USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=22 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= 0 X(o=0,f=0.08) USER MOD Set 2.1: A 56 CYS SG : rot 66:sc= 0.669 USER MOD Set 2.2: A 80 SER OG : rot 95:sc= 0.597 USER MOD Set 3.1: A 11 HIS : no HE2:sc= -0.446 K(o=-0.45,f=-2) USER MOD Set 3.2: A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 28 HIS : no HD1:sc= -2.91 K(o=-4,f=-4.7!) USER MOD Set 4.2: A 30 TYR OH : rot 97:sc= -1.09 USER MOD Set 5.1: A 21 LYS NZ :NH3+ -120:sc= -0.275 (180deg=-0.661) USER MOD Set 5.2: A 108 CYS SG : rot 150:sc= -0.131 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= -2! C(o=-2!,f=-7.6!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.342 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 38:sc= 0.323 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -2.05! C(o=-2!,f=-5.2!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.54 K(o=-1.5,f=-3.9!) USER MOD Single : A 46 MET CE :methyl -144:sc= -2.05 (180deg=-6.21!) 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 28:sc= 0.0185 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= 0.0359 X(o=0.036,f=-0.1) USER MOD Single : A 75 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.19) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot -10:sc= 0.559! USER MOD Single : A 85 ASN : amide:sc=-0.00983 K(o=-0.0098,f=-3.1!) USER MOD Single : A 95 ASN : amide:sc=-0.00399 X(o=-0.004,f=-0.35) USER MOD Single : A 97 SER OG : rot -108:sc= 0.0838 USER MOD Single : A 102 LYS NZ :NH3+ -179:sc= 0.046 (180deg=0.0356) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N PRO A 8 9.521 -4.504 6.538 1.00 0.00 N ATOM 67 CA PRO A 8 8.356 -5.389 6.618 1.00 0.00 C ATOM 68 C PRO A 8 8.371 -6.466 5.538 1.00 0.00 C ATOM 69 O PRO A 8 8.608 -6.179 4.364 1.00 0.00 O ATOM 70 CB PRO A 8 7.174 -4.440 6.411 1.00 0.00 C ATOM 71 CG PRO A 8 7.735 -3.299 5.635 1.00 0.00 C ATOM 72 CD PRO A 8 9.159 -3.147 6.095 1.00 0.00 C ATOM 0 HA PRO A 8 8.322 -5.934 7.562 1.00 0.00 H new ATOM 0 HB2 PRO A 8 6.365 -4.928 5.868 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.763 -4.107 7.364 1.00 0.00 H new ATOM 0 HG2 PRO A 8 7.690 -3.495 4.564 1.00 0.00 H new ATOM 0 HG3 PRO A 8 7.167 -2.387 5.816 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.807 -2.801 5.289 1.00 0.00 H new ATOM 0 HD3 PRO A 8 9.244 -2.423 6.906 1.00 0.00 H new ATOM 80 N LYS A 9 8.115 -7.706 5.941 1.00 0.00 N ATOM 81 CA LYS A 9 8.097 -8.826 5.007 1.00 0.00 C ATOM 82 C LYS A 9 6.992 -8.652 3.970 1.00 0.00 C ATOM 83 O LYS A 9 7.090 -9.163 2.854 1.00 0.00 O ATOM 84 CB LYS A 9 7.900 -10.142 5.762 1.00 0.00 C ATOM 85 CG LYS A 9 9.152 -10.630 6.471 1.00 0.00 C ATOM 86 CD LYS A 9 9.488 -9.761 7.671 1.00 0.00 C ATOM 87 CE LYS A 9 10.470 -10.454 8.603 1.00 0.00 C ATOM 88 NZ LYS A 9 11.808 -10.624 7.972 1.00 0.00 N ATOM 0 H LYS A 9 7.917 -7.961 6.909 1.00 0.00 H new ATOM 0 HA LYS A 9 9.056 -8.851 4.489 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.104 -10.015 6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.568 -10.907 5.061 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.009 -11.661 6.796 1.00 0.00 H new ATOM 0 HG3 LYS A 9 9.990 -10.629 5.774 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.913 -8.817 7.330 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.575 -9.522 8.216 1.00 0.00 H new ATOM 0 HE2 LYS A 9 10.572 -9.873 9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.075 -11.430 8.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.448 -11.100 8.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.715 -11.199 7.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.196 -9.691 7.725 1.00 0.00 H new ATOM 102 N ILE A 10 5.944 -7.927 4.346 1.00 0.00 N ATOM 103 CA ILE A 10 4.822 -7.684 3.446 1.00 0.00 C ATOM 104 C ILE A 10 4.996 -6.369 2.694 1.00 0.00 C ATOM 105 O ILE A 10 5.363 -5.350 3.280 1.00 0.00 O ATOM 106 CB ILE A 10 3.485 -7.654 4.210 1.00 0.00 C ATOM 107 CG1 ILE A 10 3.672 -7.008 5.584 1.00 0.00 C ATOM 108 CG2 ILE A 10 2.924 -9.061 4.351 1.00 0.00 C ATOM 109 CD1 ILE A 10 4.147 -7.974 6.647 1.00 0.00 C ATOM 0 H ILE A 10 5.848 -7.498 5.266 1.00 0.00 H new ATOM 0 HA ILE A 10 4.805 -8.508 2.732 1.00 0.00 H new ATOM 0 HB ILE A 10 2.772 -7.055 3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.390 -6.193 5.498 1.00 0.00 H new ATOM 0 HG13 ILE A 10 2.727 -6.568 5.901 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.979 -9.023 4.893 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.758 -9.487 3.362 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.632 -9.682 4.899 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.258 -7.447 7.595 1.00 0.00 H new ATOM 0 HD12 ILE A 10 3.418 -8.777 6.761 1.00 0.00 H new ATOM 0 HD13 ILE A 10 5.108 -8.396 6.352 1.00 0.00 H new ATOM 121 N HIS A 11 4.726 -6.397 1.393 1.00 0.00 N ATOM 122 CA HIS A 11 4.850 -5.206 0.560 1.00 0.00 C ATOM 123 C HIS A 11 3.686 -5.107 -0.422 1.00 0.00 C ATOM 124 O HIS A 11 3.207 -6.117 -0.936 1.00 0.00 O ATOM 125 CB HIS A 11 6.175 -5.226 -0.202 1.00 0.00 C ATOM 126 CG HIS A 11 6.183 -6.170 -1.365 1.00 0.00 C ATOM 127 ND1 HIS A 11 5.682 -5.838 -2.606 1.00 0.00 N ATOM 128 CD2 HIS A 11 6.637 -7.441 -1.471 1.00 0.00 C ATOM 129 CE1 HIS A 11 5.826 -6.865 -3.425 1.00 0.00 C ATOM 130 NE2 HIS A 11 6.403 -7.850 -2.761 1.00 0.00 N ATOM 0 H HIS A 11 4.420 -7.231 0.893 1.00 0.00 H new ATOM 0 HA HIS A 11 4.828 -4.333 1.212 1.00 0.00 H new ATOM 0 HB2 HIS A 11 6.394 -4.220 -0.560 1.00 0.00 H new ATOM 0 HB3 HIS A 11 6.975 -5.502 0.485 1.00 0.00 H new ATOM 0 HD1 HIS A 11 5.265 -4.940 -2.853 1.00 0.00 H new ATOM 0 HD2 HIS A 11 7.097 -8.024 -0.687 1.00 0.00 H new ATOM 0 HE1 HIS A 11 5.523 -6.894 -4.461 1.00 0.00 H new ATOM 138 N PHE A 12 3.237 -3.882 -0.676 1.00 0.00 N ATOM 139 CA PHE A 12 2.128 -3.651 -1.595 1.00 0.00 C ATOM 140 C PHE A 12 2.602 -3.706 -3.044 1.00 0.00 C ATOM 141 O PHE A 12 3.709 -3.276 -3.363 1.00 0.00 O ATOM 142 CB PHE A 12 1.477 -2.296 -1.311 1.00 0.00 C ATOM 143 CG PHE A 12 0.582 -2.302 -0.104 1.00 0.00 C ATOM 144 CD1 PHE A 12 -0.643 -2.948 -0.136 1.00 0.00 C ATOM 145 CD2 PHE A 12 0.967 -1.661 1.063 1.00 0.00 C ATOM 146 CE1 PHE A 12 -1.468 -2.956 0.972 1.00 0.00 C ATOM 147 CE2 PHE A 12 0.146 -1.666 2.175 1.00 0.00 C ATOM 148 CZ PHE A 12 -1.073 -2.313 2.129 1.00 0.00 C ATOM 0 H PHE A 12 3.623 -3.035 -0.259 1.00 0.00 H new ATOM 0 HA PHE A 12 1.391 -4.440 -1.442 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.258 -1.549 -1.170 1.00 0.00 H new ATOM 0 HB3 PHE A 12 0.897 -1.991 -2.182 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -0.957 -3.452 -1.038 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.919 -1.152 1.104 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.420 -3.464 0.934 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.458 -1.164 3.079 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.717 -2.316 2.996 1.00 0.00 H new ATOM 158 N ASN A 13 1.755 -4.241 -3.918 1.00 0.00 N ATOM 159 CA ASN A 13 2.087 -4.354 -5.333 1.00 0.00 C ATOM 160 C ASN A 13 2.765 -3.083 -5.836 1.00 0.00 C ATOM 161 O ASN A 13 3.608 -3.130 -6.733 1.00 0.00 O ATOM 162 CB ASN A 13 0.825 -4.631 -6.154 1.00 0.00 C ATOM 163 CG ASN A 13 -0.366 -3.824 -5.673 1.00 0.00 C ATOM 164 OD1 ASN A 13 -0.234 -2.955 -4.811 1.00 0.00 O ATOM 165 ND2 ASN A 13 -1.537 -4.109 -6.231 1.00 0.00 N ATOM 0 H ASN A 13 0.834 -4.603 -3.671 1.00 0.00 H new ATOM 0 HA ASN A 13 2.780 -5.186 -5.452 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.018 -4.400 -7.201 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.586 -5.693 -6.101 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.374 -3.599 -5.949 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.599 -4.838 -6.942 1.00 0.00 H new ATOM 172 N PHE A 14 2.393 -1.949 -5.252 1.00 0.00 N ATOM 173 CA PHE A 14 2.965 -0.665 -5.641 1.00 0.00 C ATOM 174 C PHE A 14 3.378 0.140 -4.413 1.00 0.00 C ATOM 175 O PHE A 14 3.008 -0.193 -3.287 1.00 0.00 O ATOM 176 CB PHE A 14 1.960 0.133 -6.474 1.00 0.00 C ATOM 177 CG PHE A 14 0.563 0.096 -5.925 1.00 0.00 C ATOM 178 CD1 PHE A 14 0.307 0.478 -4.618 1.00 0.00 C ATOM 179 CD2 PHE A 14 -0.496 -0.319 -6.717 1.00 0.00 C ATOM 180 CE1 PHE A 14 -0.978 0.445 -4.110 1.00 0.00 C ATOM 181 CE2 PHE A 14 -1.784 -0.354 -6.215 1.00 0.00 C ATOM 182 CZ PHE A 14 -2.024 0.029 -4.910 1.00 0.00 C ATOM 0 H PHE A 14 1.698 -1.893 -4.508 1.00 0.00 H new ATOM 0 HA PHE A 14 3.853 -0.858 -6.243 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.291 1.170 -6.533 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.952 -0.258 -7.492 1.00 0.00 H new ATOM 0 HD1 PHE A 14 1.121 0.805 -3.989 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -0.313 -0.619 -7.738 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -1.164 0.744 -3.089 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.601 -0.680 -6.842 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.029 0.003 -4.515 1.00 0.00 H new ATOM 192 N GLU A 15 4.147 1.201 -4.639 1.00 0.00 N ATOM 193 CA GLU A 15 4.611 2.053 -3.551 1.00 0.00 C ATOM 194 C GLU A 15 3.524 3.035 -3.127 1.00 0.00 C ATOM 195 O GLU A 15 3.303 3.259 -1.935 1.00 0.00 O ATOM 196 CB GLU A 15 5.868 2.817 -3.972 1.00 0.00 C ATOM 197 CG GLU A 15 6.665 3.370 -2.803 1.00 0.00 C ATOM 198 CD GLU A 15 7.550 4.536 -3.199 1.00 0.00 C ATOM 199 OE1 GLU A 15 7.011 5.638 -3.434 1.00 0.00 O ATOM 200 OE2 GLU A 15 8.782 4.346 -3.275 1.00 0.00 O ATOM 0 H GLU A 15 4.461 1.490 -5.565 1.00 0.00 H new ATOM 0 HA GLU A 15 4.851 1.414 -2.701 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.507 2.154 -4.555 1.00 0.00 H new ATOM 0 HB3 GLU A 15 5.581 3.640 -4.626 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.978 3.690 -2.019 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.283 2.577 -2.382 1.00 0.00 H new ATOM 207 N LEU A 16 2.847 3.620 -4.109 1.00 0.00 N ATOM 208 CA LEU A 16 1.782 4.579 -3.839 1.00 0.00 C ATOM 209 C LEU A 16 0.585 4.336 -4.754 1.00 0.00 C ATOM 210 O LEU A 16 0.741 3.896 -5.894 1.00 0.00 O ATOM 211 CB LEU A 16 2.297 6.008 -4.024 1.00 0.00 C ATOM 212 CG LEU A 16 1.230 7.099 -4.120 1.00 0.00 C ATOM 213 CD1 LEU A 16 1.774 8.424 -3.611 1.00 0.00 C ATOM 214 CD2 LEU A 16 0.737 7.238 -5.553 1.00 0.00 C ATOM 0 H LEU A 16 3.017 3.447 -5.100 1.00 0.00 H new ATOM 0 HA LEU A 16 1.460 4.446 -2.806 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.957 6.246 -3.190 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.903 6.040 -4.929 1.00 0.00 H new ATOM 0 HG LEU A 16 0.386 6.811 -3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.001 9.188 -3.687 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.077 8.317 -2.569 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.635 8.718 -4.211 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.022 8.019 -5.603 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.573 7.502 -6.201 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.307 6.292 -5.883 1.00 0.00 H new ATOM 226 N LEU A 17 -0.608 4.627 -4.247 1.00 0.00 N ATOM 227 CA LEU A 17 -1.832 4.442 -5.019 1.00 0.00 C ATOM 228 C LEU A 17 -2.483 5.784 -5.337 1.00 0.00 C ATOM 229 O LEU A 17 -3.055 6.431 -4.459 1.00 0.00 O ATOM 230 CB LEU A 17 -2.814 3.555 -4.251 1.00 0.00 C ATOM 231 CG LEU A 17 -4.228 3.467 -4.824 1.00 0.00 C ATOM 232 CD1 LEU A 17 -4.257 2.549 -6.037 1.00 0.00 C ATOM 233 CD2 LEU A 17 -5.205 2.981 -3.763 1.00 0.00 C ATOM 0 H LEU A 17 -0.754 4.992 -3.306 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.570 3.955 -5.958 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.400 2.548 -4.201 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.881 3.923 -3.227 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.533 4.464 -5.141 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.272 2.499 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -3.588 2.939 -6.805 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.931 1.550 -5.745 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.207 2.925 -4.189 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.903 1.993 -3.415 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.206 3.677 -2.924 1.00 0.00 H new ATOM 245 N ASP A 18 -2.395 6.195 -6.597 1.00 0.00 N ATOM 246 CA ASP A 18 -2.978 7.459 -7.032 1.00 0.00 C ATOM 247 C ASP A 18 -4.360 7.239 -7.639 1.00 0.00 C ATOM 248 O ASP A 18 -4.489 6.673 -8.725 1.00 0.00 O ATOM 249 CB ASP A 18 -2.064 8.145 -8.048 1.00 0.00 C ATOM 250 CG ASP A 18 -1.676 7.226 -9.190 1.00 0.00 C ATOM 251 OD1 ASP A 18 -0.828 6.335 -8.973 1.00 0.00 O ATOM 252 OD2 ASP A 18 -2.222 7.396 -10.300 1.00 0.00 O ATOM 0 H ASP A 18 -1.925 5.671 -7.336 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.083 8.102 -6.158 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -2.567 9.025 -8.449 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -1.163 8.494 -7.544 1.00 0.00 H new ATOM 257 N ILE A 19 -5.390 7.689 -6.930 1.00 0.00 N ATOM 258 CA ILE A 19 -6.762 7.541 -7.400 1.00 0.00 C ATOM 259 C ILE A 19 -7.210 8.769 -8.185 1.00 0.00 C ATOM 260 O ILE A 19 -8.390 8.924 -8.496 1.00 0.00 O ATOM 261 CB ILE A 19 -7.736 7.311 -6.229 1.00 0.00 C ATOM 262 CG1 ILE A 19 -7.658 8.472 -5.236 1.00 0.00 C ATOM 263 CG2 ILE A 19 -7.429 5.992 -5.536 1.00 0.00 C ATOM 264 CD1 ILE A 19 -8.641 8.357 -4.092 1.00 0.00 C ATOM 0 H ILE A 19 -5.301 8.159 -6.029 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.779 6.669 -8.054 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.751 7.264 -6.624 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.647 8.526 -4.832 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.839 9.406 -5.767 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.126 5.844 -4.711 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -7.532 5.174 -6.249 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.409 6.012 -5.151 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -8.529 9.214 -3.428 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -9.657 8.334 -4.486 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.447 7.440 -3.536 1.00 0.00 H new ATOM 276 N GLY A 20 -6.258 9.641 -8.504 1.00 0.00 N ATOM 277 CA GLY A 20 -6.574 10.844 -9.252 1.00 0.00 C ATOM 278 C GLY A 20 -7.805 11.551 -8.720 1.00 0.00 C ATOM 279 O GLY A 20 -7.894 11.850 -7.529 1.00 0.00 O ATOM 0 H GLY A 20 -5.274 9.536 -8.258 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.724 11.525 -9.215 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -6.731 10.586 -10.299 1.00 0.00 H new ATOM 283 N LYS A 21 -8.758 11.820 -9.606 1.00 0.00 N ATOM 284 CA LYS A 21 -9.991 12.497 -9.221 1.00 0.00 C ATOM 285 C LYS A 21 -11.095 11.488 -8.921 1.00 0.00 C ATOM 286 O LYS A 21 -11.095 10.377 -9.452 1.00 0.00 O ATOM 287 CB LYS A 21 -10.444 13.448 -10.331 1.00 0.00 C ATOM 288 CG LYS A 21 -9.378 14.447 -10.748 1.00 0.00 C ATOM 289 CD LYS A 21 -9.986 15.654 -11.443 1.00 0.00 C ATOM 290 CE LYS A 21 -9.074 16.867 -11.354 1.00 0.00 C ATOM 291 NZ LYS A 21 -8.880 17.313 -9.947 1.00 0.00 N ATOM 0 H LYS A 21 -8.700 11.580 -10.596 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.792 13.072 -8.317 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.742 12.862 -11.201 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.327 13.991 -9.995 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.821 14.774 -9.870 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.665 13.963 -11.415 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.175 15.416 -12.490 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.950 15.888 -10.991 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.107 16.627 -11.796 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.498 17.684 -11.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -9.217 18.291 -9.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.417 16.692 -9.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.870 17.268 -9.705 1.00 0.00 H new ATOM 305 N VAL A 22 -12.035 11.882 -8.068 1.00 0.00 N ATOM 306 CA VAL A 22 -13.146 11.012 -7.700 1.00 0.00 C ATOM 307 C VAL A 22 -14.376 11.826 -7.311 1.00 0.00 C ATOM 308 O VAL A 22 -14.365 12.549 -6.315 1.00 0.00 O ATOM 309 CB VAL A 22 -12.768 10.083 -6.531 1.00 0.00 C ATOM 310 CG1 VAL A 22 -11.737 9.058 -6.975 1.00 0.00 C ATOM 311 CG2 VAL A 22 -12.252 10.895 -5.352 1.00 0.00 C ATOM 0 H VAL A 22 -12.050 12.798 -7.619 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.377 10.406 -8.576 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.662 9.547 -6.211 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.482 8.411 -6.136 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.148 8.456 -7.786 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.840 9.571 -7.323 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -11.989 10.223 -4.535 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.370 11.458 -5.656 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.027 11.586 -5.019 1.00 0.00 H new ATOM 321 N PHE A 23 -15.435 11.703 -8.104 1.00 0.00 N ATOM 322 CA PHE A 23 -16.673 12.427 -7.844 1.00 0.00 C ATOM 323 C PHE A 23 -17.006 12.418 -6.354 1.00 0.00 C ATOM 324 O PHE A 23 -16.635 11.495 -5.628 1.00 0.00 O ATOM 325 CB PHE A 23 -17.826 11.811 -8.639 1.00 0.00 C ATOM 326 CG PHE A 23 -18.892 12.801 -9.013 1.00 0.00 C ATOM 327 CD1 PHE A 23 -18.643 13.783 -9.958 1.00 0.00 C ATOM 328 CD2 PHE A 23 -20.143 12.749 -8.420 1.00 0.00 C ATOM 329 CE1 PHE A 23 -19.622 14.695 -10.304 1.00 0.00 C ATOM 330 CE2 PHE A 23 -21.127 13.658 -8.762 1.00 0.00 C ATOM 331 CZ PHE A 23 -20.866 14.632 -9.706 1.00 0.00 C ATOM 0 H PHE A 23 -15.460 11.108 -8.932 1.00 0.00 H new ATOM 0 HA PHE A 23 -16.533 13.460 -8.161 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -17.429 11.356 -9.547 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -18.275 11.010 -8.051 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -17.673 13.836 -10.430 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -20.352 11.989 -7.682 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -19.415 15.456 -11.041 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -22.098 13.607 -8.292 1.00 0.00 H new ATOM 0 HZ PHE A 23 -21.633 15.343 -9.976 1.00 0.00 H new ATOM 341 N THR A 24 -17.707 13.454 -5.904 1.00 0.00 N ATOM 342 CA THR A 24 -18.089 13.568 -4.502 1.00 0.00 C ATOM 343 C THR A 24 -19.492 13.020 -4.268 1.00 0.00 C ATOM 344 O THR A 24 -20.347 13.080 -5.150 1.00 0.00 O ATOM 345 CB THR A 24 -18.034 15.030 -4.022 1.00 0.00 C ATOM 346 OG1 THR A 24 -18.266 15.092 -2.610 1.00 0.00 O ATOM 347 CG2 THR A 24 -19.067 15.878 -4.749 1.00 0.00 C ATOM 0 H THR A 24 -18.022 14.227 -6.491 1.00 0.00 H new ATOM 0 HA THR A 24 -17.372 12.979 -3.930 1.00 0.00 H new ATOM 0 HB THR A 24 -17.042 15.425 -4.244 1.00 0.00 H new ATOM 0 HG1 THR A 24 -18.228 16.025 -2.313 1.00 0.00 H new ATOM 0 HG21 THR A 24 -19.009 16.907 -4.393 1.00 0.00 H new ATOM 0 HG22 THR A 24 -18.869 15.853 -5.821 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.064 15.483 -4.555 1.00 0.00 H new ATOM 355 N GLY A 25 -19.722 12.487 -3.072 1.00 0.00 N ATOM 356 CA GLY A 25 -21.024 11.937 -2.744 1.00 0.00 C ATOM 357 C GLY A 25 -21.025 10.421 -2.721 1.00 0.00 C ATOM 358 O GLY A 25 -21.185 9.809 -1.665 1.00 0.00 O ATOM 0 H GLY A 25 -19.030 12.426 -2.325 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -21.338 12.312 -1.770 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -21.756 12.287 -3.472 1.00 0.00 H new ATOM 362 N SER A 26 -20.846 9.813 -3.890 1.00 0.00 N ATOM 363 CA SER A 26 -20.831 8.359 -4.001 1.00 0.00 C ATOM 364 C SER A 26 -19.569 7.779 -3.370 1.00 0.00 C ATOM 365 O SER A 26 -18.755 8.506 -2.803 1.00 0.00 O ATOM 366 CB SER A 26 -20.922 7.938 -5.468 1.00 0.00 C ATOM 367 OG SER A 26 -19.826 8.442 -6.212 1.00 0.00 O ATOM 0 H SER A 26 -20.709 10.305 -4.773 1.00 0.00 H new ATOM 0 HA SER A 26 -21.696 7.969 -3.465 1.00 0.00 H new ATOM 0 HB2 SER A 26 -20.943 6.850 -5.537 1.00 0.00 H new ATOM 0 HB3 SER A 26 -21.855 8.303 -5.897 1.00 0.00 H new ATOM 0 HG SER A 26 -19.906 8.158 -7.146 1.00 0.00 H new ATOM 373 N ALA A 27 -19.416 6.463 -3.473 1.00 0.00 N ATOM 374 CA ALA A 27 -18.253 5.783 -2.915 1.00 0.00 C ATOM 375 C ALA A 27 -17.474 5.048 -4.000 1.00 0.00 C ATOM 376 O ALA A 27 -18.051 4.567 -4.975 1.00 0.00 O ATOM 377 CB ALA A 27 -18.681 4.816 -1.822 1.00 0.00 C ATOM 0 H ALA A 27 -20.083 5.846 -3.938 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.596 6.537 -2.481 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -17.803 4.316 -1.415 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.187 5.365 -1.028 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.361 4.073 -2.239 1.00 0.00 H new ATOM 383 N HIS A 28 -16.159 4.964 -3.824 1.00 0.00 N ATOM 384 CA HIS A 28 -15.300 4.286 -4.789 1.00 0.00 C ATOM 385 C HIS A 28 -14.834 2.938 -4.249 1.00 0.00 C ATOM 386 O HIS A 28 -14.666 2.767 -3.041 1.00 0.00 O ATOM 387 CB HIS A 28 -14.091 5.158 -5.128 1.00 0.00 C ATOM 388 CG HIS A 28 -14.393 6.245 -6.114 1.00 0.00 C ATOM 389 ND1 HIS A 28 -13.913 6.243 -7.406 1.00 0.00 N ATOM 390 CD2 HIS A 28 -15.132 7.372 -5.990 1.00 0.00 C ATOM 391 CE1 HIS A 28 -14.343 7.322 -8.035 1.00 0.00 C ATOM 392 NE2 HIS A 28 -15.086 8.024 -7.197 1.00 0.00 N ATOM 0 H HIS A 28 -15.665 5.357 -3.023 1.00 0.00 H new ATOM 0 HA HIS A 28 -15.880 4.113 -5.696 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.709 5.607 -4.211 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.298 4.526 -5.528 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.660 7.698 -5.106 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -14.125 7.586 -9.059 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -15.550 8.907 -7.412 1.00 0.00 H new ATOM 400 N CYS A 29 -14.629 1.984 -5.151 1.00 0.00 N ATOM 401 CA CYS A 29 -14.184 0.650 -4.764 1.00 0.00 C ATOM 402 C CYS A 29 -12.768 0.383 -5.263 1.00 0.00 C ATOM 403 O CYS A 29 -12.533 0.271 -6.466 1.00 0.00 O ATOM 404 CB CYS A 29 -15.140 -0.409 -5.316 1.00 0.00 C ATOM 405 SG CYS A 29 -15.245 -0.439 -7.121 1.00 0.00 S ATOM 0 H CYS A 29 -14.764 2.109 -6.154 1.00 0.00 H new ATOM 0 HA CYS A 29 -14.182 0.596 -3.675 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -14.820 -1.390 -4.965 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.135 -0.233 -4.908 1.00 0.00 H new ATOM 0 HG CYS A 29 -14.068 -0.218 -7.628 1.00 0.00 H new ATOM 411 N TYR A 30 -11.827 0.285 -4.331 1.00 0.00 N ATOM 412 CA TYR A 30 -10.432 0.036 -4.675 1.00 0.00 C ATOM 413 C TYR A 30 -9.960 -1.298 -4.104 1.00 0.00 C ATOM 414 O TYR A 30 -10.693 -1.970 -3.380 1.00 0.00 O ATOM 415 CB TYR A 30 -9.546 1.169 -4.155 1.00 0.00 C ATOM 416 CG TYR A 30 -9.876 2.518 -4.752 1.00 0.00 C ATOM 417 CD1 TYR A 30 -9.580 2.804 -6.079 1.00 0.00 C ATOM 418 CD2 TYR A 30 -10.484 3.507 -3.988 1.00 0.00 C ATOM 419 CE1 TYR A 30 -9.879 4.036 -6.627 1.00 0.00 C ATOM 420 CE2 TYR A 30 -10.788 4.741 -4.529 1.00 0.00 C ATOM 421 CZ TYR A 30 -10.483 5.001 -5.849 1.00 0.00 C ATOM 422 OH TYR A 30 -10.784 6.229 -6.392 1.00 0.00 O ATOM 0 H TYR A 30 -12.005 0.374 -3.331 1.00 0.00 H new ATOM 0 HA TYR A 30 -10.354 -0.007 -5.761 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -9.644 1.227 -3.071 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.504 0.931 -4.369 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.108 2.050 -6.692 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -10.723 3.307 -2.954 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.641 4.243 -7.660 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -11.262 5.498 -3.922 1.00 0.00 H new ATOM 0 HH TYR A 30 -11.720 6.238 -6.681 1.00 0.00 H new ATOM 432 N GLU A 31 -8.728 -1.673 -4.437 1.00 0.00 N ATOM 433 CA GLU A 31 -8.157 -2.926 -3.957 1.00 0.00 C ATOM 434 C GLU A 31 -6.632 -2.863 -3.953 1.00 0.00 C ATOM 435 O GLU A 31 -6.014 -2.483 -4.946 1.00 0.00 O ATOM 436 CB GLU A 31 -8.627 -4.093 -4.828 1.00 0.00 C ATOM 437 CG GLU A 31 -8.222 -5.456 -4.292 1.00 0.00 C ATOM 438 CD GLU A 31 -8.947 -6.594 -4.983 1.00 0.00 C ATOM 439 OE1 GLU A 31 -9.235 -6.467 -6.191 1.00 0.00 O ATOM 440 OE2 GLU A 31 -9.227 -7.612 -4.315 1.00 0.00 O ATOM 0 H GLU A 31 -8.108 -1.128 -5.036 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.500 -3.083 -2.934 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -9.713 -4.055 -4.916 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.221 -3.972 -5.832 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -7.147 -5.586 -4.417 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.426 -5.497 -3.222 1.00 0.00 H new ATOM 447 N ALA A 32 -6.034 -3.238 -2.827 1.00 0.00 N ATOM 448 CA ALA A 32 -4.582 -3.225 -2.693 1.00 0.00 C ATOM 449 C ALA A 32 -4.046 -4.622 -2.400 1.00 0.00 C ATOM 450 O ALA A 32 -4.456 -5.264 -1.432 1.00 0.00 O ATOM 451 CB ALA A 32 -4.162 -2.256 -1.599 1.00 0.00 C ATOM 0 H ALA A 32 -6.532 -3.554 -1.995 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.157 -2.892 -3.640 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.076 -2.257 -1.510 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.505 -1.252 -1.851 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.604 -2.564 -0.651 1.00 0.00 H new ATOM 457 N ILE A 33 -3.128 -5.087 -3.241 1.00 0.00 N ATOM 458 CA ILE A 33 -2.536 -6.408 -3.070 1.00 0.00 C ATOM 459 C ILE A 33 -1.282 -6.341 -2.205 1.00 0.00 C ATOM 460 O ILE A 33 -0.422 -5.482 -2.405 1.00 0.00 O ATOM 461 CB ILE A 33 -2.177 -7.044 -4.427 1.00 0.00 C ATOM 462 CG1 ILE A 33 -3.295 -6.796 -5.442 1.00 0.00 C ATOM 463 CG2 ILE A 33 -1.924 -8.535 -4.263 1.00 0.00 C ATOM 464 CD1 ILE A 33 -4.683 -6.955 -4.863 1.00 0.00 C ATOM 0 H ILE A 33 -2.778 -4.569 -4.047 1.00 0.00 H new ATOM 0 HA ILE A 33 -3.284 -7.027 -2.574 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.264 -6.580 -4.799 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.192 -5.789 -5.845 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.177 -7.487 -6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -1.672 -8.970 -5.230 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.098 -8.690 -3.569 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.821 -9.015 -3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -5.425 -6.764 -5.639 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -4.806 -7.970 -4.485 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -4.820 -6.245 -4.047 1.00 0.00 H new ATOM 476 N LEU A 34 -1.183 -7.254 -1.245 1.00 0.00 N ATOM 477 CA LEU A 34 -0.032 -7.300 -0.350 1.00 0.00 C ATOM 478 C LEU A 34 0.634 -8.672 -0.390 1.00 0.00 C ATOM 479 O LEU A 34 0.025 -9.680 -0.029 1.00 0.00 O ATOM 480 CB LEU A 34 -0.461 -6.971 1.081 1.00 0.00 C ATOM 481 CG LEU A 34 0.656 -6.546 2.036 1.00 0.00 C ATOM 482 CD1 LEU A 34 1.160 -5.155 1.683 1.00 0.00 C ATOM 483 CD2 LEU A 34 0.171 -6.590 3.477 1.00 0.00 C ATOM 0 H LEU A 34 -1.885 -7.972 -1.066 1.00 0.00 H new ATOM 0 HA LEU A 34 0.690 -6.556 -0.687 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.202 -6.173 1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.957 -7.846 1.501 1.00 0.00 H new ATOM 0 HG LEU A 34 1.484 -7.247 1.931 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.954 -4.870 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.548 -5.156 0.664 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.340 -4.441 1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.979 -6.285 4.142 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.674 -5.912 3.597 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.140 -7.605 3.726 1.00 0.00 H new ATOM 495 N TYR A 35 1.887 -8.702 -0.829 1.00 0.00 N ATOM 496 CA TYR A 35 2.636 -9.950 -0.916 1.00 0.00 C ATOM 497 C TYR A 35 3.433 -10.198 0.361 1.00 0.00 C ATOM 498 O TYR A 35 4.225 -9.358 0.785 1.00 0.00 O ATOM 499 CB TYR A 35 3.579 -9.921 -2.120 1.00 0.00 C ATOM 500 CG TYR A 35 2.867 -9.744 -3.443 1.00 0.00 C ATOM 501 CD1 TYR A 35 2.173 -8.574 -3.729 1.00 0.00 C ATOM 502 CD2 TYR A 35 2.886 -10.746 -4.404 1.00 0.00 C ATOM 503 CE1 TYR A 35 1.520 -8.408 -4.935 1.00 0.00 C ATOM 504 CE2 TYR A 35 2.238 -10.588 -5.614 1.00 0.00 C ATOM 505 CZ TYR A 35 1.556 -9.418 -5.875 1.00 0.00 C ATOM 506 OH TYR A 35 0.907 -9.257 -7.077 1.00 0.00 O ATOM 0 H TYR A 35 2.405 -7.877 -1.130 1.00 0.00 H new ATOM 0 HA TYR A 35 1.922 -10.764 -1.041 1.00 0.00 H new ATOM 0 HB2 TYR A 35 4.295 -9.109 -1.991 1.00 0.00 H new ATOM 0 HB3 TYR A 35 4.150 -10.849 -2.146 1.00 0.00 H new ATOM 0 HD1 TYR A 35 2.144 -7.781 -2.996 1.00 0.00 H new ATOM 0 HD2 TYR A 35 3.417 -11.665 -4.202 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.984 -7.493 -5.141 1.00 0.00 H new ATOM 0 HE2 TYR A 35 2.265 -11.376 -6.352 1.00 0.00 H new ATOM 0 HH TYR A 35 1.031 -10.059 -7.626 1.00 0.00 H new ATOM 516 N ASN A 36 3.216 -11.360 0.970 1.00 0.00 N ATOM 517 CA ASN A 36 3.913 -11.720 2.199 1.00 0.00 C ATOM 518 C ASN A 36 5.208 -12.466 1.892 1.00 0.00 C ATOM 519 O ASN A 36 5.186 -13.622 1.469 1.00 0.00 O ATOM 520 CB ASN A 36 3.013 -12.582 3.087 1.00 0.00 C ATOM 521 CG ASN A 36 3.612 -12.821 4.459 1.00 0.00 C ATOM 522 OD1 ASN A 36 4.258 -11.941 5.028 1.00 0.00 O ATOM 523 ND2 ASN A 36 3.399 -14.016 4.998 1.00 0.00 N ATOM 0 H ASN A 36 2.563 -12.067 0.632 1.00 0.00 H new ATOM 0 HA ASN A 36 4.161 -10.800 2.729 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.043 -12.097 3.197 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.836 -13.540 2.599 1.00 0.00 H new ATOM 0 HD21 ASN A 36 3.777 -14.234 5.920 1.00 0.00 H new ATOM 0 HD22 ASN A 36 2.857 -14.715 4.490 1.00 0.00 H new ATOM 530 N LYS A 37 6.335 -11.797 2.108 1.00 0.00 N ATOM 531 CA LYS A 37 7.641 -12.396 1.856 1.00 0.00 C ATOM 532 C LYS A 37 8.199 -13.037 3.123 1.00 0.00 C ATOM 533 O LYS A 37 9.375 -12.875 3.446 1.00 0.00 O ATOM 534 CB LYS A 37 8.617 -11.339 1.334 1.00 0.00 C ATOM 535 CG LYS A 37 8.270 -10.823 -0.052 1.00 0.00 C ATOM 536 CD LYS A 37 8.719 -11.788 -1.136 1.00 0.00 C ATOM 537 CE LYS A 37 8.153 -11.405 -2.494 1.00 0.00 C ATOM 538 NZ LYS A 37 9.024 -10.427 -3.202 1.00 0.00 N ATOM 0 H LYS A 37 6.371 -10.839 2.457 1.00 0.00 H new ATOM 0 HA LYS A 37 7.518 -13.173 1.101 1.00 0.00 H new ATOM 0 HB2 LYS A 37 8.638 -10.500 2.030 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.621 -11.762 1.314 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.193 -10.669 -0.125 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.742 -9.853 -0.209 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.808 -11.800 -1.185 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.400 -12.798 -0.880 1.00 0.00 H new ATOM 0 HE2 LYS A 37 8.040 -12.300 -3.106 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.158 -10.979 -2.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.604 -10.191 -4.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.112 -9.563 -2.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.966 -10.843 -3.347 1.00 0.00 H new ATOM 552 N GLY A 38 7.347 -13.767 3.836 1.00 0.00 N ATOM 553 CA GLY A 38 7.774 -14.422 5.058 1.00 0.00 C ATOM 554 C GLY A 38 7.939 -15.919 4.887 1.00 0.00 C ATOM 555 O GLY A 38 7.937 -16.426 3.765 1.00 0.00 O ATOM 0 H GLY A 38 6.369 -13.916 3.589 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.720 -13.991 5.386 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.045 -14.228 5.845 1.00 0.00 H new ATOM 559 N SER A 39 8.083 -16.629 6.001 1.00 0.00 N ATOM 560 CA SER A 39 8.255 -18.076 5.969 1.00 0.00 C ATOM 561 C SER A 39 6.979 -18.785 6.410 1.00 0.00 C ATOM 562 O SER A 39 6.690 -19.898 5.969 1.00 0.00 O ATOM 563 CB SER A 39 9.421 -18.493 6.868 1.00 0.00 C ATOM 564 OG SER A 39 10.659 -18.065 6.328 1.00 0.00 O ATOM 0 H SER A 39 8.084 -16.225 6.938 1.00 0.00 H new ATOM 0 HA SER A 39 8.475 -18.368 4.942 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.288 -18.067 7.863 1.00 0.00 H new ATOM 0 HB3 SER A 39 9.426 -19.577 6.983 1.00 0.00 H new ATOM 0 HG SER A 39 11.388 -18.342 6.921 1.00 0.00 H new ATOM 570 N ILE A 40 6.219 -18.133 7.284 1.00 0.00 N ATOM 571 CA ILE A 40 4.973 -18.700 7.785 1.00 0.00 C ATOM 572 C ILE A 40 3.893 -17.631 7.906 1.00 0.00 C ATOM 573 O ILE A 40 4.121 -16.464 7.588 1.00 0.00 O ATOM 574 CB ILE A 40 5.172 -19.371 9.157 1.00 0.00 C ATOM 575 CG1 ILE A 40 5.861 -18.407 10.125 1.00 0.00 C ATOM 576 CG2 ILE A 40 5.981 -20.651 9.009 1.00 0.00 C ATOM 577 CD1 ILE A 40 4.921 -17.398 10.745 1.00 0.00 C ATOM 0 H ILE A 40 6.444 -17.212 7.660 1.00 0.00 H new ATOM 0 HA ILE A 40 4.656 -19.453 7.064 1.00 0.00 H new ATOM 0 HB ILE A 40 4.194 -19.628 9.564 1.00 0.00 H new ATOM 0 HG12 ILE A 40 6.339 -18.982 10.919 1.00 0.00 H new ATOM 0 HG13 ILE A 40 6.652 -17.877 9.595 1.00 0.00 H new ATOM 0 HG21 ILE A 40 6.113 -21.113 9.987 1.00 0.00 H new ATOM 0 HG22 ILE A 40 5.454 -21.341 8.350 1.00 0.00 H new ATOM 0 HG23 ILE A 40 6.957 -20.417 8.583 1.00 0.00 H new ATOM 0 HD11 ILE A 40 5.478 -16.748 11.420 1.00 0.00 H new ATOM 0 HD12 ILE A 40 4.462 -16.798 9.959 1.00 0.00 H new ATOM 0 HD13 ILE A 40 4.144 -17.920 11.304 1.00 0.00 H new ATOM 589 N ASP A 41 2.716 -18.037 8.368 1.00 0.00 N ATOM 590 CA ASP A 41 1.599 -17.114 8.535 1.00 0.00 C ATOM 591 C ASP A 41 2.067 -15.802 9.157 1.00 0.00 C ATOM 592 O ASP A 41 2.505 -15.770 10.306 1.00 0.00 O ATOM 593 CB ASP A 41 0.512 -17.746 9.405 1.00 0.00 C ATOM 594 CG ASP A 41 1.076 -18.726 10.415 1.00 0.00 C ATOM 595 OD1 ASP A 41 1.415 -18.293 11.537 1.00 0.00 O ATOM 596 OD2 ASP A 41 1.177 -19.926 10.085 1.00 0.00 O ATOM 0 H ASP A 41 2.510 -19.000 8.634 1.00 0.00 H new ATOM 0 HA ASP A 41 1.185 -16.901 7.549 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -0.032 -16.960 9.930 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.207 -18.260 8.767 1.00 0.00 H new ATOM 601 N ALA A 42 1.972 -14.722 8.388 1.00 0.00 N ATOM 602 CA ALA A 42 2.385 -13.407 8.864 1.00 0.00 C ATOM 603 C ALA A 42 1.190 -12.607 9.371 1.00 0.00 C ATOM 604 O ALA A 42 0.272 -12.293 8.612 1.00 0.00 O ATOM 605 CB ALA A 42 3.101 -12.646 7.758 1.00 0.00 C ATOM 0 H ALA A 42 1.613 -14.732 7.433 1.00 0.00 H new ATOM 0 HA ALA A 42 3.074 -13.549 9.697 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.404 -11.666 8.128 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.983 -13.204 7.445 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.430 -12.522 6.908 1.00 0.00 H new ATOM 611 N LEU A 43 1.206 -12.280 10.659 1.00 0.00 N ATOM 612 CA LEU A 43 0.123 -11.517 11.268 1.00 0.00 C ATOM 613 C LEU A 43 0.250 -10.033 10.937 1.00 0.00 C ATOM 614 O LEU A 43 1.293 -9.421 11.168 1.00 0.00 O ATOM 615 CB LEU A 43 0.124 -11.714 12.785 1.00 0.00 C ATOM 616 CG LEU A 43 -0.648 -12.928 13.304 1.00 0.00 C ATOM 617 CD1 LEU A 43 0.257 -14.148 13.370 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.250 -12.633 14.670 1.00 0.00 C ATOM 0 H LEU A 43 1.957 -12.532 11.301 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.820 -11.883 10.861 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.158 -11.795 13.120 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.292 -10.819 13.248 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.461 -13.142 12.610 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.310 -15.002 13.741 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.639 -14.372 12.374 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.091 -13.946 14.042 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.796 -13.508 15.024 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.454 -12.393 15.374 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.933 -11.787 14.592 1.00 0.00 H new ATOM 630 N PHE A 44 -0.821 -9.459 10.398 1.00 0.00 N ATOM 631 CA PHE A 44 -0.830 -8.046 10.036 1.00 0.00 C ATOM 632 C PHE A 44 -2.072 -7.352 10.588 1.00 0.00 C ATOM 633 O PHE A 44 -2.947 -7.992 11.170 1.00 0.00 O ATOM 634 CB PHE A 44 -0.776 -7.886 8.516 1.00 0.00 C ATOM 635 CG PHE A 44 -2.079 -8.193 7.834 1.00 0.00 C ATOM 636 CD1 PHE A 44 -2.374 -9.483 7.422 1.00 0.00 C ATOM 637 CD2 PHE A 44 -3.008 -7.191 7.604 1.00 0.00 C ATOM 638 CE1 PHE A 44 -3.572 -9.768 6.795 1.00 0.00 C ATOM 639 CE2 PHE A 44 -4.208 -7.471 6.978 1.00 0.00 C ATOM 640 CZ PHE A 44 -4.490 -8.761 6.572 1.00 0.00 C ATOM 0 H PHE A 44 -1.693 -9.950 10.202 1.00 0.00 H new ATOM 0 HA PHE A 44 0.052 -7.579 10.474 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -0.482 -6.864 8.276 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.003 -8.542 8.117 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -1.659 -10.275 7.593 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.792 -6.180 7.917 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.790 -10.778 6.480 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -4.925 -6.682 6.806 1.00 0.00 H new ATOM 0 HZ PHE A 44 -5.426 -8.981 6.081 1.00 0.00 H new ATOM 650 N ASN A 45 -2.140 -6.038 10.401 1.00 0.00 N ATOM 651 CA ASN A 45 -3.273 -5.255 10.880 1.00 0.00 C ATOM 652 C ASN A 45 -3.180 -3.811 10.399 1.00 0.00 C ATOM 653 O ASN A 45 -2.090 -3.301 10.142 1.00 0.00 O ATOM 654 CB ASN A 45 -3.335 -5.292 12.409 1.00 0.00 C ATOM 655 CG ASN A 45 -4.606 -4.668 12.951 1.00 0.00 C ATOM 656 OD1 ASN A 45 -5.627 -4.616 12.265 1.00 0.00 O ATOM 657 ND2 ASN A 45 -4.549 -4.190 14.189 1.00 0.00 N ATOM 0 H ASN A 45 -1.424 -5.493 9.921 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.184 -5.696 10.475 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -3.268 -6.326 12.748 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -2.472 -4.766 12.818 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.373 -3.758 14.607 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -3.681 -4.255 14.721 1.00 0.00 H new ATOM 664 N MET A 46 -4.331 -3.157 10.279 1.00 0.00 N ATOM 665 CA MET A 46 -4.379 -1.770 9.830 1.00 0.00 C ATOM 666 C MET A 46 -4.506 -0.819 11.015 1.00 0.00 C ATOM 667 O MET A 46 -5.262 -1.076 11.953 1.00 0.00 O ATOM 668 CB MET A 46 -5.550 -1.564 8.867 1.00 0.00 C ATOM 669 CG MET A 46 -5.570 -2.553 7.713 1.00 0.00 C ATOM 670 SD MET A 46 -4.316 -2.193 6.468 1.00 0.00 S ATOM 671 CE MET A 46 -4.630 -0.456 6.164 1.00 0.00 C ATOM 0 H MET A 46 -5.243 -3.565 10.486 1.00 0.00 H new ATOM 0 HA MET A 46 -3.447 -1.550 9.309 1.00 0.00 H new ATOM 0 HB2 MET A 46 -6.485 -1.647 9.422 1.00 0.00 H new ATOM 0 HB3 MET A 46 -5.506 -0.551 8.466 1.00 0.00 H new ATOM 0 HG2 MET A 46 -5.414 -3.560 8.100 1.00 0.00 H new ATOM 0 HG3 MET A 46 -6.555 -2.540 7.246 1.00 0.00 H new ATOM 0 HE1 MET A 46 -4.468 -0.236 5.109 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.661 -0.221 6.430 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.953 0.147 6.768 1.00 0.00 H new ATOM 681 N THR A 47 -3.761 0.281 10.968 1.00 0.00 N ATOM 682 CA THR A 47 -3.789 1.270 12.038 1.00 0.00 C ATOM 683 C THR A 47 -4.912 2.278 11.826 1.00 0.00 C ATOM 684 O THR A 47 -5.157 2.746 10.714 1.00 0.00 O ATOM 685 CB THR A 47 -2.450 2.024 12.142 1.00 0.00 C ATOM 686 OG1 THR A 47 -1.380 1.096 12.353 1.00 0.00 O ATOM 687 CG2 THR A 47 -2.484 3.034 13.279 1.00 0.00 C ATOM 0 H THR A 47 -3.130 0.509 10.200 1.00 0.00 H new ATOM 0 HA THR A 47 -3.964 0.726 12.966 1.00 0.00 H new ATOM 0 HB THR A 47 -2.287 2.559 11.207 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.532 1.583 12.416 1.00 0.00 H new ATOM 0 HG21 THR A 47 -1.527 3.554 13.333 1.00 0.00 H new ATOM 0 HG22 THR A 47 -3.280 3.757 13.100 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.669 2.516 14.220 1.00 0.00 H new ATOM 695 N PRO A 48 -5.612 2.624 12.917 1.00 0.00 N ATOM 696 CA PRO A 48 -6.721 3.582 12.875 1.00 0.00 C ATOM 697 C PRO A 48 -6.246 5.006 12.608 1.00 0.00 C ATOM 698 O PRO A 48 -5.373 5.534 13.297 1.00 0.00 O ATOM 699 CB PRO A 48 -7.335 3.475 14.273 1.00 0.00 C ATOM 700 CG PRO A 48 -6.221 2.998 15.140 1.00 0.00 C ATOM 701 CD PRO A 48 -5.375 2.106 14.275 1.00 0.00 C ATOM 0 HA PRO A 48 -7.421 3.361 12.070 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -7.717 4.438 14.613 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -8.173 2.778 14.285 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -5.639 3.836 15.523 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -6.604 2.455 16.004 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -4.321 2.163 14.549 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -5.672 1.061 14.364 1.00 0.00 H new ATOM 709 N PRO A 49 -6.834 5.645 11.586 1.00 0.00 N ATOM 710 CA PRO A 49 -6.488 7.018 11.206 1.00 0.00 C ATOM 711 C PRO A 49 -6.951 8.040 12.239 1.00 0.00 C ATOM 712 O PRO A 49 -7.926 7.815 12.957 1.00 0.00 O ATOM 713 CB PRO A 49 -7.233 7.219 9.884 1.00 0.00 C ATOM 714 CG PRO A 49 -8.376 6.266 9.945 1.00 0.00 C ATOM 715 CD PRO A 49 -7.883 5.077 10.723 1.00 0.00 C ATOM 0 HA PRO A 49 -5.410 7.160 11.129 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.580 8.247 9.777 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.588 7.010 9.030 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -9.238 6.721 10.433 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.694 5.973 8.944 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -8.681 4.621 11.308 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -7.487 4.303 10.066 1.00 0.00 H new ATOM 723 N THR A 50 -6.245 9.164 12.310 1.00 0.00 N ATOM 724 CA THR A 50 -6.583 10.220 13.255 1.00 0.00 C ATOM 725 C THR A 50 -7.025 11.487 12.530 1.00 0.00 C ATOM 726 O THR A 50 -6.774 12.599 12.994 1.00 0.00 O ATOM 727 CB THR A 50 -5.392 10.556 14.172 1.00 0.00 C ATOM 728 OG1 THR A 50 -4.701 9.356 14.537 1.00 0.00 O ATOM 729 CG2 THR A 50 -5.860 11.280 15.425 1.00 0.00 C ATOM 0 H THR A 50 -5.435 9.366 11.724 1.00 0.00 H new ATOM 0 HA THR A 50 -7.407 9.847 13.864 1.00 0.00 H new ATOM 0 HB THR A 50 -4.715 11.212 13.625 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.944 9.578 15.119 1.00 0.00 H new ATOM 0 HG21 THR A 50 -5.001 11.507 16.057 1.00 0.00 H new ATOM 0 HG22 THR A 50 -6.359 12.208 15.144 1.00 0.00 H new ATOM 0 HG23 THR A 50 -6.556 10.645 15.973 1.00 0.00 H new ATOM 737 N SER A 51 -7.685 11.310 11.390 1.00 0.00 N ATOM 738 CA SER A 51 -8.160 12.440 10.599 1.00 0.00 C ATOM 739 C SER A 51 -9.580 12.194 10.099 1.00 0.00 C ATOM 740 O SER A 51 -9.923 11.085 9.691 1.00 0.00 O ATOM 741 CB SER A 51 -7.225 12.688 9.414 1.00 0.00 C ATOM 742 OG SER A 51 -7.226 14.056 9.041 1.00 0.00 O ATOM 0 H SER A 51 -7.903 10.396 10.993 1.00 0.00 H new ATOM 0 HA SER A 51 -8.167 13.323 11.238 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.213 12.380 9.675 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.536 12.077 8.567 1.00 0.00 H new ATOM 0 HG SER A 51 -6.619 14.189 8.283 1.00 0.00 H new ATOM 748 N ALA A 52 -10.401 13.238 10.132 1.00 0.00 N ATOM 749 CA ALA A 52 -11.783 13.138 9.681 1.00 0.00 C ATOM 750 C ALA A 52 -11.863 12.517 8.290 1.00 0.00 C ATOM 751 O ALA A 52 -12.787 11.760 7.988 1.00 0.00 O ATOM 752 CB ALA A 52 -12.442 14.509 9.686 1.00 0.00 C ATOM 0 H ALA A 52 -10.133 14.163 10.467 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.318 12.488 10.373 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.474 14.418 9.347 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -12.427 14.916 10.697 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -11.898 15.177 9.018 1.00 0.00 H new ATOM 758 N LEU A 53 -10.889 12.841 7.446 1.00 0.00 N ATOM 759 CA LEU A 53 -10.849 12.315 6.086 1.00 0.00 C ATOM 760 C LEU A 53 -10.342 10.877 6.073 1.00 0.00 C ATOM 761 O LEU A 53 -10.944 10.001 5.453 1.00 0.00 O ATOM 762 CB LEU A 53 -9.956 13.191 5.206 1.00 0.00 C ATOM 763 CG LEU A 53 -10.305 13.224 3.718 1.00 0.00 C ATOM 764 CD1 LEU A 53 -10.764 11.853 3.246 1.00 0.00 C ATOM 765 CD2 LEU A 53 -11.376 14.270 3.445 1.00 0.00 C ATOM 0 H LEU A 53 -10.117 13.465 7.680 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.864 12.326 5.688 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.990 14.211 5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -8.927 12.846 5.310 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.409 13.496 3.160 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.008 11.896 2.185 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.966 11.127 3.406 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.647 11.551 3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -11.612 14.280 2.381 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -12.274 14.028 4.014 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -11.010 15.252 3.744 1.00 0.00 H new ATOM 777 N GLY A 54 -9.232 10.640 6.764 1.00 0.00 N ATOM 778 CA GLY A 54 -8.663 9.305 6.821 1.00 0.00 C ATOM 779 C GLY A 54 -9.621 8.292 7.416 1.00 0.00 C ATOM 780 O GLY A 54 -9.560 7.106 7.094 1.00 0.00 O ATOM 0 H GLY A 54 -8.716 11.348 7.286 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -8.383 8.989 5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -7.749 9.328 7.414 1.00 0.00 H new ATOM 784 N ALA A 55 -10.507 8.760 8.289 1.00 0.00 N ATOM 785 CA ALA A 55 -11.482 7.887 8.931 1.00 0.00 C ATOM 786 C ALA A 55 -12.490 7.352 7.919 1.00 0.00 C ATOM 787 O ALA A 55 -12.978 6.228 8.050 1.00 0.00 O ATOM 788 CB ALA A 55 -12.198 8.627 10.051 1.00 0.00 C ATOM 0 H ALA A 55 -10.570 9.739 8.568 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.947 7.038 9.356 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.923 7.962 10.521 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.471 8.954 10.794 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.714 9.495 9.642 1.00 0.00 H new ATOM 794 N CYS A 56 -12.797 8.162 6.913 1.00 0.00 N ATOM 795 CA CYS A 56 -13.748 7.770 5.879 1.00 0.00 C ATOM 796 C CYS A 56 -13.296 6.493 5.179 1.00 0.00 C ATOM 797 O CYS A 56 -14.116 5.656 4.800 1.00 0.00 O ATOM 798 CB CYS A 56 -13.914 8.895 4.856 1.00 0.00 C ATOM 799 SG CYS A 56 -14.778 10.351 5.492 1.00 0.00 S ATOM 0 H CYS A 56 -12.402 9.094 6.791 1.00 0.00 H new ATOM 0 HA CYS A 56 -14.708 7.579 6.358 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -12.929 9.197 4.501 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -14.459 8.510 3.994 1.00 0.00 H new ATOM 0 HG CYS A 56 -14.056 10.916 6.414 1.00 0.00 H new ATOM 805 N PHE A 57 -11.986 6.349 5.010 1.00 0.00 N ATOM 806 CA PHE A 57 -11.424 5.175 4.354 1.00 0.00 C ATOM 807 C PHE A 57 -11.734 3.908 5.146 1.00 0.00 C ATOM 808 O PHE A 57 -11.710 3.910 6.377 1.00 0.00 O ATOM 809 CB PHE A 57 -9.910 5.330 4.192 1.00 0.00 C ATOM 810 CG PHE A 57 -9.518 6.256 3.076 1.00 0.00 C ATOM 811 CD1 PHE A 57 -9.364 7.614 3.307 1.00 0.00 C ATOM 812 CD2 PHE A 57 -9.303 5.769 1.797 1.00 0.00 C ATOM 813 CE1 PHE A 57 -9.005 8.468 2.282 1.00 0.00 C ATOM 814 CE2 PHE A 57 -8.943 6.619 0.768 1.00 0.00 C ATOM 815 CZ PHE A 57 -8.793 7.970 1.011 1.00 0.00 C ATOM 0 H PHE A 57 -11.293 7.031 5.319 1.00 0.00 H new ATOM 0 HA PHE A 57 -11.881 5.088 3.368 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.489 5.701 5.126 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.470 4.349 4.011 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -9.526 8.009 4.299 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.418 4.713 1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -8.890 9.525 2.474 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.779 6.227 -0.225 1.00 0.00 H new ATOM 0 HZ PHE A 57 -8.511 8.636 0.209 1.00 0.00 H new ATOM 825 N VAL A 58 -12.028 2.827 4.430 1.00 0.00 N ATOM 826 CA VAL A 58 -12.343 1.552 5.064 1.00 0.00 C ATOM 827 C VAL A 58 -11.439 0.441 4.543 1.00 0.00 C ATOM 828 O VAL A 58 -11.701 -0.146 3.493 1.00 0.00 O ATOM 829 CB VAL A 58 -13.813 1.157 4.829 1.00 0.00 C ATOM 830 CG1 VAL A 58 -14.128 -0.161 5.519 1.00 0.00 C ATOM 831 CG2 VAL A 58 -14.744 2.258 5.313 1.00 0.00 C ATOM 0 H VAL A 58 -12.055 2.809 3.411 1.00 0.00 H new ATOM 0 HA VAL A 58 -12.176 1.680 6.133 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.970 1.025 3.758 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -15.171 -0.424 5.342 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.483 -0.944 5.120 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -13.956 -0.061 6.591 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -15.779 1.962 5.139 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -14.588 2.424 6.379 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.533 3.178 4.768 1.00 0.00 H new ATOM 841 N PHE A 59 -10.374 0.155 5.285 1.00 0.00 N ATOM 842 CA PHE A 59 -9.430 -0.887 4.898 1.00 0.00 C ATOM 843 C PHE A 59 -9.796 -2.220 5.544 1.00 0.00 C ATOM 844 O PHE A 59 -10.035 -2.293 6.750 1.00 0.00 O ATOM 845 CB PHE A 59 -8.007 -0.488 5.295 1.00 0.00 C ATOM 846 CG PHE A 59 -7.405 0.556 4.399 1.00 0.00 C ATOM 847 CD1 PHE A 59 -7.741 1.892 4.547 1.00 0.00 C ATOM 848 CD2 PHE A 59 -6.503 0.202 3.408 1.00 0.00 C ATOM 849 CE1 PHE A 59 -7.189 2.855 3.724 1.00 0.00 C ATOM 850 CE2 PHE A 59 -5.948 1.160 2.582 1.00 0.00 C ATOM 851 CZ PHE A 59 -6.290 2.488 2.740 1.00 0.00 C ATOM 0 H PHE A 59 -10.143 0.630 6.158 1.00 0.00 H new ATOM 0 HA PHE A 59 -9.479 -1.003 3.815 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -8.015 -0.115 6.319 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -7.373 -1.375 5.283 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -8.442 2.184 5.314 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.231 -0.835 3.280 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.460 3.893 3.849 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.247 0.870 1.813 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.856 3.239 2.096 1.00 0.00 H new ATOM 861 N SER A 60 -9.838 -3.272 4.733 1.00 0.00 N ATOM 862 CA SER A 60 -10.179 -4.602 5.224 1.00 0.00 C ATOM 863 C SER A 60 -9.419 -5.677 4.454 1.00 0.00 C ATOM 864 O SER A 60 -8.920 -5.451 3.351 1.00 0.00 O ATOM 865 CB SER A 60 -11.685 -4.842 5.105 1.00 0.00 C ATOM 866 OG SER A 60 -12.359 -4.451 6.288 1.00 0.00 O ATOM 0 H SER A 60 -9.640 -3.229 3.733 1.00 0.00 H new ATOM 0 HA SER A 60 -9.891 -4.659 6.274 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.079 -4.283 4.256 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.874 -5.897 4.907 1.00 0.00 H new ATOM 0 HG SER A 60 -11.852 -3.740 6.734 1.00 0.00 H new ATOM 872 N PRO A 61 -9.326 -6.876 5.047 1.00 0.00 N ATOM 873 CA PRO A 61 -9.915 -7.157 6.360 1.00 0.00 C ATOM 874 C PRO A 61 -9.188 -6.433 7.488 1.00 0.00 C ATOM 875 O PRO A 61 -7.958 -6.367 7.507 1.00 0.00 O ATOM 876 CB PRO A 61 -9.753 -8.672 6.505 1.00 0.00 C ATOM 877 CG PRO A 61 -8.592 -9.014 5.637 1.00 0.00 C ATOM 878 CD PRO A 61 -8.640 -8.051 4.483 1.00 0.00 C ATOM 0 HA PRO A 61 -10.949 -6.817 6.424 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.568 -8.953 7.542 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.653 -9.198 6.188 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -7.654 -8.920 6.185 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -8.656 -10.045 5.288 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.641 -7.800 4.127 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.185 -8.466 3.636 1.00 0.00 H new ATOM 886 N LYS A 62 -9.954 -5.891 8.429 1.00 0.00 N ATOM 887 CA LYS A 62 -9.384 -5.173 9.562 1.00 0.00 C ATOM 888 C LYS A 62 -8.087 -5.830 10.025 1.00 0.00 C ATOM 889 O LYS A 62 -7.172 -5.155 10.494 1.00 0.00 O ATOM 890 CB LYS A 62 -10.385 -5.125 10.718 1.00 0.00 C ATOM 891 CG LYS A 62 -11.007 -6.473 11.041 1.00 0.00 C ATOM 892 CD LYS A 62 -11.401 -6.568 12.505 1.00 0.00 C ATOM 893 CE LYS A 62 -11.578 -8.015 12.942 1.00 0.00 C ATOM 894 NZ LYS A 62 -12.502 -8.135 14.103 1.00 0.00 N ATOM 0 H LYS A 62 -10.973 -5.936 8.429 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.161 -4.156 9.241 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.882 -4.744 11.607 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.178 -4.418 10.472 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.886 -6.628 10.416 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -10.301 -7.268 10.801 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.637 -6.092 13.120 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -12.329 -6.021 12.669 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.964 -8.601 12.108 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.608 -8.436 13.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.596 -9.136 14.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.121 -7.596 14.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.436 -7.757 13.844 1.00 0.00 H new ATOM 908 N GLU A 63 -8.017 -7.151 9.889 1.00 0.00 N ATOM 909 CA GLU A 63 -6.831 -7.898 10.294 1.00 0.00 C ATOM 910 C GLU A 63 -6.822 -9.287 9.662 1.00 0.00 C ATOM 911 O GLU A 63 -7.771 -9.680 8.985 1.00 0.00 O ATOM 912 CB GLU A 63 -6.773 -8.018 11.818 1.00 0.00 C ATOM 913 CG GLU A 63 -7.635 -9.139 12.373 1.00 0.00 C ATOM 914 CD GLU A 63 -6.897 -10.462 12.447 1.00 0.00 C ATOM 915 OE1 GLU A 63 -5.652 -10.440 12.544 1.00 0.00 O ATOM 916 OE2 GLU A 63 -7.563 -11.517 12.407 1.00 0.00 O ATOM 0 H GLU A 63 -8.766 -7.725 9.502 1.00 0.00 H new ATOM 0 HA GLU A 63 -5.953 -7.354 9.946 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -5.739 -8.181 12.122 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -7.090 -7.074 12.261 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -7.983 -8.865 13.369 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -8.520 -9.256 11.747 1.00 0.00 H new ATOM 923 N GLY A 64 -5.739 -10.026 9.887 1.00 0.00 N ATOM 924 CA GLY A 64 -5.625 -11.362 9.333 1.00 0.00 C ATOM 925 C GLY A 64 -4.189 -11.743 9.032 1.00 0.00 C ATOM 926 O GLY A 64 -3.265 -10.982 9.317 1.00 0.00 O ATOM 0 H GLY A 64 -4.939 -9.723 10.443 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -6.049 -12.080 10.034 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -6.214 -11.424 8.418 1.00 0.00 H new ATOM 930 N ILE A 65 -4.002 -12.925 8.454 1.00 0.00 N ATOM 931 CA ILE A 65 -2.668 -13.406 8.115 1.00 0.00 C ATOM 932 C ILE A 65 -2.538 -13.653 6.616 1.00 0.00 C ATOM 933 O ILE A 65 -3.482 -14.106 5.967 1.00 0.00 O ATOM 934 CB ILE A 65 -2.329 -14.705 8.869 1.00 0.00 C ATOM 935 CG1 ILE A 65 -2.572 -14.527 10.370 1.00 0.00 C ATOM 936 CG2 ILE A 65 -0.886 -15.109 8.606 1.00 0.00 C ATOM 937 CD1 ILE A 65 -3.975 -14.893 10.801 1.00 0.00 C ATOM 0 H ILE A 65 -4.757 -13.567 8.211 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.966 -12.628 8.415 1.00 0.00 H new ATOM 0 HB ILE A 65 -2.981 -15.499 8.505 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.859 -15.141 10.921 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.376 -13.490 10.641 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -0.662 -16.029 9.146 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.742 -15.271 7.538 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.219 -14.317 8.946 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.076 -14.743 11.876 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -4.693 -14.262 10.277 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.168 -15.939 10.561 1.00 0.00 H new ATOM 949 N ILE A 66 -1.363 -13.356 6.072 1.00 0.00 N ATOM 950 CA ILE A 66 -1.108 -13.549 4.650 1.00 0.00 C ATOM 951 C ILE A 66 -0.223 -14.767 4.410 1.00 0.00 C ATOM 952 O ILE A 66 0.981 -14.730 4.662 1.00 0.00 O ATOM 953 CB ILE A 66 -0.439 -12.311 4.025 1.00 0.00 C ATOM 954 CG1 ILE A 66 -1.298 -11.067 4.258 1.00 0.00 C ATOM 955 CG2 ILE A 66 -0.207 -12.529 2.537 1.00 0.00 C ATOM 956 CD1 ILE A 66 -0.714 -9.807 3.659 1.00 0.00 C ATOM 0 H ILE A 66 -0.572 -12.980 6.595 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.076 -13.708 4.175 1.00 0.00 H new ATOM 0 HB ILE A 66 0.527 -12.158 4.506 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.288 -11.235 3.835 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.430 -10.922 5.330 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.266 -11.645 2.109 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.441 -13.394 2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.162 -12.705 2.042 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -1.377 -8.966 3.863 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.264 -9.614 4.100 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.608 -9.932 2.581 1.00 0.00 H new ATOM 968 N GLU A 67 -0.828 -15.845 3.921 1.00 0.00 N ATOM 969 CA GLU A 67 -0.094 -17.074 3.646 1.00 0.00 C ATOM 970 C GLU A 67 1.312 -16.766 3.140 1.00 0.00 C ATOM 971 O GLU A 67 1.550 -15.768 2.460 1.00 0.00 O ATOM 972 CB GLU A 67 -0.843 -17.923 2.617 1.00 0.00 C ATOM 973 CG GLU A 67 -1.261 -17.149 1.378 1.00 0.00 C ATOM 974 CD GLU A 67 -2.490 -16.292 1.612 1.00 0.00 C ATOM 975 OE1 GLU A 67 -3.614 -16.804 1.426 1.00 0.00 O ATOM 976 OE2 GLU A 67 -2.327 -15.110 1.981 1.00 0.00 O ATOM 0 H GLU A 67 -1.824 -15.892 3.707 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.012 -17.634 4.578 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.210 -18.758 2.317 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.730 -18.348 3.086 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.436 -16.514 1.056 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.460 -17.849 0.567 1.00 0.00 H new ATOM 983 N PRO A 68 2.269 -17.643 3.481 1.00 0.00 N ATOM 984 CA PRO A 68 3.668 -17.487 3.072 1.00 0.00 C ATOM 985 C PRO A 68 3.863 -17.706 1.576 1.00 0.00 C ATOM 986 O PRO A 68 3.319 -18.649 1.001 1.00 0.00 O ATOM 987 CB PRO A 68 4.394 -18.573 3.871 1.00 0.00 C ATOM 988 CG PRO A 68 3.353 -19.603 4.141 1.00 0.00 C ATOM 989 CD PRO A 68 2.057 -18.855 4.290 1.00 0.00 C ATOM 0 HA PRO A 68 4.038 -16.479 3.262 1.00 0.00 H new ATOM 0 HB2 PRO A 68 5.227 -18.991 3.305 1.00 0.00 H new ATOM 0 HB3 PRO A 68 4.806 -18.174 4.798 1.00 0.00 H new ATOM 0 HG2 PRO A 68 3.296 -20.323 3.325 1.00 0.00 H new ATOM 0 HG3 PRO A 68 3.585 -20.165 5.046 1.00 0.00 H new ATOM 0 HD2 PRO A 68 1.212 -19.439 3.926 1.00 0.00 H new ATOM 0 HD3 PRO A 68 1.851 -18.612 5.332 1.00 0.00 H new ATOM 997 N SER A 69 4.641 -16.829 0.951 1.00 0.00 N ATOM 998 CA SER A 69 4.905 -16.925 -0.481 1.00 0.00 C ATOM 999 C SER A 69 3.619 -16.752 -1.283 1.00 0.00 C ATOM 1000 O SER A 69 3.455 -17.343 -2.349 1.00 0.00 O ATOM 1001 CB SER A 69 5.550 -18.272 -0.812 1.00 0.00 C ATOM 1002 OG SER A 69 6.806 -18.409 -0.171 1.00 0.00 O ATOM 0 H SER A 69 5.100 -16.044 1.413 1.00 0.00 H new ATOM 0 HA SER A 69 5.592 -16.124 -0.754 1.00 0.00 H new ATOM 0 HB2 SER A 69 4.889 -19.081 -0.500 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.677 -18.362 -1.891 1.00 0.00 H new ATOM 0 HG SER A 69 7.196 -19.279 -0.398 1.00 0.00 H new ATOM 1008 N GLY A 70 2.708 -15.937 -0.760 1.00 0.00 N ATOM 1009 CA GLY A 70 1.447 -15.701 -1.440 1.00 0.00 C ATOM 1010 C GLY A 70 1.072 -14.232 -1.471 1.00 0.00 C ATOM 1011 O GLY A 70 1.942 -13.363 -1.512 1.00 0.00 O ATOM 0 H GLY A 70 2.820 -15.436 0.122 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.512 -16.078 -2.461 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.658 -16.264 -0.942 1.00 0.00 H new ATOM 1015 N VAL A 71 -0.227 -13.954 -1.453 1.00 0.00 N ATOM 1016 CA VAL A 71 -0.716 -12.581 -1.480 1.00 0.00 C ATOM 1017 C VAL A 71 -2.027 -12.449 -0.712 1.00 0.00 C ATOM 1018 O VAL A 71 -2.567 -13.435 -0.213 1.00 0.00 O ATOM 1019 CB VAL A 71 -0.928 -12.089 -2.924 1.00 0.00 C ATOM 1020 CG1 VAL A 71 0.399 -12.018 -3.664 1.00 0.00 C ATOM 1021 CG2 VAL A 71 -1.908 -12.994 -3.656 1.00 0.00 C ATOM 0 H VAL A 71 -0.961 -14.662 -1.420 1.00 0.00 H new ATOM 0 HA VAL A 71 0.045 -11.965 -1.002 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.351 -11.085 -2.889 1.00 0.00 H new ATOM 0 HG11 VAL A 71 0.229 -11.668 -4.682 1.00 0.00 H new ATOM 0 HG12 VAL A 71 1.066 -11.326 -3.149 1.00 0.00 H new ATOM 0 HG13 VAL A 71 0.854 -13.008 -3.691 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.046 -12.632 -4.675 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.515 -14.010 -3.682 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.866 -12.989 -3.136 1.00 0.00 H new ATOM 1031 N GLN A 72 -2.532 -11.223 -0.623 1.00 0.00 N ATOM 1032 CA GLN A 72 -3.780 -10.962 0.085 1.00 0.00 C ATOM 1033 C GLN A 72 -4.447 -9.694 -0.438 1.00 0.00 C ATOM 1034 O GLN A 72 -3.854 -8.616 -0.419 1.00 0.00 O ATOM 1035 CB GLN A 72 -3.522 -10.834 1.587 1.00 0.00 C ATOM 1036 CG GLN A 72 -4.764 -10.480 2.390 1.00 0.00 C ATOM 1037 CD GLN A 72 -5.821 -11.565 2.339 1.00 0.00 C ATOM 1038 OE1 GLN A 72 -5.531 -12.742 2.559 1.00 0.00 O ATOM 1039 NE2 GLN A 72 -7.056 -11.175 2.047 1.00 0.00 N ATOM 0 H GLN A 72 -2.097 -10.396 -1.032 1.00 0.00 H new ATOM 0 HA GLN A 72 -4.451 -11.803 -0.091 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.115 -11.774 1.959 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.762 -10.070 1.753 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.482 -10.301 3.428 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.185 -9.550 2.009 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -7.252 -10.189 1.872 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -7.809 -11.861 1.998 1.00 0.00 H new ATOM 1048 N ALA A 73 -5.684 -9.831 -0.904 1.00 0.00 N ATOM 1049 CA ALA A 73 -6.432 -8.696 -1.431 1.00 0.00 C ATOM 1050 C ALA A 73 -6.946 -7.807 -0.304 1.00 0.00 C ATOM 1051 O ALA A 73 -7.544 -8.291 0.658 1.00 0.00 O ATOM 1052 CB ALA A 73 -7.589 -9.181 -2.292 1.00 0.00 C ATOM 0 H ALA A 73 -6.189 -10.717 -0.927 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.757 -8.103 -2.048 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.139 -8.323 -2.679 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -7.202 -9.769 -3.124 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.256 -9.799 -1.691 1.00 0.00 H new ATOM 1058 N ILE A 74 -6.708 -6.505 -0.428 1.00 0.00 N ATOM 1059 CA ILE A 74 -7.147 -5.549 0.581 1.00 0.00 C ATOM 1060 C ILE A 74 -8.252 -4.649 0.040 1.00 0.00 C ATOM 1061 O ILE A 74 -8.057 -3.931 -0.941 1.00 0.00 O ATOM 1062 CB ILE A 74 -5.980 -4.673 1.071 1.00 0.00 C ATOM 1063 CG1 ILE A 74 -4.842 -5.549 1.599 1.00 0.00 C ATOM 1064 CG2 ILE A 74 -6.457 -3.709 2.148 1.00 0.00 C ATOM 1065 CD1 ILE A 74 -5.019 -5.963 3.043 1.00 0.00 C ATOM 0 H ILE A 74 -6.214 -6.089 -1.217 1.00 0.00 H new ATOM 0 HA ILE A 74 -7.532 -6.129 1.420 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.604 -4.091 0.230 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -4.765 -6.443 0.980 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.901 -5.009 1.497 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.621 -3.096 2.484 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.237 -3.066 1.741 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.855 -4.274 2.991 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -4.176 -6.582 3.350 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -5.066 -5.075 3.673 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -5.943 -6.531 3.148 1.00 0.00 H new ATOM 1077 N GLN A 75 -9.412 -4.690 0.688 1.00 0.00 N ATOM 1078 CA GLN A 75 -10.549 -3.877 0.272 1.00 0.00 C ATOM 1079 C GLN A 75 -10.427 -2.456 0.812 1.00 0.00 C ATOM 1080 O GLN A 75 -10.409 -2.242 2.025 1.00 0.00 O ATOM 1081 CB GLN A 75 -11.857 -4.507 0.752 1.00 0.00 C ATOM 1082 CG GLN A 75 -12.235 -5.772 -0.002 1.00 0.00 C ATOM 1083 CD GLN A 75 -12.427 -5.531 -1.486 1.00 0.00 C ATOM 1084 OE1 GLN A 75 -13.350 -4.827 -1.898 1.00 0.00 O ATOM 1085 NE2 GLN A 75 -11.555 -6.116 -2.299 1.00 0.00 N ATOM 0 H GLN A 75 -9.589 -5.277 1.503 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.554 -3.834 -0.817 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.771 -4.739 1.814 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.661 -3.778 0.649 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -11.458 -6.523 0.143 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.154 -6.180 0.418 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.805 -6.691 -1.914 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.635 -5.990 -3.308 1.00 0.00 H new ATOM 1094 N ILE A 76 -10.343 -1.488 -0.095 1.00 0.00 N ATOM 1095 CA ILE A 76 -10.224 -0.088 0.291 1.00 0.00 C ATOM 1096 C ILE A 76 -11.389 0.733 -0.251 1.00 0.00 C ATOM 1097 O ILE A 76 -11.473 0.992 -1.452 1.00 0.00 O ATOM 1098 CB ILE A 76 -8.902 0.524 -0.210 1.00 0.00 C ATOM 1099 CG1 ILE A 76 -7.720 -0.356 0.201 1.00 0.00 C ATOM 1100 CG2 ILE A 76 -8.733 1.935 0.332 1.00 0.00 C ATOM 1101 CD1 ILE A 76 -6.511 -0.200 -0.695 1.00 0.00 C ATOM 0 H ILE A 76 -10.355 -1.648 -1.102 1.00 0.00 H new ATOM 0 HA ILE A 76 -10.238 -0.059 1.381 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.931 0.575 -1.298 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -7.437 -0.115 1.225 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.035 -1.400 0.195 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.794 2.354 -0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -9.562 2.556 -0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -8.721 1.907 1.422 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.712 -0.853 -0.345 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.778 -0.469 -1.717 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.171 0.835 -0.670 1.00 0.00 H new ATOM 1113 N SER A 77 -12.285 1.140 0.642 1.00 0.00 N ATOM 1114 CA SER A 77 -13.447 1.931 0.253 1.00 0.00 C ATOM 1115 C SER A 77 -13.348 3.350 0.803 1.00 0.00 C ATOM 1116 O SER A 77 -13.157 3.551 2.003 1.00 0.00 O ATOM 1117 CB SER A 77 -14.732 1.267 0.751 1.00 0.00 C ATOM 1118 OG SER A 77 -15.867 1.779 0.073 1.00 0.00 O ATOM 0 H SER A 77 -12.229 0.935 1.640 1.00 0.00 H new ATOM 0 HA SER A 77 -13.472 1.983 -0.835 1.00 0.00 H new ATOM 0 HB2 SER A 77 -14.670 0.189 0.600 1.00 0.00 H new ATOM 0 HB3 SER A 77 -14.839 1.433 1.823 1.00 0.00 H new ATOM 0 HG SER A 77 -16.675 1.337 0.408 1.00 0.00 H new ATOM 1124 N PHE A 78 -13.480 4.332 -0.082 1.00 0.00 N ATOM 1125 CA PHE A 78 -13.404 5.734 0.314 1.00 0.00 C ATOM 1126 C PHE A 78 -14.700 6.465 -0.023 1.00 0.00 C ATOM 1127 O PHE A 78 -15.257 6.296 -1.108 1.00 0.00 O ATOM 1128 CB PHE A 78 -12.224 6.418 -0.379 1.00 0.00 C ATOM 1129 CG PHE A 78 -12.265 7.917 -0.291 1.00 0.00 C ATOM 1130 CD1 PHE A 78 -12.570 8.546 0.905 1.00 0.00 C ATOM 1131 CD2 PHE A 78 -11.999 8.697 -1.405 1.00 0.00 C ATOM 1132 CE1 PHE A 78 -12.608 9.925 0.990 1.00 0.00 C ATOM 1133 CE2 PHE A 78 -12.035 10.077 -1.326 1.00 0.00 C ATOM 1134 CZ PHE A 78 -12.341 10.691 -0.128 1.00 0.00 C ATOM 0 H PHE A 78 -13.640 4.183 -1.078 1.00 0.00 H new ATOM 0 HA PHE A 78 -13.255 5.774 1.393 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -11.295 6.061 0.066 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -12.209 6.124 -1.428 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -12.781 7.952 1.782 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -11.761 8.222 -2.345 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -12.846 10.403 1.929 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -11.824 10.674 -2.201 1.00 0.00 H new ATOM 0 HZ PHE A 78 -12.372 11.769 -0.065 1.00 0.00 H new ATOM 1144 N SER A 79 -15.175 7.278 0.915 1.00 0.00 N ATOM 1145 CA SER A 79 -16.408 8.032 0.720 1.00 0.00 C ATOM 1146 C SER A 79 -16.437 9.267 1.615 1.00 0.00 C ATOM 1147 O SER A 79 -16.338 9.164 2.838 1.00 0.00 O ATOM 1148 CB SER A 79 -17.623 7.148 1.012 1.00 0.00 C ATOM 1149 OG SER A 79 -17.924 7.137 2.397 1.00 0.00 O ATOM 0 H SER A 79 -14.725 7.431 1.817 1.00 0.00 H new ATOM 0 HA SER A 79 -16.445 8.357 -0.320 1.00 0.00 H new ATOM 0 HB2 SER A 79 -18.485 7.512 0.452 1.00 0.00 H new ATOM 0 HB3 SER A 79 -17.428 6.131 0.671 1.00 0.00 H new ATOM 0 HG SER A 79 -17.196 7.566 2.893 1.00 0.00 H new ATOM 1155 N SER A 80 -16.573 10.435 0.996 1.00 0.00 N ATOM 1156 CA SER A 80 -16.610 11.692 1.735 1.00 0.00 C ATOM 1157 C SER A 80 -17.211 12.806 0.883 1.00 0.00 C ATOM 1158 O SER A 80 -17.456 12.625 -0.311 1.00 0.00 O ATOM 1159 CB SER A 80 -15.203 12.084 2.188 1.00 0.00 C ATOM 1160 OG SER A 80 -15.247 12.879 3.361 1.00 0.00 O ATOM 0 H SER A 80 -16.659 10.537 -0.015 1.00 0.00 H new ATOM 0 HA SER A 80 -17.240 11.550 2.613 1.00 0.00 H new ATOM 0 HB2 SER A 80 -14.615 11.186 2.376 1.00 0.00 H new ATOM 0 HB3 SER A 80 -14.701 12.633 1.391 1.00 0.00 H new ATOM 0 HG SER A 80 -15.126 12.308 4.148 1.00 0.00 H new ATOM 1166 N ILE A 81 -17.446 13.956 1.504 1.00 0.00 N ATOM 1167 CA ILE A 81 -18.017 15.100 0.803 1.00 0.00 C ATOM 1168 C ILE A 81 -17.134 16.334 0.954 1.00 0.00 C ATOM 1169 O ILE A 81 -17.510 17.432 0.543 1.00 0.00 O ATOM 1170 CB ILE A 81 -19.431 15.427 1.318 1.00 0.00 C ATOM 1171 CG1 ILE A 81 -19.438 15.492 2.847 1.00 0.00 C ATOM 1172 CG2 ILE A 81 -20.428 14.392 0.821 1.00 0.00 C ATOM 1173 CD1 ILE A 81 -20.561 16.334 3.410 1.00 0.00 C ATOM 0 H ILE A 81 -17.250 14.121 2.491 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.077 14.827 -0.250 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.727 16.402 0.931 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -19.518 14.481 3.245 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -18.485 15.895 3.190 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -21.423 14.637 1.193 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -20.439 14.391 -0.269 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -20.138 13.405 1.182 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -20.504 16.335 4.499 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -20.470 17.356 3.041 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -21.519 15.919 3.097 1.00 0.00 H new ATOM 1185 N ILE A 82 -15.959 16.145 1.545 1.00 0.00 N ATOM 1186 CA ILE A 82 -15.021 17.243 1.747 1.00 0.00 C ATOM 1187 C ILE A 82 -14.158 17.464 0.509 1.00 0.00 C ATOM 1188 O ILE A 82 -13.065 16.908 0.393 1.00 0.00 O ATOM 1189 CB ILE A 82 -14.105 16.985 2.958 1.00 0.00 C ATOM 1190 CG1 ILE A 82 -14.937 16.856 4.236 1.00 0.00 C ATOM 1191 CG2 ILE A 82 -13.082 18.102 3.096 1.00 0.00 C ATOM 1192 CD1 ILE A 82 -14.229 16.109 5.345 1.00 0.00 C ATOM 0 H ILE A 82 -15.634 15.243 1.892 1.00 0.00 H new ATOM 0 HA ILE A 82 -15.617 18.136 1.936 1.00 0.00 H new ATOM 0 HB ILE A 82 -13.571 16.048 2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -15.200 17.852 4.591 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -15.870 16.344 4.002 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.442 17.905 3.956 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -12.472 18.150 2.194 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -13.597 19.052 3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -14.877 16.056 6.220 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -13.990 15.100 5.009 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -13.309 16.632 5.607 1.00 0.00 H new ATOM 1204 N LEU A 83 -14.655 18.281 -0.413 1.00 0.00 N ATOM 1205 CA LEU A 83 -13.929 18.579 -1.642 1.00 0.00 C ATOM 1206 C LEU A 83 -12.531 19.106 -1.335 1.00 0.00 C ATOM 1207 O LEU A 83 -12.254 19.547 -0.221 1.00 0.00 O ATOM 1208 CB LEU A 83 -14.700 19.602 -2.478 1.00 0.00 C ATOM 1209 CG LEU A 83 -16.171 19.280 -2.744 1.00 0.00 C ATOM 1210 CD1 LEU A 83 -16.858 20.450 -3.430 1.00 0.00 C ATOM 1211 CD2 LEU A 83 -16.297 18.018 -3.586 1.00 0.00 C ATOM 0 H LEU A 83 -15.558 18.749 -0.333 1.00 0.00 H new ATOM 0 HA LEU A 83 -13.832 17.654 -2.210 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.645 20.567 -1.975 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -14.194 19.713 -3.437 1.00 0.00 H new ATOM 0 HG LEU A 83 -16.663 19.106 -1.787 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -17.904 20.202 -3.611 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -16.799 21.332 -2.792 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -16.364 20.656 -4.380 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -17.351 17.804 -3.765 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -15.789 18.164 -4.539 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -15.842 17.181 -3.057 1.00 0.00 H new ATOM 1223 N GLY A 84 -11.654 19.059 -2.333 1.00 0.00 N ATOM 1224 CA GLY A 84 -10.296 19.536 -2.150 1.00 0.00 C ATOM 1225 C GLY A 84 -9.302 18.405 -1.978 1.00 0.00 C ATOM 1226 O GLY A 84 -9.602 17.398 -1.339 1.00 0.00 O ATOM 0 H GLY A 84 -11.860 18.699 -3.265 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.008 20.141 -3.010 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -10.257 20.186 -1.276 1.00 0.00 H new ATOM 1230 N ASN A 85 -8.113 18.571 -2.550 1.00 0.00 N ATOM 1231 CA ASN A 85 -7.072 17.554 -2.458 1.00 0.00 C ATOM 1232 C ASN A 85 -6.901 17.079 -1.018 1.00 0.00 C ATOM 1233 O ASN A 85 -7.215 17.803 -0.073 1.00 0.00 O ATOM 1234 CB ASN A 85 -5.746 18.103 -2.987 1.00 0.00 C ATOM 1235 CG ASN A 85 -5.354 19.409 -2.322 1.00 0.00 C ATOM 1236 OD1 ASN A 85 -6.064 20.410 -2.429 1.00 0.00 O ATOM 1237 ND2 ASN A 85 -4.220 19.404 -1.632 1.00 0.00 N ATOM 0 H ASN A 85 -7.847 19.400 -3.082 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.375 16.703 -3.069 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.960 17.366 -2.825 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -5.823 18.255 -4.064 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.905 20.253 -1.163 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -3.664 18.551 -1.571 1.00 0.00 H new ATOM 1244 N PHE A 86 -6.400 15.859 -0.859 1.00 0.00 N ATOM 1245 CA PHE A 86 -6.187 15.287 0.465 1.00 0.00 C ATOM 1246 C PHE A 86 -5.087 14.229 0.430 1.00 0.00 C ATOM 1247 O PHE A 86 -5.067 13.369 -0.450 1.00 0.00 O ATOM 1248 CB PHE A 86 -7.485 14.672 0.993 1.00 0.00 C ATOM 1249 CG PHE A 86 -7.848 13.375 0.328 1.00 0.00 C ATOM 1250 CD1 PHE A 86 -7.119 12.224 0.580 1.00 0.00 C ATOM 1251 CD2 PHE A 86 -8.918 13.307 -0.549 1.00 0.00 C ATOM 1252 CE1 PHE A 86 -7.451 11.030 -0.031 1.00 0.00 C ATOM 1253 CE2 PHE A 86 -9.255 12.115 -1.163 1.00 0.00 C ATOM 1254 CZ PHE A 86 -8.521 10.975 -0.903 1.00 0.00 C ATOM 0 H PHE A 86 -6.134 15.247 -1.631 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.875 16.089 1.134 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -7.389 14.506 2.066 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -8.299 15.384 0.852 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -6.282 12.260 1.262 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -9.496 14.196 -0.756 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -6.874 10.140 0.173 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.091 12.076 -1.845 1.00 0.00 H new ATOM 0 HZ PHE A 86 -8.783 10.042 -1.380 1.00 0.00 H new ATOM 1264 N GLU A 87 -4.174 14.301 1.394 1.00 0.00 N ATOM 1265 CA GLU A 87 -3.071 13.351 1.473 1.00 0.00 C ATOM 1266 C GLU A 87 -3.005 12.707 2.854 1.00 0.00 C ATOM 1267 O GLU A 87 -2.850 13.393 3.863 1.00 0.00 O ATOM 1268 CB GLU A 87 -1.745 14.049 1.159 1.00 0.00 C ATOM 1269 CG GLU A 87 -0.628 13.090 0.783 1.00 0.00 C ATOM 1270 CD GLU A 87 0.749 13.690 0.991 1.00 0.00 C ATOM 1271 OE1 GLU A 87 1.014 14.199 2.100 1.00 0.00 O ATOM 1272 OE2 GLU A 87 1.563 13.649 0.044 1.00 0.00 O ATOM 0 H GLU A 87 -4.177 15.007 2.130 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.246 12.568 0.735 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.899 14.753 0.341 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.436 14.631 2.027 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.718 12.181 1.378 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.740 12.799 -0.262 1.00 0.00 H new ATOM 1279 N GLU A 88 -3.125 11.383 2.890 1.00 0.00 N ATOM 1280 CA GLU A 88 -3.081 10.646 4.147 1.00 0.00 C ATOM 1281 C GLU A 88 -2.060 9.514 4.078 1.00 0.00 C ATOM 1282 O GLU A 88 -1.764 8.997 3.002 1.00 0.00 O ATOM 1283 CB GLU A 88 -4.463 10.082 4.482 1.00 0.00 C ATOM 1284 CG GLU A 88 -5.597 11.062 4.234 1.00 0.00 C ATOM 1285 CD GLU A 88 -6.937 10.373 4.064 1.00 0.00 C ATOM 1286 OE1 GLU A 88 -6.952 9.209 3.611 1.00 0.00 O ATOM 1287 OE2 GLU A 88 -7.971 10.997 4.383 1.00 0.00 O ATOM 0 H GLU A 88 -3.253 10.800 2.063 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.779 11.337 4.934 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.633 9.184 3.888 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.478 9.779 5.529 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.656 11.762 5.067 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.378 11.647 3.341 1.00 0.00 H new ATOM 1294 N GLU A 89 -1.527 9.135 5.236 1.00 0.00 N ATOM 1295 CA GLU A 89 -0.538 8.065 5.306 1.00 0.00 C ATOM 1296 C GLU A 89 -1.007 6.952 6.239 1.00 0.00 C ATOM 1297 O GLU A 89 -1.081 7.136 7.455 1.00 0.00 O ATOM 1298 CB GLU A 89 0.807 8.614 5.785 1.00 0.00 C ATOM 1299 CG GLU A 89 1.596 9.325 4.698 1.00 0.00 C ATOM 1300 CD GLU A 89 2.555 10.360 5.255 1.00 0.00 C ATOM 1301 OE1 GLU A 89 3.662 9.973 5.685 1.00 0.00 O ATOM 1302 OE2 GLU A 89 2.198 11.556 5.260 1.00 0.00 O ATOM 0 H GLU A 89 -1.763 9.552 6.136 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.417 7.650 4.305 1.00 0.00 H new ATOM 0 HB2 GLU A 89 0.635 9.306 6.609 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.406 7.793 6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.156 8.589 4.121 1.00 0.00 H new ATOM 0 HG3 GLU A 89 0.904 9.810 4.010 1.00 0.00 H new ATOM 1309 N PHE A 90 -1.323 5.798 5.662 1.00 0.00 N ATOM 1310 CA PHE A 90 -1.786 4.655 6.440 1.00 0.00 C ATOM 1311 C PHE A 90 -0.629 3.715 6.768 1.00 0.00 C ATOM 1312 O PHE A 90 0.340 3.619 6.013 1.00 0.00 O ATOM 1313 CB PHE A 90 -2.873 3.897 5.676 1.00 0.00 C ATOM 1314 CG PHE A 90 -3.991 4.777 5.193 1.00 0.00 C ATOM 1315 CD1 PHE A 90 -3.877 5.470 3.998 1.00 0.00 C ATOM 1316 CD2 PHE A 90 -5.154 4.911 5.933 1.00 0.00 C ATOM 1317 CE1 PHE A 90 -4.904 6.281 3.551 1.00 0.00 C ATOM 1318 CE2 PHE A 90 -6.184 5.720 5.490 1.00 0.00 C ATOM 1319 CZ PHE A 90 -6.058 6.406 4.298 1.00 0.00 C ATOM 0 H PHE A 90 -1.267 5.629 4.658 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.203 5.029 7.375 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.421 3.394 4.821 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.285 3.121 6.321 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.976 5.376 3.410 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.257 4.378 6.866 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.803 6.816 2.618 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.086 5.815 6.076 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.861 7.039 3.951 1.00 0.00 H new ATOM 1329 N LEU A 91 -0.738 3.025 7.897 1.00 0.00 N ATOM 1330 CA LEU A 91 0.299 2.092 8.326 1.00 0.00 C ATOM 1331 C LEU A 91 -0.296 0.722 8.637 1.00 0.00 C ATOM 1332 O LEU A 91 -1.459 0.612 9.024 1.00 0.00 O ATOM 1333 CB LEU A 91 1.024 2.637 9.558 1.00 0.00 C ATOM 1334 CG LEU A 91 1.755 3.967 9.373 1.00 0.00 C ATOM 1335 CD1 LEU A 91 2.545 4.320 10.624 1.00 0.00 C ATOM 1336 CD2 LEU A 91 2.672 3.908 8.160 1.00 0.00 C ATOM 0 H LEU A 91 -1.533 3.093 8.532 1.00 0.00 H new ATOM 0 HA LEU A 91 1.014 1.981 7.510 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.296 2.754 10.361 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.747 1.891 9.889 1.00 0.00 H new ATOM 0 HG LEU A 91 1.013 4.747 9.204 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.059 5.270 10.474 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.865 4.405 11.472 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.278 3.539 10.824 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.184 4.863 8.044 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.408 3.116 8.299 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.082 3.702 7.267 1.00 0.00 H new ATOM 1348 N VAL A 92 0.511 -0.320 8.465 1.00 0.00 N ATOM 1349 CA VAL A 92 0.066 -1.683 8.730 1.00 0.00 C ATOM 1350 C VAL A 92 0.935 -2.348 9.791 1.00 0.00 C ATOM 1351 O VAL A 92 2.134 -2.539 9.596 1.00 0.00 O ATOM 1352 CB VAL A 92 0.091 -2.540 7.450 1.00 0.00 C ATOM 1353 CG1 VAL A 92 -0.359 -3.961 7.751 1.00 0.00 C ATOM 1354 CG2 VAL A 92 -0.779 -1.913 6.372 1.00 0.00 C ATOM 0 H VAL A 92 1.476 -0.246 8.143 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.959 -1.617 9.094 1.00 0.00 H new ATOM 0 HB VAL A 92 1.115 -2.580 7.080 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.335 -4.552 6.835 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.310 -4.406 8.488 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.375 -3.945 8.146 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.749 -2.532 5.475 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.806 -1.841 6.730 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.406 -0.916 6.138 1.00 0.00 H new ATOM 1364 N ASN A 93 0.320 -2.700 10.916 1.00 0.00 N ATOM 1365 CA ASN A 93 1.038 -3.345 12.010 1.00 0.00 C ATOM 1366 C ASN A 93 1.401 -4.782 11.649 1.00 0.00 C ATOM 1367 O ASN A 93 0.619 -5.492 11.018 1.00 0.00 O ATOM 1368 CB ASN A 93 0.191 -3.325 13.284 1.00 0.00 C ATOM 1369 CG ASN A 93 -0.033 -1.920 13.808 1.00 0.00 C ATOM 1370 OD1 ASN A 93 0.915 -1.159 14.001 1.00 0.00 O ATOM 1371 ND2 ASN A 93 -1.293 -1.569 14.040 1.00 0.00 N ATOM 0 H ASN A 93 -0.673 -2.550 11.094 1.00 0.00 H new ATOM 0 HA ASN A 93 1.959 -2.790 12.185 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -0.773 -3.793 13.083 1.00 0.00 H new ATOM 0 HB3 ASN A 93 0.682 -3.922 14.052 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -1.506 -0.636 14.393 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -2.048 -2.233 13.866 1.00 0.00 H new ATOM 1378 N VAL A 94 2.594 -5.205 12.056 1.00 0.00 N ATOM 1379 CA VAL A 94 3.061 -6.558 11.778 1.00 0.00 C ATOM 1380 C VAL A 94 3.742 -7.166 13.000 1.00 0.00 C ATOM 1381 O VAL A 94 4.429 -6.473 13.749 1.00 0.00 O ATOM 1382 CB VAL A 94 4.044 -6.579 10.593 1.00 0.00 C ATOM 1383 CG1 VAL A 94 4.498 -8.002 10.301 1.00 0.00 C ATOM 1384 CG2 VAL A 94 3.408 -5.951 9.362 1.00 0.00 C ATOM 0 H VAL A 94 3.254 -4.630 12.579 1.00 0.00 H new ATOM 0 HA VAL A 94 2.182 -7.151 11.523 1.00 0.00 H new ATOM 0 HB VAL A 94 4.921 -5.990 10.861 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.192 -7.997 9.461 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.995 -8.413 11.180 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.632 -8.616 10.053 1.00 0.00 H new ATOM 0 HG21 VAL A 94 4.117 -5.974 8.534 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.513 -6.510 9.089 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.138 -4.918 9.579 1.00 0.00 H new ATOM 1394 N ASN A 95 3.546 -8.466 13.193 1.00 0.00 N ATOM 1395 CA ASN A 95 4.141 -9.168 14.324 1.00 0.00 C ATOM 1396 C ASN A 95 5.614 -9.469 14.064 1.00 0.00 C ATOM 1397 O ASN A 95 5.949 -10.328 13.249 1.00 0.00 O ATOM 1398 CB ASN A 95 3.384 -10.469 14.599 1.00 0.00 C ATOM 1399 CG ASN A 95 4.193 -11.444 15.433 1.00 0.00 C ATOM 1400 OD1 ASN A 95 4.813 -11.063 16.426 1.00 0.00 O ATOM 1401 ND2 ASN A 95 4.192 -12.710 15.031 1.00 0.00 N ATOM 0 H ASN A 95 2.980 -9.054 12.581 1.00 0.00 H new ATOM 0 HA ASN A 95 4.070 -8.522 15.199 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.451 -10.241 15.115 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.118 -10.939 13.652 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.720 -13.411 15.552 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.664 -12.981 14.202 1.00 0.00 H new ATOM 1408 N GLY A 96 6.491 -8.755 14.763 1.00 0.00 N ATOM 1409 CA GLY A 96 7.918 -8.961 14.594 1.00 0.00 C ATOM 1410 C GLY A 96 8.635 -7.703 14.145 1.00 0.00 C ATOM 1411 O GLY A 96 9.549 -7.227 14.819 1.00 0.00 O ATOM 0 H GLY A 96 6.239 -8.038 15.443 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.347 -9.304 15.536 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.084 -9.751 13.862 1.00 0.00 H new ATOM 1415 N SER A 97 8.223 -7.165 13.002 1.00 0.00 N ATOM 1416 CA SER A 97 8.836 -5.958 12.460 1.00 0.00 C ATOM 1417 C SER A 97 8.486 -4.741 13.312 1.00 0.00 C ATOM 1418 O SER A 97 7.332 -4.519 13.678 1.00 0.00 O ATOM 1419 CB SER A 97 8.381 -5.732 11.017 1.00 0.00 C ATOM 1420 OG SER A 97 9.190 -4.764 10.372 1.00 0.00 O ATOM 0 H SER A 97 7.467 -7.546 12.433 1.00 0.00 H new ATOM 0 HA SER A 97 9.918 -6.092 12.475 1.00 0.00 H new ATOM 0 HB2 SER A 97 8.425 -6.672 10.467 1.00 0.00 H new ATOM 0 HB3 SER A 97 7.341 -5.406 11.007 1.00 0.00 H new ATOM 0 HG SER A 97 8.677 -3.938 10.248 1.00 0.00 H new ATOM 1426 N PRO A 98 9.507 -3.933 13.635 1.00 0.00 N ATOM 1427 CA PRO A 98 9.333 -2.725 14.447 1.00 0.00 C ATOM 1428 C PRO A 98 8.575 -1.631 13.703 1.00 0.00 C ATOM 1429 O PRO A 98 7.760 -0.920 14.290 1.00 0.00 O ATOM 1430 CB PRO A 98 10.770 -2.280 14.732 1.00 0.00 C ATOM 1431 CG PRO A 98 11.570 -2.839 13.607 1.00 0.00 C ATOM 1432 CD PRO A 98 10.909 -4.137 13.233 1.00 0.00 C ATOM 0 HA PRO A 98 8.745 -2.918 15.345 1.00 0.00 H new ATOM 0 HB2 PRO A 98 10.847 -1.193 14.771 1.00 0.00 H new ATOM 0 HB3 PRO A 98 11.119 -2.659 15.693 1.00 0.00 H new ATOM 0 HG2 PRO A 98 11.587 -2.152 12.761 1.00 0.00 H new ATOM 0 HG3 PRO A 98 12.605 -3.001 13.907 1.00 0.00 H new ATOM 0 HD2 PRO A 98 10.996 -4.339 12.165 1.00 0.00 H new ATOM 0 HD3 PRO A 98 11.358 -4.982 13.755 1.00 0.00 H new ATOM 1440 N GLU A 99 8.848 -1.503 12.408 1.00 0.00 N ATOM 1441 CA GLU A 99 8.190 -0.495 11.586 1.00 0.00 C ATOM 1442 C GLU A 99 7.113 -1.126 10.709 1.00 0.00 C ATOM 1443 O GLU A 99 7.319 -2.164 10.078 1.00 0.00 O ATOM 1444 CB GLU A 99 9.216 0.229 10.711 1.00 0.00 C ATOM 1445 CG GLU A 99 8.842 1.669 10.400 1.00 0.00 C ATOM 1446 CD GLU A 99 8.010 1.797 9.139 1.00 0.00 C ATOM 1447 OE1 GLU A 99 8.503 1.404 8.061 1.00 0.00 O ATOM 1448 OE2 GLU A 99 6.867 2.290 9.230 1.00 0.00 O ATOM 0 H GLU A 99 9.520 -2.084 11.906 1.00 0.00 H new ATOM 0 HA GLU A 99 7.715 0.227 12.251 1.00 0.00 H new ATOM 0 HB2 GLU A 99 10.184 0.214 11.212 1.00 0.00 H new ATOM 0 HB3 GLU A 99 9.333 -0.317 9.775 1.00 0.00 H new ATOM 0 HG2 GLU A 99 8.287 2.086 11.241 1.00 0.00 H new ATOM 0 HG3 GLU A 99 9.751 2.261 10.293 1.00 0.00 H new ATOM 1455 N PRO A 100 5.935 -0.487 10.667 1.00 0.00 N ATOM 1456 CA PRO A 100 4.801 -0.967 9.871 1.00 0.00 C ATOM 1457 C PRO A 100 5.043 -0.824 8.373 1.00 0.00 C ATOM 1458 O PRO A 100 6.177 -0.637 7.932 1.00 0.00 O ATOM 1459 CB PRO A 100 3.648 -0.064 10.316 1.00 0.00 C ATOM 1460 CG PRO A 100 4.307 1.183 10.796 1.00 0.00 C ATOM 1461 CD PRO A 100 5.619 0.755 11.393 1.00 0.00 C ATOM 0 HA PRO A 100 4.613 -2.029 10.028 1.00 0.00 H new ATOM 0 HB2 PRO A 100 2.965 0.141 9.492 1.00 0.00 H new ATOM 0 HB3 PRO A 100 3.062 -0.532 11.107 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.462 1.883 9.975 1.00 0.00 H new ATOM 0 HG3 PRO A 100 3.689 1.691 11.536 1.00 0.00 H new ATOM 0 HD2 PRO A 100 6.391 1.511 11.251 1.00 0.00 H new ATOM 0 HD3 PRO A 100 5.535 0.583 12.466 1.00 0.00 H new ATOM 1469 N VAL A 101 3.969 -0.913 7.594 1.00 0.00 N ATOM 1470 CA VAL A 101 4.065 -0.792 6.144 1.00 0.00 C ATOM 1471 C VAL A 101 3.445 0.514 5.659 1.00 0.00 C ATOM 1472 O VAL A 101 2.258 0.569 5.337 1.00 0.00 O ATOM 1473 CB VAL A 101 3.371 -1.970 5.435 1.00 0.00 C ATOM 1474 CG1 VAL A 101 3.574 -1.883 3.930 1.00 0.00 C ATOM 1475 CG2 VAL A 101 3.888 -3.295 5.975 1.00 0.00 C ATOM 0 H VAL A 101 3.023 -1.068 7.943 1.00 0.00 H new ATOM 0 HA VAL A 101 5.126 -0.802 5.896 1.00 0.00 H new ATOM 0 HB VAL A 101 2.301 -1.913 5.637 1.00 0.00 H new ATOM 0 HG11 VAL A 101 3.077 -2.724 3.447 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.151 -0.949 3.559 1.00 0.00 H new ATOM 0 HG13 VAL A 101 4.640 -1.914 3.704 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.387 -4.117 5.463 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.963 -3.363 5.805 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.685 -3.356 7.044 1.00 0.00 H new ATOM 1485 N LYS A 102 4.256 1.565 5.610 1.00 0.00 N ATOM 1486 CA LYS A 102 3.790 2.872 5.163 1.00 0.00 C ATOM 1487 C LYS A 102 3.091 2.768 3.812 1.00 0.00 C ATOM 1488 O LYS A 102 3.569 2.084 2.905 1.00 0.00 O ATOM 1489 CB LYS A 102 4.963 3.850 5.068 1.00 0.00 C ATOM 1490 CG LYS A 102 4.549 5.261 4.686 1.00 0.00 C ATOM 1491 CD LYS A 102 5.487 6.298 5.281 1.00 0.00 C ATOM 1492 CE LYS A 102 4.906 7.700 5.177 1.00 0.00 C ATOM 1493 NZ LYS A 102 5.288 8.366 3.901 1.00 0.00 N ATOM 0 H LYS A 102 5.241 1.537 5.875 1.00 0.00 H new ATOM 0 HA LYS A 102 3.073 3.244 5.895 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.480 3.879 6.027 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.677 3.478 4.333 1.00 0.00 H new ATOM 0 HG2 LYS A 102 4.540 5.357 3.600 1.00 0.00 H new ATOM 0 HG3 LYS A 102 3.532 5.449 5.031 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.679 6.059 6.327 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.446 6.261 4.765 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.820 7.649 5.249 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.253 8.300 6.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 4.887 9.325 3.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.324 8.423 3.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 4.920 7.816 3.099 1.00 0.00 H new ATOM 1507 N LEU A 103 1.959 3.450 3.682 1.00 0.00 N ATOM 1508 CA LEU A 103 1.194 3.436 2.439 1.00 0.00 C ATOM 1509 C LEU A 103 0.596 4.809 2.152 1.00 0.00 C ATOM 1510 O LEU A 103 -0.343 5.242 2.821 1.00 0.00 O ATOM 1511 CB LEU A 103 0.083 2.387 2.513 1.00 0.00 C ATOM 1512 CG LEU A 103 -0.822 2.281 1.286 1.00 0.00 C ATOM 1513 CD1 LEU A 103 -0.010 1.912 0.054 1.00 0.00 C ATOM 1514 CD2 LEU A 103 -1.926 1.261 1.524 1.00 0.00 C ATOM 0 H LEU A 103 1.550 4.020 4.422 1.00 0.00 H new ATOM 0 HA LEU A 103 1.873 3.180 1.626 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.541 1.413 2.687 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.539 2.606 3.381 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.284 3.253 1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.671 1.841 -0.810 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.744 2.678 -0.128 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.480 0.952 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.561 1.199 0.640 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.483 0.285 1.722 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.526 1.568 2.381 1.00 0.00 H new ATOM 1526 N THR A 104 1.143 5.490 1.150 1.00 0.00 N ATOM 1527 CA THR A 104 0.663 6.813 0.773 1.00 0.00 C ATOM 1528 C THR A 104 -0.448 6.719 -0.266 1.00 0.00 C ATOM 1529 O THR A 104 -0.372 5.919 -1.199 1.00 0.00 O ATOM 1530 CB THR A 104 1.802 7.685 0.212 1.00 0.00 C ATOM 1531 OG1 THR A 104 2.885 7.738 1.147 1.00 0.00 O ATOM 1532 CG2 THR A 104 1.310 9.094 -0.082 1.00 0.00 C ATOM 0 H THR A 104 1.919 5.146 0.585 1.00 0.00 H new ATOM 0 HA THR A 104 0.272 7.277 1.678 1.00 0.00 H new ATOM 0 HB THR A 104 2.148 7.236 -0.719 1.00 0.00 H new ATOM 0 HG1 THR A 104 3.606 8.293 0.782 1.00 0.00 H new ATOM 0 HG21 THR A 104 2.132 9.691 -0.477 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.506 9.053 -0.816 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.940 9.549 0.837 1.00 0.00 H new ATOM 1540 N ILE A 105 -1.479 7.541 -0.099 1.00 0.00 N ATOM 1541 CA ILE A 105 -2.605 7.550 -1.025 1.00 0.00 C ATOM 1542 C ILE A 105 -3.057 8.975 -1.325 1.00 0.00 C ATOM 1543 O ILE A 105 -3.684 9.628 -0.490 1.00 0.00 O ATOM 1544 CB ILE A 105 -3.799 6.752 -0.467 1.00 0.00 C ATOM 1545 CG1 ILE A 105 -3.414 5.283 -0.278 1.00 0.00 C ATOM 1546 CG2 ILE A 105 -4.998 6.875 -1.395 1.00 0.00 C ATOM 1547 CD1 ILE A 105 -4.507 4.448 0.351 1.00 0.00 C ATOM 0 H ILE A 105 -1.558 8.209 0.668 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.261 7.078 -1.945 1.00 0.00 H new ATOM 0 HB ILE A 105 -4.072 7.165 0.504 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -3.154 4.856 -1.247 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.521 5.227 0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -5.833 6.306 -0.987 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -5.283 7.923 -1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -4.738 6.484 -2.379 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -4.164 3.418 0.454 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -4.751 4.850 1.334 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -5.394 4.473 -0.282 1.00 0.00 H new ATOM 1559 N ARG A 106 -2.737 9.452 -2.524 1.00 0.00 N ATOM 1560 CA ARG A 106 -3.110 10.799 -2.935 1.00 0.00 C ATOM 1561 C ARG A 106 -4.274 10.764 -3.922 1.00 0.00 C ATOM 1562 O ARG A 106 -4.258 10.004 -4.889 1.00 0.00 O ATOM 1563 CB ARG A 106 -1.914 11.513 -3.567 1.00 0.00 C ATOM 1564 CG ARG A 106 -1.568 11.007 -4.958 1.00 0.00 C ATOM 1565 CD ARG A 106 -0.156 11.404 -5.359 1.00 0.00 C ATOM 1566 NE ARG A 106 0.196 10.906 -6.687 1.00 0.00 N ATOM 1567 CZ ARG A 106 1.443 10.842 -7.141 1.00 0.00 C ATOM 1568 NH1 ARG A 106 2.451 11.241 -6.378 1.00 0.00 N ATOM 1569 NH2 ARG A 106 1.683 10.377 -8.360 1.00 0.00 N ATOM 0 H ARG A 106 -2.220 8.925 -3.227 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.424 11.348 -2.047 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.126 12.581 -3.620 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.046 11.392 -2.919 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.664 9.922 -4.986 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.279 11.409 -5.680 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -0.067 12.490 -5.344 1.00 0.00 H new ATOM 0 HD3 ARG A 106 0.552 11.015 -4.627 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.557 10.590 -7.299 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.270 11.598 -5.440 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.407 11.191 -6.729 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.910 10.068 -8.949 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.641 10.328 -8.708 1.00 0.00 H new ATOM 1583 N GLY A 107 -5.283 11.592 -3.669 1.00 0.00 N ATOM 1584 CA GLY A 107 -6.441 11.639 -4.543 1.00 0.00 C ATOM 1585 C GLY A 107 -6.955 13.050 -4.749 1.00 0.00 C ATOM 1586 O GLY A 107 -6.201 14.016 -4.629 1.00 0.00 O ATOM 0 H GLY A 107 -5.319 12.231 -2.875 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.181 11.206 -5.509 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.236 11.024 -4.121 1.00 0.00 H new ATOM 1590 N CYS A 108 -8.240 13.169 -5.062 1.00 0.00 N ATOM 1591 CA CYS A 108 -8.854 14.473 -5.288 1.00 0.00 C ATOM 1592 C CYS A 108 -10.372 14.352 -5.375 1.00 0.00 C ATOM 1593 O CYS A 108 -10.905 13.742 -6.302 1.00 0.00 O ATOM 1594 CB CYS A 108 -8.307 15.102 -6.570 1.00 0.00 C ATOM 1595 SG CYS A 108 -8.758 16.839 -6.791 1.00 0.00 S ATOM 0 H CYS A 108 -8.877 12.379 -5.165 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.607 15.115 -4.442 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -7.220 15.017 -6.568 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -8.670 14.532 -7.425 1.00 0.00 H new ATOM 0 HG CYS A 108 -7.824 17.448 -7.459 1.00 0.00 H new ATOM 1601 N VAL A 109 -11.064 14.935 -4.401 1.00 0.00 N ATOM 1602 CA VAL A 109 -12.521 14.892 -4.366 1.00 0.00 C ATOM 1603 C VAL A 109 -13.123 16.107 -5.062 1.00 0.00 C ATOM 1604 O VAL A 109 -12.900 17.245 -4.649 1.00 0.00 O ATOM 1605 CB VAL A 109 -13.046 14.829 -2.920 1.00 0.00 C ATOM 1606 CG1 VAL A 109 -14.562 14.701 -2.907 1.00 0.00 C ATOM 1607 CG2 VAL A 109 -12.400 13.675 -2.168 1.00 0.00 C ATOM 0 H VAL A 109 -10.639 15.443 -3.625 1.00 0.00 H new ATOM 0 HA VAL A 109 -12.824 13.988 -4.894 1.00 0.00 H new ATOM 0 HB VAL A 109 -12.779 15.757 -2.415 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -14.915 14.658 -1.877 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -15.004 15.563 -3.406 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -14.855 13.790 -3.429 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.783 13.646 -1.148 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.634 12.737 -2.671 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.319 13.815 -2.146 1.00 0.00 H new ATOM 1617 N ILE A 110 -13.888 15.858 -6.120 1.00 0.00 N ATOM 1618 CA ILE A 110 -14.524 16.932 -6.872 1.00 0.00 C ATOM 1619 C ILE A 110 -16.036 16.744 -6.927 1.00 0.00 C ATOM 1620 O ILE A 110 -16.562 15.725 -6.482 1.00 0.00 O ATOM 1621 CB ILE A 110 -13.976 17.015 -8.309 1.00 0.00 C ATOM 1622 CG1 ILE A 110 -14.096 15.656 -9.002 1.00 0.00 C ATOM 1623 CG2 ILE A 110 -12.528 17.483 -8.297 1.00 0.00 C ATOM 1624 CD1 ILE A 110 -13.953 15.731 -10.506 1.00 0.00 C ATOM 0 H ILE A 110 -14.082 14.922 -6.475 1.00 0.00 H new ATOM 0 HA ILE A 110 -14.294 17.861 -6.350 1.00 0.00 H new ATOM 0 HB ILE A 110 -14.568 17.741 -8.867 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -13.333 14.986 -8.605 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -15.063 15.217 -8.758 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -12.155 17.537 -9.320 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -12.468 18.469 -7.837 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -11.923 16.779 -7.726 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -14.049 14.732 -10.931 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -14.732 16.375 -10.914 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -12.975 16.140 -10.759 1.00 0.00 H new ATOM 1636 N GLY A 111 -16.731 17.735 -7.478 1.00 0.00 N ATOM 1637 CA GLY A 111 -18.177 17.658 -7.583 1.00 0.00 C ATOM 1638 C GLY A 111 -18.718 18.475 -8.739 1.00 0.00 C ATOM 1639 O GLY A 111 -17.970 18.955 -9.592 1.00 0.00 O ATOM 0 H GLY A 111 -16.319 18.589 -7.853 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -18.474 16.617 -7.707 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -18.625 18.009 -6.653 1.00 0.00 H new ATOM 1643 N PRO A 112 -20.048 18.642 -8.780 1.00 0.00 N ATOM 1644 CA PRO A 112 -20.718 19.405 -9.836 1.00 0.00 C ATOM 1645 C PRO A 112 -20.436 20.901 -9.740 1.00 0.00 C ATOM 1646 O PRO A 112 -19.823 21.485 -10.633 1.00 0.00 O ATOM 1647 CB PRO A 112 -22.203 19.124 -9.590 1.00 0.00 C ATOM 1648 CG PRO A 112 -22.289 18.792 -8.140 1.00 0.00 C ATOM 1649 CD PRO A 112 -21.000 18.098 -7.797 1.00 0.00 C ATOM 0 HA PRO A 112 -20.374 19.114 -10.829 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -22.816 19.991 -9.835 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -22.558 18.298 -10.207 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -22.419 19.693 -7.540 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -23.145 18.148 -7.937 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -20.688 18.312 -6.775 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -21.091 17.015 -7.883 1.00 0.00 H new