USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 811 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 Single : A 1 GLY N :NH3+ -108:sc= 0.0106 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 3 SER OG : rot 180:sc= -0.0194 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 TYR OH : rot 70:sc= -1.77 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -152:sc= 0.00107 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.019) USER MOD Single : A 17 THR OG1 : rot 65:sc= 0.521 USER MOD Single : A 24 GLN : amide:sc= -0.292 K(o=-0.29,f=-2.1!) USER MOD Single : A 31 THR OG1 : rot 95:sc= 0.0549 USER MOD Single : A 42 SER OG : rot 70:sc= 0.42 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -1.21 K(o=-1.2,f=-11!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 61 ASN : amide:sc= -0.141 K(o=-0.14,f=-0.8) USER MOD Single : A 62 SER OG : rot 180:sc= 0.235 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0.00928 USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.0064) USER MOD Single : A 89 GLN : amide:sc= 0.373 K(o=0.37,f=-4.7!) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 101 ASN : amide:sc= -0.185 K(o=-0.19,f=-1.7!) USER MOD Single : A 103 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.433 0.920 -3.377 1.00 52.20 N ATOM 2 CA GLY A 1 0.680 0.766 -2.458 1.00 53.15 C ATOM 3 C GLY A 1 1.963 0.372 -3.163 1.00 34.51 C ATOM 4 O GLY A 1 1.937 -0.372 -4.143 1.00 11.22 O ATOM 0 H1 GLY A 1 -0.665 1.929 -3.476 1.00 52.20 H new ATOM 0 H2 GLY A 1 -0.172 0.532 -4.306 1.00 52.20 H new ATOM 0 H3 GLY A 1 -1.261 0.409 -3.009 1.00 52.20 H new ATOM 0 HA2 GLY A 1 0.836 1.702 -1.921 1.00 53.15 H new ATOM 0 HA3 GLY A 1 0.431 0.010 -1.714 1.00 53.15 H new ATOM 8 N ASN A 2 3.088 0.872 -2.664 1.00 21.04 N ATOM 9 CA ASN A 2 4.387 0.569 -3.253 1.00 60.05 C ATOM 10 C ASN A 2 4.869 -0.814 -2.827 1.00 31.23 C ATOM 11 O ASN A 2 4.355 -1.394 -1.870 1.00 3.00 O ATOM 12 CB ASN A 2 5.414 1.627 -2.847 1.00 5.23 C ATOM 13 CG ASN A 2 5.111 2.987 -3.445 1.00 45.31 C ATOM 14 OD1 ASN A 2 4.364 3.098 -4.417 1.00 61.41 O ATOM 15 ND2 ASN A 2 5.693 4.031 -2.865 1.00 55.34 N ATOM 0 H ASN A 2 3.127 1.489 -1.853 1.00 21.04 H new ATOM 0 HA ASN A 2 4.277 0.577 -4.337 1.00 60.05 H new ATOM 0 HB2 ASN A 2 5.438 1.708 -1.760 1.00 5.23 H new ATOM 0 HB3 ASN A 2 6.406 1.307 -3.164 1.00 5.23 H new ATOM 0 HD21 ASN A 2 5.528 4.971 -3.224 1.00 55.34 H new ATOM 0 HD22 ASN A 2 6.305 3.892 -2.061 1.00 55.34 H new ATOM 22 N SER A 3 5.859 -1.337 -3.543 1.00 41.00 N ATOM 23 CA SER A 3 6.409 -2.653 -3.241 1.00 32.41 C ATOM 24 C SER A 3 7.907 -2.696 -3.528 1.00 55.34 C ATOM 25 O SER A 3 8.459 -3.750 -3.839 1.00 25.42 O ATOM 26 CB SER A 3 5.691 -3.729 -4.058 1.00 35.11 C ATOM 27 OG SER A 3 4.435 -3.264 -4.521 1.00 53.13 O ATOM 0 H SER A 3 6.297 -0.869 -4.337 1.00 41.00 H new ATOM 0 HA SER A 3 6.255 -2.848 -2.180 1.00 32.41 H new ATOM 0 HB2 SER A 3 6.310 -4.019 -4.907 1.00 35.11 H new ATOM 0 HB3 SER A 3 5.550 -4.620 -3.447 1.00 35.11 H new ATOM 0 HG SER A 3 3.997 -3.969 -5.042 1.00 53.13 H new ATOM 33 N GLN A 4 8.556 -1.541 -3.423 1.00 12.15 N ATOM 34 CA GLN A 4 9.989 -1.445 -3.672 1.00 23.42 C ATOM 35 C GLN A 4 10.785 -1.810 -2.422 1.00 55.25 C ATOM 36 O GLN A 4 10.867 -1.025 -1.477 1.00 22.20 O ATOM 37 CB GLN A 4 10.356 -0.033 -4.130 1.00 13.31 C ATOM 38 CG GLN A 4 9.517 0.465 -5.296 1.00 1.40 C ATOM 39 CD GLN A 4 10.341 1.197 -6.337 1.00 23.00 C ATOM 40 OE1 GLN A 4 10.963 0.578 -7.201 1.00 23.34 O ATOM 41 NE2 GLN A 4 10.350 2.523 -6.261 1.00 20.31 N ATOM 0 H GLN A 4 8.112 -0.659 -3.167 1.00 12.15 H new ATOM 0 HA GLN A 4 10.242 -2.152 -4.462 1.00 23.42 H new ATOM 0 HB2 GLN A 4 10.241 0.654 -3.291 1.00 13.31 H new ATOM 0 HB3 GLN A 4 11.408 -0.014 -4.416 1.00 13.31 H new ATOM 0 HG2 GLN A 4 9.015 -0.381 -5.765 1.00 1.40 H new ATOM 0 HG3 GLN A 4 8.739 1.130 -4.921 1.00 1.40 H new ATOM 0 HE21 GLN A 4 9.820 2.995 -5.529 1.00 20.31 H new ATOM 0 HE22 GLN A 4 10.887 3.069 -6.935 1.00 20.31 H new ATOM 50 N ILE A 5 11.367 -3.004 -2.425 1.00 42.15 N ATOM 51 CA ILE A 5 12.156 -3.471 -1.292 1.00 62.24 C ATOM 52 C ILE A 5 13.475 -4.081 -1.755 1.00 71.41 C ATOM 53 O ILE A 5 13.528 -4.776 -2.771 1.00 14.22 O ATOM 54 CB ILE A 5 11.385 -4.513 -0.461 1.00 60.41 C ATOM 55 CG1 ILE A 5 9.956 -4.033 -0.198 1.00 44.45 C ATOM 56 CG2 ILE A 5 12.108 -4.785 0.850 1.00 73.01 C ATOM 57 CD1 ILE A 5 9.887 -2.764 0.623 1.00 61.13 C ATOM 0 H ILE A 5 11.307 -3.666 -3.199 1.00 42.15 H new ATOM 0 HA ILE A 5 12.360 -2.600 -0.669 1.00 62.24 H new ATOM 0 HB ILE A 5 11.337 -5.443 -1.027 1.00 60.41 H new ATOM 0 HG12 ILE A 5 9.456 -3.867 -1.152 1.00 44.45 H new ATOM 0 HG13 ILE A 5 9.406 -4.820 0.318 1.00 44.45 H new ATOM 0 HG21 ILE A 5 11.551 -5.524 1.426 1.00 73.01 H new ATOM 0 HG22 ILE A 5 13.108 -5.166 0.642 1.00 73.01 H new ATOM 0 HG23 ILE A 5 12.184 -3.860 1.422 1.00 73.01 H new ATOM 0 HD11 ILE A 5 8.844 -2.482 0.770 1.00 61.13 H new ATOM 0 HD12 ILE A 5 10.358 -2.931 1.592 1.00 61.13 H new ATOM 0 HD13 ILE A 5 10.409 -1.963 0.099 1.00 61.13 H new ATOM 69 N HIS A 6 14.539 -3.819 -1.002 1.00 75.12 N ATOM 70 CA HIS A 6 15.858 -4.344 -1.334 1.00 22.53 C ATOM 71 C HIS A 6 16.591 -4.805 -0.077 1.00 73.52 C ATOM 72 O HIS A 6 16.351 -4.293 1.016 1.00 32.13 O ATOM 73 CB HIS A 6 16.685 -3.283 -2.060 1.00 23.21 C ATOM 74 CG HIS A 6 16.723 -1.964 -1.351 1.00 75.41 C ATOM 75 ND1 HIS A 6 15.907 -0.905 -1.689 1.00 43.13 N ATOM 76 CD2 HIS A 6 17.482 -1.537 -0.316 1.00 3.13 C ATOM 77 CE1 HIS A 6 16.165 0.118 -0.894 1.00 23.32 C ATOM 78 NE2 HIS A 6 17.117 -0.240 -0.051 1.00 1.03 N ATOM 0 H HIS A 6 14.513 -3.246 -0.158 1.00 75.12 H new ATOM 0 HA HIS A 6 15.725 -5.203 -1.992 1.00 22.53 H new ATOM 0 HB2 HIS A 6 17.704 -3.650 -2.183 1.00 23.21 H new ATOM 0 HB3 HIS A 6 16.276 -3.137 -3.060 1.00 23.21 H new ATOM 0 HD2 HIS A 6 18.235 -2.110 0.205 1.00 3.13 H new ATOM 0 HE1 HIS A 6 15.680 1.083 -0.928 1.00 23.32 H new ATOM 0 HE2 HIS A 6 17.516 0.351 0.678 1.00 1.03 H new ATOM 86 N TYR A 7 17.483 -5.775 -0.241 1.00 63.42 N ATOM 87 CA TYR A 7 18.248 -6.308 0.880 1.00 3.42 C ATOM 88 C TYR A 7 19.747 -6.190 0.622 1.00 63.22 C ATOM 89 O TYR A 7 20.181 -6.020 -0.518 1.00 13.44 O ATOM 90 CB TYR A 7 17.876 -7.770 1.131 1.00 54.13 C ATOM 91 CG TYR A 7 16.389 -8.035 1.066 1.00 75.41 C ATOM 92 CD1 TYR A 7 15.479 -7.144 1.620 1.00 53.51 C ATOM 93 CD2 TYR A 7 15.893 -9.178 0.450 1.00 64.14 C ATOM 94 CE1 TYR A 7 14.119 -7.383 1.564 1.00 43.33 C ATOM 95 CE2 TYR A 7 14.535 -9.425 0.387 1.00 5.33 C ATOM 96 CZ TYR A 7 13.653 -8.524 0.946 1.00 34.32 C ATOM 97 OH TYR A 7 12.299 -8.765 0.887 1.00 61.52 O ATOM 0 H TYR A 7 17.694 -6.209 -1.140 1.00 63.42 H new ATOM 0 HA TYR A 7 18.002 -5.721 1.765 1.00 3.42 H new ATOM 0 HB2 TYR A 7 18.381 -8.396 0.395 1.00 54.13 H new ATOM 0 HB3 TYR A 7 18.247 -8.068 2.112 1.00 54.13 H new ATOM 0 HD1 TYR A 7 15.841 -6.248 2.103 1.00 53.51 H new ATOM 0 HD2 TYR A 7 16.582 -9.886 0.013 1.00 64.14 H new ATOM 0 HE1 TYR A 7 13.425 -6.680 2.002 1.00 43.33 H new ATOM 0 HE2 TYR A 7 14.167 -10.318 -0.097 1.00 5.33 H new ATOM 0 HH TYR A 7 11.879 -8.126 0.274 1.00 61.52 H new ATOM 107 N SER A 8 20.534 -6.284 1.689 1.00 42.40 N ATOM 108 CA SER A 8 21.985 -6.185 1.580 1.00 50.21 C ATOM 109 C SER A 8 22.651 -7.498 1.981 1.00 15.20 C ATOM 110 O SER A 8 22.738 -7.826 3.165 1.00 40.53 O ATOM 111 CB SER A 8 22.507 -5.046 2.458 1.00 22.11 C ATOM 112 OG SER A 8 21.588 -3.968 2.495 1.00 3.00 O ATOM 0 H SER A 8 20.191 -6.429 2.639 1.00 42.40 H new ATOM 0 HA SER A 8 22.233 -5.975 0.540 1.00 50.21 H new ATOM 0 HB2 SER A 8 22.682 -5.413 3.469 1.00 22.11 H new ATOM 0 HB3 SER A 8 23.466 -4.697 2.075 1.00 22.11 H new ATOM 0 HG SER A 8 21.944 -3.254 3.064 1.00 3.00 H new ATOM 118 N ILE A 9 23.118 -8.245 0.986 1.00 12.25 N ATOM 119 CA ILE A 9 23.776 -9.521 1.235 1.00 64.23 C ATOM 120 C ILE A 9 25.229 -9.489 0.773 1.00 63.15 C ATOM 121 O ILE A 9 25.527 -9.302 -0.407 1.00 44.23 O ATOM 122 CB ILE A 9 23.049 -10.678 0.524 1.00 12.32 C ATOM 123 CG1 ILE A 9 23.900 -11.948 0.567 1.00 25.14 C ATOM 124 CG2 ILE A 9 22.727 -10.298 -0.913 1.00 44.45 C ATOM 125 CD1 ILE A 9 23.247 -13.137 -0.102 1.00 12.14 C ATOM 0 H ILE A 9 23.053 -7.989 0.001 1.00 12.25 H new ATOM 0 HA ILE A 9 23.742 -9.689 2.312 1.00 64.23 H new ATOM 0 HB ILE A 9 22.112 -10.874 1.046 1.00 12.32 H new ATOM 0 HG12 ILE A 9 24.857 -11.751 0.084 1.00 25.14 H new ATOM 0 HG13 ILE A 9 24.113 -12.198 1.606 1.00 25.14 H new ATOM 0 HG21 ILE A 9 22.213 -11.126 -1.402 1.00 44.45 H new ATOM 0 HG22 ILE A 9 22.085 -9.417 -0.921 1.00 44.45 H new ATOM 0 HG23 ILE A 9 23.651 -10.078 -1.447 1.00 44.45 H new ATOM 0 HD11 ILE A 9 23.907 -14.001 -0.033 1.00 12.14 H new ATOM 0 HD12 ILE A 9 22.303 -13.361 0.395 1.00 12.14 H new ATOM 0 HD13 ILE A 9 23.059 -12.907 -1.151 1.00 12.14 H new ATOM 137 N PRO A 10 26.157 -9.678 1.723 1.00 72.02 N ATOM 138 CA PRO A 10 27.595 -9.678 1.437 1.00 55.41 C ATOM 139 C PRO A 10 28.026 -10.900 0.635 1.00 64.43 C ATOM 140 O PRO A 10 27.609 -12.021 0.923 1.00 72.43 O ATOM 141 CB PRO A 10 28.233 -9.698 2.828 1.00 32.10 C ATOM 142 CG PRO A 10 27.206 -10.325 3.707 1.00 40.12 C ATOM 143 CD PRO A 10 25.873 -9.907 3.150 1.00 63.04 C ATOM 0 HA PRO A 10 27.890 -8.822 0.830 1.00 55.41 H new ATOM 0 HB2 PRO A 10 29.160 -10.272 2.830 1.00 32.10 H new ATOM 0 HB3 PRO A 10 28.481 -8.691 3.164 1.00 32.10 H new ATOM 0 HG2 PRO A 10 27.305 -11.411 3.710 1.00 40.12 H new ATOM 0 HG3 PRO A 10 27.320 -9.992 4.739 1.00 40.12 H new ATOM 0 HD2 PRO A 10 25.118 -10.681 3.291 1.00 63.04 H new ATOM 0 HD3 PRO A 10 25.499 -9.005 3.635 1.00 63.04 H new ATOM 151 N GLU A 11 28.865 -10.676 -0.372 1.00 71.12 N ATOM 152 CA GLU A 11 29.352 -11.761 -1.216 1.00 23.13 C ATOM 153 C GLU A 11 29.838 -12.933 -0.368 1.00 22.12 C ATOM 154 O GLU A 11 30.201 -12.762 0.795 1.00 1.14 O ATOM 155 CB GLU A 11 30.485 -11.266 -2.118 1.00 33.21 C ATOM 156 CG GLU A 11 30.009 -10.758 -3.468 1.00 51.25 C ATOM 157 CD GLU A 11 31.012 -11.017 -4.576 1.00 1.23 C ATOM 158 OE1 GLU A 11 32.227 -11.009 -4.288 1.00 24.11 O ATOM 159 OE2 GLU A 11 30.583 -11.227 -5.729 1.00 55.32 O ATOM 0 H GLU A 11 29.221 -9.754 -0.623 1.00 71.12 H new ATOM 0 HA GLU A 11 28.525 -12.103 -1.838 1.00 23.13 H new ATOM 0 HB2 GLU A 11 31.022 -10.467 -1.607 1.00 33.21 H new ATOM 0 HB3 GLU A 11 31.195 -12.078 -2.274 1.00 33.21 H new ATOM 0 HG2 GLU A 11 29.063 -11.238 -3.720 1.00 51.25 H new ATOM 0 HG3 GLU A 11 29.815 -9.687 -3.401 1.00 51.25 H new ATOM 166 N GLU A 12 29.841 -14.123 -0.960 1.00 71.30 N ATOM 167 CA GLU A 12 30.281 -15.324 -0.259 1.00 14.24 C ATOM 168 C GLU A 12 29.361 -15.633 0.919 1.00 72.50 C ATOM 169 O GLU A 12 29.752 -16.321 1.862 1.00 41.41 O ATOM 170 CB GLU A 12 31.719 -15.155 0.234 1.00 22.24 C ATOM 171 CG GLU A 12 32.536 -16.435 0.177 1.00 21.15 C ATOM 172 CD GLU A 12 33.936 -16.210 -0.360 1.00 61.31 C ATOM 173 OE1 GLU A 12 34.065 -15.840 -1.546 1.00 33.14 O ATOM 174 OE2 GLU A 12 34.903 -16.405 0.406 1.00 42.51 O ATOM 0 H GLU A 12 29.544 -14.281 -1.923 1.00 71.30 H new ATOM 0 HA GLU A 12 30.240 -16.159 -0.959 1.00 14.24 H new ATOM 0 HB2 GLU A 12 32.213 -14.392 -0.367 1.00 22.24 H new ATOM 0 HB3 GLU A 12 31.702 -14.790 1.261 1.00 22.24 H new ATOM 0 HG2 GLU A 12 32.599 -16.866 1.176 1.00 21.15 H new ATOM 0 HG3 GLU A 12 32.022 -17.162 -0.452 1.00 21.15 H new ATOM 181 N ALA A 13 28.136 -15.121 0.857 1.00 43.44 N ATOM 182 CA ALA A 13 27.160 -15.343 1.916 1.00 41.11 C ATOM 183 C ALA A 13 26.915 -16.832 2.133 1.00 61.31 C ATOM 184 O ALA A 13 26.245 -17.485 1.333 1.00 70.24 O ATOM 185 CB ALA A 13 25.855 -14.634 1.588 1.00 54.31 C ATOM 0 H ALA A 13 27.796 -14.549 0.084 1.00 43.44 H new ATOM 0 HA ALA A 13 27.563 -14.929 2.840 1.00 41.11 H new ATOM 0 HB1 ALA A 13 25.135 -14.808 2.388 1.00 54.31 H new ATOM 0 HB2 ALA A 13 26.037 -13.564 1.491 1.00 54.31 H new ATOM 0 HB3 ALA A 13 25.456 -15.021 0.650 1.00 54.31 H new ATOM 191 N LYS A 14 27.463 -17.365 3.220 1.00 12.00 N ATOM 192 CA LYS A 14 27.304 -18.778 3.544 1.00 51.24 C ATOM 193 C LYS A 14 25.829 -19.142 3.679 1.00 70.42 C ATOM 194 O LYS A 14 24.954 -18.282 3.575 1.00 3.32 O ATOM 195 CB LYS A 14 28.044 -19.111 4.841 1.00 33.41 C ATOM 196 CG LYS A 14 29.255 -20.005 4.638 1.00 0.11 C ATOM 197 CD LYS A 14 30.324 -19.315 3.807 1.00 32.11 C ATOM 198 CE LYS A 14 30.715 -20.150 2.597 1.00 33.14 C ATOM 199 NZ LYS A 14 31.338 -19.321 1.529 1.00 23.01 N ATOM 0 H LYS A 14 28.022 -16.839 3.892 1.00 12.00 H new ATOM 0 HA LYS A 14 27.731 -19.363 2.729 1.00 51.24 H new ATOM 0 HB2 LYS A 14 28.363 -18.183 5.316 1.00 33.41 H new ATOM 0 HB3 LYS A 14 27.353 -19.600 5.528 1.00 33.41 H new ATOM 0 HG2 LYS A 14 29.669 -20.284 5.607 1.00 0.11 H new ATOM 0 HG3 LYS A 14 28.949 -20.928 4.145 1.00 0.11 H new ATOM 0 HD2 LYS A 14 29.958 -18.343 3.477 1.00 32.11 H new ATOM 0 HD3 LYS A 14 31.204 -19.132 4.424 1.00 32.11 H new ATOM 0 HE2 LYS A 14 31.412 -20.930 2.904 1.00 33.14 H new ATOM 0 HE3 LYS A 14 29.832 -20.650 2.200 1.00 33.14 H new ATOM 0 HZ1 LYS A 14 31.163 -19.759 0.602 1.00 23.01 H new ATOM 0 HZ2 LYS A 14 30.924 -18.367 1.544 1.00 23.01 H new ATOM 0 HZ3 LYS A 14 32.363 -19.257 1.693 1.00 23.01 H new ATOM 213 N HIS A 15 25.560 -20.423 3.912 1.00 35.01 N ATOM 214 CA HIS A 15 24.190 -20.901 4.064 1.00 53.22 C ATOM 215 C HIS A 15 23.568 -20.368 5.351 1.00 10.12 C ATOM 216 O HIS A 15 24.030 -20.675 6.449 1.00 21.41 O ATOM 217 CB HIS A 15 24.157 -22.429 4.063 1.00 62.43 C ATOM 218 CG HIS A 15 24.194 -23.028 2.690 1.00 33.24 C ATOM 219 ND1 HIS A 15 24.293 -24.385 2.464 1.00 42.34 N ATOM 220 CD2 HIS A 15 24.142 -22.447 1.469 1.00 15.11 C ATOM 221 CE1 HIS A 15 24.302 -24.612 1.162 1.00 4.22 C ATOM 222 NE2 HIS A 15 24.211 -23.452 0.536 1.00 30.33 N ATOM 0 H HIS A 15 26.272 -21.148 4.000 1.00 35.01 H new ATOM 0 HA HIS A 15 23.607 -20.532 3.220 1.00 53.22 H new ATOM 0 HB2 HIS A 15 25.005 -22.803 4.637 1.00 62.43 H new ATOM 0 HB3 HIS A 15 23.254 -22.765 4.573 1.00 62.43 H new ATOM 0 HD2 HIS A 15 24.061 -21.389 1.266 1.00 15.11 H new ATOM 0 HE1 HIS A 15 24.372 -25.581 0.690 1.00 4.22 H new ATOM 0 HE2 HIS A 15 24.195 -23.324 -0.476 1.00 30.33 H new ATOM 230 N GLY A 16 22.517 -19.566 5.208 1.00 70.13 N ATOM 231 CA GLY A 16 21.850 -19.003 6.367 1.00 50.31 C ATOM 232 C GLY A 16 22.260 -17.567 6.631 1.00 32.50 C ATOM 233 O GLY A 16 21.905 -16.991 7.660 1.00 22.20 O ATOM 0 H GLY A 16 22.116 -19.296 4.310 1.00 70.13 H new ATOM 0 HA2 GLY A 16 20.771 -19.048 6.219 1.00 50.31 H new ATOM 0 HA3 GLY A 16 22.077 -19.610 7.244 1.00 50.31 H new ATOM 237 N THR A 17 23.011 -16.987 5.700 1.00 23.23 N ATOM 238 CA THR A 17 23.472 -15.612 5.839 1.00 45.35 C ATOM 239 C THR A 17 22.299 -14.639 5.868 1.00 3.21 C ATOM 240 O THR A 17 21.297 -14.838 5.181 1.00 2.11 O ATOM 241 CB THR A 17 24.421 -15.219 4.690 1.00 23.23 C ATOM 242 OG1 THR A 17 25.601 -16.030 4.731 1.00 72.24 O ATOM 243 CG2 THR A 17 24.806 -13.750 4.784 1.00 21.53 C ATOM 0 H THR A 17 23.313 -17.448 4.842 1.00 23.23 H new ATOM 0 HA THR A 17 24.012 -15.554 6.784 1.00 45.35 H new ATOM 0 HB THR A 17 23.900 -15.382 3.746 1.00 23.23 H new ATOM 0 HG1 THR A 17 25.363 -16.964 4.552 1.00 72.24 H new ATOM 0 HG21 THR A 17 25.476 -13.496 3.963 1.00 21.53 H new ATOM 0 HG22 THR A 17 23.909 -13.134 4.724 1.00 21.53 H new ATOM 0 HG23 THR A 17 25.309 -13.566 5.733 1.00 21.53 H new ATOM 251 N PHE A 18 22.430 -13.585 6.667 1.00 24.23 N ATOM 252 CA PHE A 18 21.380 -12.581 6.786 1.00 1.44 C ATOM 253 C PHE A 18 21.380 -11.648 5.578 1.00 32.34 C ATOM 254 O PHE A 18 22.406 -11.065 5.230 1.00 2.52 O ATOM 255 CB PHE A 18 21.564 -11.769 8.071 1.00 60.53 C ATOM 256 CG PHE A 18 20.785 -10.486 8.086 1.00 54.43 C ATOM 257 CD1 PHE A 18 19.454 -10.463 7.699 1.00 43.13 C ATOM 258 CD2 PHE A 18 21.382 -9.302 8.487 1.00 10.32 C ATOM 259 CE1 PHE A 18 18.735 -9.283 7.711 1.00 43.31 C ATOM 260 CE2 PHE A 18 20.668 -8.118 8.502 1.00 73.42 C ATOM 261 CZ PHE A 18 19.342 -8.109 8.114 1.00 22.31 C ATOM 0 H PHE A 18 23.253 -13.404 7.242 1.00 24.23 H new ATOM 0 HA PHE A 18 20.421 -13.098 6.825 1.00 1.44 H new ATOM 0 HB2 PHE A 18 21.262 -12.378 8.923 1.00 60.53 H new ATOM 0 HB3 PHE A 18 22.623 -11.544 8.200 1.00 60.53 H new ATOM 0 HD1 PHE A 18 18.974 -11.378 7.385 1.00 43.13 H new ATOM 0 HD2 PHE A 18 22.418 -9.304 8.792 1.00 10.32 H new ATOM 0 HE1 PHE A 18 17.699 -9.278 7.406 1.00 43.31 H new ATOM 0 HE2 PHE A 18 21.146 -7.202 8.816 1.00 73.42 H new ATOM 0 HZ PHE A 18 18.781 -7.186 8.126 1.00 22.31 H new ATOM 271 N VAL A 19 20.220 -11.514 4.942 1.00 23.13 N ATOM 272 CA VAL A 19 20.085 -10.653 3.774 1.00 73.05 C ATOM 273 C VAL A 19 19.252 -9.417 4.095 1.00 72.30 C ATOM 274 O VAL A 19 19.706 -8.287 3.920 1.00 34.23 O ATOM 275 CB VAL A 19 19.436 -11.404 2.596 1.00 52.25 C ATOM 276 CG1 VAL A 19 19.453 -10.545 1.340 1.00 24.11 C ATOM 277 CG2 VAL A 19 20.143 -12.729 2.355 1.00 74.21 C ATOM 0 H VAL A 19 19.361 -11.991 5.216 1.00 23.13 H new ATOM 0 HA VAL A 19 21.091 -10.345 3.490 1.00 73.05 H new ATOM 0 HB VAL A 19 18.397 -11.613 2.850 1.00 52.25 H new ATOM 0 HG11 VAL A 19 18.990 -11.092 0.519 1.00 24.11 H new ATOM 0 HG12 VAL A 19 18.898 -9.625 1.521 1.00 24.11 H new ATOM 0 HG13 VAL A 19 20.483 -10.302 1.079 1.00 24.11 H new ATOM 0 HG21 VAL A 19 19.672 -13.246 1.519 1.00 74.21 H new ATOM 0 HG22 VAL A 19 21.192 -12.545 2.122 1.00 74.21 H new ATOM 0 HG23 VAL A 19 20.073 -13.347 3.250 1.00 74.21 H new ATOM 287 N GLY A 20 18.029 -9.641 4.567 1.00 51.31 N ATOM 288 CA GLY A 20 17.151 -8.536 4.906 1.00 4.30 C ATOM 289 C GLY A 20 15.729 -8.986 5.174 1.00 70.13 C ATOM 290 O GLY A 20 15.108 -9.637 4.333 1.00 41.41 O ATOM 0 H GLY A 20 17.631 -10.567 4.721 1.00 51.31 H new ATOM 0 HA2 GLY A 20 17.539 -8.025 5.787 1.00 4.30 H new ATOM 0 HA3 GLY A 20 17.152 -7.812 4.091 1.00 4.30 H new ATOM 294 N ARG A 21 15.212 -8.641 6.348 1.00 31.14 N ATOM 295 CA ARG A 21 13.855 -9.017 6.726 1.00 53.24 C ATOM 296 C ARG A 21 12.868 -8.683 5.610 1.00 23.03 C ATOM 297 O ARG A 21 12.480 -7.527 5.437 1.00 33.43 O ATOM 298 CB ARG A 21 13.444 -8.302 8.015 1.00 65.15 C ATOM 299 CG ARG A 21 14.325 -8.642 9.206 1.00 41.30 C ATOM 300 CD ARG A 21 13.952 -7.817 10.428 1.00 51.44 C ATOM 301 NE ARG A 21 14.513 -8.373 11.656 1.00 52.11 N ATOM 302 CZ ARG A 21 14.538 -7.722 12.813 1.00 14.54 C ATOM 303 NH1 ARG A 21 14.035 -6.498 12.900 1.00 44.51 N ATOM 304 NH2 ARG A 21 15.065 -8.295 13.888 1.00 42.25 N ATOM 0 H ARG A 21 15.712 -8.101 7.054 1.00 31.14 H new ATOM 0 HA ARG A 21 13.837 -10.094 6.895 1.00 53.24 H new ATOM 0 HB2 ARG A 21 13.472 -7.225 7.848 1.00 65.15 H new ATOM 0 HB3 ARG A 21 12.412 -8.561 8.251 1.00 65.15 H new ATOM 0 HG2 ARG A 21 14.230 -9.703 9.439 1.00 41.30 H new ATOM 0 HG3 ARG A 21 15.369 -8.464 8.950 1.00 41.30 H new ATOM 0 HD2 ARG A 21 14.307 -6.795 10.297 1.00 51.44 H new ATOM 0 HD3 ARG A 21 12.867 -7.768 10.515 1.00 51.44 H new ATOM 0 HE ARG A 21 14.907 -9.313 11.623 1.00 52.11 H new ATOM 0 HH11 ARG A 21 13.628 -6.054 12.077 1.00 44.51 H new ATOM 0 HH12 ARG A 21 14.056 -6.000 13.790 1.00 44.51 H new ATOM 0 HH21 ARG A 21 15.452 -9.237 13.826 1.00 42.25 H new ATOM 0 HH22 ARG A 21 15.083 -7.793 14.776 1.00 42.25 H new ATOM 318 N ILE A 22 12.468 -9.702 4.857 1.00 42.21 N ATOM 319 CA ILE A 22 11.527 -9.516 3.759 1.00 23.23 C ATOM 320 C ILE A 22 10.161 -9.076 4.275 1.00 44.43 C ATOM 321 O ILE A 22 9.535 -8.178 3.713 1.00 52.30 O ATOM 322 CB ILE A 22 11.361 -10.807 2.936 1.00 32.22 C ATOM 323 CG1 ILE A 22 10.302 -10.612 1.849 1.00 12.02 C ATOM 324 CG2 ILE A 22 10.988 -11.970 3.844 1.00 51.21 C ATOM 325 CD1 ILE A 22 10.581 -11.396 0.586 1.00 50.41 C ATOM 0 H ILE A 22 12.780 -10.664 4.987 1.00 42.21 H new ATOM 0 HA ILE A 22 11.939 -8.737 3.118 1.00 23.23 H new ATOM 0 HB ILE A 22 12.311 -11.038 2.454 1.00 32.22 H new ATOM 0 HG12 ILE A 22 9.330 -10.908 2.243 1.00 12.02 H new ATOM 0 HG13 ILE A 22 10.237 -9.552 1.602 1.00 12.02 H new ATOM 0 HG21 ILE A 22 10.874 -12.875 3.248 1.00 51.21 H new ATOM 0 HG22 ILE A 22 11.774 -12.120 4.585 1.00 51.21 H new ATOM 0 HG23 ILE A 22 10.049 -11.749 4.351 1.00 51.21 H new ATOM 0 HD11 ILE A 22 9.790 -11.210 -0.140 1.00 50.41 H new ATOM 0 HD12 ILE A 22 11.538 -11.084 0.168 1.00 50.41 H new ATOM 0 HD13 ILE A 22 10.617 -12.460 0.819 1.00 50.41 H new ATOM 337 N ALA A 23 9.707 -9.713 5.349 1.00 54.24 N ATOM 338 CA ALA A 23 8.417 -9.384 5.943 1.00 72.12 C ATOM 339 C ALA A 23 8.455 -8.016 6.615 1.00 54.35 C ATOM 340 O ALA A 23 7.568 -7.188 6.406 1.00 44.32 O ATOM 341 CB ALA A 23 8.009 -10.455 6.944 1.00 12.40 C ATOM 0 H ALA A 23 10.213 -10.460 5.825 1.00 54.24 H new ATOM 0 HA ALA A 23 7.676 -9.347 5.145 1.00 72.12 H new ATOM 0 HB1 ALA A 23 7.044 -10.197 7.380 1.00 12.40 H new ATOM 0 HB2 ALA A 23 7.932 -11.417 6.437 1.00 12.40 H new ATOM 0 HB3 ALA A 23 8.758 -10.520 7.733 1.00 12.40 H new ATOM 347 N GLN A 24 9.485 -7.786 7.421 1.00 4.04 N ATOM 348 CA GLN A 24 9.637 -6.518 8.125 1.00 53.44 C ATOM 349 C GLN A 24 9.600 -5.346 7.149 1.00 72.34 C ATOM 350 O GLN A 24 9.007 -4.306 7.435 1.00 42.34 O ATOM 351 CB GLN A 24 10.948 -6.500 8.912 1.00 41.13 C ATOM 352 CG GLN A 24 10.971 -5.474 10.033 1.00 50.51 C ATOM 353 CD GLN A 24 11.421 -4.105 9.562 1.00 43.30 C ATOM 354 OE1 GLN A 24 12.124 -3.981 8.558 1.00 10.14 O ATOM 355 NE2 GLN A 24 11.018 -3.067 10.286 1.00 71.12 N ATOM 0 H GLN A 24 10.228 -8.461 7.603 1.00 4.04 H new ATOM 0 HA GLN A 24 8.804 -6.416 8.820 1.00 53.44 H new ATOM 0 HB2 GLN A 24 11.123 -7.490 9.333 1.00 41.13 H new ATOM 0 HB3 GLN A 24 11.771 -6.296 8.227 1.00 41.13 H new ATOM 0 HG2 GLN A 24 9.975 -5.395 10.468 1.00 50.51 H new ATOM 0 HG3 GLN A 24 11.638 -5.820 10.823 1.00 50.51 H new ATOM 0 HE21 GLN A 24 10.436 -3.215 11.111 1.00 71.12 H new ATOM 0 HE22 GLN A 24 11.290 -2.121 10.017 1.00 71.12 H new ATOM 364 N ASP A 25 10.237 -5.523 5.996 1.00 13.23 N ATOM 365 CA ASP A 25 10.276 -4.480 4.977 1.00 22.51 C ATOM 366 C ASP A 25 8.939 -4.380 4.250 1.00 33.03 C ATOM 367 O ASP A 25 8.546 -3.305 3.796 1.00 11.52 O ATOM 368 CB ASP A 25 11.396 -4.761 3.974 1.00 41.32 C ATOM 369 CG ASP A 25 12.756 -4.857 4.636 1.00 22.55 C ATOM 370 OD1 ASP A 25 12.878 -4.436 5.806 1.00 62.10 O ATOM 371 OD2 ASP A 25 13.699 -5.355 3.986 1.00 75.40 O ATOM 0 H ASP A 25 10.733 -6.378 5.744 1.00 13.23 H new ATOM 0 HA ASP A 25 10.471 -3.529 5.472 1.00 22.51 H new ATOM 0 HB2 ASP A 25 11.184 -5.693 3.449 1.00 41.32 H new ATOM 0 HB3 ASP A 25 11.415 -3.970 3.224 1.00 41.32 H new ATOM 376 N LEU A 26 8.244 -5.507 4.143 1.00 73.02 N ATOM 377 CA LEU A 26 6.950 -5.547 3.470 1.00 11.21 C ATOM 378 C LEU A 26 5.875 -4.871 4.316 1.00 63.40 C ATOM 379 O LEU A 26 5.011 -4.169 3.794 1.00 14.33 O ATOM 380 CB LEU A 26 6.550 -6.994 3.177 1.00 54.21 C ATOM 381 CG LEU A 26 6.757 -7.469 1.738 1.00 31.24 C ATOM 382 CD1 LEU A 26 8.204 -7.271 1.314 1.00 73.10 C ATOM 383 CD2 LEU A 26 6.352 -8.929 1.596 1.00 65.31 C ATOM 0 H LEU A 26 8.555 -6.405 4.513 1.00 73.02 H new ATOM 0 HA LEU A 26 7.040 -5.004 2.529 1.00 11.21 H new ATOM 0 HB2 LEU A 26 7.117 -7.648 3.839 1.00 54.21 H new ATOM 0 HB3 LEU A 26 5.497 -7.118 3.431 1.00 54.21 H new ATOM 0 HG LEU A 26 6.123 -6.871 1.083 1.00 31.24 H new ATOM 0 HD11 LEU A 26 8.333 -7.614 0.288 1.00 73.10 H new ATOM 0 HD12 LEU A 26 8.460 -6.213 1.378 1.00 73.10 H new ATOM 0 HD13 LEU A 26 8.858 -7.843 1.973 1.00 73.10 H new ATOM 0 HD21 LEU A 26 6.506 -9.251 0.566 1.00 65.31 H new ATOM 0 HD22 LEU A 26 6.960 -9.542 2.262 1.00 65.31 H new ATOM 0 HD23 LEU A 26 5.300 -9.042 1.858 1.00 65.31 H new ATOM 395 N GLY A 27 5.938 -5.088 5.626 1.00 13.04 N ATOM 396 CA GLY A 27 4.966 -4.492 6.524 1.00 13.40 C ATOM 397 C GLY A 27 3.803 -5.419 6.819 1.00 42.43 C ATOM 398 O GLY A 27 2.648 -4.991 6.841 1.00 4.22 O ATOM 0 H GLY A 27 6.645 -5.666 6.081 1.00 13.04 H new ATOM 0 HA2 GLY A 27 5.457 -4.222 7.459 1.00 13.40 H new ATOM 0 HA3 GLY A 27 4.588 -3.569 6.084 1.00 13.40 H new ATOM 402 N LEU A 28 4.107 -6.692 7.044 1.00 73.24 N ATOM 403 CA LEU A 28 3.078 -7.684 7.337 1.00 54.33 C ATOM 404 C LEU A 28 3.483 -8.556 8.521 1.00 50.32 C ATOM 405 O LEU A 28 4.669 -8.757 8.777 1.00 24.32 O ATOM 406 CB LEU A 28 2.820 -8.559 6.109 1.00 42.13 C ATOM 407 CG LEU A 28 3.964 -8.650 5.098 1.00 71.01 C ATOM 408 CD1 LEU A 28 5.167 -9.347 5.714 1.00 12.03 C ATOM 409 CD2 LEU A 28 3.509 -9.379 3.842 1.00 53.31 C ATOM 0 H LEU A 28 5.057 -7.062 7.029 1.00 73.24 H new ATOM 0 HA LEU A 28 2.162 -7.154 7.597 1.00 54.33 H new ATOM 0 HB2 LEU A 28 2.581 -9.567 6.449 1.00 42.13 H new ATOM 0 HB3 LEU A 28 1.937 -8.178 5.595 1.00 42.13 H new ATOM 0 HG LEU A 28 4.259 -7.638 4.820 1.00 71.01 H new ATOM 0 HD11 LEU A 28 5.971 -9.402 4.980 1.00 12.03 H new ATOM 0 HD12 LEU A 28 5.508 -8.785 6.583 1.00 12.03 H new ATOM 0 HD13 LEU A 28 4.886 -10.354 6.021 1.00 12.03 H new ATOM 0 HD21 LEU A 28 4.336 -9.434 3.134 1.00 53.31 H new ATOM 0 HD22 LEU A 28 3.187 -10.387 4.103 1.00 53.31 H new ATOM 0 HD23 LEU A 28 2.678 -8.838 3.388 1.00 53.31 H new ATOM 421 N GLU A 29 2.489 -9.071 9.237 1.00 30.42 N ATOM 422 CA GLU A 29 2.743 -9.923 10.393 1.00 3.02 C ATOM 423 C GLU A 29 3.369 -11.247 9.966 1.00 24.51 C ATOM 424 O GLU A 29 3.158 -11.715 8.846 1.00 12.22 O ATOM 425 CB GLU A 29 1.444 -10.184 11.158 1.00 0.32 C ATOM 426 CG GLU A 29 1.479 -9.703 12.599 1.00 23.12 C ATOM 427 CD GLU A 29 0.184 -9.978 13.338 1.00 53.23 C ATOM 428 OE1 GLU A 29 -0.739 -9.141 13.247 1.00 73.34 O ATOM 429 OE2 GLU A 29 0.093 -11.028 14.006 1.00 34.35 O ATOM 0 H GLU A 29 1.501 -8.914 9.037 1.00 30.42 H new ATOM 0 HA GLU A 29 3.443 -9.404 11.047 1.00 3.02 H new ATOM 0 HB2 GLU A 29 0.622 -9.691 10.639 1.00 0.32 H new ATOM 0 HB3 GLU A 29 1.234 -11.253 11.146 1.00 0.32 H new ATOM 0 HG2 GLU A 29 2.302 -10.192 13.121 1.00 23.12 H new ATOM 0 HG3 GLU A 29 1.682 -8.632 12.616 1.00 23.12 H new ATOM 436 N LEU A 30 4.141 -11.847 10.865 1.00 23.25 N ATOM 437 CA LEU A 30 4.800 -13.118 10.583 1.00 34.10 C ATOM 438 C LEU A 30 3.782 -14.252 10.500 1.00 4.41 C ATOM 439 O LEU A 30 4.034 -15.283 9.876 1.00 43.24 O ATOM 440 CB LEU A 30 5.838 -13.428 11.662 1.00 5.23 C ATOM 441 CG LEU A 30 7.297 -13.444 11.205 1.00 44.13 C ATOM 442 CD1 LEU A 30 7.587 -14.693 10.387 1.00 32.44 C ATOM 443 CD2 LEU A 30 7.618 -12.192 10.401 1.00 71.35 C ATOM 0 H LEU A 30 4.326 -11.474 11.796 1.00 23.25 H new ATOM 0 HA LEU A 30 5.302 -13.033 9.619 1.00 34.10 H new ATOM 0 HB2 LEU A 30 5.736 -12.691 12.459 1.00 5.23 H new ATOM 0 HB3 LEU A 30 5.603 -14.400 12.095 1.00 5.23 H new ATOM 0 HG LEU A 30 7.934 -13.458 12.089 1.00 44.13 H new ATOM 0 HD11 LEU A 30 8.630 -14.687 10.071 1.00 32.44 H new ATOM 0 HD12 LEU A 30 7.397 -15.578 10.994 1.00 32.44 H new ATOM 0 HD13 LEU A 30 6.942 -14.711 9.509 1.00 32.44 H new ATOM 0 HD21 LEU A 30 8.661 -12.220 10.084 1.00 71.35 H new ATOM 0 HD22 LEU A 30 6.973 -12.148 9.523 1.00 71.35 H new ATOM 0 HD23 LEU A 30 7.451 -11.310 11.019 1.00 71.35 H new ATOM 455 N THR A 31 2.630 -14.053 11.132 1.00 32.25 N ATOM 456 CA THR A 31 1.574 -15.058 11.130 1.00 53.54 C ATOM 457 C THR A 31 0.556 -14.782 10.029 1.00 51.12 C ATOM 458 O THR A 31 -0.440 -15.493 9.900 1.00 11.15 O ATOM 459 CB THR A 31 0.845 -15.110 12.486 1.00 71.24 C ATOM 460 OG1 THR A 31 0.978 -13.855 13.163 1.00 64.54 O ATOM 461 CG2 THR A 31 1.404 -16.225 13.357 1.00 13.44 C ATOM 0 H THR A 31 2.404 -13.205 11.652 1.00 32.25 H new ATOM 0 HA THR A 31 2.053 -16.020 10.947 1.00 53.54 H new ATOM 0 HB THR A 31 -0.210 -15.310 12.300 1.00 71.24 H new ATOM 0 HG1 THR A 31 0.194 -13.298 12.976 1.00 64.54 H new ATOM 0 HG21 THR A 31 0.874 -16.243 14.309 1.00 13.44 H new ATOM 0 HG22 THR A 31 1.274 -17.182 12.851 1.00 13.44 H new ATOM 0 HG23 THR A 31 2.465 -16.050 13.535 1.00 13.44 H new ATOM 469 N GLU A 32 0.814 -13.746 9.237 1.00 54.13 N ATOM 470 CA GLU A 32 -0.082 -13.377 8.146 1.00 21.45 C ATOM 471 C GLU A 32 0.413 -13.947 6.820 1.00 50.51 C ATOM 472 O GLU A 32 -0.353 -14.080 5.864 1.00 23.33 O ATOM 473 CB GLU A 32 -0.202 -11.855 8.048 1.00 60.21 C ATOM 474 CG GLU A 32 -1.620 -11.372 7.794 1.00 1.44 C ATOM 475 CD GLU A 32 -2.450 -11.309 9.062 1.00 73.13 C ATOM 476 OE1 GLU A 32 -3.087 -12.328 9.404 1.00 5.21 O ATOM 477 OE2 GLU A 32 -2.464 -10.242 9.711 1.00 73.45 O ATOM 0 H GLU A 32 1.635 -13.148 9.330 1.00 54.13 H new ATOM 0 HA GLU A 32 -1.065 -13.798 8.358 1.00 21.45 H new ATOM 0 HB2 GLU A 32 0.164 -11.410 8.973 1.00 60.21 H new ATOM 0 HB3 GLU A 32 0.444 -11.499 7.245 1.00 60.21 H new ATOM 0 HG2 GLU A 32 -1.587 -10.383 7.336 1.00 1.44 H new ATOM 0 HG3 GLU A 32 -2.104 -12.038 7.080 1.00 1.44 H new ATOM 484 N LEU A 33 1.698 -14.279 6.769 1.00 71.45 N ATOM 485 CA LEU A 33 2.297 -14.834 5.559 1.00 11.24 C ATOM 486 C LEU A 33 1.722 -16.212 5.250 1.00 61.34 C ATOM 487 O LEU A 33 1.411 -16.523 4.100 1.00 54.43 O ATOM 488 CB LEU A 33 3.816 -14.925 5.715 1.00 71.32 C ATOM 489 CG LEU A 33 4.522 -13.649 6.175 1.00 74.20 C ATOM 490 CD1 LEU A 33 5.561 -13.968 7.239 1.00 52.23 C ATOM 491 CD2 LEU A 33 5.166 -12.940 4.993 1.00 60.23 C ATOM 0 H LEU A 33 2.345 -14.174 7.550 1.00 71.45 H new ATOM 0 HA LEU A 33 2.062 -14.169 4.728 1.00 11.24 H new ATOM 0 HB2 LEU A 33 4.041 -15.718 6.428 1.00 71.32 H new ATOM 0 HB3 LEU A 33 4.242 -15.227 4.758 1.00 71.32 H new ATOM 0 HG LEU A 33 3.778 -12.982 6.611 1.00 74.20 H new ATOM 0 HD11 LEU A 33 6.053 -13.048 7.554 1.00 52.23 H new ATOM 0 HD12 LEU A 33 5.073 -14.431 8.097 1.00 52.23 H new ATOM 0 HD13 LEU A 33 6.302 -14.654 6.829 1.00 52.23 H new ATOM 0 HD21 LEU A 33 5.664 -12.034 5.339 1.00 60.23 H new ATOM 0 HD22 LEU A 33 5.897 -13.600 4.527 1.00 60.23 H new ATOM 0 HD23 LEU A 33 4.399 -12.677 4.265 1.00 60.23 H new ATOM 503 N VAL A 34 1.582 -17.035 6.284 1.00 70.51 N ATOM 504 CA VAL A 34 1.041 -18.380 6.123 1.00 1.12 C ATOM 505 C VAL A 34 -0.291 -18.351 5.382 1.00 64.44 C ATOM 506 O VAL A 34 -0.457 -18.968 4.329 1.00 64.10 O ATOM 507 CB VAL A 34 0.843 -19.072 7.485 1.00 1.30 C ATOM 508 CG1 VAL A 34 -0.326 -20.043 7.426 1.00 64.44 C ATOM 509 CG2 VAL A 34 2.118 -19.784 7.911 1.00 42.13 C ATOM 0 H VAL A 34 1.836 -16.794 7.242 1.00 70.51 H new ATOM 0 HA VAL A 34 1.767 -18.945 5.539 1.00 1.12 H new ATOM 0 HB VAL A 34 0.614 -18.310 8.230 1.00 1.30 H new ATOM 0 HG11 VAL A 34 -0.450 -20.522 8.397 1.00 64.44 H new ATOM 0 HG12 VAL A 34 -1.236 -19.501 7.169 1.00 64.44 H new ATOM 0 HG13 VAL A 34 -0.130 -20.803 6.669 1.00 64.44 H new ATOM 0 HG21 VAL A 34 1.960 -20.267 8.875 1.00 42.13 H new ATOM 0 HG22 VAL A 34 2.381 -20.536 7.167 1.00 42.13 H new ATOM 0 HG23 VAL A 34 2.928 -19.060 7.997 1.00 42.13 H new ATOM 519 N PRO A 35 -1.264 -17.618 5.942 1.00 71.14 N ATOM 520 CA PRO A 35 -2.599 -17.490 5.350 1.00 71.35 C ATOM 521 C PRO A 35 -2.587 -16.671 4.064 1.00 41.23 C ATOM 522 O PRO A 35 -3.539 -16.708 3.284 1.00 65.44 O ATOM 523 CB PRO A 35 -3.401 -16.769 6.436 1.00 72.23 C ATOM 524 CG PRO A 35 -2.384 -16.017 7.222 1.00 65.03 C ATOM 525 CD PRO A 35 -1.136 -16.857 7.196 1.00 54.25 C ATOM 0 HA PRO A 35 -3.013 -18.457 5.066 1.00 71.35 H new ATOM 0 HB2 PRO A 35 -4.141 -16.097 6.001 1.00 72.23 H new ATOM 0 HB3 PRO A 35 -3.943 -17.477 7.064 1.00 72.23 H new ATOM 0 HG2 PRO A 35 -2.202 -15.035 6.786 1.00 65.03 H new ATOM 0 HG3 PRO A 35 -2.724 -15.854 8.245 1.00 65.03 H new ATOM 0 HD2 PRO A 35 -0.237 -16.241 7.202 1.00 54.25 H new ATOM 0 HD3 PRO A 35 -1.077 -17.516 8.062 1.00 54.25 H new ATOM 533 N ARG A 36 -1.504 -15.931 3.849 1.00 64.52 N ATOM 534 CA ARG A 36 -1.369 -15.102 2.657 1.00 24.24 C ATOM 535 C ARG A 36 -0.718 -15.885 1.521 1.00 61.32 C ATOM 536 O ARG A 36 -0.371 -15.321 0.482 1.00 0.35 O ATOM 537 CB ARG A 36 -0.541 -13.854 2.970 1.00 53.10 C ATOM 538 CG ARG A 36 -1.358 -12.712 3.553 1.00 21.44 C ATOM 539 CD ARG A 36 -0.484 -11.512 3.879 1.00 44.52 C ATOM 540 NE ARG A 36 -1.275 -10.346 4.263 1.00 34.11 N ATOM 541 CZ ARG A 36 -0.825 -9.098 4.199 1.00 20.12 C ATOM 542 NH1 ARG A 36 0.405 -8.855 3.768 1.00 1.02 N ATOM 543 NH2 ARG A 36 -1.606 -8.090 4.567 1.00 63.04 N ATOM 0 H ARG A 36 -0.707 -15.889 4.485 1.00 64.52 H new ATOM 0 HA ARG A 36 -2.367 -14.799 2.341 1.00 24.24 H new ATOM 0 HB2 ARG A 36 0.250 -14.119 3.672 1.00 53.10 H new ATOM 0 HB3 ARG A 36 -0.055 -13.512 2.056 1.00 53.10 H new ATOM 0 HG2 ARG A 36 -2.132 -12.418 2.844 1.00 21.44 H new ATOM 0 HG3 ARG A 36 -1.865 -13.050 4.457 1.00 21.44 H new ATOM 0 HD2 ARG A 36 0.198 -11.770 4.689 1.00 44.52 H new ATOM 0 HD3 ARG A 36 0.129 -11.264 3.013 1.00 44.52 H new ATOM 0 HE ARG A 36 -2.226 -10.498 4.599 1.00 34.11 H new ATOM 0 HH11 ARG A 36 1.008 -9.627 3.485 1.00 1.02 H new ATOM 0 HH12 ARG A 36 0.748 -7.896 3.720 1.00 1.02 H new ATOM 0 HH21 ARG A 36 -2.553 -8.273 4.899 1.00 63.04 H new ATOM 0 HH22 ARG A 36 -1.259 -7.132 4.517 1.00 63.04 H new ATOM 557 N LEU A 37 -0.555 -17.188 1.724 1.00 2.25 N ATOM 558 CA LEU A 37 0.055 -18.049 0.717 1.00 32.23 C ATOM 559 C LEU A 37 1.335 -17.426 0.171 1.00 63.14 C ATOM 560 O LEU A 37 1.481 -17.241 -1.038 1.00 24.32 O ATOM 561 CB LEU A 37 -0.929 -18.306 -0.425 1.00 70.35 C ATOM 562 CG LEU A 37 -1.936 -19.435 -0.203 1.00 32.11 C ATOM 563 CD1 LEU A 37 -1.216 -20.755 0.029 1.00 55.42 C ATOM 564 CD2 LEU A 37 -2.850 -19.111 0.970 1.00 52.23 C ATOM 0 H LEU A 37 -0.837 -17.671 2.577 1.00 2.25 H new ATOM 0 HA LEU A 37 0.309 -18.998 1.190 1.00 32.23 H new ATOM 0 HB2 LEU A 37 -1.481 -17.386 -0.616 1.00 70.35 H new ATOM 0 HB3 LEU A 37 -0.358 -18.528 -1.327 1.00 70.35 H new ATOM 0 HG LEU A 37 -2.548 -19.531 -1.100 1.00 32.11 H new ATOM 0 HD11 LEU A 37 -1.949 -21.547 0.185 1.00 55.42 H new ATOM 0 HD12 LEU A 37 -0.604 -20.993 -0.841 1.00 55.42 H new ATOM 0 HD13 LEU A 37 -0.579 -20.672 0.909 1.00 55.42 H new ATOM 0 HD21 LEU A 37 -3.560 -19.925 1.114 1.00 52.23 H new ATOM 0 HD22 LEU A 37 -2.253 -18.987 1.873 1.00 52.23 H new ATOM 0 HD23 LEU A 37 -3.393 -18.188 0.764 1.00 52.23 H new ATOM 576 N PHE A 38 2.261 -17.106 1.068 1.00 4.03 N ATOM 577 CA PHE A 38 3.531 -16.505 0.676 1.00 52.10 C ATOM 578 C PHE A 38 4.349 -17.470 -0.176 1.00 63.25 C ATOM 579 O PHE A 38 4.493 -18.645 0.162 1.00 71.12 O ATOM 580 CB PHE A 38 4.331 -16.097 1.915 1.00 54.11 C ATOM 581 CG PHE A 38 5.104 -14.822 1.736 1.00 13.42 C ATOM 582 CD1 PHE A 38 4.465 -13.594 1.804 1.00 43.31 C ATOM 583 CD2 PHE A 38 6.469 -14.851 1.501 1.00 12.30 C ATOM 584 CE1 PHE A 38 5.174 -12.419 1.639 1.00 44.11 C ATOM 585 CE2 PHE A 38 7.183 -13.679 1.336 1.00 63.03 C ATOM 586 CZ PHE A 38 6.535 -12.461 1.406 1.00 62.52 C ATOM 0 H PHE A 38 2.156 -17.253 2.072 1.00 4.03 H new ATOM 0 HA PHE A 38 3.316 -15.616 0.082 1.00 52.10 H new ATOM 0 HB2 PHE A 38 3.648 -15.984 2.757 1.00 54.11 H new ATOM 0 HB3 PHE A 38 5.023 -16.899 2.171 1.00 54.11 H new ATOM 0 HD1 PHE A 38 3.401 -13.555 1.988 1.00 43.31 H new ATOM 0 HD2 PHE A 38 6.981 -15.800 1.446 1.00 12.30 H new ATOM 0 HE1 PHE A 38 4.664 -11.468 1.692 1.00 44.11 H new ATOM 0 HE2 PHE A 38 8.247 -13.715 1.152 1.00 63.03 H new ATOM 0 HZ PHE A 38 7.091 -11.544 1.279 1.00 62.52 H new ATOM 596 N ARG A 39 4.883 -16.965 -1.284 1.00 20.40 N ATOM 597 CA ARG A 39 5.685 -17.782 -2.186 1.00 64.34 C ATOM 598 C ARG A 39 6.749 -16.939 -2.882 1.00 45.43 C ATOM 599 O ARG A 39 6.493 -15.803 -3.283 1.00 34.21 O ATOM 600 CB ARG A 39 4.792 -18.457 -3.229 1.00 13.32 C ATOM 601 CG ARG A 39 4.443 -19.897 -2.892 1.00 21.22 C ATOM 602 CD ARG A 39 3.987 -20.663 -4.124 1.00 43.00 C ATOM 603 NE ARG A 39 5.115 -21.133 -4.925 1.00 12.15 N ATOM 604 CZ ARG A 39 4.988 -21.642 -6.145 1.00 1.01 C ATOM 605 NH1 ARG A 39 3.790 -21.746 -6.702 1.00 54.13 N ATOM 606 NH2 ARG A 39 6.062 -22.048 -6.811 1.00 11.15 N ATOM 0 H ARG A 39 4.774 -15.994 -1.578 1.00 20.40 H new ATOM 0 HA ARG A 39 6.183 -18.549 -1.593 1.00 64.34 H new ATOM 0 HB2 ARG A 39 3.871 -17.883 -3.332 1.00 13.32 H new ATOM 0 HB3 ARG A 39 5.294 -18.431 -4.196 1.00 13.32 H new ATOM 0 HG2 ARG A 39 5.312 -20.391 -2.456 1.00 21.22 H new ATOM 0 HG3 ARG A 39 3.655 -19.915 -2.139 1.00 21.22 H new ATOM 0 HD2 ARG A 39 3.380 -21.515 -3.817 1.00 43.00 H new ATOM 0 HD3 ARG A 39 3.351 -20.022 -4.735 1.00 43.00 H new ATOM 0 HE ARG A 39 6.051 -21.067 -4.525 1.00 12.15 H new ATOM 0 HH11 ARG A 39 2.962 -21.435 -6.194 1.00 54.13 H new ATOM 0 HH12 ARG A 39 3.696 -22.137 -7.639 1.00 54.13 H new ATOM 0 HH21 ARG A 39 6.986 -21.969 -6.386 1.00 11.15 H new ATOM 0 HH22 ARG A 39 5.964 -22.439 -7.748 1.00 11.15 H new ATOM 620 N VAL A 40 7.946 -17.501 -3.022 1.00 74.53 N ATOM 621 CA VAL A 40 9.049 -16.802 -3.670 1.00 14.20 C ATOM 622 C VAL A 40 9.270 -17.318 -5.087 1.00 65.21 C ATOM 623 O VAL A 40 9.172 -18.518 -5.344 1.00 44.30 O ATOM 624 CB VAL A 40 10.356 -16.953 -2.870 1.00 0.32 C ATOM 625 CG1 VAL A 40 11.490 -16.204 -3.553 1.00 40.12 C ATOM 626 CG2 VAL A 40 10.166 -16.462 -1.442 1.00 62.24 C ATOM 0 H VAL A 40 8.176 -18.439 -2.695 1.00 74.53 H new ATOM 0 HA VAL A 40 8.776 -15.747 -3.710 1.00 14.20 H new ATOM 0 HB VAL A 40 10.620 -18.010 -2.835 1.00 0.32 H new ATOM 0 HG11 VAL A 40 12.405 -16.322 -2.973 1.00 40.12 H new ATOM 0 HG12 VAL A 40 11.640 -16.606 -4.555 1.00 40.12 H new ATOM 0 HG13 VAL A 40 11.238 -15.146 -3.621 1.00 40.12 H new ATOM 0 HG21 VAL A 40 11.099 -16.576 -0.891 1.00 62.24 H new ATOM 0 HG22 VAL A 40 9.878 -15.411 -1.454 1.00 62.24 H new ATOM 0 HG23 VAL A 40 9.385 -17.047 -0.957 1.00 62.24 H new ATOM 636 N ALA A 41 9.571 -16.404 -6.004 1.00 35.01 N ATOM 637 CA ALA A 41 9.809 -16.767 -7.395 1.00 60.13 C ATOM 638 C ALA A 41 10.909 -15.906 -8.006 1.00 65.34 C ATOM 639 O ALA A 41 10.703 -14.726 -8.289 1.00 33.21 O ATOM 640 CB ALA A 41 8.526 -16.638 -8.202 1.00 55.50 C ATOM 0 H ALA A 41 9.656 -15.407 -5.808 1.00 35.01 H new ATOM 0 HA ALA A 41 10.139 -17.806 -7.422 1.00 60.13 H new ATOM 0 HB1 ALA A 41 8.719 -16.912 -9.239 1.00 55.50 H new ATOM 0 HB2 ALA A 41 7.767 -17.301 -7.787 1.00 55.50 H new ATOM 0 HB3 ALA A 41 8.171 -15.608 -8.159 1.00 55.50 H new ATOM 646 N SER A 42 12.079 -16.504 -8.207 1.00 64.33 N ATOM 647 CA SER A 42 13.214 -15.791 -8.781 1.00 2.51 C ATOM 648 C SER A 42 13.239 -15.940 -10.299 1.00 52.11 C ATOM 649 O SER A 42 12.669 -16.881 -10.852 1.00 10.02 O ATOM 650 CB SER A 42 14.524 -16.309 -8.185 1.00 22.22 C ATOM 651 OG SER A 42 15.531 -16.411 -9.177 1.00 31.21 O ATOM 0 H SER A 42 12.266 -17.481 -7.981 1.00 64.33 H new ATOM 0 HA SER A 42 13.106 -14.734 -8.539 1.00 2.51 H new ATOM 0 HB2 SER A 42 14.857 -15.639 -7.392 1.00 22.22 H new ATOM 0 HB3 SER A 42 14.359 -17.285 -7.729 1.00 22.22 H new ATOM 0 HG SER A 42 15.806 -15.513 -9.458 1.00 31.21 H new ATOM 657 N LYS A 43 13.903 -15.004 -10.969 1.00 24.25 N ATOM 658 CA LYS A 43 14.005 -15.030 -12.423 1.00 2.22 C ATOM 659 C LYS A 43 15.329 -15.646 -12.865 1.00 11.32 C ATOM 660 O LYS A 43 15.397 -16.324 -13.890 1.00 1.00 O ATOM 661 CB LYS A 43 13.875 -13.614 -12.989 1.00 1.13 C ATOM 662 CG LYS A 43 13.030 -13.538 -14.249 1.00 2.34 C ATOM 663 CD LYS A 43 13.889 -13.326 -15.484 1.00 61.21 C ATOM 664 CE LYS A 43 13.119 -12.609 -16.582 1.00 40.31 C ATOM 665 NZ LYS A 43 13.832 -11.389 -17.053 1.00 55.20 N ATOM 0 H LYS A 43 14.379 -14.217 -10.527 1.00 24.25 H new ATOM 0 HA LYS A 43 13.192 -15.645 -12.808 1.00 2.22 H new ATOM 0 HB2 LYS A 43 13.438 -12.967 -12.229 1.00 1.13 H new ATOM 0 HB3 LYS A 43 14.870 -13.225 -13.205 1.00 1.13 H new ATOM 0 HG2 LYS A 43 12.455 -14.457 -14.358 1.00 2.34 H new ATOM 0 HG3 LYS A 43 12.313 -12.722 -14.159 1.00 2.34 H new ATOM 0 HD2 LYS A 43 14.772 -12.745 -15.219 1.00 61.21 H new ATOM 0 HD3 LYS A 43 14.240 -14.289 -15.854 1.00 61.21 H new ATOM 0 HE2 LYS A 43 12.967 -13.288 -17.421 1.00 40.31 H new ATOM 0 HE3 LYS A 43 12.132 -12.333 -16.212 1.00 40.31 H new ATOM 0 HZ1 LYS A 43 13.275 -10.929 -17.801 1.00 55.20 H new ATOM 0 HZ2 LYS A 43 13.955 -10.730 -16.258 1.00 55.20 H new ATOM 0 HZ3 LYS A 43 14.764 -11.655 -17.429 1.00 55.20 H new ATOM 679 N ASP A 44 16.377 -15.406 -12.085 1.00 22.21 N ATOM 680 CA ASP A 44 17.699 -15.940 -12.395 1.00 15.33 C ATOM 681 C ASP A 44 17.670 -17.464 -12.451 1.00 55.13 C ATOM 682 O ASP A 44 17.694 -18.055 -13.531 1.00 20.43 O ATOM 683 CB ASP A 44 18.717 -15.475 -11.353 1.00 11.15 C ATOM 684 CG ASP A 44 18.915 -13.972 -11.367 1.00 2.00 C ATOM 685 OD1 ASP A 44 19.661 -13.480 -12.240 1.00 53.11 O ATOM 686 OD2 ASP A 44 18.324 -13.288 -10.506 1.00 3.22 O ATOM 0 H ASP A 44 16.337 -14.846 -11.234 1.00 22.21 H new ATOM 0 HA ASP A 44 17.995 -15.564 -13.374 1.00 15.33 H new ATOM 0 HB2 ASP A 44 18.386 -15.786 -10.362 1.00 11.15 H new ATOM 0 HB3 ASP A 44 19.672 -15.966 -11.538 1.00 11.15 H new ATOM 691 N ARG A 45 17.618 -18.093 -11.282 1.00 23.50 N ATOM 692 CA ARG A 45 17.589 -19.549 -11.198 1.00 55.34 C ATOM 693 C ARG A 45 16.298 -20.029 -10.542 1.00 33.33 C ATOM 694 O ARG A 45 15.924 -21.195 -10.663 1.00 23.21 O ATOM 695 CB ARG A 45 18.796 -20.060 -10.410 1.00 75.40 C ATOM 696 CG ARG A 45 19.709 -20.969 -11.216 1.00 70.04 C ATOM 697 CD ARG A 45 20.703 -21.694 -10.323 1.00 44.01 C ATOM 698 NE ARG A 45 20.980 -23.047 -10.798 1.00 5.02 N ATOM 699 CZ ARG A 45 21.671 -23.943 -10.102 1.00 20.14 C ATOM 700 NH1 ARG A 45 22.152 -23.631 -8.906 1.00 33.31 N ATOM 701 NH2 ARG A 45 21.882 -25.154 -10.601 1.00 74.21 N ATOM 0 H ARG A 45 17.595 -17.618 -10.380 1.00 23.50 H new ATOM 0 HA ARG A 45 17.631 -19.948 -12.211 1.00 55.34 H new ATOM 0 HB2 ARG A 45 19.372 -19.207 -10.050 1.00 75.40 H new ATOM 0 HB3 ARG A 45 18.443 -20.600 -9.531 1.00 75.40 H new ATOM 0 HG2 ARG A 45 19.109 -21.698 -11.761 1.00 70.04 H new ATOM 0 HG3 ARG A 45 20.248 -20.380 -11.958 1.00 70.04 H new ATOM 0 HD2 ARG A 45 21.633 -21.127 -10.281 1.00 44.01 H new ATOM 0 HD3 ARG A 45 20.311 -21.740 -9.307 1.00 44.01 H new ATOM 0 HE ARG A 45 20.623 -23.319 -11.714 1.00 5.02 H new ATOM 0 HH11 ARG A 45 21.992 -22.701 -8.519 1.00 33.31 H new ATOM 0 HH12 ARG A 45 22.682 -24.321 -8.374 1.00 33.31 H new ATOM 0 HH21 ARG A 45 21.513 -25.398 -11.520 1.00 74.21 H new ATOM 0 HH22 ARG A 45 22.413 -25.841 -10.065 1.00 74.21 H new ATOM 715 N GLY A 46 15.620 -19.121 -9.845 1.00 64.50 N ATOM 716 CA GLY A 46 14.380 -19.472 -9.179 1.00 14.10 C ATOM 717 C GLY A 46 14.603 -19.986 -7.770 1.00 53.44 C ATOM 718 O GLY A 46 13.661 -20.090 -6.984 1.00 42.21 O ATOM 0 H GLY A 46 15.908 -18.149 -9.730 1.00 64.50 H new ATOM 0 HA2 GLY A 46 13.730 -18.598 -9.145 1.00 14.10 H new ATOM 0 HA3 GLY A 46 13.861 -20.233 -9.762 1.00 14.10 H new ATOM 722 N ASP A 47 15.851 -20.309 -7.451 1.00 50.12 N ATOM 723 CA ASP A 47 16.195 -20.816 -6.128 1.00 10.53 C ATOM 724 C ASP A 47 17.462 -20.148 -5.603 1.00 2.22 C ATOM 725 O ASP A 47 18.498 -20.795 -5.445 1.00 62.12 O ATOM 726 CB ASP A 47 16.384 -22.333 -6.172 1.00 51.41 C ATOM 727 CG ASP A 47 16.483 -22.944 -4.789 1.00 23.44 C ATOM 728 OD1 ASP A 47 15.565 -22.720 -3.973 1.00 14.33 O ATOM 729 OD2 ASP A 47 17.479 -23.649 -4.522 1.00 2.30 O ATOM 0 H ASP A 47 16.642 -20.229 -8.091 1.00 50.12 H new ATOM 0 HA ASP A 47 15.374 -20.580 -5.451 1.00 10.53 H new ATOM 0 HB2 ASP A 47 15.549 -22.785 -6.707 1.00 51.41 H new ATOM 0 HB3 ASP A 47 17.287 -22.568 -6.735 1.00 51.41 H new ATOM 734 N LEU A 48 17.373 -18.850 -5.335 1.00 1.23 N ATOM 735 CA LEU A 48 18.513 -18.093 -4.828 1.00 71.22 C ATOM 736 C LEU A 48 18.460 -17.982 -3.308 1.00 4.31 C ATOM 737 O LEU A 48 19.470 -18.164 -2.626 1.00 51.10 O ATOM 738 CB LEU A 48 18.541 -16.697 -5.453 1.00 24.03 C ATOM 739 CG LEU A 48 18.465 -16.643 -6.979 1.00 15.42 C ATOM 740 CD1 LEU A 48 17.718 -15.398 -7.432 1.00 13.33 C ATOM 741 CD2 LEU A 48 19.860 -16.680 -7.585 1.00 11.42 C ATOM 0 H LEU A 48 16.523 -18.299 -5.460 1.00 1.23 H new ATOM 0 HA LEU A 48 19.423 -18.626 -5.103 1.00 71.22 H new ATOM 0 HB2 LEU A 48 17.708 -16.122 -5.047 1.00 24.03 H new ATOM 0 HB3 LEU A 48 19.457 -16.198 -5.137 1.00 24.03 H new ATOM 0 HG LEU A 48 17.917 -17.518 -7.327 1.00 15.42 H new ATOM 0 HD11 LEU A 48 17.674 -15.376 -8.521 1.00 13.33 H new ATOM 0 HD12 LEU A 48 16.706 -15.414 -7.028 1.00 13.33 H new ATOM 0 HD13 LEU A 48 18.238 -14.510 -7.072 1.00 13.33 H new ATOM 0 HD21 LEU A 48 19.786 -16.641 -8.672 1.00 11.42 H new ATOM 0 HD22 LEU A 48 20.434 -15.824 -7.229 1.00 11.42 H new ATOM 0 HD23 LEU A 48 20.361 -17.602 -7.289 1.00 11.42 H new ATOM 753 N LEU A 49 17.277 -17.684 -2.782 1.00 43.44 N ATOM 754 CA LEU A 49 17.092 -17.550 -1.342 1.00 31.24 C ATOM 755 C LEU A 49 15.676 -17.948 -0.936 1.00 3.34 C ATOM 756 O LEU A 49 14.835 -18.235 -1.786 1.00 33.20 O ATOM 757 CB LEU A 49 17.376 -16.113 -0.902 1.00 2.12 C ATOM 758 CG LEU A 49 18.810 -15.621 -1.102 1.00 21.13 C ATOM 759 CD1 LEU A 49 18.989 -15.052 -2.500 1.00 41.25 C ATOM 760 CD2 LEU A 49 19.169 -14.581 -0.051 1.00 15.34 C ATOM 0 H LEU A 49 16.432 -17.531 -3.332 1.00 43.44 H new ATOM 0 HA LEU A 49 17.795 -18.220 -0.847 1.00 31.24 H new ATOM 0 HB2 LEU A 49 16.706 -15.448 -1.447 1.00 2.12 H new ATOM 0 HB3 LEU A 49 17.126 -16.022 0.155 1.00 2.12 H new ATOM 0 HG LEU A 49 19.484 -16.470 -0.989 1.00 21.13 H new ATOM 0 HD11 LEU A 49 20.016 -14.707 -2.624 1.00 41.25 H new ATOM 0 HD12 LEU A 49 18.775 -15.825 -3.238 1.00 41.25 H new ATOM 0 HD13 LEU A 49 18.305 -14.215 -2.643 1.00 41.25 H new ATOM 0 HD21 LEU A 49 20.193 -14.242 -0.209 1.00 15.34 H new ATOM 0 HD22 LEU A 49 18.490 -13.732 -0.132 1.00 15.34 H new ATOM 0 HD23 LEU A 49 19.082 -15.022 0.942 1.00 15.34 H new ATOM 772 N GLU A 50 15.421 -17.959 0.369 1.00 25.31 N ATOM 773 CA GLU A 50 14.107 -18.320 0.887 1.00 71.13 C ATOM 774 C GLU A 50 13.830 -17.611 2.209 1.00 34.23 C ATOM 775 O GLU A 50 14.744 -17.355 2.993 1.00 40.43 O ATOM 776 CB GLU A 50 14.007 -19.835 1.077 1.00 62.12 C ATOM 777 CG GLU A 50 13.500 -20.571 -0.152 1.00 42.32 C ATOM 778 CD GLU A 50 12.127 -20.099 -0.589 1.00 72.21 C ATOM 779 OE1 GLU A 50 11.188 -20.163 0.232 1.00 42.41 O ATOM 780 OE2 GLU A 50 11.991 -19.666 -1.753 1.00 23.42 O ATOM 0 H GLU A 50 16.107 -17.722 1.086 1.00 25.31 H new ATOM 0 HA GLU A 50 13.359 -18.003 0.161 1.00 71.13 H new ATOM 0 HB2 GLU A 50 14.989 -20.225 1.344 1.00 62.12 H new ATOM 0 HB3 GLU A 50 13.343 -20.044 1.915 1.00 62.12 H new ATOM 0 HG2 GLU A 50 14.206 -20.432 -0.971 1.00 42.32 H new ATOM 0 HG3 GLU A 50 13.463 -21.640 0.059 1.00 42.32 H new ATOM 787 N VAL A 51 12.561 -17.297 2.451 1.00 51.52 N ATOM 788 CA VAL A 51 12.162 -16.618 3.678 1.00 52.21 C ATOM 789 C VAL A 51 11.656 -17.613 4.717 1.00 41.34 C ATOM 790 O VAL A 51 10.995 -18.594 4.380 1.00 14.25 O ATOM 791 CB VAL A 51 11.064 -15.571 3.409 1.00 64.01 C ATOM 792 CG1 VAL A 51 9.923 -16.186 2.614 1.00 33.21 C ATOM 793 CG2 VAL A 51 10.558 -14.982 4.717 1.00 70.40 C ATOM 0 H VAL A 51 11.792 -17.502 1.813 1.00 51.52 H new ATOM 0 HA VAL A 51 13.048 -16.114 4.063 1.00 52.21 H new ATOM 0 HB VAL A 51 11.493 -14.763 2.816 1.00 64.01 H new ATOM 0 HG11 VAL A 51 9.157 -15.432 2.434 1.00 33.21 H new ATOM 0 HG12 VAL A 51 10.301 -16.554 1.660 1.00 33.21 H new ATOM 0 HG13 VAL A 51 9.492 -17.013 3.177 1.00 33.21 H new ATOM 0 HG21 VAL A 51 9.783 -14.244 4.508 1.00 70.40 H new ATOM 0 HG22 VAL A 51 10.145 -15.777 5.338 1.00 70.40 H new ATOM 0 HG23 VAL A 51 11.383 -14.502 5.243 1.00 70.40 H new ATOM 803 N ASN A 52 11.972 -17.352 5.981 1.00 41.41 N ATOM 804 CA ASN A 52 11.549 -18.224 7.070 1.00 24.42 C ATOM 805 C ASN A 52 10.349 -17.635 7.805 1.00 70.32 C ATOM 806 O ASN A 52 10.426 -16.541 8.364 1.00 15.42 O ATOM 807 CB ASN A 52 12.703 -18.446 8.051 1.00 71.24 C ATOM 808 CG ASN A 52 12.335 -19.401 9.170 1.00 71.12 C ATOM 809 OD1 ASN A 52 11.259 -20.000 9.162 1.00 41.54 O ATOM 810 ND2 ASN A 52 13.229 -19.548 10.140 1.00 4.33 N ATOM 0 H ASN A 52 12.520 -16.544 6.276 1.00 41.41 H new ATOM 0 HA ASN A 52 11.255 -19.182 6.641 1.00 24.42 H new ATOM 0 HB2 ASN A 52 13.565 -18.838 7.511 1.00 71.24 H new ATOM 0 HB3 ASN A 52 13.003 -17.489 8.478 1.00 71.24 H new ATOM 0 HD21 ASN A 52 13.037 -20.177 10.919 1.00 4.33 H new ATOM 0 HD22 ASN A 52 14.108 -19.032 10.106 1.00 4.33 H new ATOM 817 N LEU A 53 9.241 -18.369 7.800 1.00 43.53 N ATOM 818 CA LEU A 53 8.024 -17.920 8.466 1.00 13.22 C ATOM 819 C LEU A 53 8.174 -17.995 9.982 1.00 15.13 C ATOM 820 O LEU A 53 7.303 -17.541 10.724 1.00 11.12 O ATOM 821 CB LEU A 53 6.831 -18.767 8.018 1.00 45.34 C ATOM 822 CG LEU A 53 6.406 -18.607 6.558 1.00 51.33 C ATOM 823 CD1 LEU A 53 5.153 -19.420 6.275 1.00 73.43 C ATOM 824 CD2 LEU A 53 6.177 -17.139 6.227 1.00 62.14 C ATOM 0 H LEU A 53 9.161 -19.277 7.342 1.00 43.53 H new ATOM 0 HA LEU A 53 7.849 -16.881 8.187 1.00 13.22 H new ATOM 0 HB2 LEU A 53 7.069 -19.816 8.193 1.00 45.34 H new ATOM 0 HB3 LEU A 53 5.979 -18.523 8.653 1.00 45.34 H new ATOM 0 HG LEU A 53 7.209 -18.981 5.923 1.00 51.33 H new ATOM 0 HD11 LEU A 53 4.865 -19.294 5.231 1.00 73.43 H new ATOM 0 HD12 LEU A 53 5.351 -20.474 6.472 1.00 73.43 H new ATOM 0 HD13 LEU A 53 4.343 -19.076 6.919 1.00 73.43 H new ATOM 0 HD21 LEU A 53 5.875 -17.044 5.184 1.00 62.14 H new ATOM 0 HD22 LEU A 53 5.393 -16.739 6.870 1.00 62.14 H new ATOM 0 HD23 LEU A 53 7.099 -16.581 6.390 1.00 62.14 H new ATOM 836 N GLN A 54 9.284 -18.569 10.434 1.00 12.23 N ATOM 837 CA GLN A 54 9.548 -18.701 11.862 1.00 32.32 C ATOM 838 C GLN A 54 9.716 -17.333 12.514 1.00 15.31 C ATOM 839 O GLN A 54 9.060 -17.023 13.508 1.00 75.43 O ATOM 840 CB GLN A 54 10.801 -19.547 12.094 1.00 2.13 C ATOM 841 CG GLN A 54 10.893 -20.127 13.496 1.00 33.14 C ATOM 842 CD GLN A 54 12.312 -20.490 13.886 1.00 30.42 C ATOM 843 OE1 GLN A 54 13.221 -19.664 13.805 1.00 1.25 O ATOM 844 NE2 GLN A 54 12.510 -21.732 14.312 1.00 34.43 N ATOM 0 H GLN A 54 10.015 -18.950 9.833 1.00 12.23 H new ATOM 0 HA GLN A 54 8.692 -19.198 12.319 1.00 32.32 H new ATOM 0 HB2 GLN A 54 10.818 -20.362 11.371 1.00 2.13 H new ATOM 0 HB3 GLN A 54 11.683 -18.935 11.905 1.00 2.13 H new ATOM 0 HG2 GLN A 54 10.498 -19.405 14.210 1.00 33.14 H new ATOM 0 HG3 GLN A 54 10.264 -21.015 13.559 1.00 33.14 H new ATOM 0 HE21 GLN A 54 11.728 -22.384 14.363 1.00 34.43 H new ATOM 0 HE22 GLN A 54 13.445 -22.034 14.588 1.00 34.43 H new ATOM 853 N ASN A 55 10.599 -16.517 11.948 1.00 71.24 N ATOM 854 CA ASN A 55 10.854 -15.181 12.475 1.00 75.44 C ATOM 855 C ASN A 55 10.580 -14.118 11.416 1.00 54.51 C ATOM 856 O ASN A 55 10.208 -12.989 11.736 1.00 31.31 O ATOM 857 CB ASN A 55 12.299 -15.070 12.963 1.00 21.23 C ATOM 858 CG ASN A 55 12.421 -15.277 14.461 1.00 71.44 C ATOM 859 OD1 ASN A 55 11.699 -16.083 15.048 1.00 74.23 O ATOM 860 ND2 ASN A 55 13.338 -14.549 15.086 1.00 50.50 N ATOM 0 H ASN A 55 11.150 -16.757 11.124 1.00 71.24 H new ATOM 0 HA ASN A 55 10.180 -15.014 13.315 1.00 75.44 H new ATOM 0 HB2 ASN A 55 12.912 -15.808 12.446 1.00 21.23 H new ATOM 0 HB3 ASN A 55 12.694 -14.088 12.701 1.00 21.23 H new ATOM 0 HD21 ASN A 55 13.466 -14.646 16.093 1.00 50.50 H new ATOM 0 HD22 ASN A 55 13.914 -13.893 14.559 1.00 50.50 H new ATOM 867 N GLY A 56 10.766 -14.486 10.152 1.00 74.30 N ATOM 868 CA GLY A 56 10.534 -13.553 9.065 1.00 12.01 C ATOM 869 C GLY A 56 11.823 -13.014 8.479 1.00 44.22 C ATOM 870 O GLY A 56 11.822 -11.989 7.796 1.00 73.21 O ATOM 0 H GLY A 56 11.073 -15.414 9.861 1.00 74.30 H new ATOM 0 HA2 GLY A 56 9.961 -14.048 8.281 1.00 12.01 H new ATOM 0 HA3 GLY A 56 9.928 -12.722 9.426 1.00 12.01 H new ATOM 874 N ILE A 57 12.927 -13.704 8.747 1.00 40.43 N ATOM 875 CA ILE A 57 14.229 -13.287 8.241 1.00 61.10 C ATOM 876 C ILE A 57 14.553 -13.978 6.921 1.00 72.23 C ATOM 877 O ILE A 57 14.098 -15.094 6.663 1.00 3.33 O ATOM 878 CB ILE A 57 15.349 -13.589 9.254 1.00 63.42 C ATOM 879 CG1 ILE A 57 16.662 -12.945 8.803 1.00 13.32 C ATOM 880 CG2 ILE A 57 15.521 -15.092 9.421 1.00 11.20 C ATOM 881 CD1 ILE A 57 16.558 -11.451 8.586 1.00 60.30 C ATOM 0 H ILE A 57 12.946 -14.554 9.311 1.00 40.43 H new ATOM 0 HA ILE A 57 14.175 -12.210 8.081 1.00 61.10 H new ATOM 0 HB ILE A 57 15.070 -13.165 10.219 1.00 63.42 H new ATOM 0 HG12 ILE A 57 17.430 -13.143 9.551 1.00 13.32 H new ATOM 0 HG13 ILE A 57 16.990 -13.417 7.877 1.00 13.32 H new ATOM 0 HG21 ILE A 57 16.316 -15.290 10.140 1.00 11.20 H new ATOM 0 HG22 ILE A 57 14.589 -15.527 9.782 1.00 11.20 H new ATOM 0 HG23 ILE A 57 15.781 -15.537 8.461 1.00 11.20 H new ATOM 0 HD11 ILE A 57 17.525 -11.061 8.268 1.00 60.30 H new ATOM 0 HD12 ILE A 57 15.813 -11.246 7.817 1.00 60.30 H new ATOM 0 HD13 ILE A 57 16.261 -10.968 9.517 1.00 60.30 H new ATOM 893 N LEU A 58 15.342 -13.309 6.087 1.00 23.55 N ATOM 894 CA LEU A 58 15.729 -13.860 4.793 1.00 5.31 C ATOM 895 C LEU A 58 17.083 -14.558 4.881 1.00 52.20 C ATOM 896 O LEU A 58 18.100 -13.929 5.173 1.00 11.43 O ATOM 897 CB LEU A 58 15.782 -12.751 3.741 1.00 42.24 C ATOM 898 CG LEU A 58 15.111 -13.063 2.403 1.00 41.14 C ATOM 899 CD1 LEU A 58 15.773 -14.261 1.740 1.00 42.11 C ATOM 900 CD2 LEU A 58 13.623 -13.314 2.598 1.00 20.11 C ATOM 0 H LEU A 58 15.726 -12.385 6.284 1.00 23.55 H new ATOM 0 HA LEU A 58 14.980 -14.596 4.500 1.00 5.31 H new ATOM 0 HB2 LEU A 58 15.316 -11.859 4.159 1.00 42.24 H new ATOM 0 HB3 LEU A 58 16.827 -12.506 3.552 1.00 42.24 H new ATOM 0 HG LEU A 58 15.231 -12.200 1.749 1.00 41.14 H new ATOM 0 HD11 LEU A 58 15.282 -14.468 0.789 1.00 42.11 H new ATOM 0 HD12 LEU A 58 16.827 -14.044 1.565 1.00 42.11 H new ATOM 0 HD13 LEU A 58 15.685 -15.131 2.390 1.00 42.11 H new ATOM 0 HD21 LEU A 58 13.162 -13.534 1.635 1.00 20.11 H new ATOM 0 HD22 LEU A 58 13.482 -14.160 3.270 1.00 20.11 H new ATOM 0 HD23 LEU A 58 13.158 -12.427 3.029 1.00 20.11 H new ATOM 912 N PHE A 59 17.088 -15.862 4.624 1.00 10.40 N ATOM 913 CA PHE A 59 18.317 -16.646 4.673 1.00 54.42 C ATOM 914 C PHE A 59 18.771 -17.033 3.268 1.00 11.45 C ATOM 915 O PHE A 59 17.961 -17.419 2.426 1.00 33.31 O ATOM 916 CB PHE A 59 18.111 -17.904 5.519 1.00 12.52 C ATOM 917 CG PHE A 59 16.954 -18.748 5.067 1.00 51.22 C ATOM 918 CD1 PHE A 59 15.679 -18.520 5.558 1.00 54.50 C ATOM 919 CD2 PHE A 59 17.142 -19.770 4.151 1.00 72.14 C ATOM 920 CE1 PHE A 59 14.612 -19.294 5.143 1.00 33.34 C ATOM 921 CE2 PHE A 59 16.079 -20.548 3.732 1.00 13.11 C ATOM 922 CZ PHE A 59 14.812 -20.311 4.230 1.00 4.40 C ATOM 0 H PHE A 59 16.255 -16.398 4.380 1.00 10.40 H new ATOM 0 HA PHE A 59 19.093 -16.032 5.131 1.00 54.42 H new ATOM 0 HB2 PHE A 59 19.021 -18.504 5.491 1.00 12.52 H new ATOM 0 HB3 PHE A 59 17.954 -17.612 6.557 1.00 12.52 H new ATOM 0 HD1 PHE A 59 15.517 -17.728 6.274 1.00 54.50 H new ATOM 0 HD2 PHE A 59 18.130 -19.961 3.760 1.00 72.14 H new ATOM 0 HE1 PHE A 59 13.623 -19.104 5.532 1.00 33.34 H new ATOM 0 HE2 PHE A 59 16.239 -21.341 3.016 1.00 13.11 H new ATOM 0 HZ PHE A 59 13.980 -20.919 3.906 1.00 4.40 H new ATOM 932 N VAL A 60 20.073 -16.925 3.023 1.00 0.15 N ATOM 933 CA VAL A 60 20.637 -17.264 1.722 1.00 13.32 C ATOM 934 C VAL A 60 20.674 -18.774 1.516 1.00 42.32 C ATOM 935 O VAL A 60 20.920 -19.532 2.453 1.00 71.35 O ATOM 936 CB VAL A 60 22.061 -16.699 1.563 1.00 20.34 C ATOM 937 CG1 VAL A 60 22.549 -16.875 0.133 1.00 14.52 C ATOM 938 CG2 VAL A 60 22.102 -15.235 1.974 1.00 63.12 C ATOM 0 H VAL A 60 20.757 -16.605 3.709 1.00 0.15 H new ATOM 0 HA VAL A 60 19.990 -16.814 0.969 1.00 13.32 H new ATOM 0 HB VAL A 60 22.730 -17.255 2.220 1.00 20.34 H new ATOM 0 HG11 VAL A 60 23.557 -16.470 0.040 1.00 14.52 H new ATOM 0 HG12 VAL A 60 22.559 -17.935 -0.120 1.00 14.52 H new ATOM 0 HG13 VAL A 60 21.881 -16.346 -0.547 1.00 14.52 H new ATOM 0 HG21 VAL A 60 23.116 -14.852 1.855 1.00 63.12 H new ATOM 0 HG22 VAL A 60 21.421 -14.661 1.345 1.00 63.12 H new ATOM 0 HG23 VAL A 60 21.798 -15.141 3.017 1.00 63.12 H new ATOM 948 N ASN A 61 20.429 -19.203 0.282 1.00 21.11 N ATOM 949 CA ASN A 61 20.435 -20.624 -0.048 1.00 51.40 C ATOM 950 C ASN A 61 20.890 -20.846 -1.487 1.00 44.21 C ATOM 951 O ASN A 61 20.264 -21.592 -2.239 1.00 30.50 O ATOM 952 CB ASN A 61 19.041 -21.222 0.156 1.00 44.42 C ATOM 953 CG ASN A 61 19.057 -22.738 0.152 1.00 53.05 C ATOM 954 OD1 ASN A 61 19.965 -23.362 0.700 1.00 63.24 O ATOM 955 ND2 ASN A 61 18.048 -23.338 -0.469 1.00 55.11 N ATOM 0 H ASN A 61 20.224 -18.588 -0.505 1.00 21.11 H new ATOM 0 HA ASN A 61 21.139 -21.124 0.618 1.00 51.40 H new ATOM 0 HB2 ASN A 61 18.632 -20.868 1.102 1.00 44.42 H new ATOM 0 HB3 ASN A 61 18.377 -20.866 -0.632 1.00 44.42 H new ATOM 0 HD21 ASN A 61 18.005 -24.356 -0.505 1.00 55.11 H new ATOM 0 HD22 ASN A 61 17.317 -22.780 -0.910 1.00 55.11 H new ATOM 962 N SER A 62 21.985 -20.193 -1.863 1.00 43.30 N ATOM 963 CA SER A 62 22.523 -20.316 -3.213 1.00 24.03 C ATOM 964 C SER A 62 23.965 -19.819 -3.270 1.00 73.04 C ATOM 965 O SER A 62 24.574 -19.527 -2.241 1.00 71.21 O ATOM 966 CB SER A 62 21.661 -19.530 -4.202 1.00 70.12 C ATOM 967 OG SER A 62 21.972 -19.880 -5.540 1.00 2.23 O ATOM 0 H SER A 62 22.517 -19.573 -1.252 1.00 43.30 H new ATOM 0 HA SER A 62 22.509 -21.370 -3.489 1.00 24.03 H new ATOM 0 HB2 SER A 62 20.607 -19.727 -4.007 1.00 70.12 H new ATOM 0 HB3 SER A 62 21.818 -18.461 -4.057 1.00 70.12 H new ATOM 0 HG SER A 62 21.406 -19.365 -6.153 1.00 2.23 H new ATOM 973 N ARG A 63 24.504 -19.726 -4.482 1.00 13.44 N ATOM 974 CA ARG A 63 25.873 -19.265 -4.675 1.00 25.42 C ATOM 975 C ARG A 63 25.946 -17.742 -4.631 1.00 44.21 C ATOM 976 O ARG A 63 25.405 -17.060 -5.502 1.00 10.44 O ATOM 977 CB ARG A 63 26.422 -19.775 -6.009 1.00 52.21 C ATOM 978 CG ARG A 63 26.126 -21.243 -6.269 1.00 13.25 C ATOM 979 CD ARG A 63 26.802 -22.137 -5.241 1.00 72.54 C ATOM 980 NE ARG A 63 27.135 -23.448 -5.792 1.00 63.23 N ATOM 981 CZ ARG A 63 27.452 -24.500 -5.046 1.00 30.34 C ATOM 982 NH1 ARG A 63 27.477 -24.396 -3.724 1.00 45.11 N ATOM 983 NH2 ARG A 63 27.743 -25.660 -5.621 1.00 24.02 N ATOM 0 H ARG A 63 24.013 -19.964 -5.344 1.00 13.44 H new ATOM 0 HA ARG A 63 26.482 -19.663 -3.863 1.00 25.42 H new ATOM 0 HB2 ARG A 63 25.999 -19.179 -6.818 1.00 52.21 H new ATOM 0 HB3 ARG A 63 27.501 -19.621 -6.031 1.00 52.21 H new ATOM 0 HG2 ARG A 63 25.049 -21.408 -6.245 1.00 13.25 H new ATOM 0 HG3 ARG A 63 26.467 -21.513 -7.268 1.00 13.25 H new ATOM 0 HD2 ARG A 63 27.710 -21.653 -4.881 1.00 72.54 H new ATOM 0 HD3 ARG A 63 26.145 -22.262 -4.380 1.00 72.54 H new ATOM 0 HE ARG A 63 27.123 -23.562 -6.806 1.00 63.23 H new ATOM 0 HH11 ARG A 63 27.252 -23.507 -3.278 1.00 45.11 H new ATOM 0 HH12 ARG A 63 27.721 -25.205 -3.153 1.00 45.11 H new ATOM 0 HH21 ARG A 63 27.723 -25.745 -6.637 1.00 24.02 H new ATOM 0 HH22 ARG A 63 27.986 -26.467 -5.047 1.00 24.02 H new ATOM 997 N ILE A 64 26.618 -17.216 -3.613 1.00 3.15 N ATOM 998 CA ILE A 64 26.762 -15.774 -3.456 1.00 42.12 C ATOM 999 C ILE A 64 28.191 -15.329 -3.751 1.00 54.20 C ATOM 1000 O ILE A 64 28.447 -14.149 -3.990 1.00 2.45 O ATOM 1001 CB ILE A 64 26.378 -15.321 -2.035 1.00 41.53 C ATOM 1002 CG1 ILE A 64 25.022 -15.907 -1.638 1.00 72.05 C ATOM 1003 CG2 ILE A 64 26.349 -13.802 -1.954 1.00 12.42 C ATOM 1004 CD1 ILE A 64 23.907 -15.553 -2.597 1.00 74.02 C ATOM 0 H ILE A 64 27.072 -17.767 -2.884 1.00 3.15 H new ATOM 0 HA ILE A 64 26.084 -15.309 -4.172 1.00 42.12 H new ATOM 0 HB ILE A 64 27.130 -15.689 -1.336 1.00 41.53 H new ATOM 0 HG12 ILE A 64 25.108 -16.992 -1.578 1.00 72.05 H new ATOM 0 HG13 ILE A 64 24.760 -15.552 -0.641 1.00 72.05 H new ATOM 0 HG21 ILE A 64 26.076 -13.497 -0.944 1.00 12.42 H new ATOM 0 HG22 ILE A 64 27.334 -13.406 -2.199 1.00 12.42 H new ATOM 0 HG23 ILE A 64 25.616 -13.414 -2.661 1.00 12.42 H new ATOM 0 HD11 ILE A 64 22.975 -16.002 -2.253 1.00 74.02 H new ATOM 0 HD12 ILE A 64 23.794 -14.470 -2.640 1.00 74.02 H new ATOM 0 HD13 ILE A 64 24.147 -15.932 -3.590 1.00 74.02 H new ATOM 1016 N ASP A 65 29.116 -16.281 -3.735 1.00 23.44 N ATOM 1017 CA ASP A 65 30.519 -15.989 -4.003 1.00 45.43 C ATOM 1018 C ASP A 65 30.690 -15.367 -5.386 1.00 13.42 C ATOM 1019 O ASP A 65 29.959 -15.696 -6.320 1.00 34.22 O ATOM 1020 CB ASP A 65 31.358 -17.263 -3.897 1.00 71.42 C ATOM 1021 CG ASP A 65 30.718 -18.438 -4.610 1.00 33.42 C ATOM 1022 OD1 ASP A 65 30.363 -18.289 -5.798 1.00 35.45 O ATOM 1023 OD2 ASP A 65 30.571 -19.507 -3.980 1.00 1.24 O ATOM 0 H ASP A 65 28.920 -17.263 -3.539 1.00 23.44 H new ATOM 0 HA ASP A 65 30.864 -15.274 -3.256 1.00 45.43 H new ATOM 0 HB2 ASP A 65 32.346 -17.080 -4.319 1.00 71.42 H new ATOM 0 HB3 ASP A 65 31.502 -17.514 -2.846 1.00 71.42 H new ATOM 1028 N ARG A 66 31.658 -14.465 -5.508 1.00 44.02 N ATOM 1029 CA ARG A 66 31.923 -13.795 -6.776 1.00 30.12 C ATOM 1030 C ARG A 66 31.993 -14.803 -7.919 1.00 71.21 C ATOM 1031 O ARG A 66 31.677 -14.480 -9.064 1.00 30.14 O ATOM 1032 CB ARG A 66 33.231 -13.006 -6.697 1.00 21.03 C ATOM 1033 CG ARG A 66 34.474 -13.878 -6.775 1.00 51.41 C ATOM 1034 CD ARG A 66 35.682 -13.182 -6.167 1.00 15.21 C ATOM 1035 NE ARG A 66 36.769 -13.032 -7.130 1.00 3.22 N ATOM 1036 CZ ARG A 66 37.970 -12.560 -6.814 1.00 41.54 C ATOM 1037 NH1 ARG A 66 38.236 -12.194 -5.568 1.00 12.20 N ATOM 1038 NH2 ARG A 66 38.908 -12.453 -7.747 1.00 3.23 N ATOM 0 H ARG A 66 32.272 -14.181 -4.745 1.00 44.02 H new ATOM 0 HA ARG A 66 31.102 -13.105 -6.972 1.00 30.12 H new ATOM 0 HB2 ARG A 66 33.256 -12.279 -7.508 1.00 21.03 H new ATOM 0 HB3 ARG A 66 33.250 -12.443 -5.764 1.00 21.03 H new ATOM 0 HG2 ARG A 66 34.294 -14.818 -6.253 1.00 51.41 H new ATOM 0 HG3 ARG A 66 34.681 -14.126 -7.816 1.00 51.41 H new ATOM 0 HD2 ARG A 66 35.387 -12.200 -5.798 1.00 15.21 H new ATOM 0 HD3 ARG A 66 36.035 -13.753 -5.308 1.00 15.21 H new ATOM 0 HE ARG A 66 36.597 -13.304 -8.098 1.00 3.22 H new ATOM 0 HH11 ARG A 66 37.518 -12.274 -4.848 1.00 12.20 H new ATOM 0 HH12 ARG A 66 39.159 -11.832 -5.329 1.00 12.20 H new ATOM 0 HH21 ARG A 66 38.707 -12.733 -8.707 1.00 3.23 H new ATOM 0 HH22 ARG A 66 39.830 -12.091 -7.504 1.00 3.23 H new ATOM 1052 N GLU A 67 32.409 -16.025 -7.600 1.00 3.42 N ATOM 1053 CA GLU A 67 32.522 -17.079 -8.601 1.00 52.31 C ATOM 1054 C GLU A 67 31.224 -17.218 -9.392 1.00 64.33 C ATOM 1055 O GLU A 67 31.179 -16.922 -10.586 1.00 12.34 O ATOM 1056 CB GLU A 67 32.871 -18.411 -7.934 1.00 43.14 C ATOM 1057 CG GLU A 67 33.335 -19.477 -8.912 1.00 63.51 C ATOM 1058 CD GLU A 67 32.344 -20.617 -9.046 1.00 70.00 C ATOM 1059 OE1 GLU A 67 31.726 -20.990 -8.027 1.00 5.12 O ATOM 1060 OE2 GLU A 67 32.186 -21.136 -10.171 1.00 52.31 O ATOM 0 H GLU A 67 32.673 -16.309 -6.657 1.00 3.42 H new ATOM 0 HA GLU A 67 33.321 -16.806 -9.291 1.00 52.31 H new ATOM 0 HB2 GLU A 67 33.653 -18.243 -7.194 1.00 43.14 H new ATOM 0 HB3 GLU A 67 31.997 -18.779 -7.396 1.00 43.14 H new ATOM 0 HG2 GLU A 67 33.495 -19.023 -9.890 1.00 63.51 H new ATOM 0 HG3 GLU A 67 34.296 -19.873 -8.583 1.00 63.51 H new ATOM 1067 N GLU A 68 30.173 -17.672 -8.718 1.00 33.43 N ATOM 1068 CA GLU A 68 28.875 -17.853 -9.358 1.00 42.21 C ATOM 1069 C GLU A 68 28.107 -16.535 -9.412 1.00 62.32 C ATOM 1070 O GLU A 68 27.433 -16.237 -10.399 1.00 14.35 O ATOM 1071 CB GLU A 68 28.054 -18.904 -8.609 1.00 73.32 C ATOM 1072 CG GLU A 68 27.913 -20.216 -9.362 1.00 73.43 C ATOM 1073 CD GLU A 68 28.840 -21.294 -8.835 1.00 61.12 C ATOM 1074 OE1 GLU A 68 28.878 -21.494 -7.603 1.00 62.54 O ATOM 1075 OE2 GLU A 68 29.528 -21.937 -9.656 1.00 33.53 O ATOM 0 H GLU A 68 30.194 -17.921 -7.729 1.00 33.43 H new ATOM 0 HA GLU A 68 29.046 -18.196 -10.378 1.00 42.21 H new ATOM 0 HB2 GLU A 68 28.521 -19.097 -7.643 1.00 73.32 H new ATOM 0 HB3 GLU A 68 27.061 -18.502 -8.408 1.00 73.32 H new ATOM 0 HG2 GLU A 68 26.882 -20.562 -9.291 1.00 73.43 H new ATOM 0 HG3 GLU A 68 28.121 -20.048 -10.419 1.00 73.43 H new ATOM 1082 N LEU A 69 28.214 -15.751 -8.345 1.00 61.13 N ATOM 1083 CA LEU A 69 27.530 -14.465 -8.269 1.00 52.14 C ATOM 1084 C LEU A 69 27.720 -13.670 -9.558 1.00 34.35 C ATOM 1085 O LEU A 69 26.781 -13.494 -10.335 1.00 61.42 O ATOM 1086 CB LEU A 69 28.049 -13.658 -7.078 1.00 31.21 C ATOM 1087 CG LEU A 69 27.183 -12.477 -6.639 1.00 43.41 C ATOM 1088 CD1 LEU A 69 27.287 -11.338 -7.642 1.00 13.34 C ATOM 1089 CD2 LEU A 69 25.735 -12.911 -6.470 1.00 14.42 C ATOM 0 H LEU A 69 28.768 -15.983 -7.521 1.00 61.13 H new ATOM 0 HA LEU A 69 26.465 -14.655 -8.134 1.00 52.14 H new ATOM 0 HB2 LEU A 69 28.164 -14.333 -6.230 1.00 31.21 H new ATOM 0 HB3 LEU A 69 29.042 -13.283 -7.324 1.00 31.21 H new ATOM 0 HG LEU A 69 27.549 -12.121 -5.676 1.00 43.41 H new ATOM 0 HD11 LEU A 69 26.664 -10.506 -7.314 1.00 13.34 H new ATOM 0 HD12 LEU A 69 28.324 -11.009 -7.713 1.00 13.34 H new ATOM 0 HD13 LEU A 69 26.948 -11.682 -8.619 1.00 13.34 H new ATOM 0 HD21 LEU A 69 25.133 -12.057 -6.157 1.00 14.42 H new ATOM 0 HD22 LEU A 69 25.357 -13.294 -7.418 1.00 14.42 H new ATOM 0 HD23 LEU A 69 25.676 -13.693 -5.713 1.00 14.42 H new ATOM 1101 N CYS A 70 28.940 -13.194 -9.778 1.00 42.13 N ATOM 1102 CA CYS A 70 29.255 -12.419 -10.973 1.00 30.53 C ATOM 1103 C CYS A 70 30.752 -12.457 -11.266 1.00 40.42 C ATOM 1104 O CYS A 70 31.171 -12.820 -12.364 1.00 43.43 O ATOM 1105 CB CYS A 70 28.793 -10.971 -10.803 1.00 42.20 C ATOM 1106 SG CYS A 70 27.122 -10.643 -11.449 1.00 13.21 S ATOM 0 H CYS A 70 29.728 -13.331 -9.145 1.00 42.13 H new ATOM 0 HA CYS A 70 28.727 -12.865 -11.816 1.00 30.53 H new ATOM 0 HB2 CYS A 70 28.818 -10.715 -9.744 1.00 42.20 H new ATOM 0 HB3 CYS A 70 29.501 -10.313 -11.307 1.00 42.20 H new ATOM 1111 N GLY A 71 31.554 -12.078 -10.275 1.00 35.21 N ATOM 1112 CA GLY A 71 32.995 -12.076 -10.446 1.00 54.41 C ATOM 1113 C GLY A 71 33.480 -10.893 -11.260 1.00 54.53 C ATOM 1114 O GLY A 71 34.214 -10.042 -10.756 1.00 35.50 O ATOM 0 H GLY A 71 31.231 -11.772 -9.357 1.00 35.21 H new ATOM 0 HA2 GLY A 71 33.474 -12.060 -9.467 1.00 54.41 H new ATOM 0 HA3 GLY A 71 33.301 -13.000 -10.936 1.00 54.41 H new ATOM 1118 N ARG A 72 33.070 -10.838 -12.524 1.00 2.15 N ATOM 1119 CA ARG A 72 33.470 -9.752 -13.410 1.00 2.20 C ATOM 1120 C ARG A 72 33.184 -8.396 -12.772 1.00 3.34 C ATOM 1121 O ARG A 72 34.100 -7.700 -12.333 1.00 12.51 O ATOM 1122 CB ARG A 72 32.738 -9.862 -14.749 1.00 1.23 C ATOM 1123 CG ARG A 72 33.516 -10.626 -15.807 1.00 43.25 C ATOM 1124 CD ARG A 72 32.833 -10.550 -17.164 1.00 44.31 C ATOM 1125 NE ARG A 72 33.021 -9.248 -17.799 1.00 13.11 N ATOM 1126 CZ ARG A 72 32.581 -8.954 -19.018 1.00 30.55 C ATOM 1127 NH1 ARG A 72 31.932 -9.866 -19.729 1.00 15.32 N ATOM 1128 NH2 ARG A 72 32.790 -7.747 -19.527 1.00 22.21 N ATOM 0 H ARG A 72 32.461 -11.533 -12.957 1.00 2.15 H new ATOM 0 HA ARG A 72 34.543 -9.834 -13.582 1.00 2.20 H new ATOM 0 HB2 ARG A 72 31.779 -10.354 -14.590 1.00 1.23 H new ATOM 0 HB3 ARG A 72 32.524 -8.860 -15.120 1.00 1.23 H new ATOM 0 HG2 ARG A 72 34.525 -10.220 -15.883 1.00 43.25 H new ATOM 0 HG3 ARG A 72 33.614 -11.669 -15.506 1.00 43.25 H new ATOM 0 HD2 ARG A 72 33.229 -11.331 -17.813 1.00 44.31 H new ATOM 0 HD3 ARG A 72 31.767 -10.745 -17.045 1.00 44.31 H new ATOM 0 HE ARG A 72 33.517 -8.525 -17.278 1.00 13.11 H new ATOM 0 HH11 ARG A 72 31.770 -10.795 -19.340 1.00 15.32 H new ATOM 0 HH12 ARG A 72 31.595 -9.638 -20.664 1.00 15.32 H new ATOM 0 HH21 ARG A 72 33.289 -7.043 -18.983 1.00 22.21 H new ATOM 0 HH22 ARG A 72 32.452 -7.523 -20.463 1.00 22.21 H new ATOM 1142 N SER A 73 31.908 -8.027 -12.724 1.00 21.11 N ATOM 1143 CA SER A 73 31.502 -6.753 -12.143 1.00 53.34 C ATOM 1144 C SER A 73 31.549 -6.810 -10.620 1.00 35.34 C ATOM 1145 O SER A 73 30.877 -7.633 -9.998 1.00 12.33 O ATOM 1146 CB SER A 73 30.092 -6.383 -12.608 1.00 73.00 C ATOM 1147 OG SER A 73 29.977 -4.988 -12.831 1.00 24.24 O ATOM 0 H SER A 73 31.138 -8.592 -13.081 1.00 21.11 H new ATOM 0 HA SER A 73 32.201 -5.988 -12.482 1.00 53.34 H new ATOM 0 HB2 SER A 73 29.855 -6.922 -13.526 1.00 73.00 H new ATOM 0 HB3 SER A 73 29.365 -6.696 -11.858 1.00 73.00 H new ATOM 0 HG SER A 73 29.067 -4.778 -13.129 1.00 24.24 H new ATOM 1153 N ALA A 74 32.347 -5.930 -10.025 1.00 24.43 N ATOM 1154 CA ALA A 74 32.481 -5.879 -8.574 1.00 43.32 C ATOM 1155 C ALA A 74 31.120 -5.730 -7.902 1.00 65.33 C ATOM 1156 O ALA A 74 30.792 -6.470 -6.975 1.00 64.14 O ATOM 1157 CB ALA A 74 33.399 -4.735 -8.169 1.00 65.04 C ATOM 0 H ALA A 74 32.911 -5.243 -10.525 1.00 24.43 H new ATOM 0 HA ALA A 74 32.921 -6.819 -8.241 1.00 43.32 H new ATOM 0 HB1 ALA A 74 33.490 -4.709 -7.083 1.00 65.04 H new ATOM 0 HB2 ALA A 74 34.384 -4.884 -8.612 1.00 65.04 H new ATOM 0 HB3 ALA A 74 32.982 -3.792 -8.521 1.00 65.04 H new ATOM 1163 N GLU A 75 30.333 -4.769 -8.376 1.00 24.23 N ATOM 1164 CA GLU A 75 29.009 -4.524 -7.818 1.00 55.22 C ATOM 1165 C GLU A 75 27.921 -5.076 -8.736 1.00 24.24 C ATOM 1166 O GLU A 75 27.614 -4.491 -9.775 1.00 34.53 O ATOM 1167 CB GLU A 75 28.793 -3.025 -7.599 1.00 32.05 C ATOM 1168 CG GLU A 75 29.388 -2.508 -6.299 1.00 60.45 C ATOM 1169 CD GLU A 75 28.898 -1.118 -5.946 1.00 11.34 C ATOM 1170 OE1 GLU A 75 27.923 -0.655 -6.574 1.00 71.24 O ATOM 1171 OE2 GLU A 75 29.489 -0.492 -5.041 1.00 33.12 O ATOM 0 H GLU A 75 30.589 -4.149 -9.144 1.00 24.23 H new ATOM 0 HA GLU A 75 28.947 -5.037 -6.858 1.00 55.22 H new ATOM 0 HB2 GLU A 75 29.232 -2.477 -8.433 1.00 32.05 H new ATOM 0 HB3 GLU A 75 27.723 -2.815 -7.608 1.00 32.05 H new ATOM 0 HG2 GLU A 75 29.136 -3.194 -5.490 1.00 60.45 H new ATOM 0 HG3 GLU A 75 30.475 -2.496 -6.381 1.00 60.45 H new ATOM 1178 N CYS A 76 27.343 -6.207 -8.344 1.00 45.02 N ATOM 1179 CA CYS A 76 26.292 -6.841 -9.130 1.00 14.40 C ATOM 1180 C CYS A 76 24.953 -6.775 -8.400 1.00 50.23 C ATOM 1181 O CYS A 76 24.887 -6.960 -7.185 1.00 51.21 O ATOM 1182 CB CYS A 76 26.653 -8.298 -9.424 1.00 44.33 C ATOM 1183 SG CYS A 76 26.835 -8.675 -11.197 1.00 63.21 S ATOM 0 H CYS A 76 27.585 -6.703 -7.486 1.00 45.02 H new ATOM 0 HA CYS A 76 26.201 -6.300 -10.072 1.00 14.40 H new ATOM 0 HB2 CYS A 76 27.586 -8.540 -8.914 1.00 44.33 H new ATOM 0 HB3 CYS A 76 25.883 -8.944 -9.003 1.00 44.33 H new ATOM 1188 N SER A 77 23.888 -6.510 -9.151 1.00 65.20 N ATOM 1189 CA SER A 77 22.552 -6.416 -8.576 1.00 33.41 C ATOM 1190 C SER A 77 21.709 -7.630 -8.959 1.00 4.55 C ATOM 1191 O SER A 77 21.926 -8.245 -10.003 1.00 40.41 O ATOM 1192 CB SER A 77 21.861 -5.134 -9.044 1.00 2.24 C ATOM 1193 OG SER A 77 22.325 -4.743 -10.324 1.00 43.41 O ATOM 0 H SER A 77 23.925 -6.357 -10.159 1.00 65.20 H new ATOM 0 HA SER A 77 22.651 -6.391 -7.491 1.00 33.41 H new ATOM 0 HB2 SER A 77 20.783 -5.289 -9.076 1.00 2.24 H new ATOM 0 HB3 SER A 77 22.046 -4.335 -8.327 1.00 2.24 H new ATOM 0 HG SER A 77 21.867 -3.922 -10.601 1.00 43.41 H new ATOM 1199 N ILE A 78 20.748 -7.967 -8.105 1.00 64.43 N ATOM 1200 CA ILE A 78 19.873 -9.106 -8.354 1.00 14.33 C ATOM 1201 C ILE A 78 18.406 -8.712 -8.212 1.00 61.15 C ATOM 1202 O ILE A 78 18.042 -7.938 -7.327 1.00 5.42 O ATOM 1203 CB ILE A 78 20.175 -10.269 -7.391 1.00 61.43 C ATOM 1204 CG1 ILE A 78 21.625 -10.730 -7.554 1.00 20.43 C ATOM 1205 CG2 ILE A 78 19.216 -11.424 -7.638 1.00 54.01 C ATOM 1206 CD1 ILE A 78 22.530 -10.288 -6.425 1.00 52.11 C ATOM 0 H ILE A 78 20.556 -7.468 -7.236 1.00 64.43 H new ATOM 0 HA ILE A 78 20.063 -9.433 -9.376 1.00 14.33 H new ATOM 0 HB ILE A 78 20.036 -9.920 -6.368 1.00 61.43 H new ATOM 0 HG12 ILE A 78 21.647 -11.818 -7.622 1.00 20.43 H new ATOM 0 HG13 ILE A 78 22.017 -10.344 -8.495 1.00 20.43 H new ATOM 0 HG21 ILE A 78 19.442 -12.238 -6.950 1.00 54.01 H new ATOM 0 HG22 ILE A 78 18.192 -11.087 -7.478 1.00 54.01 H new ATOM 0 HG23 ILE A 78 19.326 -11.775 -8.664 1.00 54.01 H new ATOM 0 HD11 ILE A 78 23.542 -10.650 -6.607 1.00 52.11 H new ATOM 0 HD12 ILE A 78 22.538 -9.199 -6.370 1.00 52.11 H new ATOM 0 HD13 ILE A 78 22.163 -10.696 -5.483 1.00 52.11 H new ATOM 1218 N HIS A 79 17.567 -9.252 -9.091 1.00 31.25 N ATOM 1219 CA HIS A 79 16.138 -8.959 -9.063 1.00 22.35 C ATOM 1220 C HIS A 79 15.334 -10.210 -8.723 1.00 33.35 C ATOM 1221 O HIS A 79 15.662 -11.312 -9.165 1.00 41.34 O ATOM 1222 CB HIS A 79 15.685 -8.398 -10.410 1.00 52.24 C ATOM 1223 CG HIS A 79 16.600 -7.347 -10.960 1.00 14.11 C ATOM 1224 ND1 HIS A 79 17.472 -7.579 -12.002 1.00 51.23 N ATOM 1225 CD2 HIS A 79 16.773 -6.052 -10.607 1.00 4.13 C ATOM 1226 CE1 HIS A 79 18.144 -6.472 -12.265 1.00 60.34 C ATOM 1227 NE2 HIS A 79 17.739 -5.531 -11.433 1.00 15.52 N ATOM 0 H HIS A 79 17.852 -9.894 -9.831 1.00 31.25 H new ATOM 0 HA HIS A 79 15.960 -8.213 -8.289 1.00 22.35 H new ATOM 0 HB2 HIS A 79 15.610 -9.215 -11.128 1.00 52.24 H new ATOM 0 HB3 HIS A 79 14.685 -7.977 -10.301 1.00 52.24 H new ATOM 0 HD2 HIS A 79 16.249 -5.526 -9.822 1.00 4.13 H new ATOM 0 HE1 HIS A 79 18.897 -6.357 -13.031 1.00 60.34 H new ATOM 0 HE2 HIS A 79 18.087 -4.572 -11.407 1.00 15.52 H new ATOM 1235 N LEU A 80 14.280 -10.034 -7.934 1.00 13.55 N ATOM 1236 CA LEU A 80 13.428 -11.148 -7.533 1.00 61.33 C ATOM 1237 C LEU A 80 11.971 -10.709 -7.425 1.00 64.22 C ATOM 1238 O LEU A 80 11.682 -9.529 -7.230 1.00 22.33 O ATOM 1239 CB LEU A 80 13.900 -11.722 -6.196 1.00 43.01 C ATOM 1240 CG LEU A 80 13.064 -12.867 -5.624 1.00 60.34 C ATOM 1241 CD1 LEU A 80 13.944 -13.836 -4.850 1.00 2.24 C ATOM 1242 CD2 LEU A 80 11.954 -12.325 -4.736 1.00 73.31 C ATOM 0 H LEU A 80 13.995 -9.129 -7.559 1.00 13.55 H new ATOM 0 HA LEU A 80 13.499 -11.921 -8.298 1.00 61.33 H new ATOM 0 HB2 LEU A 80 14.925 -12.072 -6.316 1.00 43.01 H new ATOM 0 HB3 LEU A 80 13.922 -10.914 -5.464 1.00 43.01 H new ATOM 0 HG LEU A 80 12.607 -13.407 -6.453 1.00 60.34 H new ATOM 0 HD11 LEU A 80 13.331 -14.644 -4.450 1.00 2.24 H new ATOM 0 HD12 LEU A 80 14.702 -14.250 -5.515 1.00 2.24 H new ATOM 0 HD13 LEU A 80 14.430 -13.309 -4.029 1.00 2.24 H new ATOM 0 HD21 LEU A 80 11.369 -13.154 -4.338 1.00 73.31 H new ATOM 0 HD22 LEU A 80 12.390 -11.760 -3.912 1.00 73.31 H new ATOM 0 HD23 LEU A 80 11.306 -11.672 -5.321 1.00 73.31 H new ATOM 1254 N GLU A 81 11.059 -11.668 -7.552 1.00 12.41 N ATOM 1255 CA GLU A 81 9.632 -11.379 -7.467 1.00 10.12 C ATOM 1256 C GLU A 81 8.939 -12.340 -6.505 1.00 11.41 C ATOM 1257 O GLU A 81 8.853 -13.540 -6.763 1.00 75.15 O ATOM 1258 CB GLU A 81 8.987 -11.472 -8.851 1.00 52.01 C ATOM 1259 CG GLU A 81 8.674 -10.120 -9.469 1.00 13.40 C ATOM 1260 CD GLU A 81 7.934 -10.238 -10.787 1.00 41.35 C ATOM 1261 OE1 GLU A 81 6.716 -10.513 -10.761 1.00 62.21 O ATOM 1262 OE2 GLU A 81 8.572 -10.055 -11.845 1.00 25.11 O ATOM 0 H GLU A 81 11.282 -12.650 -7.714 1.00 12.41 H new ATOM 0 HA GLU A 81 9.515 -10.364 -7.087 1.00 10.12 H new ATOM 0 HB2 GLU A 81 9.653 -12.021 -9.517 1.00 52.01 H new ATOM 0 HB3 GLU A 81 8.066 -12.049 -8.775 1.00 52.01 H new ATOM 0 HG2 GLU A 81 8.074 -9.536 -8.771 1.00 13.40 H new ATOM 0 HG3 GLU A 81 9.603 -9.573 -9.626 1.00 13.40 H new ATOM 1269 N VAL A 82 8.447 -11.802 -5.393 1.00 74.12 N ATOM 1270 CA VAL A 82 7.761 -12.610 -4.392 1.00 74.12 C ATOM 1271 C VAL A 82 6.260 -12.656 -4.657 1.00 60.44 C ATOM 1272 O VAL A 82 5.553 -11.668 -4.457 1.00 24.14 O ATOM 1273 CB VAL A 82 8.003 -12.068 -2.971 1.00 22.10 C ATOM 1274 CG1 VAL A 82 7.609 -13.104 -1.930 1.00 31.34 C ATOM 1275 CG2 VAL A 82 9.457 -11.655 -2.800 1.00 1.41 C ATOM 0 H VAL A 82 8.511 -10.810 -5.163 1.00 74.12 H new ATOM 0 HA VAL A 82 8.171 -13.617 -4.464 1.00 74.12 H new ATOM 0 HB VAL A 82 7.379 -11.187 -2.826 1.00 22.10 H new ATOM 0 HG11 VAL A 82 7.787 -12.703 -0.932 1.00 31.34 H new ATOM 0 HG12 VAL A 82 6.552 -13.347 -2.040 1.00 31.34 H new ATOM 0 HG13 VAL A 82 8.205 -14.006 -2.070 1.00 31.34 H new ATOM 0 HG21 VAL A 82 9.611 -11.274 -1.790 1.00 1.41 H new ATOM 0 HG22 VAL A 82 10.102 -12.518 -2.965 1.00 1.41 H new ATOM 0 HG23 VAL A 82 9.701 -10.876 -3.522 1.00 1.41 H new ATOM 1285 N ILE A 83 5.780 -13.810 -5.109 1.00 71.10 N ATOM 1286 CA ILE A 83 4.363 -13.985 -5.400 1.00 75.51 C ATOM 1287 C ILE A 83 3.580 -14.329 -4.137 1.00 63.20 C ATOM 1288 O ILE A 83 3.975 -15.206 -3.369 1.00 21.33 O ATOM 1289 CB ILE A 83 4.136 -15.091 -6.448 1.00 34.32 C ATOM 1290 CG1 ILE A 83 2.639 -15.357 -6.625 1.00 3.00 C ATOM 1291 CG2 ILE A 83 4.860 -16.365 -6.039 1.00 45.11 C ATOM 1292 CD1 ILE A 83 2.124 -16.499 -5.777 1.00 52.14 C ATOM 0 H ILE A 83 6.352 -14.637 -5.281 1.00 71.10 H new ATOM 0 HA ILE A 83 4.004 -13.037 -5.800 1.00 75.51 H new ATOM 0 HB ILE A 83 4.542 -14.755 -7.402 1.00 34.32 H new ATOM 0 HG12 ILE A 83 2.085 -14.452 -6.376 1.00 3.00 H new ATOM 0 HG13 ILE A 83 2.438 -15.575 -7.674 1.00 3.00 H new ATOM 0 HG21 ILE A 83 4.690 -17.137 -6.789 1.00 45.11 H new ATOM 0 HG22 ILE A 83 5.929 -16.166 -5.958 1.00 45.11 H new ATOM 0 HG23 ILE A 83 4.481 -16.706 -5.076 1.00 45.11 H new ATOM 0 HD11 ILE A 83 1.056 -16.631 -5.953 1.00 52.14 H new ATOM 0 HD12 ILE A 83 2.651 -17.415 -6.042 1.00 52.14 H new ATOM 0 HD13 ILE A 83 2.293 -16.275 -4.724 1.00 52.14 H new ATOM 1304 N VAL A 84 2.467 -13.633 -3.929 1.00 61.11 N ATOM 1305 CA VAL A 84 1.627 -13.866 -2.761 1.00 33.23 C ATOM 1306 C VAL A 84 0.171 -14.076 -3.164 1.00 4.35 C ATOM 1307 O VAL A 84 -0.347 -13.382 -4.038 1.00 55.40 O ATOM 1308 CB VAL A 84 1.709 -12.692 -1.767 1.00 30.31 C ATOM 1309 CG1 VAL A 84 3.033 -12.717 -1.019 1.00 63.31 C ATOM 1310 CG2 VAL A 84 1.521 -11.368 -2.491 1.00 0.30 C ATOM 0 H VAL A 84 2.126 -12.903 -4.555 1.00 61.11 H new ATOM 0 HA VAL A 84 2.001 -14.768 -2.277 1.00 33.23 H new ATOM 0 HB VAL A 84 0.906 -12.799 -1.038 1.00 30.31 H new ATOM 0 HG11 VAL A 84 3.073 -11.880 -0.322 1.00 63.31 H new ATOM 0 HG12 VAL A 84 3.122 -13.653 -0.468 1.00 63.31 H new ATOM 0 HG13 VAL A 84 3.855 -12.635 -1.731 1.00 63.31 H new ATOM 0 HG21 VAL A 84 1.582 -10.549 -1.774 1.00 0.30 H new ATOM 0 HG22 VAL A 84 2.301 -11.250 -3.243 1.00 0.30 H new ATOM 0 HG23 VAL A 84 0.545 -11.354 -2.976 1.00 0.30 H new ATOM 1320 N ASP A 85 -0.482 -15.037 -2.520 1.00 13.51 N ATOM 1321 CA ASP A 85 -1.880 -15.337 -2.810 1.00 24.15 C ATOM 1322 C ASP A 85 -2.783 -14.869 -1.673 1.00 20.22 C ATOM 1323 O ASP A 85 -2.703 -15.377 -0.554 1.00 43.40 O ATOM 1324 CB ASP A 85 -2.064 -16.838 -3.039 1.00 44.00 C ATOM 1325 CG ASP A 85 -2.799 -17.140 -4.330 1.00 30.42 C ATOM 1326 OD1 ASP A 85 -2.171 -17.053 -5.406 1.00 4.13 O ATOM 1327 OD2 ASP A 85 -4.003 -17.465 -4.264 1.00 62.42 O ATOM 0 H ASP A 85 -0.067 -15.621 -1.794 1.00 13.51 H new ATOM 0 HA ASP A 85 -2.161 -14.802 -3.717 1.00 24.15 H new ATOM 0 HB2 ASP A 85 -1.088 -17.322 -3.058 1.00 44.00 H new ATOM 0 HB3 ASP A 85 -2.615 -17.266 -2.202 1.00 44.00 H new ATOM 1332 N ARG A 86 -3.641 -13.898 -1.967 1.00 73.14 N ATOM 1333 CA ARG A 86 -4.558 -13.360 -0.970 1.00 20.15 C ATOM 1334 C ARG A 86 -3.796 -12.615 0.123 1.00 54.23 C ATOM 1335 O ARG A 86 -3.483 -13.163 1.179 1.00 24.15 O ATOM 1336 CB ARG A 86 -5.389 -14.485 -0.350 1.00 23.32 C ATOM 1337 CG ARG A 86 -6.859 -14.440 -0.734 1.00 44.21 C ATOM 1338 CD ARG A 86 -7.632 -13.463 0.137 1.00 11.33 C ATOM 1339 NE ARG A 86 -8.967 -13.197 -0.391 1.00 54.32 N ATOM 1340 CZ ARG A 86 -9.941 -12.638 0.319 1.00 41.30 C ATOM 1341 NH1 ARG A 86 -9.729 -12.287 1.580 1.00 62.11 N ATOM 1342 NH2 ARG A 86 -11.129 -12.428 -0.232 1.00 55.23 N ATOM 0 H ARG A 86 -3.720 -13.468 -2.888 1.00 73.14 H new ATOM 0 HA ARG A 86 -5.225 -12.657 -1.469 1.00 20.15 H new ATOM 0 HB2 ARG A 86 -4.972 -15.444 -0.656 1.00 23.32 H new ATOM 0 HB3 ARG A 86 -5.304 -14.432 0.735 1.00 23.32 H new ATOM 0 HG2 ARG A 86 -6.954 -14.150 -1.780 1.00 44.21 H new ATOM 0 HG3 ARG A 86 -7.292 -15.436 -0.638 1.00 44.21 H new ATOM 0 HD2 ARG A 86 -7.715 -13.865 1.147 1.00 11.33 H new ATOM 0 HD3 ARG A 86 -7.078 -12.527 0.211 1.00 11.33 H new ATOM 0 HE ARG A 86 -9.163 -13.455 -1.358 1.00 54.32 H new ATOM 0 HH11 ARG A 86 -8.816 -12.446 2.007 1.00 62.11 H new ATOM 0 HH12 ARG A 86 -10.478 -11.858 2.123 1.00 62.11 H new ATOM 0 HH21 ARG A 86 -11.296 -12.696 -1.202 1.00 55.23 H new ATOM 0 HH22 ARG A 86 -11.876 -11.999 0.314 1.00 55.23 H new ATOM 1356 N PRO A 87 -3.491 -11.335 -0.137 1.00 2.23 N ATOM 1357 CA PRO A 87 -3.859 -10.672 -1.391 1.00 44.24 C ATOM 1358 C PRO A 87 -3.068 -11.204 -2.582 1.00 21.03 C ATOM 1359 O PRO A 87 -1.988 -11.774 -2.418 1.00 52.22 O ATOM 1360 CB PRO A 87 -3.511 -9.204 -1.132 1.00 10.21 C ATOM 1361 CG PRO A 87 -2.449 -9.245 -0.088 1.00 14.34 C ATOM 1362 CD PRO A 87 -2.762 -10.436 0.775 1.00 73.44 C ATOM 0 HA PRO A 87 -4.905 -10.838 -1.647 1.00 44.24 H new ATOM 0 HB2 PRO A 87 -3.156 -8.715 -2.039 1.00 10.21 H new ATOM 0 HB3 PRO A 87 -4.382 -8.645 -0.789 1.00 10.21 H new ATOM 0 HG2 PRO A 87 -1.461 -9.339 -0.540 1.00 14.34 H new ATOM 0 HG3 PRO A 87 -2.444 -8.327 0.500 1.00 14.34 H new ATOM 0 HD2 PRO A 87 -1.855 -10.903 1.160 1.00 73.44 H new ATOM 0 HD3 PRO A 87 -3.369 -10.159 1.637 1.00 73.44 H new ATOM 1370 N LEU A 88 -3.611 -11.015 -3.779 1.00 53.20 N ATOM 1371 CA LEU A 88 -2.956 -11.476 -4.998 1.00 41.41 C ATOM 1372 C LEU A 88 -2.093 -10.373 -5.603 1.00 2.23 C ATOM 1373 O LEU A 88 -2.608 -9.376 -6.107 1.00 40.43 O ATOM 1374 CB LEU A 88 -3.998 -11.939 -6.017 1.00 73.40 C ATOM 1375 CG LEU A 88 -4.688 -13.270 -5.713 1.00 55.41 C ATOM 1376 CD1 LEU A 88 -5.889 -13.053 -4.806 1.00 14.24 C ATOM 1377 CD2 LEU A 88 -5.110 -13.959 -7.003 1.00 2.32 C ATOM 0 H LEU A 88 -4.504 -10.546 -3.932 1.00 53.20 H new ATOM 0 HA LEU A 88 -2.312 -12.316 -4.739 1.00 41.41 H new ATOM 0 HB2 LEU A 88 -4.763 -11.167 -6.101 1.00 73.40 H new ATOM 0 HB3 LEU A 88 -3.515 -12.017 -6.991 1.00 73.40 H new ATOM 0 HG LEU A 88 -3.978 -13.915 -5.195 1.00 55.41 H new ATOM 0 HD11 LEU A 88 -6.367 -14.011 -4.600 1.00 14.24 H new ATOM 0 HD12 LEU A 88 -5.561 -12.603 -3.869 1.00 14.24 H new ATOM 0 HD13 LEU A 88 -6.601 -12.390 -5.297 1.00 14.24 H new ATOM 0 HD21 LEU A 88 -5.599 -14.904 -6.767 1.00 2.32 H new ATOM 0 HD22 LEU A 88 -5.803 -13.318 -7.548 1.00 2.32 H new ATOM 0 HD23 LEU A 88 -4.231 -14.149 -7.618 1.00 2.32 H new ATOM 1389 N GLN A 89 -0.778 -10.561 -5.549 1.00 52.12 N ATOM 1390 CA GLN A 89 0.156 -9.582 -6.093 1.00 72.22 C ATOM 1391 C GLN A 89 1.597 -10.048 -5.916 1.00 21.11 C ATOM 1392 O GLN A 89 1.848 -11.164 -5.460 1.00 43.20 O ATOM 1393 CB GLN A 89 -0.041 -8.226 -5.414 1.00 53.44 C ATOM 1394 CG GLN A 89 -0.493 -7.129 -6.366 1.00 24.22 C ATOM 1395 CD GLN A 89 0.670 -6.373 -6.978 1.00 71.02 C ATOM 1396 OE1 GLN A 89 1.783 -6.390 -6.451 1.00 52.54 O ATOM 1397 NE2 GLN A 89 0.418 -5.704 -8.097 1.00 72.45 N ATOM 0 H GLN A 89 -0.336 -11.381 -5.134 1.00 52.12 H new ATOM 0 HA GLN A 89 -0.045 -9.479 -7.159 1.00 72.22 H new ATOM 0 HB2 GLN A 89 -0.778 -8.331 -4.618 1.00 53.44 H new ATOM 0 HB3 GLN A 89 0.895 -7.925 -4.944 1.00 53.44 H new ATOM 0 HG2 GLN A 89 -1.095 -7.568 -7.161 1.00 24.22 H new ATOM 0 HG3 GLN A 89 -1.135 -6.430 -5.830 1.00 24.22 H new ATOM 0 HE21 GLN A 89 -0.519 -5.717 -8.499 1.00 72.45 H new ATOM 0 HE22 GLN A 89 1.162 -5.177 -8.554 1.00 72.45 H new ATOM 1406 N VAL A 90 2.542 -9.186 -6.280 1.00 35.25 N ATOM 1407 CA VAL A 90 3.958 -9.509 -6.160 1.00 23.02 C ATOM 1408 C VAL A 90 4.714 -8.405 -5.429 1.00 52.43 C ATOM 1409 O VAL A 90 4.277 -7.254 -5.399 1.00 12.01 O ATOM 1410 CB VAL A 90 4.602 -9.729 -7.541 1.00 65.25 C ATOM 1411 CG1 VAL A 90 5.974 -10.371 -7.395 1.00 75.54 C ATOM 1412 CG2 VAL A 90 3.698 -10.579 -8.421 1.00 53.44 C ATOM 0 H VAL A 90 2.352 -8.259 -6.660 1.00 35.25 H new ATOM 0 HA VAL A 90 4.024 -10.433 -5.585 1.00 23.02 H new ATOM 0 HB VAL A 90 4.731 -8.759 -8.021 1.00 65.25 H new ATOM 0 HG11 VAL A 90 6.413 -10.519 -8.381 1.00 75.54 H new ATOM 0 HG12 VAL A 90 6.619 -9.721 -6.804 1.00 75.54 H new ATOM 0 HG13 VAL A 90 5.874 -11.334 -6.895 1.00 75.54 H new ATOM 0 HG21 VAL A 90 4.169 -10.724 -9.393 1.00 53.44 H new ATOM 0 HG22 VAL A 90 3.536 -11.547 -7.948 1.00 53.44 H new ATOM 0 HG23 VAL A 90 2.741 -10.075 -8.553 1.00 53.44 H new ATOM 1422 N PHE A 91 5.851 -8.762 -4.841 1.00 52.05 N ATOM 1423 CA PHE A 91 6.668 -7.801 -4.110 1.00 21.21 C ATOM 1424 C PHE A 91 8.047 -7.662 -4.749 1.00 53.31 C ATOM 1425 O PHE A 91 8.763 -8.647 -4.929 1.00 33.41 O ATOM 1426 CB PHE A 91 6.812 -8.230 -2.648 1.00 63.54 C ATOM 1427 CG PHE A 91 5.513 -8.241 -1.896 1.00 15.23 C ATOM 1428 CD1 PHE A 91 4.747 -7.091 -1.793 1.00 0.40 C ATOM 1429 CD2 PHE A 91 5.057 -9.401 -1.290 1.00 54.23 C ATOM 1430 CE1 PHE A 91 3.550 -7.097 -1.101 1.00 43.33 C ATOM 1431 CE2 PHE A 91 3.861 -9.413 -0.598 1.00 34.11 C ATOM 1432 CZ PHE A 91 3.107 -8.259 -0.502 1.00 61.42 C ATOM 0 H PHE A 91 6.227 -9.710 -4.857 1.00 52.05 H new ATOM 0 HA PHE A 91 6.169 -6.833 -4.150 1.00 21.21 H new ATOM 0 HB2 PHE A 91 7.252 -9.227 -2.612 1.00 63.54 H new ATOM 0 HB3 PHE A 91 7.507 -7.556 -2.147 1.00 63.54 H new ATOM 0 HD1 PHE A 91 5.089 -6.179 -2.259 1.00 0.40 H new ATOM 0 HD2 PHE A 91 5.643 -10.306 -1.359 1.00 54.23 H new ATOM 0 HE1 PHE A 91 2.962 -6.194 -1.029 1.00 43.33 H new ATOM 0 HE2 PHE A 91 3.516 -10.324 -0.132 1.00 34.11 H new ATOM 0 HZ PHE A 91 2.173 -8.266 0.040 1.00 61.42 H new ATOM 1442 N HIS A 92 8.412 -6.430 -5.091 1.00 61.20 N ATOM 1443 CA HIS A 92 9.705 -6.161 -5.711 1.00 13.55 C ATOM 1444 C HIS A 92 10.840 -6.378 -4.715 1.00 22.10 C ATOM 1445 O HIS A 92 10.897 -5.729 -3.670 1.00 73.04 O ATOM 1446 CB HIS A 92 9.748 -4.729 -6.247 1.00 23.42 C ATOM 1447 CG HIS A 92 10.352 -4.620 -7.613 1.00 41.11 C ATOM 1448 ND1 HIS A 92 11.479 -5.316 -7.996 1.00 20.31 N ATOM 1449 CD2 HIS A 92 9.978 -3.891 -8.690 1.00 43.43 C ATOM 1450 CE1 HIS A 92 11.773 -5.019 -9.249 1.00 3.31 C ATOM 1451 NE2 HIS A 92 10.878 -4.156 -9.694 1.00 14.14 N ATOM 0 H HIS A 92 7.832 -5.603 -4.950 1.00 61.20 H new ATOM 0 HA HIS A 92 9.835 -6.856 -6.540 1.00 13.55 H new ATOM 0 HB2 HIS A 92 8.734 -4.329 -6.274 1.00 23.42 H new ATOM 0 HB3 HIS A 92 10.318 -4.108 -5.556 1.00 23.42 H new ATOM 0 HD2 HIS A 92 9.130 -3.225 -8.749 1.00 43.43 H new ATOM 0 HE1 HIS A 92 12.604 -5.415 -9.814 1.00 3.31 H new ATOM 0 HE2 HIS A 92 10.858 -3.752 -10.630 1.00 14.14 H new ATOM 1459 N VAL A 93 11.743 -7.296 -5.046 1.00 31.35 N ATOM 1460 CA VAL A 93 12.877 -7.599 -4.181 1.00 21.31 C ATOM 1461 C VAL A 93 14.194 -7.477 -4.939 1.00 61.42 C ATOM 1462 O VAL A 93 14.392 -8.125 -5.967 1.00 14.32 O ATOM 1463 CB VAL A 93 12.768 -9.017 -3.588 1.00 40.31 C ATOM 1464 CG1 VAL A 93 13.999 -9.344 -2.757 1.00 62.42 C ATOM 1465 CG2 VAL A 93 11.502 -9.149 -2.755 1.00 71.55 C ATOM 0 H VAL A 93 11.711 -7.842 -5.907 1.00 31.35 H new ATOM 0 HA VAL A 93 12.859 -6.872 -3.369 1.00 21.31 H new ATOM 0 HB VAL A 93 12.713 -9.733 -4.408 1.00 40.31 H new ATOM 0 HG11 VAL A 93 13.904 -10.349 -2.346 1.00 62.42 H new ATOM 0 HG12 VAL A 93 14.887 -9.291 -3.386 1.00 62.42 H new ATOM 0 HG13 VAL A 93 14.089 -8.626 -1.942 1.00 62.42 H new ATOM 0 HG21 VAL A 93 11.441 -10.157 -2.344 1.00 71.55 H new ATOM 0 HG22 VAL A 93 11.525 -8.425 -1.940 1.00 71.55 H new ATOM 0 HG23 VAL A 93 10.632 -8.960 -3.383 1.00 71.55 H new ATOM 1475 N GLU A 94 15.092 -6.643 -4.424 1.00 61.42 N ATOM 1476 CA GLU A 94 16.391 -6.437 -5.054 1.00 1.21 C ATOM 1477 C GLU A 94 17.519 -6.593 -4.038 1.00 61.21 C ATOM 1478 O GLU A 94 17.627 -5.817 -3.089 1.00 41.40 O ATOM 1479 CB GLU A 94 16.457 -5.049 -5.696 1.00 33.33 C ATOM 1480 CG GLU A 94 17.548 -4.915 -6.744 1.00 51.24 C ATOM 1481 CD GLU A 94 18.018 -3.483 -6.917 1.00 72.51 C ATOM 1482 OE1 GLU A 94 17.295 -2.565 -6.477 1.00 33.22 O ATOM 1483 OE2 GLU A 94 19.107 -3.281 -7.492 1.00 65.43 O ATOM 0 H GLU A 94 14.944 -6.100 -3.573 1.00 61.42 H new ATOM 0 HA GLU A 94 16.515 -7.194 -5.828 1.00 1.21 H new ATOM 0 HB2 GLU A 94 15.494 -4.824 -6.155 1.00 33.33 H new ATOM 0 HB3 GLU A 94 16.620 -4.305 -4.917 1.00 33.33 H new ATOM 0 HG2 GLU A 94 18.395 -5.540 -6.463 1.00 51.24 H new ATOM 0 HG3 GLU A 94 17.178 -5.290 -7.698 1.00 51.24 H new ATOM 1490 N VAL A 95 18.357 -7.604 -4.245 1.00 5.14 N ATOM 1491 CA VAL A 95 19.478 -7.863 -3.348 1.00 71.13 C ATOM 1492 C VAL A 95 20.809 -7.604 -4.044 1.00 5.21 C ATOM 1493 O VAL A 95 21.084 -8.161 -5.106 1.00 42.52 O ATOM 1494 CB VAL A 95 19.457 -9.313 -2.828 1.00 13.41 C ATOM 1495 CG1 VAL A 95 18.262 -9.534 -1.913 1.00 22.14 C ATOM 1496 CG2 VAL A 95 19.438 -10.295 -3.989 1.00 43.13 C ATOM 0 H VAL A 95 18.281 -8.257 -5.025 1.00 5.14 H new ATOM 0 HA VAL A 95 19.373 -7.181 -2.505 1.00 71.13 H new ATOM 0 HB VAL A 95 20.365 -9.487 -2.250 1.00 13.41 H new ATOM 0 HG11 VAL A 95 18.263 -10.564 -1.555 1.00 22.14 H new ATOM 0 HG12 VAL A 95 18.324 -8.854 -1.063 1.00 22.14 H new ATOM 0 HG13 VAL A 95 17.341 -9.343 -2.464 1.00 22.14 H new ATOM 0 HG21 VAL A 95 19.423 -11.314 -3.603 1.00 43.13 H new ATOM 0 HG22 VAL A 95 18.549 -10.124 -4.596 1.00 43.13 H new ATOM 0 HG23 VAL A 95 20.328 -10.152 -4.601 1.00 43.13 H new ATOM 1506 N GLU A 96 21.633 -6.755 -3.436 1.00 71.15 N ATOM 1507 CA GLU A 96 22.936 -6.422 -3.999 1.00 5.03 C ATOM 1508 C GLU A 96 24.053 -7.141 -3.247 1.00 70.21 C ATOM 1509 O GLU A 96 23.901 -7.496 -2.078 1.00 62.42 O ATOM 1510 CB GLU A 96 23.166 -4.910 -3.951 1.00 1.14 C ATOM 1511 CG GLU A 96 23.973 -4.379 -5.124 1.00 31.24 C ATOM 1512 CD GLU A 96 24.049 -2.865 -5.142 1.00 5.15 C ATOM 1513 OE1 GLU A 96 23.033 -2.223 -5.480 1.00 5.21 O ATOM 1514 OE2 GLU A 96 25.126 -2.322 -4.816 1.00 63.14 O ATOM 0 H GLU A 96 21.421 -6.286 -2.555 1.00 71.15 H new ATOM 0 HA GLU A 96 22.949 -6.752 -5.038 1.00 5.03 H new ATOM 0 HB2 GLU A 96 22.200 -4.405 -3.927 1.00 1.14 H new ATOM 0 HB3 GLU A 96 23.681 -4.659 -3.024 1.00 1.14 H new ATOM 0 HG2 GLU A 96 24.982 -4.789 -5.081 1.00 31.24 H new ATOM 0 HG3 GLU A 96 23.526 -4.728 -6.055 1.00 31.24 H new ATOM 1521 N VAL A 97 25.175 -7.353 -3.927 1.00 62.14 N ATOM 1522 CA VAL A 97 26.318 -8.029 -3.325 1.00 61.13 C ATOM 1523 C VAL A 97 27.353 -7.025 -2.832 1.00 45.42 C ATOM 1524 O VAL A 97 27.886 -6.234 -3.611 1.00 42.11 O ATOM 1525 CB VAL A 97 26.989 -8.994 -4.322 1.00 15.44 C ATOM 1526 CG1 VAL A 97 26.185 -10.280 -4.443 1.00 3.41 C ATOM 1527 CG2 VAL A 97 27.152 -8.327 -5.679 1.00 62.44 C ATOM 0 H VAL A 97 25.317 -7.066 -4.896 1.00 62.14 H new ATOM 0 HA VAL A 97 25.938 -8.600 -2.478 1.00 61.13 H new ATOM 0 HB VAL A 97 27.980 -9.248 -3.946 1.00 15.44 H new ATOM 0 HG11 VAL A 97 26.674 -10.949 -5.151 1.00 3.41 H new ATOM 0 HG12 VAL A 97 26.124 -10.764 -3.468 1.00 3.41 H new ATOM 0 HG13 VAL A 97 25.180 -10.049 -4.796 1.00 3.41 H new ATOM 0 HG21 VAL A 97 27.627 -9.022 -6.371 1.00 62.44 H new ATOM 0 HG22 VAL A 97 26.173 -8.043 -6.065 1.00 62.44 H new ATOM 0 HG23 VAL A 97 27.773 -7.437 -5.575 1.00 62.44 H new ATOM 1537 N ARG A 98 27.634 -7.062 -1.534 1.00 3.23 N ATOM 1538 CA ARG A 98 28.606 -6.154 -0.936 1.00 10.01 C ATOM 1539 C ARG A 98 29.994 -6.786 -0.907 1.00 24.23 C ATOM 1540 O ARG A 98 30.235 -7.747 -0.176 1.00 35.24 O ATOM 1541 CB ARG A 98 28.176 -5.775 0.483 1.00 63.14 C ATOM 1542 CG ARG A 98 29.200 -4.931 1.224 1.00 50.10 C ATOM 1543 CD ARG A 98 28.777 -4.678 2.662 1.00 13.05 C ATOM 1544 NE ARG A 98 29.568 -3.622 3.288 1.00 15.50 N ATOM 1545 CZ ARG A 98 29.446 -2.334 2.984 1.00 71.34 C ATOM 1546 NH1 ARG A 98 28.570 -1.946 2.067 1.00 34.33 N ATOM 1547 NH2 ARG A 98 30.201 -1.432 3.597 1.00 44.04 N ATOM 0 H ARG A 98 27.203 -7.711 -0.876 1.00 3.23 H new ATOM 0 HA ARG A 98 28.649 -5.253 -1.548 1.00 10.01 H new ATOM 0 HB2 ARG A 98 27.234 -5.229 0.435 1.00 63.14 H new ATOM 0 HB3 ARG A 98 27.988 -6.685 1.052 1.00 63.14 H new ATOM 0 HG2 ARG A 98 30.166 -5.435 1.211 1.00 50.10 H new ATOM 0 HG3 ARG A 98 29.330 -3.979 0.709 1.00 50.10 H new ATOM 0 HD2 ARG A 98 27.722 -4.404 2.687 1.00 13.05 H new ATOM 0 HD3 ARG A 98 28.881 -5.598 3.237 1.00 13.05 H new ATOM 0 HE ARG A 98 30.251 -3.887 3.997 1.00 15.50 H new ATOM 0 HH11 ARG A 98 27.988 -2.637 1.593 1.00 34.33 H new ATOM 0 HH12 ARG A 98 28.478 -0.957 1.836 1.00 34.33 H new ATOM 0 HH21 ARG A 98 30.876 -1.727 4.303 1.00 44.04 H new ATOM 0 HH22 ARG A 98 30.106 -0.444 3.363 1.00 44.04 H new ATOM 1561 N ASP A 99 30.904 -6.241 -1.706 1.00 40.44 N ATOM 1562 CA ASP A 99 32.269 -6.750 -1.772 1.00 73.40 C ATOM 1563 C ASP A 99 33.103 -5.943 -2.761 1.00 64.24 C ATOM 1564 O ASP A 99 32.673 -4.893 -3.239 1.00 5.32 O ATOM 1565 CB ASP A 99 32.266 -8.226 -2.173 1.00 72.33 C ATOM 1566 CG ASP A 99 33.039 -9.093 -1.199 1.00 13.14 C ATOM 1567 OD1 ASP A 99 32.603 -9.209 -0.034 1.00 72.44 O ATOM 1568 OD2 ASP A 99 34.080 -9.654 -1.600 1.00 1.13 O ATOM 0 H ASP A 99 30.721 -5.446 -2.318 1.00 40.44 H new ATOM 0 HA ASP A 99 32.716 -6.651 -0.783 1.00 73.40 H new ATOM 0 HB2 ASP A 99 31.237 -8.581 -2.233 1.00 72.33 H new ATOM 0 HB3 ASP A 99 32.698 -8.330 -3.169 1.00 72.33 H new ATOM 1573 N ILE A 100 34.298 -6.440 -3.064 1.00 20.35 N ATOM 1574 CA ILE A 100 35.192 -5.765 -3.996 1.00 23.13 C ATOM 1575 C ILE A 100 35.653 -6.712 -5.099 1.00 4.24 C ATOM 1576 O ILE A 100 35.662 -7.929 -4.922 1.00 75.32 O ATOM 1577 CB ILE A 100 36.428 -5.193 -3.276 1.00 51.10 C ATOM 1578 CG1 ILE A 100 36.010 -4.476 -1.991 1.00 11.42 C ATOM 1579 CG2 ILE A 100 37.185 -4.246 -4.195 1.00 71.13 C ATOM 1580 CD1 ILE A 100 37.178 -3.957 -1.181 1.00 53.23 C ATOM 0 H ILE A 100 34.669 -7.308 -2.677 1.00 20.35 H new ATOM 0 HA ILE A 100 34.627 -4.944 -4.438 1.00 23.13 H new ATOM 0 HB ILE A 100 37.090 -6.017 -3.011 1.00 51.10 H new ATOM 0 HG12 ILE A 100 35.356 -3.642 -2.246 1.00 11.42 H new ATOM 0 HG13 ILE A 100 35.427 -5.161 -1.375 1.00 11.42 H new ATOM 0 HG21 ILE A 100 38.056 -3.850 -3.672 1.00 71.13 H new ATOM 0 HG22 ILE A 100 37.510 -4.785 -5.085 1.00 71.13 H new ATOM 0 HG23 ILE A 100 36.532 -3.424 -4.487 1.00 71.13 H new ATOM 0 HD11 ILE A 100 36.807 -3.460 -0.284 1.00 53.23 H new ATOM 0 HD12 ILE A 100 37.821 -4.789 -0.895 1.00 53.23 H new ATOM 0 HD13 ILE A 100 37.749 -3.247 -1.779 1.00 53.23 H new ATOM 1592 N ASN A 101 36.039 -6.143 -6.236 1.00 54.04 N ATOM 1593 CA ASN A 101 36.503 -6.936 -7.369 1.00 31.33 C ATOM 1594 C ASN A 101 37.756 -7.725 -7.003 1.00 24.24 C ATOM 1595 O ASN A 101 37.789 -8.950 -7.123 1.00 33.02 O ATOM 1596 CB ASN A 101 36.788 -6.032 -8.569 1.00 45.31 C ATOM 1597 CG ASN A 101 36.493 -6.714 -9.891 1.00 31.13 C ATOM 1598 OD1 ASN A 101 35.672 -7.629 -9.960 1.00 24.45 O ATOM 1599 ND2 ASN A 101 37.163 -6.271 -10.948 1.00 55.42 N ATOM 0 H ASN A 101 36.040 -5.136 -6.398 1.00 54.04 H new ATOM 0 HA ASN A 101 35.715 -7.641 -7.634 1.00 31.33 H new ATOM 0 HB2 ASN A 101 36.187 -5.126 -8.489 1.00 45.31 H new ATOM 0 HB3 ASN A 101 37.833 -5.724 -8.548 1.00 45.31 H new ATOM 0 HD21 ASN A 101 37.007 -6.692 -11.864 1.00 55.42 H new ATOM 0 HD22 ASN A 101 37.834 -5.510 -10.844 1.00 55.42 H new ATOM 1606 N ASP A 102 38.786 -7.015 -6.555 1.00 51.11 N ATOM 1607 CA ASP A 102 40.042 -7.648 -6.169 1.00 73.14 C ATOM 1608 C ASP A 102 39.807 -8.722 -5.112 1.00 15.24 C ATOM 1609 O ASP A 102 40.566 -9.684 -5.011 1.00 73.50 O ATOM 1610 CB ASP A 102 41.024 -6.601 -5.642 1.00 24.41 C ATOM 1611 CG ASP A 102 42.313 -6.563 -6.440 1.00 54.53 C ATOM 1612 OD1 ASP A 102 42.328 -5.920 -7.512 1.00 20.45 O ATOM 1613 OD2 ASP A 102 43.306 -7.173 -5.993 1.00 74.54 O ATOM 0 H ASP A 102 38.776 -6.000 -6.450 1.00 51.11 H new ATOM 0 HA ASP A 102 40.469 -8.122 -7.053 1.00 73.14 H new ATOM 0 HB2 ASP A 102 40.553 -5.618 -5.671 1.00 24.41 H new ATOM 0 HB3 ASP A 102 41.253 -6.814 -4.598 1.00 24.41 H new ATOM 1618 N ASN A 103 38.750 -8.548 -4.324 1.00 71.12 N ATOM 1619 CA ASN A 103 38.416 -9.501 -3.272 1.00 73.54 C ATOM 1620 C ASN A 103 37.009 -10.058 -3.469 1.00 53.43 C ATOM 1621 O ASN A 103 36.567 -10.933 -2.725 1.00 63.03 O ATOM 1622 CB ASN A 103 38.526 -8.837 -1.899 1.00 12.52 C ATOM 1623 CG ASN A 103 39.359 -9.650 -0.928 1.00 20.34 C ATOM 1624 OD1 ASN A 103 39.435 -10.875 -1.032 1.00 13.41 O ATOM 1625 ND2 ASN A 103 39.989 -8.971 0.024 1.00 63.50 N ATOM 0 H ASN A 103 38.111 -7.756 -4.394 1.00 71.12 H new ATOM 0 HA ASN A 103 39.125 -10.327 -3.326 1.00 73.54 H new ATOM 0 HB2 ASN A 103 38.968 -7.847 -2.012 1.00 12.52 H new ATOM 0 HB3 ASN A 103 37.527 -8.695 -1.486 1.00 12.52 H new ATOM 0 HD21 ASN A 103 40.564 -9.464 0.707 1.00 63.50 H new ATOM 0 HD22 ASN A 103 39.898 -7.956 0.072 1.00 63.50 H new TER 1632 ASN A 103