USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 915 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 8 CYS SG : rot 80:sc= 0.27 USER MOD Set 1.2: A 78 SER OG : rot -96:sc= 1.35 USER MOD Set 1.3: A 80 CYS SG : rot 92:sc= 0.105 USER MOD Set 2.1: A 15 SER OG : rot 175:sc= 0.141 USER MOD Set 2.2: A 16 GLN : amide:sc= 0.12 K(o=1.5,f=0.56) USER MOD Set 2.3: A 40 SER OG : rot 150:sc= 0.793 USER MOD Set 2.4: A 62 SER OG : rot 164:sc= 0.481 USER MOD Single : A 1 MET CE :methyl 154:sc= -0.0148 (180deg=-1.28) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.0322 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -136:sc= 0.023 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 172:sc= 1.26 (180deg=1.2) USER MOD Single : A 5 MET CE :methyl -163:sc= 0 (180deg=-0.959) USER MOD Single : A 17 MET CE :methyl 163:sc= -0.339 (180deg=-0.642) USER MOD Single : A 23 LYS NZ :NH3+ -171:sc= 1.35 (180deg=1.16) USER MOD Single : A 24 THR OG1 : rot 77:sc= 0.721 USER MOD Single : A 29 LYS NZ :NH3+ 177:sc= 0.782 (180deg=0.775) USER MOD Single : A 33 THR OG1 : rot -150:sc=-0.00548 USER MOD Single : A 34 SER OG : rot -96:sc= 1.25 USER MOD Single : A 35 CYS SG : rot 51:sc= -0.372 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00605 USER MOD Single : A 43 HIS : no HD1:sc= -0.267 X(o=-0.27,f=-0.25) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -159:sc=-0.000173 (180deg=-0.095) USER MOD Single : A 50 MET CE :methyl -166:sc= 0 (180deg=-0.0269) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0483 USER MOD Single : A 60 GLN : amide:sc= 1.71 K(o=1.7,f=-1.2) USER MOD Single : A 61 THR OG1 : rot 180:sc=-4.25e-05 USER MOD Single : A 67 ASN : amide:sc= 2.17 K(o=2.2,f=-0.0001) USER MOD Single : A 69 ASN : amide:sc= 0.976 K(o=0.98,f=-0.11) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0139 K(o=-0.014,f=-1.2) USER MOD Single : A 92 THR OG1 : rot -33:sc= 0.138 USER MOD Single : A 93 GLN : amide:sc= -0.503! C(o=-0.5!,f=-5.5!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 90:sc= 1.26 USER MOD Single : A 118 GLN : amide:sc= 0.675 K(o=0.67,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.07) USER MOD Single : A 125 ASN : amide:sc= 0.67 K(o=0.67,f=-0.022) USER MOD Single : A 129 LYS NZ :NH3+ -177:sc= 1.3 (180deg=1.17) USER MOD Single : A 131 SER OG : rot 73:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.145 1.283 1.751 1.00 0.00 N ATOM 2 CA MET A 1 3.221 1.149 0.258 1.00 0.00 C ATOM 3 C MET A 1 4.324 0.147 -0.150 1.00 0.00 C ATOM 4 O MET A 1 5.324 0.021 0.553 1.00 0.00 O ATOM 5 CB MET A 1 3.420 2.533 -0.415 1.00 0.00 C ATOM 6 CG MET A 1 3.179 2.539 -1.938 1.00 0.00 C ATOM 7 SD MET A 1 3.506 4.121 -2.769 1.00 0.00 S ATOM 8 CE MET A 1 5.305 4.172 -2.580 1.00 0.00 C ATOM 0 H1 MET A 1 2.282 0.819 2.098 1.00 0.00 H new ATOM 0 H2 MET A 1 3.977 0.833 2.183 1.00 0.00 H new ATOM 0 H3 MET A 1 3.123 2.290 2.008 1.00 0.00 H new ATOM 0 HA MET A 1 2.271 0.750 -0.098 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.745 3.251 0.051 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.435 2.877 -0.218 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.807 1.772 -2.392 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.144 2.255 -2.127 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.738 4.776 -3.377 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.557 4.611 -1.615 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.705 3.160 -2.634 1.00 0.00 H new ATOM 18 N LYS A 2 4.165 -0.563 -1.285 1.00 0.00 N ATOM 19 CA LYS A 2 5.103 -1.600 -1.765 1.00 0.00 C ATOM 20 C LYS A 2 6.353 -1.008 -2.407 1.00 0.00 C ATOM 21 O LYS A 2 6.269 -0.011 -3.127 1.00 0.00 O ATOM 22 CB LYS A 2 4.418 -2.555 -2.761 1.00 0.00 C ATOM 23 CG LYS A 2 3.204 -3.319 -2.200 1.00 0.00 C ATOM 24 CD LYS A 2 2.318 -3.851 -3.343 1.00 0.00 C ATOM 25 CE LYS A 2 1.473 -2.740 -4.005 1.00 0.00 C ATOM 26 NZ LYS A 2 0.124 -2.600 -3.374 1.00 0.00 N ATOM 0 H LYS A 2 3.367 -0.430 -1.906 1.00 0.00 H new ATOM 0 HA LYS A 2 5.411 -2.159 -0.881 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.097 -1.980 -3.630 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.154 -3.279 -3.112 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.545 -4.149 -1.581 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.620 -2.661 -1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 2 2.948 -4.322 -4.098 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.655 -4.624 -2.954 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.005 -1.791 -3.934 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.354 -2.960 -5.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.598 -2.501 -4.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.081 -3.444 -2.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.112 -1.758 -2.764 1.00 0.00 H new ATOM 40 N LYS A 3 7.482 -1.696 -2.239 1.00 0.00 N ATOM 41 CA LYS A 3 8.749 -1.419 -2.936 1.00 0.00 C ATOM 42 C LYS A 3 9.120 -2.562 -3.885 1.00 0.00 C ATOM 43 O LYS A 3 9.184 -3.719 -3.474 1.00 0.00 O ATOM 44 CB LYS A 3 9.821 -1.137 -1.875 1.00 0.00 C ATOM 45 CG LYS A 3 11.078 -0.449 -2.424 1.00 0.00 C ATOM 46 CD LYS A 3 12.088 -0.114 -1.312 1.00 0.00 C ATOM 47 CE LYS A 3 11.500 0.814 -0.234 1.00 0.00 C ATOM 48 NZ LYS A 3 12.516 1.176 0.791 1.00 0.00 N ATOM 0 H LYS A 3 7.548 -2.486 -1.597 1.00 0.00 H new ATOM 0 HA LYS A 3 8.655 -0.540 -3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.389 -0.511 -1.094 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.110 -2.078 -1.406 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.553 -1.097 -3.161 1.00 0.00 H new ATOM 0 HG3 LYS A 3 10.793 0.467 -2.942 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.427 -1.038 -0.844 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.965 0.359 -1.754 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.117 1.720 -0.703 1.00 0.00 H new ATOM 0 HE3 LYS A 3 10.655 0.323 0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.127 1.905 1.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.764 0.333 1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.368 1.543 0.321 1.00 0.00 H new ATOM 62 N VAL A 4 9.360 -2.221 -5.152 1.00 0.00 N ATOM 63 CA VAL A 4 9.740 -3.145 -6.232 1.00 0.00 C ATOM 64 C VAL A 4 11.259 -3.149 -6.414 1.00 0.00 C ATOM 65 O VAL A 4 11.814 -2.170 -6.912 1.00 0.00 O ATOM 66 CB VAL A 4 9.044 -2.778 -7.560 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.344 -3.817 -8.652 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.519 -2.682 -7.420 1.00 0.00 C ATOM 0 H VAL A 4 9.293 -1.255 -5.471 1.00 0.00 H new ATOM 0 HA VAL A 4 9.411 -4.145 -5.948 1.00 0.00 H new ATOM 0 HB VAL A 4 9.443 -1.802 -7.836 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.840 -3.531 -9.575 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.419 -3.863 -8.825 1.00 0.00 H new ATOM 0 HG13 VAL A 4 8.986 -4.795 -8.332 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.081 -2.421 -8.383 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.123 -3.642 -7.089 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.268 -1.914 -6.688 1.00 0.00 H new ATOM 78 N MET A 5 11.943 -4.232 -6.039 1.00 0.00 N ATOM 79 CA MET A 5 13.360 -4.412 -6.392 1.00 0.00 C ATOM 80 C MET A 5 13.473 -5.076 -7.768 1.00 0.00 C ATOM 81 O MET A 5 12.904 -6.147 -7.980 1.00 0.00 O ATOM 82 CB MET A 5 14.112 -5.251 -5.349 1.00 0.00 C ATOM 83 CG MET A 5 15.613 -5.360 -5.656 1.00 0.00 C ATOM 84 SD MET A 5 16.542 -3.809 -5.543 1.00 0.00 S ATOM 85 CE MET A 5 17.177 -3.965 -3.851 1.00 0.00 C ATOM 0 H MET A 5 11.545 -4.996 -5.494 1.00 0.00 H new ATOM 0 HA MET A 5 13.820 -3.424 -6.416 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.977 -4.806 -4.363 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.679 -6.250 -5.310 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.056 -6.080 -4.968 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.733 -5.764 -6.661 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.513 -2.990 -3.497 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.386 -4.335 -3.198 1.00 0.00 H new ATOM 0 HE3 MET A 5 18.014 -4.663 -3.839 1.00 0.00 H new ATOM 95 N PHE A 6 14.250 -4.487 -8.671 1.00 0.00 N ATOM 96 CA PHE A 6 14.643 -5.083 -9.944 1.00 0.00 C ATOM 97 C PHE A 6 16.056 -5.684 -9.823 1.00 0.00 C ATOM 98 O PHE A 6 16.992 -4.966 -9.470 1.00 0.00 O ATOM 99 CB PHE A 6 14.540 -4.019 -11.044 1.00 0.00 C ATOM 100 CG PHE A 6 13.111 -3.641 -11.382 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.363 -4.484 -12.219 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.509 -2.487 -10.847 1.00 0.00 C ATOM 103 CE1 PHE A 6 11.042 -4.157 -12.562 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.183 -2.159 -11.193 1.00 0.00 C ATOM 105 CZ PHE A 6 10.458 -2.976 -12.082 1.00 0.00 C ATOM 0 H PHE A 6 14.636 -3.553 -8.533 1.00 0.00 H new ATOM 0 HA PHE A 6 13.975 -5.901 -10.213 1.00 0.00 H new ATOM 0 HB2 PHE A 6 15.079 -3.126 -10.728 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.033 -4.387 -11.943 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.807 -5.391 -12.602 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.063 -1.853 -10.171 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.473 -4.818 -13.199 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.721 -1.277 -10.775 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.462 -2.696 -12.391 1.00 0.00 H new ATOM 115 N VAL A 7 16.228 -6.980 -10.110 1.00 0.00 N ATOM 116 CA VAL A 7 17.506 -7.714 -9.964 1.00 0.00 C ATOM 117 C VAL A 7 17.952 -8.392 -11.262 1.00 0.00 C ATOM 118 O VAL A 7 17.132 -8.857 -12.045 1.00 0.00 O ATOM 119 CB VAL A 7 17.507 -8.717 -8.785 1.00 0.00 C ATOM 120 CG1 VAL A 7 17.100 -8.042 -7.473 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.585 -9.926 -8.975 1.00 0.00 C ATOM 0 H VAL A 7 15.470 -7.567 -10.458 1.00 0.00 H new ATOM 0 HA VAL A 7 18.242 -6.946 -9.726 1.00 0.00 H new ATOM 0 HB VAL A 7 18.537 -9.073 -8.751 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.112 -8.776 -6.667 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.802 -7.240 -7.244 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.096 -7.629 -7.573 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.650 -10.574 -8.101 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.557 -9.584 -9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.891 -10.481 -9.862 1.00 0.00 H new ATOM 131 N CYS A 8 19.263 -8.468 -11.499 1.00 0.00 N ATOM 132 CA CYS A 8 19.839 -9.227 -12.623 1.00 0.00 C ATOM 133 C CYS A 8 21.238 -9.777 -12.273 1.00 0.00 C ATOM 134 O CYS A 8 21.807 -9.396 -11.250 1.00 0.00 O ATOM 135 CB CYS A 8 19.856 -8.299 -13.853 1.00 0.00 C ATOM 136 SG CYS A 8 20.079 -9.278 -15.365 1.00 0.00 S ATOM 0 H CYS A 8 19.962 -8.005 -10.918 1.00 0.00 H new ATOM 0 HA CYS A 8 19.232 -10.105 -12.844 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.924 -7.737 -13.908 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.662 -7.571 -13.759 1.00 0.00 H new ATOM 0 HG CYS A 8 18.943 -9.806 -15.711 1.00 0.00 H new ATOM 224 N ARG A 14 20.074 -4.501 -17.133 1.00 0.00 N ATOM 225 CA ARG A 14 18.623 -4.785 -17.116 1.00 0.00 C ATOM 226 C ARG A 14 17.925 -4.397 -15.821 1.00 0.00 C ATOM 227 O ARG A 14 16.820 -3.888 -15.893 1.00 0.00 O ATOM 228 CB ARG A 14 18.400 -6.283 -17.425 1.00 0.00 C ATOM 229 CG ARG A 14 18.563 -6.608 -18.920 1.00 0.00 C ATOM 230 CD ARG A 14 18.460 -8.113 -19.205 1.00 0.00 C ATOM 231 NE ARG A 14 19.632 -8.841 -18.678 1.00 0.00 N ATOM 232 CZ ARG A 14 19.975 -10.092 -18.931 1.00 0.00 C ATOM 233 NH1 ARG A 14 19.226 -10.897 -19.621 1.00 0.00 N ATOM 234 NH2 ARG A 14 21.113 -10.553 -18.500 1.00 0.00 N ATOM 0 HA ARG A 14 18.169 -4.158 -17.884 1.00 0.00 H new ATOM 0 HB2 ARG A 14 19.107 -6.879 -16.848 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.400 -6.572 -17.101 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.798 -6.080 -19.490 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.529 -6.240 -19.266 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.550 -8.509 -18.754 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.380 -8.277 -20.280 1.00 0.00 H new ATOM 0 HE ARG A 14 20.244 -8.321 -18.049 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.333 -10.571 -19.992 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.530 -11.855 -19.792 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.739 -9.949 -17.968 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.379 -11.518 -18.695 1.00 0.00 H new ATOM 248 N SER A 15 18.541 -4.576 -14.656 1.00 0.00 N ATOM 249 CA SER A 15 17.931 -4.184 -13.370 1.00 0.00 C ATOM 250 C SER A 15 17.785 -2.669 -13.244 1.00 0.00 C ATOM 251 O SER A 15 16.704 -2.168 -12.941 1.00 0.00 O ATOM 252 CB SER A 15 18.766 -4.742 -12.226 1.00 0.00 C ATOM 253 OG SER A 15 20.136 -4.479 -12.469 1.00 0.00 O ATOM 0 H SER A 15 19.468 -4.992 -14.567 1.00 0.00 H new ATOM 0 HA SER A 15 16.925 -4.602 -13.327 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.459 -4.289 -11.283 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.602 -5.815 -12.132 1.00 0.00 H new ATOM 0 HG SER A 15 20.666 -4.767 -11.697 1.00 0.00 H new ATOM 259 N GLN A 16 18.855 -1.932 -13.542 1.00 0.00 N ATOM 260 CA GLN A 16 18.851 -0.464 -13.559 1.00 0.00 C ATOM 261 C GLN A 16 17.944 0.096 -14.670 1.00 0.00 C ATOM 262 O GLN A 16 17.109 0.958 -14.397 1.00 0.00 O ATOM 263 CB GLN A 16 20.311 0.040 -13.592 1.00 0.00 C ATOM 264 CG GLN A 16 20.839 0.135 -12.148 1.00 0.00 C ATOM 265 CD GLN A 16 22.313 0.504 -12.026 1.00 0.00 C ATOM 266 OE1 GLN A 16 22.683 1.618 -11.685 1.00 0.00 O ATOM 267 NE2 GLN A 16 23.212 -0.429 -12.243 1.00 0.00 N ATOM 0 H GLN A 16 19.759 -2.339 -13.781 1.00 0.00 H new ATOM 0 HA GLN A 16 18.402 -0.076 -12.644 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.931 -0.640 -14.176 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.362 1.015 -14.077 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.248 0.876 -11.609 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.677 -0.823 -11.654 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.919 -1.363 -12.528 1.00 0.00 H new ATOM 0 HE22 GLN A 16 24.203 -0.219 -12.126 1.00 0.00 H new ATOM 276 N MET A 17 17.976 -0.470 -15.884 1.00 0.00 N ATOM 277 CA MET A 17 17.080 -0.059 -16.979 1.00 0.00 C ATOM 278 C MET A 17 15.602 -0.352 -16.678 1.00 0.00 C ATOM 279 O MET A 17 14.753 0.511 -16.906 1.00 0.00 O ATOM 280 CB MET A 17 17.513 -0.720 -18.299 1.00 0.00 C ATOM 281 CG MET A 17 16.899 -0.045 -19.532 1.00 0.00 C ATOM 282 SD MET A 17 17.523 1.633 -19.817 1.00 0.00 S ATOM 283 CE MET A 17 16.106 2.662 -19.337 1.00 0.00 C ATOM 0 H MET A 17 18.618 -1.221 -16.136 1.00 0.00 H new ATOM 0 HA MET A 17 17.167 1.023 -17.077 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.600 -0.688 -18.377 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.225 -1.771 -18.285 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.104 -0.655 -20.411 1.00 0.00 H new ATOM 0 HG3 MET A 17 15.816 -0.007 -19.415 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.439 3.687 -19.174 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.359 2.645 -20.130 1.00 0.00 H new ATOM 0 HE3 MET A 17 15.668 2.272 -18.418 1.00 0.00 H new ATOM 293 N ALA A 18 15.291 -1.523 -16.113 1.00 0.00 N ATOM 294 CA ALA A 18 13.935 -1.851 -15.646 1.00 0.00 C ATOM 295 C ALA A 18 13.435 -0.864 -14.579 1.00 0.00 C ATOM 296 O ALA A 18 12.340 -0.318 -14.717 1.00 0.00 O ATOM 297 CB ALA A 18 13.913 -3.296 -15.141 1.00 0.00 C ATOM 0 H ALA A 18 15.969 -2.271 -15.966 1.00 0.00 H new ATOM 0 HA ALA A 18 13.245 -1.757 -16.484 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.910 -3.545 -14.793 1.00 0.00 H new ATOM 0 HB2 ALA A 18 14.194 -3.969 -15.951 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.620 -3.405 -14.318 1.00 0.00 H new ATOM 303 N GLU A 19 14.257 -0.542 -13.572 1.00 0.00 N ATOM 304 CA GLU A 19 13.923 0.509 -12.600 1.00 0.00 C ATOM 305 C GLU A 19 13.747 1.878 -13.276 1.00 0.00 C ATOM 306 O GLU A 19 12.842 2.609 -12.905 1.00 0.00 O ATOM 307 CB GLU A 19 14.980 0.580 -11.491 1.00 0.00 C ATOM 308 CG GLU A 19 14.590 1.539 -10.349 1.00 0.00 C ATOM 309 CD GLU A 19 15.797 2.364 -9.882 1.00 0.00 C ATOM 310 OE1 GLU A 19 16.655 1.812 -9.156 1.00 0.00 O ATOM 311 OE2 GLU A 19 15.909 3.544 -10.287 1.00 0.00 O ATOM 0 H GLU A 19 15.157 -0.993 -13.408 1.00 0.00 H new ATOM 0 HA GLU A 19 12.967 0.244 -12.149 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.138 -0.418 -11.082 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.929 0.902 -11.921 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.798 2.207 -10.686 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.190 0.968 -9.511 1.00 0.00 H new ATOM 318 N GLY A 20 14.528 2.206 -14.312 1.00 0.00 N ATOM 319 CA GLY A 20 14.387 3.449 -15.086 1.00 0.00 C ATOM 320 C GLY A 20 12.987 3.617 -15.679 1.00 0.00 C ATOM 321 O GLY A 20 12.305 4.605 -15.402 1.00 0.00 O ATOM 0 H GLY A 20 15.286 1.609 -14.642 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.610 4.300 -14.443 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.122 3.457 -15.891 1.00 0.00 H new ATOM 325 N PHE A 21 12.499 2.609 -16.412 1.00 0.00 N ATOM 326 CA PHE A 21 11.104 2.588 -16.881 1.00 0.00 C ATOM 327 C PHE A 21 10.116 2.612 -15.704 1.00 0.00 C ATOM 328 O PHE A 21 9.118 3.329 -15.744 1.00 0.00 O ATOM 329 CB PHE A 21 10.876 1.377 -17.818 1.00 0.00 C ATOM 330 CG PHE A 21 11.255 1.657 -19.255 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.309 2.259 -20.105 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.540 1.352 -19.745 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.656 2.609 -21.417 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.881 1.688 -21.069 1.00 0.00 C ATOM 335 CZ PHE A 21 11.948 2.346 -21.890 1.00 0.00 C ATOM 0 H PHE A 21 13.047 1.797 -16.694 1.00 0.00 H new ATOM 0 HA PHE A 21 10.914 3.493 -17.458 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.457 0.530 -17.454 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.827 1.085 -17.776 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.310 2.453 -19.744 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.261 0.862 -19.107 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.929 3.080 -22.062 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.859 1.440 -21.454 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.228 2.649 -22.888 1.00 0.00 H new ATOM 345 N ALA A 22 10.414 1.903 -14.612 1.00 0.00 N ATOM 346 CA ALA A 22 9.525 1.806 -13.454 1.00 0.00 C ATOM 347 C ALA A 22 9.406 3.104 -12.641 1.00 0.00 C ATOM 348 O ALA A 22 8.307 3.411 -12.198 1.00 0.00 O ATOM 349 CB ALA A 22 9.967 0.607 -12.612 1.00 0.00 C ATOM 0 H ALA A 22 11.282 1.378 -14.507 1.00 0.00 H new ATOM 0 HA ALA A 22 8.508 1.647 -13.812 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.318 0.515 -11.741 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.903 -0.302 -13.211 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.996 0.753 -12.283 1.00 0.00 H new ATOM 355 N LYS A 23 10.455 3.925 -12.498 1.00 0.00 N ATOM 356 CA LYS A 23 10.345 5.251 -11.847 1.00 0.00 C ATOM 357 C LYS A 23 9.669 6.303 -12.736 1.00 0.00 C ATOM 358 O LYS A 23 9.095 7.258 -12.220 1.00 0.00 O ATOM 359 CB LYS A 23 11.695 5.729 -11.273 1.00 0.00 C ATOM 360 CG LYS A 23 12.785 6.086 -12.296 1.00 0.00 C ATOM 361 CD LYS A 23 13.912 6.863 -11.592 1.00 0.00 C ATOM 362 CE LYS A 23 14.946 7.399 -12.593 1.00 0.00 C ATOM 363 NZ LYS A 23 15.916 8.319 -11.930 1.00 0.00 N ATOM 0 H LYS A 23 11.395 3.699 -12.823 1.00 0.00 H new ATOM 0 HA LYS A 23 9.676 5.119 -10.996 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.511 6.605 -10.651 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.083 4.949 -10.618 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.183 5.179 -12.751 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.361 6.687 -13.101 1.00 0.00 H new ATOM 0 HD2 LYS A 23 13.485 7.694 -11.030 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.407 6.212 -10.871 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.483 6.566 -13.046 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.436 7.925 -13.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.504 8.782 -12.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.397 9.041 -11.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.524 7.776 -11.284 1.00 0.00 H new ATOM 377 N THR A 24 9.676 6.097 -14.058 1.00 0.00 N ATOM 378 CA THR A 24 8.974 6.973 -15.020 1.00 0.00 C ATOM 379 C THR A 24 7.468 6.666 -15.074 1.00 0.00 C ATOM 380 O THR A 24 6.647 7.578 -15.027 1.00 0.00 O ATOM 381 CB THR A 24 9.585 6.861 -16.427 1.00 0.00 C ATOM 382 OG1 THR A 24 10.990 7.007 -16.389 1.00 0.00 O ATOM 383 CG2 THR A 24 9.071 7.958 -17.357 1.00 0.00 C ATOM 0 H THR A 24 10.167 5.319 -14.498 1.00 0.00 H new ATOM 0 HA THR A 24 9.101 7.996 -14.666 1.00 0.00 H new ATOM 0 HB THR A 24 9.298 5.875 -16.794 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.397 6.176 -16.066 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.526 7.844 -18.341 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.988 7.880 -17.447 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.332 8.934 -16.948 1.00 0.00 H new ATOM 391 N LEU A 25 7.092 5.378 -15.137 1.00 0.00 N ATOM 392 CA LEU A 25 5.700 4.921 -15.354 1.00 0.00 C ATOM 393 C LEU A 25 4.981 4.537 -14.051 1.00 0.00 C ATOM 394 O LEU A 25 3.762 4.659 -13.941 1.00 0.00 O ATOM 395 CB LEU A 25 5.719 3.749 -16.359 1.00 0.00 C ATOM 396 CG LEU A 25 6.408 4.083 -17.693 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.510 2.827 -18.551 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.671 5.156 -18.492 1.00 0.00 C ATOM 0 H LEU A 25 7.754 4.609 -15.037 1.00 0.00 H new ATOM 0 HA LEU A 25 5.125 5.752 -15.762 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.227 2.900 -15.902 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.694 3.438 -16.559 1.00 0.00 H new ATOM 0 HG LEU A 25 7.396 4.470 -17.443 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.999 3.070 -19.495 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.094 2.072 -18.024 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.511 2.440 -18.749 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.205 5.348 -19.422 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.661 4.812 -18.718 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.620 6.074 -17.907 1.00 0.00 H new ATOM 410 N GLY A 26 5.751 4.117 -13.044 1.00 0.00 N ATOM 411 CA GLY A 26 5.324 3.900 -11.658 1.00 0.00 C ATOM 412 C GLY A 26 5.348 5.161 -10.799 1.00 0.00 C ATOM 413 O GLY A 26 5.053 5.065 -9.608 1.00 0.00 O ATOM 0 H GLY A 26 6.740 3.908 -13.180 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.313 3.492 -11.659 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.970 3.149 -11.202 1.00 0.00 H new ATOM 417 N ALA A 27 5.690 6.324 -11.377 1.00 0.00 N ATOM 418 CA ALA A 27 5.724 7.608 -10.666 1.00 0.00 C ATOM 419 C ALA A 27 4.466 7.840 -9.793 1.00 0.00 C ATOM 420 O ALA A 27 3.357 8.001 -10.306 1.00 0.00 O ATOM 421 CB ALA A 27 5.898 8.731 -11.699 1.00 0.00 C ATOM 0 H ALA A 27 5.953 6.398 -12.360 1.00 0.00 H new ATOM 0 HA ALA A 27 6.566 7.600 -9.974 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.925 9.694 -11.189 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.830 8.583 -12.244 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.062 8.715 -12.398 1.00 0.00 H new ATOM 427 N GLY A 28 4.643 7.842 -8.464 1.00 0.00 N ATOM 428 CA GLY A 28 3.575 8.066 -7.480 1.00 0.00 C ATOM 429 C GLY A 28 2.621 6.882 -7.223 1.00 0.00 C ATOM 430 O GLY A 28 1.549 7.097 -6.652 1.00 0.00 O ATOM 0 H GLY A 28 5.554 7.684 -8.034 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.036 8.345 -6.533 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.981 8.919 -7.809 1.00 0.00 H new ATOM 434 N LYS A 29 2.972 5.649 -7.635 1.00 0.00 N ATOM 435 CA LYS A 29 2.107 4.449 -7.521 1.00 0.00 C ATOM 436 C LYS A 29 2.690 3.401 -6.572 1.00 0.00 C ATOM 437 O LYS A 29 1.971 2.775 -5.798 1.00 0.00 O ATOM 438 CB LYS A 29 1.914 3.822 -8.914 1.00 0.00 C ATOM 439 CG LYS A 29 1.225 4.776 -9.903 1.00 0.00 C ATOM 440 CD LYS A 29 1.158 4.189 -11.319 1.00 0.00 C ATOM 441 CE LYS A 29 0.626 5.251 -12.296 1.00 0.00 C ATOM 442 NZ LYS A 29 0.833 4.853 -13.719 1.00 0.00 N ATOM 0 H LYS A 29 3.876 5.451 -8.063 1.00 0.00 H new ATOM 0 HA LYS A 29 1.151 4.772 -7.110 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.885 3.529 -9.314 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.321 2.912 -8.820 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.216 4.994 -9.553 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.765 5.723 -9.929 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.148 3.856 -11.632 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.509 3.313 -11.330 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.437 5.411 -12.115 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.127 6.200 -12.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.416 5.571 -14.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.852 4.775 -13.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.376 3.935 -13.893 1.00 0.00 H new ATOM 456 N ILE A 30 4.008 3.231 -6.667 1.00 0.00 N ATOM 457 CA ILE A 30 4.842 2.297 -5.904 1.00 0.00 C ATOM 458 C ILE A 30 6.258 2.872 -5.741 1.00 0.00 C ATOM 459 O ILE A 30 6.644 3.807 -6.442 1.00 0.00 O ATOM 460 CB ILE A 30 4.892 0.891 -6.560 1.00 0.00 C ATOM 461 CG1 ILE A 30 4.626 0.788 -8.077 1.00 0.00 C ATOM 462 CG2 ILE A 30 3.928 -0.059 -5.835 1.00 0.00 C ATOM 463 CD1 ILE A 30 5.709 1.457 -8.927 1.00 0.00 C ATOM 0 H ILE A 30 4.562 3.780 -7.325 1.00 0.00 H new ATOM 0 HA ILE A 30 4.390 2.173 -4.920 1.00 0.00 H new ATOM 0 HB ILE A 30 5.940 0.614 -6.449 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.553 -0.263 -8.356 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.663 1.245 -8.302 1.00 0.00 H new ATOM 0 HG21 ILE A 30 3.968 -1.044 -6.301 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.217 -0.141 -4.787 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.913 0.332 -5.901 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.461 1.348 -9.983 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.767 2.516 -8.675 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.671 0.984 -8.729 1.00 0.00 H new ATOM 475 N ALA A 31 7.044 2.286 -4.833 1.00 0.00 N ATOM 476 CA ALA A 31 8.477 2.578 -4.710 1.00 0.00 C ATOM 477 C ALA A 31 9.277 1.600 -5.583 1.00 0.00 C ATOM 478 O ALA A 31 8.847 0.465 -5.778 1.00 0.00 O ATOM 479 CB ALA A 31 8.878 2.559 -3.226 1.00 0.00 C ATOM 0 H ALA A 31 6.706 1.596 -4.162 1.00 0.00 H new ATOM 0 HA ALA A 31 8.706 3.578 -5.079 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.942 2.776 -3.134 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.306 3.313 -2.685 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.670 1.575 -2.806 1.00 0.00 H new ATOM 485 N VAL A 32 10.428 2.007 -6.120 1.00 0.00 N ATOM 486 CA VAL A 32 11.252 1.177 -7.023 1.00 0.00 C ATOM 487 C VAL A 32 12.752 1.311 -6.737 1.00 0.00 C ATOM 488 O VAL A 32 13.235 2.395 -6.408 1.00 0.00 O ATOM 489 CB VAL A 32 10.958 1.457 -8.511 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.474 1.283 -8.854 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.343 2.866 -8.967 1.00 0.00 C ATOM 0 H VAL A 32 10.825 2.930 -5.943 1.00 0.00 H new ATOM 0 HA VAL A 32 10.966 0.146 -6.816 1.00 0.00 H new ATOM 0 HB VAL A 32 11.574 0.723 -9.030 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.318 1.491 -9.913 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.168 0.260 -8.637 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.879 1.974 -8.257 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.105 2.984 -10.024 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.787 3.601 -8.386 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.412 3.018 -8.817 1.00 0.00 H new ATOM 501 N THR A 33 13.489 0.209 -6.883 1.00 0.00 N ATOM 502 CA THR A 33 14.942 0.123 -6.633 1.00 0.00 C ATOM 503 C THR A 33 15.581 -0.906 -7.574 1.00 0.00 C ATOM 504 O THR A 33 14.893 -1.805 -8.055 1.00 0.00 O ATOM 505 CB THR A 33 15.205 -0.280 -5.168 1.00 0.00 C ATOM 506 OG1 THR A 33 14.413 0.484 -4.280 1.00 0.00 O ATOM 507 CG2 THR A 33 16.653 -0.097 -4.708 1.00 0.00 C ATOM 0 H THR A 33 13.087 -0.678 -7.187 1.00 0.00 H new ATOM 0 HA THR A 33 15.386 1.101 -6.820 1.00 0.00 H new ATOM 0 HB THR A 33 14.957 -1.341 -5.143 1.00 0.00 H new ATOM 0 HG1 THR A 33 14.884 0.585 -3.426 1.00 0.00 H new ATOM 0 HG21 THR A 33 16.746 -0.405 -3.666 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.311 -0.707 -5.327 1.00 0.00 H new ATOM 0 HG23 THR A 33 16.935 0.952 -4.803 1.00 0.00 H new ATOM 515 N SER A 34 16.885 -0.806 -7.845 1.00 0.00 N ATOM 516 CA SER A 34 17.631 -1.750 -8.687 1.00 0.00 C ATOM 517 C SER A 34 18.898 -2.288 -8.018 1.00 0.00 C ATOM 518 O SER A 34 19.520 -1.630 -7.178 1.00 0.00 O ATOM 519 CB SER A 34 17.968 -1.131 -10.042 1.00 0.00 C ATOM 520 OG SER A 34 18.531 0.158 -9.911 1.00 0.00 O ATOM 0 H SER A 34 17.465 -0.051 -7.478 1.00 0.00 H new ATOM 0 HA SER A 34 16.969 -2.603 -8.838 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.666 -1.779 -10.573 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.064 -1.072 -10.648 1.00 0.00 H new ATOM 0 HG SER A 34 17.828 0.834 -10.011 1.00 0.00 H new ATOM 526 N CYS A 35 19.269 -3.517 -8.390 1.00 0.00 N ATOM 527 CA CYS A 35 20.369 -4.269 -7.797 1.00 0.00 C ATOM 528 C CYS A 35 20.903 -5.307 -8.801 1.00 0.00 C ATOM 529 O CYS A 35 20.198 -5.716 -9.722 1.00 0.00 O ATOM 530 CB CYS A 35 19.800 -4.904 -6.510 1.00 0.00 C ATOM 531 SG CYS A 35 20.841 -6.227 -5.836 1.00 0.00 S ATOM 0 H CYS A 35 18.795 -4.028 -9.135 1.00 0.00 H new ATOM 0 HA CYS A 35 21.224 -3.641 -7.549 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.678 -4.128 -5.755 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.808 -5.304 -6.719 1.00 0.00 H new ATOM 0 HG CYS A 35 22.065 -5.803 -5.728 1.00 0.00 H new ATOM 537 N GLY A 36 22.151 -5.739 -8.644 1.00 0.00 N ATOM 538 CA GLY A 36 22.713 -6.881 -9.371 1.00 0.00 C ATOM 539 C GLY A 36 23.263 -7.905 -8.381 1.00 0.00 C ATOM 540 O GLY A 36 23.677 -7.527 -7.285 1.00 0.00 O ATOM 0 H GLY A 36 22.812 -5.303 -8.001 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.946 -7.340 -9.994 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.506 -6.544 -10.038 1.00 0.00 H new ATOM 544 N LEU A 37 23.314 -9.193 -8.741 1.00 0.00 N ATOM 545 CA LEU A 37 23.768 -10.249 -7.811 1.00 0.00 C ATOM 546 C LEU A 37 25.176 -9.946 -7.249 1.00 0.00 C ATOM 547 O LEU A 37 25.431 -10.167 -6.069 1.00 0.00 O ATOM 548 CB LEU A 37 23.692 -11.638 -8.480 1.00 0.00 C ATOM 549 CG LEU A 37 22.296 -12.085 -8.958 1.00 0.00 C ATOM 550 CD1 LEU A 37 22.387 -13.509 -9.502 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.237 -12.049 -7.859 1.00 0.00 C ATOM 0 H LEU A 37 23.049 -9.534 -9.665 1.00 0.00 H new ATOM 0 HA LEU A 37 23.091 -10.262 -6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.366 -11.644 -9.337 1.00 0.00 H new ATOM 0 HB3 LEU A 37 24.067 -12.380 -7.775 1.00 0.00 H new ATOM 0 HG LEU A 37 21.986 -11.378 -9.728 1.00 0.00 H new ATOM 0 HD11 LEU A 37 21.403 -13.832 -9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 37 23.086 -13.535 -10.338 1.00 0.00 H new ATOM 0 HD13 LEU A 37 22.736 -14.177 -8.715 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.280 -12.376 -8.265 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.532 -12.714 -7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 37 21.142 -11.032 -7.479 1.00 0.00 H new ATOM 563 N GLU A 38 26.037 -9.331 -8.069 1.00 0.00 N ATOM 564 CA GLU A 38 27.335 -8.749 -7.680 1.00 0.00 C ATOM 565 C GLU A 38 27.453 -7.311 -8.244 1.00 0.00 C ATOM 566 O GLU A 38 28.445 -6.962 -8.886 1.00 0.00 O ATOM 567 CB GLU A 38 28.511 -9.665 -8.084 1.00 0.00 C ATOM 568 CG GLU A 38 28.387 -11.101 -7.553 1.00 0.00 C ATOM 569 CD GLU A 38 29.660 -11.913 -7.864 1.00 0.00 C ATOM 570 OE1 GLU A 38 30.622 -11.878 -7.056 1.00 0.00 O ATOM 571 OE2 GLU A 38 29.710 -12.600 -8.913 1.00 0.00 O ATOM 0 H GLU A 38 25.844 -9.219 -9.064 1.00 0.00 H new ATOM 0 HA GLU A 38 27.387 -8.676 -6.594 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.580 -9.694 -9.171 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.441 -9.231 -7.717 1.00 0.00 H new ATOM 0 HG2 GLU A 38 28.217 -11.082 -6.477 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.522 -11.587 -8.004 1.00 0.00 H new ATOM 578 N SER A 39 26.416 -6.484 -8.014 1.00 0.00 N ATOM 579 CA SER A 39 26.197 -5.153 -8.629 1.00 0.00 C ATOM 580 C SER A 39 25.875 -5.219 -10.136 1.00 0.00 C ATOM 581 O SER A 39 25.914 -6.288 -10.740 1.00 0.00 O ATOM 582 CB SER A 39 27.354 -4.194 -8.306 1.00 0.00 C ATOM 583 OG SER A 39 26.959 -2.863 -8.577 1.00 0.00 O ATOM 0 H SER A 39 25.670 -6.734 -7.364 1.00 0.00 H new ATOM 0 HA SER A 39 25.298 -4.741 -8.171 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.640 -4.293 -7.259 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.230 -4.452 -8.901 1.00 0.00 H new ATOM 0 HG SER A 39 27.698 -2.254 -8.369 1.00 0.00 H new ATOM 589 N SER A 40 25.470 -4.100 -10.740 1.00 0.00 N ATOM 590 CA SER A 40 25.109 -3.954 -12.164 1.00 0.00 C ATOM 591 C SER A 40 25.501 -2.562 -12.693 1.00 0.00 C ATOM 592 O SER A 40 25.858 -1.683 -11.902 1.00 0.00 O ATOM 593 CB SER A 40 23.609 -4.225 -12.362 1.00 0.00 C ATOM 594 OG SER A 40 22.821 -3.261 -11.676 1.00 0.00 O ATOM 0 H SER A 40 25.378 -3.222 -10.229 1.00 0.00 H new ATOM 0 HA SER A 40 25.668 -4.691 -12.741 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.370 -4.205 -13.425 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.365 -5.224 -11.999 1.00 0.00 H new ATOM 0 HG SER A 40 21.976 -3.130 -12.154 1.00 0.00 H new ATOM 600 N ARG A 41 25.442 -2.328 -14.015 1.00 0.00 N ATOM 601 CA ARG A 41 25.970 -1.092 -14.637 1.00 0.00 C ATOM 602 C ARG A 41 24.929 -0.202 -15.332 1.00 0.00 C ATOM 603 O ARG A 41 23.854 -0.652 -15.720 1.00 0.00 O ATOM 604 CB ARG A 41 27.165 -1.439 -15.555 1.00 0.00 C ATOM 605 CG ARG A 41 26.804 -2.102 -16.899 1.00 0.00 C ATOM 606 CD ARG A 41 28.025 -2.169 -17.828 1.00 0.00 C ATOM 607 NE ARG A 41 29.041 -3.153 -17.386 1.00 0.00 N ATOM 608 CZ ARG A 41 29.266 -4.367 -17.873 1.00 0.00 C ATOM 609 NH1 ARG A 41 28.575 -4.895 -18.839 1.00 0.00 N ATOM 610 NH2 ARG A 41 30.224 -5.108 -17.391 1.00 0.00 N ATOM 0 H ARG A 41 25.031 -2.982 -14.682 1.00 0.00 H new ATOM 0 HA ARG A 41 26.313 -0.463 -13.816 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.720 -0.524 -15.760 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.836 -2.104 -15.011 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.423 -3.108 -16.721 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.006 -1.539 -17.383 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.694 -2.425 -18.834 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.485 -1.182 -17.885 1.00 0.00 H new ATOM 0 HE ARG A 41 29.640 -2.862 -16.614 1.00 0.00 H new ATOM 0 HH11 ARG A 41 27.811 -4.370 -19.266 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.796 -5.834 -19.170 1.00 0.00 H new ATOM 0 HH21 ARG A 41 30.809 -4.756 -16.633 1.00 0.00 H new ATOM 0 HH22 ARG A 41 30.389 -6.040 -17.772 1.00 0.00 H new ATOM 624 N VAL A 42 25.309 1.064 -15.520 1.00 0.00 N ATOM 625 CA VAL A 42 24.621 2.073 -16.358 1.00 0.00 C ATOM 626 C VAL A 42 25.498 2.301 -17.601 1.00 0.00 C ATOM 627 O VAL A 42 26.723 2.173 -17.537 1.00 0.00 O ATOM 628 CB VAL A 42 24.343 3.403 -15.615 1.00 0.00 C ATOM 629 CG1 VAL A 42 23.338 4.295 -16.360 1.00 0.00 C ATOM 630 CG2 VAL A 42 23.768 3.176 -14.214 1.00 0.00 C ATOM 0 H VAL A 42 26.145 1.441 -15.074 1.00 0.00 H new ATOM 0 HA VAL A 42 23.635 1.697 -16.632 1.00 0.00 H new ATOM 0 HB VAL A 42 25.316 3.891 -15.558 1.00 0.00 H new ATOM 0 HG11 VAL A 42 23.179 5.214 -15.796 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.730 4.538 -17.348 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.391 3.766 -16.466 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.590 4.138 -13.733 1.00 0.00 H new ATOM 0 HG22 VAL A 42 22.828 2.629 -14.291 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.476 2.599 -13.619 1.00 0.00 H new ATOM 640 N HIS A 43 24.879 2.619 -18.738 1.00 0.00 N ATOM 641 CA HIS A 43 25.540 2.656 -20.053 1.00 0.00 C ATOM 642 C HIS A 43 25.146 3.892 -20.883 1.00 0.00 C ATOM 643 O HIS A 43 23.946 4.118 -21.039 1.00 0.00 O ATOM 644 CB HIS A 43 25.169 1.354 -20.778 1.00 0.00 C ATOM 645 CG HIS A 43 25.868 1.195 -22.101 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.252 1.156 -22.274 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.259 1.086 -23.316 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.453 1.007 -23.593 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.276 0.961 -24.243 1.00 0.00 N ATOM 0 H HIS A 43 23.889 2.863 -18.777 1.00 0.00 H new ATOM 0 HA HIS A 43 26.619 2.736 -19.919 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.416 0.506 -20.139 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.091 1.329 -20.938 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.197 1.095 -23.514 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.422 0.934 -24.065 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.155 0.852 -25.250 1.00 0.00 H new ATOM 657 N PRO A 44 26.080 4.661 -21.487 1.00 0.00 N ATOM 658 CA PRO A 44 25.758 5.885 -22.238 1.00 0.00 C ATOM 659 C PRO A 44 24.728 5.712 -23.362 1.00 0.00 C ATOM 660 O PRO A 44 23.824 6.536 -23.498 1.00 0.00 O ATOM 661 CB PRO A 44 27.095 6.407 -22.772 1.00 0.00 C ATOM 662 CG PRO A 44 28.083 5.934 -21.711 1.00 0.00 C ATOM 663 CD PRO A 44 27.530 4.563 -21.328 1.00 0.00 C ATOM 0 HA PRO A 44 25.266 6.592 -21.570 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.327 5.996 -23.755 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.096 7.492 -22.872 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.098 5.867 -22.103 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.116 6.611 -20.857 1.00 0.00 H new ATOM 0 HD2 PRO A 44 27.942 3.782 -21.968 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.795 4.307 -20.302 1.00 0.00 H new ATOM 671 N THR A 45 24.769 4.603 -24.107 1.00 0.00 N ATOM 672 CA THR A 45 23.757 4.321 -25.148 1.00 0.00 C ATOM 673 C THR A 45 22.380 4.050 -24.540 1.00 0.00 C ATOM 674 O THR A 45 21.375 4.456 -25.113 1.00 0.00 O ATOM 675 CB THR A 45 24.201 3.169 -26.073 1.00 0.00 C ATOM 676 OG1 THR A 45 25.517 3.412 -26.528 1.00 0.00 O ATOM 677 CG2 THR A 45 23.312 3.002 -27.304 1.00 0.00 C ATOM 0 H THR A 45 25.487 3.884 -24.015 1.00 0.00 H new ATOM 0 HA THR A 45 23.669 5.218 -25.762 1.00 0.00 H new ATOM 0 HB THR A 45 24.132 2.258 -25.479 1.00 0.00 H new ATOM 0 HG1 THR A 45 25.801 2.680 -27.114 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.681 2.175 -27.910 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.290 2.793 -26.989 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.330 3.919 -27.893 1.00 0.00 H new ATOM 685 N ALA A 46 22.300 3.482 -23.332 1.00 0.00 N ATOM 686 CA ALA A 46 21.037 3.349 -22.601 1.00 0.00 C ATOM 687 C ALA A 46 20.554 4.684 -22.002 1.00 0.00 C ATOM 688 O ALA A 46 19.378 4.809 -21.685 1.00 0.00 O ATOM 689 CB ALA A 46 21.173 2.244 -21.545 1.00 0.00 C ATOM 0 H ALA A 46 23.106 3.103 -22.836 1.00 0.00 H new ATOM 0 HA ALA A 46 20.259 3.059 -23.307 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.234 2.144 -21.000 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.411 1.300 -22.035 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.971 2.502 -20.849 1.00 0.00 H new ATOM 695 N ILE A 47 21.407 5.705 -21.869 1.00 0.00 N ATOM 696 CA ILE A 47 20.934 7.058 -21.530 1.00 0.00 C ATOM 697 C ILE A 47 20.226 7.619 -22.776 1.00 0.00 C ATOM 698 O ILE A 47 19.044 7.962 -22.733 1.00 0.00 O ATOM 699 CB ILE A 47 22.074 7.978 -21.031 1.00 0.00 C ATOM 700 CG1 ILE A 47 22.836 7.339 -19.845 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.479 9.339 -20.624 1.00 0.00 C ATOM 702 CD1 ILE A 47 24.053 8.134 -19.351 1.00 0.00 C ATOM 0 H ILE A 47 22.417 5.626 -21.988 1.00 0.00 H new ATOM 0 HA ILE A 47 20.237 7.011 -20.693 1.00 0.00 H new ATOM 0 HB ILE A 47 22.793 8.119 -21.838 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.143 7.212 -19.014 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.167 6.343 -20.140 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.276 9.994 -20.271 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.990 9.794 -21.485 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.749 9.194 -19.827 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.519 7.606 -18.519 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.772 8.240 -20.163 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.732 9.122 -19.019 1.00 0.00 H new ATOM 714 N ALA A 48 20.908 7.612 -23.928 1.00 0.00 N ATOM 715 CA ALA A 48 20.437 8.292 -25.136 1.00 0.00 C ATOM 716 C ALA A 48 19.291 7.576 -25.874 1.00 0.00 C ATOM 717 O ALA A 48 18.380 8.235 -26.371 1.00 0.00 O ATOM 718 CB ALA A 48 21.639 8.520 -26.061 1.00 0.00 C ATOM 0 H ALA A 48 21.801 7.134 -24.047 1.00 0.00 H new ATOM 0 HA ALA A 48 19.999 9.240 -24.824 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.309 9.026 -26.968 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.379 9.136 -25.550 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.084 7.560 -26.323 1.00 0.00 H new ATOM 724 N MET A 49 19.274 6.237 -25.904 1.00 0.00 N ATOM 725 CA MET A 49 18.188 5.449 -26.524 1.00 0.00 C ATOM 726 C MET A 49 16.877 5.480 -25.724 1.00 0.00 C ATOM 727 O MET A 49 15.858 4.988 -26.207 1.00 0.00 O ATOM 728 CB MET A 49 18.645 3.998 -26.741 1.00 0.00 C ATOM 729 CG MET A 49 19.783 3.850 -27.757 1.00 0.00 C ATOM 730 SD MET A 49 19.347 4.243 -29.472 1.00 0.00 S ATOM 731 CE MET A 49 20.057 5.909 -29.614 1.00 0.00 C ATOM 0 H MET A 49 20.013 5.663 -25.499 1.00 0.00 H new ATOM 0 HA MET A 49 17.973 5.919 -27.484 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.967 3.582 -25.786 1.00 0.00 H new ATOM 0 HB3 MET A 49 17.793 3.405 -27.075 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.607 4.496 -27.452 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.151 2.825 -27.719 1.00 0.00 H new ATOM 0 HE1 MET A 49 19.578 6.440 -30.437 1.00 0.00 H new ATOM 0 HE2 MET A 49 19.892 6.455 -28.685 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.127 5.833 -29.805 1.00 0.00 H new ATOM 741 N MET A 50 16.892 6.039 -24.510 1.00 0.00 N ATOM 742 CA MET A 50 15.773 5.987 -23.559 1.00 0.00 C ATOM 743 C MET A 50 15.317 7.385 -23.121 1.00 0.00 C ATOM 744 O MET A 50 14.124 7.583 -22.896 1.00 0.00 O ATOM 745 CB MET A 50 16.155 5.109 -22.355 1.00 0.00 C ATOM 746 CG MET A 50 16.868 3.805 -22.736 1.00 0.00 C ATOM 747 SD MET A 50 15.922 2.617 -23.698 1.00 0.00 S ATOM 748 CE MET A 50 17.229 1.386 -23.957 1.00 0.00 C ATOM 0 H MET A 50 17.698 6.551 -24.152 1.00 0.00 H new ATOM 0 HA MET A 50 14.918 5.536 -24.064 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.800 5.683 -21.690 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.253 4.867 -21.794 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.766 4.060 -23.299 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.195 3.316 -21.819 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.923 0.689 -24.737 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.147 1.889 -24.260 1.00 0.00 H new ATOM 0 HE3 MET A 50 17.403 0.840 -23.030 1.00 0.00 H new ATOM 758 N GLU A 51 16.196 8.394 -23.105 1.00 0.00 N ATOM 759 CA GLU A 51 15.777 9.790 -22.895 1.00 0.00 C ATOM 760 C GLU A 51 14.818 10.283 -24.000 1.00 0.00 C ATOM 761 O GLU A 51 13.947 11.113 -23.747 1.00 0.00 O ATOM 762 CB GLU A 51 16.978 10.732 -22.706 1.00 0.00 C ATOM 763 CG GLU A 51 17.746 11.062 -23.990 1.00 0.00 C ATOM 764 CD GLU A 51 18.908 12.035 -23.704 1.00 0.00 C ATOM 765 OE1 GLU A 51 18.650 13.256 -23.551 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.082 11.599 -23.645 1.00 0.00 O ATOM 0 H GLU A 51 17.201 8.273 -23.234 1.00 0.00 H new ATOM 0 HA GLU A 51 15.213 9.811 -21.962 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.625 11.663 -22.261 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.668 10.280 -21.993 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.135 10.144 -24.431 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.068 11.504 -24.720 1.00 0.00 H new ATOM 773 N GLU A 52 14.907 9.701 -25.205 1.00 0.00 N ATOM 774 CA GLU A 52 13.999 9.963 -26.337 1.00 0.00 C ATOM 775 C GLU A 52 12.568 9.402 -26.134 1.00 0.00 C ATOM 776 O GLU A 52 11.653 9.785 -26.866 1.00 0.00 O ATOM 777 CB GLU A 52 14.654 9.531 -27.667 1.00 0.00 C ATOM 778 CG GLU A 52 14.992 8.035 -27.760 1.00 0.00 C ATOM 779 CD GLU A 52 15.604 7.645 -29.123 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.497 8.338 -29.658 1.00 0.00 O ATOM 781 OE2 GLU A 52 15.219 6.590 -29.679 1.00 0.00 O ATOM 0 H GLU A 52 15.630 9.017 -25.427 1.00 0.00 H new ATOM 0 HA GLU A 52 13.845 11.041 -26.386 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.984 9.790 -28.487 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.569 10.106 -27.809 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.691 7.775 -26.965 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.087 7.451 -27.593 1.00 0.00 H new ATOM 788 N VAL A 53 12.353 8.547 -25.116 1.00 0.00 N ATOM 789 CA VAL A 53 11.017 8.104 -24.642 1.00 0.00 C ATOM 790 C VAL A 53 10.733 8.598 -23.207 1.00 0.00 C ATOM 791 O VAL A 53 9.787 8.156 -22.555 1.00 0.00 O ATOM 792 CB VAL A 53 10.726 6.598 -24.868 1.00 0.00 C ATOM 793 CG1 VAL A 53 11.107 6.157 -26.287 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.401 5.646 -23.874 1.00 0.00 C ATOM 0 H VAL A 53 13.118 8.132 -24.584 1.00 0.00 H new ATOM 0 HA VAL A 53 10.286 8.593 -25.285 1.00 0.00 H new ATOM 0 HB VAL A 53 9.651 6.521 -24.707 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.889 5.096 -26.409 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.532 6.731 -27.013 1.00 0.00 H new ATOM 0 HG13 VAL A 53 12.171 6.330 -26.448 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.135 4.617 -24.117 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.483 5.765 -23.934 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.066 5.878 -22.863 1.00 0.00 H new ATOM 804 N GLY A 54 11.543 9.551 -22.723 1.00 0.00 N ATOM 805 CA GLY A 54 11.378 10.259 -21.448 1.00 0.00 C ATOM 806 C GLY A 54 12.004 9.593 -20.214 1.00 0.00 C ATOM 807 O GLY A 54 11.726 10.031 -19.095 1.00 0.00 O ATOM 0 H GLY A 54 12.369 9.862 -23.235 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.806 11.256 -21.553 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.311 10.387 -21.263 1.00 0.00 H new ATOM 811 N ILE A 55 12.834 8.552 -20.379 1.00 0.00 N ATOM 812 CA ILE A 55 13.431 7.802 -19.252 1.00 0.00 C ATOM 813 C ILE A 55 14.714 8.470 -18.736 1.00 0.00 C ATOM 814 O ILE A 55 15.483 9.054 -19.501 1.00 0.00 O ATOM 815 CB ILE A 55 13.699 6.318 -19.604 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.590 5.662 -20.448 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.919 5.468 -18.340 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.177 5.725 -19.851 1.00 0.00 C ATOM 0 H ILE A 55 13.113 8.203 -21.296 1.00 0.00 H new ATOM 0 HA ILE A 55 12.690 7.822 -18.453 1.00 0.00 H new ATOM 0 HB ILE A 55 14.605 6.342 -20.209 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.573 6.140 -21.427 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.851 4.616 -20.608 1.00 0.00 H new ATOM 0 HG21 ILE A 55 14.104 4.432 -18.626 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.777 5.851 -17.789 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.031 5.517 -17.709 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.475 5.235 -20.525 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.167 5.219 -18.886 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.884 6.767 -19.718 1.00 0.00 H new ATOM 830 N ASP A 56 14.978 8.308 -17.440 1.00 0.00 N ATOM 831 CA ASP A 56 16.238 8.672 -16.782 1.00 0.00 C ATOM 832 C ASP A 56 16.874 7.452 -16.092 1.00 0.00 C ATOM 833 O ASP A 56 16.200 6.722 -15.362 1.00 0.00 O ATOM 834 CB ASP A 56 15.992 9.813 -15.784 1.00 0.00 C ATOM 835 CG ASP A 56 17.269 10.138 -14.994 1.00 0.00 C ATOM 836 OD1 ASP A 56 18.153 10.840 -15.536 1.00 0.00 O ATOM 837 OD2 ASP A 56 17.400 9.651 -13.845 1.00 0.00 O ATOM 0 H ASP A 56 14.298 7.906 -16.794 1.00 0.00 H new ATOM 0 HA ASP A 56 16.943 9.018 -17.538 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.654 10.701 -16.318 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.195 9.533 -15.095 1.00 0.00 H new ATOM 842 N ILE A 57 18.181 7.255 -16.304 1.00 0.00 N ATOM 843 CA ILE A 57 18.999 6.230 -15.619 1.00 0.00 C ATOM 844 C ILE A 57 20.365 6.747 -15.133 1.00 0.00 C ATOM 845 O ILE A 57 21.015 6.095 -14.319 1.00 0.00 O ATOM 846 CB ILE A 57 19.202 4.983 -16.514 1.00 0.00 C ATOM 847 CG1 ILE A 57 19.949 5.304 -17.828 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.869 4.269 -16.774 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.335 4.050 -18.616 1.00 0.00 C ATOM 0 H ILE A 57 18.717 7.812 -16.969 1.00 0.00 H new ATOM 0 HA ILE A 57 18.429 5.957 -14.731 1.00 0.00 H new ATOM 0 HB ILE A 57 19.847 4.299 -15.962 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.320 5.939 -18.452 1.00 0.00 H new ATOM 0 HG13 ILE A 57 20.849 5.874 -17.598 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.040 3.397 -17.405 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.435 3.951 -15.826 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.183 4.951 -17.276 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.856 4.340 -19.528 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.988 3.425 -18.008 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.435 3.491 -18.874 1.00 0.00 H new ATOM 861 N SER A 58 20.809 7.922 -15.596 1.00 0.00 N ATOM 862 CA SER A 58 22.168 8.452 -15.409 1.00 0.00 C ATOM 863 C SER A 58 22.595 8.590 -13.937 1.00 0.00 C ATOM 864 O SER A 58 23.774 8.431 -13.616 1.00 0.00 O ATOM 865 CB SER A 58 22.259 9.830 -16.085 1.00 0.00 C ATOM 866 OG SER A 58 21.587 9.819 -17.336 1.00 0.00 O ATOM 0 H SER A 58 20.212 8.553 -16.130 1.00 0.00 H new ATOM 0 HA SER A 58 22.847 7.729 -15.860 1.00 0.00 H new ATOM 0 HB2 SER A 58 21.820 10.589 -15.437 1.00 0.00 H new ATOM 0 HB3 SER A 58 23.305 10.101 -16.230 1.00 0.00 H new ATOM 0 HG SER A 58 21.654 10.704 -17.751 1.00 0.00 H new ATOM 872 N GLY A 59 21.639 8.872 -13.043 1.00 0.00 N ATOM 873 CA GLY A 59 21.849 9.029 -11.599 1.00 0.00 C ATOM 874 C GLY A 59 21.708 7.748 -10.761 1.00 0.00 C ATOM 875 O GLY A 59 21.789 7.825 -9.532 1.00 0.00 O ATOM 0 H GLY A 59 20.664 9.002 -13.315 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.846 9.438 -11.438 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.138 9.766 -11.225 1.00 0.00 H new ATOM 879 N GLN A 60 21.464 6.580 -11.375 1.00 0.00 N ATOM 880 CA GLN A 60 21.282 5.316 -10.639 1.00 0.00 C ATOM 881 C GLN A 60 22.612 4.742 -10.111 1.00 0.00 C ATOM 882 O GLN A 60 23.701 5.082 -10.585 1.00 0.00 O ATOM 883 CB GLN A 60 20.570 4.271 -11.512 1.00 0.00 C ATOM 884 CG GLN A 60 19.129 4.653 -11.880 1.00 0.00 C ATOM 885 CD GLN A 60 18.524 3.637 -12.844 1.00 0.00 C ATOM 886 OE1 GLN A 60 19.141 3.189 -13.793 1.00 0.00 O ATOM 887 NE2 GLN A 60 17.300 3.219 -12.656 1.00 0.00 N ATOM 0 H GLN A 60 21.387 6.483 -12.388 1.00 0.00 H new ATOM 0 HA GLN A 60 20.659 5.548 -9.775 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.143 4.124 -12.428 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.560 3.317 -10.986 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.522 4.709 -10.977 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.116 5.644 -12.335 1.00 0.00 H new ATOM 0 HE21 GLN A 60 16.755 3.574 -11.870 1.00 0.00 H new ATOM 0 HE22 GLN A 60 16.890 2.538 -13.295 1.00 0.00 H new ATOM 896 N THR A 61 22.507 3.836 -9.134 1.00 0.00 N ATOM 897 CA THR A 61 23.620 3.013 -8.633 1.00 0.00 C ATOM 898 C THR A 61 23.137 1.598 -8.272 1.00 0.00 C ATOM 899 O THR A 61 21.931 1.346 -8.182 1.00 0.00 O ATOM 900 CB THR A 61 24.326 3.712 -7.457 1.00 0.00 C ATOM 901 OG1 THR A 61 25.550 3.060 -7.195 1.00 0.00 O ATOM 902 CG2 THR A 61 23.502 3.747 -6.167 1.00 0.00 C ATOM 0 H THR A 61 21.626 3.648 -8.656 1.00 0.00 H new ATOM 0 HA THR A 61 24.358 2.901 -9.427 1.00 0.00 H new ATOM 0 HB THR A 61 24.476 4.747 -7.763 1.00 0.00 H new ATOM 0 HG1 THR A 61 26.003 3.503 -6.448 1.00 0.00 H new ATOM 0 HG21 THR A 61 24.069 4.256 -5.387 1.00 0.00 H new ATOM 0 HG22 THR A 61 22.569 4.282 -6.345 1.00 0.00 H new ATOM 0 HG23 THR A 61 23.281 2.728 -5.849 1.00 0.00 H new ATOM 910 N SER A 62 24.070 0.666 -8.074 1.00 0.00 N ATOM 911 CA SER A 62 23.813 -0.742 -7.746 1.00 0.00 C ATOM 912 C SER A 62 24.868 -1.290 -6.770 1.00 0.00 C ATOM 913 O SER A 62 25.947 -0.710 -6.606 1.00 0.00 O ATOM 914 CB SER A 62 23.774 -1.557 -9.038 1.00 0.00 C ATOM 915 OG SER A 62 23.310 -2.880 -8.816 1.00 0.00 O ATOM 0 H SER A 62 25.066 0.877 -8.140 1.00 0.00 H new ATOM 0 HA SER A 62 22.849 -0.822 -7.245 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.125 -1.061 -9.760 1.00 0.00 H new ATOM 0 HB3 SER A 62 24.772 -1.591 -9.476 1.00 0.00 H new ATOM 0 HG SER A 62 23.054 -3.285 -9.671 1.00 0.00 H new ATOM 921 N ASP A 63 24.542 -2.399 -6.106 1.00 0.00 N ATOM 922 CA ASP A 63 25.398 -3.119 -5.156 1.00 0.00 C ATOM 923 C ASP A 63 25.038 -4.621 -5.155 1.00 0.00 C ATOM 924 O ASP A 63 23.922 -4.970 -5.563 1.00 0.00 O ATOM 925 CB ASP A 63 25.233 -2.551 -3.734 1.00 0.00 C ATOM 926 CG ASP A 63 25.984 -1.228 -3.516 1.00 0.00 C ATOM 927 OD1 ASP A 63 27.238 -1.255 -3.458 1.00 0.00 O ATOM 928 OD2 ASP A 63 25.330 -0.174 -3.323 1.00 0.00 O ATOM 0 H ASP A 63 23.631 -2.843 -6.220 1.00 0.00 H new ATOM 0 HA ASP A 63 26.435 -2.992 -5.467 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.173 -2.396 -3.533 1.00 0.00 H new ATOM 0 HB3 ASP A 63 25.590 -3.286 -3.013 1.00 0.00 H new ATOM 933 N PRO A 64 25.933 -5.517 -4.684 1.00 0.00 N ATOM 934 CA PRO A 64 25.651 -6.947 -4.529 1.00 0.00 C ATOM 935 C PRO A 64 24.417 -7.213 -3.660 1.00 0.00 C ATOM 936 O PRO A 64 24.275 -6.629 -2.584 1.00 0.00 O ATOM 937 CB PRO A 64 26.912 -7.555 -3.898 1.00 0.00 C ATOM 938 CG PRO A 64 28.021 -6.593 -4.319 1.00 0.00 C ATOM 939 CD PRO A 64 27.308 -5.245 -4.286 1.00 0.00 C ATOM 0 HA PRO A 64 25.420 -7.397 -5.495 1.00 0.00 H new ATOM 0 HB2 PRO A 64 26.827 -7.619 -2.813 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.097 -8.565 -4.264 1.00 0.00 H new ATOM 0 HG2 PRO A 64 28.868 -6.623 -3.633 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.407 -6.825 -5.312 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.348 -4.805 -3.289 1.00 0.00 H new ATOM 0 HD3 PRO A 64 27.780 -4.536 -4.966 1.00 0.00 H new ATOM 947 N ILE A 65 23.539 -8.122 -4.090 1.00 0.00 N ATOM 948 CA ILE A 65 22.218 -8.325 -3.465 1.00 0.00 C ATOM 949 C ILE A 65 22.270 -8.675 -1.968 1.00 0.00 C ATOM 950 O ILE A 65 21.412 -8.239 -1.204 1.00 0.00 O ATOM 951 CB ILE A 65 21.406 -9.352 -4.293 1.00 0.00 C ATOM 952 CG1 ILE A 65 19.912 -9.282 -3.910 1.00 0.00 C ATOM 953 CG2 ILE A 65 21.968 -10.785 -4.172 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.021 -10.167 -4.784 1.00 0.00 C ATOM 0 H ILE A 65 23.718 -8.741 -4.881 1.00 0.00 H new ATOM 0 HA ILE A 65 21.702 -7.365 -3.484 1.00 0.00 H new ATOM 0 HB ILE A 65 21.503 -9.083 -5.345 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.797 -9.579 -2.868 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.573 -8.249 -3.986 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.363 -11.465 -4.771 1.00 0.00 H new ATOM 0 HG22 ILE A 65 22.997 -10.804 -4.531 1.00 0.00 H new ATOM 0 HG23 ILE A 65 21.942 -11.099 -3.129 1.00 0.00 H new ATOM 0 HD11 ILE A 65 17.984 -10.071 -4.461 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.108 -9.855 -5.825 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.335 -11.206 -4.689 1.00 0.00 H new ATOM 966 N GLU A 66 23.316 -9.374 -1.515 1.00 0.00 N ATOM 967 CA GLU A 66 23.482 -9.769 -0.105 1.00 0.00 C ATOM 968 C GLU A 66 23.749 -8.586 0.851 1.00 0.00 C ATOM 969 O GLU A 66 23.645 -8.753 2.068 1.00 0.00 O ATOM 970 CB GLU A 66 24.590 -10.829 0.017 1.00 0.00 C ATOM 971 CG GLU A 66 24.266 -12.125 -0.738 1.00 0.00 C ATOM 972 CD GLU A 66 25.350 -13.189 -0.479 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.371 -13.218 -1.211 1.00 0.00 O ATOM 974 OE2 GLU A 66 25.189 -14.008 0.460 1.00 0.00 O ATOM 0 H GLU A 66 24.078 -9.685 -2.117 1.00 0.00 H new ATOM 0 HA GLU A 66 22.528 -10.191 0.211 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.524 -10.416 -0.365 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.751 -11.059 1.070 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.294 -12.504 -0.421 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.196 -11.922 -1.807 1.00 0.00 H new ATOM 981 N ASN A 67 24.051 -7.383 0.333 1.00 0.00 N ATOM 982 CA ASN A 67 24.146 -6.162 1.148 1.00 0.00 C ATOM 983 C ASN A 67 22.760 -5.605 1.557 1.00 0.00 C ATOM 984 O ASN A 67 22.669 -4.844 2.523 1.00 0.00 O ATOM 985 CB ASN A 67 25.027 -5.107 0.432 1.00 0.00 C ATOM 986 CG ASN A 67 24.221 -3.980 -0.207 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.109 -2.880 0.315 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.605 -4.227 -1.334 1.00 0.00 N ATOM 0 H ASN A 67 24.235 -7.231 -0.659 1.00 0.00 H new ATOM 0 HA ASN A 67 24.634 -6.425 2.087 1.00 0.00 H new ATOM 0 HB2 ASN A 67 25.727 -4.681 1.150 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.620 -5.601 -0.337 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.035 -3.504 -1.773 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.695 -5.143 -1.774 1.00 0.00 H new ATOM 995 N PHE A 68 21.692 -5.963 0.832 1.00 0.00 N ATOM 996 CA PHE A 68 20.324 -5.474 1.046 1.00 0.00 C ATOM 997 C PHE A 68 19.482 -6.418 1.933 1.00 0.00 C ATOM 998 O PHE A 68 19.848 -7.568 2.184 1.00 0.00 O ATOM 999 CB PHE A 68 19.647 -5.227 -0.319 1.00 0.00 C ATOM 1000 CG PHE A 68 20.314 -4.208 -1.224 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.537 -2.892 -0.774 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.692 -4.567 -2.531 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.137 -1.948 -1.623 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.304 -3.626 -3.375 1.00 0.00 C ATOM 1005 CZ PHE A 68 21.515 -2.315 -2.927 1.00 0.00 C ATOM 0 H PHE A 68 21.759 -6.622 0.056 1.00 0.00 H new ATOM 0 HA PHE A 68 20.386 -4.533 1.593 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.595 -6.176 -0.852 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.621 -4.906 -0.139 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.246 -2.608 0.227 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.511 -5.571 -2.887 1.00 0.00 H new ATOM 0 HE1 PHE A 68 21.308 -0.940 -1.275 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.612 -3.913 -4.370 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.968 -1.586 -3.583 1.00 0.00 H new ATOM 1015 N ASN A 69 18.324 -5.917 2.386 1.00 0.00 N ATOM 1016 CA ASN A 69 17.337 -6.638 3.203 1.00 0.00 C ATOM 1017 C ASN A 69 16.019 -6.832 2.431 1.00 0.00 C ATOM 1018 O ASN A 69 15.272 -5.875 2.224 1.00 0.00 O ATOM 1019 CB ASN A 69 17.147 -5.896 4.548 1.00 0.00 C ATOM 1020 CG ASN A 69 17.147 -4.368 4.474 1.00 0.00 C ATOM 1021 OD1 ASN A 69 17.913 -3.696 5.149 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.318 -3.761 3.650 1.00 0.00 N ATOM 0 H ASN A 69 18.038 -4.959 2.185 1.00 0.00 H new ATOM 0 HA ASN A 69 17.702 -7.640 3.426 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.204 -6.219 4.989 1.00 0.00 H new ATOM 0 HB3 ASN A 69 17.940 -6.208 5.228 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.321 -2.743 3.581 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.673 -4.309 3.080 1.00 0.00 H new ATOM 1029 N ALA A 70 15.693 -8.058 2.024 1.00 0.00 N ATOM 1030 CA ALA A 70 14.584 -8.344 1.110 1.00 0.00 C ATOM 1031 C ALA A 70 13.185 -8.051 1.681 1.00 0.00 C ATOM 1032 O ALA A 70 12.227 -7.870 0.928 1.00 0.00 O ATOM 1033 CB ALA A 70 14.690 -9.812 0.725 1.00 0.00 C ATOM 0 H ALA A 70 16.197 -8.893 2.323 1.00 0.00 H new ATOM 0 HA ALA A 70 14.679 -7.676 0.254 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.880 -10.069 0.042 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.647 -9.992 0.236 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.619 -10.429 1.621 1.00 0.00 H new ATOM 1039 N ASP A 71 13.065 -7.976 3.008 1.00 0.00 N ATOM 1040 CA ASP A 71 11.798 -7.728 3.714 1.00 0.00 C ATOM 1041 C ASP A 71 11.205 -6.345 3.388 1.00 0.00 C ATOM 1042 O ASP A 71 9.991 -6.142 3.430 1.00 0.00 O ATOM 1043 CB ASP A 71 12.073 -7.793 5.222 1.00 0.00 C ATOM 1044 CG ASP A 71 10.775 -7.744 6.047 1.00 0.00 C ATOM 1045 OD1 ASP A 71 9.969 -8.701 5.967 1.00 0.00 O ATOM 1046 OD2 ASP A 71 10.574 -6.767 6.808 1.00 0.00 O ATOM 0 H ASP A 71 13.859 -8.088 3.638 1.00 0.00 H new ATOM 0 HA ASP A 71 11.079 -8.482 3.394 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.615 -8.710 5.453 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.717 -6.962 5.509 1.00 0.00 H new ATOM 1051 N ASP A 72 12.082 -5.402 3.041 1.00 0.00 N ATOM 1052 CA ASP A 72 11.755 -4.022 2.697 1.00 0.00 C ATOM 1053 C ASP A 72 11.410 -3.855 1.203 1.00 0.00 C ATOM 1054 O ASP A 72 11.048 -2.760 0.774 1.00 0.00 O ATOM 1055 CB ASP A 72 12.940 -3.155 3.134 1.00 0.00 C ATOM 1056 CG ASP A 72 12.621 -1.652 3.115 1.00 0.00 C ATOM 1057 OD1 ASP A 72 11.680 -1.215 3.821 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.339 -0.887 2.428 1.00 0.00 O ATOM 0 H ASP A 72 13.083 -5.590 2.991 1.00 0.00 H new ATOM 0 HA ASP A 72 10.852 -3.705 3.219 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.244 -3.444 4.140 1.00 0.00 H new ATOM 0 HB3 ASP A 72 13.788 -3.350 2.477 1.00 0.00 H new ATOM 1063 N TYR A 73 11.494 -4.943 0.425 1.00 0.00 N ATOM 1064 CA TYR A 73 11.135 -5.042 -0.985 1.00 0.00 C ATOM 1065 C TYR A 73 10.019 -6.075 -1.114 1.00 0.00 C ATOM 1066 O TYR A 73 10.252 -7.237 -1.440 1.00 0.00 O ATOM 1067 CB TYR A 73 12.368 -5.379 -1.832 1.00 0.00 C ATOM 1068 CG TYR A 73 13.504 -4.404 -1.617 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.580 -3.218 -2.367 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.446 -4.655 -0.607 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.602 -2.289 -2.097 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.463 -3.727 -0.323 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.541 -2.529 -1.070 1.00 0.00 C ATOM 1074 OH TYR A 73 16.512 -1.609 -0.814 1.00 0.00 O ATOM 0 H TYR A 73 11.837 -5.830 0.793 1.00 0.00 H new ATOM 0 HA TYR A 73 10.768 -4.088 -1.365 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.707 -6.386 -1.589 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.091 -5.382 -2.886 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.858 -3.021 -3.146 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.389 -5.573 -0.041 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.669 -1.383 -2.681 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.179 -3.928 0.460 1.00 0.00 H new ATOM 0 HH TYR A 73 17.076 -1.925 -0.077 1.00 0.00 H new ATOM 1084 N ASP A 74 8.797 -5.642 -0.812 1.00 0.00 N ATOM 1085 CA ASP A 74 7.562 -6.441 -0.831 1.00 0.00 C ATOM 1086 C ASP A 74 7.337 -7.175 -2.163 1.00 0.00 C ATOM 1087 O ASP A 74 6.658 -8.201 -2.205 1.00 0.00 O ATOM 1088 CB ASP A 74 6.354 -5.517 -0.599 1.00 0.00 C ATOM 1089 CG ASP A 74 6.601 -4.447 0.476 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.270 -3.440 0.134 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.129 -4.610 1.628 1.00 0.00 O ATOM 0 H ASP A 74 8.627 -4.676 -0.532 1.00 0.00 H new ATOM 0 HA ASP A 74 7.665 -7.188 -0.044 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.096 -5.026 -1.537 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.494 -6.121 -0.309 1.00 0.00 H new ATOM 1096 N VAL A 75 7.899 -6.642 -3.252 1.00 0.00 N ATOM 1097 CA VAL A 75 7.777 -7.144 -4.621 1.00 0.00 C ATOM 1098 C VAL A 75 9.173 -7.201 -5.258 1.00 0.00 C ATOM 1099 O VAL A 75 9.945 -6.247 -5.154 1.00 0.00 O ATOM 1100 CB VAL A 75 6.780 -6.252 -5.391 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.687 -6.648 -6.869 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.371 -6.345 -4.789 1.00 0.00 C ATOM 0 H VAL A 75 8.481 -5.806 -3.198 1.00 0.00 H new ATOM 0 HA VAL A 75 7.379 -8.158 -4.646 1.00 0.00 H new ATOM 0 HB VAL A 75 7.158 -5.233 -5.308 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.975 -5.997 -7.376 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.667 -6.547 -7.335 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.352 -7.682 -6.948 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.692 -5.706 -5.353 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.022 -7.377 -4.837 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.397 -6.019 -3.749 1.00 0.00 H new ATOM 1112 N VAL A 76 9.533 -8.315 -5.906 1.00 0.00 N ATOM 1113 CA VAL A 76 10.888 -8.525 -6.470 1.00 0.00 C ATOM 1114 C VAL A 76 10.802 -9.096 -7.889 1.00 0.00 C ATOM 1115 O VAL A 76 10.237 -10.167 -8.099 1.00 0.00 O ATOM 1116 CB VAL A 76 11.740 -9.428 -5.548 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.089 -9.805 -6.182 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.065 -8.753 -4.201 1.00 0.00 C ATOM 0 H VAL A 76 8.900 -9.100 -6.058 1.00 0.00 H new ATOM 0 HA VAL A 76 11.386 -7.557 -6.530 1.00 0.00 H new ATOM 0 HB VAL A 76 11.126 -10.315 -5.394 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.649 -10.439 -5.495 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.915 -10.344 -7.114 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.660 -8.900 -6.387 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.665 -9.428 -3.591 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.623 -7.834 -4.380 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.138 -8.519 -3.678 1.00 0.00 H new ATOM 1128 N ILE A 77 11.367 -8.385 -8.867 1.00 0.00 N ATOM 1129 CA ILE A 77 11.417 -8.783 -10.283 1.00 0.00 C ATOM 1130 C ILE A 77 12.869 -9.086 -10.652 1.00 0.00 C ATOM 1131 O ILE A 77 13.738 -8.223 -10.544 1.00 0.00 O ATOM 1132 CB ILE A 77 10.830 -7.677 -11.206 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.285 -7.513 -11.234 1.00 0.00 C ATOM 1134 CG2 ILE A 77 11.258 -7.881 -12.678 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.512 -7.944 -9.988 1.00 0.00 C ATOM 0 H ILE A 77 11.818 -7.487 -8.694 1.00 0.00 H new ATOM 0 HA ILE A 77 10.805 -9.673 -10.428 1.00 0.00 H new ATOM 0 HB ILE A 77 11.244 -6.779 -10.748 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.061 -6.463 -11.424 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.901 -8.080 -12.082 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.830 -7.090 -13.294 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.345 -7.848 -12.749 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.901 -8.849 -13.030 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.447 -7.775 -10.144 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.688 -9.003 -9.799 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.850 -7.362 -9.131 1.00 0.00 H new ATOM 1147 N SER A 78 13.131 -10.299 -11.122 1.00 0.00 N ATOM 1148 CA SER A 78 14.396 -10.697 -11.739 1.00 0.00 C ATOM 1149 C SER A 78 14.303 -10.523 -13.261 1.00 0.00 C ATOM 1150 O SER A 78 13.210 -10.538 -13.829 1.00 0.00 O ATOM 1151 CB SER A 78 14.749 -12.122 -11.309 1.00 0.00 C ATOM 1152 OG SER A 78 15.858 -12.610 -12.034 1.00 0.00 O ATOM 0 H SER A 78 12.451 -11.058 -11.085 1.00 0.00 H new ATOM 0 HA SER A 78 15.211 -10.057 -11.400 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.972 -12.139 -10.242 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.891 -12.776 -11.466 1.00 0.00 H new ATOM 0 HG SER A 78 15.543 -13.147 -12.791 1.00 0.00 H new ATOM 1158 N LEU A 79 15.439 -10.338 -13.936 1.00 0.00 N ATOM 1159 CA LEU A 79 15.540 -10.255 -15.400 1.00 0.00 C ATOM 1160 C LEU A 79 16.577 -11.253 -15.949 1.00 0.00 C ATOM 1161 O LEU A 79 17.443 -10.888 -16.740 1.00 0.00 O ATOM 1162 CB LEU A 79 15.778 -8.797 -15.856 1.00 0.00 C ATOM 1163 CG LEU A 79 14.683 -7.799 -15.427 1.00 0.00 C ATOM 1164 CD1 LEU A 79 15.064 -7.049 -14.148 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.448 -6.739 -16.505 1.00 0.00 C ATOM 0 H LEU A 79 16.341 -10.239 -13.470 1.00 0.00 H new ATOM 0 HA LEU A 79 14.586 -10.555 -15.834 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.735 -8.458 -15.458 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.860 -8.780 -16.943 1.00 0.00 H new ATOM 0 HG LEU A 79 13.786 -8.396 -15.263 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.266 -6.356 -13.881 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.211 -7.763 -13.338 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.987 -6.493 -14.314 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.671 -6.050 -16.174 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.372 -6.187 -16.680 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.134 -7.224 -17.429 1.00 0.00 H new ATOM 1177 N CYS A 80 16.527 -12.500 -15.469 1.00 0.00 N ATOM 1178 CA CYS A 80 17.446 -13.581 -15.847 1.00 0.00 C ATOM 1179 C CYS A 80 16.756 -14.658 -16.711 1.00 0.00 C ATOM 1180 O CYS A 80 17.381 -15.219 -17.615 1.00 0.00 O ATOM 1181 CB CYS A 80 18.043 -14.194 -14.575 1.00 0.00 C ATOM 1182 SG CYS A 80 18.829 -12.918 -13.538 1.00 0.00 S ATOM 0 H CYS A 80 15.827 -12.794 -14.788 1.00 0.00 H new ATOM 0 HA CYS A 80 18.242 -13.160 -16.461 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.260 -14.696 -14.008 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.778 -14.952 -14.844 1.00 0.00 H new ATOM 0 HG CYS A 80 17.964 -12.461 -12.682 1.00 0.00 H new ATOM 1229 N ASN A 85 19.977 -17.078 -9.251 1.00 0.00 N ATOM 1230 CA ASN A 85 20.521 -17.454 -7.942 1.00 0.00 C ATOM 1231 C ASN A 85 20.145 -16.380 -6.902 1.00 0.00 C ATOM 1232 O ASN A 85 20.565 -15.230 -7.033 1.00 0.00 O ATOM 1233 CB ASN A 85 22.044 -17.657 -8.079 1.00 0.00 C ATOM 1234 CG ASN A 85 22.716 -18.152 -6.801 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.087 -18.446 -5.794 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.025 -18.268 -6.804 1.00 0.00 N ATOM 0 HA ASN A 85 20.095 -18.394 -7.591 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.236 -18.372 -8.880 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.502 -16.714 -8.377 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.509 -18.601 -5.970 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.557 -18.025 -7.640 1.00 0.00 H new ATOM 1243 N LEU A 86 19.343 -16.739 -5.893 1.00 0.00 N ATOM 1244 CA LEU A 86 18.827 -15.817 -4.874 1.00 0.00 C ATOM 1245 C LEU A 86 18.798 -16.454 -3.469 1.00 0.00 C ATOM 1246 O LEU A 86 18.368 -17.606 -3.345 1.00 0.00 O ATOM 1247 CB LEU A 86 17.385 -15.400 -5.234 1.00 0.00 C ATOM 1248 CG LEU A 86 17.226 -14.425 -6.410 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.738 -14.175 -6.657 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.871 -13.067 -6.144 1.00 0.00 C ATOM 0 H LEU A 86 19.028 -17.700 -5.759 1.00 0.00 H new ATOM 0 HA LEU A 86 19.497 -14.958 -4.855 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.815 -16.302 -5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.931 -14.948 -4.352 1.00 0.00 H new ATOM 0 HG LEU A 86 17.718 -14.885 -7.267 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.619 -13.483 -7.491 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.245 -15.118 -6.894 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.288 -13.745 -5.762 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.727 -12.420 -7.009 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.410 -12.610 -5.268 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.938 -13.200 -5.964 1.00 0.00 H new ATOM 1262 N PRO A 87 19.181 -15.712 -2.408 1.00 0.00 N ATOM 1263 CA PRO A 87 18.958 -16.148 -1.028 1.00 0.00 C ATOM 1264 C PRO A 87 17.443 -16.268 -0.743 1.00 0.00 C ATOM 1265 O PRO A 87 16.661 -15.532 -1.356 1.00 0.00 O ATOM 1266 CB PRO A 87 19.641 -15.100 -0.135 1.00 0.00 C ATOM 1267 CG PRO A 87 20.654 -14.425 -1.061 1.00 0.00 C ATOM 1268 CD PRO A 87 19.986 -14.497 -2.434 1.00 0.00 C ATOM 0 HA PRO A 87 19.377 -17.135 -0.834 1.00 0.00 H new ATOM 0 HB2 PRO A 87 18.922 -14.382 0.260 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.131 -15.564 0.721 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.847 -13.395 -0.762 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.613 -14.944 -1.053 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.367 -13.619 -2.616 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.729 -14.534 -3.231 1.00 0.00 H new ATOM 1276 N PRO A 88 16.987 -17.126 0.197 1.00 0.00 N ATOM 1277 CA PRO A 88 15.559 -17.443 0.363 1.00 0.00 C ATOM 1278 C PRO A 88 14.644 -16.243 0.644 1.00 0.00 C ATOM 1279 O PRO A 88 13.481 -16.228 0.242 1.00 0.00 O ATOM 1280 CB PRO A 88 15.497 -18.452 1.513 1.00 0.00 C ATOM 1281 CG PRO A 88 16.859 -19.135 1.465 1.00 0.00 C ATOM 1282 CD PRO A 88 17.796 -18.012 1.029 1.00 0.00 C ATOM 0 HA PRO A 88 15.176 -17.831 -0.581 1.00 0.00 H new ATOM 0 HB2 PRO A 88 15.329 -17.959 2.470 1.00 0.00 H new ATOM 0 HB3 PRO A 88 14.685 -19.166 1.376 1.00 0.00 H new ATOM 0 HG2 PRO A 88 17.141 -19.540 2.437 1.00 0.00 H new ATOM 0 HG3 PRO A 88 16.869 -19.965 0.758 1.00 0.00 H new ATOM 0 HD2 PRO A 88 18.199 -17.481 1.891 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.646 -18.405 0.471 1.00 0.00 H new ATOM 1290 N GLU A 89 15.168 -15.196 1.286 1.00 0.00 N ATOM 1291 CA GLU A 89 14.406 -13.975 1.580 1.00 0.00 C ATOM 1292 C GLU A 89 14.019 -13.157 0.328 1.00 0.00 C ATOM 1293 O GLU A 89 13.083 -12.362 0.396 1.00 0.00 O ATOM 1294 CB GLU A 89 15.143 -13.144 2.639 1.00 0.00 C ATOM 1295 CG GLU A 89 16.518 -12.615 2.200 1.00 0.00 C ATOM 1296 CD GLU A 89 17.111 -11.673 3.271 1.00 0.00 C ATOM 1297 OE1 GLU A 89 17.769 -12.175 4.218 1.00 0.00 O ATOM 1298 OE2 GLU A 89 16.926 -10.433 3.178 1.00 0.00 O ATOM 0 H GLU A 89 16.132 -15.169 1.618 1.00 0.00 H new ATOM 0 HA GLU A 89 13.445 -14.283 1.992 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.516 -12.297 2.918 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.272 -13.753 3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.196 -13.451 2.029 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.423 -12.083 1.254 1.00 0.00 H new ATOM 1305 N TRP A 90 14.668 -13.373 -0.824 1.00 0.00 N ATOM 1306 CA TRP A 90 14.389 -12.665 -2.090 1.00 0.00 C ATOM 1307 C TRP A 90 13.349 -13.347 -3.001 1.00 0.00 C ATOM 1308 O TRP A 90 13.019 -12.802 -4.054 1.00 0.00 O ATOM 1309 CB TRP A 90 15.709 -12.417 -2.834 1.00 0.00 C ATOM 1310 CG TRP A 90 16.607 -11.433 -2.159 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.637 -11.731 -1.336 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.499 -9.980 -2.153 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.171 -10.567 -0.820 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.472 -9.462 -1.251 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.629 -9.052 -2.765 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.530 -8.107 -0.913 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.690 -7.683 -2.446 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.623 -7.210 -1.504 1.00 0.00 C ATOM 0 H TRP A 90 15.418 -14.059 -0.908 1.00 0.00 H new ATOM 0 HA TRP A 90 13.923 -11.718 -1.818 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.238 -13.364 -2.941 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.487 -12.061 -3.840 1.00 0.00 H new ATOM 0 HD1 TRP A 90 17.989 -12.728 -1.116 1.00 0.00 H new ATOM 0 HE1 TRP A 90 18.980 -10.530 -0.199 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.906 -9.398 -3.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.264 -7.753 -0.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.016 -6.990 -2.927 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.642 -6.164 -1.237 1.00 0.00 H new ATOM 1329 N VAL A 91 12.840 -14.527 -2.622 1.00 0.00 N ATOM 1330 CA VAL A 91 11.849 -15.316 -3.399 1.00 0.00 C ATOM 1331 C VAL A 91 10.512 -15.549 -2.671 1.00 0.00 C ATOM 1332 O VAL A 91 9.599 -16.163 -3.222 1.00 0.00 O ATOM 1333 CB VAL A 91 12.450 -16.669 -3.835 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.598 -16.480 -4.831 1.00 0.00 C ATOM 1335 CG2 VAL A 91 12.962 -17.479 -2.636 1.00 0.00 C ATOM 0 H VAL A 91 13.106 -14.978 -1.747 1.00 0.00 H new ATOM 0 HA VAL A 91 11.618 -14.707 -4.273 1.00 0.00 H new ATOM 0 HB VAL A 91 11.642 -17.219 -4.317 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.997 -17.454 -5.116 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.229 -15.965 -5.718 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.387 -15.886 -4.369 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.377 -18.424 -2.986 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.736 -16.912 -2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.137 -17.676 -1.951 1.00 0.00 H new ATOM 1345 N THR A 92 10.391 -15.070 -1.430 1.00 0.00 N ATOM 1346 CA THR A 92 9.272 -15.337 -0.495 1.00 0.00 C ATOM 1347 C THR A 92 8.254 -14.174 -0.411 1.00 0.00 C ATOM 1348 O THR A 92 7.249 -14.233 0.301 1.00 0.00 O ATOM 1349 CB THR A 92 9.860 -15.774 0.864 1.00 0.00 C ATOM 1350 OG1 THR A 92 8.863 -16.232 1.756 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.673 -14.668 1.527 1.00 0.00 C ATOM 0 H THR A 92 11.097 -14.457 -1.022 1.00 0.00 H new ATOM 0 HA THR A 92 8.667 -16.158 -0.880 1.00 0.00 H new ATOM 0 HB THR A 92 10.530 -16.604 0.639 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.032 -15.737 1.599 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.065 -15.025 2.479 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.501 -14.386 0.877 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.035 -13.801 1.699 1.00 0.00 H new ATOM 1359 N GLN A 93 8.497 -13.112 -1.188 1.00 0.00 N ATOM 1360 CA GLN A 93 7.648 -11.934 -1.396 1.00 0.00 C ATOM 1361 C GLN A 93 6.211 -12.268 -1.837 1.00 0.00 C ATOM 1362 O GLN A 93 5.946 -13.327 -2.411 1.00 0.00 O ATOM 1363 CB GLN A 93 8.311 -11.050 -2.474 1.00 0.00 C ATOM 1364 CG GLN A 93 9.401 -10.128 -1.909 1.00 0.00 C ATOM 1365 CD GLN A 93 10.683 -10.834 -1.468 1.00 0.00 C ATOM 1366 OE1 GLN A 93 10.952 -11.976 -1.817 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.520 -10.214 -0.672 1.00 0.00 N ATOM 0 H GLN A 93 9.359 -13.050 -1.729 1.00 0.00 H new ATOM 0 HA GLN A 93 7.563 -11.425 -0.436 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.746 -11.689 -3.242 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.546 -10.444 -2.959 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.655 -9.386 -2.666 1.00 0.00 H new ATOM 0 HG3 GLN A 93 8.991 -9.587 -1.056 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.322 -9.262 -0.365 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.370 -10.684 -0.360 1.00 0.00 H new ATOM 1376 N GLU A 94 5.286 -11.319 -1.628 1.00 0.00 N ATOM 1377 CA GLU A 94 3.887 -11.475 -2.057 1.00 0.00 C ATOM 1378 C GLU A 94 3.739 -11.576 -3.586 1.00 0.00 C ATOM 1379 O GLU A 94 2.888 -12.330 -4.067 1.00 0.00 O ATOM 1380 CB GLU A 94 2.996 -10.358 -1.482 1.00 0.00 C ATOM 1381 CG GLU A 94 3.407 -8.913 -1.800 1.00 0.00 C ATOM 1382 CD GLU A 94 2.327 -7.928 -1.316 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.334 -7.549 -0.119 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.454 -7.530 -2.126 1.00 0.00 O ATOM 0 H GLU A 94 5.482 -10.433 -1.163 1.00 0.00 H new ATOM 0 HA GLU A 94 3.544 -12.426 -1.649 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.981 -10.511 -1.848 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.965 -10.472 -0.398 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.358 -8.685 -1.319 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.557 -8.799 -2.874 1.00 0.00 H new ATOM 1391 N ILE A 95 4.586 -10.861 -4.345 1.00 0.00 N ATOM 1392 CA ILE A 95 4.655 -10.930 -5.815 1.00 0.00 C ATOM 1393 C ILE A 95 6.122 -11.033 -6.269 1.00 0.00 C ATOM 1394 O ILE A 95 6.973 -10.239 -5.861 1.00 0.00 O ATOM 1395 CB ILE A 95 3.900 -9.743 -6.467 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.418 -9.728 -6.012 1.00 0.00 C ATOM 1397 CG2 ILE A 95 4.001 -9.793 -8.005 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.592 -8.537 -6.493 1.00 0.00 C ATOM 0 H ILE A 95 5.257 -10.205 -3.945 1.00 0.00 H new ATOM 0 HA ILE A 95 4.147 -11.832 -6.157 1.00 0.00 H new ATOM 0 HB ILE A 95 4.373 -8.819 -6.135 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.940 -10.643 -6.361 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.391 -9.750 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.462 -8.948 -8.433 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.048 -9.743 -8.303 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.564 -10.723 -8.368 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.572 -8.626 -6.118 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.035 -7.613 -6.122 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.578 -8.520 -7.583 1.00 0.00 H new ATOM 1410 N PHE A 96 6.400 -12.004 -7.144 1.00 0.00 N ATOM 1411 CA PHE A 96 7.716 -12.259 -7.738 1.00 0.00 C ATOM 1412 C PHE A 96 7.616 -12.463 -9.261 1.00 0.00 C ATOM 1413 O PHE A 96 6.616 -12.985 -9.758 1.00 0.00 O ATOM 1414 CB PHE A 96 8.360 -13.471 -7.047 1.00 0.00 C ATOM 1415 CG PHE A 96 9.782 -13.779 -7.490 1.00 0.00 C ATOM 1416 CD1 PHE A 96 10.024 -14.639 -8.581 1.00 0.00 C ATOM 1417 CD2 PHE A 96 10.871 -13.197 -6.816 1.00 0.00 C ATOM 1418 CE1 PHE A 96 11.341 -14.913 -8.990 1.00 0.00 C ATOM 1419 CE2 PHE A 96 12.187 -13.460 -7.233 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.423 -14.318 -8.321 1.00 0.00 C ATOM 0 H PHE A 96 5.689 -12.658 -7.470 1.00 0.00 H new ATOM 0 HA PHE A 96 8.350 -11.387 -7.581 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.359 -13.300 -5.970 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.739 -14.348 -7.231 1.00 0.00 H new ATOM 0 HD1 PHE A 96 9.194 -15.089 -9.105 1.00 0.00 H new ATOM 0 HD2 PHE A 96 10.695 -12.545 -5.974 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.521 -15.581 -9.819 1.00 0.00 H new ATOM 0 HE2 PHE A 96 13.018 -13.002 -6.717 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.434 -14.519 -8.642 1.00 0.00 H new ATOM 1430 N GLU A 97 8.660 -12.082 -10.000 1.00 0.00 N ATOM 1431 CA GLU A 97 8.804 -12.327 -11.447 1.00 0.00 C ATOM 1432 C GLU A 97 10.259 -12.674 -11.815 1.00 0.00 C ATOM 1433 O GLU A 97 11.185 -12.283 -11.107 1.00 0.00 O ATOM 1434 CB GLU A 97 8.413 -11.075 -12.255 1.00 0.00 C ATOM 1435 CG GLU A 97 6.999 -10.499 -12.065 1.00 0.00 C ATOM 1436 CD GLU A 97 5.850 -11.403 -12.564 1.00 0.00 C ATOM 1437 OE1 GLU A 97 6.094 -12.406 -13.279 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.674 -11.058 -12.294 1.00 0.00 O ATOM 0 H GLU A 97 9.454 -11.580 -9.602 1.00 0.00 H new ATOM 0 HA GLU A 97 8.147 -13.162 -11.688 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.128 -10.288 -12.016 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.538 -11.309 -13.312 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.846 -10.295 -11.005 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.940 -9.543 -12.585 1.00 0.00 H new ATOM 1445 N ASP A 98 10.472 -13.345 -12.952 1.00 0.00 N ATOM 1446 CA ASP A 98 11.807 -13.546 -13.549 1.00 0.00 C ATOM 1447 C ASP A 98 11.738 -13.463 -15.087 1.00 0.00 C ATOM 1448 O ASP A 98 11.503 -14.460 -15.776 1.00 0.00 O ATOM 1449 CB ASP A 98 12.468 -14.846 -13.064 1.00 0.00 C ATOM 1450 CG ASP A 98 13.926 -14.966 -13.546 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.556 -13.935 -13.894 1.00 0.00 O ATOM 1452 OD2 ASP A 98 14.447 -16.101 -13.573 1.00 0.00 O ATOM 0 H ASP A 98 9.719 -13.770 -13.493 1.00 0.00 H new ATOM 0 HA ASP A 98 12.449 -12.735 -13.206 1.00 0.00 H new ATOM 0 HB2 ASP A 98 12.442 -14.882 -11.975 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.895 -15.700 -13.425 1.00 0.00 H new ATOM 1457 N TRP A 99 11.887 -12.249 -15.623 1.00 0.00 N ATOM 1458 CA TRP A 99 11.645 -11.912 -17.030 1.00 0.00 C ATOM 1459 C TRP A 99 12.697 -12.489 -17.996 1.00 0.00 C ATOM 1460 O TRP A 99 13.888 -12.548 -17.699 1.00 0.00 O ATOM 1461 CB TRP A 99 11.500 -10.383 -17.168 1.00 0.00 C ATOM 1462 CG TRP A 99 10.360 -9.746 -16.421 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.272 -10.384 -15.924 1.00 0.00 C ATOM 1464 CD2 TRP A 99 10.160 -8.332 -16.094 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.433 -9.479 -15.306 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.939 -8.206 -15.366 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.860 -7.132 -16.366 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.457 -6.978 -14.905 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.385 -5.889 -15.905 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.187 -5.813 -15.176 1.00 0.00 C ATOM 0 H TRP A 99 12.190 -11.446 -15.072 1.00 0.00 H new ATOM 0 HA TRP A 99 10.713 -12.391 -17.330 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.428 -9.921 -16.832 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.390 -10.145 -18.226 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.089 -11.446 -16.000 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.549 -9.726 -14.861 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.775 -7.170 -16.938 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.534 -6.927 -14.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.945 -4.989 -16.113 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.828 -4.857 -14.824 1.00 0.00 H new ATOM 1481 N GLN A 100 12.242 -12.856 -19.200 1.00 0.00 N ATOM 1482 CA GLN A 100 13.008 -13.536 -20.264 1.00 0.00 C ATOM 1483 C GLN A 100 13.397 -12.478 -21.310 1.00 0.00 C ATOM 1484 O GLN A 100 12.969 -12.497 -22.464 1.00 0.00 O ATOM 1485 CB GLN A 100 12.169 -14.702 -20.823 1.00 0.00 C ATOM 1486 CG GLN A 100 11.972 -15.836 -19.801 1.00 0.00 C ATOM 1487 CD GLN A 100 10.942 -16.859 -20.279 1.00 0.00 C ATOM 1488 OE1 GLN A 100 11.159 -17.608 -21.223 1.00 0.00 O ATOM 1489 NE2 GLN A 100 9.778 -16.920 -19.662 1.00 0.00 N ATOM 0 H GLN A 100 11.277 -12.679 -19.478 1.00 0.00 H new ATOM 0 HA GLN A 100 13.932 -13.983 -19.896 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.194 -14.326 -21.135 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.656 -15.101 -21.713 1.00 0.00 H new ATOM 0 HG2 GLN A 100 12.925 -16.335 -19.624 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.651 -15.415 -18.848 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.585 -16.301 -18.874 1.00 0.00 H new ATOM 0 HE22 GLN A 100 9.070 -17.586 -19.972 1.00 0.00 H new ATOM 1498 N LEU A 101 14.158 -11.493 -20.829 1.00 0.00 N ATOM 1499 CA LEU A 101 14.484 -10.240 -21.500 1.00 0.00 C ATOM 1500 C LEU A 101 15.996 -10.118 -21.742 1.00 0.00 C ATOM 1501 O LEU A 101 16.786 -10.332 -20.826 1.00 0.00 O ATOM 1502 CB LEU A 101 13.881 -9.185 -20.546 1.00 0.00 C ATOM 1503 CG LEU A 101 13.827 -7.713 -20.947 1.00 0.00 C ATOM 1504 CD1 LEU A 101 15.167 -7.017 -20.725 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.345 -7.497 -22.379 1.00 0.00 C ATOM 0 H LEU A 101 14.587 -11.556 -19.906 1.00 0.00 H new ATOM 0 HA LEU A 101 14.079 -10.134 -22.506 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.859 -9.496 -20.328 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.438 -9.243 -19.611 1.00 0.00 H new ATOM 0 HG LEU A 101 13.086 -7.258 -20.290 1.00 0.00 H new ATOM 0 HD11 LEU A 101 15.088 -5.971 -21.022 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.437 -7.075 -19.671 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.935 -7.507 -21.323 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.330 -6.430 -22.601 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.020 -8.002 -23.070 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.340 -7.905 -22.490 1.00 0.00 H new ATOM 1517 N GLU A 102 16.410 -9.774 -22.964 1.00 0.00 N ATOM 1518 CA GLU A 102 17.810 -9.740 -23.399 1.00 0.00 C ATOM 1519 C GLU A 102 18.470 -8.386 -23.116 1.00 0.00 C ATOM 1520 O GLU A 102 17.812 -7.347 -23.083 1.00 0.00 O ATOM 1521 CB GLU A 102 17.923 -10.153 -24.880 1.00 0.00 C ATOM 1522 CG GLU A 102 17.337 -9.139 -25.871 1.00 0.00 C ATOM 1523 CD GLU A 102 17.341 -9.699 -27.307 1.00 0.00 C ATOM 1524 OE1 GLU A 102 18.430 -9.806 -27.922 1.00 0.00 O ATOM 1525 OE2 GLU A 102 16.250 -10.032 -27.834 1.00 0.00 O ATOM 0 H GLU A 102 15.760 -9.503 -23.702 1.00 0.00 H new ATOM 0 HA GLU A 102 18.365 -10.469 -22.809 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.974 -10.311 -25.121 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.418 -11.109 -25.017 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.318 -8.888 -25.578 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.915 -8.216 -25.836 1.00 0.00 H new ATOM 1532 N ASP A 103 19.783 -8.398 -22.909 1.00 0.00 N ATOM 1533 CA ASP A 103 20.550 -7.193 -22.585 1.00 0.00 C ATOM 1534 C ASP A 103 21.149 -6.541 -23.853 1.00 0.00 C ATOM 1535 O ASP A 103 21.837 -7.222 -24.620 1.00 0.00 O ATOM 1536 CB ASP A 103 21.622 -7.523 -21.537 1.00 0.00 C ATOM 1537 CG ASP A 103 22.130 -6.261 -20.844 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.614 -5.346 -21.534 1.00 0.00 O ATOM 1539 OD2 ASP A 103 21.986 -6.176 -19.606 1.00 0.00 O ATOM 0 H ASP A 103 20.350 -9.245 -22.961 1.00 0.00 H new ATOM 0 HA ASP A 103 19.875 -6.453 -22.155 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.209 -8.207 -20.795 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.455 -8.038 -22.016 1.00 0.00 H new ATOM 1544 N PRO A 104 20.909 -5.240 -24.108 1.00 0.00 N ATOM 1545 CA PRO A 104 21.414 -4.554 -25.294 1.00 0.00 C ATOM 1546 C PRO A 104 22.892 -4.108 -25.184 1.00 0.00 C ATOM 1547 O PRO A 104 23.449 -3.625 -26.166 1.00 0.00 O ATOM 1548 CB PRO A 104 20.461 -3.375 -25.469 1.00 0.00 C ATOM 1549 CG PRO A 104 20.133 -2.990 -24.028 1.00 0.00 C ATOM 1550 CD PRO A 104 20.036 -4.354 -23.351 1.00 0.00 C ATOM 0 HA PRO A 104 21.431 -5.218 -26.158 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.929 -2.553 -26.011 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.567 -3.656 -26.026 1.00 0.00 H new ATOM 0 HG2 PRO A 104 20.911 -2.368 -23.584 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.200 -2.432 -23.957 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.349 -4.295 -22.308 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.009 -4.720 -23.356 1.00 0.00 H new ATOM 1594 N SER A 108 23.370 -3.747 -31.099 1.00 0.00 N ATOM 1595 CA SER A 108 23.008 -2.625 -31.984 1.00 0.00 C ATOM 1596 C SER A 108 22.014 -1.664 -31.326 1.00 0.00 C ATOM 1597 O SER A 108 21.228 -2.057 -30.465 1.00 0.00 O ATOM 1598 CB SER A 108 22.467 -3.180 -33.311 1.00 0.00 C ATOM 1599 OG SER A 108 22.070 -2.127 -34.177 1.00 0.00 O ATOM 0 HA SER A 108 23.905 -2.038 -32.182 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.233 -3.785 -33.796 1.00 0.00 H new ATOM 0 HB3 SER A 108 21.618 -3.836 -33.116 1.00 0.00 H new ATOM 0 HG SER A 108 21.731 -2.504 -35.016 1.00 0.00 H new ATOM 1605 N LEU A 109 21.972 -0.410 -31.780 1.00 0.00 N ATOM 1606 CA LEU A 109 20.997 0.597 -31.333 1.00 0.00 C ATOM 1607 C LEU A 109 19.558 0.178 -31.666 1.00 0.00 C ATOM 1608 O LEU A 109 18.637 0.502 -30.921 1.00 0.00 O ATOM 1609 CB LEU A 109 21.378 1.972 -31.911 1.00 0.00 C ATOM 1610 CG LEU A 109 22.447 2.715 -31.079 1.00 0.00 C ATOM 1611 CD1 LEU A 109 23.744 1.925 -30.880 1.00 0.00 C ATOM 1612 CD2 LEU A 109 22.787 4.042 -31.751 1.00 0.00 C ATOM 0 H LEU A 109 22.624 -0.056 -32.480 1.00 0.00 H new ATOM 0 HA LEU A 109 21.030 0.675 -30.246 1.00 0.00 H new ATOM 0 HB2 LEU A 109 21.747 1.840 -32.928 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.483 2.591 -31.975 1.00 0.00 H new ATOM 0 HG LEU A 109 22.008 2.863 -30.092 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.442 2.515 -30.286 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.526 0.992 -30.361 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.189 1.705 -31.851 1.00 0.00 H new ATOM 0 HD21 LEU A 109 23.541 4.565 -31.163 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.174 3.854 -32.753 1.00 0.00 H new ATOM 0 HD23 LEU A 109 21.889 4.656 -31.818 1.00 0.00 H new ATOM 1624 N GLU A 110 19.362 -0.646 -32.695 1.00 0.00 N ATOM 1625 CA GLU A 110 18.066 -1.280 -32.963 1.00 0.00 C ATOM 1626 C GLU A 110 17.693 -2.279 -31.852 1.00 0.00 C ATOM 1627 O GLU A 110 16.531 -2.348 -31.459 1.00 0.00 O ATOM 1628 CB GLU A 110 18.106 -1.939 -34.352 1.00 0.00 C ATOM 1629 CG GLU A 110 16.717 -2.398 -34.809 1.00 0.00 C ATOM 1630 CD GLU A 110 16.764 -2.944 -36.248 1.00 0.00 C ATOM 1631 OE1 GLU A 110 17.059 -4.150 -36.437 1.00 0.00 O ATOM 1632 OE2 GLU A 110 16.494 -2.178 -37.205 1.00 0.00 O ATOM 0 H GLU A 110 20.091 -0.894 -33.364 1.00 0.00 H new ATOM 0 HA GLU A 110 17.283 -0.522 -32.964 1.00 0.00 H new ATOM 0 HB2 GLU A 110 18.511 -1.233 -35.077 1.00 0.00 H new ATOM 0 HB3 GLU A 110 18.781 -2.794 -34.328 1.00 0.00 H new ATOM 0 HG2 GLU A 110 16.345 -3.170 -34.135 1.00 0.00 H new ATOM 0 HG3 GLU A 110 16.018 -1.563 -34.755 1.00 0.00 H new ATOM 1639 N VAL A 111 18.662 -2.983 -31.248 1.00 0.00 N ATOM 1640 CA VAL A 111 18.423 -3.867 -30.092 1.00 0.00 C ATOM 1641 C VAL A 111 18.065 -3.045 -28.856 1.00 0.00 C ATOM 1642 O VAL A 111 17.085 -3.383 -28.200 1.00 0.00 O ATOM 1643 CB VAL A 111 19.591 -4.844 -29.830 1.00 0.00 C ATOM 1644 CG1 VAL A 111 19.292 -5.793 -28.661 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.849 -5.717 -31.066 1.00 0.00 C ATOM 0 H VAL A 111 19.637 -2.957 -31.547 1.00 0.00 H new ATOM 0 HA VAL A 111 17.569 -4.499 -30.336 1.00 0.00 H new ATOM 0 HB VAL A 111 20.459 -4.229 -29.593 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.139 -6.463 -28.511 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.124 -5.212 -27.754 1.00 0.00 H new ATOM 0 HG13 VAL A 111 18.401 -6.379 -28.887 1.00 0.00 H new ATOM 0 HG21 VAL A 111 20.675 -6.399 -30.864 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.953 -6.292 -31.299 1.00 0.00 H new ATOM 0 HG23 VAL A 111 20.103 -5.081 -31.914 1.00 0.00 H new ATOM 1655 N PHE A 112 18.734 -1.913 -28.586 1.00 0.00 N ATOM 1656 CA PHE A 112 18.282 -0.977 -27.532 1.00 0.00 C ATOM 1657 C PHE A 112 16.831 -0.516 -27.773 1.00 0.00 C ATOM 1658 O PHE A 112 15.991 -0.618 -26.878 1.00 0.00 O ATOM 1659 CB PHE A 112 19.219 0.243 -27.437 1.00 0.00 C ATOM 1660 CG PHE A 112 20.564 0.003 -26.776 1.00 0.00 C ATOM 1661 CD1 PHE A 112 20.703 0.137 -25.381 1.00 0.00 C ATOM 1662 CD2 PHE A 112 21.684 -0.359 -27.545 1.00 0.00 C ATOM 1663 CE1 PHE A 112 21.942 -0.122 -24.766 1.00 0.00 C ATOM 1664 CE2 PHE A 112 22.925 -0.600 -26.934 1.00 0.00 C ATOM 1665 CZ PHE A 112 23.050 -0.499 -25.542 1.00 0.00 C ATOM 0 H PHE A 112 19.581 -1.621 -29.074 1.00 0.00 H new ATOM 0 HA PHE A 112 18.315 -1.515 -26.585 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.394 0.620 -28.445 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.703 1.030 -26.888 1.00 0.00 H new ATOM 0 HD1 PHE A 112 19.857 0.439 -24.782 1.00 0.00 H new ATOM 0 HD2 PHE A 112 21.589 -0.453 -28.617 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.041 -0.031 -23.694 1.00 0.00 H new ATOM 0 HE2 PHE A 112 23.782 -0.863 -27.536 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.997 -0.711 -25.067 1.00 0.00 H new ATOM 1675 N ARG A 113 16.504 -0.090 -29.001 1.00 0.00 N ATOM 1676 CA ARG A 113 15.160 0.392 -29.383 1.00 0.00 C ATOM 1677 C ARG A 113 14.081 -0.708 -29.445 1.00 0.00 C ATOM 1678 O ARG A 113 12.898 -0.397 -29.343 1.00 0.00 O ATOM 1679 CB ARG A 113 15.254 1.199 -30.697 1.00 0.00 C ATOM 1680 CG ARG A 113 15.981 2.543 -30.490 1.00 0.00 C ATOM 1681 CD ARG A 113 16.007 3.375 -31.778 1.00 0.00 C ATOM 1682 NE ARG A 113 16.385 4.783 -31.514 1.00 0.00 N ATOM 1683 CZ ARG A 113 17.155 5.574 -32.238 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.758 5.172 -33.322 1.00 0.00 N ATOM 1685 NH2 ARG A 113 17.324 6.809 -31.871 1.00 0.00 N ATOM 0 H ARG A 113 17.172 -0.068 -29.771 1.00 0.00 H new ATOM 0 HA ARG A 113 14.817 1.047 -28.582 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.782 0.611 -31.448 1.00 0.00 H new ATOM 0 HB3 ARG A 113 14.252 1.383 -31.083 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.485 3.108 -29.701 1.00 0.00 H new ATOM 0 HG3 ARG A 113 17.002 2.357 -30.155 1.00 0.00 H new ATOM 0 HD2 ARG A 113 16.713 2.934 -32.481 1.00 0.00 H new ATOM 0 HD3 ARG A 113 15.025 3.344 -32.251 1.00 0.00 H new ATOM 0 HE ARG A 113 16.001 5.194 -30.663 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.644 4.210 -33.642 1.00 0.00 H new ATOM 0 HH12 ARG A 113 18.344 5.819 -33.850 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.864 7.159 -31.031 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.917 7.429 -32.423 1.00 0.00 H new ATOM 1699 N THR A 114 14.472 -1.983 -29.518 1.00 0.00 N ATOM 1700 CA THR A 114 13.575 -3.153 -29.415 1.00 0.00 C ATOM 1701 C THR A 114 13.397 -3.624 -27.966 1.00 0.00 C ATOM 1702 O THR A 114 12.297 -3.977 -27.549 1.00 0.00 O ATOM 1703 CB THR A 114 14.086 -4.330 -30.271 1.00 0.00 C ATOM 1704 OG1 THR A 114 14.400 -3.916 -31.582 1.00 0.00 O ATOM 1705 CG2 THR A 114 13.042 -5.430 -30.470 1.00 0.00 C ATOM 0 H THR A 114 15.448 -2.245 -29.654 1.00 0.00 H new ATOM 0 HA THR A 114 12.606 -2.825 -29.792 1.00 0.00 H new ATOM 0 HB THR A 114 14.951 -4.699 -29.719 1.00 0.00 H new ATOM 0 HG1 THR A 114 15.336 -3.628 -31.619 1.00 0.00 H new ATOM 0 HG21 THR A 114 13.466 -6.227 -31.081 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.748 -5.832 -29.501 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.167 -5.015 -30.971 1.00 0.00 H new ATOM 1713 N VAL A 115 14.468 -3.646 -27.163 1.00 0.00 N ATOM 1714 CA VAL A 115 14.433 -4.089 -25.751 1.00 0.00 C ATOM 1715 C VAL A 115 13.676 -3.101 -24.876 1.00 0.00 C ATOM 1716 O VAL A 115 12.912 -3.531 -24.018 1.00 0.00 O ATOM 1717 CB VAL A 115 15.862 -4.387 -25.239 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.892 -4.593 -23.718 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.407 -5.657 -25.899 1.00 0.00 C ATOM 0 H VAL A 115 15.396 -3.355 -27.472 1.00 0.00 H new ATOM 0 HA VAL A 115 13.876 -5.024 -25.692 1.00 0.00 H new ATOM 0 HB VAL A 115 16.476 -3.524 -25.495 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.914 -4.800 -23.399 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.532 -3.692 -23.222 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.252 -5.434 -23.452 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.413 -5.856 -25.530 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.759 -6.499 -25.657 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.437 -5.521 -26.980 1.00 0.00 H new ATOM 1729 N ARG A 116 13.783 -1.795 -25.135 1.00 0.00 N ATOM 1730 CA ARG A 116 13.109 -0.759 -24.326 1.00 0.00 C ATOM 1731 C ARG A 116 11.591 -0.938 -24.224 1.00 0.00 C ATOM 1732 O ARG A 116 11.042 -0.869 -23.135 1.00 0.00 O ATOM 1733 CB ARG A 116 13.532 0.622 -24.855 1.00 0.00 C ATOM 1734 CG ARG A 116 12.847 1.062 -26.154 1.00 0.00 C ATOM 1735 CD ARG A 116 13.362 2.431 -26.600 1.00 0.00 C ATOM 1736 NE ARG A 116 12.715 2.836 -27.865 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.990 3.918 -28.572 1.00 0.00 C ATOM 1738 NH1 ARG A 116 13.919 4.743 -28.203 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.361 4.173 -29.678 1.00 0.00 N ATOM 0 H ARG A 116 14.335 -1.420 -25.906 1.00 0.00 H new ATOM 0 HA ARG A 116 13.435 -0.859 -23.291 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.328 1.366 -24.085 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.610 0.617 -25.015 1.00 0.00 H new ATOM 0 HG2 ARG A 116 13.032 0.326 -26.936 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.768 1.105 -26.006 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.160 3.172 -25.827 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.443 2.395 -26.732 1.00 0.00 H new ATOM 0 HE ARG A 116 11.986 2.221 -28.227 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.453 4.563 -27.353 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.116 5.573 -28.763 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.641 3.533 -30.014 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.586 5.013 -30.211 1.00 0.00 H new ATOM 1753 N GLY A 117 10.927 -1.281 -25.329 1.00 0.00 N ATOM 1754 CA GLY A 117 9.474 -1.523 -25.358 1.00 0.00 C ATOM 1755 C GLY A 117 9.087 -2.834 -24.671 1.00 0.00 C ATOM 1756 O GLY A 117 8.061 -2.904 -23.998 1.00 0.00 O ATOM 0 H GLY A 117 11.379 -1.401 -26.235 1.00 0.00 H new ATOM 0 HA2 GLY A 117 8.961 -0.695 -24.869 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.132 -1.544 -26.393 1.00 0.00 H new ATOM 1760 N GLN A 118 9.967 -3.840 -24.725 1.00 0.00 N ATOM 1761 CA GLN A 118 9.780 -5.105 -24.008 1.00 0.00 C ATOM 1762 C GLN A 118 9.929 -4.921 -22.497 1.00 0.00 C ATOM 1763 O GLN A 118 9.142 -5.484 -21.737 1.00 0.00 O ATOM 1764 CB GLN A 118 10.742 -6.169 -24.555 1.00 0.00 C ATOM 1765 CG GLN A 118 10.360 -6.607 -25.976 1.00 0.00 C ATOM 1766 CD GLN A 118 11.466 -7.467 -26.565 1.00 0.00 C ATOM 1767 OE1 GLN A 118 11.462 -8.687 -26.513 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.477 -6.827 -27.109 1.00 0.00 N ATOM 0 H GLN A 118 10.830 -3.799 -25.268 1.00 0.00 H new ATOM 0 HA GLN A 118 8.761 -5.452 -24.179 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.758 -5.774 -24.557 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.739 -7.036 -23.894 1.00 0.00 H new ATOM 0 HG2 GLN A 118 9.424 -7.166 -25.955 1.00 0.00 H new ATOM 0 HG3 GLN A 118 10.194 -5.732 -26.604 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.473 -5.808 -27.149 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.265 -7.350 -27.491 1.00 0.00 H new ATOM 1777 N VAL A 119 10.876 -4.092 -22.054 1.00 0.00 N ATOM 1778 CA VAL A 119 10.982 -3.657 -20.644 1.00 0.00 C ATOM 1779 C VAL A 119 9.755 -2.831 -20.257 1.00 0.00 C ATOM 1780 O VAL A 119 9.141 -3.127 -19.239 1.00 0.00 O ATOM 1781 CB VAL A 119 12.286 -2.872 -20.406 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.378 -2.270 -18.997 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.506 -3.778 -20.576 1.00 0.00 C ATOM 0 H VAL A 119 11.597 -3.698 -22.658 1.00 0.00 H new ATOM 0 HA VAL A 119 11.014 -4.540 -20.006 1.00 0.00 H new ATOM 0 HB VAL A 119 12.273 -2.069 -21.143 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.319 -1.730 -18.893 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.546 -1.583 -18.840 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.334 -3.069 -18.257 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.415 -3.201 -20.403 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.454 -4.597 -19.858 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.520 -4.183 -21.588 1.00 0.00 H new ATOM 1793 N LYS A 120 9.341 -1.862 -21.087 1.00 0.00 N ATOM 1794 CA LYS A 120 8.163 -1.007 -20.847 1.00 0.00 C ATOM 1795 C LYS A 120 6.904 -1.825 -20.612 1.00 0.00 C ATOM 1796 O LYS A 120 6.268 -1.626 -19.597 1.00 0.00 O ATOM 1797 CB LYS A 120 8.007 0.000 -22.002 1.00 0.00 C ATOM 1798 CG LYS A 120 6.873 1.020 -21.794 1.00 0.00 C ATOM 1799 CD LYS A 120 5.567 0.661 -22.523 1.00 0.00 C ATOM 1800 CE LYS A 120 4.592 1.844 -22.425 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.255 1.512 -22.996 1.00 0.00 N ATOM 0 H LYS A 120 9.822 -1.645 -21.960 1.00 0.00 H new ATOM 0 HA LYS A 120 8.322 -0.444 -19.927 1.00 0.00 H new ATOM 0 HB2 LYS A 120 8.946 0.538 -22.131 1.00 0.00 H new ATOM 0 HB3 LYS A 120 7.824 -0.548 -22.926 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.669 1.108 -20.727 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.211 1.998 -22.136 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.772 0.429 -23.568 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.122 -0.230 -22.080 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.479 2.135 -21.381 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.009 2.702 -22.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 2.671 2.372 -23.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.373 1.129 -23.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.788 0.803 -22.396 1.00 0.00 H new ATOM 1815 N GLU A 121 6.561 -2.779 -21.471 1.00 0.00 N ATOM 1816 CA GLU A 121 5.330 -3.581 -21.300 1.00 0.00 C ATOM 1817 C GLU A 121 5.408 -4.528 -20.090 1.00 0.00 C ATOM 1818 O GLU A 121 4.398 -4.799 -19.440 1.00 0.00 O ATOM 1819 CB GLU A 121 4.982 -4.320 -22.604 1.00 0.00 C ATOM 1820 CG GLU A 121 5.920 -5.490 -22.938 1.00 0.00 C ATOM 1821 CD GLU A 121 5.654 -6.163 -24.304 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.637 -5.867 -24.979 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.471 -7.039 -24.687 1.00 0.00 O ATOM 0 H GLU A 121 7.110 -3.024 -22.295 1.00 0.00 H new ATOM 0 HA GLU A 121 4.514 -2.893 -21.081 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.962 -4.697 -22.533 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.002 -3.607 -23.428 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.948 -5.129 -22.920 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.833 -6.243 -22.155 1.00 0.00 H new ATOM 1830 N ARG A 122 6.612 -4.990 -19.732 1.00 0.00 N ATOM 1831 CA ARG A 122 6.849 -5.817 -18.531 1.00 0.00 C ATOM 1832 C ARG A 122 6.668 -4.994 -17.253 1.00 0.00 C ATOM 1833 O ARG A 122 5.811 -5.326 -16.440 1.00 0.00 O ATOM 1834 CB ARG A 122 8.203 -6.541 -18.665 1.00 0.00 C ATOM 1835 CG ARG A 122 8.044 -7.720 -19.638 1.00 0.00 C ATOM 1836 CD ARG A 122 9.369 -8.278 -20.177 1.00 0.00 C ATOM 1837 NE ARG A 122 9.122 -9.319 -21.206 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.585 -9.161 -22.407 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.284 -7.983 -22.865 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.321 -10.178 -23.168 1.00 0.00 N ATOM 0 H ARG A 122 7.459 -4.802 -20.268 1.00 0.00 H new ATOM 0 HA ARG A 122 6.098 -6.603 -18.450 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.964 -5.852 -19.030 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.537 -6.899 -17.691 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.504 -8.522 -19.134 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.429 -7.401 -20.479 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.962 -7.470 -20.606 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.951 -8.701 -19.358 1.00 0.00 H new ATOM 0 HE ARG A 122 9.399 -10.269 -20.959 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.460 -7.155 -22.297 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.871 -7.887 -23.793 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.527 -11.123 -22.845 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.908 -10.032 -24.089 1.00 0.00 H new ATOM 1854 N VAL A 123 7.365 -3.863 -17.134 1.00 0.00 N ATOM 1855 CA VAL A 123 7.154 -2.847 -16.083 1.00 0.00 C ATOM 1856 C VAL A 123 5.698 -2.377 -16.008 1.00 0.00 C ATOM 1857 O VAL A 123 5.124 -2.379 -14.928 1.00 0.00 O ATOM 1858 CB VAL A 123 8.101 -1.670 -16.361 1.00 0.00 C ATOM 1859 CG1 VAL A 123 7.847 -0.441 -15.499 1.00 0.00 C ATOM 1860 CG2 VAL A 123 9.567 -2.073 -16.142 1.00 0.00 C ATOM 0 H VAL A 123 8.114 -3.615 -17.780 1.00 0.00 H new ATOM 0 HA VAL A 123 7.374 -3.290 -15.112 1.00 0.00 H new ATOM 0 HB VAL A 123 7.901 -1.411 -17.401 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.560 0.341 -15.761 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.833 -0.080 -15.670 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.966 -0.703 -14.448 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.213 -1.219 -16.346 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.706 -2.394 -15.110 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.824 -2.892 -16.814 1.00 0.00 H new ATOM 1870 N GLU A 124 5.074 -1.995 -17.120 1.00 0.00 N ATOM 1871 CA GLU A 124 3.734 -1.432 -17.155 1.00 0.00 C ATOM 1872 C GLU A 124 2.670 -2.448 -16.730 1.00 0.00 C ATOM 1873 O GLU A 124 1.865 -2.128 -15.862 1.00 0.00 O ATOM 1874 CB GLU A 124 3.483 -0.901 -18.572 1.00 0.00 C ATOM 1875 CG GLU A 124 2.352 0.104 -18.581 1.00 0.00 C ATOM 1876 CD GLU A 124 2.097 0.700 -19.977 1.00 0.00 C ATOM 1877 OE1 GLU A 124 2.104 -0.043 -20.989 1.00 0.00 O ATOM 1878 OE2 GLU A 124 1.902 1.933 -20.084 1.00 0.00 O ATOM 0 H GLU A 124 5.501 -2.072 -18.043 1.00 0.00 H new ATOM 0 HA GLU A 124 3.661 -0.617 -16.435 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.391 -0.436 -18.956 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.243 -1.730 -19.238 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.441 -0.377 -18.224 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.582 0.909 -17.883 1.00 0.00 H new ATOM 1885 N ASN A 125 2.694 -3.683 -17.250 1.00 0.00 N ATOM 1886 CA ASN A 125 1.703 -4.689 -16.849 1.00 0.00 C ATOM 1887 C ASN A 125 1.927 -5.175 -15.404 1.00 0.00 C ATOM 1888 O ASN A 125 0.954 -5.431 -14.696 1.00 0.00 O ATOM 1889 CB ASN A 125 1.590 -5.814 -17.899 1.00 0.00 C ATOM 1890 CG ASN A 125 2.372 -7.066 -17.543 1.00 0.00 C ATOM 1891 OD1 ASN A 125 1.894 -7.960 -16.861 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.610 -7.150 -17.957 1.00 0.00 N ATOM 0 H ASN A 125 3.376 -4.005 -17.937 1.00 0.00 H new ATOM 0 HA ASN A 125 0.721 -4.217 -16.828 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.540 -6.077 -18.025 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.942 -5.438 -18.860 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.176 -7.962 -17.710 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.009 -6.404 -18.526 1.00 0.00 H new ATOM 1899 N LEU A 126 3.185 -5.208 -14.933 1.00 0.00 N ATOM 1900 CA LEU A 126 3.516 -5.441 -13.524 1.00 0.00 C ATOM 1901 C LEU A 126 2.939 -4.330 -12.647 1.00 0.00 C ATOM 1902 O LEU A 126 2.236 -4.613 -11.684 1.00 0.00 O ATOM 1903 CB LEU A 126 5.048 -5.599 -13.379 1.00 0.00 C ATOM 1904 CG LEU A 126 5.641 -5.838 -11.972 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.790 -4.571 -11.132 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.860 -6.882 -11.171 1.00 0.00 C ATOM 0 H LEU A 126 4.004 -5.072 -15.526 1.00 0.00 H new ATOM 0 HA LEU A 126 3.058 -6.367 -13.177 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.356 -6.431 -14.013 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.513 -4.700 -13.785 1.00 0.00 H new ATOM 0 HG LEU A 126 6.642 -6.217 -12.177 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.213 -4.826 -10.160 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.452 -3.871 -11.643 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.812 -4.110 -10.993 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.321 -7.009 -10.192 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.830 -6.549 -11.046 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.872 -7.833 -11.704 1.00 0.00 H new ATOM 1918 N ILE A 127 3.187 -3.063 -12.980 1.00 0.00 N ATOM 1919 CA ILE A 127 2.722 -1.954 -12.133 1.00 0.00 C ATOM 1920 C ILE A 127 1.193 -1.827 -12.176 1.00 0.00 C ATOM 1921 O ILE A 127 0.568 -1.635 -11.134 1.00 0.00 O ATOM 1922 CB ILE A 127 3.471 -0.666 -12.514 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.952 -0.828 -12.094 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.874 0.595 -11.865 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.885 0.226 -12.690 1.00 0.00 C ATOM 0 H ILE A 127 3.698 -2.777 -13.815 1.00 0.00 H new ATOM 0 HA ILE A 127 2.959 -2.158 -11.089 1.00 0.00 H new ATOM 0 HB ILE A 127 3.377 -0.526 -13.591 1.00 0.00 H new ATOM 0 HG12 ILE A 127 5.018 -0.784 -11.007 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.298 -1.817 -12.394 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.447 1.469 -12.173 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.837 0.711 -12.181 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.914 0.499 -10.780 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.904 0.044 -12.349 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.851 0.169 -13.778 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.566 1.218 -12.369 1.00 0.00 H new ATOM 1937 N ALA A 128 0.573 -2.024 -13.338 1.00 0.00 N ATOM 1938 CA ALA A 128 -0.876 -1.933 -13.527 1.00 0.00 C ATOM 1939 C ALA A 128 -1.677 -2.988 -12.736 1.00 0.00 C ATOM 1940 O ALA A 128 -2.821 -2.722 -12.359 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.166 -2.014 -15.033 1.00 0.00 C ATOM 0 H ALA A 128 1.075 -2.257 -14.195 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.213 -0.979 -13.122 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.241 -1.948 -15.201 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.668 -1.190 -15.544 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.795 -2.961 -15.425 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.077 -4.154 -12.432 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.694 -5.196 -11.586 1.00 0.00 C ATOM 1949 C LYS A 129 -1.442 -5.033 -10.079 1.00 0.00 C ATOM 1950 O LYS A 129 -2.160 -5.662 -9.299 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.368 -6.613 -12.110 1.00 0.00 C ATOM 1952 CG LYS A 129 0.057 -7.096 -11.823 1.00 0.00 C ATOM 1953 CD LYS A 129 0.289 -8.520 -12.349 1.00 0.00 C ATOM 1954 CE LYS A 129 1.748 -8.928 -12.101 1.00 0.00 C ATOM 1955 NZ LYS A 129 2.012 -10.328 -12.544 1.00 0.00 N ATOM 0 H LYS A 129 -0.146 -4.402 -12.767 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.770 -5.053 -11.680 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.071 -7.319 -11.667 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.532 -6.633 -13.187 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.772 -6.416 -12.286 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.241 -7.070 -10.749 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.384 -9.217 -11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.064 -8.566 -13.414 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.412 -8.247 -12.633 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.977 -8.833 -11.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.993 -10.586 -12.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.361 -10.975 -12.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.866 -10.400 -13.571 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.469 -4.207 -9.656 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.148 -4.007 -8.217 1.00 0.00 C ATOM 1971 C ILE A 130 -0.531 -2.628 -7.647 1.00 0.00 C ATOM 1972 O ILE A 130 -0.604 -2.485 -6.423 1.00 0.00 O ATOM 1973 CB ILE A 130 1.318 -4.375 -7.888 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.331 -3.320 -8.377 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.652 -5.771 -8.439 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.780 -3.607 -7.972 1.00 0.00 C ATOM 0 H ILE A 130 0.116 -3.661 -10.288 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.799 -4.711 -7.699 1.00 0.00 H new ATOM 0 HB ILE A 130 1.408 -4.392 -6.802 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.275 -3.255 -9.464 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.042 -2.345 -7.984 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.687 -6.018 -8.201 1.00 0.00 H new ATOM 0 HG22 ILE A 130 0.989 -6.509 -7.987 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.517 -5.777 -9.521 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.428 -2.818 -8.355 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.854 -3.642 -6.885 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.091 -4.566 -8.388 1.00 0.00 H new ATOM 1988 N SER A 131 -0.757 -1.623 -8.502 1.00 0.00 N ATOM 1989 CA SER A 131 -1.146 -0.252 -8.105 1.00 0.00 C ATOM 1990 C SER A 131 -2.524 -0.187 -7.431 1.00 0.00 C ATOM 1991 O SER A 131 -2.637 0.481 -6.377 1.00 0.00 O ATOM 1992 CB SER A 131 -1.129 0.695 -9.302 1.00 0.00 C ATOM 1993 OG SER A 131 0.176 0.739 -9.848 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.495 -0.782 -7.956 1.00 0.00 O ATOM 0 H SER A 131 -0.674 -1.736 -9.512 1.00 0.00 H new ATOM 0 HA SER A 131 -0.402 0.063 -7.373 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.840 0.358 -10.057 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.440 1.693 -8.994 1.00 0.00 H new ATOM 0 HG SER A 131 0.361 -0.099 -10.320 1.00 0.00 H new