USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1157 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 84 LYS NZ :NH3+ 162:sc= -0.206 (180deg=-0.721) USER MOD Set 1.2: A 101 THR OG1 : rot 66:sc= 1.15 USER MOD Set 2.1: A 90 THR OG1 : rot -118:sc= 0.924 USER MOD Set 2.2: A 92 TYR OH : rot 165:sc= -0.884 USER MOD Set 3.1: A 76 TYR OH : rot -97:sc= -0.265 USER MOD Set 3.2: A 78 SER OG : rot 164:sc= -0.245 USER MOD Set 4.1: A 31 LYS NZ :NH3+ -163:sc= -0.089 (180deg=0) USER MOD Set 4.2: A 32 MET CE :methyl -115:sc= -3.24! (180deg=-5.83!) USER MOD Set 5.1: A 21 ASN : amide:sc= -2.94! C(o=-3!,f=-7.2!) USER MOD Set 5.2: A 110 HIS : no HD1:sc= -0.79 K(o=-3,f=-5.6!) USER MOD Set 5.3: A 138 TYR OH : rot -46:sc= 0.759 USER MOD Set 5.4: A 142 MET CE :methyl -167:sc= -0.0601 (180deg=-0.014) USER MOD Set 6.1: A 14 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -140:sc= -1.32! USER MOD Single : A 22 THR OG1 : rot -74:sc= 0.0923 USER MOD Single : A 29 LYS NZ :NH3+ 156:sc= -2.79 (180deg=-3.71!) USER MOD Single : A 33 LYS NZ :NH3+ -162:sc= 0.00347 (180deg=-0.294) USER MOD Single : A 34 MET CE :methyl 146:sc= -1.35 (180deg=-5.77!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -132:sc= 0.98 (180deg=-0.853!) USER MOD Single : A 50 SER OG : rot 180:sc= -0.903 USER MOD Single : A 51 TYR OH : rot -29:sc= 0.293 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.02 X(o=-0.02,f=-0.02) USER MOD Single : A 61 LYS NZ :NH3+ 153:sc= -0.183 (180deg=-0.885) USER MOD Single : A 64 THR OG1 : rot -114:sc= -0.241 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -159:sc= -7.86! (180deg=-9.01!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 116:sc= 0.86 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= -1.31 USER MOD Single : A 104 LYS NZ :NH3+ 162:sc= -0.0118 (180deg=-0.217) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -121:sc= -4.65! (180deg=-5.37!) USER MOD Single : A 112 MET CE :methyl -157:sc= -0.342 (180deg=-0.701) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -159:sc= 1.24 USER MOD Single : A 118 SER OG : rot 180:sc= -0.479 USER MOD Single : A 122 SER OG : rot 180:sc= 0.00209 USER MOD Single : A 126 THR OG1 : rot 93:sc= 0.0205 USER MOD Single : A 131 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.172) USER MOD Single : A 137 ASN : amide:sc= -0.139 X(o=-0.14,f=0) USER MOD Single : A 139 THR OG1 : rot -141:sc= -2.25 USER MOD Single : A 145 MET CE :methyl -113:sc= -0.625 (180deg=-2.27) USER MOD Single : A 149 GLN : amide:sc= -0.809 K(o=-0.81,f=-0.23) USER MOD Single : A 153 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ASP A 5 1.207 19.337 -14.121 1.00 12.13 N ATOM 65 CA ASP A 5 0.346 18.992 -12.996 1.00 64.24 C ATOM 66 C ASP A 5 1.094 18.119 -11.993 1.00 74.15 C ATOM 67 O ASP A 5 0.972 18.305 -10.782 1.00 75.14 O ATOM 68 CB ASP A 5 -0.894 18.249 -13.497 1.00 44.42 C ATOM 69 CG ASP A 5 -1.742 19.174 -14.362 1.00 54.35 C ATOM 70 OD1 ASP A 5 -1.661 20.375 -14.168 1.00 34.12 O ATOM 71 OD2 ASP A 5 -2.460 18.667 -15.209 1.00 23.10 O ATOM 0 HA ASP A 5 0.043 19.914 -12.500 1.00 64.24 H new ATOM 0 HB2 ASP A 5 -0.595 17.372 -14.072 1.00 44.42 H new ATOM 0 HB3 ASP A 5 -1.480 17.891 -12.651 1.00 44.42 H new ATOM 76 N ARG A 6 1.866 17.166 -12.505 1.00 72.11 N ATOM 77 CA ARG A 6 2.629 16.270 -11.644 1.00 74.44 C ATOM 78 C ARG A 6 3.734 17.030 -10.918 1.00 63.31 C ATOM 79 O ARG A 6 3.863 16.942 -9.698 1.00 63.00 O ATOM 80 CB ARG A 6 3.241 15.140 -12.480 1.00 35.30 C ATOM 81 CG ARG A 6 4.043 14.181 -11.574 1.00 33.35 C ATOM 82 CD ARG A 6 5.545 14.453 -11.717 1.00 43.55 C ATOM 83 NE ARG A 6 5.993 14.106 -13.061 1.00 43.41 N ATOM 84 CZ ARG A 6 7.122 14.602 -13.558 1.00 65.30 C ATOM 85 NH1 ARG A 6 7.850 15.413 -12.842 1.00 62.40 N ATOM 86 NH2 ARG A 6 7.502 14.276 -14.764 1.00 53.32 N ATOM 0 H ARG A 6 1.979 16.995 -13.504 1.00 72.11 H new ATOM 0 HA ARG A 6 1.953 15.847 -10.901 1.00 74.44 H new ATOM 0 HB2 ARG A 6 2.453 14.591 -12.995 1.00 35.30 H new ATOM 0 HB3 ARG A 6 3.893 15.557 -13.247 1.00 35.30 H new ATOM 0 HG2 ARG A 6 3.739 14.311 -10.535 1.00 33.35 H new ATOM 0 HG3 ARG A 6 3.826 13.147 -11.843 1.00 33.35 H new ATOM 0 HD2 ARG A 6 5.753 15.504 -11.516 1.00 43.55 H new ATOM 0 HD3 ARG A 6 6.099 13.872 -10.980 1.00 43.55 H new ATOM 0 HE ARG A 6 5.431 13.472 -13.629 1.00 43.41 H new ATOM 0 HH11 ARG A 6 7.553 15.667 -11.900 1.00 62.40 H new ATOM 0 HH12 ARG A 6 8.716 15.793 -13.224 1.00 62.40 H new ATOM 0 HH21 ARG A 6 6.933 13.641 -15.324 1.00 53.32 H new ATOM 0 HH22 ARG A 6 8.368 14.656 -15.146 1.00 53.32 H new ATOM 100 N SER A 7 4.526 17.778 -11.678 1.00 2.24 N ATOM 101 CA SER A 7 5.618 18.555 -11.103 1.00 61.12 C ATOM 102 C SER A 7 5.087 19.562 -10.086 1.00 10.10 C ATOM 103 O SER A 7 5.765 19.900 -9.115 1.00 42.32 O ATOM 104 CB SER A 7 6.368 19.296 -12.210 1.00 32.41 C ATOM 105 OG SER A 7 5.523 20.299 -12.759 1.00 35.12 O ATOM 0 H SER A 7 4.433 17.863 -12.690 1.00 2.24 H new ATOM 0 HA SER A 7 6.297 17.870 -10.596 1.00 61.12 H new ATOM 0 HB2 SER A 7 7.276 19.748 -11.811 1.00 32.41 H new ATOM 0 HB3 SER A 7 6.675 18.597 -12.988 1.00 32.41 H new ATOM 0 HG SER A 7 6.001 20.777 -13.468 1.00 35.12 H new ATOM 111 N GLU A 8 3.875 20.045 -10.328 1.00 20.30 N ATOM 112 CA GLU A 8 3.256 21.024 -9.442 1.00 45.32 C ATOM 113 C GLU A 8 2.931 20.418 -8.077 1.00 21.01 C ATOM 114 O GLU A 8 3.188 21.033 -7.042 1.00 44.11 O ATOM 115 CB GLU A 8 1.973 21.564 -10.078 1.00 42.43 C ATOM 116 CG GLU A 8 1.497 22.798 -9.308 1.00 71.54 C ATOM 117 CD GLU A 8 2.443 23.967 -9.561 1.00 53.24 C ATOM 118 OE1 GLU A 8 3.095 23.963 -10.593 1.00 4.21 O ATOM 119 OE2 GLU A 8 2.502 24.849 -8.721 1.00 14.30 O ATOM 0 H GLU A 8 3.302 19.776 -11.128 1.00 20.30 H new ATOM 0 HA GLU A 8 3.968 21.836 -9.294 1.00 45.32 H new ATOM 0 HB2 GLU A 8 2.153 21.822 -11.122 1.00 42.43 H new ATOM 0 HB3 GLU A 8 1.199 20.796 -10.068 1.00 42.43 H new ATOM 0 HG2 GLU A 8 0.486 23.063 -9.619 1.00 71.54 H new ATOM 0 HG3 GLU A 8 1.455 22.578 -8.241 1.00 71.54 H new ATOM 126 N ILE A 9 2.349 19.219 -8.077 1.00 62.31 N ATOM 127 CA ILE A 9 1.979 18.560 -6.823 1.00 1.13 C ATOM 128 C ILE A 9 3.129 17.724 -6.278 1.00 11.35 C ATOM 129 O ILE A 9 3.234 17.506 -5.071 1.00 31.44 O ATOM 130 CB ILE A 9 0.747 17.667 -7.053 1.00 73.05 C ATOM 131 CG1 ILE A 9 0.038 17.359 -5.701 1.00 1.41 C ATOM 132 CG2 ILE A 9 1.157 16.377 -7.783 1.00 51.20 C ATOM 133 CD1 ILE A 9 0.415 15.986 -5.157 1.00 53.30 C ATOM 0 H ILE A 9 2.125 18.689 -8.919 1.00 62.31 H new ATOM 0 HA ILE A 9 1.744 19.330 -6.088 1.00 1.13 H new ATOM 0 HB ILE A 9 0.035 18.198 -7.685 1.00 73.05 H new ATOM 0 HG12 ILE A 9 0.303 18.123 -4.971 1.00 1.41 H new ATOM 0 HG13 ILE A 9 -1.042 17.410 -5.838 1.00 1.41 H new ATOM 0 HG21 ILE A 9 0.277 15.753 -7.940 1.00 51.20 H new ATOM 0 HG22 ILE A 9 1.600 16.629 -8.746 1.00 51.20 H new ATOM 0 HG23 ILE A 9 1.885 15.833 -7.180 1.00 51.20 H new ATOM 0 HD11 ILE A 9 -0.103 15.814 -4.213 1.00 53.30 H new ATOM 0 HD12 ILE A 9 0.126 15.218 -5.875 1.00 53.30 H new ATOM 0 HD13 ILE A 9 1.492 15.943 -4.993 1.00 53.30 H new ATOM 145 N ALA A 10 3.995 17.268 -7.172 1.00 43.10 N ATOM 146 CA ALA A 10 5.127 16.472 -6.734 1.00 44.45 C ATOM 147 C ALA A 10 5.996 17.330 -5.839 1.00 11.22 C ATOM 148 O ALA A 10 6.120 18.536 -6.059 1.00 11.32 O ATOM 149 CB ALA A 10 5.910 15.898 -7.919 1.00 15.11 C ATOM 0 H ALA A 10 3.938 17.431 -8.177 1.00 43.10 H new ATOM 0 HA ALA A 10 4.772 15.610 -6.170 1.00 44.45 H new ATOM 0 HB1 ALA A 10 6.749 15.309 -7.549 1.00 15.11 H new ATOM 0 HB2 ALA A 10 5.255 15.262 -8.515 1.00 15.11 H new ATOM 0 HB3 ALA A 10 6.284 16.714 -8.537 1.00 15.11 H new ATOM 155 N GLY A 11 6.558 16.727 -4.797 1.00 54.35 N ATOM 156 CA GLY A 11 7.368 17.465 -3.837 1.00 52.34 C ATOM 157 C GLY A 11 6.692 17.396 -2.470 1.00 55.14 C ATOM 158 O GLY A 11 7.353 17.413 -1.433 1.00 11.24 O ATOM 0 H GLY A 11 6.467 15.731 -4.597 1.00 54.35 H new ATOM 0 HA2 GLY A 11 8.371 17.041 -3.784 1.00 52.34 H new ATOM 0 HA3 GLY A 11 7.476 18.503 -4.153 1.00 52.34 H new ATOM 162 N LYS A 12 5.357 17.308 -2.486 1.00 23.01 N ATOM 163 CA LYS A 12 4.583 17.226 -1.250 1.00 25.33 C ATOM 164 C LYS A 12 3.158 16.713 -1.510 1.00 33.35 C ATOM 165 O LYS A 12 2.342 17.422 -2.099 1.00 43.24 O ATOM 166 CB LYS A 12 4.512 18.606 -0.595 1.00 2.33 C ATOM 167 CG LYS A 12 3.799 18.496 0.754 1.00 62.41 C ATOM 168 CD LYS A 12 3.958 19.808 1.527 1.00 64.30 C ATOM 169 CE LYS A 12 3.269 20.946 0.766 1.00 72.11 C ATOM 170 NZ LYS A 12 3.008 22.078 1.699 1.00 44.32 N ATOM 0 H LYS A 12 4.796 17.292 -3.338 1.00 23.01 H new ATOM 0 HA LYS A 12 5.084 16.521 -0.587 1.00 25.33 H new ATOM 0 HB2 LYS A 12 5.516 19.006 -0.456 1.00 2.33 H new ATOM 0 HB3 LYS A 12 3.979 19.301 -1.244 1.00 2.33 H new ATOM 0 HG2 LYS A 12 2.742 18.278 0.601 1.00 62.41 H new ATOM 0 HG3 LYS A 12 4.215 17.670 1.330 1.00 62.41 H new ATOM 0 HD2 LYS A 12 3.525 19.709 2.522 1.00 64.30 H new ATOM 0 HD3 LYS A 12 5.015 20.036 1.661 1.00 64.30 H new ATOM 0 HE2 LYS A 12 3.897 21.279 -0.060 1.00 72.11 H new ATOM 0 HE3 LYS A 12 2.333 20.594 0.333 1.00 72.11 H new ATOM 0 HZ1 LYS A 12 2.540 22.851 1.184 1.00 44.32 H new ATOM 0 HZ2 LYS A 12 2.393 21.755 2.473 1.00 44.32 H new ATOM 0 HZ3 LYS A 12 3.909 22.419 2.092 1.00 44.32 H new ATOM 184 N TRP A 13 2.848 15.497 -1.041 1.00 53.04 N ATOM 185 CA TRP A 13 1.505 14.924 -1.198 1.00 41.52 C ATOM 186 C TRP A 13 0.919 14.717 0.192 1.00 32.11 C ATOM 187 O TRP A 13 1.576 14.143 1.057 1.00 53.41 O ATOM 188 CB TRP A 13 1.620 13.558 -1.898 1.00 4.21 C ATOM 189 CG TRP A 13 1.987 13.738 -3.306 1.00 1.13 C ATOM 190 CD1 TRP A 13 3.110 14.328 -3.747 1.00 12.11 C ATOM 191 CD2 TRP A 13 1.248 13.311 -4.478 1.00 14.55 C ATOM 192 NE1 TRP A 13 3.108 14.281 -5.118 1.00 73.23 N ATOM 193 CE2 TRP A 13 1.995 13.654 -5.608 1.00 75.23 C ATOM 194 CE3 TRP A 13 0.019 12.655 -4.671 1.00 54.34 C ATOM 195 CZ2 TRP A 13 1.571 13.369 -6.884 1.00 33.50 C ATOM 196 CZ3 TRP A 13 -0.428 12.365 -5.972 1.00 52.24 C ATOM 197 CH2 TRP A 13 0.354 12.719 -7.079 1.00 21.02 C ATOM 0 H TRP A 13 3.507 14.893 -0.551 1.00 53.04 H new ATOM 0 HA TRP A 13 0.873 15.586 -1.789 1.00 41.52 H new ATOM 0 HB2 TRP A 13 2.369 12.946 -1.395 1.00 4.21 H new ATOM 0 HB3 TRP A 13 0.672 13.024 -1.827 1.00 4.21 H new ATOM 0 HD1 TRP A 13 3.881 14.764 -3.129 1.00 12.11 H new ATOM 0 HE1 TRP A 13 3.849 14.668 -5.703 1.00 73.23 H new ATOM 0 HE3 TRP A 13 -0.582 12.374 -3.819 1.00 54.34 H new ATOM 0 HZ2 TRP A 13 2.179 13.648 -7.732 1.00 33.50 H new ATOM 0 HZ3 TRP A 13 -1.376 11.868 -6.118 1.00 52.24 H new ATOM 0 HH2 TRP A 13 0.015 12.489 -8.078 1.00 21.02 H new ATOM 208 N TYR A 14 -0.288 15.218 0.431 1.00 74.13 N ATOM 209 CA TYR A 14 -0.901 15.112 1.758 1.00 14.30 C ATOM 210 C TYR A 14 -1.974 14.019 1.818 1.00 42.23 C ATOM 211 O TYR A 14 -2.891 13.999 1.002 1.00 21.41 O ATOM 212 CB TYR A 14 -1.556 16.468 2.094 1.00 53.01 C ATOM 213 CG TYR A 14 -0.815 17.199 3.194 1.00 12.22 C ATOM 214 CD1 TYR A 14 0.576 17.330 3.146 1.00 74.31 C ATOM 215 CD2 TYR A 14 -1.535 17.763 4.255 1.00 43.30 C ATOM 216 CE1 TYR A 14 1.245 18.025 4.162 1.00 32.41 C ATOM 217 CE2 TYR A 14 -0.866 18.458 5.267 1.00 54.42 C ATOM 218 CZ TYR A 14 0.525 18.589 5.222 1.00 13.21 C ATOM 219 OH TYR A 14 1.186 19.274 6.220 1.00 23.02 O ATOM 0 H TYR A 14 -0.859 15.697 -0.265 1.00 74.13 H new ATOM 0 HA TYR A 14 -0.122 14.849 2.474 1.00 14.30 H new ATOM 0 HB2 TYR A 14 -1.582 17.090 1.199 1.00 53.01 H new ATOM 0 HB3 TYR A 14 -2.590 16.306 2.399 1.00 53.01 H new ATOM 0 HD1 TYR A 14 1.133 16.897 2.328 1.00 74.31 H new ATOM 0 HD2 TYR A 14 -2.610 17.661 4.291 1.00 43.30 H new ATOM 0 HE1 TYR A 14 2.320 18.126 4.127 1.00 32.41 H new ATOM 0 HE2 TYR A 14 -1.424 18.893 6.083 1.00 54.42 H new ATOM 0 HH TYR A 14 0.537 19.602 6.877 1.00 23.02 H new ATOM 229 N VAL A 15 -1.876 13.151 2.827 1.00 41.03 N ATOM 230 CA VAL A 15 -2.869 12.094 3.044 1.00 72.21 C ATOM 231 C VAL A 15 -3.724 12.514 4.238 1.00 0.23 C ATOM 232 O VAL A 15 -3.219 12.574 5.359 1.00 51.34 O ATOM 233 CB VAL A 15 -2.173 10.762 3.354 1.00 3.21 C ATOM 234 CG1 VAL A 15 -3.188 9.761 3.919 1.00 33.22 C ATOM 235 CG2 VAL A 15 -1.560 10.186 2.077 1.00 50.42 C ATOM 0 H VAL A 15 -1.117 13.159 3.509 1.00 41.03 H new ATOM 0 HA VAL A 15 -3.479 11.958 2.151 1.00 72.21 H new ATOM 0 HB VAL A 15 -1.388 10.939 4.089 1.00 3.21 H new ATOM 0 HG11 VAL A 15 -2.687 8.818 4.137 1.00 33.22 H new ATOM 0 HG12 VAL A 15 -3.622 10.161 4.835 1.00 33.22 H new ATOM 0 HG13 VAL A 15 -3.978 9.592 3.187 1.00 33.22 H new ATOM 0 HG21 VAL A 15 -1.068 9.241 2.304 1.00 50.42 H new ATOM 0 HG22 VAL A 15 -2.345 10.018 1.340 1.00 50.42 H new ATOM 0 HG23 VAL A 15 -0.830 10.888 1.675 1.00 50.42 H new ATOM 245 N VAL A 16 -4.997 12.858 4.005 1.00 62.33 N ATOM 246 CA VAL A 16 -5.849 13.329 5.106 1.00 72.41 C ATOM 247 C VAL A 16 -7.128 12.530 5.292 1.00 31.20 C ATOM 248 O VAL A 16 -7.994 12.932 6.070 1.00 13.12 O ATOM 249 CB VAL A 16 -6.201 14.795 4.886 1.00 21.42 C ATOM 250 CG1 VAL A 16 -4.952 15.549 4.398 1.00 3.33 C ATOM 251 CG2 VAL A 16 -7.320 14.916 3.842 1.00 54.51 C ATOM 0 H VAL A 16 -5.450 12.822 3.092 1.00 62.33 H new ATOM 0 HA VAL A 16 -5.266 13.192 6.017 1.00 72.41 H new ATOM 0 HB VAL A 16 -6.547 15.228 5.825 1.00 21.42 H new ATOM 0 HG11 VAL A 16 -5.199 16.599 4.239 1.00 3.33 H new ATOM 0 HG12 VAL A 16 -4.164 15.471 5.147 1.00 3.33 H new ATOM 0 HG13 VAL A 16 -4.606 15.112 3.461 1.00 3.33 H new ATOM 0 HG21 VAL A 16 -7.565 15.967 3.691 1.00 54.51 H new ATOM 0 HG22 VAL A 16 -6.986 14.482 2.899 1.00 54.51 H new ATOM 0 HG23 VAL A 16 -8.204 14.384 4.193 1.00 54.51 H new ATOM 261 N ALA A 17 -7.239 11.383 4.658 1.00 34.34 N ATOM 262 CA ALA A 17 -8.423 10.567 4.884 1.00 60.14 C ATOM 263 C ALA A 17 -8.321 9.263 4.120 1.00 60.40 C ATOM 264 O ALA A 17 -7.905 9.246 2.966 1.00 31.13 O ATOM 265 CB ALA A 17 -9.667 11.354 4.439 1.00 12.25 C ATOM 0 H ALA A 17 -6.555 11.000 4.005 1.00 34.34 H new ATOM 0 HA ALA A 17 -8.503 10.331 5.945 1.00 60.14 H new ATOM 0 HB1 ALA A 17 -10.559 10.749 4.605 1.00 12.25 H new ATOM 0 HB2 ALA A 17 -9.741 12.275 5.017 1.00 12.25 H new ATOM 0 HB3 ALA A 17 -9.585 11.596 3.379 1.00 12.25 H new ATOM 271 N LEU A 18 -8.654 8.158 4.785 1.00 51.42 N ATOM 272 CA LEU A 18 -8.544 6.841 4.173 1.00 23.54 C ATOM 273 C LEU A 18 -9.817 6.026 4.348 1.00 60.12 C ATOM 274 O LEU A 18 -10.731 6.405 5.081 1.00 33.43 O ATOM 275 CB LEU A 18 -7.349 6.080 4.770 1.00 74.34 C ATOM 276 CG LEU A 18 -7.225 6.359 6.278 1.00 63.33 C ATOM 277 CD1 LEU A 18 -6.763 7.809 6.538 1.00 72.33 C ATOM 278 CD2 LEU A 18 -8.574 6.102 6.968 1.00 63.20 C ATOM 0 H LEU A 18 -9.001 8.151 5.744 1.00 51.42 H new ATOM 0 HA LEU A 18 -8.388 6.987 3.104 1.00 23.54 H new ATOM 0 HB2 LEU A 18 -7.472 5.010 4.602 1.00 74.34 H new ATOM 0 HB3 LEU A 18 -6.431 6.379 4.263 1.00 74.34 H new ATOM 0 HG LEU A 18 -6.474 5.686 6.691 1.00 63.33 H new ATOM 0 HD11 LEU A 18 -6.684 7.979 7.612 1.00 72.33 H new ATOM 0 HD12 LEU A 18 -5.791 7.970 6.073 1.00 72.33 H new ATOM 0 HD13 LEU A 18 -7.488 8.504 6.113 1.00 72.33 H new ATOM 0 HD21 LEU A 18 -8.480 6.301 8.036 1.00 63.20 H new ATOM 0 HD22 LEU A 18 -9.332 6.759 6.541 1.00 63.20 H new ATOM 0 HD23 LEU A 18 -8.868 5.063 6.817 1.00 63.20 H new ATOM 290 N ALA A 19 -9.847 4.887 3.669 1.00 2.54 N ATOM 291 CA ALA A 19 -10.978 3.975 3.737 1.00 10.24 C ATOM 292 C ALA A 19 -10.461 2.540 3.719 1.00 23.52 C ATOM 293 O ALA A 19 -9.502 2.230 3.014 1.00 62.10 O ATOM 294 CB ALA A 19 -11.928 4.221 2.558 1.00 30.45 C ATOM 0 H ALA A 19 -9.092 4.572 3.059 1.00 2.54 H new ATOM 0 HA ALA A 19 -11.533 4.146 4.660 1.00 10.24 H new ATOM 0 HB1 ALA A 19 -12.771 3.532 2.620 1.00 30.45 H new ATOM 0 HB2 ALA A 19 -12.294 5.247 2.594 1.00 30.45 H new ATOM 0 HB3 ALA A 19 -11.395 4.059 1.621 1.00 30.45 H new ATOM 300 N SER A 20 -11.082 1.674 4.506 1.00 42.23 N ATOM 301 CA SER A 20 -10.647 0.287 4.572 1.00 35.53 C ATOM 302 C SER A 20 -11.682 -0.577 5.271 1.00 31.33 C ATOM 303 O SER A 20 -12.716 -0.092 5.727 1.00 5.13 O ATOM 304 CB SER A 20 -9.316 0.201 5.322 1.00 13.14 C ATOM 305 OG SER A 20 -9.196 -1.079 5.926 1.00 70.33 O ATOM 0 H SER A 20 -11.879 1.903 5.101 1.00 42.23 H new ATOM 0 HA SER A 20 -10.523 -0.082 3.554 1.00 35.53 H new ATOM 0 HB2 SER A 20 -8.487 0.370 4.635 1.00 13.14 H new ATOM 0 HB3 SER A 20 -9.263 0.980 6.082 1.00 13.14 H new ATOM 0 HG SER A 20 -8.798 -0.984 6.817 1.00 70.33 H new ATOM 311 N ASN A 21 -11.380 -1.866 5.356 1.00 11.21 N ATOM 312 CA ASN A 21 -12.267 -2.821 6.009 1.00 44.23 C ATOM 313 C ASN A 21 -11.466 -3.731 6.931 1.00 1.34 C ATOM 314 O ASN A 21 -12.025 -4.369 7.823 1.00 4.14 O ATOM 315 CB ASN A 21 -12.991 -3.661 4.962 1.00 51.14 C ATOM 316 CG ASN A 21 -13.847 -2.766 4.073 1.00 72.55 C ATOM 317 OD1 ASN A 21 -14.070 -3.082 2.904 1.00 62.11 O ATOM 318 ND2 ASN A 21 -14.342 -1.661 4.558 1.00 13.24 N ATOM 0 H ASN A 21 -10.525 -2.276 4.980 1.00 11.21 H new ATOM 0 HA ASN A 21 -13.001 -2.272 6.598 1.00 44.23 H new ATOM 0 HB2 ASN A 21 -12.266 -4.203 4.355 1.00 51.14 H new ATOM 0 HB3 ASN A 21 -13.618 -4.406 5.452 1.00 51.14 H new ATOM 0 HD21 ASN A 21 -14.915 -1.057 3.969 1.00 13.24 H new ATOM 0 HD22 ASN A 21 -14.156 -1.401 5.527 1.00 13.24 H new ATOM 325 N THR A 22 -10.147 -3.766 6.736 1.00 43.11 N ATOM 326 CA THR A 22 -9.297 -4.581 7.591 1.00 32.01 C ATOM 327 C THR A 22 -9.147 -3.860 8.921 1.00 3.33 C ATOM 328 O THR A 22 -8.556 -2.783 8.996 1.00 0.11 O ATOM 329 CB THR A 22 -7.933 -4.824 6.937 1.00 31.34 C ATOM 330 OG1 THR A 22 -7.233 -5.817 7.674 1.00 44.33 O ATOM 331 CG2 THR A 22 -7.114 -3.535 6.919 1.00 72.41 C ATOM 0 H THR A 22 -9.656 -3.249 6.007 1.00 43.11 H new ATOM 0 HA THR A 22 -9.750 -5.560 7.747 1.00 32.01 H new ATOM 0 HB THR A 22 -8.085 -5.158 5.911 1.00 31.34 H new ATOM 0 HG1 THR A 22 -6.905 -5.431 8.513 1.00 44.33 H new ATOM 0 HG21 THR A 22 -6.148 -3.724 6.451 1.00 72.41 H new ATOM 0 HG22 THR A 22 -7.648 -2.772 6.352 1.00 72.41 H new ATOM 0 HG23 THR A 22 -6.961 -3.187 7.941 1.00 72.41 H new ATOM 339 N GLU A 23 -9.738 -4.429 9.957 1.00 2.14 N ATOM 340 CA GLU A 23 -9.722 -3.803 11.269 1.00 3.35 C ATOM 341 C GLU A 23 -8.324 -3.466 11.748 1.00 3.02 C ATOM 342 O GLU A 23 -8.115 -2.415 12.343 1.00 70.02 O ATOM 343 CB GLU A 23 -10.413 -4.708 12.291 1.00 0.31 C ATOM 344 CG GLU A 23 -11.853 -4.975 11.847 1.00 73.34 C ATOM 345 CD GLU A 23 -12.658 -3.679 11.876 1.00 53.24 C ATOM 346 OE1 GLU A 23 -12.215 -2.744 12.522 1.00 14.20 O ATOM 347 OE2 GLU A 23 -13.705 -3.642 11.251 1.00 45.50 O ATOM 0 H GLU A 23 -10.233 -5.320 9.917 1.00 2.14 H new ATOM 0 HA GLU A 23 -10.263 -2.862 11.173 1.00 3.35 H new ATOM 0 HB2 GLU A 23 -9.870 -5.649 12.385 1.00 0.31 H new ATOM 0 HB3 GLU A 23 -10.406 -4.236 13.274 1.00 0.31 H new ATOM 0 HG2 GLU A 23 -11.860 -5.394 10.841 1.00 73.34 H new ATOM 0 HG3 GLU A 23 -12.313 -5.713 12.503 1.00 73.34 H new ATOM 354 N PHE A 24 -7.374 -4.342 11.516 1.00 41.22 N ATOM 355 CA PHE A 24 -6.022 -4.081 11.980 1.00 22.23 C ATOM 356 C PHE A 24 -5.563 -2.682 11.560 1.00 35.01 C ATOM 357 O PHE A 24 -5.137 -1.882 12.396 1.00 51.53 O ATOM 358 CB PHE A 24 -5.058 -5.140 11.415 1.00 70.30 C ATOM 359 CG PHE A 24 -5.821 -6.408 11.105 1.00 23.03 C ATOM 360 CD1 PHE A 24 -6.763 -6.899 12.017 1.00 4.25 C ATOM 361 CD2 PHE A 24 -5.587 -7.089 9.904 1.00 14.33 C ATOM 362 CE1 PHE A 24 -7.472 -8.071 11.727 1.00 11.11 C ATOM 363 CE2 PHE A 24 -6.296 -8.261 9.615 1.00 14.24 C ATOM 364 CZ PHE A 24 -7.238 -8.752 10.527 1.00 5.12 C ATOM 0 H PHE A 24 -7.502 -5.224 11.020 1.00 41.22 H new ATOM 0 HA PHE A 24 -6.017 -4.133 13.069 1.00 22.23 H new ATOM 0 HB2 PHE A 24 -4.577 -4.763 10.512 1.00 70.30 H new ATOM 0 HB3 PHE A 24 -4.267 -5.347 12.135 1.00 70.30 H new ATOM 0 HD1 PHE A 24 -6.943 -6.374 12.944 1.00 4.25 H new ATOM 0 HD2 PHE A 24 -4.860 -6.710 9.201 1.00 14.33 H new ATOM 0 HE1 PHE A 24 -8.200 -8.450 12.430 1.00 11.11 H new ATOM 0 HE2 PHE A 24 -6.116 -8.786 8.689 1.00 14.24 H new ATOM 0 HZ PHE A 24 -7.784 -9.657 10.304 1.00 5.12 H new ATOM 374 N PHE A 25 -5.625 -2.399 10.265 1.00 0.32 N ATOM 375 CA PHE A 25 -5.182 -1.101 9.748 1.00 54.32 C ATOM 376 C PHE A 25 -6.199 0.003 10.016 1.00 63.11 C ATOM 377 O PHE A 25 -5.841 1.102 10.441 1.00 71.03 O ATOM 378 CB PHE A 25 -4.902 -1.209 8.243 1.00 52.15 C ATOM 379 CG PHE A 25 -4.055 -2.443 7.929 1.00 13.41 C ATOM 380 CD1 PHE A 25 -3.347 -3.138 8.936 1.00 62.14 C ATOM 381 CD2 PHE A 25 -3.990 -2.900 6.606 1.00 41.51 C ATOM 382 CE1 PHE A 25 -2.590 -4.268 8.607 1.00 52.35 C ATOM 383 CE2 PHE A 25 -3.232 -4.035 6.287 1.00 62.22 C ATOM 384 CZ PHE A 25 -2.534 -4.718 7.285 1.00 40.32 C ATOM 0 H PHE A 25 -5.974 -3.042 9.554 1.00 0.32 H new ATOM 0 HA PHE A 25 -4.266 -0.831 10.274 1.00 54.32 H new ATOM 0 HB2 PHE A 25 -5.844 -1.262 7.697 1.00 52.15 H new ATOM 0 HB3 PHE A 25 -4.385 -0.312 7.901 1.00 52.15 H new ATOM 0 HD1 PHE A 25 -3.390 -2.797 9.960 1.00 62.14 H new ATOM 0 HD2 PHE A 25 -4.526 -2.376 5.829 1.00 41.51 H new ATOM 0 HE1 PHE A 25 -2.047 -4.795 9.378 1.00 52.35 H new ATOM 0 HE2 PHE A 25 -3.188 -4.383 5.265 1.00 62.22 H new ATOM 0 HZ PHE A 25 -1.952 -5.593 7.036 1.00 40.32 H new ATOM 394 N LEU A 26 -7.466 -0.304 9.784 1.00 21.02 N ATOM 395 CA LEU A 26 -8.540 0.655 10.015 1.00 63.53 C ATOM 396 C LEU A 26 -8.543 1.053 11.490 1.00 11.03 C ATOM 397 O LEU A 26 -8.834 2.197 11.856 1.00 61.20 O ATOM 398 CB LEU A 26 -9.859 -0.008 9.613 1.00 52.22 C ATOM 399 CG LEU A 26 -11.059 0.834 10.037 1.00 62.41 C ATOM 400 CD1 LEU A 26 -10.932 2.248 9.464 1.00 73.21 C ATOM 401 CD2 LEU A 26 -12.329 0.169 9.494 1.00 44.03 C ATOM 0 H LEU A 26 -7.778 -1.210 9.435 1.00 21.02 H new ATOM 0 HA LEU A 26 -8.401 1.559 9.422 1.00 63.53 H new ATOM 0 HB2 LEU A 26 -9.879 -0.155 8.533 1.00 52.22 H new ATOM 0 HB3 LEU A 26 -9.926 -0.995 10.070 1.00 52.22 H new ATOM 0 HG LEU A 26 -11.103 0.901 11.124 1.00 62.41 H new ATOM 0 HD11 LEU A 26 -11.792 2.843 9.771 1.00 73.21 H new ATOM 0 HD12 LEU A 26 -10.018 2.711 9.837 1.00 73.21 H new ATOM 0 HD13 LEU A 26 -10.895 2.198 8.376 1.00 73.21 H new ATOM 0 HD21 LEU A 26 -13.200 0.755 9.786 1.00 44.03 H new ATOM 0 HD22 LEU A 26 -12.275 0.116 8.407 1.00 44.03 H new ATOM 0 HD23 LEU A 26 -12.416 -0.838 9.903 1.00 44.03 H new ATOM 413 N ARG A 27 -8.162 0.087 12.308 1.00 34.31 N ATOM 414 CA ARG A 27 -8.068 0.303 13.745 1.00 64.24 C ATOM 415 C ARG A 27 -7.031 1.385 14.027 1.00 42.00 C ATOM 416 O ARG A 27 -7.253 2.273 14.851 1.00 31.12 O ATOM 417 CB ARG A 27 -7.682 -0.991 14.474 1.00 2.41 C ATOM 418 CG ARG A 27 -7.353 -0.686 15.939 1.00 70.22 C ATOM 419 CD ARG A 27 -7.289 -1.994 16.729 1.00 70.01 C ATOM 420 NE ARG A 27 -7.038 -1.720 18.139 1.00 72.51 N ATOM 421 CZ ARG A 27 -5.809 -1.478 18.585 1.00 34.33 C ATOM 422 NH1 ARG A 27 -4.802 -1.479 17.754 1.00 31.40 N ATOM 423 NH2 ARG A 27 -5.610 -1.240 19.852 1.00 3.13 N ATOM 0 H ARG A 27 -7.913 -0.854 12.004 1.00 34.31 H new ATOM 0 HA ARG A 27 -9.044 0.620 14.113 1.00 64.24 H new ATOM 0 HB2 ARG A 27 -8.501 -1.708 14.418 1.00 2.41 H new ATOM 0 HB3 ARG A 27 -6.822 -1.450 13.987 1.00 2.41 H new ATOM 0 HG2 ARG A 27 -6.401 -0.160 16.007 1.00 70.22 H new ATOM 0 HG3 ARG A 27 -8.111 -0.028 16.364 1.00 70.22 H new ATOM 0 HD2 ARG A 27 -8.226 -2.540 16.619 1.00 70.01 H new ATOM 0 HD3 ARG A 27 -6.500 -2.631 16.329 1.00 70.01 H new ATOM 0 HE ARG A 27 -7.819 -1.714 18.795 1.00 72.51 H new ATOM 0 HH11 ARG A 27 -4.958 -1.665 16.763 1.00 31.40 H new ATOM 0 HH12 ARG A 27 -3.859 -1.293 18.095 1.00 31.40 H new ATOM 0 HH21 ARG A 27 -6.397 -1.240 20.501 1.00 3.13 H new ATOM 0 HH22 ARG A 27 -4.667 -1.054 20.194 1.00 3.13 H new ATOM 437 N GLU A 28 -5.881 1.283 13.363 1.00 5.50 N ATOM 438 CA GLU A 28 -4.799 2.241 13.581 1.00 33.24 C ATOM 439 C GLU A 28 -4.964 3.541 12.782 1.00 71.42 C ATOM 440 O GLU A 28 -4.722 4.627 13.312 1.00 32.40 O ATOM 441 CB GLU A 28 -3.465 1.593 13.208 1.00 23.30 C ATOM 442 CG GLU A 28 -3.213 0.385 14.113 1.00 55.42 C ATOM 443 CD GLU A 28 -1.842 -0.212 13.814 1.00 64.12 C ATOM 444 OE1 GLU A 28 -1.300 0.094 12.765 1.00 2.21 O ATOM 445 OE2 GLU A 28 -1.354 -0.966 14.640 1.00 61.43 O ATOM 0 H GLU A 28 -5.676 0.556 12.678 1.00 5.50 H new ATOM 0 HA GLU A 28 -4.827 2.509 14.637 1.00 33.24 H new ATOM 0 HB2 GLU A 28 -3.479 1.281 12.164 1.00 23.30 H new ATOM 0 HB3 GLU A 28 -2.656 2.315 13.314 1.00 23.30 H new ATOM 0 HG2 GLU A 28 -3.268 0.686 15.159 1.00 55.42 H new ATOM 0 HG3 GLU A 28 -3.988 -0.365 13.956 1.00 55.42 H new ATOM 452 N LYS A 29 -5.367 3.477 11.516 1.00 54.40 N ATOM 453 CA LYS A 29 -5.499 4.707 10.754 1.00 72.22 C ATOM 454 C LYS A 29 -6.317 5.715 11.542 1.00 72.23 C ATOM 455 O LYS A 29 -6.107 6.923 11.446 1.00 31.44 O ATOM 456 CB LYS A 29 -6.147 4.412 9.396 1.00 44.31 C ATOM 457 CG LYS A 29 -5.104 3.753 8.452 1.00 41.12 C ATOM 458 CD LYS A 29 -5.704 2.541 7.711 1.00 62.35 C ATOM 459 CE LYS A 29 -6.507 3.005 6.496 1.00 13.32 C ATOM 460 NZ LYS A 29 -6.956 1.816 5.719 1.00 1.14 N ATOM 0 H LYS A 29 -5.599 2.620 11.014 1.00 54.40 H new ATOM 0 HA LYS A 29 -4.512 5.133 10.575 1.00 72.22 H new ATOM 0 HB2 LYS A 29 -7.003 3.750 9.527 1.00 44.31 H new ATOM 0 HB3 LYS A 29 -6.522 5.335 8.953 1.00 44.31 H new ATOM 0 HG2 LYS A 29 -4.752 4.487 7.727 1.00 41.12 H new ATOM 0 HG3 LYS A 29 -4.237 3.435 9.031 1.00 41.12 H new ATOM 0 HD2 LYS A 29 -4.906 1.869 7.393 1.00 62.35 H new ATOM 0 HD3 LYS A 29 -6.347 1.976 8.386 1.00 62.35 H new ATOM 0 HE2 LYS A 29 -7.369 3.590 6.817 1.00 13.32 H new ATOM 0 HE3 LYS A 29 -5.896 3.654 5.869 1.00 13.32 H new ATOM 0 HZ1 LYS A 29 -7.800 2.063 5.163 1.00 1.14 H new ATOM 0 HZ2 LYS A 29 -6.195 1.513 5.078 1.00 1.14 H new ATOM 0 HZ3 LYS A 29 -7.187 1.041 6.373 1.00 1.14 H new ATOM 474 N ASP A 30 -7.257 5.201 12.312 1.00 33.00 N ATOM 475 CA ASP A 30 -8.120 6.051 13.112 1.00 41.25 C ATOM 476 C ASP A 30 -7.334 6.852 14.157 1.00 2.31 C ATOM 477 O ASP A 30 -7.808 7.895 14.608 1.00 35.44 O ATOM 478 CB ASP A 30 -9.171 5.196 13.822 1.00 52.12 C ATOM 479 CG ASP A 30 -10.030 4.465 12.794 1.00 24.34 C ATOM 480 OD1 ASP A 30 -9.800 4.664 11.613 1.00 72.24 O ATOM 481 OD2 ASP A 30 -10.901 3.717 13.204 1.00 61.04 O ATOM 0 H ASP A 30 -7.443 4.202 12.401 1.00 33.00 H new ATOM 0 HA ASP A 30 -8.598 6.759 12.435 1.00 41.25 H new ATOM 0 HB2 ASP A 30 -8.683 4.476 14.478 1.00 52.12 H new ATOM 0 HB3 ASP A 30 -9.800 5.826 14.451 1.00 52.12 H new ATOM 486 N LYS A 31 -6.155 6.362 14.581 1.00 31.25 N ATOM 487 CA LYS A 31 -5.392 7.076 15.618 1.00 54.12 C ATOM 488 C LYS A 31 -4.303 8.008 15.078 1.00 54.22 C ATOM 489 O LYS A 31 -3.855 8.889 15.810 1.00 3.21 O ATOM 490 CB LYS A 31 -4.805 6.097 16.658 1.00 62.31 C ATOM 491 CG LYS A 31 -3.613 5.309 16.094 1.00 23.21 C ATOM 492 CD LYS A 31 -2.297 6.128 16.181 1.00 52.31 C ATOM 493 CE LYS A 31 -1.616 6.203 14.801 1.00 1.21 C ATOM 494 NZ LYS A 31 -0.729 5.018 14.630 1.00 41.14 N ATOM 0 H LYS A 31 -5.722 5.505 14.236 1.00 31.25 H new ATOM 0 HA LYS A 31 -6.120 7.725 16.105 1.00 54.12 H new ATOM 0 HB2 LYS A 31 -4.488 6.652 17.541 1.00 62.31 H new ATOM 0 HB3 LYS A 31 -5.580 5.402 16.980 1.00 62.31 H new ATOM 0 HG2 LYS A 31 -3.499 4.376 16.645 1.00 23.21 H new ATOM 0 HG3 LYS A 31 -3.810 5.044 15.055 1.00 23.21 H new ATOM 0 HD2 LYS A 31 -2.511 7.134 16.543 1.00 52.31 H new ATOM 0 HD3 LYS A 31 -1.622 5.667 16.902 1.00 52.31 H new ATOM 0 HE2 LYS A 31 -2.367 6.227 14.012 1.00 1.21 H new ATOM 0 HE3 LYS A 31 -1.036 7.122 14.717 1.00 1.21 H new ATOM 0 HZ1 LYS A 31 -0.059 5.195 13.854 1.00 41.14 H new ATOM 0 HZ2 LYS A 31 -0.202 4.849 15.511 1.00 41.14 H new ATOM 0 HZ3 LYS A 31 -1.306 4.182 14.406 1.00 41.14 H new ATOM 508 N MET A 32 -3.858 7.848 13.834 1.00 3.13 N ATOM 509 CA MET A 32 -2.807 8.747 13.332 1.00 21.14 C ATOM 510 C MET A 32 -3.367 10.107 12.945 1.00 15.43 C ATOM 511 O MET A 32 -4.575 10.329 12.928 1.00 32.15 O ATOM 512 CB MET A 32 -2.040 8.154 12.124 1.00 15.31 C ATOM 513 CG MET A 32 -2.983 7.422 11.156 1.00 0.23 C ATOM 514 SD MET A 32 -2.064 6.113 10.303 1.00 61.54 S ATOM 515 CE MET A 32 -2.001 4.943 11.682 1.00 4.52 C ATOM 0 H MET A 32 -4.186 7.141 13.176 1.00 3.13 H new ATOM 0 HA MET A 32 -2.107 8.866 14.159 1.00 21.14 H new ATOM 0 HB2 MET A 32 -1.523 8.953 11.593 1.00 15.31 H new ATOM 0 HB3 MET A 32 -1.277 7.463 12.481 1.00 15.31 H new ATOM 0 HG2 MET A 32 -3.824 6.995 11.702 1.00 0.23 H new ATOM 0 HG3 MET A 32 -3.396 8.124 10.432 1.00 0.23 H new ATOM 0 HE1 MET A 32 -0.966 4.805 11.995 1.00 4.52 H new ATOM 0 HE2 MET A 32 -2.584 5.332 12.516 1.00 4.52 H new ATOM 0 HE3 MET A 32 -2.415 3.985 11.366 1.00 4.52 H new ATOM 525 N LYS A 33 -2.443 11.003 12.623 1.00 23.10 N ATOM 526 CA LYS A 33 -2.769 12.363 12.205 1.00 64.13 C ATOM 527 C LYS A 33 -2.423 12.507 10.723 1.00 15.40 C ATOM 528 O LYS A 33 -1.884 11.576 10.124 1.00 72.35 O ATOM 529 CB LYS A 33 -1.956 13.369 13.024 1.00 2.42 C ATOM 530 CG LYS A 33 -1.913 12.933 14.492 1.00 12.41 C ATOM 531 CD LYS A 33 -3.337 12.851 15.051 1.00 21.25 C ATOM 532 CE LYS A 33 -3.285 12.793 16.579 1.00 3.31 C ATOM 533 NZ LYS A 33 -2.424 11.652 17.004 1.00 43.44 N ATOM 0 H LYS A 33 -1.442 10.808 12.644 1.00 23.10 H new ATOM 0 HA LYS A 33 -3.829 12.558 12.365 1.00 64.13 H new ATOM 0 HB2 LYS A 33 -0.943 13.440 12.627 1.00 2.42 H new ATOM 0 HB3 LYS A 33 -2.401 14.361 12.943 1.00 2.42 H new ATOM 0 HG2 LYS A 33 -1.422 11.964 14.579 1.00 12.41 H new ATOM 0 HG3 LYS A 33 -1.324 13.642 15.074 1.00 12.41 H new ATOM 0 HD2 LYS A 33 -3.915 13.717 14.729 1.00 21.25 H new ATOM 0 HD3 LYS A 33 -3.842 11.967 14.660 1.00 21.25 H new ATOM 0 HE2 LYS A 33 -2.890 13.728 16.976 1.00 3.31 H new ATOM 0 HE3 LYS A 33 -4.290 12.674 16.984 1.00 3.31 H new ATOM 0 HZ1 LYS A 33 -2.622 11.419 17.998 1.00 43.44 H new ATOM 0 HZ2 LYS A 33 -2.625 10.824 16.407 1.00 43.44 H new ATOM 0 HZ3 LYS A 33 -1.423 11.916 16.904 1.00 43.44 H new ATOM 547 N MET A 34 -2.720 13.650 10.115 1.00 63.34 N ATOM 548 CA MET A 34 -2.440 13.853 8.706 1.00 60.14 C ATOM 549 C MET A 34 -0.985 13.494 8.381 1.00 3.33 C ATOM 550 O MET A 34 -0.077 13.751 9.171 1.00 50.40 O ATOM 551 CB MET A 34 -2.660 15.350 8.434 1.00 71.44 C ATOM 552 CG MET A 34 -3.215 15.579 7.041 1.00 52.31 C ATOM 553 SD MET A 34 -3.471 17.354 6.794 1.00 32.54 S ATOM 554 CE MET A 34 -5.147 17.459 7.473 1.00 61.01 C ATOM 0 H MET A 34 -3.154 14.448 10.579 1.00 63.34 H new ATOM 0 HA MET A 34 -3.084 13.222 8.094 1.00 60.14 H new ATOM 0 HB2 MET A 34 -3.348 15.759 9.174 1.00 71.44 H new ATOM 0 HB3 MET A 34 -1.717 15.885 8.545 1.00 71.44 H new ATOM 0 HG2 MET A 34 -2.525 15.190 6.292 1.00 52.31 H new ATOM 0 HG3 MET A 34 -4.155 15.042 6.917 1.00 52.31 H new ATOM 0 HE1 MET A 34 -5.279 18.420 7.969 1.00 61.01 H new ATOM 0 HE2 MET A 34 -5.873 17.365 6.666 1.00 61.01 H new ATOM 0 HE3 MET A 34 -5.299 16.655 8.193 1.00 61.01 H new ATOM 564 N ALA A 35 -0.785 12.884 7.209 1.00 31.44 N ATOM 565 CA ALA A 35 0.546 12.466 6.767 1.00 13.12 C ATOM 566 C ALA A 35 0.940 13.199 5.489 1.00 2.12 C ATOM 567 O ALA A 35 0.098 13.808 4.828 1.00 15.31 O ATOM 568 CB ALA A 35 0.562 10.952 6.530 1.00 24.32 C ATOM 0 H ALA A 35 -1.532 12.669 6.548 1.00 31.44 H new ATOM 0 HA ALA A 35 1.268 12.716 7.545 1.00 13.12 H new ATOM 0 HB1 ALA A 35 1.555 10.646 6.201 1.00 24.32 H new ATOM 0 HB2 ALA A 35 0.312 10.436 7.457 1.00 24.32 H new ATOM 0 HB3 ALA A 35 -0.169 10.696 5.763 1.00 24.32 H new ATOM 574 N MET A 36 2.228 13.142 5.146 1.00 54.54 N ATOM 575 CA MET A 36 2.725 13.814 3.943 1.00 11.34 C ATOM 576 C MET A 36 3.621 12.874 3.130 1.00 63.31 C ATOM 577 O MET A 36 4.076 11.846 3.628 1.00 74.32 O ATOM 578 CB MET A 36 3.498 15.099 4.312 1.00 15.23 C ATOM 579 CG MET A 36 3.598 15.257 5.835 1.00 64.12 C ATOM 580 SD MET A 36 1.990 15.755 6.501 1.00 62.31 S ATOM 581 CE MET A 36 2.613 16.729 7.892 1.00 14.11 C ATOM 0 H MET A 36 2.941 12.643 5.678 1.00 54.54 H new ATOM 0 HA MET A 36 1.865 14.091 3.333 1.00 11.34 H new ATOM 0 HB2 MET A 36 4.498 15.064 3.879 1.00 15.23 H new ATOM 0 HB3 MET A 36 2.995 15.966 3.884 1.00 15.23 H new ATOM 0 HG2 MET A 36 3.915 14.318 6.288 1.00 64.12 H new ATOM 0 HG3 MET A 36 4.353 16.003 6.085 1.00 64.12 H new ATOM 0 HE1 MET A 36 1.774 17.140 8.453 1.00 14.11 H new ATOM 0 HE2 MET A 36 3.209 16.091 8.545 1.00 14.11 H new ATOM 0 HE3 MET A 36 3.233 17.544 7.517 1.00 14.11 H new ATOM 591 N ALA A 37 3.848 13.236 1.867 1.00 13.23 N ATOM 592 CA ALA A 37 4.672 12.410 0.986 1.00 53.14 C ATOM 593 C ALA A 37 5.244 13.211 -0.191 1.00 0.13 C ATOM 594 O ALA A 37 4.764 14.288 -0.510 1.00 62.44 O ATOM 595 CB ALA A 37 3.828 11.243 0.476 1.00 24.12 C ATOM 0 H ALA A 37 3.479 14.084 1.436 1.00 13.23 H new ATOM 0 HA ALA A 37 5.523 12.040 1.557 1.00 53.14 H new ATOM 0 HB1 ALA A 37 4.431 10.618 -0.183 1.00 24.12 H new ATOM 0 HB2 ALA A 37 3.480 10.649 1.321 1.00 24.12 H new ATOM 0 HB3 ALA A 37 2.970 11.628 -0.075 1.00 24.12 H new ATOM 601 N ARG A 38 6.269 12.659 -0.838 1.00 20.53 N ATOM 602 CA ARG A 38 6.901 13.316 -1.999 1.00 4.52 C ATOM 603 C ARG A 38 7.049 12.302 -3.132 1.00 71.21 C ATOM 604 O ARG A 38 7.506 11.189 -2.888 1.00 22.01 O ATOM 605 CB ARG A 38 8.277 13.866 -1.604 1.00 0.11 C ATOM 606 CG ARG A 38 9.067 14.251 -2.861 1.00 71.03 C ATOM 607 CD ARG A 38 10.183 15.231 -2.489 1.00 41.44 C ATOM 608 NE ARG A 38 11.121 14.600 -1.568 1.00 61.12 N ATOM 609 CZ ARG A 38 12.164 15.269 -1.085 1.00 43.41 C ATOM 610 NH1 ARG A 38 12.362 16.510 -1.435 1.00 1.43 N ATOM 611 NH2 ARG A 38 12.989 14.683 -0.260 1.00 55.23 N ATOM 0 H ARG A 38 6.684 11.762 -0.585 1.00 20.53 H new ATOM 0 HA ARG A 38 6.276 14.144 -2.333 1.00 4.52 H new ATOM 0 HB2 ARG A 38 8.159 14.736 -0.958 1.00 0.11 H new ATOM 0 HB3 ARG A 38 8.827 13.118 -1.033 1.00 0.11 H new ATOM 0 HG2 ARG A 38 9.492 13.360 -3.323 1.00 71.03 H new ATOM 0 HG3 ARG A 38 8.402 14.704 -3.596 1.00 71.03 H new ATOM 0 HD2 ARG A 38 10.707 15.555 -3.388 1.00 41.44 H new ATOM 0 HD3 ARG A 38 9.756 16.123 -2.030 1.00 41.44 H new ATOM 0 HE ARG A 38 10.975 13.630 -1.290 1.00 61.12 H new ATOM 0 HH11 ARG A 38 11.717 16.967 -2.079 1.00 1.43 H new ATOM 0 HH12 ARG A 38 13.162 17.023 -1.064 1.00 1.43 H new ATOM 0 HH21 ARG A 38 12.833 13.713 0.014 1.00 55.23 H new ATOM 0 HH22 ARG A 38 13.789 15.195 0.111 1.00 55.23 H new ATOM 625 N ILE A 39 6.648 12.664 -4.367 1.00 41.21 N ATOM 626 CA ILE A 39 6.714 11.749 -5.514 1.00 15.13 C ATOM 627 C ILE A 39 7.578 12.329 -6.633 1.00 22.01 C ATOM 628 O ILE A 39 7.603 13.540 -6.846 1.00 55.43 O ATOM 629 CB ILE A 39 5.291 11.478 -5.963 1.00 13.54 C ATOM 630 CG1 ILE A 39 5.177 10.301 -6.924 1.00 32.15 C ATOM 631 CG2 ILE A 39 4.723 12.664 -6.640 1.00 62.11 C ATOM 632 CD1 ILE A 39 3.683 9.970 -7.076 1.00 45.13 C ATOM 0 H ILE A 39 6.275 13.586 -4.591 1.00 41.21 H new ATOM 0 HA ILE A 39 7.190 10.810 -5.232 1.00 15.13 H new ATOM 0 HB ILE A 39 4.740 11.239 -5.053 1.00 13.54 H new ATOM 0 HG12 ILE A 39 5.614 10.552 -7.890 1.00 32.15 H new ATOM 0 HG13 ILE A 39 5.723 9.439 -6.541 1.00 32.15 H new ATOM 0 HG21 ILE A 39 3.702 12.449 -6.954 1.00 62.11 H new ATOM 0 HG22 ILE A 39 4.721 13.509 -5.952 1.00 62.11 H new ATOM 0 HG23 ILE A 39 5.328 12.909 -7.513 1.00 62.11 H new ATOM 0 HD11 ILE A 39 3.564 9.129 -7.759 1.00 45.13 H new ATOM 0 HD12 ILE A 39 3.268 9.708 -6.103 1.00 45.13 H new ATOM 0 HD13 ILE A 39 3.157 10.838 -7.474 1.00 45.13 H new ATOM 644 N SER A 40 8.293 11.451 -7.339 1.00 34.35 N ATOM 645 CA SER A 40 9.168 11.875 -8.435 1.00 73.31 C ATOM 646 C SER A 40 9.049 10.912 -9.613 1.00 1.44 C ATOM 647 O SER A 40 8.800 9.721 -9.428 1.00 55.15 O ATOM 648 CB SER A 40 10.624 11.921 -7.950 1.00 71.54 C ATOM 649 OG SER A 40 11.481 11.403 -8.960 1.00 50.44 O ATOM 0 H SER A 40 8.284 10.445 -7.173 1.00 34.35 H new ATOM 0 HA SER A 40 8.863 12.869 -8.761 1.00 73.31 H new ATOM 0 HB2 SER A 40 10.906 12.946 -7.711 1.00 71.54 H new ATOM 0 HB3 SER A 40 10.731 11.339 -7.035 1.00 71.54 H new ATOM 0 HG SER A 40 12.410 11.435 -8.649 1.00 50.44 H new ATOM 655 N PHE A 41 9.202 11.438 -10.829 1.00 70.11 N ATOM 656 CA PHE A 41 9.082 10.617 -12.033 1.00 63.21 C ATOM 657 C PHE A 41 10.431 10.070 -12.497 1.00 41.11 C ATOM 658 O PHE A 41 11.137 10.692 -13.293 1.00 5.24 O ATOM 659 CB PHE A 41 8.452 11.446 -13.159 1.00 33.00 C ATOM 660 CG PHE A 41 6.967 11.162 -13.253 1.00 72.23 C ATOM 661 CD1 PHE A 41 6.198 11.044 -12.090 1.00 0.12 C ATOM 662 CD2 PHE A 41 6.363 11.012 -14.508 1.00 31.51 C ATOM 663 CE1 PHE A 41 4.827 10.776 -12.180 1.00 20.32 C ATOM 664 CE2 PHE A 41 4.992 10.744 -14.598 1.00 11.21 C ATOM 665 CZ PHE A 41 4.224 10.626 -13.435 1.00 3.30 C ATOM 0 H PHE A 41 9.408 12.421 -11.005 1.00 70.11 H new ATOM 0 HA PHE A 41 8.448 9.765 -11.787 1.00 63.21 H new ATOM 0 HB2 PHE A 41 8.615 12.508 -12.973 1.00 33.00 H new ATOM 0 HB3 PHE A 41 8.935 11.210 -14.107 1.00 33.00 H new ATOM 0 HD1 PHE A 41 6.663 11.160 -11.122 1.00 0.12 H new ATOM 0 HD2 PHE A 41 6.955 11.103 -15.406 1.00 31.51 H new ATOM 0 HE1 PHE A 41 4.234 10.685 -11.282 1.00 20.32 H new ATOM 0 HE2 PHE A 41 4.527 10.628 -15.566 1.00 11.21 H new ATOM 0 HZ PHE A 41 3.166 10.419 -13.505 1.00 3.30 H new ATOM 675 N LEU A 42 10.737 8.877 -12.029 1.00 11.24 N ATOM 676 CA LEU A 42 11.964 8.200 -12.432 1.00 65.41 C ATOM 677 C LEU A 42 11.815 7.839 -13.901 1.00 73.33 C ATOM 678 O LEU A 42 12.764 7.866 -14.684 1.00 4.42 O ATOM 679 CB LEU A 42 12.178 6.920 -11.620 1.00 52.33 C ATOM 680 CG LEU A 42 12.658 7.241 -10.201 1.00 74.45 C ATOM 681 CD1 LEU A 42 12.712 5.937 -9.394 1.00 63.34 C ATOM 682 CD2 LEU A 42 14.054 7.888 -10.241 1.00 11.53 C ATOM 0 H LEU A 42 10.159 8.354 -11.372 1.00 11.24 H new ATOM 0 HA LEU A 42 12.820 8.852 -12.261 1.00 65.41 H new ATOM 0 HB2 LEU A 42 11.247 6.355 -11.573 1.00 52.33 H new ATOM 0 HB3 LEU A 42 12.910 6.286 -12.120 1.00 52.33 H new ATOM 0 HG LEU A 42 11.968 7.943 -9.733 1.00 74.45 H new ATOM 0 HD11 LEU A 42 13.052 6.150 -8.381 1.00 63.34 H new ATOM 0 HD12 LEU A 42 11.718 5.491 -9.357 1.00 63.34 H new ATOM 0 HD13 LEU A 42 13.404 5.243 -9.871 1.00 63.34 H new ATOM 0 HD21 LEU A 42 14.381 8.110 -9.225 1.00 11.53 H new ATOM 0 HD22 LEU A 42 14.760 7.201 -10.708 1.00 11.53 H new ATOM 0 HD23 LEU A 42 14.011 8.811 -10.818 1.00 11.53 H new ATOM 694 N GLY A 43 10.579 7.510 -14.234 1.00 34.45 N ATOM 695 CA GLY A 43 10.179 7.135 -15.581 1.00 75.32 C ATOM 696 C GLY A 43 8.683 6.829 -15.579 1.00 1.45 C ATOM 697 O GLY A 43 8.143 6.393 -14.566 1.00 23.42 O ATOM 0 H GLY A 43 9.810 7.495 -13.564 1.00 34.45 H new ATOM 0 HA2 GLY A 43 10.399 7.943 -16.279 1.00 75.32 H new ATOM 0 HA3 GLY A 43 10.743 6.264 -15.914 1.00 75.32 H new ATOM 701 N GLU A 44 8.006 7.065 -16.692 1.00 55.11 N ATOM 702 CA GLU A 44 6.571 6.799 -16.742 1.00 63.34 C ATOM 703 C GLU A 44 6.282 5.386 -16.244 1.00 45.43 C ATOM 704 O GLU A 44 5.196 5.107 -15.737 1.00 42.53 O ATOM 705 CB GLU A 44 6.051 6.965 -18.170 1.00 64.34 C ATOM 706 CG GLU A 44 6.304 8.398 -18.644 1.00 51.34 C ATOM 707 CD GLU A 44 5.472 9.375 -17.819 1.00 65.41 C ATOM 708 OE1 GLU A 44 4.513 8.935 -17.207 1.00 32.42 O ATOM 709 OE2 GLU A 44 5.807 10.547 -17.811 1.00 4.13 O ATOM 0 H GLU A 44 8.411 7.431 -17.554 1.00 55.11 H new ATOM 0 HA GLU A 44 6.061 7.514 -16.097 1.00 63.34 H new ATOM 0 HB2 GLU A 44 6.549 6.258 -18.834 1.00 64.34 H new ATOM 0 HB3 GLU A 44 4.985 6.741 -18.208 1.00 64.34 H new ATOM 0 HG2 GLU A 44 7.363 8.639 -18.550 1.00 51.34 H new ATOM 0 HG3 GLU A 44 6.049 8.491 -19.700 1.00 51.34 H new ATOM 716 N ASP A 45 7.269 4.504 -16.380 1.00 53.31 N ATOM 717 CA ASP A 45 7.125 3.122 -15.928 1.00 11.13 C ATOM 718 C ASP A 45 7.877 2.925 -14.614 1.00 10.04 C ATOM 719 O ASP A 45 8.158 1.796 -14.209 1.00 52.13 O ATOM 720 CB ASP A 45 7.680 2.163 -16.987 1.00 4.14 C ATOM 721 CG ASP A 45 7.385 2.702 -18.384 1.00 51.14 C ATOM 722 OD1 ASP A 45 6.231 2.995 -18.652 1.00 22.02 O ATOM 723 OD2 ASP A 45 8.317 2.814 -19.163 1.00 32.45 O ATOM 0 H ASP A 45 8.174 4.720 -16.798 1.00 53.31 H new ATOM 0 HA ASP A 45 6.067 2.910 -15.773 1.00 11.13 H new ATOM 0 HB2 ASP A 45 8.755 2.044 -16.854 1.00 4.14 H new ATOM 0 HB3 ASP A 45 7.232 1.176 -16.867 1.00 4.14 H new ATOM 728 N GLU A 46 8.210 4.034 -13.960 1.00 32.31 N ATOM 729 CA GLU A 46 8.942 3.979 -12.701 1.00 73.43 C ATOM 730 C GLU A 46 8.952 5.343 -12.009 1.00 34.51 C ATOM 731 O GLU A 46 9.321 6.353 -12.604 1.00 30.11 O ATOM 732 CB GLU A 46 10.384 3.539 -12.972 1.00 4.15 C ATOM 733 CG GLU A 46 11.099 3.242 -11.651 1.00 30.44 C ATOM 734 CD GLU A 46 12.601 3.131 -11.888 1.00 45.35 C ATOM 735 OE1 GLU A 46 13.014 3.286 -13.025 1.00 60.32 O ATOM 736 OE2 GLU A 46 13.316 2.894 -10.928 1.00 54.02 O ATOM 0 H GLU A 46 7.986 4.976 -14.280 1.00 32.31 H new ATOM 0 HA GLU A 46 8.446 3.263 -12.046 1.00 73.43 H new ATOM 0 HB2 GLU A 46 10.389 2.652 -13.605 1.00 4.15 H new ATOM 0 HB3 GLU A 46 10.915 4.321 -13.515 1.00 4.15 H new ATOM 0 HG2 GLU A 46 10.893 4.033 -10.930 1.00 30.44 H new ATOM 0 HG3 GLU A 46 10.720 2.314 -11.223 1.00 30.44 H new ATOM 743 N LEU A 47 8.547 5.372 -10.744 1.00 40.43 N ATOM 744 CA LEU A 47 8.527 6.620 -9.982 1.00 11.44 C ATOM 745 C LEU A 47 8.995 6.374 -8.549 1.00 10.44 C ATOM 746 O LEU A 47 8.795 5.301 -7.991 1.00 44.20 O ATOM 747 CB LEU A 47 7.131 7.275 -9.989 1.00 20.14 C ATOM 748 CG LEU A 47 6.039 6.234 -10.261 1.00 54.12 C ATOM 749 CD1 LEU A 47 4.686 6.844 -9.888 1.00 2.14 C ATOM 750 CD2 LEU A 47 6.035 5.816 -11.748 1.00 3.34 C ATOM 0 H LEU A 47 8.230 4.553 -10.225 1.00 40.43 H new ATOM 0 HA LEU A 47 9.215 7.313 -10.467 1.00 11.44 H new ATOM 0 HB2 LEU A 47 6.947 7.758 -9.030 1.00 20.14 H new ATOM 0 HB3 LEU A 47 7.094 8.054 -10.751 1.00 20.14 H new ATOM 0 HG LEU A 47 6.232 5.343 -9.663 1.00 54.12 H new ATOM 0 HD11 LEU A 47 3.895 6.117 -10.075 1.00 2.14 H new ATOM 0 HD12 LEU A 47 4.688 7.115 -8.832 1.00 2.14 H new ATOM 0 HD13 LEU A 47 4.510 7.735 -10.491 1.00 2.14 H new ATOM 0 HD21 LEU A 47 5.252 5.077 -11.916 1.00 3.34 H new ATOM 0 HD22 LEU A 47 5.848 6.691 -12.371 1.00 3.34 H new ATOM 0 HD23 LEU A 47 7.002 5.385 -12.007 1.00 3.34 H new ATOM 762 N LYS A 48 9.612 7.383 -7.956 1.00 13.43 N ATOM 763 CA LYS A 48 10.087 7.278 -6.581 1.00 71.43 C ATOM 764 C LYS A 48 9.142 8.053 -5.671 1.00 61.35 C ATOM 765 O LYS A 48 8.957 9.255 -5.862 1.00 11.03 O ATOM 766 CB LYS A 48 11.507 7.853 -6.480 1.00 32.54 C ATOM 767 CG LYS A 48 12.276 7.160 -5.350 1.00 70.50 C ATOM 768 CD LYS A 48 13.711 7.701 -5.292 1.00 65.55 C ATOM 769 CE LYS A 48 14.629 6.657 -4.654 1.00 70.34 C ATOM 770 NZ LYS A 48 15.905 7.303 -4.235 1.00 14.31 N ATOM 0 H LYS A 48 9.796 8.282 -8.401 1.00 13.43 H new ATOM 0 HA LYS A 48 10.110 6.232 -6.275 1.00 71.43 H new ATOM 0 HB2 LYS A 48 12.032 7.715 -7.425 1.00 32.54 H new ATOM 0 HB3 LYS A 48 11.461 8.926 -6.294 1.00 32.54 H new ATOM 0 HG2 LYS A 48 11.774 7.331 -4.398 1.00 70.50 H new ATOM 0 HG3 LYS A 48 12.290 6.083 -5.514 1.00 70.50 H new ATOM 0 HD2 LYS A 48 14.060 7.942 -6.296 1.00 65.55 H new ATOM 0 HD3 LYS A 48 13.739 8.625 -4.715 1.00 65.55 H new ATOM 0 HE2 LYS A 48 14.138 6.205 -3.792 1.00 70.34 H new ATOM 0 HE3 LYS A 48 14.832 5.854 -5.363 1.00 70.34 H new ATOM 0 HZ1 LYS A 48 16.708 6.731 -4.566 1.00 14.31 H new ATOM 0 HZ2 LYS A 48 15.964 8.255 -4.649 1.00 14.31 H new ATOM 0 HZ3 LYS A 48 15.934 7.374 -3.198 1.00 14.31 H new ATOM 784 N VAL A 49 8.546 7.380 -4.678 1.00 44.43 N ATOM 785 CA VAL A 49 7.632 8.071 -3.766 1.00 22.14 C ATOM 786 C VAL A 49 7.938 7.737 -2.308 1.00 40.03 C ATOM 787 O VAL A 49 8.330 6.623 -1.962 1.00 3.01 O ATOM 788 CB VAL A 49 6.144 7.860 -4.180 1.00 12.35 C ATOM 789 CG1 VAL A 49 5.461 6.677 -3.487 1.00 63.23 C ATOM 790 CG2 VAL A 49 5.329 9.111 -3.849 1.00 41.24 C ATOM 0 H VAL A 49 8.676 6.386 -4.490 1.00 44.43 H new ATOM 0 HA VAL A 49 7.801 9.144 -3.853 1.00 22.14 H new ATOM 0 HB VAL A 49 6.172 7.653 -5.250 1.00 12.35 H new ATOM 0 HG11 VAL A 49 4.429 6.600 -3.831 1.00 63.23 H new ATOM 0 HG12 VAL A 49 5.993 5.757 -3.729 1.00 63.23 H new ATOM 0 HG13 VAL A 49 5.474 6.831 -2.408 1.00 63.23 H new ATOM 0 HG21 VAL A 49 4.290 8.956 -4.141 1.00 41.24 H new ATOM 0 HG22 VAL A 49 5.380 9.305 -2.778 1.00 41.24 H new ATOM 0 HG23 VAL A 49 5.735 9.964 -4.392 1.00 41.24 H new ATOM 800 N SER A 50 7.796 8.770 -1.480 1.00 14.24 N ATOM 801 CA SER A 50 8.097 8.683 -0.048 1.00 60.14 C ATOM 802 C SER A 50 6.854 8.856 0.817 1.00 75.14 C ATOM 803 O SER A 50 5.921 9.565 0.444 1.00 13.45 O ATOM 804 CB SER A 50 9.103 9.774 0.313 1.00 14.31 C ATOM 805 OG SER A 50 10.392 9.401 -0.156 1.00 10.25 O ATOM 0 H SER A 50 7.470 9.689 -1.779 1.00 14.24 H new ATOM 0 HA SER A 50 8.502 7.690 0.146 1.00 60.14 H new ATOM 0 HB2 SER A 50 8.803 10.723 -0.132 1.00 14.31 H new ATOM 0 HB3 SER A 50 9.125 9.921 1.393 1.00 14.31 H new ATOM 0 HG SER A 50 11.039 10.101 0.073 1.00 10.25 H new ATOM 811 N TYR A 51 6.866 8.213 1.991 1.00 72.42 N ATOM 812 CA TYR A 51 5.747 8.307 2.928 1.00 41.53 C ATOM 813 C TYR A 51 6.194 8.991 4.220 1.00 53.10 C ATOM 814 O TYR A 51 7.197 8.594 4.817 1.00 44.43 O ATOM 815 CB TYR A 51 5.252 6.904 3.326 1.00 45.40 C ATOM 816 CG TYR A 51 4.970 6.026 2.123 1.00 72.31 C ATOM 817 CD1 TYR A 51 5.994 5.687 1.229 1.00 1.41 C ATOM 818 CD2 TYR A 51 3.677 5.524 1.920 1.00 4.41 C ATOM 819 CE1 TYR A 51 5.723 4.854 0.139 1.00 60.03 C ATOM 820 CE2 TYR A 51 3.410 4.692 0.826 1.00 14.42 C ATOM 821 CZ TYR A 51 4.434 4.357 -0.062 1.00 62.13 C ATOM 822 OH TYR A 51 4.171 3.533 -1.136 1.00 32.04 O ATOM 0 H TYR A 51 7.636 7.625 2.311 1.00 72.42 H new ATOM 0 HA TYR A 51 4.958 8.873 2.432 1.00 41.53 H new ATOM 0 HB2 TYR A 51 6.001 6.423 3.956 1.00 45.40 H new ATOM 0 HB3 TYR A 51 4.345 6.998 3.924 1.00 45.40 H new ATOM 0 HD1 TYR A 51 6.993 6.069 1.382 1.00 1.41 H new ATOM 0 HD2 TYR A 51 2.885 5.779 2.609 1.00 4.41 H new ATOM 0 HE1 TYR A 51 6.513 4.594 -0.550 1.00 60.03 H new ATOM 0 HE2 TYR A 51 2.412 4.309 0.669 1.00 14.42 H new ATOM 0 HH TYR A 51 4.785 3.746 -1.870 1.00 32.04 H new ATOM 832 N ALA A 52 5.446 10.001 4.661 1.00 63.05 N ATOM 833 CA ALA A 52 5.775 10.706 5.901 1.00 54.43 C ATOM 834 C ALA A 52 4.560 10.716 6.827 1.00 70.23 C ATOM 835 O ALA A 52 3.565 11.383 6.544 1.00 70.14 O ATOM 836 CB ALA A 52 6.200 12.143 5.589 1.00 11.31 C ATOM 0 H ALA A 52 4.614 10.348 4.183 1.00 63.05 H new ATOM 0 HA ALA A 52 6.599 10.191 6.395 1.00 54.43 H new ATOM 0 HB1 ALA A 52 6.443 12.660 6.517 1.00 11.31 H new ATOM 0 HB2 ALA A 52 7.076 12.131 4.940 1.00 11.31 H new ATOM 0 HB3 ALA A 52 5.384 12.663 5.087 1.00 11.31 H new ATOM 842 N VAL A 53 4.638 9.960 7.925 1.00 13.22 N ATOM 843 CA VAL A 53 3.529 9.875 8.878 1.00 60.10 C ATOM 844 C VAL A 53 3.994 10.278 10.284 1.00 35.32 C ATOM 845 O VAL A 53 4.895 9.647 10.837 1.00 70.25 O ATOM 846 CB VAL A 53 3.008 8.436 8.921 1.00 51.24 C ATOM 847 CG1 VAL A 53 1.693 8.385 9.705 1.00 43.21 C ATOM 848 CG2 VAL A 53 2.769 7.937 7.494 1.00 12.32 C ATOM 0 H VAL A 53 5.453 9.401 8.175 1.00 13.22 H new ATOM 0 HA VAL A 53 2.740 10.554 8.556 1.00 60.10 H new ATOM 0 HB VAL A 53 3.746 7.801 9.412 1.00 51.24 H new ATOM 0 HG11 VAL A 53 1.326 7.359 9.733 1.00 43.21 H new ATOM 0 HG12 VAL A 53 1.862 8.738 10.722 1.00 43.21 H new ATOM 0 HG13 VAL A 53 0.954 9.022 9.218 1.00 43.21 H new ATOM 0 HG21 VAL A 53 2.398 6.912 7.524 1.00 12.32 H new ATOM 0 HG22 VAL A 53 2.034 8.575 7.004 1.00 12.32 H new ATOM 0 HG23 VAL A 53 3.705 7.968 6.936 1.00 12.32 H new ATOM 858 N PRO A 54 3.410 11.296 10.881 1.00 55.04 N ATOM 859 CA PRO A 54 3.797 11.744 12.248 1.00 52.13 C ATOM 860 C PRO A 54 3.087 10.942 13.336 1.00 61.54 C ATOM 861 O PRO A 54 1.999 11.308 13.778 1.00 33.05 O ATOM 862 CB PRO A 54 3.347 13.202 12.263 1.00 21.43 C ATOM 863 CG PRO A 54 2.122 13.220 11.408 1.00 13.30 C ATOM 864 CD PRO A 54 2.327 12.140 10.336 1.00 42.11 C ATOM 0 HA PRO A 54 4.859 11.609 12.451 1.00 52.13 H new ATOM 0 HB2 PRO A 54 3.130 13.541 13.276 1.00 21.43 H new ATOM 0 HB3 PRO A 54 4.119 13.861 11.865 1.00 21.43 H new ATOM 0 HG2 PRO A 54 1.231 13.014 12.001 1.00 13.30 H new ATOM 0 HG3 PRO A 54 1.982 14.200 10.951 1.00 13.30 H new ATOM 0 HD2 PRO A 54 1.417 11.564 10.171 1.00 42.11 H new ATOM 0 HD3 PRO A 54 2.606 12.577 9.377 1.00 42.11 H new ATOM 872 N LYS A 55 3.709 9.847 13.763 1.00 12.13 N ATOM 873 CA LYS A 55 3.128 8.999 14.801 1.00 51.21 C ATOM 874 C LYS A 55 3.641 9.421 16.184 1.00 61.43 C ATOM 875 O LYS A 55 4.823 9.248 16.479 1.00 73.41 O ATOM 876 CB LYS A 55 3.513 7.539 14.546 1.00 75.43 C ATOM 877 CG LYS A 55 2.928 7.079 13.208 1.00 52.15 C ATOM 878 CD LYS A 55 2.939 5.550 13.140 1.00 60.51 C ATOM 879 CE LYS A 55 4.376 5.040 13.254 1.00 64.12 C ATOM 880 NZ LYS A 55 4.433 3.613 12.828 1.00 12.03 N ATOM 0 H LYS A 55 4.610 9.527 13.409 1.00 12.13 H new ATOM 0 HA LYS A 55 2.044 9.107 14.774 1.00 51.21 H new ATOM 0 HB2 LYS A 55 4.598 7.435 14.535 1.00 75.43 H new ATOM 0 HB3 LYS A 55 3.141 6.908 15.353 1.00 75.43 H new ATOM 0 HG2 LYS A 55 1.909 7.450 13.098 1.00 52.15 H new ATOM 0 HG3 LYS A 55 3.509 7.494 12.384 1.00 52.15 H new ATOM 0 HD2 LYS A 55 2.331 5.136 13.944 1.00 60.51 H new ATOM 0 HD3 LYS A 55 2.497 5.215 12.202 1.00 60.51 H new ATOM 0 HE2 LYS A 55 5.037 5.643 12.632 1.00 64.12 H new ATOM 0 HE3 LYS A 55 4.727 5.138 14.281 1.00 64.12 H new ATOM 0 HZ1 LYS A 55 5.410 3.266 12.906 1.00 12.03 H new ATOM 0 HZ2 LYS A 55 3.814 3.043 13.439 1.00 12.03 H new ATOM 0 HZ3 LYS A 55 4.114 3.532 11.841 1.00 12.03 H new ATOM 894 N PRO A 56 2.799 9.965 17.038 1.00 11.11 N ATOM 895 CA PRO A 56 3.226 10.397 18.402 1.00 20.22 C ATOM 896 C PRO A 56 4.092 9.346 19.094 1.00 53.52 C ATOM 897 O PRO A 56 4.927 9.672 19.938 1.00 72.41 O ATOM 898 CB PRO A 56 1.902 10.600 19.145 1.00 42.05 C ATOM 899 CG PRO A 56 0.917 10.963 18.083 1.00 32.32 C ATOM 900 CD PRO A 56 1.363 10.233 16.812 1.00 23.11 C ATOM 0 HA PRO A 56 3.845 11.294 18.376 1.00 20.22 H new ATOM 0 HB2 PRO A 56 1.601 9.694 19.670 1.00 42.05 H new ATOM 0 HB3 PRO A 56 1.985 11.389 19.893 1.00 42.05 H new ATOM 0 HG2 PRO A 56 -0.091 10.663 18.369 1.00 32.32 H new ATOM 0 HG3 PRO A 56 0.896 12.041 17.925 1.00 32.32 H new ATOM 0 HD2 PRO A 56 0.803 9.309 16.665 1.00 23.11 H new ATOM 0 HD3 PRO A 56 1.206 10.846 15.924 1.00 23.11 H new ATOM 908 N ASN A 57 3.887 8.083 18.731 1.00 34.52 N ATOM 909 CA ASN A 57 4.654 6.993 19.324 1.00 1.40 C ATOM 910 C ASN A 57 6.065 6.954 18.746 1.00 24.11 C ATOM 911 O ASN A 57 6.996 6.464 19.386 1.00 35.05 O ATOM 912 CB ASN A 57 3.955 5.658 19.059 1.00 44.12 C ATOM 913 CG ASN A 57 4.718 4.526 19.739 1.00 32.21 C ATOM 914 OD1 ASN A 57 5.198 3.611 19.069 1.00 55.25 O ATOM 915 ND2 ASN A 57 4.861 4.534 21.036 1.00 52.15 N ATOM 0 H ASN A 57 3.202 7.791 18.034 1.00 34.52 H new ATOM 0 HA ASN A 57 4.719 7.162 20.399 1.00 1.40 H new ATOM 0 HB2 ASN A 57 2.932 5.694 19.432 1.00 44.12 H new ATOM 0 HB3 ASN A 57 3.897 5.475 17.986 1.00 44.12 H new ATOM 0 HD21 ASN A 57 5.371 3.781 21.497 1.00 52.15 H new ATOM 0 HD22 ASN A 57 4.462 5.293 21.588 1.00 52.15 H new ATOM 922 N GLY A 58 6.216 7.474 17.533 1.00 2.53 N ATOM 923 CA GLY A 58 7.518 7.494 16.877 1.00 31.12 C ATOM 924 C GLY A 58 7.384 7.885 15.409 1.00 62.42 C ATOM 925 O GLY A 58 6.921 7.094 14.586 1.00 10.55 O ATOM 0 H GLY A 58 5.459 7.885 16.987 1.00 2.53 H new ATOM 0 HA2 GLY A 58 8.175 8.199 17.386 1.00 31.12 H new ATOM 0 HA3 GLY A 58 7.983 6.511 16.954 1.00 31.12 H new ATOM 929 N CYS A 59 7.793 9.108 15.087 1.00 51.21 N ATOM 930 CA CYS A 59 7.715 9.592 13.714 1.00 2.24 C ATOM 931 C CYS A 59 8.368 8.593 12.761 1.00 44.25 C ATOM 932 O CYS A 59 9.374 7.968 13.099 1.00 11.32 O ATOM 933 CB CYS A 59 8.412 10.952 13.603 1.00 5.11 C ATOM 934 SG CYS A 59 8.033 11.939 15.073 1.00 2.50 S ATOM 0 H CYS A 59 8.179 9.777 15.753 1.00 51.21 H new ATOM 0 HA CYS A 59 6.666 9.702 13.439 1.00 2.24 H new ATOM 0 HB2 CYS A 59 9.489 10.815 13.510 1.00 5.11 H new ATOM 0 HB3 CYS A 59 8.079 11.472 12.705 1.00 5.11 H new ATOM 939 N ARG A 60 7.786 8.441 11.572 1.00 15.55 N ATOM 940 CA ARG A 60 8.318 7.506 10.579 1.00 62.22 C ATOM 941 C ARG A 60 8.424 8.168 9.208 1.00 15.31 C ATOM 942 O ARG A 60 7.419 8.556 8.613 1.00 53.25 O ATOM 943 CB ARG A 60 7.404 6.281 10.482 1.00 21.43 C ATOM 944 CG ARG A 60 8.057 5.222 9.590 1.00 63.34 C ATOM 945 CD ARG A 60 7.121 4.020 9.458 1.00 62.30 C ATOM 946 NE ARG A 60 7.762 2.964 8.680 1.00 43.34 N ATOM 947 CZ ARG A 60 7.759 2.989 7.352 1.00 14.55 C ATOM 948 NH1 ARG A 60 7.177 3.970 6.719 1.00 45.05 N ATOM 949 NH2 ARG A 60 8.339 2.032 6.679 1.00 12.20 N ATOM 0 H ARG A 60 6.953 8.948 11.274 1.00 15.55 H new ATOM 0 HA ARG A 60 9.315 7.201 10.896 1.00 62.22 H new ATOM 0 HB2 ARG A 60 7.221 5.872 11.476 1.00 21.43 H new ATOM 0 HB3 ARG A 60 6.436 6.569 10.073 1.00 21.43 H new ATOM 0 HG2 ARG A 60 8.270 5.641 8.606 1.00 63.34 H new ATOM 0 HG3 ARG A 60 9.010 4.909 10.016 1.00 63.34 H new ATOM 0 HD2 ARG A 60 6.858 3.644 10.447 1.00 62.30 H new ATOM 0 HD3 ARG A 60 6.192 4.324 8.975 1.00 62.30 H new ATOM 0 HE ARG A 60 8.221 2.193 9.165 1.00 43.34 H new ATOM 0 HH11 ARG A 60 6.724 4.718 7.244 1.00 45.05 H new ATOM 0 HH12 ARG A 60 7.175 3.989 5.699 1.00 45.05 H new ATOM 0 HH21 ARG A 60 8.795 1.265 7.173 1.00 12.20 H new ATOM 0 HH22 ARG A 60 8.336 2.052 5.659 1.00 12.20 H new ATOM 963 N LYS A 61 9.653 8.279 8.708 1.00 3.20 N ATOM 964 CA LYS A 61 9.900 8.879 7.397 1.00 4.24 C ATOM 965 C LYS A 61 10.847 7.996 6.590 1.00 4.32 C ATOM 966 O LYS A 61 11.882 7.564 7.094 1.00 43.24 O ATOM 967 CB LYS A 61 10.510 10.273 7.566 1.00 10.22 C ATOM 968 CG LYS A 61 11.830 10.166 8.332 1.00 42.34 C ATOM 969 CD LYS A 61 12.292 11.565 8.750 1.00 30.40 C ATOM 970 CE LYS A 61 13.712 11.488 9.311 1.00 52.32 C ATOM 971 NZ LYS A 61 14.646 11.031 8.242 1.00 63.14 N ATOM 0 H LYS A 61 10.494 7.962 9.190 1.00 3.20 H new ATOM 0 HA LYS A 61 8.953 8.966 6.865 1.00 4.24 H new ATOM 0 HB2 LYS A 61 10.680 10.727 6.590 1.00 10.22 H new ATOM 0 HB3 LYS A 61 9.818 10.921 8.103 1.00 10.22 H new ATOM 0 HG2 LYS A 61 11.702 9.535 9.212 1.00 42.34 H new ATOM 0 HG3 LYS A 61 12.588 9.692 7.708 1.00 42.34 H new ATOM 0 HD2 LYS A 61 12.264 12.239 7.894 1.00 30.40 H new ATOM 0 HD3 LYS A 61 11.615 11.974 9.500 1.00 30.40 H new ATOM 0 HE2 LYS A 61 14.020 12.465 9.685 1.00 52.32 H new ATOM 0 HE3 LYS A 61 13.744 10.799 10.155 1.00 52.32 H new ATOM 0 HZ1 LYS A 61 15.600 11.396 8.436 1.00 63.14 H new ATOM 0 HZ2 LYS A 61 14.670 9.991 8.223 1.00 63.14 H new ATOM 0 HZ3 LYS A 61 14.320 11.387 7.321 1.00 63.14 H new ATOM 985 N TRP A 62 10.487 7.720 5.338 1.00 55.34 N ATOM 986 CA TRP A 62 11.326 6.875 4.493 1.00 74.55 C ATOM 987 C TRP A 62 11.016 7.086 3.011 1.00 43.13 C ATOM 988 O TRP A 62 10.114 7.845 2.649 1.00 12.21 O ATOM 989 CB TRP A 62 11.118 5.400 4.869 1.00 73.22 C ATOM 990 CG TRP A 62 9.894 4.873 4.190 1.00 3.41 C ATOM 991 CD1 TRP A 62 8.688 5.483 4.182 1.00 64.13 C ATOM 992 CD2 TRP A 62 9.742 3.650 3.414 1.00 54.25 C ATOM 993 NE1 TRP A 62 7.804 4.714 3.449 1.00 34.23 N ATOM 994 CE2 TRP A 62 8.406 3.575 2.956 1.00 25.41 C ATOM 995 CE3 TRP A 62 10.623 2.611 3.067 1.00 21.20 C ATOM 996 CZ2 TRP A 62 7.960 2.507 2.181 1.00 43.24 C ATOM 997 CZ3 TRP A 62 10.177 1.532 2.286 1.00 1.43 C ATOM 998 CH2 TRP A 62 8.848 1.480 1.843 1.00 54.30 C ATOM 0 H TRP A 62 9.636 8.062 4.893 1.00 55.34 H new ATOM 0 HA TRP A 62 12.367 7.152 4.659 1.00 74.55 H new ATOM 0 HB2 TRP A 62 11.989 4.814 4.576 1.00 73.22 H new ATOM 0 HB3 TRP A 62 11.017 5.301 5.950 1.00 73.22 H new ATOM 0 HD1 TRP A 62 8.453 6.418 4.669 1.00 64.13 H new ATOM 0 HE1 TRP A 62 6.826 4.959 3.292 1.00 34.23 H new ATOM 0 HE3 TRP A 62 11.649 2.643 3.403 1.00 21.20 H new ATOM 0 HZ2 TRP A 62 6.935 2.472 1.843 1.00 43.24 H new ATOM 0 HZ3 TRP A 62 10.862 0.738 2.025 1.00 1.43 H new ATOM 0 HH2 TRP A 62 8.510 0.649 1.242 1.00 54.30 H new ATOM 1009 N GLU A 63 11.775 6.393 2.165 1.00 70.22 N ATOM 1010 CA GLU A 63 11.599 6.481 0.714 1.00 32.22 C ATOM 1011 C GLU A 63 11.219 5.116 0.143 1.00 23.05 C ATOM 1012 O GLU A 63 11.422 4.086 0.787 1.00 21.10 O ATOM 1013 CB GLU A 63 12.897 6.970 0.066 1.00 54.11 C ATOM 1014 CG GLU A 63 12.637 7.356 -1.393 1.00 43.30 C ATOM 1015 CD GLU A 63 13.860 8.065 -1.966 1.00 12.33 C ATOM 1016 OE1 GLU A 63 14.927 7.473 -1.944 1.00 22.45 O ATOM 1017 OE2 GLU A 63 13.712 9.187 -2.420 1.00 75.32 O ATOM 0 H GLU A 63 12.521 5.762 2.459 1.00 70.22 H new ATOM 0 HA GLU A 63 10.798 7.188 0.498 1.00 32.22 H new ATOM 0 HB2 GLU A 63 13.287 7.828 0.614 1.00 54.11 H new ATOM 0 HB3 GLU A 63 13.655 6.189 0.115 1.00 54.11 H new ATOM 0 HG2 GLU A 63 12.413 6.465 -1.980 1.00 43.30 H new ATOM 0 HG3 GLU A 63 11.765 8.007 -1.457 1.00 43.30 H new ATOM 1024 N THR A 64 10.674 5.113 -1.071 1.00 2.50 N ATOM 1025 CA THR A 64 10.275 3.865 -1.722 1.00 63.24 C ATOM 1026 C THR A 64 10.307 4.013 -3.240 1.00 65.10 C ATOM 1027 O THR A 64 9.978 5.071 -3.777 1.00 2.44 O ATOM 1028 CB THR A 64 8.864 3.459 -1.276 1.00 71.13 C ATOM 1029 OG1 THR A 64 8.655 3.883 0.063 1.00 52.42 O ATOM 1030 CG2 THR A 64 8.705 1.938 -1.363 1.00 63.50 C ATOM 0 H THR A 64 10.499 5.954 -1.622 1.00 2.50 H new ATOM 0 HA THR A 64 10.983 3.090 -1.429 1.00 63.24 H new ATOM 0 HB THR A 64 8.130 3.931 -1.930 1.00 71.13 H new ATOM 0 HG1 THR A 64 8.561 3.099 0.643 1.00 52.42 H new ATOM 0 HG21 THR A 64 7.701 1.658 -1.045 1.00 63.50 H new ATOM 0 HG22 THR A 64 8.863 1.614 -2.392 1.00 63.50 H new ATOM 0 HG23 THR A 64 9.438 1.458 -0.715 1.00 63.50 H new ATOM 1038 N THR A 65 10.695 2.942 -3.926 1.00 34.42 N ATOM 1039 CA THR A 65 10.758 2.954 -5.385 1.00 15.15 C ATOM 1040 C THR A 65 9.599 2.155 -5.975 1.00 3.42 C ATOM 1041 O THR A 65 9.243 1.092 -5.465 1.00 62.32 O ATOM 1042 CB THR A 65 12.085 2.353 -5.853 1.00 45.40 C ATOM 1043 OG1 THR A 65 13.158 3.009 -5.192 1.00 52.35 O ATOM 1044 CG2 THR A 65 12.227 2.535 -7.366 1.00 73.41 C ATOM 0 H THR A 65 10.970 2.058 -3.498 1.00 34.42 H new ATOM 0 HA THR A 65 10.686 3.986 -5.727 1.00 15.15 H new ATOM 0 HB THR A 65 12.106 1.289 -5.615 1.00 45.40 H new ATOM 0 HG1 THR A 65 14.009 2.625 -5.489 1.00 52.35 H new ATOM 0 HG21 THR A 65 13.173 2.106 -7.697 1.00 73.41 H new ATOM 0 HG22 THR A 65 11.403 2.031 -7.872 1.00 73.41 H new ATOM 0 HG23 THR A 65 12.206 3.598 -7.608 1.00 73.41 H new ATOM 1052 N PHE A 66 9.018 2.677 -7.054 1.00 72.43 N ATOM 1053 CA PHE A 66 7.890 2.031 -7.730 1.00 45.13 C ATOM 1054 C PHE A 66 8.356 1.601 -9.123 1.00 64.34 C ATOM 1055 O PHE A 66 8.846 2.428 -9.891 1.00 15.01 O ATOM 1056 CB PHE A 66 6.751 3.057 -7.877 1.00 32.41 C ATOM 1057 CG PHE A 66 5.965 3.292 -6.590 1.00 4.43 C ATOM 1058 CD1 PHE A 66 6.316 2.693 -5.363 1.00 12.44 C ATOM 1059 CD2 PHE A 66 4.855 4.146 -6.644 1.00 72.30 C ATOM 1060 CE1 PHE A 66 5.554 2.951 -4.215 1.00 45.24 C ATOM 1061 CE2 PHE A 66 4.099 4.400 -5.496 1.00 23.34 C ATOM 1062 CZ PHE A 66 4.446 3.803 -4.283 1.00 24.24 C ATOM 0 H PHE A 66 9.312 3.554 -7.483 1.00 72.43 H new ATOM 0 HA PHE A 66 7.541 1.169 -7.162 1.00 45.13 H new ATOM 0 HB2 PHE A 66 7.170 4.005 -8.214 1.00 32.41 H new ATOM 0 HB3 PHE A 66 6.066 2.717 -8.653 1.00 32.41 H new ATOM 0 HD1 PHE A 66 7.171 2.036 -5.308 1.00 12.44 H new ATOM 0 HD2 PHE A 66 4.582 4.611 -7.580 1.00 72.30 H new ATOM 0 HE1 PHE A 66 5.823 2.491 -3.276 1.00 45.24 H new ATOM 0 HE2 PHE A 66 3.245 5.059 -5.548 1.00 23.34 H new ATOM 0 HZ PHE A 66 3.860 3.999 -3.397 1.00 24.24 H new ATOM 1187 N VAL A 75 -0.217 2.554 -13.518 1.00 55.32 N ATOM 1188 CA VAL A 75 -0.317 2.004 -12.168 1.00 2.32 C ATOM 1189 C VAL A 75 1.071 1.632 -11.683 1.00 1.22 C ATOM 1190 O VAL A 75 1.940 1.355 -12.496 1.00 63.33 O ATOM 1191 CB VAL A 75 -1.209 0.765 -12.154 1.00 64.11 C ATOM 1192 CG1 VAL A 75 -1.353 0.252 -10.711 1.00 32.41 C ATOM 1193 CG2 VAL A 75 -2.583 1.129 -12.728 1.00 24.21 C ATOM 0 HA VAL A 75 -0.758 2.755 -11.512 1.00 2.32 H new ATOM 0 HB VAL A 75 -0.763 -0.021 -12.763 1.00 64.11 H new ATOM 0 HG11 VAL A 75 -1.990 -0.633 -10.701 1.00 32.41 H new ATOM 0 HG12 VAL A 75 -0.370 -0.004 -10.316 1.00 32.41 H new ATOM 0 HG13 VAL A 75 -1.801 1.029 -10.092 1.00 32.41 H new ATOM 0 HG21 VAL A 75 -3.225 0.248 -12.721 1.00 24.21 H new ATOM 0 HG22 VAL A 75 -3.035 1.913 -12.120 1.00 24.21 H new ATOM 0 HG23 VAL A 75 -2.467 1.485 -13.752 1.00 24.21 H new ATOM 1203 N TYR A 76 1.292 1.655 -10.372 1.00 0.10 N ATOM 1204 CA TYR A 76 2.634 1.338 -9.842 1.00 1.14 C ATOM 1205 C TYR A 76 2.669 -0.036 -9.183 1.00 33.00 C ATOM 1206 O TYR A 76 1.716 -0.422 -8.518 1.00 22.34 O ATOM 1207 CB TYR A 76 3.052 2.405 -8.798 1.00 54.13 C ATOM 1208 CG TYR A 76 3.563 1.739 -7.521 1.00 60.11 C ATOM 1209 CD1 TYR A 76 4.693 0.909 -7.555 1.00 41.13 C ATOM 1210 CD2 TYR A 76 2.894 1.941 -6.307 1.00 43.42 C ATOM 1211 CE1 TYR A 76 5.146 0.289 -6.389 1.00 12.03 C ATOM 1212 CE2 TYR A 76 3.353 1.321 -5.138 1.00 70.24 C ATOM 1213 CZ TYR A 76 4.477 0.497 -5.180 1.00 20.12 C ATOM 1214 OH TYR A 76 4.924 -0.111 -4.026 1.00 14.42 O ATOM 0 H TYR A 76 0.590 1.881 -9.668 1.00 0.10 H new ATOM 0 HA TYR A 76 3.327 1.336 -10.683 1.00 1.14 H new ATOM 0 HB2 TYR A 76 3.829 3.045 -9.216 1.00 54.13 H new ATOM 0 HB3 TYR A 76 2.202 3.046 -8.565 1.00 54.13 H new ATOM 0 HD1 TYR A 76 5.215 0.749 -8.487 1.00 41.13 H new ATOM 0 HD2 TYR A 76 2.022 2.577 -6.272 1.00 43.42 H new ATOM 0 HE1 TYR A 76 6.015 -0.352 -6.422 1.00 12.03 H new ATOM 0 HE2 TYR A 76 2.836 1.481 -4.203 1.00 70.24 H new ATOM 0 HH TYR A 76 4.410 -0.930 -3.868 1.00 14.42 H new ATOM 1224 N TYR A 77 3.792 -0.777 -9.356 1.00 45.44 N ATOM 1225 CA TYR A 77 3.903 -2.089 -8.736 1.00 15.32 C ATOM 1226 C TYR A 77 5.332 -2.390 -8.255 1.00 5.31 C ATOM 1227 O TYR A 77 6.293 -2.282 -9.014 1.00 31.34 O ATOM 1228 CB TYR A 77 3.448 -3.169 -9.725 1.00 12.41 C ATOM 1229 CG TYR A 77 3.718 -4.542 -9.155 1.00 31.32 C ATOM 1230 CD1 TYR A 77 2.796 -5.137 -8.285 1.00 31.00 C ATOM 1231 CD2 TYR A 77 4.892 -5.223 -9.502 1.00 34.24 C ATOM 1232 CE1 TYR A 77 3.049 -6.410 -7.761 1.00 50.53 C ATOM 1233 CE2 TYR A 77 5.144 -6.496 -8.977 1.00 75.04 C ATOM 1234 CZ TYR A 77 4.223 -7.090 -8.107 1.00 51.15 C ATOM 1235 OH TYR A 77 4.472 -8.346 -7.591 1.00 14.13 O ATOM 0 H TYR A 77 4.601 -0.487 -9.905 1.00 45.44 H new ATOM 0 HA TYR A 77 3.258 -2.091 -7.857 1.00 15.32 H new ATOM 0 HB2 TYR A 77 2.384 -3.056 -9.934 1.00 12.41 H new ATOM 0 HB3 TYR A 77 3.974 -3.050 -10.672 1.00 12.41 H new ATOM 0 HD1 TYR A 77 1.890 -4.614 -8.018 1.00 31.00 H new ATOM 0 HD2 TYR A 77 5.603 -4.766 -10.175 1.00 34.24 H new ATOM 0 HE1 TYR A 77 2.338 -6.868 -7.089 1.00 50.53 H new ATOM 0 HE2 TYR A 77 6.050 -7.020 -9.244 1.00 75.04 H new ATOM 0 HH TYR A 77 5.329 -8.676 -7.933 1.00 14.13 H new ATOM 1245 N SER A 78 5.464 -2.769 -6.977 1.00 33.44 N ATOM 1246 CA SER A 78 6.777 -3.098 -6.410 1.00 51.31 C ATOM 1247 C SER A 78 6.859 -4.595 -6.119 1.00 44.42 C ATOM 1248 O SER A 78 6.312 -5.081 -5.129 1.00 55.11 O ATOM 1249 CB SER A 78 7.015 -2.311 -5.114 1.00 53.44 C ATOM 1250 OG SER A 78 7.863 -1.202 -5.388 1.00 70.33 O ATOM 0 H SER A 78 4.686 -2.855 -6.323 1.00 33.44 H new ATOM 0 HA SER A 78 7.544 -2.826 -7.135 1.00 51.31 H new ATOM 0 HB2 SER A 78 6.066 -1.966 -4.705 1.00 53.44 H new ATOM 0 HB3 SER A 78 7.471 -2.955 -4.362 1.00 53.44 H new ATOM 0 HG SER A 78 7.817 -0.564 -4.646 1.00 70.33 H new ATOM 1256 N GLU A 79 7.540 -5.312 -6.996 1.00 64.42 N ATOM 1257 CA GLU A 79 7.686 -6.752 -6.840 1.00 30.01 C ATOM 1258 C GLU A 79 8.153 -7.093 -5.425 1.00 2.23 C ATOM 1259 O GLU A 79 7.790 -8.133 -4.876 1.00 4.33 O ATOM 1260 CB GLU A 79 8.698 -7.287 -7.855 1.00 33.30 C ATOM 1261 CG GLU A 79 8.641 -8.816 -7.877 1.00 30.34 C ATOM 1262 CD GLU A 79 9.737 -9.365 -8.785 1.00 33.33 C ATOM 1263 OE1 GLU A 79 10.598 -8.594 -9.174 1.00 65.52 O ATOM 1264 OE2 GLU A 79 9.699 -10.550 -9.076 1.00 23.34 O ATOM 0 H GLU A 79 7.999 -4.925 -7.820 1.00 64.42 H new ATOM 0 HA GLU A 79 6.716 -7.218 -7.014 1.00 30.01 H new ATOM 0 HB2 GLU A 79 8.479 -6.890 -8.846 1.00 33.30 H new ATOM 0 HB3 GLU A 79 9.702 -6.954 -7.593 1.00 33.30 H new ATOM 0 HG2 GLU A 79 8.764 -9.207 -6.867 1.00 30.34 H new ATOM 0 HG3 GLU A 79 7.664 -9.147 -8.231 1.00 30.34 H new ATOM 1271 N GLU A 80 8.966 -6.214 -4.847 1.00 4.13 N ATOM 1272 CA GLU A 80 9.489 -6.432 -3.499 1.00 34.44 C ATOM 1273 C GLU A 80 8.488 -6.018 -2.414 1.00 22.20 C ATOM 1274 O GLU A 80 8.330 -6.715 -1.412 1.00 25.24 O ATOM 1275 CB GLU A 80 10.785 -5.639 -3.317 1.00 1.22 C ATOM 1276 CG GLU A 80 11.841 -6.150 -4.298 1.00 12.50 C ATOM 1277 CD GLU A 80 11.520 -5.674 -5.711 1.00 21.23 C ATOM 1278 OE1 GLU A 80 10.699 -4.782 -5.843 1.00 3.01 O ATOM 1279 OE2 GLU A 80 12.102 -6.209 -6.641 1.00 33.43 O ATOM 0 H GLU A 80 9.277 -5.348 -5.287 1.00 4.13 H new ATOM 0 HA GLU A 80 9.676 -7.500 -3.390 1.00 34.44 H new ATOM 0 HB2 GLU A 80 10.601 -4.578 -3.485 1.00 1.22 H new ATOM 0 HB3 GLU A 80 11.145 -5.741 -2.293 1.00 1.22 H new ATOM 0 HG2 GLU A 80 12.827 -5.793 -4.001 1.00 12.50 H new ATOM 0 HG3 GLU A 80 11.875 -7.239 -4.272 1.00 12.50 H new ATOM 1286 N ALA A 81 7.846 -4.864 -2.596 1.00 25.42 N ATOM 1287 CA ALA A 81 6.899 -4.352 -1.600 1.00 41.45 C ATOM 1288 C ALA A 81 5.481 -4.889 -1.808 1.00 51.33 C ATOM 1289 O ALA A 81 4.558 -4.482 -1.104 1.00 34.11 O ATOM 1290 CB ALA A 81 6.875 -2.819 -1.653 1.00 41.11 C ATOM 0 H ALA A 81 7.961 -4.269 -3.416 1.00 25.42 H new ATOM 0 HA ALA A 81 7.240 -4.696 -0.623 1.00 41.45 H new ATOM 0 HB1 ALA A 81 6.171 -2.440 -0.912 1.00 41.11 H new ATOM 0 HB2 ALA A 81 7.871 -2.432 -1.438 1.00 41.11 H new ATOM 0 HB3 ALA A 81 6.566 -2.494 -2.647 1.00 41.11 H new ATOM 1296 N LYS A 82 5.312 -5.802 -2.765 1.00 51.43 N ATOM 1297 CA LYS A 82 3.995 -6.391 -3.050 1.00 20.21 C ATOM 1298 C LYS A 82 2.867 -5.411 -2.735 1.00 61.12 C ATOM 1299 O LYS A 82 1.956 -5.704 -1.952 1.00 24.41 O ATOM 1300 CB LYS A 82 3.805 -7.673 -2.240 1.00 71.13 C ATOM 1301 CG LYS A 82 4.860 -8.700 -2.655 1.00 50.23 C ATOM 1302 CD LYS A 82 4.594 -10.026 -1.938 1.00 25.51 C ATOM 1303 CE LYS A 82 5.687 -11.032 -2.302 1.00 23.00 C ATOM 1304 NZ LYS A 82 5.375 -12.351 -1.681 1.00 51.05 N ATOM 0 H LYS A 82 6.066 -6.152 -3.357 1.00 51.43 H new ATOM 0 HA LYS A 82 3.958 -6.624 -4.114 1.00 20.21 H new ATOM 0 HB2 LYS A 82 3.890 -7.459 -1.175 1.00 71.13 H new ATOM 0 HB3 LYS A 82 2.806 -8.075 -2.405 1.00 71.13 H new ATOM 0 HG2 LYS A 82 4.834 -8.847 -3.735 1.00 50.23 H new ATOM 0 HG3 LYS A 82 5.856 -8.334 -2.407 1.00 50.23 H new ATOM 0 HD2 LYS A 82 4.573 -9.870 -0.859 1.00 25.51 H new ATOM 0 HD3 LYS A 82 3.617 -10.416 -2.223 1.00 25.51 H new ATOM 0 HE2 LYS A 82 5.755 -11.135 -3.385 1.00 23.00 H new ATOM 0 HE3 LYS A 82 6.656 -10.674 -1.954 1.00 23.00 H new ATOM 0 HZ1 LYS A 82 6.118 -13.036 -1.928 1.00 51.05 H new ATOM 0 HZ2 LYS A 82 5.331 -12.246 -0.647 1.00 51.05 H new ATOM 0 HZ3 LYS A 82 4.458 -12.693 -2.034 1.00 51.05 H new ATOM 1318 N LYS A 83 2.939 -4.254 -3.373 1.00 61.34 N ATOM 1319 CA LYS A 83 1.934 -3.211 -3.189 1.00 5.42 C ATOM 1320 C LYS A 83 1.897 -2.293 -4.404 1.00 43.43 C ATOM 1321 O LYS A 83 2.937 -1.857 -4.897 1.00 51.02 O ATOM 1322 CB LYS A 83 2.246 -2.384 -1.938 1.00 12.21 C ATOM 1323 CG LYS A 83 1.035 -1.501 -1.590 1.00 44.23 C ATOM 1324 CD LYS A 83 1.479 -0.316 -0.727 1.00 74.25 C ATOM 1325 CE LYS A 83 1.901 -0.814 0.655 1.00 0.32 C ATOM 1326 NZ LYS A 83 0.784 -1.586 1.266 1.00 40.13 N ATOM 0 H LYS A 83 3.684 -4.010 -4.025 1.00 61.34 H new ATOM 0 HA LYS A 83 0.962 -3.690 -3.069 1.00 5.42 H new ATOM 0 HB2 LYS A 83 2.480 -3.044 -1.102 1.00 12.21 H new ATOM 0 HB3 LYS A 83 3.125 -1.763 -2.110 1.00 12.21 H new ATOM 0 HG2 LYS A 83 0.564 -1.139 -2.504 1.00 44.23 H new ATOM 0 HG3 LYS A 83 0.287 -2.089 -1.058 1.00 44.23 H new ATOM 0 HD2 LYS A 83 2.309 0.204 -1.206 1.00 74.25 H new ATOM 0 HD3 LYS A 83 0.665 0.402 -0.632 1.00 74.25 H new ATOM 0 HE2 LYS A 83 2.788 -1.441 0.572 1.00 0.32 H new ATOM 0 HE3 LYS A 83 2.166 0.030 1.292 1.00 0.32 H new ATOM 0 HZ1 LYS A 83 0.909 -1.620 2.298 1.00 40.13 H new ATOM 0 HZ2 LYS A 83 -0.121 -1.124 1.042 1.00 40.13 H new ATOM 0 HZ3 LYS A 83 0.782 -2.554 0.886 1.00 40.13 H new ATOM 1340 N LYS A 84 0.691 -2.016 -4.891 1.00 12.51 N ATOM 1341 CA LYS A 84 0.521 -1.163 -6.065 1.00 13.44 C ATOM 1342 C LYS A 84 -0.527 -0.092 -5.822 1.00 44.44 C ATOM 1343 O LYS A 84 -1.504 -0.310 -5.105 1.00 11.55 O ATOM 1344 CB LYS A 84 0.120 -2.019 -7.275 1.00 32.15 C ATOM 1345 CG LYS A 84 -0.866 -3.105 -6.841 1.00 61.44 C ATOM 1346 CD LYS A 84 -1.266 -3.944 -8.056 1.00 25.05 C ATOM 1347 CE LYS A 84 -2.036 -5.182 -7.591 1.00 75.31 C ATOM 1348 NZ LYS A 84 -3.036 -4.786 -6.560 1.00 64.50 N ATOM 0 H LYS A 84 -0.180 -2.368 -4.494 1.00 12.51 H new ATOM 0 HA LYS A 84 1.471 -0.667 -6.265 1.00 13.44 H new ATOM 0 HB2 LYS A 84 -0.332 -1.390 -8.042 1.00 32.15 H new ATOM 0 HB3 LYS A 84 1.005 -2.475 -7.718 1.00 32.15 H new ATOM 0 HG2 LYS A 84 -0.412 -3.740 -6.080 1.00 61.44 H new ATOM 0 HG3 LYS A 84 -1.749 -2.651 -6.392 1.00 61.44 H new ATOM 0 HD2 LYS A 84 -1.882 -3.352 -8.733 1.00 25.05 H new ATOM 0 HD3 LYS A 84 -0.378 -4.243 -8.613 1.00 25.05 H new ATOM 0 HE2 LYS A 84 -2.537 -5.651 -8.438 1.00 75.31 H new ATOM 0 HE3 LYS A 84 -1.346 -5.919 -7.180 1.00 75.31 H new ATOM 0 HZ1 LYS A 84 -3.751 -5.535 -6.465 1.00 64.50 H new ATOM 0 HZ2 LYS A 84 -2.557 -4.646 -5.647 1.00 64.50 H new ATOM 0 HZ3 LYS A 84 -3.499 -3.900 -6.847 1.00 64.50 H new ATOM 1362 N VAL A 85 -0.329 1.065 -6.458 1.00 1.33 N ATOM 1363 CA VAL A 85 -1.278 2.162 -6.338 1.00 51.31 C ATOM 1364 C VAL A 85 -1.591 2.729 -7.717 1.00 52.24 C ATOM 1365 O VAL A 85 -0.699 2.943 -8.539 1.00 71.10 O ATOM 1366 CB VAL A 85 -0.777 3.248 -5.347 1.00 52.31 C ATOM 1367 CG1 VAL A 85 -0.037 2.575 -4.184 1.00 41.50 C ATOM 1368 CG2 VAL A 85 0.149 4.326 -6.004 1.00 71.05 C ATOM 0 H VAL A 85 0.474 1.261 -7.055 1.00 1.33 H new ATOM 0 HA VAL A 85 -2.207 1.778 -5.916 1.00 51.31 H new ATOM 0 HB VAL A 85 -1.662 3.777 -4.994 1.00 52.31 H new ATOM 0 HG11 VAL A 85 0.315 3.336 -3.488 1.00 41.50 H new ATOM 0 HG12 VAL A 85 -0.714 1.895 -3.667 1.00 41.50 H new ATOM 0 HG13 VAL A 85 0.814 2.015 -4.570 1.00 41.50 H new ATOM 0 HG21 VAL A 85 0.458 5.049 -5.249 1.00 71.05 H new ATOM 0 HG22 VAL A 85 1.030 3.841 -6.424 1.00 71.05 H new ATOM 0 HG23 VAL A 85 -0.396 4.839 -6.797 1.00 71.05 H new ATOM 1378 N GLU A 86 -2.883 2.905 -7.984 1.00 5.11 N ATOM 1379 CA GLU A 86 -3.332 3.383 -9.288 1.00 3.32 C ATOM 1380 C GLU A 86 -4.107 4.681 -9.164 1.00 11.42 C ATOM 1381 O GLU A 86 -5.038 4.798 -8.367 1.00 54.22 O ATOM 1382 CB GLU A 86 -4.235 2.319 -9.936 1.00 11.43 C ATOM 1383 CG GLU A 86 -5.035 2.932 -11.095 1.00 22.21 C ATOM 1384 CD GLU A 86 -5.506 1.838 -12.048 1.00 63.34 C ATOM 1385 OE1 GLU A 86 -5.549 0.693 -11.628 1.00 62.21 O ATOM 1386 OE2 GLU A 86 -5.815 2.160 -13.182 1.00 63.21 O ATOM 0 H GLU A 86 -3.634 2.725 -7.318 1.00 5.11 H new ATOM 0 HA GLU A 86 -2.452 3.565 -9.905 1.00 3.32 H new ATOM 0 HB2 GLU A 86 -3.628 1.491 -10.302 1.00 11.43 H new ATOM 0 HB3 GLU A 86 -4.917 1.909 -9.191 1.00 11.43 H new ATOM 0 HG2 GLU A 86 -5.894 3.478 -10.705 1.00 22.21 H new ATOM 0 HG3 GLU A 86 -4.417 3.651 -11.633 1.00 22.21 H new ATOM 1393 N VAL A 87 -3.719 5.645 -9.982 1.00 0.33 N ATOM 1394 CA VAL A 87 -4.389 6.939 -9.986 1.00 31.11 C ATOM 1395 C VAL A 87 -5.889 6.747 -10.226 1.00 2.45 C ATOM 1396 O VAL A 87 -6.328 6.518 -11.352 1.00 14.23 O ATOM 1397 CB VAL A 87 -3.791 7.846 -11.073 1.00 63.04 C ATOM 1398 CG1 VAL A 87 -3.757 7.114 -12.423 1.00 51.21 C ATOM 1399 CG2 VAL A 87 -4.639 9.117 -11.202 1.00 34.51 C ATOM 0 H VAL A 87 -2.951 5.560 -10.647 1.00 0.33 H new ATOM 0 HA VAL A 87 -4.242 7.415 -9.017 1.00 31.11 H new ATOM 0 HB VAL A 87 -2.772 8.109 -10.790 1.00 63.04 H new ATOM 0 HG11 VAL A 87 -3.331 7.770 -13.182 1.00 51.21 H new ATOM 0 HG12 VAL A 87 -3.146 6.216 -12.335 1.00 51.21 H new ATOM 0 HG13 VAL A 87 -4.771 6.836 -12.712 1.00 51.21 H new ATOM 0 HG21 VAL A 87 -4.215 9.761 -11.973 1.00 34.51 H new ATOM 0 HG22 VAL A 87 -5.659 8.848 -11.475 1.00 34.51 H new ATOM 0 HG23 VAL A 87 -4.646 9.648 -10.250 1.00 34.51 H new ATOM 1409 N LEU A 88 -6.668 6.826 -9.147 1.00 41.20 N ATOM 1410 CA LEU A 88 -8.119 6.644 -9.230 1.00 43.03 C ATOM 1411 C LEU A 88 -8.825 7.993 -9.389 1.00 34.50 C ATOM 1412 O LEU A 88 -9.958 8.064 -9.863 1.00 31.10 O ATOM 1413 CB LEU A 88 -8.609 5.933 -7.952 1.00 35.44 C ATOM 1414 CG LEU A 88 -9.771 4.970 -8.256 1.00 11.52 C ATOM 1415 CD1 LEU A 88 -10.912 5.731 -8.935 1.00 53.12 C ATOM 1416 CD2 LEU A 88 -9.293 3.820 -9.166 1.00 21.43 C ATOM 0 H LEU A 88 -6.320 7.014 -8.207 1.00 41.20 H new ATOM 0 HA LEU A 88 -8.356 6.036 -10.103 1.00 43.03 H new ATOM 0 HB2 LEU A 88 -7.784 5.380 -7.502 1.00 35.44 H new ATOM 0 HB3 LEU A 88 -8.931 6.675 -7.222 1.00 35.44 H new ATOM 0 HG LEU A 88 -10.129 4.547 -7.318 1.00 11.52 H new ATOM 0 HD11 LEU A 88 -11.731 5.044 -9.148 1.00 53.12 H new ATOM 0 HD12 LEU A 88 -11.265 6.523 -8.275 1.00 53.12 H new ATOM 0 HD13 LEU A 88 -10.554 6.168 -9.867 1.00 53.12 H new ATOM 0 HD21 LEU A 88 -10.126 3.148 -9.371 1.00 21.43 H new ATOM 0 HD22 LEU A 88 -8.918 4.230 -10.104 1.00 21.43 H new ATOM 0 HD23 LEU A 88 -8.497 3.268 -8.667 1.00 21.43 H new ATOM 1428 N ASP A 89 -8.136 9.064 -9.021 1.00 52.04 N ATOM 1429 CA ASP A 89 -8.675 10.413 -9.140 1.00 22.30 C ATOM 1430 C ASP A 89 -7.631 11.390 -8.607 1.00 51.35 C ATOM 1431 O ASP A 89 -7.165 11.252 -7.477 1.00 43.23 O ATOM 1432 CB ASP A 89 -9.982 10.564 -8.342 1.00 5.43 C ATOM 1433 CG ASP A 89 -10.981 11.429 -9.110 1.00 21.30 C ATOM 1434 OD1 ASP A 89 -11.741 10.874 -9.886 1.00 2.35 O ATOM 1435 OD2 ASP A 89 -10.969 12.632 -8.911 1.00 41.13 O ATOM 0 H ASP A 89 -7.193 9.024 -8.634 1.00 52.04 H new ATOM 0 HA ASP A 89 -8.900 10.619 -10.186 1.00 22.30 H new ATOM 0 HB2 ASP A 89 -10.414 9.582 -8.151 1.00 5.43 H new ATOM 0 HB3 ASP A 89 -9.773 11.014 -7.372 1.00 5.43 H new ATOM 1440 N THR A 90 -7.244 12.355 -9.424 1.00 4.01 N ATOM 1441 CA THR A 90 -6.230 13.317 -9.012 1.00 50.20 C ATOM 1442 C THR A 90 -6.436 14.642 -9.755 1.00 53.34 C ATOM 1443 O THR A 90 -6.591 14.665 -10.976 1.00 62.12 O ATOM 1444 CB THR A 90 -4.836 12.694 -9.285 1.00 11.42 C ATOM 1445 OG1 THR A 90 -3.963 12.859 -8.167 1.00 65.02 O ATOM 1446 CG2 THR A 90 -4.183 13.319 -10.520 1.00 13.20 C ATOM 0 H THR A 90 -7.610 12.495 -10.366 1.00 4.01 H new ATOM 0 HA THR A 90 -6.307 13.540 -7.948 1.00 50.20 H new ATOM 0 HB THR A 90 -4.996 11.630 -9.460 1.00 11.42 H new ATOM 0 HG1 THR A 90 -3.193 13.405 -8.431 1.00 65.02 H new ATOM 0 HG21 THR A 90 -3.207 12.862 -10.686 1.00 13.20 H new ATOM 0 HG22 THR A 90 -4.816 13.150 -11.391 1.00 13.20 H new ATOM 0 HG23 THR A 90 -4.060 14.391 -10.364 1.00 13.20 H new ATOM 1454 N ASP A 91 -6.429 15.744 -9.009 1.00 20.02 N ATOM 1455 CA ASP A 91 -6.605 17.067 -9.616 1.00 42.32 C ATOM 1456 C ASP A 91 -5.619 18.048 -9.005 1.00 61.40 C ATOM 1457 O ASP A 91 -5.342 19.112 -9.558 1.00 3.42 O ATOM 1458 CB ASP A 91 -8.034 17.564 -9.384 1.00 65.05 C ATOM 1459 CG ASP A 91 -8.261 18.868 -10.141 1.00 11.04 C ATOM 1460 OD1 ASP A 91 -7.344 19.306 -10.816 1.00 64.23 O ATOM 1461 OD2 ASP A 91 -9.348 19.411 -10.033 1.00 44.42 O ATOM 0 H ASP A 91 -6.305 15.752 -7.997 1.00 20.02 H new ATOM 0 HA ASP A 91 -6.423 16.992 -10.688 1.00 42.32 H new ATOM 0 HB2 ASP A 91 -8.748 16.811 -9.717 1.00 65.05 H new ATOM 0 HB3 ASP A 91 -8.206 17.717 -8.319 1.00 65.05 H new ATOM 1466 N TYR A 92 -5.118 17.671 -7.846 1.00 72.23 N ATOM 1467 CA TYR A 92 -4.177 18.486 -7.097 1.00 13.20 C ATOM 1468 C TYR A 92 -4.718 19.901 -6.904 1.00 10.24 C ATOM 1469 O TYR A 92 -4.038 20.761 -6.345 1.00 24.32 O ATOM 1470 CB TYR A 92 -2.843 18.569 -7.843 1.00 41.21 C ATOM 1471 CG TYR A 92 -2.428 17.205 -8.356 1.00 42.22 C ATOM 1472 CD1 TYR A 92 -2.489 16.077 -7.522 1.00 52.12 C ATOM 1473 CD2 TYR A 92 -1.965 17.073 -9.672 1.00 15.23 C ATOM 1474 CE1 TYR A 92 -2.088 14.827 -8.004 1.00 45.31 C ATOM 1475 CE2 TYR A 92 -1.564 15.821 -10.152 1.00 44.32 C ATOM 1476 CZ TYR A 92 -1.625 14.700 -9.319 1.00 34.02 C ATOM 1477 OH TYR A 92 -1.227 13.470 -9.795 1.00 33.51 O ATOM 0 H TYR A 92 -5.352 16.787 -7.393 1.00 72.23 H new ATOM 0 HA TYR A 92 -4.032 18.019 -6.123 1.00 13.20 H new ATOM 0 HB2 TYR A 92 -2.930 19.265 -8.677 1.00 41.21 H new ATOM 0 HB3 TYR A 92 -2.073 18.962 -7.179 1.00 41.21 H new ATOM 0 HD1 TYR A 92 -2.846 16.175 -6.507 1.00 52.12 H new ATOM 0 HD2 TYR A 92 -1.918 17.938 -10.317 1.00 15.23 H new ATOM 0 HE1 TYR A 92 -2.135 13.960 -7.362 1.00 45.31 H new ATOM 0 HE2 TYR A 92 -1.207 15.721 -11.166 1.00 44.32 H new ATOM 0 HH TYR A 92 -1.164 13.502 -10.772 1.00 33.51 H new ATOM 1487 N LYS A 93 -5.940 20.141 -7.371 1.00 22.31 N ATOM 1488 CA LYS A 93 -6.545 21.459 -7.242 1.00 51.55 C ATOM 1489 C LYS A 93 -7.036 21.658 -5.821 1.00 42.14 C ATOM 1490 O LYS A 93 -6.948 22.751 -5.262 1.00 13.41 O ATOM 1491 CB LYS A 93 -7.717 21.598 -8.216 1.00 71.21 C ATOM 1492 CG LYS A 93 -8.214 23.046 -8.213 1.00 64.03 C ATOM 1493 CD LYS A 93 -9.300 23.221 -9.280 1.00 73.04 C ATOM 1494 CE LYS A 93 -10.535 22.391 -8.913 1.00 51.21 C ATOM 1495 NZ LYS A 93 -11.731 22.954 -9.601 1.00 51.31 N ATOM 0 H LYS A 93 -6.524 19.447 -7.837 1.00 22.31 H new ATOM 0 HA LYS A 93 -5.797 22.217 -7.477 1.00 51.55 H new ATOM 0 HB2 LYS A 93 -7.405 21.311 -9.220 1.00 71.21 H new ATOM 0 HB3 LYS A 93 -8.524 20.925 -7.929 1.00 71.21 H new ATOM 0 HG2 LYS A 93 -8.611 23.302 -7.231 1.00 64.03 H new ATOM 0 HG3 LYS A 93 -7.385 23.726 -8.409 1.00 64.03 H new ATOM 0 HD2 LYS A 93 -9.571 24.273 -9.365 1.00 73.04 H new ATOM 0 HD3 LYS A 93 -8.919 22.910 -10.253 1.00 73.04 H new ATOM 0 HE2 LYS A 93 -10.389 21.351 -9.206 1.00 51.21 H new ATOM 0 HE3 LYS A 93 -10.685 22.399 -7.833 1.00 51.21 H new ATOM 0 HZ1 LYS A 93 -12.570 22.392 -9.353 1.00 51.31 H new ATOM 0 HZ2 LYS A 93 -11.873 23.939 -9.300 1.00 51.31 H new ATOM 0 HZ3 LYS A 93 -11.586 22.924 -10.630 1.00 51.31 H new ATOM 1509 N SER A 94 -7.547 20.582 -5.243 1.00 73.00 N ATOM 1510 CA SER A 94 -8.050 20.619 -3.883 1.00 23.01 C ATOM 1511 C SER A 94 -7.987 19.231 -3.263 1.00 63.33 C ATOM 1512 O SER A 94 -7.986 19.091 -2.040 1.00 12.21 O ATOM 1513 CB SER A 94 -9.494 21.122 -3.872 1.00 22.22 C ATOM 1514 OG SER A 94 -10.252 20.395 -4.829 1.00 61.41 O ATOM 0 H SER A 94 -7.623 19.672 -5.697 1.00 73.00 H new ATOM 0 HA SER A 94 -7.429 21.299 -3.299 1.00 23.01 H new ATOM 0 HB2 SER A 94 -9.926 20.999 -2.879 1.00 22.22 H new ATOM 0 HB3 SER A 94 -9.522 22.187 -4.102 1.00 22.22 H new ATOM 0 HG SER A 94 -10.946 19.877 -4.371 1.00 61.41 H new ATOM 1520 N TYR A 95 -7.946 18.199 -4.107 1.00 21.41 N ATOM 1521 CA TYR A 95 -7.900 16.839 -3.599 1.00 74.45 C ATOM 1522 C TYR A 95 -7.606 15.814 -4.695 1.00 73.30 C ATOM 1523 O TYR A 95 -7.649 16.103 -5.901 1.00 21.12 O ATOM 1524 CB TYR A 95 -9.235 16.500 -2.943 1.00 12.22 C ATOM 1525 CG TYR A 95 -10.351 16.737 -3.931 1.00 4.10 C ATOM 1526 CD1 TYR A 95 -10.704 15.735 -4.843 1.00 4.13 C ATOM 1527 CD2 TYR A 95 -11.032 17.961 -3.938 1.00 42.22 C ATOM 1528 CE1 TYR A 95 -11.738 15.957 -5.760 1.00 30.41 C ATOM 1529 CE2 TYR A 95 -12.065 18.182 -4.856 1.00 41.31 C ATOM 1530 CZ TYR A 95 -12.418 17.180 -5.767 1.00 32.24 C ATOM 1531 OH TYR A 95 -13.437 17.398 -6.672 1.00 14.31 O ATOM 0 H TYR A 95 -7.944 18.281 -5.124 1.00 21.41 H new ATOM 0 HA TYR A 95 -7.087 16.789 -2.875 1.00 74.45 H new ATOM 0 HB2 TYR A 95 -9.239 15.460 -2.615 1.00 12.22 H new ATOM 0 HB3 TYR A 95 -9.383 17.115 -2.055 1.00 12.22 H new ATOM 0 HD1 TYR A 95 -10.179 14.791 -4.839 1.00 4.13 H new ATOM 0 HD2 TYR A 95 -10.760 18.734 -3.235 1.00 42.22 H new ATOM 0 HE1 TYR A 95 -12.011 15.184 -6.463 1.00 30.41 H new ATOM 0 HE2 TYR A 95 -12.590 19.126 -4.861 1.00 41.31 H new ATOM 0 HH TYR A 95 -13.804 18.297 -6.541 1.00 14.31 H new ATOM 1541 N ALA A 96 -7.313 14.602 -4.242 1.00 52.13 N ATOM 1542 CA ALA A 96 -7.030 13.492 -5.137 1.00 33.31 C ATOM 1543 C ALA A 96 -7.465 12.197 -4.464 1.00 51.34 C ATOM 1544 O ALA A 96 -7.266 12.019 -3.263 1.00 74.13 O ATOM 1545 CB ALA A 96 -5.539 13.435 -5.478 1.00 55.32 C ATOM 0 H ALA A 96 -7.265 14.364 -3.251 1.00 52.13 H new ATOM 0 HA ALA A 96 -7.580 13.630 -6.068 1.00 33.31 H new ATOM 0 HB1 ALA A 96 -5.351 12.597 -6.149 1.00 55.32 H new ATOM 0 HB2 ALA A 96 -5.241 14.363 -5.965 1.00 55.32 H new ATOM 0 HB3 ALA A 96 -4.961 13.304 -4.563 1.00 55.32 H new ATOM 1551 N VAL A 97 -8.057 11.294 -5.241 1.00 72.44 N ATOM 1552 CA VAL A 97 -8.516 10.009 -4.695 1.00 13.52 C ATOM 1553 C VAL A 97 -7.795 8.894 -5.419 1.00 72.53 C ATOM 1554 O VAL A 97 -7.728 8.892 -6.647 1.00 70.24 O ATOM 1555 CB VAL A 97 -10.036 9.853 -4.852 1.00 62.23 C ATOM 1556 CG1 VAL A 97 -10.556 8.836 -3.831 1.00 23.52 C ATOM 1557 CG2 VAL A 97 -10.717 11.204 -4.611 1.00 63.21 C ATOM 0 H VAL A 97 -8.231 11.420 -6.238 1.00 72.44 H new ATOM 0 HA VAL A 97 -8.292 9.969 -3.629 1.00 13.52 H new ATOM 0 HB VAL A 97 -10.260 9.505 -5.860 1.00 62.23 H new ATOM 0 HG11 VAL A 97 -11.635 8.726 -3.944 1.00 23.52 H new ATOM 0 HG12 VAL A 97 -10.074 7.873 -3.999 1.00 23.52 H new ATOM 0 HG13 VAL A 97 -10.330 9.184 -2.823 1.00 23.52 H new ATOM 0 HG21 VAL A 97 -11.796 11.093 -4.723 1.00 63.21 H new ATOM 0 HG22 VAL A 97 -10.490 11.551 -3.603 1.00 63.21 H new ATOM 0 HG23 VAL A 97 -10.350 11.931 -5.336 1.00 63.21 H new ATOM 1567 N ILE A 98 -7.196 7.979 -4.666 1.00 33.53 N ATOM 1568 CA ILE A 98 -6.415 6.911 -5.262 1.00 24.44 C ATOM 1569 C ILE A 98 -6.811 5.537 -4.730 1.00 43.24 C ATOM 1570 O ILE A 98 -7.210 5.393 -3.574 1.00 11.30 O ATOM 1571 CB ILE A 98 -4.967 7.190 -4.904 1.00 61.12 C ATOM 1572 CG1 ILE A 98 -4.048 6.123 -5.479 1.00 24.14 C ATOM 1573 CG2 ILE A 98 -4.817 7.198 -3.382 1.00 14.43 C ATOM 1574 CD1 ILE A 98 -2.597 6.538 -5.226 1.00 65.13 C ATOM 0 H ILE A 98 -7.238 7.958 -3.647 1.00 33.53 H new ATOM 0 HA ILE A 98 -6.584 6.890 -6.339 1.00 24.44 H new ATOM 0 HB ILE A 98 -4.690 8.157 -5.323 1.00 61.12 H new ATOM 0 HG12 ILE A 98 -4.252 5.158 -5.014 1.00 24.14 H new ATOM 0 HG13 ILE A 98 -4.227 6.006 -6.548 1.00 24.14 H new ATOM 0 HG21 ILE A 98 -3.778 7.398 -3.120 1.00 14.43 H new ATOM 0 HG22 ILE A 98 -5.454 7.974 -2.958 1.00 14.43 H new ATOM 0 HG23 ILE A 98 -5.112 6.228 -2.982 1.00 14.43 H new ATOM 0 HD11 ILE A 98 -1.926 5.782 -5.633 1.00 65.13 H new ATOM 0 HD12 ILE A 98 -2.402 7.495 -5.711 1.00 65.13 H new ATOM 0 HD13 ILE A 98 -2.428 6.634 -4.153 1.00 65.13 H new ATOM 1586 N TYR A 99 -6.681 4.531 -5.588 1.00 42.22 N ATOM 1587 CA TYR A 99 -7.008 3.160 -5.210 1.00 30.30 C ATOM 1588 C TYR A 99 -5.740 2.428 -4.781 1.00 44.43 C ATOM 1589 O TYR A 99 -4.901 2.075 -5.610 1.00 15.43 O ATOM 1590 CB TYR A 99 -7.644 2.433 -6.397 1.00 65.05 C ATOM 1591 CG TYR A 99 -8.044 1.035 -5.986 1.00 52.20 C ATOM 1592 CD1 TYR A 99 -9.238 0.826 -5.286 1.00 52.24 C ATOM 1593 CD2 TYR A 99 -7.222 -0.052 -6.307 1.00 20.23 C ATOM 1594 CE1 TYR A 99 -9.611 -0.470 -4.908 1.00 13.24 C ATOM 1595 CE2 TYR A 99 -7.594 -1.347 -5.929 1.00 53.13 C ATOM 1596 CZ TYR A 99 -8.788 -1.556 -5.230 1.00 44.45 C ATOM 1597 OH TYR A 99 -9.155 -2.834 -4.858 1.00 54.12 O ATOM 0 H TYR A 99 -6.352 4.638 -6.548 1.00 42.22 H new ATOM 0 HA TYR A 99 -7.713 3.177 -4.379 1.00 30.30 H new ATOM 0 HB2 TYR A 99 -8.518 2.983 -6.747 1.00 65.05 H new ATOM 0 HB3 TYR A 99 -6.940 2.390 -7.228 1.00 65.05 H new ATOM 0 HD1 TYR A 99 -9.872 1.664 -5.037 1.00 52.24 H new ATOM 0 HD2 TYR A 99 -6.300 0.109 -6.847 1.00 20.23 H new ATOM 0 HE1 TYR A 99 -10.533 -0.632 -4.369 1.00 13.24 H new ATOM 0 HE2 TYR A 99 -6.960 -2.185 -6.177 1.00 53.13 H new ATOM 0 HH TYR A 99 -8.474 -3.471 -5.160 1.00 54.12 H new ATOM 1607 N ALA A 100 -5.606 2.217 -3.474 1.00 14.23 N ATOM 1608 CA ALA A 100 -4.435 1.537 -2.921 1.00 62.31 C ATOM 1609 C ALA A 100 -4.790 0.122 -2.484 1.00 51.33 C ATOM 1610 O ALA A 100 -5.815 -0.101 -1.839 1.00 2.34 O ATOM 1611 CB ALA A 100 -3.898 2.324 -1.723 1.00 51.00 C ATOM 0 H ALA A 100 -6.293 2.506 -2.778 1.00 14.23 H new ATOM 0 HA ALA A 100 -3.670 1.481 -3.696 1.00 62.31 H new ATOM 0 HB1 ALA A 100 -3.026 1.814 -1.314 1.00 51.00 H new ATOM 0 HB2 ALA A 100 -3.615 3.327 -2.044 1.00 51.00 H new ATOM 0 HB3 ALA A 100 -4.670 2.393 -0.957 1.00 51.00 H new ATOM 1617 N THR A 101 -3.935 -0.833 -2.839 1.00 10.21 N ATOM 1618 CA THR A 101 -4.167 -2.229 -2.477 1.00 62.12 C ATOM 1619 C THR A 101 -2.854 -2.946 -2.179 1.00 40.43 C ATOM 1620 O THR A 101 -1.883 -2.830 -2.925 1.00 73.41 O ATOM 1621 CB THR A 101 -4.893 -2.949 -3.619 1.00 65.14 C ATOM 1622 OG1 THR A 101 -4.586 -4.336 -3.573 1.00 33.41 O ATOM 1623 CG2 THR A 101 -4.438 -2.368 -4.958 1.00 51.42 C ATOM 0 H THR A 101 -3.082 -0.669 -3.373 1.00 10.21 H new ATOM 0 HA THR A 101 -4.783 -2.247 -1.578 1.00 62.12 H new ATOM 0 HB THR A 101 -5.969 -2.812 -3.512 1.00 65.14 H new ATOM 0 HG1 THR A 101 -4.965 -4.728 -2.759 1.00 33.41 H new ATOM 0 HG21 THR A 101 -4.954 -2.879 -5.771 1.00 51.42 H new ATOM 0 HG22 THR A 101 -4.673 -1.304 -4.992 1.00 51.42 H new ATOM 0 HG23 THR A 101 -3.362 -2.506 -5.068 1.00 51.42 H new ATOM 1631 N ARG A 102 -2.850 -3.702 -1.087 1.00 74.42 N ATOM 1632 CA ARG A 102 -1.672 -4.468 -0.677 1.00 0.04 C ATOM 1633 C ARG A 102 -2.034 -5.944 -0.640 1.00 11.11 C ATOM 1634 O ARG A 102 -3.046 -6.310 -0.045 1.00 62.44 O ATOM 1635 CB ARG A 102 -1.214 -4.021 0.713 1.00 52.14 C ATOM 1636 CG ARG A 102 0.136 -4.668 1.043 1.00 21.50 C ATOM 1637 CD ARG A 102 0.430 -4.501 2.535 1.00 61.15 C ATOM 1638 NE ARG A 102 1.683 -5.165 2.879 1.00 50.41 N ATOM 1639 CZ ARG A 102 2.855 -4.564 2.694 1.00 63.32 C ATOM 1640 NH1 ARG A 102 2.899 -3.357 2.200 1.00 34.10 N ATOM 1641 NH2 ARG A 102 3.961 -5.181 3.007 1.00 0.53 N ATOM 0 H ARG A 102 -3.652 -3.803 -0.465 1.00 74.42 H new ATOM 0 HA ARG A 102 -0.863 -4.299 -1.387 1.00 0.04 H new ATOM 0 HB2 ARG A 102 -1.126 -2.935 0.746 1.00 52.14 H new ATOM 0 HB3 ARG A 102 -1.956 -4.303 1.460 1.00 52.14 H new ATOM 0 HG2 ARG A 102 0.118 -5.726 0.781 1.00 21.50 H new ATOM 0 HG3 ARG A 102 0.927 -4.207 0.452 1.00 21.50 H new ATOM 0 HD2 ARG A 102 0.491 -3.442 2.785 1.00 61.15 H new ATOM 0 HD3 ARG A 102 -0.386 -4.921 3.123 1.00 61.15 H new ATOM 0 HE ARG A 102 1.660 -6.107 3.269 1.00 50.41 H new ATOM 0 HH11 ARG A 102 2.034 -2.874 1.956 1.00 34.10 H new ATOM 0 HH12 ARG A 102 3.798 -2.896 2.058 1.00 34.10 H new ATOM 0 HH21 ARG A 102 3.927 -6.124 3.394 1.00 0.53 H new ATOM 0 HH22 ARG A 102 4.860 -4.720 2.865 1.00 0.53 H new ATOM 1655 N VAL A 103 -1.240 -6.805 -1.285 1.00 33.24 N ATOM 1656 CA VAL A 103 -1.556 -8.234 -1.300 1.00 34.25 C ATOM 1657 C VAL A 103 -0.439 -9.045 -0.656 1.00 1.42 C ATOM 1658 O VAL A 103 0.693 -9.061 -1.138 1.00 43.00 O ATOM 1659 CB VAL A 103 -1.763 -8.694 -2.749 1.00 11.35 C ATOM 1660 CG1 VAL A 103 -0.492 -8.436 -3.567 1.00 12.02 C ATOM 1661 CG2 VAL A 103 -2.094 -10.190 -2.777 1.00 20.31 C ATOM 0 H VAL A 103 -0.394 -6.545 -1.792 1.00 33.24 H new ATOM 0 HA VAL A 103 -2.469 -8.396 -0.727 1.00 34.25 H new ATOM 0 HB VAL A 103 -2.590 -8.132 -3.183 1.00 11.35 H new ATOM 0 HG11 VAL A 103 -0.647 -8.765 -4.594 1.00 12.02 H new ATOM 0 HG12 VAL A 103 -0.264 -7.370 -3.558 1.00 12.02 H new ATOM 0 HG13 VAL A 103 0.340 -8.989 -3.131 1.00 12.02 H new ATOM 0 HG21 VAL A 103 -2.240 -10.511 -3.808 1.00 20.31 H new ATOM 0 HG22 VAL A 103 -1.272 -10.753 -2.335 1.00 20.31 H new ATOM 0 HG23 VAL A 103 -3.006 -10.372 -2.208 1.00 20.31 H new ATOM 1671 N LYS A 104 -0.773 -9.725 0.437 1.00 63.44 N ATOM 1672 CA LYS A 104 0.188 -10.552 1.153 1.00 12.14 C ATOM 1673 C LYS A 104 -0.026 -12.007 0.760 1.00 23.50 C ATOM 1674 O LYS A 104 -1.010 -12.335 0.097 1.00 0.51 O ATOM 1675 CB LYS A 104 0.004 -10.376 2.667 1.00 34.44 C ATOM 1676 CG LYS A 104 1.303 -10.730 3.399 1.00 31.22 C ATOM 1677 CD LYS A 104 1.128 -10.479 4.899 1.00 15.11 C ATOM 1678 CE LYS A 104 2.483 -10.598 5.598 1.00 64.23 C ATOM 1679 NZ LYS A 104 3.306 -9.393 5.296 1.00 24.35 N ATOM 0 H LYS A 104 -1.707 -9.718 0.846 1.00 63.44 H new ATOM 0 HA LYS A 104 1.203 -10.251 0.893 1.00 12.14 H new ATOM 0 HB2 LYS A 104 -0.280 -9.347 2.890 1.00 34.44 H new ATOM 0 HB3 LYS A 104 -0.807 -11.014 3.019 1.00 34.44 H new ATOM 0 HG2 LYS A 104 1.560 -11.774 3.222 1.00 31.22 H new ATOM 0 HG3 LYS A 104 2.126 -10.129 3.012 1.00 31.22 H new ATOM 0 HD2 LYS A 104 0.707 -9.488 5.066 1.00 15.11 H new ATOM 0 HD3 LYS A 104 0.426 -11.199 5.319 1.00 15.11 H new ATOM 0 HE2 LYS A 104 2.342 -10.694 6.674 1.00 64.23 H new ATOM 0 HE3 LYS A 104 2.999 -11.497 5.263 1.00 64.23 H new ATOM 0 HZ1 LYS A 104 4.078 -9.317 5.989 1.00 24.35 H new ATOM 0 HZ2 LYS A 104 3.706 -9.477 4.340 1.00 24.35 H new ATOM 0 HZ3 LYS A 104 2.709 -8.543 5.349 1.00 24.35 H new ATOM 1693 N ASP A 105 0.891 -12.874 1.151 1.00 70.32 N ATOM 1694 CA ASP A 105 0.766 -14.280 0.803 1.00 14.22 C ATOM 1695 C ASP A 105 -0.561 -14.844 1.307 1.00 14.23 C ATOM 1696 O ASP A 105 -0.761 -15.025 2.507 1.00 31.32 O ATOM 1697 CB ASP A 105 1.925 -15.075 1.407 1.00 60.24 C ATOM 1698 CG ASP A 105 1.912 -14.947 2.927 1.00 75.41 C ATOM 1699 OD1 ASP A 105 1.202 -14.088 3.424 1.00 4.44 O ATOM 1700 OD2 ASP A 105 2.614 -15.709 3.572 1.00 33.33 O ATOM 0 H ASP A 105 1.717 -12.637 1.700 1.00 70.32 H new ATOM 0 HA ASP A 105 0.794 -14.368 -0.283 1.00 14.22 H new ATOM 0 HB2 ASP A 105 1.844 -16.124 1.122 1.00 60.24 H new ATOM 0 HB3 ASP A 105 2.872 -14.709 1.011 1.00 60.24 H new ATOM 1705 N GLY A 106 -1.449 -15.148 0.363 1.00 13.15 N ATOM 1706 CA GLY A 106 -2.749 -15.730 0.688 1.00 73.44 C ATOM 1707 C GLY A 106 -3.795 -14.680 1.064 1.00 33.33 C ATOM 1708 O GLY A 106 -4.950 -15.026 1.312 1.00 50.05 O ATOM 0 H GLY A 106 -1.292 -15.001 -0.634 1.00 13.15 H new ATOM 0 HA2 GLY A 106 -3.108 -16.303 -0.167 1.00 73.44 H new ATOM 0 HA3 GLY A 106 -2.631 -16.430 1.515 1.00 73.44 H new ATOM 1712 N ARG A 107 -3.402 -13.408 1.126 1.00 61.34 N ATOM 1713 CA ARG A 107 -4.349 -12.348 1.497 1.00 32.10 C ATOM 1714 C ARG A 107 -4.283 -11.159 0.541 1.00 31.24 C ATOM 1715 O ARG A 107 -3.203 -10.727 0.138 1.00 53.22 O ATOM 1716 CB ARG A 107 -4.050 -11.867 2.919 1.00 43.32 C ATOM 1717 CG ARG A 107 -4.052 -13.062 3.874 1.00 74.41 C ATOM 1718 CD ARG A 107 -3.812 -12.573 5.303 1.00 21.00 C ATOM 1719 NE ARG A 107 -3.502 -13.699 6.177 1.00 72.23 N ATOM 1720 CZ ARG A 107 -4.428 -14.599 6.493 1.00 10.22 C ATOM 1721 NH1 ARG A 107 -5.639 -14.482 6.021 1.00 3.11 N ATOM 1722 NH2 ARG A 107 -4.126 -15.598 7.277 1.00 13.14 N ATOM 0 H ARG A 107 -2.454 -13.087 0.929 1.00 61.34 H new ATOM 0 HA ARG A 107 -5.352 -12.770 1.440 1.00 32.10 H new ATOM 0 HB2 ARG A 107 -3.082 -11.366 2.949 1.00 43.32 H new ATOM 0 HB3 ARG A 107 -4.797 -11.137 3.232 1.00 43.32 H new ATOM 0 HG2 ARG A 107 -5.005 -13.588 3.813 1.00 74.41 H new ATOM 0 HG3 ARG A 107 -3.277 -13.772 3.586 1.00 74.41 H new ATOM 0 HD2 ARG A 107 -2.991 -11.856 5.316 1.00 21.00 H new ATOM 0 HD3 ARG A 107 -4.696 -12.052 5.670 1.00 21.00 H new ATOM 0 HE ARG A 107 -2.559 -13.798 6.552 1.00 72.23 H new ATOM 0 HH11 ARG A 107 -5.875 -13.700 5.410 1.00 3.11 H new ATOM 0 HH12 ARG A 107 -6.350 -15.172 6.263 1.00 3.11 H new ATOM 0 HH21 ARG A 107 -3.180 -15.688 7.647 1.00 13.14 H new ATOM 0 HH22 ARG A 107 -4.836 -16.289 7.520 1.00 13.14 H new ATOM 1736 N THR A 108 -5.460 -10.626 0.204 1.00 44.21 N ATOM 1737 CA THR A 108 -5.569 -9.468 -0.687 1.00 51.51 C ATOM 1738 C THR A 108 -6.233 -8.316 0.060 1.00 31.44 C ATOM 1739 O THR A 108 -7.023 -8.544 0.976 1.00 64.10 O ATOM 1740 CB THR A 108 -6.405 -9.832 -1.917 1.00 3.05 C ATOM 1741 OG1 THR A 108 -5.847 -10.977 -2.545 1.00 63.31 O ATOM 1742 CG2 THR A 108 -6.407 -8.659 -2.899 1.00 74.04 C ATOM 0 H THR A 108 -6.356 -10.981 0.537 1.00 44.21 H new ATOM 0 HA THR A 108 -4.572 -9.168 -1.011 1.00 51.51 H new ATOM 0 HB THR A 108 -7.428 -10.048 -1.611 1.00 3.05 H new ATOM 0 HG1 THR A 108 -6.382 -11.212 -3.332 1.00 63.31 H new ATOM 0 HG21 THR A 108 -7.002 -8.918 -3.775 1.00 74.04 H new ATOM 0 HG22 THR A 108 -6.836 -7.781 -2.416 1.00 74.04 H new ATOM 0 HG23 THR A 108 -5.385 -8.441 -3.207 1.00 74.04 H new ATOM 1750 N LEU A 109 -5.907 -7.076 -0.310 1.00 32.24 N ATOM 1751 CA LEU A 109 -6.492 -5.923 0.375 1.00 43.31 C ATOM 1752 C LEU A 109 -6.672 -4.737 -0.547 1.00 74.01 C ATOM 1753 O LEU A 109 -5.879 -4.506 -1.461 1.00 63.20 O ATOM 1754 CB LEU A 109 -5.585 -5.492 1.523 1.00 62.54 C ATOM 1755 CG LEU A 109 -6.210 -4.336 2.315 1.00 51.30 C ATOM 1756 CD1 LEU A 109 -7.532 -4.784 2.956 1.00 75.30 C ATOM 1757 CD2 LEU A 109 -5.230 -3.910 3.410 1.00 33.50 C ATOM 0 H LEU A 109 -5.257 -6.847 -1.062 1.00 32.24 H new ATOM 0 HA LEU A 109 -7.471 -6.234 0.738 1.00 43.31 H new ATOM 0 HB2 LEU A 109 -5.407 -6.338 2.187 1.00 62.54 H new ATOM 0 HB3 LEU A 109 -4.616 -5.186 1.130 1.00 62.54 H new ATOM 0 HG LEU A 109 -6.414 -3.502 1.644 1.00 51.30 H new ATOM 0 HD11 LEU A 109 -7.965 -3.954 3.515 1.00 75.30 H new ATOM 0 HD12 LEU A 109 -8.226 -5.098 2.177 1.00 75.30 H new ATOM 0 HD13 LEU A 109 -7.344 -5.618 3.632 1.00 75.30 H new ATOM 0 HD21 LEU A 109 -5.659 -3.088 3.983 1.00 33.50 H new ATOM 0 HD22 LEU A 109 -5.037 -4.753 4.074 1.00 33.50 H new ATOM 0 HD23 LEU A 109 -4.295 -3.585 2.955 1.00 33.50 H new ATOM 1769 N HIS A 110 -7.707 -3.961 -0.255 1.00 5.55 N ATOM 1770 CA HIS A 110 -7.990 -2.759 -1.013 1.00 51.43 C ATOM 1771 C HIS A 110 -8.412 -1.641 -0.066 1.00 72.13 C ATOM 1772 O HIS A 110 -9.083 -1.894 0.935 1.00 42.32 O ATOM 1773 CB HIS A 110 -9.089 -3.019 -2.044 1.00 64.03 C ATOM 1774 CG HIS A 110 -10.356 -3.417 -1.337 1.00 42.45 C ATOM 1775 ND1 HIS A 110 -10.378 -4.401 -0.360 1.00 33.35 N ATOM 1776 CD2 HIS A 110 -11.649 -2.974 -1.453 1.00 54.02 C ATOM 1777 CE1 HIS A 110 -11.649 -4.515 0.069 1.00 31.11 C ATOM 1778 NE2 HIS A 110 -12.464 -3.669 -0.564 1.00 22.10 N ATOM 0 H HIS A 110 -8.363 -4.146 0.504 1.00 5.55 H new ATOM 0 HA HIS A 110 -7.087 -2.458 -1.544 1.00 51.43 H new ATOM 0 HB2 HIS A 110 -9.260 -2.124 -2.643 1.00 64.03 H new ATOM 0 HB3 HIS A 110 -8.780 -3.807 -2.730 1.00 64.03 H new ATOM 0 HD2 HIS A 110 -11.984 -2.203 -2.131 1.00 54.02 H new ATOM 0 HE1 HIS A 110 -11.970 -5.207 0.833 1.00 31.11 H new ATOM 0 HE2 HIS A 110 -13.468 -3.556 -0.426 1.00 22.10 H new ATOM 1786 N MET A 111 -8.026 -0.405 -0.377 1.00 32.11 N ATOM 1787 CA MET A 111 -8.384 0.730 0.467 1.00 23.14 C ATOM 1788 C MET A 111 -8.348 2.028 -0.342 1.00 31.31 C ATOM 1789 O MET A 111 -7.573 2.154 -1.290 1.00 64.53 O ATOM 1790 CB MET A 111 -7.419 0.824 1.655 1.00 62.50 C ATOM 1791 CG MET A 111 -6.009 0.436 1.205 1.00 65.01 C ATOM 1792 SD MET A 111 -4.861 0.643 2.588 1.00 35.14 S ATOM 1793 CE MET A 111 -4.438 2.374 2.276 1.00 3.04 C ATOM 0 H MET A 111 -7.471 -0.167 -1.199 1.00 32.11 H new ATOM 0 HA MET A 111 -9.397 0.581 0.842 1.00 23.14 H new ATOM 0 HB2 MET A 111 -7.417 1.838 2.055 1.00 62.50 H new ATOM 0 HB3 MET A 111 -7.749 0.165 2.458 1.00 62.50 H new ATOM 0 HG2 MET A 111 -5.997 -0.598 0.859 1.00 65.01 H new ATOM 0 HG3 MET A 111 -5.699 1.057 0.364 1.00 65.01 H new ATOM 0 HE1 MET A 111 -3.363 2.463 2.117 1.00 3.04 H new ATOM 0 HE2 MET A 111 -4.966 2.723 1.389 1.00 3.04 H new ATOM 0 HE3 MET A 111 -4.729 2.980 3.134 1.00 3.04 H new ATOM 1803 N MET A 112 -9.179 2.993 0.046 1.00 43.15 N ATOM 1804 CA MET A 112 -9.226 4.285 -0.644 1.00 44.31 C ATOM 1805 C MET A 112 -8.537 5.354 0.203 1.00 65.34 C ATOM 1806 O MET A 112 -8.637 5.339 1.430 1.00 35.42 O ATOM 1807 CB MET A 112 -10.684 4.686 -0.892 1.00 33.34 C ATOM 1808 CG MET A 112 -10.741 5.899 -1.819 1.00 72.23 C ATOM 1809 SD MET A 112 -10.414 5.369 -3.520 1.00 71.13 S ATOM 1810 CE MET A 112 -12.136 5.257 -4.064 1.00 71.15 C ATOM 0 H MET A 112 -9.826 2.908 0.830 1.00 43.15 H new ATOM 0 HA MET A 112 -8.708 4.197 -1.599 1.00 44.31 H new ATOM 0 HB2 MET A 112 -11.229 3.853 -1.336 1.00 33.34 H new ATOM 0 HB3 MET A 112 -11.172 4.918 0.055 1.00 33.34 H new ATOM 0 HG2 MET A 112 -11.720 6.374 -1.756 1.00 72.23 H new ATOM 0 HG3 MET A 112 -10.006 6.642 -1.510 1.00 72.23 H new ATOM 0 HE1 MET A 112 -12.205 4.579 -4.915 1.00 71.15 H new ATOM 0 HE2 MET A 112 -12.752 4.879 -3.248 1.00 71.15 H new ATOM 0 HE3 MET A 112 -12.490 6.245 -4.358 1.00 71.15 H new ATOM 1820 N ARG A 113 -7.837 6.281 -0.455 1.00 72.31 N ATOM 1821 CA ARG A 113 -7.137 7.351 0.261 1.00 74.31 C ATOM 1822 C ARG A 113 -7.471 8.716 -0.330 1.00 45.20 C ATOM 1823 O ARG A 113 -7.432 8.907 -1.545 1.00 50.24 O ATOM 1824 CB ARG A 113 -5.627 7.122 0.199 1.00 21.21 C ATOM 1825 CG ARG A 113 -5.255 5.915 1.065 1.00 30.34 C ATOM 1826 CD ARG A 113 -3.735 5.736 1.074 1.00 72.50 C ATOM 1827 NE ARG A 113 -3.332 4.903 2.201 1.00 40.45 N ATOM 1828 CZ ARG A 113 -3.389 5.361 3.447 1.00 21.02 C ATOM 1829 NH1 ARG A 113 -3.814 6.574 3.678 1.00 14.40 N ATOM 1830 NH2 ARG A 113 -3.019 4.599 4.441 1.00 74.45 N ATOM 0 H ARG A 113 -7.740 6.314 -1.470 1.00 72.31 H new ATOM 0 HA ARG A 113 -7.467 7.334 1.300 1.00 74.31 H new ATOM 0 HB2 ARG A 113 -5.317 6.952 -0.832 1.00 21.21 H new ATOM 0 HB3 ARG A 113 -5.100 8.010 0.549 1.00 21.21 H new ATOM 0 HG2 ARG A 113 -5.620 6.058 2.082 1.00 30.34 H new ATOM 0 HG3 ARG A 113 -5.735 5.016 0.678 1.00 30.34 H new ATOM 0 HD2 ARG A 113 -3.410 5.278 0.140 1.00 72.50 H new ATOM 0 HD3 ARG A 113 -3.247 6.709 1.139 1.00 72.50 H new ATOM 0 HE ARG A 113 -3.001 3.953 2.030 1.00 40.45 H new ATOM 0 HH11 ARG A 113 -4.102 7.170 2.902 1.00 14.40 H new ATOM 0 HH12 ARG A 113 -3.858 6.926 4.634 1.00 14.40 H new ATOM 0 HH21 ARG A 113 -2.686 3.652 4.261 1.00 74.45 H new ATOM 0 HH22 ARG A 113 -3.063 4.951 5.397 1.00 74.45 H new ATOM 1844 N LEU A 114 -7.805 9.664 0.548 1.00 61.04 N ATOM 1845 CA LEU A 114 -8.153 11.019 0.128 1.00 14.24 C ATOM 1846 C LEU A 114 -7.058 12.000 0.535 1.00 31.42 C ATOM 1847 O LEU A 114 -6.657 12.064 1.714 1.00 44.40 O ATOM 1848 CB LEU A 114 -9.490 11.428 0.768 1.00 14.30 C ATOM 1849 CG LEU A 114 -9.716 12.951 0.654 1.00 15.14 C ATOM 1850 CD1 LEU A 114 -9.918 13.332 -0.815 1.00 31.15 C ATOM 1851 CD2 LEU A 114 -10.955 13.352 1.472 1.00 4.03 C ATOM 0 H LEU A 114 -7.841 9.516 1.556 1.00 61.04 H new ATOM 0 HA LEU A 114 -8.250 11.040 -0.957 1.00 14.24 H new ATOM 0 HB2 LEU A 114 -10.308 10.898 0.280 1.00 14.30 H new ATOM 0 HB3 LEU A 114 -9.500 11.133 1.817 1.00 14.30 H new ATOM 0 HG LEU A 114 -8.844 13.476 1.044 1.00 15.14 H new ATOM 0 HD11 LEU A 114 -10.077 14.407 -0.893 1.00 31.15 H new ATOM 0 HD12 LEU A 114 -9.034 13.054 -1.388 1.00 31.15 H new ATOM 0 HD13 LEU A 114 -10.787 12.807 -1.211 1.00 31.15 H new ATOM 0 HD21 LEU A 114 -11.113 14.427 1.390 1.00 4.03 H new ATOM 0 HD22 LEU A 114 -11.830 12.827 1.089 1.00 4.03 H new ATOM 0 HD23 LEU A 114 -10.802 13.086 2.518 1.00 4.03 H new ATOM 1863 N TYR A 115 -6.583 12.746 -0.467 1.00 63.52 N ATOM 1864 CA TYR A 115 -5.528 13.736 -0.282 1.00 21.22 C ATOM 1865 C TYR A 115 -6.085 15.155 -0.364 1.00 10.04 C ATOM 1866 O TYR A 115 -7.146 15.388 -0.946 1.00 23.43 O ATOM 1867 CB TYR A 115 -4.476 13.594 -1.386 1.00 1.41 C ATOM 1868 CG TYR A 115 -3.728 12.290 -1.257 1.00 3.33 C ATOM 1869 CD1 TYR A 115 -4.408 11.072 -1.371 1.00 32.21 C ATOM 1870 CD2 TYR A 115 -2.345 12.298 -1.029 1.00 4.12 C ATOM 1871 CE1 TYR A 115 -3.711 9.869 -1.250 1.00 64.53 C ATOM 1872 CE2 TYR A 115 -1.650 11.093 -0.913 1.00 25.53 C ATOM 1873 CZ TYR A 115 -2.332 9.879 -1.023 1.00 51.04 C ATOM 1874 OH TYR A 115 -1.651 8.693 -0.887 1.00 14.15 O ATOM 0 H TYR A 115 -6.921 12.678 -1.427 1.00 63.52 H new ATOM 0 HA TYR A 115 -5.090 13.564 0.701 1.00 21.22 H new ATOM 0 HB2 TYR A 115 -4.959 13.645 -2.362 1.00 1.41 H new ATOM 0 HB3 TYR A 115 -3.774 14.426 -1.334 1.00 1.41 H new ATOM 0 HD1 TYR A 115 -5.473 11.063 -1.553 1.00 32.21 H new ATOM 0 HD2 TYR A 115 -1.817 13.236 -0.943 1.00 4.12 H new ATOM 0 HE1 TYR A 115 -4.238 8.930 -1.332 1.00 64.53 H new ATOM 0 HE2 TYR A 115 -0.584 11.099 -0.738 1.00 25.53 H new ATOM 0 HH TYR A 115 -0.701 8.877 -0.735 1.00 14.15 H new ATOM 1884 N SER A 116 -5.326 16.099 0.188 1.00 74.05 N ATOM 1885 CA SER A 116 -5.695 17.513 0.156 1.00 63.32 C ATOM 1886 C SER A 116 -4.481 18.328 -0.266 1.00 70.03 C ATOM 1887 O SER A 116 -3.376 18.083 0.213 1.00 51.32 O ATOM 1888 CB SER A 116 -6.153 17.981 1.537 1.00 52.55 C ATOM 1889 OG SER A 116 -6.410 19.377 1.492 1.00 71.21 O ATOM 0 H SER A 116 -4.445 15.908 0.666 1.00 74.05 H new ATOM 0 HA SER A 116 -6.513 17.650 -0.551 1.00 63.32 H new ATOM 0 HB2 SER A 116 -7.052 17.443 1.838 1.00 52.55 H new ATOM 0 HB3 SER A 116 -5.387 17.763 2.281 1.00 52.55 H new ATOM 0 HG SER A 116 -6.370 19.746 2.399 1.00 71.21 H new ATOM 1895 N ARG A 117 -4.669 19.293 -1.158 1.00 11.35 N ATOM 1896 CA ARG A 117 -3.547 20.107 -1.605 1.00 33.24 C ATOM 1897 C ARG A 117 -3.088 21.032 -0.485 1.00 50.25 C ATOM 1898 O ARG A 117 -1.989 21.585 -0.532 1.00 21.22 O ATOM 1899 CB ARG A 117 -3.961 20.939 -2.822 1.00 50.51 C ATOM 1900 CG ARG A 117 -2.712 21.427 -3.573 1.00 33.11 C ATOM 1901 CD ARG A 117 -1.987 20.246 -4.242 1.00 64.31 C ATOM 1902 NE ARG A 117 -0.900 19.775 -3.391 1.00 40.24 N ATOM 1903 CZ ARG A 117 0.274 20.398 -3.367 1.00 21.21 C ATOM 1904 NH1 ARG A 117 0.468 21.451 -4.112 1.00 55.52 N ATOM 1905 NH2 ARG A 117 1.231 19.957 -2.598 1.00 15.21 N ATOM 0 H ARG A 117 -5.568 19.528 -1.578 1.00 11.35 H new ATOM 0 HA ARG A 117 -2.724 19.448 -1.880 1.00 33.24 H new ATOM 0 HB2 ARG A 117 -4.585 20.341 -3.487 1.00 50.51 H new ATOM 0 HB3 ARG A 117 -4.560 21.792 -2.503 1.00 50.51 H new ATOM 0 HG2 ARG A 117 -2.998 22.160 -4.327 1.00 33.11 H new ATOM 0 HG3 ARG A 117 -2.037 21.930 -2.880 1.00 33.11 H new ATOM 0 HD2 ARG A 117 -2.691 19.435 -4.427 1.00 64.31 H new ATOM 0 HD3 ARG A 117 -1.593 20.553 -5.211 1.00 64.31 H new ATOM 0 HE ARG A 117 -1.043 18.953 -2.804 1.00 40.24 H new ATOM 0 HH11 ARG A 117 -0.281 21.796 -4.712 1.00 55.52 H new ATOM 0 HH12 ARG A 117 1.369 21.930 -4.094 1.00 55.52 H new ATOM 0 HH21 ARG A 117 1.078 19.134 -2.015 1.00 15.21 H new ATOM 0 HH22 ARG A 117 2.132 20.435 -2.580 1.00 15.21 H new ATOM 1919 N SER A 118 -3.942 21.194 0.522 1.00 74.34 N ATOM 1920 CA SER A 118 -3.627 22.055 1.659 1.00 64.21 C ATOM 1921 C SER A 118 -4.116 21.411 2.960 1.00 53.13 C ATOM 1922 O SER A 118 -5.160 20.759 2.975 1.00 61.44 O ATOM 1923 CB SER A 118 -4.303 23.413 1.475 1.00 43.25 C ATOM 1924 OG SER A 118 -4.116 24.198 2.646 1.00 11.11 O ATOM 0 H SER A 118 -4.855 20.742 0.574 1.00 74.34 H new ATOM 0 HA SER A 118 -2.547 22.189 1.714 1.00 64.21 H new ATOM 0 HB2 SER A 118 -3.883 23.926 0.610 1.00 43.25 H new ATOM 0 HB3 SER A 118 -5.367 23.278 1.281 1.00 43.25 H new ATOM 0 HG SER A 118 -4.548 25.070 2.528 1.00 11.11 H new ATOM 1930 N PRO A 119 -3.393 21.577 4.043 1.00 0.43 N ATOM 1931 CA PRO A 119 -3.776 20.997 5.361 1.00 21.24 C ATOM 1932 C PRO A 119 -5.287 21.010 5.595 1.00 71.42 C ATOM 1933 O PRO A 119 -5.808 20.220 6.380 1.00 43.03 O ATOM 1934 CB PRO A 119 -3.059 21.911 6.355 1.00 31.21 C ATOM 1935 CG PRO A 119 -1.822 22.367 5.644 1.00 2.13 C ATOM 1936 CD PRO A 119 -2.129 22.329 4.139 1.00 63.14 C ATOM 0 HA PRO A 119 -3.499 19.946 5.447 1.00 21.24 H new ATOM 0 HB2 PRO A 119 -3.686 22.757 6.636 1.00 31.21 H new ATOM 0 HB3 PRO A 119 -2.812 21.378 7.273 1.00 31.21 H new ATOM 0 HG2 PRO A 119 -1.547 23.375 5.956 1.00 2.13 H new ATOM 0 HG3 PRO A 119 -0.979 21.718 5.882 1.00 2.13 H new ATOM 0 HD2 PRO A 119 -2.232 23.334 3.729 1.00 63.14 H new ATOM 0 HD3 PRO A 119 -1.331 21.838 3.583 1.00 63.14 H new ATOM 1944 N GLU A 120 -5.985 21.912 4.911 1.00 72.12 N ATOM 1945 CA GLU A 120 -7.426 22.021 5.052 1.00 62.41 C ATOM 1946 C GLU A 120 -8.129 21.076 4.091 1.00 62.33 C ATOM 1947 O GLU A 120 -7.550 20.629 3.104 1.00 4.55 O ATOM 1948 CB GLU A 120 -7.872 23.454 4.760 1.00 62.22 C ATOM 1949 CG GLU A 120 -7.002 24.436 5.548 1.00 22.25 C ATOM 1950 CD GLU A 120 -7.186 24.213 7.045 1.00 21.55 C ATOM 1951 OE1 GLU A 120 -8.193 23.634 7.418 1.00 20.31 O ATOM 1952 OE2 GLU A 120 -6.319 24.625 7.797 1.00 33.55 O ATOM 0 H GLU A 120 -5.573 22.576 4.255 1.00 72.12 H new ATOM 0 HA GLU A 120 -7.691 21.754 6.075 1.00 62.41 H new ATOM 0 HB2 GLU A 120 -7.793 23.659 3.692 1.00 62.22 H new ATOM 0 HB3 GLU A 120 -8.920 23.582 5.033 1.00 62.22 H new ATOM 0 HG2 GLU A 120 -5.954 24.303 5.279 1.00 22.25 H new ATOM 0 HG3 GLU A 120 -7.270 25.460 5.289 1.00 22.25 H new ATOM 1959 N VAL A 121 -9.385 20.788 4.392 1.00 43.13 N ATOM 1960 CA VAL A 121 -10.195 19.899 3.559 1.00 34.10 C ATOM 1961 C VAL A 121 -11.391 20.654 2.988 1.00 41.10 C ATOM 1962 O VAL A 121 -12.064 21.400 3.699 1.00 4.10 O ATOM 1963 CB VAL A 121 -10.687 18.708 4.389 1.00 43.22 C ATOM 1964 CG1 VAL A 121 -9.562 17.680 4.524 1.00 1.10 C ATOM 1965 CG2 VAL A 121 -11.101 19.194 5.780 1.00 13.23 C ATOM 0 H VAL A 121 -9.872 21.156 5.209 1.00 43.13 H new ATOM 0 HA VAL A 121 -9.579 19.535 2.736 1.00 34.10 H new ATOM 0 HB VAL A 121 -11.542 18.248 3.893 1.00 43.22 H new ATOM 0 HG11 VAL A 121 -9.912 16.833 5.114 1.00 1.10 H new ATOM 0 HG12 VAL A 121 -9.264 17.334 3.534 1.00 1.10 H new ATOM 0 HG13 VAL A 121 -8.707 18.139 5.020 1.00 1.10 H new ATOM 0 HG21 VAL A 121 -11.451 18.348 6.372 1.00 13.23 H new ATOM 0 HG22 VAL A 121 -10.245 19.653 6.275 1.00 13.23 H new ATOM 0 HG23 VAL A 121 -11.902 19.927 5.686 1.00 13.23 H new ATOM 1975 N SER A 122 -11.648 20.456 1.698 1.00 61.21 N ATOM 1976 CA SER A 122 -12.765 21.124 1.034 1.00 2.45 C ATOM 1977 C SER A 122 -13.997 20.211 1.007 1.00 21.04 C ATOM 1978 O SER A 122 -13.882 19.030 0.678 1.00 4.24 O ATOM 1979 CB SER A 122 -12.371 21.482 -0.400 1.00 24.24 C ATOM 1980 OG SER A 122 -13.543 21.760 -1.153 1.00 22.40 O ATOM 0 H SER A 122 -11.102 19.842 1.094 1.00 61.21 H new ATOM 0 HA SER A 122 -13.007 22.031 1.589 1.00 2.45 H new ATOM 0 HB2 SER A 122 -11.709 22.348 -0.402 1.00 24.24 H new ATOM 0 HB3 SER A 122 -11.820 20.659 -0.854 1.00 24.24 H new ATOM 0 HG SER A 122 -13.294 21.991 -2.072 1.00 22.40 H new ATOM 1986 N PRO A 123 -15.166 20.718 1.334 1.00 40.21 N ATOM 1987 CA PRO A 123 -16.415 19.903 1.327 1.00 41.25 C ATOM 1988 C PRO A 123 -16.481 18.953 0.131 1.00 75.13 C ATOM 1989 O PRO A 123 -17.071 17.876 0.213 1.00 61.11 O ATOM 1990 CB PRO A 123 -17.522 20.956 1.252 1.00 40.21 C ATOM 1991 CG PRO A 123 -16.960 22.163 1.935 1.00 12.51 C ATOM 1992 CD PRO A 123 -15.436 22.110 1.747 1.00 22.11 C ATOM 0 HA PRO A 123 -16.490 19.255 2.200 1.00 41.25 H new ATOM 0 HB2 PRO A 123 -17.787 21.176 0.218 1.00 40.21 H new ATOM 0 HB3 PRO A 123 -18.429 20.610 1.747 1.00 40.21 H new ATOM 0 HG2 PRO A 123 -17.371 23.077 1.506 1.00 12.51 H new ATOM 0 HG3 PRO A 123 -17.219 22.164 2.994 1.00 12.51 H new ATOM 0 HD2 PRO A 123 -15.104 22.821 0.990 1.00 22.11 H new ATOM 0 HD3 PRO A 123 -14.913 22.359 2.670 1.00 22.11 H new ATOM 2000 N ALA A 124 -15.869 19.360 -0.976 1.00 21.10 N ATOM 2001 CA ALA A 124 -15.862 18.539 -2.182 1.00 43.15 C ATOM 2002 C ALA A 124 -14.864 17.393 -2.045 1.00 72.30 C ATOM 2003 O ALA A 124 -15.068 16.308 -2.588 1.00 20.22 O ATOM 2004 CB ALA A 124 -15.493 19.396 -3.394 1.00 32.13 C ATOM 0 H ALA A 124 -15.374 20.248 -1.064 1.00 21.10 H new ATOM 0 HA ALA A 124 -16.860 18.122 -2.321 1.00 43.15 H new ATOM 0 HB1 ALA A 124 -15.490 18.776 -4.291 1.00 32.13 H new ATOM 0 HB2 ALA A 124 -16.223 20.197 -3.509 1.00 32.13 H new ATOM 0 HB3 ALA A 124 -14.502 19.827 -3.247 1.00 32.13 H new ATOM 2010 N ALA A 125 -13.781 17.649 -1.320 1.00 64.13 N ATOM 2011 CA ALA A 125 -12.744 16.643 -1.117 1.00 1.50 C ATOM 2012 C ALA A 125 -13.256 15.490 -0.259 1.00 25.33 C ATOM 2013 O ALA A 125 -13.081 14.323 -0.599 1.00 32.23 O ATOM 2014 CB ALA A 125 -11.541 17.284 -0.426 1.00 75.12 C ATOM 0 H ALA A 125 -13.598 18.543 -0.864 1.00 64.13 H new ATOM 0 HA ALA A 125 -12.455 16.250 -2.092 1.00 1.50 H new ATOM 0 HB1 ALA A 125 -10.766 16.533 -0.274 1.00 75.12 H new ATOM 0 HB2 ALA A 125 -11.150 18.088 -1.049 1.00 75.12 H new ATOM 0 HB3 ALA A 125 -11.848 17.689 0.538 1.00 75.12 H new ATOM 2020 N THR A 126 -13.894 15.836 0.850 1.00 20.14 N ATOM 2021 CA THR A 126 -14.438 14.833 1.758 1.00 3.30 C ATOM 2022 C THR A 126 -15.687 14.185 1.160 1.00 23.33 C ATOM 2023 O THR A 126 -15.986 13.022 1.430 1.00 43.03 O ATOM 2024 CB THR A 126 -14.769 15.475 3.120 1.00 22.42 C ATOM 2025 OG1 THR A 126 -13.958 16.628 3.300 1.00 2.41 O ATOM 2026 CG2 THR A 126 -14.496 14.481 4.263 1.00 4.03 C ATOM 0 H THR A 126 -14.048 16.801 1.143 1.00 20.14 H new ATOM 0 HA THR A 126 -13.687 14.057 1.907 1.00 3.30 H new ATOM 0 HB THR A 126 -15.824 15.750 3.136 1.00 22.42 H new ATOM 0 HG1 THR A 126 -14.439 17.420 2.981 1.00 2.41 H new ATOM 0 HG21 THR A 126 -14.735 14.950 5.218 1.00 4.03 H new ATOM 0 HG22 THR A 126 -15.115 13.594 4.129 1.00 4.03 H new ATOM 0 HG23 THR A 126 -13.444 14.194 4.253 1.00 4.03 H new ATOM 2034 N ALA A 127 -16.436 14.960 0.383 1.00 75.53 N ATOM 2035 CA ALA A 127 -17.680 14.482 -0.217 1.00 74.44 C ATOM 2036 C ALA A 127 -17.465 13.549 -1.408 1.00 64.32 C ATOM 2037 O ALA A 127 -18.047 12.466 -1.458 1.00 31.01 O ATOM 2038 CB ALA A 127 -18.478 15.679 -0.684 1.00 74.43 C ATOM 0 H ALA A 127 -16.203 15.926 0.152 1.00 75.53 H new ATOM 0 HA ALA A 127 -18.204 13.909 0.548 1.00 74.44 H new ATOM 0 HB1 ALA A 127 -19.411 15.341 -1.135 1.00 74.43 H new ATOM 0 HB2 ALA A 127 -18.699 16.323 0.167 1.00 74.43 H new ATOM 0 HB3 ALA A 127 -17.900 16.237 -1.421 1.00 74.43 H new ATOM 2044 N ILE A 128 -16.621 13.949 -2.357 1.00 41.33 N ATOM 2045 CA ILE A 128 -16.361 13.098 -3.501 1.00 21.54 C ATOM 2046 C ILE A 128 -15.789 11.799 -2.968 1.00 1.11 C ATOM 2047 O ILE A 128 -16.048 10.707 -3.471 1.00 31.32 O ATOM 2048 CB ILE A 128 -15.382 13.812 -4.452 1.00 42.31 C ATOM 2049 CG1 ILE A 128 -15.627 13.356 -5.888 1.00 14.43 C ATOM 2050 CG2 ILE A 128 -13.920 13.528 -4.072 1.00 32.51 C ATOM 2051 CD1 ILE A 128 -15.573 11.827 -5.976 1.00 15.02 C ATOM 0 H ILE A 128 -16.119 14.837 -2.353 1.00 41.33 H new ATOM 0 HA ILE A 128 -17.267 12.887 -4.070 1.00 21.54 H new ATOM 0 HB ILE A 128 -15.558 14.884 -4.366 1.00 42.31 H new ATOM 0 HG12 ILE A 128 -16.599 13.713 -6.229 1.00 14.43 H new ATOM 0 HG13 ILE A 128 -14.877 13.792 -6.548 1.00 14.43 H new ATOM 0 HG21 ILE A 128 -13.257 14.047 -4.764 1.00 32.51 H new ATOM 0 HG22 ILE A 128 -13.733 13.879 -3.057 1.00 32.51 H new ATOM 0 HG23 ILE A 128 -13.732 12.456 -4.125 1.00 32.51 H new ATOM 0 HD11 ILE A 128 -15.749 11.515 -7.005 1.00 15.02 H new ATOM 0 HD12 ILE A 128 -14.592 11.478 -5.654 1.00 15.02 H new ATOM 0 HD13 ILE A 128 -16.340 11.398 -5.331 1.00 15.02 H new ATOM 2063 N PHE A 129 -15.011 11.977 -1.922 1.00 33.53 N ATOM 2064 CA PHE A 129 -14.365 10.879 -1.239 1.00 40.20 C ATOM 2065 C PHE A 129 -15.397 9.922 -0.646 1.00 72.51 C ATOM 2066 O PHE A 129 -15.284 8.705 -0.790 1.00 34.40 O ATOM 2067 CB PHE A 129 -13.493 11.449 -0.132 1.00 21.32 C ATOM 2068 CG PHE A 129 -12.887 10.326 0.686 1.00 62.51 C ATOM 2069 CD1 PHE A 129 -12.255 9.240 0.056 1.00 72.20 C ATOM 2070 CD2 PHE A 129 -12.963 10.370 2.082 1.00 24.04 C ATOM 2071 CE1 PHE A 129 -11.704 8.208 0.823 1.00 64.05 C ATOM 2072 CE2 PHE A 129 -12.411 9.337 2.846 1.00 20.40 C ATOM 2073 CZ PHE A 129 -11.781 8.258 2.218 1.00 62.13 C ATOM 0 H PHE A 129 -14.808 12.892 -1.520 1.00 33.53 H new ATOM 0 HA PHE A 129 -13.759 10.318 -1.950 1.00 40.20 H new ATOM 0 HB2 PHE A 129 -12.702 12.064 -0.562 1.00 21.32 H new ATOM 0 HB3 PHE A 129 -14.087 12.098 0.511 1.00 21.32 H new ATOM 0 HD1 PHE A 129 -12.195 9.202 -1.022 1.00 72.20 H new ATOM 0 HD2 PHE A 129 -13.448 11.202 2.570 1.00 24.04 H new ATOM 0 HE1 PHE A 129 -11.220 7.373 0.338 1.00 64.05 H new ATOM 0 HE2 PHE A 129 -12.471 9.373 3.924 1.00 20.40 H new ATOM 0 HZ PHE A 129 -11.354 7.463 2.811 1.00 62.13 H new ATOM 2083 N ARG A 130 -16.402 10.482 0.023 1.00 74.34 N ATOM 2084 CA ARG A 130 -17.448 9.668 0.633 1.00 5.14 C ATOM 2085 C ARG A 130 -18.302 9.004 -0.441 1.00 41.10 C ATOM 2086 O ARG A 130 -18.755 7.872 -0.276 1.00 32.32 O ATOM 2087 CB ARG A 130 -18.333 10.537 1.537 1.00 61.03 C ATOM 2088 CG ARG A 130 -17.629 10.770 2.877 1.00 52.24 C ATOM 2089 CD ARG A 130 -18.445 11.752 3.719 1.00 72.22 C ATOM 2090 NE ARG A 130 -17.770 12.013 4.985 1.00 44.41 N ATOM 2091 CZ ARG A 130 -18.270 12.874 5.866 1.00 13.45 C ATOM 2092 NH1 ARG A 130 -19.382 13.504 5.604 1.00 74.51 N ATOM 2093 NH2 ARG A 130 -17.647 13.091 6.992 1.00 12.21 N ATOM 0 H ARG A 130 -16.513 11.487 0.155 1.00 74.34 H new ATOM 0 HA ARG A 130 -16.975 8.892 1.234 1.00 5.14 H new ATOM 0 HB2 ARG A 130 -18.539 11.491 1.052 1.00 61.03 H new ATOM 0 HB3 ARG A 130 -19.294 10.049 1.700 1.00 61.03 H new ATOM 0 HG2 ARG A 130 -17.515 9.826 3.409 1.00 52.24 H new ATOM 0 HG3 ARG A 130 -16.627 11.164 2.709 1.00 52.24 H new ATOM 0 HD2 ARG A 130 -18.581 12.685 3.172 1.00 72.22 H new ATOM 0 HD3 ARG A 130 -19.438 11.344 3.906 1.00 72.22 H new ATOM 0 HE ARG A 130 -16.899 11.527 5.198 1.00 44.41 H new ATOM 0 HH11 ARG A 130 -19.868 13.336 4.723 1.00 74.51 H new ATOM 0 HH12 ARG A 130 -19.765 14.165 6.280 1.00 74.51 H new ATOM 0 HH21 ARG A 130 -16.777 12.600 7.196 1.00 12.21 H new ATOM 0 HH22 ARG A 130 -18.031 13.752 7.668 1.00 12.21 H new ATOM 2107 N LYS A 131 -18.514 9.713 -1.546 1.00 3.50 N ATOM 2108 CA LYS A 131 -19.312 9.173 -2.639 1.00 22.51 C ATOM 2109 C LYS A 131 -18.751 7.826 -3.080 1.00 44.42 C ATOM 2110 O LYS A 131 -19.474 6.833 -3.152 1.00 4.42 O ATOM 2111 CB LYS A 131 -19.305 10.145 -3.821 1.00 0.54 C ATOM 2112 CG LYS A 131 -20.286 9.658 -4.890 1.00 42.04 C ATOM 2113 CD LYS A 131 -20.243 10.603 -6.093 1.00 73.24 C ATOM 2114 CE LYS A 131 -21.263 10.147 -7.137 1.00 74.53 C ATOM 2115 NZ LYS A 131 -22.639 10.455 -6.656 1.00 73.43 N ATOM 0 H LYS A 131 -18.149 10.652 -1.706 1.00 3.50 H new ATOM 0 HA LYS A 131 -20.336 9.037 -2.292 1.00 22.51 H new ATOM 0 HB2 LYS A 131 -19.583 11.144 -3.485 1.00 0.54 H new ATOM 0 HB3 LYS A 131 -18.301 10.217 -4.240 1.00 0.54 H new ATOM 0 HG2 LYS A 131 -20.028 8.645 -5.200 1.00 42.04 H new ATOM 0 HG3 LYS A 131 -21.296 9.619 -4.481 1.00 42.04 H new ATOM 0 HD2 LYS A 131 -20.462 11.623 -5.776 1.00 73.24 H new ATOM 0 HD3 LYS A 131 -19.243 10.612 -6.526 1.00 73.24 H new ATOM 0 HE2 LYS A 131 -21.077 10.650 -8.086 1.00 74.53 H new ATOM 0 HE3 LYS A 131 -21.161 9.077 -7.318 1.00 74.53 H new ATOM 0 HZ1 LYS A 131 -23.305 10.402 -7.453 1.00 73.43 H new ATOM 0 HZ2 LYS A 131 -22.915 9.766 -5.928 1.00 73.43 H new ATOM 0 HZ3 LYS A 131 -22.659 11.413 -6.251 1.00 73.43 H new ATOM 2129 N LEU A 132 -17.456 7.805 -3.372 1.00 3.13 N ATOM 2130 CA LEU A 132 -16.797 6.578 -3.805 1.00 63.42 C ATOM 2131 C LEU A 132 -16.904 5.506 -2.721 1.00 14.34 C ATOM 2132 O LEU A 132 -17.279 4.363 -2.994 1.00 43.11 O ATOM 2133 CB LEU A 132 -15.310 6.865 -4.103 1.00 73.01 C ATOM 2134 CG LEU A 132 -15.076 7.181 -5.594 1.00 61.30 C ATOM 2135 CD1 LEU A 132 -15.005 5.876 -6.398 1.00 61.11 C ATOM 2136 CD2 LEU A 132 -16.197 8.081 -6.148 1.00 71.13 C ATOM 0 H LEU A 132 -16.844 8.619 -3.317 1.00 3.13 H new ATOM 0 HA LEU A 132 -17.288 6.216 -4.708 1.00 63.42 H new ATOM 0 HB2 LEU A 132 -14.973 7.705 -3.496 1.00 73.01 H new ATOM 0 HB3 LEU A 132 -14.709 6.003 -3.815 1.00 73.01 H new ATOM 0 HG LEU A 132 -14.131 7.716 -5.689 1.00 61.30 H new ATOM 0 HD11 LEU A 132 -14.840 6.106 -7.451 1.00 61.11 H new ATOM 0 HD12 LEU A 132 -14.183 5.264 -6.027 1.00 61.11 H new ATOM 0 HD13 LEU A 132 -15.942 5.330 -6.289 1.00 61.11 H new ATOM 0 HD21 LEU A 132 -16.009 8.290 -7.201 1.00 71.13 H new ATOM 0 HD22 LEU A 132 -17.156 7.573 -6.044 1.00 71.13 H new ATOM 0 HD23 LEU A 132 -16.220 9.018 -5.591 1.00 71.13 H new ATOM 2148 N ALA A 133 -16.567 5.876 -1.491 1.00 1.25 N ATOM 2149 CA ALA A 133 -16.626 4.925 -0.393 1.00 21.11 C ATOM 2150 C ALA A 133 -18.040 4.369 -0.243 1.00 41.20 C ATOM 2151 O ALA A 133 -18.217 3.198 0.087 1.00 20.44 O ATOM 2152 CB ALA A 133 -16.185 5.578 0.918 1.00 71.34 C ATOM 0 H ALA A 133 -16.255 6.812 -1.233 1.00 1.25 H new ATOM 0 HA ALA A 133 -15.944 4.106 -0.622 1.00 21.11 H new ATOM 0 HB1 ALA A 133 -16.238 4.847 1.725 1.00 71.34 H new ATOM 0 HB2 ALA A 133 -15.160 5.936 0.819 1.00 71.34 H new ATOM 0 HB3 ALA A 133 -16.842 6.417 1.146 1.00 71.34 H new ATOM 2158 N GLY A 134 -19.050 5.195 -0.512 1.00 71.52 N ATOM 2159 CA GLY A 134 -20.430 4.737 -0.409 1.00 64.23 C ATOM 2160 C GLY A 134 -20.722 3.698 -1.479 1.00 33.34 C ATOM 2161 O GLY A 134 -21.396 2.702 -1.222 1.00 0.31 O ATOM 0 H GLY A 134 -18.940 6.168 -0.798 1.00 71.52 H new ATOM 0 HA2 GLY A 134 -20.606 4.311 0.579 1.00 64.23 H new ATOM 0 HA3 GLY A 134 -21.110 5.582 -0.518 1.00 64.23 H new ATOM 2165 N GLU A 135 -20.202 3.931 -2.681 1.00 15.34 N ATOM 2166 CA GLU A 135 -20.407 2.992 -3.771 1.00 54.22 C ATOM 2167 C GLU A 135 -19.901 1.621 -3.349 1.00 2.21 C ATOM 2168 O GLU A 135 -20.356 0.594 -3.850 1.00 52.54 O ATOM 2169 CB GLU A 135 -19.664 3.458 -5.026 1.00 71.22 C ATOM 2170 CG GLU A 135 -20.359 4.694 -5.602 1.00 11.05 C ATOM 2171 CD GLU A 135 -19.625 5.169 -6.851 1.00 14.42 C ATOM 2172 OE1 GLU A 135 -18.517 4.713 -7.073 1.00 65.03 O ATOM 2173 OE2 GLU A 135 -20.184 5.983 -7.567 1.00 41.20 O ATOM 0 H GLU A 135 -19.644 4.751 -2.920 1.00 15.34 H new ATOM 0 HA GLU A 135 -21.471 2.937 -4.002 1.00 54.22 H new ATOM 0 HB2 GLU A 135 -18.628 3.691 -4.782 1.00 71.22 H new ATOM 0 HB3 GLU A 135 -19.645 2.660 -5.768 1.00 71.22 H new ATOM 0 HG2 GLU A 135 -21.395 4.458 -5.846 1.00 11.05 H new ATOM 0 HG3 GLU A 135 -20.380 5.490 -4.858 1.00 11.05 H new ATOM 2180 N ARG A 136 -18.961 1.621 -2.404 1.00 3.45 N ATOM 2181 CA ARG A 136 -18.397 0.379 -1.888 1.00 71.25 C ATOM 2182 C ARG A 136 -19.128 -0.029 -0.606 1.00 73.32 C ATOM 2183 O ARG A 136 -18.744 -0.989 0.060 1.00 52.32 O ATOM 2184 CB ARG A 136 -16.896 0.569 -1.607 1.00 24.14 C ATOM 2185 CG ARG A 136 -16.156 -0.774 -1.727 1.00 0.22 C ATOM 2186 CD ARG A 136 -15.777 -1.035 -3.190 1.00 32.32 C ATOM 2187 NE ARG A 136 -15.451 -2.443 -3.381 1.00 22.23 N ATOM 2188 CZ ARG A 136 -15.061 -2.904 -4.565 1.00 42.14 C ATOM 2189 NH1 ARG A 136 -14.967 -2.090 -5.582 1.00 24.34 N ATOM 2190 NH2 ARG A 136 -14.775 -4.168 -4.712 1.00 63.21 N ATOM 0 H ARG A 136 -18.576 2.466 -1.983 1.00 3.45 H new ATOM 0 HA ARG A 136 -18.521 -0.410 -2.630 1.00 71.25 H new ATOM 0 HB2 ARG A 136 -16.476 1.288 -2.310 1.00 24.14 H new ATOM 0 HB3 ARG A 136 -16.756 0.981 -0.608 1.00 24.14 H new ATOM 0 HG2 ARG A 136 -15.259 -0.761 -1.107 1.00 0.22 H new ATOM 0 HG3 ARG A 136 -16.788 -1.581 -1.357 1.00 0.22 H new ATOM 0 HD2 ARG A 136 -16.603 -0.753 -3.843 1.00 32.32 H new ATOM 0 HD3 ARG A 136 -14.925 -0.416 -3.469 1.00 32.32 H new ATOM 0 HE ARG A 136 -15.523 -3.086 -2.592 1.00 22.23 H new ATOM 0 HH11 ARG A 136 -15.193 -1.102 -5.467 1.00 24.34 H new ATOM 0 HH12 ARG A 136 -14.668 -2.442 -6.491 1.00 24.34 H new ATOM 0 HH21 ARG A 136 -14.851 -4.804 -3.918 1.00 63.21 H new ATOM 0 HH22 ARG A 136 -14.476 -4.521 -5.621 1.00 63.21 H new ATOM 2204 N ASN A 137 -20.192 0.714 -0.290 1.00 22.52 N ATOM 2205 CA ASN A 137 -21.010 0.445 0.895 1.00 3.30 C ATOM 2206 C ASN A 137 -20.196 0.561 2.176 1.00 5.22 C ATOM 2207 O ASN A 137 -20.359 -0.231 3.105 1.00 12.24 O ATOM 2208 CB ASN A 137 -21.567 -0.953 0.805 1.00 64.11 C ATOM 2209 CG ASN A 137 -22.352 -1.129 -0.491 1.00 0.44 C ATOM 2210 OD1 ASN A 137 -22.181 -2.127 -1.191 1.00 61.11 O ATOM 2211 ND2 ASN A 137 -23.208 -0.214 -0.853 1.00 12.45 N ATOM 0 H ASN A 137 -20.508 1.511 -0.842 1.00 22.52 H new ATOM 0 HA ASN A 137 -21.811 1.184 0.925 1.00 3.30 H new ATOM 0 HB2 ASN A 137 -20.755 -1.679 0.847 1.00 64.11 H new ATOM 0 HB3 ASN A 137 -22.214 -1.149 1.660 1.00 64.11 H new ATOM 0 HD21 ASN A 137 -23.737 -0.325 -1.718 1.00 12.45 H new ATOM 0 HD22 ASN A 137 -23.348 0.612 -0.271 1.00 12.45 H new ATOM 2218 N TYR A 138 -19.333 1.551 2.217 1.00 72.44 N ATOM 2219 CA TYR A 138 -18.491 1.787 3.394 1.00 4.12 C ATOM 2220 C TYR A 138 -19.224 2.642 4.426 1.00 53.42 C ATOM 2221 O TYR A 138 -19.644 3.761 4.134 1.00 42.35 O ATOM 2222 CB TYR A 138 -17.191 2.506 2.990 1.00 74.33 C ATOM 2223 CG TYR A 138 -16.126 1.500 2.622 1.00 64.33 C ATOM 2224 CD1 TYR A 138 -16.465 0.353 1.902 1.00 31.32 C ATOM 2225 CD2 TYR A 138 -14.800 1.716 3.014 1.00 34.13 C ATOM 2226 CE1 TYR A 138 -15.477 -0.583 1.570 1.00 51.43 C ATOM 2227 CE2 TYR A 138 -13.812 0.783 2.682 1.00 13.50 C ATOM 2228 CZ TYR A 138 -14.151 -0.368 1.959 1.00 11.22 C ATOM 2229 OH TYR A 138 -13.177 -1.290 1.633 1.00 72.41 O ATOM 0 H TYR A 138 -19.187 2.212 1.454 1.00 72.44 H new ATOM 0 HA TYR A 138 -18.256 0.816 3.831 1.00 4.12 H new ATOM 0 HB2 TYR A 138 -17.382 3.169 2.146 1.00 74.33 H new ATOM 0 HB3 TYR A 138 -16.842 3.130 3.813 1.00 74.33 H new ATOM 0 HD1 TYR A 138 -17.489 0.187 1.601 1.00 31.32 H new ATOM 0 HD2 TYR A 138 -14.540 2.603 3.573 1.00 34.13 H new ATOM 0 HE1 TYR A 138 -15.739 -1.471 1.014 1.00 51.43 H new ATOM 0 HE2 TYR A 138 -12.788 0.950 2.983 1.00 13.50 H new ATOM 0 HH TYR A 138 -13.503 -2.193 1.828 1.00 72.41 H new ATOM 2239 N THR A 139 -19.343 2.119 5.642 1.00 73.35 N ATOM 2240 CA THR A 139 -19.990 2.857 6.721 1.00 53.43 C ATOM 2241 C THR A 139 -18.989 3.846 7.318 1.00 45.45 C ATOM 2242 O THR A 139 -17.779 3.677 7.164 1.00 2.43 O ATOM 2243 CB THR A 139 -20.494 1.892 7.810 1.00 50.03 C ATOM 2244 OG1 THR A 139 -19.541 1.825 8.861 1.00 62.52 O ATOM 2245 CG2 THR A 139 -20.702 0.492 7.220 1.00 5.14 C ATOM 0 H THR A 139 -19.003 1.194 5.904 1.00 73.35 H new ATOM 0 HA THR A 139 -20.848 3.398 6.322 1.00 53.43 H new ATOM 0 HB THR A 139 -21.444 2.259 8.198 1.00 50.03 H new ATOM 0 HG1 THR A 139 -19.477 0.903 9.186 1.00 62.52 H new ATOM 0 HG21 THR A 139 -21.058 -0.182 7.999 1.00 5.14 H new ATOM 0 HG22 THR A 139 -21.438 0.541 6.418 1.00 5.14 H new ATOM 0 HG23 THR A 139 -19.757 0.120 6.823 1.00 5.14 H new ATOM 2253 N ASP A 140 -19.488 4.903 7.949 1.00 53.52 N ATOM 2254 CA ASP A 140 -18.605 5.930 8.500 1.00 5.52 C ATOM 2255 C ASP A 140 -17.397 5.328 9.224 1.00 31.22 C ATOM 2256 O ASP A 140 -16.260 5.706 8.945 1.00 10.14 O ATOM 2257 CB ASP A 140 -19.388 6.816 9.470 1.00 20.31 C ATOM 2258 CG ASP A 140 -19.950 5.973 10.610 1.00 21.43 C ATOM 2259 OD1 ASP A 140 -20.099 4.778 10.420 1.00 44.34 O ATOM 2260 OD2 ASP A 140 -20.224 6.537 11.657 1.00 1.43 O ATOM 0 H ASP A 140 -20.484 5.072 8.092 1.00 53.52 H new ATOM 0 HA ASP A 140 -18.230 6.521 7.664 1.00 5.52 H new ATOM 0 HB2 ASP A 140 -18.738 7.595 9.869 1.00 20.31 H new ATOM 0 HB3 ASP A 140 -20.200 7.317 8.943 1.00 20.31 H new ATOM 2265 N GLU A 141 -17.629 4.417 10.162 1.00 53.42 N ATOM 2266 CA GLU A 141 -16.520 3.821 10.908 1.00 10.41 C ATOM 2267 C GLU A 141 -15.502 3.160 9.975 1.00 2.44 C ATOM 2268 O GLU A 141 -14.353 2.944 10.356 1.00 45.00 O ATOM 2269 CB GLU A 141 -17.052 2.792 11.912 1.00 15.24 C ATOM 2270 CG GLU A 141 -18.138 1.940 11.255 1.00 61.03 C ATOM 2271 CD GLU A 141 -18.564 0.820 12.198 1.00 21.14 C ATOM 2272 OE1 GLU A 141 -19.056 1.131 13.271 1.00 23.12 O ATOM 2273 OE2 GLU A 141 -18.393 -0.331 11.834 1.00 3.54 O ATOM 0 H GLU A 141 -18.555 4.078 10.423 1.00 53.42 H new ATOM 0 HA GLU A 141 -16.013 4.623 11.443 1.00 10.41 H new ATOM 0 HB2 GLU A 141 -16.238 2.155 12.260 1.00 15.24 H new ATOM 0 HB3 GLU A 141 -17.456 3.300 12.788 1.00 15.24 H new ATOM 0 HG2 GLU A 141 -18.997 2.562 11.004 1.00 61.03 H new ATOM 0 HG3 GLU A 141 -17.766 1.519 10.321 1.00 61.03 H new ATOM 2280 N MET A 142 -15.928 2.835 8.758 1.00 4.40 N ATOM 2281 CA MET A 142 -15.033 2.191 7.795 1.00 61.31 C ATOM 2282 C MET A 142 -14.103 3.209 7.154 1.00 43.01 C ATOM 2283 O MET A 142 -13.049 2.861 6.622 1.00 0.32 O ATOM 2284 CB MET A 142 -15.855 1.494 6.717 1.00 2.32 C ATOM 2285 CG MET A 142 -17.026 0.756 7.379 1.00 5.12 C ATOM 2286 SD MET A 142 -17.246 -0.860 6.603 1.00 3.23 S ATOM 2287 CE MET A 142 -15.920 -1.689 7.511 1.00 41.33 C ATOM 0 H MET A 142 -16.874 3.003 8.416 1.00 4.40 H new ATOM 0 HA MET A 142 -14.426 1.457 8.325 1.00 61.31 H new ATOM 0 HB2 MET A 142 -16.228 2.223 5.998 1.00 2.32 H new ATOM 0 HB3 MET A 142 -15.232 0.791 6.164 1.00 2.32 H new ATOM 0 HG2 MET A 142 -16.836 0.635 8.445 1.00 5.12 H new ATOM 0 HG3 MET A 142 -17.939 1.343 7.283 1.00 5.12 H new ATOM 0 HE1 MET A 142 -15.703 -2.649 7.042 1.00 41.33 H new ATOM 0 HE2 MET A 142 -15.025 -1.067 7.496 1.00 41.33 H new ATOM 0 HE3 MET A 142 -16.232 -1.851 8.543 1.00 41.33 H new ATOM 2297 N VAL A 143 -14.503 4.468 7.225 1.00 64.53 N ATOM 2298 CA VAL A 143 -13.707 5.560 6.667 1.00 14.22 C ATOM 2299 C VAL A 143 -13.402 6.570 7.772 1.00 14.35 C ATOM 2300 O VAL A 143 -14.314 7.079 8.425 1.00 2.04 O ATOM 2301 CB VAL A 143 -14.475 6.211 5.507 1.00 64.42 C ATOM 2302 CG1 VAL A 143 -15.537 7.172 6.047 1.00 63.32 C ATOM 2303 CG2 VAL A 143 -13.499 6.970 4.602 1.00 15.42 C ATOM 0 H VAL A 143 -15.375 4.764 7.663 1.00 64.53 H new ATOM 0 HA VAL A 143 -12.762 5.182 6.276 1.00 14.22 H new ATOM 0 HB VAL A 143 -14.970 5.430 4.929 1.00 64.42 H new ATOM 0 HG11 VAL A 143 -16.074 7.626 5.214 1.00 63.32 H new ATOM 0 HG12 VAL A 143 -16.239 6.623 6.675 1.00 63.32 H new ATOM 0 HG13 VAL A 143 -15.056 7.952 6.637 1.00 63.32 H new ATOM 0 HG21 VAL A 143 -14.048 7.430 3.780 1.00 15.42 H new ATOM 0 HG22 VAL A 143 -12.994 7.744 5.180 1.00 15.42 H new ATOM 0 HG23 VAL A 143 -12.760 6.276 4.201 1.00 15.42 H new ATOM 2313 N ALA A 144 -12.112 6.817 8.011 1.00 21.22 N ATOM 2314 CA ALA A 144 -11.696 7.727 9.083 1.00 22.10 C ATOM 2315 C ALA A 144 -10.941 8.951 8.558 1.00 31.53 C ATOM 2316 O ALA A 144 -9.865 8.824 7.970 1.00 10.11 O ATOM 2317 CB ALA A 144 -10.787 6.961 10.060 1.00 35.50 C ATOM 0 H ALA A 144 -11.343 6.404 7.483 1.00 21.22 H new ATOM 0 HA ALA A 144 -12.598 8.087 9.578 1.00 22.10 H new ATOM 0 HB1 ALA A 144 -10.471 7.628 10.862 1.00 35.50 H new ATOM 0 HB2 ALA A 144 -11.335 6.119 10.483 1.00 35.50 H new ATOM 0 HB3 ALA A 144 -9.910 6.592 9.528 1.00 35.50 H new ATOM 2323 N MET A 145 -11.507 10.141 8.790 1.00 34.32 N ATOM 2324 CA MET A 145 -10.870 11.376 8.359 1.00 63.14 C ATOM 2325 C MET A 145 -9.789 11.737 9.374 1.00 14.24 C ATOM 2326 O MET A 145 -9.923 11.417 10.555 1.00 64.15 O ATOM 2327 CB MET A 145 -11.907 12.515 8.255 1.00 23.12 C ATOM 2328 CG MET A 145 -13.327 11.952 7.999 1.00 13.52 C ATOM 2329 SD MET A 145 -14.030 12.716 6.518 1.00 53.13 S ATOM 2330 CE MET A 145 -13.183 11.685 5.289 1.00 63.10 C ATOM 0 H MET A 145 -12.398 10.268 9.270 1.00 34.32 H new ATOM 0 HA MET A 145 -10.427 11.238 7.373 1.00 63.14 H new ATOM 0 HB2 MET A 145 -11.904 13.099 9.175 1.00 23.12 H new ATOM 0 HB3 MET A 145 -11.629 13.192 7.447 1.00 23.12 H new ATOM 0 HG2 MET A 145 -13.282 10.870 7.875 1.00 13.52 H new ATOM 0 HG3 MET A 145 -13.967 12.148 8.859 1.00 13.52 H new ATOM 0 HE1 MET A 145 -12.478 12.296 4.725 1.00 63.10 H new ATOM 0 HE2 MET A 145 -12.644 10.884 5.795 1.00 63.10 H new ATOM 0 HE3 MET A 145 -13.917 11.255 4.607 1.00 63.10 H new ATOM 2340 N LEU A 146 -8.693 12.348 8.912 1.00 12.01 N ATOM 2341 CA LEU A 146 -7.589 12.671 9.795 1.00 23.41 C ATOM 2342 C LEU A 146 -7.389 14.191 9.965 1.00 21.43 C ATOM 2343 O LEU A 146 -7.424 14.941 8.990 1.00 31.13 O ATOM 2344 CB LEU A 146 -6.333 12.011 9.193 1.00 10.10 C ATOM 2345 CG LEU A 146 -5.532 11.304 10.278 1.00 33.14 C ATOM 2346 CD1 LEU A 146 -6.392 10.284 11.042 1.00 44.05 C ATOM 2347 CD2 LEU A 146 -4.347 10.582 9.656 1.00 0.12 C ATOM 0 H LEU A 146 -8.556 12.623 7.939 1.00 12.01 H new ATOM 0 HA LEU A 146 -7.795 12.294 10.797 1.00 23.41 H new ATOM 0 HB2 LEU A 146 -6.624 11.296 8.423 1.00 10.10 H new ATOM 0 HB3 LEU A 146 -5.714 12.767 8.709 1.00 10.10 H new ATOM 0 HG LEU A 146 -5.187 12.062 10.981 1.00 33.14 H new ATOM 0 HD11 LEU A 146 -5.787 9.799 11.808 1.00 44.05 H new ATOM 0 HD12 LEU A 146 -7.231 10.796 11.513 1.00 44.05 H new ATOM 0 HD13 LEU A 146 -6.768 9.533 10.348 1.00 44.05 H new ATOM 0 HD21 LEU A 146 -3.777 10.078 10.437 1.00 0.12 H new ATOM 0 HD22 LEU A 146 -4.706 9.846 8.936 1.00 0.12 H new ATOM 0 HD23 LEU A 146 -3.707 11.304 9.148 1.00 0.12 H new ATOM 2359 N PRO A 147 -7.177 14.650 11.192 1.00 74.32 N ATOM 2360 CA PRO A 147 -6.962 16.106 11.509 1.00 13.22 C ATOM 2361 C PRO A 147 -5.572 16.610 11.109 1.00 62.42 C ATOM 2362 O PRO A 147 -4.624 15.833 11.012 1.00 32.22 O ATOM 2363 CB PRO A 147 -7.121 16.146 13.030 1.00 50.41 C ATOM 2364 CG PRO A 147 -6.621 14.818 13.472 1.00 23.44 C ATOM 2365 CD PRO A 147 -7.126 13.837 12.430 1.00 75.41 C ATOM 0 HA PRO A 147 -7.654 16.747 10.962 1.00 13.22 H new ATOM 0 HB2 PRO A 147 -6.544 16.958 13.472 1.00 50.41 H new ATOM 0 HB3 PRO A 147 -8.160 16.299 13.320 1.00 50.41 H new ATOM 0 HG2 PRO A 147 -5.533 14.806 13.530 1.00 23.44 H new ATOM 0 HG3 PRO A 147 -6.995 14.566 14.464 1.00 23.44 H new ATOM 0 HD2 PRO A 147 -6.456 12.984 12.323 1.00 75.41 H new ATOM 0 HD3 PRO A 147 -8.107 13.442 12.692 1.00 75.41 H new ATOM 2373 N ARG A 148 -5.471 17.920 10.885 1.00 54.23 N ATOM 2374 CA ARG A 148 -4.208 18.551 10.492 1.00 1.22 C ATOM 2375 C ARG A 148 -3.132 18.418 11.567 1.00 0.43 C ATOM 2376 O ARG A 148 -1.963 18.707 11.309 1.00 13.04 O ATOM 2377 CB ARG A 148 -4.443 20.037 10.212 1.00 51.40 C ATOM 2378 CG ARG A 148 -5.017 20.706 11.464 1.00 43.21 C ATOM 2379 CD ARG A 148 -5.349 22.173 11.170 1.00 35.10 C ATOM 2380 NE ARG A 148 -4.147 22.997 11.282 1.00 62.22 N ATOM 2381 CZ ARG A 148 -3.363 23.232 10.232 1.00 1.20 C ATOM 2382 NH1 ARG A 148 -3.657 22.727 9.065 1.00 52.02 N ATOM 2383 NH2 ARG A 148 -2.297 23.973 10.369 1.00 12.35 N ATOM 0 H ARG A 148 -6.253 18.570 10.969 1.00 54.23 H new ATOM 0 HA ARG A 148 -3.856 18.037 9.597 1.00 1.22 H new ATOM 0 HB2 ARG A 148 -3.507 20.517 9.927 1.00 51.40 H new ATOM 0 HB3 ARG A 148 -5.131 20.156 9.375 1.00 51.40 H new ATOM 0 HG2 ARG A 148 -5.915 20.180 11.788 1.00 43.21 H new ATOM 0 HG3 ARG A 148 -4.298 20.644 12.281 1.00 43.21 H new ATOM 0 HD2 ARG A 148 -5.769 22.264 10.168 1.00 35.10 H new ATOM 0 HD3 ARG A 148 -6.108 22.528 11.867 1.00 35.10 H new ATOM 0 HE ARG A 148 -3.903 23.402 12.186 1.00 62.22 H new ATOM 0 HH11 ARG A 148 -4.490 22.150 8.955 1.00 52.02 H new ATOM 0 HH12 ARG A 148 -3.053 22.910 8.263 1.00 52.02 H new ATOM 0 HH21 ARG A 148 -2.066 24.371 11.279 1.00 12.35 H new ATOM 0 HH22 ARG A 148 -1.695 24.154 9.566 1.00 12.35 H new ATOM 2397 N GLN A 149 -3.520 17.998 12.767 1.00 64.01 N ATOM 2398 CA GLN A 149 -2.558 17.853 13.863 1.00 11.12 C ATOM 2399 C GLN A 149 -1.219 17.328 13.342 1.00 23.43 C ATOM 2400 O GLN A 149 -1.161 16.276 12.705 1.00 1.45 O ATOM 2401 CB GLN A 149 -3.109 16.900 14.924 1.00 63.41 C ATOM 2402 CG GLN A 149 -2.241 16.975 16.182 1.00 22.32 C ATOM 2403 CD GLN A 149 -2.450 18.314 16.881 1.00 72.30 C ATOM 2404 OE1 GLN A 149 -1.488 18.938 17.331 1.00 52.21 O ATOM 2405 NE2 GLN A 149 -3.657 18.797 17.000 1.00 51.13 N ATOM 0 H GLN A 149 -4.481 17.754 13.007 1.00 64.01 H new ATOM 0 HA GLN A 149 -2.398 18.834 14.309 1.00 11.12 H new ATOM 0 HB2 GLN A 149 -4.139 17.164 15.164 1.00 63.41 H new ATOM 0 HB3 GLN A 149 -3.122 15.880 14.539 1.00 63.41 H new ATOM 0 HG2 GLN A 149 -2.495 16.159 16.858 1.00 22.32 H new ATOM 0 HG3 GLN A 149 -1.191 16.854 15.917 1.00 22.32 H new ATOM 0 HE21 GLN A 149 -4.453 18.279 16.627 1.00 51.13 H new ATOM 0 HE22 GLN A 149 -3.804 19.692 17.466 1.00 51.13 H new ATOM 2414 N GLU A 150 -0.148 18.076 13.605 1.00 42.02 N ATOM 2415 CA GLU A 150 1.189 17.689 13.149 1.00 71.13 C ATOM 2416 C GLU A 150 2.158 17.581 14.323 1.00 22.12 C ATOM 2417 O GLU A 150 2.259 18.492 15.146 1.00 71.23 O ATOM 2418 CB GLU A 150 1.712 18.723 12.150 1.00 34.32 C ATOM 2419 CG GLU A 150 1.926 20.063 12.859 1.00 13.13 C ATOM 2420 CD GLU A 150 2.070 21.180 11.831 1.00 52.33 C ATOM 2421 OE1 GLU A 150 2.226 20.866 10.662 1.00 3.52 O ATOM 2422 OE2 GLU A 150 2.022 22.333 12.227 1.00 32.34 O ATOM 0 H GLU A 150 -0.178 18.950 14.129 1.00 42.02 H new ATOM 0 HA GLU A 150 1.117 16.713 12.669 1.00 71.13 H new ATOM 0 HB2 GLU A 150 2.649 18.378 11.712 1.00 34.32 H new ATOM 0 HB3 GLU A 150 1.003 18.843 11.331 1.00 34.32 H new ATOM 0 HG2 GLU A 150 1.085 20.272 13.520 1.00 13.13 H new ATOM 0 HG3 GLU A 150 2.818 20.015 13.483 1.00 13.13 H new ATOM 2429 N GLU A 151 2.876 16.461 14.385 1.00 4.03 N ATOM 2430 CA GLU A 151 3.850 16.228 15.451 1.00 52.44 C ATOM 2431 C GLU A 151 5.249 16.111 14.854 1.00 73.51 C ATOM 2432 O GLU A 151 6.240 16.478 15.485 1.00 3.50 O ATOM 2433 CB GLU A 151 3.505 14.941 16.203 1.00 72.13 C ATOM 2434 CG GLU A 151 2.122 15.076 16.840 1.00 41.50 C ATOM 2435 CD GLU A 151 2.148 16.151 17.922 1.00 14.22 C ATOM 2436 OE1 GLU A 151 3.233 16.499 18.357 1.00 62.43 O ATOM 2437 OE2 GLU A 151 1.083 16.611 18.299 1.00 41.41 O ATOM 0 H GLU A 151 2.802 15.700 13.710 1.00 4.03 H new ATOM 0 HA GLU A 151 3.822 17.067 16.146 1.00 52.44 H new ATOM 0 HB2 GLU A 151 3.520 14.093 15.519 1.00 72.13 H new ATOM 0 HB3 GLU A 151 4.253 14.745 16.971 1.00 72.13 H new ATOM 0 HG2 GLU A 151 1.385 15.333 16.079 1.00 41.50 H new ATOM 0 HG3 GLU A 151 1.816 14.122 17.271 1.00 41.50 H new ATOM 2444 N CYS A 152 5.313 15.602 13.627 1.00 54.01 N ATOM 2445 CA CYS A 152 6.585 15.437 12.927 1.00 34.43 C ATOM 2446 C CYS A 152 6.415 15.797 11.453 1.00 75.51 C ATOM 2447 O CYS A 152 5.296 15.850 10.942 1.00 62.32 O ATOM 2448 CB CYS A 152 7.075 13.987 13.061 1.00 0.24 C ATOM 2449 SG CYS A 152 8.221 13.854 14.457 1.00 44.10 S ATOM 0 H CYS A 152 4.498 15.296 13.095 1.00 54.01 H new ATOM 0 HA CYS A 152 7.325 16.101 13.373 1.00 34.43 H new ATOM 0 HB2 CYS A 152 6.227 13.319 13.210 1.00 0.24 H new ATOM 0 HB3 CYS A 152 7.570 13.674 12.141 1.00 0.24 H new ATOM 2454 N THR A 153 7.532 16.046 10.776 1.00 75.14 N ATOM 2455 CA THR A 153 7.497 16.402 9.361 1.00 22.23 C ATOM 2456 C THR A 153 8.791 15.977 8.674 1.00 50.03 C ATOM 2457 O THR A 153 9.805 15.744 9.333 1.00 31.11 O ATOM 2458 CB THR A 153 7.297 17.912 9.208 1.00 71.11 C ATOM 2459 OG1 THR A 153 8.311 18.597 9.930 1.00 5.13 O ATOM 2460 CG2 THR A 153 5.922 18.308 9.755 1.00 31.04 C ATOM 0 H THR A 153 8.467 16.008 11.181 1.00 75.14 H new ATOM 0 HA THR A 153 6.664 15.881 8.890 1.00 22.23 H new ATOM 0 HB THR A 153 7.355 18.181 8.153 1.00 71.11 H new ATOM 0 HG1 THR A 153 8.186 19.564 9.832 1.00 5.13 H new ATOM 0 HG21 THR A 153 5.783 19.383 9.645 1.00 31.04 H new ATOM 0 HG22 THR A 153 5.145 17.782 9.200 1.00 31.04 H new ATOM 0 HG23 THR A 153 5.859 18.040 10.810 1.00 31.04 H new ATOM 2468 N VAL A 154 8.751 15.875 7.346 1.00 43.53 N ATOM 2469 CA VAL A 154 9.929 15.475 6.578 1.00 13.03 C ATOM 2470 C VAL A 154 10.564 16.685 5.909 1.00 70.14 C ATOM 2471 O VAL A 154 9.937 17.732 5.748 1.00 41.12 O ATOM 2472 CB VAL A 154 9.543 14.423 5.527 1.00 11.05 C ATOM 2473 CG1 VAL A 154 8.194 14.785 4.904 1.00 73.42 C ATOM 2474 CG2 VAL A 154 10.604 14.338 4.419 1.00 75.21 C ATOM 0 H VAL A 154 7.921 16.062 6.783 1.00 43.53 H new ATOM 0 HA VAL A 154 10.658 15.037 7.260 1.00 13.03 H new ATOM 0 HB VAL A 154 9.476 13.455 6.024 1.00 11.05 H new ATOM 0 HG11 VAL A 154 7.924 14.036 4.159 1.00 73.42 H new ATOM 0 HG12 VAL A 154 7.431 14.815 5.681 1.00 73.42 H new ATOM 0 HG13 VAL A 154 8.264 15.762 4.427 1.00 73.42 H new ATOM 0 HG21 VAL A 154 10.307 13.586 3.688 1.00 75.21 H new ATOM 0 HG22 VAL A 154 10.695 15.307 3.927 1.00 75.21 H new ATOM 0 HG23 VAL A 154 11.564 14.061 4.855 1.00 75.21 H new ATOM 2484 N ASP A 155 11.819 16.516 5.524 1.00 53.10 N ATOM 2485 CA ASP A 155 12.578 17.578 4.865 1.00 33.15 C ATOM 2486 C ASP A 155 12.841 17.236 3.412 1.00 24.14 C ATOM 2487 O ASP A 155 12.653 16.102 2.972 1.00 1.22 O ATOM 2488 CB ASP A 155 13.909 17.823 5.571 1.00 73.41 C ATOM 2489 CG ASP A 155 14.755 18.821 4.785 1.00 20.14 C ATOM 2490 OD1 ASP A 155 15.401 18.403 3.839 1.00 61.10 O ATOM 2491 OD2 ASP A 155 14.746 19.987 5.143 1.00 21.31 O ATOM 0 H ASP A 155 12.340 15.649 5.656 1.00 53.10 H new ATOM 0 HA ASP A 155 11.975 18.485 4.917 1.00 33.15 H new ATOM 0 HB2 ASP A 155 13.729 18.202 6.577 1.00 73.41 H new ATOM 0 HB3 ASP A 155 14.450 16.883 5.677 1.00 73.41 H new