.704 2.430 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -8.529 8.908 4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.344 6.054 2.857 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.305 6.484 4.292 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -10.079 5.665 2.914 1.00 0.00 H new ATOM 1394 N ALA A 85 -12.891 8.866 -0.089 1.00 0.00 N ATOM 1395 CA ALA A 85 -13.288 8.187 -1.316 1.00 0.00 C ATOM 1396 C ALA A 85 -13.018 9.055 -2.539 1.00 0.00 C ATOM 1397 O ALA A 85 -13.794 9.056 -3.495 1.00 0.00 O ATOM 1398 CB ALA A 85 -14.758 7.802 -1.254 1.00 0.00 C ATOM 0 H ALA A 85 -13.259 9.812 0.008 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.689 7.281 -1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -15.041 7.296 -2.177 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -14.924 7.134 -0.408 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -15.364 8.700 -1.132 1.00 0.00 H new ATOM 1404 N THR A 86 -11.911 9.792 -2.507 1.00 0.00 N ATOM 1405 CA THR A 86 -11.543 10.660 -3.620 1.00 0.00 C ATOM 1406 C THR A 86 -10.291 10.147 -4.322 1.00 0.00 C ATOM 1407 O THR A 86 -10.192 10.191 -5.548 1.00 0.00 O ATOM 1408 CB THR A 86 -11.313 12.088 -3.122 1.00 0.00 C ATOM 1409 OG1 THR A 86 -10.814 12.907 -4.165 1.00 0.00 O ATOM 1410 CG2 THR A 86 -10.338 12.169 -1.967 1.00 0.00 C ATOM 0 H THR A 86 -11.256 9.805 -1.725 1.00 0.00 H new ATOM 0 HA THR A 86 -12.364 10.658 -4.337 1.00 0.00 H new ATOM 0 HB THR A 86 -12.287 12.436 -2.778 1.00 0.00 H new ATOM 0 HG1 THR A 86 -10.675 13.817 -3.828 1.00 0.00 H new ATOM 0 HG21 THR A 86 -10.220 13.209 -1.663 1.00 0.00 H new ATOM 0 HG22 THR A 86 -10.718 11.586 -1.128 1.00 0.00 H new ATOM 0 HG23 THR A 86 -9.372 11.770 -2.277 1.00 0.00 H new ATOM 1418 N SER A 87 -9.337 9.660 -3.537 1.00 0.00 N ATOM 1419 CA SER A 87 -8.091 9.135 -4.083 1.00 0.00 C ATOM 1420 C SER A 87 -7.404 8.206 -3.086 1.00 0.00 C ATOM 1421 O SER A 87 -6.942 8.644 -2.033 1.00 0.00 O ATOM 1422 CB SER A 87 -7.150 10.280 -4.462 1.00 0.00 C ATOM 1423 OG SER A 87 -6.632 10.920 -3.308 1.00 0.00 O ATOM 0 H SER A 87 -9.402 9.618 -2.520 1.00 0.00 H new ATOM 0 HA SER A 87 -8.333 8.562 -4.978 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.329 9.895 -5.067 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.684 11.006 -5.075 1.00 0.00 H new ATOM 0 HG SER A 87 -6.430 10.248 -2.624 1.00 0.00 H new ATOM 1429 N VAL A 88 -7.337 6.923 -3.427 1.00 0.00 N ATOM 1430 CA VAL A 88 -6.701 5.937 -2.561 1.00 0.00 C ATOM 1431 C VAL A 88 -5.700 5.090 -3.341 1.00 0.00 C ATOM 1432 O VAL A 88 -6.063 4.404 -4.297 1.00 0.00 O ATOM 1433 CB VAL A 88 -7.744 5.012 -1.900 1.00 0.00 C ATOM 1434 CG1 VAL A 88 -7.069 4.021 -0.961 1.00 0.00 C ATOM 1435 CG2 VAL A 88 -8.792 5.831 -1.158 1.00 0.00 C ATOM 0 H VAL A 88 -7.714 6.543 -4.295 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.176 6.488 -1.781 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.245 4.446 -2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.823 3.379 -0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.363 3.410 -1.523 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.536 4.564 -0.180 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.519 5.161 -0.699 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.308 6.427 -0.384 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.301 6.492 -1.860 1.00 0.00 H new ATOM 1445 N THR A 89 -4.439 5.141 -2.924 1.00 0.00 N ATOM 1446 CA THR A 89 -3.385 4.375 -3.580 1.00 0.00 C ATOM 1447 C THR A 89 -3.227 3.009 -2.924 1.00 0.00 C ATOM 1448 O THR A 89 -2.899 2.914 -1.742 1.00 0.00 O ATOM 1449 CB THR A 89 -2.062 5.139 -3.526 1.00 0.00 C ATOM 1450 OG1 THR A 89 -1.691 5.408 -2.186 1.00 0.00 O ATOM 1451 CG2 THR A 89 -2.103 6.459 -4.265 1.00 0.00 C ATOM 0 H THR A 89 -4.122 5.705 -2.135 1.00 0.00 H new ATOM 0 HA THR A 89 -3.666 4.229 -4.623 1.00 0.00 H new ATOM 0 HB THR A 89 -1.334 4.490 -4.014 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.031 4.697 -1.603 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.133 6.950 -4.187 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.337 6.281 -5.315 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.869 7.098 -3.826 1.00 0.00 H new ATOM 1459 N LEU A 90 -3.469 1.954 -3.694 1.00 0.00 N ATOM 1460 CA LEU A 90 -3.361 0.594 -3.179 1.00 0.00 C ATOM 1461 C LEU A 90 -2.010 -0.025 -3.512 1.00 0.00 C ATOM 1462 O LEU A 90 -1.403 0.283 -4.539 1.00 0.00 O ATOM 1463 CB LEU A 90 -4.475 -0.280 -3.754 1.00 0.00 C ATOM 1464 CG LEU A 90 -5.868 0.349 -3.732 1.00 0.00 C ATOM 1465 CD1 LEU A 90 -6.164 1.027 -5.062 1.00 0.00 C ATOM 1466 CD2 LEU A 90 -6.925 -0.701 -3.417 1.00 0.00 C ATOM 0 H LEU A 90 -3.741 2.014 -4.675 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.457 0.646 -2.095 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.223 -0.532 -4.784 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.507 -1.216 -3.196 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.894 1.104 -2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.159 1.470 -5.031 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.425 1.807 -5.245 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.120 0.290 -5.864 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.910 -0.234 -3.406 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.902 -1.481 -4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.721 -1.141 -2.441 1.00 0.00 H new ATOM 1478 N LEU A 91 -1.556 -0.912 -2.633 1.00 0.00 N ATOM 1479 CA LEU A 91 -0.285 -1.603 -2.812 1.00 0.00 C ATOM 1480 C LEU A 91 -0.432 -3.071 -2.423 1.00 0.00 C ATOM 1481 O LEU A 91 -1.244 -3.406 -1.562 1.00 0.00 O ATOM 1482 CB LEU A 91 0.792 -0.940 -1.960 1.00 0.00 C ATOM 1483 CG LEU A 91 1.445 0.296 -2.584 1.00 0.00 C ATOM 1484 CD1 LEU A 91 1.496 1.438 -1.581 1.00 0.00 C ATOM 1485 CD2 LEU A 91 2.843 -0.032 -3.092 1.00 0.00 C ATOM 0 H LEU A 91 -2.055 -1.171 -1.782 1.00 0.00 H new ATOM 0 HA LEU A 91 0.008 -1.543 -3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.353 -0.656 -1.004 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.569 -1.674 -1.748 1.00 0.00 H new ATOM 0 HG LEU A 91 0.838 0.610 -3.433 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.963 2.307 -2.043 1.00 0.00 H new ATOM 0 HD12 LEU A 91 0.483 1.693 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.078 1.133 -0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.289 0.860 -3.532 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.461 -0.375 -2.262 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.781 -0.816 -3.847 1.00 0.00 H new ATOM 1497 N LYS A 92 0.341 -3.948 -3.059 1.00 0.00 N ATOM 1498 CA LYS A 92 0.260 -5.374 -2.756 1.00 0.00 C ATOM 1499 C LYS A 92 0.869 -5.676 -1.391 1.00 0.00 C ATOM 1500 O LYS A 92 2.043 -5.393 -1.141 1.00 0.00 O ATOM 1501 CB LYS A 92 0.965 -6.188 -3.844 1.00 0.00 C ATOM 1502 CG LYS A 92 0.303 -6.077 -5.206 1.00 0.00 C ATOM 1503 CD LYS A 92 -0.649 -7.231 -5.473 1.00 0.00 C ATOM 1504 CE LYS A 92 -0.265 -7.991 -6.732 1.00 0.00 C ATOM 1505 NZ LYS A 92 -0.900 -9.337 -6.784 1.00 0.00 N ATOM 0 H LYS A 92 1.022 -3.701 -3.778 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.792 -5.658 -2.729 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.000 -5.855 -3.923 1.00 0.00 H new ATOM 0 HB3 LYS A 92 0.990 -7.236 -3.545 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.243 -5.135 -5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.070 -6.053 -5.981 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.646 -7.911 -4.621 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.665 -6.850 -5.573 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.562 -7.415 -7.608 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.819 -8.099 -6.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.613 -9.823 -7.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.596 -9.896 -5.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.935 -9.233 -6.769 1.00 0.00 H new ATOM 1519 N ALA A 93 0.058 -6.262 -0.512 1.00 0.00 N ATOM 1520 CA ALA A 93 0.499 -6.612 0.833 1.00 0.00 C ATOM 1521 C ALA A 93 1.798 -7.407 0.794 1.00 0.00 C ATOM 1522 O ALA A 93 2.632 -7.301 1.692 1.00 0.00 O ATOM 1523 CB ALA A 93 -0.583 -7.402 1.554 1.00 0.00 C ATOM 0 H ALA A 93 -0.913 -6.505 -0.711 1.00 0.00 H new ATOM 0 HA ALA A 93 0.685 -5.688 1.380 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.240 -7.657 2.557 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.489 -6.800 1.622 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.796 -8.316 1.000 1.00 0.00 H new ATOM 1529 N SER A 94 1.958 -8.205 -0.254 1.00 0.00 N ATOM 1530 CA SER A 94 3.152 -9.022 -0.417 1.00 0.00 C ATOM 1531 C SER A 94 4.393 -8.151 -0.577 1.00 0.00 C ATOM 1532 O SER A 94 5.439 -8.433 0.010 1.00 0.00 O ATOM 1533 CB SER A 94 3.003 -9.943 -1.629 1.00 0.00 C ATOM 1534 OG SER A 94 3.134 -9.217 -2.839 1.00 0.00 O ATOM 0 H SER A 94 1.274 -8.303 -1.005 1.00 0.00 H new ATOM 0 HA SER A 94 3.270 -9.628 0.481 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.758 -10.728 -1.588 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.030 -10.434 -1.599 1.00 0.00 H new ATOM 0 HG SER A 94 3.037 -9.828 -3.599 1.00 0.00 H new ATOM 1540 N GLU A 95 4.276 -7.089 -1.368 1.00 0.00 N ATOM 1541 CA GLU A 95 5.401 -6.190 -1.591 1.00 0.00 C ATOM 1542 C GLU A 95 5.740 -5.433 -0.315 1.00 0.00 C ATOM 1543 O GLU A 95 6.899 -5.383 0.103 1.00 0.00 O ATOM 1544 CB GLU A 95 5.094 -5.200 -2.716 1.00 0.00 C ATOM 1545 CG GLU A 95 4.445 -5.831 -3.937 1.00 0.00 C ATOM 1546 CD GLU A 95 5.429 -6.078 -5.062 1.00 0.00 C ATOM 1547 OE1 GLU A 95 5.875 -5.093 -5.687 1.00 0.00 O ATOM 1548 OE2 GLU A 95 5.752 -7.257 -5.319 1.00 0.00 O ATOM 0 H GLU A 95 3.421 -6.832 -1.861 1.00 0.00 H new ATOM 0 HA GLU A 95 6.260 -6.794 -1.884 1.00 0.00 H new ATOM 0 HB2 GLU A 95 4.437 -4.421 -2.330 1.00 0.00 H new ATOM 0 HB3 GLU A 95 6.021 -4.714 -3.021 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.983 -6.776 -3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.646 -5.181 -4.295 1.00 0.00 H new ATOM 1555 N VAL A 96 4.721 -4.851 0.306 1.00 0.00 N ATOM 1556 CA VAL A 96 4.914 -4.103 1.540 1.00 0.00 C ATOM 1557 C VAL A 96 5.460 -5.007 2.636 1.00 0.00 C ATOM 1558 O VAL A 96 6.411 -4.656 3.331 1.00 0.00 O ATOM 1559 CB VAL A 96 3.601 -3.460 2.027 1.00 0.00 C ATOM 1560 CG1 VAL A 96 3.864 -2.541 3.211 1.00 0.00 C ATOM 1561 CG2 VAL A 96 2.920 -2.701 0.896 1.00 0.00 C ATOM 0 H VAL A 96 3.756 -4.883 -0.024 1.00 0.00 H new ATOM 0 HA VAL A 96 5.632 -3.311 1.324 1.00 0.00 H new ATOM 0 HB VAL A 96 2.930 -4.255 2.353 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.926 -2.096 3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.300 -3.116 4.028 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.555 -1.752 2.913 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.995 -2.255 1.262 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.583 -1.915 0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.694 -3.389 0.081 1.00 0.00 H new ATOM 1571 N GLU A 97 4.852 -6.178 2.775 1.00 0.00 N ATOM 1572 CA GLU A 97 5.269 -7.146 3.781 1.00 0.00 C ATOM 1573 C GLU A 97 6.750 -7.476 3.639 1.00 0.00 C ATOM 1574 O GLU A 97 7.482 -7.523 4.627 1.00 0.00 O ATOM 1575 CB GLU A 97 4.434 -8.424 3.667 1.00 0.00 C ATOM 1576 CG GLU A 97 3.087 -8.333 4.366 1.00 0.00 C ATOM 1577 CD GLU A 97 2.883 -9.436 5.386 1.00 0.00 C ATOM 1578 OE1 GLU A 97 3.884 -9.891 5.978 1.00 0.00 O ATOM 1579 OE2 GLU A 97 1.720 -9.844 5.594 1.00 0.00 O ATOM 0 H GLU A 97 4.065 -6.481 2.201 1.00 0.00 H new ATOM 0 HA GLU A 97 5.108 -6.703 4.764 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.273 -8.650 2.613 1.00 0.00 H new ATOM 0 HB3 GLU A 97 4.998 -9.256 4.089 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.004 -7.366 4.861 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.292 -8.380 3.622 1.00 0.00 H new ATOM 1586 N GLU A 98 7.187 -7.701 2.405 1.00 0.00 N ATOM 1587 CA GLU A 98 8.584 -8.024 2.143 1.00 0.00 C ATOM 1588 C GLU A 98 9.500 -6.886 2.587 1.00 0.00 C ATOM 1589 O GLU A 98 10.496 -7.106 3.285 1.00 0.00 O ATOM 1590 CB GLU A 98 8.789 -8.289 0.654 1.00 0.00 C ATOM 1591 CG GLU A 98 8.018 -9.481 0.124 1.00 0.00 C ATOM 1592 CD GLU A 98 8.815 -10.768 0.189 1.00 0.00 C ATOM 1593 OE1 GLU A 98 8.386 -11.697 0.906 1.00 0.00 O ATOM 1594 OE2 GLU A 98 9.871 -10.847 -0.475 1.00 0.00 O ATOM 0 H GLU A 98 6.597 -7.666 1.574 1.00 0.00 H new ATOM 0 HA GLU A 98 8.837 -8.918 2.712 1.00 0.00 H new ATOM 0 HB2 GLU A 98 8.494 -7.401 0.094 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.851 -8.445 0.467 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.099 -9.598 0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.727 -9.290 -0.909 1.00 0.00 H new ATOM 1601 N ILE A 99 9.154 -5.661 2.197 1.00 0.00 N ATOM 1602 CA ILE A 99 9.955 -4.505 2.573 1.00 0.00 C ATOM 1603 C ILE A 99 9.981 -4.374 4.087 1.00 0.00 C ATOM 1604 O ILE A 99 11.014 -4.060 4.680 1.00 0.00 O ATOM 1605 CB ILE A 99 9.434 -3.192 1.950 1.00 0.00 C ATOM 1606 CG1 ILE A 99 9.077 -3.389 0.474 1.00 0.00 C ATOM 1607 CG2 ILE A 99 10.481 -2.094 2.091 1.00 0.00 C ATOM 1608 CD1 ILE A 99 7.834 -2.638 0.051 1.00 0.00 C ATOM 0 H ILE A 99 8.335 -5.447 1.628 1.00 0.00 H new ATOM 0 HA ILE A 99 10.961 -4.670 2.187 1.00 0.00 H new ATOM 0 HB ILE A 99 8.531 -2.897 2.484 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.916 -3.064 -0.141 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.933 -4.452 0.281 1.00 0.00 H new ATOM 0 HG21 ILE A 99 10.103 -1.172 1.648 1.00 0.00 H new ATOM 0 HG22 ILE A 99 10.695 -1.928 3.147 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.395 -2.395 1.579 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.640 -2.822 -1.006 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.984 -2.980 0.641 1.00 0.00 H new ATOM 0 HD13 ILE A 99 7.982 -1.570 0.212 1.00 0.00 H new ATOM 1620 N LEU A 100 8.839 -4.642 4.709 1.00 0.00 N ATOM 1621 CA LEU A 100 8.731 -4.582 6.159 1.00 0.00 C ATOM 1622 C LEU A 100 9.607 -5.658 6.791 1.00 0.00 C ATOM 1623 O LEU A 100 10.214 -5.446 7.841 1.00 0.00 O ATOM 1624 CB LEU A 100 7.277 -4.764 6.599 1.00 0.00 C ATOM 1625 CG LEU A 100 6.333 -3.615 6.234 1.00 0.00 C ATOM 1626 CD1 LEU A 100 5.040 -3.725 7.024 1.00 0.00 C ATOM 1627 CD2 LEU A 100 6.997 -2.268 6.479 1.00 0.00 C ATOM 0 H LEU A 100 7.976 -4.903 4.231 1.00 0.00 H new ATOM 0 HA LEU A 100 9.072 -3.602 6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.893 -5.683 6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.256 -4.899 7.680 1.00 0.00 H new ATOM 0 HG LEU A 100 6.100 -3.687 5.172 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.378 -2.902 6.755 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.553 -4.673 6.794 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.260 -3.679 8.091 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.306 -1.468 6.212 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.264 -2.180 7.532 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.897 -2.189 5.868 1.00 0.00 H new ATOM 1639 N ASP A 101 9.684 -6.809 6.126 1.00 0.00 N ATOM 1640 CA ASP A 101 10.505 -7.918 6.604 1.00 0.00 C ATOM 1641 C ASP A 101 11.976 -7.660 6.284 1.00 0.00 C ATOM 1642 O ASP A 101 12.866 -8.333 6.804 1.00 0.00 O ATOM 1643 CB ASP A 101 10.050 -9.232 5.966 1.00 0.00 C ATOM 1644 CG ASP A 101 9.061 -9.984 6.834 1.00 0.00 C ATOM 1645 OD1 ASP A 101 7.843 -9.749 6.685 1.00 0.00 O ATOM 1646 OD2 ASP A 101 9.502 -10.807 7.664 1.00 0.00 O ATOM 0 H ASP A 101 9.188 -6.997 5.255 1.00 0.00 H new ATOM 0 HA ASP A 101 10.388 -7.997 7.685 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.595 -9.024 4.998 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.919 -9.863 5.780 1.00 0.00 H new ATOM 1651 N GLY A 102 12.215 -6.675 5.422 1.00 0.00 N ATOM 1652 CA GLY A 102 13.568 -6.323 5.031 1.00 0.00 C ATOM 1653 C GLY A 102 13.945 -6.878 3.674 1.00 0.00 C ATOM 1654 O GLY A 102 15.071 -6.692 3.212 1.00 0.00 O ATOM 0 H GLY A 102 11.487 -6.110 4.984 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.667 -5.238 5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.267 -6.696 5.779 1.00 0.00 H new ATOM 1658 N ASN A 103 12.991 -7.523 3.014 1.00 0.00 N ATOM 1659 CA ASN A 103 13.217 -8.060 1.682 1.00 0.00 C ATOM 1660 C ASN A 103 12.535 -7.166 0.657 1.00 0.00 C ATOM 1661 O ASN A 103 11.310 -7.094 0.610 1.00 0.00 O ATOM 1662 CB ASN A 103 12.681 -9.489 1.575 1.00 0.00 C ATOM 1663 CG ASN A 103 13.107 -10.170 0.290 1.00 0.00 C ATOM 1664 OD1 ASN A 103 14.134 -10.846 0.242 1.00 0.00 O ATOM 1665 ND2 ASN A 103 12.317 -9.993 -0.763 1.00 0.00 N ATOM 0 H ASN A 103 12.054 -7.686 3.381 1.00 0.00 H new ATOM 0 HA ASN A 103 14.289 -8.086 1.488 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.034 -10.071 2.426 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.593 -9.471 1.630 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.553 -10.426 -1.656 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.474 -9.424 -0.679 1.00 0.00 H new ATOM 1672 N ASP A 104 13.315 -6.467 -0.152 1.00 0.00 N ATOM 1673 CA ASP A 104 12.731 -5.574 -1.147 1.00 0.00 C ATOM 1674 C ASP A 104 13.748 -5.112 -2.186 1.00 0.00 C ATOM 1675 O ASP A 104 13.507 -4.141 -2.900 1.00 0.00 O ATOM 1676 CB ASP A 104 12.123 -4.361 -0.447 1.00 0.00 C ATOM 1677 CG ASP A 104 13.080 -3.727 0.543 1.00 0.00 C ATOM 1678 OD1 ASP A 104 13.364 -2.520 0.405 1.00 0.00 O ATOM 1679 OD2 ASP A 104 13.547 -4.440 1.457 1.00 0.00 O ATOM 0 H ASP A 104 14.335 -6.497 -0.143 1.00 0.00 H new ATOM 0 HA ASP A 104 11.960 -6.133 -1.677 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.833 -3.621 -1.193 1.00 0.00 H new ATOM 0 HB3 ASP A 104 11.214 -4.662 0.073 1.00 0.00 H new ATOM 1684 N GLU A 105 14.874 -5.806 -2.273 1.00 0.00 N ATOM 1685 CA GLU A 105 15.917 -5.455 -3.231 1.00 0.00 C ATOM 1686 C GLU A 105 15.367 -5.425 -4.653 1.00 0.00 C ATOM 1687 O GLU A 105 15.748 -4.577 -5.460 1.00 0.00 O ATOM 1688 CB GLU A 105 17.077 -6.448 -3.141 1.00 0.00 C ATOM 1689 CG GLU A 105 16.695 -7.866 -3.530 1.00 0.00 C ATOM 1690 CD GLU A 105 17.677 -8.898 -3.010 1.00 0.00 C ATOM 1691 OE1 GLU A 105 18.358 -8.614 -2.003 1.00 0.00 O ATOM 1692 OE2 GLU A 105 17.762 -9.991 -3.609 1.00 0.00 O ATOM 0 H GLU A 105 15.090 -6.616 -1.692 1.00 0.00 H new ATOM 0 HA GLU A 105 16.280 -4.458 -2.982 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.886 -6.108 -3.787 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.463 -6.451 -2.122 1.00 0.00 H new ATOM 0 HG2 GLU A 105 15.700 -8.089 -3.144 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.639 -7.938 -4.616 1.00 0.00 H new ATOM 1699 N LYS A 106 14.469 -6.355 -4.950 1.00 0.00 N ATOM 1700 CA LYS A 106 13.862 -6.436 -6.272 1.00 0.00 C ATOM 1701 C LYS A 106 12.918 -5.261 -6.508 1.00 0.00 C ATOM 1702 O LYS A 106 12.681 -4.861 -7.649 1.00 0.00 O ATOM 1703 CB LYS A 106 13.104 -7.756 -6.429 1.00 0.00 C ATOM 1704 CG LYS A 106 11.905 -7.884 -5.502 1.00 0.00 C ATOM 1705 CD LYS A 106 12.167 -8.877 -4.380 1.00 0.00 C ATOM 1706 CE LYS A 106 12.319 -10.292 -4.914 1.00 0.00 C ATOM 1707 NZ LYS A 106 13.746 -10.707 -4.991 1.00 0.00 N ATOM 0 H LYS A 106 14.145 -7.064 -4.293 1.00 0.00 H new ATOM 0 HA LYS A 106 14.659 -6.394 -7.015 1.00 0.00 H new ATOM 0 HB2 LYS A 106 12.766 -7.851 -7.461 1.00 0.00 H new ATOM 0 HB3 LYS A 106 13.788 -8.583 -6.240 1.00 0.00 H new ATOM 0 HG2 LYS A 106 11.667 -6.909 -5.077 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.034 -8.203 -6.075 1.00 0.00 H new ATOM 0 HD2 LYS A 106 13.071 -8.591 -3.843 1.00 0.00 H new ATOM 0 HD3 LYS A 106 11.346 -8.843 -3.664 1.00 0.00 H new ATOM 0 HE2 LYS A 106 11.774 -10.983 -4.271 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.868 -10.356 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 13.979 -10.969 -5.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 14.354 -9.918 -4.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 13.904 -11.524 -4.367 1.00 0.00 H new ATOM 1721 N TYR A 107 12.375 -4.718 -5.423 1.00 0.00 N ATOM 1722 CA TYR A 107 11.455 -3.597 -5.505 1.00 0.00 C ATOM 1723 C TYR A 107 12.202 -2.276 -5.650 1.00 0.00 C ATOM 1724 O TYR A 107 11.697 -1.332 -6.260 1.00 0.00 O ATOM 1725 CB TYR A 107 10.582 -3.558 -4.255 1.00 0.00 C ATOM 1726 CG TYR A 107 9.862 -4.853 -3.967 1.00 0.00 C ATOM 1727 CD1 TYR A 107 9.884 -5.408 -2.695 1.00 0.00 C ATOM 1728 CD2 TYR A 107 9.157 -5.516 -4.960 1.00 0.00 C ATOM 1729 CE1 TYR A 107 9.225 -6.588 -2.421 1.00 0.00 C ATOM 1730 CE2 TYR A 107 8.494 -6.699 -4.695 1.00 0.00 C ATOM 1731 CZ TYR A 107 8.532 -7.232 -3.423 1.00 0.00 C ATOM 1732 OH TYR A 107 7.872 -8.409 -3.154 1.00 0.00 O ATOM 0 H TYR A 107 12.560 -5.041 -4.473 1.00 0.00 H new ATOM 0 HA TYR A 107 10.832 -3.733 -6.389 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.205 -3.302 -3.398 1.00 0.00 H new ATOM 0 HB3 TYR A 107 9.846 -2.761 -4.363 1.00 0.00 H new ATOM 0 HD1 TYR A 107 10.426 -4.907 -1.907 1.00 0.00 H new ATOM 0 HD2 TYR A 107 9.126 -5.101 -5.957 1.00 0.00 H new ATOM 0 HE1 TYR A 107 9.252 -7.006 -1.425 1.00 0.00 H new ATOM 0 HE2 TYR A 107 7.949 -7.204 -5.479 1.00 0.00 H new ATOM 0 HH TYR A 107 7.433 -8.732 -3.969 1.00 0.00 H new ATOM 1742 N LYS A 108 13.401 -2.207 -5.081 1.00 0.00 N ATOM 1743 CA LYS A 108 14.204 -0.989 -5.146 1.00 0.00 C ATOM 1744 C LYS A 108 15.025 -0.937 -6.436 1.00 0.00 C ATOM 1745 O LYS A 108 15.657 0.076 -6.734 1.00 0.00 O ATOM 1746 CB LYS A 108 15.148 -0.878 -3.937 1.00 0.00 C ATOM 1747 CG LYS A 108 14.831 -1.824 -2.792 1.00 0.00 C ATOM 1748 CD LYS A 108 15.533 -1.404 -1.508 1.00 0.00 C ATOM 1749 CE LYS A 108 15.194 0.028 -1.129 1.00 0.00 C ATOM 1750 NZ LYS A 108 15.217 0.237 0.346 1.00 0.00 N ATOM 0 H LYS A 108 13.837 -2.976 -4.572 1.00 0.00 H new ATOM 0 HA LYS A 108 13.510 -0.148 -5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 108 16.168 -1.065 -4.272 1.00 0.00 H new ATOM 0 HB3 LYS A 108 15.118 0.145 -3.563 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.754 -1.849 -2.627 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.136 -2.836 -3.060 1.00 0.00 H new ATOM 0 HD2 LYS A 108 15.243 -2.074 -0.698 1.00 0.00 H new ATOM 0 HD3 LYS A 108 16.611 -1.503 -1.633 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.905 0.706 -1.602 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.207 0.281 -1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.488 1.220 0.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 14.273 0.048 0.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.907 -0.410 0.778 1.00 0.00 H new ATOM 1764 N ALA A 109 15.029 -2.035 -7.191 1.00 0.00 N ATOM 1765 CA ALA A 109 15.794 -2.101 -8.433 1.00 0.00 C ATOM 1766 C ALA A 109 14.896 -2.273 -9.655 1.00 0.00 C ATOM 1767 O ALA A 109 15.334 -2.787 -10.684 1.00 0.00 O ATOM 1768 CB ALA A 109 16.797 -3.239 -8.361 1.00 0.00 C ATOM 0 H ALA A 109 14.514 -2.886 -6.965 1.00 0.00 H new ATOM 0 HA ALA A 109 16.319 -1.152 -8.546 1.00 0.00 H new ATOM 0 HB1 ALA A 109 17.365 -3.283 -9.291 1.00 0.00 H new ATOM 0 HB2 ALA A 109 17.479 -3.071 -7.527 1.00 0.00 H new ATOM 0 HB3 ALA A 109 16.269 -4.181 -8.214 1.00 0.00 H new ATOM 1774 N VAL A 110 13.646 -1.837 -9.546 1.00 0.00 N ATOM 1775 CA VAL A 110 12.699 -1.940 -10.653 1.00 0.00 C ATOM 1776 C VAL A 110 12.736 -3.326 -11.297 1.00 0.00 C ATOM 1777 O VAL A 110 12.564 -3.463 -12.508 1.00 0.00 O ATOM 1778 CB VAL A 110 12.998 -0.881 -11.726 1.00 0.00 C ATOM 1779 CG1 VAL A 110 11.899 -0.852 -12.779 1.00 0.00 C ATOM 1780 CG2 VAL A 110 13.176 0.490 -11.091 1.00 0.00 C ATOM 0 H VAL A 110 13.264 -1.409 -8.703 1.00 0.00 H new ATOM 0 HA VAL A 110 11.705 -1.771 -10.239 1.00 0.00 H new ATOM 0 HB VAL A 110 13.931 -1.151 -12.221 1.00 0.00 H new ATOM 0 HG11 VAL A 110 12.132 -0.095 -13.528 1.00 0.00 H new ATOM 0 HG12 VAL A 110 11.829 -1.828 -13.259 1.00 0.00 H new ATOM 0 HG13 VAL A 110 10.947 -0.612 -12.305 1.00 0.00 H new ATOM 0 HG21 VAL A 110 13.387 1.226 -11.867 1.00 0.00 H new ATOM 0 HG22 VAL A 110 12.263 0.769 -10.565 1.00 0.00 H new ATOM 0 HG23 VAL A 110 14.006 0.459 -10.385 1.00 0.00 H new ATOM 1790 N SER A 111 12.965 -4.349 -10.481 1.00 0.00 N ATOM 1791 CA SER A 111 13.028 -5.720 -10.977 1.00 0.00 C ATOM 1792 C SER A 111 11.753 -6.486 -10.634 1.00 0.00 C ATOM 1793 O SER A 111 11.586 -6.964 -9.512 1.00 0.00 O ATOM 1794 CB SER A 111 14.243 -6.441 -10.390 1.00 0.00 C ATOM 1795 OG SER A 111 14.653 -5.845 -9.172 1.00 0.00 O ATOM 0 H SER A 111 13.110 -4.256 -9.476 1.00 0.00 H new ATOM 0 HA SER A 111 13.124 -5.682 -12.062 1.00 0.00 H new ATOM 0 HB2 SER A 111 14.000 -7.490 -10.221 1.00 0.00 H new ATOM 0 HB3 SER A 111 15.065 -6.415 -11.105 1.00 0.00 H new ATOM 0 HG SER A 111 13.864 -5.631 -8.631 1.00 0.00 H new ATOM 1801 N ILE A 112 10.857 -6.601 -11.610 1.00 0.00 N ATOM 1802 CA ILE A 112 9.598 -7.311 -11.413 1.00 0.00 C ATOM 1803 C ILE A 112 9.516 -8.542 -12.312 1.00 0.00 C ATOM 1804 O ILE A 112 8.462 -8.854 -12.866 1.00 0.00 O ATOM 1805 CB ILE A 112 8.386 -6.394 -11.688 1.00 0.00 C ATOM 1806 CG1 ILE A 112 7.082 -7.109 -11.326 1.00 0.00 C ATOM 1807 CG2 ILE A 112 8.372 -5.948 -13.143 1.00 0.00 C ATOM 1808 CD1 ILE A 112 6.111 -6.240 -10.556 1.00 0.00 C ATOM 0 H ILE A 112 10.980 -6.212 -12.545 1.00 0.00 H new ATOM 0 HA ILE A 112 9.570 -7.628 -10.370 1.00 0.00 H new ATOM 0 HB ILE A 112 8.474 -5.506 -11.062 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.601 -7.455 -12.241 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.314 -7.994 -10.733 1.00 0.00 H new ATOM 0 HG21 ILE A 112 7.511 -5.303 -13.318 1.00 0.00 H new ATOM 0 HG22 ILE A 112 9.287 -5.399 -13.364 1.00 0.00 H new ATOM 0 HG23 ILE A 112 8.308 -6.822 -13.791 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.210 -6.811 -10.333 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.574 -5.914 -9.624 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.849 -5.368 -11.155 1.00 0.00 H new ATOM 1820 N SER A 113 10.640 -9.239 -12.453 1.00 0.00 N ATOM 1821 CA SER A 113 10.697 -10.437 -13.285 1.00 0.00 C ATOM 1822 C SER A 113 11.321 -11.600 -12.522 1.00 0.00 C ATOM 1823 O SER A 113 11.428 -12.700 -13.105 1.00 0.00 O ATOM 1824 CB SER A 113 11.496 -10.159 -14.559 1.00 0.00 C ATOM 1825 OG SER A 113 10.656 -9.685 -15.596 1.00 0.00 O ATOM 1826 OXT SER A 113 11.699 -11.402 -11.349 1.00 0.00 O ATOM 0 H SER A 113 11.522 -8.995 -12.003 1.00 0.00 H new ATOM 0 HA SER A 113 9.677 -10.711 -13.556 1.00 0.00 H new ATOM 0 HB2 SER A 113 12.273 -9.423 -14.351 1.00 0.00 H new ATOM 0 HB3 SER A 113 11.999 -11.070 -14.882 1.00 0.00 H new ATOM 0 HG SER A 113 11.192 -9.513 -16.398 1.00 0.00 H new TER 1832 SER A 113