USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 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 21 GLN : amide:sc= 0.841 K(o=1.5,f=-4.1!) USER MOD Set 1.2: A 25 TYR OH : rot 100:sc= 0.677 USER MOD Set 2.1: A 12 THR OG1 : rot -89:sc= -3.09! USER MOD Set 2.2: A 31 MET CE :methyl -172:sc= -2.82! (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= -0.463 USER MOD Single : A 19 THR OG1 : rot 118:sc= -5.35! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -1.39 X(o=-1.4,f=-1.7!) USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= -4.21! (180deg=-4.7!) USER MOD Single : A 29 LYS NZ :NH3+ 138:sc= -3.06! (180deg=-5.84!) USER MOD Single : A 32 GLN : amide:sc= -2.8! C(o=-2.8!,f=-4.1!) USER MOD Single : A 34 THR OG1 : rot 48:sc= -0.244 USER MOD Single : A 38 CYS SG : rot 66:sc= -0.63! USER MOD Single : A 45 SER OG : rot 89:sc= 0.44! USER MOD Single : A 49 SER OG : rot 180:sc= -0.314! USER MOD Single : A 50 SER OG : rot 180:sc=-0.00987 USER MOD Single : A 53 LYS NZ :NH3+ 155:sc= -6.08! (180deg=-6.94!) USER MOD Single : A 54 GLN : amide:sc= -0.147 X(o=-0.15,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0297) USER MOD Single : A 56 MET CE :methyl -128:sc= -11.9! (180deg=-22.2!) USER MOD Single : A 62 SER OG : rot 180:sc= -0.991! USER MOD Single : A 63 SER OG : rot -176:sc= -5.97! USER MOD Single : A 67 LYS NZ :NH3+ -148:sc= -4.24! (180deg=-6.06!) USER MOD Single : A 71 THR OG1 : rot -174:sc= -3.37! USER MOD Single : A 79 ASN : amide:sc= -4.2! C(o=-4.2!,f=-7.7!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -60:sc= -3.13! USER MOD Single : A 93 LYS NZ :NH3+ 135:sc= -16.4! (180deg=-18!) USER MOD Single : A 96 THR OG1 : rot -105:sc= -1.16! USER MOD Single : A 97 MET CE :methyl 180:sc= -0.263 (180deg=-0.263) USER MOD Single : A 98 LYS NZ :NH3+ -164:sc= -0.003 (180deg=-0.0877) USER MOD Single : A 99 TYR OH : rot -148:sc= -1.02 USER MOD Single : A 104 LYS NZ :NH3+ 161:sc= -0.305 (180deg=-0.483) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0.0852 USER MOD Single : A 126 ASN : amide:sc= -3.25! C(o=-3.2!,f=-1.6!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -104:sc= 0.178 USER MOD Single : A 141 SER OG : rot -63:sc= -0.872 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 112.865 3.338 -14.211 1.00 0.00 N ATOM 106 CA VAL A 7 113.438 4.210 -13.154 1.00 0.00 C ATOM 107 C VAL A 7 114.938 4.391 -13.364 1.00 0.00 C ATOM 108 O VAL A 7 115.385 5.391 -13.889 1.00 0.00 O ATOM 109 CB VAL A 7 113.199 3.560 -11.791 1.00 0.00 C ATOM 110 CG1 VAL A 7 113.703 4.485 -10.679 1.00 0.00 C ATOM 111 CG2 VAL A 7 111.700 3.299 -11.613 1.00 0.00 C ATOM 0 HA VAL A 7 112.956 5.186 -13.200 1.00 0.00 H new ATOM 0 HB VAL A 7 113.741 2.616 -11.737 1.00 0.00 H new ATOM 0 HG11 VAL A 7 113.530 4.017 -9.710 1.00 0.00 H new ATOM 0 HG12 VAL A 7 114.770 4.664 -10.810 1.00 0.00 H new ATOM 0 HG13 VAL A 7 113.168 5.433 -10.724 1.00 0.00 H new ATOM 0 HG21 VAL A 7 111.524 2.835 -10.642 1.00 0.00 H new ATOM 0 HG22 VAL A 7 111.157 4.243 -11.668 1.00 0.00 H new ATOM 0 HG23 VAL A 7 111.350 2.633 -12.402 1.00 0.00 H new ATOM 121 N LYS A 8 115.722 3.445 -12.930 1.00 0.00 N ATOM 122 CA LYS A 8 117.194 3.587 -13.076 1.00 0.00 C ATOM 123 C LYS A 8 117.641 4.760 -12.200 1.00 0.00 C ATOM 124 O LYS A 8 118.810 4.941 -11.923 1.00 0.00 O ATOM 125 CB LYS A 8 117.543 3.850 -14.548 1.00 0.00 C ATOM 126 CG LYS A 8 118.187 5.232 -14.703 1.00 0.00 C ATOM 127 CD LYS A 8 118.489 5.491 -16.180 1.00 0.00 C ATOM 128 CE LYS A 8 117.254 6.087 -16.858 1.00 0.00 C ATOM 129 NZ LYS A 8 117.197 5.631 -18.276 1.00 0.00 N ATOM 0 H LYS A 8 115.408 2.584 -12.483 1.00 0.00 H new ATOM 0 HA LYS A 8 117.704 2.676 -12.764 1.00 0.00 H new ATOM 0 HB2 LYS A 8 118.225 3.081 -14.910 1.00 0.00 H new ATOM 0 HB3 LYS A 8 116.642 3.790 -15.159 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.519 6.002 -14.317 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.105 5.285 -14.118 1.00 0.00 H new ATOM 0 HD2 LYS A 8 119.334 6.173 -16.275 1.00 0.00 H new ATOM 0 HD3 LYS A 8 118.774 4.561 -16.672 1.00 0.00 H new ATOM 0 HE2 LYS A 8 116.352 5.779 -16.329 1.00 0.00 H new ATOM 0 HE3 LYS A 8 117.293 7.176 -16.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 116.358 6.036 -18.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 118.053 5.945 -18.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 117.141 4.593 -18.305 1.00 0.00 H new ATOM 143 N GLY A 9 116.700 5.557 -11.762 1.00 0.00 N ATOM 144 CA GLY A 9 117.032 6.725 -10.901 1.00 0.00 C ATOM 145 C GLY A 9 115.909 7.760 -11.000 1.00 0.00 C ATOM 146 O GLY A 9 116.095 8.835 -11.534 1.00 0.00 O ATOM 0 H GLY A 9 115.707 5.445 -11.968 1.00 0.00 H new ATOM 0 HA2 GLY A 9 117.158 6.405 -9.867 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.978 7.166 -11.215 1.00 0.00 H new ATOM 150 N ALA A 10 114.745 7.438 -10.489 1.00 0.00 N ATOM 151 CA ALA A 10 113.595 8.388 -10.550 1.00 0.00 C ATOM 152 C ALA A 10 112.302 7.581 -10.648 1.00 0.00 C ATOM 153 O ALA A 10 112.146 6.752 -11.522 1.00 0.00 O ATOM 154 CB ALA A 10 113.717 9.291 -11.781 1.00 0.00 C ATOM 0 H ALA A 10 114.543 6.550 -10.029 1.00 0.00 H new ATOM 0 HA ALA A 10 113.591 9.010 -9.655 1.00 0.00 H new ATOM 0 HB1 ALA A 10 112.872 9.979 -11.813 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.645 9.859 -11.725 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.721 8.678 -12.683 1.00 0.00 H new ATOM 160 N LEU A 11 111.375 7.803 -9.759 1.00 0.00 N ATOM 161 CA LEU A 11 110.106 7.028 -9.817 1.00 0.00 C ATOM 162 C LEU A 11 108.917 7.933 -9.491 1.00 0.00 C ATOM 163 O LEU A 11 109.054 9.133 -9.356 1.00 0.00 O ATOM 164 CB LEU A 11 110.173 5.866 -8.818 1.00 0.00 C ATOM 165 CG LEU A 11 110.088 6.378 -7.373 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.678 5.324 -6.435 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.885 7.676 -7.211 1.00 0.00 C ATOM 0 H LEU A 11 111.440 8.482 -9.001 1.00 0.00 H new ATOM 0 HA LEU A 11 109.973 6.632 -10.824 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.357 5.169 -9.010 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.103 5.314 -8.958 1.00 0.00 H new ATOM 0 HG LEU A 11 109.042 6.569 -7.132 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.622 5.680 -5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 11 110.114 4.396 -6.529 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.720 5.144 -6.700 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.812 8.022 -6.180 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.931 7.494 -7.459 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.481 8.437 -7.878 1.00 0.00 H new ATOM 179 N THR A 12 107.749 7.369 -9.373 1.00 0.00 N ATOM 180 CA THR A 12 106.550 8.198 -9.063 1.00 0.00 C ATOM 181 C THR A 12 106.889 9.204 -7.959 1.00 0.00 C ATOM 182 O THR A 12 107.948 9.158 -7.364 1.00 0.00 O ATOM 183 CB THR A 12 105.411 7.290 -8.592 1.00 0.00 C ATOM 184 OG1 THR A 12 105.927 6.307 -7.706 1.00 0.00 O ATOM 185 CG2 THR A 12 104.769 6.606 -9.799 1.00 0.00 C ATOM 0 H THR A 12 107.571 6.370 -9.478 1.00 0.00 H new ATOM 0 HA THR A 12 106.242 8.736 -9.959 1.00 0.00 H new ATOM 0 HB THR A 12 104.660 7.887 -8.075 1.00 0.00 H new ATOM 0 HG1 THR A 12 106.213 5.522 -8.219 1.00 0.00 H new ATOM 0 HG21 THR A 12 103.958 5.960 -9.462 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.373 7.362 -10.477 1.00 0.00 H new ATOM 0 HG23 THR A 12 105.517 6.008 -10.319 1.00 0.00 H new ATOM 193 N SER A 13 105.992 10.111 -7.680 1.00 0.00 N ATOM 194 CA SER A 13 106.246 11.124 -6.614 1.00 0.00 C ATOM 195 C SER A 13 106.507 10.415 -5.281 1.00 0.00 C ATOM 196 O SER A 13 106.552 11.032 -4.237 1.00 0.00 O ATOM 197 CB SER A 13 105.024 12.033 -6.475 1.00 0.00 C ATOM 198 OG SER A 13 105.434 13.298 -5.975 1.00 0.00 O ATOM 0 H SER A 13 105.089 10.195 -8.147 1.00 0.00 H new ATOM 0 HA SER A 13 107.117 11.721 -6.883 1.00 0.00 H new ATOM 0 HB2 SER A 13 104.534 12.153 -7.441 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.295 11.582 -5.801 1.00 0.00 H new ATOM 0 HG SER A 13 104.653 13.883 -5.886 1.00 0.00 H new ATOM 204 N GLY A 14 106.665 9.123 -5.310 1.00 0.00 N ATOM 205 CA GLY A 14 106.905 8.364 -4.050 1.00 0.00 C ATOM 206 C GLY A 14 107.980 9.044 -3.192 1.00 0.00 C ATOM 207 O GLY A 14 107.966 8.945 -1.982 1.00 0.00 O ATOM 0 H GLY A 14 106.638 8.555 -6.157 1.00 0.00 H new ATOM 0 HA2 GLY A 14 105.976 8.290 -3.484 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.215 7.347 -4.288 1.00 0.00 H new ATOM 211 N ARG A 15 108.926 9.707 -3.796 1.00 0.00 N ATOM 212 CA ARG A 15 110.004 10.350 -2.986 1.00 0.00 C ATOM 213 C ARG A 15 109.474 11.561 -2.204 1.00 0.00 C ATOM 214 O ARG A 15 109.574 11.612 -0.994 1.00 0.00 O ATOM 215 CB ARG A 15 111.168 10.772 -3.899 1.00 0.00 C ATOM 216 CG ARG A 15 110.722 11.822 -4.927 1.00 0.00 C ATOM 217 CD ARG A 15 109.654 11.236 -5.846 1.00 0.00 C ATOM 218 NE ARG A 15 109.650 11.978 -7.138 1.00 0.00 N ATOM 219 CZ ARG A 15 110.457 11.621 -8.099 1.00 0.00 C ATOM 220 NH1 ARG A 15 111.267 10.613 -7.930 1.00 0.00 N ATOM 221 NH2 ARG A 15 110.454 12.273 -9.230 1.00 0.00 N ATOM 0 H ARG A 15 109.002 9.832 -4.805 1.00 0.00 H new ATOM 0 HA ARG A 15 110.363 9.619 -2.262 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.980 11.175 -3.293 1.00 0.00 H new ATOM 0 HB3 ARG A 15 111.561 9.897 -4.417 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.330 12.700 -4.414 1.00 0.00 H new ATOM 0 HG3 ARG A 15 111.578 12.152 -5.516 1.00 0.00 H new ATOM 0 HD2 ARG A 15 109.851 10.178 -6.022 1.00 0.00 H new ATOM 0 HD3 ARG A 15 108.675 11.303 -5.372 1.00 0.00 H new ATOM 0 HE ARG A 15 109.016 12.766 -7.271 1.00 0.00 H new ATOM 0 HH11 ARG A 15 111.270 10.104 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 15 111.898 10.334 -8.681 1.00 0.00 H new ATOM 0 HH21 ARG A 15 109.821 13.062 -9.362 1.00 0.00 H new ATOM 0 HH22 ARG A 15 111.085 11.994 -9.981 1.00 0.00 H new ATOM 235 N GLU A 16 108.935 12.543 -2.870 1.00 0.00 N ATOM 236 CA GLU A 16 108.436 13.748 -2.142 1.00 0.00 C ATOM 237 C GLU A 16 107.024 13.510 -1.603 1.00 0.00 C ATOM 238 O GLU A 16 106.672 13.971 -0.536 1.00 0.00 O ATOM 239 CB GLU A 16 108.415 14.943 -3.098 1.00 0.00 C ATOM 240 CG GLU A 16 107.181 14.858 -3.999 1.00 0.00 C ATOM 241 CD GLU A 16 107.336 15.829 -5.170 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.402 15.847 -5.763 1.00 0.00 O ATOM 243 OE2 GLU A 16 106.385 16.540 -5.454 1.00 0.00 O ATOM 0 H GLU A 16 108.818 12.566 -3.883 1.00 0.00 H new ATOM 0 HA GLU A 16 109.102 13.949 -1.303 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.401 15.874 -2.532 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.321 14.952 -3.704 1.00 0.00 H new ATOM 0 HG2 GLU A 16 107.058 13.841 -4.370 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.284 15.100 -3.429 1.00 0.00 H new ATOM 250 N GLU A 17 106.204 12.824 -2.344 1.00 0.00 N ATOM 251 CA GLU A 17 104.805 12.593 -1.888 1.00 0.00 C ATOM 252 C GLU A 17 104.753 11.586 -0.734 1.00 0.00 C ATOM 253 O GLU A 17 104.144 11.838 0.285 1.00 0.00 O ATOM 254 CB GLU A 17 103.982 12.055 -3.061 1.00 0.00 C ATOM 255 CG GLU A 17 102.584 11.667 -2.575 1.00 0.00 C ATOM 256 CD GLU A 17 101.912 12.880 -1.929 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.187 13.137 -0.769 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.135 13.533 -2.606 1.00 0.00 O ATOM 0 H GLU A 17 106.440 12.412 -3.247 1.00 0.00 H new ATOM 0 HA GLU A 17 104.397 13.540 -1.534 1.00 0.00 H new ATOM 0 HB2 GLU A 17 103.909 12.811 -3.843 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.478 11.189 -3.499 1.00 0.00 H new ATOM 0 HG2 GLU A 17 101.984 11.308 -3.411 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.651 10.850 -1.857 1.00 0.00 H new ATOM 265 N LEU A 18 105.346 10.436 -0.888 1.00 0.00 N ATOM 266 CA LEU A 18 105.268 9.420 0.202 1.00 0.00 C ATOM 267 C LEU A 18 106.224 9.739 1.355 1.00 0.00 C ATOM 268 O LEU A 18 105.934 9.421 2.489 1.00 0.00 O ATOM 269 CB LEU A 18 105.583 8.033 -0.363 1.00 0.00 C ATOM 270 CG LEU A 18 104.282 7.241 -0.529 1.00 0.00 C ATOM 271 CD1 LEU A 18 103.751 6.824 0.848 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.238 8.110 -1.240 1.00 0.00 C ATOM 0 H LEU A 18 105.877 10.155 -1.712 1.00 0.00 H new ATOM 0 HA LEU A 18 104.254 9.440 0.601 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.089 8.126 -1.324 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.262 7.502 0.305 1.00 0.00 H new ATOM 0 HG LEU A 18 104.478 6.349 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 18 102.826 6.261 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.491 6.201 1.350 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.558 7.713 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.313 7.545 -1.357 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.044 9.004 -0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.613 8.400 -2.222 1.00 0.00 H new ATOM 284 N THR A 19 107.356 10.349 1.111 1.00 0.00 N ATOM 285 CA THR A 19 108.265 10.633 2.257 1.00 0.00 C ATOM 286 C THR A 19 107.662 11.746 3.108 1.00 0.00 C ATOM 287 O THR A 19 107.454 11.587 4.292 1.00 0.00 O ATOM 288 CB THR A 19 109.641 11.064 1.746 1.00 0.00 C ATOM 289 OG1 THR A 19 110.069 10.161 0.737 1.00 0.00 O ATOM 290 CG2 THR A 19 110.645 11.055 2.906 1.00 0.00 C ATOM 0 H THR A 19 107.682 10.655 0.194 1.00 0.00 H new ATOM 0 HA THR A 19 108.381 9.730 2.857 1.00 0.00 H new ATOM 0 HB THR A 19 109.580 12.071 1.332 1.00 0.00 H new ATOM 0 HG1 THR A 19 110.177 10.643 -0.109 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.625 11.362 2.541 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.313 11.747 3.680 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.711 10.050 3.322 1.00 0.00 H new ATOM 298 N ARG A 20 107.363 12.864 2.509 1.00 0.00 N ATOM 299 CA ARG A 20 106.756 13.984 3.274 1.00 0.00 C ATOM 300 C ARG A 20 105.498 13.495 3.997 1.00 0.00 C ATOM 301 O ARG A 20 105.127 14.006 5.035 1.00 0.00 O ATOM 302 CB ARG A 20 106.370 15.098 2.307 1.00 0.00 C ATOM 303 CG ARG A 20 107.624 15.841 1.873 1.00 0.00 C ATOM 304 CD ARG A 20 107.252 16.943 0.879 1.00 0.00 C ATOM 305 NE ARG A 20 106.404 17.961 1.561 1.00 0.00 N ATOM 306 CZ ARG A 20 105.826 18.901 0.865 1.00 0.00 C ATOM 307 NH1 ARG A 20 105.989 18.951 -0.428 1.00 0.00 N ATOM 308 NH2 ARG A 20 105.083 19.793 1.463 1.00 0.00 N ATOM 0 H ARG A 20 107.514 13.050 1.518 1.00 0.00 H new ATOM 0 HA ARG A 20 107.475 14.354 4.005 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.861 14.681 1.438 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.673 15.786 2.785 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.121 16.274 2.741 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.329 15.147 1.415 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.154 17.411 0.484 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.716 16.517 0.031 1.00 0.00 H new ATOM 0 HE ARG A 20 106.275 17.923 2.572 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.569 18.255 -0.896 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.537 19.686 -0.971 1.00 0.00 H new ATOM 0 HH21 ARG A 20 104.955 19.755 2.474 1.00 0.00 H new ATOM 0 HH22 ARG A 20 104.631 20.528 0.919 1.00 0.00 H new ATOM 322 N GLN A 21 104.827 12.525 3.439 1.00 0.00 N ATOM 323 CA GLN A 21 103.577 12.016 4.071 1.00 0.00 C ATOM 324 C GLN A 21 103.891 11.082 5.244 1.00 0.00 C ATOM 325 O GLN A 21 103.048 10.840 6.083 1.00 0.00 O ATOM 326 CB GLN A 21 102.755 11.259 3.030 1.00 0.00 C ATOM 327 CG GLN A 21 102.260 12.237 1.964 1.00 0.00 C ATOM 328 CD GLN A 21 100.964 12.897 2.438 1.00 0.00 C ATOM 329 OE1 GLN A 21 99.889 12.370 2.231 1.00 0.00 O ATOM 330 NE2 GLN A 21 101.020 14.037 3.071 1.00 0.00 N ATOM 0 H GLN A 21 105.092 12.062 2.570 1.00 0.00 H new ATOM 0 HA GLN A 21 103.013 12.868 4.450 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.361 10.478 2.570 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.909 10.766 3.508 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.018 12.996 1.772 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.090 11.712 1.024 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.922 14.480 3.245 1.00 0.00 H new ATOM 0 HE22 GLN A 21 100.162 14.485 3.392 1.00 0.00 H new ATOM 339 N VAL A 22 105.076 10.537 5.315 1.00 0.00 N ATOM 340 CA VAL A 22 105.378 9.611 6.447 1.00 0.00 C ATOM 341 C VAL A 22 104.902 10.251 7.752 1.00 0.00 C ATOM 342 O VAL A 22 104.481 9.573 8.666 1.00 0.00 O ATOM 343 CB VAL A 22 106.885 9.335 6.533 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.426 8.969 5.151 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.608 10.579 7.054 1.00 0.00 C ATOM 0 H VAL A 22 105.836 10.688 4.652 1.00 0.00 H new ATOM 0 HA VAL A 22 104.862 8.665 6.280 1.00 0.00 H new ATOM 0 HB VAL A 22 107.057 8.504 7.217 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.496 8.774 5.219 1.00 0.00 H new ATOM 0 HG12 VAL A 22 106.917 8.077 4.786 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.251 9.795 4.461 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.678 10.380 7.114 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.432 11.413 6.375 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.230 10.831 8.045 1.00 0.00 H new ATOM 355 N GLY A 23 104.947 11.552 7.843 1.00 0.00 N ATOM 356 CA GLY A 23 104.474 12.219 9.088 1.00 0.00 C ATOM 357 C GLY A 23 103.043 11.764 9.367 1.00 0.00 C ATOM 358 O GLY A 23 102.508 11.965 10.439 1.00 0.00 O ATOM 0 H GLY A 23 105.289 12.178 7.114 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.123 11.963 9.925 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.512 13.302 8.975 1.00 0.00 H new ATOM 362 N ARG A 24 102.425 11.142 8.399 1.00 0.00 N ATOM 363 CA ARG A 24 101.031 10.655 8.582 1.00 0.00 C ATOM 364 C ARG A 24 101.023 9.127 8.508 1.00 0.00 C ATOM 365 O ARG A 24 100.378 8.461 9.293 1.00 0.00 O ATOM 366 CB ARG A 24 100.141 11.225 7.475 1.00 0.00 C ATOM 367 CG ARG A 24 100.468 12.705 7.268 1.00 0.00 C ATOM 368 CD ARG A 24 99.660 13.247 6.087 1.00 0.00 C ATOM 369 NE ARG A 24 98.367 13.799 6.581 1.00 0.00 N ATOM 370 CZ ARG A 24 97.476 14.233 5.732 1.00 0.00 C ATOM 371 NH1 ARG A 24 97.717 14.184 4.451 1.00 0.00 N ATOM 372 NH2 ARG A 24 96.344 14.716 6.165 1.00 0.00 N ATOM 0 H ARG A 24 102.831 10.950 7.483 1.00 0.00 H new ATOM 0 HA ARG A 24 100.652 10.979 9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.298 10.674 6.548 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.091 11.108 7.742 1.00 0.00 H new ATOM 0 HG2 ARG A 24 100.235 13.269 8.171 1.00 0.00 H new ATOM 0 HG3 ARG A 24 101.534 12.830 7.080 1.00 0.00 H new ATOM 0 HD2 ARG A 24 100.226 14.023 5.571 1.00 0.00 H new ATOM 0 HD3 ARG A 24 99.476 12.453 5.364 1.00 0.00 H new ATOM 0 HE ARG A 24 98.178 13.838 7.583 1.00 0.00 H new ATOM 0 HH11 ARG A 24 98.602 13.806 4.113 1.00 0.00 H new ATOM 0 HH12 ARG A 24 97.020 14.523 3.788 1.00 0.00 H new ATOM 0 HH21 ARG A 24 96.156 14.754 7.167 1.00 0.00 H new ATOM 0 HH22 ARG A 24 95.647 15.055 5.502 1.00 0.00 H new ATOM 386 N TYR A 25 101.741 8.566 7.572 1.00 0.00 N ATOM 387 CA TYR A 25 101.780 7.082 7.452 1.00 0.00 C ATOM 388 C TYR A 25 102.994 6.544 8.208 1.00 0.00 C ATOM 389 O TYR A 25 102.994 5.426 8.684 1.00 0.00 O ATOM 390 CB TYR A 25 101.886 6.678 5.978 1.00 0.00 C ATOM 391 CG TYR A 25 101.093 7.635 5.120 1.00 0.00 C ATOM 392 CD1 TYR A 25 99.977 8.296 5.648 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.475 7.861 3.792 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.245 9.181 4.850 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.742 8.746 2.993 1.00 0.00 C ATOM 396 CZ TYR A 25 99.627 9.407 3.522 1.00 0.00 C ATOM 397 OH TYR A 25 98.904 10.280 2.735 1.00 0.00 O ATOM 0 H TYR A 25 102.301 9.072 6.886 1.00 0.00 H new ATOM 0 HA TYR A 25 100.865 6.666 7.874 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.931 6.678 5.667 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.514 5.662 5.843 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.681 8.122 6.672 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.336 7.352 3.384 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.385 9.690 5.258 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.037 8.919 1.968 1.00 0.00 H new ATOM 0 HH TYR A 25 99.366 11.143 2.694 1.00 0.00 H new ATOM 407 N LYS A 26 104.034 7.326 8.320 1.00 0.00 N ATOM 408 CA LYS A 26 105.244 6.847 9.043 1.00 0.00 C ATOM 409 C LYS A 26 105.741 5.556 8.390 1.00 0.00 C ATOM 410 O LYS A 26 106.691 4.947 8.840 1.00 0.00 O ATOM 411 CB LYS A 26 104.893 6.576 10.509 1.00 0.00 C ATOM 412 CG LYS A 26 103.679 7.418 10.912 1.00 0.00 C ATOM 413 CD LYS A 26 103.732 7.717 12.413 1.00 0.00 C ATOM 414 CE LYS A 26 103.377 6.454 13.201 1.00 0.00 C ATOM 415 NZ LYS A 26 104.085 6.471 14.512 1.00 0.00 N ATOM 0 H LYS A 26 104.097 8.272 7.943 1.00 0.00 H new ATOM 0 HA LYS A 26 106.024 7.607 8.994 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.677 5.517 10.652 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.743 6.817 11.147 1.00 0.00 H new ATOM 0 HG2 LYS A 26 103.667 8.350 10.346 1.00 0.00 H new ATOM 0 HG3 LYS A 26 102.759 6.886 10.670 1.00 0.00 H new ATOM 0 HD2 LYS A 26 104.728 8.063 12.690 1.00 0.00 H new ATOM 0 HD3 LYS A 26 103.036 8.519 12.659 1.00 0.00 H new ATOM 0 HE2 LYS A 26 102.300 6.401 13.358 1.00 0.00 H new ATOM 0 HE3 LYS A 26 103.660 5.567 12.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 103.844 5.613 15.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 105.112 6.502 14.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 103.794 7.310 15.053 1.00 0.00 H new ATOM 429 N ASN A 27 105.103 5.132 7.331 1.00 0.00 N ATOM 430 CA ASN A 27 105.538 3.881 6.653 1.00 0.00 C ATOM 431 C ASN A 27 106.621 4.208 5.624 1.00 0.00 C ATOM 432 O ASN A 27 106.687 5.302 5.101 1.00 0.00 O ATOM 433 CB ASN A 27 104.340 3.240 5.949 1.00 0.00 C ATOM 434 CG ASN A 27 103.654 2.257 6.899 1.00 0.00 C ATOM 435 OD1 ASN A 27 103.090 1.271 6.467 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.679 2.484 8.183 1.00 0.00 N ATOM 0 H ASN A 27 104.301 5.599 6.908 1.00 0.00 H new ATOM 0 HA ASN A 27 105.939 3.187 7.392 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.635 4.010 5.635 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.669 2.722 5.048 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.225 1.834 8.825 1.00 0.00 H new ATOM 0 HD22 ASN A 27 104.152 3.312 8.545 1.00 0.00 H new ATOM 443 N LYS A 28 107.469 3.263 5.332 1.00 0.00 N ATOM 444 CA LYS A 28 108.552 3.503 4.338 1.00 0.00 C ATOM 445 C LYS A 28 108.613 2.311 3.378 1.00 0.00 C ATOM 446 O LYS A 28 108.725 2.462 2.174 1.00 0.00 O ATOM 447 CB LYS A 28 109.885 3.639 5.072 1.00 0.00 C ATOM 448 CG LYS A 28 109.957 5.002 5.765 1.00 0.00 C ATOM 449 CD LYS A 28 109.337 4.902 7.161 1.00 0.00 C ATOM 450 CE LYS A 28 108.689 6.238 7.529 1.00 0.00 C ATOM 451 NZ LYS A 28 109.597 7.354 7.139 1.00 0.00 N ATOM 0 H LYS A 28 107.459 2.329 5.741 1.00 0.00 H new ATOM 0 HA LYS A 28 108.353 4.417 3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.989 2.841 5.807 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.711 3.534 4.368 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.994 5.329 5.839 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.428 5.750 5.174 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.592 4.106 7.184 1.00 0.00 H new ATOM 0 HD3 LYS A 28 110.102 4.643 7.893 1.00 0.00 H new ATOM 0 HE2 LYS A 28 107.730 6.341 7.022 1.00 0.00 H new ATOM 0 HE3 LYS A 28 108.489 6.275 8.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 109.331 8.215 7.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 110.579 7.100 7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 109.516 7.527 6.117 1.00 0.00 H new ATOM 465 N LYS A 29 108.532 1.125 3.917 1.00 0.00 N ATOM 466 CA LYS A 29 108.575 -0.103 3.074 1.00 0.00 C ATOM 467 C LYS A 29 107.293 -0.200 2.245 1.00 0.00 C ATOM 468 O LYS A 29 107.118 -1.098 1.449 1.00 0.00 O ATOM 469 CB LYS A 29 108.669 -1.329 3.988 1.00 0.00 C ATOM 470 CG LYS A 29 107.924 -1.061 5.298 1.00 0.00 C ATOM 471 CD LYS A 29 106.492 -0.612 4.997 1.00 0.00 C ATOM 472 CE LYS A 29 105.618 -0.829 6.234 1.00 0.00 C ATOM 473 NZ LYS A 29 106.307 -0.275 7.434 1.00 0.00 N ATOM 0 H LYS A 29 108.437 0.953 4.918 1.00 0.00 H new ATOM 0 HA LYS A 29 109.438 -0.061 2.409 1.00 0.00 H new ATOM 0 HB2 LYS A 29 108.243 -2.199 3.489 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.714 -1.560 4.195 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.911 -1.962 5.911 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.443 -0.293 5.872 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.482 0.440 4.712 1.00 0.00 H new ATOM 0 HD3 LYS A 29 106.093 -1.175 4.153 1.00 0.00 H new ATOM 0 HE2 LYS A 29 104.652 -0.343 6.099 1.00 0.00 H new ATOM 0 HE3 LYS A 29 105.423 -1.892 6.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 105.618 0.229 8.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 106.732 -1.052 7.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 107.052 0.385 7.133 1.00 0.00 H new ATOM 487 N PHE A 30 106.383 0.700 2.452 1.00 0.00 N ATOM 488 CA PHE A 30 105.090 0.642 1.708 1.00 0.00 C ATOM 489 C PHE A 30 105.276 0.959 0.214 1.00 0.00 C ATOM 490 O PHE A 30 105.275 0.080 -0.628 1.00 0.00 O ATOM 491 CB PHE A 30 104.202 1.729 2.314 1.00 0.00 C ATOM 492 CG PHE A 30 104.990 3.035 2.420 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.304 3.141 1.910 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.400 4.151 3.027 1.00 0.00 C ATOM 495 CE1 PHE A 30 107.001 4.346 2.008 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.108 5.357 3.124 1.00 0.00 C ATOM 497 CZ PHE A 30 106.407 5.453 2.612 1.00 0.00 C ATOM 0 H PHE A 30 106.473 1.478 3.105 1.00 0.00 H new ATOM 0 HA PHE A 30 104.665 -0.358 1.788 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.316 1.876 1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.855 1.421 3.300 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.770 2.286 1.443 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.397 4.082 3.421 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.004 4.421 1.615 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.650 6.214 3.595 1.00 0.00 H new ATOM 0 HZ PHE A 30 106.949 6.384 2.685 1.00 0.00 H new ATOM 507 N MET A 31 105.477 2.207 -0.107 1.00 0.00 N ATOM 508 CA MET A 31 105.702 2.610 -1.516 1.00 0.00 C ATOM 509 C MET A 31 107.152 2.336 -1.886 1.00 0.00 C ATOM 510 O MET A 31 107.454 1.781 -2.924 1.00 0.00 O ATOM 511 CB MET A 31 105.409 4.103 -1.663 1.00 0.00 C ATOM 512 CG MET A 31 106.071 4.636 -2.935 1.00 0.00 C ATOM 513 SD MET A 31 105.682 3.542 -4.323 1.00 0.00 S ATOM 514 CE MET A 31 105.710 4.803 -5.620 1.00 0.00 C ATOM 0 H MET A 31 105.494 2.976 0.563 1.00 0.00 H new ATOM 0 HA MET A 31 105.044 2.044 -2.175 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.333 4.270 -1.705 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.782 4.644 -0.793 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.719 5.646 -3.145 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.151 4.697 -2.798 1.00 0.00 H new ATOM 0 HE1 MET A 31 105.354 4.371 -6.555 1.00 0.00 H new ATOM 0 HE2 MET A 31 105.064 5.633 -5.334 1.00 0.00 H new ATOM 0 HE3 MET A 31 106.729 5.166 -5.753 1.00 0.00 H new ATOM 524 N GLN A 32 108.056 2.748 -1.039 1.00 0.00 N ATOM 525 CA GLN A 32 109.493 2.546 -1.325 1.00 0.00 C ATOM 526 C GLN A 32 109.851 1.068 -1.145 1.00 0.00 C ATOM 527 O GLN A 32 110.738 0.555 -1.793 1.00 0.00 O ATOM 528 CB GLN A 32 110.319 3.438 -0.393 1.00 0.00 C ATOM 529 CG GLN A 32 109.994 4.913 -0.664 1.00 0.00 C ATOM 530 CD GLN A 32 109.973 5.181 -2.171 1.00 0.00 C ATOM 531 OE1 GLN A 32 110.796 4.672 -2.905 1.00 0.00 O ATOM 532 NE2 GLN A 32 109.058 5.968 -2.667 1.00 0.00 N ATOM 0 H GLN A 32 107.853 3.218 -0.157 1.00 0.00 H new ATOM 0 HA GLN A 32 109.716 2.822 -2.356 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.102 3.193 0.647 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.382 3.256 -0.548 1.00 0.00 H new ATOM 0 HG2 GLN A 32 109.027 5.166 -0.229 1.00 0.00 H new ATOM 0 HG3 GLN A 32 110.736 5.551 -0.184 1.00 0.00 H new ATOM 0 HE21 GLN A 32 108.366 6.396 -2.052 1.00 0.00 H new ATOM 0 HE22 GLN A 32 109.035 6.155 -3.669 1.00 0.00 H new ATOM 541 N GLY A 33 109.171 0.364 -0.283 1.00 0.00 N ATOM 542 CA GLY A 33 109.497 -1.076 -0.119 1.00 0.00 C ATOM 543 C GLY A 33 109.042 -1.799 -1.381 1.00 0.00 C ATOM 544 O GLY A 33 109.641 -2.764 -1.810 1.00 0.00 O ATOM 0 H GLY A 33 108.416 0.718 0.305 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.568 -1.211 0.034 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.995 -1.485 0.758 1.00 0.00 H new ATOM 548 N THR A 34 107.988 -1.319 -1.988 1.00 0.00 N ATOM 549 CA THR A 34 107.488 -1.957 -3.235 1.00 0.00 C ATOM 550 C THR A 34 108.507 -1.749 -4.362 1.00 0.00 C ATOM 551 O THR A 34 108.741 -2.632 -5.162 1.00 0.00 O ATOM 552 CB THR A 34 106.150 -1.324 -3.632 1.00 0.00 C ATOM 553 OG1 THR A 34 106.072 -0.011 -3.095 1.00 0.00 O ATOM 554 CG2 THR A 34 105.000 -2.170 -3.083 1.00 0.00 C ATOM 0 H THR A 34 107.453 -0.511 -1.671 1.00 0.00 H new ATOM 0 HA THR A 34 107.349 -3.025 -3.065 1.00 0.00 H new ATOM 0 HB THR A 34 106.078 -1.278 -4.719 1.00 0.00 H new ATOM 0 HG1 THR A 34 106.901 0.473 -3.293 1.00 0.00 H new ATOM 0 HG21 THR A 34 104.049 -1.719 -3.366 1.00 0.00 H new ATOM 0 HG22 THR A 34 105.060 -3.177 -3.495 1.00 0.00 H new ATOM 0 HG23 THR A 34 105.070 -2.218 -1.996 1.00 0.00 H new ATOM 562 N VAL A 35 109.119 -0.593 -4.436 1.00 0.00 N ATOM 563 CA VAL A 35 110.118 -0.363 -5.521 1.00 0.00 C ATOM 564 C VAL A 35 111.352 -1.231 -5.258 1.00 0.00 C ATOM 565 O VAL A 35 111.847 -1.902 -6.140 1.00 0.00 O ATOM 566 CB VAL A 35 110.520 1.121 -5.583 1.00 0.00 C ATOM 567 CG1 VAL A 35 109.270 1.999 -5.576 1.00 0.00 C ATOM 568 CG2 VAL A 35 111.387 1.487 -4.381 1.00 0.00 C ATOM 0 H VAL A 35 108.972 0.191 -3.800 1.00 0.00 H new ATOM 0 HA VAL A 35 109.674 -0.635 -6.479 1.00 0.00 H new ATOM 0 HB VAL A 35 111.084 1.286 -6.501 1.00 0.00 H new ATOM 0 HG11 VAL A 35 109.562 3.048 -5.620 1.00 0.00 H new ATOM 0 HG12 VAL A 35 108.651 1.758 -6.440 1.00 0.00 H new ATOM 0 HG13 VAL A 35 108.703 1.818 -4.663 1.00 0.00 H new ATOM 0 HG21 VAL A 35 111.663 2.540 -4.439 1.00 0.00 H new ATOM 0 HG22 VAL A 35 110.829 1.308 -3.462 1.00 0.00 H new ATOM 0 HG23 VAL A 35 112.289 0.875 -4.383 1.00 0.00 H new ATOM 578 N ALA A 36 111.850 -1.235 -4.050 1.00 0.00 N ATOM 579 CA ALA A 36 113.044 -2.072 -3.749 1.00 0.00 C ATOM 580 C ALA A 36 112.835 -3.462 -4.350 1.00 0.00 C ATOM 581 O ALA A 36 113.635 -3.940 -5.130 1.00 0.00 O ATOM 582 CB ALA A 36 113.222 -2.185 -2.233 1.00 0.00 C ATOM 0 H ALA A 36 111.483 -0.698 -3.264 1.00 0.00 H new ATOM 0 HA ALA A 36 113.936 -1.615 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.096 -2.798 -2.014 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.360 -1.191 -1.808 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.337 -2.647 -1.796 1.00 0.00 H new ATOM 588 N VAL A 37 111.757 -4.109 -4.001 1.00 0.00 N ATOM 589 CA VAL A 37 111.490 -5.463 -4.565 1.00 0.00 C ATOM 590 C VAL A 37 111.438 -5.359 -6.089 1.00 0.00 C ATOM 591 O VAL A 37 111.975 -6.194 -6.796 1.00 0.00 O ATOM 592 CB VAL A 37 110.158 -6.005 -4.019 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.550 -4.987 -3.057 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.174 -6.263 -5.166 1.00 0.00 C ATOM 0 H VAL A 37 111.052 -3.760 -3.352 1.00 0.00 H new ATOM 0 HA VAL A 37 112.284 -6.150 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 37 110.350 -6.943 -3.498 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.606 -5.371 -2.670 1.00 0.00 H new ATOM 0 HG12 VAL A 37 110.238 -4.813 -2.229 1.00 0.00 H new ATOM 0 HG13 VAL A 37 109.372 -4.050 -3.584 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.237 -6.646 -4.762 1.00 0.00 H new ATOM 0 HG22 VAL A 37 108.985 -5.332 -5.700 1.00 0.00 H new ATOM 0 HG23 VAL A 37 109.599 -6.995 -5.853 1.00 0.00 H new ATOM 604 N CYS A 38 110.814 -4.333 -6.607 1.00 0.00 N ATOM 605 CA CYS A 38 110.760 -4.187 -8.082 1.00 0.00 C ATOM 606 C CYS A 38 112.186 -4.293 -8.606 1.00 0.00 C ATOM 607 O CYS A 38 112.432 -4.738 -9.707 1.00 0.00 O ATOM 608 CB CYS A 38 110.170 -2.825 -8.456 1.00 0.00 C ATOM 609 SG CYS A 38 108.517 -2.664 -7.736 1.00 0.00 S ATOM 0 H CYS A 38 110.346 -3.600 -6.075 1.00 0.00 H new ATOM 0 HA CYS A 38 110.129 -4.962 -8.518 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.816 -2.025 -8.093 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.117 -2.725 -9.540 1.00 0.00 H new ATOM 0 HG CYS A 38 108.610 -2.627 -6.440 1.00 0.00 H new ATOM 615 N ALA A 39 113.134 -3.881 -7.813 1.00 0.00 N ATOM 616 CA ALA A 39 114.551 -3.964 -8.242 1.00 0.00 C ATOM 617 C ALA A 39 115.075 -5.397 -8.067 1.00 0.00 C ATOM 618 O ALA A 39 115.675 -5.965 -8.957 1.00 0.00 O ATOM 619 CB ALA A 39 115.390 -3.010 -7.397 1.00 0.00 C ATOM 0 H ALA A 39 112.985 -3.489 -6.883 1.00 0.00 H new ATOM 0 HA ALA A 39 114.622 -3.687 -9.294 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.433 -3.068 -7.709 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.027 -1.991 -7.531 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.310 -3.289 -6.346 1.00 0.00 H new ATOM 625 N ARG A 40 114.881 -5.966 -6.905 1.00 0.00 N ATOM 626 CA ARG A 40 115.401 -7.340 -6.635 1.00 0.00 C ATOM 627 C ARG A 40 115.210 -8.251 -7.850 1.00 0.00 C ATOM 628 O ARG A 40 116.086 -9.018 -8.191 1.00 0.00 O ATOM 629 CB ARG A 40 114.671 -7.936 -5.431 1.00 0.00 C ATOM 630 CG ARG A 40 115.185 -9.356 -5.169 1.00 0.00 C ATOM 631 CD ARG A 40 114.208 -10.374 -5.760 1.00 0.00 C ATOM 632 NE ARG A 40 114.881 -11.698 -5.878 1.00 0.00 N ATOM 633 CZ ARG A 40 114.193 -12.751 -6.226 1.00 0.00 C ATOM 634 NH1 ARG A 40 112.916 -12.644 -6.470 1.00 0.00 N ATOM 635 NH2 ARG A 40 114.783 -13.910 -6.330 1.00 0.00 N ATOM 0 H ARG A 40 114.382 -5.535 -6.127 1.00 0.00 H new ATOM 0 HA ARG A 40 116.468 -7.267 -6.425 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.831 -7.313 -4.551 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.597 -7.956 -5.617 1.00 0.00 H new ATOM 0 HG2 ARG A 40 116.172 -9.484 -5.614 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.294 -9.522 -4.097 1.00 0.00 H new ATOM 0 HD2 ARG A 40 113.326 -10.458 -5.126 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.866 -10.039 -6.739 1.00 0.00 H new ATOM 0 HE ARG A 40 115.879 -11.781 -5.687 1.00 0.00 H new ATOM 0 HH11 ARG A 40 112.455 -11.738 -6.389 1.00 0.00 H new ATOM 0 HH12 ARG A 40 112.378 -13.467 -6.742 1.00 0.00 H new ATOM 0 HH21 ARG A 40 115.782 -13.993 -6.139 1.00 0.00 H new ATOM 0 HH22 ARG A 40 114.246 -14.733 -6.602 1.00 0.00 H new ATOM 649 N ILE A 41 114.083 -8.201 -8.501 1.00 0.00 N ATOM 650 CA ILE A 41 113.888 -9.096 -9.682 1.00 0.00 C ATOM 651 C ILE A 41 114.318 -8.397 -10.977 1.00 0.00 C ATOM 652 O ILE A 41 114.584 -9.040 -11.973 1.00 0.00 O ATOM 653 CB ILE A 41 112.420 -9.510 -9.793 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.531 -8.406 -9.224 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.197 -10.798 -9.007 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.880 -7.081 -9.896 1.00 0.00 C ATOM 0 H ILE A 41 113.298 -7.591 -8.274 1.00 0.00 H new ATOM 0 HA ILE A 41 114.508 -9.981 -9.539 1.00 0.00 H new ATOM 0 HB ILE A 41 112.167 -9.673 -10.841 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.481 -8.646 -9.391 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.673 -8.329 -8.146 1.00 0.00 H new ATOM 0 HG21 ILE A 41 111.151 -11.095 -9.085 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.830 -11.587 -9.414 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.451 -10.634 -7.960 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.247 -6.291 -9.492 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.926 -6.841 -9.706 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.716 -7.164 -10.970 1.00 0.00 H new ATOM 668 N ALA A 42 114.377 -7.093 -10.990 1.00 0.00 N ATOM 669 CA ALA A 42 114.775 -6.387 -12.240 1.00 0.00 C ATOM 670 C ALA A 42 116.296 -6.237 -12.287 1.00 0.00 C ATOM 671 O ALA A 42 116.845 -5.699 -13.227 1.00 0.00 O ATOM 672 CB ALA A 42 114.106 -5.012 -12.287 1.00 0.00 C ATOM 0 H ALA A 42 114.168 -6.490 -10.194 1.00 0.00 H new ATOM 0 HA ALA A 42 114.453 -6.968 -13.104 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.398 -4.496 -13.202 1.00 0.00 H new ATOM 0 HB2 ALA A 42 113.023 -5.134 -12.269 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.420 -4.425 -11.424 1.00 0.00 H new ATOM 678 N VAL A 43 116.978 -6.696 -11.270 1.00 0.00 N ATOM 679 CA VAL A 43 118.469 -6.571 -11.244 1.00 0.00 C ATOM 680 C VAL A 43 119.037 -6.616 -12.667 1.00 0.00 C ATOM 681 O VAL A 43 120.039 -5.998 -12.960 1.00 0.00 O ATOM 682 CB VAL A 43 119.062 -7.700 -10.397 1.00 0.00 C ATOM 683 CG1 VAL A 43 118.004 -8.238 -9.440 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.555 -8.836 -11.294 1.00 0.00 C ATOM 0 H VAL A 43 116.568 -7.153 -10.455 1.00 0.00 H new ATOM 0 HA VAL A 43 118.738 -5.612 -10.801 1.00 0.00 H new ATOM 0 HB VAL A 43 119.903 -7.303 -9.829 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.431 -9.041 -8.840 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.665 -7.436 -8.784 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.159 -8.622 -10.011 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.974 -9.631 -10.677 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.721 -9.229 -11.875 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.322 -8.459 -11.970 1.00 0.00 H new ATOM 694 N ALA A 44 118.412 -7.335 -13.552 1.00 0.00 N ATOM 695 CA ALA A 44 118.930 -7.409 -14.947 1.00 0.00 C ATOM 696 C ALA A 44 120.324 -8.038 -14.935 1.00 0.00 C ATOM 697 O ALA A 44 120.760 -8.626 -15.905 1.00 0.00 O ATOM 698 CB ALA A 44 119.010 -6.000 -15.538 1.00 0.00 C ATOM 0 H ALA A 44 117.566 -7.875 -13.373 1.00 0.00 H new ATOM 0 HA ALA A 44 118.260 -8.018 -15.554 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.389 -6.054 -16.559 1.00 0.00 H new ATOM 0 HB2 ALA A 44 118.017 -5.551 -15.543 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.681 -5.390 -14.934 1.00 0.00 H new ATOM 704 N SER A 45 121.027 -7.921 -13.841 1.00 0.00 N ATOM 705 CA SER A 45 122.390 -8.514 -13.762 1.00 0.00 C ATOM 706 C SER A 45 122.306 -10.017 -13.992 1.00 0.00 C ATOM 707 O SER A 45 121.568 -10.494 -14.831 1.00 0.00 O ATOM 708 CB SER A 45 122.981 -8.258 -12.378 1.00 0.00 C ATOM 709 OG SER A 45 124.397 -8.189 -12.478 1.00 0.00 O ATOM 0 H SER A 45 120.714 -7.439 -12.998 1.00 0.00 H new ATOM 0 HA SER A 45 123.023 -8.058 -14.523 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.588 -7.327 -11.968 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.692 -9.055 -11.693 1.00 0.00 H new ATOM 0 HG SER A 45 124.667 -7.266 -12.668 1.00 0.00 H new ATOM 715 N ASP A 46 123.059 -10.761 -13.242 1.00 0.00 N ATOM 716 CA ASP A 46 123.037 -12.242 -13.393 1.00 0.00 C ATOM 717 C ASP A 46 123.145 -12.890 -12.013 1.00 0.00 C ATOM 718 O ASP A 46 124.033 -13.678 -11.755 1.00 0.00 O ATOM 719 CB ASP A 46 124.218 -12.685 -14.260 1.00 0.00 C ATOM 720 CG ASP A 46 125.529 -12.290 -13.579 1.00 0.00 C ATOM 721 OD1 ASP A 46 125.897 -11.131 -13.673 1.00 0.00 O ATOM 722 OD2 ASP A 46 126.143 -13.154 -12.974 1.00 0.00 O ATOM 0 H ASP A 46 123.694 -10.409 -12.526 1.00 0.00 H new ATOM 0 HA ASP A 46 122.105 -12.548 -13.869 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.186 -13.764 -14.413 1.00 0.00 H new ATOM 0 HB3 ASP A 46 124.154 -12.222 -15.245 1.00 0.00 H new ATOM 727 N GLY A 47 122.252 -12.561 -11.119 1.00 0.00 N ATOM 728 CA GLY A 47 122.315 -13.157 -9.756 1.00 0.00 C ATOM 729 C GLY A 47 120.948 -13.062 -9.077 1.00 0.00 C ATOM 730 O GLY A 47 120.396 -14.049 -8.633 1.00 0.00 O ATOM 0 H GLY A 47 121.484 -11.907 -11.274 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.626 -14.200 -9.821 1.00 0.00 H new ATOM 0 HA3 GLY A 47 123.064 -12.638 -9.158 1.00 0.00 H new ATOM 734 N VAL A 48 120.402 -11.882 -8.985 1.00 0.00 N ATOM 735 CA VAL A 48 119.076 -11.723 -8.327 1.00 0.00 C ATOM 736 C VAL A 48 119.202 -12.056 -6.840 1.00 0.00 C ATOM 737 O VAL A 48 120.028 -12.853 -6.440 1.00 0.00 O ATOM 738 CB VAL A 48 118.059 -12.661 -8.979 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.643 -12.165 -8.682 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.281 -12.685 -10.493 1.00 0.00 C ATOM 0 H VAL A 48 120.817 -11.020 -9.338 1.00 0.00 H new ATOM 0 HA VAL A 48 118.738 -10.693 -8.441 1.00 0.00 H new ATOM 0 HB VAL A 48 118.185 -13.666 -8.577 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.918 -12.834 -9.147 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.482 -12.148 -7.604 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.518 -11.159 -9.083 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.556 -13.354 -10.957 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.156 -11.680 -10.895 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.289 -13.039 -10.707 1.00 0.00 H new ATOM 750 N SER A 49 118.393 -11.446 -6.018 1.00 0.00 N ATOM 751 CA SER A 49 118.470 -11.721 -4.556 1.00 0.00 C ATOM 752 C SER A 49 117.086 -12.107 -4.028 1.00 0.00 C ATOM 753 O SER A 49 116.394 -12.920 -4.608 1.00 0.00 O ATOM 754 CB SER A 49 118.961 -10.468 -3.830 1.00 0.00 C ATOM 755 OG SER A 49 117.852 -9.627 -3.542 1.00 0.00 O ATOM 0 H SER A 49 117.682 -10.769 -6.296 1.00 0.00 H new ATOM 0 HA SER A 49 119.164 -12.543 -4.379 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.471 -10.745 -2.908 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.685 -9.936 -4.447 1.00 0.00 H new ATOM 0 HG SER A 49 118.163 -8.824 -3.075 1.00 0.00 H new ATOM 761 N SER A 50 116.686 -11.530 -2.927 1.00 0.00 N ATOM 762 CA SER A 50 115.358 -11.854 -2.340 1.00 0.00 C ATOM 763 C SER A 50 115.428 -11.587 -0.839 1.00 0.00 C ATOM 764 O SER A 50 114.762 -10.715 -0.319 1.00 0.00 O ATOM 765 CB SER A 50 115.026 -13.327 -2.582 1.00 0.00 C ATOM 766 OG SER A 50 114.210 -13.805 -1.520 1.00 0.00 O ATOM 0 H SER A 50 117.229 -10.842 -2.406 1.00 0.00 H new ATOM 0 HA SER A 50 114.584 -11.242 -2.802 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.509 -13.443 -3.534 1.00 0.00 H new ATOM 0 HB3 SER A 50 115.943 -13.913 -2.644 1.00 0.00 H new ATOM 0 HG SER A 50 113.994 -14.749 -1.673 1.00 0.00 H new ATOM 772 N GLU A 51 116.247 -12.325 -0.144 1.00 0.00 N ATOM 773 CA GLU A 51 116.385 -12.110 1.321 1.00 0.00 C ATOM 774 C GLU A 51 117.134 -10.799 1.567 1.00 0.00 C ATOM 775 O GLU A 51 116.886 -10.105 2.530 1.00 0.00 O ATOM 776 CB GLU A 51 117.169 -13.271 1.937 1.00 0.00 C ATOM 777 CG GLU A 51 116.215 -14.428 2.240 1.00 0.00 C ATOM 778 CD GLU A 51 117.023 -15.678 2.593 1.00 0.00 C ATOM 779 OE1 GLU A 51 117.633 -16.238 1.697 1.00 0.00 O ATOM 780 OE2 GLU A 51 117.019 -16.053 3.754 1.00 0.00 O ATOM 0 H GLU A 51 116.828 -13.070 -0.529 1.00 0.00 H new ATOM 0 HA GLU A 51 115.397 -12.060 1.779 1.00 0.00 H new ATOM 0 HB2 GLU A 51 117.950 -13.600 1.252 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.664 -12.945 2.852 1.00 0.00 H new ATOM 0 HG2 GLU A 51 115.556 -14.163 3.067 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.580 -14.625 1.377 1.00 0.00 H new ATOM 787 N GLU A 52 118.055 -10.454 0.706 1.00 0.00 N ATOM 788 CA GLU A 52 118.817 -9.187 0.902 1.00 0.00 C ATOM 789 C GLU A 52 117.905 -7.991 0.624 1.00 0.00 C ATOM 790 O GLU A 52 117.782 -7.096 1.436 1.00 0.00 O ATOM 791 CB GLU A 52 120.001 -9.155 -0.062 1.00 0.00 C ATOM 792 CG GLU A 52 121.266 -9.639 0.652 1.00 0.00 C ATOM 793 CD GLU A 52 121.174 -11.147 0.890 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.237 -11.566 1.551 1.00 0.00 O ATOM 795 OE2 GLU A 52 122.041 -11.857 0.409 1.00 0.00 O ATOM 0 H GLU A 52 118.311 -10.993 -0.121 1.00 0.00 H new ATOM 0 HA GLU A 52 119.178 -9.136 1.929 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.795 -9.788 -0.926 1.00 0.00 H new ATOM 0 HB3 GLU A 52 120.149 -8.142 -0.437 1.00 0.00 H new ATOM 0 HG2 GLU A 52 122.146 -9.408 0.051 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.382 -9.117 1.602 1.00 0.00 H new ATOM 802 N LYS A 53 117.251 -7.968 -0.508 1.00 0.00 N ATOM 803 CA LYS A 53 116.343 -6.824 -0.799 1.00 0.00 C ATOM 804 C LYS A 53 115.363 -6.700 0.357 1.00 0.00 C ATOM 805 O LYS A 53 115.061 -5.622 0.826 1.00 0.00 O ATOM 806 CB LYS A 53 115.566 -7.076 -2.096 1.00 0.00 C ATOM 807 CG LYS A 53 114.329 -6.164 -2.142 1.00 0.00 C ATOM 808 CD LYS A 53 113.089 -6.903 -1.611 1.00 0.00 C ATOM 809 CE LYS A 53 112.850 -8.190 -2.405 1.00 0.00 C ATOM 810 NZ LYS A 53 113.411 -9.349 -1.654 1.00 0.00 N ATOM 0 H LYS A 53 117.306 -8.683 -1.234 1.00 0.00 H new ATOM 0 HA LYS A 53 116.925 -5.910 -0.917 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.205 -6.883 -2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.262 -8.121 -2.152 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.508 -5.269 -1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.152 -5.835 -3.166 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.224 -7.140 -0.556 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.214 -6.256 -1.683 1.00 0.00 H new ATOM 0 HE2 LYS A 53 111.783 -8.334 -2.572 1.00 0.00 H new ATOM 0 HE3 LYS A 53 113.319 -8.117 -3.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 112.913 -10.218 -1.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 114.424 -9.445 -1.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 113.288 -9.193 -0.633 1.00 0.00 H new ATOM 824 N GLN A 54 114.870 -7.814 0.820 1.00 0.00 N ATOM 825 CA GLN A 54 113.911 -7.801 1.950 1.00 0.00 C ATOM 826 C GLN A 54 114.520 -6.991 3.101 1.00 0.00 C ATOM 827 O GLN A 54 113.855 -6.195 3.740 1.00 0.00 O ATOM 828 CB GLN A 54 113.647 -9.251 2.376 1.00 0.00 C ATOM 829 CG GLN A 54 114.238 -9.511 3.760 1.00 0.00 C ATOM 830 CD GLN A 54 113.975 -10.962 4.165 1.00 0.00 C ATOM 831 OE1 GLN A 54 112.841 -11.360 4.343 1.00 0.00 O ATOM 832 NE2 GLN A 54 114.983 -11.777 4.319 1.00 0.00 N ATOM 0 H GLN A 54 115.095 -8.740 0.458 1.00 0.00 H new ATOM 0 HA GLN A 54 112.966 -7.340 1.662 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.574 -9.444 2.389 1.00 0.00 H new ATOM 0 HB3 GLN A 54 114.086 -9.936 1.651 1.00 0.00 H new ATOM 0 HG2 GLN A 54 115.310 -9.314 3.752 1.00 0.00 H new ATOM 0 HG3 GLN A 54 113.795 -8.833 4.489 1.00 0.00 H new ATOM 0 HE21 GLN A 54 115.935 -11.444 4.170 1.00 0.00 H new ATOM 0 HE22 GLN A 54 114.818 -12.747 4.588 1.00 0.00 H new ATOM 841 N LYS A 55 115.787 -7.174 3.356 1.00 0.00 N ATOM 842 CA LYS A 55 116.444 -6.403 4.445 1.00 0.00 C ATOM 843 C LYS A 55 116.432 -4.925 4.063 1.00 0.00 C ATOM 844 O LYS A 55 116.138 -4.064 4.868 1.00 0.00 O ATOM 845 CB LYS A 55 117.889 -6.880 4.611 1.00 0.00 C ATOM 846 CG LYS A 55 117.907 -8.206 5.377 1.00 0.00 C ATOM 847 CD LYS A 55 118.972 -9.130 4.782 1.00 0.00 C ATOM 848 CE LYS A 55 119.524 -10.044 5.877 1.00 0.00 C ATOM 849 NZ LYS A 55 118.461 -10.991 6.316 1.00 0.00 N ATOM 0 H LYS A 55 116.394 -7.824 2.857 1.00 0.00 H new ATOM 0 HA LYS A 55 115.912 -6.552 5.385 1.00 0.00 H new ATOM 0 HB2 LYS A 55 118.355 -7.006 3.634 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.471 -6.130 5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.116 -8.025 6.431 1.00 0.00 H new ATOM 0 HG3 LYS A 55 116.928 -8.682 5.323 1.00 0.00 H new ATOM 0 HD2 LYS A 55 118.542 -9.727 3.978 1.00 0.00 H new ATOM 0 HD3 LYS A 55 119.778 -8.540 4.346 1.00 0.00 H new ATOM 0 HE2 LYS A 55 120.387 -10.596 5.504 1.00 0.00 H new ATOM 0 HE3 LYS A 55 119.868 -9.449 6.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 118.877 -11.718 6.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 117.728 -10.471 6.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 118.035 -11.446 5.483 1.00 0.00 H new ATOM 863 N MET A 56 116.744 -4.628 2.831 1.00 0.00 N ATOM 864 CA MET A 56 116.746 -3.211 2.382 1.00 0.00 C ATOM 865 C MET A 56 115.390 -2.575 2.720 1.00 0.00 C ATOM 866 O MET A 56 115.313 -1.414 3.062 1.00 0.00 O ATOM 867 CB MET A 56 117.014 -3.168 0.867 1.00 0.00 C ATOM 868 CG MET A 56 115.853 -2.499 0.124 1.00 0.00 C ATOM 869 SD MET A 56 115.876 -0.719 0.455 1.00 0.00 S ATOM 870 CE MET A 56 114.087 -0.458 0.552 1.00 0.00 C ATOM 0 H MET A 56 116.998 -5.309 2.116 1.00 0.00 H new ATOM 0 HA MET A 56 117.528 -2.648 2.891 1.00 0.00 H new ATOM 0 HB2 MET A 56 117.938 -2.623 0.673 1.00 0.00 H new ATOM 0 HB3 MET A 56 117.156 -4.181 0.490 1.00 0.00 H new ATOM 0 HG2 MET A 56 115.938 -2.682 -0.947 1.00 0.00 H new ATOM 0 HG3 MET A 56 114.904 -2.928 0.447 1.00 0.00 H new ATOM 0 HE1 MET A 56 113.802 0.358 -0.112 1.00 0.00 H new ATOM 0 HE2 MET A 56 113.570 -1.369 0.251 1.00 0.00 H new ATOM 0 HE3 MET A 56 113.811 -0.206 1.576 1.00 0.00 H new ATOM 880 N ILE A 57 114.319 -3.324 2.646 1.00 0.00 N ATOM 881 CA ILE A 57 112.991 -2.735 2.989 1.00 0.00 C ATOM 882 C ILE A 57 112.996 -2.369 4.471 1.00 0.00 C ATOM 883 O ILE A 57 112.547 -1.311 4.860 1.00 0.00 O ATOM 884 CB ILE A 57 111.867 -3.735 2.696 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.295 -4.668 1.562 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.596 -2.981 2.276 1.00 0.00 C ATOM 887 CD1 ILE A 57 111.167 -5.657 1.260 1.00 0.00 C ATOM 0 H ILE A 57 114.306 -4.305 2.367 1.00 0.00 H new ATOM 0 HA ILE A 57 112.815 -1.846 2.383 1.00 0.00 H new ATOM 0 HB ILE A 57 111.664 -4.317 3.595 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.533 -4.088 0.670 1.00 0.00 H new ATOM 0 HG13 ILE A 57 113.200 -5.207 1.842 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.800 -3.696 2.069 1.00 0.00 H new ATOM 0 HG22 ILE A 57 110.285 -2.315 3.081 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.800 -2.395 1.380 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.472 -6.322 0.452 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.951 -6.245 2.152 1.00 0.00 H new ATOM 0 HD13 ILE A 57 110.273 -5.109 0.961 1.00 0.00 H new ATOM 899 N GLY A 58 113.529 -3.219 5.306 1.00 0.00 N ATOM 900 CA GLY A 58 113.585 -2.877 6.754 1.00 0.00 C ATOM 901 C GLY A 58 114.258 -1.509 6.885 1.00 0.00 C ATOM 902 O GLY A 58 113.823 -0.641 7.627 1.00 0.00 O ATOM 0 H GLY A 58 113.923 -4.125 5.052 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.582 -2.852 7.180 1.00 0.00 H new ATOM 0 HA3 GLY A 58 114.146 -3.633 7.304 1.00 0.00 H new ATOM 906 N PHE A 59 115.310 -1.304 6.139 1.00 0.00 N ATOM 907 CA PHE A 59 116.012 0.004 6.181 1.00 0.00 C ATOM 908 C PHE A 59 114.991 1.096 5.874 1.00 0.00 C ATOM 909 O PHE A 59 114.969 2.135 6.499 1.00 0.00 O ATOM 910 CB PHE A 59 117.127 0.005 5.128 1.00 0.00 C ATOM 911 CG PHE A 59 117.152 1.319 4.386 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.783 2.429 4.953 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.551 1.422 3.126 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.813 3.644 4.261 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.582 2.636 2.434 1.00 0.00 C ATOM 916 CZ PHE A 59 117.212 3.747 3.001 1.00 0.00 C ATOM 0 H PHE A 59 115.712 -1.991 5.501 1.00 0.00 H new ATOM 0 HA PHE A 59 116.456 0.180 7.161 1.00 0.00 H new ATOM 0 HB2 PHE A 59 118.090 -0.166 5.609 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.972 -0.813 4.425 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.247 2.349 5.925 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.063 0.563 2.689 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.300 4.503 4.699 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.119 2.715 1.461 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.235 4.685 2.467 1.00 0.00 H new ATOM 926 N LEU A 60 114.128 0.851 4.927 1.00 0.00 N ATOM 927 CA LEU A 60 113.085 1.855 4.589 1.00 0.00 C ATOM 928 C LEU A 60 112.346 2.230 5.869 1.00 0.00 C ATOM 929 O LEU A 60 112.122 3.388 6.155 1.00 0.00 O ATOM 930 CB LEU A 60 112.105 1.239 3.588 1.00 0.00 C ATOM 931 CG LEU A 60 112.071 2.043 2.280 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.489 2.459 1.860 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.461 1.163 1.191 1.00 0.00 C ATOM 0 H LEU A 60 114.102 -0.004 4.372 1.00 0.00 H new ATOM 0 HA LEU A 60 113.537 2.743 4.148 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.394 0.209 3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.107 1.207 4.025 1.00 0.00 H new ATOM 0 HG LEU A 60 111.477 2.945 2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.441 3.027 0.931 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.933 3.076 2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.100 1.569 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.428 1.716 0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.070 0.268 1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.450 0.876 1.479 1.00 0.00 H new ATOM 945 N ARG A 61 111.979 1.258 6.655 1.00 0.00 N ATOM 946 CA ARG A 61 111.271 1.569 7.921 1.00 0.00 C ATOM 947 C ARG A 61 112.057 2.655 8.650 1.00 0.00 C ATOM 948 O ARG A 61 111.494 3.544 9.257 1.00 0.00 O ATOM 949 CB ARG A 61 111.200 0.310 8.787 1.00 0.00 C ATOM 950 CG ARG A 61 110.530 -0.817 7.994 1.00 0.00 C ATOM 951 CD ARG A 61 109.066 -0.946 8.422 1.00 0.00 C ATOM 952 NE ARG A 61 108.988 -1.057 9.907 1.00 0.00 N ATOM 953 CZ ARG A 61 109.252 -2.193 10.491 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.584 -3.233 9.776 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.185 -2.290 11.791 1.00 0.00 N ATOM 0 H ARG A 61 112.139 0.267 6.475 1.00 0.00 H new ATOM 0 HA ARG A 61 110.257 1.913 7.717 1.00 0.00 H new ATOM 0 HB2 ARG A 61 112.202 0.009 9.092 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.637 0.513 9.698 1.00 0.00 H new ATOM 0 HG2 ARG A 61 110.590 -0.609 6.926 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.054 -1.757 8.166 1.00 0.00 H new ATOM 0 HD2 ARG A 61 108.499 -0.079 8.082 1.00 0.00 H new ATOM 0 HD3 ARG A 61 108.617 -1.824 7.957 1.00 0.00 H new ATOM 0 HE ARG A 61 108.728 -0.244 10.466 1.00 0.00 H new ATOM 0 HH11 ARG A 61 109.637 -3.158 8.760 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.790 -4.121 10.233 1.00 0.00 H new ATOM 0 HH21 ARG A 61 108.926 -1.477 12.350 1.00 0.00 H new ATOM 0 HH22 ARG A 61 109.391 -3.179 12.247 1.00 0.00 H new ATOM 969 N SER A 62 113.360 2.592 8.585 1.00 0.00 N ATOM 970 CA SER A 62 114.188 3.629 9.266 1.00 0.00 C ATOM 971 C SER A 62 114.936 4.482 8.226 1.00 0.00 C ATOM 972 O SER A 62 115.776 5.289 8.569 1.00 0.00 O ATOM 973 CB SER A 62 115.189 2.947 10.198 1.00 0.00 C ATOM 974 OG SER A 62 115.590 1.706 9.631 1.00 0.00 O ATOM 0 H SER A 62 113.885 1.870 8.092 1.00 0.00 H new ATOM 0 HA SER A 62 113.537 4.282 9.847 1.00 0.00 H new ATOM 0 HB2 SER A 62 116.057 3.588 10.349 1.00 0.00 H new ATOM 0 HB3 SER A 62 114.739 2.784 11.177 1.00 0.00 H new ATOM 0 HG SER A 62 116.233 1.267 10.226 1.00 0.00 H new ATOM 980 N SER A 63 114.651 4.297 6.959 1.00 0.00 N ATOM 981 CA SER A 63 115.355 5.083 5.897 1.00 0.00 C ATOM 982 C SER A 63 115.493 6.548 6.307 1.00 0.00 C ATOM 983 O SER A 63 115.056 6.957 7.362 1.00 0.00 O ATOM 984 CB SER A 63 114.570 5.013 4.587 1.00 0.00 C ATOM 985 OG SER A 63 113.195 4.797 4.870 1.00 0.00 O ATOM 0 H SER A 63 113.958 3.633 6.614 1.00 0.00 H new ATOM 0 HA SER A 63 116.347 4.652 5.763 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.696 5.939 4.025 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.955 4.207 3.963 1.00 0.00 H new ATOM 0 HG SER A 63 112.702 4.684 4.031 1.00 0.00 H new ATOM 991 N GLU A 64 116.098 7.344 5.466 1.00 0.00 N ATOM 992 CA GLU A 64 116.264 8.785 5.791 1.00 0.00 C ATOM 993 C GLU A 64 114.888 9.443 5.852 1.00 0.00 C ATOM 994 O GLU A 64 114.733 10.525 6.380 1.00 0.00 O ATOM 995 CB GLU A 64 117.110 9.461 4.708 1.00 0.00 C ATOM 996 CG GLU A 64 117.329 10.935 5.070 1.00 0.00 C ATOM 997 CD GLU A 64 118.824 11.259 5.027 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.599 10.452 5.512 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.168 12.309 4.508 1.00 0.00 O ATOM 0 H GLU A 64 116.484 7.055 4.567 1.00 0.00 H new ATOM 0 HA GLU A 64 116.765 8.890 6.753 1.00 0.00 H new ATOM 0 HB2 GLU A 64 118.070 8.953 4.613 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.611 9.384 3.742 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.788 11.575 4.373 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.931 11.138 6.064 1.00 0.00 H new ATOM 1006 N GLU A 65 113.882 8.792 5.326 1.00 0.00 N ATOM 1007 CA GLU A 65 112.513 9.378 5.369 1.00 0.00 C ATOM 1008 C GLU A 65 112.267 9.939 6.769 1.00 0.00 C ATOM 1009 O GLU A 65 111.316 10.655 7.011 1.00 0.00 O ATOM 1010 CB GLU A 65 111.479 8.288 5.065 1.00 0.00 C ATOM 1011 CG GLU A 65 111.423 8.024 3.554 1.00 0.00 C ATOM 1012 CD GLU A 65 112.009 6.643 3.250 1.00 0.00 C ATOM 1013 OE1 GLU A 65 111.406 5.663 3.656 1.00 0.00 O ATOM 1014 OE2 GLU A 65 113.051 6.590 2.617 1.00 0.00 O ATOM 0 H GLU A 65 113.951 7.882 4.870 1.00 0.00 H new ATOM 0 HA GLU A 65 112.423 10.172 4.627 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.739 7.371 5.593 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.497 8.596 5.425 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.392 8.078 3.204 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.982 8.792 3.020 1.00 0.00 H new ATOM 1021 N LEU A 66 113.131 9.616 7.690 1.00 0.00 N ATOM 1022 CA LEU A 66 112.978 10.122 9.083 1.00 0.00 C ATOM 1023 C LEU A 66 112.722 11.629 9.035 1.00 0.00 C ATOM 1024 O LEU A 66 112.088 12.194 9.905 1.00 0.00 O ATOM 1025 CB LEU A 66 114.276 9.859 9.857 1.00 0.00 C ATOM 1026 CG LEU A 66 114.251 8.469 10.511 1.00 0.00 C ATOM 1027 CD1 LEU A 66 113.471 7.478 9.641 1.00 0.00 C ATOM 1028 CD2 LEU A 66 115.690 7.968 10.673 1.00 0.00 C ATOM 0 H LEU A 66 113.943 9.018 7.536 1.00 0.00 H new ATOM 0 HA LEU A 66 112.146 9.617 9.574 1.00 0.00 H new ATOM 0 HB2 LEU A 66 115.128 9.932 9.182 1.00 0.00 H new ATOM 0 HB3 LEU A 66 114.409 10.623 10.623 1.00 0.00 H new ATOM 0 HG LEU A 66 113.763 8.545 11.483 1.00 0.00 H new ATOM 0 HD11 LEU A 66 113.464 6.499 10.121 1.00 0.00 H new ATOM 0 HD12 LEU A 66 112.446 7.829 9.519 1.00 0.00 H new ATOM 0 HD13 LEU A 66 113.946 7.400 8.663 1.00 0.00 H new ATOM 0 HD21 LEU A 66 115.682 6.982 11.137 1.00 0.00 H new ATOM 0 HD22 LEU A 66 116.166 7.905 9.694 1.00 0.00 H new ATOM 0 HD23 LEU A 66 116.248 8.661 11.303 1.00 0.00 H new ATOM 1040 N LYS A 67 113.221 12.281 8.022 1.00 0.00 N ATOM 1041 CA LYS A 67 113.024 13.754 7.901 1.00 0.00 C ATOM 1042 C LYS A 67 111.625 14.055 7.353 1.00 0.00 C ATOM 1043 O LYS A 67 110.942 14.923 7.854 1.00 0.00 O ATOM 1044 CB LYS A 67 114.079 14.338 6.958 1.00 0.00 C ATOM 1045 CG LYS A 67 114.321 13.376 5.789 1.00 0.00 C ATOM 1046 CD LYS A 67 113.807 13.994 4.494 1.00 0.00 C ATOM 1047 CE LYS A 67 113.564 12.879 3.475 1.00 0.00 C ATOM 1048 NZ LYS A 67 114.796 12.052 3.339 1.00 0.00 N ATOM 0 H LYS A 67 113.760 11.855 7.268 1.00 0.00 H new ATOM 0 HA LYS A 67 113.125 14.207 8.887 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.748 15.306 6.582 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.010 14.508 7.499 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.385 13.158 5.701 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.816 12.428 5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 67 112.884 14.543 4.679 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.531 14.709 4.104 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.729 12.256 3.794 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.292 13.307 2.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 114.867 11.692 2.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.630 12.634 3.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 114.752 11.252 4.002 1.00 0.00 H new ATOM 1062 N VAL A 68 111.195 13.351 6.331 1.00 0.00 N ATOM 1063 CA VAL A 68 109.837 13.605 5.761 1.00 0.00 C ATOM 1064 C VAL A 68 109.913 14.757 4.751 1.00 0.00 C ATOM 1065 O VAL A 68 109.107 15.661 4.788 1.00 0.00 O ATOM 1066 CB VAL A 68 108.872 13.982 6.902 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.420 13.895 6.426 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.074 13.023 8.082 1.00 0.00 C ATOM 0 H VAL A 68 111.727 12.613 5.869 1.00 0.00 H new ATOM 0 HA VAL A 68 109.476 12.708 5.258 1.00 0.00 H new ATOM 0 HB VAL A 68 109.083 15.005 7.213 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.752 14.164 7.244 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.268 14.581 5.593 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.204 12.877 6.101 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.391 13.290 8.889 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.873 12.002 7.759 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.102 13.095 8.438 1.00 0.00 H new ATOM 1078 N PHE A 69 110.870 14.735 3.845 1.00 0.00 N ATOM 1079 CA PHE A 69 110.972 15.854 2.854 1.00 0.00 C ATOM 1080 C PHE A 69 112.046 15.581 1.790 1.00 0.00 C ATOM 1081 O PHE A 69 111.752 15.500 0.615 1.00 0.00 O ATOM 1082 CB PHE A 69 111.340 17.151 3.580 1.00 0.00 C ATOM 1083 CG PHE A 69 110.166 17.655 4.383 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.066 18.230 3.735 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.179 17.549 5.779 1.00 0.00 C ATOM 1086 CE1 PHE A 69 107.980 18.699 4.483 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.093 18.016 6.527 1.00 0.00 C ATOM 1088 CZ PHE A 69 107.993 18.592 5.880 1.00 0.00 C ATOM 0 H PHE A 69 111.573 14.001 3.752 1.00 0.00 H new ATOM 0 HA PHE A 69 110.003 15.940 2.362 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.192 16.978 4.238 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.645 17.907 2.856 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.056 18.312 2.658 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.028 17.106 6.279 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.132 19.143 3.983 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.103 17.932 7.604 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.155 18.954 6.457 1.00 0.00 H new ATOM 1098 N ASP A 70 113.292 15.483 2.180 1.00 0.00 N ATOM 1099 CA ASP A 70 114.372 15.268 1.167 1.00 0.00 C ATOM 1100 C ASP A 70 113.979 14.155 0.196 1.00 0.00 C ATOM 1101 O ASP A 70 114.342 13.003 0.357 1.00 0.00 O ATOM 1102 CB ASP A 70 115.684 14.894 1.862 1.00 0.00 C ATOM 1103 CG ASP A 70 116.098 16.017 2.815 1.00 0.00 C ATOM 1104 OD1 ASP A 70 115.232 16.779 3.213 1.00 0.00 O ATOM 1105 OD2 ASP A 70 117.274 16.096 3.131 1.00 0.00 O ATOM 0 H ASP A 70 113.607 15.542 3.148 1.00 0.00 H new ATOM 0 HA ASP A 70 114.509 16.196 0.612 1.00 0.00 H new ATOM 0 HB2 ASP A 70 115.562 13.962 2.413 1.00 0.00 H new ATOM 0 HB3 ASP A 70 116.465 14.726 1.121 1.00 0.00 H new ATOM 1110 N THR A 71 113.253 14.504 -0.829 1.00 0.00 N ATOM 1111 CA THR A 71 112.843 13.491 -1.835 1.00 0.00 C ATOM 1112 C THR A 71 114.090 12.992 -2.563 1.00 0.00 C ATOM 1113 O THR A 71 114.187 11.840 -2.936 1.00 0.00 O ATOM 1114 CB THR A 71 111.885 14.132 -2.839 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.270 13.768 -4.157 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.931 15.653 -2.694 1.00 0.00 C ATOM 0 H THR A 71 112.925 15.452 -1.012 1.00 0.00 H new ATOM 0 HA THR A 71 112.342 12.657 -1.344 1.00 0.00 H new ATOM 0 HB THR A 71 110.871 13.783 -2.646 1.00 0.00 H new ATOM 0 HG1 THR A 71 111.717 14.252 -4.805 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.247 16.108 -3.411 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.634 15.931 -1.683 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.944 16.006 -2.885 1.00 0.00 H new ATOM 1124 N ALA A 72 115.050 13.855 -2.759 1.00 0.00 N ATOM 1125 CA ALA A 72 116.296 13.434 -3.453 1.00 0.00 C ATOM 1126 C ALA A 72 116.940 12.296 -2.662 1.00 0.00 C ATOM 1127 O ALA A 72 117.617 11.451 -3.210 1.00 0.00 O ATOM 1128 CB ALA A 72 117.264 14.616 -3.530 1.00 0.00 C ATOM 0 H ALA A 72 115.023 14.832 -2.468 1.00 0.00 H new ATOM 0 HA ALA A 72 116.062 13.098 -4.463 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.177 14.306 -4.039 1.00 0.00 H new ATOM 0 HB2 ALA A 72 116.799 15.432 -4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.507 14.954 -2.522 1.00 0.00 H new ATOM 1134 N GLU A 73 116.725 12.268 -1.374 1.00 0.00 N ATOM 1135 CA GLU A 73 117.314 11.184 -0.540 1.00 0.00 C ATOM 1136 C GLU A 73 116.551 9.883 -0.796 1.00 0.00 C ATOM 1137 O GLU A 73 117.133 8.830 -0.973 1.00 0.00 O ATOM 1138 CB GLU A 73 117.199 11.559 0.939 1.00 0.00 C ATOM 1139 CG GLU A 73 118.435 12.356 1.362 1.00 0.00 C ATOM 1140 CD GLU A 73 119.612 11.401 1.571 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.418 10.386 2.220 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.687 11.700 1.077 1.00 0.00 O ATOM 0 H GLU A 73 116.165 12.951 -0.864 1.00 0.00 H new ATOM 0 HA GLU A 73 118.364 11.051 -0.799 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.298 12.149 1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.108 10.659 1.547 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.683 13.094 0.599 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.230 12.904 2.282 1.00 0.00 H new ATOM 1149 N VAL A 74 115.247 9.949 -0.820 1.00 0.00 N ATOM 1150 CA VAL A 74 114.442 8.716 -1.066 1.00 0.00 C ATOM 1151 C VAL A 74 114.840 8.115 -2.422 1.00 0.00 C ATOM 1152 O VAL A 74 115.345 7.007 -2.504 1.00 0.00 O ATOM 1153 CB VAL A 74 112.953 9.075 -1.072 1.00 0.00 C ATOM 1154 CG1 VAL A 74 112.120 7.803 -0.919 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.644 10.024 0.095 1.00 0.00 C ATOM 0 H VAL A 74 114.704 10.801 -0.680 1.00 0.00 H new ATOM 0 HA VAL A 74 114.631 7.987 -0.279 1.00 0.00 H new ATOM 0 HB VAL A 74 112.707 9.564 -2.014 1.00 0.00 H new ATOM 0 HG11 VAL A 74 111.061 8.059 -0.923 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.333 7.127 -1.747 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.371 7.315 0.022 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.584 10.277 0.087 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.894 9.536 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.235 10.934 -0.010 1.00 0.00 H new ATOM 1165 N ILE A 75 114.634 8.839 -3.489 1.00 0.00 N ATOM 1166 CA ILE A 75 115.024 8.303 -4.821 1.00 0.00 C ATOM 1167 C ILE A 75 116.477 7.857 -4.748 1.00 0.00 C ATOM 1168 O ILE A 75 116.921 7.029 -5.507 1.00 0.00 O ATOM 1169 CB ILE A 75 114.890 9.389 -5.893 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.538 10.687 -5.390 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.412 9.634 -6.202 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.708 11.063 -6.302 1.00 0.00 C ATOM 0 H ILE A 75 114.216 9.770 -3.495 1.00 0.00 H new ATOM 0 HA ILE A 75 114.373 7.469 -5.083 1.00 0.00 H new ATOM 0 HB ILE A 75 115.393 9.062 -6.803 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.802 11.491 -5.375 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.889 10.557 -4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.323 10.407 -6.965 1.00 0.00 H new ATOM 0 HG22 ILE A 75 112.959 8.712 -6.565 1.00 0.00 H new ATOM 0 HG23 ILE A 75 112.900 9.958 -5.296 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.167 11.984 -5.944 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.448 10.262 -6.294 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.344 11.210 -7.319 1.00 0.00 H new ATOM 1184 N GLU A 76 117.222 8.411 -3.835 1.00 0.00 N ATOM 1185 CA GLU A 76 118.653 8.026 -3.708 1.00 0.00 C ATOM 1186 C GLU A 76 118.752 6.533 -3.415 1.00 0.00 C ATOM 1187 O GLU A 76 119.586 5.842 -3.965 1.00 0.00 O ATOM 1188 CB GLU A 76 119.302 8.811 -2.568 1.00 0.00 C ATOM 1189 CG GLU A 76 120.788 9.015 -2.869 1.00 0.00 C ATOM 1190 CD GLU A 76 120.968 10.266 -3.730 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.316 11.257 -3.445 1.00 0.00 O ATOM 1192 OE2 GLU A 76 121.755 10.212 -4.661 1.00 0.00 O ATOM 0 H GLU A 76 116.901 9.115 -3.170 1.00 0.00 H new ATOM 0 HA GLU A 76 119.170 8.252 -4.641 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.808 9.776 -2.450 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.181 8.274 -1.627 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.347 9.117 -1.939 1.00 0.00 H new ATOM 0 HG3 GLU A 76 121.188 8.143 -3.387 1.00 0.00 H new ATOM 1199 N PHE A 77 117.914 6.019 -2.554 1.00 0.00 N ATOM 1200 CA PHE A 77 117.995 4.568 -2.253 1.00 0.00 C ATOM 1201 C PHE A 77 117.435 3.771 -3.433 1.00 0.00 C ATOM 1202 O PHE A 77 118.135 2.972 -4.021 1.00 0.00 O ATOM 1203 CB PHE A 77 117.209 4.248 -0.979 1.00 0.00 C ATOM 1204 CG PHE A 77 115.877 3.642 -1.340 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.786 2.283 -1.667 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.735 4.443 -1.351 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.546 1.730 -2.003 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.499 3.894 -1.687 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.402 2.537 -2.013 1.00 0.00 C ATOM 0 H PHE A 77 117.189 6.535 -2.055 1.00 0.00 H new ATOM 0 HA PHE A 77 119.037 4.291 -2.095 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.776 3.557 -0.355 1.00 0.00 H new ATOM 0 HB3 PHE A 77 117.059 5.156 -0.395 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.671 1.664 -1.660 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.809 5.491 -1.099 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.471 0.682 -2.254 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.616 4.516 -1.696 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.444 2.112 -2.273 1.00 0.00 H new ATOM 1219 N PHE A 78 116.189 3.967 -3.806 1.00 0.00 N ATOM 1220 CA PHE A 78 115.670 3.180 -4.955 1.00 0.00 C ATOM 1221 C PHE A 78 116.540 3.441 -6.183 1.00 0.00 C ATOM 1222 O PHE A 78 116.911 2.529 -6.891 1.00 0.00 O ATOM 1223 CB PHE A 78 114.225 3.564 -5.264 1.00 0.00 C ATOM 1224 CG PHE A 78 113.670 2.601 -6.298 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.865 1.216 -6.158 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.971 3.093 -7.406 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.362 0.335 -7.122 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.466 2.209 -8.367 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.662 0.831 -8.226 1.00 0.00 C ATOM 0 H PHE A 78 115.533 4.618 -3.375 1.00 0.00 H new ATOM 0 HA PHE A 78 115.701 2.122 -4.696 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.623 3.529 -4.356 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.179 4.587 -5.638 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.404 0.831 -5.305 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.821 4.156 -7.520 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.515 -0.729 -7.013 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.924 2.592 -9.219 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.273 0.151 -8.969 1.00 0.00 H new ATOM 1239 N ASN A 79 116.874 4.675 -6.441 1.00 0.00 N ATOM 1240 CA ASN A 79 117.726 4.978 -7.627 1.00 0.00 C ATOM 1241 C ASN A 79 118.958 4.083 -7.590 1.00 0.00 C ATOM 1242 O ASN A 79 119.249 3.367 -8.527 1.00 0.00 O ATOM 1243 CB ASN A 79 118.176 6.441 -7.590 1.00 0.00 C ATOM 1244 CG ASN A 79 119.207 6.687 -8.693 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.637 5.764 -9.356 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.625 7.903 -8.920 1.00 0.00 N ATOM 0 H ASN A 79 116.596 5.484 -5.885 1.00 0.00 H new ATOM 0 HA ASN A 79 117.153 4.800 -8.537 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.318 7.100 -7.726 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.607 6.675 -6.616 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.312 8.078 -9.653 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.264 8.678 -8.364 1.00 0.00 H new ATOM 1253 N LYS A 80 119.680 4.111 -6.509 1.00 0.00 N ATOM 1254 CA LYS A 80 120.886 3.255 -6.410 1.00 0.00 C ATOM 1255 C LYS A 80 120.464 1.795 -6.565 1.00 0.00 C ATOM 1256 O LYS A 80 121.176 0.988 -7.126 1.00 0.00 O ATOM 1257 CB LYS A 80 121.549 3.463 -5.049 1.00 0.00 C ATOM 1258 CG LYS A 80 122.505 4.658 -5.125 1.00 0.00 C ATOM 1259 CD LYS A 80 123.844 4.215 -5.721 1.00 0.00 C ATOM 1260 CE LYS A 80 124.466 3.135 -4.837 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.941 3.337 -4.767 1.00 0.00 N ATOM 0 H LYS A 80 119.486 4.689 -5.691 1.00 0.00 H new ATOM 0 HA LYS A 80 121.597 3.517 -7.193 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.791 3.638 -4.286 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.094 2.565 -4.757 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.068 5.447 -5.737 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.660 5.075 -4.130 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.695 3.832 -6.731 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.518 5.068 -5.800 1.00 0.00 H new ATOM 0 HE2 LYS A 80 124.035 3.176 -3.837 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.242 2.147 -5.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.364 2.602 -4.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.345 3.277 -5.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.144 4.274 -4.364 1.00 0.00 H new ATOM 1275 N LEU A 81 119.306 1.449 -6.073 1.00 0.00 N ATOM 1276 CA LEU A 81 118.841 0.040 -6.195 1.00 0.00 C ATOM 1277 C LEU A 81 118.633 -0.312 -7.676 1.00 0.00 C ATOM 1278 O LEU A 81 119.178 -1.272 -8.172 1.00 0.00 O ATOM 1279 CB LEU A 81 117.514 -0.137 -5.433 1.00 0.00 C ATOM 1280 CG LEU A 81 117.694 0.073 -3.917 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.860 -0.967 -3.164 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.166 -0.069 -3.501 1.00 0.00 C ATOM 0 H LEU A 81 118.664 2.080 -5.593 1.00 0.00 H new ATOM 0 HA LEU A 81 119.594 -0.623 -5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.779 0.572 -5.814 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.119 -1.136 -5.618 1.00 0.00 H new ATOM 0 HG LEU A 81 117.364 1.082 -3.671 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.983 -0.824 -2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.809 -0.850 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.194 -1.968 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.257 0.085 -2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.521 -1.067 -3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.766 0.674 -4.026 1.00 0.00 H new ATOM 1294 N VAL A 82 117.848 0.446 -8.390 1.00 0.00 N ATOM 1295 CA VAL A 82 117.617 0.117 -9.829 1.00 0.00 C ATOM 1296 C VAL A 82 118.929 0.180 -10.615 1.00 0.00 C ATOM 1297 O VAL A 82 119.269 -0.726 -11.339 1.00 0.00 O ATOM 1298 CB VAL A 82 116.623 1.109 -10.430 1.00 0.00 C ATOM 1299 CG1 VAL A 82 115.231 0.832 -9.865 1.00 0.00 C ATOM 1300 CG2 VAL A 82 117.047 2.535 -10.076 1.00 0.00 C ATOM 0 H VAL A 82 117.359 1.272 -8.046 1.00 0.00 H new ATOM 0 HA VAL A 82 117.216 -0.895 -9.891 1.00 0.00 H new ATOM 0 HB VAL A 82 116.605 0.998 -11.514 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.518 1.538 -10.291 1.00 0.00 H new ATOM 0 HG12 VAL A 82 114.931 -0.185 -10.119 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.249 0.945 -8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.338 3.243 -10.505 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.065 2.651 -8.992 1.00 0.00 H new ATOM 0 HG23 VAL A 82 118.041 2.729 -10.478 1.00 0.00 H new ATOM 1310 N THR A 83 119.658 1.247 -10.508 1.00 0.00 N ATOM 1311 CA THR A 83 120.929 1.346 -11.286 1.00 0.00 C ATOM 1312 C THR A 83 122.032 0.465 -10.669 1.00 0.00 C ATOM 1313 O THR A 83 122.753 -0.213 -11.374 1.00 0.00 O ATOM 1314 CB THR A 83 121.391 2.803 -11.319 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.195 3.017 -12.470 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.202 3.107 -10.065 1.00 0.00 C ATOM 0 H THR A 83 119.437 2.053 -9.922 1.00 0.00 H new ATOM 0 HA THR A 83 120.741 0.991 -12.299 1.00 0.00 H new ATOM 0 HB THR A 83 120.523 3.461 -11.356 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.491 3.951 -12.494 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.532 4.146 -10.088 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.583 2.942 -9.183 1.00 0.00 H new ATOM 0 HG23 THR A 83 123.072 2.451 -10.026 1.00 0.00 H new ATOM 1324 N SER A 84 122.195 0.491 -9.373 1.00 0.00 N ATOM 1325 CA SER A 84 123.282 -0.323 -8.738 1.00 0.00 C ATOM 1326 C SER A 84 122.906 -1.809 -8.637 1.00 0.00 C ATOM 1327 O SER A 84 123.768 -2.656 -8.510 1.00 0.00 O ATOM 1328 CB SER A 84 123.559 0.209 -7.331 1.00 0.00 C ATOM 1329 OG SER A 84 123.333 1.612 -7.304 1.00 0.00 O ATOM 0 H SER A 84 121.627 1.037 -8.726 1.00 0.00 H new ATOM 0 HA SER A 84 124.167 -0.237 -9.369 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.912 -0.289 -6.608 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.587 -0.011 -7.043 1.00 0.00 H new ATOM 0 HG SER A 84 123.932 2.052 -7.942 1.00 0.00 H new ATOM 1335 N PHE A 85 121.646 -2.141 -8.649 1.00 0.00 N ATOM 1336 CA PHE A 85 121.268 -3.580 -8.504 1.00 0.00 C ATOM 1337 C PHE A 85 121.627 -4.391 -9.755 1.00 0.00 C ATOM 1338 O PHE A 85 121.288 -5.549 -9.857 1.00 0.00 O ATOM 1339 CB PHE A 85 119.771 -3.715 -8.201 1.00 0.00 C ATOM 1340 CG PHE A 85 118.945 -3.598 -9.465 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.467 -3.004 -10.622 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.650 -4.122 -9.480 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.693 -2.939 -11.788 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.876 -4.051 -10.643 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.399 -3.462 -11.798 1.00 0.00 C ATOM 0 H PHE A 85 120.868 -1.490 -8.751 1.00 0.00 H new ATOM 0 HA PHE A 85 121.840 -3.984 -7.668 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.579 -4.677 -7.725 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.469 -2.943 -7.493 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.467 -2.596 -10.615 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.245 -4.583 -8.591 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.098 -2.484 -12.680 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.873 -4.452 -10.649 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.802 -3.412 -12.697 1.00 0.00 H new ATOM 1355 N ASP A 86 122.299 -3.818 -10.714 1.00 0.00 N ATOM 1356 CA ASP A 86 122.641 -4.623 -11.919 1.00 0.00 C ATOM 1357 C ASP A 86 123.972 -5.342 -11.691 1.00 0.00 C ATOM 1358 O ASP A 86 124.526 -5.948 -12.586 1.00 0.00 O ATOM 1359 CB ASP A 86 122.732 -3.737 -13.155 1.00 0.00 C ATOM 1360 CG ASP A 86 123.389 -2.404 -12.791 1.00 0.00 C ATOM 1361 OD1 ASP A 86 123.927 -2.310 -11.700 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.343 -1.500 -13.609 1.00 0.00 O ATOM 0 H ASP A 86 122.620 -2.850 -10.718 1.00 0.00 H new ATOM 0 HA ASP A 86 121.853 -5.357 -12.085 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.311 -4.238 -13.931 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.736 -3.563 -13.563 1.00 0.00 H new ATOM 1367 N PHE A 87 124.471 -5.303 -10.487 1.00 0.00 N ATOM 1368 CA PHE A 87 125.746 -6.008 -10.174 1.00 0.00 C ATOM 1369 C PHE A 87 125.531 -6.816 -8.894 1.00 0.00 C ATOM 1370 O PHE A 87 125.307 -8.010 -8.932 1.00 0.00 O ATOM 1371 CB PHE A 87 126.887 -4.988 -9.984 1.00 0.00 C ATOM 1372 CG PHE A 87 127.702 -5.326 -8.749 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.046 -6.656 -8.467 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.097 -4.307 -7.869 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.772 -6.959 -7.316 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.832 -4.618 -6.721 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.167 -5.946 -6.445 1.00 0.00 C ATOM 0 H PHE A 87 124.048 -4.810 -9.701 1.00 0.00 H new ATOM 0 HA PHE A 87 126.026 -6.670 -10.994 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.531 -4.987 -10.863 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.473 -3.984 -9.890 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.749 -7.445 -9.141 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.833 -3.281 -8.079 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.030 -7.985 -7.098 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.141 -3.832 -6.048 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.732 -6.187 -5.557 1.00 0.00 H new ATOM 1387 N ASP A 88 125.591 -6.175 -7.761 1.00 0.00 N ATOM 1388 CA ASP A 88 125.381 -6.904 -6.482 1.00 0.00 C ATOM 1389 C ASP A 88 123.904 -6.837 -6.113 1.00 0.00 C ATOM 1390 O ASP A 88 123.465 -5.945 -5.416 1.00 0.00 O ATOM 1391 CB ASP A 88 126.203 -6.253 -5.376 1.00 0.00 C ATOM 1392 CG ASP A 88 126.298 -4.747 -5.629 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.559 -4.259 -6.467 1.00 0.00 O ATOM 1394 OD2 ASP A 88 127.107 -4.108 -4.979 1.00 0.00 O ATOM 0 H ASP A 88 125.777 -5.177 -7.666 1.00 0.00 H new ATOM 0 HA ASP A 88 125.693 -7.942 -6.598 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.741 -6.441 -4.407 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.201 -6.691 -5.344 1.00 0.00 H new ATOM 1399 N LEU A 89 123.131 -7.769 -6.581 1.00 0.00 N ATOM 1400 CA LEU A 89 121.683 -7.757 -6.268 1.00 0.00 C ATOM 1401 C LEU A 89 121.493 -7.846 -4.754 1.00 0.00 C ATOM 1402 O LEU A 89 120.808 -7.041 -4.155 1.00 0.00 O ATOM 1403 CB LEU A 89 121.011 -8.950 -6.952 1.00 0.00 C ATOM 1404 CG LEU A 89 121.444 -9.045 -8.432 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.077 -7.737 -8.913 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.465 -10.166 -8.617 1.00 0.00 C ATOM 0 H LEU A 89 123.442 -8.542 -7.170 1.00 0.00 H new ATOM 0 HA LEU A 89 121.231 -6.834 -6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.275 -9.870 -6.431 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.928 -8.848 -6.891 1.00 0.00 H new ATOM 0 HG LEU A 89 120.547 -9.249 -9.017 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.370 -7.837 -9.958 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.355 -6.926 -8.815 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.957 -7.515 -8.309 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.760 -10.220 -9.665 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.343 -9.964 -8.003 1.00 0.00 H new ATOM 0 HD23 LEU A 89 122.022 -11.115 -8.315 1.00 0.00 H new ATOM 1418 N GLU A 90 122.088 -8.821 -4.130 1.00 0.00 N ATOM 1419 CA GLU A 90 121.935 -8.966 -2.655 1.00 0.00 C ATOM 1420 C GLU A 90 122.850 -7.982 -1.913 1.00 0.00 C ATOM 1421 O GLU A 90 122.435 -7.310 -0.989 1.00 0.00 O ATOM 1422 CB GLU A 90 122.302 -10.395 -2.248 1.00 0.00 C ATOM 1423 CG GLU A 90 122.417 -11.266 -3.496 1.00 0.00 C ATOM 1424 CD GLU A 90 123.775 -11.031 -4.162 1.00 0.00 C ATOM 1425 OE1 GLU A 90 124.775 -11.393 -3.566 1.00 0.00 O ATOM 1426 OE2 GLU A 90 123.790 -10.492 -5.257 1.00 0.00 O ATOM 0 H GLU A 90 122.675 -9.526 -4.577 1.00 0.00 H new ATOM 0 HA GLU A 90 120.900 -8.751 -2.390 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.245 -10.398 -1.701 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.544 -10.800 -1.578 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.308 -12.317 -3.229 1.00 0.00 H new ATOM 0 HG3 GLU A 90 121.613 -11.029 -4.193 1.00 0.00 H new ATOM 1433 N ILE A 91 124.097 -7.919 -2.288 1.00 0.00 N ATOM 1434 CA ILE A 91 125.048 -7.011 -1.580 1.00 0.00 C ATOM 1435 C ILE A 91 124.818 -5.549 -1.980 1.00 0.00 C ATOM 1436 O ILE A 91 125.080 -4.641 -1.215 1.00 0.00 O ATOM 1437 CB ILE A 91 126.481 -7.413 -1.942 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.492 -8.872 -2.406 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.394 -7.258 -0.724 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.920 -9.412 -2.368 1.00 0.00 C ATOM 0 H ILE A 91 124.501 -8.457 -3.055 1.00 0.00 H new ATOM 0 HA ILE A 91 124.884 -7.103 -0.506 1.00 0.00 H new ATOM 0 HB ILE A 91 126.845 -6.767 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.848 -9.473 -1.764 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.092 -8.945 -3.417 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.410 -7.546 -0.992 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.387 -6.219 -0.394 1.00 0.00 H new ATOM 0 HG23 ILE A 91 127.036 -7.898 0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.925 -10.451 -2.699 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.551 -8.818 -3.029 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.304 -9.354 -1.350 1.00 0.00 H new ATOM 1452 N GLY A 92 124.358 -5.308 -3.175 1.00 0.00 N ATOM 1453 CA GLY A 92 124.147 -3.897 -3.622 1.00 0.00 C ATOM 1454 C GLY A 92 123.175 -3.172 -2.685 1.00 0.00 C ATOM 1455 O GLY A 92 123.469 -2.110 -2.175 1.00 0.00 O ATOM 0 H GLY A 92 124.119 -6.022 -3.862 1.00 0.00 H new ATOM 0 HA2 GLY A 92 125.101 -3.370 -3.643 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.755 -3.887 -4.639 1.00 0.00 H new ATOM 1459 N LYS A 93 122.017 -3.728 -2.467 1.00 0.00 N ATOM 1460 CA LYS A 93 121.022 -3.059 -1.577 1.00 0.00 C ATOM 1461 C LYS A 93 121.408 -3.256 -0.106 1.00 0.00 C ATOM 1462 O LYS A 93 120.914 -2.570 0.769 1.00 0.00 O ATOM 1463 CB LYS A 93 119.620 -3.644 -1.816 1.00 0.00 C ATOM 1464 CG LYS A 93 119.704 -4.961 -2.603 1.00 0.00 C ATOM 1465 CD LYS A 93 119.437 -4.699 -4.090 1.00 0.00 C ATOM 1466 CE LYS A 93 120.705 -4.165 -4.760 1.00 0.00 C ATOM 1467 NZ LYS A 93 120.950 -2.763 -4.318 1.00 0.00 N ATOM 0 H LYS A 93 121.714 -4.617 -2.865 1.00 0.00 H new ATOM 0 HA LYS A 93 121.015 -1.994 -1.808 1.00 0.00 H new ATOM 0 HB2 LYS A 93 119.126 -3.817 -0.860 1.00 0.00 H new ATOM 0 HB3 LYS A 93 119.010 -2.926 -2.364 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.689 -5.409 -2.475 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.977 -5.674 -2.214 1.00 0.00 H new ATOM 0 HD2 LYS A 93 119.117 -5.619 -4.579 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.626 -3.980 -4.202 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.557 -4.793 -4.501 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.599 -4.202 -5.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 121.955 -2.645 -4.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.697 -2.108 -5.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.369 -2.556 -3.481 1.00 0.00 H new ATOM 1481 N GLY A 94 122.269 -4.193 0.175 1.00 0.00 N ATOM 1482 CA GLY A 94 122.663 -4.444 1.592 1.00 0.00 C ATOM 1483 C GLY A 94 123.412 -3.240 2.183 1.00 0.00 C ATOM 1484 O GLY A 94 123.066 -2.752 3.241 1.00 0.00 O ATOM 0 H GLY A 94 122.718 -4.797 -0.514 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.774 -4.651 2.188 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.295 -5.330 1.645 1.00 0.00 H new ATOM 1488 N GLU A 95 124.446 -2.767 1.534 1.00 0.00 N ATOM 1489 CA GLU A 95 125.208 -1.610 2.103 1.00 0.00 C ATOM 1490 C GLU A 95 124.571 -0.285 1.681 1.00 0.00 C ATOM 1491 O GLU A 95 124.460 0.636 2.467 1.00 0.00 O ATOM 1492 CB GLU A 95 126.656 -1.640 1.601 1.00 0.00 C ATOM 1493 CG GLU A 95 127.374 -0.354 2.035 1.00 0.00 C ATOM 1494 CD GLU A 95 127.235 -0.180 3.548 1.00 0.00 C ATOM 1495 OE1 GLU A 95 127.154 -1.185 4.235 1.00 0.00 O ATOM 1496 OE2 GLU A 95 127.214 0.955 3.995 1.00 0.00 O ATOM 0 H GLU A 95 124.794 -3.126 0.645 1.00 0.00 H new ATOM 0 HA GLU A 95 125.187 -1.692 3.190 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.173 -2.511 2.002 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.674 -1.731 0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 95 128.427 -0.402 1.759 1.00 0.00 H new ATOM 0 HG3 GLU A 95 126.947 0.506 1.518 1.00 0.00 H new ATOM 1503 N THR A 96 124.177 -0.166 0.447 1.00 0.00 N ATOM 1504 CA THR A 96 123.579 1.117 -0.011 1.00 0.00 C ATOM 1505 C THR A 96 122.493 1.570 0.967 1.00 0.00 C ATOM 1506 O THR A 96 122.480 2.702 1.415 1.00 0.00 O ATOM 1507 CB THR A 96 122.986 0.939 -1.405 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.332 -0.317 -1.483 1.00 0.00 O ATOM 1509 CG2 THR A 96 124.112 1.003 -2.436 1.00 0.00 C ATOM 0 H THR A 96 124.242 -0.897 -0.262 1.00 0.00 H new ATOM 0 HA THR A 96 124.357 1.880 -0.048 1.00 0.00 H new ATOM 0 HB THR A 96 122.263 1.730 -1.605 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.881 -0.940 -2.004 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.697 0.877 -3.436 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.611 1.970 -2.370 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.832 0.208 -2.239 1.00 0.00 H new ATOM 1517 N MET A 97 121.588 0.697 1.312 1.00 0.00 N ATOM 1518 CA MET A 97 120.512 1.085 2.266 1.00 0.00 C ATOM 1519 C MET A 97 121.154 1.683 3.522 1.00 0.00 C ATOM 1520 O MET A 97 120.539 2.434 4.263 1.00 0.00 O ATOM 1521 CB MET A 97 119.715 -0.164 2.647 1.00 0.00 C ATOM 1522 CG MET A 97 120.623 -1.138 3.398 1.00 0.00 C ATOM 1523 SD MET A 97 120.550 -0.786 5.172 1.00 0.00 S ATOM 1524 CE MET A 97 119.718 -2.312 5.672 1.00 0.00 C ATOM 0 H MET A 97 121.547 -0.265 0.976 1.00 0.00 H new ATOM 0 HA MET A 97 119.849 1.819 1.808 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.864 0.111 3.270 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.314 -0.640 1.752 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.310 -2.164 3.207 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.648 -1.046 3.040 1.00 0.00 H new ATOM 0 HE1 MET A 97 119.569 -2.308 6.752 1.00 0.00 H new ATOM 0 HE2 MET A 97 118.752 -2.380 5.172 1.00 0.00 H new ATOM 0 HE3 MET A 97 120.332 -3.169 5.394 1.00 0.00 H new ATOM 1534 N LYS A 98 122.388 1.343 3.766 1.00 0.00 N ATOM 1535 CA LYS A 98 123.092 1.858 4.972 1.00 0.00 C ATOM 1536 C LYS A 98 123.490 3.326 4.796 1.00 0.00 C ATOM 1537 O LYS A 98 123.318 4.125 5.692 1.00 0.00 O ATOM 1538 CB LYS A 98 124.354 1.024 5.206 1.00 0.00 C ATOM 1539 CG LYS A 98 124.494 0.705 6.696 1.00 0.00 C ATOM 1540 CD LYS A 98 125.703 -0.208 6.910 1.00 0.00 C ATOM 1541 CE LYS A 98 125.271 -1.669 6.768 1.00 0.00 C ATOM 1542 NZ LYS A 98 124.584 -2.108 8.015 1.00 0.00 N ATOM 0 H LYS A 98 122.944 0.724 3.176 1.00 0.00 H new ATOM 0 HA LYS A 98 122.417 1.783 5.825 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.303 0.100 4.630 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.231 1.569 4.857 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.615 1.626 7.266 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.589 0.220 7.062 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.481 0.025 6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.130 -0.038 7.899 1.00 0.00 H new ATOM 0 HE2 LYS A 98 124.603 -1.780 5.914 1.00 0.00 H new ATOM 0 HE3 LYS A 98 126.140 -2.299 6.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 124.533 -3.147 8.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 125.117 -1.771 8.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 123.622 -1.713 8.039 1.00 0.00 H new ATOM 1556 N TYR A 99 124.046 3.696 3.673 1.00 0.00 N ATOM 1557 CA TYR A 99 124.465 5.117 3.514 1.00 0.00 C ATOM 1558 C TYR A 99 123.247 6.040 3.578 1.00 0.00 C ATOM 1559 O TYR A 99 123.348 7.161 4.037 1.00 0.00 O ATOM 1560 CB TYR A 99 125.239 5.313 2.202 1.00 0.00 C ATOM 1561 CG TYR A 99 124.300 5.464 1.034 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.554 6.634 0.867 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.197 4.429 0.104 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.700 6.765 -0.235 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.343 4.554 -0.996 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.593 5.724 -1.166 1.00 0.00 C ATOM 1567 OH TYR A 99 121.750 5.853 -2.252 1.00 0.00 O ATOM 0 H TYR A 99 124.225 3.088 2.874 1.00 0.00 H new ATOM 0 HA TYR A 99 125.133 5.376 4.336 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.873 6.196 2.279 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.898 4.461 2.035 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.636 7.435 1.586 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.779 3.528 0.234 1.00 0.00 H new ATOM 0 HE1 TYR A 99 122.124 7.669 -0.367 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.262 3.750 -1.713 1.00 0.00 H new ATOM 0 HH TYR A 99 121.392 4.973 -2.495 1.00 0.00 H new ATOM 1577 N ILE A 100 122.091 5.593 3.153 1.00 0.00 N ATOM 1578 CA ILE A 100 120.900 6.491 3.241 1.00 0.00 C ATOM 1579 C ILE A 100 120.564 6.716 4.715 1.00 0.00 C ATOM 1580 O ILE A 100 120.474 7.836 5.175 1.00 0.00 O ATOM 1581 CB ILE A 100 119.688 5.872 2.540 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.966 5.746 1.042 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.475 6.781 2.750 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.871 4.543 0.791 1.00 0.00 C ATOM 0 H ILE A 100 121.922 4.668 2.758 1.00 0.00 H new ATOM 0 HA ILE A 100 121.136 7.435 2.749 1.00 0.00 H new ATOM 0 HB ILE A 100 119.493 4.883 2.955 1.00 0.00 H new ATOM 0 HG12 ILE A 100 119.030 5.630 0.496 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.440 6.655 0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.606 6.348 2.254 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.273 6.878 3.817 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.681 7.765 2.329 1.00 0.00 H new ATOM 0 HD11 ILE A 100 121.069 4.453 -0.277 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.812 4.678 1.324 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.379 3.637 1.146 1.00 0.00 H new ATOM 1596 N LEU A 101 120.387 5.659 5.466 1.00 0.00 N ATOM 1597 CA LEU A 101 120.069 5.831 6.914 1.00 0.00 C ATOM 1598 C LEU A 101 121.290 6.410 7.621 1.00 0.00 C ATOM 1599 O LEU A 101 121.225 7.446 8.251 1.00 0.00 O ATOM 1600 CB LEU A 101 119.729 4.471 7.526 1.00 0.00 C ATOM 1601 CG LEU A 101 118.328 4.519 8.129 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.934 3.124 8.615 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.313 5.500 9.305 1.00 0.00 C ATOM 0 H LEU A 101 120.448 4.694 5.143 1.00 0.00 H new ATOM 0 HA LEU A 101 119.218 6.503 7.029 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.782 3.694 6.763 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.458 4.214 8.294 1.00 0.00 H new ATOM 0 HG LEU A 101 117.616 4.851 7.373 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.933 3.158 9.046 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.944 2.430 7.775 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.643 2.788 9.371 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.313 5.535 9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 101 119.024 5.170 10.063 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.592 6.493 8.954 1.00 0.00 H new ATOM 1615 N ALA A 102 122.406 5.751 7.510 1.00 0.00 N ATOM 1616 CA ALA A 102 123.634 6.266 8.164 1.00 0.00 C ATOM 1617 C ALA A 102 123.845 7.715 7.736 1.00 0.00 C ATOM 1618 O ALA A 102 123.399 8.636 8.390 1.00 0.00 O ATOM 1619 CB ALA A 102 124.836 5.425 7.731 1.00 0.00 C ATOM 0 H ALA A 102 122.520 4.878 6.995 1.00 0.00 H new ATOM 0 HA ALA A 102 123.530 6.209 9.248 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.738 5.804 8.212 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.678 4.387 8.023 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.950 5.484 6.649 1.00 0.00 H new ATOM 1625 N LEU A 103 124.513 7.922 6.634 1.00 0.00 N ATOM 1626 CA LEU A 103 124.754 9.311 6.151 1.00 0.00 C ATOM 1627 C LEU A 103 125.461 10.125 7.238 1.00 0.00 C ATOM 1628 O LEU A 103 126.141 11.089 6.949 1.00 0.00 O ATOM 1629 CB LEU A 103 123.418 9.970 5.801 1.00 0.00 C ATOM 1630 CG LEU A 103 123.646 11.446 5.470 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.687 11.566 4.357 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.329 12.072 5.005 1.00 0.00 C ATOM 0 H LEU A 103 124.903 7.186 6.046 1.00 0.00 H new ATOM 0 HA LEU A 103 125.386 9.278 5.263 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.962 9.462 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.725 9.877 6.637 1.00 0.00 H new ATOM 0 HG LEU A 103 124.004 11.966 6.359 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.849 12.618 4.122 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.625 11.119 4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.330 11.046 3.468 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.490 13.124 4.769 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.972 11.551 4.117 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.586 11.988 5.798 1.00 0.00 H new ATOM 1644 N LYS A 104 125.316 9.747 8.484 1.00 0.00 N ATOM 1645 CA LYS A 104 125.996 10.507 9.574 1.00 0.00 C ATOM 1646 C LYS A 104 127.312 11.056 9.032 1.00 0.00 C ATOM 1647 O LYS A 104 127.719 12.158 9.341 1.00 0.00 O ATOM 1648 CB LYS A 104 126.273 9.573 10.754 1.00 0.00 C ATOM 1649 CG LYS A 104 125.075 8.647 10.962 1.00 0.00 C ATOM 1650 CD LYS A 104 124.874 8.394 12.456 1.00 0.00 C ATOM 1651 CE LYS A 104 123.628 7.533 12.663 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.575 7.066 14.077 1.00 0.00 N ATOM 0 H LYS A 104 124.759 8.949 8.791 1.00 0.00 H new ATOM 0 HA LYS A 104 125.362 11.326 9.913 1.00 0.00 H new ATOM 0 HB2 LYS A 104 127.171 8.986 10.564 1.00 0.00 H new ATOM 0 HB3 LYS A 104 126.458 10.155 11.657 1.00 0.00 H new ATOM 0 HG2 LYS A 104 124.178 9.095 10.535 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.238 7.703 10.442 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.748 7.893 12.872 1.00 0.00 H new ATOM 0 HD3 LYS A 104 124.767 9.341 12.985 1.00 0.00 H new ATOM 0 HE2 LYS A 104 122.733 8.107 12.425 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.647 6.678 11.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.606 6.767 14.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 124.224 6.263 14.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.857 7.842 14.710 1.00 0.00 H new ATOM 1666 N ASP A 105 127.967 10.293 8.202 1.00 0.00 N ATOM 1667 CA ASP A 105 129.247 10.757 7.603 1.00 0.00 C ATOM 1668 C ASP A 105 129.101 10.731 6.080 1.00 0.00 C ATOM 1669 O ASP A 105 128.659 11.688 5.477 1.00 0.00 O ATOM 1670 CB ASP A 105 130.382 9.824 8.037 1.00 0.00 C ATOM 1671 CG ASP A 105 131.279 10.543 9.048 1.00 0.00 C ATOM 1672 OD1 ASP A 105 130.846 10.718 10.175 1.00 0.00 O ATOM 1673 OD2 ASP A 105 132.384 10.905 8.678 1.00 0.00 O ATOM 0 H ASP A 105 127.668 9.362 7.912 1.00 0.00 H new ATOM 0 HA ASP A 105 129.479 11.768 7.937 1.00 0.00 H new ATOM 0 HB2 ASP A 105 129.971 8.917 8.480 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.967 9.518 7.170 1.00 0.00 H new ATOM 1678 N GLN A 106 129.448 9.634 5.459 1.00 0.00 N ATOM 1679 CA GLN A 106 129.314 9.530 3.976 1.00 0.00 C ATOM 1680 C GLN A 106 130.265 8.450 3.451 1.00 0.00 C ATOM 1681 O GLN A 106 129.836 7.435 2.935 1.00 0.00 O ATOM 1682 CB GLN A 106 129.646 10.876 3.317 1.00 0.00 C ATOM 1683 CG GLN A 106 128.350 11.608 2.948 1.00 0.00 C ATOM 1684 CD GLN A 106 127.975 11.286 1.501 1.00 0.00 C ATOM 1685 OE1 GLN A 106 128.708 11.604 0.585 1.00 0.00 O ATOM 1686 NE2 GLN A 106 126.855 10.664 1.253 1.00 0.00 N ATOM 0 H GLN A 106 129.820 8.802 5.917 1.00 0.00 H new ATOM 0 HA GLN A 106 128.286 9.262 3.730 1.00 0.00 H new ATOM 0 HB2 GLN A 106 130.239 11.488 3.997 1.00 0.00 H new ATOM 0 HB3 GLN A 106 130.250 10.715 2.424 1.00 0.00 H new ATOM 0 HG2 GLN A 106 127.546 11.306 3.619 1.00 0.00 H new ATOM 0 HG3 GLN A 106 128.480 12.683 3.070 1.00 0.00 H new ATOM 0 HE21 GLN A 106 126.239 10.397 2.021 1.00 0.00 H new ATOM 0 HE22 GLN A 106 126.595 10.445 0.291 1.00 0.00 H new ATOM 1695 N PRO A 107 131.548 8.664 3.580 1.00 0.00 N ATOM 1696 CA PRO A 107 132.577 7.692 3.108 1.00 0.00 C ATOM 1697 C PRO A 107 132.546 6.374 3.887 1.00 0.00 C ATOM 1698 O PRO A 107 133.079 5.378 3.446 1.00 0.00 O ATOM 1699 CB PRO A 107 133.906 8.413 3.351 1.00 0.00 C ATOM 1700 CG PRO A 107 133.615 9.431 4.401 1.00 0.00 C ATOM 1701 CD PRO A 107 132.165 9.854 4.188 1.00 0.00 C ATOM 0 HA PRO A 107 132.410 7.415 2.067 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.677 7.717 3.681 1.00 0.00 H new ATOM 0 HB3 PRO A 107 134.271 8.883 2.438 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.757 9.014 5.398 1.00 0.00 H new ATOM 0 HG3 PRO A 107 134.287 10.285 4.313 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.682 10.121 5.128 1.00 0.00 H new ATOM 0 HD3 PRO A 107 132.092 10.723 3.534 1.00 0.00 H new ATOM 1709 N GLU A 108 131.934 6.353 5.042 1.00 0.00 N ATOM 1710 CA GLU A 108 131.897 5.084 5.827 1.00 0.00 C ATOM 1711 C GLU A 108 130.935 4.103 5.161 1.00 0.00 C ATOM 1712 O GLU A 108 131.291 2.986 4.834 1.00 0.00 O ATOM 1713 CB GLU A 108 131.423 5.374 7.254 1.00 0.00 C ATOM 1714 CG GLU A 108 131.388 6.882 7.489 1.00 0.00 C ATOM 1715 CD GLU A 108 132.769 7.477 7.206 1.00 0.00 C ATOM 1716 OE1 GLU A 108 133.585 6.781 6.624 1.00 0.00 O ATOM 1717 OE2 GLU A 108 132.989 8.618 7.578 1.00 0.00 O ATOM 0 H GLU A 108 131.463 7.149 5.472 1.00 0.00 H new ATOM 0 HA GLU A 108 132.896 4.650 5.860 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.432 4.949 7.412 1.00 0.00 H new ATOM 0 HB3 GLU A 108 132.091 4.900 7.973 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.642 7.344 6.842 1.00 0.00 H new ATOM 0 HG3 GLU A 108 131.093 7.093 8.517 1.00 0.00 H new ATOM 1724 N ALA A 109 129.720 4.517 4.944 1.00 0.00 N ATOM 1725 CA ALA A 109 128.740 3.614 4.290 1.00 0.00 C ATOM 1726 C ALA A 109 129.269 3.247 2.903 1.00 0.00 C ATOM 1727 O ALA A 109 129.119 2.133 2.437 1.00 0.00 O ATOM 1728 CB ALA A 109 127.397 4.334 4.168 1.00 0.00 C ATOM 0 H ALA A 109 129.365 5.441 5.191 1.00 0.00 H new ATOM 0 HA ALA A 109 128.602 2.708 4.880 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.673 3.675 3.688 1.00 0.00 H new ATOM 0 HB2 ALA A 109 127.038 4.605 5.161 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.521 5.235 3.568 1.00 0.00 H new ATOM 1734 N ALA A 110 129.901 4.181 2.250 1.00 0.00 N ATOM 1735 CA ALA A 110 130.462 3.908 0.900 1.00 0.00 C ATOM 1736 C ALA A 110 131.653 2.960 1.034 1.00 0.00 C ATOM 1737 O ALA A 110 131.878 2.111 0.195 1.00 0.00 O ATOM 1738 CB ALA A 110 130.921 5.220 0.260 1.00 0.00 C ATOM 0 H ALA A 110 130.054 5.128 2.597 1.00 0.00 H new ATOM 0 HA ALA A 110 129.698 3.450 0.272 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.332 5.018 -0.729 1.00 0.00 H new ATOM 0 HB2 ALA A 110 130.072 5.897 0.169 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.687 5.681 0.884 1.00 0.00 H new ATOM 1744 N GLN A 111 132.414 3.084 2.089 1.00 0.00 N ATOM 1745 CA GLN A 111 133.575 2.170 2.263 1.00 0.00 C ATOM 1746 C GLN A 111 133.075 0.741 2.102 1.00 0.00 C ATOM 1747 O GLN A 111 133.579 -0.021 1.298 1.00 0.00 O ATOM 1748 CB GLN A 111 134.182 2.357 3.653 1.00 0.00 C ATOM 1749 CG GLN A 111 134.974 3.666 3.689 1.00 0.00 C ATOM 1750 CD GLN A 111 136.463 3.364 3.875 1.00 0.00 C ATOM 1751 OE1 GLN A 111 137.242 3.494 2.951 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.894 2.962 5.039 1.00 0.00 N ATOM 0 H GLN A 111 132.282 3.772 2.830 1.00 0.00 H new ATOM 0 HA GLN A 111 134.343 2.388 1.521 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.395 2.375 4.407 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.834 1.517 3.893 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.819 4.222 2.764 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.616 4.296 4.503 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.241 2.853 5.815 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.884 2.757 5.173 1.00 0.00 H new ATOM 1761 N LEU A 112 132.060 0.378 2.835 1.00 0.00 N ATOM 1762 CA LEU A 112 131.511 -0.990 2.685 1.00 0.00 C ATOM 1763 C LEU A 112 131.205 -1.195 1.205 1.00 0.00 C ATOM 1764 O LEU A 112 131.553 -2.196 0.618 1.00 0.00 O ATOM 1765 CB LEU A 112 130.231 -1.118 3.510 1.00 0.00 C ATOM 1766 CG LEU A 112 130.584 -1.553 4.932 1.00 0.00 C ATOM 1767 CD1 LEU A 112 131.090 -2.996 4.919 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.676 -0.638 5.488 1.00 0.00 C ATOM 0 H LEU A 112 131.593 0.966 3.525 1.00 0.00 H new ATOM 0 HA LEU A 112 132.221 -1.740 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.702 -0.165 3.530 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.561 -1.845 3.051 1.00 0.00 H new ATOM 0 HG LEU A 112 129.696 -1.487 5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.341 -3.303 5.934 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.313 -3.650 4.524 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.977 -3.065 4.290 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.928 -0.947 6.502 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.562 -0.704 4.857 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.317 0.391 5.502 1.00 0.00 H new ATOM 1780 N ALA A 113 130.583 -0.228 0.589 1.00 0.00 N ATOM 1781 CA ALA A 113 130.284 -0.346 -0.861 1.00 0.00 C ATOM 1782 C ALA A 113 131.567 -0.757 -1.589 1.00 0.00 C ATOM 1783 O ALA A 113 131.533 -1.377 -2.633 1.00 0.00 O ATOM 1784 CB ALA A 113 129.798 1.001 -1.399 1.00 0.00 C ATOM 0 H ALA A 113 130.270 0.637 1.029 1.00 0.00 H new ATOM 0 HA ALA A 113 129.506 -1.092 -1.022 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.580 0.910 -2.463 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.895 1.301 -0.867 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.573 1.753 -1.250 1.00 0.00 H new ATOM 1790 N LEU A 114 132.702 -0.410 -1.038 1.00 0.00 N ATOM 1791 CA LEU A 114 133.996 -0.773 -1.687 1.00 0.00 C ATOM 1792 C LEU A 114 134.187 -2.286 -1.604 1.00 0.00 C ATOM 1793 O LEU A 114 134.341 -2.967 -2.610 1.00 0.00 O ATOM 1794 CB LEU A 114 135.147 -0.071 -0.962 1.00 0.00 C ATOM 1795 CG LEU A 114 136.308 0.148 -1.935 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.664 -1.177 -2.611 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.898 1.171 -2.999 1.00 0.00 C ATOM 0 H LEU A 114 132.788 0.110 -0.165 1.00 0.00 H new ATOM 0 HA LEU A 114 133.985 -0.460 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.809 0.885 -0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.477 -0.672 -0.115 1.00 0.00 H new ATOM 0 HG LEU A 114 137.174 0.521 -1.388 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.491 -1.021 -3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.957 -1.904 -1.854 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.798 -1.551 -3.157 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.725 1.327 -3.692 1.00 0.00 H new ATOM 0 HD22 LEU A 114 135.031 0.800 -3.546 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.645 2.116 -2.517 1.00 0.00 H new ATOM 1809 N ARG A 115 134.149 -2.841 -0.424 1.00 0.00 N ATOM 1810 CA ARG A 115 134.297 -4.310 -0.338 1.00 0.00 C ATOM 1811 C ARG A 115 133.246 -4.890 -1.276 1.00 0.00 C ATOM 1812 O ARG A 115 133.521 -5.737 -2.095 1.00 0.00 O ATOM 1813 CB ARG A 115 134.082 -4.791 1.103 1.00 0.00 C ATOM 1814 CG ARG A 115 135.407 -4.711 1.862 1.00 0.00 C ATOM 1815 CD ARG A 115 135.766 -3.245 2.111 1.00 0.00 C ATOM 1816 NE ARG A 115 137.078 -3.167 2.813 1.00 0.00 N ATOM 1817 CZ ARG A 115 138.188 -3.203 2.128 1.00 0.00 C ATOM 1818 NH1 ARG A 115 138.149 -3.307 0.828 1.00 0.00 N ATOM 1819 NH2 ARG A 115 139.337 -3.134 2.743 1.00 0.00 N ATOM 0 H ARG A 115 134.025 -2.350 0.462 1.00 0.00 H new ATOM 0 HA ARG A 115 135.298 -4.632 -0.624 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.329 -4.176 1.596 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.709 -5.815 1.106 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.328 -5.243 2.810 1.00 0.00 H new ATOM 0 HG3 ARG A 115 136.196 -5.197 1.289 1.00 0.00 H new ATOM 0 HD2 ARG A 115 135.815 -2.706 1.165 1.00 0.00 H new ATOM 0 HD3 ARG A 115 134.992 -2.767 2.711 1.00 0.00 H new ATOM 0 HE ARG A 115 137.108 -3.085 3.829 1.00 0.00 H new ATOM 0 HH11 ARG A 115 137.251 -3.360 0.347 1.00 0.00 H new ATOM 0 HH12 ARG A 115 139.017 -3.335 0.292 1.00 0.00 H new ATOM 0 HH21 ARG A 115 139.367 -3.052 3.759 1.00 0.00 H new ATOM 0 HH22 ARG A 115 140.205 -3.162 2.207 1.00 0.00 H new ATOM 1833 N VAL A 116 132.052 -4.383 -1.226 1.00 0.00 N ATOM 1834 CA VAL A 116 131.031 -4.875 -2.174 1.00 0.00 C ATOM 1835 C VAL A 116 131.692 -4.860 -3.549 1.00 0.00 C ATOM 1836 O VAL A 116 131.434 -5.691 -4.391 1.00 0.00 O ATOM 1837 CB VAL A 116 129.816 -3.941 -2.144 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.296 -3.702 -3.561 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.702 -4.564 -1.297 1.00 0.00 C ATOM 0 H VAL A 116 131.743 -3.658 -0.578 1.00 0.00 H new ATOM 0 HA VAL A 116 130.682 -5.876 -1.922 1.00 0.00 H new ATOM 0 HB VAL A 116 130.120 -2.989 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.433 -3.037 -3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 116 130.081 -3.246 -4.164 1.00 0.00 H new ATOM 0 HG13 VAL A 116 129.003 -4.653 -4.006 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.841 -3.896 -1.279 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.409 -5.521 -1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 116 129.062 -4.719 -0.280 1.00 0.00 H new ATOM 1849 N GLY A 117 132.581 -3.929 -3.764 1.00 0.00 N ATOM 1850 CA GLY A 117 133.292 -3.882 -5.064 1.00 0.00 C ATOM 1851 C GLY A 117 133.845 -5.276 -5.338 1.00 0.00 C ATOM 1852 O GLY A 117 133.664 -5.841 -6.411 1.00 0.00 O ATOM 0 H GLY A 117 132.842 -3.204 -3.096 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.614 -3.576 -5.860 1.00 0.00 H new ATOM 0 HA3 GLY A 117 134.099 -3.149 -5.033 1.00 0.00 H new ATOM 1856 N ILE A 118 134.507 -5.861 -4.369 1.00 0.00 N ATOM 1857 CA ILE A 118 135.035 -7.227 -4.611 1.00 0.00 C ATOM 1858 C ILE A 118 133.881 -8.092 -5.098 1.00 0.00 C ATOM 1859 O ILE A 118 134.063 -8.996 -5.889 1.00 0.00 O ATOM 1860 CB ILE A 118 135.702 -7.834 -3.357 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.837 -7.710 -2.092 1.00 0.00 C ATOM 1862 CG2 ILE A 118 137.010 -7.089 -3.104 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.408 -8.209 -2.331 1.00 0.00 C ATOM 0 H ILE A 118 134.697 -5.462 -3.450 1.00 0.00 H new ATOM 0 HA ILE A 118 135.820 -7.180 -5.365 1.00 0.00 H new ATOM 0 HB ILE A 118 135.854 -8.896 -3.552 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.292 -8.282 -1.283 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.810 -6.669 -1.770 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.499 -7.502 -2.222 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.665 -7.201 -3.968 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.801 -6.032 -2.942 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.828 -8.105 -1.414 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.944 -7.620 -3.122 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.434 -9.258 -2.627 1.00 0.00 H new ATOM 1875 N ALA A 119 132.682 -7.808 -4.657 1.00 0.00 N ATOM 1876 CA ALA A 119 131.532 -8.606 -5.133 1.00 0.00 C ATOM 1877 C ALA A 119 131.293 -8.277 -6.603 1.00 0.00 C ATOM 1878 O ALA A 119 130.846 -9.106 -7.363 1.00 0.00 O ATOM 1879 CB ALA A 119 130.286 -8.294 -4.304 1.00 0.00 C ATOM 0 H ALA A 119 132.459 -7.065 -3.995 1.00 0.00 H new ATOM 0 HA ALA A 119 131.747 -9.669 -5.023 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.449 -8.890 -4.667 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.475 -8.534 -3.258 1.00 0.00 H new ATOM 0 HB3 ALA A 119 130.044 -7.235 -4.395 1.00 0.00 H new ATOM 1885 N VAL A 120 131.623 -7.090 -7.039 1.00 0.00 N ATOM 1886 CA VAL A 120 131.425 -6.794 -8.480 1.00 0.00 C ATOM 1887 C VAL A 120 132.085 -7.932 -9.223 1.00 0.00 C ATOM 1888 O VAL A 120 131.554 -8.468 -10.176 1.00 0.00 O ATOM 1889 CB VAL A 120 132.079 -5.466 -8.847 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.893 -5.205 -10.341 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.424 -4.344 -8.045 1.00 0.00 C ATOM 0 H VAL A 120 132.010 -6.334 -6.475 1.00 0.00 H new ATOM 0 HA VAL A 120 130.368 -6.707 -8.732 1.00 0.00 H new ATOM 0 HB VAL A 120 133.144 -5.504 -8.617 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.360 -4.256 -10.605 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.357 -6.009 -10.911 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.829 -5.163 -10.573 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.888 -3.393 -8.304 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.360 -4.304 -8.278 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.555 -4.534 -6.980 1.00 0.00 H new ATOM 1901 N ALA A 121 133.213 -8.355 -8.740 1.00 0.00 N ATOM 1902 CA ALA A 121 133.879 -9.524 -9.361 1.00 0.00 C ATOM 1903 C ALA A 121 133.281 -10.774 -8.708 1.00 0.00 C ATOM 1904 O ALA A 121 133.388 -11.876 -9.210 1.00 0.00 O ATOM 1905 CB ALA A 121 135.386 -9.467 -9.096 1.00 0.00 C ATOM 0 H ALA A 121 133.701 -7.943 -7.945 1.00 0.00 H new ATOM 0 HA ALA A 121 133.726 -9.535 -10.440 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.869 -10.329 -9.555 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.796 -8.552 -9.522 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.567 -9.479 -8.021 1.00 0.00 H new ATOM 1911 N LYS A 122 132.652 -10.588 -7.571 1.00 0.00 N ATOM 1912 CA LYS A 122 132.032 -11.728 -6.830 1.00 0.00 C ATOM 1913 C LYS A 122 130.609 -11.350 -6.386 1.00 0.00 C ATOM 1914 O LYS A 122 130.267 -11.470 -5.226 1.00 0.00 O ATOM 1915 CB LYS A 122 132.884 -12.061 -5.601 1.00 0.00 C ATOM 1916 CG LYS A 122 133.954 -13.089 -5.984 1.00 0.00 C ATOM 1917 CD LYS A 122 135.270 -12.757 -5.275 1.00 0.00 C ATOM 1918 CE LYS A 122 136.416 -13.520 -5.941 1.00 0.00 C ATOM 1919 NZ LYS A 122 136.414 -14.933 -5.468 1.00 0.00 N ATOM 0 H LYS A 122 132.542 -9.680 -7.120 1.00 0.00 H new ATOM 0 HA LYS A 122 131.982 -12.598 -7.484 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.355 -11.157 -5.216 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.254 -12.456 -4.804 1.00 0.00 H new ATOM 0 HG2 LYS A 122 133.624 -14.091 -5.708 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.102 -13.088 -7.064 1.00 0.00 H new ATOM 0 HD2 LYS A 122 135.459 -11.684 -5.320 1.00 0.00 H new ATOM 0 HD3 LYS A 122 135.205 -13.025 -4.221 1.00 0.00 H new ATOM 0 HE2 LYS A 122 136.307 -13.488 -7.025 1.00 0.00 H new ATOM 0 HE3 LYS A 122 137.369 -13.047 -5.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 137.193 -15.452 -5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.538 -14.954 -4.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 135.509 -15.381 -5.717 1.00 0.00 H new ATOM 1933 N SER A 123 129.791 -10.864 -7.284 1.00 0.00 N ATOM 1934 CA SER A 123 128.405 -10.448 -6.897 1.00 0.00 C ATOM 1935 C SER A 123 127.822 -11.436 -5.895 1.00 0.00 C ATOM 1936 O SER A 123 126.828 -11.170 -5.248 1.00 0.00 O ATOM 1937 CB SER A 123 127.518 -10.401 -8.142 1.00 0.00 C ATOM 1938 OG SER A 123 128.332 -10.216 -9.292 1.00 0.00 O ATOM 0 H SER A 123 130.021 -10.736 -8.269 1.00 0.00 H new ATOM 0 HA SER A 123 128.446 -9.460 -6.439 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.947 -11.325 -8.231 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.797 -9.588 -8.058 1.00 0.00 H new ATOM 0 HG SER A 123 127.766 -10.187 -10.092 1.00 0.00 H new ATOM 1944 N ASP A 124 128.435 -12.566 -5.752 1.00 0.00 N ATOM 1945 CA ASP A 124 127.924 -13.568 -4.779 1.00 0.00 C ATOM 1946 C ASP A 124 129.070 -14.487 -4.355 1.00 0.00 C ATOM 1947 O ASP A 124 128.989 -15.693 -4.470 1.00 0.00 O ATOM 1948 CB ASP A 124 126.806 -14.387 -5.430 1.00 0.00 C ATOM 1949 CG ASP A 124 127.413 -15.413 -6.389 1.00 0.00 C ATOM 1950 OD1 ASP A 124 127.905 -15.005 -7.428 1.00 0.00 O ATOM 1951 OD2 ASP A 124 127.375 -16.590 -6.068 1.00 0.00 O ATOM 0 H ASP A 124 129.271 -12.845 -6.266 1.00 0.00 H new ATOM 0 HA ASP A 124 127.526 -13.061 -3.900 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.219 -14.893 -4.664 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.126 -13.728 -5.969 1.00 0.00 H new ATOM 1956 N GLY A 125 130.143 -13.922 -3.865 1.00 0.00 N ATOM 1957 CA GLY A 125 131.294 -14.766 -3.439 1.00 0.00 C ATOM 1958 C GLY A 125 132.099 -14.053 -2.347 1.00 0.00 C ATOM 1959 O GLY A 125 132.677 -14.685 -1.485 1.00 0.00 O ATOM 0 H GLY A 125 130.270 -12.917 -3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.933 -15.725 -3.067 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.936 -14.977 -4.294 1.00 0.00 H new ATOM 1963 N ASN A 126 132.155 -12.745 -2.375 1.00 0.00 N ATOM 1964 CA ASN A 126 132.938 -12.018 -1.334 1.00 0.00 C ATOM 1965 C ASN A 126 132.034 -11.046 -0.566 1.00 0.00 C ATOM 1966 O ASN A 126 130.839 -10.994 -0.776 1.00 0.00 O ATOM 1967 CB ASN A 126 134.088 -11.259 -1.999 1.00 0.00 C ATOM 1968 CG ASN A 126 135.360 -12.107 -1.942 1.00 0.00 C ATOM 1969 OD1 ASN A 126 136.455 -11.581 -1.949 1.00 0.00 O ATOM 1970 ND2 ASN A 126 135.261 -13.407 -1.886 1.00 0.00 N ATOM 0 H ASN A 126 131.696 -12.155 -3.068 1.00 0.00 H new ATOM 0 HA ASN A 126 133.345 -12.739 -0.625 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.836 -11.031 -3.035 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.250 -10.307 -1.493 1.00 0.00 H new ATOM 0 HD21 ASN A 126 136.103 -13.981 -1.848 1.00 0.00 H new ATOM 0 HD22 ASN A 126 134.342 -13.849 -1.880 1.00 0.00 H new ATOM 1977 N PHE A 127 132.605 -10.292 0.340 1.00 0.00 N ATOM 1978 CA PHE A 127 131.804 -9.328 1.156 1.00 0.00 C ATOM 1979 C PHE A 127 131.299 -10.034 2.414 1.00 0.00 C ATOM 1980 O PHE A 127 131.435 -11.232 2.559 1.00 0.00 O ATOM 1981 CB PHE A 127 130.607 -8.804 0.360 1.00 0.00 C ATOM 1982 CG PHE A 127 130.247 -7.430 0.876 1.00 0.00 C ATOM 1983 CD1 PHE A 127 131.099 -6.353 0.620 1.00 0.00 C ATOM 1984 CD2 PHE A 127 129.075 -7.233 1.616 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.782 -5.077 1.102 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.758 -5.955 2.099 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.613 -4.878 1.841 1.00 0.00 C ATOM 0 H PHE A 127 133.603 -10.303 0.551 1.00 0.00 H new ATOM 0 HA PHE A 127 132.441 -8.485 1.424 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.850 -8.757 -0.702 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.759 -9.481 0.463 1.00 0.00 H new ATOM 0 HD1 PHE A 127 132.003 -6.505 0.050 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.415 -8.065 1.815 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.442 -4.246 0.902 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.854 -5.802 2.670 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.370 -3.894 2.213 1.00 0.00 H new ATOM 1997 N ASP A 128 130.715 -9.301 3.324 1.00 0.00 N ATOM 1998 CA ASP A 128 130.197 -9.925 4.570 1.00 0.00 C ATOM 1999 C ASP A 128 131.367 -10.409 5.424 1.00 0.00 C ATOM 2000 O ASP A 128 131.179 -10.948 6.492 1.00 0.00 O ATOM 2001 CB ASP A 128 129.298 -11.107 4.204 1.00 0.00 C ATOM 2002 CG ASP A 128 128.370 -10.709 3.056 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.696 -9.703 3.187 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.351 -11.419 2.063 1.00 0.00 O ATOM 0 H ASP A 128 130.575 -8.293 3.255 1.00 0.00 H new ATOM 0 HA ASP A 128 129.621 -9.193 5.136 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.906 -11.963 3.913 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.711 -11.413 5.070 1.00 0.00 H new ATOM 2009 N ASP A 129 132.574 -10.212 4.972 1.00 0.00 N ATOM 2010 CA ASP A 129 133.746 -10.661 5.777 1.00 0.00 C ATOM 2011 C ASP A 129 134.413 -9.445 6.414 1.00 0.00 C ATOM 2012 O ASP A 129 134.813 -9.473 7.561 1.00 0.00 O ATOM 2013 CB ASP A 129 134.748 -11.379 4.869 1.00 0.00 C ATOM 2014 CG ASP A 129 135.964 -11.808 5.691 1.00 0.00 C ATOM 2015 OD1 ASP A 129 136.743 -10.943 6.057 1.00 0.00 O ATOM 2016 OD2 ASP A 129 136.097 -12.995 5.940 1.00 0.00 O ATOM 0 H ASP A 129 132.800 -9.762 4.085 1.00 0.00 H new ATOM 0 HA ASP A 129 133.413 -11.346 6.557 1.00 0.00 H new ATOM 0 HB2 ASP A 129 134.280 -12.250 4.410 1.00 0.00 H new ATOM 0 HB3 ASP A 129 135.058 -10.720 4.058 1.00 0.00 H new ATOM 2021 N ASP A 130 134.528 -8.373 5.683 1.00 0.00 N ATOM 2022 CA ASP A 130 135.159 -7.154 6.251 1.00 0.00 C ATOM 2023 C ASP A 130 134.096 -6.349 6.998 1.00 0.00 C ATOM 2024 O ASP A 130 134.404 -5.519 7.828 1.00 0.00 O ATOM 2025 CB ASP A 130 135.750 -6.307 5.121 1.00 0.00 C ATOM 2026 CG ASP A 130 137.182 -5.900 5.478 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.340 -5.090 6.376 1.00 0.00 O ATOM 2028 OD2 ASP A 130 138.095 -6.405 4.846 1.00 0.00 O ATOM 0 H ASP A 130 134.212 -8.289 4.717 1.00 0.00 H new ATOM 0 HA ASP A 130 135.957 -7.436 6.938 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.744 -6.871 4.189 1.00 0.00 H new ATOM 0 HB3 ASP A 130 135.138 -5.419 4.960 1.00 0.00 H new ATOM 2033 N GLU A 131 132.844 -6.587 6.710 1.00 0.00 N ATOM 2034 CA GLU A 131 131.770 -5.832 7.403 1.00 0.00 C ATOM 2035 C GLU A 131 131.992 -5.895 8.912 1.00 0.00 C ATOM 2036 O GLU A 131 131.609 -5.009 9.639 1.00 0.00 O ATOM 2037 CB GLU A 131 130.413 -6.446 7.060 1.00 0.00 C ATOM 2038 CG GLU A 131 130.004 -6.042 5.639 1.00 0.00 C ATOM 2039 CD GLU A 131 128.872 -5.014 5.699 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.790 -4.309 6.691 1.00 0.00 O ATOM 2041 OE2 GLU A 131 128.107 -4.948 4.751 1.00 0.00 O ATOM 0 H GLU A 131 132.523 -7.271 6.025 1.00 0.00 H new ATOM 0 HA GLU A 131 131.791 -4.792 7.078 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.465 -7.532 7.138 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.661 -6.110 7.774 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.860 -5.624 5.109 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.681 -6.920 5.080 1.00 0.00 H new ATOM 2048 N LYS A 132 132.612 -6.930 9.395 1.00 0.00 N ATOM 2049 CA LYS A 132 132.852 -7.018 10.861 1.00 0.00 C ATOM 2050 C LYS A 132 133.838 -5.922 11.265 1.00 0.00 C ATOM 2051 O LYS A 132 133.585 -5.148 12.167 1.00 0.00 O ATOM 2052 CB LYS A 132 133.418 -8.396 11.192 1.00 0.00 C ATOM 2053 CG LYS A 132 132.696 -9.441 10.337 1.00 0.00 C ATOM 2054 CD LYS A 132 132.309 -10.642 11.200 1.00 0.00 C ATOM 2055 CE LYS A 132 133.558 -11.196 11.879 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.402 -12.664 12.089 1.00 0.00 N ATOM 0 H LYS A 132 132.962 -7.715 8.845 1.00 0.00 H new ATOM 0 HA LYS A 132 131.921 -6.880 11.410 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.490 -8.422 10.995 1.00 0.00 H new ATOM 0 HB3 LYS A 132 133.283 -8.616 12.251 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.805 -9.003 9.887 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.341 -9.763 9.519 1.00 0.00 H new ATOM 0 HD2 LYS A 132 131.575 -10.345 11.949 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.843 -11.412 10.585 1.00 0.00 H new ATOM 0 HE2 LYS A 132 134.437 -10.997 11.265 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.717 -10.696 12.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 134.254 -13.041 12.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.573 -12.842 12.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 133.270 -13.134 11.171 1.00 0.00 H new ATOM 2070 N SER A 133 134.950 -5.831 10.589 1.00 0.00 N ATOM 2071 CA SER A 133 135.934 -4.763 10.920 1.00 0.00 C ATOM 2072 C SER A 133 135.445 -3.453 10.300 1.00 0.00 C ATOM 2073 O SER A 133 135.555 -2.387 10.883 1.00 0.00 O ATOM 2074 CB SER A 133 137.302 -5.127 10.344 1.00 0.00 C ATOM 2075 OG SER A 133 137.374 -4.689 8.993 1.00 0.00 O ATOM 0 H SER A 133 135.219 -6.449 9.823 1.00 0.00 H new ATOM 0 HA SER A 133 136.026 -4.657 12.001 1.00 0.00 H new ATOM 0 HB2 SER A 133 138.093 -4.661 10.932 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.457 -6.205 10.398 1.00 0.00 H new ATOM 0 HG SER A 133 137.273 -5.458 8.394 1.00 0.00 H new ATOM 2081 N ALA A 134 134.876 -3.532 9.126 1.00 0.00 N ATOM 2082 CA ALA A 134 134.353 -2.307 8.474 1.00 0.00 C ATOM 2083 C ALA A 134 133.276 -1.735 9.381 1.00 0.00 C ATOM 2084 O ALA A 134 133.206 -0.544 9.610 1.00 0.00 O ATOM 2085 CB ALA A 134 133.755 -2.657 7.109 1.00 0.00 C ATOM 0 H ALA A 134 134.753 -4.394 8.595 1.00 0.00 H new ATOM 0 HA ALA A 134 135.152 -1.581 8.319 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.373 -1.752 6.636 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.525 -3.099 6.477 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.940 -3.369 7.240 1.00 0.00 H new ATOM 2091 N VAL A 135 132.449 -2.585 9.926 1.00 0.00 N ATOM 2092 CA VAL A 135 131.400 -2.092 10.846 1.00 0.00 C ATOM 2093 C VAL A 135 132.092 -1.397 12.019 1.00 0.00 C ATOM 2094 O VAL A 135 131.607 -0.425 12.552 1.00 0.00 O ATOM 2095 CB VAL A 135 130.549 -3.264 11.334 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.794 -2.869 12.604 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.545 -3.632 10.238 1.00 0.00 C ATOM 0 H VAL A 135 132.458 -3.593 9.772 1.00 0.00 H new ATOM 0 HA VAL A 135 130.740 -1.388 10.339 1.00 0.00 H new ATOM 0 HB VAL A 135 131.192 -4.116 11.556 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.190 -3.710 12.945 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.508 -2.596 13.381 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.145 -2.019 12.392 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.931 -4.468 10.573 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.907 -2.774 10.026 1.00 0.00 H new ATOM 0 HG23 VAL A 135 130.082 -3.916 9.333 1.00 0.00 H new ATOM 2107 N ARG A 136 133.243 -1.875 12.410 1.00 0.00 N ATOM 2108 CA ARG A 136 133.972 -1.215 13.529 1.00 0.00 C ATOM 2109 C ARG A 136 134.047 0.282 13.237 1.00 0.00 C ATOM 2110 O ARG A 136 133.707 1.108 14.061 1.00 0.00 O ATOM 2111 CB ARG A 136 135.396 -1.774 13.626 1.00 0.00 C ATOM 2112 CG ARG A 136 135.911 -1.627 15.062 1.00 0.00 C ATOM 2113 CD ARG A 136 135.391 -2.781 15.922 1.00 0.00 C ATOM 2114 NE ARG A 136 135.828 -2.584 17.333 1.00 0.00 N ATOM 2115 CZ ARG A 136 137.009 -2.987 17.713 1.00 0.00 C ATOM 2116 NH1 ARG A 136 137.809 -3.563 16.857 1.00 0.00 N ATOM 2117 NH2 ARG A 136 137.391 -2.814 18.949 1.00 0.00 N ATOM 0 H ARG A 136 133.707 -2.689 12.006 1.00 0.00 H new ATOM 0 HA ARG A 136 133.450 -1.399 14.468 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.406 -2.823 13.331 1.00 0.00 H new ATOM 0 HB3 ARG A 136 136.053 -1.243 12.937 1.00 0.00 H new ATOM 0 HG2 ARG A 136 137.001 -1.620 15.068 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.584 -0.675 15.479 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.303 -2.826 15.870 1.00 0.00 H new ATOM 0 HD3 ARG A 136 135.768 -3.731 15.542 1.00 0.00 H new ATOM 0 HE ARG A 136 135.203 -2.134 18.002 1.00 0.00 H new ATOM 0 HH11 ARG A 136 137.511 -3.698 15.891 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.732 -3.878 17.154 1.00 0.00 H new ATOM 0 HH21 ARG A 136 136.766 -2.364 19.618 1.00 0.00 H new ATOM 0 HH22 ARG A 136 138.314 -3.129 19.246 1.00 0.00 H new ATOM 2131 N GLU A 137 134.496 0.632 12.063 1.00 0.00 N ATOM 2132 CA GLU A 137 134.604 2.074 11.703 1.00 0.00 C ATOM 2133 C GLU A 137 133.218 2.648 11.385 1.00 0.00 C ATOM 2134 O GLU A 137 132.970 3.823 11.568 1.00 0.00 O ATOM 2135 CB GLU A 137 135.507 2.224 10.477 1.00 0.00 C ATOM 2136 CG GLU A 137 136.697 1.270 10.599 1.00 0.00 C ATOM 2137 CD GLU A 137 137.875 1.817 9.791 1.00 0.00 C ATOM 2138 OE1 GLU A 137 138.038 3.026 9.762 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.595 1.018 9.216 1.00 0.00 O ATOM 0 H GLU A 137 134.793 -0.019 11.337 1.00 0.00 H new ATOM 0 HA GLU A 137 135.029 2.619 12.546 1.00 0.00 H new ATOM 0 HB2 GLU A 137 134.944 2.006 9.569 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.859 3.252 10.395 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.981 1.158 11.645 1.00 0.00 H new ATOM 0 HG3 GLU A 137 136.422 0.280 10.236 1.00 0.00 H new ATOM 2146 N ILE A 138 132.315 1.837 10.899 1.00 0.00 N ATOM 2147 CA ILE A 138 130.956 2.357 10.563 1.00 0.00 C ATOM 2148 C ILE A 138 130.176 2.636 11.853 1.00 0.00 C ATOM 2149 O ILE A 138 129.696 3.728 12.076 1.00 0.00 O ATOM 2150 CB ILE A 138 130.219 1.317 9.695 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.621 2.002 8.460 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.091 0.643 10.487 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.640 1.994 7.316 1.00 0.00 C ATOM 0 H ILE A 138 132.458 0.843 10.721 1.00 0.00 H new ATOM 0 HA ILE A 138 131.041 3.289 10.005 1.00 0.00 H new ATOM 0 HB ILE A 138 130.940 0.558 9.390 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.711 1.487 8.152 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.340 3.027 8.702 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.587 -0.086 9.853 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.509 0.139 11.358 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.375 1.397 10.813 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.209 2.482 6.442 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.538 2.529 7.625 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.899 0.965 7.067 1.00 0.00 H new ATOM 2165 N ALA A 139 130.049 1.661 12.704 1.00 0.00 N ATOM 2166 CA ALA A 139 129.306 1.867 13.975 1.00 0.00 C ATOM 2167 C ALA A 139 129.903 3.054 14.728 1.00 0.00 C ATOM 2168 O ALA A 139 129.196 3.859 15.301 1.00 0.00 O ATOM 2169 CB ALA A 139 129.429 0.609 14.834 1.00 0.00 C ATOM 0 H ALA A 139 130.430 0.724 12.573 1.00 0.00 H new ATOM 0 HA ALA A 139 128.256 2.066 13.759 1.00 0.00 H new ATOM 0 HB1 ALA A 139 128.886 0.752 15.769 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.008 -0.241 14.297 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.480 0.417 15.050 1.00 0.00 H new ATOM 2175 N ARG A 140 131.202 3.165 14.738 1.00 0.00 N ATOM 2176 CA ARG A 140 131.844 4.294 15.463 1.00 0.00 C ATOM 2177 C ARG A 140 131.690 5.588 14.657 1.00 0.00 C ATOM 2178 O ARG A 140 131.245 6.596 15.168 1.00 0.00 O ATOM 2179 CB ARG A 140 133.331 3.989 15.659 1.00 0.00 C ATOM 2180 CG ARG A 140 133.517 3.133 16.913 1.00 0.00 C ATOM 2181 CD ARG A 140 133.739 4.040 18.124 1.00 0.00 C ATOM 2182 NE ARG A 140 135.055 4.727 17.994 1.00 0.00 N ATOM 2183 CZ ARG A 140 136.162 4.042 18.092 1.00 0.00 C ATOM 2184 NH1 ARG A 140 136.115 2.755 18.303 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.314 4.644 17.978 1.00 0.00 N ATOM 0 H ARG A 140 131.846 2.523 14.276 1.00 0.00 H new ATOM 0 HA ARG A 140 131.363 4.419 16.433 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.723 3.465 14.787 1.00 0.00 H new ATOM 0 HB3 ARG A 140 133.894 4.918 15.753 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.639 2.506 17.071 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.368 2.464 16.786 1.00 0.00 H new ATOM 0 HD2 ARG A 140 132.938 4.776 18.193 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.712 3.453 19.042 1.00 0.00 H new ATOM 0 HE ARG A 140 135.091 5.733 17.828 1.00 0.00 H new ATOM 0 HH11 ARG A 140 135.214 2.285 18.391 1.00 0.00 H new ATOM 0 HH12 ARG A 140 136.979 2.219 18.380 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.350 5.650 17.812 1.00 0.00 H new ATOM 0 HH22 ARG A 140 138.179 4.109 18.055 1.00 0.00 H new ATOM 2199 N SER A 141 132.057 5.572 13.403 1.00 0.00 N ATOM 2200 CA SER A 141 131.929 6.809 12.579 1.00 0.00 C ATOM 2201 C SER A 141 130.485 7.307 12.633 1.00 0.00 C ATOM 2202 O SER A 141 130.227 8.475 12.842 1.00 0.00 O ATOM 2203 CB SER A 141 132.308 6.501 11.130 1.00 0.00 C ATOM 2204 OG SER A 141 131.545 5.393 10.671 1.00 0.00 O ATOM 0 H SER A 141 132.438 4.761 12.916 1.00 0.00 H new ATOM 0 HA SER A 141 132.595 7.577 12.971 1.00 0.00 H new ATOM 0 HB2 SER A 141 132.122 7.371 10.500 1.00 0.00 H new ATOM 0 HB3 SER A 141 133.373 6.278 11.060 1.00 0.00 H new ATOM 0 HG SER A 141 131.765 4.601 11.204 1.00 0.00 H new ATOM 2210 N LEU A 142 129.542 6.426 12.454 1.00 0.00 N ATOM 2211 CA LEU A 142 128.118 6.835 12.503 1.00 0.00 C ATOM 2212 C LEU A 142 127.660 6.853 13.962 1.00 0.00 C ATOM 2213 O LEU A 142 127.533 7.899 14.568 1.00 0.00 O ATOM 2214 CB LEU A 142 127.284 5.835 11.699 1.00 0.00 C ATOM 2215 CG LEU A 142 128.007 5.501 10.390 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.251 4.394 9.657 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.070 6.745 9.502 1.00 0.00 C ATOM 0 H LEU A 142 129.701 5.434 12.275 1.00 0.00 H new ATOM 0 HA LEU A 142 127.992 7.829 12.074 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.125 4.927 12.281 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.300 6.254 11.487 1.00 0.00 H new ATOM 0 HG LEU A 142 129.019 5.166 10.615 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.766 4.157 8.726 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.209 3.504 10.285 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.238 4.730 9.436 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.585 6.503 8.572 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.058 7.084 9.279 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.612 7.536 10.021 1.00 0.00 H new ATOM 2229 N GLY A 143 127.423 5.707 14.539 1.00 0.00 N ATOM 2230 CA GLY A 143 126.990 5.680 15.967 1.00 0.00 C ATOM 2231 C GLY A 143 126.290 4.357 16.305 1.00 0.00 C ATOM 2232 O GLY A 143 125.281 4.345 16.981 1.00 0.00 O ATOM 0 H GLY A 143 127.509 4.795 14.090 1.00 0.00 H new ATOM 0 HA2 GLY A 143 127.856 5.813 16.616 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.314 6.513 16.162 1.00 0.00 H new ATOM 2236 N PHE A 144 126.812 3.243 15.859 1.00 0.00 N ATOM 2237 CA PHE A 144 126.155 1.940 16.188 1.00 0.00 C ATOM 2238 C PHE A 144 127.058 1.116 17.111 1.00 0.00 C ATOM 2239 O PHE A 144 127.587 1.614 18.085 1.00 0.00 O ATOM 2240 CB PHE A 144 125.882 1.142 14.910 1.00 0.00 C ATOM 2241 CG PHE A 144 125.424 2.065 13.809 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.631 3.179 14.107 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.791 1.801 12.485 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.207 4.029 13.081 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.367 2.650 11.459 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.575 3.765 11.757 1.00 0.00 C ATOM 0 H PHE A 144 127.655 3.178 15.288 1.00 0.00 H new ATOM 0 HA PHE A 144 125.210 2.149 16.690 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.785 0.615 14.601 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.121 0.385 15.100 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.347 3.382 15.129 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.402 0.941 12.256 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.596 4.889 13.310 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.650 2.446 10.437 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.248 4.422 10.965 1.00 0.00 H new ATOM 2256 N ASP A 145 127.228 -0.148 16.816 1.00 0.00 N ATOM 2257 CA ASP A 145 128.085 -1.012 17.680 1.00 0.00 C ATOM 2258 C ASP A 145 129.374 -1.384 16.933 1.00 0.00 C ATOM 2259 O ASP A 145 129.331 -1.974 15.871 1.00 0.00 O ATOM 2260 CB ASP A 145 127.319 -2.291 18.025 1.00 0.00 C ATOM 2261 CG ASP A 145 126.606 -2.116 19.367 1.00 0.00 C ATOM 2262 OD1 ASP A 145 125.667 -1.338 19.420 1.00 0.00 O ATOM 2263 OD2 ASP A 145 127.011 -2.762 20.319 1.00 0.00 O ATOM 0 H ASP A 145 126.810 -0.618 16.013 1.00 0.00 H new ATOM 0 HA ASP A 145 128.340 -0.471 18.591 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.594 -2.515 17.243 1.00 0.00 H new ATOM 0 HB3 ASP A 145 128.006 -3.136 18.074 1.00 0.00 H new ATOM 2268 N PRO A 146 130.513 -1.046 17.485 1.00 0.00 N ATOM 2269 CA PRO A 146 131.833 -1.355 16.863 1.00 0.00 C ATOM 2270 C PRO A 146 131.948 -2.811 16.392 1.00 0.00 C ATOM 2271 O PRO A 146 131.995 -3.730 17.186 1.00 0.00 O ATOM 2272 CB PRO A 146 132.840 -1.085 17.981 1.00 0.00 C ATOM 2273 CG PRO A 146 132.175 -0.113 18.897 1.00 0.00 C ATOM 2274 CD PRO A 146 130.667 -0.328 18.761 1.00 0.00 C ATOM 0 HA PRO A 146 131.994 -0.754 15.968 1.00 0.00 H new ATOM 0 HB2 PRO A 146 133.098 -2.005 18.506 1.00 0.00 H new ATOM 0 HB3 PRO A 146 133.768 -0.675 17.582 1.00 0.00 H new ATOM 0 HG2 PRO A 146 132.496 -0.272 19.927 1.00 0.00 H new ATOM 0 HG3 PRO A 146 132.444 0.910 18.634 1.00 0.00 H new ATOM 0 HD2 PRO A 146 130.272 -0.909 19.594 1.00 0.00 H new ATOM 0 HD3 PRO A 146 130.130 0.620 18.751 1.00 0.00 H new ATOM 2282 N ALA A 147 132.006 -3.023 15.104 1.00 0.00 N ATOM 2283 CA ALA A 147 132.134 -4.409 14.567 1.00 0.00 C ATOM 2284 C ALA A 147 131.232 -5.360 15.339 1.00 0.00 C ATOM 2285 O ALA A 147 131.570 -5.823 16.410 1.00 0.00 O ATOM 2286 CB ALA A 147 133.578 -4.890 14.695 1.00 0.00 C ATOM 0 H ALA A 147 131.970 -2.290 14.396 1.00 0.00 H new ATOM 0 HA ALA A 147 131.840 -4.397 13.518 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.661 -5.903 14.300 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.234 -4.226 14.132 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.872 -4.885 15.745 1.00 0.00 H new ATOM 2292 N GLU A 148 130.094 -5.670 14.798 1.00 0.00 N ATOM 2293 CA GLU A 148 129.183 -6.607 15.498 1.00 0.00 C ATOM 2294 C GLU A 148 128.032 -7.007 14.571 1.00 0.00 C ATOM 2295 O GLU A 148 127.006 -7.475 15.023 1.00 0.00 O ATOM 2296 CB GLU A 148 128.618 -5.929 16.747 1.00 0.00 C ATOM 2297 CG GLU A 148 128.183 -6.995 17.755 1.00 0.00 C ATOM 2298 CD GLU A 148 127.760 -6.321 19.062 1.00 0.00 C ATOM 2299 OE1 GLU A 148 126.864 -5.494 19.016 1.00 0.00 O ATOM 2300 OE2 GLU A 148 128.339 -6.643 20.086 1.00 0.00 O ATOM 0 H GLU A 148 129.755 -5.316 13.903 1.00 0.00 H new ATOM 0 HA GLU A 148 129.739 -7.500 15.784 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.371 -5.278 17.192 1.00 0.00 H new ATOM 0 HB3 GLU A 148 127.770 -5.299 16.479 1.00 0.00 H new ATOM 0 HG2 GLU A 148 127.356 -7.577 17.350 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.002 -7.690 17.941 1.00 0.00 H new ATOM 2307 N PHE A 149 128.185 -6.839 13.278 1.00 0.00 N ATOM 2308 CA PHE A 149 127.083 -7.221 12.351 1.00 0.00 C ATOM 2309 C PHE A 149 127.583 -8.282 11.374 1.00 0.00 C ATOM 2310 O PHE A 149 126.993 -9.335 11.240 1.00 0.00 O ATOM 2311 CB PHE A 149 126.594 -5.999 11.563 1.00 0.00 C ATOM 2312 CG PHE A 149 126.530 -4.782 12.459 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.164 -4.908 13.805 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.841 -3.522 11.938 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.112 -3.776 14.626 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.789 -2.390 12.758 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.425 -2.517 14.103 1.00 0.00 C ATOM 0 H PHE A 149 129.019 -6.457 12.832 1.00 0.00 H new ATOM 0 HA PHE A 149 126.255 -7.617 12.939 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.265 -5.807 10.726 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.609 -6.200 11.142 1.00 0.00 H new ATOM 0 HD1 PHE A 149 125.922 -5.880 14.210 1.00 0.00 H new ATOM 0 HD2 PHE A 149 127.122 -3.423 10.900 1.00 0.00 H new ATOM 0 HE1 PHE A 149 125.830 -3.874 15.664 1.00 0.00 H new ATOM 0 HE2 PHE A 149 127.030 -1.418 12.353 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.386 -1.644 14.737 1.00 0.00 H new ATOM 2327 N GLY A 150 128.665 -8.016 10.692 1.00 0.00 N ATOM 2328 CA GLY A 150 129.197 -9.009 9.726 1.00 0.00 C ATOM 2329 C GLY A 150 128.041 -9.829 9.145 1.00 0.00 C ATOM 2330 O GLY A 150 127.825 -10.963 9.520 1.00 0.00 O ATOM 0 H GLY A 150 129.201 -7.151 10.765 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.735 -8.501 8.925 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.911 -9.667 10.221 1.00 0.00 H new