USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1018 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 47 ASN : amide:sc= -0.527 K(o=-0.85,f=-0.066) USER MOD Set 1.2: A 75 GLN : amide:sc= -0.32 K(o=-0.85,f=-0.066) USER MOD Set 2.1: A 45 THR OG1 : rot 150:sc=0.000433 USER MOD Set 2.2: A 93 HIS : no HE2:sc= -3.83! C(o=-3.8!,f=-6.4!) USER MOD Set 3.1: A 42 SER OG : rot -93:sc= -0.26! USER MOD Set 3.2: A 71 HIS : no HE2:sc= -2.65! C(o=-2.9!,f=-6.3!) USER MOD Set 4.1: A 27 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Set 4.2: A 31 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Set 5.1: A 28 GLN : amide:sc= -0.0224 K(o=-0.3,f=-3.2) USER MOD Set 5.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 5.3: A 150 HIS : no HD1:sc= -0.276 K(o=-0.3,f=-4.4!) USER MOD Set 6.1: A 11 CYS SG : rot -170:sc= -0.261 USER MOD Set 6.2: A 12 THR OG1 : rot 180:sc= 0.0856 USER MOD Set 7.1: A 6 HIS : no HE2:sc= -0.55 K(o=-5.5,f=-6.8) USER MOD Set 7.2: A 8 THR OG1 : rot -130:sc= -1.21 USER MOD Set 7.3: A 41 THR OG1 : rot 180:sc= 0 USER MOD Set 7.4: A 80 HIS : no HD1:sc= -3.78! C(o=-5.5!,f=-6.6!) USER MOD Single : A 14 ASN : amide:sc= -3.89! C(o=-3.9!,f=-8.3!) USER MOD Single : A 16 CYS SG : rot 180:sc= -0.508 USER MOD Single : A 18 SER OG : rot -129:sc= 0.133 USER MOD Single : A 20 MET CE :methyl 141:sc= -2! (180deg=-3.96!) USER MOD Single : A 23 LYS NZ :NH3+ 143:sc= -2.15 (180deg=-2.49) USER MOD Single : A 24 MET CE :methyl -152:sc= -1.34 (180deg=-2.11) USER MOD Single : A 49 HIS : no HD1:sc= -0.026 X(o=-0.026,f=-0.026) USER MOD Single : A 52 SER OG : rot 180:sc= 0.182 USER MOD Single : A 53 CYS SG : rot 48:sc= 0.195 USER MOD Single : A 65 HIS : no HD1:sc= 0.0276 K(o=0.028,f=-4.6!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc=-0.00782 K(o=-0.0078,f=-0.71) USER MOD Single : A 99 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 109 MET CE :methyl -136:sc= -0.689 (180deg=-2.93!) USER MOD Single : A 112 SER OG : rot -33:sc= 0.336 USER MOD Single : A 144 SER OG : rot 76:sc= 1.29 USER MOD ----------------------------------------------------------------- ATOM 50 N PRO A 4 -6.172 21.085 -17.692 1.00 1.00 N ATOM 51 CA PRO A 4 -5.999 21.646 -16.351 1.00 1.00 C ATOM 52 C PRO A 4 -4.821 22.605 -16.232 1.00 1.00 C ATOM 53 O PRO A 4 -3.909 22.615 -17.064 1.00 1.00 O ATOM 54 CB PRO A 4 -5.766 20.413 -15.467 1.00 1.00 C ATOM 55 CG PRO A 4 -5.284 19.359 -16.395 1.00 1.00 C ATOM 56 CD PRO A 4 -5.945 19.630 -17.709 1.00 1.00 C ATOM 0 HA PRO A 4 -6.866 22.244 -16.070 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -5.032 20.619 -14.688 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -6.685 20.108 -14.966 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -4.199 19.391 -16.491 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -5.543 18.367 -16.026 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -5.311 19.333 -18.545 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -6.881 19.080 -17.808 1.00 1.00 H new ATOM 64 N LEU A 5 -4.858 23.401 -15.172 1.00 1.00 N ATOM 65 CA LEU A 5 -3.797 24.351 -14.855 1.00 1.00 C ATOM 66 C LEU A 5 -2.517 23.583 -14.502 1.00 1.00 C ATOM 67 O LEU A 5 -2.525 22.358 -14.438 1.00 1.00 O ATOM 68 CB LEU A 5 -4.249 25.211 -13.659 1.00 1.00 C ATOM 69 CG LEU A 5 -4.020 26.731 -13.742 1.00 1.00 C ATOM 70 CD1 LEU A 5 -2.543 27.084 -13.678 1.00 1.00 C ATOM 71 CD2 LEU A 5 -4.653 27.303 -15.000 1.00 1.00 C ATOM 0 H LEU A 5 -5.628 23.407 -14.504 1.00 1.00 H new ATOM 0 HA LEU A 5 -3.595 24.995 -15.711 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -5.315 25.040 -13.507 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -3.738 24.843 -12.769 1.00 1.00 H new ATOM 0 HG LEU A 5 -4.502 27.180 -12.874 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -2.424 28.166 -13.740 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -2.124 26.726 -12.738 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -2.020 26.614 -14.511 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -4.479 28.378 -15.038 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -4.209 26.832 -15.877 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -5.726 27.109 -14.988 1.00 1.00 H new ATOM 83 N HIS A 6 -1.441 24.293 -14.218 1.00 1.00 N ATOM 84 CA HIS A 6 -0.182 23.656 -13.858 1.00 1.00 C ATOM 85 C HIS A 6 0.662 24.622 -13.061 1.00 1.00 C ATOM 86 O HIS A 6 1.310 25.492 -13.632 1.00 1.00 O ATOM 87 CB HIS A 6 0.601 23.237 -15.107 1.00 1.00 C ATOM 88 CG HIS A 6 1.471 22.019 -14.936 1.00 1.00 C ATOM 89 ND1 HIS A 6 2.140 21.425 -15.988 1.00 1.00 N ATOM 90 CD2 HIS A 6 1.801 21.300 -13.832 1.00 1.00 C ATOM 91 CE1 HIS A 6 2.845 20.401 -15.541 1.00 1.00 C ATOM 92 NE2 HIS A 6 2.658 20.304 -14.238 1.00 1.00 N ATOM 0 H HIS A 6 -1.411 25.312 -14.229 1.00 1.00 H new ATOM 0 HA HIS A 6 -0.409 22.768 -13.268 1.00 1.00 H new ATOM 0 HB2 HIS A 6 -0.107 23.049 -15.914 1.00 1.00 H new ATOM 0 HB3 HIS A 6 1.228 24.071 -15.421 1.00 1.00 H new ATOM 0 HD1 HIS A 6 2.097 21.730 -16.960 1.00 1.00 H new ATOM 0 HD2 HIS A 6 1.455 21.477 -12.824 1.00 1.00 H new ATOM 0 HE1 HIS A 6 3.468 19.753 -16.140 1.00 1.00 H new ATOM 101 N VAL A 7 0.637 24.496 -11.754 1.00 1.00 N ATOM 102 CA VAL A 7 1.461 25.359 -10.923 1.00 1.00 C ATOM 103 C VAL A 7 2.655 24.550 -10.460 1.00 1.00 C ATOM 104 O VAL A 7 2.481 23.486 -9.877 1.00 1.00 O ATOM 105 CB VAL A 7 0.720 25.897 -9.680 1.00 1.00 C ATOM 106 CG1 VAL A 7 1.358 27.175 -9.188 1.00 1.00 C ATOM 107 CG2 VAL A 7 -0.758 26.098 -9.954 1.00 1.00 C ATOM 0 H VAL A 7 0.068 23.819 -11.246 1.00 1.00 H new ATOM 0 HA VAL A 7 1.748 26.224 -11.521 1.00 1.00 H new ATOM 0 HB VAL A 7 0.806 25.147 -8.894 1.00 1.00 H new ATOM 0 HG11 VAL A 7 0.820 27.536 -8.312 1.00 1.00 H new ATOM 0 HG12 VAL A 7 2.398 26.984 -8.922 1.00 1.00 H new ATOM 0 HG13 VAL A 7 1.317 27.928 -9.975 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -1.246 26.477 -9.056 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -0.883 26.815 -10.766 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -1.208 25.147 -10.237 1.00 1.00 H new ATOM 117 N THR A 8 3.846 24.960 -10.833 1.00 1.00 N ATOM 118 CA THR A 8 5.038 24.242 -10.432 1.00 1.00 C ATOM 119 C THR A 8 5.941 25.146 -9.587 1.00 1.00 C ATOM 120 O THR A 8 6.379 26.201 -10.039 1.00 1.00 O ATOM 121 CB THR A 8 5.783 23.665 -11.668 1.00 1.00 C ATOM 122 OG1 THR A 8 6.767 22.714 -11.250 1.00 1.00 O ATOM 123 CG2 THR A 8 6.444 24.745 -12.507 1.00 1.00 C ATOM 0 H THR A 8 4.017 25.783 -11.411 1.00 1.00 H new ATOM 0 HA THR A 8 4.746 23.393 -9.814 1.00 1.00 H new ATOM 0 HB THR A 8 5.033 23.178 -12.292 1.00 1.00 H new ATOM 0 HG1 THR A 8 7.625 22.923 -11.675 1.00 1.00 H new ATOM 0 HG21 THR A 8 6.950 24.287 -13.357 1.00 1.00 H new ATOM 0 HG22 THR A 8 5.686 25.440 -12.868 1.00 1.00 H new ATOM 0 HG23 THR A 8 7.171 25.284 -11.899 1.00 1.00 H new ATOM 131 N PHE A 9 6.112 24.797 -8.317 1.00 1.00 N ATOM 132 CA PHE A 9 6.931 25.609 -7.422 1.00 1.00 C ATOM 133 C PHE A 9 8.391 25.262 -7.592 1.00 1.00 C ATOM 134 O PHE A 9 8.793 24.111 -7.430 1.00 1.00 O ATOM 135 CB PHE A 9 6.545 25.403 -5.967 1.00 1.00 C ATOM 136 CG PHE A 9 5.094 25.125 -5.771 1.00 1.00 C ATOM 137 CD1 PHE A 9 4.149 26.127 -5.908 1.00 1.00 C ATOM 138 CD2 PHE A 9 4.672 23.849 -5.458 1.00 1.00 C ATOM 139 CE1 PHE A 9 2.814 25.857 -5.731 1.00 1.00 C ATOM 140 CE2 PHE A 9 3.339 23.576 -5.282 1.00 1.00 C ATOM 141 CZ PHE A 9 2.410 24.578 -5.416 1.00 1.00 C ATOM 0 H PHE A 9 5.701 23.968 -7.887 1.00 1.00 H new ATOM 0 HA PHE A 9 6.759 26.653 -7.685 1.00 1.00 H new ATOM 0 HB2 PHE A 9 7.124 24.574 -5.560 1.00 1.00 H new ATOM 0 HB3 PHE A 9 6.817 26.292 -5.398 1.00 1.00 H new ATOM 0 HD1 PHE A 9 4.464 27.130 -6.156 1.00 1.00 H new ATOM 0 HD2 PHE A 9 5.398 23.057 -5.350 1.00 1.00 H new ATOM 0 HE1 PHE A 9 2.083 26.645 -5.838 1.00 1.00 H new ATOM 0 HE2 PHE A 9 3.021 22.573 -5.038 1.00 1.00 H new ATOM 0 HZ PHE A 9 1.361 24.363 -5.274 1.00 1.00 H new ATOM 151 N VAL A 10 9.189 26.269 -7.851 1.00 1.00 N ATOM 152 CA VAL A 10 10.593 26.078 -8.116 1.00 1.00 C ATOM 153 C VAL A 10 11.454 26.611 -6.984 1.00 1.00 C ATOM 154 O VAL A 10 11.542 27.825 -6.760 1.00 1.00 O ATOM 155 CB VAL A 10 10.981 26.787 -9.416 1.00 1.00 C ATOM 156 CG1 VAL A 10 12.415 26.485 -9.788 1.00 1.00 C ATOM 157 CG2 VAL A 10 10.034 26.394 -10.531 1.00 1.00 C ATOM 0 H VAL A 10 8.884 27.242 -7.884 1.00 1.00 H new ATOM 0 HA VAL A 10 10.767 25.006 -8.206 1.00 1.00 H new ATOM 0 HB VAL A 10 10.900 27.863 -9.261 1.00 1.00 H new ATOM 0 HG11 VAL A 10 12.667 27.000 -10.715 1.00 1.00 H new ATOM 0 HG12 VAL A 10 13.077 26.826 -8.992 1.00 1.00 H new ATOM 0 HG13 VAL A 10 12.537 25.411 -9.925 1.00 1.00 H new ATOM 0 HG21 VAL A 10 10.321 26.905 -11.450 1.00 1.00 H new ATOM 0 HG22 VAL A 10 10.081 25.316 -10.686 1.00 1.00 H new ATOM 0 HG23 VAL A 10 9.017 26.677 -10.261 1.00 1.00 H new ATOM 167 N CYS A 11 12.105 25.704 -6.282 1.00 1.00 N ATOM 168 CA CYS A 11 13.009 26.072 -5.213 1.00 1.00 C ATOM 169 C CYS A 11 14.222 25.160 -5.284 1.00 1.00 C ATOM 170 O CYS A 11 14.168 24.130 -5.941 1.00 1.00 O ATOM 171 CB CYS A 11 12.322 25.951 -3.850 1.00 1.00 C ATOM 172 SG CYS A 11 13.291 26.603 -2.465 1.00 1.00 S ATOM 0 H CYS A 11 12.023 24.699 -6.436 1.00 1.00 H new ATOM 0 HA CYS A 11 13.315 27.112 -5.330 1.00 1.00 H new ATOM 0 HB2 CYS A 11 11.368 26.476 -3.889 1.00 1.00 H new ATOM 0 HB3 CYS A 11 12.100 24.901 -3.660 1.00 1.00 H new ATOM 0 HG CYS A 11 12.725 26.269 -1.344 1.00 1.00 H new ATOM 178 N THR A 12 15.322 25.546 -4.665 1.00 1.00 N ATOM 179 CA THR A 12 16.507 24.713 -4.682 1.00 1.00 C ATOM 180 C THR A 12 16.245 23.431 -3.916 1.00 1.00 C ATOM 181 O THR A 12 16.604 22.340 -4.357 1.00 1.00 O ATOM 182 CB THR A 12 17.706 25.458 -4.097 1.00 1.00 C ATOM 183 OG1 THR A 12 17.245 26.482 -3.204 1.00 1.00 O ATOM 184 CG2 THR A 12 18.526 26.070 -5.214 1.00 1.00 C ATOM 0 H THR A 12 15.419 26.421 -4.150 1.00 1.00 H new ATOM 0 HA THR A 12 16.744 24.463 -5.716 1.00 1.00 H new ATOM 0 HB THR A 12 18.333 24.758 -3.544 1.00 1.00 H new ATOM 0 HG1 THR A 12 18.014 26.958 -2.828 1.00 1.00 H new ATOM 0 HG21 THR A 12 19.379 26.600 -4.791 1.00 1.00 H new ATOM 0 HG22 THR A 12 18.881 25.282 -5.878 1.00 1.00 H new ATOM 0 HG23 THR A 12 17.908 26.769 -5.778 1.00 1.00 H new ATOM 192 N GLY A 13 15.538 23.572 -2.809 1.00 1.00 N ATOM 193 CA GLY A 13 15.136 22.427 -2.044 1.00 1.00 C ATOM 194 C GLY A 13 13.665 22.123 -2.259 1.00 1.00 C ATOM 195 O GLY A 13 12.801 22.567 -1.500 1.00 1.00 O ATOM 0 H GLY A 13 15.236 24.469 -2.429 1.00 1.00 H new ATOM 0 HA2 GLY A 13 15.736 21.564 -2.331 1.00 1.00 H new ATOM 0 HA3 GLY A 13 15.324 22.607 -0.986 1.00 1.00 H new ATOM 199 N ASN A 14 13.400 21.460 -3.378 1.00 1.00 N ATOM 200 CA ASN A 14 12.079 20.969 -3.792 1.00 1.00 C ATOM 201 C ASN A 14 11.476 19.986 -2.779 1.00 1.00 C ATOM 202 O ASN A 14 10.553 19.233 -3.094 1.00 1.00 O ATOM 203 CB ASN A 14 12.222 20.277 -5.160 1.00 1.00 C ATOM 204 CG ASN A 14 13.325 19.216 -5.194 1.00 1.00 C ATOM 205 OD1 ASN A 14 14.223 19.185 -4.352 1.00 1.00 O ATOM 206 ND2 ASN A 14 13.296 18.365 -6.202 1.00 1.00 N ATOM 0 H ASN A 14 14.128 21.237 -4.056 1.00 1.00 H new ATOM 0 HA ASN A 14 11.403 21.822 -3.852 1.00 1.00 H new ATOM 0 HB2 ASN A 14 11.272 19.811 -5.424 1.00 1.00 H new ATOM 0 HB3 ASN A 14 12.430 21.030 -5.920 1.00 1.00 H new ATOM 0 HD21 ASN A 14 14.028 17.661 -6.296 1.00 1.00 H new ATOM 0 HD22 ASN A 14 12.541 18.411 -6.887 1.00 1.00 H new ATOM 213 N ILE A 15 12.004 19.997 -1.572 1.00 1.00 N ATOM 214 CA ILE A 15 11.523 19.155 -0.501 1.00 1.00 C ATOM 215 C ILE A 15 11.084 20.007 0.679 1.00 1.00 C ATOM 216 O ILE A 15 10.529 19.502 1.645 1.00 1.00 O ATOM 217 CB ILE A 15 12.609 18.171 -0.035 1.00 1.00 C ATOM 218 CG1 ILE A 15 13.933 18.908 0.218 1.00 1.00 C ATOM 219 CG2 ILE A 15 12.792 17.085 -1.082 1.00 1.00 C ATOM 220 CD1 ILE A 15 14.847 18.206 1.198 1.00 1.00 C ATOM 0 H ILE A 15 12.786 20.596 -1.307 1.00 1.00 H new ATOM 0 HA ILE A 15 10.675 18.586 -0.883 1.00 1.00 H new ATOM 0 HB ILE A 15 12.296 17.712 0.903 1.00 1.00 H new ATOM 0 HG12 ILE A 15 14.457 19.029 -0.730 1.00 1.00 H new ATOM 0 HG13 ILE A 15 13.715 19.908 0.592 1.00 1.00 H new ATOM 0 HG21 ILE A 15 13.562 16.387 -0.752 1.00 1.00 H new ATOM 0 HG22 ILE A 15 11.852 16.550 -1.219 1.00 1.00 H new ATOM 0 HG23 ILE A 15 13.093 17.537 -2.027 1.00 1.00 H new ATOM 0 HD11 ILE A 15 15.760 18.787 1.324 1.00 1.00 H new ATOM 0 HD12 ILE A 15 14.343 18.109 2.160 1.00 1.00 H new ATOM 0 HD13 ILE A 15 15.097 17.216 0.817 1.00 1.00 H new ATOM 232 N CYS A 16 11.225 21.315 0.542 1.00 1.00 N ATOM 233 CA CYS A 16 10.886 22.217 1.626 1.00 1.00 C ATOM 234 C CYS A 16 9.726 23.146 1.264 1.00 1.00 C ATOM 235 O CYS A 16 8.566 22.780 1.419 1.00 1.00 O ATOM 236 CB CYS A 16 12.105 23.047 2.018 1.00 1.00 C ATOM 237 SG CYS A 16 13.619 22.086 2.261 1.00 1.00 S ATOM 0 H CYS A 16 11.569 21.772 -0.303 1.00 1.00 H new ATOM 0 HA CYS A 16 10.568 21.603 2.469 1.00 1.00 H new ATOM 0 HB2 CYS A 16 12.284 23.794 1.245 1.00 1.00 H new ATOM 0 HB3 CYS A 16 11.881 23.587 2.938 1.00 1.00 H new ATOM 0 HG CYS A 16 14.592 22.884 2.588 1.00 1.00 H new ATOM 243 N ARG A 17 10.043 24.283 0.644 1.00 1.00 N ATOM 244 CA ARG A 17 9.039 25.316 0.373 1.00 1.00 C ATOM 245 C ARG A 17 8.071 24.910 -0.739 1.00 1.00 C ATOM 246 O ARG A 17 6.849 25.047 -0.590 1.00 1.00 O ATOM 247 CB ARG A 17 9.729 26.645 0.036 1.00 1.00 C ATOM 248 CG ARG A 17 10.848 26.989 1.007 1.00 1.00 C ATOM 249 CD ARG A 17 10.910 28.477 1.327 1.00 1.00 C ATOM 250 NE ARG A 17 11.315 29.301 0.186 1.00 1.00 N ATOM 251 CZ ARG A 17 12.508 29.898 0.091 1.00 1.00 C ATOM 252 NH1 ARG A 17 13.485 29.568 0.925 1.00 1.00 N ATOM 253 NH2 ARG A 17 12.740 30.791 -0.863 1.00 1.00 N ATOM 0 H ARG A 17 10.983 24.513 0.321 1.00 1.00 H new ATOM 0 HA ARG A 17 8.444 25.440 1.278 1.00 1.00 H new ATOM 0 HB2 ARG A 17 10.134 26.593 -0.975 1.00 1.00 H new ATOM 0 HB3 ARG A 17 8.989 27.445 0.042 1.00 1.00 H new ATOM 0 HG2 ARG A 17 10.707 26.428 1.931 1.00 1.00 H new ATOM 0 HG3 ARG A 17 11.801 26.672 0.584 1.00 1.00 H new ATOM 0 HD2 ARG A 17 9.931 28.807 1.675 1.00 1.00 H new ATOM 0 HD3 ARG A 17 11.610 28.636 2.147 1.00 1.00 H new ATOM 0 HE ARG A 17 10.651 29.426 -0.578 1.00 1.00 H new ATOM 0 HH11 ARG A 17 13.327 28.858 1.640 1.00 1.00 H new ATOM 0 HH12 ARG A 17 14.394 30.024 0.851 1.00 1.00 H new ATOM 0 HH21 ARG A 17 12.006 31.027 -1.531 1.00 1.00 H new ATOM 0 HH22 ARG A 17 13.653 31.242 -0.929 1.00 1.00 H new ATOM 267 N SER A 18 8.617 24.404 -1.839 1.00 1.00 N ATOM 268 CA SER A 18 7.803 23.974 -2.968 1.00 1.00 C ATOM 269 C SER A 18 6.733 22.961 -2.532 1.00 1.00 C ATOM 270 O SER A 18 5.539 23.244 -2.637 1.00 1.00 O ATOM 271 CB SER A 18 8.691 23.389 -4.070 1.00 1.00 C ATOM 272 OG SER A 18 9.689 24.310 -4.467 1.00 1.00 O ATOM 0 H SER A 18 9.621 24.282 -1.972 1.00 1.00 H new ATOM 0 HA SER A 18 7.285 24.847 -3.365 1.00 1.00 H new ATOM 0 HB2 SER A 18 9.160 22.472 -3.714 1.00 1.00 H new ATOM 0 HB3 SER A 18 8.078 23.120 -4.930 1.00 1.00 H new ATOM 0 HG SER A 18 9.681 24.401 -5.443 1.00 1.00 H new ATOM 278 N PRO A 19 7.123 21.806 -1.943 1.00 1.00 N ATOM 279 CA PRO A 19 6.149 20.791 -1.506 1.00 1.00 C ATOM 280 C PRO A 19 5.211 21.286 -0.403 1.00 1.00 C ATOM 281 O PRO A 19 4.140 20.716 -0.197 1.00 1.00 O ATOM 282 CB PRO A 19 7.024 19.664 -0.971 1.00 1.00 C ATOM 283 CG PRO A 19 8.296 20.330 -0.609 1.00 1.00 C ATOM 284 CD PRO A 19 8.511 21.377 -1.656 1.00 1.00 C ATOM 0 HA PRO A 19 5.491 20.502 -2.326 1.00 1.00 H new ATOM 0 HB2 PRO A 19 6.567 19.182 -0.107 1.00 1.00 H new ATOM 0 HB3 PRO A 19 7.180 18.890 -1.723 1.00 1.00 H new ATOM 0 HG2 PRO A 19 8.237 20.775 0.384 1.00 1.00 H new ATOM 0 HG3 PRO A 19 9.121 19.618 -0.591 1.00 1.00 H new ATOM 0 HD2 PRO A 19 9.126 22.200 -1.292 1.00 1.00 H new ATOM 0 HD3 PRO A 19 9.006 20.976 -2.540 1.00 1.00 H new ATOM 292 N MET A 20 5.634 22.302 0.337 1.00 1.00 N ATOM 293 CA MET A 20 4.802 22.864 1.402 1.00 1.00 C ATOM 294 C MET A 20 3.493 23.416 0.836 1.00 1.00 C ATOM 295 O MET A 20 2.411 22.947 1.187 1.00 1.00 O ATOM 296 CB MET A 20 5.553 23.969 2.139 1.00 1.00 C ATOM 297 CG MET A 20 6.406 23.477 3.295 1.00 1.00 C ATOM 298 SD MET A 20 5.430 23.108 4.769 1.00 1.00 S ATOM 299 CE MET A 20 4.857 24.752 5.195 1.00 1.00 C ATOM 0 H MET A 20 6.541 22.754 0.224 1.00 1.00 H new ATOM 0 HA MET A 20 4.568 22.063 2.104 1.00 1.00 H new ATOM 0 HB2 MET A 20 6.191 24.495 1.429 1.00 1.00 H new ATOM 0 HB3 MET A 20 4.832 24.694 2.517 1.00 1.00 H new ATOM 0 HG2 MET A 20 6.946 22.582 2.988 1.00 1.00 H new ATOM 0 HG3 MET A 20 7.153 24.233 3.538 1.00 1.00 H new ATOM 0 HE1 MET A 20 3.825 24.699 5.541 1.00 1.00 H new ATOM 0 HE2 MET A 20 5.484 25.162 5.987 1.00 1.00 H new ATOM 0 HE3 MET A 20 4.913 25.396 4.317 1.00 1.00 H new ATOM 309 N ALA A 21 3.607 24.289 -0.157 1.00 1.00 N ATOM 310 CA ALA A 21 2.415 24.889 -0.769 1.00 1.00 C ATOM 311 C ALA A 21 1.714 23.878 -1.643 1.00 1.00 C ATOM 312 O ALA A 21 0.495 23.930 -1.813 1.00 1.00 O ATOM 313 CB ALA A 21 2.764 26.122 -1.584 1.00 1.00 C ATOM 0 H ALA A 21 4.494 24.597 -0.555 1.00 1.00 H new ATOM 0 HA ALA A 21 1.749 25.197 0.037 1.00 1.00 H new ATOM 0 HB1 ALA A 21 1.856 26.538 -2.021 1.00 1.00 H new ATOM 0 HB2 ALA A 21 3.229 26.866 -0.937 1.00 1.00 H new ATOM 0 HB3 ALA A 21 3.457 25.848 -2.379 1.00 1.00 H new ATOM 319 N GLU A 22 2.495 22.921 -2.120 1.00 1.00 N ATOM 320 CA GLU A 22 2.008 21.857 -2.979 1.00 1.00 C ATOM 321 C GLU A 22 0.800 21.187 -2.337 1.00 1.00 C ATOM 322 O GLU A 22 -0.312 21.307 -2.821 1.00 1.00 O ATOM 323 CB GLU A 22 3.133 20.836 -3.182 1.00 1.00 C ATOM 324 CG GLU A 22 3.012 19.980 -4.428 1.00 1.00 C ATOM 325 CD GLU A 22 4.060 18.885 -4.450 1.00 1.00 C ATOM 326 OE1 GLU A 22 4.083 18.056 -3.520 1.00 1.00 O ATOM 327 OE2 GLU A 22 4.843 18.820 -5.425 1.00 1.00 O ATOM 0 H GLU A 22 3.493 22.862 -1.919 1.00 1.00 H new ATOM 0 HA GLU A 22 1.705 22.265 -3.943 1.00 1.00 H new ATOM 0 HB2 GLU A 22 4.083 21.369 -3.218 1.00 1.00 H new ATOM 0 HB3 GLU A 22 3.168 20.180 -2.312 1.00 1.00 H new ATOM 0 HG2 GLU A 22 2.018 19.535 -4.471 1.00 1.00 H new ATOM 0 HG3 GLU A 22 3.119 20.606 -5.314 1.00 1.00 H new ATOM 334 N LYS A 23 0.985 20.746 -1.109 1.00 1.00 N ATOM 335 CA LYS A 23 -0.065 20.006 -0.423 1.00 1.00 C ATOM 336 C LYS A 23 -1.064 20.952 0.213 1.00 1.00 C ATOM 337 O LYS A 23 -2.223 20.605 0.370 1.00 1.00 O ATOM 338 CB LYS A 23 0.513 19.085 0.645 1.00 1.00 C ATOM 339 CG LYS A 23 2.001 18.890 0.508 1.00 1.00 C ATOM 340 CD LYS A 23 2.382 17.444 0.303 1.00 1.00 C ATOM 341 CE LYS A 23 3.875 17.329 0.108 1.00 1.00 C ATOM 342 NZ LYS A 23 4.618 17.909 1.257 1.00 1.00 N ATOM 0 H LYS A 23 1.839 20.882 -0.568 1.00 1.00 H new ATOM 0 HA LYS A 23 -0.573 19.398 -1.171 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.295 19.497 1.630 1.00 1.00 H new ATOM 0 HB3 LYS A 23 0.018 18.116 0.588 1.00 1.00 H new ATOM 0 HG2 LYS A 23 2.365 19.480 -0.333 1.00 1.00 H new ATOM 0 HG3 LYS A 23 2.497 19.269 1.402 1.00 1.00 H new ATOM 0 HD2 LYS A 23 2.072 16.852 1.164 1.00 1.00 H new ATOM 0 HD3 LYS A 23 1.861 17.041 -0.565 1.00 1.00 H new ATOM 0 HE2 LYS A 23 4.148 16.281 -0.012 1.00 1.00 H new ATOM 0 HE3 LYS A 23 4.164 17.841 -0.810 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 5.464 17.335 1.448 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 4.904 18.883 1.030 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 4.007 17.915 2.098 1.00 1.00 H new ATOM 356 N MET A 24 -0.615 22.153 0.551 1.00 1.00 N ATOM 357 CA MET A 24 -1.470 23.133 1.207 1.00 1.00 C ATOM 358 C MET A 24 -2.679 23.518 0.355 1.00 1.00 C ATOM 359 O MET A 24 -3.800 23.034 0.567 1.00 1.00 O ATOM 360 CB MET A 24 -0.661 24.377 1.560 1.00 1.00 C ATOM 361 CG MET A 24 0.249 24.166 2.757 1.00 1.00 C ATOM 362 SD MET A 24 -0.352 24.971 4.253 1.00 1.00 S ATOM 363 CE MET A 24 0.080 26.676 3.912 1.00 1.00 C ATOM 0 H MET A 24 0.339 22.473 0.381 1.00 1.00 H new ATOM 0 HA MET A 24 -1.852 22.670 2.117 1.00 1.00 H new ATOM 0 HB2 MET A 24 -0.060 24.670 0.699 1.00 1.00 H new ATOM 0 HB3 MET A 24 -1.343 25.201 1.768 1.00 1.00 H new ATOM 0 HG2 MET A 24 0.352 23.097 2.943 1.00 1.00 H new ATOM 0 HG3 MET A 24 1.243 24.546 2.521 1.00 1.00 H new ATOM 0 HE1 MET A 24 0.248 27.204 4.851 1.00 1.00 H new ATOM 0 HE2 MET A 24 0.988 26.708 3.310 1.00 1.00 H new ATOM 0 HE3 MET A 24 -0.733 27.155 3.367 1.00 1.00 H new ATOM 373 N PHE A 25 -2.448 24.329 -0.659 1.00 1.00 N ATOM 374 CA PHE A 25 -3.550 24.835 -1.449 1.00 1.00 C ATOM 375 C PHE A 25 -4.037 23.808 -2.454 1.00 1.00 C ATOM 376 O PHE A 25 -5.208 23.827 -2.829 1.00 1.00 O ATOM 377 CB PHE A 25 -3.172 26.145 -2.136 1.00 1.00 C ATOM 378 CG PHE A 25 -2.292 26.007 -3.333 1.00 1.00 C ATOM 379 CD1 PHE A 25 -2.823 25.820 -4.602 1.00 1.00 C ATOM 380 CD2 PHE A 25 -0.932 26.106 -3.187 1.00 1.00 C ATOM 381 CE1 PHE A 25 -1.992 25.727 -5.698 1.00 1.00 C ATOM 382 CE2 PHE A 25 -0.105 26.028 -4.270 1.00 1.00 C ATOM 383 CZ PHE A 25 -0.633 25.837 -5.527 1.00 1.00 C ATOM 0 H PHE A 25 -1.524 24.647 -0.951 1.00 1.00 H new ATOM 0 HA PHE A 25 -4.377 25.037 -0.768 1.00 1.00 H new ATOM 0 HB2 PHE A 25 -4.087 26.656 -2.435 1.00 1.00 H new ATOM 0 HB3 PHE A 25 -2.672 26.786 -1.410 1.00 1.00 H new ATOM 0 HD1 PHE A 25 -3.893 25.747 -4.731 1.00 1.00 H new ATOM 0 HD2 PHE A 25 -0.510 26.247 -2.203 1.00 1.00 H new ATOM 0 HE1 PHE A 25 -2.406 25.569 -6.683 1.00 1.00 H new ATOM 0 HE2 PHE A 25 0.964 26.116 -4.141 1.00 1.00 H new ATOM 0 HZ PHE A 25 0.024 25.773 -6.382 1.00 1.00 H new ATOM 393 N ALA A 26 -3.160 22.922 -2.917 1.00 1.00 N ATOM 394 CA ALA A 26 -3.610 21.907 -3.868 1.00 1.00 C ATOM 395 C ALA A 26 -4.620 20.970 -3.219 1.00 1.00 C ATOM 396 O ALA A 26 -5.559 20.508 -3.872 1.00 1.00 O ATOM 397 CB ALA A 26 -2.462 21.132 -4.463 1.00 1.00 C ATOM 0 H ALA A 26 -2.173 22.882 -2.664 1.00 1.00 H new ATOM 0 HA ALA A 26 -4.099 22.431 -4.689 1.00 1.00 H new ATOM 0 HB1 ALA A 26 -2.847 20.390 -5.163 1.00 1.00 H new ATOM 0 HB2 ALA A 26 -1.796 21.815 -4.989 1.00 1.00 H new ATOM 0 HB3 ALA A 26 -1.912 20.629 -3.668 1.00 1.00 H new ATOM 403 N GLN A 27 -4.416 20.668 -1.931 1.00 1.00 N ATOM 404 CA GLN A 27 -5.363 19.843 -1.205 1.00 1.00 C ATOM 405 C GLN A 27 -6.696 20.578 -1.134 1.00 1.00 C ATOM 406 O GLN A 27 -7.761 19.973 -1.272 1.00 1.00 O ATOM 407 CB GLN A 27 -4.833 19.490 0.181 1.00 1.00 C ATOM 408 CG GLN A 27 -5.262 20.424 1.293 1.00 1.00 C ATOM 409 CD GLN A 27 -6.348 19.815 2.143 1.00 1.00 C ATOM 410 OE1 GLN A 27 -7.534 20.091 1.974 1.00 1.00 O ATOM 411 NE2 GLN A 27 -5.938 18.914 3.003 1.00 1.00 N ATOM 0 H GLN A 27 -3.613 20.981 -1.385 1.00 1.00 H new ATOM 0 HA GLN A 27 -5.508 18.898 -1.729 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -5.159 18.480 0.431 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -3.744 19.473 0.142 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -4.402 20.665 1.918 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -5.617 21.361 0.865 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -4.941 18.722 3.105 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -6.616 18.405 3.570 1.00 1.00 H new ATOM 420 N GLN A 28 -6.618 21.899 -0.946 1.00 1.00 N ATOM 421 CA GLN A 28 -7.801 22.748 -0.949 1.00 1.00 C ATOM 422 C GLN A 28 -8.534 22.639 -2.284 1.00 1.00 C ATOM 423 O GLN A 28 -9.753 22.496 -2.318 1.00 1.00 O ATOM 424 CB GLN A 28 -7.420 24.205 -0.696 1.00 1.00 C ATOM 425 CG GLN A 28 -6.748 24.448 0.646 1.00 1.00 C ATOM 426 CD GLN A 28 -6.338 25.896 0.823 1.00 1.00 C ATOM 427 OE1 GLN A 28 -6.932 26.796 0.225 1.00 1.00 O ATOM 428 NE2 GLN A 28 -5.332 26.135 1.648 1.00 1.00 N ATOM 0 H GLN A 28 -5.743 22.399 -0.790 1.00 1.00 H new ATOM 0 HA GLN A 28 -8.460 22.409 -0.149 1.00 1.00 H new ATOM 0 HB2 GLN A 28 -6.752 24.537 -1.490 1.00 1.00 H new ATOM 0 HB3 GLN A 28 -8.318 24.820 -0.757 1.00 1.00 H new ATOM 0 HG2 GLN A 28 -7.428 24.163 1.449 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -5.869 23.809 0.732 1.00 1.00 H new ATOM 0 HE21 GLN A 28 -4.867 25.361 2.123 1.00 1.00 H new ATOM 0 HE22 GLN A 28 -5.021 27.093 1.809 1.00 1.00 H new ATOM 437 N LEU A 29 -7.766 22.680 -3.376 1.00 1.00 N ATOM 438 CA LEU A 29 -8.323 22.602 -4.729 1.00 1.00 C ATOM 439 C LEU A 29 -9.199 21.366 -4.895 1.00 1.00 C ATOM 440 O LEU A 29 -10.368 21.462 -5.262 1.00 1.00 O ATOM 441 CB LEU A 29 -7.204 22.578 -5.771 1.00 1.00 C ATOM 442 CG LEU A 29 -6.283 23.795 -5.762 1.00 1.00 C ATOM 443 CD1 LEU A 29 -5.166 23.624 -6.776 1.00 1.00 C ATOM 444 CD2 LEU A 29 -7.067 25.066 -6.049 1.00 1.00 C ATOM 0 H LEU A 29 -6.750 22.767 -3.349 1.00 1.00 H new ATOM 0 HA LEU A 29 -8.939 23.489 -4.882 1.00 1.00 H new ATOM 0 HB2 LEU A 29 -6.601 21.684 -5.613 1.00 1.00 H new ATOM 0 HB3 LEU A 29 -7.652 22.489 -6.761 1.00 1.00 H new ATOM 0 HG LEU A 29 -5.842 23.880 -4.769 1.00 1.00 H new ATOM 0 HD11 LEU A 29 -4.519 24.501 -6.756 1.00 1.00 H new ATOM 0 HD12 LEU A 29 -4.583 22.737 -6.529 1.00 1.00 H new ATOM 0 HD13 LEU A 29 -5.593 23.511 -7.772 1.00 1.00 H new ATOM 0 HD21 LEU A 29 -6.391 25.921 -6.038 1.00 1.00 H new ATOM 0 HD22 LEU A 29 -7.539 24.989 -7.029 1.00 1.00 H new ATOM 0 HD23 LEU A 29 -7.834 25.200 -5.287 1.00 1.00 H new ATOM 456 N ARG A 30 -8.614 20.200 -4.696 1.00 1.00 N ATOM 457 CA ARG A 30 -9.371 18.961 -4.800 1.00 1.00 C ATOM 458 C ARG A 30 -10.533 18.938 -3.803 1.00 1.00 C ATOM 459 O ARG A 30 -11.598 18.411 -4.105 1.00 1.00 O ATOM 460 CB ARG A 30 -8.455 17.738 -4.649 1.00 1.00 C ATOM 461 CG ARG A 30 -7.544 17.784 -3.433 1.00 1.00 C ATOM 462 CD ARG A 30 -6.116 17.393 -3.788 1.00 1.00 C ATOM 463 NE ARG A 30 -6.008 15.990 -4.203 1.00 1.00 N ATOM 464 CZ ARG A 30 -4.853 15.326 -4.321 1.00 1.00 C ATOM 465 NH1 ARG A 30 -3.698 15.934 -4.069 1.00 1.00 N ATOM 466 NH2 ARG A 30 -4.853 14.055 -4.701 1.00 1.00 N ATOM 0 H ARG A 30 -7.628 20.082 -4.464 1.00 1.00 H new ATOM 0 HA ARG A 30 -9.806 18.913 -5.798 1.00 1.00 H new ATOM 0 HB2 ARG A 30 -9.072 16.841 -4.592 1.00 1.00 H new ATOM 0 HB3 ARG A 30 -7.841 17.646 -5.545 1.00 1.00 H new ATOM 0 HG2 ARG A 30 -7.552 18.788 -3.009 1.00 1.00 H new ATOM 0 HG3 ARG A 30 -7.926 17.111 -2.666 1.00 1.00 H new ATOM 0 HD2 ARG A 30 -5.755 18.036 -4.591 1.00 1.00 H new ATOM 0 HD3 ARG A 30 -5.470 17.565 -2.927 1.00 1.00 H new ATOM 0 HE ARG A 30 -6.870 15.488 -4.415 1.00 1.00 H new ATOM 0 HH11 ARG A 30 -3.689 16.913 -3.784 1.00 1.00 H new ATOM 0 HH12 ARG A 30 -2.821 15.421 -4.161 1.00 1.00 H new ATOM 0 HH21 ARG A 30 -5.734 13.583 -4.904 1.00 1.00 H new ATOM 0 HH22 ARG A 30 -3.972 13.550 -4.791 1.00 1.00 H new ATOM 480 N HIS A 31 -10.327 19.534 -2.628 1.00 1.00 N ATOM 481 CA HIS A 31 -11.384 19.634 -1.613 1.00 1.00 C ATOM 482 C HIS A 31 -12.584 20.448 -2.102 1.00 1.00 C ATOM 483 O HIS A 31 -13.715 20.210 -1.680 1.00 1.00 O ATOM 484 CB HIS A 31 -10.840 20.228 -0.312 1.00 1.00 C ATOM 485 CG HIS A 31 -10.432 19.190 0.683 1.00 1.00 C ATOM 486 ND1 HIS A 31 -10.763 19.253 2.017 1.00 1.00 N ATOM 487 CD2 HIS A 31 -9.726 18.048 0.528 1.00 1.00 C ATOM 488 CE1 HIS A 31 -10.283 18.194 2.636 1.00 1.00 C ATOM 489 NE2 HIS A 31 -9.649 17.442 1.757 1.00 1.00 N ATOM 0 H HIS A 31 -9.440 19.955 -2.353 1.00 1.00 H new ATOM 0 HA HIS A 31 -11.731 18.618 -1.422 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -9.982 20.861 -0.540 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -11.600 20.870 0.133 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -9.300 17.680 -0.394 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -10.391 17.977 3.689 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -9.180 16.558 1.957 1.00 1.00 H new ATOM 498 N ARG A 32 -12.341 21.395 -2.999 1.00 1.00 N ATOM 499 CA ARG A 32 -13.438 22.204 -3.518 1.00 1.00 C ATOM 500 C ARG A 32 -13.969 21.610 -4.813 1.00 1.00 C ATOM 501 O ARG A 32 -15.041 21.980 -5.296 1.00 1.00 O ATOM 502 CB ARG A 32 -13.022 23.660 -3.696 1.00 1.00 C ATOM 503 CG ARG A 32 -11.596 23.844 -4.168 1.00 1.00 C ATOM 504 CD ARG A 32 -11.133 25.271 -3.981 1.00 1.00 C ATOM 505 NE ARG A 32 -11.321 25.739 -2.606 1.00 1.00 N ATOM 506 CZ ARG A 32 -11.780 26.948 -2.286 1.00 1.00 C ATOM 507 NH1 ARG A 32 -12.026 27.842 -3.233 1.00 1.00 N ATOM 508 NH2 ARG A 32 -11.963 27.267 -1.012 1.00 1.00 N ATOM 0 H ARG A 32 -11.420 21.619 -3.375 1.00 1.00 H new ATOM 0 HA ARG A 32 -14.246 22.193 -2.786 1.00 1.00 H new ATOM 0 HB2 ARG A 32 -13.694 24.133 -4.412 1.00 1.00 H new ATOM 0 HB3 ARG A 32 -13.149 24.181 -2.747 1.00 1.00 H new ATOM 0 HG2 ARG A 32 -10.939 23.171 -3.617 1.00 1.00 H new ATOM 0 HG3 ARG A 32 -11.521 23.571 -5.221 1.00 1.00 H new ATOM 0 HD2 ARG A 32 -10.079 25.347 -4.248 1.00 1.00 H new ATOM 0 HD3 ARG A 32 -11.682 25.921 -4.662 1.00 1.00 H new ATOM 0 HE ARG A 32 -11.086 25.100 -1.847 1.00 1.00 H new ATOM 0 HH11 ARG A 32 -11.864 27.606 -4.212 1.00 1.00 H new ATOM 0 HH12 ARG A 32 -12.377 28.766 -2.983 1.00 1.00 H new ATOM 0 HH21 ARG A 32 -11.752 26.588 -0.281 1.00 1.00 H new ATOM 0 HH22 ARG A 32 -12.314 28.192 -0.763 1.00 1.00 H new ATOM 522 N GLY A 33 -13.181 20.724 -5.395 1.00 1.00 N ATOM 523 CA GLY A 33 -13.593 20.048 -6.604 1.00 1.00 C ATOM 524 C GLY A 33 -12.919 20.629 -7.817 1.00 1.00 C ATOM 525 O GLY A 33 -13.534 20.771 -8.873 1.00 1.00 O ATOM 0 H GLY A 33 -12.258 20.459 -5.050 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -13.356 18.987 -6.528 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -14.675 20.126 -6.715 1.00 1.00 H new ATOM 529 N LEU A 34 -11.648 20.978 -7.667 1.00 1.00 N ATOM 530 CA LEU A 34 -10.892 21.588 -8.745 1.00 1.00 C ATOM 531 C LEU A 34 -9.541 20.905 -8.887 1.00 1.00 C ATOM 532 O LEU A 34 -8.735 21.280 -9.731 1.00 1.00 O ATOM 533 CB LEU A 34 -10.684 23.071 -8.442 1.00 1.00 C ATOM 534 CG LEU A 34 -11.957 23.840 -8.091 1.00 1.00 C ATOM 535 CD1 LEU A 34 -11.617 25.213 -7.547 1.00 1.00 C ATOM 536 CD2 LEU A 34 -12.864 23.951 -9.305 1.00 1.00 C ATOM 0 H LEU A 34 -11.120 20.847 -6.804 1.00 1.00 H new ATOM 0 HA LEU A 34 -11.446 21.477 -9.677 1.00 1.00 H new ATOM 0 HB2 LEU A 34 -9.981 23.163 -7.614 1.00 1.00 H new ATOM 0 HB3 LEU A 34 -10.219 23.542 -9.308 1.00 1.00 H new ATOM 0 HG LEU A 34 -12.490 23.289 -7.316 1.00 1.00 H new ATOM 0 HD11 LEU A 34 -12.536 25.745 -7.303 1.00 1.00 H new ATOM 0 HD12 LEU A 34 -11.009 25.108 -6.649 1.00 1.00 H new ATOM 0 HD13 LEU A 34 -11.061 25.774 -8.298 1.00 1.00 H new ATOM 0 HD21 LEU A 34 -13.766 24.502 -9.036 1.00 1.00 H new ATOM 0 HD22 LEU A 34 -12.341 24.478 -10.103 1.00 1.00 H new ATOM 0 HD23 LEU A 34 -13.137 22.953 -9.648 1.00 1.00 H new ATOM 548 N GLY A 35 -9.305 19.888 -8.057 1.00 1.00 N ATOM 549 CA GLY A 35 -8.046 19.155 -8.105 1.00 1.00 C ATOM 550 C GLY A 35 -7.780 18.556 -9.471 1.00 1.00 C ATOM 551 O GLY A 35 -6.633 18.332 -9.850 1.00 1.00 O ATOM 0 H GLY A 35 -9.964 19.558 -7.351 1.00 1.00 H new ATOM 0 HA2 GLY A 35 -7.228 19.825 -7.839 1.00 1.00 H new ATOM 0 HA3 GLY A 35 -8.062 18.360 -7.359 1.00 1.00 H new ATOM 555 N ASP A 36 -8.854 18.276 -10.194 1.00 1.00 N ATOM 556 CA ASP A 36 -8.757 17.747 -11.545 1.00 1.00 C ATOM 557 C ASP A 36 -8.534 18.882 -12.531 1.00 1.00 C ATOM 558 O ASP A 36 -7.858 18.716 -13.544 1.00 1.00 O ATOM 559 CB ASP A 36 -10.054 17.029 -11.934 1.00 1.00 C ATOM 560 CG ASP A 36 -10.422 15.892 -11.005 1.00 1.00 C ATOM 561 OD1 ASP A 36 -11.083 16.160 -9.977 1.00 1.00 O ATOM 562 OD2 ASP A 36 -10.078 14.730 -11.309 1.00 1.00 O ATOM 0 H ASP A 36 -9.810 18.408 -9.864 1.00 1.00 H new ATOM 0 HA ASP A 36 -7.922 17.047 -11.574 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -10.869 17.753 -11.949 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -9.954 16.641 -12.948 1.00 1.00 H new ATOM 567 N ALA A 37 -9.086 20.041 -12.193 1.00 1.00 N ATOM 568 CA ALA A 37 -9.061 21.202 -13.076 1.00 1.00 C ATOM 569 C ALA A 37 -7.717 21.925 -13.045 1.00 1.00 C ATOM 570 O ALA A 37 -7.435 22.761 -13.908 1.00 1.00 O ATOM 571 CB ALA A 37 -10.187 22.162 -12.711 1.00 1.00 C ATOM 0 H ALA A 37 -9.561 20.203 -11.305 1.00 1.00 H new ATOM 0 HA ALA A 37 -9.207 20.840 -14.094 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -10.159 23.025 -13.376 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -11.146 21.654 -12.815 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -10.062 22.494 -11.680 1.00 1.00 H new ATOM 577 N VAL A 38 -6.904 21.663 -12.033 1.00 1.00 N ATOM 578 CA VAL A 38 -5.608 22.313 -11.936 1.00 1.00 C ATOM 579 C VAL A 38 -4.560 21.370 -11.366 1.00 1.00 C ATOM 580 O VAL A 38 -4.766 20.744 -10.329 1.00 1.00 O ATOM 581 CB VAL A 38 -5.689 23.613 -11.093 1.00 1.00 C ATOM 582 CG1 VAL A 38 -6.684 23.459 -9.960 1.00 1.00 C ATOM 583 CG2 VAL A 38 -4.324 24.009 -10.541 1.00 1.00 C ATOM 0 H VAL A 38 -7.116 21.013 -11.276 1.00 1.00 H new ATOM 0 HA VAL A 38 -5.305 22.586 -12.947 1.00 1.00 H new ATOM 0 HB VAL A 38 -6.030 24.409 -11.756 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -6.724 24.383 -9.383 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -7.671 23.244 -10.369 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -6.374 22.639 -9.312 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -4.420 24.924 -9.956 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -3.943 23.210 -9.905 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -3.632 24.177 -11.367 1.00 1.00 H new ATOM 593 N ARG A 39 -3.463 21.235 -12.093 1.00 1.00 N ATOM 594 CA ARG A 39 -2.373 20.379 -11.685 1.00 1.00 C ATOM 595 C ARG A 39 -1.398 21.197 -10.853 1.00 1.00 C ATOM 596 O ARG A 39 -0.994 22.290 -11.260 1.00 1.00 O ATOM 597 CB ARG A 39 -1.663 19.811 -12.922 1.00 1.00 C ATOM 598 CG ARG A 39 -2.603 19.225 -13.975 1.00 1.00 C ATOM 599 CD ARG A 39 -3.209 17.909 -13.530 1.00 1.00 C ATOM 600 NE ARG A 39 -3.280 16.955 -14.637 1.00 1.00 N ATOM 601 CZ ARG A 39 -3.956 15.810 -14.607 1.00 1.00 C ATOM 602 NH1 ARG A 39 -4.652 15.464 -13.530 1.00 1.00 N ATOM 603 NH2 ARG A 39 -3.928 15.010 -15.661 1.00 1.00 N ATOM 0 H ARG A 39 -3.308 21.716 -12.979 1.00 1.00 H new ATOM 0 HA ARG A 39 -2.755 19.547 -11.093 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -1.070 20.602 -13.381 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -0.967 19.036 -12.602 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -3.400 19.938 -14.185 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -2.056 19.075 -14.906 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -2.613 17.487 -12.721 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -4.209 18.083 -13.132 1.00 1.00 H new ATOM 0 HE ARG A 39 -2.775 17.184 -15.493 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -4.671 16.079 -12.716 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -5.167 14.584 -13.517 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -3.391 15.274 -16.487 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -4.443 14.130 -15.647 1.00 1.00 H new ATOM 617 N VAL A 40 -0.983 20.672 -9.717 1.00 1.00 N ATOM 618 CA VAL A 40 -0.062 21.390 -8.856 1.00 1.00 C ATOM 619 C VAL A 40 1.155 20.519 -8.586 1.00 1.00 C ATOM 620 O VAL A 40 1.040 19.378 -8.139 1.00 1.00 O ATOM 621 CB VAL A 40 -0.732 21.852 -7.538 1.00 1.00 C ATOM 622 CG1 VAL A 40 0.291 22.416 -6.570 1.00 1.00 C ATOM 623 CG2 VAL A 40 -1.803 22.885 -7.833 1.00 1.00 C ATOM 0 H VAL A 40 -1.267 19.756 -9.369 1.00 1.00 H new ATOM 0 HA VAL A 40 0.253 22.298 -9.370 1.00 1.00 H new ATOM 0 HB VAL A 40 -1.194 20.983 -7.069 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -0.210 22.732 -5.655 1.00 1.00 H new ATOM 0 HG12 VAL A 40 1.030 21.650 -6.334 1.00 1.00 H new ATOM 0 HG13 VAL A 40 0.789 23.272 -7.025 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -2.268 23.203 -6.900 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -1.352 23.746 -8.326 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -2.560 22.449 -8.485 1.00 1.00 H new ATOM 633 N THR A 41 2.299 21.035 -8.997 1.00 1.00 N ATOM 634 CA THR A 41 3.554 20.307 -8.932 1.00 1.00 C ATOM 635 C THR A 41 4.653 21.169 -8.330 1.00 1.00 C ATOM 636 O THR A 41 4.434 22.332 -8.007 1.00 1.00 O ATOM 637 CB THR A 41 3.983 19.871 -10.350 1.00 1.00 C ATOM 638 OG1 THR A 41 4.159 21.026 -11.184 1.00 1.00 O ATOM 639 CG2 THR A 41 2.939 18.964 -10.981 1.00 1.00 C ATOM 0 H THR A 41 2.385 21.974 -9.387 1.00 1.00 H new ATOM 0 HA THR A 41 3.402 19.432 -8.300 1.00 1.00 H new ATOM 0 HB THR A 41 4.922 19.324 -10.263 1.00 1.00 H new ATOM 0 HG1 THR A 41 4.432 20.743 -12.082 1.00 1.00 H new ATOM 0 HG21 THR A 41 3.266 18.672 -11.979 1.00 1.00 H new ATOM 0 HG22 THR A 41 2.811 18.073 -10.366 1.00 1.00 H new ATOM 0 HG23 THR A 41 1.990 19.496 -11.051 1.00 1.00 H new ATOM 647 N SER A 42 5.863 20.645 -8.312 1.00 1.00 N ATOM 648 CA SER A 42 6.993 21.372 -7.775 1.00 1.00 C ATOM 649 C SER A 42 8.284 20.801 -8.339 1.00 1.00 C ATOM 650 O SER A 42 8.284 19.708 -8.918 1.00 1.00 O ATOM 651 CB SER A 42 6.998 21.296 -6.246 1.00 1.00 C ATOM 652 OG SER A 42 7.121 19.961 -5.803 1.00 1.00 O ATOM 0 H SER A 42 6.088 19.715 -8.665 1.00 1.00 H new ATOM 0 HA SER A 42 6.912 22.420 -8.065 1.00 1.00 H new ATOM 0 HB2 SER A 42 7.822 21.890 -5.852 1.00 1.00 H new ATOM 0 HB3 SER A 42 6.077 21.729 -5.854 1.00 1.00 H new ATOM 0 HG SER A 42 6.229 19.581 -5.659 1.00 1.00 H new ATOM 658 N ALA A 43 9.372 21.554 -8.221 1.00 1.00 N ATOM 659 CA ALA A 43 10.649 21.124 -8.752 1.00 1.00 C ATOM 660 C ALA A 43 11.793 21.948 -8.190 1.00 1.00 C ATOM 661 O ALA A 43 11.582 22.973 -7.536 1.00 1.00 O ATOM 662 CB ALA A 43 10.651 21.217 -10.269 1.00 1.00 C ATOM 0 H ALA A 43 9.390 22.464 -7.761 1.00 1.00 H new ATOM 0 HA ALA A 43 10.795 20.087 -8.451 1.00 1.00 H new ATOM 0 HB1 ALA A 43 11.618 20.890 -10.652 1.00 1.00 H new ATOM 0 HB2 ALA A 43 9.866 20.579 -10.674 1.00 1.00 H new ATOM 0 HB3 ALA A 43 10.471 22.249 -10.571 1.00 1.00 H new ATOM 668 N GLY A 44 12.999 21.475 -8.441 1.00 1.00 N ATOM 669 CA GLY A 44 14.181 22.164 -7.997 1.00 1.00 C ATOM 670 C GLY A 44 15.146 22.391 -9.132 1.00 1.00 C ATOM 671 O GLY A 44 15.423 21.472 -9.904 1.00 1.00 O ATOM 0 H GLY A 44 13.179 20.611 -8.953 1.00 1.00 H new ATOM 0 HA2 GLY A 44 13.902 23.122 -7.558 1.00 1.00 H new ATOM 0 HA3 GLY A 44 14.669 21.584 -7.213 1.00 1.00 H new ATOM 675 N THR A 45 15.649 23.612 -9.246 1.00 1.00 N ATOM 676 CA THR A 45 16.563 23.969 -10.327 1.00 1.00 C ATOM 677 C THR A 45 17.919 23.283 -10.158 1.00 1.00 C ATOM 678 O THR A 45 18.649 23.084 -11.124 1.00 1.00 O ATOM 679 CB THR A 45 16.773 25.499 -10.385 1.00 1.00 C ATOM 680 OG1 THR A 45 17.120 25.993 -9.081 1.00 1.00 O ATOM 681 CG2 THR A 45 15.521 26.207 -10.879 1.00 1.00 C ATOM 0 H THR A 45 15.440 24.375 -8.602 1.00 1.00 H new ATOM 0 HA THR A 45 16.109 23.629 -11.258 1.00 1.00 H new ATOM 0 HB THR A 45 17.583 25.703 -11.085 1.00 1.00 H new ATOM 0 HG1 THR A 45 17.694 26.782 -9.172 1.00 1.00 H new ATOM 0 HG21 THR A 45 15.699 27.282 -10.909 1.00 1.00 H new ATOM 0 HG22 THR A 45 15.273 25.852 -11.879 1.00 1.00 H new ATOM 0 HG23 THR A 45 14.693 25.995 -10.203 1.00 1.00 H new ATOM 689 N GLY A 46 18.235 22.911 -8.921 1.00 1.00 N ATOM 690 CA GLY A 46 19.506 22.273 -8.638 1.00 1.00 C ATOM 691 C GLY A 46 19.342 20.831 -8.210 1.00 1.00 C ATOM 692 O GLY A 46 20.289 20.218 -7.724 1.00 1.00 O ATOM 0 H GLY A 46 17.632 23.041 -8.109 1.00 1.00 H new ATOM 0 HA2 GLY A 46 20.137 22.317 -9.525 1.00 1.00 H new ATOM 0 HA3 GLY A 46 20.021 22.826 -7.853 1.00 1.00 H new ATOM 696 N ASN A 47 18.110 20.323 -8.341 1.00 1.00 N ATOM 697 CA ASN A 47 17.755 18.927 -8.021 1.00 1.00 C ATOM 698 C ASN A 47 18.370 18.427 -6.704 1.00 1.00 C ATOM 699 O ASN A 47 18.665 17.238 -6.583 1.00 1.00 O ATOM 700 CB ASN A 47 18.131 17.984 -9.181 1.00 1.00 C ATOM 701 CG ASN A 47 19.623 17.893 -9.482 1.00 1.00 C ATOM 702 OD1 ASN A 47 20.145 18.613 -10.334 1.00 1.00 O ATOM 703 ND2 ASN A 47 20.315 17.003 -8.791 1.00 1.00 N ATOM 0 H ASN A 47 17.319 20.873 -8.676 1.00 1.00 H new ATOM 0 HA ASN A 47 16.674 18.916 -7.883 1.00 1.00 H new ATOM 0 HB2 ASN A 47 17.761 16.985 -8.951 1.00 1.00 H new ATOM 0 HB3 ASN A 47 17.614 18.316 -10.081 1.00 1.00 H new ATOM 0 HD21 ASN A 47 21.316 16.895 -8.956 1.00 1.00 H new ATOM 0 HD22 ASN A 47 19.848 16.424 -8.093 1.00 1.00 H new ATOM 710 N TRP A 48 18.406 19.300 -5.687 1.00 1.00 N ATOM 711 CA TRP A 48 18.991 18.975 -4.376 1.00 1.00 C ATOM 712 C TRP A 48 18.602 17.581 -3.896 1.00 1.00 C ATOM 713 O TRP A 48 19.430 16.676 -3.826 1.00 1.00 O ATOM 714 CB TRP A 48 18.572 20.025 -3.324 1.00 1.00 C ATOM 715 CG TRP A 48 19.685 20.955 -2.936 1.00 1.00 C ATOM 716 CD1 TRP A 48 20.319 21.007 -1.730 1.00 1.00 C ATOM 717 CD2 TRP A 48 20.301 21.956 -3.758 1.00 1.00 C ATOM 718 NE1 TRP A 48 21.286 21.981 -1.748 1.00 1.00 N ATOM 719 CE2 TRP A 48 21.296 22.576 -2.981 1.00 1.00 C ATOM 720 CE3 TRP A 48 20.110 22.386 -5.071 1.00 1.00 C ATOM 721 CZ2 TRP A 48 22.092 23.606 -3.472 1.00 1.00 C ATOM 722 CZ3 TRP A 48 20.901 23.407 -5.560 1.00 1.00 C ATOM 723 CH2 TRP A 48 21.884 24.006 -4.762 1.00 1.00 C ATOM 0 H TRP A 48 18.033 20.247 -5.748 1.00 1.00 H new ATOM 0 HA TRP A 48 20.074 18.991 -4.499 1.00 1.00 H new ATOM 0 HB2 TRP A 48 17.740 20.610 -3.716 1.00 1.00 H new ATOM 0 HB3 TRP A 48 18.210 19.512 -2.433 1.00 1.00 H new ATOM 0 HD1 TRP A 48 20.093 20.374 -0.884 1.00 1.00 H new ATOM 0 HE1 TRP A 48 21.898 22.222 -0.969 1.00 1.00 H new ATOM 0 HE3 TRP A 48 19.356 21.928 -5.695 1.00 1.00 H new ATOM 0 HZ2 TRP A 48 22.847 24.072 -2.856 1.00 1.00 H new ATOM 0 HZ3 TRP A 48 20.759 23.749 -6.574 1.00 1.00 H new ATOM 0 HH2 TRP A 48 22.489 24.800 -5.174 1.00 1.00 H new ATOM 734 N HIS A 49 17.358 17.451 -3.503 1.00 1.00 N ATOM 735 CA HIS A 49 16.847 16.169 -3.049 1.00 1.00 C ATOM 736 C HIS A 49 15.822 15.616 -4.012 1.00 1.00 C ATOM 737 O HIS A 49 14.777 15.120 -3.606 1.00 1.00 O ATOM 738 CB HIS A 49 16.287 16.266 -1.633 1.00 1.00 C ATOM 739 CG HIS A 49 17.364 16.306 -0.592 1.00 1.00 C ATOM 740 ND1 HIS A 49 17.914 15.170 -0.046 1.00 1.00 N ATOM 741 CD2 HIS A 49 18.017 17.346 -0.021 1.00 1.00 C ATOM 742 CE1 HIS A 49 18.857 15.507 0.812 1.00 1.00 C ATOM 743 NE2 HIS A 49 18.947 16.823 0.848 1.00 1.00 N ATOM 0 H HIS A 49 16.678 18.211 -3.486 1.00 1.00 H new ATOM 0 HA HIS A 49 17.683 15.470 -3.023 1.00 1.00 H new ATOM 0 HB2 HIS A 49 15.672 17.162 -1.550 1.00 1.00 H new ATOM 0 HB3 HIS A 49 15.635 15.413 -1.444 1.00 1.00 H new ATOM 0 HD2 HIS A 49 17.840 18.394 -0.213 1.00 1.00 H new ATOM 0 HE1 HIS A 49 19.457 14.819 1.390 1.00 1.00 H new ATOM 0 HE2 HIS A 49 19.596 17.361 1.422 1.00 1.00 H new ATOM 752 N VAL A 50 16.148 15.677 -5.290 1.00 1.00 N ATOM 753 CA VAL A 50 15.275 15.132 -6.322 1.00 1.00 C ATOM 754 C VAL A 50 15.100 13.624 -6.122 1.00 1.00 C ATOM 755 O VAL A 50 16.071 12.893 -5.923 1.00 1.00 O ATOM 756 CB VAL A 50 15.816 15.422 -7.743 1.00 1.00 C ATOM 757 CG1 VAL A 50 17.171 14.775 -7.960 1.00 1.00 C ATOM 758 CG2 VAL A 50 14.841 14.958 -8.810 1.00 1.00 C ATOM 0 H VAL A 50 17.009 16.097 -5.641 1.00 1.00 H new ATOM 0 HA VAL A 50 14.307 15.624 -6.230 1.00 1.00 H new ATOM 0 HB VAL A 50 15.932 16.503 -7.828 1.00 1.00 H new ATOM 0 HG11 VAL A 50 17.523 14.997 -8.967 1.00 1.00 H new ATOM 0 HG12 VAL A 50 17.882 15.166 -7.232 1.00 1.00 H new ATOM 0 HG13 VAL A 50 17.083 13.696 -7.837 1.00 1.00 H new ATOM 0 HG21 VAL A 50 15.250 15.176 -9.796 1.00 1.00 H new ATOM 0 HG22 VAL A 50 14.680 13.884 -8.713 1.00 1.00 H new ATOM 0 HG23 VAL A 50 13.892 15.480 -8.687 1.00 1.00 H new ATOM 768 N GLY A 51 13.855 13.179 -6.127 1.00 1.00 N ATOM 769 CA GLY A 51 13.565 11.777 -5.901 1.00 1.00 C ATOM 770 C GLY A 51 13.272 11.484 -4.445 1.00 1.00 C ATOM 771 O GLY A 51 12.749 10.422 -4.110 1.00 1.00 O ATOM 0 H GLY A 51 13.035 13.765 -6.284 1.00 1.00 H new ATOM 0 HA2 GLY A 51 12.710 11.481 -6.509 1.00 1.00 H new ATOM 0 HA3 GLY A 51 14.412 11.175 -6.228 1.00 1.00 H new ATOM 775 N SER A 52 13.623 12.425 -3.584 1.00 1.00 N ATOM 776 CA SER A 52 13.385 12.278 -2.162 1.00 1.00 C ATOM 777 C SER A 52 11.935 12.611 -1.842 1.00 1.00 C ATOM 778 O SER A 52 11.089 12.725 -2.735 1.00 1.00 O ATOM 779 CB SER A 52 14.319 13.183 -1.365 1.00 1.00 C ATOM 780 OG SER A 52 14.520 12.690 -0.052 1.00 1.00 O ATOM 0 H SER A 52 14.075 13.300 -3.848 1.00 1.00 H new ATOM 0 HA SER A 52 13.585 11.244 -1.881 1.00 1.00 H new ATOM 0 HB2 SER A 52 15.278 13.260 -1.877 1.00 1.00 H new ATOM 0 HB3 SER A 52 13.901 14.189 -1.318 1.00 1.00 H new ATOM 0 HG SER A 52 15.124 13.290 0.434 1.00 1.00 H new ATOM 786 N CYS A 53 11.688 12.891 -0.581 1.00 1.00 N ATOM 787 CA CYS A 53 10.365 13.212 -0.112 1.00 1.00 C ATOM 788 C CYS A 53 10.420 14.515 0.662 1.00 1.00 C ATOM 789 O CYS A 53 11.501 15.056 0.887 1.00 1.00 O ATOM 790 CB CYS A 53 9.850 12.076 0.770 1.00 1.00 C ATOM 791 SG CYS A 53 8.108 12.208 1.240 1.00 1.00 S ATOM 0 H CYS A 53 12.403 12.902 0.147 1.00 1.00 H new ATOM 0 HA CYS A 53 9.683 13.331 -0.954 1.00 1.00 H new ATOM 0 HB2 CYS A 53 10.000 11.132 0.246 1.00 1.00 H new ATOM 0 HB3 CYS A 53 10.454 12.037 1.676 1.00 1.00 H new ATOM 0 HG CYS A 53 7.393 12.468 0.186 1.00 1.00 H new ATOM 797 N ALA A 54 9.255 15.049 0.997 1.00 1.00 N ATOM 798 CA ALA A 54 9.170 16.317 1.721 1.00 1.00 C ATOM 799 C ALA A 54 10.036 16.300 2.979 1.00 1.00 C ATOM 800 O ALA A 54 10.045 15.318 3.723 1.00 1.00 O ATOM 801 CB ALA A 54 7.724 16.631 2.072 1.00 1.00 C ATOM 0 H ALA A 54 8.352 14.627 0.781 1.00 1.00 H new ATOM 0 HA ALA A 54 9.551 17.102 1.067 1.00 1.00 H new ATOM 0 HB1 ALA A 54 7.678 17.578 2.610 1.00 1.00 H new ATOM 0 HB2 ALA A 54 7.135 16.704 1.158 1.00 1.00 H new ATOM 0 HB3 ALA A 54 7.321 15.836 2.700 1.00 1.00 H new ATOM 807 N ASP A 55 10.755 17.396 3.190 1.00 1.00 N ATOM 808 CA ASP A 55 11.671 17.553 4.313 1.00 1.00 C ATOM 809 C ASP A 55 10.956 17.360 5.640 1.00 1.00 C ATOM 810 O ASP A 55 9.807 17.779 5.809 1.00 1.00 O ATOM 811 CB ASP A 55 12.312 18.944 4.270 1.00 1.00 C ATOM 812 CG ASP A 55 13.416 19.113 5.294 1.00 1.00 C ATOM 813 OD1 ASP A 55 13.101 19.264 6.490 1.00 1.00 O ATOM 814 OD2 ASP A 55 14.598 19.104 4.905 1.00 1.00 O ATOM 0 H ASP A 55 10.718 18.211 2.578 1.00 1.00 H new ATOM 0 HA ASP A 55 12.444 16.789 4.228 1.00 1.00 H new ATOM 0 HB2 ASP A 55 12.716 19.122 3.274 1.00 1.00 H new ATOM 0 HB3 ASP A 55 11.544 19.698 4.442 1.00 1.00 H new ATOM 819 N GLU A 56 11.644 16.690 6.555 1.00 1.00 N ATOM 820 CA GLU A 56 11.136 16.396 7.890 1.00 1.00 C ATOM 821 C GLU A 56 10.479 17.597 8.571 1.00 1.00 C ATOM 822 O GLU A 56 9.451 17.439 9.234 1.00 1.00 O ATOM 823 CB GLU A 56 12.277 15.872 8.760 1.00 1.00 C ATOM 824 CG GLU A 56 13.528 16.736 8.700 1.00 1.00 C ATOM 825 CD GLU A 56 14.648 16.200 9.561 1.00 1.00 C ATOM 826 OE1 GLU A 56 15.351 15.263 9.121 1.00 1.00 O ATOM 827 OE2 GLU A 56 14.833 16.713 10.683 1.00 1.00 O ATOM 0 H GLU A 56 12.584 16.330 6.389 1.00 1.00 H new ATOM 0 HA GLU A 56 10.357 15.642 7.774 1.00 1.00 H new ATOM 0 HB2 GLU A 56 11.937 15.809 9.794 1.00 1.00 H new ATOM 0 HB3 GLU A 56 12.528 14.859 8.445 1.00 1.00 H new ATOM 0 HG2 GLU A 56 13.869 16.803 7.667 1.00 1.00 H new ATOM 0 HG3 GLU A 56 13.281 17.748 9.020 1.00 1.00 H new ATOM 834 N ARG A 57 11.026 18.798 8.388 1.00 1.00 N ATOM 835 CA ARG A 57 10.479 19.966 9.053 1.00 1.00 C ATOM 836 C ARG A 57 9.118 20.340 8.467 1.00 1.00 C ATOM 837 O ARG A 57 8.156 20.541 9.206 1.00 1.00 O ATOM 838 CB ARG A 57 11.451 21.146 8.949 1.00 1.00 C ATOM 839 CG ARG A 57 11.731 21.604 7.524 1.00 1.00 C ATOM 840 CD ARG A 57 12.746 22.729 7.487 1.00 1.00 C ATOM 841 NE ARG A 57 14.052 22.297 7.967 1.00 1.00 N ATOM 842 CZ ARG A 57 14.858 23.037 8.728 1.00 1.00 C ATOM 843 NH1 ARG A 57 14.513 24.276 9.085 1.00 1.00 N ATOM 844 NH2 ARG A 57 16.014 22.529 9.132 1.00 1.00 N ATOM 0 H ARG A 57 11.834 18.981 7.794 1.00 1.00 H new ATOM 0 HA ARG A 57 10.339 19.723 10.106 1.00 1.00 H new ATOM 0 HB2 ARG A 57 11.047 21.985 9.515 1.00 1.00 H new ATOM 0 HB3 ARG A 57 12.394 20.868 9.421 1.00 1.00 H new ATOM 0 HG2 ARG A 57 12.099 20.763 6.937 1.00 1.00 H new ATOM 0 HG3 ARG A 57 10.803 21.936 7.059 1.00 1.00 H new ATOM 0 HD2 ARG A 57 12.839 23.101 6.467 1.00 1.00 H new ATOM 0 HD3 ARG A 57 12.391 23.559 8.098 1.00 1.00 H new ATOM 0 HE ARG A 57 14.371 21.365 7.703 1.00 1.00 H new ATOM 0 HH11 ARG A 57 13.623 24.667 8.775 1.00 1.00 H new ATOM 0 HH12 ARG A 57 15.139 24.832 9.668 1.00 1.00 H new ATOM 0 HH21 ARG A 57 16.278 21.582 8.860 1.00 1.00 H new ATOM 0 HH22 ARG A 57 16.640 23.085 9.715 1.00 1.00 H new ATOM 858 N ALA A 58 9.023 20.326 7.140 1.00 1.00 N ATOM 859 CA ALA A 58 7.792 20.697 6.450 1.00 1.00 C ATOM 860 C ALA A 58 6.732 19.626 6.646 1.00 1.00 C ATOM 861 O ALA A 58 5.535 19.914 6.668 1.00 1.00 O ATOM 862 CB ALA A 58 8.070 20.924 4.969 1.00 1.00 C ATOM 0 H ALA A 58 9.788 20.060 6.519 1.00 1.00 H new ATOM 0 HA ALA A 58 7.415 21.627 6.875 1.00 1.00 H new ATOM 0 HB1 ALA A 58 7.145 21.200 4.463 1.00 1.00 H new ATOM 0 HB2 ALA A 58 8.800 21.726 4.854 1.00 1.00 H new ATOM 0 HB3 ALA A 58 8.465 20.009 4.528 1.00 1.00 H new ATOM 868 N ALA A 59 7.184 18.387 6.781 1.00 1.00 N ATOM 869 CA ALA A 59 6.285 17.276 7.031 1.00 1.00 C ATOM 870 C ALA A 59 5.582 17.464 8.363 1.00 1.00 C ATOM 871 O ALA A 59 4.363 17.315 8.456 1.00 1.00 O ATOM 872 CB ALA A 59 7.038 15.952 6.994 1.00 1.00 C ATOM 0 H ALA A 59 8.169 18.129 6.721 1.00 1.00 H new ATOM 0 HA ALA A 59 5.532 17.252 6.243 1.00 1.00 H new ATOM 0 HB1 ALA A 59 6.344 15.133 7.184 1.00 1.00 H new ATOM 0 HB2 ALA A 59 7.495 15.820 6.013 1.00 1.00 H new ATOM 0 HB3 ALA A 59 7.815 15.954 7.758 1.00 1.00 H new ATOM 878 N GLY A 60 6.352 17.829 9.381 1.00 1.00 N ATOM 879 CA GLY A 60 5.787 18.082 10.686 1.00 1.00 C ATOM 880 C GLY A 60 4.825 19.247 10.664 1.00 1.00 C ATOM 881 O GLY A 60 3.808 19.230 11.348 1.00 1.00 O ATOM 0 H GLY A 60 7.363 17.954 9.322 1.00 1.00 H new ATOM 0 HA2 GLY A 60 5.269 17.189 11.037 1.00 1.00 H new ATOM 0 HA3 GLY A 60 6.589 18.286 11.396 1.00 1.00 H new ATOM 885 N VAL A 61 5.157 20.252 9.868 1.00 1.00 N ATOM 886 CA VAL A 61 4.314 21.429 9.707 1.00 1.00 C ATOM 887 C VAL A 61 2.956 21.049 9.118 1.00 1.00 C ATOM 888 O VAL A 61 1.909 21.256 9.738 1.00 1.00 O ATOM 889 CB VAL A 61 4.991 22.464 8.785 1.00 1.00 C ATOM 890 CG1 VAL A 61 4.099 23.661 8.557 1.00 1.00 C ATOM 891 CG2 VAL A 61 6.320 22.897 9.361 1.00 1.00 C ATOM 0 H VAL A 61 6.015 20.276 9.317 1.00 1.00 H new ATOM 0 HA VAL A 61 4.168 21.866 10.695 1.00 1.00 H new ATOM 0 HB VAL A 61 5.166 21.988 7.820 1.00 1.00 H new ATOM 0 HG11 VAL A 61 4.604 24.372 7.903 1.00 1.00 H new ATOM 0 HG12 VAL A 61 3.168 23.338 8.091 1.00 1.00 H new ATOM 0 HG13 VAL A 61 3.880 24.138 9.512 1.00 1.00 H new ATOM 0 HG21 VAL A 61 6.784 23.627 8.698 1.00 1.00 H new ATOM 0 HG22 VAL A 61 6.163 23.346 10.342 1.00 1.00 H new ATOM 0 HG23 VAL A 61 6.974 22.030 9.460 1.00 1.00 H new ATOM 901 N LEU A 62 2.986 20.454 7.936 1.00 1.00 N ATOM 902 CA LEU A 62 1.768 20.095 7.231 1.00 1.00 C ATOM 903 C LEU A 62 0.920 19.122 8.046 1.00 1.00 C ATOM 904 O LEU A 62 -0.256 19.382 8.299 1.00 1.00 O ATOM 905 CB LEU A 62 2.126 19.507 5.867 1.00 1.00 C ATOM 906 CG LEU A 62 2.867 20.471 4.938 1.00 1.00 C ATOM 907 CD1 LEU A 62 3.257 19.785 3.643 1.00 1.00 C ATOM 908 CD2 LEU A 62 2.010 21.694 4.659 1.00 1.00 C ATOM 0 H LEU A 62 3.845 20.209 7.444 1.00 1.00 H new ATOM 0 HA LEU A 62 1.168 20.993 7.084 1.00 1.00 H new ATOM 0 HB2 LEU A 62 2.742 18.621 6.017 1.00 1.00 H new ATOM 0 HB3 LEU A 62 1.211 19.179 5.375 1.00 1.00 H new ATOM 0 HG LEU A 62 3.782 20.792 5.436 1.00 1.00 H new ATOM 0 HD11 LEU A 62 3.782 20.492 3.001 1.00 1.00 H new ATOM 0 HD12 LEU A 62 3.909 18.939 3.861 1.00 1.00 H new ATOM 0 HD13 LEU A 62 2.360 19.430 3.135 1.00 1.00 H new ATOM 0 HD21 LEU A 62 2.548 22.372 3.997 1.00 1.00 H new ATOM 0 HD22 LEU A 62 1.079 21.385 4.183 1.00 1.00 H new ATOM 0 HD23 LEU A 62 1.787 22.203 5.596 1.00 1.00 H new ATOM 920 N ARG A 63 1.545 18.053 8.530 1.00 1.00 N ATOM 921 CA ARG A 63 0.841 17.049 9.326 1.00 1.00 C ATOM 922 C ARG A 63 0.227 17.674 10.582 1.00 1.00 C ATOM 923 O ARG A 63 -0.824 17.236 11.047 1.00 1.00 O ATOM 924 CB ARG A 63 1.786 15.901 9.721 1.00 1.00 C ATOM 925 CG ARG A 63 2.703 16.231 10.894 1.00 1.00 C ATOM 926 CD ARG A 63 3.612 15.065 11.259 1.00 1.00 C ATOM 927 NE ARG A 63 2.888 13.993 11.946 1.00 1.00 N ATOM 928 CZ ARG A 63 3.344 13.359 13.030 1.00 1.00 C ATOM 929 NH1 ARG A 63 4.533 13.665 13.538 1.00 1.00 N ATOM 930 NH2 ARG A 63 2.609 12.411 13.602 1.00 1.00 N ATOM 0 H ARG A 63 2.536 17.858 8.386 1.00 1.00 H new ATOM 0 HA ARG A 63 0.037 16.646 8.710 1.00 1.00 H new ATOM 0 HB2 ARG A 63 1.190 15.024 9.974 1.00 1.00 H new ATOM 0 HB3 ARG A 63 2.397 15.634 8.859 1.00 1.00 H new ATOM 0 HG2 ARG A 63 3.312 17.100 10.644 1.00 1.00 H new ATOM 0 HG3 ARG A 63 2.099 16.504 11.760 1.00 1.00 H new ATOM 0 HD2 ARG A 63 4.072 14.668 10.354 1.00 1.00 H new ATOM 0 HD3 ARG A 63 4.420 15.422 11.897 1.00 1.00 H new ATOM 0 HE ARG A 63 1.980 13.713 11.574 1.00 1.00 H new ATOM 0 HH11 ARG A 63 5.104 14.388 13.100 1.00 1.00 H new ATOM 0 HH12 ARG A 63 4.875 13.177 14.366 1.00 1.00 H new ATOM 0 HH21 ARG A 63 1.698 12.168 13.213 1.00 1.00 H new ATOM 0 HH22 ARG A 63 2.956 11.926 14.430 1.00 1.00 H new ATOM 944 N ALA A 64 0.868 18.719 11.106 1.00 1.00 N ATOM 945 CA ALA A 64 0.385 19.380 12.314 1.00 1.00 C ATOM 946 C ALA A 64 -0.929 20.109 12.054 1.00 1.00 C ATOM 947 O ALA A 64 -1.794 20.192 12.926 1.00 1.00 O ATOM 948 CB ALA A 64 1.418 20.364 12.847 1.00 1.00 C ATOM 0 H ALA A 64 1.719 19.123 10.714 1.00 1.00 H new ATOM 0 HA ALA A 64 0.215 18.606 13.062 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.033 20.843 13.747 1.00 1.00 H new ATOM 0 HB2 ALA A 64 2.339 19.832 13.084 1.00 1.00 H new ATOM 0 HB3 ALA A 64 1.622 21.123 12.091 1.00 1.00 H new ATOM 954 N HIS A 65 -1.074 20.625 10.841 1.00 1.00 N ATOM 955 CA HIS A 65 -2.270 21.376 10.470 1.00 1.00 C ATOM 956 C HIS A 65 -3.273 20.496 9.721 1.00 1.00 C ATOM 957 O HIS A 65 -4.312 20.968 9.257 1.00 1.00 O ATOM 958 CB HIS A 65 -1.878 22.607 9.646 1.00 1.00 C ATOM 959 CG HIS A 65 -1.000 23.563 10.404 1.00 1.00 C ATOM 960 ND1 HIS A 65 -1.491 24.522 11.263 1.00 1.00 N ATOM 961 CD2 HIS A 65 0.349 23.683 10.450 1.00 1.00 C ATOM 962 CE1 HIS A 65 -0.484 25.184 11.804 1.00 1.00 C ATOM 963 NE2 HIS A 65 0.643 24.696 11.328 1.00 1.00 N ATOM 0 H HIS A 65 -0.381 20.539 10.097 1.00 1.00 H new ATOM 0 HA HIS A 65 -2.764 21.713 11.381 1.00 1.00 H new ATOM 0 HB2 HIS A 65 -1.360 22.284 8.743 1.00 1.00 H new ATOM 0 HB3 HIS A 65 -2.781 23.127 9.326 1.00 1.00 H new ATOM 0 HD2 HIS A 65 1.062 23.090 9.897 1.00 1.00 H new ATOM 0 HE1 HIS A 65 -0.570 25.990 12.517 1.00 1.00 H new ATOM 0 HE2 HIS A 65 1.580 25.018 11.572 1.00 1.00 H new ATOM 972 N GLY A 66 -2.963 19.208 9.628 1.00 1.00 N ATOM 973 CA GLY A 66 -3.868 18.267 8.991 1.00 1.00 C ATOM 974 C GLY A 66 -3.640 18.151 7.496 1.00 1.00 C ATOM 975 O GLY A 66 -4.460 17.579 6.776 1.00 1.00 O ATOM 0 H GLY A 66 -2.100 18.797 9.983 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -3.746 17.286 9.450 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -4.896 18.579 9.174 1.00 1.00 H new ATOM 979 N TYR A 67 -2.516 18.678 7.035 1.00 1.00 N ATOM 980 CA TYR A 67 -2.177 18.641 5.621 1.00 1.00 C ATOM 981 C TYR A 67 -1.366 17.399 5.289 1.00 1.00 C ATOM 982 O TYR A 67 -0.627 16.891 6.131 1.00 1.00 O ATOM 983 CB TYR A 67 -1.396 19.894 5.218 1.00 1.00 C ATOM 984 CG TYR A 67 -2.248 21.140 5.134 1.00 1.00 C ATOM 985 CD1 TYR A 67 -3.129 21.332 4.075 1.00 1.00 C ATOM 986 CD2 TYR A 67 -2.176 22.121 6.114 1.00 1.00 C ATOM 987 CE1 TYR A 67 -3.913 22.466 3.996 1.00 1.00 C ATOM 988 CE2 TYR A 67 -2.959 23.257 6.043 1.00 1.00 C ATOM 989 CZ TYR A 67 -3.824 23.424 4.982 1.00 1.00 C ATOM 990 OH TYR A 67 -4.605 24.554 4.909 1.00 1.00 O ATOM 0 H TYR A 67 -1.821 19.138 7.622 1.00 1.00 H new ATOM 0 HA TYR A 67 -3.109 18.610 5.057 1.00 1.00 H new ATOM 0 HB2 TYR A 67 -0.595 20.060 5.939 1.00 1.00 H new ATOM 0 HB3 TYR A 67 -0.924 19.722 4.251 1.00 1.00 H new ATOM 0 HD1 TYR A 67 -3.201 20.582 3.302 1.00 1.00 H new ATOM 0 HD2 TYR A 67 -1.497 21.994 6.945 1.00 1.00 H new ATOM 0 HE1 TYR A 67 -4.592 22.601 3.167 1.00 1.00 H new ATOM 0 HE2 TYR A 67 -2.894 24.010 6.814 1.00 1.00 H new ATOM 0 HH TYR A 67 -4.423 25.128 5.682 1.00 1.00 H new ATOM 1000 N PRO A 68 -1.511 16.881 4.062 1.00 1.00 N ATOM 1001 CA PRO A 68 -0.737 15.732 3.606 1.00 1.00 C ATOM 1002 C PRO A 68 0.716 16.105 3.411 1.00 1.00 C ATOM 1003 O PRO A 68 1.049 17.278 3.232 1.00 1.00 O ATOM 1004 CB PRO A 68 -1.379 15.366 2.269 1.00 1.00 C ATOM 1005 CG PRO A 68 -2.003 16.631 1.791 1.00 1.00 C ATOM 1006 CD PRO A 68 -2.435 17.369 3.024 1.00 1.00 C ATOM 0 HA PRO A 68 -0.747 14.910 4.321 1.00 1.00 H new ATOM 0 HB2 PRO A 68 -0.637 14.998 1.561 1.00 1.00 H new ATOM 0 HB3 PRO A 68 -2.123 14.578 2.389 1.00 1.00 H new ATOM 0 HG2 PRO A 68 -1.294 17.221 1.211 1.00 1.00 H new ATOM 0 HG3 PRO A 68 -2.853 16.426 1.141 1.00 1.00 H new ATOM 0 HD2 PRO A 68 -2.357 18.448 2.893 1.00 1.00 H new ATOM 0 HD3 PRO A 68 -3.473 17.153 3.278 1.00 1.00 H new ATOM 1014 N THR A 69 1.588 15.122 3.439 1.00 1.00 N ATOM 1015 CA THR A 69 3.000 15.395 3.303 1.00 1.00 C ATOM 1016 C THR A 69 3.631 14.476 2.266 1.00 1.00 C ATOM 1017 O THR A 69 4.837 14.535 2.023 1.00 1.00 O ATOM 1018 CB THR A 69 3.717 15.240 4.659 1.00 1.00 C ATOM 1019 OG1 THR A 69 3.667 13.873 5.091 1.00 1.00 O ATOM 1020 CG2 THR A 69 3.062 16.118 5.712 1.00 1.00 C ATOM 0 H THR A 69 1.348 14.137 3.553 1.00 1.00 H new ATOM 0 HA THR A 69 3.113 16.425 2.965 1.00 1.00 H new ATOM 0 HB THR A 69 4.755 15.546 4.531 1.00 1.00 H new ATOM 0 HG1 THR A 69 4.127 13.785 5.952 1.00 1.00 H new ATOM 0 HG21 THR A 69 3.581 15.995 6.662 1.00 1.00 H new ATOM 0 HG22 THR A 69 3.116 17.161 5.401 1.00 1.00 H new ATOM 0 HG23 THR A 69 2.018 15.828 5.829 1.00 1.00 H new ATOM 1028 N ASP A 70 2.779 13.748 1.555 1.00 1.00 N ATOM 1029 CA ASP A 70 3.230 12.803 0.538 1.00 1.00 C ATOM 1030 C ASP A 70 3.714 13.565 -0.685 1.00 1.00 C ATOM 1031 O ASP A 70 2.988 14.401 -1.229 1.00 1.00 O ATOM 1032 CB ASP A 70 2.095 11.844 0.161 1.00 1.00 C ATOM 1033 CG ASP A 70 2.541 10.739 -0.779 1.00 1.00 C ATOM 1034 OD1 ASP A 70 2.978 9.673 -0.286 1.00 1.00 O ATOM 1035 OD2 ASP A 70 2.445 10.922 -2.011 1.00 1.00 O ATOM 0 H ASP A 70 1.766 13.794 1.664 1.00 1.00 H new ATOM 0 HA ASP A 70 4.055 12.213 0.937 1.00 1.00 H new ATOM 0 HB2 ASP A 70 1.686 11.399 1.068 1.00 1.00 H new ATOM 0 HB3 ASP A 70 1.289 12.409 -0.308 1.00 1.00 H new ATOM 1040 N HIS A 71 4.954 13.315 -1.077 1.00 1.00 N ATOM 1041 CA HIS A 71 5.574 14.047 -2.171 1.00 1.00 C ATOM 1042 C HIS A 71 6.843 13.353 -2.640 1.00 1.00 C ATOM 1043 O HIS A 71 7.508 12.672 -1.866 1.00 1.00 O ATOM 1044 CB HIS A 71 5.881 15.479 -1.691 1.00 1.00 C ATOM 1045 CG HIS A 71 6.875 16.253 -2.510 1.00 1.00 C ATOM 1046 ND1 HIS A 71 6.530 17.051 -3.573 1.00 1.00 N ATOM 1047 CD2 HIS A 71 8.215 16.379 -2.370 1.00 1.00 C ATOM 1048 CE1 HIS A 71 7.612 17.630 -4.055 1.00 1.00 C ATOM 1049 NE2 HIS A 71 8.652 17.245 -3.340 1.00 1.00 N ATOM 0 H HIS A 71 5.553 12.608 -0.652 1.00 1.00 H new ATOM 0 HA HIS A 71 4.891 14.081 -3.020 1.00 1.00 H new ATOM 0 HB2 HIS A 71 4.947 16.040 -1.666 1.00 1.00 H new ATOM 0 HB3 HIS A 71 6.249 15.426 -0.666 1.00 1.00 H new ATOM 0 HD1 HIS A 71 5.584 17.176 -3.933 1.00 1.00 H new ATOM 0 HD2 HIS A 71 8.829 15.887 -1.630 1.00 1.00 H new ATOM 0 HE1 HIS A 71 7.642 18.307 -4.896 1.00 1.00 H new ATOM 1058 N ARG A 72 7.196 13.585 -3.887 1.00 1.00 N ATOM 1059 CA ARG A 72 8.425 13.069 -4.440 1.00 1.00 C ATOM 1060 C ARG A 72 9.086 14.181 -5.237 1.00 1.00 C ATOM 1061 O ARG A 72 8.561 14.639 -6.255 1.00 1.00 O ATOM 1062 CB ARG A 72 8.166 11.828 -5.305 1.00 1.00 C ATOM 1063 CG ARG A 72 9.437 11.132 -5.764 1.00 1.00 C ATOM 1064 CD ARG A 72 10.011 11.777 -7.014 1.00 1.00 C ATOM 1065 NE ARG A 72 9.454 11.206 -8.241 1.00 1.00 N ATOM 1066 CZ ARG A 72 9.048 11.923 -9.289 1.00 1.00 C ATOM 1067 NH1 ARG A 72 9.022 13.250 -9.228 1.00 1.00 N ATOM 1068 NH2 ARG A 72 8.649 11.306 -10.393 1.00 1.00 N ATOM 0 H ARG A 72 6.640 14.135 -4.542 1.00 1.00 H new ATOM 0 HA ARG A 72 9.091 12.750 -3.638 1.00 1.00 H new ATOM 0 HB2 ARG A 72 7.558 11.121 -4.740 1.00 1.00 H new ATOM 0 HB3 ARG A 72 7.585 12.120 -6.180 1.00 1.00 H new ATOM 0 HG2 ARG A 72 10.178 11.164 -4.965 1.00 1.00 H new ATOM 0 HG3 ARG A 72 9.225 10.081 -5.961 1.00 1.00 H new ATOM 0 HD2 ARG A 72 9.811 12.848 -6.991 1.00 1.00 H new ATOM 0 HD3 ARG A 72 11.094 11.655 -7.018 1.00 1.00 H new ATOM 0 HE ARG A 72 9.371 10.191 -8.298 1.00 1.00 H new ATOM 0 HH11 ARG A 72 9.314 13.727 -8.375 1.00 1.00 H new ATOM 0 HH12 ARG A 72 8.710 13.792 -10.034 1.00 1.00 H new ATOM 0 HH21 ARG A 72 8.654 10.287 -10.438 1.00 1.00 H new ATOM 0 HH22 ARG A 72 8.337 11.850 -11.197 1.00 1.00 H new ATOM 1082 N ALA A 73 10.191 14.662 -4.698 1.00 1.00 N ATOM 1083 CA ALA A 73 10.916 15.795 -5.260 1.00 1.00 C ATOM 1084 C ALA A 73 11.306 15.574 -6.724 1.00 1.00 C ATOM 1085 O ALA A 73 11.742 14.491 -7.099 1.00 1.00 O ATOM 1086 CB ALA A 73 12.142 16.075 -4.413 1.00 1.00 C ATOM 0 H ALA A 73 10.616 14.278 -3.854 1.00 1.00 H new ATOM 0 HA ALA A 73 10.252 16.659 -5.246 1.00 1.00 H new ATOM 0 HB1 ALA A 73 12.687 16.922 -4.830 1.00 1.00 H new ATOM 0 HB2 ALA A 73 11.834 16.308 -3.394 1.00 1.00 H new ATOM 0 HB3 ALA A 73 12.787 15.197 -4.405 1.00 1.00 H new ATOM 1092 N ALA A 74 11.128 16.600 -7.555 1.00 1.00 N ATOM 1093 CA ALA A 74 11.487 16.507 -8.971 1.00 1.00 C ATOM 1094 C ALA A 74 12.352 17.687 -9.386 1.00 1.00 C ATOM 1095 O ALA A 74 12.366 18.708 -8.707 1.00 1.00 O ATOM 1096 CB ALA A 74 10.233 16.460 -9.832 1.00 1.00 C ATOM 0 H ALA A 74 10.740 17.501 -7.275 1.00 1.00 H new ATOM 0 HA ALA A 74 12.055 15.589 -9.117 1.00 1.00 H new ATOM 0 HB1 ALA A 74 10.515 16.391 -10.883 1.00 1.00 H new ATOM 0 HB2 ALA A 74 9.636 15.590 -9.559 1.00 1.00 H new ATOM 0 HB3 ALA A 74 9.648 17.366 -9.672 1.00 1.00 H new ATOM 1102 N GLN A 75 13.076 17.556 -10.490 1.00 1.00 N ATOM 1103 CA GLN A 75 13.917 18.640 -10.965 1.00 1.00 C ATOM 1104 C GLN A 75 13.156 19.409 -12.037 1.00 1.00 C ATOM 1105 O GLN A 75 12.253 18.856 -12.667 1.00 1.00 O ATOM 1106 CB GLN A 75 15.239 18.089 -11.522 1.00 1.00 C ATOM 1107 CG GLN A 75 15.902 18.981 -12.568 1.00 1.00 C ATOM 1108 CD GLN A 75 17.227 18.436 -13.056 1.00 1.00 C ATOM 1109 OE1 GLN A 75 17.275 17.614 -13.974 1.00 1.00 O ATOM 1110 NE2 GLN A 75 18.314 18.923 -12.485 1.00 1.00 N ATOM 0 H GLN A 75 13.096 16.716 -11.068 1.00 1.00 H new ATOM 0 HA GLN A 75 14.161 19.310 -10.140 1.00 1.00 H new ATOM 0 HB2 GLN A 75 15.934 17.941 -10.695 1.00 1.00 H new ATOM 0 HB3 GLN A 75 15.054 17.109 -11.962 1.00 1.00 H new ATOM 0 HG2 GLN A 75 15.229 19.098 -13.417 1.00 1.00 H new ATOM 0 HG3 GLN A 75 16.057 19.974 -12.145 1.00 1.00 H new ATOM 0 HE21 GLN A 75 18.232 19.602 -11.728 1.00 1.00 H new ATOM 0 HE22 GLN A 75 19.235 18.620 -12.801 1.00 1.00 H new ATOM 1119 N VAL A 76 13.474 20.682 -12.206 1.00 1.00 N ATOM 1120 CA VAL A 76 12.812 21.496 -13.217 1.00 1.00 C ATOM 1121 C VAL A 76 13.140 20.991 -14.616 1.00 1.00 C ATOM 1122 O VAL A 76 14.268 21.095 -15.085 1.00 1.00 O ATOM 1123 CB VAL A 76 13.213 22.973 -13.114 1.00 1.00 C ATOM 1124 CG1 VAL A 76 12.370 23.833 -14.016 1.00 1.00 C ATOM 1125 CG2 VAL A 76 13.122 23.457 -11.679 1.00 1.00 C ATOM 0 H VAL A 76 14.182 21.174 -11.661 1.00 1.00 H new ATOM 0 HA VAL A 76 11.740 21.412 -13.036 1.00 1.00 H new ATOM 0 HB VAL A 76 14.249 23.058 -13.442 1.00 1.00 H new ATOM 0 HG11 VAL A 76 12.679 24.874 -13.920 1.00 1.00 H new ATOM 0 HG12 VAL A 76 12.498 23.511 -15.049 1.00 1.00 H new ATOM 0 HG13 VAL A 76 11.322 23.738 -13.733 1.00 1.00 H new ATOM 0 HG21 VAL A 76 13.411 24.507 -11.630 1.00 1.00 H new ATOM 0 HG22 VAL A 76 12.098 23.345 -11.322 1.00 1.00 H new ATOM 0 HG23 VAL A 76 13.791 22.867 -11.053 1.00 1.00 H new ATOM 1135 N GLY A 77 12.143 20.419 -15.258 1.00 1.00 N ATOM 1136 CA GLY A 77 12.307 19.899 -16.595 1.00 1.00 C ATOM 1137 C GLY A 77 11.359 20.563 -17.554 1.00 1.00 C ATOM 1138 O GLY A 77 10.664 21.510 -17.179 1.00 1.00 O ATOM 0 H GLY A 77 11.206 20.303 -14.871 1.00 1.00 H new ATOM 0 HA2 GLY A 77 13.334 20.056 -16.926 1.00 1.00 H new ATOM 0 HA3 GLY A 77 12.134 18.823 -16.594 1.00 1.00 H new ATOM 1142 N THR A 78 11.267 20.026 -18.759 1.00 1.00 N ATOM 1143 CA THR A 78 10.391 20.577 -19.777 1.00 1.00 C ATOM 1144 C THR A 78 8.944 20.589 -19.294 1.00 1.00 C ATOM 1145 O THR A 78 8.246 21.588 -19.441 1.00 1.00 O ATOM 1146 CB THR A 78 10.513 19.774 -21.081 1.00 1.00 C ATOM 1147 OG1 THR A 78 11.833 19.922 -21.618 1.00 1.00 O ATOM 1148 CG2 THR A 78 9.481 20.220 -22.104 1.00 1.00 C ATOM 0 H THR A 78 11.792 19.204 -19.057 1.00 1.00 H new ATOM 0 HA THR A 78 10.696 21.605 -19.971 1.00 1.00 H new ATOM 0 HB THR A 78 10.327 18.724 -20.854 1.00 1.00 H new ATOM 0 HG1 THR A 78 11.908 19.407 -22.449 1.00 1.00 H new ATOM 0 HG21 THR A 78 9.594 19.632 -23.015 1.00 1.00 H new ATOM 0 HG22 THR A 78 8.480 20.072 -21.699 1.00 1.00 H new ATOM 0 HG23 THR A 78 9.628 21.276 -22.333 1.00 1.00 H new ATOM 1156 N GLU A 79 8.523 19.501 -18.656 1.00 1.00 N ATOM 1157 CA GLU A 79 7.180 19.405 -18.089 1.00 1.00 C ATOM 1158 C GLU A 79 6.922 20.525 -17.077 1.00 1.00 C ATOM 1159 O GLU A 79 5.797 21.006 -16.938 1.00 1.00 O ATOM 1160 CB GLU A 79 6.990 18.042 -17.419 1.00 1.00 C ATOM 1161 CG GLU A 79 8.043 17.728 -16.368 1.00 1.00 C ATOM 1162 CD GLU A 79 7.572 16.709 -15.351 1.00 1.00 C ATOM 1163 OE1 GLU A 79 6.877 17.094 -14.392 1.00 1.00 O ATOM 1164 OE2 GLU A 79 7.878 15.512 -15.537 1.00 1.00 O ATOM 0 H GLU A 79 9.096 18.668 -18.518 1.00 1.00 H new ATOM 0 HA GLU A 79 6.462 19.512 -18.903 1.00 1.00 H new ATOM 0 HB2 GLU A 79 6.004 18.009 -16.955 1.00 1.00 H new ATOM 0 HB3 GLU A 79 7.009 17.265 -18.183 1.00 1.00 H new ATOM 0 HG2 GLU A 79 8.941 17.355 -16.860 1.00 1.00 H new ATOM 0 HG3 GLU A 79 8.321 18.647 -15.853 1.00 1.00 H new ATOM 1171 N HIS A 80 7.973 20.952 -16.383 1.00 1.00 N ATOM 1172 CA HIS A 80 7.834 22.001 -15.383 1.00 1.00 C ATOM 1173 C HIS A 80 7.775 23.374 -16.039 1.00 1.00 C ATOM 1174 O HIS A 80 6.967 24.210 -15.659 1.00 1.00 O ATOM 1175 CB HIS A 80 8.952 21.920 -14.332 1.00 1.00 C ATOM 1176 CG HIS A 80 8.900 20.640 -13.548 1.00 1.00 C ATOM 1177 ND1 HIS A 80 9.543 19.483 -13.938 1.00 1.00 N ATOM 1178 CD2 HIS A 80 8.249 20.331 -12.401 1.00 1.00 C ATOM 1179 CE1 HIS A 80 9.288 18.526 -13.071 1.00 1.00 C ATOM 1180 NE2 HIS A 80 8.505 19.011 -12.127 1.00 1.00 N ATOM 0 H HIS A 80 8.920 20.591 -16.494 1.00 1.00 H new ATOM 0 HA HIS A 80 6.890 21.846 -14.861 1.00 1.00 H new ATOM 0 HB2 HIS A 80 9.920 22.003 -14.826 1.00 1.00 H new ATOM 0 HB3 HIS A 80 8.869 22.766 -13.650 1.00 1.00 H new ATOM 0 HD2 HIS A 80 7.641 21.000 -11.811 1.00 1.00 H new ATOM 0 HE1 HIS A 80 9.658 17.513 -13.124 1.00 1.00 H new ATOM 0 HE2 HIS A 80 8.148 18.491 -11.325 1.00 1.00 H new ATOM 1189 N LEU A 81 8.610 23.584 -17.049 1.00 1.00 N ATOM 1190 CA LEU A 81 8.614 24.842 -17.797 1.00 1.00 C ATOM 1191 C LEU A 81 7.328 24.980 -18.595 1.00 1.00 C ATOM 1192 O LEU A 81 6.973 26.067 -19.033 1.00 1.00 O ATOM 1193 CB LEU A 81 9.799 24.888 -18.756 1.00 1.00 C ATOM 1194 CG LEU A 81 11.151 24.527 -18.136 1.00 1.00 C ATOM 1195 CD1 LEU A 81 12.180 24.253 -19.220 1.00 1.00 C ATOM 1196 CD2 LEU A 81 11.628 25.650 -17.231 1.00 1.00 C ATOM 0 H LEU A 81 9.295 22.901 -17.372 1.00 1.00 H new ATOM 0 HA LEU A 81 8.694 25.662 -17.083 1.00 1.00 H new ATOM 0 HB2 LEU A 81 9.603 24.207 -19.584 1.00 1.00 H new ATOM 0 HB3 LEU A 81 9.866 25.891 -19.178 1.00 1.00 H new ATOM 0 HG LEU A 81 11.028 23.622 -17.541 1.00 1.00 H new ATOM 0 HD11 LEU A 81 13.135 23.998 -18.760 1.00 1.00 H new ATOM 0 HD12 LEU A 81 11.843 23.422 -19.840 1.00 1.00 H new ATOM 0 HD13 LEU A 81 12.302 25.142 -19.839 1.00 1.00 H new ATOM 0 HD21 LEU A 81 12.591 25.382 -16.795 1.00 1.00 H new ATOM 0 HD22 LEU A 81 11.735 26.566 -17.813 1.00 1.00 H new ATOM 0 HD23 LEU A 81 10.901 25.809 -16.435 1.00 1.00 H new ATOM 1208 N ALA A 82 6.643 23.865 -18.811 1.00 1.00 N ATOM 1209 CA ALA A 82 5.414 23.873 -19.584 1.00 1.00 C ATOM 1210 C ALA A 82 4.232 24.198 -18.693 1.00 1.00 C ATOM 1211 O ALA A 82 3.091 24.238 -19.149 1.00 1.00 O ATOM 1212 CB ALA A 82 5.196 22.527 -20.250 1.00 1.00 C ATOM 0 H ALA A 82 6.919 22.947 -18.462 1.00 1.00 H new ATOM 0 HA ALA A 82 5.501 24.639 -20.354 1.00 1.00 H new ATOM 0 HB1 ALA A 82 4.270 22.551 -20.825 1.00 1.00 H new ATOM 0 HB2 ALA A 82 6.031 22.311 -20.916 1.00 1.00 H new ATOM 0 HB3 ALA A 82 5.129 21.751 -19.488 1.00 1.00 H new ATOM 1218 N ALA A 83 4.497 24.305 -17.398 1.00 1.00 N ATOM 1219 CA ALA A 83 3.461 24.644 -16.440 1.00 1.00 C ATOM 1220 C ALA A 83 2.821 25.981 -16.787 1.00 1.00 C ATOM 1221 O ALA A 83 3.449 26.845 -17.403 1.00 1.00 O ATOM 1222 CB ALA A 83 4.019 24.683 -15.032 1.00 1.00 C ATOM 0 H ALA A 83 5.421 24.162 -16.990 1.00 1.00 H new ATOM 0 HA ALA A 83 2.696 23.869 -16.488 1.00 1.00 H new ATOM 0 HB1 ALA A 83 3.223 24.939 -14.332 1.00 1.00 H new ATOM 0 HB2 ALA A 83 4.427 23.706 -14.775 1.00 1.00 H new ATOM 0 HB3 ALA A 83 4.808 25.432 -14.974 1.00 1.00 H new ATOM 1228 N ASP A 84 1.580 26.151 -16.372 1.00 1.00 N ATOM 1229 CA ASP A 84 0.852 27.379 -16.642 1.00 1.00 C ATOM 1230 C ASP A 84 1.274 28.447 -15.652 1.00 1.00 C ATOM 1231 O ASP A 84 1.125 29.637 -15.902 1.00 1.00 O ATOM 1232 CB ASP A 84 -0.658 27.144 -16.564 1.00 1.00 C ATOM 1233 CG ASP A 84 -1.435 28.182 -17.354 1.00 1.00 C ATOM 1234 OD1 ASP A 84 -1.168 28.313 -18.573 1.00 1.00 O ATOM 1235 OD2 ASP A 84 -2.320 28.843 -16.774 1.00 1.00 O ATOM 0 H ASP A 84 1.053 25.454 -15.846 1.00 1.00 H new ATOM 0 HA ASP A 84 1.088 27.713 -17.652 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -0.891 26.149 -16.945 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -0.976 27.169 -15.522 1.00 1.00 H new ATOM 1240 N LEU A 85 1.944 28.009 -14.597 1.00 1.00 N ATOM 1241 CA LEU A 85 2.380 28.900 -13.544 1.00 1.00 C ATOM 1242 C LEU A 85 3.566 28.282 -12.842 1.00 1.00 C ATOM 1243 O LEU A 85 3.475 27.179 -12.303 1.00 1.00 O ATOM 1244 CB LEU A 85 1.254 29.108 -12.528 1.00 1.00 C ATOM 1245 CG LEU A 85 1.346 30.359 -11.643 1.00 1.00 C ATOM 1246 CD1 LEU A 85 0.398 30.221 -10.479 1.00 1.00 C ATOM 1247 CD2 LEU A 85 2.748 30.585 -11.123 1.00 1.00 C ATOM 0 H LEU A 85 2.197 27.032 -14.451 1.00 1.00 H new ATOM 0 HA LEU A 85 2.652 29.862 -13.978 1.00 1.00 H new ATOM 0 HB2 LEU A 85 0.309 29.143 -13.070 1.00 1.00 H new ATOM 0 HB3 LEU A 85 1.216 28.234 -11.878 1.00 1.00 H new ATOM 0 HG LEU A 85 1.075 31.219 -12.256 1.00 1.00 H new ATOM 0 HD11 LEU A 85 0.463 31.109 -9.850 1.00 1.00 H new ATOM 0 HD12 LEU A 85 -0.621 30.113 -10.851 1.00 1.00 H new ATOM 0 HD13 LEU A 85 0.666 29.341 -9.894 1.00 1.00 H new ATOM 0 HD21 LEU A 85 2.766 31.481 -10.502 1.00 1.00 H new ATOM 0 HD22 LEU A 85 3.059 29.725 -10.529 1.00 1.00 H new ATOM 0 HD23 LEU A 85 3.431 30.712 -11.963 1.00 1.00 H new ATOM 1259 N LEU A 86 4.693 28.960 -12.896 1.00 1.00 N ATOM 1260 CA LEU A 86 5.865 28.487 -12.237 1.00 1.00 C ATOM 1261 C LEU A 86 6.154 29.347 -11.023 1.00 1.00 C ATOM 1262 O LEU A 86 6.649 30.462 -11.136 1.00 1.00 O ATOM 1263 CB LEU A 86 7.011 28.456 -13.230 1.00 1.00 C ATOM 1264 CG LEU A 86 6.799 27.480 -14.397 1.00 1.00 C ATOM 1265 CD1 LEU A 86 5.732 27.960 -15.367 1.00 1.00 C ATOM 1266 CD2 LEU A 86 8.094 27.273 -15.123 1.00 1.00 C ATOM 0 H LEU A 86 4.810 29.842 -13.394 1.00 1.00 H new ATOM 0 HA LEU A 86 5.722 27.470 -11.871 1.00 1.00 H new ATOM 0 HB2 LEU A 86 7.159 29.459 -13.631 1.00 1.00 H new ATOM 0 HB3 LEU A 86 7.927 28.185 -12.704 1.00 1.00 H new ATOM 0 HG LEU A 86 6.451 26.537 -13.976 1.00 1.00 H new ATOM 0 HD11 LEU A 86 5.621 27.235 -16.173 1.00 1.00 H new ATOM 0 HD12 LEU A 86 4.783 28.066 -14.841 1.00 1.00 H new ATOM 0 HD13 LEU A 86 6.026 28.923 -15.784 1.00 1.00 H new ATOM 0 HD21 LEU A 86 7.941 26.580 -15.950 1.00 1.00 H new ATOM 0 HD22 LEU A 86 8.451 28.227 -15.510 1.00 1.00 H new ATOM 0 HD23 LEU A 86 8.834 26.861 -14.437 1.00 1.00 H new ATOM 1278 N VAL A 87 5.870 28.781 -9.869 1.00 1.00 N ATOM 1279 CA VAL A 87 5.998 29.481 -8.608 1.00 1.00 C ATOM 1280 C VAL A 87 7.425 29.409 -8.072 1.00 1.00 C ATOM 1281 O VAL A 87 7.818 28.446 -7.424 1.00 1.00 O ATOM 1282 CB VAL A 87 5.019 28.917 -7.566 1.00 1.00 C ATOM 1283 CG1 VAL A 87 5.317 29.457 -6.188 1.00 1.00 C ATOM 1284 CG2 VAL A 87 3.598 29.254 -7.953 1.00 1.00 C ATOM 0 H VAL A 87 5.543 27.819 -9.779 1.00 1.00 H new ATOM 0 HA VAL A 87 5.754 30.527 -8.792 1.00 1.00 H new ATOM 0 HB VAL A 87 5.140 27.834 -7.542 1.00 1.00 H new ATOM 0 HG11 VAL A 87 4.608 29.040 -5.473 1.00 1.00 H new ATOM 0 HG12 VAL A 87 6.330 29.178 -5.899 1.00 1.00 H new ATOM 0 HG13 VAL A 87 5.228 30.543 -6.196 1.00 1.00 H new ATOM 0 HG21 VAL A 87 2.912 28.850 -7.208 1.00 1.00 H new ATOM 0 HG22 VAL A 87 3.482 30.337 -8.004 1.00 1.00 H new ATOM 0 HG23 VAL A 87 3.373 28.819 -8.927 1.00 1.00 H new ATOM 1294 N ALA A 88 8.210 30.409 -8.411 1.00 1.00 N ATOM 1295 CA ALA A 88 9.584 30.486 -7.962 1.00 1.00 C ATOM 1296 C ALA A 88 9.655 30.983 -6.522 1.00 1.00 C ATOM 1297 O ALA A 88 8.831 31.786 -6.082 1.00 1.00 O ATOM 1298 CB ALA A 88 10.399 31.378 -8.874 1.00 1.00 C ATOM 0 H ALA A 88 7.917 31.187 -9.002 1.00 1.00 H new ATOM 0 HA ALA A 88 10.008 29.483 -7.999 1.00 1.00 H new ATOM 0 HB1 ALA A 88 11.428 31.421 -8.517 1.00 1.00 H new ATOM 0 HB2 ALA A 88 10.383 30.975 -9.887 1.00 1.00 H new ATOM 0 HB3 ALA A 88 9.974 32.382 -8.876 1.00 1.00 H new ATOM 1304 N LEU A 89 10.635 30.489 -5.785 1.00 1.00 N ATOM 1305 CA LEU A 89 10.831 30.888 -4.405 1.00 1.00 C ATOM 1306 C LEU A 89 11.955 31.911 -4.301 1.00 1.00 C ATOM 1307 O LEU A 89 12.236 32.426 -3.224 1.00 1.00 O ATOM 1308 CB LEU A 89 11.143 29.661 -3.538 1.00 1.00 C ATOM 1309 CG LEU A 89 9.927 28.895 -3.004 1.00 1.00 C ATOM 1310 CD1 LEU A 89 9.005 29.834 -2.240 1.00 1.00 C ATOM 1311 CD2 LEU A 89 9.176 28.194 -4.130 1.00 1.00 C ATOM 0 H LEU A 89 11.312 29.805 -6.124 1.00 1.00 H new ATOM 0 HA LEU A 89 9.912 31.348 -4.042 1.00 1.00 H new ATOM 0 HB2 LEU A 89 11.754 28.973 -4.122 1.00 1.00 H new ATOM 0 HB3 LEU A 89 11.747 29.983 -2.690 1.00 1.00 H new ATOM 0 HG LEU A 89 10.285 28.126 -2.319 1.00 1.00 H new ATOM 0 HD11 LEU A 89 8.146 29.276 -1.867 1.00 1.00 H new ATOM 0 HD12 LEU A 89 9.546 30.272 -1.401 1.00 1.00 H new ATOM 0 HD13 LEU A 89 8.662 30.627 -2.904 1.00 1.00 H new ATOM 0 HD21 LEU A 89 8.319 27.660 -3.719 1.00 1.00 H new ATOM 0 HD22 LEU A 89 8.830 28.934 -4.852 1.00 1.00 H new ATOM 0 HD23 LEU A 89 9.841 27.487 -4.626 1.00 1.00 H new ATOM 1323 N ASP A 90 12.642 32.134 -5.412 1.00 1.00 N ATOM 1324 CA ASP A 90 13.723 33.113 -5.449 1.00 1.00 C ATOM 1325 C ASP A 90 13.927 33.661 -6.861 1.00 1.00 C ATOM 1326 O ASP A 90 13.556 33.017 -7.850 1.00 1.00 O ATOM 1327 CB ASP A 90 15.016 32.490 -4.906 1.00 1.00 C ATOM 1328 CG ASP A 90 16.106 32.347 -5.945 1.00 1.00 C ATOM 1329 OD1 ASP A 90 16.016 31.428 -6.779 1.00 1.00 O ATOM 1330 OD2 ASP A 90 17.048 33.154 -5.931 1.00 1.00 O ATOM 0 H ASP A 90 12.473 31.654 -6.296 1.00 1.00 H new ATOM 0 HA ASP A 90 13.448 33.953 -4.812 1.00 1.00 H new ATOM 0 HB2 ASP A 90 15.387 33.103 -4.085 1.00 1.00 H new ATOM 0 HB3 ASP A 90 14.789 31.507 -4.493 1.00 1.00 H new ATOM 1335 N ARG A 91 14.506 34.857 -6.931 1.00 1.00 N ATOM 1336 CA ARG A 91 14.767 35.560 -8.193 1.00 1.00 C ATOM 1337 C ARG A 91 15.598 34.741 -9.188 1.00 1.00 C ATOM 1338 O ARG A 91 15.518 34.962 -10.402 1.00 1.00 O ATOM 1339 CB ARG A 91 15.485 36.882 -7.900 1.00 1.00 C ATOM 1340 CG ARG A 91 16.530 36.779 -6.793 1.00 1.00 C ATOM 1341 CD ARG A 91 17.422 38.011 -6.745 1.00 1.00 C ATOM 1342 NE ARG A 91 18.343 38.066 -7.880 1.00 1.00 N ATOM 1343 CZ ARG A 91 18.312 39.006 -8.826 1.00 1.00 C ATOM 1344 NH1 ARG A 91 17.399 39.973 -8.783 1.00 1.00 N ATOM 1345 NH2 ARG A 91 19.203 38.980 -9.809 1.00 1.00 N ATOM 0 H ARG A 91 14.812 35.374 -6.107 1.00 1.00 H new ATOM 0 HA ARG A 91 13.798 35.735 -8.661 1.00 1.00 H new ATOM 0 HB2 ARG A 91 15.968 37.233 -8.812 1.00 1.00 H new ATOM 0 HB3 ARG A 91 14.746 37.633 -7.621 1.00 1.00 H new ATOM 0 HG2 ARG A 91 16.031 36.653 -5.832 1.00 1.00 H new ATOM 0 HG3 ARG A 91 17.143 35.892 -6.952 1.00 1.00 H new ATOM 0 HD2 ARG A 91 16.802 38.907 -6.738 1.00 1.00 H new ATOM 0 HD3 ARG A 91 17.992 38.010 -5.816 1.00 1.00 H new ATOM 0 HE ARG A 91 19.055 37.339 -7.953 1.00 1.00 H new ATOM 0 HH11 ARG A 91 16.718 39.998 -8.024 1.00 1.00 H new ATOM 0 HH12 ARG A 91 17.380 40.689 -9.509 1.00 1.00 H new ATOM 0 HH21 ARG A 91 19.908 38.243 -9.839 1.00 1.00 H new ATOM 0 HH22 ARG A 91 19.183 39.697 -10.534 1.00 1.00 H new ATOM 1359 N ASN A 92 16.380 33.801 -8.686 1.00 1.00 N ATOM 1360 CA ASN A 92 17.233 32.990 -9.545 1.00 1.00 C ATOM 1361 C ASN A 92 16.407 31.933 -10.256 1.00 1.00 C ATOM 1362 O ASN A 92 16.470 31.806 -11.474 1.00 1.00 O ATOM 1363 CB ASN A 92 18.331 32.318 -8.727 1.00 1.00 C ATOM 1364 CG ASN A 92 19.393 33.284 -8.251 1.00 1.00 C ATOM 1365 OD1 ASN A 92 19.755 34.233 -8.949 1.00 1.00 O ATOM 1366 ND2 ASN A 92 19.891 33.053 -7.050 1.00 1.00 N ATOM 0 H ASN A 92 16.444 33.579 -7.692 1.00 1.00 H new ATOM 0 HA ASN A 92 17.694 33.643 -10.286 1.00 1.00 H new ATOM 0 HB2 ASN A 92 17.883 31.826 -7.864 1.00 1.00 H new ATOM 0 HB3 ASN A 92 18.800 31.540 -9.329 1.00 1.00 H new ATOM 0 HD21 ASN A 92 20.605 33.672 -6.666 1.00 1.00 H new ATOM 0 HD22 ASN A 92 19.562 32.255 -6.506 1.00 1.00 H new ATOM 1373 N HIS A 93 15.626 31.185 -9.482 1.00 1.00 N ATOM 1374 CA HIS A 93 14.781 30.127 -10.031 1.00 1.00 C ATOM 1375 C HIS A 93 13.868 30.682 -11.117 1.00 1.00 C ATOM 1376 O HIS A 93 13.782 30.115 -12.204 1.00 1.00 O ATOM 1377 CB HIS A 93 13.940 29.447 -8.937 1.00 1.00 C ATOM 1378 CG HIS A 93 14.731 29.021 -7.739 1.00 1.00 C ATOM 1379 ND1 HIS A 93 14.228 29.058 -6.459 1.00 1.00 N ATOM 1380 CD2 HIS A 93 16.006 28.577 -7.626 1.00 1.00 C ATOM 1381 CE1 HIS A 93 15.157 28.664 -5.612 1.00 1.00 C ATOM 1382 NE2 HIS A 93 16.249 28.365 -6.292 1.00 1.00 N ATOM 0 H HIS A 93 15.560 31.292 -8.470 1.00 1.00 H new ATOM 0 HA HIS A 93 15.441 29.376 -10.466 1.00 1.00 H new ATOM 0 HB2 HIS A 93 13.156 30.133 -8.617 1.00 1.00 H new ATOM 0 HB3 HIS A 93 13.446 28.574 -9.363 1.00 1.00 H new ATOM 0 HD1 HIS A 93 13.283 29.346 -6.205 1.00 1.00 H new ATOM 0 HD2 HIS A 93 16.703 28.419 -8.436 1.00 1.00 H new ATOM 0 HE1 HIS A 93 15.044 28.597 -4.540 1.00 1.00 H new ATOM 1391 N ALA A 94 13.231 31.821 -10.841 1.00 1.00 N ATOM 1392 CA ALA A 94 12.343 32.449 -11.813 1.00 1.00 C ATOM 1393 C ALA A 94 13.099 32.794 -13.089 1.00 1.00 C ATOM 1394 O ALA A 94 12.602 32.584 -14.202 1.00 1.00 O ATOM 1395 CB ALA A 94 11.694 33.695 -11.228 1.00 1.00 C ATOM 0 H ALA A 94 13.314 32.323 -9.957 1.00 1.00 H new ATOM 0 HA ALA A 94 11.556 31.736 -12.060 1.00 1.00 H new ATOM 0 HB1 ALA A 94 11.036 34.146 -11.971 1.00 1.00 H new ATOM 0 HB2 ALA A 94 11.113 33.423 -10.347 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.467 34.410 -10.946 1.00 1.00 H new ATOM 1401 N ARG A 95 14.304 33.334 -12.913 1.00 1.00 N ATOM 1402 CA ARG A 95 15.164 33.675 -14.034 1.00 1.00 C ATOM 1403 C ARG A 95 15.457 32.456 -14.884 1.00 1.00 C ATOM 1404 O ARG A 95 15.291 32.493 -16.100 1.00 1.00 O ATOM 1405 CB ARG A 95 16.478 34.285 -13.540 1.00 1.00 C ATOM 1406 CG ARG A 95 17.640 34.070 -14.500 1.00 1.00 C ATOM 1407 CD ARG A 95 18.862 34.880 -14.107 1.00 1.00 C ATOM 1408 NE ARG A 95 18.561 36.306 -13.969 1.00 1.00 N ATOM 1409 CZ ARG A 95 19.232 37.282 -14.582 1.00 1.00 C ATOM 1410 NH1 ARG A 95 20.231 37.003 -15.411 1.00 1.00 N ATOM 1411 NH2 ARG A 95 18.897 38.547 -14.363 1.00 1.00 N ATOM 0 H ARG A 95 14.704 33.544 -11.998 1.00 1.00 H new ATOM 0 HA ARG A 95 14.637 34.409 -14.644 1.00 1.00 H new ATOM 0 HB2 ARG A 95 16.338 35.355 -13.384 1.00 1.00 H new ATOM 0 HB3 ARG A 95 16.730 33.852 -12.572 1.00 1.00 H new ATOM 0 HG2 ARG A 95 17.899 33.012 -14.523 1.00 1.00 H new ATOM 0 HG3 ARG A 95 17.332 34.345 -15.509 1.00 1.00 H new ATOM 0 HD2 ARG A 95 19.259 34.502 -13.165 1.00 1.00 H new ATOM 0 HD3 ARG A 95 19.641 34.746 -14.858 1.00 1.00 H new ATOM 0 HE ARG A 95 17.785 36.571 -13.363 1.00 1.00 H new ATOM 0 HH11 ARG A 95 20.493 36.033 -15.585 1.00 1.00 H new ATOM 0 HH12 ARG A 95 20.736 37.759 -15.874 1.00 1.00 H new ATOM 0 HH21 ARG A 95 18.130 38.769 -13.729 1.00 1.00 H new ATOM 0 HH22 ARG A 95 19.407 39.298 -14.829 1.00 1.00 H new ATOM 1425 N LEU A 96 15.807 31.359 -14.224 1.00 1.00 N ATOM 1426 CA LEU A 96 16.203 30.150 -14.918 1.00 1.00 C ATOM 1427 C LEU A 96 15.055 29.621 -15.756 1.00 1.00 C ATOM 1428 O LEU A 96 15.183 29.492 -16.958 1.00 1.00 O ATOM 1429 CB LEU A 96 16.658 29.077 -13.924 1.00 1.00 C ATOM 1430 CG LEU A 96 17.720 29.528 -12.922 1.00 1.00 C ATOM 1431 CD1 LEU A 96 18.148 28.371 -12.037 1.00 1.00 C ATOM 1432 CD2 LEU A 96 18.922 30.125 -13.641 1.00 1.00 C ATOM 0 H LEU A 96 15.823 31.286 -13.207 1.00 1.00 H new ATOM 0 HA LEU A 96 17.039 30.395 -15.574 1.00 1.00 H new ATOM 0 HB2 LEU A 96 15.787 28.723 -13.372 1.00 1.00 H new ATOM 0 HB3 LEU A 96 17.047 28.227 -14.484 1.00 1.00 H new ATOM 0 HG LEU A 96 17.283 30.300 -12.289 1.00 1.00 H new ATOM 0 HD11 LEU A 96 18.904 28.713 -11.331 1.00 1.00 H new ATOM 0 HD12 LEU A 96 17.285 27.993 -11.489 1.00 1.00 H new ATOM 0 HD13 LEU A 96 18.563 27.574 -12.655 1.00 1.00 H new ATOM 0 HD21 LEU A 96 19.665 30.439 -12.908 1.00 1.00 H new ATOM 0 HD22 LEU A 96 19.359 29.377 -14.303 1.00 1.00 H new ATOM 0 HD23 LEU A 96 18.604 30.987 -14.228 1.00 1.00 H new ATOM 1444 N LEU A 97 13.899 29.479 -15.130 1.00 1.00 N ATOM 1445 CA LEU A 97 12.719 28.926 -15.790 1.00 1.00 C ATOM 1446 C LEU A 97 12.431 29.631 -17.117 1.00 1.00 C ATOM 1447 O LEU A 97 12.345 28.994 -18.166 1.00 1.00 O ATOM 1448 CB LEU A 97 11.505 29.085 -14.874 1.00 1.00 C ATOM 1449 CG LEU A 97 11.664 28.515 -13.469 1.00 1.00 C ATOM 1450 CD1 LEU A 97 10.501 28.941 -12.592 1.00 1.00 C ATOM 1451 CD2 LEU A 97 11.771 27.007 -13.521 1.00 1.00 C ATOM 0 H LEU A 97 13.748 29.741 -14.156 1.00 1.00 H new ATOM 0 HA LEU A 97 12.914 27.873 -15.995 1.00 1.00 H new ATOM 0 HB2 LEU A 97 11.270 30.146 -14.792 1.00 1.00 H new ATOM 0 HB3 LEU A 97 10.649 28.604 -15.348 1.00 1.00 H new ATOM 0 HG LEU A 97 12.583 28.908 -13.035 1.00 1.00 H new ATOM 0 HD11 LEU A 97 10.628 28.526 -11.592 1.00 1.00 H new ATOM 0 HD12 LEU A 97 10.470 30.029 -12.533 1.00 1.00 H new ATOM 0 HD13 LEU A 97 9.568 28.574 -13.021 1.00 1.00 H new ATOM 0 HD21 LEU A 97 11.884 26.615 -12.510 1.00 1.00 H new ATOM 0 HD22 LEU A 97 10.869 26.594 -13.972 1.00 1.00 H new ATOM 0 HD23 LEU A 97 12.637 26.724 -14.119 1.00 1.00 H new ATOM 1463 N ARG A 98 12.233 30.939 -17.049 1.00 1.00 N ATOM 1464 CA ARG A 98 11.930 31.738 -18.237 1.00 1.00 C ATOM 1465 C ARG A 98 13.030 31.641 -19.297 1.00 1.00 C ATOM 1466 O ARG A 98 12.737 31.404 -20.467 1.00 1.00 O ATOM 1467 CB ARG A 98 11.665 33.199 -17.852 1.00 1.00 C ATOM 1468 CG ARG A 98 12.893 33.946 -17.369 1.00 1.00 C ATOM 1469 CD ARG A 98 12.519 35.176 -16.572 1.00 1.00 C ATOM 1470 NE ARG A 98 13.493 36.250 -16.751 1.00 1.00 N ATOM 1471 CZ ARG A 98 13.484 37.399 -16.075 1.00 1.00 C ATOM 1472 NH1 ARG A 98 12.548 37.634 -15.162 1.00 1.00 N ATOM 1473 NH2 ARG A 98 14.412 38.311 -16.320 1.00 1.00 N ATOM 0 H ARG A 98 12.276 31.475 -16.182 1.00 1.00 H new ATOM 0 HA ARG A 98 11.025 31.325 -18.682 1.00 1.00 H new ATOM 0 HB2 ARG A 98 11.252 33.721 -18.715 1.00 1.00 H new ATOM 0 HB3 ARG A 98 10.906 33.225 -17.070 1.00 1.00 H new ATOM 0 HG2 ARG A 98 13.503 33.285 -16.754 1.00 1.00 H new ATOM 0 HG3 ARG A 98 13.502 34.237 -18.225 1.00 1.00 H new ATOM 0 HD2 ARG A 98 11.533 35.524 -16.880 1.00 1.00 H new ATOM 0 HD3 ARG A 98 12.451 34.918 -15.515 1.00 1.00 H new ATOM 0 HE ARG A 98 14.231 36.111 -17.441 1.00 1.00 H new ATOM 0 HH11 ARG A 98 11.831 36.933 -14.975 1.00 1.00 H new ATOM 0 HH12 ARG A 98 12.547 38.515 -14.648 1.00 1.00 H new ATOM 0 HH21 ARG A 98 15.129 38.133 -17.023 1.00 1.00 H new ATOM 0 HH22 ARG A 98 14.410 39.192 -15.806 1.00 1.00 H new ATOM 1487 N GLN A 99 14.289 31.783 -18.897 1.00 1.00 N ATOM 1488 CA GLN A 99 15.387 31.697 -19.853 1.00 1.00 C ATOM 1489 C GLN A 99 15.542 30.269 -20.368 1.00 1.00 C ATOM 1490 O GLN A 99 16.162 30.036 -21.404 1.00 1.00 O ATOM 1491 CB GLN A 99 16.699 32.225 -19.259 1.00 1.00 C ATOM 1492 CG GLN A 99 17.201 31.477 -18.040 1.00 1.00 C ATOM 1493 CD GLN A 99 18.536 32.003 -17.545 1.00 1.00 C ATOM 1494 OE1 GLN A 99 18.841 33.189 -17.691 1.00 1.00 O ATOM 1495 NE2 GLN A 99 19.340 31.131 -16.957 1.00 1.00 N ATOM 0 H GLN A 99 14.572 31.956 -17.932 1.00 1.00 H new ATOM 0 HA GLN A 99 15.142 32.337 -20.701 1.00 1.00 H new ATOM 0 HB2 GLN A 99 17.469 32.190 -20.030 1.00 1.00 H new ATOM 0 HB3 GLN A 99 16.563 33.273 -18.992 1.00 1.00 H new ATOM 0 HG2 GLN A 99 16.464 31.555 -17.241 1.00 1.00 H new ATOM 0 HG3 GLN A 99 17.298 30.419 -18.282 1.00 1.00 H new ATOM 0 HE21 GLN A 99 19.051 30.158 -16.856 1.00 1.00 H new ATOM 0 HE22 GLN A 99 20.249 31.432 -16.605 1.00 1.00 H new ATOM 1504 N LEU A 100 14.989 29.318 -19.622 1.00 1.00 N ATOM 1505 CA LEU A 100 15.001 27.918 -20.013 1.00 1.00 C ATOM 1506 C LEU A 100 13.891 27.622 -21.013 1.00 1.00 C ATOM 1507 O LEU A 100 13.957 26.641 -21.753 1.00 1.00 O ATOM 1508 CB LEU A 100 14.846 27.019 -18.779 1.00 1.00 C ATOM 1509 CG LEU A 100 16.049 26.994 -17.829 1.00 1.00 C ATOM 1510 CD1 LEU A 100 16.003 25.763 -16.938 1.00 1.00 C ATOM 1511 CD2 LEU A 100 17.359 27.074 -18.604 1.00 1.00 C ATOM 0 H LEU A 100 14.522 29.498 -18.733 1.00 1.00 H new ATOM 0 HA LEU A 100 15.959 27.709 -20.489 1.00 1.00 H new ATOM 0 HB2 LEU A 100 13.970 27.346 -18.220 1.00 1.00 H new ATOM 0 HB3 LEU A 100 14.648 26.001 -19.115 1.00 1.00 H new ATOM 0 HG LEU A 100 15.996 27.873 -17.186 1.00 1.00 H new ATOM 0 HD11 LEU A 100 16.865 25.764 -16.271 1.00 1.00 H new ATOM 0 HD12 LEU A 100 15.087 25.776 -16.347 1.00 1.00 H new ATOM 0 HD13 LEU A 100 16.023 24.865 -17.556 1.00 1.00 H new ATOM 0 HD21 LEU A 100 18.196 27.054 -17.906 1.00 1.00 H new ATOM 0 HD22 LEU A 100 17.433 26.224 -19.283 1.00 1.00 H new ATOM 0 HD23 LEU A 100 17.386 28.000 -19.178 1.00 1.00 H new ATOM 1523 N GLY A 101 12.895 28.497 -21.072 1.00 1.00 N ATOM 1524 CA GLY A 101 11.790 28.266 -21.978 1.00 1.00 C ATOM 1525 C GLY A 101 10.492 28.912 -21.532 1.00 1.00 C ATOM 1526 O GLY A 101 9.631 29.200 -22.361 1.00 1.00 O ATOM 0 H GLY A 101 12.833 29.350 -20.517 1.00 1.00 H new ATOM 0 HA2 GLY A 101 12.055 28.646 -22.965 1.00 1.00 H new ATOM 0 HA3 GLY A 101 11.635 27.192 -22.081 1.00 1.00 H new ATOM 1530 N VAL A 102 10.336 29.143 -20.230 1.00 1.00 N ATOM 1531 CA VAL A 102 9.101 29.730 -19.723 1.00 1.00 C ATOM 1532 C VAL A 102 9.063 31.248 -20.012 1.00 1.00 C ATOM 1533 O VAL A 102 9.819 31.744 -20.843 1.00 1.00 O ATOM 1534 CB VAL A 102 8.858 29.362 -18.210 1.00 1.00 C ATOM 1535 CG1 VAL A 102 9.148 30.460 -17.215 1.00 1.00 C ATOM 1536 CG2 VAL A 102 7.452 28.845 -18.048 1.00 1.00 C ATOM 0 H VAL A 102 11.037 28.936 -19.519 1.00 1.00 H new ATOM 0 HA VAL A 102 8.259 29.294 -20.260 1.00 1.00 H new ATOM 0 HB VAL A 102 9.590 28.591 -17.969 1.00 1.00 H new ATOM 0 HG11 VAL A 102 8.947 30.099 -16.206 1.00 1.00 H new ATOM 0 HG12 VAL A 102 10.194 30.755 -17.293 1.00 1.00 H new ATOM 0 HG13 VAL A 102 8.512 31.320 -17.426 1.00 1.00 H new ATOM 0 HG21 VAL A 102 7.277 28.588 -17.003 1.00 1.00 H new ATOM 0 HG22 VAL A 102 6.744 29.614 -18.356 1.00 1.00 H new ATOM 0 HG23 VAL A 102 7.317 27.958 -18.667 1.00 1.00 H new ATOM 1546 N GLU A 103 8.218 31.980 -19.311 1.00 1.00 N ATOM 1547 CA GLU A 103 8.076 33.408 -19.509 1.00 1.00 C ATOM 1548 C GLU A 103 7.455 33.984 -18.256 1.00 1.00 C ATOM 1549 O GLU A 103 6.874 33.243 -17.464 1.00 1.00 O ATOM 1550 CB GLU A 103 7.178 33.693 -20.717 1.00 1.00 C ATOM 1551 CG GLU A 103 5.770 33.158 -20.561 1.00 1.00 C ATOM 1552 CD GLU A 103 4.972 33.227 -21.841 1.00 1.00 C ATOM 1553 OE1 GLU A 103 4.780 34.343 -22.369 1.00 1.00 O ATOM 1554 OE2 GLU A 103 4.520 32.166 -22.315 1.00 1.00 O ATOM 0 H GLU A 103 7.610 31.599 -18.586 1.00 1.00 H new ATOM 0 HA GLU A 103 9.049 33.861 -19.700 1.00 1.00 H new ATOM 0 HB2 GLU A 103 7.133 34.770 -20.881 1.00 1.00 H new ATOM 0 HB3 GLU A 103 7.629 33.254 -21.607 1.00 1.00 H new ATOM 0 HG2 GLU A 103 5.815 32.123 -20.222 1.00 1.00 H new ATOM 0 HG3 GLU A 103 5.255 33.725 -19.786 1.00 1.00 H new ATOM 1561 N ALA A 104 7.573 35.290 -18.072 1.00 1.00 N ATOM 1562 CA ALA A 104 7.097 35.932 -16.848 1.00 1.00 C ATOM 1563 C ALA A 104 5.591 35.779 -16.690 1.00 1.00 C ATOM 1564 O ALA A 104 5.056 35.913 -15.586 1.00 1.00 O ATOM 1565 CB ALA A 104 7.494 37.400 -16.821 1.00 1.00 C ATOM 0 H ALA A 104 7.992 35.927 -18.749 1.00 1.00 H new ATOM 0 HA ALA A 104 7.572 35.431 -16.005 1.00 1.00 H new ATOM 0 HB1 ALA A 104 7.130 37.859 -15.902 1.00 1.00 H new ATOM 0 HB2 ALA A 104 8.580 37.484 -16.863 1.00 1.00 H new ATOM 0 HB3 ALA A 104 7.057 37.911 -17.679 1.00 1.00 H new ATOM 1571 N ALA A 105 4.904 35.588 -17.811 1.00 1.00 N ATOM 1572 CA ALA A 105 3.477 35.316 -17.792 1.00 1.00 C ATOM 1573 C ALA A 105 3.192 34.058 -16.977 1.00 1.00 C ATOM 1574 O ALA A 105 2.193 33.973 -16.270 1.00 1.00 O ATOM 1575 CB ALA A 105 2.943 35.166 -19.209 1.00 1.00 C ATOM 0 H ALA A 105 5.316 35.617 -18.744 1.00 1.00 H new ATOM 0 HA ALA A 105 2.968 36.158 -17.323 1.00 1.00 H new ATOM 0 HB1 ALA A 105 1.873 34.963 -19.175 1.00 1.00 H new ATOM 0 HB2 ALA A 105 3.120 36.087 -19.764 1.00 1.00 H new ATOM 0 HB3 ALA A 105 3.454 34.340 -19.705 1.00 1.00 H new ATOM 1581 N ARG A 106 4.101 33.090 -17.076 1.00 1.00 N ATOM 1582 CA ARG A 106 3.938 31.818 -16.389 1.00 1.00 C ATOM 1583 C ARG A 106 4.735 31.780 -15.102 1.00 1.00 C ATOM 1584 O ARG A 106 4.251 31.310 -14.081 1.00 1.00 O ATOM 1585 CB ARG A 106 4.386 30.658 -17.272 1.00 1.00 C ATOM 1586 CG ARG A 106 4.113 30.896 -18.746 1.00 1.00 C ATOM 1587 CD ARG A 106 4.153 29.610 -19.554 1.00 1.00 C ATOM 1588 NE ARG A 106 3.150 29.622 -20.626 1.00 1.00 N ATOM 1589 CZ ARG A 106 1.917 29.115 -20.501 1.00 1.00 C ATOM 1590 NH1 ARG A 106 1.574 28.461 -19.403 1.00 1.00 N ATOM 1591 NH2 ARG A 106 1.032 29.242 -21.485 1.00 1.00 N ATOM 0 H ARG A 106 4.957 33.166 -17.626 1.00 1.00 H new ATOM 0 HA ARG A 106 2.877 31.717 -16.160 1.00 1.00 H new ATOM 0 HB2 ARG A 106 5.453 30.490 -17.128 1.00 1.00 H new ATOM 0 HB3 ARG A 106 3.875 29.749 -16.955 1.00 1.00 H new ATOM 0 HG2 ARG A 106 3.136 31.365 -18.861 1.00 1.00 H new ATOM 0 HG3 ARG A 106 4.850 31.594 -19.142 1.00 1.00 H new ATOM 0 HD2 ARG A 106 5.146 29.479 -19.984 1.00 1.00 H new ATOM 0 HD3 ARG A 106 3.975 28.759 -18.896 1.00 1.00 H new ATOM 0 HE ARG A 106 3.408 30.042 -21.519 1.00 1.00 H new ATOM 0 HH11 ARG A 106 2.250 28.342 -18.648 1.00 1.00 H new ATOM 0 HH12 ARG A 106 0.634 28.076 -19.311 1.00 1.00 H new ATOM 0 HH21 ARG A 106 1.290 29.729 -22.343 1.00 1.00 H new ATOM 0 HH22 ARG A 106 0.095 28.853 -21.381 1.00 1.00 H new ATOM 1605 N VAL A 107 5.952 32.302 -15.142 1.00 1.00 N ATOM 1606 CA VAL A 107 6.824 32.236 -13.989 1.00 1.00 C ATOM 1607 C VAL A 107 6.450 33.332 -12.985 1.00 1.00 C ATOM 1608 O VAL A 107 6.431 34.517 -13.320 1.00 1.00 O ATOM 1609 CB VAL A 107 8.312 32.375 -14.386 1.00 1.00 C ATOM 1610 CG1 VAL A 107 8.620 33.751 -14.905 1.00 1.00 C ATOM 1611 CG2 VAL A 107 9.214 32.040 -13.215 1.00 1.00 C ATOM 0 H VAL A 107 6.351 32.771 -15.955 1.00 1.00 H new ATOM 0 HA VAL A 107 6.691 31.256 -13.530 1.00 1.00 H new ATOM 0 HB VAL A 107 8.503 31.664 -15.190 1.00 1.00 H new ATOM 0 HG11 VAL A 107 9.675 33.811 -15.174 1.00 1.00 H new ATOM 0 HG12 VAL A 107 8.009 33.953 -15.785 1.00 1.00 H new ATOM 0 HG13 VAL A 107 8.400 34.489 -14.133 1.00 1.00 H new ATOM 0 HG21 VAL A 107 10.256 32.144 -13.517 1.00 1.00 H new ATOM 0 HG22 VAL A 107 9.006 32.720 -12.389 1.00 1.00 H new ATOM 0 HG23 VAL A 107 9.030 31.014 -12.896 1.00 1.00 H new ATOM 1621 N ARG A 108 6.088 32.944 -11.778 1.00 1.00 N ATOM 1622 CA ARG A 108 5.707 33.909 -10.761 1.00 1.00 C ATOM 1623 C ARG A 108 6.284 33.514 -9.417 1.00 1.00 C ATOM 1624 O ARG A 108 6.451 32.339 -9.125 1.00 1.00 O ATOM 1625 CB ARG A 108 4.186 34.004 -10.632 1.00 1.00 C ATOM 1626 CG ARG A 108 3.454 34.291 -11.928 1.00 1.00 C ATOM 1627 CD ARG A 108 3.799 35.667 -12.467 1.00 1.00 C ATOM 1628 NE ARG A 108 3.441 36.749 -11.543 1.00 1.00 N ATOM 1629 CZ ARG A 108 3.930 37.989 -11.635 1.00 1.00 C ATOM 1630 NH1 ARG A 108 4.787 38.295 -12.601 1.00 1.00 N ATOM 1631 NH2 ARG A 108 3.569 38.929 -10.766 1.00 1.00 N ATOM 0 H ARG A 108 6.049 31.970 -11.476 1.00 1.00 H new ATOM 0 HA ARG A 108 6.102 34.878 -11.066 1.00 1.00 H new ATOM 0 HB2 ARG A 108 3.811 33.067 -10.219 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.945 34.788 -9.914 1.00 1.00 H new ATOM 0 HG2 ARG A 108 3.712 33.534 -12.668 1.00 1.00 H new ATOM 0 HG3 ARG A 108 2.379 34.223 -11.763 1.00 1.00 H new ATOM 0 HD2 ARG A 108 4.868 35.713 -12.675 1.00 1.00 H new ATOM 0 HD3 ARG A 108 3.283 35.820 -13.415 1.00 1.00 H new ATOM 0 HE ARG A 108 2.784 36.544 -10.790 1.00 1.00 H new ATOM 0 HH11 ARG A 108 5.073 37.583 -13.274 1.00 1.00 H new ATOM 0 HH12 ARG A 108 5.160 39.242 -12.671 1.00 1.00 H new ATOM 0 HH21 ARG A 108 2.912 38.707 -10.018 1.00 1.00 H new ATOM 0 HH22 ARG A 108 3.950 39.872 -10.847 1.00 1.00 H new ATOM 1645 N MET A 109 6.573 34.504 -8.605 1.00 1.00 N ATOM 1646 CA MET A 109 7.119 34.269 -7.272 1.00 1.00 C ATOM 1647 C MET A 109 6.014 33.859 -6.311 1.00 1.00 C ATOM 1648 O MET A 109 4.960 34.484 -6.298 1.00 1.00 O ATOM 1649 CB MET A 109 7.807 35.529 -6.754 1.00 1.00 C ATOM 1650 CG MET A 109 9.057 35.907 -7.527 1.00 1.00 C ATOM 1651 SD MET A 109 10.420 34.775 -7.206 1.00 1.00 S ATOM 1652 CE MET A 109 10.605 35.003 -5.439 1.00 1.00 C ATOM 0 H MET A 109 6.441 35.488 -8.838 1.00 1.00 H new ATOM 0 HA MET A 109 7.850 33.463 -7.337 1.00 1.00 H new ATOM 0 HB2 MET A 109 7.102 36.359 -6.794 1.00 1.00 H new ATOM 0 HB3 MET A 109 8.069 35.384 -5.706 1.00 1.00 H new ATOM 0 HG2 MET A 109 8.835 35.913 -8.594 1.00 1.00 H new ATOM 0 HG3 MET A 109 9.357 36.920 -7.258 1.00 1.00 H new ATOM 0 HE1 MET A 109 11.663 35.089 -5.192 1.00 1.00 H new ATOM 0 HE2 MET A 109 10.086 35.911 -5.133 1.00 1.00 H new ATOM 0 HE3 MET A 109 10.178 34.148 -4.915 1.00 1.00 H new ATOM 1662 N LEU A 110 6.268 32.844 -5.481 1.00 1.00 N ATOM 1663 CA LEU A 110 5.282 32.367 -4.508 1.00 1.00 C ATOM 1664 C LEU A 110 4.780 33.510 -3.642 1.00 1.00 C ATOM 1665 O LEU A 110 3.582 33.775 -3.593 1.00 1.00 O ATOM 1666 CB LEU A 110 5.914 31.269 -3.625 1.00 1.00 C ATOM 1667 CG LEU A 110 4.987 30.568 -2.607 1.00 1.00 C ATOM 1668 CD1 LEU A 110 4.894 31.356 -1.311 1.00 1.00 C ATOM 1669 CD2 LEU A 110 3.597 30.351 -3.193 1.00 1.00 C ATOM 0 H LEU A 110 7.152 32.335 -5.464 1.00 1.00 H new ATOM 0 HA LEU A 110 4.431 31.952 -5.048 1.00 1.00 H new ATOM 0 HB2 LEU A 110 6.334 30.507 -4.281 1.00 1.00 H new ATOM 0 HB3 LEU A 110 6.746 31.712 -3.077 1.00 1.00 H new ATOM 0 HG LEU A 110 5.425 29.595 -2.384 1.00 1.00 H new ATOM 0 HD11 LEU A 110 4.235 30.836 -0.616 1.00 1.00 H new ATOM 0 HD12 LEU A 110 5.886 31.449 -0.869 1.00 1.00 H new ATOM 0 HD13 LEU A 110 4.494 32.349 -1.517 1.00 1.00 H new ATOM 0 HD21 LEU A 110 2.965 29.856 -2.456 1.00 1.00 H new ATOM 0 HD22 LEU A 110 3.160 31.314 -3.458 1.00 1.00 H new ATOM 0 HD23 LEU A 110 3.671 29.728 -4.084 1.00 1.00 H new ATOM 1681 N ARG A 111 5.696 34.237 -3.018 1.00 1.00 N ATOM 1682 CA ARG A 111 5.291 35.296 -2.112 1.00 1.00 C ATOM 1683 C ARG A 111 4.761 36.501 -2.872 1.00 1.00 C ATOM 1684 O ARG A 111 4.188 37.408 -2.284 1.00 1.00 O ATOM 1685 CB ARG A 111 6.423 35.732 -1.192 1.00 1.00 C ATOM 1686 CG ARG A 111 5.877 36.404 0.054 1.00 1.00 C ATOM 1687 CD ARG A 111 6.737 37.541 0.561 1.00 1.00 C ATOM 1688 NE ARG A 111 6.069 38.210 1.682 1.00 1.00 N ATOM 1689 CZ ARG A 111 6.460 38.122 2.952 1.00 1.00 C ATOM 1690 NH1 ARG A 111 7.552 37.441 3.272 1.00 1.00 N ATOM 1691 NH2 ARG A 111 5.742 38.705 3.904 1.00 1.00 N ATOM 0 H ARG A 111 6.704 34.116 -3.120 1.00 1.00 H new ATOM 0 HA ARG A 111 4.493 34.882 -1.496 1.00 1.00 H new ATOM 0 HB2 ARG A 111 7.023 34.866 -0.911 1.00 1.00 H new ATOM 0 HB3 ARG A 111 7.084 36.419 -1.721 1.00 1.00 H new ATOM 0 HG2 ARG A 111 4.877 36.783 -0.157 1.00 1.00 H new ATOM 0 HG3 ARG A 111 5.775 35.658 0.843 1.00 1.00 H new ATOM 0 HD2 ARG A 111 7.708 37.161 0.879 1.00 1.00 H new ATOM 0 HD3 ARG A 111 6.922 38.255 -0.242 1.00 1.00 H new ATOM 0 HE ARG A 111 5.250 38.781 1.475 1.00 1.00 H new ATOM 0 HH11 ARG A 111 8.098 36.981 2.544 1.00 1.00 H new ATOM 0 HH12 ARG A 111 7.846 37.377 4.247 1.00 1.00 H new ATOM 0 HH21 ARG A 111 4.894 39.218 3.662 1.00 1.00 H new ATOM 0 HH22 ARG A 111 6.038 38.640 4.878 1.00 1.00 H new ATOM 1705 N SER A 112 4.929 36.504 -4.182 1.00 1.00 N ATOM 1706 CA SER A 112 4.427 37.594 -4.991 1.00 1.00 C ATOM 1707 C SER A 112 2.908 37.471 -5.141 1.00 1.00 C ATOM 1708 O SER A 112 2.261 38.342 -5.720 1.00 1.00 O ATOM 1709 CB SER A 112 5.133 37.612 -6.349 1.00 1.00 C ATOM 1710 OG SER A 112 4.686 38.686 -7.159 1.00 1.00 O ATOM 0 H SER A 112 5.406 35.768 -4.703 1.00 1.00 H new ATOM 0 HA SER A 112 4.639 38.543 -4.499 1.00 1.00 H new ATOM 0 HB2 SER A 112 6.209 37.694 -6.198 1.00 1.00 H new ATOM 0 HB3 SER A 112 4.954 36.669 -6.865 1.00 1.00 H new ATOM 0 HG SER A 112 3.742 38.868 -6.969 1.00 1.00 H new ATOM 1716 N PHE A 113 2.344 36.365 -4.637 1.00 1.00 N ATOM 1717 CA PHE A 113 0.904 36.158 -4.614 1.00 1.00 C ATOM 1718 C PHE A 113 0.347 36.605 -3.258 1.00 1.00 C ATOM 1719 O PHE A 113 -0.860 36.764 -3.079 1.00 1.00 O ATOM 1720 CB PHE A 113 0.604 34.664 -4.834 1.00 1.00 C ATOM 1721 CG PHE A 113 0.970 34.150 -6.200 1.00 1.00 C ATOM 1722 CD1 PHE A 113 0.075 34.247 -7.251 1.00 1.00 C ATOM 1723 CD2 PHE A 113 2.198 33.547 -6.428 1.00 1.00 C ATOM 1724 CE1 PHE A 113 0.397 33.759 -8.502 1.00 1.00 C ATOM 1725 CE2 PHE A 113 2.526 33.055 -7.677 1.00 1.00 C ATOM 1726 CZ PHE A 113 1.622 33.161 -8.715 1.00 1.00 C ATOM 0 H PHE A 113 2.879 35.594 -4.236 1.00 1.00 H new ATOM 0 HA PHE A 113 0.434 36.742 -5.405 1.00 1.00 H new ATOM 0 HB2 PHE A 113 1.143 34.084 -4.085 1.00 1.00 H new ATOM 0 HB3 PHE A 113 -0.459 34.491 -4.667 1.00 1.00 H new ATOM 0 HD1 PHE A 113 -0.887 34.710 -7.091 1.00 1.00 H new ATOM 0 HD2 PHE A 113 2.908 33.461 -5.618 1.00 1.00 H new ATOM 0 HE1 PHE A 113 -0.310 33.845 -9.314 1.00 1.00 H new ATOM 0 HE2 PHE A 113 3.486 32.589 -7.841 1.00 1.00 H new ATOM 0 HZ PHE A 113 1.873 32.776 -9.692 1.00 1.00 H new ATOM 1736 N ASP A 114 1.265 36.823 -2.317 1.00 1.00 N ATOM 1737 CA ASP A 114 0.936 37.212 -0.942 1.00 1.00 C ATOM 1738 C ASP A 114 0.445 38.660 -0.870 1.00 1.00 C ATOM 1739 O ASP A 114 1.068 39.559 -1.425 1.00 1.00 O ATOM 1740 CB ASP A 114 2.195 37.035 -0.066 1.00 1.00 C ATOM 1741 CG ASP A 114 2.107 37.684 1.302 1.00 1.00 C ATOM 1742 OD1 ASP A 114 1.049 37.598 1.948 1.00 1.00 O ATOM 1743 OD2 ASP A 114 3.112 38.300 1.724 1.00 1.00 O ATOM 0 H ASP A 114 2.267 36.734 -2.487 1.00 1.00 H new ATOM 0 HA ASP A 114 0.128 36.576 -0.579 1.00 1.00 H new ATOM 0 HB2 ASP A 114 2.385 35.970 0.063 1.00 1.00 H new ATOM 0 HB3 ASP A 114 3.052 37.450 -0.596 1.00 1.00 H new ATOM 2056 N GLU A 136 7.192 26.937 10.557 1.00 1.00 N ATOM 2057 CA GLU A 136 5.845 27.467 10.456 1.00 1.00 C ATOM 2058 C GLU A 136 5.846 28.896 9.936 1.00 1.00 C ATOM 2059 O GLU A 136 4.816 29.398 9.489 1.00 1.00 O ATOM 2060 CB GLU A 136 5.123 27.355 11.797 1.00 1.00 C ATOM 2061 CG GLU A 136 5.036 25.919 12.288 1.00 1.00 C ATOM 2062 CD GLU A 136 3.856 25.681 13.201 1.00 1.00 C ATOM 2063 OE1 GLU A 136 3.991 25.889 14.424 1.00 1.00 O ATOM 2064 OE2 GLU A 136 2.795 25.262 12.701 1.00 1.00 O ATOM 0 HA GLU A 136 5.298 26.866 9.730 1.00 1.00 H new ATOM 0 HB2 GLU A 136 5.644 27.959 12.539 1.00 1.00 H new ATOM 0 HB3 GLU A 136 4.118 27.765 11.701 1.00 1.00 H new ATOM 0 HG2 GLU A 136 4.966 25.250 11.430 1.00 1.00 H new ATOM 0 HG3 GLU A 136 5.955 25.664 12.816 1.00 1.00 H new ATOM 2071 N GLU A 137 6.994 29.561 10.005 1.00 1.00 N ATOM 2072 CA GLU A 137 7.118 30.885 9.418 1.00 1.00 C ATOM 2073 C GLU A 137 6.943 30.765 7.916 1.00 1.00 C ATOM 2074 O GLU A 137 6.149 31.480 7.315 1.00 1.00 O ATOM 2075 CB GLU A 137 8.462 31.525 9.749 1.00 1.00 C ATOM 2076 CG GLU A 137 8.670 32.877 9.082 1.00 1.00 C ATOM 2077 CD GLU A 137 7.569 33.875 9.399 1.00 1.00 C ATOM 2078 OE1 GLU A 137 7.170 33.980 10.579 1.00 1.00 O ATOM 2079 OE2 GLU A 137 7.091 34.553 8.465 1.00 1.00 O ATOM 0 H GLU A 137 7.839 29.210 10.455 1.00 1.00 H new ATOM 0 HA GLU A 137 6.347 31.531 9.837 1.00 1.00 H new ATOM 0 HB2 GLU A 137 8.542 31.645 10.829 1.00 1.00 H new ATOM 0 HB3 GLU A 137 9.262 30.851 9.443 1.00 1.00 H new ATOM 0 HG2 GLU A 137 9.628 33.289 9.400 1.00 1.00 H new ATOM 0 HG3 GLU A 137 8.726 32.738 8.002 1.00 1.00 H new ATOM 2086 N VAL A 138 7.635 29.797 7.327 1.00 1.00 N ATOM 2087 CA VAL A 138 7.503 29.517 5.902 1.00 1.00 C ATOM 2088 C VAL A 138 6.068 29.100 5.589 1.00 1.00 C ATOM 2089 O VAL A 138 5.506 29.465 4.556 1.00 1.00 O ATOM 2090 CB VAL A 138 8.461 28.406 5.473 1.00 1.00 C ATOM 2091 CG1 VAL A 138 8.276 28.052 4.007 1.00 1.00 C ATOM 2092 CG2 VAL A 138 9.899 28.799 5.758 1.00 1.00 C ATOM 0 H VAL A 138 8.295 29.191 7.815 1.00 1.00 H new ATOM 0 HA VAL A 138 7.753 30.423 5.351 1.00 1.00 H new ATOM 0 HB VAL A 138 8.226 27.517 6.059 1.00 1.00 H new ATOM 0 HG11 VAL A 138 8.972 27.259 3.734 1.00 1.00 H new ATOM 0 HG12 VAL A 138 7.254 27.711 3.841 1.00 1.00 H new ATOM 0 HG13 VAL A 138 8.469 28.932 3.393 1.00 1.00 H new ATOM 0 HG21 VAL A 138 10.565 27.995 5.445 1.00 1.00 H new ATOM 0 HG22 VAL A 138 10.144 29.707 5.208 1.00 1.00 H new ATOM 0 HG23 VAL A 138 10.022 28.978 6.826 1.00 1.00 H new ATOM 2102 N PHE A 139 5.508 28.296 6.486 1.00 1.00 N ATOM 2103 CA PHE A 139 4.108 27.893 6.399 1.00 1.00 C ATOM 2104 C PHE A 139 3.235 29.135 6.270 1.00 1.00 C ATOM 2105 O PHE A 139 2.370 29.210 5.395 1.00 1.00 O ATOM 2106 CB PHE A 139 3.701 27.053 7.622 1.00 1.00 C ATOM 2107 CG PHE A 139 2.211 26.914 7.812 1.00 1.00 C ATOM 2108 CD1 PHE A 139 1.489 27.874 8.513 1.00 1.00 C ATOM 2109 CD2 PHE A 139 1.535 25.820 7.297 1.00 1.00 C ATOM 2110 CE1 PHE A 139 0.126 27.741 8.693 1.00 1.00 C ATOM 2111 CE2 PHE A 139 0.172 25.683 7.478 1.00 1.00 C ATOM 2112 CZ PHE A 139 -0.533 26.643 8.176 1.00 1.00 C ATOM 0 H PHE A 139 6.006 27.908 7.287 1.00 1.00 H new ATOM 0 HA PHE A 139 3.969 27.268 5.517 1.00 1.00 H new ATOM 0 HB2 PHE A 139 4.138 26.059 7.527 1.00 1.00 H new ATOM 0 HB3 PHE A 139 4.129 27.505 8.517 1.00 1.00 H new ATOM 0 HD1 PHE A 139 2.000 28.733 8.921 1.00 1.00 H new ATOM 0 HD2 PHE A 139 2.079 25.066 6.748 1.00 1.00 H new ATOM 0 HE1 PHE A 139 -0.424 28.495 9.237 1.00 1.00 H new ATOM 0 HE2 PHE A 139 -0.342 24.824 7.073 1.00 1.00 H new ATOM 0 HZ PHE A 139 -1.598 26.536 8.318 1.00 1.00 H new ATOM 2122 N ALA A 140 3.508 30.115 7.128 1.00 1.00 N ATOM 2123 CA ALA A 140 2.808 31.392 7.103 1.00 1.00 C ATOM 2124 C ALA A 140 3.006 32.074 5.758 1.00 1.00 C ATOM 2125 O ALA A 140 2.066 32.617 5.193 1.00 1.00 O ATOM 2126 CB ALA A 140 3.305 32.290 8.223 1.00 1.00 C ATOM 0 H ALA A 140 4.218 30.045 7.857 1.00 1.00 H new ATOM 0 HA ALA A 140 1.744 31.207 7.250 1.00 1.00 H new ATOM 0 HB1 ALA A 140 2.772 33.240 8.191 1.00 1.00 H new ATOM 0 HB2 ALA A 140 3.127 31.806 9.183 1.00 1.00 H new ATOM 0 HB3 ALA A 140 4.373 32.468 8.099 1.00 1.00 H new ATOM 2132 N VAL A 141 4.238 32.039 5.254 1.00 1.00 N ATOM 2133 CA VAL A 141 4.550 32.618 3.946 1.00 1.00 C ATOM 2134 C VAL A 141 3.638 32.039 2.876 1.00 1.00 C ATOM 2135 O VAL A 141 2.987 32.762 2.125 1.00 1.00 O ATOM 2136 CB VAL A 141 6.005 32.317 3.504 1.00 1.00 C ATOM 2137 CG1 VAL A 141 6.405 33.181 2.320 1.00 1.00 C ATOM 2138 CG2 VAL A 141 6.994 32.465 4.645 1.00 1.00 C ATOM 0 H VAL A 141 5.036 31.617 5.729 1.00 1.00 H new ATOM 0 HA VAL A 141 4.411 33.694 4.052 1.00 1.00 H new ATOM 0 HB VAL A 141 6.033 31.273 3.191 1.00 1.00 H new ATOM 0 HG11 VAL A 141 7.430 32.950 2.030 1.00 1.00 H new ATOM 0 HG12 VAL A 141 5.737 32.981 1.482 1.00 1.00 H new ATOM 0 HG13 VAL A 141 6.335 34.233 2.597 1.00 1.00 H new ATOM 0 HG21 VAL A 141 7.999 32.244 4.286 1.00 1.00 H new ATOM 0 HG22 VAL A 141 6.961 33.486 5.025 1.00 1.00 H new ATOM 0 HG23 VAL A 141 6.734 31.771 5.445 1.00 1.00 H new ATOM 2148 N ILE A 142 3.583 30.722 2.844 1.00 1.00 N ATOM 2149 CA ILE A 142 2.790 30.008 1.865 1.00 1.00 C ATOM 2150 C ILE A 142 1.303 30.244 2.054 1.00 1.00 C ATOM 2151 O ILE A 142 0.609 30.568 1.099 1.00 1.00 O ATOM 2152 CB ILE A 142 3.094 28.510 1.933 1.00 1.00 C ATOM 2153 CG1 ILE A 142 4.505 28.263 1.414 1.00 1.00 C ATOM 2154 CG2 ILE A 142 2.068 27.720 1.137 1.00 1.00 C ATOM 2155 CD1 ILE A 142 5.283 27.263 2.229 1.00 1.00 C ATOM 0 H ILE A 142 4.086 30.119 3.495 1.00 1.00 H new ATOM 0 HA ILE A 142 3.062 30.392 0.882 1.00 1.00 H new ATOM 0 HB ILE A 142 3.034 28.172 2.967 1.00 1.00 H new ATOM 0 HG12 ILE A 142 4.448 27.913 0.383 1.00 1.00 H new ATOM 0 HG13 ILE A 142 5.048 29.208 1.400 1.00 1.00 H new ATOM 0 HG21 ILE A 142 2.301 26.657 1.197 1.00 1.00 H new ATOM 0 HG22 ILE A 142 1.074 27.898 1.547 1.00 1.00 H new ATOM 0 HG23 ILE A 142 2.092 28.038 0.095 1.00 1.00 H new ATOM 0 HD11 ILE A 142 6.277 27.139 1.800 1.00 1.00 H new ATOM 0 HD12 ILE A 142 5.373 27.621 3.255 1.00 1.00 H new ATOM 0 HD13 ILE A 142 4.763 26.305 2.223 1.00 1.00 H new ATOM 2167 N GLU A 143 0.814 30.066 3.278 1.00 1.00 N ATOM 2168 CA GLU A 143 -0.607 30.270 3.561 1.00 1.00 C ATOM 2169 C GLU A 143 -1.022 31.675 3.147 1.00 1.00 C ATOM 2170 O GLU A 143 -2.146 31.892 2.698 1.00 1.00 O ATOM 2171 CB GLU A 143 -0.930 30.045 5.043 1.00 1.00 C ATOM 2172 CG GLU A 143 -0.595 31.236 5.928 1.00 1.00 C ATOM 2173 CD GLU A 143 -1.132 31.106 7.340 1.00 1.00 C ATOM 2174 OE1 GLU A 143 -2.281 30.639 7.503 1.00 1.00 O ATOM 2175 OE2 GLU A 143 -0.426 31.506 8.291 1.00 1.00 O ATOM 0 H GLU A 143 1.372 29.784 4.084 1.00 1.00 H new ATOM 0 HA GLU A 143 -1.169 29.536 2.983 1.00 1.00 H new ATOM 0 HB2 GLU A 143 -1.991 29.815 5.144 1.00 1.00 H new ATOM 0 HB3 GLU A 143 -0.380 29.173 5.398 1.00 1.00 H new ATOM 0 HG2 GLU A 143 0.488 31.356 5.968 1.00 1.00 H new ATOM 0 HG3 GLU A 143 -1.000 32.141 5.475 1.00 1.00 H new ATOM 2182 N SER A 144 -0.096 32.618 3.294 1.00 1.00 N ATOM 2183 CA SER A 144 -0.339 34.004 2.937 1.00 1.00 C ATOM 2184 C SER A 144 -0.377 34.166 1.427 1.00 1.00 C ATOM 2185 O SER A 144 -1.033 35.054 0.902 1.00 1.00 O ATOM 2186 CB SER A 144 0.740 34.890 3.549 1.00 1.00 C ATOM 2187 OG SER A 144 0.679 34.853 4.962 1.00 1.00 O ATOM 0 H SER A 144 0.838 32.440 3.662 1.00 1.00 H new ATOM 0 HA SER A 144 -1.308 34.308 3.332 1.00 1.00 H new ATOM 0 HB2 SER A 144 1.723 34.558 3.214 1.00 1.00 H new ATOM 0 HB3 SER A 144 0.615 35.916 3.202 1.00 1.00 H new ATOM 0 HG SER A 144 1.055 34.007 5.284 1.00 1.00 H new ATOM 2193 N ALA A 145 0.344 33.307 0.731 1.00 1.00 N ATOM 2194 CA ALA A 145 0.385 33.354 -0.718 1.00 1.00 C ATOM 2195 C ALA A 145 -0.735 32.554 -1.338 1.00 1.00 C ATOM 2196 O ALA A 145 -1.097 32.792 -2.485 1.00 1.00 O ATOM 2197 CB ALA A 145 1.713 32.858 -1.249 1.00 1.00 C ATOM 0 H ALA A 145 0.910 32.567 1.147 1.00 1.00 H new ATOM 0 HA ALA A 145 0.259 34.400 -0.997 1.00 1.00 H new ATOM 0 HB1 ALA A 145 1.710 32.906 -2.338 1.00 1.00 H new ATOM 0 HB2 ALA A 145 2.517 33.483 -0.860 1.00 1.00 H new ATOM 0 HB3 ALA A 145 1.869 31.827 -0.932 1.00 1.00 H new ATOM 2203 N LEU A 146 -1.286 31.597 -0.605 1.00 1.00 N ATOM 2204 CA LEU A 146 -2.355 30.768 -1.141 1.00 1.00 C ATOM 2205 C LEU A 146 -3.572 31.597 -1.613 1.00 1.00 C ATOM 2206 O LEU A 146 -4.164 31.259 -2.630 1.00 1.00 O ATOM 2207 CB LEU A 146 -2.784 29.708 -0.121 1.00 1.00 C ATOM 2208 CG LEU A 146 -1.667 28.764 0.350 1.00 1.00 C ATOM 2209 CD1 LEU A 146 -2.246 27.511 0.987 1.00 1.00 C ATOM 2210 CD2 LEU A 146 -0.750 28.395 -0.807 1.00 1.00 C ATOM 0 H LEU A 146 -1.014 31.377 0.353 1.00 1.00 H new ATOM 0 HA LEU A 146 -1.953 30.267 -2.022 1.00 1.00 H new ATOM 0 HB2 LEU A 146 -3.202 30.213 0.750 1.00 1.00 H new ATOM 0 HB3 LEU A 146 -3.584 29.110 -0.557 1.00 1.00 H new ATOM 0 HG LEU A 146 -1.080 29.290 1.103 1.00 1.00 H new ATOM 0 HD11 LEU A 146 -1.435 26.860 1.312 1.00 1.00 H new ATOM 0 HD12 LEU A 146 -2.855 27.788 1.847 1.00 1.00 H new ATOM 0 HD13 LEU A 146 -2.864 26.985 0.259 1.00 1.00 H new ATOM 0 HD21 LEU A 146 0.034 27.726 -0.451 1.00 1.00 H new ATOM 0 HD22 LEU A 146 -1.328 27.895 -1.584 1.00 1.00 H new ATOM 0 HD23 LEU A 146 -0.298 29.299 -1.215 1.00 1.00 H new ATOM 2222 N PRO A 147 -3.959 32.701 -0.909 1.00 1.00 N ATOM 2223 CA PRO A 147 -5.078 33.568 -1.332 1.00 1.00 C ATOM 2224 C PRO A 147 -4.747 34.331 -2.611 1.00 1.00 C ATOM 2225 O PRO A 147 -5.621 34.886 -3.273 1.00 1.00 O ATOM 2226 CB PRO A 147 -5.237 34.548 -0.167 1.00 1.00 C ATOM 2227 CG PRO A 147 -3.901 34.577 0.477 1.00 1.00 C ATOM 2228 CD PRO A 147 -3.363 33.187 0.345 1.00 1.00 C ATOM 0 HA PRO A 147 -5.979 32.995 -1.549 1.00 1.00 H new ATOM 0 HB2 PRO A 147 -5.530 35.537 -0.518 1.00 1.00 H new ATOM 0 HB3 PRO A 147 -6.007 34.215 0.530 1.00 1.00 H new ATOM 0 HG2 PRO A 147 -3.246 35.299 -0.010 1.00 1.00 H new ATOM 0 HG3 PRO A 147 -3.976 34.871 1.524 1.00 1.00 H new ATOM 0 HD2 PRO A 147 -2.274 33.182 0.299 1.00 1.00 H new ATOM 0 HD3 PRO A 147 -3.650 32.564 1.192 1.00 1.00 H new ATOM 2236 N GLY A 148 -3.477 34.290 -2.970 1.00 1.00 N ATOM 2237 CA GLY A 148 -3.025 34.947 -4.174 1.00 1.00 C ATOM 2238 C GLY A 148 -2.779 33.944 -5.276 1.00 1.00 C ATOM 2239 O GLY A 148 -3.078 34.194 -6.443 1.00 1.00 O ATOM 0 H GLY A 148 -2.746 33.810 -2.445 1.00 1.00 H new ATOM 0 HA2 GLY A 148 -3.770 35.674 -4.498 1.00 1.00 H new ATOM 0 HA3 GLY A 148 -2.108 35.500 -3.969 1.00 1.00 H new ATOM 2243 N LEU A 149 -2.303 32.768 -4.882 1.00 1.00 N ATOM 2244 CA LEU A 149 -2.010 31.701 -5.823 1.00 1.00 C ATOM 2245 C LEU A 149 -3.322 31.064 -6.271 1.00 1.00 C ATOM 2246 O LEU A 149 -3.502 30.744 -7.444 1.00 1.00 O ATOM 2247 CB LEU A 149 -1.078 30.664 -5.173 1.00 1.00 C ATOM 2248 CG LEU A 149 -0.328 29.773 -6.144 1.00 1.00 C ATOM 2249 CD1 LEU A 149 0.430 30.565 -7.171 1.00 1.00 C ATOM 2250 CD2 LEU A 149 0.602 28.843 -5.403 1.00 1.00 C ATOM 0 H LEU A 149 -2.112 32.532 -3.908 1.00 1.00 H new ATOM 0 HA LEU A 149 -1.497 32.103 -6.697 1.00 1.00 H new ATOM 0 HB2 LEU A 149 -0.352 31.190 -4.552 1.00 1.00 H new ATOM 0 HB3 LEU A 149 -1.669 30.034 -4.508 1.00 1.00 H new ATOM 0 HG LEU A 149 -1.072 29.180 -6.676 1.00 1.00 H new ATOM 0 HD11 LEU A 149 0.951 29.884 -7.844 1.00 1.00 H new ATOM 0 HD12 LEU A 149 -0.266 31.179 -7.743 1.00 1.00 H new ATOM 0 HD13 LEU A 149 1.155 31.208 -6.672 1.00 1.00 H new ATOM 0 HD21 LEU A 149 1.131 28.212 -6.117 1.00 1.00 H new ATOM 0 HD22 LEU A 149 1.323 29.428 -4.832 1.00 1.00 H new ATOM 0 HD23 LEU A 149 0.024 28.216 -4.723 1.00 1.00 H new ATOM 2262 N HIS A 150 -4.227 30.888 -5.307 1.00 1.00 N ATOM 2263 CA HIS A 150 -5.579 30.393 -5.581 1.00 1.00 C ATOM 2264 C HIS A 150 -6.238 31.248 -6.638 1.00 1.00 C ATOM 2265 O HIS A 150 -6.677 30.757 -7.670 1.00 1.00 O ATOM 2266 CB HIS A 150 -6.453 30.487 -4.334 1.00 1.00 C ATOM 2267 CG HIS A 150 -6.877 29.182 -3.763 1.00 1.00 C ATOM 2268 ND1 HIS A 150 -7.917 28.431 -4.264 1.00 1.00 N ATOM 2269 CD2 HIS A 150 -6.425 28.528 -2.680 1.00 1.00 C ATOM 2270 CE1 HIS A 150 -8.092 27.370 -3.498 1.00 1.00 C ATOM 2271 NE2 HIS A 150 -7.196 27.403 -2.523 1.00 1.00 N ATOM 0 H HIS A 150 -4.047 31.082 -4.322 1.00 1.00 H new ATOM 0 HA HIS A 150 -5.486 29.357 -5.908 1.00 1.00 H new ATOM 0 HB2 HIS A 150 -5.910 31.042 -3.569 1.00 1.00 H new ATOM 0 HB3 HIS A 150 -7.344 31.067 -4.576 1.00 1.00 H new ATOM 0 HD2 HIS A 150 -5.604 28.832 -2.048 1.00 1.00 H new ATOM 0 HE1 HIS A 150 -8.840 26.604 -3.642 1.00 1.00 H new ATOM 0 HE2 HIS A 150 -7.096 26.710 -1.781 1.00 1.00 H new ATOM 2280 N ASP A 151 -6.242 32.546 -6.381 1.00 1.00 N ATOM 2281 CA ASP A 151 -6.904 33.506 -7.251 1.00 1.00 C ATOM 2282 C ASP A 151 -6.350 33.423 -8.659 1.00 1.00 C ATOM 2283 O ASP A 151 -7.098 33.381 -9.632 1.00 1.00 O ATOM 2284 CB ASP A 151 -6.701 34.918 -6.696 1.00 1.00 C ATOM 2285 CG ASP A 151 -7.616 35.950 -7.327 1.00 1.00 C ATOM 2286 OD1 ASP A 151 -8.779 36.067 -6.885 1.00 1.00 O ATOM 2287 OD2 ASP A 151 -7.166 36.676 -8.236 1.00 1.00 O ATOM 0 H ASP A 151 -5.789 32.963 -5.568 1.00 1.00 H new ATOM 0 HA ASP A 151 -7.968 33.274 -7.286 1.00 1.00 H new ATOM 0 HB2 ASP A 151 -6.869 34.905 -5.619 1.00 1.00 H new ATOM 0 HB3 ASP A 151 -5.665 35.217 -6.854 1.00 1.00 H new ATOM 2292 N TRP A 152 -5.034 33.332 -8.746 1.00 1.00 N ATOM 2293 CA TRP A 152 -4.356 33.250 -10.022 1.00 1.00 C ATOM 2294 C TRP A 152 -4.775 31.994 -10.767 1.00 1.00 C ATOM 2295 O TRP A 152 -5.265 32.072 -11.891 1.00 1.00 O ATOM 2296 CB TRP A 152 -2.845 33.265 -9.796 1.00 1.00 C ATOM 2297 CG TRP A 152 -2.047 33.476 -11.052 1.00 1.00 C ATOM 2298 CD1 TRP A 152 -1.419 34.627 -11.439 1.00 1.00 C ATOM 2299 CD2 TRP A 152 -1.792 32.514 -12.087 1.00 1.00 C ATOM 2300 NE1 TRP A 152 -0.781 34.435 -12.641 1.00 1.00 N ATOM 2301 CE2 TRP A 152 -0.997 33.146 -13.058 1.00 1.00 C ATOM 2302 CE3 TRP A 152 -2.146 31.174 -12.282 1.00 1.00 C ATOM 2303 CZ2 TRP A 152 -0.568 32.492 -14.209 1.00 1.00 C ATOM 2304 CZ3 TRP A 152 -1.720 30.528 -13.425 1.00 1.00 C ATOM 2305 CH2 TRP A 152 -0.932 31.186 -14.372 1.00 1.00 C ATOM 0 H TRP A 152 -4.412 33.313 -7.938 1.00 1.00 H new ATOM 0 HA TRP A 152 -4.633 34.110 -10.632 1.00 1.00 H new ATOM 0 HB2 TRP A 152 -2.601 34.054 -9.085 1.00 1.00 H new ATOM 0 HB3 TRP A 152 -2.546 32.321 -9.340 1.00 1.00 H new ATOM 0 HD1 TRP A 152 -1.424 35.552 -10.882 1.00 1.00 H new ATOM 0 HE1 TRP A 152 -0.236 35.137 -13.142 1.00 1.00 H new ATOM 0 HE3 TRP A 152 -2.744 30.653 -11.549 1.00 1.00 H new ATOM 0 HZ2 TRP A 152 0.033 33.000 -14.949 1.00 1.00 H new ATOM 0 HZ3 TRP A 152 -2.000 29.498 -13.590 1.00 1.00 H new ATOM 0 HH2 TRP A 152 -0.604 30.651 -15.251 1.00 1.00 H new ATOM 2316 N VAL A 153 -4.611 30.841 -10.140 1.00 1.00 N ATOM 2317 CA VAL A 153 -4.943 29.585 -10.795 1.00 1.00 C ATOM 2318 C VAL A 153 -6.433 29.522 -11.143 1.00 1.00 C ATOM 2319 O VAL A 153 -6.785 29.175 -12.270 1.00 1.00 O ATOM 2320 CB VAL A 153 -4.523 28.351 -9.957 1.00 1.00 C ATOM 2321 CG1 VAL A 153 -3.060 28.451 -9.575 1.00 1.00 C ATOM 2322 CG2 VAL A 153 -5.365 28.184 -8.703 1.00 1.00 C ATOM 0 H VAL A 153 -4.254 30.747 -9.189 1.00 1.00 H new ATOM 0 HA VAL A 153 -4.369 29.554 -11.721 1.00 1.00 H new ATOM 0 HB VAL A 153 -4.687 27.474 -10.583 1.00 1.00 H new ATOM 0 HG11 VAL A 153 -2.777 27.578 -8.987 1.00 1.00 H new ATOM 0 HG12 VAL A 153 -2.450 28.493 -10.478 1.00 1.00 H new ATOM 0 HG13 VAL A 153 -2.899 29.354 -8.986 1.00 1.00 H new ATOM 0 HG21 VAL A 153 -5.029 27.305 -8.153 1.00 1.00 H new ATOM 0 HG22 VAL A 153 -5.260 29.068 -8.074 1.00 1.00 H new ATOM 0 HG23 VAL A 153 -6.411 28.059 -8.981 1.00 1.00 H new ATOM 2332 N ASP A 154 -7.292 29.935 -10.206 1.00 1.00 N ATOM 2333 CA ASP A 154 -8.737 29.928 -10.425 1.00 1.00 C ATOM 2334 C ASP A 154 -9.108 30.809 -11.614 1.00 1.00 C ATOM 2335 O ASP A 154 -9.810 30.380 -12.530 1.00 1.00 O ATOM 2336 CB ASP A 154 -9.494 30.393 -9.167 1.00 1.00 C ATOM 2337 CG ASP A 154 -9.769 29.271 -8.173 1.00 1.00 C ATOM 2338 OD1 ASP A 154 -10.700 28.477 -8.419 1.00 1.00 O ATOM 2339 OD2 ASP A 154 -9.082 29.198 -7.121 1.00 1.00 O ATOM 0 H ASP A 154 -7.009 30.278 -9.288 1.00 1.00 H new ATOM 0 HA ASP A 154 -9.032 28.901 -10.642 1.00 1.00 H new ATOM 0 HB2 ASP A 154 -8.915 31.173 -8.672 1.00 1.00 H new ATOM 0 HB3 ASP A 154 -10.441 30.842 -9.468 1.00 1.00 H new ATOM 2344 N GLU A 155 -8.592 32.034 -11.605 1.00 1.00 N ATOM 2345 CA GLU A 155 -8.891 32.999 -12.655 1.00 1.00 C ATOM 2346 C GLU A 155 -8.382 32.497 -14.006 1.00 1.00 C ATOM 2347 O GLU A 155 -9.074 32.597 -15.013 1.00 1.00 O ATOM 2348 CB GLU A 155 -8.271 34.374 -12.349 1.00 1.00 C ATOM 2349 CG GLU A 155 -6.821 34.502 -12.794 1.00 1.00 C ATOM 2350 CD GLU A 155 -6.280 35.912 -12.713 1.00 1.00 C ATOM 2351 OE1 GLU A 155 -6.865 36.815 -13.338 1.00 1.00 O ATOM 2352 OE2 GLU A 155 -5.297 36.132 -11.973 1.00 1.00 O ATOM 0 H GLU A 155 -7.964 32.381 -10.880 1.00 1.00 H new ATOM 0 HA GLU A 155 -9.974 33.111 -12.696 1.00 1.00 H new ATOM 0 HB2 GLU A 155 -8.862 35.147 -12.840 1.00 1.00 H new ATOM 0 HB3 GLU A 155 -8.331 34.560 -11.277 1.00 1.00 H new ATOM 0 HG2 GLU A 155 -6.203 33.850 -12.178 1.00 1.00 H new ATOM 0 HG3 GLU A 155 -6.733 34.148 -13.821 1.00 1.00 H new ATOM 2359 N ARG A 156 -7.207 31.878 -13.989 1.00 1.00 N ATOM 2360 CA ARG A 156 -6.565 31.427 -15.212 1.00 1.00 C ATOM 2361 C ARG A 156 -7.267 30.213 -15.781 1.00 1.00 C ATOM 2362 O ARG A 156 -7.595 30.174 -16.963 1.00 1.00 O ATOM 2363 CB ARG A 156 -5.100 31.102 -14.960 1.00 1.00 C ATOM 2364 CG ARG A 156 -4.248 32.318 -14.647 1.00 1.00 C ATOM 2365 CD ARG A 156 -4.672 33.516 -15.463 1.00 1.00 C ATOM 2366 NE ARG A 156 -4.007 34.740 -15.017 1.00 1.00 N ATOM 2367 CZ ARG A 156 -3.056 35.372 -15.699 1.00 1.00 C ATOM 2368 NH1 ARG A 156 -2.628 34.895 -16.861 1.00 1.00 N ATOM 2369 NH2 ARG A 156 -2.531 36.491 -15.212 1.00 1.00 N ATOM 0 H ARG A 156 -6.681 31.678 -13.138 1.00 1.00 H new ATOM 0 HA ARG A 156 -6.631 32.238 -15.938 1.00 1.00 H new ATOM 0 HB2 ARG A 156 -5.031 30.398 -14.130 1.00 1.00 H new ATOM 0 HB3 ARG A 156 -4.692 30.601 -15.838 1.00 1.00 H new ATOM 0 HG2 ARG A 156 -4.325 32.554 -13.586 1.00 1.00 H new ATOM 0 HG3 ARG A 156 -3.201 32.092 -14.848 1.00 1.00 H new ATOM 0 HD2 ARG A 156 -4.442 33.340 -16.514 1.00 1.00 H new ATOM 0 HD3 ARG A 156 -5.752 33.642 -15.390 1.00 1.00 H new ATOM 0 HE ARG A 156 -4.292 35.136 -14.121 1.00 1.00 H new ATOM 0 HH11 ARG A 156 -3.029 34.036 -17.239 1.00 1.00 H new ATOM 0 HH12 ARG A 156 -1.898 35.387 -17.377 1.00 1.00 H new ATOM 0 HH21 ARG A 156 -2.858 36.861 -14.319 1.00 1.00 H new ATOM 0 HH22 ARG A 156 -1.801 36.980 -15.731 1.00 1.00 H new ATOM 2383 N LEU A 157 -7.536 29.246 -14.915 1.00 1.00 N ATOM 2384 CA LEU A 157 -8.185 28.006 -15.332 1.00 1.00 C ATOM 2385 C LEU A 157 -9.569 28.304 -15.882 1.00 1.00 C ATOM 2386 O LEU A 157 -10.112 27.547 -16.695 1.00 1.00 O ATOM 2387 CB LEU A 157 -8.242 26.978 -14.174 1.00 1.00 C ATOM 2388 CG LEU A 157 -9.137 27.320 -12.969 1.00 1.00 C ATOM 2389 CD1 LEU A 157 -10.595 26.990 -13.250 1.00 1.00 C ATOM 2390 CD2 LEU A 157 -8.663 26.571 -11.731 1.00 1.00 C ATOM 0 H LEU A 157 -7.316 29.294 -13.920 1.00 1.00 H new ATOM 0 HA LEU A 157 -7.589 27.554 -16.125 1.00 1.00 H new ATOM 0 HB2 LEU A 157 -8.578 26.026 -14.585 1.00 1.00 H new ATOM 0 HB3 LEU A 157 -7.227 26.826 -13.808 1.00 1.00 H new ATOM 0 HG LEU A 157 -9.061 28.393 -12.791 1.00 1.00 H new ATOM 0 HD11 LEU A 157 -11.200 27.243 -12.379 1.00 1.00 H new ATOM 0 HD12 LEU A 157 -10.939 27.564 -14.110 1.00 1.00 H new ATOM 0 HD13 LEU A 157 -10.693 25.925 -13.462 1.00 1.00 H new ATOM 0 HD21 LEU A 157 -9.304 26.822 -10.886 1.00 1.00 H new ATOM 0 HD22 LEU A 157 -8.709 25.498 -11.915 1.00 1.00 H new ATOM 0 HD23 LEU A 157 -7.636 26.857 -11.504 1.00 1.00 H new