USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1013 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 52 TYR OH : rot -84:sc= 1.28 USER MOD Set 1.2: A 121 CYS SG : rot -49:sc= 1.02 USER MOD Set 2.1: A 6 GLN : amide:sc= -0.103 X(o=0.46,f=0.55) USER MOD Set 2.2: A 117 SER OG : rot 180:sc= 0.563 USER MOD Set 3.1: A 57 ASN : amide:sc= 0.496 K(o=1.8,f=-5!) USER MOD Set 3.2: A 58 SER OG : rot -87:sc= 1.27 USER MOD Set 3.3: A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 45 LYS NZ :NH3+ -153:sc= 1.28 (180deg=0.904) USER MOD Set 4.2: A 91 GLN : amide:sc= 0.741 K(o=2,f=1.3) USER MOD Set 5.1: A 47 THR OG1 : rot 70:sc= 0.551 USER MOD Set 5.2: A 85 LYS NZ :NH3+ -176:sc= 1.28 (180deg=0.304) USER MOD Set 5.3: A 86 HIS : no HD1:sc= 0.773 K(o=2.6,f=-1.1) USER MOD Set 6.1: A 27 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 72 MET CE :methyl 177:sc= 0 (180deg=-0.0112) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0281 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -122:sc= 1.23 USER MOD Single : A 29 ASN : amide:sc= -0.0296 X(o=-0.03,f=-0.03) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.531 K(o=0.53,f=-5.8!) USER MOD Single : A 36 SER OG : rot 180:sc= 0.0165 USER MOD Single : A 39 LYS NZ :NH3+ -161:sc= 1.24 (180deg=1.15) USER MOD Single : A 41 CYS SG : rot -173:sc= -1.89 USER MOD Single : A 43 LYS NZ :NH3+ 141:sc= 0.0877 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 158:sc= 0.141 USER MOD Single : A 53 CYS SG : rot 41:sc= -0.082 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0.00891 USER MOD Single : A 74 GLN : amide:sc= 1.02 K(o=1,f=-0.29) USER MOD Single : A 78 TYR OH : rot 79:sc= 0.019 USER MOD Single : A 81 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 83 LYS NZ :NH3+ -158:sc= 0.764 (180deg=0.471) USER MOD Single : A 84 SER OG : rot 136:sc= 1.27 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 MET CE :methyl -133:sc=-0.000762 (180deg=-0.114) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 141:sc= 1.06 (180deg=0.306) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl 178:sc= 0 (180deg=-0.0155) USER MOD ----------------------------------------------------------------- ATOM 63 N GLN A 6 8.859 28.875 0.318 1.00 0.00 N ATOM 64 CA GLN A 6 7.607 28.684 -0.422 1.00 0.00 C ATOM 65 C GLN A 6 7.180 29.967 -1.154 1.00 0.00 C ATOM 66 O GLN A 6 7.717 31.053 -0.919 1.00 0.00 O ATOM 67 CB GLN A 6 6.509 28.191 0.543 1.00 0.00 C ATOM 68 CG GLN A 6 6.001 29.260 1.525 1.00 0.00 C ATOM 69 CD GLN A 6 7.061 29.644 2.563 1.00 0.00 C ATOM 70 OE1 GLN A 6 7.799 30.612 2.427 1.00 0.00 O ATOM 71 NE2 GLN A 6 7.242 28.844 3.586 1.00 0.00 N ATOM 0 HA GLN A 6 7.767 27.927 -1.190 1.00 0.00 H new ATOM 0 HB2 GLN A 6 5.666 27.823 -0.042 1.00 0.00 H new ATOM 0 HB3 GLN A 6 6.895 27.346 1.113 1.00 0.00 H new ATOM 0 HG2 GLN A 6 5.701 30.148 0.969 1.00 0.00 H new ATOM 0 HG3 GLN A 6 5.113 28.889 2.036 1.00 0.00 H new ATOM 0 HE21 GLN A 6 6.636 28.034 3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.989 29.032 4.255 1.00 0.00 H new ATOM 80 N ILE A 7 6.162 29.846 -2.011 1.00 0.00 N ATOM 81 CA ILE A 7 5.546 30.987 -2.703 1.00 0.00 C ATOM 82 C ILE A 7 4.703 31.881 -1.776 1.00 0.00 C ATOM 83 O ILE A 7 4.685 33.096 -1.953 1.00 0.00 O ATOM 84 CB ILE A 7 4.720 30.464 -3.898 1.00 0.00 C ATOM 85 CG1 ILE A 7 4.244 31.574 -4.854 1.00 0.00 C ATOM 86 CG2 ILE A 7 3.487 29.671 -3.445 1.00 0.00 C ATOM 87 CD1 ILE A 7 5.417 32.295 -5.516 1.00 0.00 C ATOM 0 H ILE A 7 5.738 28.949 -2.247 1.00 0.00 H new ATOM 0 HA ILE A 7 6.347 31.632 -3.064 1.00 0.00 H new ATOM 0 HB ILE A 7 5.411 29.815 -4.435 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.603 31.142 -5.622 1.00 0.00 H new ATOM 0 HG13 ILE A 7 3.639 32.294 -4.302 1.00 0.00 H new ATOM 0 HG21 ILE A 7 2.937 29.323 -4.319 1.00 0.00 H new ATOM 0 HG22 ILE A 7 3.804 28.814 -2.851 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.843 30.312 -2.843 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.038 33.070 -6.182 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.044 32.750 -4.749 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.007 31.580 -6.089 1.00 0.00 H new ATOM 99 N LEU A 8 3.995 31.297 -0.798 1.00 0.00 N ATOM 100 CA LEU A 8 3.031 32.031 0.041 1.00 0.00 C ATOM 101 C LEU A 8 3.691 32.841 1.170 1.00 0.00 C ATOM 102 O LEU A 8 4.767 32.499 1.660 1.00 0.00 O ATOM 103 CB LEU A 8 1.967 31.083 0.643 1.00 0.00 C ATOM 104 CG LEU A 8 0.946 30.464 -0.328 1.00 0.00 C ATOM 105 CD1 LEU A 8 -0.209 29.869 0.474 1.00 0.00 C ATOM 106 CD2 LEU A 8 0.311 31.495 -1.257 1.00 0.00 C ATOM 0 H LEU A 8 4.073 30.307 -0.566 1.00 0.00 H new ATOM 0 HA LEU A 8 2.550 32.741 -0.632 1.00 0.00 H new ATOM 0 HB2 LEU A 8 2.487 30.270 1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.417 31.634 1.406 1.00 0.00 H new ATOM 0 HG LEU A 8 1.492 29.726 -0.915 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.936 29.429 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.172 29.099 1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.689 30.654 1.059 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.400 31.000 -1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.209 32.248 -0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.087 31.975 -1.853 1.00 0.00 H new ATOM 118 N VAL A 9 2.981 33.878 1.626 1.00 0.00 N ATOM 119 CA VAL A 9 3.308 34.654 2.834 1.00 0.00 C ATOM 120 C VAL A 9 2.216 34.414 3.890 1.00 0.00 C ATOM 121 O VAL A 9 1.022 34.496 3.592 1.00 0.00 O ATOM 122 CB VAL A 9 3.595 36.136 2.496 1.00 0.00 C ATOM 123 CG1 VAL A 9 2.504 36.833 1.672 1.00 0.00 C ATOM 124 CG2 VAL A 9 3.865 36.954 3.762 1.00 0.00 C ATOM 0 H VAL A 9 2.140 34.212 1.155 1.00 0.00 H new ATOM 0 HA VAL A 9 4.243 34.309 3.275 1.00 0.00 H new ATOM 0 HB VAL A 9 4.485 36.098 1.868 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.794 37.867 1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.378 36.314 0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.564 36.814 2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.063 37.991 3.490 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.994 36.910 4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.730 36.544 4.283 1.00 0.00 H new ATOM 134 N LEU A 10 2.628 34.045 5.110 1.00 0.00 N ATOM 135 CA LEU A 10 1.752 33.629 6.214 1.00 0.00 C ATOM 136 C LEU A 10 1.691 34.732 7.295 1.00 0.00 C ATOM 137 O LEU A 10 2.592 35.568 7.388 1.00 0.00 O ATOM 138 CB LEU A 10 2.143 32.244 6.795 1.00 0.00 C ATOM 139 CG LEU A 10 2.510 31.113 5.800 1.00 0.00 C ATOM 140 CD1 LEU A 10 3.955 31.195 5.309 1.00 0.00 C ATOM 141 CD2 LEU A 10 2.373 29.759 6.491 1.00 0.00 C ATOM 0 H LEU A 10 3.616 34.027 5.365 1.00 0.00 H new ATOM 0 HA LEU A 10 0.747 33.499 5.813 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.992 32.390 7.462 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.313 31.893 7.408 1.00 0.00 H new ATOM 0 HG LEU A 10 1.833 31.227 4.954 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.151 30.377 4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.113 32.146 4.801 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.633 31.120 6.159 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.631 28.965 5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.044 29.719 7.349 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.345 29.625 6.828 1.00 0.00 H new ATOM 153 N ASP A 11 0.641 34.748 8.117 1.00 0.00 N ATOM 154 CA ASP A 11 0.371 35.799 9.104 1.00 0.00 C ATOM 155 C ASP A 11 -0.385 35.239 10.327 1.00 0.00 C ATOM 156 O ASP A 11 -1.585 34.964 10.215 1.00 0.00 O ATOM 157 CB ASP A 11 -0.485 36.904 8.461 1.00 0.00 C ATOM 158 CG ASP A 11 -0.634 38.141 9.364 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.298 38.450 10.146 1.00 0.00 O ATOM 160 OD2 ASP A 11 -1.681 38.827 9.281 1.00 0.00 O ATOM 0 H ASP A 11 -0.065 34.012 8.116 1.00 0.00 H new ATOM 0 HA ASP A 11 1.329 36.200 9.435 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.034 37.202 7.514 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.473 36.505 8.232 1.00 0.00 H new ATOM 165 N PRO A 12 0.260 35.064 11.498 1.00 0.00 N ATOM 166 CA PRO A 12 1.690 35.250 11.771 1.00 0.00 C ATOM 167 C PRO A 12 2.617 34.320 10.943 1.00 0.00 C ATOM 168 O PRO A 12 2.304 33.140 10.767 1.00 0.00 O ATOM 169 CB PRO A 12 1.846 34.992 13.277 1.00 0.00 C ATOM 170 CG PRO A 12 0.640 34.121 13.633 1.00 0.00 C ATOM 171 CD PRO A 12 -0.438 34.666 12.707 1.00 0.00 C ATOM 0 HA PRO A 12 1.999 36.253 11.478 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.784 34.484 13.499 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.846 35.923 13.843 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.835 33.064 13.453 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.363 34.220 14.682 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.193 33.909 12.494 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -0.954 35.513 13.160 1.00 0.00 H new ATOM 179 N PRO A 13 3.771 34.816 10.447 1.00 0.00 N ATOM 180 CA PRO A 13 4.699 34.046 9.603 1.00 0.00 C ATOM 181 C PRO A 13 5.580 33.046 10.364 1.00 0.00 C ATOM 182 O PRO A 13 5.980 32.021 9.811 1.00 0.00 O ATOM 183 CB PRO A 13 5.583 35.096 8.923 1.00 0.00 C ATOM 184 CG PRO A 13 5.565 36.285 9.881 1.00 0.00 C ATOM 185 CD PRO A 13 4.155 36.220 10.462 1.00 0.00 C ATOM 0 HA PRO A 13 4.123 33.430 8.912 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.596 34.724 8.770 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.193 35.370 7.943 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.327 36.194 10.655 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.747 37.226 9.363 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.134 36.618 11.477 1.00 0.00 H new ATOM 0 HD3 PRO A 13 3.463 36.819 9.870 1.00 0.00 H new ATOM 193 N THR A 14 5.919 33.371 11.610 1.00 0.00 N ATOM 194 CA THR A 14 6.887 32.626 12.436 1.00 0.00 C ATOM 195 C THR A 14 6.264 31.439 13.172 1.00 0.00 C ATOM 196 O THR A 14 6.683 30.300 12.967 1.00 0.00 O ATOM 197 CB THR A 14 7.566 33.552 13.455 1.00 0.00 C ATOM 198 OG1 THR A 14 6.612 34.393 14.075 1.00 0.00 O ATOM 199 CG2 THR A 14 8.608 34.454 12.795 1.00 0.00 C ATOM 0 H THR A 14 5.523 34.178 12.091 1.00 0.00 H new ATOM 0 HA THR A 14 7.627 32.231 11.740 1.00 0.00 H new ATOM 0 HB THR A 14 8.050 32.905 14.187 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.061 34.975 14.723 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.066 35.094 13.550 1.00 0.00 H new ATOM 0 HG22 THR A 14 9.376 33.839 12.326 1.00 0.00 H new ATOM 0 HG23 THR A 14 8.126 35.073 12.038 1.00 0.00 H new ATOM 207 N ASP A 15 5.268 31.699 14.022 1.00 0.00 N ATOM 208 CA ASP A 15 4.637 30.730 14.927 1.00 0.00 C ATOM 209 C ASP A 15 3.133 31.025 15.107 1.00 0.00 C ATOM 210 O ASP A 15 2.706 32.174 14.970 1.00 0.00 O ATOM 211 CB ASP A 15 5.348 30.765 16.287 1.00 0.00 C ATOM 212 CG ASP A 15 6.823 30.348 16.198 1.00 0.00 C ATOM 213 OD1 ASP A 15 7.109 29.173 15.872 1.00 0.00 O ATOM 214 OD2 ASP A 15 7.714 31.174 16.512 1.00 0.00 O ATOM 0 H ASP A 15 4.860 32.630 14.103 1.00 0.00 H new ATOM 0 HA ASP A 15 4.730 29.737 14.488 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.284 31.772 16.699 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.829 30.103 16.980 1.00 0.00 H new ATOM 219 N LEU A 16 2.335 30.021 15.481 1.00 0.00 N ATOM 220 CA LEU A 16 0.907 30.176 15.792 1.00 0.00 C ATOM 221 C LEU A 16 0.764 30.543 17.273 1.00 0.00 C ATOM 222 O LEU A 16 1.289 29.850 18.143 1.00 0.00 O ATOM 223 CB LEU A 16 0.145 28.857 15.525 1.00 0.00 C ATOM 224 CG LEU A 16 -0.447 28.633 14.124 1.00 0.00 C ATOM 225 CD1 LEU A 16 -1.602 29.582 13.814 1.00 0.00 C ATOM 226 CD2 LEU A 16 0.590 28.740 13.013 1.00 0.00 C ATOM 0 H LEU A 16 2.666 29.061 15.578 1.00 0.00 H new ATOM 0 HA LEU A 16 0.488 30.958 15.159 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.824 28.031 15.736 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.670 28.791 16.246 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.824 27.611 14.150 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.981 29.379 12.812 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.400 29.433 14.541 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.250 30.612 13.867 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.109 28.572 12.049 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.037 29.734 13.027 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.366 27.991 13.167 1.00 0.00 H new ATOM 238 N LYS A 17 0.031 31.620 17.565 1.00 0.00 N ATOM 239 CA LYS A 17 -0.129 32.161 18.922 1.00 0.00 C ATOM 240 C LYS A 17 -1.491 31.797 19.499 1.00 0.00 C ATOM 241 O LYS A 17 -2.531 32.091 18.907 1.00 0.00 O ATOM 242 CB LYS A 17 0.128 33.678 18.928 1.00 0.00 C ATOM 243 CG LYS A 17 1.574 34.013 18.521 1.00 0.00 C ATOM 244 CD LYS A 17 1.834 35.525 18.583 1.00 0.00 C ATOM 245 CE LYS A 17 3.277 35.829 18.159 1.00 0.00 C ATOM 246 NZ LYS A 17 3.568 37.288 18.220 1.00 0.00 N ATOM 0 H LYS A 17 -0.477 32.150 16.857 1.00 0.00 H new ATOM 0 HA LYS A 17 0.616 31.704 19.574 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.565 34.167 18.243 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -0.072 34.077 19.923 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.269 33.495 19.181 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.763 33.650 17.511 1.00 0.00 H new ATOM 0 HD2 LYS A 17 1.137 36.049 17.930 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.659 35.891 19.595 1.00 0.00 H new ATOM 0 HE2 LYS A 17 3.969 35.292 18.808 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.444 35.466 17.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.551 37.458 17.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 2.924 37.797 17.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.433 37.629 19.193 1.00 0.00 H new ATOM 260 N PHE A 18 -1.471 31.174 20.670 1.00 0.00 N ATOM 261 CA PHE A 18 -2.641 30.753 21.435 1.00 0.00 C ATOM 262 C PHE A 18 -2.648 31.481 22.785 1.00 0.00 C ATOM 263 O PHE A 18 -1.829 31.197 23.656 1.00 0.00 O ATOM 264 CB PHE A 18 -2.605 29.223 21.584 1.00 0.00 C ATOM 265 CG PHE A 18 -2.648 28.490 20.258 1.00 0.00 C ATOM 266 CD1 PHE A 18 -3.892 28.320 19.630 1.00 0.00 C ATOM 267 CD2 PHE A 18 -1.476 28.034 19.621 1.00 0.00 C ATOM 268 CE1 PHE A 18 -3.974 27.726 18.365 1.00 0.00 C ATOM 269 CE2 PHE A 18 -1.561 27.418 18.362 1.00 0.00 C ATOM 270 CZ PHE A 18 -2.801 27.291 17.715 1.00 0.00 C ATOM 0 H PHE A 18 -0.596 30.936 21.137 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.567 31.015 20.923 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.699 28.938 22.119 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.450 28.904 22.195 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.793 28.650 20.127 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.516 28.158 20.100 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.935 27.601 17.888 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.667 27.040 17.888 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.856 26.863 16.725 1.00 0.00 H new ATOM 280 N LYS A 19 -3.554 32.455 22.950 1.00 0.00 N ATOM 281 CA LYS A 19 -3.719 33.236 24.189 1.00 0.00 C ATOM 282 C LYS A 19 -5.045 32.905 24.874 1.00 0.00 C ATOM 283 O LYS A 19 -6.094 32.965 24.230 1.00 0.00 O ATOM 284 CB LYS A 19 -3.524 34.731 23.874 1.00 0.00 C ATOM 285 CG LYS A 19 -3.558 35.654 25.109 1.00 0.00 C ATOM 286 CD LYS A 19 -4.947 36.200 25.492 1.00 0.00 C ATOM 287 CE LYS A 19 -5.504 37.160 24.426 1.00 0.00 C ATOM 288 NZ LYS A 19 -6.816 37.740 24.832 1.00 0.00 N ATOM 0 H LYS A 19 -4.205 32.729 22.214 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.954 32.963 24.916 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.569 34.861 23.365 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.301 35.047 23.178 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -3.155 35.107 25.961 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.892 36.498 24.928 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.638 35.368 25.628 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.881 36.719 26.448 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.789 37.965 24.253 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.619 36.627 23.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -7.157 38.381 24.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.505 36.974 24.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -6.702 38.270 25.719 1.00 0.00 H new ATOM 302 N GLY A 20 -5.024 32.602 26.172 1.00 0.00 N ATOM 303 CA GLY A 20 -6.213 32.307 26.959 1.00 0.00 C ATOM 304 C GLY A 20 -5.840 31.556 28.237 1.00 0.00 C ATOM 305 O GLY A 20 -4.666 31.277 28.473 1.00 0.00 O ATOM 0 H GLY A 20 -4.161 32.555 26.713 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.727 33.234 27.213 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -6.907 31.709 26.369 1.00 0.00 H new ATOM 309 N PRO A 21 -6.821 31.203 29.081 1.00 0.00 N ATOM 310 CA PRO A 21 -6.531 30.450 30.303 1.00 0.00 C ATOM 311 C PRO A 21 -6.209 28.961 30.177 1.00 0.00 C ATOM 312 O PRO A 21 -5.705 28.295 31.081 1.00 0.00 O ATOM 313 CB PRO A 21 -7.818 30.563 31.096 1.00 0.00 C ATOM 314 CG PRO A 21 -8.455 31.870 30.658 1.00 0.00 C ATOM 315 CD PRO A 21 -8.138 31.831 29.164 1.00 0.00 C ATOM 0 HA PRO A 21 -5.621 30.869 30.732 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.478 29.719 30.895 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.619 30.564 32.168 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.526 31.899 30.856 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.016 32.735 31.155 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.885 31.258 28.615 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.127 32.833 28.735 1.00 0.00 H new ATOM 323 N PHE A 22 -6.636 28.487 29.027 1.00 0.00 N ATOM 324 CA PHE A 22 -6.756 27.122 28.518 1.00 0.00 C ATOM 325 C PHE A 22 -7.765 26.271 29.306 1.00 0.00 C ATOM 326 O PHE A 22 -7.738 25.045 29.263 1.00 0.00 O ATOM 327 CB PHE A 22 -5.374 26.507 28.309 1.00 0.00 C ATOM 328 CG PHE A 22 -4.420 27.379 27.511 1.00 0.00 C ATOM 329 CD1 PHE A 22 -4.448 27.379 26.104 1.00 0.00 C ATOM 330 CD2 PHE A 22 -3.526 28.230 28.186 1.00 0.00 C ATOM 331 CE1 PHE A 22 -3.546 28.182 25.384 1.00 0.00 C ATOM 332 CE2 PHE A 22 -2.625 29.034 27.469 1.00 0.00 C ATOM 333 CZ PHE A 22 -2.632 29.005 26.065 1.00 0.00 C ATOM 0 H PHE A 22 -6.957 29.145 28.316 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.209 27.153 27.527 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -4.930 26.298 29.282 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.487 25.550 27.799 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.162 26.763 25.578 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -3.533 28.265 29.265 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.555 28.167 24.304 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -1.930 29.672 27.995 1.00 0.00 H new ATOM 0 HZ PHE A 22 -1.936 29.615 25.509 1.00 0.00 H new ATOM 343 N THR A 23 -8.704 26.945 29.977 1.00 0.00 N ATOM 344 CA THR A 23 -9.890 26.353 30.627 1.00 0.00 C ATOM 345 C THR A 23 -11.038 26.089 29.637 1.00 0.00 C ATOM 346 O THR A 23 -11.945 25.305 29.924 1.00 0.00 O ATOM 347 CB THR A 23 -10.388 27.274 31.751 1.00 0.00 C ATOM 348 OG1 THR A 23 -10.785 28.521 31.219 1.00 0.00 O ATOM 349 CG2 THR A 23 -9.279 27.558 32.763 1.00 0.00 C ATOM 0 H THR A 23 -8.662 27.958 30.090 1.00 0.00 H new ATOM 0 HA THR A 23 -9.580 25.391 31.035 1.00 0.00 H new ATOM 0 HB THR A 23 -11.222 26.765 32.235 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.102 29.100 31.943 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.661 28.212 33.547 1.00 0.00 H new ATOM 0 HG22 THR A 23 -8.941 26.621 33.205 1.00 0.00 H new ATOM 0 HG23 THR A 23 -8.443 28.044 32.260 1.00 0.00 H new ATOM 357 N ASP A 24 -10.976 26.709 28.455 1.00 0.00 N ATOM 358 CA ASP A 24 -11.854 26.476 27.296 1.00 0.00 C ATOM 359 C ASP A 24 -11.054 26.552 25.971 1.00 0.00 C ATOM 360 O ASP A 24 -9.842 26.791 25.975 1.00 0.00 O ATOM 361 CB ASP A 24 -13.009 27.497 27.324 1.00 0.00 C ATOM 362 CG ASP A 24 -14.340 26.900 26.827 1.00 0.00 C ATOM 363 OD1 ASP A 24 -14.383 26.350 25.701 1.00 0.00 O ATOM 364 OD2 ASP A 24 -15.353 26.988 27.562 1.00 0.00 O ATOM 0 H ASP A 24 -10.276 27.426 28.267 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.274 25.472 27.354 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.138 27.866 28.341 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.746 28.355 26.705 1.00 0.00 H new ATOM 369 N VAL A 25 -11.722 26.342 24.834 1.00 0.00 N ATOM 370 CA VAL A 25 -11.132 26.376 23.485 1.00 0.00 C ATOM 371 C VAL A 25 -10.552 27.759 23.152 1.00 0.00 C ATOM 372 O VAL A 25 -11.198 28.789 23.369 1.00 0.00 O ATOM 373 CB VAL A 25 -12.173 25.964 22.421 1.00 0.00 C ATOM 374 CG1 VAL A 25 -11.641 26.054 20.982 1.00 0.00 C ATOM 375 CG2 VAL A 25 -12.647 24.522 22.639 1.00 0.00 C ATOM 0 H VAL A 25 -12.721 26.137 24.822 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.312 25.658 23.473 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.992 26.673 22.542 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.423 25.751 20.285 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.342 27.080 20.768 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.780 25.395 20.870 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.379 24.260 21.875 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.795 23.845 22.572 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.104 24.434 23.625 1.00 0.00 H new ATOM 385 N VAL A 26 -9.356 27.774 22.556 1.00 0.00 N ATOM 386 CA VAL A 26 -8.712 28.961 21.968 1.00 0.00 C ATOM 387 C VAL A 26 -8.946 28.975 20.461 1.00 0.00 C ATOM 388 O VAL A 26 -8.663 27.985 19.788 1.00 0.00 O ATOM 389 CB VAL A 26 -7.193 28.986 22.225 1.00 0.00 C ATOM 390 CG1 VAL A 26 -6.562 30.314 21.794 1.00 0.00 C ATOM 391 CG2 VAL A 26 -6.850 28.793 23.695 1.00 0.00 C ATOM 0 H VAL A 26 -8.787 26.933 22.464 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.155 29.837 22.442 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.795 28.161 21.634 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.491 30.289 21.993 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.730 30.468 20.728 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.016 31.131 22.354 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.768 28.819 23.823 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.304 29.591 24.282 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.233 27.831 24.035 1.00 0.00 H new ATOM 401 N THR A 27 -9.396 30.107 19.924 1.00 0.00 N ATOM 402 CA THR A 27 -9.485 30.339 18.469 1.00 0.00 C ATOM 403 C THR A 27 -8.300 31.184 18.005 1.00 0.00 C ATOM 404 O THR A 27 -8.053 32.259 18.558 1.00 0.00 O ATOM 405 CB THR A 27 -10.816 31.003 18.078 1.00 0.00 C ATOM 406 OG1 THR A 27 -11.888 30.164 18.454 1.00 0.00 O ATOM 407 CG2 THR A 27 -10.933 31.237 16.569 1.00 0.00 C ATOM 0 H THR A 27 -9.713 30.899 20.483 1.00 0.00 H new ATOM 0 HA THR A 27 -9.451 29.371 17.969 1.00 0.00 H new ATOM 0 HB THR A 27 -10.849 31.965 18.590 1.00 0.00 H new ATOM 0 HG1 THR A 27 -12.737 30.587 18.207 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.891 31.708 16.347 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.124 31.888 16.238 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.868 30.282 16.047 1.00 0.00 H new ATOM 415 N THR A 28 -7.601 30.728 16.963 1.00 0.00 N ATOM 416 CA THR A 28 -6.437 31.404 16.375 1.00 0.00 C ATOM 417 C THR A 28 -6.584 31.354 14.863 1.00 0.00 C ATOM 418 O THR A 28 -6.664 30.272 14.286 1.00 0.00 O ATOM 419 CB THR A 28 -5.126 30.738 16.835 1.00 0.00 C ATOM 420 OG1 THR A 28 -4.952 30.980 18.213 1.00 0.00 O ATOM 421 CG2 THR A 28 -3.871 31.272 16.142 1.00 0.00 C ATOM 0 H THR A 28 -7.834 29.855 16.490 1.00 0.00 H new ATOM 0 HA THR A 28 -6.394 32.441 16.707 1.00 0.00 H new ATOM 0 HB THR A 28 -5.229 29.682 16.585 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.102 31.445 18.359 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.994 30.749 16.524 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.951 31.108 15.067 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.772 32.339 16.340 1.00 0.00 H new ATOM 429 N ASN A 29 -6.641 32.513 14.209 1.00 0.00 N ATOM 430 CA ASN A 29 -6.658 32.605 12.755 1.00 0.00 C ATOM 431 C ASN A 29 -5.246 32.840 12.187 1.00 0.00 C ATOM 432 O ASN A 29 -4.434 33.564 12.766 1.00 0.00 O ATOM 433 CB ASN A 29 -7.697 33.642 12.298 1.00 0.00 C ATOM 434 CG ASN A 29 -7.437 35.055 12.794 1.00 0.00 C ATOM 435 OD1 ASN A 29 -6.688 35.822 12.209 1.00 0.00 O ATOM 436 ND2 ASN A 29 -8.055 35.441 13.890 1.00 0.00 N ATOM 0 H ASN A 29 -6.677 33.418 14.678 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.975 31.648 12.339 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.726 33.653 11.208 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.682 33.326 12.640 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -7.909 36.383 14.253 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.680 34.798 14.376 1.00 0.00 H new ATOM 443 N LEU A 30 -4.984 32.221 11.036 1.00 0.00 N ATOM 444 CA LEU A 30 -3.780 32.368 10.229 1.00 0.00 C ATOM 445 C LEU A 30 -4.190 32.920 8.857 1.00 0.00 C ATOM 446 O LEU A 30 -4.976 32.283 8.154 1.00 0.00 O ATOM 447 CB LEU A 30 -3.097 30.988 10.131 1.00 0.00 C ATOM 448 CG LEU A 30 -1.715 31.015 9.456 1.00 0.00 C ATOM 449 CD1 LEU A 30 -0.634 31.540 10.394 1.00 0.00 C ATOM 450 CD2 LEU A 30 -1.289 29.610 9.038 1.00 0.00 C ATOM 0 H LEU A 30 -5.647 31.566 10.621 1.00 0.00 H new ATOM 0 HA LEU A 30 -3.067 33.064 10.671 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.991 30.576 11.134 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.747 30.312 9.576 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.814 31.672 8.592 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.326 31.542 9.878 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.882 32.555 10.703 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.572 30.898 11.273 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.309 29.653 8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.238 28.968 9.918 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.016 29.204 8.334 1.00 0.00 H new ATOM 462 N LYS A 31 -3.684 34.088 8.463 1.00 0.00 N ATOM 463 CA LYS A 31 -3.912 34.668 7.128 1.00 0.00 C ATOM 464 C LYS A 31 -2.820 34.216 6.166 1.00 0.00 C ATOM 465 O LYS A 31 -1.640 34.426 6.433 1.00 0.00 O ATOM 466 CB LYS A 31 -4.019 36.200 7.215 1.00 0.00 C ATOM 467 CG LYS A 31 -5.495 36.557 7.248 1.00 0.00 C ATOM 468 CD LYS A 31 -5.762 38.059 7.289 1.00 0.00 C ATOM 469 CE LYS A 31 -7.282 38.187 7.203 1.00 0.00 C ATOM 470 NZ LYS A 31 -7.728 39.608 7.199 1.00 0.00 N ATOM 0 H LYS A 31 -3.098 34.668 9.063 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.862 34.306 6.735 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.516 36.569 8.109 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.531 36.667 6.359 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.982 36.134 6.369 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.953 36.092 8.121 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.379 38.504 8.207 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.274 38.570 6.459 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.636 37.695 6.297 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.737 37.668 8.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.766 39.646 7.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.414 40.073 8.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.316 40.099 6.380 1.00 0.00 H new ATOM 484 N LEU A 32 -3.201 33.603 5.047 1.00 0.00 N ATOM 485 CA LEU A 32 -2.291 33.210 3.972 1.00 0.00 C ATOM 486 C LEU A 32 -2.567 34.058 2.738 1.00 0.00 C ATOM 487 O LEU A 32 -3.666 33.976 2.193 1.00 0.00 O ATOM 488 CB LEU A 32 -2.469 31.716 3.633 1.00 0.00 C ATOM 489 CG LEU A 32 -2.125 30.666 4.702 1.00 0.00 C ATOM 490 CD1 LEU A 32 -0.999 31.085 5.626 1.00 0.00 C ATOM 491 CD2 LEU A 32 -3.331 30.302 5.558 1.00 0.00 C ATOM 0 H LEU A 32 -4.173 33.360 4.858 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.264 33.370 4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.509 31.565 3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.861 31.503 2.754 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.797 29.799 4.129 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.812 30.295 6.353 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.096 31.262 5.042 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.278 32.000 6.148 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.040 29.557 6.299 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.700 31.194 6.065 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.118 29.894 4.923 1.00 0.00 H new ATOM 503 N ARG A 33 -1.588 34.844 2.281 1.00 0.00 N ATOM 504 CA ARG A 33 -1.687 35.649 1.052 1.00 0.00 C ATOM 505 C ARG A 33 -0.737 35.123 -0.020 1.00 0.00 C ATOM 506 O ARG A 33 0.373 34.682 0.281 1.00 0.00 O ATOM 507 CB ARG A 33 -1.497 37.148 1.372 1.00 0.00 C ATOM 508 CG ARG A 33 -1.812 38.041 0.159 1.00 0.00 C ATOM 509 CD ARG A 33 -1.829 39.534 0.495 1.00 0.00 C ATOM 510 NE ARG A 33 -2.411 40.294 -0.629 1.00 0.00 N ATOM 511 CZ ARG A 33 -2.373 41.595 -0.837 1.00 0.00 C ATOM 512 NH1 ARG A 33 -1.753 42.416 -0.037 1.00 0.00 N ATOM 513 NH2 ARG A 33 -2.982 42.085 -1.879 1.00 0.00 N ATOM 0 H ARG A 33 -0.692 34.943 2.757 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.689 35.551 0.634 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.144 37.426 2.204 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.470 37.323 1.694 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.071 37.859 -0.619 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.781 37.757 -0.251 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -2.410 39.705 1.401 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.816 39.882 0.695 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.904 39.744 -1.332 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.272 42.058 0.788 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.749 43.416 -0.236 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.478 41.464 -2.519 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.963 43.089 -2.055 1.00 0.00 H new ATOM 527 N ASN A 34 -1.166 35.198 -1.276 1.00 0.00 N ATOM 528 CA ASN A 34 -0.381 34.768 -2.431 1.00 0.00 C ATOM 529 C ASN A 34 0.189 35.992 -3.170 1.00 0.00 C ATOM 530 O ASN A 34 -0.581 36.759 -3.749 1.00 0.00 O ATOM 531 CB ASN A 34 -1.292 33.899 -3.317 1.00 0.00 C ATOM 532 CG ASN A 34 -0.619 33.389 -4.579 1.00 0.00 C ATOM 533 OD1 ASN A 34 0.566 33.569 -4.818 1.00 0.00 O ATOM 534 ND2 ASN A 34 -1.374 32.737 -5.426 1.00 0.00 N ATOM 0 H ASN A 34 -2.084 35.565 -1.525 1.00 0.00 H new ATOM 0 HA ASN A 34 0.480 34.172 -2.130 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.643 33.047 -2.735 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.172 34.479 -3.595 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.974 32.375 -6.292 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.362 32.590 -5.220 1.00 0.00 H new ATOM 541 N PRO A 35 1.525 36.173 -3.184 1.00 0.00 N ATOM 542 CA PRO A 35 2.161 37.302 -3.859 1.00 0.00 C ATOM 543 C PRO A 35 2.206 37.153 -5.395 1.00 0.00 C ATOM 544 O PRO A 35 2.353 38.141 -6.119 1.00 0.00 O ATOM 545 CB PRO A 35 3.581 37.328 -3.302 1.00 0.00 C ATOM 546 CG PRO A 35 3.883 35.889 -2.914 1.00 0.00 C ATOM 547 CD PRO A 35 2.520 35.356 -2.496 1.00 0.00 C ATOM 0 HA PRO A 35 1.597 38.217 -3.679 1.00 0.00 H new ATOM 0 HB2 PRO A 35 4.289 37.692 -4.046 1.00 0.00 H new ATOM 0 HB3 PRO A 35 3.654 37.992 -2.441 1.00 0.00 H new ATOM 0 HG2 PRO A 35 4.299 35.324 -3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 35 4.606 35.833 -2.100 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.414 34.306 -2.768 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.394 35.420 -1.415 1.00 0.00 H new ATOM 555 N SER A 36 2.134 35.908 -5.874 1.00 0.00 N ATOM 556 CA SER A 36 2.327 35.499 -7.274 1.00 0.00 C ATOM 557 C SER A 36 1.206 35.930 -8.235 1.00 0.00 C ATOM 558 O SER A 36 0.167 36.455 -7.833 1.00 0.00 O ATOM 559 CB SER A 36 2.492 33.974 -7.329 1.00 0.00 C ATOM 560 OG SER A 36 3.203 33.603 -8.499 1.00 0.00 O ATOM 0 H SER A 36 1.929 35.115 -5.267 1.00 0.00 H new ATOM 0 HA SER A 36 3.222 36.017 -7.620 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.025 33.626 -6.444 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.513 33.494 -7.321 1.00 0.00 H new ATOM 0 HG SER A 36 3.305 32.629 -8.525 1.00 0.00 H new ATOM 566 N ASP A 37 1.412 35.631 -9.522 1.00 0.00 N ATOM 567 CA ASP A 37 0.475 35.811 -10.643 1.00 0.00 C ATOM 568 C ASP A 37 -0.105 34.459 -11.136 1.00 0.00 C ATOM 569 O ASP A 37 -0.424 34.281 -12.314 1.00 0.00 O ATOM 570 CB ASP A 37 1.176 36.630 -11.741 1.00 0.00 C ATOM 571 CG ASP A 37 0.214 37.137 -12.832 1.00 0.00 C ATOM 572 OD1 ASP A 37 -0.873 37.668 -12.494 1.00 0.00 O ATOM 573 OD2 ASP A 37 0.566 37.060 -14.035 1.00 0.00 O ATOM 0 H ASP A 37 2.297 35.229 -9.832 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.399 36.373 -10.315 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.678 37.483 -11.284 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.949 36.017 -12.204 1.00 0.00 H new ATOM 578 N ARG A 38 -0.214 33.479 -10.221 1.00 0.00 N ATOM 579 CA ARG A 38 -0.695 32.103 -10.440 1.00 0.00 C ATOM 580 C ARG A 38 -1.613 31.688 -9.292 1.00 0.00 C ATOM 581 O ARG A 38 -1.479 32.210 -8.186 1.00 0.00 O ATOM 582 CB ARG A 38 0.500 31.129 -10.494 1.00 0.00 C ATOM 583 CG ARG A 38 1.514 31.394 -11.616 1.00 0.00 C ATOM 584 CD ARG A 38 2.666 30.389 -11.499 1.00 0.00 C ATOM 585 NE ARG A 38 3.682 30.587 -12.548 1.00 0.00 N ATOM 586 CZ ARG A 38 4.870 30.007 -12.605 1.00 0.00 C ATOM 587 NH1 ARG A 38 5.277 29.169 -11.692 1.00 0.00 N ATOM 588 NH2 ARG A 38 5.680 30.264 -13.593 1.00 0.00 N ATOM 0 H ARG A 38 0.048 33.637 -9.248 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.240 32.070 -11.383 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.023 31.168 -9.538 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.116 30.115 -10.606 1.00 0.00 H new ATOM 0 HG2 ARG A 38 1.031 31.301 -12.589 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.895 32.413 -11.545 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.133 30.486 -10.519 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.271 29.375 -11.564 1.00 0.00 H new ATOM 0 HE ARG A 38 3.447 31.233 -13.302 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.673 28.942 -10.902 1.00 0.00 H new ATOM 0 HH12 ARG A 38 6.199 28.740 -11.768 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.399 30.915 -14.327 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.595 29.815 -13.633 1.00 0.00 H new ATOM 602 N LYS A 39 -2.490 30.708 -9.519 1.00 0.00 N ATOM 603 CA LYS A 39 -3.288 30.060 -8.458 1.00 0.00 C ATOM 604 C LYS A 39 -2.453 28.984 -7.761 1.00 0.00 C ATOM 605 O LYS A 39 -1.579 28.376 -8.375 1.00 0.00 O ATOM 606 CB LYS A 39 -4.610 29.491 -9.016 1.00 0.00 C ATOM 607 CG LYS A 39 -5.564 30.588 -9.518 1.00 0.00 C ATOM 608 CD LYS A 39 -5.427 30.896 -11.022 1.00 0.00 C ATOM 609 CE LYS A 39 -5.931 32.301 -11.387 1.00 0.00 C ATOM 610 NZ LYS A 39 -7.375 32.497 -11.070 1.00 0.00 N ATOM 0 H LYS A 39 -2.673 30.334 -10.450 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.560 30.812 -7.717 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.389 28.805 -9.834 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.107 28.910 -8.239 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.591 30.285 -9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.381 31.501 -8.952 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.381 30.802 -11.314 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.985 30.154 -11.593 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.342 33.044 -10.850 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.770 32.475 -12.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.742 33.307 -11.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.906 31.641 -11.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.485 32.680 -10.052 1.00 0.00 H new ATOM 624 N VAL A 40 -2.709 28.729 -6.481 1.00 0.00 N ATOM 625 CA VAL A 40 -1.938 27.763 -5.672 1.00 0.00 C ATOM 626 C VAL A 40 -2.849 27.035 -4.686 1.00 0.00 C ATOM 627 O VAL A 40 -3.627 27.667 -3.976 1.00 0.00 O ATOM 628 CB VAL A 40 -0.745 28.482 -5.000 1.00 0.00 C ATOM 629 CG1 VAL A 40 -1.164 29.584 -4.031 1.00 0.00 C ATOM 630 CG2 VAL A 40 0.211 27.540 -4.264 1.00 0.00 C ATOM 0 H VAL A 40 -3.460 29.185 -5.964 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.519 26.988 -6.314 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.222 28.927 -5.846 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.276 30.044 -3.597 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.740 30.339 -4.566 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.776 29.157 -3.237 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.021 28.118 -3.819 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.331 27.012 -3.479 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.625 26.818 -4.968 1.00 0.00 H new ATOM 640 N CYS A 41 -2.761 25.708 -4.630 1.00 0.00 N ATOM 641 CA CYS A 41 -3.521 24.892 -3.686 1.00 0.00 C ATOM 642 C CYS A 41 -2.750 24.788 -2.372 1.00 0.00 C ATOM 643 O CYS A 41 -1.531 24.602 -2.388 1.00 0.00 O ATOM 644 CB CYS A 41 -3.797 23.504 -4.276 1.00 0.00 C ATOM 645 SG CYS A 41 -4.999 23.638 -5.631 1.00 0.00 S ATOM 0 H CYS A 41 -2.155 25.164 -5.244 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.484 25.365 -3.492 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -2.870 23.064 -4.643 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.181 22.840 -3.502 1.00 0.00 H new ATOM 0 HG CYS A 41 -5.338 22.448 -6.029 1.00 0.00 H new ATOM 651 N PHE A 42 -3.459 24.885 -1.248 1.00 0.00 N ATOM 652 CA PHE A 42 -2.885 24.705 0.095 1.00 0.00 C ATOM 653 C PHE A 42 -3.510 23.548 0.885 1.00 0.00 C ATOM 654 O PHE A 42 -4.698 23.251 0.752 1.00 0.00 O ATOM 655 CB PHE A 42 -2.912 26.026 0.887 1.00 0.00 C ATOM 656 CG PHE A 42 -4.252 26.428 1.473 1.00 0.00 C ATOM 657 CD1 PHE A 42 -5.148 27.195 0.707 1.00 0.00 C ATOM 658 CD2 PHE A 42 -4.587 26.075 2.797 1.00 0.00 C ATOM 659 CE1 PHE A 42 -6.366 27.625 1.262 1.00 0.00 C ATOM 660 CE2 PHE A 42 -5.816 26.481 3.346 1.00 0.00 C ATOM 661 CZ PHE A 42 -6.704 27.256 2.578 1.00 0.00 C ATOM 0 H PHE A 42 -4.458 25.092 -1.239 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.844 24.417 -0.054 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.190 25.952 1.701 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.571 26.826 0.230 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -4.899 27.455 -0.311 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.898 25.492 3.390 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.040 28.236 0.681 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.078 26.199 4.355 1.00 0.00 H new ATOM 0 HZ PHE A 42 -7.648 27.569 2.999 1.00 0.00 H new ATOM 671 N LYS A 43 -2.706 22.929 1.753 1.00 0.00 N ATOM 672 CA LYS A 43 -3.112 21.923 2.749 1.00 0.00 C ATOM 673 C LYS A 43 -2.470 22.193 4.114 1.00 0.00 C ATOM 674 O LYS A 43 -1.358 22.707 4.168 1.00 0.00 O ATOM 675 CB LYS A 43 -2.746 20.516 2.240 1.00 0.00 C ATOM 676 CG LYS A 43 -3.804 19.901 1.318 1.00 0.00 C ATOM 677 CD LYS A 43 -3.366 18.507 0.845 1.00 0.00 C ATOM 678 CE LYS A 43 -4.517 17.802 0.114 1.00 0.00 C ATOM 679 NZ LYS A 43 -4.112 16.455 -0.380 1.00 0.00 N ATOM 0 H LYS A 43 -1.705 23.122 1.785 1.00 0.00 H new ATOM 0 HA LYS A 43 -4.192 21.986 2.883 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -1.797 20.568 1.706 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -2.595 19.858 3.095 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.756 19.830 1.845 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -3.964 20.549 0.457 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -2.506 18.595 0.182 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.050 17.909 1.700 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.369 17.702 0.787 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.844 18.415 -0.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.899 15.787 -0.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.868 16.514 -1.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -3.286 16.122 0.157 1.00 0.00 H new ATOM 693 N VAL A 44 -3.144 21.829 5.211 1.00 0.00 N ATOM 694 CA VAL A 44 -2.696 22.089 6.596 1.00 0.00 C ATOM 695 C VAL A 44 -2.459 20.780 7.369 1.00 0.00 C ATOM 696 O VAL A 44 -3.233 19.829 7.245 1.00 0.00 O ATOM 697 CB VAL A 44 -3.691 23.013 7.339 1.00 0.00 C ATOM 698 CG1 VAL A 44 -3.079 23.530 8.644 1.00 0.00 C ATOM 699 CG2 VAL A 44 -4.084 24.241 6.501 1.00 0.00 C ATOM 0 H VAL A 44 -4.035 21.335 5.166 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.739 22.608 6.541 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.576 22.407 7.533 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.795 24.177 9.150 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.833 22.687 9.289 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.173 24.094 8.423 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.783 24.858 7.065 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.192 24.823 6.268 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.555 23.913 5.574 1.00 0.00 H new ATOM 709 N LYS A 45 -1.407 20.738 8.197 1.00 0.00 N ATOM 710 CA LYS A 45 -1.068 19.629 9.112 1.00 0.00 C ATOM 711 C LYS A 45 -0.877 20.129 10.549 1.00 0.00 C ATOM 712 O LYS A 45 -0.466 21.268 10.754 1.00 0.00 O ATOM 713 CB LYS A 45 0.201 18.884 8.646 1.00 0.00 C ATOM 714 CG LYS A 45 0.261 18.553 7.146 1.00 0.00 C ATOM 715 CD LYS A 45 1.432 17.596 6.863 1.00 0.00 C ATOM 716 CE LYS A 45 1.800 17.467 5.375 1.00 0.00 C ATOM 717 NZ LYS A 45 0.671 16.989 4.529 1.00 0.00 N ATOM 0 H LYS A 45 -0.738 21.506 8.253 1.00 0.00 H new ATOM 0 HA LYS A 45 -1.907 18.934 9.094 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.071 19.489 8.902 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.283 17.954 9.209 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -0.677 18.097 6.828 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.382 19.469 6.568 1.00 0.00 H new ATOM 0 HD2 LYS A 45 2.308 17.940 7.413 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.180 16.608 7.250 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.137 18.436 5.006 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.638 16.778 5.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.047 16.497 3.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.078 16.334 5.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 0.098 17.801 4.224 1.00 0.00 H new ATOM 731 N THR A 46 -1.111 19.259 11.529 1.00 0.00 N ATOM 732 CA THR A 46 -0.930 19.519 12.977 1.00 0.00 C ATOM 733 C THR A 46 -0.183 18.361 13.642 1.00 0.00 C ATOM 734 O THR A 46 -0.224 17.240 13.145 1.00 0.00 O ATOM 735 CB THR A 46 -2.288 19.760 13.673 1.00 0.00 C ATOM 736 OG1 THR A 46 -2.102 19.923 15.061 1.00 0.00 O ATOM 737 CG2 THR A 46 -3.282 18.605 13.529 1.00 0.00 C ATOM 0 H THR A 46 -1.445 18.314 11.341 1.00 0.00 H new ATOM 0 HA THR A 46 -0.332 20.424 13.084 1.00 0.00 H new ATOM 0 HB THR A 46 -2.691 20.646 13.183 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.863 20.412 15.438 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.208 18.856 14.046 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.491 18.434 12.473 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.856 17.702 13.965 1.00 0.00 H new ATOM 745 N THR A 47 0.483 18.585 14.774 1.00 0.00 N ATOM 746 CA THR A 47 1.046 17.498 15.598 1.00 0.00 C ATOM 747 C THR A 47 -0.005 16.672 16.347 1.00 0.00 C ATOM 748 O THR A 47 0.307 15.580 16.822 1.00 0.00 O ATOM 749 CB THR A 47 2.042 18.048 16.624 1.00 0.00 C ATOM 750 OG1 THR A 47 1.561 19.246 17.202 1.00 0.00 O ATOM 751 CG2 THR A 47 3.366 18.382 15.960 1.00 0.00 C ATOM 0 H THR A 47 0.651 19.518 15.151 1.00 0.00 H new ATOM 0 HA THR A 47 1.541 16.838 14.886 1.00 0.00 H new ATOM 0 HB THR A 47 2.171 17.277 17.384 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.797 19.046 17.782 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.059 18.771 16.706 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.785 17.482 15.510 1.00 0.00 H new ATOM 0 HG23 THR A 47 3.206 19.133 15.187 1.00 0.00 H new ATOM 759 N ALA A 48 -1.233 17.189 16.510 1.00 0.00 N ATOM 760 CA ALA A 48 -2.232 16.573 17.392 1.00 0.00 C ATOM 761 C ALA A 48 -3.691 16.825 16.951 1.00 0.00 C ATOM 762 O ALA A 48 -4.349 17.709 17.503 1.00 0.00 O ATOM 763 CB ALA A 48 -1.947 17.088 18.816 1.00 0.00 C ATOM 0 H ALA A 48 -1.557 18.035 16.040 1.00 0.00 H new ATOM 0 HA ALA A 48 -2.139 15.488 17.347 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.667 16.656 19.510 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.939 16.799 19.112 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -2.033 18.174 18.834 1.00 0.00 H new ATOM 769 N PRO A 49 -4.280 16.002 16.058 1.00 0.00 N ATOM 770 CA PRO A 49 -5.701 16.116 15.683 1.00 0.00 C ATOM 771 C PRO A 49 -6.649 15.991 16.889 1.00 0.00 C ATOM 772 O PRO A 49 -7.656 16.685 16.987 1.00 0.00 O ATOM 773 CB PRO A 49 -5.938 14.993 14.664 1.00 0.00 C ATOM 774 CG PRO A 49 -4.551 14.741 14.077 1.00 0.00 C ATOM 775 CD PRO A 49 -3.650 14.931 15.295 1.00 0.00 C ATOM 0 HA PRO A 49 -5.915 17.101 15.269 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.340 14.099 15.140 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.650 15.293 13.895 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -4.462 13.739 13.656 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.312 15.444 13.279 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.579 14.015 15.882 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -2.636 15.199 14.999 1.00 0.00 H new ATOM 783 N ARG A 50 -6.256 15.170 17.876 1.00 0.00 N ATOM 784 CA ARG A 50 -6.920 15.006 19.189 1.00 0.00 C ATOM 785 C ARG A 50 -6.852 16.230 20.131 1.00 0.00 C ATOM 786 O ARG A 50 -7.529 16.233 21.157 1.00 0.00 O ATOM 787 CB ARG A 50 -6.512 13.659 19.843 1.00 0.00 C ATOM 788 CG ARG A 50 -5.064 13.169 19.625 1.00 0.00 C ATOM 789 CD ARG A 50 -3.994 14.102 20.200 1.00 0.00 C ATOM 790 NE ARG A 50 -3.737 13.828 21.627 1.00 0.00 N ATOM 791 CZ ARG A 50 -2.702 13.204 22.164 1.00 0.00 C ATOM 792 NH1 ARG A 50 -1.734 12.688 21.460 1.00 0.00 N ATOM 793 NH2 ARG A 50 -2.642 13.094 23.455 1.00 0.00 N ATOM 0 H ARG A 50 -5.433 14.575 17.782 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.990 14.957 18.985 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.681 13.742 20.917 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.187 12.888 19.473 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -4.953 12.184 20.078 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.890 13.049 18.556 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -3.069 13.986 19.635 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.312 15.138 20.080 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.446 14.161 22.280 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -1.752 12.755 20.442 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -0.959 12.217 21.927 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -3.384 13.485 24.035 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -1.853 12.617 23.890 1.00 0.00 H new ATOM 807 N ARG A 51 -6.092 17.280 19.774 1.00 0.00 N ATOM 808 CA ARG A 51 -6.056 18.599 20.457 1.00 0.00 C ATOM 809 C ARG A 51 -6.443 19.784 19.562 1.00 0.00 C ATOM 810 O ARG A 51 -6.856 20.807 20.101 1.00 0.00 O ATOM 811 CB ARG A 51 -4.667 18.833 21.090 1.00 0.00 C ATOM 812 CG ARG A 51 -4.287 17.830 22.195 1.00 0.00 C ATOM 813 CD ARG A 51 -5.206 17.906 23.422 1.00 0.00 C ATOM 814 NE ARG A 51 -4.846 16.885 24.424 1.00 0.00 N ATOM 815 CZ ARG A 51 -4.177 17.022 25.552 1.00 0.00 C ATOM 816 NH1 ARG A 51 -3.635 18.150 25.919 1.00 0.00 N ATOM 817 NH2 ARG A 51 -4.044 15.995 26.336 1.00 0.00 N ATOM 0 H ARG A 51 -5.461 17.239 18.974 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.820 18.555 21.233 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.913 18.790 20.304 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.637 19.840 21.506 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.319 16.820 21.787 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.259 18.015 22.507 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.138 18.898 23.869 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.242 17.766 23.113 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.159 15.937 24.214 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -3.720 18.974 25.324 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.126 18.208 26.801 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -4.454 15.098 26.076 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -3.529 16.085 27.212 1.00 0.00 H new ATOM 831 N TYR A 52 -6.390 19.662 18.235 1.00 0.00 N ATOM 832 CA TYR A 52 -6.619 20.764 17.288 1.00 0.00 C ATOM 833 C TYR A 52 -7.694 20.487 16.221 1.00 0.00 C ATOM 834 O TYR A 52 -7.725 19.427 15.598 1.00 0.00 O ATOM 835 CB TYR A 52 -5.299 21.099 16.582 1.00 0.00 C ATOM 836 CG TYR A 52 -4.259 21.735 17.477 1.00 0.00 C ATOM 837 CD1 TYR A 52 -4.304 23.120 17.717 1.00 0.00 C ATOM 838 CD2 TYR A 52 -3.242 20.953 18.053 1.00 0.00 C ATOM 839 CE1 TYR A 52 -3.303 23.728 18.496 1.00 0.00 C ATOM 840 CE2 TYR A 52 -2.269 21.552 18.874 1.00 0.00 C ATOM 841 CZ TYR A 52 -2.295 22.945 19.090 1.00 0.00 C ATOM 842 OH TYR A 52 -1.361 23.540 19.871 1.00 0.00 O ATOM 0 H TYR A 52 -6.182 18.776 17.774 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.992 21.597 17.885 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.885 20.184 16.157 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.506 21.772 15.750 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -5.105 23.715 17.304 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.208 19.890 17.865 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.308 24.799 18.639 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -1.504 20.946 19.337 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.642 23.895 19.308 1.00 0.00 H new ATOM 852 N CYS A 53 -8.518 21.502 15.950 1.00 0.00 N ATOM 853 CA CYS A 53 -9.467 21.563 14.834 1.00 0.00 C ATOM 854 C CYS A 53 -8.945 22.584 13.812 1.00 0.00 C ATOM 855 O CYS A 53 -8.445 23.644 14.187 1.00 0.00 O ATOM 856 CB CYS A 53 -10.869 21.905 15.369 1.00 0.00 C ATOM 857 SG CYS A 53 -12.009 22.389 14.040 1.00 0.00 S ATOM 0 H CYS A 53 -8.544 22.342 16.528 1.00 0.00 H new ATOM 0 HA CYS A 53 -9.554 20.601 14.329 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -11.275 21.043 15.898 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -10.792 22.716 16.093 1.00 0.00 H new ATOM 0 HG CYS A 53 -11.833 21.612 13.013 1.00 0.00 H new ATOM 863 N VAL A 54 -9.051 22.242 12.529 1.00 0.00 N ATOM 864 CA VAL A 54 -8.475 22.953 11.369 1.00 0.00 C ATOM 865 C VAL A 54 -9.604 23.062 10.348 1.00 0.00 C ATOM 866 O VAL A 54 -9.659 22.306 9.384 1.00 0.00 O ATOM 867 CB VAL A 54 -7.255 22.180 10.839 1.00 0.00 C ATOM 868 CG1 VAL A 54 -6.503 23.031 9.815 1.00 0.00 C ATOM 869 CG2 VAL A 54 -6.258 21.875 11.971 1.00 0.00 C ATOM 0 H VAL A 54 -9.571 21.412 12.245 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.108 23.949 11.618 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.627 21.255 10.398 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.641 22.477 9.444 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.166 23.270 8.983 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.166 23.954 10.286 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.406 21.328 11.568 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.913 22.809 12.414 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.748 21.271 12.735 1.00 0.00 H new ATOM 879 N ARG A 55 -10.531 24.002 10.565 1.00 0.00 N ATOM 880 CA ARG A 55 -11.810 24.069 9.834 1.00 0.00 C ATOM 881 C ARG A 55 -11.797 23.899 8.312 1.00 0.00 C ATOM 882 O ARG A 55 -12.456 22.974 7.832 1.00 0.00 O ATOM 883 CB ARG A 55 -12.659 25.255 10.315 1.00 0.00 C ATOM 884 CG ARG A 55 -14.159 24.934 10.242 1.00 0.00 C ATOM 885 CD ARG A 55 -14.636 24.103 11.446 1.00 0.00 C ATOM 886 NE ARG A 55 -15.995 23.574 11.212 1.00 0.00 N ATOM 887 CZ ARG A 55 -16.307 22.439 10.608 1.00 0.00 C ATOM 888 NH1 ARG A 55 -15.420 21.543 10.305 1.00 0.00 N ATOM 889 NH2 ARG A 55 -17.534 22.171 10.274 1.00 0.00 N ATOM 0 H ARG A 55 -10.418 24.744 11.256 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.299 23.136 10.114 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.388 25.506 11.340 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.442 26.131 9.704 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.726 25.864 10.197 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.368 24.389 9.321 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -13.945 23.278 11.621 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.631 24.720 12.345 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.772 24.141 11.551 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.438 21.700 10.533 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.704 20.681 9.839 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -18.276 22.841 10.477 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -17.755 21.291 9.809 1.00 0.00 H new ATOM 903 N PRO A 56 -11.062 24.712 7.537 1.00 0.00 N ATOM 904 CA PRO A 56 -10.901 24.467 6.105 1.00 0.00 C ATOM 905 C PRO A 56 -10.199 23.142 5.750 1.00 0.00 C ATOM 906 O PRO A 56 -10.557 22.495 4.771 1.00 0.00 O ATOM 907 CB PRO A 56 -10.014 25.616 5.603 1.00 0.00 C ATOM 908 CG PRO A 56 -9.333 26.104 6.883 1.00 0.00 C ATOM 909 CD PRO A 56 -10.431 25.967 7.905 1.00 0.00 C ATOM 0 HA PRO A 56 -11.891 24.407 5.652 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.289 25.274 4.864 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.601 26.404 5.132 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.463 25.498 7.137 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -8.988 27.134 6.793 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.036 25.938 8.921 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.132 26.800 7.859 1.00 0.00 H new ATOM 917 N ASN A 57 -9.157 22.786 6.521 1.00 0.00 N ATOM 918 CA ASN A 57 -8.148 21.722 6.340 1.00 0.00 C ATOM 919 C ASN A 57 -7.260 21.888 5.084 1.00 0.00 C ATOM 920 O ASN A 57 -6.122 21.418 5.050 1.00 0.00 O ATOM 921 CB ASN A 57 -8.764 20.320 6.542 1.00 0.00 C ATOM 922 CG ASN A 57 -9.463 19.698 5.337 1.00 0.00 C ATOM 923 OD1 ASN A 57 -9.039 19.797 4.196 1.00 0.00 O ATOM 924 ND2 ASN A 57 -10.535 18.969 5.551 1.00 0.00 N ATOM 0 H ASN A 57 -8.979 23.295 7.387 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.419 21.837 7.142 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.972 19.643 6.862 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.483 20.379 7.359 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -10.996 18.499 4.772 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.906 18.873 6.496 1.00 0.00 H new ATOM 931 N SER A 58 -7.768 22.593 4.078 1.00 0.00 N ATOM 932 CA SER A 58 -7.180 22.777 2.748 1.00 0.00 C ATOM 933 C SER A 58 -7.960 23.821 1.938 1.00 0.00 C ATOM 934 O SER A 58 -9.035 24.273 2.352 1.00 0.00 O ATOM 935 CB SER A 58 -7.189 21.444 1.978 1.00 0.00 C ATOM 936 OG SER A 58 -8.497 20.926 1.824 1.00 0.00 O ATOM 0 H SER A 58 -8.657 23.083 4.172 1.00 0.00 H new ATOM 0 HA SER A 58 -6.156 23.125 2.883 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.740 21.590 0.996 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.572 20.717 2.506 1.00 0.00 H new ATOM 0 HG SER A 58 -8.727 20.381 2.606 1.00 0.00 H new ATOM 942 N GLY A 59 -7.435 24.194 0.773 1.00 0.00 N ATOM 943 CA GLY A 59 -8.124 25.070 -0.175 1.00 0.00 C ATOM 944 C GLY A 59 -7.243 25.506 -1.342 1.00 0.00 C ATOM 945 O GLY A 59 -6.234 24.875 -1.650 1.00 0.00 O ATOM 0 H GLY A 59 -6.512 23.895 0.457 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -9.002 24.554 -0.564 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.482 25.955 0.352 1.00 0.00 H new ATOM 949 N ILE A 60 -7.620 26.606 -1.995 1.00 0.00 N ATOM 950 CA ILE A 60 -6.848 27.250 -3.069 1.00 0.00 C ATOM 951 C ILE A 60 -6.802 28.770 -2.830 1.00 0.00 C ATOM 952 O ILE A 60 -7.790 29.351 -2.373 1.00 0.00 O ATOM 953 CB ILE A 60 -7.445 26.929 -4.459 1.00 0.00 C ATOM 954 CG1 ILE A 60 -7.990 25.485 -4.611 1.00 0.00 C ATOM 955 CG2 ILE A 60 -6.448 27.275 -5.585 1.00 0.00 C ATOM 956 CD1 ILE A 60 -8.554 25.168 -6.004 1.00 0.00 C ATOM 0 H ILE A 60 -8.494 27.090 -1.789 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.832 26.855 -3.053 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.321 27.571 -4.551 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.189 24.781 -4.387 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.772 25.324 -3.869 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.894 27.039 -6.551 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.209 28.338 -5.545 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.536 26.693 -5.455 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.914 24.139 -6.025 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.379 25.846 -6.225 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.770 25.294 -6.751 1.00 0.00 H new ATOM 968 N ILE A 61 -5.680 29.417 -3.161 1.00 0.00 N ATOM 969 CA ILE A 61 -5.506 30.877 -3.102 1.00 0.00 C ATOM 970 C ILE A 61 -5.244 31.451 -4.500 1.00 0.00 C ATOM 971 O ILE A 61 -4.401 30.956 -5.251 1.00 0.00 O ATOM 972 CB ILE A 61 -4.412 31.292 -2.093 1.00 0.00 C ATOM 973 CG1 ILE A 61 -4.578 30.497 -0.780 1.00 0.00 C ATOM 974 CG2 ILE A 61 -4.481 32.814 -1.859 1.00 0.00 C ATOM 975 CD1 ILE A 61 -3.805 31.034 0.420 1.00 0.00 C ATOM 0 H ILE A 61 -4.845 28.930 -3.486 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.439 31.305 -2.736 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.426 31.058 -2.493 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.637 30.470 -0.524 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.267 29.468 -0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.710 33.108 -1.147 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.321 33.335 -2.803 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.461 33.077 -1.461 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -3.994 30.401 1.287 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.738 31.034 0.196 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.130 32.052 0.636 1.00 0.00 H new ATOM 987 N ASP A 62 -5.953 32.530 -4.824 1.00 0.00 N ATOM 988 CA ASP A 62 -5.834 33.276 -6.085 1.00 0.00 C ATOM 989 C ASP A 62 -4.690 34.314 -6.058 1.00 0.00 C ATOM 990 O ASP A 62 -4.299 34.769 -4.978 1.00 0.00 O ATOM 991 CB ASP A 62 -7.188 33.932 -6.414 1.00 0.00 C ATOM 992 CG ASP A 62 -8.131 32.958 -7.133 1.00 0.00 C ATOM 993 OD1 ASP A 62 -7.935 32.737 -8.353 1.00 0.00 O ATOM 994 OD2 ASP A 62 -9.072 32.432 -6.492 1.00 0.00 O ATOM 0 H ASP A 62 -6.652 32.927 -4.197 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.572 32.572 -6.875 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -7.657 34.280 -5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.025 34.809 -7.040 1.00 0.00 H new ATOM 999 N PRO A 63 -4.134 34.718 -7.218 1.00 0.00 N ATOM 1000 CA PRO A 63 -3.051 35.700 -7.288 1.00 0.00 C ATOM 1001 C PRO A 63 -3.439 37.047 -6.655 1.00 0.00 C ATOM 1002 O PRO A 63 -4.461 37.646 -7.001 1.00 0.00 O ATOM 1003 CB PRO A 63 -2.725 35.839 -8.776 1.00 0.00 C ATOM 1004 CG PRO A 63 -3.997 35.392 -9.489 1.00 0.00 C ATOM 1005 CD PRO A 63 -4.509 34.297 -8.560 1.00 0.00 C ATOM 0 HA PRO A 63 -2.183 35.371 -6.716 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.467 36.867 -9.031 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -1.874 35.218 -9.056 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.714 36.206 -9.595 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -3.793 35.015 -10.491 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.589 34.182 -8.647 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -4.064 33.333 -8.807 1.00 0.00 H new ATOM 1013 N GLY A 64 -2.614 37.524 -5.717 1.00 0.00 N ATOM 1014 CA GLY A 64 -2.850 38.736 -4.921 1.00 0.00 C ATOM 1015 C GLY A 64 -3.859 38.591 -3.778 1.00 0.00 C ATOM 1016 O GLY A 64 -3.981 39.520 -2.975 1.00 0.00 O ATOM 0 H GLY A 64 -1.735 37.063 -5.482 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.899 39.065 -4.503 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.195 39.526 -5.588 1.00 0.00 H new ATOM 1020 N SER A 65 -4.546 37.450 -3.663 1.00 0.00 N ATOM 1021 CA SER A 65 -5.646 37.243 -2.711 1.00 0.00 C ATOM 1022 C SER A 65 -5.208 36.540 -1.420 1.00 0.00 C ATOM 1023 O SER A 65 -4.120 35.964 -1.348 1.00 0.00 O ATOM 1024 CB SER A 65 -6.802 36.484 -3.384 1.00 0.00 C ATOM 1025 OG SER A 65 -7.306 37.218 -4.489 1.00 0.00 O ATOM 0 H SER A 65 -4.351 36.630 -4.237 1.00 0.00 H new ATOM 0 HA SER A 65 -5.991 38.233 -2.413 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.456 35.506 -3.718 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.600 36.311 -2.662 1.00 0.00 H new ATOM 0 HG SER A 65 -8.039 36.719 -4.906 1.00 0.00 H new ATOM 1031 N THR A 66 -6.067 36.589 -0.393 1.00 0.00 N ATOM 1032 CA THR A 66 -5.810 36.039 0.958 1.00 0.00 C ATOM 1033 C THR A 66 -6.922 35.081 1.410 1.00 0.00 C ATOM 1034 O THR A 66 -8.101 35.346 1.168 1.00 0.00 O ATOM 1035 CB THR A 66 -5.663 37.166 2.005 1.00 0.00 C ATOM 1036 OG1 THR A 66 -4.825 38.197 1.532 1.00 0.00 O ATOM 1037 CG2 THR A 66 -5.055 36.712 3.339 1.00 0.00 C ATOM 0 H THR A 66 -6.987 37.023 -0.474 1.00 0.00 H new ATOM 0 HA THR A 66 -4.875 35.483 0.888 1.00 0.00 H new ATOM 0 HB THR A 66 -6.687 37.502 2.169 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.751 38.897 2.214 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.987 37.563 4.016 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.687 35.944 3.784 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.058 36.306 3.165 1.00 0.00 H new ATOM 1045 N VAL A 67 -6.559 33.999 2.112 1.00 0.00 N ATOM 1046 CA VAL A 67 -7.490 33.089 2.817 1.00 0.00 C ATOM 1047 C VAL A 67 -7.155 33.088 4.308 1.00 0.00 C ATOM 1048 O VAL A 67 -5.986 33.038 4.688 1.00 0.00 O ATOM 1049 CB VAL A 67 -7.470 31.651 2.249 1.00 0.00 C ATOM 1050 CG1 VAL A 67 -8.387 30.688 3.028 1.00 0.00 C ATOM 1051 CG2 VAL A 67 -7.931 31.648 0.787 1.00 0.00 C ATOM 0 H VAL A 67 -5.583 33.719 2.212 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.503 33.461 2.662 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.440 31.307 2.341 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.332 29.694 2.584 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.064 30.639 4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.415 31.049 2.984 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.911 30.629 0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -8.946 32.040 0.725 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.264 32.273 0.194 1.00 0.00 H new ATOM 1061 N THR A 68 -8.181 33.111 5.157 1.00 0.00 N ATOM 1062 CA THR A 68 -8.055 33.002 6.610 1.00 0.00 C ATOM 1063 C THR A 68 -8.381 31.571 7.040 1.00 0.00 C ATOM 1064 O THR A 68 -9.490 31.079 6.831 1.00 0.00 O ATOM 1065 CB THR A 68 -8.980 34.002 7.317 1.00 0.00 C ATOM 1066 OG1 THR A 68 -8.788 35.305 6.809 1.00 0.00 O ATOM 1067 CG2 THR A 68 -8.687 34.065 8.809 1.00 0.00 C ATOM 0 H THR A 68 -9.148 33.208 4.846 1.00 0.00 H new ATOM 0 HA THR A 68 -7.030 33.240 6.896 1.00 0.00 H new ATOM 0 HB THR A 68 -10.000 33.659 7.142 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.387 35.928 7.271 1.00 0.00 H new ATOM 0 HG21 THR A 68 -9.358 34.782 9.282 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.838 33.080 9.251 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.655 34.378 8.964 1.00 0.00 H new ATOM 1075 N VAL A 69 -7.404 30.911 7.654 1.00 0.00 N ATOM 1076 CA VAL A 69 -7.493 29.547 8.199 1.00 0.00 C ATOM 1077 C VAL A 69 -7.706 29.635 9.708 1.00 0.00 C ATOM 1078 O VAL A 69 -6.882 30.210 10.414 1.00 0.00 O ATOM 1079 CB VAL A 69 -6.223 28.751 7.834 1.00 0.00 C ATOM 1080 CG1 VAL A 69 -6.122 27.386 8.525 1.00 0.00 C ATOM 1081 CG2 VAL A 69 -6.168 28.506 6.320 1.00 0.00 C ATOM 0 H VAL A 69 -6.483 31.326 7.795 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.339 29.014 7.765 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.392 29.366 8.179 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.202 26.889 8.216 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.114 27.525 9.606 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -6.978 26.772 8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.267 27.943 6.075 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.046 27.938 6.011 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.152 29.462 5.797 1.00 0.00 H new ATOM 1091 N SER A 70 -8.806 29.081 10.210 1.00 0.00 N ATOM 1092 CA SER A 70 -9.144 29.048 11.639 1.00 0.00 C ATOM 1093 C SER A 70 -8.650 27.753 12.287 1.00 0.00 C ATOM 1094 O SER A 70 -8.852 26.647 11.775 1.00 0.00 O ATOM 1095 CB SER A 70 -10.652 29.250 11.834 1.00 0.00 C ATOM 1096 OG SER A 70 -11.402 28.391 10.990 1.00 0.00 O ATOM 0 H SER A 70 -9.508 28.630 9.624 1.00 0.00 H new ATOM 0 HA SER A 70 -8.633 29.870 12.140 1.00 0.00 H new ATOM 0 HB2 SER A 70 -10.915 29.060 12.875 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.912 30.287 11.624 1.00 0.00 H new ATOM 0 HG SER A 70 -12.359 28.541 11.138 1.00 0.00 H new ATOM 1102 N VAL A 71 -7.997 27.912 13.438 1.00 0.00 N ATOM 1103 CA VAL A 71 -7.527 26.832 14.304 1.00 0.00 C ATOM 1104 C VAL A 71 -8.246 26.956 15.641 1.00 0.00 C ATOM 1105 O VAL A 71 -8.190 28.012 16.272 1.00 0.00 O ATOM 1106 CB VAL A 71 -5.999 26.877 14.498 1.00 0.00 C ATOM 1107 CG1 VAL A 71 -5.535 25.705 15.367 1.00 0.00 C ATOM 1108 CG2 VAL A 71 -5.254 26.808 13.159 1.00 0.00 C ATOM 0 H VAL A 71 -7.772 28.836 13.807 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.751 25.872 13.839 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.770 27.825 14.985 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.453 25.752 15.494 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.018 25.762 16.343 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.803 24.765 14.884 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.179 26.842 13.338 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.507 25.878 12.649 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.545 27.654 12.537 1.00 0.00 H new ATOM 1118 N MET A 72 -8.894 25.880 16.085 1.00 0.00 N ATOM 1119 CA MET A 72 -9.501 25.785 17.410 1.00 0.00 C ATOM 1120 C MET A 72 -8.710 24.767 18.233 1.00 0.00 C ATOM 1121 O MET A 72 -8.721 23.570 17.936 1.00 0.00 O ATOM 1122 CB MET A 72 -11.001 25.472 17.313 1.00 0.00 C ATOM 1123 CG MET A 72 -11.846 26.683 16.895 1.00 0.00 C ATOM 1124 SD MET A 72 -11.732 27.167 15.148 1.00 0.00 S ATOM 1125 CE MET A 72 -13.081 28.376 15.089 1.00 0.00 C ATOM 0 H MET A 72 -9.013 25.036 15.524 1.00 0.00 H new ATOM 0 HA MET A 72 -9.448 26.744 17.925 1.00 0.00 H new ATOM 0 HB2 MET A 72 -11.152 24.667 16.594 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.353 25.108 18.278 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.890 26.470 17.125 1.00 0.00 H new ATOM 0 HG3 MET A 72 -11.552 27.535 17.508 1.00 0.00 H new ATOM 0 HE1 MET A 72 -13.126 28.822 14.096 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.026 27.878 15.307 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.903 29.156 15.829 1.00 0.00 H new ATOM 1135 N LEU A 73 -7.989 25.262 19.235 1.00 0.00 N ATOM 1136 CA LEU A 73 -7.108 24.524 20.141 1.00 0.00 C ATOM 1137 C LEU A 73 -7.857 24.230 21.443 1.00 0.00 C ATOM 1138 O LEU A 73 -8.383 25.136 22.086 1.00 0.00 O ATOM 1139 CB LEU A 73 -5.837 25.369 20.316 1.00 0.00 C ATOM 1140 CG LEU A 73 -4.759 24.930 21.331 1.00 0.00 C ATOM 1141 CD1 LEU A 73 -4.886 25.689 22.649 1.00 0.00 C ATOM 1142 CD2 LEU A 73 -4.638 23.434 21.622 1.00 0.00 C ATOM 0 H LEU A 73 -8.005 26.259 19.452 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.810 23.551 19.751 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.356 25.439 19.340 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.151 26.376 20.590 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.837 25.189 20.810 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.111 25.353 23.338 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.771 26.757 22.466 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -5.867 25.499 23.085 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.844 23.268 22.350 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.582 23.064 22.023 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.402 22.902 20.700 1.00 0.00 H new ATOM 1154 N GLN A 74 -7.938 22.955 21.808 1.00 0.00 N ATOM 1155 CA GLN A 74 -8.777 22.476 22.912 1.00 0.00 C ATOM 1156 C GLN A 74 -8.134 22.741 24.297 1.00 0.00 C ATOM 1157 O GLN A 74 -6.904 22.800 24.403 1.00 0.00 O ATOM 1158 CB GLN A 74 -9.135 20.993 22.685 1.00 0.00 C ATOM 1159 CG GLN A 74 -10.397 20.768 21.823 1.00 0.00 C ATOM 1160 CD GLN A 74 -10.480 21.596 20.536 1.00 0.00 C ATOM 1161 OE1 GLN A 74 -11.376 22.403 20.337 1.00 0.00 O ATOM 1162 NE2 GLN A 74 -9.561 21.446 19.612 1.00 0.00 N ATOM 0 H GLN A 74 -7.418 22.212 21.342 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.706 23.047 22.919 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -8.290 20.496 22.208 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.281 20.514 23.653 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -10.450 19.712 21.558 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -11.274 20.988 22.432 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.802 20.780 19.751 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -9.606 21.996 18.754 1.00 0.00 H new ATOM 1171 N PRO A 75 -8.944 22.909 25.363 1.00 0.00 N ATOM 1172 CA PRO A 75 -8.453 23.268 26.695 1.00 0.00 C ATOM 1173 C PRO A 75 -7.482 22.238 27.294 1.00 0.00 C ATOM 1174 O PRO A 75 -7.639 21.030 27.089 1.00 0.00 O ATOM 1175 CB PRO A 75 -9.702 23.438 27.565 1.00 0.00 C ATOM 1176 CG PRO A 75 -10.803 22.678 26.833 1.00 0.00 C ATOM 1177 CD PRO A 75 -10.398 22.808 25.370 1.00 0.00 C ATOM 0 HA PRO A 75 -7.863 24.183 26.640 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.543 23.035 28.565 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -9.960 24.490 27.682 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.851 21.635 27.147 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -11.785 23.112 27.020 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.732 21.945 24.795 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.852 23.689 24.916 1.00 0.00 H new ATOM 1185 N PHE A 76 -6.492 22.719 28.057 1.00 0.00 N ATOM 1186 CA PHE A 76 -5.508 21.871 28.747 1.00 0.00 C ATOM 1187 C PHE A 76 -4.900 22.529 29.999 1.00 0.00 C ATOM 1188 O PHE A 76 -5.025 23.732 30.237 1.00 0.00 O ATOM 1189 CB PHE A 76 -4.404 21.404 27.777 1.00 0.00 C ATOM 1190 CG PHE A 76 -3.375 22.441 27.358 1.00 0.00 C ATOM 1191 CD1 PHE A 76 -3.676 23.379 26.352 1.00 0.00 C ATOM 1192 CD2 PHE A 76 -2.091 22.436 27.940 1.00 0.00 C ATOM 1193 CE1 PHE A 76 -2.701 24.307 25.939 1.00 0.00 C ATOM 1194 CE2 PHE A 76 -1.115 23.356 27.515 1.00 0.00 C ATOM 1195 CZ PHE A 76 -1.423 24.293 26.515 1.00 0.00 C ATOM 0 H PHE A 76 -6.349 23.717 28.215 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.058 20.999 29.101 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.876 20.570 28.239 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.883 21.019 26.877 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.655 23.387 25.897 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.855 21.723 28.716 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -2.939 25.033 25.175 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.130 23.342 27.957 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.676 25.002 26.190 1.00 0.00 H new ATOM 1205 N ASP A 77 -4.218 21.715 30.804 1.00 0.00 N ATOM 1206 CA ASP A 77 -3.576 22.082 32.070 1.00 0.00 C ATOM 1207 C ASP A 77 -2.220 22.796 31.866 1.00 0.00 C ATOM 1208 O ASP A 77 -1.164 22.320 32.292 1.00 0.00 O ATOM 1209 CB ASP A 77 -3.510 20.843 32.986 1.00 0.00 C ATOM 1210 CG ASP A 77 -2.673 19.672 32.429 1.00 0.00 C ATOM 1211 OD1 ASP A 77 -2.941 19.207 31.293 1.00 0.00 O ATOM 1212 OD2 ASP A 77 -1.790 19.159 33.161 1.00 0.00 O ATOM 0 H ASP A 77 -4.091 20.728 30.580 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.185 22.830 32.577 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -3.096 21.142 33.949 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -4.525 20.491 33.171 1.00 0.00 H new ATOM 1217 N TYR A 78 -2.256 23.957 31.203 1.00 0.00 N ATOM 1218 CA TYR A 78 -1.084 24.794 30.931 1.00 0.00 C ATOM 1219 C TYR A 78 -0.395 25.288 32.221 1.00 0.00 C ATOM 1220 O TYR A 78 -1.057 25.635 33.209 1.00 0.00 O ATOM 1221 CB TYR A 78 -1.492 25.991 30.060 1.00 0.00 C ATOM 1222 CG TYR A 78 -0.343 26.940 29.768 1.00 0.00 C ATOM 1223 CD1 TYR A 78 0.675 26.552 28.874 1.00 0.00 C ATOM 1224 CD2 TYR A 78 -0.244 28.169 30.453 1.00 0.00 C ATOM 1225 CE1 TYR A 78 1.788 27.387 28.664 1.00 0.00 C ATOM 1226 CE2 TYR A 78 0.864 29.010 30.241 1.00 0.00 C ATOM 1227 CZ TYR A 78 1.881 28.624 29.338 1.00 0.00 C ATOM 1228 OH TYR A 78 2.952 29.434 29.116 1.00 0.00 O ATOM 0 H TYR A 78 -3.122 24.349 30.832 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.360 24.176 30.400 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.899 25.624 29.118 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.290 26.540 30.560 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.601 25.611 28.349 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -1.021 28.465 31.142 1.00 0.00 H new ATOM 0 HE1 TYR A 78 2.572 27.081 27.987 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.937 29.950 30.768 1.00 0.00 H new ATOM 0 HH TYR A 78 2.831 29.912 28.269 1.00 0.00 H new ATOM 1238 N ASP A 79 0.940 25.354 32.196 1.00 0.00 N ATOM 1239 CA ASP A 79 1.782 25.936 33.248 1.00 0.00 C ATOM 1240 C ASP A 79 2.725 27.011 32.664 1.00 0.00 C ATOM 1241 O ASP A 79 3.393 26.729 31.664 1.00 0.00 O ATOM 1242 CB ASP A 79 2.594 24.823 33.927 1.00 0.00 C ATOM 1243 CG ASP A 79 3.147 25.278 35.281 1.00 0.00 C ATOM 1244 OD1 ASP A 79 4.079 26.112 35.288 1.00 0.00 O ATOM 1245 OD2 ASP A 79 2.642 24.816 36.334 1.00 0.00 O ATOM 0 H ASP A 79 1.485 24.990 31.414 1.00 0.00 H new ATOM 0 HA ASP A 79 1.142 26.417 33.987 1.00 0.00 H new ATOM 0 HB2 ASP A 79 1.964 23.945 34.067 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.417 24.524 33.278 1.00 0.00 H new ATOM 1250 N PRO A 80 2.855 28.214 33.265 1.00 0.00 N ATOM 1251 CA PRO A 80 3.732 29.273 32.756 1.00 0.00 C ATOM 1252 C PRO A 80 5.228 28.920 32.842 1.00 0.00 C ATOM 1253 O PRO A 80 6.052 29.575 32.195 1.00 0.00 O ATOM 1254 CB PRO A 80 3.386 30.516 33.583 1.00 0.00 C ATOM 1255 CG PRO A 80 2.906 29.935 34.911 1.00 0.00 C ATOM 1256 CD PRO A 80 2.193 28.656 34.479 1.00 0.00 C ATOM 0 HA PRO A 80 3.565 29.432 31.691 1.00 0.00 H new ATOM 0 HB2 PRO A 80 4.253 31.163 33.717 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.612 31.115 33.103 1.00 0.00 H new ATOM 0 HG2 PRO A 80 3.736 29.728 35.586 1.00 0.00 H new ATOM 0 HG3 PRO A 80 2.234 30.617 35.432 1.00 0.00 H new ATOM 0 HD2 PRO A 80 2.255 27.894 35.256 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.134 28.842 34.299 1.00 0.00 H new ATOM 1264 N ASN A 81 5.587 27.887 33.611 1.00 0.00 N ATOM 1265 CA ASN A 81 6.949 27.338 33.683 1.00 0.00 C ATOM 1266 C ASN A 81 7.202 26.221 32.648 1.00 0.00 C ATOM 1267 O ASN A 81 8.362 25.934 32.332 1.00 0.00 O ATOM 1268 CB ASN A 81 7.245 26.825 35.107 1.00 0.00 C ATOM 1269 CG ASN A 81 6.949 27.836 36.204 1.00 0.00 C ATOM 1270 OD1 ASN A 81 7.792 28.631 36.600 1.00 0.00 O ATOM 1271 ND2 ASN A 81 5.744 27.829 36.726 1.00 0.00 N ATOM 0 H ASN A 81 4.926 27.397 34.214 1.00 0.00 H new ATOM 0 HA ASN A 81 7.630 28.153 33.440 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.656 25.926 35.288 1.00 0.00 H new ATOM 0 HB3 ASN A 81 8.294 26.536 35.167 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.505 28.489 37.466 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.047 27.164 36.391 1.00 0.00 H new ATOM 1278 N GLU A 82 6.150 25.579 32.124 1.00 0.00 N ATOM 1279 CA GLU A 82 6.237 24.485 31.147 1.00 0.00 C ATOM 1280 C GLU A 82 6.421 24.987 29.695 1.00 0.00 C ATOM 1281 O GLU A 82 5.965 26.073 29.322 1.00 0.00 O ATOM 1282 CB GLU A 82 5.011 23.571 31.321 1.00 0.00 C ATOM 1283 CG GLU A 82 5.055 22.303 30.472 1.00 0.00 C ATOM 1284 CD GLU A 82 3.927 21.331 30.863 1.00 0.00 C ATOM 1285 OE1 GLU A 82 4.142 20.480 31.761 1.00 0.00 O ATOM 1286 OE2 GLU A 82 2.824 21.401 30.267 1.00 0.00 O ATOM 0 H GLU A 82 5.189 25.812 32.374 1.00 0.00 H new ATOM 0 HA GLU A 82 7.138 23.904 31.343 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.926 23.290 32.371 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.112 24.134 31.068 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.964 22.565 29.418 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.020 21.813 30.596 1.00 0.00 H new ATOM 1293 N LYS A 83 7.127 24.194 28.872 1.00 0.00 N ATOM 1294 CA LYS A 83 7.531 24.540 27.494 1.00 0.00 C ATOM 1295 C LYS A 83 6.554 23.964 26.455 1.00 0.00 C ATOM 1296 O LYS A 83 5.790 23.038 26.748 1.00 0.00 O ATOM 1297 CB LYS A 83 8.987 24.083 27.239 1.00 0.00 C ATOM 1298 CG LYS A 83 10.077 24.950 27.905 1.00 0.00 C ATOM 1299 CD LYS A 83 10.056 24.939 29.442 1.00 0.00 C ATOM 1300 CE LYS A 83 11.251 25.688 30.039 1.00 0.00 C ATOM 1301 NZ LYS A 83 11.196 25.672 31.527 1.00 0.00 N ATOM 0 H LYS A 83 7.443 23.266 29.153 1.00 0.00 H new ATOM 0 HA LYS A 83 7.492 25.624 27.383 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.096 23.058 27.592 1.00 0.00 H new ATOM 0 HB3 LYS A 83 9.163 24.070 26.163 1.00 0.00 H new ATOM 0 HG2 LYS A 83 11.054 24.605 27.566 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.965 25.978 27.561 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.130 25.394 29.795 1.00 0.00 H new ATOM 0 HD3 LYS A 83 10.060 23.908 29.797 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.180 25.229 29.700 1.00 0.00 H new ATOM 0 HE3 LYS A 83 11.256 26.718 29.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.761 26.460 31.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 10.209 25.774 31.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.579 24.772 31.879 1.00 0.00 H new ATOM 1315 N SER A 84 6.577 24.507 25.234 1.00 0.00 N ATOM 1316 CA SER A 84 5.692 24.068 24.140 1.00 0.00 C ATOM 1317 C SER A 84 5.980 22.629 23.671 1.00 0.00 C ATOM 1318 O SER A 84 7.094 22.115 23.815 1.00 0.00 O ATOM 1319 CB SER A 84 5.742 25.048 22.964 1.00 0.00 C ATOM 1320 OG SER A 84 4.756 24.679 22.020 1.00 0.00 O ATOM 0 H SER A 84 7.208 25.264 24.972 1.00 0.00 H new ATOM 0 HA SER A 84 4.681 24.064 24.547 1.00 0.00 H new ATOM 0 HB2 SER A 84 5.568 26.066 23.313 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.730 25.034 22.503 1.00 0.00 H new ATOM 0 HG SER A 84 4.279 25.479 21.715 1.00 0.00 H new ATOM 1326 N LYS A 85 4.946 21.985 23.107 1.00 0.00 N ATOM 1327 CA LYS A 85 4.915 20.564 22.715 1.00 0.00 C ATOM 1328 C LYS A 85 4.274 20.280 21.343 1.00 0.00 C ATOM 1329 O LYS A 85 4.207 19.120 20.936 1.00 0.00 O ATOM 1330 CB LYS A 85 4.248 19.743 23.843 1.00 0.00 C ATOM 1331 CG LYS A 85 2.753 20.030 24.098 1.00 0.00 C ATOM 1332 CD LYS A 85 2.475 21.143 25.127 1.00 0.00 C ATOM 1333 CE LYS A 85 0.977 21.264 25.466 1.00 0.00 C ATOM 1334 NZ LYS A 85 0.188 21.986 24.423 1.00 0.00 N ATOM 0 H LYS A 85 4.068 22.461 22.902 1.00 0.00 H new ATOM 0 HA LYS A 85 5.951 20.252 22.584 1.00 0.00 H new ATOM 0 HB2 LYS A 85 4.359 18.684 23.609 1.00 0.00 H new ATOM 0 HB3 LYS A 85 4.795 19.924 24.768 1.00 0.00 H new ATOM 0 HG2 LYS A 85 2.284 20.303 23.153 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.274 19.112 24.438 1.00 0.00 H new ATOM 0 HD2 LYS A 85 3.037 20.940 26.039 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.835 22.095 24.736 1.00 0.00 H new ATOM 0 HE2 LYS A 85 0.561 20.265 25.599 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.869 21.784 26.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -0.796 22.092 24.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 0.603 22.926 24.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 0.207 21.443 23.536 1.00 0.00 H new ATOM 1348 N HIS A 86 3.798 21.311 20.632 1.00 0.00 N ATOM 1349 CA HIS A 86 2.975 21.183 19.415 1.00 0.00 C ATOM 1350 C HIS A 86 3.424 22.122 18.282 1.00 0.00 C ATOM 1351 O HIS A 86 3.995 23.185 18.536 1.00 0.00 O ATOM 1352 CB HIS A 86 1.494 21.414 19.776 1.00 0.00 C ATOM 1353 CG HIS A 86 0.868 20.358 20.661 1.00 0.00 C ATOM 1354 ND1 HIS A 86 -0.005 20.605 21.728 1.00 0.00 N ATOM 1355 CD2 HIS A 86 1.002 19.007 20.512 1.00 0.00 C ATOM 1356 CE1 HIS A 86 -0.391 19.396 22.175 1.00 0.00 C ATOM 1357 NE2 HIS A 86 0.212 18.422 21.474 1.00 0.00 N ATOM 0 H HIS A 86 3.977 22.281 20.891 1.00 0.00 H new ATOM 0 HA HIS A 86 3.107 20.172 19.030 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.406 22.380 20.274 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.918 21.477 18.853 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.611 18.497 19.780 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -1.088 19.232 22.984 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.103 17.420 21.629 1.00 0.00 H new ATOM 1365 N LYS A 87 3.155 21.725 17.029 1.00 0.00 N ATOM 1366 CA LYS A 87 3.498 22.465 15.795 1.00 0.00 C ATOM 1367 C LYS A 87 2.408 22.335 14.715 1.00 0.00 C ATOM 1368 O LYS A 87 1.616 21.394 14.717 1.00 0.00 O ATOM 1369 CB LYS A 87 4.861 21.998 15.228 1.00 0.00 C ATOM 1370 CG LYS A 87 6.039 22.045 16.220 1.00 0.00 C ATOM 1371 CD LYS A 87 7.400 21.848 15.523 1.00 0.00 C ATOM 1372 CE LYS A 87 8.524 21.739 16.567 1.00 0.00 C ATOM 1373 NZ LYS A 87 9.860 21.520 15.939 1.00 0.00 N ATOM 0 H LYS A 87 2.674 20.847 16.835 1.00 0.00 H new ATOM 0 HA LYS A 87 3.569 23.517 16.072 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.754 20.976 14.865 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.109 22.618 14.366 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.035 23.003 16.740 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.905 21.271 16.976 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.375 20.947 14.910 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.597 22.684 14.852 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.551 22.650 17.165 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.306 20.917 17.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.586 21.453 16.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.845 20.637 15.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.082 22.317 15.309 1.00 0.00 H new ATOM 1387 N PHE A 88 2.448 23.245 13.745 1.00 0.00 N ATOM 1388 CA PHE A 88 1.664 23.261 12.506 1.00 0.00 C ATOM 1389 C PHE A 88 2.563 23.258 11.264 1.00 0.00 C ATOM 1390 O PHE A 88 3.708 23.713 11.304 1.00 0.00 O ATOM 1391 CB PHE A 88 0.736 24.487 12.488 1.00 0.00 C ATOM 1392 CG PHE A 88 -0.591 24.210 13.152 1.00 0.00 C ATOM 1393 CD1 PHE A 88 -0.717 24.326 14.545 1.00 0.00 C ATOM 1394 CD2 PHE A 88 -1.682 23.776 12.379 1.00 0.00 C ATOM 1395 CE1 PHE A 88 -1.927 23.982 15.169 1.00 0.00 C ATOM 1396 CE2 PHE A 88 -2.896 23.445 13.001 1.00 0.00 C ATOM 1397 CZ PHE A 88 -3.013 23.534 14.398 1.00 0.00 C ATOM 0 H PHE A 88 3.073 24.049 13.805 1.00 0.00 H new ATOM 0 HA PHE A 88 1.064 22.351 12.479 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.226 25.319 12.994 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.566 24.797 11.457 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.115 24.679 15.136 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.586 23.697 11.306 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.023 24.062 16.242 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -3.738 23.123 12.407 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.939 23.258 14.880 1.00 0.00 H new ATOM 1407 N MET A 89 2.016 22.789 10.142 1.00 0.00 N ATOM 1408 CA MET A 89 2.638 22.902 8.819 1.00 0.00 C ATOM 1409 C MET A 89 1.593 23.293 7.764 1.00 0.00 C ATOM 1410 O MET A 89 0.454 22.835 7.827 1.00 0.00 O ATOM 1411 CB MET A 89 3.344 21.582 8.463 1.00 0.00 C ATOM 1412 CG MET A 89 4.274 21.669 7.244 1.00 0.00 C ATOM 1413 SD MET A 89 4.764 20.065 6.547 1.00 0.00 S ATOM 1414 CE MET A 89 5.669 19.356 7.950 1.00 0.00 C ATOM 0 H MET A 89 1.114 22.312 10.125 1.00 0.00 H new ATOM 0 HA MET A 89 3.388 23.692 8.838 1.00 0.00 H new ATOM 0 HB2 MET A 89 3.924 21.250 9.324 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.588 20.819 8.275 1.00 0.00 H new ATOM 0 HG2 MET A 89 3.779 22.251 6.467 1.00 0.00 H new ATOM 0 HG3 MET A 89 5.173 22.216 7.528 1.00 0.00 H new ATOM 0 HE1 MET A 89 6.615 18.941 7.601 1.00 0.00 H new ATOM 0 HE2 MET A 89 5.864 20.134 8.688 1.00 0.00 H new ATOM 0 HE3 MET A 89 5.072 18.566 8.406 1.00 0.00 H new ATOM 1424 N VAL A 90 1.986 24.096 6.774 1.00 0.00 N ATOM 1425 CA VAL A 90 1.185 24.398 5.574 1.00 0.00 C ATOM 1426 C VAL A 90 1.966 23.950 4.337 1.00 0.00 C ATOM 1427 O VAL A 90 3.071 24.434 4.103 1.00 0.00 O ATOM 1428 CB VAL A 90 0.797 25.891 5.503 1.00 0.00 C ATOM 1429 CG1 VAL A 90 -0.110 26.171 4.294 1.00 0.00 C ATOM 1430 CG2 VAL A 90 0.039 26.340 6.761 1.00 0.00 C ATOM 0 H VAL A 90 2.890 24.568 6.779 1.00 0.00 H new ATOM 0 HA VAL A 90 0.245 23.848 5.621 1.00 0.00 H new ATOM 0 HB VAL A 90 1.732 26.444 5.415 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.367 27.230 4.270 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.414 25.904 3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.021 25.578 4.378 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.217 27.396 6.674 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.873 25.753 6.865 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.669 26.190 7.638 1.00 0.00 H new ATOM 1440 N GLN A 91 1.407 23.024 3.559 1.00 0.00 N ATOM 1441 CA GLN A 91 1.966 22.476 2.319 1.00 0.00 C ATOM 1442 C GLN A 91 1.252 23.104 1.115 1.00 0.00 C ATOM 1443 O GLN A 91 0.028 23.228 1.131 1.00 0.00 O ATOM 1444 CB GLN A 91 1.784 20.950 2.358 1.00 0.00 C ATOM 1445 CG GLN A 91 2.494 20.204 1.219 1.00 0.00 C ATOM 1446 CD GLN A 91 2.031 18.751 1.159 1.00 0.00 C ATOM 1447 OE1 GLN A 91 2.420 17.906 1.955 1.00 0.00 O ATOM 1448 NE2 GLN A 91 1.131 18.417 0.259 1.00 0.00 N ATOM 0 H GLN A 91 0.502 22.612 3.788 1.00 0.00 H new ATOM 0 HA GLN A 91 3.027 22.706 2.224 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.157 20.575 3.311 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.719 20.721 2.319 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.287 20.697 0.269 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.573 20.242 1.369 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.798 19.110 -0.411 1.00 0.00 H new ATOM 0 HE22 GLN A 91 0.767 17.465 0.231 1.00 0.00 H new ATOM 1457 N THR A 92 1.977 23.487 0.064 1.00 0.00 N ATOM 1458 CA THR A 92 1.431 24.240 -1.084 1.00 0.00 C ATOM 1459 C THR A 92 2.022 23.824 -2.429 1.00 0.00 C ATOM 1460 O THR A 92 3.198 23.470 -2.511 1.00 0.00 O ATOM 1461 CB THR A 92 1.589 25.759 -0.903 1.00 0.00 C ATOM 1462 OG1 THR A 92 2.844 26.112 -0.361 1.00 0.00 O ATOM 1463 CG2 THR A 92 0.505 26.305 0.021 1.00 0.00 C ATOM 0 H THR A 92 2.973 23.285 -0.023 1.00 0.00 H new ATOM 0 HA THR A 92 0.371 23.986 -1.101 1.00 0.00 H new ATOM 0 HB THR A 92 1.503 26.193 -1.899 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.897 27.086 -0.267 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.634 27.381 0.137 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.476 26.101 -0.408 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.582 25.824 0.996 1.00 0.00 H new ATOM 1471 N ILE A 93 1.212 23.896 -3.493 1.00 0.00 N ATOM 1472 CA ILE A 93 1.637 23.597 -4.876 1.00 0.00 C ATOM 1473 C ILE A 93 0.840 24.414 -5.904 1.00 0.00 C ATOM 1474 O ILE A 93 -0.343 24.686 -5.700 1.00 0.00 O ATOM 1475 CB ILE A 93 1.543 22.074 -5.111 1.00 0.00 C ATOM 1476 CG1 ILE A 93 2.530 21.559 -6.183 1.00 0.00 C ATOM 1477 CG2 ILE A 93 0.101 21.574 -5.303 1.00 0.00 C ATOM 1478 CD1 ILE A 93 2.015 21.462 -7.619 1.00 0.00 C ATOM 0 H ILE A 93 0.231 24.166 -3.422 1.00 0.00 H new ATOM 0 HA ILE A 93 2.675 23.899 -5.013 1.00 0.00 H new ATOM 0 HB ILE A 93 1.876 21.615 -4.180 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.402 22.213 -6.181 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.872 20.570 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.108 20.496 -5.463 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.486 21.805 -4.414 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.343 22.067 -6.168 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.809 21.087 -8.266 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.165 20.780 -7.655 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.704 22.449 -7.961 1.00 0.00 H new ATOM 1490 N PHE A 94 1.474 24.838 -7.003 1.00 0.00 N ATOM 1491 CA PHE A 94 0.805 25.639 -8.037 1.00 0.00 C ATOM 1492 C PHE A 94 -0.360 24.882 -8.695 1.00 0.00 C ATOM 1493 O PHE A 94 -0.223 23.741 -9.137 1.00 0.00 O ATOM 1494 CB PHE A 94 1.802 26.134 -9.092 1.00 0.00 C ATOM 1495 CG PHE A 94 2.657 27.305 -8.650 1.00 0.00 C ATOM 1496 CD1 PHE A 94 2.047 28.532 -8.320 1.00 0.00 C ATOM 1497 CD2 PHE A 94 4.059 27.191 -8.602 1.00 0.00 C ATOM 1498 CE1 PHE A 94 2.828 29.637 -7.944 1.00 0.00 C ATOM 1499 CE2 PHE A 94 4.844 28.299 -8.234 1.00 0.00 C ATOM 1500 CZ PHE A 94 4.231 29.521 -7.912 1.00 0.00 C ATOM 0 H PHE A 94 2.455 24.639 -7.201 1.00 0.00 H new ATOM 0 HA PHE A 94 0.382 26.509 -7.535 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.456 25.308 -9.371 1.00 0.00 H new ATOM 0 HB3 PHE A 94 1.251 26.421 -9.988 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.971 28.623 -8.357 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.533 26.252 -8.848 1.00 0.00 H new ATOM 0 HE1 PHE A 94 2.355 30.571 -7.681 1.00 0.00 H new ATOM 0 HE2 PHE A 94 5.920 28.210 -8.199 1.00 0.00 H new ATOM 0 HZ PHE A 94 4.836 30.373 -7.640 1.00 0.00 H new ATOM 1510 N ALA A 95 -1.512 25.548 -8.769 1.00 0.00 N ATOM 1511 CA ALA A 95 -2.770 24.993 -9.267 1.00 0.00 C ATOM 1512 C ALA A 95 -3.001 25.316 -10.763 1.00 0.00 C ATOM 1513 O ALA A 95 -2.558 26.374 -11.230 1.00 0.00 O ATOM 1514 CB ALA A 95 -3.896 25.536 -8.382 1.00 0.00 C ATOM 0 H ALA A 95 -1.598 26.521 -8.474 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.742 23.905 -9.211 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.852 25.141 -8.726 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.727 25.230 -7.350 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.911 26.624 -8.440 1.00 0.00 H new ATOM 1520 N PRO A 96 -3.709 24.455 -11.523 1.00 0.00 N ATOM 1521 CA PRO A 96 -4.099 24.755 -12.902 1.00 0.00 C ATOM 1522 C PRO A 96 -5.104 25.931 -12.983 1.00 0.00 C ATOM 1523 O PRO A 96 -5.819 26.209 -12.015 1.00 0.00 O ATOM 1524 CB PRO A 96 -4.654 23.437 -13.462 1.00 0.00 C ATOM 1525 CG PRO A 96 -5.162 22.694 -12.227 1.00 0.00 C ATOM 1526 CD PRO A 96 -4.206 23.143 -11.122 1.00 0.00 C ATOM 0 HA PRO A 96 -3.254 25.100 -13.498 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.456 23.614 -14.179 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.883 22.868 -13.981 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -6.194 22.958 -11.996 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -5.133 21.614 -12.368 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.719 23.198 -10.162 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -3.386 22.435 -11.005 1.00 0.00 H new ATOM 1599 N MET A 102 -9.423 19.885 -6.614 1.00 0.00 N ATOM 1600 CA MET A 102 -8.190 20.221 -5.881 1.00 0.00 C ATOM 1601 C MET A 102 -7.449 18.995 -5.344 1.00 0.00 C ATOM 1602 O MET A 102 -6.321 19.129 -4.894 1.00 0.00 O ATOM 1603 CB MET A 102 -8.431 21.258 -4.773 1.00 0.00 C ATOM 1604 CG MET A 102 -9.290 20.783 -3.597 1.00 0.00 C ATOM 1605 SD MET A 102 -9.465 22.048 -2.307 1.00 0.00 S ATOM 1606 CE MET A 102 -10.403 21.107 -1.074 1.00 0.00 C ATOM 0 HA MET A 102 -7.533 20.678 -6.621 1.00 0.00 H new ATOM 0 HB2 MET A 102 -7.465 21.581 -4.386 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.906 22.133 -5.216 1.00 0.00 H new ATOM 0 HG2 MET A 102 -10.278 20.503 -3.963 1.00 0.00 H new ATOM 0 HG3 MET A 102 -8.844 19.887 -3.165 1.00 0.00 H new ATOM 0 HE1 MET A 102 -10.599 21.738 -0.207 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.349 20.781 -1.507 1.00 0.00 H new ATOM 0 HE3 MET A 102 -9.826 20.235 -0.765 1.00 0.00 H new ATOM 1616 N GLU A 103 -8.048 17.802 -5.398 1.00 0.00 N ATOM 1617 CA GLU A 103 -7.371 16.549 -5.032 1.00 0.00 C ATOM 1618 C GLU A 103 -6.351 16.150 -6.112 1.00 0.00 C ATOM 1619 O GLU A 103 -5.277 15.635 -5.808 1.00 0.00 O ATOM 1620 CB GLU A 103 -8.433 15.457 -4.820 1.00 0.00 C ATOM 1621 CG GLU A 103 -7.842 14.138 -4.304 1.00 0.00 C ATOM 1622 CD GLU A 103 -8.953 13.112 -4.020 1.00 0.00 C ATOM 1623 OE1 GLU A 103 -9.337 12.355 -4.946 1.00 0.00 O ATOM 1624 OE2 GLU A 103 -9.446 13.045 -2.867 1.00 0.00 O ATOM 0 H GLU A 103 -9.015 17.675 -5.696 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.815 16.683 -4.104 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -9.179 15.816 -4.111 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.950 15.273 -5.762 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.148 13.733 -5.040 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.270 14.322 -3.394 1.00 0.00 H new ATOM 1631 N ALA A 104 -6.662 16.446 -7.378 1.00 0.00 N ATOM 1632 CA ALA A 104 -5.901 15.992 -8.536 1.00 0.00 C ATOM 1633 C ALA A 104 -4.538 16.685 -8.671 1.00 0.00 C ATOM 1634 O ALA A 104 -3.577 16.047 -9.106 1.00 0.00 O ATOM 1635 CB ALA A 104 -6.762 16.210 -9.781 1.00 0.00 C ATOM 0 H ALA A 104 -7.468 17.020 -7.627 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.671 14.934 -8.410 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.216 15.878 -10.664 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -7.685 15.638 -9.689 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -6.999 17.269 -9.878 1.00 0.00 H new ATOM 1641 N VAL A 105 -4.419 17.951 -8.233 1.00 0.00 N ATOM 1642 CA VAL A 105 -3.137 18.682 -8.296 1.00 0.00 C ATOM 1643 C VAL A 105 -2.051 17.976 -7.474 1.00 0.00 C ATOM 1644 O VAL A 105 -0.901 17.901 -7.889 1.00 0.00 O ATOM 1645 CB VAL A 105 -3.284 20.157 -7.886 1.00 0.00 C ATOM 1646 CG1 VAL A 105 -3.361 20.378 -6.374 1.00 0.00 C ATOM 1647 CG2 VAL A 105 -2.104 20.971 -8.414 1.00 0.00 C ATOM 0 H VAL A 105 -5.189 18.488 -7.834 1.00 0.00 H new ATOM 0 HA VAL A 105 -2.821 18.677 -9.339 1.00 0.00 H new ATOM 0 HB VAL A 105 -4.229 20.483 -8.321 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -3.464 21.443 -6.167 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -4.223 19.845 -5.972 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.451 20.003 -5.905 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -2.219 22.014 -8.117 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.176 20.577 -8.000 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -2.074 20.904 -9.502 1.00 0.00 H new ATOM 1657 N TRP A 106 -2.419 17.381 -6.337 1.00 0.00 N ATOM 1658 CA TRP A 106 -1.498 16.649 -5.467 1.00 0.00 C ATOM 1659 C TRP A 106 -1.077 15.297 -6.054 1.00 0.00 C ATOM 1660 O TRP A 106 0.026 14.820 -5.783 1.00 0.00 O ATOM 1661 CB TRP A 106 -2.192 16.454 -4.124 1.00 0.00 C ATOM 1662 CG TRP A 106 -2.638 17.732 -3.479 1.00 0.00 C ATOM 1663 CD1 TRP A 106 -3.915 18.165 -3.394 1.00 0.00 C ATOM 1664 CD2 TRP A 106 -1.827 18.815 -2.932 1.00 0.00 C ATOM 1665 NE1 TRP A 106 -3.955 19.410 -2.800 1.00 0.00 N ATOM 1666 CE2 TRP A 106 -2.694 19.854 -2.482 1.00 0.00 C ATOM 1667 CE3 TRP A 106 -0.441 19.042 -2.815 1.00 0.00 C ATOM 1668 CZ2 TRP A 106 -2.219 21.024 -1.879 1.00 0.00 C ATOM 1669 CZ3 TRP A 106 0.052 20.242 -2.268 1.00 0.00 C ATOM 1670 CH2 TRP A 106 -0.833 21.211 -1.761 1.00 0.00 C ATOM 0 H TRP A 106 -3.378 17.395 -5.991 1.00 0.00 H new ATOM 0 HA TRP A 106 -0.580 17.227 -5.358 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -3.058 15.808 -4.264 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -1.513 15.935 -3.447 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -4.779 17.617 -3.740 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -4.811 19.934 -2.620 1.00 0.00 H new ATOM 0 HE3 TRP A 106 0.253 18.285 -3.150 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -2.907 21.770 -1.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 1.117 20.420 -2.237 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -0.446 22.098 -1.281 1.00 0.00 H new ATOM 1681 N LYS A 107 -1.944 14.690 -6.878 1.00 0.00 N ATOM 1682 CA LYS A 107 -1.676 13.416 -7.566 1.00 0.00 C ATOM 1683 C LYS A 107 -0.785 13.592 -8.801 1.00 0.00 C ATOM 1684 O LYS A 107 0.010 12.706 -9.112 1.00 0.00 O ATOM 1685 CB LYS A 107 -3.010 12.731 -7.916 1.00 0.00 C ATOM 1686 CG LYS A 107 -3.923 12.456 -6.707 1.00 0.00 C ATOM 1687 CD LYS A 107 -3.315 11.509 -5.662 1.00 0.00 C ATOM 1688 CE LYS A 107 -4.245 11.416 -4.445 1.00 0.00 C ATOM 1689 NZ LYS A 107 -3.752 10.423 -3.452 1.00 0.00 N ATOM 0 H LYS A 107 -2.865 15.075 -7.089 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.115 12.774 -6.887 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.549 13.356 -8.628 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.798 11.787 -8.418 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.165 13.403 -6.225 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.861 12.031 -7.064 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -3.168 10.520 -6.096 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.334 11.872 -5.355 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.325 12.395 -3.972 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.247 11.137 -4.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.405 10.387 -2.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.699 9.484 -3.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -2.807 10.703 -3.121 1.00 0.00 H new ATOM 1703 N GLU A 108 -0.868 14.743 -9.473 1.00 0.00 N ATOM 1704 CA GLU A 108 0.008 15.096 -10.604 1.00 0.00 C ATOM 1705 C GLU A 108 1.351 15.718 -10.184 1.00 0.00 C ATOM 1706 O GLU A 108 2.348 15.593 -10.900 1.00 0.00 O ATOM 1707 CB GLU A 108 -0.746 16.013 -11.575 1.00 0.00 C ATOM 1708 CG GLU A 108 -0.999 17.441 -11.108 1.00 0.00 C ATOM 1709 CD GLU A 108 -1.754 18.250 -12.180 1.00 0.00 C ATOM 1710 OE1 GLU A 108 -1.101 18.767 -13.120 1.00 0.00 O ATOM 1711 OE2 GLU A 108 -2.999 18.380 -12.094 1.00 0.00 O ATOM 0 H GLU A 108 -1.551 15.467 -9.248 1.00 0.00 H new ATOM 0 HA GLU A 108 0.269 14.163 -11.103 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.186 16.054 -12.509 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.708 15.553 -11.801 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.577 17.428 -10.184 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.050 17.927 -10.883 1.00 0.00 H new ATOM 1718 N ALA A 109 1.379 16.366 -9.020 1.00 0.00 N ATOM 1719 CA ALA A 109 2.520 17.107 -8.499 1.00 0.00 C ATOM 1720 C ALA A 109 3.712 16.192 -8.236 1.00 0.00 C ATOM 1721 O ALA A 109 3.587 15.127 -7.616 1.00 0.00 O ATOM 1722 CB ALA A 109 2.146 17.842 -7.207 1.00 0.00 C ATOM 0 H ALA A 109 0.575 16.388 -8.392 1.00 0.00 H new ATOM 0 HA ALA A 109 2.804 17.834 -9.260 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.013 18.389 -6.835 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.335 18.542 -7.408 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.824 17.119 -6.457 1.00 0.00 H new ATOM 1728 N LYS A 110 4.887 16.638 -8.673 1.00 0.00 N ATOM 1729 CA LYS A 110 6.158 15.982 -8.388 1.00 0.00 C ATOM 1730 C LYS A 110 6.761 16.480 -7.063 1.00 0.00 C ATOM 1731 O LYS A 110 6.508 17.617 -6.662 1.00 0.00 O ATOM 1732 CB LYS A 110 7.104 16.207 -9.586 1.00 0.00 C ATOM 1733 CG LYS A 110 6.645 15.597 -10.926 1.00 0.00 C ATOM 1734 CD LYS A 110 6.664 14.057 -10.980 1.00 0.00 C ATOM 1735 CE LYS A 110 5.376 13.348 -10.523 1.00 0.00 C ATOM 1736 NZ LYS A 110 4.246 13.542 -11.476 1.00 0.00 N ATOM 0 H LYS A 110 4.983 17.478 -9.244 1.00 0.00 H new ATOM 0 HA LYS A 110 6.002 14.911 -8.259 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.237 17.280 -9.723 1.00 0.00 H new ATOM 0 HB3 LYS A 110 8.081 15.794 -9.336 1.00 0.00 H new ATOM 0 HG2 LYS A 110 5.632 15.941 -11.137 1.00 0.00 H new ATOM 0 HG3 LYS A 110 7.284 15.982 -11.721 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.879 13.752 -12.004 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.489 13.702 -10.362 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.573 12.282 -10.411 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.087 13.724 -9.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.704 12.658 -11.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 3.624 14.299 -11.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.621 13.804 -12.410 1.00 0.00 H new ATOM 1750 N PRO A 111 7.623 15.678 -6.408 1.00 0.00 N ATOM 1751 CA PRO A 111 8.334 16.052 -5.176 1.00 0.00 C ATOM 1752 C PRO A 111 9.214 17.309 -5.319 1.00 0.00 C ATOM 1753 O PRO A 111 9.512 17.969 -4.325 1.00 0.00 O ATOM 1754 CB PRO A 111 9.149 14.811 -4.785 1.00 0.00 C ATOM 1755 CG PRO A 111 9.284 14.025 -6.089 1.00 0.00 C ATOM 1756 CD PRO A 111 7.985 14.329 -6.808 1.00 0.00 C ATOM 0 HA PRO A 111 7.623 16.336 -4.400 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.124 15.085 -4.383 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.641 14.226 -4.018 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.150 14.348 -6.667 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.403 12.957 -5.906 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.110 14.261 -7.889 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.208 13.616 -6.531 1.00 0.00 H new ATOM 1764 N ASP A 112 9.578 17.678 -6.552 1.00 0.00 N ATOM 1765 CA ASP A 112 10.325 18.905 -6.870 1.00 0.00 C ATOM 1766 C ASP A 112 9.445 20.167 -7.004 1.00 0.00 C ATOM 1767 O ASP A 112 9.960 21.286 -6.964 1.00 0.00 O ATOM 1768 CB ASP A 112 11.146 18.683 -8.149 1.00 0.00 C ATOM 1769 CG ASP A 112 12.223 17.601 -7.971 1.00 0.00 C ATOM 1770 OD1 ASP A 112 13.261 17.881 -7.322 1.00 0.00 O ATOM 1771 OD2 ASP A 112 12.048 16.476 -8.499 1.00 0.00 O ATOM 0 H ASP A 112 9.357 17.121 -7.377 1.00 0.00 H new ATOM 0 HA ASP A 112 10.980 19.100 -6.021 1.00 0.00 H new ATOM 0 HB2 ASP A 112 10.478 18.397 -8.962 1.00 0.00 H new ATOM 0 HB3 ASP A 112 11.620 19.620 -8.441 1.00 0.00 H new ATOM 1776 N GLU A 113 8.123 20.011 -7.142 1.00 0.00 N ATOM 1777 CA GLU A 113 7.150 21.113 -7.244 1.00 0.00 C ATOM 1778 C GLU A 113 6.505 21.460 -5.888 1.00 0.00 C ATOM 1779 O GLU A 113 5.944 22.546 -5.727 1.00 0.00 O ATOM 1780 CB GLU A 113 6.040 20.731 -8.239 1.00 0.00 C ATOM 1781 CG GLU A 113 6.553 20.463 -9.659 1.00 0.00 C ATOM 1782 CD GLU A 113 5.392 20.058 -10.585 1.00 0.00 C ATOM 1783 OE1 GLU A 113 4.849 18.938 -10.417 1.00 0.00 O ATOM 1784 OE2 GLU A 113 5.028 20.853 -11.486 1.00 0.00 O ATOM 0 H GLU A 113 7.685 19.091 -7.187 1.00 0.00 H new ATOM 0 HA GLU A 113 7.696 21.991 -7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.526 19.842 -7.874 1.00 0.00 H new ATOM 0 HB3 GLU A 113 5.303 21.533 -8.273 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.043 21.355 -10.049 1.00 0.00 H new ATOM 0 HG3 GLU A 113 7.302 19.671 -9.638 1.00 0.00 H new ATOM 1791 N LEU A 114 6.566 20.539 -4.920 1.00 0.00 N ATOM 1792 CA LEU A 114 5.857 20.627 -3.642 1.00 0.00 C ATOM 1793 C LEU A 114 6.638 21.501 -2.649 1.00 0.00 C ATOM 1794 O LEU A 114 7.828 21.277 -2.409 1.00 0.00 O ATOM 1795 CB LEU A 114 5.604 19.201 -3.100 1.00 0.00 C ATOM 1796 CG LEU A 114 4.533 18.428 -3.899 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.634 16.919 -3.683 1.00 0.00 C ATOM 1798 CD2 LEU A 114 3.134 18.844 -3.461 1.00 0.00 C ATOM 0 H LEU A 114 7.125 19.690 -5.008 1.00 0.00 H new ATOM 0 HA LEU A 114 4.890 21.109 -3.787 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.539 18.640 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.294 19.265 -2.057 1.00 0.00 H new ATOM 0 HG LEU A 114 4.708 18.665 -4.948 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.861 16.416 -4.264 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.615 16.570 -4.005 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.498 16.693 -2.625 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.393 18.288 -4.035 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.006 18.630 -2.400 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.001 19.912 -3.634 1.00 0.00 H new ATOM 1810 N MET A 115 5.956 22.488 -2.058 1.00 0.00 N ATOM 1811 CA MET A 115 6.512 23.427 -1.075 1.00 0.00 C ATOM 1812 C MET A 115 5.859 23.222 0.299 1.00 0.00 C ATOM 1813 O MET A 115 4.716 22.771 0.381 1.00 0.00 O ATOM 1814 CB MET A 115 6.278 24.876 -1.533 1.00 0.00 C ATOM 1815 CG MET A 115 6.839 25.215 -2.915 1.00 0.00 C ATOM 1816 SD MET A 115 6.311 26.849 -3.499 1.00 0.00 S ATOM 1817 CE MET A 115 7.001 26.815 -5.175 1.00 0.00 C ATOM 0 H MET A 115 4.971 22.662 -2.256 1.00 0.00 H new ATOM 0 HA MET A 115 7.582 23.237 -0.994 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.206 25.072 -1.534 1.00 0.00 H new ATOM 0 HB3 MET A 115 6.724 25.549 -0.801 1.00 0.00 H new ATOM 0 HG2 MET A 115 7.928 25.180 -2.880 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.519 24.457 -3.629 1.00 0.00 H new ATOM 0 HE1 MET A 115 6.769 27.751 -5.683 1.00 0.00 H new ATOM 0 HE2 MET A 115 8.083 26.690 -5.121 1.00 0.00 H new ATOM 0 HE3 MET A 115 6.567 25.983 -5.730 1.00 0.00 H new ATOM 1827 N ASP A 116 6.537 23.613 1.380 1.00 0.00 N ATOM 1828 CA ASP A 116 5.942 23.647 2.724 1.00 0.00 C ATOM 1829 C ASP A 116 6.527 24.726 3.651 1.00 0.00 C ATOM 1830 O ASP A 116 7.572 25.328 3.381 1.00 0.00 O ATOM 1831 CB ASP A 116 5.980 22.257 3.383 1.00 0.00 C ATOM 1832 CG ASP A 116 7.412 21.766 3.659 1.00 0.00 C ATOM 1833 OD1 ASP A 116 8.006 22.176 4.686 1.00 0.00 O ATOM 1834 OD2 ASP A 116 7.937 20.948 2.865 1.00 0.00 O ATOM 0 H ASP A 116 7.511 23.915 1.352 1.00 0.00 H new ATOM 0 HA ASP A 116 4.902 23.936 2.574 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.425 22.289 4.321 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.473 21.540 2.737 1.00 0.00 H new ATOM 1839 N SER A 117 5.799 24.977 4.743 1.00 0.00 N ATOM 1840 CA SER A 117 6.057 25.990 5.775 1.00 0.00 C ATOM 1841 C SER A 117 5.782 25.366 7.143 1.00 0.00 C ATOM 1842 O SER A 117 4.716 24.774 7.297 1.00 0.00 O ATOM 1843 CB SER A 117 5.110 27.195 5.593 1.00 0.00 C ATOM 1844 OG SER A 117 4.832 27.450 4.226 1.00 0.00 O ATOM 0 H SER A 117 4.955 24.441 4.945 1.00 0.00 H new ATOM 0 HA SER A 117 7.090 26.328 5.696 1.00 0.00 H new ATOM 0 HB2 SER A 117 4.177 27.006 6.124 1.00 0.00 H new ATOM 0 HB3 SER A 117 5.559 28.080 6.043 1.00 0.00 H new ATOM 0 HG SER A 117 4.228 28.219 4.153 1.00 0.00 H new ATOM 1850 N LYS A 118 6.670 25.503 8.136 1.00 0.00 N ATOM 1851 CA LYS A 118 6.477 24.945 9.498 1.00 0.00 C ATOM 1852 C LYS A 118 6.522 26.016 10.595 1.00 0.00 C ATOM 1853 O LYS A 118 7.309 26.960 10.516 1.00 0.00 O ATOM 1854 CB LYS A 118 7.409 23.741 9.753 1.00 0.00 C ATOM 1855 CG LYS A 118 8.849 24.039 10.215 1.00 0.00 C ATOM 1856 CD LYS A 118 9.664 24.915 9.248 1.00 0.00 C ATOM 1857 CE LYS A 118 11.160 24.952 9.601 1.00 0.00 C ATOM 1858 NZ LYS A 118 11.440 25.678 10.874 1.00 0.00 N ATOM 0 H LYS A 118 7.551 26.006 8.025 1.00 0.00 H new ATOM 0 HA LYS A 118 5.461 24.553 9.547 1.00 0.00 H new ATOM 0 HB2 LYS A 118 6.940 23.106 10.504 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.465 23.159 8.833 1.00 0.00 H new ATOM 0 HG2 LYS A 118 8.810 24.532 11.186 1.00 0.00 H new ATOM 0 HG3 LYS A 118 9.373 23.094 10.358 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.543 24.538 8.233 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.266 25.930 9.260 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.534 23.931 9.681 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.708 25.429 8.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 12.463 25.670 11.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.110 26.661 10.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 10.942 25.209 11.658 1.00 0.00 H new ATOM 1872 N LEU A 119 5.650 25.882 11.593 1.00 0.00 N ATOM 1873 CA LEU A 119 5.397 26.876 12.642 1.00 0.00 C ATOM 1874 C LEU A 119 5.135 26.175 13.982 1.00 0.00 C ATOM 1875 O LEU A 119 4.478 25.138 14.007 1.00 0.00 O ATOM 1876 CB LEU A 119 4.174 27.741 12.249 1.00 0.00 C ATOM 1877 CG LEU A 119 4.376 28.670 11.028 1.00 0.00 C ATOM 1878 CD1 LEU A 119 3.904 28.039 9.712 1.00 0.00 C ATOM 1879 CD2 LEU A 119 3.571 29.961 11.176 1.00 0.00 C ATOM 0 H LEU A 119 5.076 25.046 11.700 1.00 0.00 H new ATOM 0 HA LEU A 119 6.273 27.516 12.748 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.334 27.078 12.043 1.00 0.00 H new ATOM 0 HB3 LEU A 119 3.894 28.353 13.106 1.00 0.00 H new ATOM 0 HG LEU A 119 5.450 28.856 10.997 1.00 0.00 H new ATOM 0 HD11 LEU A 119 4.071 28.738 8.893 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.464 27.122 9.527 1.00 0.00 H new ATOM 0 HD13 LEU A 119 2.841 27.808 9.780 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.733 30.593 10.303 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.511 29.721 11.258 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.894 30.490 12.072 1.00 0.00 H new ATOM 1891 N ARG A 120 5.603 26.720 15.108 1.00 0.00 N ATOM 1892 CA ARG A 120 5.354 26.148 16.449 1.00 0.00 C ATOM 1893 C ARG A 120 4.080 26.734 17.060 1.00 0.00 C ATOM 1894 O ARG A 120 3.630 27.800 16.643 1.00 0.00 O ATOM 1895 CB ARG A 120 6.558 26.398 17.376 1.00 0.00 C ATOM 1896 CG ARG A 120 7.917 26.003 16.762 1.00 0.00 C ATOM 1897 CD ARG A 120 9.086 26.559 17.582 1.00 0.00 C ATOM 1898 NE ARG A 120 9.153 28.029 17.453 1.00 0.00 N ATOM 1899 CZ ARG A 120 10.041 28.843 17.985 1.00 0.00 C ATOM 1900 NH1 ARG A 120 11.032 28.412 18.716 1.00 0.00 N ATOM 1901 NH2 ARG A 120 9.938 30.122 17.784 1.00 0.00 N ATOM 0 H ARG A 120 6.166 27.570 15.124 1.00 0.00 H new ATOM 0 HA ARG A 120 5.219 25.072 16.340 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.585 27.455 17.642 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.413 25.840 18.301 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.992 24.917 16.710 1.00 0.00 H new ATOM 0 HG3 ARG A 120 7.978 26.376 15.740 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.966 26.285 18.630 1.00 0.00 H new ATOM 0 HD3 ARG A 120 10.021 26.115 17.241 1.00 0.00 H new ATOM 0 HE ARG A 120 8.426 28.465 16.885 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.139 27.413 18.892 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.700 29.074 19.111 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.173 30.489 17.218 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.622 30.759 18.193 1.00 0.00 H new ATOM 1915 N CYS A 121 3.512 26.074 18.064 1.00 0.00 N ATOM 1916 CA CYS A 121 2.433 26.618 18.878 1.00 0.00 C ATOM 1917 C CYS A 121 3.030 27.376 20.074 1.00 0.00 C ATOM 1918 O CYS A 121 3.874 26.841 20.798 1.00 0.00 O ATOM 1919 CB CYS A 121 1.512 25.473 19.318 1.00 0.00 C ATOM 1920 SG CYS A 121 0.862 24.614 17.853 1.00 0.00 S ATOM 0 H CYS A 121 3.793 25.133 18.338 1.00 0.00 H new ATOM 0 HA CYS A 121 1.835 27.327 18.305 1.00 0.00 H new ATOM 0 HB2 CYS A 121 2.061 24.773 19.948 1.00 0.00 H new ATOM 0 HB3 CYS A 121 0.690 25.864 19.917 1.00 0.00 H new ATOM 0 HG CYS A 121 0.395 25.486 17.010 1.00 0.00 H new ATOM 1926 N VAL A 122 2.588 28.611 20.291 1.00 0.00 N ATOM 1927 CA VAL A 122 2.948 29.466 21.432 1.00 0.00 C ATOM 1928 C VAL A 122 1.748 29.565 22.357 1.00 0.00 C ATOM 1929 O VAL A 122 0.645 29.817 21.887 1.00 0.00 O ATOM 1930 CB VAL A 122 3.351 30.877 20.971 1.00 0.00 C ATOM 1931 CG1 VAL A 122 3.689 31.786 22.155 1.00 0.00 C ATOM 1932 CG2 VAL A 122 4.550 30.826 20.027 1.00 0.00 C ATOM 0 H VAL A 122 1.940 29.070 19.651 1.00 0.00 H new ATOM 0 HA VAL A 122 3.801 29.023 21.947 1.00 0.00 H new ATOM 0 HB VAL A 122 2.490 31.290 20.445 1.00 0.00 H new ATOM 0 HG11 VAL A 122 3.969 32.773 21.787 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.819 31.874 22.806 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.520 31.359 22.716 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.813 31.838 19.717 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.398 30.372 20.540 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.297 30.232 19.149 1.00 0.00 H new ATOM 1942 N PHE A 123 1.969 29.426 23.661 1.00 0.00 N ATOM 1943 CA PHE A 123 0.913 29.445 24.674 1.00 0.00 C ATOM 1944 C PHE A 123 1.113 30.621 25.647 1.00 0.00 C ATOM 1945 O PHE A 123 2.195 30.791 26.213 1.00 0.00 O ATOM 1946 CB PHE A 123 0.877 28.077 25.369 1.00 0.00 C ATOM 1947 CG PHE A 123 0.695 26.912 24.408 1.00 0.00 C ATOM 1948 CD1 PHE A 123 -0.517 26.754 23.710 1.00 0.00 C ATOM 1949 CD2 PHE A 123 1.755 26.017 24.164 1.00 0.00 C ATOM 1950 CE1 PHE A 123 -0.676 25.708 22.787 1.00 0.00 C ATOM 1951 CE2 PHE A 123 1.596 24.969 23.239 1.00 0.00 C ATOM 1952 CZ PHE A 123 0.380 24.811 22.553 1.00 0.00 C ATOM 0 H PHE A 123 2.902 29.295 24.052 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.061 29.610 24.212 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.804 27.937 25.926 1.00 0.00 H new ATOM 0 HB3 PHE A 123 0.064 28.069 26.095 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.331 27.442 23.886 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.692 26.136 24.688 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.610 25.593 22.257 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.411 24.284 23.056 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.257 24.002 21.848 1.00 0.00 H new ATOM 1962 N GLU A 124 0.083 31.453 25.820 1.00 0.00 N ATOM 1963 CA GLU A 124 0.119 32.694 26.610 1.00 0.00 C ATOM 1964 C GLU A 124 -1.113 32.858 27.513 1.00 0.00 C ATOM 1965 O GLU A 124 -2.240 32.576 27.105 1.00 0.00 O ATOM 1966 CB GLU A 124 0.213 33.919 25.679 1.00 0.00 C ATOM 1967 CG GLU A 124 1.545 34.053 24.927 1.00 0.00 C ATOM 1968 CD GLU A 124 2.773 34.276 25.840 1.00 0.00 C ATOM 1969 OE1 GLU A 124 2.622 34.696 27.014 1.00 0.00 O ATOM 1970 OE2 GLU A 124 3.918 34.074 25.363 1.00 0.00 O ATOM 0 H GLU A 124 -0.831 31.279 25.402 1.00 0.00 H new ATOM 0 HA GLU A 124 1.001 32.627 27.247 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.596 33.868 24.951 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.053 34.821 26.270 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.706 33.152 24.335 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.471 34.886 24.227 1.00 0.00 H new ATOM 1977 N MET A 125 -0.909 33.383 28.724 1.00 0.00 N ATOM 1978 CA MET A 125 -1.986 33.731 29.665 1.00 0.00 C ATOM 1979 C MET A 125 -2.456 35.191 29.473 1.00 0.00 C ATOM 1980 O MET A 125 -1.659 36.042 29.060 1.00 0.00 O ATOM 1981 CB MET A 125 -1.522 33.471 31.108 1.00 0.00 C ATOM 1982 CG MET A 125 -1.313 31.973 31.368 1.00 0.00 C ATOM 1983 SD MET A 125 -0.623 31.551 32.995 1.00 0.00 S ATOM 1984 CE MET A 125 -2.010 32.001 34.075 1.00 0.00 C ATOM 0 H MET A 125 0.023 33.583 29.088 1.00 0.00 H new ATOM 0 HA MET A 125 -2.847 33.095 29.459 1.00 0.00 H new ATOM 0 HB2 MET A 125 -0.592 34.007 31.295 1.00 0.00 H new ATOM 0 HB3 MET A 125 -2.262 33.863 31.806 1.00 0.00 H new ATOM 0 HG2 MET A 125 -2.271 31.465 31.256 1.00 0.00 H new ATOM 0 HG3 MET A 125 -0.651 31.577 30.598 1.00 0.00 H new ATOM 0 HE1 MET A 125 -1.757 31.767 35.109 1.00 0.00 H new ATOM 0 HE2 MET A 125 -2.211 33.068 33.983 1.00 0.00 H new ATOM 0 HE3 MET A 125 -2.896 31.438 33.783 1.00 0.00 H new ATOM 2301 N GLU B 358 5.736 13.993 15.212 1.00 0.00 N ATOM 2302 CA GLU B 358 4.606 13.302 14.587 1.00 0.00 C ATOM 2303 C GLU B 358 3.530 14.254 14.039 1.00 0.00 C ATOM 2304 O GLU B 358 2.497 14.494 14.667 1.00 0.00 O ATOM 2305 CB GLU B 358 4.069 12.182 15.483 1.00 0.00 C ATOM 2306 CG GLU B 358 3.318 11.147 14.640 1.00 0.00 C ATOM 2307 CD GLU B 358 4.272 10.220 13.863 1.00 0.00 C ATOM 2308 OE1 GLU B 358 4.844 9.285 14.475 1.00 0.00 O ATOM 2309 OE2 GLU B 358 4.443 10.412 12.635 1.00 0.00 O ATOM 0 HA GLU B 358 4.987 12.811 13.692 1.00 0.00 H new ATOM 0 HB2 GLU B 358 4.893 11.703 16.012 1.00 0.00 H new ATOM 0 HB3 GLU B 358 3.404 12.598 16.239 1.00 0.00 H new ATOM 0 HG2 GLU B 358 2.681 10.547 15.289 1.00 0.00 H new ATOM 0 HG3 GLU B 358 2.663 11.661 13.937 1.00 0.00 H new ATOM 2316 N PHE B 359 3.772 14.800 12.846 1.00 0.00 N ATOM 2317 CA PHE B 359 2.760 15.543 12.094 1.00 0.00 C ATOM 2318 C PHE B 359 1.679 14.596 11.536 1.00 0.00 C ATOM 2319 O PHE B 359 1.958 13.471 11.106 1.00 0.00 O ATOM 2320 CB PHE B 359 3.400 16.345 10.952 1.00 0.00 C ATOM 2321 CG PHE B 359 4.067 17.646 11.358 1.00 0.00 C ATOM 2322 CD1 PHE B 359 3.283 18.719 11.820 1.00 0.00 C ATOM 2323 CD2 PHE B 359 5.456 17.815 11.202 1.00 0.00 C ATOM 2324 CE1 PHE B 359 3.881 19.959 12.102 1.00 0.00 C ATOM 2325 CE2 PHE B 359 6.051 19.065 11.462 1.00 0.00 C ATOM 2326 CZ PHE B 359 5.262 20.141 11.906 1.00 0.00 C ATOM 0 H PHE B 359 4.674 14.740 12.374 1.00 0.00 H new ATOM 0 HA PHE B 359 2.286 16.241 12.783 1.00 0.00 H new ATOM 0 HB2 PHE B 359 4.142 15.715 10.461 1.00 0.00 H new ATOM 0 HB3 PHE B 359 2.631 16.567 10.213 1.00 0.00 H new ATOM 0 HD1 PHE B 359 2.220 18.589 11.958 1.00 0.00 H new ATOM 0 HD2 PHE B 359 6.067 16.984 10.882 1.00 0.00 H new ATOM 0 HE1 PHE B 359 3.278 20.776 12.471 1.00 0.00 H new ATOM 0 HE2 PHE B 359 7.113 19.197 11.320 1.00 0.00 H new ATOM 0 HZ PHE B 359 5.714 21.103 12.096 1.00 0.00 H new ATOM 2336 N PHE B 360 0.442 15.092 11.491 1.00 0.00 N ATOM 2337 CA PHE B 360 -0.754 14.424 10.985 1.00 0.00 C ATOM 2338 C PHE B 360 -1.445 15.314 9.949 1.00 0.00 C ATOM 2339 O PHE B 360 -1.557 16.527 10.143 1.00 0.00 O ATOM 2340 CB PHE B 360 -1.718 14.158 12.149 1.00 0.00 C ATOM 2341 CG PHE B 360 -1.388 12.934 12.977 1.00 0.00 C ATOM 2342 CD1 PHE B 360 -0.409 12.982 13.989 1.00 0.00 C ATOM 2343 CD2 PHE B 360 -2.079 11.733 12.737 1.00 0.00 C ATOM 2344 CE1 PHE B 360 -0.139 11.843 14.763 1.00 0.00 C ATOM 2345 CE2 PHE B 360 -1.794 10.586 13.498 1.00 0.00 C ATOM 2346 CZ PHE B 360 -0.828 10.641 14.518 1.00 0.00 C ATOM 0 H PHE B 360 0.237 16.032 11.829 1.00 0.00 H new ATOM 0 HA PHE B 360 -0.470 13.481 10.518 1.00 0.00 H new ATOM 0 HB2 PHE B 360 -1.726 15.030 12.802 1.00 0.00 H new ATOM 0 HB3 PHE B 360 -2.726 14.049 11.750 1.00 0.00 H new ATOM 0 HD1 PHE B 360 0.135 13.897 14.170 1.00 0.00 H new ATOM 0 HD2 PHE B 360 -2.832 11.692 11.964 1.00 0.00 H new ATOM 0 HE1 PHE B 360 0.600 11.889 15.549 1.00 0.00 H new ATOM 0 HE2 PHE B 360 -2.317 9.662 13.299 1.00 0.00 H new ATOM 0 HZ PHE B 360 -0.616 9.764 15.111 1.00 0.00 H new ATOM 2356 N ASP B 361 -1.972 14.711 8.880 1.00 0.00 N ATOM 2357 CA ASP B 361 -2.843 15.414 7.932 1.00 0.00 C ATOM 2358 C ASP B 361 -4.133 15.804 8.672 1.00 0.00 C ATOM 2359 O ASP B 361 -4.907 14.941 9.101 1.00 0.00 O ATOM 2360 CB ASP B 361 -3.117 14.535 6.704 1.00 0.00 C ATOM 2361 CG ASP B 361 -1.831 14.215 5.924 1.00 0.00 C ATOM 2362 OD1 ASP B 361 -1.170 15.165 5.436 1.00 0.00 O ATOM 2363 OD2 ASP B 361 -1.483 13.019 5.791 1.00 0.00 O ATOM 0 H ASP B 361 -1.810 13.731 8.648 1.00 0.00 H new ATOM 0 HA ASP B 361 -2.363 16.319 7.561 1.00 0.00 H new ATOM 0 HB2 ASP B 361 -3.589 13.605 7.022 1.00 0.00 H new ATOM 0 HB3 ASP B 361 -3.823 15.042 6.046 1.00 0.00 H new ATOM 2368 N ALA B 362 -4.342 17.108 8.873 1.00 0.00 N ATOM 2369 CA ALA B 362 -5.395 17.607 9.752 1.00 0.00 C ATOM 2370 C ALA B 362 -6.830 17.333 9.244 1.00 0.00 C ATOM 2371 O ALA B 362 -7.116 17.567 8.062 1.00 0.00 O ATOM 2372 CB ALA B 362 -5.179 19.105 9.981 1.00 0.00 C ATOM 0 H ALA B 362 -3.787 17.842 8.432 1.00 0.00 H new ATOM 0 HA ALA B 362 -5.317 17.056 10.689 1.00 0.00 H new ATOM 0 HB1 ALA B 362 -5.960 19.489 10.637 1.00 0.00 H new ATOM 0 HB2 ALA B 362 -4.205 19.266 10.444 1.00 0.00 H new ATOM 0 HB3 ALA B 362 -5.217 19.628 9.026 1.00 0.00 H new ATOM 2378 N PRO B 363 -7.759 16.901 10.122 1.00 0.00 N ATOM 2379 CA PRO B 363 -9.182 16.818 9.808 1.00 0.00 C ATOM 2380 C PRO B 363 -9.853 18.195 9.954 1.00 0.00 C ATOM 2381 O PRO B 363 -9.346 19.090 10.633 1.00 0.00 O ATOM 2382 CB PRO B 363 -9.736 15.794 10.803 1.00 0.00 C ATOM 2383 CG PRO B 363 -8.899 16.063 12.055 1.00 0.00 C ATOM 2384 CD PRO B 363 -7.526 16.427 11.482 1.00 0.00 C ATOM 0 HA PRO B 363 -9.372 16.514 8.779 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -10.800 15.941 10.987 1.00 0.00 H new ATOM 0 HB3 PRO B 363 -9.613 14.772 10.444 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -9.315 16.875 12.652 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -8.847 15.187 12.701 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -7.046 17.198 12.085 1.00 0.00 H new ATOM 0 HD3 PRO B 363 -6.863 15.562 11.483 1.00 0.00 H new ATOM 2392 N GLU B 364 -11.038 18.363 9.359 1.00 0.00 N ATOM 2393 CA GLU B 364 -11.810 19.611 9.488 1.00 0.00 C ATOM 2394 C GLU B 364 -12.411 19.846 10.879 1.00 0.00 C ATOM 2395 O GLU B 364 -12.757 20.981 11.207 1.00 0.00 O ATOM 2396 CB GLU B 364 -12.915 19.698 8.436 1.00 0.00 C ATOM 2397 CG GLU B 364 -13.923 18.537 8.462 1.00 0.00 C ATOM 2398 CD GLU B 364 -15.253 18.949 7.810 1.00 0.00 C ATOM 2399 OE1 GLU B 364 -16.098 19.557 8.517 1.00 0.00 O ATOM 2400 OE2 GLU B 364 -15.460 18.674 6.603 1.00 0.00 O ATOM 0 H GLU B 364 -11.487 17.652 8.782 1.00 0.00 H new ATOM 0 HA GLU B 364 -11.077 20.401 9.325 1.00 0.00 H new ATOM 0 HB2 GLU B 364 -13.456 20.634 8.575 1.00 0.00 H new ATOM 0 HB3 GLU B 364 -12.455 19.739 7.449 1.00 0.00 H new ATOM 0 HG2 GLU B 364 -13.507 17.677 7.937 1.00 0.00 H new ATOM 0 HG3 GLU B 364 -14.099 18.226 9.492 1.00 0.00 H new ATOM 2407 N ILE B 365 -12.564 18.786 11.677 1.00 0.00 N ATOM 2408 CA ILE B 365 -12.921 18.838 13.099 1.00 0.00 C ATOM 2409 C ILE B 365 -12.483 17.535 13.800 1.00 0.00 C ATOM 2410 O ILE B 365 -12.266 16.520 13.137 1.00 0.00 O ATOM 2411 CB ILE B 365 -14.432 19.135 13.278 1.00 0.00 C ATOM 2412 CG1 ILE B 365 -14.733 19.645 14.705 1.00 0.00 C ATOM 2413 CG2 ILE B 365 -15.312 17.925 12.919 1.00 0.00 C ATOM 2414 CD1 ILE B 365 -15.999 20.504 14.781 1.00 0.00 C ATOM 0 H ILE B 365 -12.438 17.832 11.339 1.00 0.00 H new ATOM 0 HA ILE B 365 -12.387 19.660 13.576 1.00 0.00 H new ATOM 0 HB ILE B 365 -14.686 19.928 12.575 1.00 0.00 H new ATOM 0 HG12 ILE B 365 -14.839 18.792 15.375 1.00 0.00 H new ATOM 0 HG13 ILE B 365 -13.884 20.227 15.063 1.00 0.00 H new ATOM 0 HG21 ILE B 365 -16.361 18.183 13.061 1.00 0.00 H new ATOM 0 HG22 ILE B 365 -15.144 17.649 11.878 1.00 0.00 H new ATOM 0 HG23 ILE B 365 -15.055 17.084 13.563 1.00 0.00 H new ATOM 0 HD11 ILE B 365 -16.156 20.831 15.809 1.00 0.00 H new ATOM 0 HD12 ILE B 365 -15.887 21.375 14.136 1.00 0.00 H new ATOM 0 HD13 ILE B 365 -16.857 19.917 14.452 1.00 0.00 H new ATOM 2426 N ILE B 366 -12.369 17.536 15.133 1.00 0.00 N ATOM 2427 CA ILE B 366 -12.047 16.329 15.913 1.00 0.00 C ATOM 2428 C ILE B 366 -13.298 15.458 16.148 1.00 0.00 C ATOM 2429 O ILE B 366 -14.273 15.895 16.761 1.00 0.00 O ATOM 2430 CB ILE B 366 -11.268 16.689 17.205 1.00 0.00 C ATOM 2431 CG1 ILE B 366 -10.964 15.470 18.106 1.00 0.00 C ATOM 2432 CG2 ILE B 366 -11.949 17.768 18.071 1.00 0.00 C ATOM 2433 CD1 ILE B 366 -10.227 14.324 17.401 1.00 0.00 C ATOM 0 H ILE B 366 -12.497 18.372 15.704 1.00 0.00 H new ATOM 0 HA ILE B 366 -11.371 15.705 15.329 1.00 0.00 H new ATOM 0 HB ILE B 366 -10.333 17.091 16.815 1.00 0.00 H new ATOM 0 HG12 ILE B 366 -10.366 15.802 18.954 1.00 0.00 H new ATOM 0 HG13 ILE B 366 -11.903 15.088 18.508 1.00 0.00 H new ATOM 0 HG21 ILE B 366 -11.341 17.962 18.955 1.00 0.00 H new ATOM 0 HG22 ILE B 366 -12.053 18.686 17.493 1.00 0.00 H new ATOM 0 HG23 ILE B 366 -12.935 17.419 18.378 1.00 0.00 H new ATOM 0 HD11 ILE B 366 -10.056 13.512 18.108 1.00 0.00 H new ATOM 0 HD12 ILE B 366 -10.831 13.960 16.570 1.00 0.00 H new ATOM 0 HD13 ILE B 366 -9.270 14.685 17.024 1.00 0.00 H new