USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 795 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 93 ASN : amide:sc= -4.73 X(o=-4.7,f=-4.3!) USER MOD Set 2.1: A 56 CYS SG : rot 60:sc= 0.735 USER MOD Set 2.2: A 80 SER OG : rot 99:sc= 0.102 USER MOD Set 3.1: A 28 HIS : no HD1:sc= -2.49! C(o=-2.1!,f=-4.5!) USER MOD Set 3.2: A 30 TYR OH : rot 70:sc= 0.352 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 HIS : no HD1:sc= -3.32! C(o=-3.3!,f=-9!) USER MOD Single : A 13 ASN : amide:sc= -3.47! C(o=-3.5!,f=-9.7!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0762 USER MOD Single : A 26 SER OG : rot 47:sc= 1.26 USER MOD Single : A 29 CYS SG : rot 34:sc= 0.184 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -4.54! X(o=-4.5!,f=-4.8) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.97 K(o=-2,f=-3.4!) USER MOD Single : A 46 MET CE :methyl -145:sc= -0.504 (180deg=-4.31!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 29:sc= 0.166 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.741 K(o=0.74,f=-0.24) USER MOD Single : A 75 GLN : amide:sc= -0.306 X(o=-0.31,f=-0.31) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 16:sc= 0.793 USER MOD Single : A 85 ASN : amide:sc= -0.754 K(o=-0.75,f=-0.13) USER MOD Single : A 95 ASN : amide:sc= -0.406 X(o=-0.41,f=-0.039) USER MOD Single : A 97 SER OG : rot -110:sc= -0.66 USER MOD Single : A 102 LYS NZ :NH3+ 150:sc= -0.266 (180deg=-0.992) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.0798 USER MOD Single : A 108 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N PRO A 8 9.515 -4.366 7.216 1.00 0.00 N ATOM 67 CA PRO A 8 8.576 -5.476 7.402 1.00 0.00 C ATOM 68 C PRO A 8 8.617 -6.470 6.246 1.00 0.00 C ATOM 69 O PRO A 8 9.122 -6.161 5.166 1.00 0.00 O ATOM 70 CB PRO A 8 7.213 -4.782 7.463 1.00 0.00 C ATOM 71 CG PRO A 8 7.401 -3.512 6.708 1.00 0.00 C ATOM 72 CD PRO A 8 8.824 -3.092 6.951 1.00 0.00 C ATOM 0 HA PRO A 8 8.810 -6.063 8.290 1.00 0.00 H new ATOM 0 HB2 PRO A 8 6.434 -5.398 7.013 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.912 -4.590 8.493 1.00 0.00 H new ATOM 0 HG2 PRO A 8 7.214 -3.659 5.644 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.704 -2.747 7.051 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.245 -2.579 6.086 1.00 0.00 H new ATOM 0 HD3 PRO A 8 8.903 -2.409 7.797 1.00 0.00 H new ATOM 80 N LYS A 9 8.083 -7.664 6.479 1.00 0.00 N ATOM 81 CA LYS A 9 8.056 -8.703 5.457 1.00 0.00 C ATOM 82 C LYS A 9 7.029 -8.378 4.377 1.00 0.00 C ATOM 83 O LYS A 9 7.373 -8.242 3.202 1.00 0.00 O ATOM 84 CB LYS A 9 7.735 -10.060 6.088 1.00 0.00 C ATOM 85 CG LYS A 9 8.884 -10.644 6.892 1.00 0.00 C ATOM 86 CD LYS A 9 8.987 -10.001 8.265 1.00 0.00 C ATOM 87 CE LYS A 9 10.090 -10.638 9.097 1.00 0.00 C ATOM 88 NZ LYS A 9 10.117 -10.102 10.486 1.00 0.00 N ATOM 0 H LYS A 9 7.663 -7.936 7.368 1.00 0.00 H new ATOM 0 HA LYS A 9 9.042 -8.748 4.995 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.866 -9.953 6.737 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.460 -10.762 5.300 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.743 -11.719 7.002 1.00 0.00 H new ATOM 0 HG3 LYS A 9 9.819 -10.499 6.350 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.183 -8.934 8.155 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.034 -10.098 8.786 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.944 -11.718 9.127 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.054 -10.459 8.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.882 -10.561 11.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 10.281 -9.075 10.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.207 -10.295 10.950 1.00 0.00 H new ATOM 102 N ILE A 10 5.770 -8.253 4.782 1.00 0.00 N ATOM 103 CA ILE A 10 4.695 -7.940 3.848 1.00 0.00 C ATOM 104 C ILE A 10 4.978 -6.644 3.097 1.00 0.00 C ATOM 105 O ILE A 10 5.631 -5.740 3.621 1.00 0.00 O ATOM 106 CB ILE A 10 3.340 -7.816 4.571 1.00 0.00 C ATOM 107 CG1 ILE A 10 3.544 -7.310 6.000 1.00 0.00 C ATOM 108 CG2 ILE A 10 2.618 -9.155 4.575 1.00 0.00 C ATOM 109 CD1 ILE A 10 3.686 -8.418 7.019 1.00 0.00 C ATOM 0 H ILE A 10 5.469 -8.364 5.750 1.00 0.00 H new ATOM 0 HA ILE A 10 4.645 -8.765 3.137 1.00 0.00 H new ATOM 0 HB ILE A 10 2.723 -7.094 4.035 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.435 -6.683 6.031 1.00 0.00 H new ATOM 0 HG13 ILE A 10 2.700 -6.679 6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.662 -9.052 5.089 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.445 -9.478 3.548 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.229 -9.896 5.090 1.00 0.00 H new ATOM 0 HD11 ILE A 10 3.828 -7.985 8.009 1.00 0.00 H new ATOM 0 HD12 ILE A 10 2.785 -9.032 7.017 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.547 -9.036 6.767 1.00 0.00 H new ATOM 121 N HIS A 11 4.482 -6.558 1.867 1.00 0.00 N ATOM 122 CA HIS A 11 4.680 -5.371 1.044 1.00 0.00 C ATOM 123 C HIS A 11 3.540 -5.207 0.043 1.00 0.00 C ATOM 124 O HIS A 11 3.005 -6.191 -0.470 1.00 0.00 O ATOM 125 CB HIS A 11 6.016 -5.453 0.305 1.00 0.00 C ATOM 126 CG HIS A 11 5.924 -6.142 -1.022 1.00 0.00 C ATOM 127 ND1 HIS A 11 5.178 -5.653 -2.074 1.00 0.00 N ATOM 128 CD2 HIS A 11 6.493 -7.287 -1.466 1.00 0.00 C ATOM 129 CE1 HIS A 11 5.289 -6.470 -3.107 1.00 0.00 C ATOM 130 NE2 HIS A 11 6.082 -7.469 -2.764 1.00 0.00 N ATOM 0 H HIS A 11 3.940 -7.296 1.418 1.00 0.00 H new ATOM 0 HA HIS A 11 4.690 -4.502 1.701 1.00 0.00 H new ATOM 0 HB2 HIS A 11 6.402 -4.445 0.156 1.00 0.00 H new ATOM 0 HB3 HIS A 11 6.736 -5.981 0.930 1.00 0.00 H new ATOM 0 HD2 HIS A 11 7.148 -7.937 -0.904 1.00 0.00 H new ATOM 0 HE1 HIS A 11 4.813 -6.342 -4.068 1.00 0.00 H new ATOM 0 HE2 HIS A 11 6.346 -8.249 -3.365 1.00 0.00 H new ATOM 138 N PHE A 12 3.173 -3.960 -0.230 1.00 0.00 N ATOM 139 CA PHE A 12 2.096 -3.668 -1.169 1.00 0.00 C ATOM 140 C PHE A 12 2.606 -3.687 -2.607 1.00 0.00 C ATOM 141 O PHE A 12 3.723 -3.253 -2.886 1.00 0.00 O ATOM 142 CB PHE A 12 1.473 -2.306 -0.855 1.00 0.00 C ATOM 143 CG PHE A 12 0.476 -2.347 0.268 1.00 0.00 C ATOM 144 CD1 PHE A 12 -0.717 -3.037 0.127 1.00 0.00 C ATOM 145 CD2 PHE A 12 0.732 -1.695 1.463 1.00 0.00 C ATOM 146 CE1 PHE A 12 -1.637 -3.077 1.159 1.00 0.00 C ATOM 147 CE2 PHE A 12 -0.183 -1.732 2.498 1.00 0.00 C ATOM 148 CZ PHE A 12 -1.369 -2.423 2.345 1.00 0.00 C ATOM 0 H PHE A 12 3.605 -3.135 0.186 1.00 0.00 H new ATOM 0 HA PHE A 12 1.336 -4.442 -1.062 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.266 -1.603 -0.601 1.00 0.00 H new ATOM 0 HB3 PHE A 12 0.984 -1.924 -1.751 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -0.931 -3.549 -0.799 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.657 -1.152 1.587 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.563 -3.619 1.037 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.029 -1.221 3.426 1.00 0.00 H new ATOM 0 HZ PHE A 12 -2.086 -2.452 3.152 1.00 0.00 H new ATOM 158 N ASN A 13 1.780 -4.195 -3.515 1.00 0.00 N ATOM 159 CA ASN A 13 2.147 -4.273 -4.924 1.00 0.00 C ATOM 160 C ASN A 13 2.753 -2.956 -5.402 1.00 0.00 C ATOM 161 O ASN A 13 3.531 -2.929 -6.355 1.00 0.00 O ATOM 162 CB ASN A 13 0.923 -4.621 -5.773 1.00 0.00 C ATOM 163 CG ASN A 13 -0.337 -3.938 -5.279 1.00 0.00 C ATOM 164 OD1 ASN A 13 -0.307 -3.184 -4.306 1.00 0.00 O ATOM 165 ND2 ASN A 13 -1.453 -4.199 -5.949 1.00 0.00 N ATOM 0 H ASN A 13 0.852 -4.559 -3.300 1.00 0.00 H new ATOM 0 HA ASN A 13 2.894 -5.059 -5.036 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.108 -4.332 -6.808 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.774 -5.701 -5.766 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.332 -3.768 -5.663 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.431 -4.830 -6.750 1.00 0.00 H new ATOM 172 N PHE A 14 2.391 -1.867 -4.732 1.00 0.00 N ATOM 173 CA PHE A 14 2.899 -0.547 -5.087 1.00 0.00 C ATOM 174 C PHE A 14 3.181 0.282 -3.838 1.00 0.00 C ATOM 175 O PHE A 14 2.785 -0.089 -2.733 1.00 0.00 O ATOM 176 CB PHE A 14 1.896 0.184 -5.983 1.00 0.00 C ATOM 177 CG PHE A 14 0.464 -0.059 -5.601 1.00 0.00 C ATOM 178 CD1 PHE A 14 -0.081 0.548 -4.481 1.00 0.00 C ATOM 179 CD2 PHE A 14 -0.338 -0.893 -6.363 1.00 0.00 C ATOM 180 CE1 PHE A 14 -1.398 0.326 -4.127 1.00 0.00 C ATOM 181 CE2 PHE A 14 -1.657 -1.119 -6.014 1.00 0.00 C ATOM 182 CZ PHE A 14 -2.187 -0.507 -4.895 1.00 0.00 C ATOM 0 H PHE A 14 1.748 -1.873 -3.940 1.00 0.00 H new ATOM 0 HA PHE A 14 3.834 -0.679 -5.632 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.098 1.254 -5.943 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.047 -0.130 -7.016 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.531 1.202 -3.878 1.00 0.00 H new ATOM 0 HD2 PHE A 14 0.072 -1.372 -7.240 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -1.810 0.804 -3.250 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.271 -1.773 -6.615 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.217 -0.680 -4.621 1.00 0.00 H new ATOM 192 N GLU A 15 3.868 1.405 -4.022 1.00 0.00 N ATOM 193 CA GLU A 15 4.204 2.286 -2.910 1.00 0.00 C ATOM 194 C GLU A 15 3.089 3.299 -2.662 1.00 0.00 C ATOM 195 O GLU A 15 2.601 3.440 -1.540 1.00 0.00 O ATOM 196 CB GLU A 15 5.519 3.016 -3.188 1.00 0.00 C ATOM 197 CG GLU A 15 6.212 3.520 -1.933 1.00 0.00 C ATOM 198 CD GLU A 15 7.113 4.710 -2.202 1.00 0.00 C ATOM 199 OE1 GLU A 15 6.733 5.568 -3.026 1.00 0.00 O ATOM 200 OE2 GLU A 15 8.197 4.783 -1.588 1.00 0.00 O ATOM 0 H GLU A 15 4.203 1.726 -4.930 1.00 0.00 H new ATOM 0 HA GLU A 15 4.319 1.673 -2.016 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.193 2.344 -3.720 1.00 0.00 H new ATOM 0 HB3 GLU A 15 5.323 3.860 -3.849 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.460 3.798 -1.194 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.802 2.713 -1.499 1.00 0.00 H new ATOM 207 N LEU A 16 2.692 4.001 -3.717 1.00 0.00 N ATOM 208 CA LEU A 16 1.635 5.002 -3.615 1.00 0.00 C ATOM 209 C LEU A 16 0.464 4.652 -4.527 1.00 0.00 C ATOM 210 O LEU A 16 0.655 4.245 -5.674 1.00 0.00 O ATOM 211 CB LEU A 16 2.180 6.386 -3.975 1.00 0.00 C ATOM 212 CG LEU A 16 1.136 7.479 -4.204 1.00 0.00 C ATOM 213 CD1 LEU A 16 1.718 8.848 -3.883 1.00 0.00 C ATOM 214 CD2 LEU A 16 0.626 7.438 -5.637 1.00 0.00 C ATOM 0 H LEU A 16 3.085 3.896 -4.652 1.00 0.00 H new ATOM 0 HA LEU A 16 1.279 5.015 -2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.848 6.711 -3.177 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.784 6.293 -4.878 1.00 0.00 H new ATOM 0 HG LEU A 16 0.295 7.297 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.961 9.614 -4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.034 8.874 -2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.577 9.038 -4.527 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.116 8.223 -5.782 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.458 7.594 -6.324 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.171 6.467 -5.833 1.00 0.00 H new ATOM 226 N LEU A 17 -0.749 4.813 -4.010 1.00 0.00 N ATOM 227 CA LEU A 17 -1.954 4.516 -4.778 1.00 0.00 C ATOM 228 C LEU A 17 -2.718 5.794 -5.109 1.00 0.00 C ATOM 229 O LEU A 17 -3.511 6.282 -4.303 1.00 0.00 O ATOM 230 CB LEU A 17 -2.855 3.557 -3.999 1.00 0.00 C ATOM 231 CG LEU A 17 -4.244 3.311 -4.591 1.00 0.00 C ATOM 232 CD1 LEU A 17 -4.143 2.487 -5.865 1.00 0.00 C ATOM 233 CD2 LEU A 17 -5.141 2.619 -3.576 1.00 0.00 C ATOM 0 H LEU A 17 -0.925 5.147 -3.063 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.652 4.043 -5.713 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.343 2.598 -3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.976 3.945 -2.988 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.688 4.275 -4.841 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.141 2.322 -6.272 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -3.537 3.021 -6.597 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.679 1.526 -5.641 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.125 2.452 -4.014 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.702 1.662 -3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.240 3.247 -2.690 1.00 0.00 H new ATOM 245 N ASP A 18 -2.475 6.331 -6.300 1.00 0.00 N ATOM 246 CA ASP A 18 -3.143 7.550 -6.740 1.00 0.00 C ATOM 247 C ASP A 18 -4.552 7.249 -7.239 1.00 0.00 C ATOM 248 O ASP A 18 -4.730 6.648 -8.299 1.00 0.00 O ATOM 249 CB ASP A 18 -2.332 8.232 -7.843 1.00 0.00 C ATOM 250 CG ASP A 18 -2.424 7.498 -9.166 1.00 0.00 C ATOM 251 OD1 ASP A 18 -2.387 6.250 -9.157 1.00 0.00 O ATOM 252 OD2 ASP A 18 -2.535 8.173 -10.211 1.00 0.00 O ATOM 0 H ASP A 18 -1.820 5.941 -6.978 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.217 8.223 -5.885 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -2.687 9.254 -7.972 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -1.288 8.294 -7.537 1.00 0.00 H new ATOM 257 N ILE A 19 -5.550 7.668 -6.469 1.00 0.00 N ATOM 258 CA ILE A 19 -6.943 7.443 -6.834 1.00 0.00 C ATOM 259 C ILE A 19 -7.451 8.538 -7.766 1.00 0.00 C ATOM 260 O ILE A 19 -8.640 8.603 -8.074 1.00 0.00 O ATOM 261 CB ILE A 19 -7.848 7.383 -5.590 1.00 0.00 C ATOM 262 CG1 ILE A 19 -7.890 8.746 -4.896 1.00 0.00 C ATOM 263 CG2 ILE A 19 -7.359 6.309 -4.630 1.00 0.00 C ATOM 264 CD1 ILE A 19 -8.906 8.824 -3.778 1.00 0.00 C ATOM 0 H ILE A 19 -5.420 8.165 -5.588 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.983 6.483 -7.349 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.859 7.126 -5.907 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.902 8.971 -4.494 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.116 9.514 -5.635 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.009 6.279 -3.756 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -7.377 5.340 -5.129 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.340 6.537 -4.317 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -8.880 9.818 -3.332 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -9.902 8.631 -4.177 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.669 8.079 -3.018 1.00 0.00 H new ATOM 276 N GLY A 20 -6.540 9.396 -8.215 1.00 0.00 N ATOM 277 CA GLY A 20 -6.914 10.475 -9.109 1.00 0.00 C ATOM 278 C GLY A 20 -8.077 11.290 -8.579 1.00 0.00 C ATOM 279 O GLY A 20 -8.154 11.571 -7.382 1.00 0.00 O ATOM 0 H GLY A 20 -5.549 9.363 -7.975 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.056 11.129 -9.263 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.178 10.061 -10.082 1.00 0.00 H new ATOM 283 N LYS A 21 -8.985 11.674 -9.471 1.00 0.00 N ATOM 284 CA LYS A 21 -10.150 12.462 -9.087 1.00 0.00 C ATOM 285 C LYS A 21 -11.316 11.557 -8.703 1.00 0.00 C ATOM 286 O LYS A 21 -11.523 10.504 -9.306 1.00 0.00 O ATOM 287 CB LYS A 21 -10.565 13.387 -10.233 1.00 0.00 C ATOM 288 CG LYS A 21 -9.497 14.397 -10.616 1.00 0.00 C ATOM 289 CD LYS A 21 -10.105 15.640 -11.245 1.00 0.00 C ATOM 290 CE LYS A 21 -9.123 16.802 -11.243 1.00 0.00 C ATOM 291 NZ LYS A 21 -8.062 16.634 -12.273 1.00 0.00 N ATOM 0 H LYS A 21 -8.936 11.452 -10.465 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.880 13.065 -8.220 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.811 12.782 -11.106 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.472 13.920 -9.948 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.926 14.678 -9.731 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.797 13.940 -11.315 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.408 15.420 -12.269 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.005 15.922 -10.699 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.661 17.732 -11.425 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -8.663 16.887 -10.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.413 17.446 -12.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -7.531 15.759 -12.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.499 16.579 -13.215 1.00 0.00 H new ATOM 305 N VAL A 22 -12.077 11.976 -7.696 1.00 0.00 N ATOM 306 CA VAL A 22 -13.224 11.205 -7.233 1.00 0.00 C ATOM 307 C VAL A 22 -14.456 12.090 -7.079 1.00 0.00 C ATOM 308 O VAL A 22 -14.377 13.192 -6.534 1.00 0.00 O ATOM 309 CB VAL A 22 -12.930 10.514 -5.887 1.00 0.00 C ATOM 310 CG1 VAL A 22 -12.089 9.265 -6.101 1.00 0.00 C ATOM 311 CG2 VAL A 22 -12.238 11.477 -4.935 1.00 0.00 C ATOM 0 H VAL A 22 -11.919 12.845 -7.186 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.419 10.444 -7.989 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.876 10.213 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.891 8.790 -5.140 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.627 8.570 -6.745 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.145 9.538 -6.572 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.038 10.973 -3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.298 11.811 -5.375 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.882 12.339 -4.758 1.00 0.00 H new ATOM 321 N PHE A 23 -15.593 11.601 -7.561 1.00 0.00 N ATOM 322 CA PHE A 23 -16.843 12.349 -7.478 1.00 0.00 C ATOM 323 C PHE A 23 -17.285 12.508 -6.026 1.00 0.00 C ATOM 324 O PHE A 23 -17.228 11.562 -5.239 1.00 0.00 O ATOM 325 CB PHE A 23 -17.937 11.644 -8.282 1.00 0.00 C ATOM 326 CG PHE A 23 -18.968 12.583 -8.841 1.00 0.00 C ATOM 327 CD1 PHE A 23 -18.624 13.515 -9.807 1.00 0.00 C ATOM 328 CD2 PHE A 23 -20.281 12.532 -8.402 1.00 0.00 C ATOM 329 CE1 PHE A 23 -19.570 14.380 -10.322 1.00 0.00 C ATOM 330 CE2 PHE A 23 -21.232 13.395 -8.915 1.00 0.00 C ATOM 331 CZ PHE A 23 -20.876 14.319 -9.877 1.00 0.00 C ATOM 0 H PHE A 23 -15.675 10.690 -8.013 1.00 0.00 H new ATOM 0 HA PHE A 23 -16.674 13.340 -7.899 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -17.476 11.093 -9.102 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -18.432 10.912 -7.644 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -17.605 13.566 -10.161 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -20.565 11.810 -7.651 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -19.288 15.104 -11.072 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -22.252 13.346 -8.563 1.00 0.00 H new ATOM 0 HZ PHE A 23 -21.617 14.993 -10.281 1.00 0.00 H new ATOM 341 N THR A 24 -17.727 13.713 -5.677 1.00 0.00 N ATOM 342 CA THR A 24 -18.177 13.998 -4.321 1.00 0.00 C ATOM 343 C THR A 24 -19.435 13.206 -3.981 1.00 0.00 C ATOM 344 O THR A 24 -20.281 12.967 -4.842 1.00 0.00 O ATOM 345 CB THR A 24 -18.462 15.500 -4.128 1.00 0.00 C ATOM 346 OG1 THR A 24 -18.651 15.788 -2.738 1.00 0.00 O ATOM 347 CG2 THR A 24 -19.696 15.921 -4.911 1.00 0.00 C ATOM 0 H THR A 24 -17.783 14.507 -6.315 1.00 0.00 H new ATOM 0 HA THR A 24 -17.371 13.699 -3.651 1.00 0.00 H new ATOM 0 HB THR A 24 -17.605 16.061 -4.501 1.00 0.00 H new ATOM 0 HG1 THR A 24 -18.830 16.745 -2.624 1.00 0.00 H new ATOM 0 HG21 THR A 24 -19.878 16.985 -4.759 1.00 0.00 H new ATOM 0 HG22 THR A 24 -19.537 15.727 -5.972 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.559 15.353 -4.564 1.00 0.00 H new ATOM 355 N GLY A 25 -19.551 12.802 -2.720 1.00 0.00 N ATOM 356 CA GLY A 25 -20.710 12.041 -2.289 1.00 0.00 C ATOM 357 C GLY A 25 -20.861 10.737 -3.046 1.00 0.00 C ATOM 358 O GLY A 25 -21.848 10.534 -3.754 1.00 0.00 O ATOM 0 H GLY A 25 -18.864 12.988 -1.989 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -20.627 11.831 -1.223 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -21.608 12.643 -2.426 1.00 0.00 H new ATOM 362 N SER A 26 -19.881 9.851 -2.898 1.00 0.00 N ATOM 363 CA SER A 26 -19.908 8.562 -3.579 1.00 0.00 C ATOM 364 C SER A 26 -18.813 7.643 -3.044 1.00 0.00 C ATOM 365 O SER A 26 -17.758 8.104 -2.610 1.00 0.00 O ATOM 366 CB SER A 26 -19.736 8.753 -5.087 1.00 0.00 C ATOM 367 OG SER A 26 -20.988 8.941 -5.723 1.00 0.00 O ATOM 0 H SER A 26 -19.059 10.002 -2.313 1.00 0.00 H new ATOM 0 HA SER A 26 -20.875 8.098 -3.387 1.00 0.00 H new ATOM 0 HB2 SER A 26 -19.095 9.614 -5.277 1.00 0.00 H new ATOM 0 HB3 SER A 26 -19.235 7.883 -5.512 1.00 0.00 H new ATOM 0 HG SER A 26 -21.511 9.603 -5.225 1.00 0.00 H new ATOM 373 N ALA A 27 -19.075 6.340 -3.077 1.00 0.00 N ATOM 374 CA ALA A 27 -18.113 5.356 -2.598 1.00 0.00 C ATOM 375 C ALA A 27 -17.345 4.729 -3.757 1.00 0.00 C ATOM 376 O ALA A 27 -17.940 4.173 -4.681 1.00 0.00 O ATOM 377 CB ALA A 27 -18.819 4.280 -1.786 1.00 0.00 C ATOM 0 H ALA A 27 -19.945 5.942 -3.430 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.396 5.868 -1.957 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -18.088 3.551 -1.434 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.316 4.737 -0.931 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.559 3.779 -2.411 1.00 0.00 H new ATOM 383 N HIS A 28 -16.020 4.822 -3.702 1.00 0.00 N ATOM 384 CA HIS A 28 -15.171 4.264 -4.748 1.00 0.00 C ATOM 385 C HIS A 28 -14.687 2.868 -4.368 1.00 0.00 C ATOM 386 O HIS A 28 -14.696 2.496 -3.194 1.00 0.00 O ATOM 387 CB HIS A 28 -13.973 5.179 -5.005 1.00 0.00 C ATOM 388 CG HIS A 28 -14.235 6.232 -6.038 1.00 0.00 C ATOM 389 ND1 HIS A 28 -13.597 6.262 -7.260 1.00 0.00 N ATOM 390 CD2 HIS A 28 -15.072 7.295 -6.026 1.00 0.00 C ATOM 391 CE1 HIS A 28 -14.029 7.300 -7.954 1.00 0.00 C ATOM 392 NE2 HIS A 28 -14.926 7.943 -7.228 1.00 0.00 N ATOM 0 H HIS A 28 -15.512 5.278 -2.945 1.00 0.00 H new ATOM 0 HA HIS A 28 -15.763 4.189 -5.660 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.688 5.662 -4.070 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.125 4.573 -5.323 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.732 7.581 -5.221 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -13.704 7.576 -8.946 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -15.428 8.784 -7.514 1.00 0.00 H new ATOM 400 N CYS A 29 -14.266 2.100 -5.367 1.00 0.00 N ATOM 401 CA CYS A 29 -13.779 0.745 -5.137 1.00 0.00 C ATOM 402 C CYS A 29 -12.303 0.627 -5.501 1.00 0.00 C ATOM 403 O CYS A 29 -11.915 0.858 -6.647 1.00 0.00 O ATOM 404 CB CYS A 29 -14.599 -0.258 -5.950 1.00 0.00 C ATOM 405 SG CYS A 29 -14.565 0.035 -7.734 1.00 0.00 S ATOM 0 H CYS A 29 -14.252 2.393 -6.344 1.00 0.00 H new ATOM 0 HA CYS A 29 -13.891 0.521 -4.076 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -14.226 -1.263 -5.750 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -15.633 -0.228 -5.607 1.00 0.00 H new ATOM 0 HG CYS A 29 -13.401 0.504 -8.075 1.00 0.00 H new ATOM 411 N TYR A 30 -11.483 0.269 -4.519 1.00 0.00 N ATOM 412 CA TYR A 30 -10.049 0.126 -4.735 1.00 0.00 C ATOM 413 C TYR A 30 -9.541 -1.196 -4.166 1.00 0.00 C ATOM 414 O TYR A 30 -10.105 -1.729 -3.211 1.00 0.00 O ATOM 415 CB TYR A 30 -9.296 1.293 -4.093 1.00 0.00 C ATOM 416 CG TYR A 30 -9.775 2.650 -4.555 1.00 0.00 C ATOM 417 CD1 TYR A 30 -9.609 3.057 -5.873 1.00 0.00 C ATOM 418 CD2 TYR A 30 -10.397 3.526 -3.673 1.00 0.00 C ATOM 419 CE1 TYR A 30 -10.045 4.296 -6.299 1.00 0.00 C ATOM 420 CE2 TYR A 30 -10.837 4.767 -4.090 1.00 0.00 C ATOM 421 CZ TYR A 30 -10.659 5.148 -5.404 1.00 0.00 C ATOM 422 OH TYR A 30 -11.096 6.383 -5.825 1.00 0.00 O ATOM 0 H TYR A 30 -11.787 0.073 -3.566 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.867 0.132 -5.810 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -9.400 1.230 -3.010 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.234 1.196 -4.317 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.130 2.392 -6.577 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -10.539 3.231 -2.644 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.906 4.597 -7.327 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -11.318 5.436 -3.391 1.00 0.00 H new ATOM 0 HH TYR A 30 -11.863 6.272 -6.425 1.00 0.00 H new ATOM 432 N GLU A 31 -8.473 -1.717 -4.760 1.00 0.00 N ATOM 433 CA GLU A 31 -7.889 -2.977 -4.313 1.00 0.00 C ATOM 434 C GLU A 31 -6.389 -2.829 -4.080 1.00 0.00 C ATOM 435 O GLU A 31 -5.690 -2.182 -4.859 1.00 0.00 O ATOM 436 CB GLU A 31 -8.151 -4.079 -5.341 1.00 0.00 C ATOM 437 CG GLU A 31 -7.986 -5.483 -4.783 1.00 0.00 C ATOM 438 CD GLU A 31 -8.457 -6.553 -5.749 1.00 0.00 C ATOM 439 OE1 GLU A 31 -9.680 -6.792 -5.821 1.00 0.00 O ATOM 440 OE2 GLU A 31 -7.601 -7.153 -6.433 1.00 0.00 O ATOM 0 H GLU A 31 -7.994 -1.287 -5.551 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.360 -3.252 -3.369 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -9.163 -3.968 -5.730 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.470 -3.949 -6.182 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.937 -5.653 -4.541 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.545 -5.568 -3.851 1.00 0.00 H new ATOM 447 N ALA A 32 -5.901 -3.433 -3.002 1.00 0.00 N ATOM 448 CA ALA A 32 -4.483 -3.370 -2.666 1.00 0.00 C ATOM 449 C ALA A 32 -3.943 -4.749 -2.305 1.00 0.00 C ATOM 450 O ALA A 32 -4.282 -5.305 -1.260 1.00 0.00 O ATOM 451 CB ALA A 32 -4.255 -2.395 -1.521 1.00 0.00 C ATOM 0 H ALA A 32 -6.466 -3.972 -2.346 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.942 -3.015 -3.543 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.192 -2.358 -1.281 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.595 -1.402 -1.815 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.814 -2.725 -0.645 1.00 0.00 H new ATOM 457 N ILE A 33 -3.102 -5.297 -3.176 1.00 0.00 N ATOM 458 CA ILE A 33 -2.515 -6.611 -2.948 1.00 0.00 C ATOM 459 C ILE A 33 -1.278 -6.514 -2.061 1.00 0.00 C ATOM 460 O ILE A 33 -0.410 -5.668 -2.278 1.00 0.00 O ATOM 461 CB ILE A 33 -2.129 -7.293 -4.274 1.00 0.00 C ATOM 462 CG1 ILE A 33 -3.190 -7.017 -5.342 1.00 0.00 C ATOM 463 CG2 ILE A 33 -1.955 -8.790 -4.068 1.00 0.00 C ATOM 464 CD1 ILE A 33 -4.563 -7.539 -4.980 1.00 0.00 C ATOM 0 H ILE A 33 -2.812 -4.851 -4.046 1.00 0.00 H new ATOM 0 HA ILE A 33 -3.273 -7.212 -2.446 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.180 -6.880 -4.616 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.252 -5.942 -5.511 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.874 -7.470 -6.282 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -1.682 -9.258 -5.014 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.168 -8.967 -3.335 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.890 -9.219 -3.707 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -5.263 -7.308 -5.782 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -4.516 -8.619 -4.839 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -4.900 -7.067 -4.057 1.00 0.00 H new ATOM 476 N LEU A 34 -1.203 -7.388 -1.063 1.00 0.00 N ATOM 477 CA LEU A 34 -0.071 -7.403 -0.143 1.00 0.00 C ATOM 478 C LEU A 34 0.674 -8.732 -0.219 1.00 0.00 C ATOM 479 O LEU A 34 0.121 -9.785 0.098 1.00 0.00 O ATOM 480 CB LEU A 34 -0.549 -7.154 1.289 1.00 0.00 C ATOM 481 CG LEU A 34 0.517 -6.689 2.281 1.00 0.00 C ATOM 482 CD1 LEU A 34 0.949 -5.264 1.970 1.00 0.00 C ATOM 483 CD2 LEU A 34 0.000 -6.792 3.708 1.00 0.00 C ATOM 0 H LEU A 34 -1.912 -8.095 -0.870 1.00 0.00 H new ATOM 0 HA LEU A 34 0.614 -6.606 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.342 -6.406 1.261 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.992 -8.075 1.668 1.00 0.00 H new ATOM 0 HG LEU A 34 1.386 -7.340 2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.708 -4.949 2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.361 -5.221 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.088 -4.599 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.773 -6.457 4.400 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.885 -6.165 3.821 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.259 -7.828 3.927 1.00 0.00 H new ATOM 495 N TYR A 35 1.933 -8.674 -0.639 1.00 0.00 N ATOM 496 CA TYR A 35 2.755 -9.873 -0.757 1.00 0.00 C ATOM 497 C TYR A 35 3.530 -10.131 0.532 1.00 0.00 C ATOM 498 O TYR A 35 4.325 -9.299 0.967 1.00 0.00 O ATOM 499 CB TYR A 35 3.725 -9.738 -1.931 1.00 0.00 C ATOM 500 CG TYR A 35 3.040 -9.640 -3.275 1.00 0.00 C ATOM 501 CD1 TYR A 35 2.224 -8.559 -3.583 1.00 0.00 C ATOM 502 CD2 TYR A 35 3.208 -10.629 -4.236 1.00 0.00 C ATOM 503 CE1 TYR A 35 1.595 -8.465 -4.809 1.00 0.00 C ATOM 504 CE2 TYR A 35 2.584 -10.543 -5.466 1.00 0.00 C ATOM 505 CZ TYR A 35 1.778 -9.459 -5.748 1.00 0.00 C ATOM 506 OH TYR A 35 1.154 -9.370 -6.971 1.00 0.00 O ATOM 0 H TYR A 35 2.407 -7.810 -0.903 1.00 0.00 H new ATOM 0 HA TYR A 35 2.093 -10.720 -0.937 1.00 0.00 H new ATOM 0 HB2 TYR A 35 4.342 -8.852 -1.782 1.00 0.00 H new ATOM 0 HB3 TYR A 35 4.397 -10.596 -1.937 1.00 0.00 H new ATOM 0 HD1 TYR A 35 2.079 -7.778 -2.851 1.00 0.00 H new ATOM 0 HD2 TYR A 35 3.837 -11.480 -4.018 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.963 -7.618 -5.031 1.00 0.00 H new ATOM 0 HE2 TYR A 35 2.726 -11.320 -6.203 1.00 0.00 H new ATOM 0 HH TYR A 35 1.389 -10.150 -7.515 1.00 0.00 H new ATOM 516 N ASN A 36 3.292 -11.290 1.136 1.00 0.00 N ATOM 517 CA ASN A 36 3.967 -11.659 2.375 1.00 0.00 C ATOM 518 C ASN A 36 5.319 -12.304 2.087 1.00 0.00 C ATOM 519 O ASN A 36 5.390 -13.437 1.608 1.00 0.00 O ATOM 520 CB ASN A 36 3.096 -12.617 3.190 1.00 0.00 C ATOM 521 CG ASN A 36 3.773 -13.068 4.470 1.00 0.00 C ATOM 522 OD1 ASN A 36 4.402 -12.272 5.166 1.00 0.00 O ATOM 523 ND2 ASN A 36 3.646 -14.352 4.785 1.00 0.00 N ATOM 0 H ASN A 36 2.637 -11.990 0.788 1.00 0.00 H new ATOM 0 HA ASN A 36 4.134 -10.750 2.953 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.153 -12.128 3.434 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.855 -13.490 2.583 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.080 -14.714 5.634 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.115 -14.976 4.178 1.00 0.00 H new ATOM 530 N LYS A 37 6.391 -11.576 2.381 1.00 0.00 N ATOM 531 CA LYS A 37 7.742 -12.077 2.156 1.00 0.00 C ATOM 532 C LYS A 37 8.303 -12.716 3.422 1.00 0.00 C ATOM 533 O LYS A 37 9.461 -12.500 3.777 1.00 0.00 O ATOM 534 CB LYS A 37 8.658 -10.941 1.696 1.00 0.00 C ATOM 535 CG LYS A 37 8.339 -10.428 0.302 1.00 0.00 C ATOM 536 CD LYS A 37 8.936 -11.323 -0.771 1.00 0.00 C ATOM 537 CE LYS A 37 8.280 -11.086 -2.123 1.00 0.00 C ATOM 538 NZ LYS A 37 8.927 -11.884 -3.201 1.00 0.00 N ATOM 0 H LYS A 37 6.350 -10.636 2.776 1.00 0.00 H new ATOM 0 HA LYS A 37 7.696 -12.837 1.376 1.00 0.00 H new ATOM 0 HB2 LYS A 37 8.582 -10.116 2.404 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.691 -11.287 1.719 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.258 -10.373 0.172 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.725 -9.415 0.189 1.00 0.00 H new ATOM 0 HD2 LYS A 37 10.007 -11.136 -0.847 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.814 -12.368 -0.484 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.223 -11.345 -2.064 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.335 -10.026 -2.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.451 -11.695 -4.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.930 -11.619 -3.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.852 -12.897 -2.976 1.00 0.00 H new ATOM 552 N GLY A 38 7.475 -13.507 4.098 1.00 0.00 N ATOM 553 CA GLY A 38 7.908 -14.167 5.315 1.00 0.00 C ATOM 554 C GLY A 38 8.024 -15.669 5.151 1.00 0.00 C ATOM 555 O GLY A 38 7.466 -16.243 4.216 1.00 0.00 O ATOM 0 H GLY A 38 6.512 -13.702 3.824 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.873 -13.763 5.620 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.202 -13.946 6.115 1.00 0.00 H new ATOM 559 N SER A 39 8.752 -16.308 6.061 1.00 0.00 N ATOM 560 CA SER A 39 8.945 -17.753 6.010 1.00 0.00 C ATOM 561 C SER A 39 7.745 -18.482 6.608 1.00 0.00 C ATOM 562 O SER A 39 7.412 -19.593 6.194 1.00 0.00 O ATOM 563 CB SER A 39 10.220 -18.145 6.758 1.00 0.00 C ATOM 564 OG SER A 39 10.701 -19.404 6.319 1.00 0.00 O ATOM 0 H SER A 39 9.218 -15.848 6.843 1.00 0.00 H new ATOM 0 HA SER A 39 9.042 -18.046 4.965 1.00 0.00 H new ATOM 0 HB2 SER A 39 10.985 -17.385 6.602 1.00 0.00 H new ATOM 0 HB3 SER A 39 10.021 -18.181 7.829 1.00 0.00 H new ATOM 0 HG SER A 39 11.517 -19.632 6.811 1.00 0.00 H new ATOM 570 N ILE A 40 7.102 -17.849 7.582 1.00 0.00 N ATOM 571 CA ILE A 40 5.939 -18.436 8.237 1.00 0.00 C ATOM 572 C ILE A 40 4.773 -17.454 8.271 1.00 0.00 C ATOM 573 O ILE A 40 4.960 -16.246 8.119 1.00 0.00 O ATOM 574 CB ILE A 40 6.266 -18.878 9.676 1.00 0.00 C ATOM 575 CG1 ILE A 40 6.632 -17.665 10.534 1.00 0.00 C ATOM 576 CG2 ILE A 40 7.400 -19.892 9.673 1.00 0.00 C ATOM 577 CD1 ILE A 40 6.400 -17.880 12.013 1.00 0.00 C ATOM 0 H ILE A 40 7.366 -16.929 7.936 1.00 0.00 H new ATOM 0 HA ILE A 40 5.656 -19.312 7.652 1.00 0.00 H new ATOM 0 HB ILE A 40 5.383 -19.350 10.105 1.00 0.00 H new ATOM 0 HG12 ILE A 40 7.681 -17.418 10.371 1.00 0.00 H new ATOM 0 HG13 ILE A 40 6.047 -16.806 10.204 1.00 0.00 H new ATOM 0 HG21 ILE A 40 7.620 -20.195 10.697 1.00 0.00 H new ATOM 0 HG22 ILE A 40 7.105 -20.766 9.091 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.288 -19.443 9.229 1.00 0.00 H new ATOM 0 HD11 ILE A 40 6.681 -16.980 12.560 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.346 -18.097 12.188 1.00 0.00 H new ATOM 0 HD13 ILE A 40 7.005 -18.718 12.358 1.00 0.00 H new ATOM 589 N ASP A 41 3.570 -17.979 8.474 1.00 0.00 N ATOM 590 CA ASP A 41 2.373 -17.149 8.532 1.00 0.00 C ATOM 591 C ASP A 41 2.678 -15.799 9.174 1.00 0.00 C ATOM 592 O ASP A 41 3.183 -15.733 10.294 1.00 0.00 O ATOM 593 CB ASP A 41 1.269 -17.862 9.315 1.00 0.00 C ATOM 594 CG ASP A 41 1.291 -19.364 9.109 1.00 0.00 C ATOM 595 OD1 ASP A 41 0.920 -19.817 8.007 1.00 0.00 O ATOM 596 OD2 ASP A 41 1.679 -20.086 10.052 1.00 0.00 O ATOM 0 H ASP A 41 3.398 -18.976 8.601 1.00 0.00 H new ATOM 0 HA ASP A 41 2.031 -16.977 7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 41 1.381 -17.642 10.377 1.00 0.00 H new ATOM 0 HB3 ASP A 41 0.299 -17.470 9.009 1.00 0.00 H new ATOM 601 N ALA A 42 2.370 -14.724 8.455 1.00 0.00 N ATOM 602 CA ALA A 42 2.610 -13.376 8.955 1.00 0.00 C ATOM 603 C ALA A 42 1.300 -12.678 9.304 1.00 0.00 C ATOM 604 O ALA A 42 0.353 -12.684 8.516 1.00 0.00 O ATOM 605 CB ALA A 42 3.386 -12.564 7.929 1.00 0.00 C ATOM 0 H ALA A 42 1.954 -14.761 7.525 1.00 0.00 H new ATOM 0 HA ALA A 42 3.203 -13.453 9.866 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.558 -11.559 8.315 1.00 0.00 H new ATOM 0 HB2 ALA A 42 4.343 -13.046 7.732 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.813 -12.504 7.004 1.00 0.00 H new ATOM 611 N LEU A 43 1.252 -12.079 10.488 1.00 0.00 N ATOM 612 CA LEU A 43 0.057 -11.376 10.942 1.00 0.00 C ATOM 613 C LEU A 43 0.113 -9.901 10.558 1.00 0.00 C ATOM 614 O LEU A 43 1.080 -9.205 10.869 1.00 0.00 O ATOM 615 CB LEU A 43 -0.096 -11.515 12.458 1.00 0.00 C ATOM 616 CG LEU A 43 -0.596 -12.869 12.961 1.00 0.00 C ATOM 617 CD1 LEU A 43 0.488 -13.926 12.816 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.052 -12.765 14.409 1.00 0.00 C ATOM 0 H LEU A 43 2.027 -12.066 11.152 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.807 -11.827 10.453 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.870 -11.312 12.921 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.784 -10.744 12.806 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.450 -13.168 12.353 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.114 -14.883 13.179 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.767 -14.020 11.766 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.362 -13.633 13.398 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.405 -13.738 14.750 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.217 -12.443 15.031 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.862 -12.039 14.484 1.00 0.00 H new ATOM 630 N PHE A 44 -0.930 -9.430 9.883 1.00 0.00 N ATOM 631 CA PHE A 44 -1.000 -8.037 9.457 1.00 0.00 C ATOM 632 C PHE A 44 -2.264 -7.369 9.990 1.00 0.00 C ATOM 633 O PHE A 44 -3.339 -7.967 9.999 1.00 0.00 O ATOM 634 CB PHE A 44 -0.966 -7.946 7.930 1.00 0.00 C ATOM 635 CG PHE A 44 -2.241 -8.394 7.275 1.00 0.00 C ATOM 636 CD1 PHE A 44 -2.538 -9.742 7.156 1.00 0.00 C ATOM 637 CD2 PHE A 44 -3.142 -7.466 6.777 1.00 0.00 C ATOM 638 CE1 PHE A 44 -3.711 -10.157 6.553 1.00 0.00 C ATOM 639 CE2 PHE A 44 -4.316 -7.876 6.174 1.00 0.00 C ATOM 640 CZ PHE A 44 -4.601 -9.223 6.061 1.00 0.00 C ATOM 0 H PHE A 44 -1.739 -9.993 9.619 1.00 0.00 H new ATOM 0 HA PHE A 44 -0.134 -7.514 9.864 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -0.760 -6.916 7.640 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.142 -8.553 7.556 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -1.845 -10.477 7.539 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.924 -6.411 6.861 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.931 -11.211 6.467 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -5.011 -7.143 5.791 1.00 0.00 H new ATOM 0 HZ PHE A 44 -5.518 -9.545 5.589 1.00 0.00 H new ATOM 650 N ASN A 45 -2.125 -6.124 10.435 1.00 0.00 N ATOM 651 CA ASN A 45 -3.254 -5.373 10.971 1.00 0.00 C ATOM 652 C ASN A 45 -3.171 -3.904 10.570 1.00 0.00 C ATOM 653 O ASN A 45 -2.094 -3.308 10.578 1.00 0.00 O ATOM 654 CB ASN A 45 -3.297 -5.495 12.496 1.00 0.00 C ATOM 655 CG ASN A 45 -2.954 -6.893 12.974 1.00 0.00 C ATOM 656 OD1 ASN A 45 -1.839 -7.374 12.774 1.00 0.00 O ATOM 657 ND2 ASN A 45 -3.916 -7.553 13.609 1.00 0.00 N ATOM 0 H ASN A 45 -1.242 -5.614 10.435 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.169 -5.794 10.553 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -2.599 -4.782 12.935 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -4.292 -5.226 12.851 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -3.745 -8.498 13.953 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -4.826 -7.115 13.753 1.00 0.00 H new ATOM 664 N MET A 46 -4.315 -3.326 10.219 1.00 0.00 N ATOM 665 CA MET A 46 -4.371 -1.925 9.817 1.00 0.00 C ATOM 666 C MET A 46 -4.630 -1.024 11.019 1.00 0.00 C ATOM 667 O MET A 46 -5.417 -1.361 11.904 1.00 0.00 O ATOM 668 CB MET A 46 -5.463 -1.719 8.765 1.00 0.00 C ATOM 669 CG MET A 46 -5.235 -2.510 7.488 1.00 0.00 C ATOM 670 SD MET A 46 -3.787 -1.949 6.572 1.00 0.00 S ATOM 671 CE MET A 46 -4.156 -0.206 6.389 1.00 0.00 C ATOM 0 H MET A 46 -5.215 -3.805 10.205 1.00 0.00 H new ATOM 0 HA MET A 46 -3.406 -1.657 9.387 1.00 0.00 H new ATOM 0 HB2 MET A 46 -6.425 -2.003 9.192 1.00 0.00 H new ATOM 0 HB3 MET A 46 -5.524 -0.659 8.520 1.00 0.00 H new ATOM 0 HG2 MET A 46 -5.117 -3.565 7.735 1.00 0.00 H new ATOM 0 HG3 MET A 46 -6.117 -2.428 6.852 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.787 0.145 5.425 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.234 -0.055 6.441 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.672 0.354 7.189 1.00 0.00 H new ATOM 681 N THR A 47 -3.962 0.126 11.046 1.00 0.00 N ATOM 682 CA THR A 47 -4.119 1.075 12.141 1.00 0.00 C ATOM 683 C THR A 47 -5.094 2.186 11.770 1.00 0.00 C ATOM 684 O THR A 47 -5.018 2.778 10.693 1.00 0.00 O ATOM 685 CB THR A 47 -2.769 1.704 12.537 1.00 0.00 C ATOM 686 OG1 THR A 47 -2.015 0.783 13.333 1.00 0.00 O ATOM 687 CG2 THR A 47 -2.980 2.996 13.310 1.00 0.00 C ATOM 0 H THR A 47 -3.307 0.422 10.322 1.00 0.00 H new ATOM 0 HA THR A 47 -4.514 0.516 12.989 1.00 0.00 H new ATOM 0 HB THR A 47 -2.217 1.932 11.625 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.158 1.189 13.579 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.013 3.421 13.579 1.00 0.00 H new ATOM 0 HG22 THR A 47 -3.529 3.705 12.690 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.550 2.789 14.216 1.00 0.00 H new ATOM 695 N PRO A 48 -6.034 2.478 12.682 1.00 0.00 N ATOM 696 CA PRO A 48 -7.043 3.521 12.473 1.00 0.00 C ATOM 697 C PRO A 48 -6.442 4.922 12.500 1.00 0.00 C ATOM 698 O PRO A 48 -5.743 5.306 13.438 1.00 0.00 O ATOM 699 CB PRO A 48 -8.002 3.327 13.650 1.00 0.00 C ATOM 700 CG PRO A 48 -7.177 2.681 14.708 1.00 0.00 C ATOM 701 CD PRO A 48 -6.184 1.812 13.987 1.00 0.00 C ATOM 0 HA PRO A 48 -7.522 3.436 11.497 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -8.408 4.279 13.991 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -8.849 2.701 13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -6.670 3.429 15.318 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -7.798 2.089 15.380 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -5.236 1.757 14.521 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -6.548 0.791 13.878 1.00 0.00 H new ATOM 709 N PRO A 49 -6.719 5.706 11.447 1.00 0.00 N ATOM 710 CA PRO A 49 -6.216 7.078 11.328 1.00 0.00 C ATOM 711 C PRO A 49 -6.869 8.024 12.329 1.00 0.00 C ATOM 712 O PRO A 49 -7.861 7.677 12.972 1.00 0.00 O ATOM 713 CB PRO A 49 -6.592 7.470 9.897 1.00 0.00 C ATOM 714 CG PRO A 49 -7.762 6.611 9.564 1.00 0.00 C ATOM 715 CD PRO A 49 -7.545 5.314 10.293 1.00 0.00 C ATOM 0 HA PRO A 49 -5.148 7.140 11.535 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.846 8.528 9.830 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.765 7.296 9.209 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -8.694 7.083 9.876 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.832 6.447 8.489 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -8.488 4.867 10.607 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -7.038 4.581 9.666 1.00 0.00 H new ATOM 723 N THR A 50 -6.308 9.222 12.457 1.00 0.00 N ATOM 724 CA THR A 50 -6.836 10.219 13.381 1.00 0.00 C ATOM 725 C THR A 50 -7.126 11.533 12.665 1.00 0.00 C ATOM 726 O THR A 50 -7.027 12.608 13.255 1.00 0.00 O ATOM 727 CB THR A 50 -5.857 10.485 14.540 1.00 0.00 C ATOM 728 OG1 THR A 50 -5.496 9.250 15.169 1.00 0.00 O ATOM 729 CG2 THR A 50 -6.475 11.422 15.566 1.00 0.00 C ATOM 0 H THR A 50 -5.488 9.526 11.932 1.00 0.00 H new ATOM 0 HA THR A 50 -7.765 9.815 13.785 1.00 0.00 H new ATOM 0 HB THR A 50 -4.964 10.958 14.132 1.00 0.00 H new ATOM 0 HG1 THR A 50 -4.872 9.427 15.904 1.00 0.00 H new ATOM 0 HG21 THR A 50 -5.765 11.595 16.375 1.00 0.00 H new ATOM 0 HG22 THR A 50 -6.721 12.371 15.090 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.382 10.972 15.970 1.00 0.00 H new ATOM 737 N SER A 51 -7.488 11.439 11.389 1.00 0.00 N ATOM 738 CA SER A 51 -7.790 12.621 10.591 1.00 0.00 C ATOM 739 C SER A 51 -9.208 12.551 10.033 1.00 0.00 C ATOM 740 O SER A 51 -9.864 11.512 10.102 1.00 0.00 O ATOM 741 CB SER A 51 -6.786 12.760 9.446 1.00 0.00 C ATOM 742 OG SER A 51 -5.531 13.218 9.920 1.00 0.00 O ATOM 0 H SER A 51 -7.579 10.556 10.886 1.00 0.00 H new ATOM 0 HA SER A 51 -7.715 13.495 11.238 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.661 11.798 8.949 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.173 13.456 8.701 1.00 0.00 H new ATOM 0 HG SER A 51 -4.907 13.297 9.169 1.00 0.00 H new ATOM 748 N ALA A 52 -9.675 13.666 9.480 1.00 0.00 N ATOM 749 CA ALA A 52 -11.014 13.732 8.908 1.00 0.00 C ATOM 750 C ALA A 52 -11.151 12.788 7.719 1.00 0.00 C ATOM 751 O ALA A 52 -12.011 11.906 7.708 1.00 0.00 O ATOM 752 CB ALA A 52 -11.341 15.159 8.492 1.00 0.00 C ATOM 0 H ALA A 52 -9.146 14.536 9.416 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.724 13.416 9.672 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.344 15.193 8.067 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.294 15.812 9.364 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -10.619 15.495 7.748 1.00 0.00 H new ATOM 758 N LEU A 53 -10.298 12.978 6.718 1.00 0.00 N ATOM 759 CA LEU A 53 -10.323 12.143 5.522 1.00 0.00 C ATOM 760 C LEU A 53 -9.913 10.710 5.849 1.00 0.00 C ATOM 761 O LEU A 53 -10.650 9.765 5.573 1.00 0.00 O ATOM 762 CB LEU A 53 -9.393 12.720 4.453 1.00 0.00 C ATOM 763 CG LEU A 53 -10.006 13.770 3.526 1.00 0.00 C ATOM 764 CD1 LEU A 53 -11.115 13.157 2.685 1.00 0.00 C ATOM 765 CD2 LEU A 53 -10.534 14.949 4.331 1.00 0.00 C ATOM 0 H LEU A 53 -9.581 13.703 6.711 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.343 12.131 5.139 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.531 13.163 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.021 11.898 3.842 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.228 14.133 2.855 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.540 13.919 2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.708 12.347 2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.894 12.765 3.339 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -10.967 15.687 3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -11.298 14.602 5.026 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -9.716 15.404 4.889 1.00 0.00 H new ATOM 777 N GLY A 54 -8.733 10.558 6.442 1.00 0.00 N ATOM 778 CA GLY A 54 -8.246 9.239 6.799 1.00 0.00 C ATOM 779 C GLY A 54 -9.335 8.356 7.376 1.00 0.00 C ATOM 780 O GLY A 54 -9.545 7.235 6.913 1.00 0.00 O ATOM 0 H GLY A 54 -8.105 11.326 6.682 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -7.824 8.760 5.916 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -7.439 9.337 7.525 1.00 0.00 H new ATOM 784 N ALA A 55 -10.030 8.862 8.389 1.00 0.00 N ATOM 785 CA ALA A 55 -11.103 8.112 9.030 1.00 0.00 C ATOM 786 C ALA A 55 -12.060 7.529 7.994 1.00 0.00 C ATOM 787 O ALA A 55 -12.421 6.354 8.061 1.00 0.00 O ATOM 788 CB ALA A 55 -11.859 9.000 10.007 1.00 0.00 C ATOM 0 H ALA A 55 -9.869 9.789 8.784 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.655 7.285 9.580 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.657 8.426 10.478 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.174 9.364 10.773 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.288 9.847 9.472 1.00 0.00 H new ATOM 794 N CYS A 56 -12.466 8.358 7.039 1.00 0.00 N ATOM 795 CA CYS A 56 -13.382 7.925 5.990 1.00 0.00 C ATOM 796 C CYS A 56 -12.922 6.606 5.376 1.00 0.00 C ATOM 797 O CYS A 56 -13.647 5.611 5.401 1.00 0.00 O ATOM 798 CB CYS A 56 -13.490 8.996 4.904 1.00 0.00 C ATOM 799 SG CYS A 56 -14.043 10.608 5.509 1.00 0.00 S ATOM 0 H CYS A 56 -12.176 9.333 6.969 1.00 0.00 H new ATOM 0 HA CYS A 56 -14.363 7.773 6.439 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -12.517 9.113 4.427 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -14.182 8.651 4.136 1.00 0.00 H new ATOM 0 HG CYS A 56 -13.201 11.051 6.395 1.00 0.00 H new ATOM 805 N PHE A 57 -11.713 6.607 4.825 1.00 0.00 N ATOM 806 CA PHE A 57 -11.156 5.411 4.202 1.00 0.00 C ATOM 807 C PHE A 57 -11.458 4.171 5.039 1.00 0.00 C ATOM 808 O PHE A 57 -11.501 4.233 6.268 1.00 0.00 O ATOM 809 CB PHE A 57 -9.645 5.562 4.019 1.00 0.00 C ATOM 810 CG PHE A 57 -9.266 6.507 2.915 1.00 0.00 C ATOM 811 CD1 PHE A 57 -9.098 6.047 1.619 1.00 0.00 C ATOM 812 CD2 PHE A 57 -9.076 7.855 3.173 1.00 0.00 C ATOM 813 CE1 PHE A 57 -8.750 6.914 0.600 1.00 0.00 C ATOM 814 CE2 PHE A 57 -8.728 8.726 2.159 1.00 0.00 C ATOM 815 CZ PHE A 57 -8.564 8.255 0.871 1.00 0.00 C ATOM 0 H PHE A 57 -11.100 7.422 4.797 1.00 0.00 H new ATOM 0 HA PHE A 57 -11.622 5.290 3.224 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.207 5.913 4.953 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.212 4.583 3.813 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -9.241 4.999 1.402 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.201 8.229 4.178 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -8.624 6.543 -0.406 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.584 9.775 2.373 1.00 0.00 H new ATOM 0 HZ PHE A 57 -8.291 8.934 0.077 1.00 0.00 H new ATOM 825 N VAL A 58 -11.667 3.045 4.364 1.00 0.00 N ATOM 826 CA VAL A 58 -11.964 1.790 5.044 1.00 0.00 C ATOM 827 C VAL A 58 -11.117 0.651 4.489 1.00 0.00 C ATOM 828 O VAL A 58 -11.278 0.247 3.337 1.00 0.00 O ATOM 829 CB VAL A 58 -13.453 1.420 4.912 1.00 0.00 C ATOM 830 CG1 VAL A 58 -13.734 0.089 5.593 1.00 0.00 C ATOM 831 CG2 VAL A 58 -14.329 2.520 5.493 1.00 0.00 C ATOM 0 H VAL A 58 -11.636 2.976 3.347 1.00 0.00 H new ATOM 0 HA VAL A 58 -11.725 1.936 6.098 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.692 1.318 3.853 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -14.791 -0.157 5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.133 -0.692 5.127 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -13.480 0.161 6.651 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -15.378 2.242 5.391 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -14.090 2.656 6.548 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.147 3.451 4.957 1.00 0.00 H new ATOM 841 N PHE A 59 -10.214 0.135 5.316 1.00 0.00 N ATOM 842 CA PHE A 59 -9.340 -0.959 4.908 1.00 0.00 C ATOM 843 C PHE A 59 -9.777 -2.273 5.550 1.00 0.00 C ATOM 844 O PHE A 59 -10.094 -2.320 6.738 1.00 0.00 O ATOM 845 CB PHE A 59 -7.890 -0.650 5.288 1.00 0.00 C ATOM 846 CG PHE A 59 -7.235 0.354 4.384 1.00 0.00 C ATOM 847 CD1 PHE A 59 -7.762 1.628 4.245 1.00 0.00 C ATOM 848 CD2 PHE A 59 -6.091 0.025 3.674 1.00 0.00 C ATOM 849 CE1 PHE A 59 -7.161 2.554 3.413 1.00 0.00 C ATOM 850 CE2 PHE A 59 -5.486 0.947 2.841 1.00 0.00 C ATOM 851 CZ PHE A 59 -6.021 2.214 2.711 1.00 0.00 C ATOM 0 H PHE A 59 -10.068 0.457 6.273 1.00 0.00 H new ATOM 0 HA PHE A 59 -9.411 -1.063 3.825 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -7.863 -0.277 6.312 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -7.313 -1.575 5.270 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -8.652 1.900 4.793 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -5.667 -0.964 3.773 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.583 3.543 3.312 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -4.596 0.677 2.292 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.549 2.937 2.062 1.00 0.00 H new ATOM 861 N SER A 60 -9.792 -3.337 4.754 1.00 0.00 N ATOM 862 CA SER A 60 -10.194 -4.651 5.242 1.00 0.00 C ATOM 863 C SER A 60 -9.486 -5.758 4.468 1.00 0.00 C ATOM 864 O SER A 60 -8.995 -5.558 3.356 1.00 0.00 O ATOM 865 CB SER A 60 -11.710 -4.820 5.124 1.00 0.00 C ATOM 866 OG SER A 60 -12.368 -4.344 6.286 1.00 0.00 O ATOM 0 H SER A 60 -9.530 -3.315 3.768 1.00 0.00 H new ATOM 0 HA SER A 60 -9.908 -4.725 6.291 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.072 -4.279 4.250 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.951 -5.872 4.971 1.00 0.00 H new ATOM 0 HG SER A 60 -11.837 -3.627 6.692 1.00 0.00 H new ATOM 872 N PRO A 61 -9.430 -6.957 5.068 1.00 0.00 N ATOM 873 CA PRO A 61 -10.010 -7.207 6.390 1.00 0.00 C ATOM 874 C PRO A 61 -9.240 -6.505 7.504 1.00 0.00 C ATOM 875 O PRO A 61 -8.009 -6.480 7.501 1.00 0.00 O ATOM 876 CB PRO A 61 -9.904 -8.726 6.543 1.00 0.00 C ATOM 877 CG PRO A 61 -8.769 -9.117 5.660 1.00 0.00 C ATOM 878 CD PRO A 61 -8.797 -8.159 4.501 1.00 0.00 C ATOM 0 HA PRO A 61 -11.029 -6.827 6.466 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.715 -9.007 7.579 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.828 -9.220 6.242 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -7.821 -9.056 6.194 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -8.877 -10.146 5.318 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.794 -7.948 4.130 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.370 -8.558 3.664 1.00 0.00 H new ATOM 886 N LYS A 62 -9.972 -5.935 8.455 1.00 0.00 N ATOM 887 CA LYS A 62 -9.359 -5.234 9.576 1.00 0.00 C ATOM 888 C LYS A 62 -8.068 -5.922 10.008 1.00 0.00 C ATOM 889 O LYS A 62 -7.140 -5.273 10.490 1.00 0.00 O ATOM 890 CB LYS A 62 -10.332 -5.165 10.755 1.00 0.00 C ATOM 891 CG LYS A 62 -10.652 -6.521 11.360 1.00 0.00 C ATOM 892 CD LYS A 62 -11.152 -6.391 12.789 1.00 0.00 C ATOM 893 CE LYS A 62 -12.599 -5.927 12.833 1.00 0.00 C ATOM 894 NZ LYS A 62 -12.890 -5.134 14.059 1.00 0.00 N ATOM 0 H LYS A 62 -10.992 -5.945 8.471 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.119 -4.222 9.251 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.909 -4.523 11.527 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.259 -4.697 10.423 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.407 -7.022 10.754 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.761 -7.148 11.341 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.061 -7.352 13.296 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.525 -5.683 13.332 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.814 -5.324 11.951 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -13.259 -6.793 12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.886 -4.836 14.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.709 -5.717 14.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.278 -4.294 14.082 1.00 0.00 H new ATOM 908 N GLU A 63 -8.016 -7.238 9.830 1.00 0.00 N ATOM 909 CA GLU A 63 -6.838 -8.013 10.201 1.00 0.00 C ATOM 910 C GLU A 63 -6.946 -9.447 9.690 1.00 0.00 C ATOM 911 O GLU A 63 -8.044 -9.976 9.522 1.00 0.00 O ATOM 912 CB GLU A 63 -6.659 -8.014 11.721 1.00 0.00 C ATOM 913 CG GLU A 63 -7.597 -8.966 12.444 1.00 0.00 C ATOM 914 CD GLU A 63 -7.497 -8.850 13.953 1.00 0.00 C ATOM 915 OE1 GLU A 63 -8.196 -7.990 14.529 1.00 0.00 O ATOM 916 OE2 GLU A 63 -6.721 -9.619 14.557 1.00 0.00 O ATOM 0 H GLU A 63 -8.776 -7.790 9.431 1.00 0.00 H new ATOM 0 HA GLU A 63 -5.968 -7.546 9.740 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -5.629 -8.283 11.957 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -6.819 -7.004 12.098 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -8.623 -8.764 12.135 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -7.370 -9.990 12.146 1.00 0.00 H new ATOM 923 N GLY A 64 -5.797 -10.069 9.444 1.00 0.00 N ATOM 924 CA GLY A 64 -5.784 -11.435 8.954 1.00 0.00 C ATOM 925 C GLY A 64 -4.379 -11.983 8.802 1.00 0.00 C ATOM 926 O GLY A 64 -3.403 -11.301 9.115 1.00 0.00 O ATOM 0 H GLY A 64 -4.876 -9.652 9.575 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -6.346 -12.069 9.640 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -6.293 -11.477 7.991 1.00 0.00 H new ATOM 930 N ILE A 65 -4.276 -13.218 8.323 1.00 0.00 N ATOM 931 CA ILE A 65 -2.980 -13.857 8.132 1.00 0.00 C ATOM 932 C ILE A 65 -2.675 -14.050 6.650 1.00 0.00 C ATOM 933 O ILE A 65 -3.529 -14.499 5.884 1.00 0.00 O ATOM 934 CB ILE A 65 -2.915 -15.223 8.840 1.00 0.00 C ATOM 935 CG1 ILE A 65 -3.314 -15.080 10.310 1.00 0.00 C ATOM 936 CG2 ILE A 65 -1.520 -15.817 8.719 1.00 0.00 C ATOM 937 CD1 ILE A 65 -3.832 -16.361 10.924 1.00 0.00 C ATOM 0 H ILE A 65 -5.074 -13.796 8.060 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.234 -13.194 8.571 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.619 -15.900 8.356 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.451 -14.737 10.880 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.080 -14.310 10.397 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -1.490 -16.782 9.224 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -1.272 -15.951 7.666 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.797 -15.144 9.180 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.095 -16.184 11.967 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -4.715 -16.695 10.379 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -3.060 -17.129 10.870 1.00 0.00 H new ATOM 949 N ILE A 66 -1.454 -13.710 6.254 1.00 0.00 N ATOM 950 CA ILE A 66 -1.036 -13.849 4.864 1.00 0.00 C ATOM 951 C ILE A 66 0.028 -14.931 4.715 1.00 0.00 C ATOM 952 O ILE A 66 1.210 -14.691 4.961 1.00 0.00 O ATOM 953 CB ILE A 66 -0.484 -12.523 4.307 1.00 0.00 C ATOM 954 CG1 ILE A 66 -1.450 -11.376 4.611 1.00 0.00 C ATOM 955 CG2 ILE A 66 -0.243 -12.638 2.809 1.00 0.00 C ATOM 956 CD1 ILE A 66 -0.859 -10.006 4.361 1.00 0.00 C ATOM 0 H ILE A 66 -0.736 -13.336 6.875 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.922 -14.133 4.295 1.00 0.00 H new ATOM 0 HB ILE A 66 0.468 -12.309 4.793 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.345 -11.494 4.000 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.764 -11.443 5.653 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.147 -11.693 2.430 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.479 -13.432 2.616 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.182 -12.871 2.306 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -1.599 -9.242 4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.019 -9.868 4.992 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.571 -9.920 3.313 1.00 0.00 H new ATOM 968 N GLU A 67 -0.400 -16.123 4.310 1.00 0.00 N ATOM 969 CA GLU A 67 0.517 -17.242 4.128 1.00 0.00 C ATOM 970 C GLU A 67 1.845 -16.768 3.544 1.00 0.00 C ATOM 971 O GLU A 67 1.917 -15.764 2.836 1.00 0.00 O ATOM 972 CB GLU A 67 -0.108 -18.297 3.212 1.00 0.00 C ATOM 973 CG GLU A 67 -0.501 -17.761 1.846 1.00 0.00 C ATOM 974 CD GLU A 67 -0.766 -18.865 0.840 1.00 0.00 C ATOM 975 OE1 GLU A 67 0.062 -19.797 0.751 1.00 0.00 O ATOM 976 OE2 GLU A 67 -1.799 -18.798 0.143 1.00 0.00 O ATOM 0 H GLU A 67 -1.375 -16.338 4.102 1.00 0.00 H new ATOM 0 HA GLU A 67 0.708 -17.686 5.105 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.598 -19.117 3.082 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.991 -18.711 3.698 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.393 -17.143 1.945 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.293 -17.116 1.471 1.00 0.00 H new ATOM 983 N PRO A 68 2.922 -17.507 3.849 1.00 0.00 N ATOM 984 CA PRO A 68 4.267 -17.182 3.366 1.00 0.00 C ATOM 985 C PRO A 68 4.414 -17.409 1.865 1.00 0.00 C ATOM 986 O PRO A 68 3.984 -18.434 1.338 1.00 0.00 O ATOM 987 CB PRO A 68 5.166 -18.147 4.143 1.00 0.00 C ATOM 988 CG PRO A 68 4.281 -19.296 4.485 1.00 0.00 C ATOM 989 CD PRO A 68 2.909 -18.717 4.688 1.00 0.00 C ATOM 0 HA PRO A 68 4.513 -16.131 3.520 1.00 0.00 H new ATOM 0 HB2 PRO A 68 6.016 -18.468 3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 68 5.569 -17.677 5.040 1.00 0.00 H new ATOM 0 HG2 PRO A 68 4.277 -20.037 3.686 1.00 0.00 H new ATOM 0 HG3 PRO A 68 4.628 -19.801 5.386 1.00 0.00 H new ATOM 0 HD2 PRO A 68 2.129 -19.413 4.378 1.00 0.00 H new ATOM 0 HD3 PRO A 68 2.725 -18.478 5.735 1.00 0.00 H new ATOM 997 N SER A 69 5.026 -16.446 1.183 1.00 0.00 N ATOM 998 CA SER A 69 5.227 -16.539 -0.258 1.00 0.00 C ATOM 999 C SER A 69 3.897 -16.445 -1.000 1.00 0.00 C ATOM 1000 O SER A 69 3.728 -17.026 -2.070 1.00 0.00 O ATOM 1001 CB SER A 69 5.929 -17.852 -0.612 1.00 0.00 C ATOM 1002 OG SER A 69 6.980 -18.129 0.297 1.00 0.00 O ATOM 0 H SER A 69 5.391 -15.592 1.605 1.00 0.00 H new ATOM 0 HA SER A 69 5.855 -15.703 -0.567 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.208 -18.669 -0.599 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.326 -17.794 -1.625 1.00 0.00 H new ATOM 0 HG SER A 69 7.412 -18.974 0.051 1.00 0.00 H new ATOM 1008 N GLY A 70 2.955 -15.707 -0.420 1.00 0.00 N ATOM 1009 CA GLY A 70 1.651 -15.549 -1.039 1.00 0.00 C ATOM 1010 C GLY A 70 1.205 -14.101 -1.089 1.00 0.00 C ATOM 1011 O GLY A 70 2.005 -13.189 -0.876 1.00 0.00 O ATOM 0 H GLY A 70 3.071 -15.216 0.467 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.682 -15.952 -2.051 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.916 -16.133 -0.485 1.00 0.00 H new ATOM 1015 N VAL A 71 -0.076 -13.888 -1.373 1.00 0.00 N ATOM 1016 CA VAL A 71 -0.627 -12.540 -1.452 1.00 0.00 C ATOM 1017 C VAL A 71 -1.995 -12.466 -0.781 1.00 0.00 C ATOM 1018 O VAL A 71 -2.663 -13.484 -0.599 1.00 0.00 O ATOM 1019 CB VAL A 71 -0.758 -12.071 -2.913 1.00 0.00 C ATOM 1020 CG1 VAL A 71 0.610 -11.753 -3.496 1.00 0.00 C ATOM 1021 CG2 VAL A 71 -1.471 -13.124 -3.748 1.00 0.00 C ATOM 0 H VAL A 71 -0.751 -14.631 -1.552 1.00 0.00 H new ATOM 0 HA VAL A 71 0.068 -11.883 -0.929 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.355 -11.159 -2.932 1.00 0.00 H new ATOM 0 HG11 VAL A 71 0.498 -11.423 -4.529 1.00 0.00 H new ATOM 0 HG12 VAL A 71 1.080 -10.962 -2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 71 1.235 -12.646 -3.466 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -1.555 -12.776 -4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -0.902 -14.054 -3.724 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.467 -13.298 -3.341 1.00 0.00 H new ATOM 1031 N GLN A 72 -2.404 -11.255 -0.417 1.00 0.00 N ATOM 1032 CA GLN A 72 -3.693 -11.049 0.233 1.00 0.00 C ATOM 1033 C GLN A 72 -4.371 -9.787 -0.289 1.00 0.00 C ATOM 1034 O GLN A 72 -3.866 -8.679 -0.109 1.00 0.00 O ATOM 1035 CB GLN A 72 -3.513 -10.955 1.750 1.00 0.00 C ATOM 1036 CG GLN A 72 -4.771 -10.523 2.486 1.00 0.00 C ATOM 1037 CD GLN A 72 -5.973 -11.379 2.139 1.00 0.00 C ATOM 1038 OE1 GLN A 72 -5.917 -12.607 2.213 1.00 0.00 O ATOM 1039 NE2 GLN A 72 -7.070 -10.734 1.759 1.00 0.00 N ATOM 0 H GLN A 72 -1.862 -10.403 -0.561 1.00 0.00 H new ATOM 0 HA GLN A 72 -4.329 -11.903 0.001 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.195 -11.925 2.131 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.713 -10.248 1.970 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.593 -10.571 3.560 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -4.989 -9.483 2.245 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -7.072 -9.715 1.712 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -7.911 -11.258 1.514 1.00 0.00 H new ATOM 1048 N ALA A 73 -5.517 -9.962 -0.938 1.00 0.00 N ATOM 1049 CA ALA A 73 -6.265 -8.837 -1.486 1.00 0.00 C ATOM 1050 C ALA A 73 -6.855 -7.977 -0.374 1.00 0.00 C ATOM 1051 O ALA A 73 -7.608 -8.466 0.469 1.00 0.00 O ATOM 1052 CB ALA A 73 -7.366 -9.335 -2.410 1.00 0.00 C ATOM 0 H ALA A 73 -5.948 -10.873 -1.097 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.575 -8.219 -2.061 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.916 -8.484 -2.812 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.924 -9.902 -3.230 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.047 -9.977 -1.851 1.00 0.00 H new ATOM 1058 N ILE A 74 -6.507 -6.694 -0.376 1.00 0.00 N ATOM 1059 CA ILE A 74 -7.002 -5.767 0.633 1.00 0.00 C ATOM 1060 C ILE A 74 -8.102 -4.875 0.066 1.00 0.00 C ATOM 1061 O ILE A 74 -7.873 -4.109 -0.869 1.00 0.00 O ATOM 1062 CB ILE A 74 -5.872 -4.879 1.185 1.00 0.00 C ATOM 1063 CG1 ILE A 74 -4.732 -5.745 1.725 1.00 0.00 C ATOM 1064 CG2 ILE A 74 -6.405 -3.958 2.272 1.00 0.00 C ATOM 1065 CD1 ILE A 74 -4.991 -6.289 3.113 1.00 0.00 C ATOM 0 H ILE A 74 -5.884 -6.274 -1.066 1.00 0.00 H new ATOM 0 HA ILE A 74 -7.408 -6.371 1.445 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.484 -4.264 0.373 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -4.565 -6.578 1.042 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.815 -5.156 1.740 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.594 -3.337 2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.187 -3.321 1.858 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.816 -4.555 3.086 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -4.141 -6.893 3.431 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -5.128 -5.461 3.808 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -5.890 -6.905 3.100 1.00 0.00 H new ATOM 1077 N GLN A 75 -9.296 -4.980 0.641 1.00 0.00 N ATOM 1078 CA GLN A 75 -10.432 -4.182 0.194 1.00 0.00 C ATOM 1079 C GLN A 75 -10.373 -2.775 0.781 1.00 0.00 C ATOM 1080 O GLN A 75 -10.377 -2.600 2.000 1.00 0.00 O ATOM 1081 CB GLN A 75 -11.745 -4.858 0.591 1.00 0.00 C ATOM 1082 CG GLN A 75 -12.225 -5.891 -0.416 1.00 0.00 C ATOM 1083 CD GLN A 75 -11.130 -6.852 -0.834 1.00 0.00 C ATOM 1084 OE1 GLN A 75 -10.801 -7.791 -0.109 1.00 0.00 O ATOM 1085 NE2 GLN A 75 -10.558 -6.622 -2.010 1.00 0.00 N ATOM 0 H GLN A 75 -9.502 -5.609 1.417 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.385 -4.105 -0.892 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.618 -5.339 1.561 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.515 -4.096 0.712 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -13.053 -6.455 0.014 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -12.611 -5.381 -1.298 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.862 -5.832 -2.579 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -9.815 -7.236 -2.344 1.00 0.00 H new ATOM 1094 N ILE A 76 -10.319 -1.777 -0.094 1.00 0.00 N ATOM 1095 CA ILE A 76 -10.260 -0.386 0.339 1.00 0.00 C ATOM 1096 C ILE A 76 -11.463 0.400 -0.173 1.00 0.00 C ATOM 1097 O ILE A 76 -11.781 0.365 -1.362 1.00 0.00 O ATOM 1098 CB ILE A 76 -8.970 0.300 -0.146 1.00 0.00 C ATOM 1099 CG1 ILE A 76 -7.742 -0.410 0.427 1.00 0.00 C ATOM 1100 CG2 ILE A 76 -8.970 1.770 0.249 1.00 0.00 C ATOM 1101 CD1 ILE A 76 -6.453 -0.055 -0.280 1.00 0.00 C ATOM 0 H ILE A 76 -10.315 -1.905 -1.106 1.00 0.00 H new ATOM 0 HA ILE A 76 -10.270 -0.394 1.429 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.930 0.236 -1.233 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -7.648 -0.160 1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -7.895 -1.488 0.367 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.051 2.241 -0.101 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -9.828 2.268 -0.203 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -9.031 1.855 1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.625 -0.595 0.180 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.527 -0.331 -1.332 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.276 1.017 -0.198 1.00 0.00 H new ATOM 1113 N SER A 77 -12.128 1.109 0.734 1.00 0.00 N ATOM 1114 CA SER A 77 -13.298 1.903 0.375 1.00 0.00 C ATOM 1115 C SER A 77 -13.192 3.314 0.944 1.00 0.00 C ATOM 1116 O SER A 77 -12.934 3.499 2.134 1.00 0.00 O ATOM 1117 CB SER A 77 -14.573 1.229 0.885 1.00 0.00 C ATOM 1118 OG SER A 77 -15.700 1.625 0.122 1.00 0.00 O ATOM 0 H SER A 77 -11.877 1.150 1.722 1.00 0.00 H new ATOM 0 HA SER A 77 -13.341 1.971 -0.712 1.00 0.00 H new ATOM 0 HB2 SER A 77 -14.460 0.146 0.837 1.00 0.00 H new ATOM 0 HB3 SER A 77 -14.730 1.487 1.932 1.00 0.00 H new ATOM 0 HG SER A 77 -16.502 1.179 0.467 1.00 0.00 H new ATOM 1124 N PHE A 78 -13.393 4.308 0.086 1.00 0.00 N ATOM 1125 CA PHE A 78 -13.320 5.704 0.501 1.00 0.00 C ATOM 1126 C PHE A 78 -14.522 6.489 -0.015 1.00 0.00 C ATOM 1127 O PHE A 78 -14.985 6.272 -1.134 1.00 0.00 O ATOM 1128 CB PHE A 78 -12.025 6.342 -0.006 1.00 0.00 C ATOM 1129 CG PHE A 78 -11.994 7.836 0.142 1.00 0.00 C ATOM 1130 CD1 PHE A 78 -12.041 8.423 1.396 1.00 0.00 C ATOM 1131 CD2 PHE A 78 -11.920 8.654 -0.974 1.00 0.00 C ATOM 1132 CE1 PHE A 78 -12.013 9.798 1.535 1.00 0.00 C ATOM 1133 CE2 PHE A 78 -11.891 10.030 -0.841 1.00 0.00 C ATOM 1134 CZ PHE A 78 -11.939 10.602 0.415 1.00 0.00 C ATOM 0 H PHE A 78 -13.608 4.173 -0.902 1.00 0.00 H new ATOM 0 HA PHE A 78 -13.330 5.733 1.591 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -11.182 5.914 0.536 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -11.891 6.086 -1.057 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -12.100 7.799 2.275 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -11.885 8.212 -1.959 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -12.049 10.243 2.518 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -11.831 10.657 -1.718 1.00 0.00 H new ATOM 0 HZ PHE A 78 -11.919 11.677 0.521 1.00 0.00 H new ATOM 1144 N SER A 79 -15.023 7.403 0.810 1.00 0.00 N ATOM 1145 CA SER A 79 -16.174 8.218 0.440 1.00 0.00 C ATOM 1146 C SER A 79 -16.268 9.459 1.323 1.00 0.00 C ATOM 1147 O SER A 79 -16.453 9.358 2.536 1.00 0.00 O ATOM 1148 CB SER A 79 -17.462 7.400 0.552 1.00 0.00 C ATOM 1149 OG SER A 79 -17.797 7.158 1.908 1.00 0.00 O ATOM 0 H SER A 79 -14.650 7.598 1.739 1.00 0.00 H new ATOM 0 HA SER A 79 -16.044 8.538 -0.594 1.00 0.00 H new ATOM 0 HB2 SER A 79 -18.278 7.932 0.062 1.00 0.00 H new ATOM 0 HB3 SER A 79 -17.340 6.451 0.029 1.00 0.00 H new ATOM 0 HG SER A 79 -17.286 7.764 2.484 1.00 0.00 H new ATOM 1155 N SER A 80 -16.139 10.628 0.705 1.00 0.00 N ATOM 1156 CA SER A 80 -16.205 11.889 1.435 1.00 0.00 C ATOM 1157 C SER A 80 -16.831 12.983 0.574 1.00 0.00 C ATOM 1158 O SER A 80 -16.872 12.875 -0.652 1.00 0.00 O ATOM 1159 CB SER A 80 -14.806 12.317 1.884 1.00 0.00 C ATOM 1160 OG SER A 80 -14.867 13.106 3.060 1.00 0.00 O ATOM 0 H SER A 80 -15.988 10.729 -0.299 1.00 0.00 H new ATOM 0 HA SER A 80 -16.831 11.739 2.314 1.00 0.00 H new ATOM 0 HB2 SER A 80 -14.193 11.434 2.066 1.00 0.00 H new ATOM 0 HB3 SER A 80 -14.322 12.882 1.088 1.00 0.00 H new ATOM 0 HG SER A 80 -14.677 12.545 3.841 1.00 0.00 H new ATOM 1166 N ILE A 81 -17.318 14.034 1.225 1.00 0.00 N ATOM 1167 CA ILE A 81 -17.941 15.147 0.521 1.00 0.00 C ATOM 1168 C ILE A 81 -17.178 16.445 0.760 1.00 0.00 C ATOM 1169 O ILE A 81 -17.741 17.536 0.659 1.00 0.00 O ATOM 1170 CB ILE A 81 -19.406 15.338 0.954 1.00 0.00 C ATOM 1171 CG1 ILE A 81 -19.507 15.385 2.480 1.00 0.00 C ATOM 1172 CG2 ILE A 81 -20.274 14.221 0.395 1.00 0.00 C ATOM 1173 CD1 ILE A 81 -19.380 14.029 3.137 1.00 0.00 C ATOM 0 H ILE A 81 -17.293 14.138 2.239 1.00 0.00 H new ATOM 0 HA ILE A 81 -17.914 14.903 -0.541 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.767 16.286 0.555 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -18.728 16.042 2.867 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -20.464 15.827 2.759 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -21.307 14.370 0.710 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -20.222 14.230 -0.694 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -19.916 13.261 0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -19.461 14.140 4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -20.175 13.375 2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.412 13.593 2.888 1.00 0.00 H new ATOM 1185 N ILE A 82 -15.893 16.320 1.076 1.00 0.00 N ATOM 1186 CA ILE A 82 -15.052 17.484 1.326 1.00 0.00 C ATOM 1187 C ILE A 82 -14.167 17.792 0.123 1.00 0.00 C ATOM 1188 O ILE A 82 -13.034 17.316 0.035 1.00 0.00 O ATOM 1189 CB ILE A 82 -14.161 17.279 2.566 1.00 0.00 C ATOM 1190 CG1 ILE A 82 -15.013 16.873 3.771 1.00 0.00 C ATOM 1191 CG2 ILE A 82 -13.375 18.545 2.869 1.00 0.00 C ATOM 1192 CD1 ILE A 82 -14.259 16.052 4.794 1.00 0.00 C ATOM 0 H ILE A 82 -15.412 15.425 1.165 1.00 0.00 H new ATOM 0 HA ILE A 82 -15.722 18.325 1.505 1.00 0.00 H new ATOM 0 HB ILE A 82 -13.453 16.477 2.358 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -15.400 17.772 4.252 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -15.874 16.303 3.422 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.750 18.384 3.748 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -12.744 18.794 2.016 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -14.067 19.365 3.061 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -14.924 15.800 5.620 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -13.895 15.136 4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -13.414 16.628 5.171 1.00 0.00 H new ATOM 1204 N LEU A 83 -14.689 18.592 -0.799 1.00 0.00 N ATOM 1205 CA LEU A 83 -13.946 18.966 -1.998 1.00 0.00 C ATOM 1206 C LEU A 83 -12.541 19.442 -1.641 1.00 0.00 C ATOM 1207 O LEU A 83 -12.272 19.813 -0.499 1.00 0.00 O ATOM 1208 CB LEU A 83 -14.690 20.062 -2.762 1.00 0.00 C ATOM 1209 CG LEU A 83 -16.089 19.701 -3.261 1.00 0.00 C ATOM 1210 CD1 LEU A 83 -16.801 20.936 -3.793 1.00 0.00 C ATOM 1211 CD2 LEU A 83 -16.012 18.624 -4.333 1.00 0.00 C ATOM 0 H LEU A 83 -15.624 18.995 -0.740 1.00 0.00 H new ATOM 0 HA LEU A 83 -13.861 18.084 -2.633 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.771 20.936 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -14.084 20.354 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 83 -16.663 19.309 -2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -17.795 20.660 -4.144 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -16.889 21.676 -2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -16.229 21.358 -4.619 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -17.017 18.380 -4.676 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -15.420 18.988 -5.173 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -15.543 17.731 -3.919 1.00 0.00 H new ATOM 1223 N GLY A 84 -11.649 19.430 -2.626 1.00 0.00 N ATOM 1224 CA GLY A 84 -10.284 19.865 -2.397 1.00 0.00 C ATOM 1225 C GLY A 84 -9.319 18.703 -2.268 1.00 0.00 C ATOM 1226 O GLY A 84 -9.672 17.651 -1.738 1.00 0.00 O ATOM 0 H GLY A 84 -11.847 19.127 -3.579 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.968 20.506 -3.220 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -10.245 20.468 -1.490 1.00 0.00 H new ATOM 1230 N ASN A 85 -8.098 18.893 -2.757 1.00 0.00 N ATOM 1231 CA ASN A 85 -7.080 17.851 -2.697 1.00 0.00 C ATOM 1232 C ASN A 85 -6.850 17.398 -1.258 1.00 0.00 C ATOM 1233 O ASN A 85 -7.050 18.164 -0.315 1.00 0.00 O ATOM 1234 CB ASN A 85 -5.767 18.356 -3.300 1.00 0.00 C ATOM 1235 CG ASN A 85 -5.268 19.618 -2.624 1.00 0.00 C ATOM 1236 OD1 ASN A 85 -5.394 20.717 -3.165 1.00 0.00 O ATOM 1237 ND2 ASN A 85 -4.696 19.466 -1.435 1.00 0.00 N ATOM 0 H ASN A 85 -7.790 19.759 -3.199 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.434 16.998 -3.276 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -5.009 17.578 -3.216 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -5.909 18.549 -4.363 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -4.340 20.279 -0.933 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.613 18.536 -1.024 1.00 0.00 H new ATOM 1244 N PHE A 86 -6.428 16.148 -1.097 1.00 0.00 N ATOM 1245 CA PHE A 86 -6.171 15.592 0.226 1.00 0.00 C ATOM 1246 C PHE A 86 -5.119 14.489 0.158 1.00 0.00 C ATOM 1247 O PHE A 86 -5.137 13.656 -0.748 1.00 0.00 O ATOM 1248 CB PHE A 86 -7.465 15.042 0.831 1.00 0.00 C ATOM 1249 CG PHE A 86 -7.908 13.744 0.219 1.00 0.00 C ATOM 1250 CD1 PHE A 86 -7.177 12.584 0.418 1.00 0.00 C ATOM 1251 CD2 PHE A 86 -9.056 13.684 -0.554 1.00 0.00 C ATOM 1252 CE1 PHE A 86 -7.583 11.388 -0.145 1.00 0.00 C ATOM 1253 CE2 PHE A 86 -9.467 12.491 -1.119 1.00 0.00 C ATOM 1254 CZ PHE A 86 -8.729 11.341 -0.913 1.00 0.00 C ATOM 0 H PHE A 86 -6.257 15.501 -1.867 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.792 16.392 0.862 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -7.324 14.900 1.902 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -8.257 15.781 0.709 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -6.280 12.614 1.019 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -9.637 14.580 -0.717 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -7.004 10.491 0.016 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.363 12.458 -1.720 1.00 0.00 H new ATOM 0 HZ PHE A 86 -9.048 10.407 -1.352 1.00 0.00 H new ATOM 1264 N GLU A 87 -4.204 14.492 1.122 1.00 0.00 N ATOM 1265 CA GLU A 87 -3.143 13.492 1.170 1.00 0.00 C ATOM 1266 C GLU A 87 -3.089 12.822 2.540 1.00 0.00 C ATOM 1267 O GLU A 87 -2.857 13.478 3.554 1.00 0.00 O ATOM 1268 CB GLU A 87 -1.792 14.135 0.851 1.00 0.00 C ATOM 1269 CG GLU A 87 -0.685 13.128 0.591 1.00 0.00 C ATOM 1270 CD GLU A 87 0.474 13.722 -0.185 1.00 0.00 C ATOM 1271 OE1 GLU A 87 0.331 13.913 -1.411 1.00 0.00 O ATOM 1272 OE2 GLU A 87 1.525 13.995 0.432 1.00 0.00 O ATOM 0 H GLU A 87 -4.176 15.175 1.879 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.361 12.731 0.421 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.902 14.776 -0.024 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.500 14.777 1.682 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.320 12.741 1.543 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.092 12.281 0.038 1.00 0.00 H new ATOM 1279 N GLU A 88 -3.306 11.510 2.559 1.00 0.00 N ATOM 1280 CA GLU A 88 -3.284 10.751 3.804 1.00 0.00 C ATOM 1281 C GLU A 88 -2.514 9.445 3.631 1.00 0.00 C ATOM 1282 O GLU A 88 -2.521 8.847 2.555 1.00 0.00 O ATOM 1283 CB GLU A 88 -4.710 10.458 4.274 1.00 0.00 C ATOM 1284 CG GLU A 88 -5.573 11.700 4.414 1.00 0.00 C ATOM 1285 CD GLU A 88 -5.117 12.602 5.544 1.00 0.00 C ATOM 1286 OE1 GLU A 88 -4.931 12.094 6.670 1.00 0.00 O ATOM 1287 OE2 GLU A 88 -4.947 13.816 5.304 1.00 0.00 O ATOM 0 H GLU A 88 -3.499 10.952 1.727 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.778 11.353 4.558 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.183 9.775 3.568 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.668 9.945 5.235 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.554 12.258 3.478 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.607 11.402 4.587 1.00 0.00 H new ATOM 1294 N GLU A 89 -1.852 9.009 4.698 1.00 0.00 N ATOM 1295 CA GLU A 89 -1.076 7.775 4.663 1.00 0.00 C ATOM 1296 C GLU A 89 -1.537 6.812 5.754 1.00 0.00 C ATOM 1297 O GLU A 89 -1.916 7.231 6.848 1.00 0.00 O ATOM 1298 CB GLU A 89 0.414 8.078 4.832 1.00 0.00 C ATOM 1299 CG GLU A 89 0.916 9.186 3.923 1.00 0.00 C ATOM 1300 CD GLU A 89 2.135 9.893 4.483 1.00 0.00 C ATOM 1301 OE1 GLU A 89 1.963 10.779 5.346 1.00 0.00 O ATOM 1302 OE2 GLU A 89 3.262 9.561 4.058 1.00 0.00 O ATOM 0 H GLU A 89 -1.837 9.491 5.597 1.00 0.00 H new ATOM 0 HA GLU A 89 -1.236 7.303 3.694 1.00 0.00 H new ATOM 0 HB2 GLU A 89 0.604 8.356 5.869 1.00 0.00 H new ATOM 0 HB3 GLU A 89 0.985 7.171 4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 89 1.160 8.767 2.947 1.00 0.00 H new ATOM 0 HG3 GLU A 89 0.119 9.913 3.768 1.00 0.00 H new ATOM 1309 N PHE A 90 -1.504 5.519 5.446 1.00 0.00 N ATOM 1310 CA PHE A 90 -1.919 4.496 6.399 1.00 0.00 C ATOM 1311 C PHE A 90 -0.754 3.578 6.753 1.00 0.00 C ATOM 1312 O PHE A 90 0.155 3.369 5.948 1.00 0.00 O ATOM 1313 CB PHE A 90 -3.075 3.674 5.824 1.00 0.00 C ATOM 1314 CG PHE A 90 -4.245 4.508 5.387 1.00 0.00 C ATOM 1315 CD1 PHE A 90 -4.166 5.295 4.250 1.00 0.00 C ATOM 1316 CD2 PHE A 90 -5.424 4.505 6.115 1.00 0.00 C ATOM 1317 CE1 PHE A 90 -5.241 6.063 3.845 1.00 0.00 C ATOM 1318 CE2 PHE A 90 -6.503 5.270 5.714 1.00 0.00 C ATOM 1319 CZ PHE A 90 -6.411 6.052 4.579 1.00 0.00 C ATOM 0 H PHE A 90 -1.194 5.155 4.545 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.254 4.995 7.308 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.712 3.097 4.973 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.410 2.958 6.575 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.253 5.309 3.673 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.501 3.898 7.005 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.166 6.671 2.956 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.418 5.256 6.288 1.00 0.00 H new ATOM 0 HZ PHE A 90 -7.252 6.653 4.266 1.00 0.00 H new ATOM 1329 N LEU A 91 -0.786 3.032 7.964 1.00 0.00 N ATOM 1330 CA LEU A 91 0.268 2.136 8.427 1.00 0.00 C ATOM 1331 C LEU A 91 -0.304 0.773 8.807 1.00 0.00 C ATOM 1332 O LEU A 91 -1.474 0.660 9.174 1.00 0.00 O ATOM 1333 CB LEU A 91 0.995 2.748 9.625 1.00 0.00 C ATOM 1334 CG LEU A 91 1.780 4.032 9.350 1.00 0.00 C ATOM 1335 CD1 LEU A 91 2.572 4.447 10.579 1.00 0.00 C ATOM 1336 CD2 LEU A 91 2.704 3.846 8.155 1.00 0.00 C ATOM 0 H LEU A 91 -1.530 3.194 8.643 1.00 0.00 H new ATOM 0 HA LEU A 91 0.977 1.998 7.611 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.261 2.955 10.403 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.683 2.004 10.026 1.00 0.00 H new ATOM 0 HG LEU A 91 1.071 4.826 9.116 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.124 5.362 10.364 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.889 4.622 11.410 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.272 3.655 10.845 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.255 4.769 7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.407 3.039 8.361 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.113 3.597 7.274 1.00 0.00 H new ATOM 1348 N VAL A 92 0.530 -0.258 8.719 1.00 0.00 N ATOM 1349 CA VAL A 92 0.109 -1.612 9.057 1.00 0.00 C ATOM 1350 C VAL A 92 0.937 -2.175 10.206 1.00 0.00 C ATOM 1351 O VAL A 92 2.113 -2.495 10.039 1.00 0.00 O ATOM 1352 CB VAL A 92 0.226 -2.555 7.845 1.00 0.00 C ATOM 1353 CG1 VAL A 92 -0.271 -3.948 8.201 1.00 0.00 C ATOM 1354 CG2 VAL A 92 -0.543 -1.994 6.658 1.00 0.00 C ATOM 0 H VAL A 92 1.501 -0.181 8.417 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.936 -1.551 9.362 1.00 0.00 H new ATOM 0 HB VAL A 92 1.277 -2.631 7.566 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.180 -4.600 7.332 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.327 -4.349 9.020 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.316 -3.894 8.507 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.450 -2.673 5.810 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.595 -1.887 6.923 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.136 -1.019 6.389 1.00 0.00 H new ATOM 1364 N ASN A 93 0.314 -2.294 11.375 1.00 0.00 N ATOM 1365 CA ASN A 93 0.995 -2.818 12.553 1.00 0.00 C ATOM 1366 C ASN A 93 1.112 -4.338 12.482 1.00 0.00 C ATOM 1367 O ASN A 93 0.140 -5.058 12.709 1.00 0.00 O ATOM 1368 CB ASN A 93 0.244 -2.413 13.824 1.00 0.00 C ATOM 1369 CG ASN A 93 -1.135 -3.038 13.905 1.00 0.00 C ATOM 1370 OD1 ASN A 93 -1.331 -4.051 14.577 1.00 0.00 O ATOM 1371 ND2 ASN A 93 -2.099 -2.436 13.219 1.00 0.00 N ATOM 0 H ASN A 93 -0.660 -2.035 11.531 1.00 0.00 H new ATOM 0 HA ASN A 93 1.999 -2.394 12.581 1.00 0.00 H new ATOM 0 HB2 ASN A 93 0.826 -2.709 14.697 1.00 0.00 H new ATOM 0 HB3 ASN A 93 0.150 -1.328 13.857 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -3.047 -2.811 13.236 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -1.891 -1.598 12.675 1.00 0.00 H new ATOM 1378 N VAL A 94 2.310 -4.819 12.166 1.00 0.00 N ATOM 1379 CA VAL A 94 2.557 -6.253 12.067 1.00 0.00 C ATOM 1380 C VAL A 94 3.124 -6.804 13.370 1.00 0.00 C ATOM 1381 O VAL A 94 3.973 -6.178 14.004 1.00 0.00 O ATOM 1382 CB VAL A 94 3.530 -6.577 10.918 1.00 0.00 C ATOM 1383 CG1 VAL A 94 3.747 -8.078 10.810 1.00 0.00 C ATOM 1384 CG2 VAL A 94 3.012 -6.008 9.606 1.00 0.00 C ATOM 0 H VAL A 94 3.125 -4.237 11.974 1.00 0.00 H new ATOM 0 HA VAL A 94 1.597 -6.726 11.864 1.00 0.00 H new ATOM 0 HB VAL A 94 4.491 -6.111 11.135 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.437 -8.288 9.993 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.165 -8.453 11.744 1.00 0.00 H new ATOM 0 HG13 VAL A 94 2.794 -8.570 10.616 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.712 -6.246 8.805 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.039 -6.444 9.379 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.914 -4.926 9.692 1.00 0.00 H new ATOM 1394 N ASN A 95 2.650 -7.982 13.764 1.00 0.00 N ATOM 1395 CA ASN A 95 3.110 -8.619 14.993 1.00 0.00 C ATOM 1396 C ASN A 95 4.577 -9.025 14.879 1.00 0.00 C ATOM 1397 O ASN A 95 4.940 -9.850 14.041 1.00 0.00 O ATOM 1398 CB ASN A 95 2.253 -9.846 15.308 1.00 0.00 C ATOM 1399 CG ASN A 95 2.840 -10.691 16.422 1.00 0.00 C ATOM 1400 OD1 ASN A 95 2.513 -10.506 17.594 1.00 0.00 O ATOM 1401 ND2 ASN A 95 3.712 -11.624 16.060 1.00 0.00 N ATOM 0 H ASN A 95 1.948 -8.514 13.250 1.00 0.00 H new ATOM 0 HA ASN A 95 3.013 -7.898 15.805 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.251 -9.523 15.590 1.00 0.00 H new ATOM 0 HB3 ASN A 95 2.151 -10.455 14.410 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.140 -12.223 16.766 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.954 -11.742 15.076 1.00 0.00 H new ATOM 1408 N GLY A 96 5.415 -8.439 15.728 1.00 0.00 N ATOM 1409 CA GLY A 96 6.832 -8.752 15.706 1.00 0.00 C ATOM 1410 C GLY A 96 7.554 -8.094 14.547 1.00 0.00 C ATOM 1411 O GLY A 96 8.446 -8.690 13.944 1.00 0.00 O ATOM 0 H GLY A 96 5.138 -7.753 16.431 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.286 -8.430 16.643 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.961 -9.833 15.644 1.00 0.00 H new ATOM 1415 N SER A 97 7.167 -6.862 14.235 1.00 0.00 N ATOM 1416 CA SER A 97 7.780 -6.124 13.136 1.00 0.00 C ATOM 1417 C SER A 97 8.364 -4.803 13.628 1.00 0.00 C ATOM 1418 O SER A 97 7.796 -4.124 14.484 1.00 0.00 O ATOM 1419 CB SER A 97 6.752 -5.861 12.034 1.00 0.00 C ATOM 1420 OG SER A 97 7.350 -5.218 10.922 1.00 0.00 O ATOM 0 H SER A 97 6.432 -6.353 14.727 1.00 0.00 H new ATOM 0 HA SER A 97 8.590 -6.731 12.730 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.306 -6.803 11.716 1.00 0.00 H new ATOM 0 HB3 SER A 97 5.945 -5.242 12.425 1.00 0.00 H new ATOM 0 HG SER A 97 7.029 -4.294 10.867 1.00 0.00 H new ATOM 1426 N PRO A 98 9.528 -4.429 13.075 1.00 0.00 N ATOM 1427 CA PRO A 98 10.215 -3.187 13.442 1.00 0.00 C ATOM 1428 C PRO A 98 9.473 -1.948 12.954 1.00 0.00 C ATOM 1429 O PRO A 98 9.289 -0.989 13.702 1.00 0.00 O ATOM 1430 CB PRO A 98 11.569 -3.311 12.738 1.00 0.00 C ATOM 1431 CG PRO A 98 11.317 -4.223 11.588 1.00 0.00 C ATOM 1432 CD PRO A 98 10.262 -5.190 12.050 1.00 0.00 C ATOM 0 HA PRO A 98 10.290 -3.066 14.523 1.00 0.00 H new ATOM 0 HB2 PRO A 98 11.930 -2.339 12.401 1.00 0.00 H new ATOM 0 HB3 PRO A 98 12.327 -3.718 13.407 1.00 0.00 H new ATOM 0 HG2 PRO A 98 10.980 -3.665 10.714 1.00 0.00 H new ATOM 0 HG3 PRO A 98 12.228 -4.748 11.299 1.00 0.00 H new ATOM 0 HD2 PRO A 98 9.610 -5.494 11.232 1.00 0.00 H new ATOM 0 HD3 PRO A 98 10.702 -6.098 12.462 1.00 0.00 H new ATOM 1440 N GLU A 99 9.048 -1.976 11.694 1.00 0.00 N ATOM 1441 CA GLU A 99 8.326 -0.853 11.107 1.00 0.00 C ATOM 1442 C GLU A 99 7.135 -1.341 10.288 1.00 0.00 C ATOM 1443 O GLU A 99 7.215 -2.327 9.555 1.00 0.00 O ATOM 1444 CB GLU A 99 9.260 -0.022 10.225 1.00 0.00 C ATOM 1445 CG GLU A 99 8.533 0.798 9.172 1.00 0.00 C ATOM 1446 CD GLU A 99 9.478 1.431 8.170 1.00 0.00 C ATOM 1447 OE1 GLU A 99 10.589 1.835 8.575 1.00 0.00 O ATOM 1448 OE2 GLU A 99 9.107 1.523 6.982 1.00 0.00 O ATOM 0 H GLU A 99 9.191 -2.763 11.061 1.00 0.00 H new ATOM 0 HA GLU A 99 7.955 -0.228 11.919 1.00 0.00 H new ATOM 0 HB2 GLU A 99 9.842 0.648 10.857 1.00 0.00 H new ATOM 0 HB3 GLU A 99 9.967 -0.688 9.731 1.00 0.00 H new ATOM 0 HG2 GLU A 99 7.825 0.159 8.644 1.00 0.00 H new ATOM 0 HG3 GLU A 99 7.953 1.580 9.662 1.00 0.00 H new ATOM 1455 N PRO A 100 6.001 -0.636 10.415 1.00 0.00 N ATOM 1456 CA PRO A 100 4.771 -0.978 9.694 1.00 0.00 C ATOM 1457 C PRO A 100 4.884 -0.714 8.197 1.00 0.00 C ATOM 1458 O PRO A 100 5.849 -0.106 7.734 1.00 0.00 O ATOM 1459 CB PRO A 100 3.724 -0.055 10.323 1.00 0.00 C ATOM 1460 CG PRO A 100 4.502 1.104 10.841 1.00 0.00 C ATOM 1461 CD PRO A 100 5.833 0.551 11.270 1.00 0.00 C ATOM 0 HA PRO A 100 4.530 -2.038 9.777 1.00 0.00 H new ATOM 0 HB2 PRO A 100 2.984 0.262 9.589 1.00 0.00 H new ATOM 0 HB3 PRO A 100 3.183 -0.558 11.124 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.626 1.866 10.072 1.00 0.00 H new ATOM 0 HG3 PRO A 100 3.988 1.577 11.678 1.00 0.00 H new ATOM 0 HD2 PRO A 100 6.636 1.273 11.118 1.00 0.00 H new ATOM 0 HD3 PRO A 100 5.837 0.288 12.328 1.00 0.00 H new ATOM 1469 N VAL A 101 3.890 -1.173 7.443 1.00 0.00 N ATOM 1470 CA VAL A 101 3.877 -0.985 5.997 1.00 0.00 C ATOM 1471 C VAL A 101 3.221 0.339 5.621 1.00 0.00 C ATOM 1472 O VAL A 101 1.995 0.450 5.590 1.00 0.00 O ATOM 1473 CB VAL A 101 3.135 -2.133 5.288 1.00 0.00 C ATOM 1474 CG1 VAL A 101 3.172 -1.942 3.779 1.00 0.00 C ATOM 1475 CG2 VAL A 101 3.734 -3.476 5.679 1.00 0.00 C ATOM 0 H VAL A 101 3.083 -1.678 7.810 1.00 0.00 H new ATOM 0 HA VAL A 101 4.917 -0.978 5.669 1.00 0.00 H new ATOM 0 HB VAL A 101 2.092 -2.120 5.606 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.643 -2.763 3.295 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.692 -0.998 3.520 1.00 0.00 H new ATOM 0 HG13 VAL A 101 4.208 -1.928 3.439 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.198 -4.276 5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.785 -3.503 5.392 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.649 -3.612 6.757 1.00 0.00 H new ATOM 1485 N LYS A 102 4.044 1.341 5.336 1.00 0.00 N ATOM 1486 CA LYS A 102 3.546 2.659 4.959 1.00 0.00 C ATOM 1487 C LYS A 102 2.773 2.593 3.645 1.00 0.00 C ATOM 1488 O LYS A 102 3.182 1.908 2.707 1.00 0.00 O ATOM 1489 CB LYS A 102 4.705 3.649 4.833 1.00 0.00 C ATOM 1490 CG LYS A 102 4.281 5.023 4.343 1.00 0.00 C ATOM 1491 CD LYS A 102 3.905 5.935 5.499 1.00 0.00 C ATOM 1492 CE LYS A 102 5.108 6.717 6.006 1.00 0.00 C ATOM 1493 NZ LYS A 102 5.729 7.538 4.930 1.00 0.00 N ATOM 0 H LYS A 102 5.061 1.266 5.359 1.00 0.00 H new ATOM 0 HA LYS A 102 2.869 3.001 5.742 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.191 3.752 5.803 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.447 3.241 4.147 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.093 5.473 3.772 1.00 0.00 H new ATOM 0 HG3 LYS A 102 3.433 4.923 3.666 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.128 6.629 5.179 1.00 0.00 H new ATOM 0 HD3 LYS A 102 3.487 5.341 6.312 1.00 0.00 H new ATOM 0 HE2 LYS A 102 4.800 7.366 6.826 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.848 6.025 6.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.162 8.387 5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.460 6.979 4.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.000 7.822 4.245 1.00 0.00 H new ATOM 1507 N LEU A 103 1.657 3.311 3.584 1.00 0.00 N ATOM 1508 CA LEU A 103 0.828 3.335 2.384 1.00 0.00 C ATOM 1509 C LEU A 103 0.258 4.730 2.145 1.00 0.00 C ATOM 1510 O LEU A 103 -0.662 5.164 2.839 1.00 0.00 O ATOM 1511 CB LEU A 103 -0.309 2.320 2.505 1.00 0.00 C ATOM 1512 CG LEU A 103 -1.206 2.167 1.276 1.00 0.00 C ATOM 1513 CD1 LEU A 103 -0.379 1.794 0.055 1.00 0.00 C ATOM 1514 CD2 LEU A 103 -2.286 1.125 1.530 1.00 0.00 C ATOM 0 H LEU A 103 1.305 3.884 4.351 1.00 0.00 H new ATOM 0 HA LEU A 103 1.455 3.068 1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.123 1.347 2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.933 2.603 3.353 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.691 3.124 1.082 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.034 1.689 -0.810 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.356 2.575 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.134 0.850 0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.915 1.029 0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.820 0.164 1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.897 1.434 2.378 1.00 0.00 H new ATOM 1526 N THR A 104 0.808 5.427 1.156 1.00 0.00 N ATOM 1527 CA THR A 104 0.353 6.772 0.824 1.00 0.00 C ATOM 1528 C THR A 104 -0.711 6.739 -0.266 1.00 0.00 C ATOM 1529 O THR A 104 -0.612 5.966 -1.220 1.00 0.00 O ATOM 1530 CB THR A 104 1.522 7.661 0.358 1.00 0.00 C ATOM 1531 OG1 THR A 104 2.594 7.596 1.305 1.00 0.00 O ATOM 1532 CG2 THR A 104 1.071 9.104 0.192 1.00 0.00 C ATOM 0 H THR A 104 1.569 5.083 0.571 1.00 0.00 H new ATOM 0 HA THR A 104 -0.075 7.194 1.733 1.00 0.00 H new ATOM 0 HB THR A 104 1.868 7.292 -0.608 1.00 0.00 H new ATOM 0 HG1 THR A 104 3.334 8.162 1.001 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.913 9.713 -0.138 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.275 9.153 -0.551 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.701 9.482 1.145 1.00 0.00 H new ATOM 1540 N ILE A 105 -1.728 7.581 -0.119 1.00 0.00 N ATOM 1541 CA ILE A 105 -2.811 7.648 -1.093 1.00 0.00 C ATOM 1542 C ILE A 105 -3.124 9.093 -1.468 1.00 0.00 C ATOM 1543 O ILE A 105 -3.554 9.884 -0.627 1.00 0.00 O ATOM 1544 CB ILE A 105 -4.091 6.979 -0.560 1.00 0.00 C ATOM 1545 CG1 ILE A 105 -3.883 5.470 -0.419 1.00 0.00 C ATOM 1546 CG2 ILE A 105 -5.266 7.273 -1.481 1.00 0.00 C ATOM 1547 CD1 ILE A 105 -4.996 4.774 0.333 1.00 0.00 C ATOM 0 H ILE A 105 -1.825 8.226 0.665 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.472 7.110 -1.978 1.00 0.00 H new ATOM 0 HB ILE A 105 -4.315 7.390 0.425 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -3.795 5.029 -1.412 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.939 5.288 0.095 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -6.163 6.793 -1.090 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -5.425 8.350 -1.536 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -5.053 6.887 -2.478 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -4.782 3.707 0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -5.070 5.188 1.339 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -5.939 4.925 -0.192 1.00 0.00 H new ATOM 1559 N ARG A 106 -2.907 9.431 -2.735 1.00 0.00 N ATOM 1560 CA ARG A 106 -3.167 10.780 -3.221 1.00 0.00 C ATOM 1561 C ARG A 106 -4.417 10.812 -4.096 1.00 0.00 C ATOM 1562 O ARG A 106 -4.610 9.949 -4.951 1.00 0.00 O ATOM 1563 CB ARG A 106 -1.965 11.301 -4.011 1.00 0.00 C ATOM 1564 CG ARG A 106 -1.863 10.725 -5.414 1.00 0.00 C ATOM 1565 CD ARG A 106 -0.569 11.141 -6.095 1.00 0.00 C ATOM 1566 NE ARG A 106 -0.448 12.593 -6.200 1.00 0.00 N ATOM 1567 CZ ARG A 106 -1.063 13.317 -7.128 1.00 0.00 C ATOM 1568 NH1 ARG A 106 -1.838 12.727 -8.028 1.00 0.00 N ATOM 1569 NH2 ARG A 106 -0.903 14.634 -7.159 1.00 0.00 N ATOM 0 H ARG A 106 -2.552 8.789 -3.443 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.333 11.424 -2.357 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.027 12.387 -4.077 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.052 11.067 -3.464 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.917 9.637 -5.367 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.713 11.061 -6.009 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.279 10.746 -5.535 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.526 10.701 -7.091 1.00 0.00 H new ATOM 0 HE ARG A 106 0.141 13.078 -5.523 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.963 11.715 -8.008 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -2.309 13.285 -8.740 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -0.307 15.092 -6.469 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -1.376 15.189 -7.872 1.00 0.00 H new ATOM 1583 N GLY A 107 -5.263 11.814 -3.874 1.00 0.00 N ATOM 1584 CA GLY A 107 -6.483 11.939 -4.649 1.00 0.00 C ATOM 1585 C GLY A 107 -7.051 13.344 -4.615 1.00 0.00 C ATOM 1586 O GLY A 107 -6.506 14.224 -3.948 1.00 0.00 O ATOM 0 H GLY A 107 -5.125 12.541 -3.172 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.284 11.656 -5.683 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.227 11.241 -4.265 1.00 0.00 H new ATOM 1590 N CYS A 108 -8.146 13.555 -5.335 1.00 0.00 N ATOM 1591 CA CYS A 108 -8.787 14.865 -5.387 1.00 0.00 C ATOM 1592 C CYS A 108 -10.304 14.726 -5.462 1.00 0.00 C ATOM 1593 O CYS A 108 -10.832 14.032 -6.331 1.00 0.00 O ATOM 1594 CB CYS A 108 -8.275 15.659 -6.589 1.00 0.00 C ATOM 1595 SG CYS A 108 -8.746 17.405 -6.576 1.00 0.00 S ATOM 0 H CYS A 108 -8.609 12.836 -5.891 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.535 15.402 -4.472 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -7.188 15.587 -6.622 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -8.652 15.199 -7.502 1.00 0.00 H new ATOM 0 HG CYS A 108 -8.265 17.992 -7.631 1.00 0.00 H new ATOM 1601 N VAL A 109 -11.000 15.390 -4.544 1.00 0.00 N ATOM 1602 CA VAL A 109 -12.456 15.340 -4.506 1.00 0.00 C ATOM 1603 C VAL A 109 -13.067 16.488 -5.302 1.00 0.00 C ATOM 1604 O VAL A 109 -12.822 17.659 -5.009 1.00 0.00 O ATOM 1605 CB VAL A 109 -12.982 15.396 -3.059 1.00 0.00 C ATOM 1606 CG1 VAL A 109 -14.503 15.387 -3.043 1.00 0.00 C ATOM 1607 CG2 VAL A 109 -12.425 14.238 -2.245 1.00 0.00 C ATOM 0 H VAL A 109 -10.579 15.968 -3.817 1.00 0.00 H new ATOM 0 HA VAL A 109 -12.752 14.392 -4.956 1.00 0.00 H new ATOM 0 HB VAL A 109 -12.643 16.326 -2.603 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -14.856 15.427 -2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -14.878 16.253 -3.589 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -14.866 14.475 -3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.807 14.293 -1.226 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.732 13.295 -2.697 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.337 14.295 -2.228 1.00 0.00 H new ATOM 1617 N ILE A 110 -13.862 16.145 -6.309 1.00 0.00 N ATOM 1618 CA ILE A 110 -14.509 17.147 -7.146 1.00 0.00 C ATOM 1619 C ILE A 110 -16.026 16.993 -7.116 1.00 0.00 C ATOM 1620 O ILE A 110 -16.552 16.043 -6.538 1.00 0.00 O ATOM 1621 CB ILE A 110 -14.024 17.060 -8.606 1.00 0.00 C ATOM 1622 CG1 ILE A 110 -14.290 15.663 -9.171 1.00 0.00 C ATOM 1623 CG2 ILE A 110 -12.544 17.400 -8.693 1.00 0.00 C ATOM 1624 CD1 ILE A 110 -14.171 15.588 -10.677 1.00 0.00 C ATOM 0 H ILE A 110 -14.074 15.181 -6.565 1.00 0.00 H new ATOM 0 HA ILE A 110 -14.237 18.121 -6.739 1.00 0.00 H new ATOM 0 HB ILE A 110 -14.579 17.784 -9.202 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -13.588 14.959 -8.724 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -15.291 15.346 -8.877 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -12.216 17.334 -9.730 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -12.381 18.413 -8.324 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -11.973 16.697 -8.087 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -14.372 14.569 -11.008 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -14.892 16.267 -11.133 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -13.163 15.874 -10.977 1.00 0.00 H new ATOM 1636 N GLY A 111 -16.724 17.934 -7.745 1.00 0.00 N ATOM 1637 CA GLY A 111 -18.174 17.884 -7.780 1.00 0.00 C ATOM 1638 C GLY A 111 -18.738 18.339 -9.111 1.00 0.00 C ATOM 1639 O GLY A 111 -18.033 18.904 -9.948 1.00 0.00 O ATOM 0 H GLY A 111 -16.311 18.730 -8.231 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -18.504 16.865 -7.578 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -18.575 18.512 -6.985 1.00 0.00 H new ATOM 1643 N PRO A 112 -20.039 18.090 -9.323 1.00 0.00 N ATOM 1644 CA PRO A 112 -20.725 18.469 -10.562 1.00 0.00 C ATOM 1645 C PRO A 112 -20.892 19.979 -10.693 1.00 0.00 C ATOM 1646 O PRO A 112 -21.491 20.466 -11.652 1.00 0.00 O ATOM 1647 CB PRO A 112 -22.091 17.790 -10.432 1.00 0.00 C ATOM 1648 CG PRO A 112 -22.303 17.641 -8.965 1.00 0.00 C ATOM 1649 CD PRO A 112 -20.939 17.420 -8.370 1.00 0.00 C ATOM 0 HA PRO A 112 -20.165 18.167 -11.447 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -22.877 18.393 -10.886 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -22.101 16.822 -10.934 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -22.772 18.531 -8.546 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -22.964 16.801 -8.749 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -20.861 17.852 -7.372 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -20.708 16.359 -8.277 1.00 0.00 H new