USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1106 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 57 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 59 SER OG : rot 180:sc= 0.0421 USER MOD Set 2.1: A 45 LYS NZ :NH3+ 140:sc= -0.267 (180deg=-0.854) USER MOD Set 2.2: A 66 ASN : amide:sc= -1.8! C(o=-2.1!,f=-4.1!) USER MOD Set 3.1: A 36 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 27 THR OG1 : rot 180:sc= -0.0107 USER MOD Set 4.2: A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 9 GLN : amide:sc= -0.247 K(o=-0.88,f=-3.2) USER MOD Set 5.2: A 32 ASN : amide:sc= -0.628 K(o=-0.88,f=-1.7!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0443 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot -87:sc= 1.3 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 31 MET CE :methyl -113:sc= -5.68 (180deg=-11.4!) USER MOD Single : A 38 MET CE :methyl -159:sc= -4.49 (180deg=-5.57!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 144:sc= -0.28 (180deg=-1.5) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 153:sc= -0.0705 (180deg=-0.374) USER MOD Single : A 51 LYS NZ :NH3+ -136:sc= -1.03 (180deg=-3.65!) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.168 USER MOD Single : A 53 ASN : amide:sc= -0.111 K(o=-0.11,f=-1.1) USER MOD Single : A 54 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0557) USER MOD Single : A 55 GLN : amide:sc= -0.212 K(o=-0.21,f=-1.5) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -158:sc= -0.287 (180deg=-1.06) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.00598 USER MOD Single : A 87 THR OG1 : rot 173:sc= -0.662 USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -2.82 X(o=-2.8,f=-3.1) USER MOD Single : A 100 SER OG : rot 103:sc= 0.259 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 74:sc= -0.142 USER MOD Single : A 110 HIS : no HD1:sc= -0.0707 X(o=-0.071,f=-0.071) USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.276 USER MOD Single : A 125 TYR OH : rot -109:sc= 0.885 USER MOD Single : A 126 TYR OH : rot 138:sc= 0.514 USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 7.033 -4.111 -2.390 1.00 45.45 N ATOM 45 CA ILE A 4 7.766 -4.166 -1.132 1.00 22.34 C ATOM 46 C ILE A 4 8.889 -5.196 -1.194 1.00 73.50 C ATOM 47 O ILE A 4 8.902 -6.063 -2.068 1.00 74.32 O ATOM 48 CB ILE A 4 6.835 -4.508 0.047 1.00 65.52 C ATOM 49 CG1 ILE A 4 6.589 -6.017 0.109 1.00 71.31 C ATOM 50 CG2 ILE A 4 5.519 -3.756 -0.082 1.00 25.12 C ATOM 51 CD1 ILE A 4 5.972 -6.581 -1.152 1.00 62.10 C ATOM 0 HA ILE A 4 8.193 -3.176 -0.972 1.00 22.34 H new ATOM 0 HB ILE A 4 7.318 -4.199 0.974 1.00 65.52 H new ATOM 0 HG12 ILE A 4 7.535 -6.524 0.299 1.00 71.31 H new ATOM 0 HG13 ILE A 4 5.935 -6.236 0.953 1.00 71.31 H new ATOM 0 HG21 ILE A 4 4.872 -4.008 0.758 1.00 25.12 H new ATOM 0 HG22 ILE A 4 5.712 -2.683 -0.083 1.00 25.12 H new ATOM 0 HG23 ILE A 4 5.029 -4.037 -1.014 1.00 25.12 H new ATOM 0 HD11 ILE A 4 5.826 -7.655 -1.037 1.00 62.10 H new ATOM 0 HD12 ILE A 4 5.010 -6.101 -1.332 1.00 62.10 H new ATOM 0 HD13 ILE A 4 6.635 -6.394 -1.997 1.00 62.10 H new ATOM 63 N ARG A 5 9.829 -5.097 -0.260 1.00 12.51 N ATOM 64 CA ARG A 5 10.956 -6.020 -0.208 1.00 74.11 C ATOM 65 C ARG A 5 10.474 -7.455 -0.016 1.00 70.22 C ATOM 66 O ARG A 5 9.461 -7.698 0.640 1.00 13.41 O ATOM 67 CB ARG A 5 11.907 -5.634 0.926 1.00 61.21 C ATOM 68 CG ARG A 5 12.858 -4.504 0.565 1.00 33.35 C ATOM 69 CD ARG A 5 12.106 -3.214 0.279 1.00 11.20 C ATOM 70 NE ARG A 5 11.195 -2.859 1.364 1.00 75.04 N ATOM 71 CZ ARG A 5 10.305 -1.875 1.284 1.00 23.41 C ATOM 72 NH1 ARG A 5 10.208 -1.153 0.177 1.00 60.14 N ATOM 73 NH2 ARG A 5 9.510 -1.613 2.314 1.00 65.22 N ATOM 0 H ARG A 5 9.832 -4.386 0.472 1.00 12.51 H new ATOM 0 HA ARG A 5 11.489 -5.957 -1.157 1.00 74.11 H new ATOM 0 HB2 ARG A 5 11.321 -5.340 1.796 1.00 61.21 H new ATOM 0 HB3 ARG A 5 12.489 -6.509 1.215 1.00 61.21 H new ATOM 0 HG2 ARG A 5 13.561 -4.343 1.382 1.00 33.35 H new ATOM 0 HG3 ARG A 5 13.445 -4.786 -0.309 1.00 33.35 H new ATOM 0 HD2 ARG A 5 12.820 -2.405 0.126 1.00 11.20 H new ATOM 0 HD3 ARG A 5 11.542 -3.321 -0.647 1.00 11.20 H new ATOM 0 HE ARG A 5 11.244 -3.395 2.230 1.00 75.04 H new ATOM 0 HH11 ARG A 5 10.817 -1.352 -0.617 1.00 60.14 H new ATOM 0 HH12 ARG A 5 9.524 -0.399 0.118 1.00 60.14 H new ATOM 0 HH21 ARG A 5 9.582 -2.167 3.168 1.00 65.22 H new ATOM 0 HH22 ARG A 5 8.827 -0.858 2.252 1.00 65.22 H new ATOM 87 N ILE A 6 11.206 -8.402 -0.593 1.00 44.33 N ATOM 88 CA ILE A 6 10.854 -9.812 -0.485 1.00 41.01 C ATOM 89 C ILE A 6 11.689 -10.507 0.585 1.00 45.31 C ATOM 90 O ILE A 6 11.218 -11.423 1.259 1.00 54.43 O ATOM 91 CB ILE A 6 11.046 -10.545 -1.826 1.00 52.41 C ATOM 92 CG1 ILE A 6 10.598 -9.654 -2.987 1.00 61.42 C ATOM 93 CG2 ILE A 6 10.274 -11.856 -1.829 1.00 11.45 C ATOM 94 CD1 ILE A 6 11.700 -8.773 -3.533 1.00 31.04 C ATOM 0 H ILE A 6 12.047 -8.218 -1.140 1.00 44.33 H new ATOM 0 HA ILE A 6 9.801 -9.853 -0.205 1.00 41.01 H new ATOM 0 HB ILE A 6 12.105 -10.770 -1.952 1.00 52.41 H new ATOM 0 HG12 ILE A 6 10.215 -10.283 -3.791 1.00 61.42 H new ATOM 0 HG13 ILE A 6 9.772 -9.025 -2.654 1.00 61.42 H new ATOM 0 HG21 ILE A 6 10.420 -12.362 -2.783 1.00 11.45 H new ATOM 0 HG22 ILE A 6 10.635 -12.493 -1.022 1.00 11.45 H new ATOM 0 HG23 ILE A 6 9.213 -11.654 -1.684 1.00 11.45 H new ATOM 0 HD11 ILE A 6 11.311 -8.169 -4.353 1.00 31.04 H new ATOM 0 HD12 ILE A 6 12.067 -8.118 -2.743 1.00 31.04 H new ATOM 0 HD13 ILE A 6 12.517 -9.396 -3.897 1.00 31.04 H new ATOM 106 N VAL A 7 12.933 -10.064 0.737 1.00 4.41 N ATOM 107 CA VAL A 7 13.835 -10.640 1.728 1.00 74.45 C ATOM 108 C VAL A 7 14.897 -9.634 2.156 1.00 33.22 C ATOM 109 O VAL A 7 15.894 -9.416 1.468 1.00 2.13 O ATOM 110 CB VAL A 7 14.529 -11.904 1.186 1.00 62.01 C ATOM 111 CG1 VAL A 7 13.560 -13.076 1.157 1.00 55.42 C ATOM 112 CG2 VAL A 7 15.105 -11.643 -0.198 1.00 31.32 C ATOM 0 H VAL A 7 13.339 -9.308 0.186 1.00 4.41 H new ATOM 0 HA VAL A 7 13.227 -10.910 2.591 1.00 74.45 H new ATOM 0 HB VAL A 7 15.351 -12.161 1.854 1.00 62.01 H new ATOM 0 HG11 VAL A 7 14.069 -13.959 0.771 1.00 55.42 H new ATOM 0 HG12 VAL A 7 13.201 -13.276 2.166 1.00 55.42 H new ATOM 0 HG13 VAL A 7 12.715 -12.834 0.513 1.00 55.42 H new ATOM 0 HG21 VAL A 7 15.592 -12.546 -0.566 1.00 31.32 H new ATOM 0 HG22 VAL A 7 14.302 -11.360 -0.879 1.00 31.32 H new ATOM 0 HG23 VAL A 7 15.834 -10.835 -0.142 1.00 31.32 H new ATOM 122 N PRO A 8 14.680 -9.006 3.321 1.00 2.51 N ATOM 123 CA PRO A 8 15.609 -8.012 3.869 1.00 74.10 C ATOM 124 C PRO A 8 16.917 -8.638 4.338 1.00 64.51 C ATOM 125 O PRO A 8 17.007 -9.854 4.510 1.00 40.22 O ATOM 126 CB PRO A 8 14.841 -7.426 5.056 1.00 13.13 C ATOM 127 CG PRO A 8 13.890 -8.500 5.460 1.00 2.31 C ATOM 128 CD PRO A 8 13.513 -9.216 4.193 1.00 34.43 C ATOM 0 HA PRO A 8 15.900 -7.271 3.124 1.00 74.10 H new ATOM 0 HB2 PRO A 8 15.514 -7.165 5.873 1.00 13.13 H new ATOM 0 HB3 PRO A 8 14.313 -6.515 4.775 1.00 13.13 H new ATOM 0 HG2 PRO A 8 14.353 -9.184 6.172 1.00 2.31 H new ATOM 0 HG3 PRO A 8 13.010 -8.080 5.947 1.00 2.31 H new ATOM 0 HD2 PRO A 8 13.329 -10.276 4.370 1.00 34.43 H new ATOM 0 HD3 PRO A 8 12.604 -8.804 3.754 1.00 34.43 H new ATOM 136 N GLN A 9 17.929 -7.801 4.543 1.00 13.13 N ATOM 137 CA GLN A 9 19.233 -8.274 4.992 1.00 33.24 C ATOM 138 C GLN A 9 19.129 -8.937 6.362 1.00 21.10 C ATOM 139 O GLN A 9 18.097 -8.849 7.029 1.00 45.45 O ATOM 140 CB GLN A 9 20.228 -7.114 5.048 1.00 24.30 C ATOM 141 CG GLN A 9 19.719 -5.912 5.827 1.00 23.43 C ATOM 142 CD GLN A 9 20.836 -4.984 6.263 1.00 33.24 C ATOM 143 OE1 GLN A 9 21.979 -5.122 5.828 1.00 23.53 O ATOM 144 NE2 GLN A 9 20.509 -4.030 7.128 1.00 62.43 N ATOM 0 H GLN A 9 17.871 -6.792 4.405 1.00 13.13 H new ATOM 0 HA GLN A 9 19.589 -9.015 4.276 1.00 33.24 H new ATOM 0 HB2 GLN A 9 21.156 -7.464 5.501 1.00 24.30 H new ATOM 0 HB3 GLN A 9 20.468 -6.802 4.031 1.00 24.30 H new ATOM 0 HG2 GLN A 9 19.011 -5.358 5.211 1.00 23.43 H new ATOM 0 HG3 GLN A 9 19.175 -6.257 6.706 1.00 23.43 H new ATOM 0 HE21 GLN A 9 19.549 -3.952 7.463 1.00 62.43 H new ATOM 0 HE22 GLN A 9 21.218 -3.375 7.457 1.00 62.43 H new ATOM 153 N ILE A 10 20.203 -9.601 6.775 1.00 4.23 N ATOM 154 CA ILE A 10 20.233 -10.278 8.066 1.00 51.22 C ATOM 155 C ILE A 10 21.351 -9.732 8.948 1.00 71.05 C ATOM 156 O ILE A 10 22.527 -9.789 8.586 1.00 53.55 O ATOM 157 CB ILE A 10 20.420 -11.797 7.900 1.00 24.52 C ATOM 158 CG1 ILE A 10 21.537 -12.089 6.895 1.00 34.11 C ATOM 159 CG2 ILE A 10 19.118 -12.447 7.457 1.00 51.42 C ATOM 160 CD1 ILE A 10 21.892 -13.556 6.796 1.00 41.03 C ATOM 0 H ILE A 10 21.064 -9.685 6.235 1.00 4.23 H new ATOM 0 HA ILE A 10 19.272 -10.089 8.544 1.00 51.22 H new ATOM 0 HB ILE A 10 20.704 -12.220 8.864 1.00 24.52 H new ATOM 0 HG12 ILE A 10 21.233 -11.730 5.912 1.00 34.11 H new ATOM 0 HG13 ILE A 10 22.426 -11.527 7.179 1.00 34.11 H new ATOM 0 HG21 ILE A 10 19.267 -13.521 7.344 1.00 51.42 H new ATOM 0 HG22 ILE A 10 18.347 -12.264 8.206 1.00 51.42 H new ATOM 0 HG23 ILE A 10 18.805 -12.022 6.503 1.00 51.42 H new ATOM 0 HD11 ILE A 10 22.690 -13.689 6.066 1.00 41.03 H new ATOM 0 HD12 ILE A 10 22.227 -13.916 7.769 1.00 41.03 H new ATOM 0 HD13 ILE A 10 21.015 -14.122 6.482 1.00 41.03 H new ATOM 172 N THR A 11 20.977 -9.204 10.109 1.00 22.31 N ATOM 173 CA THR A 11 21.948 -8.649 11.044 1.00 54.32 C ATOM 174 C THR A 11 22.551 -9.738 11.923 1.00 74.53 C ATOM 175 O THR A 11 22.360 -10.928 11.671 1.00 35.54 O ATOM 176 CB THR A 11 21.309 -7.574 11.944 1.00 43.13 C ATOM 177 OG1 THR A 11 19.999 -7.249 11.465 1.00 21.54 O ATOM 178 CG2 THR A 11 22.167 -6.318 11.979 1.00 62.13 C ATOM 0 H THR A 11 20.009 -9.149 10.424 1.00 22.31 H new ATOM 0 HA THR A 11 22.736 -8.191 10.446 1.00 54.32 H new ATOM 0 HB THR A 11 21.237 -7.975 12.955 1.00 43.13 H new ATOM 0 HG1 THR A 11 19.599 -6.566 12.043 1.00 21.54 H new ATOM 0 HG21 THR A 11 21.696 -5.573 12.620 1.00 62.13 H new ATOM 0 HG22 THR A 11 23.154 -6.563 12.371 1.00 62.13 H new ATOM 0 HG23 THR A 11 22.267 -5.917 10.970 1.00 62.13 H new ATOM 186 N ASP A 12 23.278 -9.325 12.954 1.00 5.21 N ATOM 187 CA ASP A 12 23.908 -10.267 13.872 1.00 4.41 C ATOM 188 C ASP A 12 22.858 -11.089 14.612 1.00 21.30 C ATOM 189 O ASP A 12 23.157 -12.156 15.148 1.00 53.10 O ATOM 190 CB ASP A 12 24.790 -9.522 14.875 1.00 3.53 C ATOM 191 CG ASP A 12 25.908 -10.389 15.419 1.00 4.13 C ATOM 192 OD1 ASP A 12 26.750 -10.845 14.617 1.00 71.11 O ATOM 193 OD2 ASP A 12 25.943 -10.611 16.648 1.00 55.25 O ATOM 0 H ASP A 12 23.446 -8.344 13.176 1.00 5.21 H new ATOM 0 HA ASP A 12 24.529 -10.946 13.288 1.00 4.41 H new ATOM 0 HB2 ASP A 12 25.218 -8.642 14.395 1.00 3.53 H new ATOM 0 HB3 ASP A 12 24.175 -9.167 15.702 1.00 3.53 H new ATOM 198 N GLU A 13 21.628 -10.585 14.637 1.00 5.23 N ATOM 199 CA GLU A 13 20.535 -11.273 15.314 1.00 40.25 C ATOM 200 C GLU A 13 19.967 -12.385 14.437 1.00 64.42 C ATOM 201 O GLU A 13 19.462 -13.389 14.940 1.00 44.54 O ATOM 202 CB GLU A 13 19.428 -10.282 15.679 1.00 0.13 C ATOM 203 CG GLU A 13 19.945 -8.992 16.293 1.00 13.43 C ATOM 204 CD GLU A 13 18.827 -8.048 16.694 1.00 4.02 C ATOM 205 OE1 GLU A 13 18.254 -8.239 17.787 1.00 73.30 O ATOM 206 OE2 GLU A 13 18.527 -7.119 15.916 1.00 74.10 O ATOM 0 H GLU A 13 21.364 -9.704 14.197 1.00 5.23 H new ATOM 0 HA GLU A 13 20.930 -11.719 16.227 1.00 40.25 H new ATOM 0 HB2 GLU A 13 18.855 -10.044 14.783 1.00 0.13 H new ATOM 0 HB3 GLU A 13 18.742 -10.758 16.379 1.00 0.13 H new ATOM 0 HG2 GLU A 13 20.549 -9.227 17.169 1.00 13.43 H new ATOM 0 HG3 GLU A 13 20.600 -8.491 15.580 1.00 13.43 H new ATOM 213 N GLU A 14 20.054 -12.199 13.123 1.00 4.45 N ATOM 214 CA GLU A 14 19.548 -13.186 12.177 1.00 2.40 C ATOM 215 C GLU A 14 20.663 -14.122 11.719 1.00 51.32 C ATOM 216 O GLU A 14 20.433 -15.306 11.475 1.00 71.33 O ATOM 217 CB GLU A 14 18.922 -12.490 10.967 1.00 53.03 C ATOM 218 CG GLU A 14 17.754 -11.585 11.322 1.00 40.12 C ATOM 219 CD GLU A 14 16.591 -12.345 11.930 1.00 2.43 C ATOM 220 OE1 GLU A 14 15.713 -12.797 11.165 1.00 5.44 O ATOM 221 OE2 GLU A 14 16.559 -12.487 13.170 1.00 14.24 O ATOM 0 H GLU A 14 20.470 -11.374 12.690 1.00 4.45 H new ATOM 0 HA GLU A 14 18.785 -13.778 12.682 1.00 2.40 H new ATOM 0 HB2 GLU A 14 19.687 -11.900 10.462 1.00 53.03 H new ATOM 0 HB3 GLU A 14 18.583 -13.246 10.259 1.00 53.03 H new ATOM 0 HG2 GLU A 14 18.091 -10.822 12.023 1.00 40.12 H new ATOM 0 HG3 GLU A 14 17.415 -11.067 10.425 1.00 40.12 H new ATOM 228 N PHE A 15 21.871 -13.581 11.604 1.00 64.14 N ATOM 229 CA PHE A 15 23.022 -14.366 11.173 1.00 23.43 C ATOM 230 C PHE A 15 23.454 -15.342 12.264 1.00 11.24 C ATOM 231 O PHE A 15 23.923 -16.444 11.979 1.00 43.44 O ATOM 232 CB PHE A 15 24.188 -13.445 10.808 1.00 55.45 C ATOM 233 CG PHE A 15 25.499 -14.163 10.668 1.00 2.13 C ATOM 234 CD1 PHE A 15 26.320 -14.354 11.768 1.00 13.03 C ATOM 235 CD2 PHE A 15 25.912 -14.646 9.437 1.00 20.52 C ATOM 236 CE1 PHE A 15 27.527 -15.015 11.644 1.00 43.13 C ATOM 237 CE2 PHE A 15 27.118 -15.308 9.307 1.00 62.54 C ATOM 238 CZ PHE A 15 27.927 -15.492 10.411 1.00 44.21 C ATOM 0 H PHE A 15 22.079 -12.602 11.803 1.00 64.14 H new ATOM 0 HA PHE A 15 22.730 -14.938 10.292 1.00 23.43 H new ATOM 0 HB2 PHE A 15 23.959 -12.937 9.871 1.00 55.45 H new ATOM 0 HB3 PHE A 15 24.285 -12.675 11.573 1.00 55.45 H new ATOM 0 HD1 PHE A 15 26.013 -13.982 12.734 1.00 13.03 H new ATOM 0 HD2 PHE A 15 25.285 -14.504 8.570 1.00 20.52 H new ATOM 0 HE1 PHE A 15 28.157 -15.158 12.510 1.00 43.13 H new ATOM 0 HE2 PHE A 15 27.428 -15.681 8.342 1.00 62.54 H new ATOM 0 HZ PHE A 15 28.871 -16.008 10.310 1.00 44.21 H new ATOM 248 N LYS A 16 23.292 -14.928 13.517 1.00 61.52 N ATOM 249 CA LYS A 16 23.663 -15.764 14.653 1.00 44.23 C ATOM 250 C LYS A 16 22.772 -16.999 14.734 1.00 23.10 C ATOM 251 O LYS A 16 23.054 -17.933 15.486 1.00 63.14 O ATOM 252 CB LYS A 16 23.565 -14.964 15.954 1.00 72.21 C ATOM 253 CG LYS A 16 22.143 -14.582 16.327 1.00 72.13 C ATOM 254 CD LYS A 16 22.085 -13.905 17.686 1.00 65.12 C ATOM 255 CE LYS A 16 22.305 -14.901 18.814 1.00 1.13 C ATOM 256 NZ LYS A 16 23.108 -14.315 19.923 1.00 42.31 N ATOM 0 H LYS A 16 22.906 -14.019 13.771 1.00 61.52 H new ATOM 0 HA LYS A 16 24.693 -16.091 14.511 1.00 44.23 H new ATOM 0 HB2 LYS A 16 24.000 -15.549 16.764 1.00 72.21 H new ATOM 0 HB3 LYS A 16 24.163 -14.058 15.859 1.00 72.21 H new ATOM 0 HG2 LYS A 16 21.734 -13.914 15.569 1.00 72.13 H new ATOM 0 HG3 LYS A 16 21.517 -15.474 16.337 1.00 72.13 H new ATOM 0 HD2 LYS A 16 22.843 -13.123 17.737 1.00 65.12 H new ATOM 0 HD3 LYS A 16 21.117 -13.420 17.811 1.00 65.12 H new ATOM 0 HE2 LYS A 16 21.341 -15.232 19.199 1.00 1.13 H new ATOM 0 HE3 LYS A 16 22.813 -15.784 18.425 1.00 1.13 H new ATOM 0 HZ1 LYS A 16 23.236 -15.025 20.672 1.00 42.31 H new ATOM 0 HZ2 LYS A 16 24.038 -14.022 19.561 1.00 42.31 H new ATOM 0 HZ3 LYS A 16 22.612 -13.488 20.311 1.00 42.31 H new ATOM 270 N THR A 17 21.695 -16.999 13.954 1.00 3.14 N ATOM 271 CA THR A 17 20.763 -18.119 13.938 1.00 24.21 C ATOM 272 C THR A 17 21.327 -19.292 13.144 1.00 3.02 C ATOM 273 O THR A 17 20.751 -20.380 13.133 1.00 21.21 O ATOM 274 CB THR A 17 19.406 -17.712 13.336 1.00 55.33 C ATOM 275 OG1 THR A 17 19.492 -17.686 11.907 1.00 54.14 O ATOM 276 CG2 THR A 17 18.974 -16.346 13.848 1.00 45.44 C ATOM 0 H THR A 17 21.447 -16.235 13.325 1.00 3.14 H new ATOM 0 HA THR A 17 20.616 -18.422 14.975 1.00 24.21 H new ATOM 0 HB THR A 17 18.663 -18.448 13.642 1.00 55.33 H new ATOM 0 HG1 THR A 17 19.811 -16.807 11.614 1.00 54.14 H new ATOM 0 HG21 THR A 17 18.013 -16.080 13.409 1.00 45.44 H new ATOM 0 HG22 THR A 17 18.881 -16.377 14.934 1.00 45.44 H new ATOM 0 HG23 THR A 17 19.719 -15.601 13.569 1.00 45.44 H new ATOM 284 N ILE A 18 22.456 -19.064 12.482 1.00 43.31 N ATOM 285 CA ILE A 18 23.098 -20.103 11.687 1.00 45.02 C ATOM 286 C ILE A 18 24.410 -20.550 12.323 1.00 20.42 C ATOM 287 O ILE A 18 25.335 -19.762 12.519 1.00 53.50 O ATOM 288 CB ILE A 18 23.376 -19.622 10.250 1.00 33.22 C ATOM 289 CG1 ILE A 18 22.071 -19.208 9.567 1.00 12.21 C ATOM 290 CG2 ILE A 18 24.074 -20.713 9.452 1.00 5.22 C ATOM 291 CD1 ILE A 18 21.991 -17.728 9.263 1.00 65.12 C ATOM 0 H ILE A 18 22.945 -18.169 12.480 1.00 43.31 H new ATOM 0 HA ILE A 18 22.407 -20.945 11.653 1.00 45.02 H new ATOM 0 HB ILE A 18 24.033 -18.754 10.294 1.00 33.22 H new ATOM 0 HG12 ILE A 18 21.963 -19.768 8.638 1.00 12.21 H new ATOM 0 HG13 ILE A 18 21.232 -19.485 10.206 1.00 12.21 H new ATOM 0 HG21 ILE A 18 24.264 -20.358 8.439 1.00 5.22 H new ATOM 0 HG22 ILE A 18 25.020 -20.966 9.931 1.00 5.22 H new ATOM 0 HG23 ILE A 18 23.439 -21.598 9.413 1.00 5.22 H new ATOM 0 HD11 ILE A 18 21.039 -17.507 8.780 1.00 65.12 H new ATOM 0 HD12 ILE A 18 22.067 -17.161 10.191 1.00 65.12 H new ATOM 0 HD13 ILE A 18 22.809 -17.448 8.599 1.00 65.12 H new ATOM 303 N PRO A 19 24.495 -21.848 12.653 1.00 44.21 N ATOM 304 CA PRO A 19 25.690 -22.431 13.270 1.00 45.21 C ATOM 305 C PRO A 19 26.868 -22.498 12.303 1.00 32.11 C ATOM 306 O PRO A 19 26.684 -22.543 11.087 1.00 51.15 O ATOM 307 CB PRO A 19 25.237 -23.840 13.659 1.00 1.03 C ATOM 308 CG PRO A 19 24.124 -24.153 12.720 1.00 14.33 C ATOM 309 CD PRO A 19 23.432 -22.846 12.448 1.00 11.53 C ATOM 0 HA PRO A 19 26.046 -21.836 14.111 1.00 45.21 H new ATOM 0 HB2 PRO A 19 26.051 -24.558 13.562 1.00 1.03 H new ATOM 0 HB3 PRO A 19 24.902 -23.876 14.696 1.00 1.03 H new ATOM 0 HG2 PRO A 19 24.504 -24.593 11.798 1.00 14.33 H new ATOM 0 HG3 PRO A 19 23.435 -24.875 13.158 1.00 14.33 H new ATOM 0 HD2 PRO A 19 23.033 -22.806 11.434 1.00 11.53 H new ATOM 0 HD3 PRO A 19 22.594 -22.686 13.127 1.00 11.53 H new ATOM 317 N LYS A 20 28.078 -22.505 12.851 1.00 30.55 N ATOM 318 CA LYS A 20 29.287 -22.569 12.038 1.00 34.33 C ATOM 319 C LYS A 20 29.275 -23.803 11.142 1.00 74.23 C ATOM 320 O LYS A 20 29.873 -23.806 10.066 1.00 61.33 O ATOM 321 CB LYS A 20 30.528 -22.588 12.933 1.00 32.34 C ATOM 322 CG LYS A 20 30.615 -23.814 13.827 1.00 51.35 C ATOM 323 CD LYS A 20 31.457 -23.544 15.063 1.00 74.25 C ATOM 324 CE LYS A 20 32.943 -23.671 14.764 1.00 55.05 C ATOM 325 NZ LYS A 20 33.422 -25.072 14.918 1.00 31.41 N ATOM 0 H LYS A 20 28.248 -22.467 13.856 1.00 30.55 H new ATOM 0 HA LYS A 20 29.317 -21.682 11.405 1.00 34.33 H new ATOM 0 HB2 LYS A 20 31.418 -22.542 12.306 1.00 32.34 H new ATOM 0 HB3 LYS A 20 30.530 -21.694 13.556 1.00 32.34 H new ATOM 0 HG2 LYS A 20 29.612 -24.118 14.128 1.00 51.35 H new ATOM 0 HG3 LYS A 20 31.045 -24.644 13.267 1.00 51.35 H new ATOM 0 HD2 LYS A 20 31.244 -22.543 15.438 1.00 74.25 H new ATOM 0 HD3 LYS A 20 31.182 -24.244 15.852 1.00 74.25 H new ATOM 0 HE2 LYS A 20 33.139 -23.330 13.748 1.00 55.05 H new ATOM 0 HE3 LYS A 20 33.505 -23.019 15.433 1.00 55.05 H new ATOM 0 HZ1 LYS A 20 34.439 -25.116 14.706 1.00 31.41 H new ATOM 0 HZ2 LYS A 20 33.258 -25.390 15.895 1.00 31.41 H new ATOM 0 HZ3 LYS A 20 32.904 -25.690 14.261 1.00 31.41 H new ATOM 339 N TYR A 21 28.589 -24.848 11.591 1.00 70.42 N ATOM 340 CA TYR A 21 28.500 -26.089 10.829 1.00 0.42 C ATOM 341 C TYR A 21 27.799 -25.859 9.494 1.00 51.21 C ATOM 342 O TYR A 21 27.906 -26.673 8.577 1.00 52.40 O ATOM 343 CB TYR A 21 27.752 -27.153 11.634 1.00 64.32 C ATOM 344 CG TYR A 21 28.532 -27.674 12.820 1.00 11.12 C ATOM 345 CD1 TYR A 21 29.440 -28.716 12.677 1.00 0.51 C ATOM 346 CD2 TYR A 21 28.361 -27.123 14.084 1.00 34.25 C ATOM 347 CE1 TYR A 21 30.154 -29.195 13.759 1.00 54.25 C ATOM 348 CE2 TYR A 21 29.071 -27.595 15.171 1.00 20.13 C ATOM 349 CZ TYR A 21 29.966 -28.631 15.003 1.00 32.24 C ATOM 350 OH TYR A 21 30.676 -29.105 16.083 1.00 53.21 O ATOM 0 H TYR A 21 28.086 -24.861 12.478 1.00 70.42 H new ATOM 0 HA TYR A 21 29.513 -26.438 10.631 1.00 0.42 H new ATOM 0 HB2 TYR A 21 26.809 -26.734 11.985 1.00 64.32 H new ATOM 0 HB3 TYR A 21 27.505 -27.987 10.977 1.00 64.32 H new ATOM 0 HD1 TYR A 21 29.590 -29.159 11.704 1.00 0.51 H new ATOM 0 HD2 TYR A 21 27.661 -26.312 14.219 1.00 34.25 H new ATOM 0 HE1 TYR A 21 30.855 -30.006 13.631 1.00 54.25 H new ATOM 0 HE2 TYR A 21 28.926 -27.155 16.147 1.00 20.13 H new ATOM 0 HH TYR A 21 30.428 -28.599 16.885 1.00 53.21 H new ATOM 360 N GLN A 22 27.082 -24.744 9.393 1.00 4.14 N ATOM 361 CA GLN A 22 26.363 -24.406 8.171 1.00 64.13 C ATOM 362 C GLN A 22 27.036 -23.244 7.447 1.00 15.34 C ATOM 363 O GLN A 22 27.029 -23.177 6.217 1.00 12.25 O ATOM 364 CB GLN A 22 24.910 -24.052 8.490 1.00 40.30 C ATOM 365 CG GLN A 22 24.182 -25.125 9.284 1.00 44.32 C ATOM 366 CD GLN A 22 23.541 -26.173 8.396 1.00 12.04 C ATOM 367 OE1 GLN A 22 24.229 -26.994 7.788 1.00 13.52 O ATOM 368 NE2 GLN A 22 22.215 -26.152 8.318 1.00 45.44 N ATOM 0 H GLN A 22 26.984 -24.060 10.143 1.00 4.14 H new ATOM 0 HA GLN A 22 26.381 -25.277 7.516 1.00 64.13 H new ATOM 0 HB2 GLN A 22 24.887 -23.118 9.052 1.00 40.30 H new ATOM 0 HB3 GLN A 22 24.374 -23.876 7.557 1.00 40.30 H new ATOM 0 HG2 GLN A 22 24.884 -25.609 9.962 1.00 44.32 H new ATOM 0 HG3 GLN A 22 23.414 -24.658 9.901 1.00 44.32 H new ATOM 0 HE21 GLN A 22 21.684 -25.454 8.839 1.00 45.44 H new ATOM 0 HE22 GLN A 22 21.727 -26.834 7.737 1.00 45.44 H new ATOM 377 N LEU A 23 27.615 -22.330 8.218 1.00 52.31 N ATOM 378 CA LEU A 23 28.292 -21.169 7.651 1.00 53.44 C ATOM 379 C LEU A 23 29.455 -21.597 6.762 1.00 40.21 C ATOM 380 O LEU A 23 29.480 -21.299 5.569 1.00 44.34 O ATOM 381 CB LEU A 23 28.798 -20.253 8.767 1.00 52.04 C ATOM 382 CG LEU A 23 27.731 -19.679 9.699 1.00 12.14 C ATOM 383 CD1 LEU A 23 28.361 -18.745 10.720 1.00 2.45 C ATOM 384 CD2 LEU A 23 26.658 -18.953 8.900 1.00 23.03 C ATOM 0 H LEU A 23 27.629 -22.370 9.237 1.00 52.31 H new ATOM 0 HA LEU A 23 27.573 -20.623 7.040 1.00 53.44 H new ATOM 0 HB2 LEU A 23 29.516 -20.810 9.369 1.00 52.04 H new ATOM 0 HB3 LEU A 23 29.339 -19.423 8.312 1.00 52.04 H new ATOM 0 HG LEU A 23 27.261 -20.505 10.233 1.00 12.14 H new ATOM 0 HD11 LEU A 23 27.586 -18.346 11.375 1.00 2.45 H new ATOM 0 HD12 LEU A 23 29.091 -19.295 11.314 1.00 2.45 H new ATOM 0 HD13 LEU A 23 28.858 -17.924 10.204 1.00 2.45 H new ATOM 0 HD21 LEU A 23 25.907 -18.551 9.580 1.00 23.03 H new ATOM 0 HD22 LEU A 23 27.112 -18.137 8.338 1.00 23.03 H new ATOM 0 HD23 LEU A 23 26.185 -19.650 8.209 1.00 23.03 H new ATOM 396 N GLY A 24 30.417 -22.300 7.352 1.00 34.43 N ATOM 397 CA GLY A 24 31.568 -22.760 6.599 1.00 65.31 C ATOM 398 C GLY A 24 32.423 -21.616 6.091 1.00 63.33 C ATOM 399 O GLY A 24 32.408 -21.302 4.901 1.00 72.15 O ATOM 0 H GLY A 24 30.419 -22.559 8.339 1.00 34.43 H new ATOM 0 HA2 GLY A 24 32.174 -23.411 7.229 1.00 65.31 H new ATOM 0 HA3 GLY A 24 31.230 -23.360 5.754 1.00 65.31 H new ATOM 403 N ARG A 25 33.170 -20.991 6.995 1.00 41.12 N ATOM 404 CA ARG A 25 34.033 -19.873 6.632 1.00 70.11 C ATOM 405 C ARG A 25 33.207 -18.673 6.179 1.00 75.12 C ATOM 406 O ARG A 25 33.737 -17.721 5.605 1.00 23.10 O ATOM 407 CB ARG A 25 35.001 -20.288 5.522 1.00 53.30 C ATOM 408 CG ARG A 25 36.465 -20.152 5.908 1.00 35.22 C ATOM 409 CD ARG A 25 36.950 -21.365 6.686 1.00 61.30 C ATOM 410 NE ARG A 25 38.379 -21.292 6.979 1.00 51.31 N ATOM 411 CZ ARG A 25 39.032 -22.206 7.687 1.00 30.32 C ATOM 412 NH1 ARG A 25 38.388 -23.259 8.172 1.00 15.40 N ATOM 413 NH2 ARG A 25 40.333 -22.069 7.911 1.00 34.33 N ATOM 0 H ARG A 25 33.195 -21.240 7.984 1.00 41.12 H new ATOM 0 HA ARG A 25 34.604 -19.586 7.515 1.00 70.11 H new ATOM 0 HB2 ARG A 25 34.802 -21.323 5.246 1.00 53.30 H new ATOM 0 HB3 ARG A 25 34.809 -19.680 4.638 1.00 53.30 H new ATOM 0 HG2 ARG A 25 37.070 -20.029 5.009 1.00 35.22 H new ATOM 0 HG3 ARG A 25 36.602 -19.254 6.510 1.00 35.22 H new ATOM 0 HD2 ARG A 25 36.392 -21.444 7.619 1.00 61.30 H new ATOM 0 HD3 ARG A 25 36.743 -22.269 6.114 1.00 61.30 H new ATOM 0 HE ARG A 25 38.904 -20.495 6.620 1.00 51.31 H new ATOM 0 HH11 ARG A 25 37.388 -23.368 8.001 1.00 15.40 H new ATOM 0 HH12 ARG A 25 38.892 -23.959 8.715 1.00 15.40 H new ATOM 0 HH21 ARG A 25 40.832 -21.261 7.539 1.00 34.33 H new ATOM 0 HH22 ARG A 25 40.834 -22.772 8.455 1.00 34.33 H new ATOM 427 N LEU A 26 31.905 -18.725 6.440 1.00 60.54 N ATOM 428 CA LEU A 26 31.004 -17.643 6.058 1.00 22.24 C ATOM 429 C LEU A 26 31.004 -16.539 7.110 1.00 5.43 C ATOM 430 O LEU A 26 31.405 -16.755 8.255 1.00 73.43 O ATOM 431 CB LEU A 26 29.584 -18.179 5.865 1.00 5.14 C ATOM 432 CG LEU A 26 29.121 -18.345 4.418 1.00 72.02 C ATOM 433 CD1 LEU A 26 27.895 -19.243 4.349 1.00 25.25 C ATOM 434 CD2 LEU A 26 28.826 -16.989 3.793 1.00 31.03 C ATOM 0 H LEU A 26 31.450 -19.505 6.915 1.00 60.54 H new ATOM 0 HA LEU A 26 31.358 -17.223 5.116 1.00 22.24 H new ATOM 0 HB2 LEU A 26 29.512 -19.146 6.362 1.00 5.14 H new ATOM 0 HB3 LEU A 26 28.891 -17.507 6.372 1.00 5.14 H new ATOM 0 HG LEU A 26 29.924 -18.817 3.852 1.00 72.02 H new ATOM 0 HD11 LEU A 26 27.580 -19.349 3.311 1.00 25.25 H new ATOM 0 HD12 LEU A 26 28.139 -20.224 4.757 1.00 25.25 H new ATOM 0 HD13 LEU A 26 27.086 -18.800 4.930 1.00 25.25 H new ATOM 0 HD21 LEU A 26 28.498 -17.127 2.763 1.00 31.03 H new ATOM 0 HD22 LEU A 26 28.040 -16.490 4.360 1.00 31.03 H new ATOM 0 HD23 LEU A 26 29.728 -16.378 3.807 1.00 31.03 H new ATOM 446 N THR A 27 30.551 -15.353 6.716 1.00 40.40 N ATOM 447 CA THR A 27 30.498 -14.214 7.624 1.00 33.23 C ATOM 448 C THR A 27 29.270 -13.352 7.353 1.00 4.34 C ATOM 449 O THR A 27 28.695 -13.397 6.265 1.00 1.42 O ATOM 450 CB THR A 27 31.761 -13.341 7.505 1.00 1.03 C ATOM 451 OG1 THR A 27 32.925 -14.172 7.423 1.00 53.52 O ATOM 452 CG2 THR A 27 31.885 -12.403 8.697 1.00 72.05 C ATOM 0 H THR A 27 30.215 -15.156 5.773 1.00 40.40 H new ATOM 0 HA THR A 27 30.439 -14.618 8.635 1.00 33.23 H new ATOM 0 HB THR A 27 31.678 -12.742 6.598 1.00 1.03 H new ATOM 0 HG1 THR A 27 33.724 -13.609 7.346 1.00 53.52 H new ATOM 0 HG21 THR A 27 32.784 -11.797 8.591 1.00 72.05 H new ATOM 0 HG22 THR A 27 31.012 -11.752 8.740 1.00 72.05 H new ATOM 0 HG23 THR A 27 31.948 -12.987 9.615 1.00 72.05 H new ATOM 460 N LEU A 28 28.874 -12.566 8.349 1.00 71.14 N ATOM 461 CA LEU A 28 27.714 -11.691 8.217 1.00 32.43 C ATOM 462 C LEU A 28 27.806 -10.852 6.947 1.00 12.01 C ATOM 463 O LEU A 28 26.819 -10.683 6.231 1.00 24.21 O ATOM 464 CB LEU A 28 27.598 -10.778 9.439 1.00 45.22 C ATOM 465 CG LEU A 28 26.229 -10.736 10.119 1.00 45.45 C ATOM 466 CD1 LEU A 28 26.380 -10.840 11.628 1.00 13.33 C ATOM 467 CD2 LEU A 28 25.486 -9.463 9.741 1.00 14.22 C ATOM 0 H LEU A 28 29.339 -12.517 9.256 1.00 71.14 H new ATOM 0 HA LEU A 28 26.823 -12.316 8.153 1.00 32.43 H new ATOM 0 HB2 LEU A 28 28.337 -11.094 10.175 1.00 45.22 H new ATOM 0 HB3 LEU A 28 27.862 -9.765 9.137 1.00 45.22 H new ATOM 0 HG LEU A 28 25.646 -11.590 9.774 1.00 45.45 H new ATOM 0 HD11 LEU A 28 25.396 -10.808 12.095 1.00 13.33 H new ATOM 0 HD12 LEU A 28 26.872 -11.779 11.881 1.00 13.33 H new ATOM 0 HD13 LEU A 28 26.981 -10.007 11.992 1.00 13.33 H new ATOM 0 HD21 LEU A 28 24.514 -9.449 10.234 1.00 14.22 H new ATOM 0 HD22 LEU A 28 26.065 -8.596 10.058 1.00 14.22 H new ATOM 0 HD23 LEU A 28 25.346 -9.431 8.661 1.00 14.22 H new ATOM 479 N GLU A 29 28.998 -10.330 6.674 1.00 74.35 N ATOM 480 CA GLU A 29 29.218 -9.510 5.488 1.00 13.34 C ATOM 481 C GLU A 29 28.894 -10.291 4.218 1.00 11.21 C ATOM 482 O GLU A 29 28.344 -9.743 3.263 1.00 2.32 O ATOM 483 CB GLU A 29 30.666 -9.018 5.443 1.00 61.41 C ATOM 484 CG GLU A 29 30.986 -8.179 4.217 1.00 12.14 C ATOM 485 CD GLU A 29 31.316 -6.740 4.566 1.00 70.54 C ATOM 486 OE1 GLU A 29 30.411 -6.021 5.038 1.00 24.22 O ATOM 487 OE2 GLU A 29 32.480 -6.335 4.365 1.00 0.53 O ATOM 0 H GLU A 29 29.825 -10.460 7.257 1.00 74.35 H new ATOM 0 HA GLU A 29 28.551 -8.650 5.544 1.00 13.34 H new ATOM 0 HB2 GLU A 29 30.869 -8.430 6.338 1.00 61.41 H new ATOM 0 HB3 GLU A 29 31.334 -9.879 5.468 1.00 61.41 H new ATOM 0 HG2 GLU A 29 31.829 -8.623 3.687 1.00 12.14 H new ATOM 0 HG3 GLU A 29 30.135 -8.198 3.536 1.00 12.14 H new ATOM 494 N MET A 30 29.240 -11.574 4.215 1.00 33.02 N ATOM 495 CA MET A 30 28.985 -12.431 3.063 1.00 64.00 C ATOM 496 C MET A 30 27.488 -12.555 2.797 1.00 4.14 C ATOM 497 O MET A 30 27.035 -12.402 1.664 1.00 43.15 O ATOM 498 CB MET A 30 29.592 -13.817 3.288 1.00 72.50 C ATOM 499 CG MET A 30 30.998 -13.780 3.865 1.00 14.40 C ATOM 500 SD MET A 30 32.119 -12.754 2.895 1.00 62.23 S ATOM 501 CE MET A 30 33.707 -13.328 3.494 1.00 15.34 C ATOM 0 H MET A 30 29.697 -12.043 4.997 1.00 33.02 H new ATOM 0 HA MET A 30 29.453 -11.974 2.191 1.00 64.00 H new ATOM 0 HB2 MET A 30 28.947 -14.382 3.961 1.00 72.50 H new ATOM 0 HB3 MET A 30 29.612 -14.354 2.340 1.00 72.50 H new ATOM 0 HG2 MET A 30 30.958 -13.402 4.887 1.00 14.40 H new ATOM 0 HG3 MET A 30 31.393 -14.795 3.916 1.00 14.40 H new ATOM 0 HE1 MET A 30 34.505 -12.786 2.987 1.00 15.34 H new ATOM 0 HE2 MET A 30 33.776 -13.154 4.568 1.00 15.34 H new ATOM 0 HE3 MET A 30 33.808 -14.394 3.293 1.00 15.34 H new ATOM 511 N MET A 31 26.726 -12.833 3.850 1.00 63.20 N ATOM 512 CA MET A 31 25.280 -12.977 3.729 1.00 0.42 C ATOM 513 C MET A 31 24.610 -11.616 3.568 1.00 44.41 C ATOM 514 O MET A 31 23.582 -11.495 2.904 1.00 40.53 O ATOM 515 CB MET A 31 24.713 -13.695 4.955 1.00 1.13 C ATOM 516 CG MET A 31 25.092 -15.165 5.028 1.00 62.25 C ATOM 517 SD MET A 31 23.911 -16.141 5.978 1.00 72.13 S ATOM 518 CE MET A 31 24.972 -16.803 7.260 1.00 60.34 C ATOM 0 H MET A 31 27.086 -12.963 4.796 1.00 63.20 H new ATOM 0 HA MET A 31 25.072 -13.572 2.840 1.00 0.42 H new ATOM 0 HB2 MET A 31 25.066 -13.192 5.856 1.00 1.13 H new ATOM 0 HB3 MET A 31 23.626 -13.608 4.946 1.00 1.13 H new ATOM 0 HG2 MET A 31 25.162 -15.569 4.018 1.00 62.25 H new ATOM 0 HG3 MET A 31 26.080 -15.259 5.478 1.00 62.25 H new ATOM 0 HE1 MET A 31 25.060 -17.883 7.138 1.00 60.34 H new ATOM 0 HE2 MET A 31 25.960 -16.348 7.186 1.00 60.34 H new ATOM 0 HE3 MET A 31 24.543 -16.582 8.237 1.00 60.34 H new ATOM 528 N ASN A 32 25.201 -10.594 4.180 1.00 34.33 N ATOM 529 CA ASN A 32 24.660 -9.242 4.105 1.00 51.11 C ATOM 530 C ASN A 32 24.573 -8.771 2.656 1.00 1.23 C ATOM 531 O ASN A 32 23.580 -8.169 2.248 1.00 24.30 O ATOM 532 CB ASN A 32 25.528 -8.277 4.915 1.00 30.35 C ATOM 533 CG ASN A 32 25.265 -6.826 4.562 1.00 73.31 C ATOM 534 OD1 ASN A 32 25.684 -6.347 3.508 1.00 11.45 O ATOM 535 ND2 ASN A 32 24.567 -6.120 5.444 1.00 41.22 N ATOM 0 H ASN A 32 26.054 -10.677 4.733 1.00 34.33 H new ATOM 0 HA ASN A 32 23.654 -9.256 4.526 1.00 51.11 H new ATOM 0 HB2 ASN A 32 25.340 -8.429 5.978 1.00 30.35 H new ATOM 0 HB3 ASN A 32 26.580 -8.505 4.741 1.00 30.35 H new ATOM 0 HD21 ASN A 32 24.358 -5.139 5.261 1.00 41.22 H new ATOM 0 HD22 ASN A 32 24.240 -6.559 6.305 1.00 41.22 H new ATOM 542 N GLU A 33 25.619 -9.050 1.885 1.00 5.32 N ATOM 543 CA GLU A 33 25.661 -8.654 0.482 1.00 32.14 C ATOM 544 C GLU A 33 24.861 -9.626 -0.381 1.00 4.02 C ATOM 545 O GLU A 33 24.287 -9.240 -1.399 1.00 42.24 O ATOM 546 CB GLU A 33 27.108 -8.589 -0.010 1.00 21.31 C ATOM 547 CG GLU A 33 27.886 -9.874 0.217 1.00 23.43 C ATOM 548 CD GLU A 33 29.387 -9.655 0.222 1.00 53.21 C ATOM 549 OE1 GLU A 33 29.919 -9.170 -0.798 1.00 61.12 O ATOM 550 OE2 GLU A 33 30.028 -9.968 1.247 1.00 43.12 O ATOM 0 H GLU A 33 26.448 -9.548 2.208 1.00 5.32 H new ATOM 0 HA GLU A 33 25.212 -7.665 0.396 1.00 32.14 H new ATOM 0 HB2 GLU A 33 27.111 -8.356 -1.075 1.00 21.31 H new ATOM 0 HB3 GLU A 33 27.619 -7.770 0.497 1.00 21.31 H new ATOM 0 HG2 GLU A 33 27.584 -10.314 1.167 1.00 23.43 H new ATOM 0 HG3 GLU A 33 27.630 -10.592 -0.562 1.00 23.43 H new ATOM 557 N ILE A 34 24.830 -10.888 0.034 1.00 51.12 N ATOM 558 CA ILE A 34 24.101 -11.915 -0.700 1.00 42.24 C ATOM 559 C ILE A 34 22.596 -11.680 -0.626 1.00 63.31 C ATOM 560 O ILE A 34 21.897 -11.742 -1.637 1.00 73.32 O ATOM 561 CB ILE A 34 24.417 -13.323 -0.162 1.00 42.24 C ATOM 562 CG1 ILE A 34 25.832 -13.742 -0.568 1.00 75.24 C ATOM 563 CG2 ILE A 34 23.394 -14.327 -0.673 1.00 2.33 C ATOM 564 CD1 ILE A 34 26.413 -14.831 0.306 1.00 45.21 C ATOM 0 H ILE A 34 25.301 -11.224 0.874 1.00 51.12 H new ATOM 0 HA ILE A 34 24.425 -11.851 -1.739 1.00 42.24 H new ATOM 0 HB ILE A 34 24.363 -13.301 0.926 1.00 42.24 H new ATOM 0 HG12 ILE A 34 25.818 -14.086 -1.602 1.00 75.24 H new ATOM 0 HG13 ILE A 34 26.485 -12.870 -0.531 1.00 75.24 H new ATOM 0 HG21 ILE A 34 23.631 -15.317 -0.284 1.00 2.33 H new ATOM 0 HG22 ILE A 34 22.399 -14.034 -0.339 1.00 2.33 H new ATOM 0 HG23 ILE A 34 23.419 -14.349 -1.762 1.00 2.33 H new ATOM 0 HD11 ILE A 34 27.417 -15.078 -0.039 1.00 45.21 H new ATOM 0 HD12 ILE A 34 26.460 -14.483 1.338 1.00 45.21 H new ATOM 0 HD13 ILE A 34 25.782 -15.718 0.250 1.00 45.21 H new ATOM 576 N VAL A 35 22.104 -11.409 0.578 1.00 11.44 N ATOM 577 CA VAL A 35 20.682 -11.161 0.785 1.00 30.41 C ATOM 578 C VAL A 35 20.288 -9.774 0.292 1.00 2.52 C ATOM 579 O VAL A 35 19.140 -9.540 -0.083 1.00 55.25 O ATOM 580 CB VAL A 35 20.299 -11.294 2.271 1.00 25.12 C ATOM 581 CG1 VAL A 35 18.787 -11.299 2.435 1.00 22.21 C ATOM 582 CG2 VAL A 35 20.913 -12.551 2.869 1.00 71.44 C ATOM 0 H VAL A 35 22.669 -11.355 1.425 1.00 11.44 H new ATOM 0 HA VAL A 35 20.143 -11.914 0.210 1.00 30.41 H new ATOM 0 HB VAL A 35 20.695 -10.433 2.809 1.00 25.12 H new ATOM 0 HG11 VAL A 35 18.536 -11.394 3.491 1.00 22.21 H new ATOM 0 HG12 VAL A 35 18.376 -10.367 2.046 1.00 22.21 H new ATOM 0 HG13 VAL A 35 18.364 -12.140 1.885 1.00 22.21 H new ATOM 0 HG21 VAL A 35 20.632 -12.629 3.919 1.00 71.44 H new ATOM 0 HG22 VAL A 35 20.549 -13.426 2.330 1.00 71.44 H new ATOM 0 HG23 VAL A 35 21.999 -12.500 2.787 1.00 71.44 H new ATOM 592 N SER A 36 21.249 -8.855 0.296 1.00 23.40 N ATOM 593 CA SER A 36 21.002 -7.488 -0.148 1.00 24.52 C ATOM 594 C SER A 36 20.857 -7.428 -1.665 1.00 43.13 C ATOM 595 O SER A 36 19.882 -6.887 -2.187 1.00 10.22 O ATOM 596 CB SER A 36 22.139 -6.570 0.304 1.00 3.12 C ATOM 597 OG SER A 36 22.255 -5.444 -0.549 1.00 31.05 O ATOM 0 H SER A 36 22.206 -9.033 0.602 1.00 23.40 H new ATOM 0 HA SER A 36 20.069 -7.148 0.302 1.00 24.52 H new ATOM 0 HB2 SER A 36 21.958 -6.238 1.327 1.00 3.12 H new ATOM 0 HB3 SER A 36 23.078 -7.124 0.310 1.00 3.12 H new ATOM 0 HG SER A 36 22.988 -4.872 -0.238 1.00 31.05 H new ATOM 603 N LYS A 37 21.835 -7.987 -2.370 1.00 22.44 N ATOM 604 CA LYS A 37 21.818 -8.000 -3.828 1.00 5.45 C ATOM 605 C LYS A 37 20.675 -8.863 -4.351 1.00 41.23 C ATOM 606 O LYS A 37 19.990 -8.491 -5.304 1.00 3.33 O ATOM 607 CB LYS A 37 23.153 -8.518 -4.369 1.00 75.31 C ATOM 608 CG LYS A 37 23.920 -7.490 -5.181 1.00 43.24 C ATOM 609 CD LYS A 37 24.269 -6.268 -4.348 1.00 24.42 C ATOM 610 CE LYS A 37 25.430 -6.550 -3.405 1.00 54.13 C ATOM 611 NZ LYS A 37 25.219 -5.933 -2.067 1.00 10.35 N ATOM 0 H LYS A 37 22.650 -8.438 -1.954 1.00 22.44 H new ATOM 0 HA LYS A 37 21.665 -6.978 -4.174 1.00 5.45 H new ATOM 0 HB2 LYS A 37 23.772 -8.844 -3.533 1.00 75.31 H new ATOM 0 HB3 LYS A 37 22.968 -9.395 -4.990 1.00 75.31 H new ATOM 0 HG2 LYS A 37 24.834 -7.940 -5.569 1.00 43.24 H new ATOM 0 HG3 LYS A 37 23.324 -7.187 -6.042 1.00 43.24 H new ATOM 0 HD2 LYS A 37 24.527 -5.439 -5.007 1.00 24.42 H new ATOM 0 HD3 LYS A 37 23.397 -5.958 -3.771 1.00 24.42 H new ATOM 0 HE2 LYS A 37 25.554 -7.627 -3.293 1.00 54.13 H new ATOM 0 HE3 LYS A 37 26.353 -6.167 -3.840 1.00 54.13 H new ATOM 0 HZ1 LYS A 37 26.031 -6.148 -1.454 1.00 10.35 H new ATOM 0 HZ2 LYS A 37 25.126 -4.902 -2.171 1.00 10.35 H new ATOM 0 HZ3 LYS A 37 24.352 -6.317 -1.640 1.00 10.35 H new ATOM 625 N MET A 38 20.474 -10.016 -3.722 1.00 11.11 N ATOM 626 CA MET A 38 19.411 -10.930 -4.124 1.00 21.02 C ATOM 627 C MET A 38 18.048 -10.251 -4.036 1.00 31.23 C ATOM 628 O MET A 38 17.287 -10.239 -5.003 1.00 53.52 O ATOM 629 CB MET A 38 19.428 -12.183 -3.246 1.00 13.23 C ATOM 630 CG MET A 38 20.423 -13.235 -3.707 1.00 1.00 C ATOM 631 SD MET A 38 20.215 -14.810 -2.854 1.00 14.33 S ATOM 632 CE MET A 38 20.002 -14.254 -1.164 1.00 51.24 C ATOM 0 H MET A 38 21.033 -10.340 -2.932 1.00 11.11 H new ATOM 0 HA MET A 38 19.586 -11.219 -5.160 1.00 21.02 H new ATOM 0 HB2 MET A 38 19.664 -11.895 -2.222 1.00 13.23 H new ATOM 0 HB3 MET A 38 18.430 -12.620 -3.232 1.00 13.23 H new ATOM 0 HG2 MET A 38 20.311 -13.390 -4.780 1.00 1.00 H new ATOM 0 HG3 MET A 38 21.436 -12.868 -3.542 1.00 1.00 H new ATOM 0 HE1 MET A 38 20.232 -15.071 -0.480 1.00 51.24 H new ATOM 0 HE2 MET A 38 20.673 -13.418 -0.969 1.00 51.24 H new ATOM 0 HE3 MET A 38 18.971 -13.934 -1.013 1.00 51.24 H new ATOM 642 N ASP A 39 17.746 -9.689 -2.871 1.00 4.34 N ATOM 643 CA ASP A 39 16.475 -9.007 -2.657 1.00 31.31 C ATOM 644 C ASP A 39 16.332 -7.816 -3.599 1.00 11.33 C ATOM 645 O ASP A 39 15.226 -7.472 -4.017 1.00 43.30 O ATOM 646 CB ASP A 39 16.359 -8.542 -1.205 1.00 1.05 C ATOM 647 CG ASP A 39 16.865 -7.127 -1.008 1.00 3.51 C ATOM 648 OD1 ASP A 39 16.147 -6.181 -1.393 1.00 74.00 O ATOM 649 OD2 ASP A 39 17.981 -6.964 -0.470 1.00 32.33 O ATOM 0 H ASP A 39 18.364 -9.692 -2.060 1.00 4.34 H new ATOM 0 HA ASP A 39 15.672 -9.713 -2.869 1.00 31.31 H new ATOM 0 HB2 ASP A 39 15.317 -8.599 -0.890 1.00 1.05 H new ATOM 0 HB3 ASP A 39 16.923 -9.219 -0.564 1.00 1.05 H new ATOM 654 N ASP A 40 17.457 -7.190 -3.927 1.00 54.32 N ATOM 655 CA ASP A 40 17.457 -6.036 -4.820 1.00 30.34 C ATOM 656 C ASP A 40 16.882 -6.405 -6.184 1.00 4.41 C ATOM 657 O ASP A 40 15.938 -5.775 -6.662 1.00 64.30 O ATOM 658 CB ASP A 40 18.876 -5.490 -4.981 1.00 3.33 C ATOM 659 CG ASP A 40 18.963 -4.406 -6.037 1.00 12.52 C ATOM 660 OD1 ASP A 40 18.156 -3.454 -5.977 1.00 62.34 O ATOM 661 OD2 ASP A 40 19.837 -4.509 -6.923 1.00 54.35 O ATOM 0 H ASP A 40 18.380 -7.462 -3.588 1.00 54.32 H new ATOM 0 HA ASP A 40 16.827 -5.264 -4.377 1.00 30.34 H new ATOM 0 HB2 ASP A 40 19.219 -5.091 -4.026 1.00 3.33 H new ATOM 0 HB3 ASP A 40 19.548 -6.306 -5.246 1.00 3.33 H new ATOM 666 N PHE A 41 17.459 -7.427 -6.806 1.00 60.35 N ATOM 667 CA PHE A 41 17.006 -7.878 -8.117 1.00 72.31 C ATOM 668 C PHE A 41 15.545 -8.316 -8.066 1.00 51.05 C ATOM 669 O PHE A 41 14.731 -7.899 -8.891 1.00 52.53 O ATOM 670 CB PHE A 41 17.879 -9.033 -8.613 1.00 10.04 C ATOM 671 CG PHE A 41 18.105 -9.019 -10.097 1.00 43.04 C ATOM 672 CD1 PHE A 41 17.174 -8.447 -10.948 1.00 55.42 C ATOM 673 CD2 PHE A 41 19.250 -9.579 -10.642 1.00 53.23 C ATOM 674 CE1 PHE A 41 17.379 -8.432 -12.315 1.00 51.30 C ATOM 675 CE2 PHE A 41 19.461 -9.566 -12.008 1.00 74.51 C ATOM 676 CZ PHE A 41 18.524 -8.993 -12.846 1.00 34.44 C ATOM 0 H PHE A 41 18.241 -7.959 -6.424 1.00 60.35 H new ATOM 0 HA PHE A 41 17.093 -7.042 -8.811 1.00 72.31 H new ATOM 0 HB2 PHE A 41 18.843 -8.993 -8.106 1.00 10.04 H new ATOM 0 HB3 PHE A 41 17.411 -9.977 -8.334 1.00 10.04 H new ATOM 0 HD1 PHE A 41 16.277 -8.007 -10.538 1.00 55.42 H new ATOM 0 HD2 PHE A 41 19.985 -10.030 -9.992 1.00 53.23 H new ATOM 0 HE1 PHE A 41 16.645 -7.982 -12.967 1.00 51.30 H new ATOM 0 HE2 PHE A 41 20.358 -10.004 -12.420 1.00 74.51 H new ATOM 0 HZ PHE A 41 18.686 -8.984 -13.914 1.00 34.44 H new ATOM 686 N LEU A 42 15.220 -9.160 -7.093 1.00 51.24 N ATOM 687 CA LEU A 42 13.857 -9.656 -6.934 1.00 43.30 C ATOM 688 C LEU A 42 12.893 -8.512 -6.633 1.00 25.50 C ATOM 689 O LEU A 42 11.732 -8.544 -7.039 1.00 1.33 O ATOM 690 CB LEU A 42 13.800 -10.695 -5.813 1.00 74.12 C ATOM 691 CG LEU A 42 13.110 -12.016 -6.157 1.00 44.15 C ATOM 692 CD1 LEU A 42 11.635 -11.789 -6.446 1.00 53.42 C ATOM 693 CD2 LEU A 42 13.792 -12.679 -7.345 1.00 61.52 C ATOM 0 H LEU A 42 15.881 -9.515 -6.402 1.00 51.24 H new ATOM 0 HA LEU A 42 13.555 -10.124 -7.871 1.00 43.30 H new ATOM 0 HB2 LEU A 42 14.819 -10.913 -5.494 1.00 74.12 H new ATOM 0 HB3 LEU A 42 13.287 -10.252 -4.960 1.00 74.12 H new ATOM 0 HG LEU A 42 13.192 -12.681 -5.298 1.00 44.15 H new ATOM 0 HD11 LEU A 42 11.161 -12.740 -6.689 1.00 53.42 H new ATOM 0 HD12 LEU A 42 11.154 -11.358 -5.568 1.00 53.42 H new ATOM 0 HD13 LEU A 42 11.530 -11.106 -7.289 1.00 53.42 H new ATOM 0 HD21 LEU A 42 13.288 -13.618 -7.576 1.00 61.52 H new ATOM 0 HD22 LEU A 42 13.741 -12.017 -8.210 1.00 61.52 H new ATOM 0 HD23 LEU A 42 14.836 -12.878 -7.101 1.00 61.52 H new ATOM 705 N MET A 43 13.384 -7.503 -5.921 1.00 24.52 N ATOM 706 CA MET A 43 12.567 -6.348 -5.569 1.00 21.23 C ATOM 707 C MET A 43 12.146 -5.579 -6.817 1.00 61.30 C ATOM 708 O MET A 43 11.021 -5.088 -6.906 1.00 74.34 O ATOM 709 CB MET A 43 13.334 -5.424 -4.621 1.00 33.14 C ATOM 710 CG MET A 43 12.559 -4.176 -4.230 1.00 32.23 C ATOM 711 SD MET A 43 13.334 -3.273 -2.875 1.00 41.14 S ATOM 712 CE MET A 43 14.620 -2.387 -3.752 1.00 44.10 C ATOM 0 H MET A 43 14.343 -7.462 -5.577 1.00 24.52 H new ATOM 0 HA MET A 43 11.670 -6.709 -5.066 1.00 21.23 H new ATOM 0 HB2 MET A 43 13.594 -5.978 -3.719 1.00 33.14 H new ATOM 0 HB3 MET A 43 14.270 -5.127 -5.094 1.00 33.14 H new ATOM 0 HG2 MET A 43 12.473 -3.520 -5.096 1.00 32.23 H new ATOM 0 HG3 MET A 43 11.546 -4.457 -3.942 1.00 32.23 H new ATOM 0 HE1 MET A 43 15.189 -1.781 -3.048 1.00 44.10 H new ATOM 0 HE2 MET A 43 15.286 -3.100 -4.238 1.00 44.10 H new ATOM 0 HE3 MET A 43 14.168 -1.741 -4.505 1.00 44.10 H new ATOM 722 N LYS A 44 13.057 -5.478 -7.779 1.00 51.21 N ATOM 723 CA LYS A 44 12.781 -4.770 -9.023 1.00 54.53 C ATOM 724 C LYS A 44 11.815 -5.563 -9.898 1.00 50.30 C ATOM 725 O LYS A 44 10.957 -4.991 -10.571 1.00 2.41 O ATOM 726 CB LYS A 44 14.082 -4.511 -9.786 1.00 55.55 C ATOM 727 CG LYS A 44 14.344 -5.512 -10.898 1.00 3.20 C ATOM 728 CD LYS A 44 15.761 -5.391 -11.434 1.00 22.24 C ATOM 729 CE LYS A 44 15.922 -4.161 -12.313 1.00 53.22 C ATOM 730 NZ LYS A 44 17.002 -4.338 -13.323 1.00 2.34 N ATOM 0 H LYS A 44 13.994 -5.878 -7.721 1.00 51.21 H new ATOM 0 HA LYS A 44 12.317 -3.816 -8.773 1.00 54.53 H new ATOM 0 HB2 LYS A 44 14.050 -3.508 -10.211 1.00 55.55 H new ATOM 0 HB3 LYS A 44 14.916 -4.534 -9.084 1.00 55.55 H new ATOM 0 HG2 LYS A 44 14.180 -6.523 -10.525 1.00 3.20 H new ATOM 0 HG3 LYS A 44 13.633 -5.352 -11.708 1.00 3.20 H new ATOM 0 HD2 LYS A 44 16.463 -5.339 -10.601 1.00 22.24 H new ATOM 0 HD3 LYS A 44 16.012 -6.284 -12.007 1.00 22.24 H new ATOM 0 HE2 LYS A 44 14.981 -3.952 -12.821 1.00 53.22 H new ATOM 0 HE3 LYS A 44 16.146 -3.296 -11.689 1.00 53.22 H new ATOM 0 HZ1 LYS A 44 16.730 -3.866 -14.209 1.00 2.34 H new ATOM 0 HZ2 LYS A 44 17.884 -3.920 -12.965 1.00 2.34 H new ATOM 0 HZ3 LYS A 44 17.147 -5.352 -13.502 1.00 2.34 H new ATOM 744 N LYS A 45 11.959 -6.884 -9.883 1.00 41.51 N ATOM 745 CA LYS A 45 11.098 -7.757 -10.672 1.00 44.55 C ATOM 746 C LYS A 45 9.641 -7.615 -10.245 1.00 50.32 C ATOM 747 O LYS A 45 8.763 -7.367 -11.072 1.00 2.22 O ATOM 748 CB LYS A 45 11.544 -9.213 -10.527 1.00 60.32 C ATOM 749 CG LYS A 45 12.882 -9.508 -11.183 1.00 21.35 C ATOM 750 CD LYS A 45 12.810 -9.353 -12.692 1.00 71.13 C ATOM 751 CE LYS A 45 14.165 -9.586 -13.342 1.00 63.11 C ATOM 752 NZ LYS A 45 14.773 -10.876 -12.911 1.00 55.32 N ATOM 0 H LYS A 45 12.664 -7.374 -9.333 1.00 41.51 H new ATOM 0 HA LYS A 45 11.182 -7.460 -11.717 1.00 44.55 H new ATOM 0 HB2 LYS A 45 11.606 -9.461 -9.467 1.00 60.32 H new ATOM 0 HB3 LYS A 45 10.784 -9.862 -10.963 1.00 60.32 H new ATOM 0 HG2 LYS A 45 13.640 -8.835 -10.783 1.00 21.35 H new ATOM 0 HG3 LYS A 45 13.194 -10.523 -10.935 1.00 21.35 H new ATOM 0 HD2 LYS A 45 12.085 -10.059 -13.097 1.00 71.13 H new ATOM 0 HD3 LYS A 45 12.454 -8.353 -12.939 1.00 71.13 H new ATOM 0 HE2 LYS A 45 14.053 -9.582 -14.426 1.00 63.11 H new ATOM 0 HE3 LYS A 45 14.836 -8.765 -13.087 1.00 63.11 H new ATOM 0 HZ1 LYS A 45 15.231 -11.333 -13.725 1.00 55.32 H new ATOM 0 HZ2 LYS A 45 15.481 -10.696 -12.171 1.00 55.32 H new ATOM 0 HZ3 LYS A 45 14.031 -11.501 -12.535 1.00 55.32 H new ATOM 766 N SER A 46 9.391 -7.772 -8.949 1.00 71.23 N ATOM 767 CA SER A 46 8.039 -7.664 -8.413 1.00 2.11 C ATOM 768 C SER A 46 7.500 -6.246 -8.580 1.00 63.44 C ATOM 769 O SER A 46 6.289 -6.033 -8.643 1.00 3.01 O ATOM 770 CB SER A 46 8.021 -8.057 -6.934 1.00 45.05 C ATOM 771 OG SER A 46 6.737 -8.511 -6.543 1.00 4.22 O ATOM 0 H SER A 46 10.107 -7.974 -8.251 1.00 71.23 H new ATOM 0 HA SER A 46 7.398 -8.346 -8.971 1.00 2.11 H new ATOM 0 HB2 SER A 46 8.758 -8.840 -6.753 1.00 45.05 H new ATOM 0 HB3 SER A 46 8.309 -7.201 -6.323 1.00 45.05 H new ATOM 0 HG SER A 46 6.752 -8.757 -5.595 1.00 4.22 H new ATOM 777 N LYS A 47 8.409 -5.280 -8.653 1.00 12.44 N ATOM 778 CA LYS A 47 8.028 -3.881 -8.814 1.00 72.51 C ATOM 779 C LYS A 47 7.492 -3.622 -10.219 1.00 24.23 C ATOM 780 O LYS A 47 6.661 -2.737 -10.422 1.00 42.14 O ATOM 781 CB LYS A 47 9.225 -2.970 -8.537 1.00 3.20 C ATOM 782 CG LYS A 47 9.665 -2.159 -9.744 1.00 33.01 C ATOM 783 CD LYS A 47 8.795 -0.927 -9.935 1.00 24.52 C ATOM 784 CE LYS A 47 9.601 0.353 -9.778 1.00 41.14 C ATOM 785 NZ LYS A 47 10.696 0.446 -10.783 1.00 70.25 N ATOM 0 H LYS A 47 9.415 -5.440 -8.603 1.00 12.44 H new ATOM 0 HA LYS A 47 7.238 -3.660 -8.096 1.00 72.51 H new ATOM 0 HB2 LYS A 47 8.972 -2.289 -7.725 1.00 3.20 H new ATOM 0 HB3 LYS A 47 10.062 -3.578 -8.194 1.00 3.20 H new ATOM 0 HG2 LYS A 47 10.705 -1.856 -9.620 1.00 33.01 H new ATOM 0 HG3 LYS A 47 9.618 -2.781 -10.638 1.00 33.01 H new ATOM 0 HD2 LYS A 47 8.339 -0.952 -10.925 1.00 24.52 H new ATOM 0 HD3 LYS A 47 7.982 -0.938 -9.209 1.00 24.52 H new ATOM 0 HE2 LYS A 47 8.940 1.213 -9.881 1.00 41.14 H new ATOM 0 HE3 LYS A 47 10.025 0.395 -8.775 1.00 41.14 H new ATOM 0 HZ1 LYS A 47 10.917 1.446 -10.964 1.00 70.25 H new ATOM 0 HZ2 LYS A 47 11.543 -0.035 -10.419 1.00 70.25 H new ATOM 0 HZ3 LYS A 47 10.394 -0.008 -11.669 1.00 70.25 H new ATOM 799 N ILE A 48 7.973 -4.400 -11.183 1.00 33.11 N ATOM 800 CA ILE A 48 7.540 -4.256 -12.567 1.00 52.52 C ATOM 801 C ILE A 48 6.253 -5.032 -12.825 1.00 14.44 C ATOM 802 O ILE A 48 5.426 -4.630 -13.645 1.00 31.04 O ATOM 803 CB ILE A 48 8.623 -4.740 -13.549 1.00 51.53 C ATOM 804 CG1 ILE A 48 9.619 -3.615 -13.838 1.00 64.03 C ATOM 805 CG2 ILE A 48 7.986 -5.234 -14.839 1.00 75.30 C ATOM 806 CD1 ILE A 48 10.907 -3.732 -13.053 1.00 12.23 C ATOM 0 H ILE A 48 8.662 -5.136 -11.031 1.00 33.11 H new ATOM 0 HA ILE A 48 7.360 -3.194 -12.732 1.00 52.52 H new ATOM 0 HB ILE A 48 9.162 -5.570 -13.092 1.00 51.53 H new ATOM 0 HG12 ILE A 48 9.851 -3.611 -14.903 1.00 64.03 H new ATOM 0 HG13 ILE A 48 9.150 -2.658 -13.610 1.00 64.03 H new ATOM 0 HG21 ILE A 48 8.764 -5.573 -15.523 1.00 75.30 H new ATOM 0 HG22 ILE A 48 7.312 -6.062 -14.618 1.00 75.30 H new ATOM 0 HG23 ILE A 48 7.425 -4.422 -15.302 1.00 75.30 H new ATOM 0 HD11 ILE A 48 11.565 -2.902 -13.308 1.00 12.23 H new ATOM 0 HD12 ILE A 48 10.686 -3.706 -11.986 1.00 12.23 H new ATOM 0 HD13 ILE A 48 11.399 -4.673 -13.299 1.00 12.23 H new ATOM 818 N LEU A 49 6.088 -6.144 -12.118 1.00 20.32 N ATOM 819 CA LEU A 49 4.900 -6.977 -12.268 1.00 33.13 C ATOM 820 C LEU A 49 3.640 -6.201 -11.895 1.00 64.22 C ATOM 821 O LEU A 49 2.530 -6.590 -12.256 1.00 2.43 O ATOM 822 CB LEU A 49 5.017 -8.229 -11.397 1.00 63.30 C ATOM 823 CG LEU A 49 6.312 -9.030 -11.544 1.00 12.11 C ATOM 824 CD1 LEU A 49 6.089 -10.482 -11.151 1.00 73.14 C ATOM 825 CD2 LEU A 49 6.839 -8.935 -12.968 1.00 75.45 C ATOM 0 H LEU A 49 6.762 -6.490 -11.435 1.00 20.32 H new ATOM 0 HA LEU A 49 4.826 -7.275 -13.314 1.00 33.13 H new ATOM 0 HB2 LEU A 49 4.913 -7.932 -10.353 1.00 63.30 H new ATOM 0 HB3 LEU A 49 4.178 -8.887 -11.626 1.00 63.30 H new ATOM 0 HG LEU A 49 7.058 -8.604 -10.873 1.00 12.11 H new ATOM 0 HD11 LEU A 49 7.021 -11.036 -11.262 1.00 73.14 H new ATOM 0 HD12 LEU A 49 5.759 -10.531 -10.113 1.00 73.14 H new ATOM 0 HD13 LEU A 49 5.327 -10.921 -11.796 1.00 73.14 H new ATOM 0 HD21 LEU A 49 7.761 -9.511 -13.054 1.00 75.45 H new ATOM 0 HD22 LEU A 49 6.096 -9.334 -13.658 1.00 75.45 H new ATOM 0 HD23 LEU A 49 7.039 -7.892 -13.213 1.00 75.45 H new ATOM 837 N GLY A 50 3.822 -5.100 -11.172 1.00 71.11 N ATOM 838 CA GLY A 50 2.692 -4.286 -10.765 1.00 0.34 C ATOM 839 C GLY A 50 2.596 -2.993 -11.550 1.00 50.21 C ATOM 840 O GLY A 50 1.500 -2.529 -11.866 1.00 61.34 O ATOM 0 H GLY A 50 4.731 -4.758 -10.861 1.00 71.11 H new ATOM 0 HA2 GLY A 50 1.772 -4.856 -10.896 1.00 0.34 H new ATOM 0 HA3 GLY A 50 2.777 -4.057 -9.703 1.00 0.34 H new ATOM 844 N LYS A 51 3.746 -2.407 -11.865 1.00 62.02 N ATOM 845 CA LYS A 51 3.789 -1.159 -12.618 1.00 72.22 C ATOM 846 C LYS A 51 2.978 -1.273 -13.905 1.00 44.55 C ATOM 847 O LYS A 51 2.532 -2.358 -14.277 1.00 74.40 O ATOM 848 CB LYS A 51 5.237 -0.786 -12.946 1.00 35.34 C ATOM 849 CG LYS A 51 5.681 0.528 -12.327 1.00 72.13 C ATOM 850 CD LYS A 51 5.584 0.492 -10.811 1.00 70.13 C ATOM 851 CE LYS A 51 5.776 1.875 -10.207 1.00 64.45 C ATOM 852 NZ LYS A 51 7.002 2.542 -10.728 1.00 75.25 N ATOM 0 H LYS A 51 4.662 -2.777 -11.610 1.00 62.02 H new ATOM 0 HA LYS A 51 3.350 -0.375 -12.000 1.00 72.22 H new ATOM 0 HB2 LYS A 51 5.896 -1.582 -12.600 1.00 35.34 H new ATOM 0 HB3 LYS A 51 5.352 -0.725 -14.028 1.00 35.34 H new ATOM 0 HG2 LYS A 51 6.709 0.741 -12.622 1.00 72.13 H new ATOM 0 HG3 LYS A 51 5.064 1.340 -12.713 1.00 72.13 H new ATOM 0 HD2 LYS A 51 4.612 0.097 -10.517 1.00 70.13 H new ATOM 0 HD3 LYS A 51 6.338 -0.188 -10.413 1.00 70.13 H new ATOM 0 HE2 LYS A 51 4.905 2.492 -10.428 1.00 64.45 H new ATOM 0 HE3 LYS A 51 5.841 1.792 -9.122 1.00 64.45 H new ATOM 0 HZ1 LYS A 51 7.515 2.989 -9.941 1.00 75.25 H new ATOM 0 HZ2 LYS A 51 7.615 1.836 -11.183 1.00 75.25 H new ATOM 0 HZ3 LYS A 51 6.734 3.267 -11.423 1.00 75.25 H new ATOM 866 N THR A 52 2.793 -0.144 -14.584 1.00 71.51 N ATOM 867 CA THR A 52 2.037 -0.117 -15.830 1.00 31.42 C ATOM 868 C THR A 52 2.916 0.316 -16.997 1.00 61.13 C ATOM 869 O THR A 52 4.066 0.710 -16.808 1.00 21.54 O ATOM 870 CB THR A 52 0.828 0.832 -15.733 1.00 33.24 C ATOM 871 OG1 THR A 52 0.012 0.707 -16.903 1.00 13.23 O ATOM 872 CG2 THR A 52 1.284 2.275 -15.577 1.00 75.23 C ATOM 0 H THR A 52 3.157 0.763 -14.291 1.00 71.51 H new ATOM 0 HA THR A 52 1.680 -1.132 -16.005 1.00 31.42 H new ATOM 0 HB THR A 52 0.246 0.555 -14.854 1.00 33.24 H new ATOM 0 HG1 THR A 52 -0.755 1.312 -16.833 1.00 13.23 H new ATOM 0 HG21 THR A 52 0.413 2.927 -15.511 1.00 75.23 H new ATOM 0 HG22 THR A 52 1.880 2.372 -14.670 1.00 75.23 H new ATOM 0 HG23 THR A 52 1.886 2.561 -16.439 1.00 75.23 H new ATOM 880 N ASN A 53 2.367 0.241 -18.205 1.00 52.42 N ATOM 881 CA ASN A 53 3.102 0.627 -19.404 1.00 62.43 C ATOM 882 C ASN A 53 3.567 2.077 -19.315 1.00 10.01 C ATOM 883 O ASN A 53 4.516 2.479 -19.988 1.00 4.22 O ATOM 884 CB ASN A 53 2.230 0.435 -20.647 1.00 32.55 C ATOM 885 CG ASN A 53 0.954 1.253 -20.589 1.00 63.34 C ATOM 886 OD1 ASN A 53 0.982 2.477 -20.720 1.00 23.41 O ATOM 887 ND2 ASN A 53 -0.173 0.578 -20.393 1.00 43.33 N ATOM 0 H ASN A 53 1.416 -0.083 -18.380 1.00 52.42 H new ATOM 0 HA ASN A 53 3.981 -0.013 -19.482 1.00 62.43 H new ATOM 0 HB2 ASN A 53 2.799 0.716 -21.534 1.00 32.55 H new ATOM 0 HB3 ASN A 53 1.978 -0.620 -20.751 1.00 32.55 H new ATOM 0 HD21 ASN A 53 -1.063 1.074 -20.346 1.00 43.33 H new ATOM 0 HD22 ASN A 53 -0.148 -0.436 -20.290 1.00 43.33 H new ATOM 894 N LYS A 54 2.892 2.858 -18.479 1.00 53.50 N ATOM 895 CA LYS A 54 3.235 4.264 -18.299 1.00 1.04 C ATOM 896 C LYS A 54 4.567 4.409 -17.570 1.00 44.53 C ATOM 897 O LYS A 54 5.423 5.196 -17.975 1.00 13.41 O ATOM 898 CB LYS A 54 2.133 4.983 -17.517 1.00 3.20 C ATOM 899 CG LYS A 54 0.760 4.867 -18.155 1.00 71.01 C ATOM 900 CD LYS A 54 0.649 5.730 -19.401 1.00 30.11 C ATOM 901 CE LYS A 54 0.258 7.159 -19.056 1.00 64.22 C ATOM 902 NZ LYS A 54 -1.182 7.268 -18.695 1.00 11.33 N ATOM 0 H LYS A 54 2.104 2.541 -17.915 1.00 53.50 H new ATOM 0 HA LYS A 54 3.328 4.719 -19.285 1.00 1.04 H new ATOM 0 HB2 LYS A 54 2.091 4.575 -16.507 1.00 3.20 H new ATOM 0 HB3 LYS A 54 2.394 6.037 -17.424 1.00 3.20 H new ATOM 0 HG2 LYS A 54 0.565 3.826 -18.414 1.00 71.01 H new ATOM 0 HG3 LYS A 54 -0.003 5.165 -17.436 1.00 71.01 H new ATOM 0 HD2 LYS A 54 1.602 5.730 -19.931 1.00 30.11 H new ATOM 0 HD3 LYS A 54 -0.092 5.302 -20.077 1.00 30.11 H new ATOM 0 HE2 LYS A 54 0.868 7.512 -18.225 1.00 64.22 H new ATOM 0 HE3 LYS A 54 0.470 7.809 -19.905 1.00 64.22 H new ATOM 0 HZ1 LYS A 54 -1.453 8.271 -18.649 1.00 11.33 H new ATOM 0 HZ2 LYS A 54 -1.758 6.786 -19.415 1.00 11.33 H new ATOM 0 HZ3 LYS A 54 -1.342 6.823 -17.769 1.00 11.33 H new ATOM 916 N GLN A 55 4.736 3.645 -16.496 1.00 41.02 N ATOM 917 CA GLN A 55 5.965 3.689 -15.713 1.00 42.31 C ATOM 918 C GLN A 55 7.031 2.784 -16.321 1.00 60.40 C ATOM 919 O GLN A 55 8.229 3.014 -16.148 1.00 73.14 O ATOM 920 CB GLN A 55 5.689 3.273 -14.267 1.00 60.34 C ATOM 921 CG GLN A 55 5.412 4.444 -13.339 1.00 3.11 C ATOM 922 CD GLN A 55 6.602 5.374 -13.202 1.00 53.12 C ATOM 923 OE1 GLN A 55 7.719 5.033 -13.592 1.00 52.31 O ATOM 924 NE2 GLN A 55 6.368 6.557 -12.646 1.00 53.12 N ATOM 0 H GLN A 55 4.037 2.988 -16.148 1.00 41.02 H new ATOM 0 HA GLN A 55 6.336 4.714 -15.724 1.00 42.31 H new ATOM 0 HB2 GLN A 55 4.835 2.596 -14.249 1.00 60.34 H new ATOM 0 HB3 GLN A 55 6.545 2.715 -13.889 1.00 60.34 H new ATOM 0 HG2 GLN A 55 4.557 5.007 -13.715 1.00 3.11 H new ATOM 0 HG3 GLN A 55 5.136 4.065 -12.355 1.00 3.11 H new ATOM 0 HE21 GLN A 55 5.426 6.798 -12.337 1.00 53.12 H new ATOM 0 HE22 GLN A 55 7.130 7.225 -12.528 1.00 53.12 H new ATOM 933 N LEU A 56 6.588 1.753 -17.033 1.00 24.14 N ATOM 934 CA LEU A 56 7.505 0.811 -17.667 1.00 14.13 C ATOM 935 C LEU A 56 8.584 1.548 -18.453 1.00 63.52 C ATOM 936 O LEU A 56 8.285 2.350 -19.338 1.00 44.12 O ATOM 937 CB LEU A 56 6.736 -0.133 -18.594 1.00 4.54 C ATOM 938 CG LEU A 56 7.576 -0.899 -19.617 1.00 13.23 C ATOM 939 CD1 LEU A 56 6.950 -2.253 -19.913 1.00 42.14 C ATOM 940 CD2 LEU A 56 7.729 -0.088 -20.895 1.00 73.24 C ATOM 0 H LEU A 56 5.601 1.548 -17.186 1.00 24.14 H new ATOM 0 HA LEU A 56 7.988 0.227 -16.883 1.00 14.13 H new ATOM 0 HB2 LEU A 56 6.199 -0.856 -17.980 1.00 4.54 H new ATOM 0 HB3 LEU A 56 5.986 0.448 -19.131 1.00 4.54 H new ATOM 0 HG LEU A 56 8.567 -1.065 -19.195 1.00 13.23 H new ATOM 0 HD11 LEU A 56 7.561 -2.784 -20.643 1.00 42.14 H new ATOM 0 HD12 LEU A 56 6.893 -2.836 -18.994 1.00 42.14 H new ATOM 0 HD13 LEU A 56 5.947 -2.110 -20.315 1.00 42.14 H new ATOM 0 HD21 LEU A 56 8.329 -0.648 -21.612 1.00 73.24 H new ATOM 0 HD22 LEU A 56 6.745 0.109 -21.321 1.00 73.24 H new ATOM 0 HD23 LEU A 56 8.222 0.857 -20.669 1.00 73.24 H new ATOM 952 N THR A 57 9.842 1.268 -18.126 1.00 62.12 N ATOM 953 CA THR A 57 10.967 1.902 -18.802 1.00 52.31 C ATOM 954 C THR A 57 11.949 0.863 -19.330 1.00 33.41 C ATOM 955 O THR A 57 11.679 -0.338 -19.287 1.00 52.21 O ATOM 956 CB THR A 57 11.714 2.868 -17.863 1.00 64.22 C ATOM 957 OG1 THR A 57 12.357 2.133 -16.815 1.00 52.14 O ATOM 958 CG2 THR A 57 10.758 3.887 -17.262 1.00 44.13 C ATOM 0 H THR A 57 10.107 0.606 -17.397 1.00 62.12 H new ATOM 0 HA THR A 57 10.555 2.466 -19.639 1.00 52.31 H new ATOM 0 HB THR A 57 12.465 3.399 -18.447 1.00 64.22 H new ATOM 0 HG1 THR A 57 12.831 2.754 -16.223 1.00 52.14 H new ATOM 0 HG21 THR A 57 11.309 4.558 -16.603 1.00 44.13 H new ATOM 0 HG22 THR A 57 10.293 4.464 -18.061 1.00 44.13 H new ATOM 0 HG23 THR A 57 9.987 3.370 -16.691 1.00 44.13 H new ATOM 966 N ARG A 58 13.089 1.331 -19.827 1.00 31.12 N ATOM 967 CA ARG A 58 14.111 0.441 -20.364 1.00 21.45 C ATOM 968 C ARG A 58 14.426 -0.682 -19.379 1.00 52.10 C ATOM 969 O ARG A 58 14.500 -1.851 -19.758 1.00 44.31 O ATOM 970 CB ARG A 58 15.385 1.226 -20.683 1.00 32.44 C ATOM 971 CG ARG A 58 16.448 0.400 -21.389 1.00 53.44 C ATOM 972 CD ARG A 58 16.126 0.223 -22.865 1.00 13.40 C ATOM 973 NE ARG A 58 16.168 1.490 -23.590 1.00 41.23 N ATOM 974 CZ ARG A 58 17.293 2.060 -24.009 1.00 13.24 C ATOM 975 NH1 ARG A 58 18.461 1.479 -23.775 1.00 62.10 N ATOM 976 NH2 ARG A 58 17.250 3.214 -24.663 1.00 12.05 N ATOM 0 H ARG A 58 13.328 2.322 -19.869 1.00 31.12 H new ATOM 0 HA ARG A 58 13.726 -0.002 -21.282 1.00 21.45 H new ATOM 0 HB2 ARG A 58 15.128 2.082 -21.307 1.00 32.44 H new ATOM 0 HB3 ARG A 58 15.800 1.621 -19.756 1.00 32.44 H new ATOM 0 HG2 ARG A 58 17.418 0.886 -21.283 1.00 53.44 H new ATOM 0 HG3 ARG A 58 16.527 -0.577 -20.913 1.00 53.44 H new ATOM 0 HD2 ARG A 58 16.837 -0.473 -23.310 1.00 13.40 H new ATOM 0 HD3 ARG A 58 15.136 -0.222 -22.969 1.00 13.40 H new ATOM 0 HE ARG A 58 15.286 1.963 -23.785 1.00 41.23 H new ATOM 0 HH11 ARG A 58 18.498 0.592 -23.272 1.00 62.10 H new ATOM 0 HH12 ARG A 58 19.323 1.919 -24.098 1.00 62.10 H new ATOM 0 HH21 ARG A 58 16.353 3.664 -24.844 1.00 12.05 H new ATOM 0 HH22 ARG A 58 18.114 3.651 -24.984 1.00 12.05 H new ATOM 990 N SER A 59 14.610 -0.318 -18.114 1.00 31.21 N ATOM 991 CA SER A 59 14.921 -1.294 -17.076 1.00 11.24 C ATOM 992 C SER A 59 13.789 -2.305 -16.923 1.00 55.24 C ATOM 993 O SER A 59 14.015 -3.455 -16.546 1.00 13.42 O ATOM 994 CB SER A 59 15.172 -0.588 -15.742 1.00 3.22 C ATOM 995 OG SER A 59 15.668 0.724 -15.945 1.00 11.14 O ATOM 0 H SER A 59 14.549 0.645 -17.783 1.00 31.21 H new ATOM 0 HA SER A 59 15.824 -1.828 -17.373 1.00 11.24 H new ATOM 0 HB2 SER A 59 14.245 -0.545 -15.169 1.00 3.22 H new ATOM 0 HB3 SER A 59 15.885 -1.163 -15.151 1.00 3.22 H new ATOM 0 HG SER A 59 15.819 1.155 -15.078 1.00 11.14 H new ATOM 1001 N ASP A 60 12.570 -1.867 -17.220 1.00 32.41 N ATOM 1002 CA ASP A 60 11.401 -2.733 -17.118 1.00 33.14 C ATOM 1003 C ASP A 60 11.345 -3.712 -18.286 1.00 44.14 C ATOM 1004 O ASP A 60 10.881 -4.842 -18.141 1.00 35.54 O ATOM 1005 CB ASP A 60 10.121 -1.896 -17.076 1.00 45.24 C ATOM 1006 CG ASP A 60 8.872 -2.751 -17.007 1.00 33.13 C ATOM 1007 OD1 ASP A 60 8.656 -3.562 -17.931 1.00 52.24 O ATOM 1008 OD2 ASP A 60 8.109 -2.609 -16.028 1.00 31.12 O ATOM 0 H ASP A 60 12.366 -0.918 -17.533 1.00 32.41 H new ATOM 0 HA ASP A 60 11.483 -3.304 -16.193 1.00 33.14 H new ATOM 0 HB2 ASP A 60 10.152 -1.233 -16.211 1.00 45.24 H new ATOM 0 HB3 ASP A 60 10.076 -1.262 -17.962 1.00 45.24 H new ATOM 1013 N ARG A 61 11.822 -3.269 -19.445 1.00 75.05 N ATOM 1014 CA ARG A 61 11.824 -4.105 -20.640 1.00 0.01 C ATOM 1015 C ARG A 61 12.921 -5.163 -20.561 1.00 12.12 C ATOM 1016 O ARG A 61 12.725 -6.305 -20.974 1.00 71.13 O ATOM 1017 CB ARG A 61 12.019 -3.245 -21.890 1.00 4.11 C ATOM 1018 CG ARG A 61 10.871 -3.340 -22.881 1.00 33.54 C ATOM 1019 CD ARG A 61 10.280 -1.972 -23.182 1.00 32.10 C ATOM 1020 NE ARG A 61 9.470 -1.981 -24.397 1.00 70.33 N ATOM 1021 CZ ARG A 61 9.166 -0.887 -25.086 1.00 13.21 C ATOM 1022 NH1 ARG A 61 9.602 0.298 -24.681 1.00 61.11 N ATOM 1023 NH2 ARG A 61 8.424 -0.976 -26.182 1.00 73.34 N ATOM 0 H ARG A 61 12.212 -2.336 -19.582 1.00 75.05 H new ATOM 0 HA ARG A 61 10.860 -4.610 -20.702 1.00 0.01 H new ATOM 0 HB2 ARG A 61 12.143 -2.205 -21.589 1.00 4.11 H new ATOM 0 HB3 ARG A 61 12.942 -3.545 -22.386 1.00 4.11 H new ATOM 0 HG2 ARG A 61 11.224 -3.796 -23.806 1.00 33.54 H new ATOM 0 HG3 ARG A 61 10.095 -3.992 -22.480 1.00 33.54 H new ATOM 0 HD2 ARG A 61 9.667 -1.649 -22.340 1.00 32.10 H new ATOM 0 HD3 ARG A 61 11.085 -1.245 -23.288 1.00 32.10 H new ATOM 0 HE ARG A 61 9.118 -2.877 -24.735 1.00 70.33 H new ATOM 0 HH11 ARG A 61 10.172 0.371 -23.838 1.00 61.11 H new ATOM 0 HH12 ARG A 61 9.367 1.137 -25.212 1.00 61.11 H new ATOM 0 HH21 ARG A 61 8.086 -1.886 -26.497 1.00 73.34 H new ATOM 0 HH22 ARG A 61 8.191 -0.135 -26.710 1.00 73.34 H new ATOM 1037 N GLU A 62 14.074 -4.773 -20.027 1.00 64.33 N ATOM 1038 CA GLU A 62 15.202 -5.688 -19.896 1.00 21.32 C ATOM 1039 C GLU A 62 14.914 -6.760 -18.848 1.00 41.30 C ATOM 1040 O GLU A 62 15.215 -7.937 -19.048 1.00 42.51 O ATOM 1041 CB GLU A 62 16.470 -4.919 -19.520 1.00 23.44 C ATOM 1042 CG GLU A 62 16.385 -4.228 -18.169 1.00 53.34 C ATOM 1043 CD GLU A 62 17.628 -3.422 -17.847 1.00 23.45 C ATOM 1044 OE1 GLU A 62 17.868 -2.403 -18.528 1.00 31.42 O ATOM 1045 OE2 GLU A 62 18.362 -3.811 -16.914 1.00 12.24 O ATOM 0 H GLU A 62 14.252 -3.831 -19.678 1.00 64.33 H new ATOM 0 HA GLU A 62 15.354 -6.177 -20.858 1.00 21.32 H new ATOM 0 HB2 GLU A 62 17.314 -5.608 -19.514 1.00 23.44 H new ATOM 0 HB3 GLU A 62 16.673 -4.173 -20.288 1.00 23.44 H new ATOM 0 HG2 GLU A 62 15.516 -3.570 -18.156 1.00 53.34 H new ATOM 0 HG3 GLU A 62 16.230 -4.976 -17.392 1.00 53.34 H new ATOM 1052 N VAL A 63 14.329 -6.343 -17.729 1.00 62.04 N ATOM 1053 CA VAL A 63 14.000 -7.266 -16.650 1.00 15.44 C ATOM 1054 C VAL A 63 12.918 -8.250 -17.079 1.00 71.42 C ATOM 1055 O VAL A 63 12.978 -9.437 -16.753 1.00 13.30 O ATOM 1056 CB VAL A 63 13.523 -6.512 -15.394 1.00 30.34 C ATOM 1057 CG1 VAL A 63 14.635 -5.631 -14.846 1.00 13.44 C ATOM 1058 CG2 VAL A 63 12.283 -5.688 -15.705 1.00 73.54 C ATOM 0 H VAL A 63 14.074 -5.372 -17.547 1.00 62.04 H new ATOM 0 HA VAL A 63 14.912 -7.814 -16.413 1.00 15.44 H new ATOM 0 HB VAL A 63 13.262 -7.244 -14.630 1.00 30.34 H new ATOM 0 HG11 VAL A 63 14.280 -5.106 -13.959 1.00 13.44 H new ATOM 0 HG12 VAL A 63 15.493 -6.250 -14.582 1.00 13.44 H new ATOM 0 HG13 VAL A 63 14.930 -4.905 -15.603 1.00 13.44 H new ATOM 0 HG21 VAL A 63 11.961 -5.162 -14.806 1.00 73.54 H new ATOM 0 HG22 VAL A 63 12.514 -4.963 -16.486 1.00 73.54 H new ATOM 0 HG23 VAL A 63 11.485 -6.347 -16.046 1.00 73.54 H new ATOM 1068 N LEU A 64 11.929 -7.752 -17.813 1.00 45.43 N ATOM 1069 CA LEU A 64 10.833 -8.588 -18.289 1.00 52.33 C ATOM 1070 C LEU A 64 11.342 -9.659 -19.248 1.00 74.31 C ATOM 1071 O LEU A 64 10.959 -10.825 -19.152 1.00 34.35 O ATOM 1072 CB LEU A 64 9.774 -7.728 -18.982 1.00 71.42 C ATOM 1073 CG LEU A 64 8.414 -7.649 -18.287 1.00 43.41 C ATOM 1074 CD1 LEU A 64 8.581 -7.729 -16.778 1.00 31.34 C ATOM 1075 CD2 LEU A 64 7.690 -6.369 -18.678 1.00 12.31 C ATOM 0 H LEU A 64 11.864 -6.773 -18.091 1.00 45.43 H new ATOM 0 HA LEU A 64 10.384 -9.082 -17.427 1.00 52.33 H new ATOM 0 HB2 LEU A 64 10.167 -6.716 -19.085 1.00 71.42 H new ATOM 0 HB3 LEU A 64 9.623 -8.115 -19.990 1.00 71.42 H new ATOM 0 HG LEU A 64 7.811 -8.498 -18.611 1.00 43.41 H new ATOM 0 HD11 LEU A 64 7.603 -7.671 -16.300 1.00 31.34 H new ATOM 0 HD12 LEU A 64 9.059 -8.673 -16.514 1.00 31.34 H new ATOM 0 HD13 LEU A 64 9.201 -6.901 -16.436 1.00 31.34 H new ATOM 0 HD21 LEU A 64 6.724 -6.329 -18.175 1.00 12.31 H new ATOM 0 HD22 LEU A 64 8.289 -5.507 -18.383 1.00 12.31 H new ATOM 0 HD23 LEU A 64 7.538 -6.352 -19.757 1.00 12.31 H new ATOM 1087 N ASP A 65 12.208 -9.257 -20.171 1.00 52.42 N ATOM 1088 CA ASP A 65 12.772 -10.183 -21.146 1.00 3.11 C ATOM 1089 C ASP A 65 13.559 -11.290 -20.451 1.00 40.03 C ATOM 1090 O ASP A 65 13.468 -12.458 -20.825 1.00 73.35 O ATOM 1091 CB ASP A 65 13.677 -9.436 -22.127 1.00 1.31 C ATOM 1092 CG ASP A 65 13.271 -9.655 -23.571 1.00 63.31 C ATOM 1093 OD1 ASP A 65 13.483 -10.774 -24.083 1.00 23.32 O ATOM 1094 OD2 ASP A 65 12.743 -8.708 -24.190 1.00 14.21 O ATOM 0 H ASP A 65 12.535 -8.295 -20.265 1.00 52.42 H new ATOM 0 HA ASP A 65 11.949 -10.637 -21.697 1.00 3.11 H new ATOM 0 HB2 ASP A 65 13.649 -8.370 -21.903 1.00 1.31 H new ATOM 0 HB3 ASP A 65 14.707 -9.764 -21.989 1.00 1.31 H new ATOM 1099 N ASN A 66 14.333 -10.913 -19.438 1.00 74.13 N ATOM 1100 CA ASN A 66 15.137 -11.874 -18.692 1.00 50.12 C ATOM 1101 C ASN A 66 14.252 -12.781 -17.843 1.00 11.14 C ATOM 1102 O ASN A 66 14.428 -13.999 -17.827 1.00 71.13 O ATOM 1103 CB ASN A 66 16.144 -11.144 -17.800 1.00 73.35 C ATOM 1104 CG ASN A 66 17.048 -12.101 -17.047 1.00 43.54 C ATOM 1105 OD1 ASN A 66 17.030 -12.151 -15.817 1.00 61.15 O ATOM 1106 ND2 ASN A 66 17.846 -12.865 -17.785 1.00 11.44 N ATOM 0 H ASN A 66 14.420 -9.949 -19.115 1.00 74.13 H new ATOM 0 HA ASN A 66 15.678 -12.492 -19.409 1.00 50.12 H new ATOM 0 HB2 ASN A 66 16.753 -10.479 -18.413 1.00 73.35 H new ATOM 0 HB3 ASN A 66 15.607 -10.518 -17.087 1.00 73.35 H new ATOM 0 HD21 ASN A 66 18.478 -13.527 -17.335 1.00 11.44 H new ATOM 0 HD22 ASN A 66 17.827 -12.789 -18.802 1.00 11.44 H new ATOM 1113 N TRP A 67 13.301 -12.178 -17.138 1.00 72.43 N ATOM 1114 CA TRP A 67 12.387 -12.932 -16.287 1.00 5.25 C ATOM 1115 C TRP A 67 11.775 -14.103 -17.047 1.00 53.40 C ATOM 1116 O TRP A 67 11.761 -15.233 -16.559 1.00 14.45 O ATOM 1117 CB TRP A 67 11.282 -12.018 -15.755 1.00 51.14 C ATOM 1118 CG TRP A 67 10.806 -12.396 -14.385 1.00 40.43 C ATOM 1119 CD1 TRP A 67 11.578 -12.605 -13.278 1.00 61.35 C ATOM 1120 CD2 TRP A 67 9.450 -12.610 -13.978 1.00 24.31 C ATOM 1121 NE1 TRP A 67 10.784 -12.937 -12.207 1.00 71.44 N ATOM 1122 CE2 TRP A 67 9.475 -12.946 -12.610 1.00 73.41 C ATOM 1123 CE3 TRP A 67 8.218 -12.549 -14.634 1.00 64.25 C ATOM 1124 CZ2 TRP A 67 8.315 -13.221 -11.891 1.00 12.14 C ATOM 1125 CZ3 TRP A 67 7.068 -12.822 -13.919 1.00 61.31 C ATOM 1126 CH2 TRP A 67 7.122 -13.154 -12.559 1.00 4.13 C ATOM 0 H TRP A 67 13.143 -11.170 -17.139 1.00 72.43 H new ATOM 0 HA TRP A 67 12.957 -13.328 -15.446 1.00 5.25 H new ATOM 0 HB2 TRP A 67 11.648 -10.992 -15.734 1.00 51.14 H new ATOM 0 HB3 TRP A 67 10.438 -12.041 -16.444 1.00 51.14 H new ATOM 0 HD1 TRP A 67 12.654 -12.522 -13.249 1.00 61.35 H new ATOM 0 HE1 TRP A 67 11.116 -13.143 -11.265 1.00 71.44 H new ATOM 0 HE3 TRP A 67 8.166 -12.293 -15.682 1.00 64.25 H new ATOM 0 HZ2 TRP A 67 8.355 -13.478 -10.843 1.00 12.14 H new ATOM 0 HZ3 TRP A 67 6.111 -12.779 -14.417 1.00 61.31 H new ATOM 0 HH2 TRP A 67 6.205 -13.361 -12.027 1.00 4.13 H new ATOM 1137 N ARG A 68 11.269 -13.825 -18.245 1.00 25.44 N ATOM 1138 CA ARG A 68 10.655 -14.857 -19.072 1.00 15.53 C ATOM 1139 C ARG A 68 11.711 -15.801 -19.638 1.00 52.45 C ATOM 1140 O ARG A 68 11.409 -16.936 -20.004 1.00 63.11 O ATOM 1141 CB ARG A 68 9.860 -14.219 -20.213 1.00 3.51 C ATOM 1142 CG ARG A 68 10.680 -13.991 -21.472 1.00 51.24 C ATOM 1143 CD ARG A 68 10.210 -12.757 -22.227 1.00 61.14 C ATOM 1144 NE ARG A 68 9.416 -13.104 -23.403 1.00 33.23 N ATOM 1145 CZ ARG A 68 8.110 -13.347 -23.362 1.00 2.51 C ATOM 1146 NH1 ARG A 68 7.456 -13.279 -22.211 1.00 32.42 N ATOM 1147 NH2 ARG A 68 7.457 -13.656 -24.474 1.00 73.24 N ATOM 0 H ARG A 68 11.272 -12.895 -18.664 1.00 25.44 H new ATOM 0 HA ARG A 68 9.977 -15.435 -18.444 1.00 15.53 H new ATOM 0 HB2 ARG A 68 9.010 -14.857 -20.454 1.00 3.51 H new ATOM 0 HB3 ARG A 68 9.456 -13.265 -19.874 1.00 3.51 H new ATOM 0 HG2 ARG A 68 11.731 -13.879 -21.207 1.00 51.24 H new ATOM 0 HG3 ARG A 68 10.606 -14.865 -22.119 1.00 51.24 H new ATOM 0 HD2 ARG A 68 9.617 -12.129 -21.562 1.00 61.14 H new ATOM 0 HD3 ARG A 68 11.075 -12.169 -22.534 1.00 61.14 H new ATOM 0 HE ARG A 68 9.890 -13.163 -24.304 1.00 33.23 H new ATOM 0 HH11 ARG A 68 7.955 -13.040 -21.354 1.00 32.42 H new ATOM 0 HH12 ARG A 68 6.454 -13.466 -22.182 1.00 32.42 H new ATOM 0 HH21 ARG A 68 7.957 -13.707 -25.362 1.00 73.24 H new ATOM 0 HH22 ARG A 68 6.455 -13.842 -24.442 1.00 73.24 H new ATOM 1161 N GLU A 69 12.949 -15.322 -19.708 1.00 50.43 N ATOM 1162 CA GLU A 69 14.049 -16.123 -20.232 1.00 31.00 C ATOM 1163 C GLU A 69 14.473 -17.189 -19.226 1.00 12.15 C ATOM 1164 O GLU A 69 14.797 -18.317 -19.598 1.00 72.33 O ATOM 1165 CB GLU A 69 15.242 -15.229 -20.577 1.00 54.21 C ATOM 1166 CG GLU A 69 16.505 -15.576 -19.808 1.00 63.01 C ATOM 1167 CD GLU A 69 17.692 -14.728 -20.223 1.00 21.30 C ATOM 1168 OE1 GLU A 69 17.491 -13.535 -20.531 1.00 71.10 O ATOM 1169 OE2 GLU A 69 18.823 -15.259 -20.239 1.00 54.12 O ATOM 0 H GLU A 69 13.215 -14.384 -19.409 1.00 50.43 H new ATOM 0 HA GLU A 69 13.703 -16.620 -21.138 1.00 31.00 H new ATOM 0 HB2 GLU A 69 15.445 -15.305 -21.645 1.00 54.21 H new ATOM 0 HB3 GLU A 69 14.978 -14.191 -20.375 1.00 54.21 H new ATOM 0 HG2 GLU A 69 16.324 -15.444 -18.741 1.00 63.01 H new ATOM 0 HG3 GLU A 69 16.743 -16.628 -19.963 1.00 63.01 H new ATOM 1176 N LEU A 70 14.469 -16.823 -17.948 1.00 75.15 N ATOM 1177 CA LEU A 70 14.853 -17.747 -16.887 1.00 11.33 C ATOM 1178 C LEU A 70 13.744 -18.759 -16.618 1.00 63.42 C ATOM 1179 O LEU A 70 14.007 -19.949 -16.444 1.00 53.10 O ATOM 1180 CB LEU A 70 15.176 -16.976 -15.606 1.00 4.14 C ATOM 1181 CG LEU A 70 15.862 -15.622 -15.792 1.00 42.00 C ATOM 1182 CD1 LEU A 70 15.128 -14.540 -15.015 1.00 74.25 C ATOM 1183 CD2 LEU A 70 17.319 -15.697 -15.357 1.00 75.43 C ATOM 0 H LEU A 70 14.204 -15.893 -17.622 1.00 75.15 H new ATOM 0 HA LEU A 70 15.741 -18.288 -17.213 1.00 11.33 H new ATOM 0 HB2 LEU A 70 14.248 -16.818 -15.057 1.00 4.14 H new ATOM 0 HB3 LEU A 70 15.814 -17.601 -14.981 1.00 4.14 H new ATOM 0 HG LEU A 70 15.832 -15.365 -16.851 1.00 42.00 H new ATOM 0 HD11 LEU A 70 15.631 -13.584 -15.160 1.00 74.25 H new ATOM 0 HD12 LEU A 70 14.101 -14.468 -15.373 1.00 74.25 H new ATOM 0 HD13 LEU A 70 15.125 -14.792 -13.955 1.00 74.25 H new ATOM 0 HD21 LEU A 70 17.791 -14.724 -15.497 1.00 75.43 H new ATOM 0 HD22 LEU A 70 17.371 -15.978 -14.305 1.00 75.43 H new ATOM 0 HD23 LEU A 70 17.840 -16.443 -15.958 1.00 75.43 H new ATOM 1195 N GLU A 71 12.505 -18.279 -16.588 1.00 42.24 N ATOM 1196 CA GLU A 71 11.357 -19.143 -16.343 1.00 31.34 C ATOM 1197 C GLU A 71 11.152 -20.118 -17.499 1.00 24.02 C ATOM 1198 O GLU A 71 10.641 -21.222 -17.311 1.00 1.51 O ATOM 1199 CB GLU A 71 10.093 -18.305 -16.139 1.00 4.35 C ATOM 1200 CG GLU A 71 9.509 -17.761 -17.431 1.00 53.41 C ATOM 1201 CD GLU A 71 8.407 -18.641 -17.989 1.00 41.40 C ATOM 1202 OE1 GLU A 71 7.448 -18.934 -17.246 1.00 34.02 O ATOM 1203 OE2 GLU A 71 8.505 -19.036 -19.170 1.00 0.42 O ATOM 0 H GLU A 71 12.271 -17.297 -16.730 1.00 42.24 H new ATOM 0 HA GLU A 71 11.554 -19.716 -15.437 1.00 31.34 H new ATOM 0 HB2 GLU A 71 9.340 -18.914 -15.638 1.00 4.35 H new ATOM 0 HB3 GLU A 71 10.323 -17.472 -15.475 1.00 4.35 H new ATOM 0 HG2 GLU A 71 9.115 -16.760 -17.254 1.00 53.41 H new ATOM 0 HG3 GLU A 71 10.303 -17.665 -18.172 1.00 53.41 H new ATOM 1210 N MET A 72 11.555 -19.701 -18.695 1.00 21.13 N ATOM 1211 CA MET A 72 11.417 -20.537 -19.882 1.00 33.14 C ATOM 1212 C MET A 72 12.634 -21.440 -20.056 1.00 11.15 C ATOM 1213 O MET A 72 12.588 -22.427 -20.790 1.00 32.12 O ATOM 1214 CB MET A 72 11.231 -19.667 -21.126 1.00 12.41 C ATOM 1215 CG MET A 72 12.524 -19.054 -21.637 1.00 43.54 C ATOM 1216 SD MET A 72 12.284 -18.069 -23.129 1.00 21.21 S ATOM 1217 CE MET A 72 12.359 -19.340 -24.389 1.00 34.11 C ATOM 0 H MET A 72 11.979 -18.790 -18.868 1.00 21.13 H new ATOM 0 HA MET A 72 10.536 -21.166 -19.752 1.00 33.14 H new ATOM 0 HB2 MET A 72 10.786 -20.270 -21.918 1.00 12.41 H new ATOM 0 HB3 MET A 72 10.525 -18.868 -20.899 1.00 12.41 H new ATOM 0 HG2 MET A 72 12.957 -18.427 -20.858 1.00 43.54 H new ATOM 0 HG3 MET A 72 13.242 -19.848 -21.842 1.00 43.54 H new ATOM 0 HE1 MET A 72 12.227 -18.887 -25.371 1.00 34.11 H new ATOM 0 HE2 MET A 72 13.328 -19.838 -24.346 1.00 34.11 H new ATOM 0 HE3 MET A 72 11.568 -20.070 -24.217 1.00 34.11 H new ATOM 1227 N LYS A 73 13.722 -21.095 -19.376 1.00 25.30 N ATOM 1228 CA LYS A 73 14.952 -21.875 -19.454 1.00 44.41 C ATOM 1229 C LYS A 73 14.990 -22.942 -18.365 1.00 43.10 C ATOM 1230 O LYS A 73 15.826 -23.844 -18.396 1.00 62.44 O ATOM 1231 CB LYS A 73 16.171 -20.957 -19.327 1.00 34.25 C ATOM 1232 CG LYS A 73 16.693 -20.451 -20.660 1.00 11.32 C ATOM 1233 CD LYS A 73 18.210 -20.515 -20.726 1.00 34.35 C ATOM 1234 CE LYS A 73 18.852 -19.515 -19.777 1.00 13.14 C ATOM 1235 NZ LYS A 73 20.274 -19.853 -19.494 1.00 43.31 N ATOM 0 H LYS A 73 13.777 -20.280 -18.765 1.00 25.30 H new ATOM 0 HA LYS A 73 14.977 -22.371 -20.424 1.00 44.41 H new ATOM 0 HB2 LYS A 73 15.909 -20.104 -18.701 1.00 34.25 H new ATOM 0 HB3 LYS A 73 16.969 -21.495 -18.815 1.00 34.25 H new ATOM 0 HG2 LYS A 73 16.267 -21.046 -21.468 1.00 11.32 H new ATOM 0 HG3 LYS A 73 16.364 -19.423 -20.814 1.00 11.32 H new ATOM 0 HD2 LYS A 73 18.544 -21.522 -20.476 1.00 34.35 H new ATOM 0 HD3 LYS A 73 18.540 -20.314 -21.745 1.00 34.35 H new ATOM 0 HE2 LYS A 73 18.795 -18.516 -20.209 1.00 13.14 H new ATOM 0 HE3 LYS A 73 18.292 -19.490 -18.842 1.00 13.14 H new ATOM 0 HZ1 LYS A 73 20.565 -19.409 -18.600 1.00 43.31 H new ATOM 0 HZ2 LYS A 73 20.377 -20.885 -19.418 1.00 43.31 H new ATOM 0 HZ3 LYS A 73 20.875 -19.501 -20.267 1.00 43.31 H new ATOM 1249 N ALA A 74 14.079 -22.833 -17.404 1.00 11.11 N ATOM 1250 CA ALA A 74 14.006 -23.791 -16.308 1.00 5.34 C ATOM 1251 C ALA A 74 13.384 -25.105 -16.767 1.00 44.01 C ATOM 1252 O ALA A 74 13.236 -26.041 -15.981 1.00 45.20 O ATOM 1253 CB ALA A 74 13.214 -23.206 -15.148 1.00 32.42 C ATOM 0 H ALA A 74 13.381 -22.090 -17.362 1.00 11.11 H new ATOM 0 HA ALA A 74 15.022 -23.999 -15.972 1.00 5.34 H new ATOM 0 HB1 ALA A 74 13.167 -23.932 -14.336 1.00 32.42 H new ATOM 0 HB2 ALA A 74 13.703 -22.298 -14.795 1.00 32.42 H new ATOM 0 HB3 ALA A 74 12.204 -22.968 -15.481 1.00 32.42 H new ATOM 1259 N ARG A 75 13.021 -25.168 -18.044 1.00 3.10 N ATOM 1260 CA ARG A 75 12.413 -26.367 -18.607 1.00 61.31 C ATOM 1261 C ARG A 75 11.283 -26.874 -17.716 1.00 10.33 C ATOM 1262 O ARG A 75 11.087 -28.080 -17.567 1.00 64.23 O ATOM 1263 CB ARG A 75 13.466 -27.463 -18.786 1.00 11.21 C ATOM 1264 CG ARG A 75 13.311 -28.252 -20.076 1.00 35.15 C ATOM 1265 CD ARG A 75 14.375 -29.331 -20.200 1.00 10.00 C ATOM 1266 NE ARG A 75 14.240 -30.093 -21.439 1.00 1.42 N ATOM 1267 CZ ARG A 75 15.170 -30.923 -21.896 1.00 25.43 C ATOM 1268 NH1 ARG A 75 16.297 -31.099 -21.219 1.00 41.01 N ATOM 1269 NH2 ARG A 75 14.974 -31.581 -23.031 1.00 65.13 N ATOM 0 H ARG A 75 13.138 -24.403 -18.708 1.00 3.10 H new ATOM 0 HA ARG A 75 11.997 -26.109 -19.581 1.00 61.31 H new ATOM 0 HB2 ARG A 75 14.457 -27.010 -18.764 1.00 11.21 H new ATOM 0 HB3 ARG A 75 13.411 -28.150 -17.941 1.00 11.21 H new ATOM 0 HG2 ARG A 75 12.322 -28.709 -20.108 1.00 35.15 H new ATOM 0 HG3 ARG A 75 13.377 -27.575 -20.928 1.00 35.15 H new ATOM 0 HD2 ARG A 75 15.363 -28.872 -20.163 1.00 10.00 H new ATOM 0 HD3 ARG A 75 14.306 -30.008 -19.349 1.00 10.00 H new ATOM 0 HE ARG A 75 13.384 -29.981 -21.983 1.00 1.42 H new ATOM 0 HH11 ARG A 75 16.451 -30.596 -20.345 1.00 41.01 H new ATOM 0 HH12 ARG A 75 17.010 -31.737 -21.572 1.00 41.01 H new ATOM 0 HH21 ARG A 75 14.108 -31.450 -23.554 1.00 65.13 H new ATOM 0 HH22 ARG A 75 15.689 -32.218 -23.381 1.00 65.13 H new ATOM 1283 N LYS A 76 10.541 -25.944 -17.124 1.00 5.44 N ATOM 1284 CA LYS A 76 9.430 -26.294 -16.247 1.00 41.22 C ATOM 1285 C LYS A 76 8.726 -25.042 -15.734 1.00 43.51 C ATOM 1286 O LYS A 76 9.252 -23.934 -15.843 1.00 44.20 O ATOM 1287 CB LYS A 76 9.929 -27.131 -15.067 1.00 75.22 C ATOM 1288 CG LYS A 76 9.075 -28.356 -14.788 1.00 25.44 C ATOM 1289 CD LYS A 76 9.923 -29.536 -14.341 1.00 11.35 C ATOM 1290 CE LYS A 76 9.179 -30.410 -13.342 1.00 4.40 C ATOM 1291 NZ LYS A 76 8.234 -31.341 -14.017 1.00 31.54 N ATOM 0 H LYS A 76 10.689 -24.941 -17.236 1.00 5.44 H new ATOM 0 HA LYS A 76 8.715 -26.880 -16.824 1.00 41.22 H new ATOM 0 HB2 LYS A 76 10.953 -27.449 -15.265 1.00 75.22 H new ATOM 0 HB3 LYS A 76 9.956 -26.506 -14.174 1.00 75.22 H new ATOM 0 HG2 LYS A 76 8.341 -28.121 -14.017 1.00 25.44 H new ATOM 0 HG3 LYS A 76 8.519 -28.626 -15.686 1.00 25.44 H new ATOM 0 HD2 LYS A 76 10.205 -30.132 -15.209 1.00 11.35 H new ATOM 0 HD3 LYS A 76 10.847 -29.172 -13.891 1.00 11.35 H new ATOM 0 HE2 LYS A 76 9.897 -30.983 -12.755 1.00 4.40 H new ATOM 0 HE3 LYS A 76 8.630 -29.778 -12.644 1.00 4.40 H new ATOM 0 HZ1 LYS A 76 7.747 -31.919 -13.303 1.00 31.54 H new ATOM 0 HZ2 LYS A 76 7.533 -30.794 -14.556 1.00 31.54 H new ATOM 0 HZ3 LYS A 76 8.761 -31.962 -14.664 1.00 31.54 H new ATOM 1305 N ARG A 77 7.535 -25.225 -15.174 1.00 24.34 N ATOM 1306 CA ARG A 77 6.760 -24.110 -14.643 1.00 63.04 C ATOM 1307 C ARG A 77 6.806 -24.093 -13.118 1.00 52.33 C ATOM 1308 O ARG A 77 5.976 -24.716 -12.455 1.00 24.24 O ATOM 1309 CB ARG A 77 5.309 -24.197 -15.120 1.00 63.50 C ATOM 1310 CG ARG A 77 5.056 -23.480 -16.436 1.00 22.11 C ATOM 1311 CD ARG A 77 5.118 -21.970 -16.268 1.00 13.01 C ATOM 1312 NE ARG A 77 4.639 -21.267 -17.455 1.00 64.25 N ATOM 1313 CZ ARG A 77 4.403 -19.961 -17.491 1.00 15.43 C ATOM 1314 NH1 ARG A 77 4.599 -19.219 -16.410 1.00 1.44 N ATOM 1315 NH2 ARG A 77 3.969 -19.394 -18.609 1.00 54.31 N ATOM 0 H ARG A 77 7.085 -26.135 -15.076 1.00 24.34 H new ATOM 0 HA ARG A 77 7.202 -23.184 -15.012 1.00 63.04 H new ATOM 0 HB2 ARG A 77 5.034 -25.246 -15.229 1.00 63.50 H new ATOM 0 HB3 ARG A 77 4.658 -23.774 -14.355 1.00 63.50 H new ATOM 0 HG2 ARG A 77 5.795 -23.796 -17.172 1.00 22.11 H new ATOM 0 HG3 ARG A 77 4.078 -23.764 -16.824 1.00 22.11 H new ATOM 0 HD2 ARG A 77 4.519 -21.676 -15.406 1.00 13.01 H new ATOM 0 HD3 ARG A 77 6.145 -21.670 -16.059 1.00 13.01 H new ATOM 0 HE ARG A 77 4.477 -21.809 -18.303 1.00 64.25 H new ATOM 0 HH11 ARG A 77 4.932 -19.651 -15.548 1.00 1.44 H new ATOM 0 HH12 ARG A 77 4.417 -18.216 -16.440 1.00 1.44 H new ATOM 0 HH21 ARG A 77 3.816 -19.962 -19.443 1.00 54.31 H new ATOM 0 HH22 ARG A 77 3.788 -18.390 -18.635 1.00 54.31 H new ATOM 1329 N LEU A 78 7.780 -23.376 -12.569 1.00 13.41 N ATOM 1330 CA LEU A 78 7.934 -23.277 -11.122 1.00 3.04 C ATOM 1331 C LEU A 78 6.724 -22.597 -10.490 1.00 11.02 C ATOM 1332 O LEU A 78 5.955 -21.901 -11.154 1.00 5.35 O ATOM 1333 CB LEU A 78 9.207 -22.502 -10.777 1.00 10.35 C ATOM 1334 CG LEU A 78 10.482 -23.334 -10.636 1.00 3.52 C ATOM 1335 CD1 LEU A 78 10.652 -24.257 -11.832 1.00 43.54 C ATOM 1336 CD2 LEU A 78 11.695 -22.428 -10.482 1.00 5.12 C ATOM 0 H LEU A 78 8.475 -22.855 -13.104 1.00 13.41 H new ATOM 0 HA LEU A 78 8.010 -24.287 -10.720 1.00 3.04 H new ATOM 0 HB2 LEU A 78 9.371 -21.750 -11.549 1.00 10.35 H new ATOM 0 HB3 LEU A 78 9.041 -21.967 -9.842 1.00 10.35 H new ATOM 0 HG LEU A 78 10.396 -23.948 -9.739 1.00 3.52 H new ATOM 0 HD11 LEU A 78 11.565 -24.841 -11.714 1.00 43.54 H new ATOM 0 HD12 LEU A 78 9.797 -24.929 -11.897 1.00 43.54 H new ATOM 0 HD13 LEU A 78 10.717 -23.663 -12.744 1.00 43.54 H new ATOM 0 HD21 LEU A 78 12.594 -23.037 -10.383 1.00 5.12 H new ATOM 0 HD22 LEU A 78 11.785 -21.788 -11.360 1.00 5.12 H new ATOM 0 HD23 LEU A 78 11.576 -21.809 -9.593 1.00 5.12 H new ATOM 1348 N PRO A 79 6.550 -22.800 -9.176 1.00 34.45 N ATOM 1349 CA PRO A 79 5.436 -22.213 -8.424 1.00 61.24 C ATOM 1350 C PRO A 79 5.573 -20.702 -8.272 1.00 74.20 C ATOM 1351 O PRO A 79 4.582 -19.971 -8.312 1.00 22.24 O ATOM 1352 CB PRO A 79 5.529 -22.899 -7.059 1.00 14.10 C ATOM 1353 CG PRO A 79 6.959 -23.294 -6.930 1.00 2.04 C ATOM 1354 CD PRO A 79 7.427 -23.619 -8.321 1.00 55.14 C ATOM 0 HA PRO A 79 4.480 -22.363 -8.927 1.00 61.24 H new ATOM 0 HB2 PRO A 79 5.231 -22.225 -6.256 1.00 14.10 H new ATOM 0 HB3 PRO A 79 4.872 -23.767 -7.007 1.00 14.10 H new ATOM 0 HG2 PRO A 79 7.550 -22.486 -6.499 1.00 2.04 H new ATOM 0 HG3 PRO A 79 7.068 -24.155 -6.271 1.00 2.04 H new ATOM 0 HD2 PRO A 79 8.477 -23.364 -8.461 1.00 55.14 H new ATOM 0 HD3 PRO A 79 7.325 -24.682 -8.541 1.00 55.14 H new ATOM 1362 N THR A 80 6.806 -20.238 -8.098 1.00 24.51 N ATOM 1363 CA THR A 80 7.072 -18.814 -7.939 1.00 23.41 C ATOM 1364 C THR A 80 8.055 -18.317 -8.993 1.00 74.43 C ATOM 1365 O THR A 80 9.266 -18.492 -8.860 1.00 64.23 O ATOM 1366 CB THR A 80 7.636 -18.501 -6.540 1.00 42.11 C ATOM 1367 OG1 THR A 80 6.662 -18.812 -5.538 1.00 71.40 O ATOM 1368 CG2 THR A 80 8.032 -17.036 -6.432 1.00 32.01 C ATOM 0 H THR A 80 7.637 -20.828 -8.064 1.00 24.51 H new ATOM 0 HA THR A 80 6.119 -18.299 -8.063 1.00 23.41 H new ATOM 0 HB THR A 80 8.524 -19.114 -6.385 1.00 42.11 H new ATOM 0 HG1 THR A 80 7.029 -18.612 -4.652 1.00 71.40 H new ATOM 0 HG21 THR A 80 8.427 -16.838 -5.436 1.00 32.01 H new ATOM 0 HG22 THR A 80 8.795 -16.809 -7.177 1.00 32.01 H new ATOM 0 HG23 THR A 80 7.158 -16.409 -6.606 1.00 32.01 H new ATOM 1376 N THR A 81 7.525 -17.696 -10.042 1.00 42.35 N ATOM 1377 CA THR A 81 8.355 -17.173 -11.120 1.00 64.45 C ATOM 1378 C THR A 81 9.250 -16.042 -10.627 1.00 22.43 C ATOM 1379 O THR A 81 10.181 -15.627 -11.318 1.00 4.23 O ATOM 1380 CB THR A 81 7.497 -16.660 -12.292 1.00 3.30 C ATOM 1381 OG1 THR A 81 6.386 -17.537 -12.507 1.00 0.12 O ATOM 1382 CG2 THR A 81 8.324 -16.559 -13.565 1.00 20.20 C ATOM 0 H THR A 81 6.524 -17.543 -10.168 1.00 42.35 H new ATOM 0 HA THR A 81 8.976 -17.998 -11.468 1.00 64.45 H new ATOM 0 HB THR A 81 7.130 -15.666 -12.036 1.00 3.30 H new ATOM 0 HG1 THR A 81 5.845 -17.203 -13.253 1.00 0.12 H new ATOM 0 HG21 THR A 81 7.697 -16.195 -14.379 1.00 20.20 H new ATOM 0 HG22 THR A 81 9.152 -15.867 -13.407 1.00 20.20 H new ATOM 0 HG23 THR A 81 8.717 -17.542 -13.822 1.00 20.20 H new ATOM 1390 N LEU A 82 8.963 -15.548 -9.427 1.00 64.15 N ATOM 1391 CA LEU A 82 9.744 -14.464 -8.840 1.00 74.41 C ATOM 1392 C LEU A 82 11.088 -14.975 -8.332 1.00 10.25 C ATOM 1393 O LEU A 82 11.312 -15.069 -7.125 1.00 33.45 O ATOM 1394 CB LEU A 82 8.966 -13.813 -7.695 1.00 44.41 C ATOM 1395 CG LEU A 82 7.952 -12.741 -8.097 1.00 21.12 C ATOM 1396 CD1 LEU A 82 7.206 -12.228 -6.875 1.00 40.41 C ATOM 1397 CD2 LEU A 82 8.645 -11.596 -8.821 1.00 73.13 C ATOM 0 H LEU A 82 8.196 -15.880 -8.842 1.00 64.15 H new ATOM 0 HA LEU A 82 9.929 -13.720 -9.615 1.00 74.41 H new ATOM 0 HB2 LEU A 82 8.440 -14.596 -7.149 1.00 44.41 H new ATOM 0 HB3 LEU A 82 9.681 -13.367 -7.004 1.00 44.41 H new ATOM 0 HG LEU A 82 7.228 -13.189 -8.778 1.00 21.12 H new ATOM 0 HD11 LEU A 82 6.489 -11.466 -7.180 1.00 40.41 H new ATOM 0 HD12 LEU A 82 6.678 -13.054 -6.398 1.00 40.41 H new ATOM 0 HD13 LEU A 82 7.916 -11.796 -6.170 1.00 40.41 H new ATOM 0 HD21 LEU A 82 7.908 -10.843 -9.100 1.00 73.13 H new ATOM 0 HD22 LEU A 82 9.391 -11.149 -8.164 1.00 73.13 H new ATOM 0 HD23 LEU A 82 9.133 -11.975 -9.719 1.00 73.13 H new ATOM 1409 N PHE A 83 11.981 -15.301 -9.260 1.00 40.41 N ATOM 1410 CA PHE A 83 13.304 -15.800 -8.906 1.00 65.21 C ATOM 1411 C PHE A 83 14.368 -15.232 -9.841 1.00 23.01 C ATOM 1412 O PHE A 83 14.070 -14.427 -10.723 1.00 54.21 O ATOM 1413 CB PHE A 83 13.327 -17.329 -8.959 1.00 72.23 C ATOM 1414 CG PHE A 83 12.722 -17.894 -10.213 1.00 30.34 C ATOM 1415 CD1 PHE A 83 13.139 -17.455 -11.458 1.00 44.54 C ATOM 1416 CD2 PHE A 83 11.736 -18.865 -10.145 1.00 35.01 C ATOM 1417 CE1 PHE A 83 12.585 -17.973 -12.614 1.00 2.32 C ATOM 1418 CE2 PHE A 83 11.178 -19.387 -11.297 1.00 21.13 C ATOM 1419 CZ PHE A 83 11.602 -18.940 -12.533 1.00 5.44 C ATOM 0 H PHE A 83 11.812 -15.228 -10.263 1.00 40.41 H new ATOM 0 HA PHE A 83 13.527 -15.475 -7.890 1.00 65.21 H new ATOM 0 HB2 PHE A 83 14.358 -17.672 -8.876 1.00 72.23 H new ATOM 0 HB3 PHE A 83 12.790 -17.723 -8.096 1.00 72.23 H new ATOM 0 HD1 PHE A 83 13.907 -16.698 -11.527 1.00 44.54 H new ATOM 0 HD2 PHE A 83 11.400 -19.218 -9.181 1.00 35.01 H new ATOM 0 HE1 PHE A 83 12.920 -17.622 -13.579 1.00 2.32 H new ATOM 0 HE2 PHE A 83 10.411 -20.144 -11.230 1.00 21.13 H new ATOM 0 HZ PHE A 83 11.166 -19.346 -13.434 1.00 5.44 H new ATOM 1429 N PHE A 84 15.611 -15.657 -9.640 1.00 44.24 N ATOM 1430 CA PHE A 84 16.721 -15.190 -10.463 1.00 51.05 C ATOM 1431 C PHE A 84 17.817 -16.248 -10.550 1.00 74.44 C ATOM 1432 O PHE A 84 17.802 -17.234 -9.813 1.00 33.32 O ATOM 1433 CB PHE A 84 17.295 -13.891 -9.894 1.00 30.01 C ATOM 1434 CG PHE A 84 17.539 -13.942 -8.413 1.00 34.03 C ATOM 1435 CD1 PHE A 84 18.383 -14.896 -7.869 1.00 31.45 C ATOM 1436 CD2 PHE A 84 16.923 -13.036 -7.564 1.00 53.14 C ATOM 1437 CE1 PHE A 84 18.610 -14.946 -6.506 1.00 14.11 C ATOM 1438 CE2 PHE A 84 17.146 -13.080 -6.201 1.00 71.32 C ATOM 1439 CZ PHE A 84 17.989 -14.037 -5.671 1.00 63.21 C ATOM 0 H PHE A 84 15.875 -16.324 -8.915 1.00 44.24 H new ATOM 0 HA PHE A 84 16.341 -15.002 -11.467 1.00 51.05 H new ATOM 0 HB2 PHE A 84 18.233 -13.665 -10.401 1.00 30.01 H new ATOM 0 HB3 PHE A 84 16.609 -13.073 -10.113 1.00 30.01 H new ATOM 0 HD1 PHE A 84 18.870 -15.610 -8.517 1.00 31.45 H new ATOM 0 HD2 PHE A 84 16.261 -12.287 -7.973 1.00 53.14 H new ATOM 0 HE1 PHE A 84 19.271 -15.694 -6.095 1.00 14.11 H new ATOM 0 HE2 PHE A 84 16.662 -12.367 -5.551 1.00 71.32 H new ATOM 0 HZ PHE A 84 18.163 -14.075 -4.606 1.00 63.21 H new ATOM 1449 N ILE A 85 18.765 -16.037 -11.457 1.00 11.53 N ATOM 1450 CA ILE A 85 19.868 -16.971 -11.640 1.00 62.20 C ATOM 1451 C ILE A 85 21.123 -16.488 -10.921 1.00 43.03 C ATOM 1452 O ILE A 85 21.312 -15.289 -10.721 1.00 1.22 O ATOM 1453 CB ILE A 85 20.191 -17.175 -13.132 1.00 61.40 C ATOM 1454 CG1 ILE A 85 20.502 -15.833 -13.797 1.00 65.12 C ATOM 1455 CG2 ILE A 85 19.032 -17.865 -13.835 1.00 54.13 C ATOM 1456 CD1 ILE A 85 20.914 -15.958 -15.247 1.00 63.53 C ATOM 0 H ILE A 85 18.791 -15.227 -12.076 1.00 11.53 H new ATOM 0 HA ILE A 85 19.550 -17.922 -11.212 1.00 62.20 H new ATOM 0 HB ILE A 85 21.071 -17.812 -13.214 1.00 61.40 H new ATOM 0 HG12 ILE A 85 19.623 -15.192 -13.732 1.00 65.12 H new ATOM 0 HG13 ILE A 85 21.299 -15.338 -13.243 1.00 65.12 H new ATOM 0 HG21 ILE A 85 19.275 -18.002 -14.889 1.00 54.13 H new ATOM 0 HG22 ILE A 85 18.853 -18.837 -13.374 1.00 54.13 H new ATOM 0 HG23 ILE A 85 18.136 -17.251 -13.747 1.00 54.13 H new ATOM 0 HD11 ILE A 85 21.119 -14.968 -15.654 1.00 63.53 H new ATOM 0 HD12 ILE A 85 21.811 -16.573 -15.319 1.00 63.53 H new ATOM 0 HD13 ILE A 85 20.109 -16.424 -15.815 1.00 63.53 H new ATOM 1468 N GLU A 86 21.979 -17.430 -10.538 1.00 31.44 N ATOM 1469 CA GLU A 86 23.217 -17.100 -9.842 1.00 0.41 C ATOM 1470 C GLU A 86 24.054 -16.119 -10.658 1.00 3.11 C ATOM 1471 O GLU A 86 24.796 -15.307 -10.104 1.00 42.22 O ATOM 1472 CB GLU A 86 24.026 -18.368 -9.563 1.00 33.23 C ATOM 1473 CG GLU A 86 25.307 -18.115 -8.786 1.00 41.35 C ATOM 1474 CD GLU A 86 25.473 -19.057 -7.610 1.00 54.01 C ATOM 1475 OE1 GLU A 86 24.464 -19.342 -6.931 1.00 24.00 O ATOM 1476 OE2 GLU A 86 26.612 -19.510 -7.369 1.00 55.41 O ATOM 0 H GLU A 86 21.838 -18.427 -10.698 1.00 31.44 H new ATOM 0 HA GLU A 86 22.956 -16.629 -8.894 1.00 0.41 H new ATOM 0 HB2 GLU A 86 23.405 -19.069 -9.005 1.00 33.23 H new ATOM 0 HB3 GLU A 86 24.274 -18.846 -10.511 1.00 33.23 H new ATOM 0 HG2 GLU A 86 26.160 -18.222 -9.455 1.00 41.35 H new ATOM 0 HG3 GLU A 86 25.312 -17.086 -8.426 1.00 41.35 H new ATOM 1483 N THR A 87 23.930 -16.201 -11.979 1.00 44.41 N ATOM 1484 CA THR A 87 24.676 -15.323 -12.872 1.00 51.14 C ATOM 1485 C THR A 87 24.068 -13.925 -12.903 1.00 60.34 C ATOM 1486 O THR A 87 24.648 -12.998 -13.469 1.00 71.20 O ATOM 1487 CB THR A 87 24.717 -15.884 -14.306 1.00 61.32 C ATOM 1488 OG1 THR A 87 23.853 -17.021 -14.412 1.00 61.22 O ATOM 1489 CG2 THR A 87 26.134 -16.280 -14.692 1.00 24.44 C ATOM 0 H THR A 87 23.320 -16.866 -12.454 1.00 44.41 H new ATOM 0 HA THR A 87 25.692 -15.266 -12.483 1.00 51.14 H new ATOM 0 HB THR A 87 24.376 -15.104 -14.987 1.00 61.32 H new ATOM 0 HG1 THR A 87 23.796 -17.303 -15.349 1.00 61.22 H new ATOM 0 HG21 THR A 87 26.138 -16.673 -15.709 1.00 24.44 H new ATOM 0 HG22 THR A 87 26.783 -15.406 -14.639 1.00 24.44 H new ATOM 0 HG23 THR A 87 26.498 -17.045 -14.006 1.00 24.44 H new ATOM 1497 N ASP A 88 22.898 -13.781 -12.292 1.00 13.43 N ATOM 1498 CA ASP A 88 22.212 -12.494 -12.248 1.00 33.52 C ATOM 1499 C ASP A 88 22.457 -11.793 -10.916 1.00 3.23 C ATOM 1500 O ASP A 88 22.069 -10.639 -10.730 1.00 62.10 O ATOM 1501 CB ASP A 88 20.710 -12.685 -12.469 1.00 24.33 C ATOM 1502 CG ASP A 88 20.284 -12.335 -13.881 1.00 13.45 C ATOM 1503 OD1 ASP A 88 21.121 -12.451 -14.800 1.00 60.30 O ATOM 1504 OD2 ASP A 88 19.112 -11.944 -14.066 1.00 63.42 O ATOM 0 H ASP A 88 22.404 -14.539 -11.820 1.00 13.43 H new ATOM 0 HA ASP A 88 22.613 -11.869 -13.046 1.00 33.52 H new ATOM 0 HB2 ASP A 88 20.443 -13.721 -12.258 1.00 24.33 H new ATOM 0 HB3 ASP A 88 20.160 -12.064 -11.762 1.00 24.33 H new ATOM 1509 N ILE A 89 23.103 -12.497 -9.992 1.00 74.11 N ATOM 1510 CA ILE A 89 23.400 -11.942 -8.678 1.00 15.54 C ATOM 1511 C ILE A 89 24.897 -11.971 -8.394 1.00 25.43 C ATOM 1512 O ILE A 89 25.443 -11.050 -7.785 1.00 72.43 O ATOM 1513 CB ILE A 89 22.662 -12.707 -7.563 1.00 51.12 C ATOM 1514 CG1 ILE A 89 21.209 -12.964 -7.967 1.00 73.41 C ATOM 1515 CG2 ILE A 89 22.724 -11.930 -6.256 1.00 65.44 C ATOM 1516 CD1 ILE A 89 20.375 -11.706 -8.059 1.00 11.33 C ATOM 0 H ILE A 89 23.431 -13.453 -10.130 1.00 74.11 H new ATOM 0 HA ILE A 89 23.055 -10.908 -8.688 1.00 15.54 H new ATOM 0 HB ILE A 89 23.154 -13.668 -7.415 1.00 51.12 H new ATOM 0 HG12 ILE A 89 21.193 -13.472 -8.931 1.00 73.41 H new ATOM 0 HG13 ILE A 89 20.753 -13.640 -7.243 1.00 73.41 H new ATOM 0 HG21 ILE A 89 22.198 -12.484 -5.478 1.00 65.44 H new ATOM 0 HG22 ILE A 89 23.765 -11.793 -5.963 1.00 65.44 H new ATOM 0 HG23 ILE A 89 22.253 -10.956 -6.389 1.00 65.44 H new ATOM 0 HD11 ILE A 89 19.357 -11.965 -8.350 1.00 11.33 H new ATOM 0 HD12 ILE A 89 20.360 -11.208 -7.090 1.00 11.33 H new ATOM 0 HD13 ILE A 89 20.806 -11.037 -8.804 1.00 11.33 H new ATOM 1528 N ARG A 90 25.558 -13.035 -8.840 1.00 74.00 N ATOM 1529 CA ARG A 90 26.993 -13.185 -8.635 1.00 2.24 C ATOM 1530 C ARG A 90 27.737 -11.918 -9.049 1.00 33.24 C ATOM 1531 O ARG A 90 28.440 -11.294 -8.254 1.00 21.00 O ATOM 1532 CB ARG A 90 27.521 -14.381 -9.428 1.00 64.40 C ATOM 1533 CG ARG A 90 28.959 -14.217 -9.894 1.00 11.14 C ATOM 1534 CD ARG A 90 29.606 -15.561 -10.189 1.00 1.14 C ATOM 1535 NE ARG A 90 30.981 -15.415 -10.658 1.00 5.13 N ATOM 1536 CZ ARG A 90 31.693 -16.412 -11.171 1.00 73.51 C ATOM 1537 NH1 ARG A 90 31.161 -17.622 -11.281 1.00 51.03 N ATOM 1538 NH2 ARG A 90 32.938 -16.201 -11.576 1.00 44.01 N ATOM 0 H ARG A 90 25.122 -13.806 -9.346 1.00 74.00 H new ATOM 0 HA ARG A 90 27.167 -13.357 -7.573 1.00 2.24 H new ATOM 0 HB2 ARG A 90 27.448 -15.276 -8.810 1.00 64.40 H new ATOM 0 HB3 ARG A 90 26.882 -14.540 -10.297 1.00 64.40 H new ATOM 0 HG2 ARG A 90 28.984 -13.596 -10.789 1.00 11.14 H new ATOM 0 HG3 ARG A 90 29.533 -13.696 -9.128 1.00 11.14 H new ATOM 0 HD2 ARG A 90 29.593 -16.175 -9.288 1.00 1.14 H new ATOM 0 HD3 ARG A 90 29.020 -16.088 -10.942 1.00 1.14 H new ATOM 0 HE ARG A 90 31.419 -14.497 -10.588 1.00 5.13 H new ATOM 0 HH11 ARG A 90 30.203 -17.788 -10.971 1.00 51.03 H new ATOM 0 HH12 ARG A 90 31.709 -18.386 -11.675 1.00 51.03 H new ATOM 0 HH21 ARG A 90 33.350 -15.272 -11.494 1.00 44.01 H new ATOM 0 HH22 ARG A 90 33.483 -16.968 -11.970 1.00 44.01 H new ATOM 1552 N PRO A 91 27.579 -11.529 -10.322 1.00 42.14 N ATOM 1553 CA PRO A 91 28.227 -10.334 -10.871 1.00 4.01 C ATOM 1554 C PRO A 91 27.644 -9.045 -10.302 1.00 70.10 C ATOM 1555 O PRO A 91 27.951 -7.952 -10.776 1.00 54.24 O ATOM 1556 CB PRO A 91 27.943 -10.433 -12.372 1.00 34.24 C ATOM 1557 CG PRO A 91 26.700 -11.249 -12.468 1.00 61.43 C ATOM 1558 CD PRO A 91 26.756 -12.225 -11.325 1.00 55.13 C ATOM 0 HA PRO A 91 29.289 -10.298 -10.626 1.00 4.01 H new ATOM 0 HB2 PRO A 91 27.805 -9.447 -12.815 1.00 34.24 H new ATOM 0 HB3 PRO A 91 28.770 -10.907 -12.901 1.00 34.24 H new ATOM 0 HG2 PRO A 91 25.813 -10.619 -12.400 1.00 61.43 H new ATOM 0 HG3 PRO A 91 26.648 -11.770 -13.424 1.00 61.43 H new ATOM 0 HD2 PRO A 91 25.761 -12.452 -10.941 1.00 55.13 H new ATOM 0 HD3 PRO A 91 27.205 -13.171 -11.626 1.00 55.13 H new ATOM 1566 N MET A 92 26.802 -9.181 -9.283 1.00 21.52 N ATOM 1567 CA MET A 92 26.177 -8.027 -8.648 1.00 42.54 C ATOM 1568 C MET A 92 26.682 -7.852 -7.220 1.00 10.24 C ATOM 1569 O MET A 92 26.630 -6.755 -6.662 1.00 44.40 O ATOM 1570 CB MET A 92 24.655 -8.179 -8.649 1.00 10.01 C ATOM 1571 CG MET A 92 23.972 -7.459 -9.801 1.00 25.13 C ATOM 1572 SD MET A 92 22.370 -6.774 -9.339 1.00 51.43 S ATOM 1573 CE MET A 92 22.168 -5.510 -10.593 1.00 23.31 C ATOM 0 H MET A 92 26.537 -10.079 -8.879 1.00 21.52 H new ATOM 0 HA MET A 92 26.446 -7.139 -9.220 1.00 42.54 H new ATOM 0 HB2 MET A 92 24.404 -9.239 -8.694 1.00 10.01 H new ATOM 0 HB3 MET A 92 24.260 -7.798 -7.708 1.00 10.01 H new ATOM 0 HG2 MET A 92 24.618 -6.656 -10.156 1.00 25.13 H new ATOM 0 HG3 MET A 92 23.840 -8.153 -10.631 1.00 25.13 H new ATOM 0 HE1 MET A 92 21.219 -4.995 -10.441 1.00 23.31 H new ATOM 0 HE2 MET A 92 22.986 -4.793 -10.522 1.00 23.31 H new ATOM 0 HE3 MET A 92 22.176 -5.972 -11.580 1.00 23.31 H new ATOM 1583 N LEU A 93 27.169 -8.939 -6.632 1.00 42.00 N ATOM 1584 CA LEU A 93 27.683 -8.906 -5.267 1.00 44.32 C ATOM 1585 C LEU A 93 29.037 -8.205 -5.212 1.00 40.12 C ATOM 1586 O LEU A 93 29.150 -7.026 -5.546 1.00 54.15 O ATOM 1587 CB LEU A 93 27.809 -10.326 -4.714 1.00 31.32 C ATOM 1588 CG LEU A 93 26.518 -11.145 -4.668 1.00 24.20 C ATOM 1589 CD1 LEU A 93 26.829 -12.621 -4.471 1.00 43.23 C ATOM 1590 CD2 LEU A 93 25.604 -10.639 -3.562 1.00 4.23 C ATOM 0 H LEU A 93 27.219 -9.854 -7.079 1.00 42.00 H new ATOM 0 HA LEU A 93 26.978 -8.345 -4.653 1.00 44.32 H new ATOM 0 HB2 LEU A 93 28.537 -10.867 -5.318 1.00 31.32 H new ATOM 0 HB3 LEU A 93 28.214 -10.267 -3.704 1.00 31.32 H new ATOM 0 HG LEU A 93 26.002 -11.027 -5.621 1.00 24.20 H new ATOM 0 HD11 LEU A 93 25.899 -13.188 -4.441 1.00 43.23 H new ATOM 0 HD12 LEU A 93 27.444 -12.977 -5.298 1.00 43.23 H new ATOM 0 HD13 LEU A 93 27.368 -12.757 -3.533 1.00 43.23 H new ATOM 0 HD21 LEU A 93 24.691 -11.234 -3.544 1.00 4.23 H new ATOM 0 HD22 LEU A 93 26.112 -10.726 -2.602 1.00 4.23 H new ATOM 0 HD23 LEU A 93 25.353 -9.594 -3.746 1.00 4.23 H new ATOM 1602 N GLN A 94 30.061 -8.939 -4.790 1.00 62.54 N ATOM 1603 CA GLN A 94 31.408 -8.388 -4.694 1.00 14.04 C ATOM 1604 C GLN A 94 32.435 -9.354 -5.275 1.00 14.10 C ATOM 1605 O GLN A 94 32.307 -10.570 -5.133 1.00 61.23 O ATOM 1606 CB GLN A 94 31.750 -8.077 -3.236 1.00 25.14 C ATOM 1607 CG GLN A 94 33.241 -7.924 -2.981 1.00 22.15 C ATOM 1608 CD GLN A 94 33.547 -6.907 -1.898 1.00 71.53 C ATOM 1609 OE1 GLN A 94 33.474 -7.211 -0.707 1.00 45.11 O ATOM 1610 NE2 GLN A 94 33.891 -5.692 -2.308 1.00 23.13 N ATOM 0 H GLN A 94 29.984 -9.917 -4.509 1.00 62.54 H new ATOM 0 HA GLN A 94 31.438 -7.465 -5.273 1.00 14.04 H new ATOM 0 HB2 GLN A 94 31.243 -7.159 -2.940 1.00 25.14 H new ATOM 0 HB3 GLN A 94 31.361 -8.874 -2.602 1.00 25.14 H new ATOM 0 HG2 GLN A 94 33.658 -8.890 -2.695 1.00 22.15 H new ATOM 0 HG3 GLN A 94 33.735 -7.624 -3.905 1.00 22.15 H new ATOM 0 HE21 GLN A 94 33.939 -5.485 -3.306 1.00 23.13 H new ATOM 0 HE22 GLN A 94 34.108 -4.966 -1.625 1.00 23.13 H new ATOM 1619 N ASP A 95 33.452 -8.805 -5.930 1.00 13.44 N ATOM 1620 CA ASP A 95 34.502 -9.618 -6.532 1.00 54.43 C ATOM 1621 C ASP A 95 35.296 -10.359 -5.462 1.00 63.30 C ATOM 1622 O ASP A 95 35.669 -11.518 -5.644 1.00 22.55 O ATOM 1623 CB ASP A 95 35.439 -8.742 -7.366 1.00 74.41 C ATOM 1624 CG ASP A 95 34.786 -8.247 -8.641 1.00 53.34 C ATOM 1625 OD1 ASP A 95 33.538 -8.222 -8.699 1.00 2.21 O ATOM 1626 OD2 ASP A 95 35.522 -7.883 -9.582 1.00 1.22 O ATOM 0 H ASP A 95 33.572 -7.800 -6.058 1.00 13.44 H new ATOM 0 HA ASP A 95 34.030 -10.354 -7.183 1.00 54.43 H new ATOM 0 HB2 ASP A 95 35.759 -7.888 -6.770 1.00 74.41 H new ATOM 0 HB3 ASP A 95 36.335 -9.310 -7.617 1.00 74.41 H new ATOM 1631 N ARG A 96 35.553 -9.683 -4.347 1.00 51.43 N ATOM 1632 CA ARG A 96 36.305 -10.277 -3.249 1.00 44.40 C ATOM 1633 C ARG A 96 35.371 -10.971 -2.262 1.00 51.34 C ATOM 1634 O ARG A 96 35.726 -11.190 -1.104 1.00 31.05 O ATOM 1635 CB ARG A 96 37.124 -9.206 -2.526 1.00 11.35 C ATOM 1636 CG ARG A 96 36.273 -8.162 -1.820 1.00 23.32 C ATOM 1637 CD ARG A 96 36.988 -7.590 -0.606 1.00 15.25 C ATOM 1638 NE ARG A 96 38.343 -7.151 -0.925 1.00 3.44 N ATOM 1639 CZ ARG A 96 39.238 -6.802 -0.007 1.00 11.32 C ATOM 1640 NH1 ARG A 96 38.922 -6.841 1.280 1.00 20.03 N ATOM 1641 NH2 ARG A 96 40.452 -6.413 -0.376 1.00 12.12 N ATOM 0 H ARG A 96 35.251 -8.723 -4.180 1.00 51.43 H new ATOM 0 HA ARG A 96 36.982 -11.022 -3.667 1.00 44.40 H new ATOM 0 HB2 ARG A 96 37.773 -9.689 -1.795 1.00 11.35 H new ATOM 0 HB3 ARG A 96 37.772 -8.707 -3.247 1.00 11.35 H new ATOM 0 HG2 ARG A 96 36.032 -7.357 -2.514 1.00 23.32 H new ATOM 0 HG3 ARG A 96 35.329 -8.609 -1.510 1.00 23.32 H new ATOM 0 HD2 ARG A 96 36.418 -6.749 -0.213 1.00 15.25 H new ATOM 0 HD3 ARG A 96 37.027 -8.344 0.180 1.00 15.25 H new ATOM 0 HE ARG A 96 38.618 -7.110 -1.906 1.00 3.44 H new ATOM 0 HH11 ARG A 96 37.990 -7.139 1.567 1.00 20.03 H new ATOM 0 HH12 ARG A 96 39.611 -6.573 1.983 1.00 20.03 H new ATOM 0 HH21 ARG A 96 40.699 -6.382 -1.365 1.00 12.12 H new ATOM 0 HH22 ARG A 96 41.138 -6.145 0.330 1.00 12.12 H new ATOM 1655 N LEU A 97 34.175 -11.314 -2.729 1.00 43.52 N ATOM 1656 CA LEU A 97 33.189 -11.983 -1.888 1.00 53.53 C ATOM 1657 C LEU A 97 33.480 -13.476 -1.790 1.00 63.51 C ATOM 1658 O LEU A 97 33.053 -14.142 -0.847 1.00 13.35 O ATOM 1659 CB LEU A 97 31.781 -11.762 -2.445 1.00 42.51 C ATOM 1660 CG LEU A 97 30.646 -12.461 -1.697 1.00 11.23 C ATOM 1661 CD1 LEU A 97 30.831 -12.321 -0.194 1.00 4.22 C ATOM 1662 CD2 LEU A 97 29.299 -11.897 -2.124 1.00 74.34 C ATOM 0 H LEU A 97 33.865 -11.140 -3.685 1.00 43.52 H new ATOM 0 HA LEU A 97 33.250 -11.554 -0.888 1.00 53.53 H new ATOM 0 HB2 LEU A 97 31.579 -10.691 -2.452 1.00 42.51 H new ATOM 0 HB3 LEU A 97 31.766 -12.096 -3.482 1.00 42.51 H new ATOM 0 HG LEU A 97 30.670 -13.521 -1.949 1.00 11.23 H new ATOM 0 HD11 LEU A 97 30.013 -12.825 0.322 1.00 4.22 H new ATOM 0 HD12 LEU A 97 31.778 -12.773 0.100 1.00 4.22 H new ATOM 0 HD13 LEU A 97 30.834 -11.265 0.075 1.00 4.22 H new ATOM 0 HD21 LEU A 97 28.503 -12.406 -1.581 1.00 74.34 H new ATOM 0 HD22 LEU A 97 29.264 -10.830 -1.902 1.00 74.34 H new ATOM 0 HD23 LEU A 97 29.164 -12.050 -3.195 1.00 74.34 H new ATOM 1674 N ARG A 98 34.212 -13.997 -2.770 1.00 3.13 N ATOM 1675 CA ARG A 98 34.562 -15.412 -2.793 1.00 21.00 C ATOM 1676 C ARG A 98 33.314 -16.278 -2.938 1.00 62.22 C ATOM 1677 O ARG A 98 32.188 -15.826 -2.734 1.00 35.04 O ATOM 1678 CB ARG A 98 35.315 -15.794 -1.518 1.00 25.14 C ATOM 1679 CG ARG A 98 36.813 -15.957 -1.720 1.00 40.15 C ATOM 1680 CD ARG A 98 37.441 -16.773 -0.601 1.00 44.44 C ATOM 1681 NE ARG A 98 37.510 -18.193 -0.932 1.00 63.41 N ATOM 1682 CZ ARG A 98 38.327 -18.695 -1.851 1.00 64.24 C ATOM 1683 NH1 ARG A 98 39.141 -17.896 -2.527 1.00 52.24 N ATOM 1684 NH2 ARG A 98 38.332 -19.999 -2.096 1.00 22.54 N ATOM 0 H ARG A 98 34.574 -13.460 -3.558 1.00 3.13 H new ATOM 0 HA ARG A 98 35.207 -15.587 -3.654 1.00 21.00 H new ATOM 0 HB2 ARG A 98 35.140 -15.030 -0.760 1.00 25.14 H new ATOM 0 HB3 ARG A 98 34.906 -16.727 -1.130 1.00 25.14 H new ATOM 0 HG2 ARG A 98 37.001 -16.444 -2.677 1.00 40.15 H new ATOM 0 HG3 ARG A 98 37.284 -14.975 -1.764 1.00 40.15 H new ATOM 0 HD2 ARG A 98 38.445 -16.399 -0.399 1.00 44.44 H new ATOM 0 HD3 ARG A 98 36.862 -16.641 0.313 1.00 44.44 H new ATOM 0 HE ARG A 98 36.897 -18.835 -0.430 1.00 63.41 H new ATOM 0 HH11 ARG A 98 39.141 -16.893 -2.342 1.00 52.24 H new ATOM 0 HH12 ARG A 98 39.767 -18.284 -3.232 1.00 52.24 H new ATOM 0 HH21 ARG A 98 37.708 -20.618 -1.578 1.00 22.54 H new ATOM 0 HH22 ARG A 98 38.960 -20.383 -2.802 1.00 22.54 H new ATOM 1698 N PRO A 99 33.518 -17.554 -3.300 1.00 53.55 N ATOM 1699 CA PRO A 99 32.421 -18.510 -3.481 1.00 43.42 C ATOM 1700 C PRO A 99 31.758 -18.888 -2.161 1.00 43.31 C ATOM 1701 O PRO A 99 31.887 -20.019 -1.693 1.00 11.34 O ATOM 1702 CB PRO A 99 33.111 -19.727 -4.101 1.00 62.32 C ATOM 1703 CG PRO A 99 34.528 -19.630 -3.651 1.00 40.01 C ATOM 1704 CD PRO A 99 34.834 -18.160 -3.561 1.00 32.50 C ATOM 0 HA PRO A 99 31.619 -18.099 -4.094 1.00 43.42 H new ATOM 0 HB2 PRO A 99 32.652 -20.656 -3.765 1.00 62.32 H new ATOM 0 HB3 PRO A 99 33.039 -19.711 -5.189 1.00 62.32 H new ATOM 0 HG2 PRO A 99 34.665 -20.117 -2.686 1.00 40.01 H new ATOM 0 HG3 PRO A 99 35.196 -20.125 -4.356 1.00 40.01 H new ATOM 0 HD2 PRO A 99 35.542 -17.945 -2.760 1.00 32.50 H new ATOM 0 HD3 PRO A 99 35.274 -17.784 -4.485 1.00 32.50 H new ATOM 1712 N SER A 100 31.049 -17.934 -1.566 1.00 73.21 N ATOM 1713 CA SER A 100 30.368 -18.167 -0.298 1.00 0.24 C ATOM 1714 C SER A 100 28.890 -18.472 -0.522 1.00 41.22 C ATOM 1715 O SER A 100 28.242 -19.108 0.309 1.00 24.14 O ATOM 1716 CB SER A 100 30.516 -16.948 0.616 1.00 71.44 C ATOM 1717 OG SER A 100 31.716 -16.247 0.340 1.00 52.34 O ATOM 0 H SER A 100 30.931 -16.993 -1.942 1.00 73.21 H new ATOM 0 HA SER A 100 30.830 -19.030 0.181 1.00 0.24 H new ATOM 0 HB2 SER A 100 29.663 -16.283 0.481 1.00 71.44 H new ATOM 0 HB3 SER A 100 30.509 -17.268 1.658 1.00 71.44 H new ATOM 0 HG SER A 100 31.513 -15.446 -0.187 1.00 52.34 H new ATOM 1723 N PHE A 101 28.363 -18.013 -1.652 1.00 71.14 N ATOM 1724 CA PHE A 101 26.961 -18.235 -1.988 1.00 21.14 C ATOM 1725 C PHE A 101 26.601 -19.713 -1.870 1.00 23.33 C ATOM 1726 O PHE A 101 25.616 -20.074 -1.226 1.00 44.10 O ATOM 1727 CB PHE A 101 26.669 -17.739 -3.405 1.00 51.02 C ATOM 1728 CG PHE A 101 25.212 -17.482 -3.662 1.00 15.44 C ATOM 1729 CD1 PHE A 101 24.365 -18.517 -4.023 1.00 34.02 C ATOM 1730 CD2 PHE A 101 24.689 -16.204 -3.542 1.00 74.11 C ATOM 1731 CE1 PHE A 101 23.023 -18.284 -4.259 1.00 51.32 C ATOM 1732 CE2 PHE A 101 23.348 -15.965 -3.777 1.00 13.13 C ATOM 1733 CZ PHE A 101 22.514 -17.006 -4.137 1.00 1.40 C ATOM 0 H PHE A 101 28.885 -17.485 -2.351 1.00 71.14 H new ATOM 0 HA PHE A 101 26.351 -17.673 -1.281 1.00 21.14 H new ATOM 0 HB2 PHE A 101 27.228 -16.820 -3.582 1.00 51.02 H new ATOM 0 HB3 PHE A 101 27.032 -18.476 -4.121 1.00 51.02 H new ATOM 0 HD1 PHE A 101 24.758 -19.518 -4.121 1.00 34.02 H new ATOM 0 HD2 PHE A 101 25.336 -15.386 -3.262 1.00 74.11 H new ATOM 0 HE1 PHE A 101 22.373 -19.100 -4.538 1.00 51.32 H new ATOM 0 HE2 PHE A 101 22.952 -14.965 -3.679 1.00 13.13 H new ATOM 0 HZ PHE A 101 21.466 -16.821 -4.323 1.00 1.40 H new ATOM 1743 N ALA A 102 27.407 -20.564 -2.497 1.00 21.12 N ATOM 1744 CA ALA A 102 27.175 -22.003 -2.462 1.00 4.34 C ATOM 1745 C ALA A 102 27.134 -22.517 -1.027 1.00 23.23 C ATOM 1746 O ALA A 102 26.603 -23.595 -0.757 1.00 44.03 O ATOM 1747 CB ALA A 102 28.251 -22.730 -3.255 1.00 22.05 C ATOM 0 H ALA A 102 28.226 -20.282 -3.035 1.00 21.12 H new ATOM 0 HA ALA A 102 26.206 -22.202 -2.919 1.00 4.34 H new ATOM 0 HB1 ALA A 102 28.066 -23.804 -3.220 1.00 22.05 H new ATOM 0 HB2 ALA A 102 28.231 -22.391 -4.291 1.00 22.05 H new ATOM 0 HB3 ALA A 102 29.228 -22.517 -2.822 1.00 22.05 H new ATOM 1753 N LYS A 103 27.699 -21.740 -0.108 1.00 74.52 N ATOM 1754 CA LYS A 103 27.726 -22.117 1.300 1.00 4.52 C ATOM 1755 C LYS A 103 26.638 -21.386 2.080 1.00 74.30 C ATOM 1756 O LYS A 103 26.245 -21.814 3.165 1.00 22.10 O ATOM 1757 CB LYS A 103 29.097 -21.806 1.905 1.00 3.13 C ATOM 1758 CG LYS A 103 30.088 -22.951 1.787 1.00 60.10 C ATOM 1759 CD LYS A 103 30.427 -23.247 0.336 1.00 63.33 C ATOM 1760 CE LYS A 103 31.690 -24.087 0.219 1.00 72.42 C ATOM 1761 NZ LYS A 103 32.911 -23.242 0.112 1.00 51.22 N ATOM 0 H LYS A 103 28.144 -20.846 -0.314 1.00 74.52 H new ATOM 0 HA LYS A 103 27.539 -23.189 1.367 1.00 4.52 H new ATOM 0 HB2 LYS A 103 29.511 -20.926 1.412 1.00 3.13 H new ATOM 0 HB3 LYS A 103 28.971 -21.552 2.958 1.00 3.13 H new ATOM 0 HG2 LYS A 103 30.999 -22.702 2.331 1.00 60.10 H new ATOM 0 HG3 LYS A 103 29.671 -23.844 2.254 1.00 60.10 H new ATOM 0 HD2 LYS A 103 29.595 -23.772 -0.133 1.00 63.33 H new ATOM 0 HD3 LYS A 103 30.560 -22.311 -0.206 1.00 63.33 H new ATOM 0 HE2 LYS A 103 31.775 -24.738 1.089 1.00 72.42 H new ATOM 0 HE3 LYS A 103 31.617 -24.732 -0.657 1.00 72.42 H new ATOM 0 HZ1 LYS A 103 33.750 -23.852 0.034 1.00 51.22 H new ATOM 0 HZ2 LYS A 103 32.842 -22.638 -0.732 1.00 51.22 H new ATOM 0 HZ3 LYS A 103 32.995 -22.645 0.959 1.00 51.22 H new ATOM 1775 N ALA A 104 26.153 -20.283 1.519 1.00 71.30 N ATOM 1776 CA ALA A 104 25.107 -19.496 2.160 1.00 20.33 C ATOM 1777 C ALA A 104 23.726 -20.066 1.855 1.00 51.24 C ATOM 1778 O ALA A 104 22.760 -19.791 2.567 1.00 74.51 O ATOM 1779 CB ALA A 104 25.191 -18.044 1.715 1.00 5.21 C ATOM 0 H ALA A 104 26.468 -19.914 0.622 1.00 71.30 H new ATOM 0 HA ALA A 104 25.261 -19.543 3.238 1.00 20.33 H new ATOM 0 HB1 ALA A 104 24.404 -17.468 2.202 1.00 5.21 H new ATOM 0 HB2 ALA A 104 26.163 -17.635 1.990 1.00 5.21 H new ATOM 0 HB3 ALA A 104 25.066 -17.987 0.634 1.00 5.21 H new ATOM 1785 N ILE A 105 23.640 -20.859 0.792 1.00 50.42 N ATOM 1786 CA ILE A 105 22.377 -21.467 0.393 1.00 53.40 C ATOM 1787 C ILE A 105 21.657 -22.076 1.591 1.00 24.25 C ATOM 1788 O ILE A 105 20.485 -21.801 1.849 1.00 25.05 O ATOM 1789 CB ILE A 105 22.589 -22.557 -0.674 1.00 34.25 C ATOM 1790 CG1 ILE A 105 23.054 -21.931 -1.990 1.00 14.43 C ATOM 1791 CG2 ILE A 105 21.307 -23.351 -0.882 1.00 3.52 C ATOM 1792 CD1 ILE A 105 22.212 -20.753 -2.428 1.00 43.55 C ATOM 0 H ILE A 105 24.430 -21.095 0.192 1.00 50.42 H new ATOM 0 HA ILE A 105 21.764 -20.671 -0.030 1.00 53.40 H new ATOM 0 HB ILE A 105 23.364 -23.240 -0.325 1.00 34.25 H new ATOM 0 HG12 ILE A 105 24.090 -21.608 -1.884 1.00 14.43 H new ATOM 0 HG13 ILE A 105 23.036 -22.691 -2.771 1.00 14.43 H new ATOM 0 HG21 ILE A 105 21.473 -24.118 -1.639 1.00 3.52 H new ATOM 0 HG22 ILE A 105 21.016 -23.824 0.056 1.00 3.52 H new ATOM 0 HG23 ILE A 105 20.513 -22.681 -1.212 1.00 3.52 H new ATOM 0 HD11 ILE A 105 22.599 -20.359 -3.368 1.00 43.55 H new ATOM 0 HD12 ILE A 105 21.180 -21.075 -2.567 1.00 43.55 H new ATOM 0 HD13 ILE A 105 22.250 -19.975 -1.665 1.00 43.55 H new ATOM 1804 N PRO A 106 22.375 -22.924 2.344 1.00 50.32 N ATOM 1805 CA PRO A 106 21.826 -23.588 3.530 1.00 63.55 C ATOM 1806 C PRO A 106 21.586 -22.617 4.680 1.00 52.43 C ATOM 1807 O PRO A 106 20.675 -22.808 5.486 1.00 31.13 O ATOM 1808 CB PRO A 106 22.912 -24.601 3.903 1.00 42.30 C ATOM 1809 CG PRO A 106 24.171 -24.027 3.350 1.00 70.33 C ATOM 1810 CD PRO A 106 23.777 -23.298 2.095 1.00 3.21 C ATOM 0 HA PRO A 106 20.853 -24.038 3.331 1.00 63.55 H new ATOM 0 HB2 PRO A 106 22.977 -24.732 4.983 1.00 42.30 H new ATOM 0 HB3 PRO A 106 22.703 -25.582 3.475 1.00 42.30 H new ATOM 0 HG2 PRO A 106 24.638 -23.349 4.065 1.00 70.33 H new ATOM 0 HG3 PRO A 106 24.896 -24.812 3.134 1.00 70.33 H new ATOM 0 HD2 PRO A 106 24.403 -22.422 1.926 1.00 3.21 H new ATOM 0 HD3 PRO A 106 23.873 -23.933 1.214 1.00 3.21 H new ATOM 1818 N CYS A 107 22.407 -21.575 4.749 1.00 14.30 N ATOM 1819 CA CYS A 107 22.283 -20.572 5.802 1.00 72.54 C ATOM 1820 C CYS A 107 21.134 -19.614 5.507 1.00 40.51 C ATOM 1821 O CYS A 107 20.702 -18.858 6.379 1.00 60.41 O ATOM 1822 CB CYS A 107 23.590 -19.792 5.948 1.00 71.03 C ATOM 1823 SG CYS A 107 25.076 -20.817 5.848 1.00 5.53 S ATOM 0 H CYS A 107 23.165 -21.402 4.089 1.00 14.30 H new ATOM 0 HA CYS A 107 22.070 -21.088 6.738 1.00 72.54 H new ATOM 0 HB2 CYS A 107 23.634 -19.030 5.170 1.00 71.03 H new ATOM 0 HB3 CYS A 107 23.585 -19.271 6.905 1.00 71.03 H new ATOM 0 HG CYS A 107 25.274 -21.175 4.614 1.00 5.53 H new ATOM 1829 N LEU A 108 20.644 -19.647 4.273 1.00 62.35 N ATOM 1830 CA LEU A 108 19.546 -18.780 3.861 1.00 12.23 C ATOM 1831 C LEU A 108 18.207 -19.500 3.987 1.00 11.45 C ATOM 1832 O LEU A 108 17.191 -18.888 4.316 1.00 15.44 O ATOM 1833 CB LEU A 108 19.752 -18.311 2.420 1.00 60.42 C ATOM 1834 CG LEU A 108 20.407 -16.940 2.247 1.00 75.32 C ATOM 1835 CD1 LEU A 108 19.449 -15.835 2.665 1.00 22.22 C ATOM 1836 CD2 LEU A 108 21.698 -16.861 3.047 1.00 22.04 C ATOM 0 H LEU A 108 20.990 -20.266 3.540 1.00 62.35 H new ATOM 0 HA LEU A 108 19.535 -17.912 4.520 1.00 12.23 H new ATOM 0 HB2 LEU A 108 20.362 -19.051 1.902 1.00 60.42 H new ATOM 0 HB3 LEU A 108 18.782 -18.293 1.923 1.00 60.42 H new ATOM 0 HG LEU A 108 20.648 -16.804 1.193 1.00 75.32 H new ATOM 0 HD11 LEU A 108 19.932 -14.866 2.535 1.00 22.22 H new ATOM 0 HD12 LEU A 108 18.552 -15.879 2.048 1.00 22.22 H new ATOM 0 HD13 LEU A 108 19.176 -15.967 3.712 1.00 22.22 H new ATOM 0 HD21 LEU A 108 22.150 -15.878 2.912 1.00 22.04 H new ATOM 0 HD22 LEU A 108 21.482 -17.019 4.104 1.00 22.04 H new ATOM 0 HD23 LEU A 108 22.389 -17.629 2.700 1.00 22.04 H new ATOM 1848 N ARG A 109 18.214 -20.803 3.726 1.00 44.42 N ATOM 1849 CA ARG A 109 17.001 -21.606 3.811 1.00 11.01 C ATOM 1850 C ARG A 109 16.749 -22.059 5.246 1.00 32.41 C ATOM 1851 O ARG A 109 15.603 -22.236 5.660 1.00 14.13 O ATOM 1852 CB ARG A 109 17.104 -22.824 2.891 1.00 41.42 C ATOM 1853 CG ARG A 109 18.291 -23.722 3.200 1.00 52.32 C ATOM 1854 CD ARG A 109 18.415 -24.849 2.187 1.00 33.42 C ATOM 1855 NE ARG A 109 17.243 -25.721 2.193 1.00 70.13 N ATOM 1856 CZ ARG A 109 17.190 -26.885 1.554 1.00 13.32 C ATOM 1857 NH1 ARG A 109 18.237 -27.314 0.863 1.00 14.01 N ATOM 1858 NH2 ARG A 109 16.088 -27.622 1.607 1.00 54.24 N ATOM 0 H ARG A 109 19.047 -21.325 3.454 1.00 44.42 H new ATOM 0 HA ARG A 109 16.163 -20.987 3.491 1.00 11.01 H new ATOM 0 HB2 ARG A 109 16.187 -23.408 2.971 1.00 41.42 H new ATOM 0 HB3 ARG A 109 17.176 -22.483 1.858 1.00 41.42 H new ATOM 0 HG2 ARG A 109 19.206 -23.130 3.201 1.00 52.32 H new ATOM 0 HG3 ARG A 109 18.181 -24.141 4.200 1.00 52.32 H new ATOM 0 HD2 ARG A 109 18.549 -24.428 1.191 1.00 33.42 H new ATOM 0 HD3 ARG A 109 19.306 -25.437 2.406 1.00 33.42 H new ATOM 0 HE ARG A 109 16.421 -25.420 2.716 1.00 70.13 H new ATOM 0 HH11 ARG A 109 19.086 -26.750 0.821 1.00 14.01 H new ATOM 0 HH12 ARG A 109 18.194 -28.208 0.374 1.00 14.01 H new ATOM 0 HH21 ARG A 109 15.281 -27.295 2.138 1.00 54.24 H new ATOM 0 HH22 ARG A 109 16.048 -28.515 1.116 1.00 54.24 H new ATOM 1872 N HIS A 110 17.827 -22.247 6.000 1.00 3.11 N ATOM 1873 CA HIS A 110 17.723 -22.680 7.389 1.00 2.11 C ATOM 1874 C HIS A 110 16.854 -21.718 8.194 1.00 30.52 C ATOM 1875 O HIS A 110 16.330 -22.076 9.250 1.00 62.14 O ATOM 1876 CB HIS A 110 19.112 -22.780 8.020 1.00 44.22 C ATOM 1877 CG HIS A 110 19.084 -23.086 9.486 1.00 41.24 C ATOM 1878 ND1 HIS A 110 18.677 -24.302 9.993 1.00 41.21 N ATOM 1879 CD2 HIS A 110 19.417 -22.326 10.555 1.00 22.12 C ATOM 1880 CE1 HIS A 110 18.759 -24.276 11.311 1.00 24.11 C ATOM 1881 NE2 HIS A 110 19.206 -23.089 11.678 1.00 43.53 N ATOM 0 H HIS A 110 18.783 -22.106 5.673 1.00 3.11 H new ATOM 0 HA HIS A 110 17.254 -23.664 7.403 1.00 2.11 H new ATOM 0 HB2 HIS A 110 19.680 -23.555 7.506 1.00 44.22 H new ATOM 0 HB3 HIS A 110 19.642 -21.840 7.864 1.00 44.22 H new ATOM 0 HD2 HIS A 110 19.781 -21.309 10.530 1.00 22.12 H new ATOM 0 HE1 HIS A 110 18.504 -25.088 11.976 1.00 24.11 H new ATOM 0 HE2 HIS A 110 19.368 -22.788 12.639 1.00 43.53 H new ATOM 1889 N ILE A 111 16.706 -20.498 7.689 1.00 22.35 N ATOM 1890 CA ILE A 111 15.901 -19.487 8.362 1.00 54.52 C ATOM 1891 C ILE A 111 14.528 -19.355 7.710 1.00 1.35 C ATOM 1892 O ILE A 111 13.631 -18.711 8.255 1.00 52.13 O ATOM 1893 CB ILE A 111 16.597 -18.113 8.349 1.00 54.31 C ATOM 1894 CG1 ILE A 111 17.128 -17.799 6.949 1.00 63.11 C ATOM 1895 CG2 ILE A 111 17.725 -18.081 9.369 1.00 14.13 C ATOM 1896 CD1 ILE A 111 17.683 -16.398 6.813 1.00 21.50 C ATOM 0 H ILE A 111 17.133 -20.186 6.817 1.00 22.35 H new ATOM 0 HA ILE A 111 15.781 -19.815 9.395 1.00 54.52 H new ATOM 0 HB ILE A 111 15.867 -17.350 8.620 1.00 54.31 H new ATOM 0 HG12 ILE A 111 17.909 -18.516 6.696 1.00 63.11 H new ATOM 0 HG13 ILE A 111 16.324 -17.934 6.226 1.00 63.11 H new ATOM 0 HG21 ILE A 111 18.207 -17.104 9.348 1.00 14.13 H new ATOM 0 HG22 ILE A 111 17.321 -18.265 10.364 1.00 14.13 H new ATOM 0 HG23 ILE A 111 18.457 -18.852 9.127 1.00 14.13 H new ATOM 0 HD11 ILE A 111 18.041 -16.246 5.795 1.00 21.50 H new ATOM 0 HD12 ILE A 111 16.900 -15.673 7.034 1.00 21.50 H new ATOM 0 HD13 ILE A 111 18.509 -16.264 7.512 1.00 21.50 H new ATOM 1908 N ARG A 112 14.372 -19.970 6.543 1.00 74.10 N ATOM 1909 CA ARG A 112 13.108 -19.922 5.817 1.00 20.14 C ATOM 1910 C ARG A 112 12.858 -18.527 5.252 1.00 1.14 C ATOM 1911 O ARG A 112 11.842 -17.899 5.550 1.00 40.30 O ATOM 1912 CB ARG A 112 11.953 -20.327 6.735 1.00 52.20 C ATOM 1913 CG ARG A 112 12.261 -21.534 7.606 1.00 0.41 C ATOM 1914 CD ARG A 112 12.334 -21.155 9.077 1.00 11.31 C ATOM 1915 NE ARG A 112 11.850 -22.227 9.943 1.00 5.20 N ATOM 1916 CZ ARG A 112 10.566 -22.538 10.081 1.00 44.34 C ATOM 1917 NH1 ARG A 112 9.642 -21.862 9.412 1.00 31.02 N ATOM 1918 NH2 ARG A 112 10.205 -23.527 10.888 1.00 52.22 N ATOM 0 H ARG A 112 15.105 -20.507 6.080 1.00 74.10 H new ATOM 0 HA ARG A 112 13.167 -20.626 4.987 1.00 20.14 H new ATOM 0 HB2 ARG A 112 11.696 -19.483 7.376 1.00 52.20 H new ATOM 0 HB3 ARG A 112 11.075 -20.543 6.126 1.00 52.20 H new ATOM 0 HG2 ARG A 112 11.492 -22.293 7.462 1.00 0.41 H new ATOM 0 HG3 ARG A 112 13.208 -21.976 7.296 1.00 0.41 H new ATOM 0 HD2 ARG A 112 13.364 -20.915 9.339 1.00 11.31 H new ATOM 0 HD3 ARG A 112 11.743 -20.255 9.249 1.00 11.31 H new ATOM 0 HE ARG A 112 12.536 -22.767 10.471 1.00 5.20 H new ATOM 0 HH11 ARG A 112 9.917 -21.102 8.790 1.00 31.02 H new ATOM 0 HH12 ARG A 112 8.657 -22.102 9.519 1.00 31.02 H new ATOM 0 HH21 ARG A 112 10.914 -24.049 11.403 1.00 52.22 H new ATOM 0 HH22 ARG A 112 9.219 -23.765 10.993 1.00 52.22 H new ATOM 1932 N ARG A 113 13.792 -18.048 4.437 1.00 71.54 N ATOM 1933 CA ARG A 113 13.674 -16.727 3.832 1.00 72.34 C ATOM 1934 C ARG A 113 13.697 -16.823 2.309 1.00 43.42 C ATOM 1935 O ARG A 113 13.073 -16.017 1.617 1.00 22.42 O ATOM 1936 CB ARG A 113 14.806 -15.819 4.314 1.00 64.01 C ATOM 1937 CG ARG A 113 14.720 -15.470 5.791 1.00 63.22 C ATOM 1938 CD ARG A 113 15.490 -14.198 6.108 1.00 0.34 C ATOM 1939 NE ARG A 113 14.620 -13.025 6.139 1.00 21.13 N ATOM 1940 CZ ARG A 113 13.776 -12.762 7.131 1.00 44.11 C ATOM 1941 NH1 ARG A 113 13.690 -13.584 8.168 1.00 53.32 N ATOM 1942 NH2 ARG A 113 13.017 -11.674 7.087 1.00 64.31 N ATOM 0 H ARG A 113 14.639 -18.555 4.180 1.00 71.54 H new ATOM 0 HA ARG A 113 12.719 -16.299 4.138 1.00 72.34 H new ATOM 0 HB2 ARG A 113 15.760 -16.308 4.120 1.00 64.01 H new ATOM 0 HB3 ARG A 113 14.795 -14.898 3.731 1.00 64.01 H new ATOM 0 HG2 ARG A 113 13.675 -15.345 6.076 1.00 63.22 H new ATOM 0 HG3 ARG A 113 15.116 -16.294 6.384 1.00 63.22 H new ATOM 0 HD2 ARG A 113 15.987 -14.306 7.072 1.00 0.34 H new ATOM 0 HD3 ARG A 113 16.270 -14.051 5.361 1.00 0.34 H new ATOM 0 HE ARG A 113 14.663 -12.372 5.356 1.00 21.13 H new ATOM 0 HH11 ARG A 113 14.273 -14.420 8.205 1.00 53.32 H new ATOM 0 HH12 ARG A 113 13.041 -13.380 8.928 1.00 53.32 H new ATOM 0 HH21 ARG A 113 13.081 -11.039 6.291 1.00 64.31 H new ATOM 0 HH22 ARG A 113 12.369 -11.473 7.849 1.00 64.31 H new ATOM 1956 N ILE A 114 14.421 -17.811 1.794 1.00 2.12 N ATOM 1957 CA ILE A 114 14.525 -18.011 0.354 1.00 22.22 C ATOM 1958 C ILE A 114 14.595 -19.495 0.009 1.00 4.12 C ATOM 1959 O ILE A 114 14.551 -20.351 0.893 1.00 42.21 O ATOM 1960 CB ILE A 114 15.763 -17.302 -0.225 1.00 5.21 C ATOM 1961 CG1 ILE A 114 17.036 -18.064 0.149 1.00 63.22 C ATOM 1962 CG2 ILE A 114 15.833 -15.866 0.274 1.00 24.44 C ATOM 1963 CD1 ILE A 114 17.584 -18.914 -0.977 1.00 2.44 C ATOM 0 H ILE A 114 14.944 -18.485 2.353 1.00 2.12 H new ATOM 0 HA ILE A 114 13.628 -17.579 -0.090 1.00 22.22 H new ATOM 0 HB ILE A 114 15.678 -17.285 -1.312 1.00 5.21 H new ATOM 0 HG12 ILE A 114 17.799 -17.350 0.459 1.00 63.22 H new ATOM 0 HG13 ILE A 114 16.829 -18.702 1.008 1.00 63.22 H new ATOM 0 HG21 ILE A 114 16.714 -15.378 -0.144 1.00 24.44 H new ATOM 0 HG22 ILE A 114 14.938 -15.328 -0.038 1.00 24.44 H new ATOM 0 HG23 ILE A 114 15.898 -15.862 1.362 1.00 24.44 H new ATOM 0 HD11 ILE A 114 18.486 -19.425 -0.641 1.00 2.44 H new ATOM 0 HD12 ILE A 114 16.838 -19.651 -1.273 1.00 2.44 H new ATOM 0 HD13 ILE A 114 17.823 -18.278 -1.829 1.00 2.44 H new ATOM 1975 N ARG A 115 14.707 -19.792 -1.281 1.00 72.04 N ATOM 1976 CA ARG A 115 14.784 -21.173 -1.744 1.00 1.44 C ATOM 1977 C ARG A 115 15.682 -21.285 -2.972 1.00 73.14 C ATOM 1978 O ARG A 115 16.161 -20.280 -3.496 1.00 70.12 O ATOM 1979 CB ARG A 115 13.387 -21.703 -2.069 1.00 54.23 C ATOM 1980 CG ARG A 115 12.725 -22.429 -0.910 1.00 22.44 C ATOM 1981 CD ARG A 115 11.618 -23.354 -1.390 1.00 55.33 C ATOM 1982 NE ARG A 115 12.122 -24.397 -2.279 1.00 24.13 N ATOM 1983 CZ ARG A 115 12.801 -25.458 -1.855 1.00 40.35 C ATOM 1984 NH1 ARG A 115 13.054 -25.614 -0.564 1.00 23.55 N ATOM 1985 NH2 ARG A 115 13.227 -26.364 -2.725 1.00 64.53 N ATOM 0 H ARG A 115 14.747 -19.095 -2.025 1.00 72.04 H new ATOM 0 HA ARG A 115 15.216 -21.775 -0.944 1.00 1.44 H new ATOM 0 HB2 ARG A 115 12.754 -20.870 -2.374 1.00 54.23 H new ATOM 0 HB3 ARG A 115 13.454 -22.381 -2.920 1.00 54.23 H new ATOM 0 HG2 ARG A 115 13.473 -23.007 -0.367 1.00 22.44 H new ATOM 0 HG3 ARG A 115 12.314 -21.701 -0.210 1.00 22.44 H new ATOM 0 HD2 ARG A 115 11.132 -23.815 -0.530 1.00 55.33 H new ATOM 0 HD3 ARG A 115 10.858 -22.770 -1.910 1.00 55.33 H new ATOM 0 HE ARG A 115 11.943 -24.306 -3.279 1.00 24.13 H new ATOM 0 HH11 ARG A 115 12.727 -24.919 0.107 1.00 23.55 H new ATOM 0 HH12 ARG A 115 13.575 -26.429 -0.241 1.00 23.55 H new ATOM 0 HH21 ARG A 115 13.034 -26.247 -3.720 1.00 64.53 H new ATOM 0 HH22 ARG A 115 13.748 -27.178 -2.399 1.00 64.53 H new ATOM 1999 N GLU A 116 15.904 -22.515 -3.426 1.00 4.22 N ATOM 2000 CA GLU A 116 16.746 -22.758 -4.592 1.00 15.41 C ATOM 2001 C GLU A 116 16.226 -23.943 -5.400 1.00 21.30 C ATOM 2002 O GLU A 116 15.958 -25.011 -4.851 1.00 30.31 O ATOM 2003 CB GLU A 116 18.191 -23.014 -4.161 1.00 62.11 C ATOM 2004 CG GLU A 116 18.310 -23.802 -2.867 1.00 61.15 C ATOM 2005 CD GLU A 116 19.415 -24.840 -2.916 1.00 1.52 C ATOM 2006 OE1 GLU A 116 20.336 -24.686 -3.745 1.00 4.31 O ATOM 2007 OE2 GLU A 116 19.359 -25.805 -2.126 1.00 14.44 O ATOM 0 H GLU A 116 15.513 -23.358 -3.005 1.00 4.22 H new ATOM 0 HA GLU A 116 16.716 -21.869 -5.222 1.00 15.41 H new ATOM 0 HB2 GLU A 116 18.708 -23.554 -4.954 1.00 62.11 H new ATOM 0 HB3 GLU A 116 18.701 -22.058 -4.042 1.00 62.11 H new ATOM 0 HG2 GLU A 116 18.499 -23.114 -2.043 1.00 61.15 H new ATOM 0 HG3 GLU A 116 17.361 -24.296 -2.658 1.00 61.15 H new ATOM 2014 N GLU A 117 16.086 -23.745 -6.707 1.00 65.41 N ATOM 2015 CA GLU A 117 15.598 -24.798 -7.590 1.00 52.34 C ATOM 2016 C GLU A 117 16.690 -25.247 -8.557 1.00 74.12 C ATOM 2017 O GLU A 117 17.031 -24.533 -9.500 1.00 1.21 O ATOM 2018 CB GLU A 117 14.377 -24.311 -8.373 1.00 52.25 C ATOM 2019 CG GLU A 117 13.864 -25.318 -9.389 1.00 52.21 C ATOM 2020 CD GLU A 117 12.472 -25.821 -9.060 1.00 55.41 C ATOM 2021 OE1 GLU A 117 12.110 -25.829 -7.865 1.00 0.20 O ATOM 2022 OE2 GLU A 117 11.743 -26.206 -9.999 1.00 3.41 O ATOM 0 H GLU A 117 16.303 -22.866 -7.177 1.00 65.41 H new ATOM 0 HA GLU A 117 15.310 -25.650 -6.974 1.00 52.34 H new ATOM 0 HB2 GLU A 117 13.577 -24.075 -7.672 1.00 52.25 H new ATOM 0 HB3 GLU A 117 14.632 -23.385 -8.889 1.00 52.25 H new ATOM 0 HG2 GLU A 117 13.856 -24.859 -10.378 1.00 52.21 H new ATOM 0 HG3 GLU A 117 14.550 -26.164 -9.435 1.00 52.21 H new ATOM 2029 N ARG A 118 17.233 -26.435 -8.315 1.00 64.44 N ATOM 2030 CA ARG A 118 18.288 -26.980 -9.163 1.00 14.14 C ATOM 2031 C ARG A 118 17.700 -27.631 -10.411 1.00 53.54 C ATOM 2032 O ARG A 118 17.187 -28.749 -10.358 1.00 32.03 O ATOM 2033 CB ARG A 118 19.119 -28.002 -8.385 1.00 41.03 C ATOM 2034 CG ARG A 118 19.902 -28.953 -9.275 1.00 70.53 C ATOM 2035 CD ARG A 118 20.780 -28.199 -10.261 1.00 2.20 C ATOM 2036 NE ARG A 118 21.750 -27.342 -9.585 1.00 4.32 N ATOM 2037 CZ ARG A 118 22.873 -26.913 -10.151 1.00 72.03 C ATOM 2038 NH1 ARG A 118 23.165 -27.259 -11.397 1.00 73.54 N ATOM 2039 NH2 ARG A 118 23.706 -26.136 -9.471 1.00 53.43 N ATOM 0 H ARG A 118 16.961 -27.039 -7.539 1.00 64.44 H new ATOM 0 HA ARG A 118 18.933 -26.157 -9.473 1.00 14.14 H new ATOM 0 HB2 ARG A 118 19.814 -27.472 -7.733 1.00 41.03 H new ATOM 0 HB3 ARG A 118 18.457 -28.582 -7.741 1.00 41.03 H new ATOM 0 HG2 ARG A 118 20.522 -29.603 -8.658 1.00 70.53 H new ATOM 0 HG3 ARG A 118 19.210 -29.596 -9.820 1.00 70.53 H new ATOM 0 HD2 ARG A 118 21.306 -28.911 -10.896 1.00 2.20 H new ATOM 0 HD3 ARG A 118 20.153 -27.592 -10.914 1.00 2.20 H new ATOM 0 HE ARG A 118 21.555 -27.057 -8.625 1.00 4.32 H new ATOM 0 HH11 ARG A 118 22.527 -27.856 -11.923 1.00 73.54 H new ATOM 0 HH12 ARG A 118 24.028 -26.928 -11.829 1.00 73.54 H new ATOM 0 HH21 ARG A 118 23.485 -25.867 -8.512 1.00 53.43 H new ATOM 0 HH22 ARG A 118 24.568 -25.808 -9.907 1.00 53.43 H new ATOM 2053 N CYS A 119 17.778 -26.923 -11.533 1.00 35.10 N ATOM 2054 CA CYS A 119 17.252 -27.431 -12.795 1.00 70.03 C ATOM 2055 C CYS A 119 18.323 -27.404 -13.881 1.00 3.25 C ATOM 2056 O CYS A 119 18.518 -26.390 -14.550 1.00 74.21 O ATOM 2057 CB CYS A 119 16.041 -26.607 -13.236 1.00 63.00 C ATOM 2058 SG CYS A 119 14.476 -27.151 -12.514 1.00 35.21 S ATOM 0 H CYS A 119 18.200 -25.996 -11.594 1.00 35.10 H new ATOM 0 HA CYS A 119 16.942 -28.465 -12.641 1.00 70.03 H new ATOM 0 HB2 CYS A 119 16.209 -25.563 -12.969 1.00 63.00 H new ATOM 0 HB3 CYS A 119 15.962 -26.650 -14.322 1.00 63.00 H new ATOM 0 HG CYS A 119 13.512 -26.392 -12.945 1.00 35.21 H new ATOM 2064 N GLY A 120 19.018 -28.525 -14.048 1.00 31.32 N ATOM 2065 CA GLY A 120 20.063 -28.608 -15.052 1.00 35.13 C ATOM 2066 C GLY A 120 21.173 -27.604 -14.817 1.00 3.32 C ATOM 2067 O GLY A 120 21.476 -27.235 -13.682 1.00 22.12 O ATOM 0 H GLY A 120 18.876 -29.377 -13.506 1.00 31.32 H new ATOM 0 HA2 GLY A 120 20.482 -29.614 -15.054 1.00 35.13 H new ATOM 0 HA3 GLY A 120 19.629 -28.441 -16.038 1.00 35.13 H new ATOM 2071 N PRO A 121 21.803 -27.145 -15.909 1.00 74.30 N ATOM 2072 CA PRO A 121 22.897 -26.172 -15.842 1.00 71.22 C ATOM 2073 C PRO A 121 22.417 -24.788 -15.418 1.00 70.41 C ATOM 2074 O PRO A 121 22.881 -23.773 -15.938 1.00 53.34 O ATOM 2075 CB PRO A 121 23.428 -26.137 -17.277 1.00 65.32 C ATOM 2076 CG PRO A 121 22.273 -26.556 -18.120 1.00 2.25 C ATOM 2077 CD PRO A 121 21.494 -27.541 -17.293 1.00 71.33 C ATOM 0 HA PRO A 121 23.647 -26.452 -15.102 1.00 71.22 H new ATOM 0 HB2 PRO A 121 23.773 -25.139 -17.547 1.00 65.32 H new ATOM 0 HB3 PRO A 121 24.275 -26.812 -17.402 1.00 65.32 H new ATOM 0 HG2 PRO A 121 21.656 -25.699 -18.391 1.00 2.25 H new ATOM 0 HG3 PRO A 121 22.613 -27.010 -19.051 1.00 2.25 H new ATOM 0 HD2 PRO A 121 20.425 -27.482 -17.499 1.00 71.33 H new ATOM 0 HD3 PRO A 121 21.801 -28.567 -17.495 1.00 71.33 H new ATOM 2085 N LEU A 122 21.486 -24.755 -14.471 1.00 5.24 N ATOM 2086 CA LEU A 122 20.944 -23.494 -13.976 1.00 32.44 C ATOM 2087 C LEU A 122 20.569 -23.605 -12.501 1.00 41.51 C ATOM 2088 O LEU A 122 20.504 -24.702 -11.945 1.00 43.35 O ATOM 2089 CB LEU A 122 19.719 -23.087 -14.796 1.00 14.12 C ATOM 2090 CG LEU A 122 19.982 -22.709 -16.254 1.00 23.21 C ATOM 2091 CD1 LEU A 122 18.678 -22.648 -17.034 1.00 21.32 C ATOM 2092 CD2 LEU A 122 20.717 -21.379 -16.336 1.00 24.33 C ATOM 0 H LEU A 122 21.091 -25.586 -14.031 1.00 5.24 H new ATOM 0 HA LEU A 122 21.714 -22.729 -14.080 1.00 32.44 H new ATOM 0 HB2 LEU A 122 19.005 -23.910 -14.778 1.00 14.12 H new ATOM 0 HB3 LEU A 122 19.241 -22.240 -14.303 1.00 14.12 H new ATOM 0 HG LEU A 122 20.612 -23.478 -16.700 1.00 23.21 H new ATOM 0 HD11 LEU A 122 18.886 -22.378 -18.069 1.00 21.32 H new ATOM 0 HD12 LEU A 122 18.190 -23.622 -17.004 1.00 21.32 H new ATOM 0 HD13 LEU A 122 18.022 -21.900 -16.588 1.00 21.32 H new ATOM 0 HD21 LEU A 122 20.896 -21.126 -17.381 1.00 24.33 H new ATOM 0 HD22 LEU A 122 20.112 -20.600 -15.872 1.00 24.33 H new ATOM 0 HD23 LEU A 122 21.670 -21.457 -15.814 1.00 24.33 H new ATOM 2104 N THR A 123 20.321 -22.460 -11.872 1.00 32.13 N ATOM 2105 CA THR A 123 19.951 -22.428 -10.462 1.00 44.53 C ATOM 2106 C THR A 123 19.114 -21.195 -10.142 1.00 2.43 C ATOM 2107 O THR A 123 19.612 -20.069 -10.173 1.00 14.20 O ATOM 2108 CB THR A 123 21.196 -22.439 -9.555 1.00 20.01 C ATOM 2109 OG1 THR A 123 22.233 -23.223 -10.156 1.00 1.53 O ATOM 2110 CG2 THR A 123 20.860 -23.001 -8.182 1.00 35.21 C ATOM 0 H THR A 123 20.370 -21.543 -12.316 1.00 32.13 H new ATOM 0 HA THR A 123 19.362 -23.324 -10.269 1.00 44.53 H new ATOM 0 HB THR A 123 21.540 -21.412 -9.436 1.00 20.01 H new ATOM 0 HG1 THR A 123 23.021 -23.224 -9.574 1.00 1.53 H new ATOM 0 HG21 THR A 123 21.754 -22.999 -7.559 1.00 35.21 H new ATOM 0 HG22 THR A 123 20.091 -22.385 -7.715 1.00 35.21 H new ATOM 0 HG23 THR A 123 20.493 -24.022 -8.287 1.00 35.21 H new ATOM 2118 N PHE A 124 17.840 -21.414 -9.833 1.00 24.02 N ATOM 2119 CA PHE A 124 16.933 -20.320 -9.506 1.00 45.23 C ATOM 2120 C PHE A 124 16.799 -20.157 -7.995 1.00 73.51 C ATOM 2121 O PHE A 124 17.229 -21.018 -7.227 1.00 5.45 O ATOM 2122 CB PHE A 124 15.558 -20.567 -10.129 1.00 13.52 C ATOM 2123 CG PHE A 124 15.610 -20.859 -11.601 1.00 73.31 C ATOM 2124 CD1 PHE A 124 15.948 -22.123 -12.058 1.00 34.00 C ATOM 2125 CD2 PHE A 124 15.320 -19.871 -12.528 1.00 62.21 C ATOM 2126 CE1 PHE A 124 15.997 -22.395 -13.412 1.00 51.22 C ATOM 2127 CE2 PHE A 124 15.367 -20.137 -13.884 1.00 24.23 C ATOM 2128 CZ PHE A 124 15.705 -21.401 -14.326 1.00 63.01 C ATOM 0 H PHE A 124 17.412 -22.340 -9.802 1.00 24.02 H new ATOM 0 HA PHE A 124 17.350 -19.400 -9.916 1.00 45.23 H new ATOM 0 HB2 PHE A 124 15.081 -21.403 -9.618 1.00 13.52 H new ATOM 0 HB3 PHE A 124 14.930 -19.692 -9.962 1.00 13.52 H new ATOM 0 HD1 PHE A 124 16.176 -22.904 -11.348 1.00 34.00 H new ATOM 0 HD2 PHE A 124 15.054 -18.881 -12.187 1.00 62.21 H new ATOM 0 HE1 PHE A 124 16.263 -23.384 -13.755 1.00 51.22 H new ATOM 0 HE2 PHE A 124 15.140 -19.358 -14.596 1.00 24.23 H new ATOM 0 HZ PHE A 124 15.741 -21.612 -15.385 1.00 63.01 H new ATOM 2138 N TYR A 125 16.199 -19.049 -7.577 1.00 14.14 N ATOM 2139 CA TYR A 125 16.009 -18.771 -6.158 1.00 23.22 C ATOM 2140 C TYR A 125 14.772 -17.908 -5.932 1.00 1.40 C ATOM 2141 O TYR A 125 14.691 -16.780 -6.420 1.00 13.14 O ATOM 2142 CB TYR A 125 17.244 -18.073 -5.584 1.00 73.50 C ATOM 2143 CG TYR A 125 18.543 -18.769 -5.921 1.00 5.25 C ATOM 2144 CD1 TYR A 125 19.043 -19.781 -5.110 1.00 40.24 C ATOM 2145 CD2 TYR A 125 19.272 -18.414 -7.050 1.00 14.04 C ATOM 2146 CE1 TYR A 125 20.230 -20.418 -5.414 1.00 25.13 C ATOM 2147 CE2 TYR A 125 20.459 -19.047 -7.362 1.00 3.24 C ATOM 2148 CZ TYR A 125 20.935 -20.048 -6.540 1.00 52.23 C ATOM 2149 OH TYR A 125 22.117 -20.681 -6.847 1.00 24.22 O ATOM 0 H TYR A 125 15.835 -18.328 -8.200 1.00 14.14 H new ATOM 0 HA TYR A 125 15.865 -19.721 -5.644 1.00 23.22 H new ATOM 0 HB2 TYR A 125 17.281 -17.051 -5.960 1.00 73.50 H new ATOM 0 HB3 TYR A 125 17.145 -18.011 -4.500 1.00 73.50 H new ATOM 0 HD1 TYR A 125 18.494 -20.074 -4.227 1.00 40.24 H new ATOM 0 HD2 TYR A 125 18.904 -17.629 -7.694 1.00 14.04 H new ATOM 0 HE1 TYR A 125 20.604 -21.202 -4.773 1.00 25.13 H new ATOM 0 HE2 TYR A 125 21.012 -18.760 -8.244 1.00 3.24 H new ATOM 0 HH TYR A 125 22.865 -20.064 -6.703 1.00 24.22 H new ATOM 2159 N TYR A 126 13.811 -18.445 -5.189 1.00 23.22 N ATOM 2160 CA TYR A 126 12.577 -17.726 -4.899 1.00 14.13 C ATOM 2161 C TYR A 126 12.349 -17.619 -3.394 1.00 20.21 C ATOM 2162 O TYR A 126 12.911 -18.374 -2.600 1.00 34.30 O ATOM 2163 CB TYR A 126 11.387 -18.426 -5.557 1.00 71.23 C ATOM 2164 CG TYR A 126 11.549 -19.926 -5.662 1.00 0.12 C ATOM 2165 CD1 TYR A 126 11.140 -20.762 -4.631 1.00 34.42 C ATOM 2166 CD2 TYR A 126 12.111 -20.506 -6.792 1.00 71.34 C ATOM 2167 CE1 TYR A 126 11.287 -22.133 -4.722 1.00 13.11 C ATOM 2168 CE2 TYR A 126 12.260 -21.876 -6.893 1.00 24.02 C ATOM 2169 CZ TYR A 126 11.847 -22.685 -5.855 1.00 3.02 C ATOM 2170 OH TYR A 126 11.994 -24.050 -5.950 1.00 2.11 O ATOM 0 H TYR A 126 13.863 -19.376 -4.776 1.00 23.22 H new ATOM 0 HA TYR A 126 12.669 -16.719 -5.307 1.00 14.13 H new ATOM 0 HB2 TYR A 126 10.485 -18.206 -4.986 1.00 71.23 H new ATOM 0 HB3 TYR A 126 11.241 -18.014 -6.555 1.00 71.23 H new ATOM 0 HD1 TYR A 126 10.700 -20.333 -3.743 1.00 34.42 H new ATOM 0 HD2 TYR A 126 12.437 -19.875 -7.606 1.00 71.34 H new ATOM 0 HE1 TYR A 126 10.965 -22.769 -3.910 1.00 13.11 H new ATOM 0 HE2 TYR A 126 12.697 -22.311 -7.780 1.00 24.02 H new ATOM 0 HH TYR A 126 11.747 -24.344 -6.852 1.00 2.11 H new ATOM 2180 N PRO A 127 11.504 -16.659 -2.991 1.00 41.51 N ATOM 2181 CA PRO A 127 11.181 -16.430 -1.580 1.00 14.43 C ATOM 2182 C PRO A 127 10.338 -17.555 -0.988 1.00 43.42 C ATOM 2183 O PRO A 127 9.112 -17.543 -1.086 1.00 41.42 O ATOM 2184 CB PRO A 127 10.384 -15.122 -1.606 1.00 24.52 C ATOM 2185 CG PRO A 127 9.798 -15.063 -2.974 1.00 60.41 C ATOM 2186 CD PRO A 127 10.799 -15.722 -3.882 1.00 61.14 C ATOM 0 HA PRO A 127 12.076 -16.388 -0.959 1.00 14.43 H new ATOM 0 HB2 PRO A 127 9.607 -15.117 -0.842 1.00 24.52 H new ATOM 0 HB3 PRO A 127 11.027 -14.263 -1.413 1.00 24.52 H new ATOM 0 HG2 PRO A 127 8.839 -15.580 -3.010 1.00 60.41 H new ATOM 0 HG3 PRO A 127 9.616 -14.032 -3.277 1.00 60.41 H new ATOM 0 HD2 PRO A 127 10.312 -16.242 -4.707 1.00 61.14 H new ATOM 0 HD3 PRO A 127 11.482 -14.995 -4.322 1.00 61.14 H new ATOM 2194 N GLY A 128 11.005 -18.527 -0.373 1.00 43.31 N ATOM 2195 CA GLY A 128 10.301 -19.646 0.226 1.00 42.44 C ATOM 2196 C GLY A 128 9.334 -20.305 -0.738 1.00 1.42 C ATOM 2197 O GLY A 128 9.330 -19.999 -1.930 1.00 63.13 O ATOM 0 H GLY A 128 12.020 -18.559 -0.279 1.00 43.31 H new ATOM 0 HA2 GLY A 128 11.025 -20.384 0.571 1.00 42.44 H new ATOM 0 HA3 GLY A 128 9.755 -19.300 1.104 1.00 42.44 H new