USER MOD reduce.3.24.130724 H: found=0, std=0, add=1113, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1112 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 CYS SG : rot 121:sc= 0.00368 USER MOD Set 1.2: A 106 HIS :FLIP no HE2:sc= -2.99! C(o=-4.5!,f=-3!) USER MOD Set 2.1: A 67 THR OG1 : rot 40:sc= 0.0243 USER MOD Set 2.2: A 94 LYS NZ :NH3+ -131:sc= -0.628 (180deg=-3.06!) USER MOD Set 3.1: A 17 TYR OH : rot -53:sc= -0.0344 USER MOD Set 3.2: A 18 LYS NZ :NH3+ 145:sc= 1.15 (180deg=-0.419) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HE2:sc=-0.00211 K(o=-0.0021,f=-0.8) USER MOD Single : A 20 MET CE :methyl -105:sc= -6.17! (180deg=-12.9!) USER MOD Single : A 25 THR OG1 : rot -99:sc= -1.68 USER MOD Single : A 26 HIS :FLIP no HD1:sc= -6.32! C(o=-7!,f=-6.3!) USER MOD Single : A 27 ASN :FLIP amide:sc= -1.14 F(o=-1.7,f=-1.1) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.078 K(o=-0.078,f=-1.8!) USER MOD Single : A 32 THR OG1 : rot 55:sc= 0.023 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0139 USER MOD Single : A 41 LYS NZ :NH3+ -166:sc= 0.0316 (180deg=0.00441) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 179:sc= -1.69 USER MOD Single : A 46 THR OG1 : rot -42:sc= -3.95! USER MOD Single : A 47 THR OG1 : rot -140:sc= -0.173 USER MOD Single : A 55 THR OG1 : rot 101:sc= 0.523 USER MOD Single : A 56 TYR OH : rot -172:sc= -0.605 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.039 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00158) USER MOD Single : A 89 SER OG : rot 55:sc= 1.37 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 81:sc= -0.555 USER MOD Single : A 102 CYS SG : rot -75:sc= -2.17! USER MOD Single : A 107 CYS SG : rot 180:sc= -1.68 USER MOD Single : A 125 SER OG : rot -150:sc= -1.71! USER MOD Single : A 127 MET CE :methyl -124:sc= -6.98! (180deg=-15.9!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -2.7 K(o=-2.7,f=-11!) USER MOD Single : A 138 GLN : amide:sc= -0.144 K(o=-0.14,f=-2!) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 147 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.166) USER MOD Single : A 148 GLN :FLIP amide:sc= -7.3! C(o=-8.4!,f=-7.3!) USER MOD Single : A 150 THR OG1 : rot 92:sc= 1.21 USER MOD Single : A 151 TYR OH : rot -53:sc= -6.63! USER MOD Single : A 154 LYS NZ :NH3+ -168:sc= 0.942 (180deg=0.792) USER MOD Single : A 155 TYR OH : rot 15:sc= -2.16! USER MOD ----------------------------------------------------------------- ATOM 158 N ALA A 11 -12.744 5.171 -10.733 1.00 0.00 N ATOM 159 CA ALA A 11 -13.558 4.435 -9.773 1.00 0.00 C ATOM 160 C ALA A 11 -12.685 3.733 -8.737 1.00 0.00 C ATOM 161 O ALA A 11 -11.538 3.380 -9.016 1.00 0.00 O ATOM 162 CB ALA A 11 -14.439 3.426 -10.495 1.00 0.00 C ATOM 0 HA ALA A 11 -14.194 5.148 -9.249 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -15.042 2.883 -9.767 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -15.095 3.948 -11.192 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.812 2.723 -11.044 1.00 0.00 H new ATOM 168 N PRO A 12 -13.216 3.522 -7.520 1.00 0.00 N ATOM 169 CA PRO A 12 -12.478 2.861 -6.439 1.00 0.00 C ATOM 170 C PRO A 12 -12.285 1.369 -6.693 1.00 0.00 C ATOM 171 O PRO A 12 -12.946 0.787 -7.554 1.00 0.00 O ATOM 172 CB PRO A 12 -13.367 3.084 -5.214 1.00 0.00 C ATOM 173 CG PRO A 12 -14.741 3.239 -5.768 1.00 0.00 C ATOM 174 CD PRO A 12 -14.577 3.914 -7.103 1.00 0.00 C ATOM 0 HA PRO A 12 -11.470 3.262 -6.331 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.310 2.241 -4.525 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -13.061 3.971 -4.659 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -15.229 2.270 -5.878 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.365 3.836 -5.103 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -15.328 3.579 -7.818 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.676 4.996 -7.021 1.00 0.00 H new ATOM 182 N VAL A 13 -11.378 0.754 -5.939 1.00 0.00 N ATOM 183 CA VAL A 13 -11.104 -0.670 -6.085 1.00 0.00 C ATOM 184 C VAL A 13 -10.802 -1.307 -4.734 1.00 0.00 C ATOM 185 O VAL A 13 -9.948 -0.829 -3.992 1.00 0.00 O ATOM 186 CB VAL A 13 -9.920 -0.921 -7.037 1.00 0.00 C ATOM 187 CG1 VAL A 13 -9.790 -2.405 -7.349 1.00 0.00 C ATOM 188 CG2 VAL A 13 -10.078 -0.112 -8.315 1.00 0.00 C ATOM 0 H VAL A 13 -10.822 1.220 -5.222 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.999 -1.125 -6.508 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.006 -0.596 -6.541 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.948 -2.563 -8.023 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.623 -2.958 -6.425 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.706 -2.759 -7.823 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.231 -0.304 -8.974 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -11.001 -0.401 -8.817 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -10.115 0.950 -8.071 1.00 0.00 H new ATOM 198 N GLU A 14 -11.511 -2.383 -4.415 1.00 0.00 N ATOM 199 CA GLU A 14 -11.310 -3.066 -3.145 1.00 0.00 C ATOM 200 C GLU A 14 -10.652 -4.429 -3.339 1.00 0.00 C ATOM 201 O GLU A 14 -11.231 -5.330 -3.946 1.00 0.00 O ATOM 202 CB GLU A 14 -12.646 -3.234 -2.418 1.00 0.00 C ATOM 203 CG GLU A 14 -13.640 -4.105 -3.168 1.00 0.00 C ATOM 204 CD GLU A 14 -15.051 -3.975 -2.629 1.00 0.00 C ATOM 205 OE1 GLU A 14 -15.758 -3.028 -3.037 1.00 0.00 O ATOM 206 OE2 GLU A 14 -15.449 -4.818 -1.798 1.00 0.00 O ATOM 0 H GLU A 14 -12.225 -2.798 -5.014 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.642 -2.451 -2.541 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.463 -3.669 -1.435 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -13.088 -2.251 -2.255 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.632 -3.833 -4.224 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -13.325 -5.147 -3.105 1.00 0.00 H new ATOM 213 N VAL A 15 -9.450 -4.578 -2.791 1.00 0.00 N ATOM 214 CA VAL A 15 -8.717 -5.837 -2.871 1.00 0.00 C ATOM 215 C VAL A 15 -8.716 -6.499 -1.501 1.00 0.00 C ATOM 216 O VAL A 15 -8.226 -5.923 -0.531 1.00 0.00 O ATOM 217 CB VAL A 15 -7.259 -5.632 -3.342 1.00 0.00 C ATOM 218 CG1 VAL A 15 -6.784 -6.828 -4.153 1.00 0.00 C ATOM 219 CG2 VAL A 15 -7.122 -4.350 -4.153 1.00 0.00 C ATOM 0 H VAL A 15 -8.961 -3.839 -2.285 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.215 -6.470 -3.605 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.630 -5.542 -2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.756 -6.664 -4.475 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.833 -7.727 -3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.423 -6.951 -5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.087 -4.230 -4.472 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.768 -4.403 -5.029 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -7.413 -3.498 -3.539 1.00 0.00 H new ATOM 229 N SER A 16 -9.293 -7.692 -1.406 1.00 0.00 N ATOM 230 CA SER A 16 -9.369 -8.378 -0.122 1.00 0.00 C ATOM 231 C SER A 16 -9.135 -9.876 -0.245 1.00 0.00 C ATOM 232 O SER A 16 -9.550 -10.511 -1.214 1.00 0.00 O ATOM 233 CB SER A 16 -10.733 -8.126 0.521 1.00 0.00 C ATOM 234 OG SER A 16 -11.785 -8.509 -0.348 1.00 0.00 O ATOM 0 H SER A 16 -9.709 -8.197 -2.189 1.00 0.00 H new ATOM 0 HA SER A 16 -8.574 -7.973 0.505 1.00 0.00 H new ATOM 0 HB2 SER A 16 -10.807 -8.684 1.455 1.00 0.00 H new ATOM 0 HB3 SER A 16 -10.831 -7.070 0.772 1.00 0.00 H new ATOM 0 HG SER A 16 -12.647 -8.340 0.087 1.00 0.00 H new ATOM 240 N TYR A 17 -8.496 -10.435 0.775 1.00 0.00 N ATOM 241 CA TYR A 17 -8.227 -11.862 0.833 1.00 0.00 C ATOM 242 C TYR A 17 -8.533 -12.363 2.247 1.00 0.00 C ATOM 243 O TYR A 17 -8.631 -11.564 3.176 1.00 0.00 O ATOM 244 CB TYR A 17 -6.785 -12.155 0.372 1.00 0.00 C ATOM 245 CG TYR A 17 -5.817 -12.614 1.441 1.00 0.00 C ATOM 246 CD1 TYR A 17 -5.160 -11.698 2.253 1.00 0.00 C ATOM 247 CD2 TYR A 17 -5.537 -13.965 1.615 1.00 0.00 C ATOM 248 CE1 TYR A 17 -4.255 -12.115 3.212 1.00 0.00 C ATOM 249 CE2 TYR A 17 -4.632 -14.390 2.569 1.00 0.00 C ATOM 250 CZ TYR A 17 -3.995 -13.461 3.367 1.00 0.00 C ATOM 251 OH TYR A 17 -3.092 -13.879 4.316 1.00 0.00 O ATOM 0 H TYR A 17 -8.152 -9.913 1.581 1.00 0.00 H new ATOM 0 HA TYR A 17 -8.873 -12.408 0.146 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -6.823 -12.919 -0.405 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -6.383 -11.252 -0.088 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -5.359 -10.643 2.133 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -6.035 -14.695 0.994 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -3.754 -11.390 3.837 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -4.424 -15.443 2.690 1.00 0.00 H new ATOM 0 HH TYR A 17 -2.247 -13.398 4.198 1.00 0.00 H new ATOM 261 N LYS A 18 -8.745 -13.668 2.396 1.00 0.00 N ATOM 262 CA LYS A 18 -9.106 -14.254 3.693 1.00 0.00 C ATOM 263 C LYS A 18 -10.253 -13.463 4.344 1.00 0.00 C ATOM 264 O LYS A 18 -11.407 -13.603 3.938 1.00 0.00 O ATOM 265 CB LYS A 18 -7.897 -14.363 4.640 1.00 0.00 C ATOM 266 CG LYS A 18 -6.976 -13.154 4.650 1.00 0.00 C ATOM 267 CD LYS A 18 -6.050 -13.160 5.859 1.00 0.00 C ATOM 268 CE LYS A 18 -5.312 -14.483 6.002 1.00 0.00 C ATOM 269 NZ LYS A 18 -4.002 -14.315 6.691 1.00 0.00 N ATOM 0 H LYS A 18 -8.674 -14.344 1.636 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.450 -15.271 3.506 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -8.262 -14.530 5.653 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -7.315 -15.242 4.362 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.381 -13.142 3.737 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.573 -12.242 4.654 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.327 -12.349 5.767 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.630 -12.969 6.762 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.930 -15.185 6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.151 -14.917 5.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.810 -15.150 7.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.248 -14.211 5.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.032 -13.467 7.292 1.00 0.00 H new ATOM 283 N HIS A 19 -9.948 -12.636 5.350 1.00 0.00 N ATOM 284 CA HIS A 19 -10.978 -11.850 6.025 1.00 0.00 C ATOM 285 C HIS A 19 -10.704 -10.348 5.916 1.00 0.00 C ATOM 286 O HIS A 19 -11.629 -9.537 5.974 1.00 0.00 O ATOM 287 CB HIS A 19 -11.069 -12.253 7.497 1.00 0.00 C ATOM 288 CG HIS A 19 -12.380 -11.911 8.133 1.00 0.00 C ATOM 289 ND1 HIS A 19 -12.780 -10.616 8.385 1.00 0.00 N ATOM 290 CD2 HIS A 19 -13.386 -12.704 8.572 1.00 0.00 C ATOM 291 CE1 HIS A 19 -13.973 -10.625 8.951 1.00 0.00 C ATOM 292 NE2 HIS A 19 -14.365 -11.880 9.075 1.00 0.00 N ATOM 0 H HIS A 19 -9.004 -12.496 5.710 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.927 -12.057 5.531 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -10.903 -13.327 7.582 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -10.268 -11.762 8.049 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -12.238 -9.780 8.168 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -13.414 -13.783 8.534 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -14.533 -9.755 9.260 1.00 0.00 H new ATOM 300 N MET A 20 -9.434 -9.980 5.768 1.00 0.00 N ATOM 301 CA MET A 20 -9.049 -8.573 5.662 1.00 0.00 C ATOM 302 C MET A 20 -9.422 -7.997 4.299 1.00 0.00 C ATOM 303 O MET A 20 -9.729 -8.740 3.366 1.00 0.00 O ATOM 304 CB MET A 20 -7.546 -8.419 5.895 1.00 0.00 C ATOM 305 CG MET A 20 -6.694 -9.159 4.875 1.00 0.00 C ATOM 306 SD MET A 20 -6.416 -8.198 3.375 1.00 0.00 S ATOM 307 CE MET A 20 -5.355 -6.899 4.001 1.00 0.00 C ATOM 0 H MET A 20 -8.654 -10.635 5.719 1.00 0.00 H new ATOM 0 HA MET A 20 -9.593 -8.019 6.427 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.289 -7.360 5.871 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.302 -8.783 6.893 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.733 -9.411 5.324 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.180 -10.099 4.615 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.926 -5.975 4.091 1.00 0.00 H new ATOM 0 HE2 MET A 20 -4.969 -7.184 4.980 1.00 0.00 H new ATOM 0 HE3 MET A 20 -4.523 -6.746 3.314 1.00 0.00 H new ATOM 317 N ARG A 21 -9.393 -6.669 4.188 1.00 0.00 N ATOM 318 CA ARG A 21 -9.731 -6.002 2.933 1.00 0.00 C ATOM 319 C ARG A 21 -8.930 -4.713 2.750 1.00 0.00 C ATOM 320 O ARG A 21 -8.349 -4.186 3.698 1.00 0.00 O ATOM 321 CB ARG A 21 -11.228 -5.693 2.885 1.00 0.00 C ATOM 322 CG ARG A 21 -12.104 -6.848 3.343 1.00 0.00 C ATOM 323 CD ARG A 21 -13.530 -6.703 2.838 1.00 0.00 C ATOM 324 NE ARG A 21 -14.428 -7.676 3.454 1.00 0.00 N ATOM 325 CZ ARG A 21 -15.709 -7.819 3.119 1.00 0.00 C ATOM 326 NH1 ARG A 21 -16.245 -7.054 2.175 1.00 0.00 N ATOM 327 NH2 ARG A 21 -16.456 -8.730 3.728 1.00 0.00 N ATOM 0 H ARG A 21 -9.140 -6.038 4.948 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.474 -6.679 2.119 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.431 -4.824 3.511 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.502 -5.423 1.865 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -11.684 -7.788 2.985 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -12.106 -6.894 4.432 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.888 -5.695 3.047 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -13.546 -6.829 1.755 1.00 0.00 H new ATOM 0 HE ARG A 21 -14.052 -8.282 4.184 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -15.675 -6.352 1.702 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -17.227 -7.168 1.923 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -16.049 -9.321 4.453 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -17.437 -8.839 3.471 1.00 0.00 H new ATOM 341 N PHE A 22 -8.916 -4.214 1.516 1.00 0.00 N ATOM 342 CA PHE A 22 -8.201 -2.985 1.177 1.00 0.00 C ATOM 343 C PHE A 22 -9.046 -2.126 0.245 1.00 0.00 C ATOM 344 O PHE A 22 -9.788 -2.649 -0.585 1.00 0.00 O ATOM 345 CB PHE A 22 -6.867 -3.313 0.500 1.00 0.00 C ATOM 346 CG PHE A 22 -5.675 -3.198 1.405 1.00 0.00 C ATOM 347 CD1 PHE A 22 -5.183 -1.956 1.772 1.00 0.00 C ATOM 348 CD2 PHE A 22 -5.042 -4.334 1.881 1.00 0.00 C ATOM 349 CE1 PHE A 22 -4.081 -1.850 2.600 1.00 0.00 C ATOM 350 CE2 PHE A 22 -3.941 -4.234 2.709 1.00 0.00 C ATOM 351 CZ PHE A 22 -3.460 -2.991 3.068 1.00 0.00 C ATOM 0 H PHE A 22 -9.397 -4.647 0.727 1.00 0.00 H new ATOM 0 HA PHE A 22 -8.007 -2.435 2.098 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -6.913 -4.328 0.104 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.730 -2.645 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.665 -1.061 1.407 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.413 -5.309 1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.707 -0.877 2.880 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.457 -5.127 3.075 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.599 -2.911 3.714 1.00 0.00 H new ATOM 361 N LEU A 23 -8.927 -0.810 0.376 1.00 0.00 N ATOM 362 CA LEU A 23 -9.682 0.105 -0.471 1.00 0.00 C ATOM 363 C LEU A 23 -8.751 0.985 -1.284 1.00 0.00 C ATOM 364 O LEU A 23 -7.797 1.554 -0.757 1.00 0.00 O ATOM 365 CB LEU A 23 -10.613 0.990 0.363 1.00 0.00 C ATOM 366 CG LEU A 23 -11.927 0.338 0.782 1.00 0.00 C ATOM 367 CD1 LEU A 23 -12.641 -0.267 -0.421 1.00 0.00 C ATOM 368 CD2 LEU A 23 -11.673 -0.713 1.850 1.00 0.00 C ATOM 0 H LEU A 23 -8.319 -0.355 1.056 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.283 -0.503 -1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.080 1.306 1.260 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.839 1.891 -0.207 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.577 1.106 1.201 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.575 -0.726 -0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.855 0.516 -1.149 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.005 -1.024 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.618 -1.172 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.005 -1.478 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.214 -0.244 2.720 1.00 0.00 H new ATOM 380 N ILE A 24 -9.044 1.104 -2.567 1.00 0.00 N ATOM 381 CA ILE A 24 -8.249 1.929 -3.457 1.00 0.00 C ATOM 382 C ILE A 24 -9.120 3.048 -4.025 1.00 0.00 C ATOM 383 O ILE A 24 -9.983 2.802 -4.864 1.00 0.00 O ATOM 384 CB ILE A 24 -7.644 1.087 -4.608 1.00 0.00 C ATOM 385 CG1 ILE A 24 -6.306 0.483 -4.173 1.00 0.00 C ATOM 386 CG2 ILE A 24 -7.470 1.919 -5.873 1.00 0.00 C ATOM 387 CD1 ILE A 24 -5.182 1.493 -4.105 1.00 0.00 C ATOM 0 H ILE A 24 -9.831 0.637 -3.017 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.424 2.359 -2.889 1.00 0.00 H new ATOM 0 HB ILE A 24 -8.339 0.279 -4.837 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -6.427 0.019 -3.194 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -6.030 -0.309 -4.869 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.043 1.298 -6.661 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.440 2.299 -6.195 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.802 2.756 -5.669 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.265 0.996 -3.790 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.034 1.939 -5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.436 2.273 -3.387 1.00 0.00 H new ATOM 399 N THR A 25 -8.907 4.270 -3.549 1.00 0.00 N ATOM 400 CA THR A 25 -9.698 5.406 -4.008 1.00 0.00 C ATOM 401 C THR A 25 -8.820 6.594 -4.386 1.00 0.00 C ATOM 402 O THR A 25 -7.641 6.650 -4.045 1.00 0.00 O ATOM 403 CB THR A 25 -10.694 5.824 -2.927 1.00 0.00 C ATOM 404 OG1 THR A 25 -10.022 6.122 -1.715 1.00 0.00 O ATOM 405 CG2 THR A 25 -11.733 4.766 -2.627 1.00 0.00 C ATOM 0 H THR A 25 -8.199 4.498 -2.851 1.00 0.00 H new ATOM 0 HA THR A 25 -10.236 5.090 -4.902 1.00 0.00 H new ATOM 0 HB THR A 25 -11.200 6.703 -3.326 1.00 0.00 H new ATOM 0 HG1 THR A 25 -10.078 5.352 -1.112 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.408 5.128 -1.851 1.00 0.00 H new ATOM 0 HG22 THR A 25 -12.303 4.549 -3.531 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.238 3.858 -2.283 1.00 0.00 H new ATOM 413 N HIS A 26 -9.425 7.546 -5.087 1.00 0.00 N ATOM 414 CA HIS A 26 -8.739 8.755 -5.527 1.00 0.00 C ATOM 415 C HIS A 26 -8.673 9.778 -4.400 1.00 0.00 C ATOM 416 O HIS A 26 -9.515 9.784 -3.505 1.00 0.00 O ATOM 417 CB HIS A 26 -9.429 9.358 -6.756 1.00 0.00 C ATOM 418 CG HIS A 26 -10.901 9.579 -6.588 1.00 0.00 C ATOM 419 ND1 HIS A 26 -11.946 8.722 -6.680 1.00 0.00 N flip ATOM 420 CD2 HIS A 26 -11.450 10.814 -6.308 1.00 0.00 C flip ATOM 421 CE1 HIS A 26 -13.090 9.447 -6.457 1.00 0.00 C flip ATOM 422 NE2 HIS A 26 -12.764 10.707 -6.234 1.00 0.00 N flip ATOM 0 H HIS A 26 -10.405 7.501 -5.366 1.00 0.00 H new ATOM 0 HA HIS A 26 -7.721 8.482 -5.805 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.955 10.310 -6.994 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -9.267 8.699 -7.609 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -10.891 11.728 -6.171 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -14.095 9.051 -6.463 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -13.415 11.467 -6.038 1.00 0.00 H new ATOM 430 N ASN A 27 -7.654 10.629 -4.434 1.00 0.00 N ATOM 431 CA ASN A 27 -7.475 11.637 -3.396 1.00 0.00 C ATOM 432 C ASN A 27 -8.662 12.595 -3.390 1.00 0.00 C ATOM 433 O ASN A 27 -9.357 12.744 -4.394 1.00 0.00 O ATOM 434 CB ASN A 27 -6.173 12.409 -3.618 1.00 0.00 C ATOM 435 CG ASN A 27 -5.299 12.436 -2.378 1.00 0.00 C ATOM 436 OD1 ASN A 27 -5.049 13.630 -1.856 1.00 0.00 O flip ATOM 437 ND2 ASN A 27 -4.853 11.393 -1.898 1.00 0.00 N flip ATOM 0 H ASN A 27 -6.943 10.641 -5.165 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.418 11.137 -2.429 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.620 11.954 -4.440 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -6.406 13.431 -3.918 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -5.072 10.497 -2.333 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.265 11.425 -1.065 1.00 0.00 H new ATOM 444 N PRO A 28 -8.940 13.223 -2.236 1.00 0.00 N ATOM 445 CA PRO A 28 -10.083 14.126 -2.088 1.00 0.00 C ATOM 446 C PRO A 28 -10.109 15.236 -3.125 1.00 0.00 C ATOM 447 O PRO A 28 -9.085 15.844 -3.437 1.00 0.00 O ATOM 448 CB PRO A 28 -9.903 14.710 -0.685 1.00 0.00 C ATOM 449 CG PRO A 28 -9.095 13.696 0.049 1.00 0.00 C ATOM 450 CD PRO A 28 -8.192 13.066 -0.974 1.00 0.00 C ATOM 0 HA PRO A 28 -11.025 13.596 -2.230 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -9.393 15.673 -0.720 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.865 14.876 -0.199 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.516 14.162 0.847 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.737 12.949 0.516 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.224 13.565 -1.016 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -8.000 12.017 -0.749 1.00 0.00 H new ATOM 458 N THR A 29 -11.303 15.491 -3.654 1.00 0.00 N ATOM 459 CA THR A 29 -11.496 16.525 -4.658 1.00 0.00 C ATOM 460 C THR A 29 -12.025 17.795 -4.009 1.00 0.00 C ATOM 461 O THR A 29 -12.776 17.741 -3.036 1.00 0.00 O ATOM 462 CB THR A 29 -12.467 16.045 -5.738 1.00 0.00 C ATOM 463 OG1 THR A 29 -12.383 14.641 -5.902 1.00 0.00 O ATOM 464 CG2 THR A 29 -12.222 16.681 -7.090 1.00 0.00 C ATOM 0 H THR A 29 -12.154 14.990 -3.400 1.00 0.00 H new ATOM 0 HA THR A 29 -10.534 16.740 -5.123 1.00 0.00 H new ATOM 0 HB THR A 29 -13.456 16.343 -5.388 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.013 14.354 -6.596 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.945 16.297 -7.809 1.00 0.00 H new ATOM 0 HG22 THR A 29 -12.331 17.762 -7.008 1.00 0.00 H new ATOM 0 HG23 THR A 29 -11.213 16.442 -7.427 1.00 0.00 H new ATOM 472 N ASN A 30 -11.616 18.936 -4.542 1.00 0.00 N ATOM 473 CA ASN A 30 -12.035 20.220 -4.001 1.00 0.00 C ATOM 474 C ASN A 30 -13.521 20.486 -4.228 1.00 0.00 C ATOM 475 O ASN A 30 -14.069 21.437 -3.669 1.00 0.00 O ATOM 476 CB ASN A 30 -11.207 21.347 -4.621 1.00 0.00 C ATOM 477 CG ASN A 30 -11.069 22.539 -3.694 1.00 0.00 C ATOM 478 OD1 ASN A 30 -11.563 22.524 -2.566 1.00 0.00 O ATOM 479 ND2 ASN A 30 -10.394 23.580 -4.165 1.00 0.00 N ATOM 0 H ASN A 30 -10.995 18.999 -5.348 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.867 20.187 -2.924 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -10.216 20.970 -4.874 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -11.673 21.667 -5.553 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -10.268 24.410 -3.586 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -10.001 23.550 -5.106 1.00 0.00 H new ATOM 486 N ALA A 31 -14.180 19.673 -5.055 1.00 0.00 N ATOM 487 CA ALA A 31 -15.597 19.893 -5.322 1.00 0.00 C ATOM 488 C ALA A 31 -16.507 19.081 -4.398 1.00 0.00 C ATOM 489 O ALA A 31 -17.596 19.537 -4.052 1.00 0.00 O ATOM 490 CB ALA A 31 -15.906 19.568 -6.776 1.00 0.00 C ATOM 0 H ALA A 31 -13.766 18.876 -5.539 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.801 20.945 -5.124 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -16.966 19.734 -6.969 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -15.314 20.211 -7.426 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.660 18.525 -6.976 1.00 0.00 H new ATOM 496 N THR A 32 -16.066 17.896 -3.976 1.00 0.00 N ATOM 497 CA THR A 32 -16.877 17.085 -3.068 1.00 0.00 C ATOM 498 C THR A 32 -16.030 16.402 -1.998 1.00 0.00 C ATOM 499 O THR A 32 -15.604 15.260 -2.175 1.00 0.00 O ATOM 500 CB THR A 32 -17.660 16.034 -3.856 1.00 0.00 C ATOM 501 OG1 THR A 32 -16.845 15.447 -4.856 1.00 0.00 O ATOM 502 CG2 THR A 32 -18.891 16.592 -4.538 1.00 0.00 C ATOM 0 H THR A 32 -15.172 17.483 -4.241 1.00 0.00 H new ATOM 0 HA THR A 32 -17.570 17.758 -2.564 1.00 0.00 H new ATOM 0 HB THR A 32 -17.975 15.296 -3.119 1.00 0.00 H new ATOM 0 HG1 THR A 32 -16.034 15.083 -4.445 1.00 0.00 H new ATOM 0 HG21 THR A 32 -19.400 15.794 -5.079 1.00 0.00 H new ATOM 0 HG22 THR A 32 -19.564 17.010 -3.789 1.00 0.00 H new ATOM 0 HG23 THR A 32 -18.596 17.374 -5.237 1.00 0.00 H new ATOM 510 N LEU A 33 -15.816 17.078 -0.878 1.00 0.00 N ATOM 511 CA LEU A 33 -15.052 16.497 0.221 1.00 0.00 C ATOM 512 C LEU A 33 -15.913 15.561 1.069 1.00 0.00 C ATOM 513 O LEU A 33 -15.534 14.421 1.343 1.00 0.00 O ATOM 514 CB LEU A 33 -14.421 17.586 1.087 1.00 0.00 C ATOM 515 CG LEU A 33 -12.891 17.590 1.073 1.00 0.00 C ATOM 516 CD1 LEU A 33 -12.347 16.316 1.701 1.00 0.00 C ATOM 517 CD2 LEU A 33 -12.376 17.736 -0.350 1.00 0.00 C ATOM 0 H LEU A 33 -16.157 18.023 -0.705 1.00 0.00 H new ATOM 0 HA LEU A 33 -14.250 15.903 -0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -14.779 18.558 0.747 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -14.764 17.462 2.114 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.544 18.440 1.660 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.257 16.337 1.682 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -12.690 16.244 2.733 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.703 15.453 1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.286 17.737 -0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -12.735 16.903 -0.954 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -12.738 18.673 -0.773 1.00 0.00 H new ATOM 529 N SER A 34 -17.063 16.073 1.504 1.00 0.00 N ATOM 530 CA SER A 34 -17.988 15.323 2.354 1.00 0.00 C ATOM 531 C SER A 34 -18.405 13.993 1.730 1.00 0.00 C ATOM 532 O SER A 34 -18.431 12.966 2.405 1.00 0.00 O ATOM 533 CB SER A 34 -19.231 16.165 2.643 1.00 0.00 C ATOM 534 OG SER A 34 -19.059 16.946 3.812 1.00 0.00 O ATOM 0 H SER A 34 -17.380 17.016 1.279 1.00 0.00 H new ATOM 0 HA SER A 34 -17.462 15.100 3.282 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.438 16.817 1.794 1.00 0.00 H new ATOM 0 HB3 SER A 34 -20.096 15.513 2.762 1.00 0.00 H new ATOM 0 HG SER A 34 -19.867 17.476 3.973 1.00 0.00 H new ATOM 540 N THR A 35 -18.747 14.014 0.451 1.00 0.00 N ATOM 541 CA THR A 35 -19.177 12.799 -0.234 1.00 0.00 C ATOM 542 C THR A 35 -18.106 11.713 -0.163 1.00 0.00 C ATOM 543 O THR A 35 -18.415 10.522 -0.062 1.00 0.00 O ATOM 544 CB THR A 35 -19.507 13.104 -1.695 1.00 0.00 C ATOM 545 OG1 THR A 35 -20.239 14.313 -1.802 1.00 0.00 O ATOM 546 CG2 THR A 35 -20.317 12.016 -2.367 1.00 0.00 C ATOM 0 H THR A 35 -18.736 14.851 -0.132 1.00 0.00 H new ATOM 0 HA THR A 35 -20.071 12.432 0.270 1.00 0.00 H new ATOM 0 HB THR A 35 -18.543 13.179 -2.198 1.00 0.00 H new ATOM 0 HG1 THR A 35 -20.439 14.492 -2.745 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.516 12.297 -3.401 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.758 11.081 -2.346 1.00 0.00 H new ATOM 0 HG23 THR A 35 -21.261 11.886 -1.838 1.00 0.00 H new ATOM 554 N PHE A 36 -16.846 12.127 -0.232 1.00 0.00 N ATOM 555 CA PHE A 36 -15.735 11.185 -0.197 1.00 0.00 C ATOM 556 C PHE A 36 -15.519 10.594 1.192 1.00 0.00 C ATOM 557 O PHE A 36 -15.372 9.383 1.339 1.00 0.00 O ATOM 558 CB PHE A 36 -14.451 11.871 -0.663 1.00 0.00 C ATOM 559 CG PHE A 36 -13.660 11.081 -1.667 1.00 0.00 C ATOM 560 CD1 PHE A 36 -13.863 9.717 -1.834 1.00 0.00 C ATOM 561 CD2 PHE A 36 -12.707 11.709 -2.442 1.00 0.00 C ATOM 562 CE1 PHE A 36 -13.126 9.001 -2.757 1.00 0.00 C ATOM 563 CE2 PHE A 36 -11.966 11.000 -3.366 1.00 0.00 C ATOM 564 CZ PHE A 36 -12.177 9.643 -3.523 1.00 0.00 C ATOM 0 H PHE A 36 -16.569 13.105 -0.312 1.00 0.00 H new ATOM 0 HA PHE A 36 -15.989 10.366 -0.870 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -14.706 12.838 -1.097 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.822 12.068 0.205 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -14.606 9.211 -1.235 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.538 12.769 -2.324 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.293 7.941 -2.878 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.223 11.505 -3.965 1.00 0.00 H new ATOM 0 HZ PHE A 36 -11.599 9.086 -4.245 1.00 0.00 H new ATOM 574 N ILE A 37 -15.491 11.444 2.211 1.00 0.00 N ATOM 575 CA ILE A 37 -15.281 10.976 3.572 1.00 0.00 C ATOM 576 C ILE A 37 -16.315 9.926 3.950 1.00 0.00 C ATOM 577 O ILE A 37 -16.002 8.934 4.610 1.00 0.00 O ATOM 578 CB ILE A 37 -15.336 12.128 4.590 1.00 0.00 C ATOM 579 CG1 ILE A 37 -16.537 13.040 4.327 1.00 0.00 C ATOM 580 CG2 ILE A 37 -14.039 12.925 4.568 1.00 0.00 C ATOM 581 CD1 ILE A 37 -16.782 14.046 5.430 1.00 0.00 C ATOM 0 H ILE A 37 -15.610 12.453 2.121 1.00 0.00 H new ATOM 0 HA ILE A 37 -14.285 10.535 3.602 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.457 11.694 5.583 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -16.381 13.572 3.389 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.429 12.426 4.201 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.097 13.735 5.295 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.205 12.270 4.821 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -13.884 13.341 3.572 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -17.647 14.659 5.178 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -16.970 13.521 6.366 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -15.906 14.684 5.542 1.00 0.00 H new ATOM 593 N GLU A 38 -17.547 10.157 3.526 1.00 0.00 N ATOM 594 CA GLU A 38 -18.642 9.240 3.812 1.00 0.00 C ATOM 595 C GLU A 38 -18.427 7.885 3.141 1.00 0.00 C ATOM 596 O GLU A 38 -18.508 6.847 3.795 1.00 0.00 O ATOM 597 CB GLU A 38 -19.969 9.843 3.352 1.00 0.00 C ATOM 598 CG GLU A 38 -20.477 10.957 4.252 1.00 0.00 C ATOM 599 CD GLU A 38 -20.884 10.457 5.624 1.00 0.00 C ATOM 600 OE1 GLU A 38 -19.987 10.117 6.424 1.00 0.00 O ATOM 601 OE2 GLU A 38 -22.102 10.407 5.901 1.00 0.00 O ATOM 0 H GLU A 38 -17.816 10.975 2.980 1.00 0.00 H new ATOM 0 HA GLU A 38 -18.670 9.082 4.890 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.851 10.231 2.340 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -20.720 9.054 3.305 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -19.700 11.714 4.361 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -21.330 11.442 3.778 1.00 0.00 H new ATOM 608 N ASP A 39 -18.166 7.896 1.833 1.00 0.00 N ATOM 609 CA ASP A 39 -17.960 6.651 1.090 1.00 0.00 C ATOM 610 C ASP A 39 -16.670 5.943 1.513 1.00 0.00 C ATOM 611 O ASP A 39 -16.676 4.744 1.817 1.00 0.00 O ATOM 612 CB ASP A 39 -17.919 6.938 -0.413 1.00 0.00 C ATOM 613 CG ASP A 39 -19.289 6.840 -1.057 1.00 0.00 C ATOM 614 OD1 ASP A 39 -20.229 7.490 -0.555 1.00 0.00 O ATOM 615 OD2 ASP A 39 -19.419 6.114 -2.065 1.00 0.00 O ATOM 0 H ASP A 39 -18.093 8.744 1.270 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.797 5.990 1.318 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.513 7.936 -0.579 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -17.242 6.234 -0.896 1.00 0.00 H new ATOM 620 N LEU A 40 -15.569 6.689 1.535 1.00 0.00 N ATOM 621 CA LEU A 40 -14.275 6.133 1.922 1.00 0.00 C ATOM 622 C LEU A 40 -14.361 5.480 3.296 1.00 0.00 C ATOM 623 O LEU A 40 -13.894 4.358 3.493 1.00 0.00 O ATOM 624 CB LEU A 40 -13.200 7.224 1.918 1.00 0.00 C ATOM 625 CG LEU A 40 -12.977 7.911 0.569 1.00 0.00 C ATOM 626 CD1 LEU A 40 -12.102 9.144 0.730 1.00 0.00 C ATOM 627 CD2 LEU A 40 -12.354 6.948 -0.429 1.00 0.00 C ATOM 0 H LEU A 40 -15.546 7.679 1.290 1.00 0.00 H new ATOM 0 HA LEU A 40 -13.999 5.370 1.194 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.471 7.982 2.654 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.257 6.785 2.245 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.948 8.225 0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.957 9.616 -0.242 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.586 9.848 1.407 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.135 8.853 1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.204 7.457 -1.381 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.394 6.600 -0.048 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.017 6.095 -0.574 1.00 0.00 H new ATOM 639 N LYS A 41 -14.980 6.183 4.236 1.00 0.00 N ATOM 640 CA LYS A 41 -15.150 5.667 5.585 1.00 0.00 C ATOM 641 C LYS A 41 -16.281 4.644 5.619 1.00 0.00 C ATOM 642 O LYS A 41 -16.301 3.750 6.465 1.00 0.00 O ATOM 643 CB LYS A 41 -15.443 6.808 6.561 1.00 0.00 C ATOM 644 CG LYS A 41 -14.938 6.548 7.971 1.00 0.00 C ATOM 645 CD LYS A 41 -15.932 7.024 9.018 1.00 0.00 C ATOM 646 CE LYS A 41 -15.662 8.462 9.429 1.00 0.00 C ATOM 647 NZ LYS A 41 -16.374 9.433 8.552 1.00 0.00 N ATOM 0 H LYS A 41 -15.372 7.113 4.087 1.00 0.00 H new ATOM 0 HA LYS A 41 -14.224 5.179 5.888 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -14.987 7.723 6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.519 6.978 6.595 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -14.754 5.482 8.101 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -13.985 7.056 8.116 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -16.945 6.941 8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -15.877 6.378 9.894 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -15.975 8.609 10.463 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.590 8.656 9.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.988 10.386 8.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -16.244 9.162 7.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -17.388 9.430 8.782 1.00 0.00 H new ATOM 661 N LYS A 42 -17.224 4.788 4.690 1.00 0.00 N ATOM 662 CA LYS A 42 -18.367 3.885 4.603 1.00 0.00 C ATOM 663 C LYS A 42 -17.921 2.431 4.521 1.00 0.00 C ATOM 664 O LYS A 42 -18.513 1.560 5.160 1.00 0.00 O ATOM 665 CB LYS A 42 -19.230 4.233 3.389 1.00 0.00 C ATOM 666 CG LYS A 42 -20.578 4.836 3.753 1.00 0.00 C ATOM 667 CD LYS A 42 -21.682 4.335 2.834 1.00 0.00 C ATOM 668 CE LYS A 42 -22.164 5.429 1.894 1.00 0.00 C ATOM 669 NZ LYS A 42 -23.374 5.013 1.133 1.00 0.00 N ATOM 0 H LYS A 42 -17.218 5.525 3.985 1.00 0.00 H new ATOM 0 HA LYS A 42 -18.957 4.010 5.511 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -18.686 4.935 2.756 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.392 3.331 2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -20.822 4.586 4.786 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.519 5.923 3.693 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -21.316 3.489 2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -22.518 3.973 3.432 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -22.387 6.328 2.468 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -21.367 5.686 1.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.671 5.786 0.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -23.154 4.170 0.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -24.143 4.792 1.797 1.00 0.00 H new ATOM 683 N TYR A 43 -16.884 2.160 3.728 1.00 0.00 N ATOM 684 CA TYR A 43 -16.401 0.792 3.586 1.00 0.00 C ATOM 685 C TYR A 43 -15.879 0.258 4.915 1.00 0.00 C ATOM 686 O TYR A 43 -16.085 -0.909 5.247 1.00 0.00 O ATOM 687 CB TYR A 43 -15.298 0.713 2.536 1.00 0.00 C ATOM 688 CG TYR A 43 -14.957 -0.705 2.138 1.00 0.00 C ATOM 689 CD1 TYR A 43 -14.231 -1.522 2.992 1.00 0.00 C ATOM 690 CD2 TYR A 43 -15.359 -1.226 0.915 1.00 0.00 C ATOM 691 CE1 TYR A 43 -13.911 -2.818 2.643 1.00 0.00 C ATOM 692 CE2 TYR A 43 -15.044 -2.523 0.555 1.00 0.00 C ATOM 693 CZ TYR A 43 -14.321 -3.315 1.423 1.00 0.00 C ATOM 694 OH TYR A 43 -14.005 -4.607 1.069 1.00 0.00 O ATOM 0 H TYR A 43 -16.373 2.856 3.185 1.00 0.00 H new ATOM 0 HA TYR A 43 -17.242 0.178 3.265 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.608 1.268 1.650 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.403 1.201 2.921 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.910 -1.136 3.948 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.926 -0.608 0.235 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.343 -3.439 3.320 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.362 -2.914 -0.400 1.00 0.00 H new ATOM 0 HH TYR A 43 -14.382 -4.806 0.187 1.00 0.00 H new ATOM 704 N GLY A 44 -15.209 1.116 5.677 1.00 0.00 N ATOM 705 CA GLY A 44 -14.683 0.700 6.963 1.00 0.00 C ATOM 706 C GLY A 44 -13.667 1.669 7.524 1.00 0.00 C ATOM 707 O GLY A 44 -13.405 2.715 6.930 1.00 0.00 O ATOM 0 H GLY A 44 -15.022 2.087 5.428 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.506 0.595 7.670 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.223 -0.283 6.861 1.00 0.00 H new ATOM 711 N ALA A 45 -13.115 1.342 8.691 1.00 0.00 N ATOM 712 CA ALA A 45 -12.154 2.228 9.335 1.00 0.00 C ATOM 713 C ALA A 45 -10.862 1.544 9.795 1.00 0.00 C ATOM 714 O ALA A 45 -10.873 0.689 10.679 1.00 0.00 O ATOM 715 CB ALA A 45 -12.824 2.899 10.508 1.00 0.00 C ATOM 0 H ALA A 45 -13.314 0.482 9.202 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.845 2.951 8.580 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.115 3.566 10.999 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.680 3.475 10.157 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.161 2.142 11.216 1.00 0.00 H new ATOM 721 N THR A 46 -9.752 1.981 9.210 1.00 0.00 N ATOM 722 CA THR A 46 -8.418 1.492 9.555 1.00 0.00 C ATOM 723 C THR A 46 -7.382 2.447 8.976 1.00 0.00 C ATOM 724 O THR A 46 -7.733 3.532 8.514 1.00 0.00 O ATOM 725 CB THR A 46 -8.180 0.050 9.108 1.00 0.00 C ATOM 726 OG1 THR A 46 -9.384 -0.687 9.169 1.00 0.00 O ATOM 727 CG2 THR A 46 -7.167 -0.679 9.966 1.00 0.00 C ATOM 0 H THR A 46 -9.751 2.690 8.477 1.00 0.00 H new ATOM 0 HA THR A 46 -8.326 1.471 10.641 1.00 0.00 H new ATOM 0 HB THR A 46 -7.797 0.117 8.090 1.00 0.00 H new ATOM 0 HG1 THR A 46 -9.864 -0.462 9.993 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.043 -1.697 9.597 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.211 -0.158 9.922 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.517 -0.707 10.998 1.00 0.00 H new ATOM 735 N THR A 47 -6.112 2.069 9.008 1.00 0.00 N ATOM 736 CA THR A 47 -5.070 2.939 8.487 1.00 0.00 C ATOM 737 C THR A 47 -5.242 3.138 6.981 1.00 0.00 C ATOM 738 O THR A 47 -5.940 2.372 6.306 1.00 0.00 O ATOM 739 CB THR A 47 -3.688 2.355 8.783 1.00 0.00 C ATOM 740 OG1 THR A 47 -2.681 3.087 8.108 1.00 0.00 O ATOM 741 CG2 THR A 47 -3.552 0.904 8.376 1.00 0.00 C ATOM 0 H THR A 47 -5.782 1.180 9.383 1.00 0.00 H new ATOM 0 HA THR A 47 -5.155 3.907 8.980 1.00 0.00 H new ATOM 0 HB THR A 47 -3.570 2.424 9.864 1.00 0.00 H new ATOM 0 HG1 THR A 47 -2.006 2.469 7.758 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.548 0.552 8.614 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.284 0.304 8.917 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.726 0.809 7.304 1.00 0.00 H new ATOM 749 N VAL A 48 -4.629 4.196 6.468 1.00 0.00 N ATOM 750 CA VAL A 48 -4.735 4.528 5.055 1.00 0.00 C ATOM 751 C VAL A 48 -3.393 4.971 4.491 1.00 0.00 C ATOM 752 O VAL A 48 -2.688 5.766 5.108 1.00 0.00 O ATOM 753 CB VAL A 48 -5.760 5.663 4.844 1.00 0.00 C ATOM 754 CG1 VAL A 48 -5.900 6.021 3.370 1.00 0.00 C ATOM 755 CG2 VAL A 48 -7.106 5.280 5.438 1.00 0.00 C ATOM 0 H VAL A 48 -4.053 4.839 7.010 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.063 3.629 4.533 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.391 6.548 5.362 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.629 6.823 3.258 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.936 6.350 2.982 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.235 5.146 2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.817 6.091 5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -7.474 4.376 4.953 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -6.994 5.098 6.507 1.00 0.00 H new ATOM 765 N VAL A 49 -3.046 4.473 3.309 1.00 0.00 N ATOM 766 CA VAL A 49 -1.795 4.863 2.678 1.00 0.00 C ATOM 767 C VAL A 49 -2.051 5.615 1.379 1.00 0.00 C ATOM 768 O VAL A 49 -2.395 5.024 0.347 1.00 0.00 O ATOM 769 CB VAL A 49 -0.877 3.655 2.402 1.00 0.00 C ATOM 770 CG1 VAL A 49 -1.504 2.701 1.400 1.00 0.00 C ATOM 771 CG2 VAL A 49 0.488 4.123 1.923 1.00 0.00 C ATOM 0 H VAL A 49 -3.606 3.808 2.776 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.285 5.520 3.383 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.747 3.111 3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.831 1.861 1.228 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.452 2.333 1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.679 3.224 0.460 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.123 3.258 1.733 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.374 4.698 1.004 1.00 0.00 H new ATOM 0 HG23 VAL A 49 0.947 4.749 2.688 1.00 0.00 H new ATOM 781 N ARG A 50 -1.867 6.924 1.431 1.00 0.00 N ATOM 782 CA ARG A 50 -2.053 7.759 0.260 1.00 0.00 C ATOM 783 C ARG A 50 -0.725 8.368 -0.151 1.00 0.00 C ATOM 784 O ARG A 50 -0.190 9.231 0.545 1.00 0.00 O ATOM 785 CB ARG A 50 -3.076 8.861 0.543 1.00 0.00 C ATOM 786 CG ARG A 50 -2.771 9.668 1.796 1.00 0.00 C ATOM 787 CD ARG A 50 -2.894 11.163 1.543 1.00 0.00 C ATOM 788 NE ARG A 50 -4.154 11.702 2.049 1.00 0.00 N ATOM 789 CZ ARG A 50 -4.359 12.044 3.319 1.00 0.00 C ATOM 790 NH1 ARG A 50 -3.391 11.905 4.218 1.00 0.00 N ATOM 791 NH2 ARG A 50 -5.537 12.526 3.693 1.00 0.00 N ATOM 0 H ARG A 50 -1.589 7.429 2.272 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.431 7.142 -0.555 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -3.117 9.535 -0.312 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.064 8.411 0.642 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.455 9.376 2.593 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.763 9.438 2.141 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -2.061 11.681 2.019 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -2.821 11.357 0.473 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.923 11.824 1.390 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -2.483 11.534 3.937 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -3.555 12.169 5.189 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -6.285 12.634 3.008 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -5.695 12.788 4.666 1.00 0.00 H new ATOM 805 N VAL A 51 -0.195 7.934 -1.285 1.00 0.00 N ATOM 806 CA VAL A 51 1.066 8.471 -1.762 1.00 0.00 C ATOM 807 C VAL A 51 0.832 9.362 -2.964 1.00 0.00 C ATOM 808 O VAL A 51 0.824 8.911 -4.109 1.00 0.00 O ATOM 809 CB VAL A 51 2.050 7.353 -2.147 1.00 0.00 C ATOM 810 CG1 VAL A 51 3.409 7.942 -2.480 1.00 0.00 C ATOM 811 CG2 VAL A 51 2.161 6.318 -1.034 1.00 0.00 C ATOM 0 H VAL A 51 -0.613 7.221 -1.883 1.00 0.00 H new ATOM 0 HA VAL A 51 1.503 9.050 -0.948 1.00 0.00 H new ATOM 0 HB VAL A 51 1.668 6.846 -3.033 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.096 7.141 -2.751 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.311 8.634 -3.317 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.797 8.475 -1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.863 5.538 -1.331 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.518 6.800 -0.124 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.182 5.875 -0.850 1.00 0.00 H new ATOM 821 N CYS A 52 0.652 10.636 -2.677 1.00 0.00 N ATOM 822 CA CYS A 52 0.425 11.635 -3.697 1.00 0.00 C ATOM 823 C CYS A 52 0.799 12.995 -3.147 1.00 0.00 C ATOM 824 O CYS A 52 1.050 13.136 -1.950 1.00 0.00 O ATOM 825 CB CYS A 52 -1.036 11.628 -4.150 1.00 0.00 C ATOM 826 SG CYS A 52 -1.265 11.975 -5.909 1.00 0.00 S ATOM 0 H CYS A 52 0.659 11.006 -1.727 1.00 0.00 H new ATOM 0 HA CYS A 52 1.044 11.407 -4.565 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -1.471 10.655 -3.923 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.589 12.367 -3.570 1.00 0.00 H new ATOM 0 HG CYS A 52 -1.869 10.972 -6.474 1.00 0.00 H new ATOM 832 N GLU A 53 0.822 13.997 -4.003 1.00 0.00 N ATOM 833 CA GLU A 53 1.151 15.334 -3.556 1.00 0.00 C ATOM 834 C GLU A 53 0.067 15.814 -2.594 1.00 0.00 C ATOM 835 O GLU A 53 -1.125 15.679 -2.868 1.00 0.00 O ATOM 836 CB GLU A 53 1.305 16.262 -4.758 1.00 0.00 C ATOM 837 CG GLU A 53 2.013 15.607 -5.945 1.00 0.00 C ATOM 838 CD GLU A 53 3.047 14.557 -5.537 1.00 0.00 C ATOM 839 OE1 GLU A 53 4.093 14.945 -4.975 1.00 0.00 O ATOM 840 OE2 GLU A 53 2.810 13.345 -5.781 1.00 0.00 O ATOM 0 H GLU A 53 0.620 13.913 -4.999 1.00 0.00 H new ATOM 0 HA GLU A 53 2.103 15.335 -3.025 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.319 16.601 -5.075 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.864 17.147 -4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.268 15.140 -6.589 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.505 16.380 -6.535 1.00 0.00 H new ATOM 847 N VAL A 54 0.493 16.318 -1.445 1.00 0.00 N ATOM 848 CA VAL A 54 -0.438 16.757 -0.406 1.00 0.00 C ATOM 849 C VAL A 54 -1.151 18.062 -0.743 1.00 0.00 C ATOM 850 O VAL A 54 -0.517 19.096 -0.951 1.00 0.00 O ATOM 851 CB VAL A 54 0.279 16.924 0.947 1.00 0.00 C ATOM 852 CG1 VAL A 54 0.581 15.566 1.562 1.00 0.00 C ATOM 853 CG2 VAL A 54 1.553 17.738 0.781 1.00 0.00 C ATOM 0 H VAL A 54 1.477 16.435 -1.205 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.190 15.970 -0.343 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.383 17.465 1.623 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.088 15.704 2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.351 15.023 1.720 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.223 14.997 0.890 1.00 0.00 H new ATOM 0 HG21 VAL A 54 2.045 17.845 1.748 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.222 17.229 0.088 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.306 18.724 0.389 1.00 0.00 H new ATOM 863 N THR A 55 -2.483 18.006 -0.756 1.00 0.00 N ATOM 864 CA THR A 55 -3.297 19.184 -1.022 1.00 0.00 C ATOM 865 C THR A 55 -4.214 19.473 0.168 1.00 0.00 C ATOM 866 O THR A 55 -4.294 20.606 0.643 1.00 0.00 O ATOM 867 CB THR A 55 -4.131 18.981 -2.288 1.00 0.00 C ATOM 868 OG1 THR A 55 -4.764 17.714 -2.274 1.00 0.00 O ATOM 869 CG2 THR A 55 -3.317 19.074 -3.561 1.00 0.00 C ATOM 0 H THR A 55 -3.018 17.155 -0.585 1.00 0.00 H new ATOM 0 HA THR A 55 -2.634 20.036 -1.172 1.00 0.00 H new ATOM 0 HB THR A 55 -4.864 19.788 -2.284 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.703 17.821 -2.016 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.968 18.921 -4.421 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.855 20.059 -3.626 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.541 18.309 -3.553 1.00 0.00 H new ATOM 877 N TYR A 56 -4.890 18.431 0.655 1.00 0.00 N ATOM 878 CA TYR A 56 -5.788 18.557 1.803 1.00 0.00 C ATOM 879 C TYR A 56 -5.491 17.473 2.837 1.00 0.00 C ATOM 880 O TYR A 56 -6.137 16.426 2.845 1.00 0.00 O ATOM 881 CB TYR A 56 -7.250 18.455 1.355 1.00 0.00 C ATOM 882 CG TYR A 56 -7.504 18.984 -0.040 1.00 0.00 C ATOM 883 CD1 TYR A 56 -7.365 20.335 -0.326 1.00 0.00 C ATOM 884 CD2 TYR A 56 -7.884 18.130 -1.068 1.00 0.00 C ATOM 885 CE1 TYR A 56 -7.598 20.822 -1.599 1.00 0.00 C ATOM 886 CE2 TYR A 56 -8.118 18.609 -2.344 1.00 0.00 C ATOM 887 CZ TYR A 56 -7.973 19.956 -2.603 1.00 0.00 C ATOM 888 OH TYR A 56 -8.205 20.437 -3.871 1.00 0.00 O ATOM 0 H TYR A 56 -4.832 17.488 0.271 1.00 0.00 H new ATOM 0 HA TYR A 56 -5.623 19.534 2.256 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.561 17.411 1.399 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -7.875 19.004 2.060 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -7.070 21.017 0.458 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.998 17.075 -0.867 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -7.487 21.876 -1.805 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -8.412 17.933 -3.133 1.00 0.00 H new ATOM 0 HH TYR A 56 -8.581 19.724 -4.428 1.00 0.00 H new ATOM 898 N ASP A 57 -4.508 17.714 3.696 1.00 0.00 N ATOM 899 CA ASP A 57 -4.133 16.737 4.717 1.00 0.00 C ATOM 900 C ASP A 57 -5.080 16.742 5.920 1.00 0.00 C ATOM 901 O ASP A 57 -5.336 15.697 6.519 1.00 0.00 O ATOM 902 CB ASP A 57 -2.702 16.996 5.187 1.00 0.00 C ATOM 903 CG ASP A 57 -1.671 16.575 4.158 1.00 0.00 C ATOM 904 OD1 ASP A 57 -1.750 15.426 3.674 1.00 0.00 O ATOM 905 OD2 ASP A 57 -0.783 17.393 3.837 1.00 0.00 O ATOM 0 H ASP A 57 -3.957 18.572 3.708 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.205 15.753 4.255 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.581 18.057 5.406 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.525 16.456 6.117 1.00 0.00 H new ATOM 910 N LYS A 58 -5.565 17.921 6.296 1.00 0.00 N ATOM 911 CA LYS A 58 -6.446 18.055 7.460 1.00 0.00 C ATOM 912 C LYS A 58 -7.895 17.654 7.173 1.00 0.00 C ATOM 913 O LYS A 58 -8.505 16.917 7.947 1.00 0.00 O ATOM 914 CB LYS A 58 -6.404 19.495 7.978 1.00 0.00 C ATOM 915 CG LYS A 58 -5.992 19.603 9.437 1.00 0.00 C ATOM 916 CD LYS A 58 -4.569 20.119 9.581 1.00 0.00 C ATOM 917 CE LYS A 58 -3.851 19.458 10.746 1.00 0.00 C ATOM 918 NZ LYS A 58 -2.373 19.605 10.643 1.00 0.00 N ATOM 0 H LYS A 58 -5.366 18.798 5.815 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.072 17.365 8.216 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.708 20.072 7.369 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.388 19.947 7.852 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.676 20.271 9.960 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -6.075 18.626 9.912 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.018 19.932 8.659 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.586 21.199 9.728 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.195 19.899 11.682 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.109 18.400 10.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -1.920 19.141 11.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.041 19.162 9.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -2.124 20.615 10.638 1.00 0.00 H new ATOM 932 N THR A 59 -8.449 18.169 6.082 1.00 0.00 N ATOM 933 CA THR A 59 -9.841 17.895 5.719 1.00 0.00 C ATOM 934 C THR A 59 -10.210 16.412 5.841 1.00 0.00 C ATOM 935 O THR A 59 -11.247 16.076 6.413 1.00 0.00 O ATOM 936 CB THR A 59 -10.129 18.388 4.298 1.00 0.00 C ATOM 937 OG1 THR A 59 -9.449 19.603 4.041 1.00 0.00 O ATOM 938 CG2 THR A 59 -11.601 18.623 4.037 1.00 0.00 C ATOM 0 H THR A 59 -7.958 18.780 5.430 1.00 0.00 H new ATOM 0 HA THR A 59 -10.461 18.439 6.432 1.00 0.00 H new ATOM 0 HB THR A 59 -9.779 17.594 3.639 1.00 0.00 H new ATOM 0 HG1 THR A 59 -9.644 19.900 3.128 1.00 0.00 H new ATOM 0 HG21 THR A 59 -11.738 18.971 3.013 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.149 17.692 4.180 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.978 19.376 4.730 1.00 0.00 H new ATOM 946 N PRO A 60 -9.387 15.505 5.291 1.00 0.00 N ATOM 947 CA PRO A 60 -9.660 14.063 5.329 1.00 0.00 C ATOM 948 C PRO A 60 -9.448 13.439 6.707 1.00 0.00 C ATOM 949 O PRO A 60 -10.221 12.581 7.134 1.00 0.00 O ATOM 950 CB PRO A 60 -8.656 13.474 4.323 1.00 0.00 C ATOM 951 CG PRO A 60 -8.052 14.644 3.617 1.00 0.00 C ATOM 952 CD PRO A 60 -8.145 15.798 4.569 1.00 0.00 C ATOM 0 HA PRO A 60 -10.704 13.859 5.091 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -7.891 12.887 4.832 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.154 12.807 3.619 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -7.015 14.444 3.348 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -8.586 14.859 2.691 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.286 15.844 5.238 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.193 16.754 4.047 1.00 0.00 H new ATOM 960 N LEU A 61 -8.384 13.849 7.386 1.00 0.00 N ATOM 961 CA LEU A 61 -8.058 13.304 8.701 1.00 0.00 C ATOM 962 C LEU A 61 -9.103 13.653 9.759 1.00 0.00 C ATOM 963 O LEU A 61 -9.503 12.799 10.550 1.00 0.00 O ATOM 964 CB LEU A 61 -6.691 13.805 9.142 1.00 0.00 C ATOM 965 CG LEU A 61 -5.544 12.872 8.781 1.00 0.00 C ATOM 966 CD1 LEU A 61 -5.642 11.573 9.566 1.00 0.00 C ATOM 967 CD2 LEU A 61 -5.544 12.596 7.288 1.00 0.00 C ATOM 0 H LEU A 61 -7.731 14.557 7.049 1.00 0.00 H new ATOM 0 HA LEU A 61 -8.048 12.218 8.605 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.509 14.780 8.689 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.700 13.952 10.222 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.605 13.358 9.045 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.813 10.920 9.294 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.598 11.789 10.634 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.585 11.078 9.334 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.719 11.927 7.042 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -6.487 12.129 7.004 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.426 13.534 6.745 1.00 0.00 H new ATOM 979 N GLU A 62 -9.527 14.910 9.785 1.00 0.00 N ATOM 980 CA GLU A 62 -10.506 15.363 10.768 1.00 0.00 C ATOM 981 C GLU A 62 -11.917 14.891 10.439 1.00 0.00 C ATOM 982 O GLU A 62 -12.732 14.678 11.336 1.00 0.00 O ATOM 983 CB GLU A 62 -10.480 16.889 10.873 1.00 0.00 C ATOM 984 CG GLU A 62 -11.055 17.418 12.177 1.00 0.00 C ATOM 985 CD GLU A 62 -11.929 18.641 11.975 1.00 0.00 C ATOM 986 OE1 GLU A 62 -11.557 19.509 11.158 1.00 0.00 O ATOM 987 OE2 GLU A 62 -12.986 18.729 12.634 1.00 0.00 O ATOM 0 H GLU A 62 -9.210 15.633 9.139 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.228 14.923 11.726 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.451 17.234 10.772 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.041 17.312 10.040 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -11.640 16.633 12.657 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -10.239 17.667 12.855 1.00 0.00 H new ATOM 994 N LYS A 63 -12.211 14.745 9.155 1.00 0.00 N ATOM 995 CA LYS A 63 -13.538 14.318 8.727 1.00 0.00 C ATOM 996 C LYS A 63 -13.712 12.804 8.826 1.00 0.00 C ATOM 997 O LYS A 63 -14.807 12.319 9.107 1.00 0.00 O ATOM 998 CB LYS A 63 -13.803 14.776 7.292 1.00 0.00 C ATOM 999 CG LYS A 63 -14.201 16.239 7.183 1.00 0.00 C ATOM 1000 CD LYS A 63 -15.677 16.437 7.491 1.00 0.00 C ATOM 1001 CE LYS A 63 -15.887 16.948 8.908 1.00 0.00 C ATOM 1002 NZ LYS A 63 -17.171 16.467 9.487 1.00 0.00 N ATOM 0 H LYS A 63 -11.553 14.915 8.394 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.260 14.781 9.400 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -12.907 14.606 6.694 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -14.594 14.160 6.863 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -13.601 16.833 7.872 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -13.986 16.602 6.178 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -16.106 17.144 6.781 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.207 15.493 7.361 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -15.060 16.621 9.538 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -15.875 18.038 8.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.276 16.837 10.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.963 16.800 8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.172 15.427 9.513 1.00 0.00 H new ATOM 1016 N ASP A 64 -12.640 12.059 8.576 1.00 0.00 N ATOM 1017 CA ASP A 64 -12.710 10.600 8.624 1.00 0.00 C ATOM 1018 C ASP A 64 -12.128 10.027 9.918 1.00 0.00 C ATOM 1019 O ASP A 64 -12.304 8.844 10.209 1.00 0.00 O ATOM 1020 CB ASP A 64 -11.990 10.001 7.417 1.00 0.00 C ATOM 1021 CG ASP A 64 -12.436 10.627 6.110 1.00 0.00 C ATOM 1022 OD1 ASP A 64 -13.584 10.368 5.693 1.00 0.00 O ATOM 1023 OD2 ASP A 64 -11.639 11.375 5.506 1.00 0.00 O ATOM 0 H ASP A 64 -11.721 12.435 8.340 1.00 0.00 H new ATOM 0 HA ASP A 64 -13.765 10.328 8.597 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -10.915 10.137 7.534 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.173 8.927 7.384 1.00 0.00 H new ATOM 1028 N GLY A 65 -11.441 10.861 10.694 1.00 0.00 N ATOM 1029 CA GLY A 65 -10.854 10.402 11.946 1.00 0.00 C ATOM 1030 C GLY A 65 -10.105 9.083 11.812 1.00 0.00 C ATOM 1031 O GLY A 65 -9.997 8.324 12.775 1.00 0.00 O ATOM 0 H GLY A 65 -11.279 11.845 10.481 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.170 11.164 12.319 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.643 10.290 12.690 1.00 0.00 H new ATOM 1035 N ILE A 66 -9.586 8.813 10.618 1.00 0.00 N ATOM 1036 CA ILE A 66 -8.841 7.582 10.357 1.00 0.00 C ATOM 1037 C ILE A 66 -7.347 7.854 10.275 1.00 0.00 C ATOM 1038 O ILE A 66 -6.925 8.928 9.847 1.00 0.00 O ATOM 1039 CB ILE A 66 -9.280 6.891 9.053 1.00 0.00 C ATOM 1040 CG1 ILE A 66 -9.536 7.920 7.954 1.00 0.00 C ATOM 1041 CG2 ILE A 66 -10.517 6.041 9.292 1.00 0.00 C ATOM 1042 CD1 ILE A 66 -9.114 7.454 6.578 1.00 0.00 C ATOM 0 H ILE A 66 -9.667 9.432 9.811 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.059 6.919 11.194 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.472 6.238 8.723 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.598 8.163 7.936 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -9.002 8.839 8.197 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.814 5.560 8.360 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -10.296 5.279 10.039 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -11.330 6.674 9.648 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.326 8.236 5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -8.046 7.238 6.579 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -9.666 6.552 6.314 1.00 0.00 H new ATOM 1054 N THR A 67 -6.545 6.875 10.677 1.00 0.00 N ATOM 1055 CA THR A 67 -5.097 7.023 10.632 1.00 0.00 C ATOM 1056 C THR A 67 -4.612 6.840 9.200 1.00 0.00 C ATOM 1057 O THR A 67 -5.041 5.922 8.503 1.00 0.00 O ATOM 1058 CB THR A 67 -4.423 6.002 11.550 1.00 0.00 C ATOM 1059 OG1 THR A 67 -5.226 4.842 11.685 1.00 0.00 O ATOM 1060 CG2 THR A 67 -4.151 6.535 12.940 1.00 0.00 C ATOM 0 H THR A 67 -6.870 5.977 11.035 1.00 0.00 H new ATOM 0 HA THR A 67 -4.833 8.022 10.979 1.00 0.00 H new ATOM 0 HB THR A 67 -3.470 5.770 11.074 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.627 4.619 10.819 1.00 0.00 H new ATOM 0 HG21 THR A 67 -3.672 5.761 13.539 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.494 7.402 12.875 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.091 6.827 13.408 1.00 0.00 H new ATOM 1068 N VAL A 68 -3.747 7.739 8.750 1.00 0.00 N ATOM 1069 CA VAL A 68 -3.247 7.683 7.385 1.00 0.00 C ATOM 1070 C VAL A 68 -1.794 8.138 7.295 1.00 0.00 C ATOM 1071 O VAL A 68 -1.350 8.998 8.055 1.00 0.00 O ATOM 1072 CB VAL A 68 -4.117 8.570 6.464 1.00 0.00 C ATOM 1073 CG1 VAL A 68 -4.222 9.972 7.035 1.00 0.00 C ATOM 1074 CG2 VAL A 68 -3.572 8.612 5.041 1.00 0.00 C ATOM 0 H VAL A 68 -3.380 8.511 9.307 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.300 6.644 7.061 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.112 8.128 6.419 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.837 10.587 6.378 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.678 9.929 8.024 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.226 10.408 7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.211 9.245 4.425 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.560 9.017 5.051 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.555 7.603 4.628 1.00 0.00 H new ATOM 1084 N VAL A 69 -1.072 7.572 6.336 1.00 0.00 N ATOM 1085 CA VAL A 69 0.318 7.929 6.107 1.00 0.00 C ATOM 1086 C VAL A 69 0.396 8.836 4.890 1.00 0.00 C ATOM 1087 O VAL A 69 -0.165 8.524 3.839 1.00 0.00 O ATOM 1088 CB VAL A 69 1.210 6.687 5.873 1.00 0.00 C ATOM 1089 CG1 VAL A 69 2.657 6.986 6.231 1.00 0.00 C ATOM 1090 CG2 VAL A 69 0.699 5.493 6.666 1.00 0.00 C ATOM 0 H VAL A 69 -1.431 6.859 5.701 1.00 0.00 H new ATOM 0 HA VAL A 69 0.687 8.436 6.999 1.00 0.00 H new ATOM 0 HB VAL A 69 1.164 6.436 4.813 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.265 6.098 6.058 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.024 7.804 5.610 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.721 7.271 7.281 1.00 0.00 H new ATOM 0 HG21 VAL A 69 1.343 4.633 6.484 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.705 5.733 7.729 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.318 5.257 6.353 1.00 0.00 H new ATOM 1100 N ASP A 70 1.066 9.970 5.036 1.00 0.00 N ATOM 1101 CA ASP A 70 1.173 10.922 3.941 1.00 0.00 C ATOM 1102 C ASP A 70 2.521 10.814 3.249 1.00 0.00 C ATOM 1103 O ASP A 70 3.546 11.242 3.782 1.00 0.00 O ATOM 1104 CB ASP A 70 0.963 12.347 4.454 1.00 0.00 C ATOM 1105 CG ASP A 70 1.915 12.702 5.580 1.00 0.00 C ATOM 1106 OD1 ASP A 70 3.028 13.184 5.285 1.00 0.00 O ATOM 1107 OD2 ASP A 70 1.547 12.498 6.756 1.00 0.00 O ATOM 0 H ASP A 70 1.540 10.251 5.894 1.00 0.00 H new ATOM 0 HA ASP A 70 0.396 10.685 3.214 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.099 13.050 3.632 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.064 12.457 4.802 1.00 0.00 H new ATOM 1112 N TRP A 71 2.506 10.245 2.052 1.00 0.00 N ATOM 1113 CA TRP A 71 3.718 10.084 1.269 1.00 0.00 C ATOM 1114 C TRP A 71 3.694 11.019 0.063 1.00 0.00 C ATOM 1115 O TRP A 71 2.987 10.763 -0.911 1.00 0.00 O ATOM 1116 CB TRP A 71 3.810 8.650 0.761 1.00 0.00 C ATOM 1117 CG TRP A 71 4.475 7.682 1.687 1.00 0.00 C ATOM 1118 CD1 TRP A 71 4.329 7.567 3.042 1.00 0.00 C ATOM 1119 CD2 TRP A 71 5.391 6.667 1.293 1.00 0.00 C ATOM 1120 NE1 TRP A 71 5.109 6.535 3.510 1.00 0.00 N ATOM 1121 CE2 TRP A 71 5.770 5.969 2.451 1.00 0.00 C ATOM 1122 CE3 TRP A 71 5.928 6.285 0.063 1.00 0.00 C ATOM 1123 CZ2 TRP A 71 6.663 4.905 2.412 1.00 0.00 C ATOM 1124 CZ3 TRP A 71 6.814 5.232 0.025 1.00 0.00 C ATOM 1125 CH2 TRP A 71 7.173 4.552 1.192 1.00 0.00 C ATOM 0 H TRP A 71 1.663 9.887 1.603 1.00 0.00 H new ATOM 0 HA TRP A 71 4.574 10.319 1.902 1.00 0.00 H new ATOM 0 HB2 TRP A 71 2.802 8.292 0.551 1.00 0.00 H new ATOM 0 HB3 TRP A 71 4.351 8.652 -0.185 1.00 0.00 H new ATOM 0 HD1 TRP A 71 3.696 8.193 3.653 1.00 0.00 H new ATOM 0 HE1 TRP A 71 5.183 6.240 4.484 1.00 0.00 H new ATOM 0 HE3 TRP A 71 5.654 6.806 -0.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 6.944 4.376 3.311 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 7.238 4.927 -0.920 1.00 0.00 H new ATOM 0 HH2 TRP A 71 7.869 3.729 1.130 1.00 0.00 H new ATOM 1136 N PRO A 72 4.443 12.127 0.112 1.00 0.00 N ATOM 1137 CA PRO A 72 4.491 13.105 -0.951 1.00 0.00 C ATOM 1138 C PRO A 72 5.812 13.088 -1.720 1.00 0.00 C ATOM 1139 O PRO A 72 6.717 12.317 -1.401 1.00 0.00 O ATOM 1140 CB PRO A 72 4.370 14.380 -0.135 1.00 0.00 C ATOM 1141 CG PRO A 72 5.151 14.090 1.123 1.00 0.00 C ATOM 1142 CD PRO A 72 5.273 12.578 1.229 1.00 0.00 C ATOM 0 HA PRO A 72 3.737 12.953 -1.723 1.00 0.00 H new ATOM 0 HB2 PRO A 72 4.781 15.236 -0.670 1.00 0.00 H new ATOM 0 HB3 PRO A 72 3.329 14.613 0.088 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.136 14.555 1.082 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.642 14.498 1.996 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.306 12.244 1.131 1.00 0.00 H new ATOM 0 HD3 PRO A 72 4.907 12.205 2.186 1.00 0.00 H new ATOM 1260 N LYS A 82 13.923 2.656 2.751 1.00 0.00 N ATOM 1261 CA LYS A 82 13.565 2.789 4.160 1.00 0.00 C ATOM 1262 C LYS A 82 12.222 3.491 4.326 1.00 0.00 C ATOM 1263 O LYS A 82 11.489 3.214 5.274 1.00 0.00 O ATOM 1264 CB LYS A 82 14.648 3.565 4.912 1.00 0.00 C ATOM 1265 CG LYS A 82 15.059 2.918 6.225 1.00 0.00 C ATOM 1266 CD LYS A 82 15.348 3.960 7.294 1.00 0.00 C ATOM 1267 CE LYS A 82 16.843 4.170 7.478 1.00 0.00 C ATOM 1268 NZ LYS A 82 17.472 4.771 6.271 1.00 0.00 N ATOM 0 HA LYS A 82 13.482 1.786 4.578 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.526 3.660 4.273 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.288 4.575 5.111 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.266 2.254 6.568 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.944 2.302 6.067 1.00 0.00 H new ATOM 0 HD2 LYS A 82 14.878 4.904 7.020 1.00 0.00 H new ATOM 0 HD3 LYS A 82 14.905 3.646 8.239 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.015 4.818 8.338 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.319 3.215 7.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.488 4.913 6.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 17.345 4.133 5.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.024 5.687 6.066 1.00 0.00 H new ATOM 1282 N VAL A 83 11.881 4.374 3.393 1.00 0.00 N ATOM 1283 CA VAL A 83 10.598 5.062 3.459 1.00 0.00 C ATOM 1284 C VAL A 83 9.484 4.026 3.532 1.00 0.00 C ATOM 1285 O VAL A 83 8.631 4.059 4.426 1.00 0.00 O ATOM 1286 CB VAL A 83 10.365 5.967 2.235 1.00 0.00 C ATOM 1287 CG1 VAL A 83 9.087 6.775 2.402 1.00 0.00 C ATOM 1288 CG2 VAL A 83 11.558 6.882 2.013 1.00 0.00 C ATOM 0 H VAL A 83 12.464 4.627 2.595 1.00 0.00 H new ATOM 0 HA VAL A 83 10.601 5.695 4.347 1.00 0.00 H new ATOM 0 HB VAL A 83 10.253 5.334 1.355 1.00 0.00 H new ATOM 0 HG11 VAL A 83 8.940 7.408 1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.239 6.098 2.506 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.165 7.399 3.292 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.375 7.514 1.144 1.00 0.00 H new ATOM 0 HG22 VAL A 83 11.705 7.509 2.893 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.451 6.281 1.843 1.00 0.00 H new ATOM 1298 N VAL A 84 9.534 3.077 2.600 1.00 0.00 N ATOM 1299 CA VAL A 84 8.569 1.991 2.555 1.00 0.00 C ATOM 1300 C VAL A 84 8.530 1.298 3.905 1.00 0.00 C ATOM 1301 O VAL A 84 7.460 0.999 4.436 1.00 0.00 O ATOM 1302 CB VAL A 84 8.936 0.975 1.450 1.00 0.00 C ATOM 1303 CG1 VAL A 84 8.397 -0.407 1.772 1.00 0.00 C ATOM 1304 CG2 VAL A 84 8.420 1.446 0.099 1.00 0.00 C ATOM 0 H VAL A 84 10.239 3.042 1.863 1.00 0.00 H new ATOM 0 HA VAL A 84 7.586 2.403 2.325 1.00 0.00 H new ATOM 0 HB VAL A 84 10.023 0.909 1.405 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.672 -1.099 0.976 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.821 -0.752 2.715 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.311 -0.363 1.856 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.688 0.718 -0.667 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.336 1.548 0.139 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.866 2.410 -0.145 1.00 0.00 H new ATOM 1314 N GLU A 85 9.710 1.071 4.466 1.00 0.00 N ATOM 1315 CA GLU A 85 9.813 0.440 5.772 1.00 0.00 C ATOM 1316 C GLU A 85 9.014 1.240 6.800 1.00 0.00 C ATOM 1317 O GLU A 85 8.477 0.682 7.757 1.00 0.00 O ATOM 1318 CB GLU A 85 11.277 0.327 6.205 1.00 0.00 C ATOM 1319 CG GLU A 85 12.169 -0.356 5.178 1.00 0.00 C ATOM 1320 CD GLU A 85 11.939 -1.855 5.100 1.00 0.00 C ATOM 1321 OE1 GLU A 85 11.044 -2.356 5.814 1.00 0.00 O ATOM 1322 OE2 GLU A 85 12.653 -2.528 4.324 1.00 0.00 O ATOM 0 H GLU A 85 10.604 1.313 4.039 1.00 0.00 H new ATOM 0 HA GLU A 85 9.400 -0.567 5.707 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.666 1.326 6.404 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.327 -0.227 7.142 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.990 0.086 4.198 1.00 0.00 H new ATOM 0 HG3 GLU A 85 13.213 -0.166 5.427 1.00 0.00 H new ATOM 1329 N ASP A 86 8.939 2.557 6.591 1.00 0.00 N ATOM 1330 CA ASP A 86 8.205 3.438 7.496 1.00 0.00 C ATOM 1331 C ASP A 86 6.706 3.152 7.446 1.00 0.00 C ATOM 1332 O ASP A 86 6.070 2.958 8.484 1.00 0.00 O ATOM 1333 CB ASP A 86 8.466 4.903 7.138 1.00 0.00 C ATOM 1334 CG ASP A 86 8.472 5.803 8.357 1.00 0.00 C ATOM 1335 OD1 ASP A 86 9.529 5.905 9.016 1.00 0.00 O ATOM 1336 OD2 ASP A 86 7.419 6.405 8.654 1.00 0.00 O ATOM 0 H ASP A 86 9.378 3.034 5.803 1.00 0.00 H new ATOM 0 HA ASP A 86 8.558 3.247 8.509 1.00 0.00 H new ATOM 0 HB2 ASP A 86 9.425 4.984 6.625 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.702 5.246 6.441 1.00 0.00 H new ATOM 1341 N TRP A 87 6.142 3.108 6.240 1.00 0.00 N ATOM 1342 CA TRP A 87 4.718 2.822 6.098 1.00 0.00 C ATOM 1343 C TRP A 87 4.428 1.400 6.571 1.00 0.00 C ATOM 1344 O TRP A 87 3.367 1.120 7.127 1.00 0.00 O ATOM 1345 CB TRP A 87 4.251 3.017 4.645 1.00 0.00 C ATOM 1346 CG TRP A 87 3.389 1.903 4.123 1.00 0.00 C ATOM 1347 CD1 TRP A 87 3.783 0.883 3.309 1.00 0.00 C ATOM 1348 CD2 TRP A 87 1.991 1.697 4.378 1.00 0.00 C ATOM 1349 NE1 TRP A 87 2.722 0.058 3.038 1.00 0.00 N ATOM 1350 CE2 TRP A 87 1.609 0.537 3.678 1.00 0.00 C ATOM 1351 CE3 TRP A 87 1.024 2.379 5.124 1.00 0.00 C ATOM 1352 CZ2 TRP A 87 0.306 0.044 3.702 1.00 0.00 C ATOM 1353 CZ3 TRP A 87 -0.271 1.887 5.149 1.00 0.00 C ATOM 1354 CH2 TRP A 87 -0.620 0.729 4.439 1.00 0.00 C ATOM 0 H TRP A 87 6.639 3.264 5.363 1.00 0.00 H new ATOM 0 HA TRP A 87 4.161 3.525 6.718 1.00 0.00 H new ATOM 0 HB2 TRP A 87 3.698 3.953 4.575 1.00 0.00 H new ATOM 0 HB3 TRP A 87 5.127 3.116 4.003 1.00 0.00 H new ATOM 0 HD1 TRP A 87 4.786 0.745 2.932 1.00 0.00 H new ATOM 0 HE1 TRP A 87 2.756 -0.778 2.454 1.00 0.00 H new ATOM 0 HE3 TRP A 87 1.282 3.274 5.671 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 0.037 -0.849 3.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -1.024 2.404 5.725 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -1.639 0.372 4.475 1.00 0.00 H new ATOM 1365 N LEU A 88 5.389 0.507 6.344 1.00 0.00 N ATOM 1366 CA LEU A 88 5.250 -0.885 6.746 1.00 0.00 C ATOM 1367 C LEU A 88 5.005 -0.991 8.245 1.00 0.00 C ATOM 1368 O LEU A 88 4.108 -1.706 8.687 1.00 0.00 O ATOM 1369 CB LEU A 88 6.504 -1.674 6.368 1.00 0.00 C ATOM 1370 CG LEU A 88 6.525 -2.207 4.936 1.00 0.00 C ATOM 1371 CD1 LEU A 88 7.883 -2.811 4.612 1.00 0.00 C ATOM 1372 CD2 LEU A 88 5.416 -3.233 4.734 1.00 0.00 C ATOM 0 H LEU A 88 6.272 0.726 5.883 1.00 0.00 H new ATOM 0 HA LEU A 88 4.392 -1.306 6.222 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.375 -1.035 6.515 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.606 -2.515 7.054 1.00 0.00 H new ATOM 0 HG LEU A 88 6.350 -1.375 4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.880 -3.186 3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.655 -2.048 4.717 1.00 0.00 H new ATOM 0 HD13 LEU A 88 8.089 -3.632 5.298 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.445 -3.603 3.709 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.560 -4.065 5.424 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.450 -2.766 4.924 1.00 0.00 H new ATOM 1384 N SER A 89 5.803 -0.266 9.022 1.00 0.00 N ATOM 1385 CA SER A 89 5.667 -0.272 10.472 1.00 0.00 C ATOM 1386 C SER A 89 4.306 0.280 10.877 1.00 0.00 C ATOM 1387 O SER A 89 3.646 -0.255 11.767 1.00 0.00 O ATOM 1388 CB SER A 89 6.782 0.554 11.115 1.00 0.00 C ATOM 1389 OG SER A 89 7.247 1.558 10.232 1.00 0.00 O ATOM 0 H SER A 89 6.550 0.333 8.671 1.00 0.00 H new ATOM 0 HA SER A 89 5.747 -1.301 10.823 1.00 0.00 H new ATOM 0 HB2 SER A 89 6.415 1.014 12.033 1.00 0.00 H new ATOM 0 HB3 SER A 89 7.608 -0.100 11.394 1.00 0.00 H new ATOM 0 HG SER A 89 6.493 2.110 9.938 1.00 0.00 H new ATOM 1395 N LEU A 90 3.890 1.355 10.211 1.00 0.00 N ATOM 1396 CA LEU A 90 2.604 1.980 10.495 1.00 0.00 C ATOM 1397 C LEU A 90 1.461 0.986 10.288 1.00 0.00 C ATOM 1398 O LEU A 90 0.615 0.797 11.167 1.00 0.00 O ATOM 1399 CB LEU A 90 2.408 3.200 9.590 1.00 0.00 C ATOM 1400 CG LEU A 90 1.307 4.170 10.023 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -0.065 3.549 9.820 1.00 0.00 C ATOM 1402 CD2 LEU A 90 1.499 4.583 11.474 1.00 0.00 C ATOM 0 H LEU A 90 4.426 1.810 9.472 1.00 0.00 H new ATOM 0 HA LEU A 90 2.597 2.299 11.537 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.350 3.747 9.537 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.185 2.851 8.582 1.00 0.00 H new ATOM 0 HG LEU A 90 1.373 5.063 9.401 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.834 4.255 10.134 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.203 3.307 8.766 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.144 2.639 10.414 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.706 5.273 11.764 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.462 3.700 12.112 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.466 5.073 11.588 1.00 0.00 H new ATOM 1414 N VAL A 91 1.448 0.347 9.122 1.00 0.00 N ATOM 1415 CA VAL A 91 0.417 -0.629 8.802 1.00 0.00 C ATOM 1416 C VAL A 91 0.575 -1.890 9.645 1.00 0.00 C ATOM 1417 O VAL A 91 -0.412 -2.504 10.049 1.00 0.00 O ATOM 1418 CB VAL A 91 0.437 -1.006 7.307 1.00 0.00 C ATOM 1419 CG1 VAL A 91 1.713 -1.759 6.955 1.00 0.00 C ATOM 1420 CG2 VAL A 91 -0.796 -1.825 6.949 1.00 0.00 C ATOM 0 H VAL A 91 2.139 0.489 8.386 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.542 -0.163 9.031 1.00 0.00 H new ATOM 0 HB VAL A 91 0.419 -0.088 6.720 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.704 -2.014 5.895 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.577 -1.131 7.170 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.772 -2.672 7.548 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.767 -2.083 5.890 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.812 -2.738 7.545 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.693 -1.241 7.155 1.00 0.00 H new ATOM 1430 N LYS A 92 1.822 -2.267 9.914 1.00 0.00 N ATOM 1431 CA LYS A 92 2.104 -3.452 10.719 1.00 0.00 C ATOM 1432 C LYS A 92 1.431 -3.339 12.080 1.00 0.00 C ATOM 1433 O LYS A 92 0.807 -4.287 12.559 1.00 0.00 O ATOM 1434 CB LYS A 92 3.614 -3.636 10.895 1.00 0.00 C ATOM 1435 CG LYS A 92 4.194 -4.753 10.042 1.00 0.00 C ATOM 1436 CD LYS A 92 3.732 -6.119 10.526 1.00 0.00 C ATOM 1437 CE LYS A 92 4.745 -6.748 11.468 1.00 0.00 C ATOM 1438 NZ LYS A 92 4.255 -8.038 12.030 1.00 0.00 N ATOM 0 H LYS A 92 2.651 -1.771 9.587 1.00 0.00 H new ATOM 0 HA LYS A 92 1.705 -4.323 10.199 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.117 -2.702 10.646 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.827 -3.843 11.944 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.894 -4.613 9.004 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.283 -4.705 10.069 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.773 -6.021 11.034 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.573 -6.775 9.670 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.681 -6.916 10.935 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.962 -6.056 12.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 4.975 -8.435 12.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.376 -7.874 12.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 4.072 -8.707 11.255 1.00 0.00 H new ATOM 1452 N ALA A 93 1.553 -2.167 12.692 1.00 0.00 N ATOM 1453 CA ALA A 93 0.948 -1.921 13.992 1.00 0.00 C ATOM 1454 C ALA A 93 -0.571 -1.984 13.894 1.00 0.00 C ATOM 1455 O ALA A 93 -1.234 -2.584 14.740 1.00 0.00 O ATOM 1456 CB ALA A 93 1.390 -0.570 14.535 1.00 0.00 C ATOM 0 H ALA A 93 2.066 -1.373 12.308 1.00 0.00 H new ATOM 0 HA ALA A 93 1.281 -2.697 14.681 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.929 -0.400 15.508 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.475 -0.557 14.640 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.083 0.217 13.846 1.00 0.00 H new ATOM 1462 N LYS A 94 -1.117 -1.363 12.852 1.00 0.00 N ATOM 1463 CA LYS A 94 -2.560 -1.354 12.642 1.00 0.00 C ATOM 1464 C LYS A 94 -3.063 -2.727 12.195 1.00 0.00 C ATOM 1465 O LYS A 94 -4.234 -3.059 12.383 1.00 0.00 O ATOM 1466 CB LYS A 94 -2.938 -0.292 11.606 1.00 0.00 C ATOM 1467 CG LYS A 94 -3.632 0.920 12.205 1.00 0.00 C ATOM 1468 CD LYS A 94 -2.632 1.890 12.818 1.00 0.00 C ATOM 1469 CE LYS A 94 -3.052 2.316 14.216 1.00 0.00 C ATOM 1470 NZ LYS A 94 -4.032 3.436 14.185 1.00 0.00 N ATOM 0 H LYS A 94 -0.583 -0.861 12.142 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.036 -1.112 13.592 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.037 0.035 11.087 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.591 -0.742 10.858 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.208 1.430 11.432 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.340 0.595 12.968 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.648 1.422 12.859 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.540 2.770 12.181 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.490 1.465 14.738 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -2.172 2.620 14.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.725 4.184 14.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.089 3.821 13.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.968 3.086 14.474 1.00 0.00 H new ATOM 1484 N PHE A 95 -2.175 -3.521 11.601 1.00 0.00 N ATOM 1485 CA PHE A 95 -2.537 -4.855 11.128 1.00 0.00 C ATOM 1486 C PHE A 95 -2.510 -5.869 12.266 1.00 0.00 C ATOM 1487 O PHE A 95 -3.477 -6.600 12.482 1.00 0.00 O ATOM 1488 CB PHE A 95 -1.593 -5.297 10.007 1.00 0.00 C ATOM 1489 CG PHE A 95 -2.156 -5.064 8.635 1.00 0.00 C ATOM 1490 CD1 PHE A 95 -2.716 -3.841 8.306 1.00 0.00 C ATOM 1491 CD2 PHE A 95 -2.129 -6.065 7.678 1.00 0.00 C ATOM 1492 CE1 PHE A 95 -3.239 -3.620 7.046 1.00 0.00 C ATOM 1493 CE2 PHE A 95 -2.650 -5.850 6.417 1.00 0.00 C ATOM 1494 CZ PHE A 95 -3.205 -4.625 6.100 1.00 0.00 C ATOM 0 H PHE A 95 -1.202 -3.265 11.436 1.00 0.00 H new ATOM 0 HA PHE A 95 -3.554 -4.808 10.738 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -0.650 -4.759 10.102 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.369 -6.357 10.126 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.744 -3.051 9.042 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.696 -7.024 7.920 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -3.674 -2.662 6.802 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -2.624 -6.639 5.680 1.00 0.00 H new ATOM 0 HZ PHE A 95 -3.611 -4.454 5.114 1.00 0.00 H new ATOM 1504 N CYS A 96 -1.398 -5.910 12.992 1.00 0.00 N ATOM 1505 CA CYS A 96 -1.250 -6.836 14.108 1.00 0.00 C ATOM 1506 C CYS A 96 -2.265 -6.533 15.206 1.00 0.00 C ATOM 1507 O CYS A 96 -2.838 -7.444 15.804 1.00 0.00 O ATOM 1508 CB CYS A 96 0.168 -6.763 14.676 1.00 0.00 C ATOM 1509 SG CYS A 96 0.588 -8.121 15.792 1.00 0.00 S ATOM 0 H CYS A 96 -0.587 -5.313 12.828 1.00 0.00 H new ATOM 0 HA CYS A 96 -1.433 -7.844 13.736 1.00 0.00 H new ATOM 0 HB2 CYS A 96 0.879 -6.753 13.850 1.00 0.00 H new ATOM 0 HB3 CYS A 96 0.286 -5.820 15.209 1.00 0.00 H new ATOM 0 HG CYS A 96 1.807 -7.971 16.218 1.00 0.00 H new ATOM 1515 N GLU A 97 -2.479 -5.248 15.468 1.00 0.00 N ATOM 1516 CA GLU A 97 -3.424 -4.824 16.496 1.00 0.00 C ATOM 1517 C GLU A 97 -4.864 -4.968 16.015 1.00 0.00 C ATOM 1518 O GLU A 97 -5.766 -5.252 16.804 1.00 0.00 O ATOM 1519 CB GLU A 97 -3.152 -3.373 16.898 1.00 0.00 C ATOM 1520 CG GLU A 97 -3.740 -2.997 18.247 1.00 0.00 C ATOM 1521 CD GLU A 97 -3.195 -1.683 18.774 1.00 0.00 C ATOM 1522 OE1 GLU A 97 -3.617 -0.621 18.271 1.00 0.00 O ATOM 1523 OE2 GLU A 97 -2.346 -1.718 19.690 1.00 0.00 O ATOM 0 H GLU A 97 -2.011 -4.482 14.983 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.288 -5.470 17.364 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.075 -3.207 16.921 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.561 -2.710 16.135 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.824 -2.928 18.160 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.528 -3.789 18.965 1.00 0.00 H new ATOM 1530 N ALA A 98 -5.076 -4.768 14.718 1.00 0.00 N ATOM 1531 CA ALA A 98 -6.411 -4.872 14.138 1.00 0.00 C ATOM 1532 C ALA A 98 -6.434 -5.856 12.970 1.00 0.00 C ATOM 1533 O ALA A 98 -6.201 -5.475 11.824 1.00 0.00 O ATOM 1534 CB ALA A 98 -6.896 -3.504 13.685 1.00 0.00 C ATOM 0 H ALA A 98 -4.342 -4.533 14.050 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.083 -5.250 14.908 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -7.893 -3.596 13.254 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.931 -2.829 14.540 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.212 -3.105 12.936 1.00 0.00 H new ATOM 1540 N PRO A 99 -6.718 -7.141 13.248 1.00 0.00 N ATOM 1541 CA PRO A 99 -6.771 -8.178 12.214 1.00 0.00 C ATOM 1542 C PRO A 99 -8.044 -8.099 11.377 1.00 0.00 C ATOM 1543 O PRO A 99 -9.146 -7.988 11.915 1.00 0.00 O ATOM 1544 CB PRO A 99 -6.743 -9.475 13.022 1.00 0.00 C ATOM 1545 CG PRO A 99 -7.377 -9.119 14.322 1.00 0.00 C ATOM 1546 CD PRO A 99 -7.009 -7.684 14.590 1.00 0.00 C ATOM 0 HA PRO A 99 -5.955 -8.085 11.497 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -7.293 -10.269 12.517 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.723 -9.833 13.163 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -8.459 -9.241 14.274 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.019 -9.768 15.121 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.824 -7.145 15.072 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -6.144 -7.609 15.249 1.00 0.00 H new ATOM 1554 N GLY A 100 -7.886 -8.161 10.059 1.00 0.00 N ATOM 1555 CA GLY A 100 -9.031 -8.096 9.168 1.00 0.00 C ATOM 1556 C GLY A 100 -9.820 -6.812 9.327 1.00 0.00 C ATOM 1557 O GLY A 100 -11.021 -6.841 9.592 1.00 0.00 O ATOM 0 H GLY A 100 -6.985 -8.255 9.591 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.690 -8.183 8.137 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.685 -8.946 9.360 1.00 0.00 H new ATOM 1561 N SER A 101 -9.143 -5.680 9.165 1.00 0.00 N ATOM 1562 CA SER A 101 -9.786 -4.377 9.294 1.00 0.00 C ATOM 1563 C SER A 101 -10.090 -3.775 7.924 1.00 0.00 C ATOM 1564 O SER A 101 -10.065 -4.472 6.909 1.00 0.00 O ATOM 1565 CB SER A 101 -8.897 -3.429 10.098 1.00 0.00 C ATOM 1566 OG SER A 101 -8.184 -4.129 11.104 1.00 0.00 O ATOM 0 H SER A 101 -8.148 -5.639 8.944 1.00 0.00 H new ATOM 0 HA SER A 101 -10.730 -4.516 9.821 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.195 -2.930 9.430 1.00 0.00 H new ATOM 0 HB3 SER A 101 -9.509 -2.652 10.556 1.00 0.00 H new ATOM 0 HG SER A 101 -7.400 -4.562 10.708 1.00 0.00 H new ATOM 1572 N CYS A 102 -10.382 -2.476 7.902 1.00 0.00 N ATOM 1573 CA CYS A 102 -10.695 -1.782 6.658 1.00 0.00 C ATOM 1574 C CYS A 102 -9.677 -0.680 6.370 1.00 0.00 C ATOM 1575 O CYS A 102 -9.606 0.313 7.085 1.00 0.00 O ATOM 1576 CB CYS A 102 -12.099 -1.193 6.769 1.00 0.00 C ATOM 1577 SG CYS A 102 -13.389 -2.338 6.215 1.00 0.00 S ATOM 0 H CYS A 102 -10.408 -1.884 8.732 1.00 0.00 H new ATOM 0 HA CYS A 102 -10.652 -2.490 5.831 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -12.289 -0.913 7.805 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -12.152 -0.279 6.177 1.00 0.00 H new ATOM 0 HG CYS A 102 -13.387 -2.398 4.916 1.00 0.00 H new ATOM 1583 N VAL A 103 -8.899 -0.856 5.305 1.00 0.00 N ATOM 1584 CA VAL A 103 -7.879 0.126 4.935 1.00 0.00 C ATOM 1585 C VAL A 103 -8.237 0.876 3.660 1.00 0.00 C ATOM 1586 O VAL A 103 -8.884 0.336 2.765 1.00 0.00 O ATOM 1587 CB VAL A 103 -6.498 -0.552 4.749 1.00 0.00 C ATOM 1588 CG1 VAL A 103 -5.512 0.375 4.037 1.00 0.00 C ATOM 1589 CG2 VAL A 103 -5.940 -0.997 6.091 1.00 0.00 C ATOM 0 H VAL A 103 -8.953 -1.664 4.685 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.831 0.842 5.755 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.639 -1.431 4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.554 -0.132 3.923 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.904 0.637 3.054 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.375 1.282 4.626 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.970 -1.471 5.942 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.825 -0.131 6.742 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.625 -1.709 6.552 1.00 0.00 H new ATOM 1599 N ALA A 104 -7.776 2.121 3.583 1.00 0.00 N ATOM 1600 CA ALA A 104 -8.012 2.956 2.410 1.00 0.00 C ATOM 1601 C ALA A 104 -6.680 3.351 1.775 1.00 0.00 C ATOM 1602 O ALA A 104 -5.690 3.557 2.473 1.00 0.00 O ATOM 1603 CB ALA A 104 -8.835 4.183 2.780 1.00 0.00 C ATOM 0 H ALA A 104 -7.236 2.574 4.320 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.584 2.386 1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -9.000 4.792 1.891 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.796 3.868 3.187 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -8.299 4.769 3.527 1.00 0.00 H new ATOM 1609 N VAL A 105 -6.645 3.416 0.448 1.00 0.00 N ATOM 1610 CA VAL A 105 -5.412 3.744 -0.267 1.00 0.00 C ATOM 1611 C VAL A 105 -5.668 4.674 -1.459 1.00 0.00 C ATOM 1612 O VAL A 105 -6.806 4.847 -1.892 1.00 0.00 O ATOM 1613 CB VAL A 105 -4.731 2.448 -0.770 1.00 0.00 C ATOM 1614 CG1 VAL A 105 -3.499 2.750 -1.614 1.00 0.00 C ATOM 1615 CG2 VAL A 105 -4.375 1.544 0.403 1.00 0.00 C ATOM 0 H VAL A 105 -7.451 3.247 -0.154 1.00 0.00 H new ATOM 0 HA VAL A 105 -4.760 4.264 0.435 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.443 1.926 -1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -3.049 1.815 -1.948 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.789 3.344 -2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.777 3.307 -1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -3.897 0.637 0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.691 2.067 1.071 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.282 1.279 0.947 1.00 0.00 H new ATOM 1625 N HIS A 106 -4.590 5.253 -1.992 1.00 0.00 N ATOM 1626 CA HIS A 106 -4.678 6.147 -3.148 1.00 0.00 C ATOM 1627 C HIS A 106 -5.104 5.360 -4.392 1.00 0.00 C ATOM 1628 O HIS A 106 -4.938 4.144 -4.452 1.00 0.00 O ATOM 1629 CB HIS A 106 -3.334 6.848 -3.391 1.00 0.00 C ATOM 1630 CG HIS A 106 -3.128 7.297 -4.808 1.00 0.00 C ATOM 1631 ND1 HIS A 106 -2.897 6.585 -5.937 1.00 0.00 N flip ATOM 1632 CD2 HIS A 106 -3.162 8.618 -5.193 1.00 0.00 C flip ATOM 1633 CE1 HIS A 106 -2.801 7.481 -6.974 1.00 0.00 C flip ATOM 1634 NE2 HIS A 106 -2.964 8.703 -6.497 1.00 0.00 N flip ATOM 0 H HIS A 106 -3.642 5.118 -1.640 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.429 6.910 -2.942 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -3.263 7.714 -2.732 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.527 6.170 -3.114 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -2.810 5.571 -6.005 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.325 9.456 -4.531 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.622 7.229 -8.009 1.00 0.00 H new ATOM 1642 N CYS A 107 -5.691 6.058 -5.363 1.00 0.00 N ATOM 1643 CA CYS A 107 -6.187 5.421 -6.584 1.00 0.00 C ATOM 1644 C CYS A 107 -5.061 4.889 -7.470 1.00 0.00 C ATOM 1645 O CYS A 107 -4.368 5.648 -8.150 1.00 0.00 O ATOM 1646 CB CYS A 107 -7.043 6.410 -7.378 1.00 0.00 C ATOM 1647 SG CYS A 107 -7.776 5.718 -8.878 1.00 0.00 S ATOM 0 H CYS A 107 -5.835 7.067 -5.328 1.00 0.00 H new ATOM 0 HA CYS A 107 -6.789 4.566 -6.276 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -7.841 6.780 -6.735 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -6.429 7.268 -7.650 1.00 0.00 H new ATOM 0 HG CYS A 107 -8.482 6.631 -9.477 1.00 0.00 H new ATOM 1653 N VAL A 108 -4.910 3.564 -7.459 1.00 0.00 N ATOM 1654 CA VAL A 108 -3.900 2.872 -8.259 1.00 0.00 C ATOM 1655 C VAL A 108 -4.284 2.801 -9.739 1.00 0.00 C ATOM 1656 O VAL A 108 -3.559 2.212 -10.541 1.00 0.00 O ATOM 1657 CB VAL A 108 -3.654 1.439 -7.747 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.145 1.459 -6.316 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.919 0.597 -7.864 1.00 0.00 C ATOM 0 H VAL A 108 -5.486 2.940 -6.894 1.00 0.00 H new ATOM 0 HA VAL A 108 -2.987 3.459 -8.157 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.887 0.982 -8.372 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.978 0.437 -5.975 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -2.208 2.014 -6.271 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.883 1.940 -5.674 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.721 -0.410 -7.497 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.714 1.050 -7.271 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.228 0.548 -8.908 1.00 0.00 H new ATOM 1669 N ALA A 109 -5.437 3.367 -10.101 1.00 0.00 N ATOM 1670 CA ALA A 109 -5.906 3.318 -11.486 1.00 0.00 C ATOM 1671 C ALA A 109 -4.923 3.984 -12.450 1.00 0.00 C ATOM 1672 O ALA A 109 -5.070 3.871 -13.668 1.00 0.00 O ATOM 1673 CB ALA A 109 -7.275 3.970 -11.596 1.00 0.00 C ATOM 0 H ALA A 109 -6.058 3.861 -9.460 1.00 0.00 H new ATOM 0 HA ALA A 109 -5.979 2.269 -11.771 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.616 3.929 -12.631 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.983 3.439 -10.959 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.209 5.010 -11.277 1.00 0.00 H new ATOM 1679 N GLY A 110 -3.910 4.648 -11.907 1.00 0.00 N ATOM 1680 CA GLY A 110 -2.908 5.284 -12.739 1.00 0.00 C ATOM 1681 C GLY A 110 -1.522 4.778 -12.399 1.00 0.00 C ATOM 1682 O GLY A 110 -1.302 3.569 -12.319 1.00 0.00 O ATOM 0 H GLY A 110 -3.765 4.757 -10.903 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.124 5.087 -13.789 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.949 6.365 -12.602 1.00 0.00 H new ATOM 1686 N LEU A 111 -0.594 5.696 -12.169 1.00 0.00 N ATOM 1687 CA LEU A 111 0.766 5.324 -11.802 1.00 0.00 C ATOM 1688 C LEU A 111 1.172 6.065 -10.536 1.00 0.00 C ATOM 1689 O LEU A 111 1.052 7.288 -10.458 1.00 0.00 O ATOM 1690 CB LEU A 111 1.746 5.639 -12.938 1.00 0.00 C ATOM 1691 CG LEU A 111 1.702 4.680 -14.136 1.00 0.00 C ATOM 1692 CD1 LEU A 111 2.916 4.888 -15.030 1.00 0.00 C ATOM 1693 CD2 LEU A 111 1.632 3.232 -13.676 1.00 0.00 C ATOM 0 H LEU A 111 -0.757 6.701 -12.230 1.00 0.00 H new ATOM 0 HA LEU A 111 0.797 4.250 -11.619 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.547 6.649 -13.296 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.758 5.639 -12.532 1.00 0.00 H new ATOM 0 HG LEU A 111 0.801 4.900 -14.708 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.868 4.200 -15.874 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.925 5.914 -15.398 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.825 4.699 -14.459 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.602 2.575 -14.545 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.511 2.998 -13.075 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.733 3.083 -13.078 1.00 0.00 H new ATOM 1705 N GLY A 112 1.642 5.322 -9.539 1.00 0.00 N ATOM 1706 CA GLY A 112 2.039 5.943 -8.293 1.00 0.00 C ATOM 1707 C GLY A 112 2.881 5.040 -7.416 1.00 0.00 C ATOM 1708 O GLY A 112 3.624 4.192 -7.910 1.00 0.00 O ATOM 0 H GLY A 112 1.754 4.309 -9.573 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.599 6.852 -8.510 1.00 0.00 H new ATOM 0 HA3 GLY A 112 1.146 6.242 -7.744 1.00 0.00 H new ATOM 1712 N ARG A 113 2.775 5.243 -6.108 1.00 0.00 N ATOM 1713 CA ARG A 113 3.540 4.467 -5.140 1.00 0.00 C ATOM 1714 C ARG A 113 2.624 3.746 -4.134 1.00 0.00 C ATOM 1715 O ARG A 113 3.038 2.789 -3.466 1.00 0.00 O ATOM 1716 CB ARG A 113 4.512 5.400 -4.408 1.00 0.00 C ATOM 1717 CG ARG A 113 5.235 6.385 -5.328 1.00 0.00 C ATOM 1718 CD ARG A 113 4.363 7.586 -5.703 1.00 0.00 C ATOM 1719 NE ARG A 113 4.838 8.829 -5.083 1.00 0.00 N ATOM 1720 CZ ARG A 113 4.264 10.027 -5.250 1.00 0.00 C ATOM 1721 NH1 ARG A 113 3.215 10.177 -6.049 1.00 0.00 N ATOM 1722 NH2 ARG A 113 4.744 11.087 -4.618 1.00 0.00 N ATOM 0 H ARG A 113 2.162 5.944 -5.691 1.00 0.00 H new ATOM 0 HA ARG A 113 4.096 3.697 -5.674 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.963 5.960 -3.652 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.253 4.797 -3.883 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.142 6.738 -4.836 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.545 5.868 -6.236 1.00 0.00 H new ATOM 0 HD2 ARG A 113 4.354 7.702 -6.787 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.335 7.397 -5.394 1.00 0.00 H new ATOM 0 HE ARG A 113 5.662 8.776 -4.484 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.834 9.372 -6.547 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.790 11.097 -6.165 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.552 10.991 -4.003 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.306 11.999 -4.746 1.00 0.00 H new ATOM 1736 N ALA A 114 1.382 4.218 -4.028 1.00 0.00 N ATOM 1737 CA ALA A 114 0.405 3.638 -3.108 1.00 0.00 C ATOM 1738 C ALA A 114 0.244 2.126 -3.287 1.00 0.00 C ATOM 1739 O ALA A 114 0.216 1.386 -2.303 1.00 0.00 O ATOM 1740 CB ALA A 114 -0.939 4.326 -3.276 1.00 0.00 C ATOM 0 H ALA A 114 1.028 5.005 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 114 0.784 3.800 -2.099 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.661 3.888 -2.587 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -0.833 5.389 -3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.289 4.195 -4.300 1.00 0.00 H new ATOM 1746 N PRO A 115 0.111 1.636 -4.536 1.00 0.00 N ATOM 1747 CA PRO A 115 -0.073 0.205 -4.798 1.00 0.00 C ATOM 1748 C PRO A 115 0.994 -0.652 -4.124 1.00 0.00 C ATOM 1749 O PRO A 115 0.675 -1.640 -3.458 1.00 0.00 O ATOM 1750 CB PRO A 115 0.035 0.085 -6.326 1.00 0.00 C ATOM 1751 CG PRO A 115 0.508 1.417 -6.812 1.00 0.00 C ATOM 1752 CD PRO A 115 0.091 2.420 -5.777 1.00 0.00 C ATOM 0 HA PRO A 115 -1.023 -0.152 -4.401 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.733 -0.703 -6.607 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -0.929 -0.171 -6.766 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.590 1.421 -6.942 1.00 0.00 H new ATOM 0 HG3 PRO A 115 0.070 1.654 -7.781 1.00 0.00 H new ATOM 0 HD2 PRO A 115 0.778 3.265 -5.733 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -0.900 2.826 -5.983 1.00 0.00 H new ATOM 1760 N VAL A 116 2.257 -0.270 -4.282 1.00 0.00 N ATOM 1761 CA VAL A 116 3.346 -1.016 -3.664 1.00 0.00 C ATOM 1762 C VAL A 116 3.141 -1.102 -2.161 1.00 0.00 C ATOM 1763 O VAL A 116 3.181 -2.182 -1.578 1.00 0.00 O ATOM 1764 CB VAL A 116 4.720 -0.373 -3.932 1.00 0.00 C ATOM 1765 CG1 VAL A 116 5.837 -1.274 -3.426 1.00 0.00 C ATOM 1766 CG2 VAL A 116 4.902 -0.080 -5.409 1.00 0.00 C ATOM 0 H VAL A 116 2.549 0.542 -4.826 1.00 0.00 H new ATOM 0 HA VAL A 116 3.335 -2.011 -4.110 1.00 0.00 H new ATOM 0 HB VAL A 116 4.764 0.572 -3.391 1.00 0.00 H new ATOM 0 HG11 VAL A 116 6.801 -0.805 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.722 -1.429 -2.353 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.790 -2.235 -3.938 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.880 0.374 -5.572 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.834 -1.009 -5.975 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.123 0.606 -5.742 1.00 0.00 H new ATOM 1776 N LEU A 117 2.925 0.052 -1.539 1.00 0.00 N ATOM 1777 CA LEU A 117 2.725 0.115 -0.096 1.00 0.00 C ATOM 1778 C LEU A 117 1.639 -0.858 0.373 1.00 0.00 C ATOM 1779 O LEU A 117 1.839 -1.608 1.330 1.00 0.00 O ATOM 1780 CB LEU A 117 2.372 1.545 0.323 1.00 0.00 C ATOM 1781 CG LEU A 117 3.449 2.599 0.030 1.00 0.00 C ATOM 1782 CD1 LEU A 117 3.285 3.799 0.948 1.00 0.00 C ATOM 1783 CD2 LEU A 117 4.845 2.010 0.176 1.00 0.00 C ATOM 0 H LEU A 117 2.884 0.955 -2.011 1.00 0.00 H new ATOM 0 HA LEU A 117 3.659 -0.182 0.381 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.453 1.838 -0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.162 1.551 1.393 1.00 0.00 H new ATOM 0 HG LEU A 117 3.324 2.928 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.057 4.535 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.303 4.245 0.792 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.377 3.479 1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.588 2.778 -0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 117 4.982 1.646 1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.966 1.184 -0.524 1.00 0.00 H new ATOM 1795 N VAL A 118 0.490 -0.842 -0.292 1.00 0.00 N ATOM 1796 CA VAL A 118 -0.618 -1.721 0.080 1.00 0.00 C ATOM 1797 C VAL A 118 -0.196 -3.184 0.133 1.00 0.00 C ATOM 1798 O VAL A 118 -0.401 -3.861 1.140 1.00 0.00 O ATOM 1799 CB VAL A 118 -1.799 -1.587 -0.893 1.00 0.00 C ATOM 1800 CG1 VAL A 118 -3.019 -2.325 -0.359 1.00 0.00 C ATOM 1801 CG2 VAL A 118 -2.114 -0.124 -1.138 1.00 0.00 C ATOM 0 H VAL A 118 0.299 -0.234 -1.088 1.00 0.00 H new ATOM 0 HA VAL A 118 -0.928 -1.404 1.076 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.521 -2.041 -1.844 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.845 -2.219 -1.062 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.780 -3.382 -0.237 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.306 -1.904 0.605 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.953 -0.043 -1.829 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.374 0.355 -0.194 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.242 0.369 -1.567 1.00 0.00 H new ATOM 1811 N ALA A 119 0.385 -3.673 -0.958 1.00 0.00 N ATOM 1812 CA ALA A 119 0.822 -5.064 -1.025 1.00 0.00 C ATOM 1813 C ALA A 119 1.715 -5.419 0.161 1.00 0.00 C ATOM 1814 O ALA A 119 1.579 -6.487 0.762 1.00 0.00 O ATOM 1815 CB ALA A 119 1.553 -5.321 -2.335 1.00 0.00 C ATOM 0 H ALA A 119 0.564 -3.131 -1.803 1.00 0.00 H new ATOM 0 HA ALA A 119 -0.062 -5.700 -0.981 1.00 0.00 H new ATOM 0 HB1 ALA A 119 1.874 -6.362 -2.374 1.00 0.00 H new ATOM 0 HB2 ALA A 119 0.884 -5.116 -3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.424 -4.669 -2.399 1.00 0.00 H new ATOM 1821 N LEU A 120 2.624 -4.513 0.494 1.00 0.00 N ATOM 1822 CA LEU A 120 3.544 -4.721 1.606 1.00 0.00 C ATOM 1823 C LEU A 120 2.796 -4.805 2.932 1.00 0.00 C ATOM 1824 O LEU A 120 3.223 -5.500 3.851 1.00 0.00 O ATOM 1825 CB LEU A 120 4.580 -3.604 1.646 1.00 0.00 C ATOM 1826 CG LEU A 120 5.228 -3.292 0.300 1.00 0.00 C ATOM 1827 CD1 LEU A 120 5.821 -1.896 0.311 1.00 0.00 C ATOM 1828 CD2 LEU A 120 6.288 -4.330 -0.035 1.00 0.00 C ATOM 0 H LEU A 120 2.745 -3.624 0.009 1.00 0.00 H new ATOM 0 HA LEU A 120 4.055 -5.671 1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.105 -2.699 2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 120 5.361 -3.875 2.356 1.00 0.00 H new ATOM 0 HG LEU A 120 4.461 -3.331 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.280 -1.688 -0.656 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.033 -1.168 0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.577 -1.828 1.093 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.739 -4.091 -0.998 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.057 -4.327 0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.828 -5.317 -0.084 1.00 0.00 H new ATOM 1840 N ALA A 121 1.675 -4.104 3.029 1.00 0.00 N ATOM 1841 CA ALA A 121 0.880 -4.135 4.248 1.00 0.00 C ATOM 1842 C ALA A 121 0.242 -5.504 4.410 1.00 0.00 C ATOM 1843 O ALA A 121 0.158 -6.042 5.514 1.00 0.00 O ATOM 1844 CB ALA A 121 -0.181 -3.050 4.223 1.00 0.00 C ATOM 0 H ALA A 121 1.299 -3.513 2.287 1.00 0.00 H new ATOM 0 HA ALA A 121 1.533 -3.947 5.100 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.764 -3.090 5.143 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.298 -2.074 4.139 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.840 -3.205 3.369 1.00 0.00 H new ATOM 1850 N LEU A 122 -0.187 -6.071 3.288 1.00 0.00 N ATOM 1851 CA LEU A 122 -0.798 -7.391 3.282 1.00 0.00 C ATOM 1852 C LEU A 122 0.276 -8.470 3.406 1.00 0.00 C ATOM 1853 O LEU A 122 -0.018 -9.625 3.715 1.00 0.00 O ATOM 1854 CB LEU A 122 -1.607 -7.589 1.995 1.00 0.00 C ATOM 1855 CG LEU A 122 -2.497 -8.835 1.958 1.00 0.00 C ATOM 1856 CD1 LEU A 122 -3.146 -9.079 3.311 1.00 0.00 C ATOM 1857 CD2 LEU A 122 -3.558 -8.692 0.877 1.00 0.00 C ATOM 0 H LEU A 122 -0.122 -5.634 2.369 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.472 -7.472 4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -2.235 -6.711 1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.914 -7.634 1.155 1.00 0.00 H new ATOM 0 HG LEU A 122 -1.871 -9.696 1.723 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.773 -9.969 3.259 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.372 -9.224 4.065 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.759 -8.219 3.581 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -4.184 -9.584 0.861 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.176 -7.819 1.087 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.075 -8.570 -0.093 1.00 0.00 H new ATOM 1869 N ILE A 123 1.527 -8.077 3.164 1.00 0.00 N ATOM 1870 CA ILE A 123 2.657 -8.993 3.246 1.00 0.00 C ATOM 1871 C ILE A 123 2.745 -9.626 4.639 1.00 0.00 C ATOM 1872 O ILE A 123 3.175 -10.770 4.788 1.00 0.00 O ATOM 1873 CB ILE A 123 3.975 -8.248 2.875 1.00 0.00 C ATOM 1874 CG1 ILE A 123 4.155 -8.272 1.347 1.00 0.00 C ATOM 1875 CG2 ILE A 123 5.206 -8.810 3.598 1.00 0.00 C ATOM 1876 CD1 ILE A 123 5.558 -7.956 0.871 1.00 0.00 C ATOM 0 H ILE A 123 1.781 -7.123 2.908 1.00 0.00 H new ATOM 0 HA ILE A 123 2.509 -9.801 2.530 1.00 0.00 H new ATOM 0 HB ILE A 123 3.886 -7.216 3.215 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.874 -9.258 0.977 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.465 -7.555 0.902 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.092 -8.250 3.298 1.00 0.00 H new ATOM 0 HG22 ILE A 123 5.068 -8.720 4.675 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.335 -9.860 3.335 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.591 -7.996 -0.218 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.840 -6.958 1.206 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.255 -8.687 1.282 1.00 0.00 H new ATOM 1888 N GLU A 124 2.330 -8.882 5.654 1.00 0.00 N ATOM 1889 CA GLU A 124 2.365 -9.375 7.028 1.00 0.00 C ATOM 1890 C GLU A 124 1.356 -10.507 7.263 1.00 0.00 C ATOM 1891 O GLU A 124 1.434 -11.212 8.269 1.00 0.00 O ATOM 1892 CB GLU A 124 2.116 -8.227 8.014 1.00 0.00 C ATOM 1893 CG GLU A 124 0.657 -7.803 8.130 1.00 0.00 C ATOM 1894 CD GLU A 124 0.002 -8.315 9.398 1.00 0.00 C ATOM 1895 OE1 GLU A 124 0.307 -7.776 10.483 1.00 0.00 O ATOM 1896 OE2 GLU A 124 -0.815 -9.255 9.305 1.00 0.00 O ATOM 0 H GLU A 124 1.965 -7.935 5.555 1.00 0.00 H new ATOM 0 HA GLU A 124 3.360 -9.786 7.199 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.474 -8.526 8.999 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.709 -7.365 7.707 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.595 -6.715 8.107 1.00 0.00 H new ATOM 0 HG3 GLU A 124 0.105 -8.172 7.265 1.00 0.00 H new ATOM 1903 N SER A 125 0.388 -10.655 6.358 1.00 0.00 N ATOM 1904 CA SER A 125 -0.651 -11.676 6.509 1.00 0.00 C ATOM 1905 C SER A 125 -0.228 -13.060 6.002 1.00 0.00 C ATOM 1906 O SER A 125 -1.065 -13.958 5.894 1.00 0.00 O ATOM 1907 CB SER A 125 -1.924 -11.236 5.784 1.00 0.00 C ATOM 1908 OG SER A 125 -2.225 -9.880 6.067 1.00 0.00 O ATOM 0 H SER A 125 0.301 -10.085 5.517 1.00 0.00 H new ATOM 0 HA SER A 125 -0.832 -11.773 7.580 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.799 -11.368 4.709 1.00 0.00 H new ATOM 0 HB3 SER A 125 -2.758 -11.869 6.088 1.00 0.00 H new ATOM 0 HG SER A 125 -3.195 -9.745 6.027 1.00 0.00 H new ATOM 1914 N GLY A 126 1.056 -13.247 5.705 1.00 0.00 N ATOM 1915 CA GLY A 126 1.514 -14.551 5.234 1.00 0.00 C ATOM 1916 C GLY A 126 2.095 -14.510 3.833 1.00 0.00 C ATOM 1917 O GLY A 126 3.249 -14.127 3.651 1.00 0.00 O ATOM 0 H GLY A 126 1.781 -12.533 5.779 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.268 -14.934 5.922 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.679 -15.251 5.254 1.00 0.00 H new ATOM 1921 N MET A 127 1.295 -14.910 2.841 1.00 0.00 N ATOM 1922 CA MET A 127 1.747 -14.912 1.449 1.00 0.00 C ATOM 1923 C MET A 127 2.072 -13.490 1.015 1.00 0.00 C ATOM 1924 O MET A 127 1.281 -12.835 0.346 1.00 0.00 O ATOM 1925 CB MET A 127 0.675 -15.516 0.533 1.00 0.00 C ATOM 1926 CG MET A 127 -0.721 -14.946 0.751 1.00 0.00 C ATOM 1927 SD MET A 127 -1.874 -15.419 -0.556 1.00 0.00 S ATOM 1928 CE MET A 127 -2.993 -14.017 -0.566 1.00 0.00 C ATOM 0 H MET A 127 0.337 -15.234 2.975 1.00 0.00 H new ATOM 0 HA MET A 127 2.645 -15.525 1.371 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.965 -15.352 -0.505 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.644 -16.594 0.689 1.00 0.00 H new ATOM 0 HG2 MET A 127 -1.105 -15.291 1.711 1.00 0.00 H new ATOM 0 HG3 MET A 127 -0.662 -13.859 0.803 1.00 0.00 H new ATOM 0 HE1 MET A 127 -4.015 -14.366 -0.416 1.00 0.00 H new ATOM 0 HE2 MET A 127 -2.723 -13.330 0.236 1.00 0.00 H new ATOM 0 HE3 MET A 127 -2.923 -13.502 -1.524 1.00 0.00 H new ATOM 1938 N LYS A 128 3.221 -13.009 1.460 1.00 0.00 N ATOM 1939 CA LYS A 128 3.647 -11.643 1.185 1.00 0.00 C ATOM 1940 C LYS A 128 4.083 -11.387 -0.257 1.00 0.00 C ATOM 1941 O LYS A 128 3.434 -10.631 -0.979 1.00 0.00 O ATOM 1942 CB LYS A 128 4.791 -11.265 2.127 1.00 0.00 C ATOM 1943 CG LYS A 128 5.848 -12.348 2.317 1.00 0.00 C ATOM 1944 CD LYS A 128 5.962 -12.768 3.774 1.00 0.00 C ATOM 1945 CE LYS A 128 6.770 -11.763 4.580 1.00 0.00 C ATOM 1946 NZ LYS A 128 8.221 -12.092 4.587 1.00 0.00 N ATOM 0 H LYS A 128 3.882 -13.549 2.019 1.00 0.00 H new ATOM 0 HA LYS A 128 2.767 -11.022 1.350 1.00 0.00 H new ATOM 0 HB2 LYS A 128 5.276 -10.367 1.745 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.372 -11.011 3.101 1.00 0.00 H new ATOM 0 HG2 LYS A 128 5.596 -13.215 1.706 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.813 -11.981 1.967 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.966 -12.865 4.205 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.433 -13.749 3.836 1.00 0.00 H new ATOM 0 HE2 LYS A 128 6.626 -10.766 4.164 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.399 -11.738 5.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 8.735 -11.382 5.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 8.362 -13.033 5.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.582 -12.091 3.612 1.00 0.00 H new ATOM 1960 N TYR A 129 5.192 -11.984 -0.663 1.00 0.00 N ATOM 1961 CA TYR A 129 5.715 -11.777 -2.006 1.00 0.00 C ATOM 1962 C TYR A 129 4.791 -12.384 -3.054 1.00 0.00 C ATOM 1963 O TYR A 129 4.668 -11.867 -4.165 1.00 0.00 O ATOM 1964 CB TYR A 129 7.121 -12.373 -2.100 1.00 0.00 C ATOM 1965 CG TYR A 129 7.861 -12.039 -3.377 1.00 0.00 C ATOM 1966 CD1 TYR A 129 7.723 -10.797 -3.984 1.00 0.00 C ATOM 1967 CD2 TYR A 129 8.710 -12.967 -3.971 1.00 0.00 C ATOM 1968 CE1 TYR A 129 8.408 -10.490 -5.145 1.00 0.00 C ATOM 1969 CE2 TYR A 129 9.395 -12.667 -5.132 1.00 0.00 C ATOM 1970 CZ TYR A 129 9.241 -11.429 -5.715 1.00 0.00 C ATOM 1971 OH TYR A 129 9.924 -11.126 -6.870 1.00 0.00 O ATOM 0 H TYR A 129 5.747 -12.614 -0.084 1.00 0.00 H new ATOM 0 HA TYR A 129 5.769 -10.707 -2.205 1.00 0.00 H new ATOM 0 HB2 TYR A 129 7.708 -12.021 -1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.049 -13.457 -2.010 1.00 0.00 H new ATOM 0 HD1 TYR A 129 7.070 -10.059 -3.542 1.00 0.00 H new ATOM 0 HD2 TYR A 129 8.836 -13.939 -3.517 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.291 -9.519 -5.603 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.049 -13.400 -5.581 1.00 0.00 H new ATOM 0 HH TYR A 129 10.468 -11.895 -7.140 1.00 0.00 H new ATOM 1981 N GLU A 130 4.136 -13.475 -2.688 1.00 0.00 N ATOM 1982 CA GLU A 130 3.215 -14.151 -3.593 1.00 0.00 C ATOM 1983 C GLU A 130 1.936 -13.342 -3.782 1.00 0.00 C ATOM 1984 O GLU A 130 1.529 -13.073 -4.911 1.00 0.00 O ATOM 1985 CB GLU A 130 2.878 -15.547 -3.065 1.00 0.00 C ATOM 1986 CG GLU A 130 4.093 -16.327 -2.589 1.00 0.00 C ATOM 1987 CD GLU A 130 3.978 -16.766 -1.142 1.00 0.00 C ATOM 1988 OE1 GLU A 130 3.000 -17.467 -0.811 1.00 0.00 O ATOM 1989 OE2 GLU A 130 4.864 -16.405 -0.339 1.00 0.00 O ATOM 0 H GLU A 130 4.224 -13.912 -1.771 1.00 0.00 H new ATOM 0 HA GLU A 130 3.706 -14.245 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 130 2.171 -15.454 -2.241 1.00 0.00 H new ATOM 0 HB3 GLU A 130 2.378 -16.113 -3.851 1.00 0.00 H new ATOM 0 HG2 GLU A 130 4.226 -17.205 -3.221 1.00 0.00 H new ATOM 0 HG3 GLU A 130 4.984 -15.711 -2.707 1.00 0.00 H new ATOM 1996 N ASP A 131 1.302 -12.956 -2.676 1.00 0.00 N ATOM 1997 CA ASP A 131 0.067 -12.180 -2.746 1.00 0.00 C ATOM 1998 C ASP A 131 0.329 -10.781 -3.274 1.00 0.00 C ATOM 1999 O ASP A 131 -0.446 -10.252 -4.060 1.00 0.00 O ATOM 2000 CB ASP A 131 -0.597 -12.081 -1.375 1.00 0.00 C ATOM 2001 CG ASP A 131 -1.949 -11.397 -1.439 1.00 0.00 C ATOM 2002 OD1 ASP A 131 -2.645 -11.551 -2.465 1.00 0.00 O ATOM 2003 OD2 ASP A 131 -2.311 -10.709 -0.462 1.00 0.00 O ATOM 0 H ASP A 131 1.620 -13.166 -1.730 1.00 0.00 H new ATOM 0 HA ASP A 131 -0.601 -12.701 -3.431 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -0.718 -13.081 -0.959 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.055 -11.530 -0.697 1.00 0.00 H new ATOM 2008 N ALA A 132 1.415 -10.173 -2.831 1.00 0.00 N ATOM 2009 CA ALA A 132 1.741 -8.828 -3.267 1.00 0.00 C ATOM 2010 C ALA A 132 1.888 -8.758 -4.781 1.00 0.00 C ATOM 2011 O ALA A 132 1.312 -7.885 -5.420 1.00 0.00 O ATOM 2012 CB ALA A 132 3.005 -8.337 -2.584 1.00 0.00 C ATOM 0 H ALA A 132 2.080 -10.585 -2.176 1.00 0.00 H new ATOM 0 HA ALA A 132 0.916 -8.175 -2.981 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.233 -7.327 -2.924 1.00 0.00 H new ATOM 0 HB2 ALA A 132 2.857 -8.332 -1.504 1.00 0.00 H new ATOM 0 HB3 ALA A 132 3.834 -8.999 -2.833 1.00 0.00 H new ATOM 2018 N ILE A 133 2.658 -9.674 -5.353 1.00 0.00 N ATOM 2019 CA ILE A 133 2.864 -9.684 -6.794 1.00 0.00 C ATOM 2020 C ILE A 133 1.612 -10.152 -7.545 1.00 0.00 C ATOM 2021 O ILE A 133 1.277 -9.607 -8.598 1.00 0.00 O ATOM 2022 CB ILE A 133 4.068 -10.571 -7.181 1.00 0.00 C ATOM 2023 CG1 ILE A 133 5.320 -10.112 -6.430 1.00 0.00 C ATOM 2024 CG2 ILE A 133 4.305 -10.536 -8.686 1.00 0.00 C ATOM 2025 CD1 ILE A 133 5.803 -8.738 -6.842 1.00 0.00 C ATOM 0 H ILE A 133 3.146 -10.413 -4.847 1.00 0.00 H new ATOM 0 HA ILE A 133 3.075 -8.656 -7.088 1.00 0.00 H new ATOM 0 HB ILE A 133 3.845 -11.600 -6.898 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.111 -10.109 -5.360 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.119 -10.834 -6.597 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.158 -11.168 -8.935 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.418 -10.903 -9.203 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.509 -9.512 -8.998 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.693 -8.478 -6.269 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.044 -8.741 -7.905 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.020 -8.004 -6.649 1.00 0.00 H new ATOM 2037 N GLN A 134 0.929 -11.164 -7.014 1.00 0.00 N ATOM 2038 CA GLN A 134 -0.272 -11.697 -7.661 1.00 0.00 C ATOM 2039 C GLN A 134 -1.482 -10.771 -7.504 1.00 0.00 C ATOM 2040 O GLN A 134 -2.164 -10.465 -8.485 1.00 0.00 O ATOM 2041 CB GLN A 134 -0.611 -13.081 -7.098 1.00 0.00 C ATOM 2042 CG GLN A 134 0.040 -14.225 -7.860 1.00 0.00 C ATOM 2043 CD GLN A 134 1.516 -14.374 -7.546 1.00 0.00 C ATOM 2044 OE1 GLN A 134 2.209 -13.392 -7.280 1.00 0.00 O ATOM 2045 NE2 GLN A 134 2.005 -15.607 -7.578 1.00 0.00 N ATOM 0 H GLN A 134 1.183 -11.630 -6.143 1.00 0.00 H new ATOM 0 HA GLN A 134 -0.049 -11.773 -8.725 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -0.298 -13.126 -6.055 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -1.693 -13.215 -7.113 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -0.474 -15.155 -7.619 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -0.085 -14.060 -8.930 1.00 0.00 H new ATOM 0 HE21 GLN A 134 1.394 -16.392 -7.803 1.00 0.00 H new ATOM 0 HE22 GLN A 134 2.992 -15.770 -7.377 1.00 0.00 H new ATOM 2054 N PHE A 135 -1.753 -10.334 -6.277 1.00 0.00 N ATOM 2055 CA PHE A 135 -2.891 -9.456 -6.020 1.00 0.00 C ATOM 2056 C PHE A 135 -2.679 -8.099 -6.681 1.00 0.00 C ATOM 2057 O PHE A 135 -3.618 -7.502 -7.205 1.00 0.00 O ATOM 2058 CB PHE A 135 -3.126 -9.293 -4.509 1.00 0.00 C ATOM 2059 CG PHE A 135 -4.511 -9.670 -4.039 1.00 0.00 C ATOM 2060 CD1 PHE A 135 -5.274 -10.608 -4.721 1.00 0.00 C ATOM 2061 CD2 PHE A 135 -5.045 -9.085 -2.900 1.00 0.00 C ATOM 2062 CE1 PHE A 135 -6.538 -10.950 -4.278 1.00 0.00 C ATOM 2063 CE2 PHE A 135 -6.307 -9.423 -2.454 1.00 0.00 C ATOM 2064 CZ PHE A 135 -7.055 -10.355 -3.143 1.00 0.00 C ATOM 0 H PHE A 135 -1.205 -10.571 -5.450 1.00 0.00 H new ATOM 0 HA PHE A 135 -3.780 -9.915 -6.453 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -2.398 -9.903 -3.974 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -2.935 -8.255 -4.236 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.875 -11.076 -5.609 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -4.465 -8.355 -2.355 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -7.121 -11.681 -4.818 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -6.709 -8.958 -1.566 1.00 0.00 H new ATOM 0 HZ PHE A 135 -8.043 -10.619 -2.796 1.00 0.00 H new ATOM 2074 N ILE A 136 -1.437 -7.622 -6.672 1.00 0.00 N ATOM 2075 CA ILE A 136 -1.117 -6.345 -7.293 1.00 0.00 C ATOM 2076 C ILE A 136 -1.118 -6.476 -8.814 1.00 0.00 C ATOM 2077 O ILE A 136 -1.384 -5.513 -9.528 1.00 0.00 O ATOM 2078 CB ILE A 136 0.243 -5.790 -6.809 1.00 0.00 C ATOM 2079 CG1 ILE A 136 0.247 -4.263 -6.885 1.00 0.00 C ATOM 2080 CG2 ILE A 136 1.398 -6.370 -7.617 1.00 0.00 C ATOM 2081 CD1 ILE A 136 0.999 -3.605 -5.749 1.00 0.00 C ATOM 0 H ILE A 136 -0.643 -8.098 -6.244 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.889 -5.637 -6.992 1.00 0.00 H new ATOM 0 HB ILE A 136 0.381 -6.092 -5.771 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.692 -3.955 -7.831 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.782 -3.904 -6.885 1.00 0.00 H new ATOM 0 HG21 ILE A 136 2.340 -5.960 -7.252 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.409 -7.455 -7.509 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.273 -6.111 -8.668 1.00 0.00 H new ATOM 0 HD11 ILE A 136 0.961 -2.522 -5.867 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.541 -3.883 -4.800 1.00 0.00 H new ATOM 0 HD13 ILE A 136 2.038 -3.935 -5.761 1.00 0.00 H new ATOM 2093 N ARG A 137 -0.822 -7.681 -9.303 1.00 0.00 N ATOM 2094 CA ARG A 137 -0.798 -7.938 -10.739 1.00 0.00 C ATOM 2095 C ARG A 137 -2.196 -7.792 -11.335 1.00 0.00 C ATOM 2096 O ARG A 137 -2.376 -7.151 -12.371 1.00 0.00 O ATOM 2097 CB ARG A 137 -0.258 -9.343 -11.022 1.00 0.00 C ATOM 2098 CG ARG A 137 1.168 -9.353 -11.550 1.00 0.00 C ATOM 2099 CD ARG A 137 1.490 -10.662 -12.255 1.00 0.00 C ATOM 2100 NE ARG A 137 2.914 -10.983 -12.192 1.00 0.00 N ATOM 2101 CZ ARG A 137 3.418 -12.174 -12.505 1.00 0.00 C ATOM 2102 NH1 ARG A 137 2.621 -13.158 -12.901 1.00 0.00 N ATOM 2103 NH2 ARG A 137 4.726 -12.382 -12.423 1.00 0.00 N ATOM 0 H ARG A 137 -0.596 -8.491 -8.725 1.00 0.00 H new ATOM 0 HA ARG A 137 -0.139 -7.204 -11.204 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -0.301 -9.931 -10.105 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -0.908 -9.834 -11.746 1.00 0.00 H new ATOM 0 HG2 ARG A 137 1.307 -8.522 -12.241 1.00 0.00 H new ATOM 0 HG3 ARG A 137 1.864 -9.202 -10.725 1.00 0.00 H new ATOM 0 HD2 ARG A 137 0.916 -11.469 -11.800 1.00 0.00 H new ATOM 0 HD3 ARG A 137 1.179 -10.598 -13.298 1.00 0.00 H new ATOM 0 HE ARG A 137 3.559 -10.252 -11.891 1.00 0.00 H new ATOM 0 HH11 ARG A 137 1.615 -13.004 -12.967 1.00 0.00 H new ATOM 0 HH12 ARG A 137 3.014 -14.068 -13.139 1.00 0.00 H new ATOM 0 HH21 ARG A 137 5.344 -11.629 -12.120 1.00 0.00 H new ATOM 0 HH22 ARG A 137 5.113 -13.295 -12.663 1.00 0.00 H new ATOM 2117 N GLN A 138 -3.183 -8.388 -10.670 1.00 0.00 N ATOM 2118 CA GLN A 138 -4.565 -8.322 -11.134 1.00 0.00 C ATOM 2119 C GLN A 138 -5.040 -6.873 -11.203 1.00 0.00 C ATOM 2120 O GLN A 138 -5.654 -6.454 -12.184 1.00 0.00 O ATOM 2121 CB GLN A 138 -5.474 -9.134 -10.206 1.00 0.00 C ATOM 2122 CG GLN A 138 -6.134 -10.321 -10.888 1.00 0.00 C ATOM 2123 CD GLN A 138 -7.534 -10.008 -11.379 1.00 0.00 C ATOM 2124 OE1 GLN A 138 -7.995 -8.870 -11.292 1.00 0.00 O ATOM 2125 NE2 GLN A 138 -8.220 -11.020 -11.898 1.00 0.00 N ATOM 0 H GLN A 138 -3.051 -8.921 -9.810 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.613 -8.749 -12.136 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -4.888 -9.492 -9.359 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -6.248 -8.479 -9.805 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -5.520 -10.638 -11.731 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.176 -11.158 -10.191 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -7.799 -11.948 -11.951 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -9.168 -10.870 -12.244 1.00 0.00 H new ATOM 2134 N LYS A 139 -4.737 -6.112 -10.158 1.00 0.00 N ATOM 2135 CA LYS A 139 -5.115 -4.705 -10.092 1.00 0.00 C ATOM 2136 C LYS A 139 -4.051 -3.842 -10.762 1.00 0.00 C ATOM 2137 O LYS A 139 -2.881 -4.216 -10.804 1.00 0.00 O ATOM 2138 CB LYS A 139 -5.302 -4.271 -8.637 1.00 0.00 C ATOM 2139 CG LYS A 139 -6.406 -5.025 -7.913 1.00 0.00 C ATOM 2140 CD LYS A 139 -7.778 -4.472 -8.260 1.00 0.00 C ATOM 2141 CE LYS A 139 -8.394 -5.206 -9.441 1.00 0.00 C ATOM 2142 NZ LYS A 139 -9.847 -5.466 -9.237 1.00 0.00 N ATOM 0 H LYS A 139 -4.228 -6.448 -9.340 1.00 0.00 H new ATOM 0 HA LYS A 139 -6.060 -4.575 -10.620 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -4.364 -4.414 -8.101 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -5.525 -3.204 -8.611 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -6.361 -6.081 -8.178 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -6.248 -4.959 -6.837 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -8.435 -4.558 -7.395 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -7.695 -3.411 -8.493 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -8.254 -4.617 -10.347 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -7.874 -6.152 -9.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -10.229 -5.968 -10.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -9.979 -6.049 -8.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -10.348 -4.562 -9.118 1.00 0.00 H new ATOM 2156 N ARG A 140 -4.451 -2.693 -11.294 1.00 0.00 N ATOM 2157 CA ARG A 140 -3.499 -1.811 -11.959 1.00 0.00 C ATOM 2158 C ARG A 140 -2.604 -1.123 -10.934 1.00 0.00 C ATOM 2159 O ARG A 140 -3.076 -0.360 -10.091 1.00 0.00 O ATOM 2160 CB ARG A 140 -4.237 -0.766 -12.798 1.00 0.00 C ATOM 2161 CG ARG A 140 -3.626 -0.548 -14.173 1.00 0.00 C ATOM 2162 CD ARG A 140 -2.445 0.408 -14.116 1.00 0.00 C ATOM 2163 NE ARG A 140 -2.807 1.753 -14.560 1.00 0.00 N ATOM 2164 CZ ARG A 140 -3.198 2.045 -15.798 1.00 0.00 C ATOM 2165 NH1 ARG A 140 -3.275 1.093 -16.720 1.00 0.00 N ATOM 2166 NH2 ARG A 140 -3.512 3.293 -16.117 1.00 0.00 N ATOM 0 H ARG A 140 -5.413 -2.354 -11.279 1.00 0.00 H new ATOM 0 HA ARG A 140 -2.875 -2.414 -12.619 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -5.276 -1.074 -12.916 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -4.245 0.181 -12.259 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -3.301 -1.504 -14.583 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -4.383 -0.152 -14.850 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -2.064 0.453 -13.096 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.638 0.025 -14.741 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.757 2.512 -13.881 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -3.034 0.131 -16.481 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.575 1.323 -17.667 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.454 4.029 -15.413 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -3.812 3.517 -17.066 1.00 0.00 H new ATOM 2180 N ARG A 141 -1.308 -1.410 -11.012 1.00 0.00 N ATOM 2181 CA ARG A 141 -0.330 -0.834 -10.095 1.00 0.00 C ATOM 2182 C ARG A 141 0.646 0.077 -10.833 1.00 0.00 C ATOM 2183 O ARG A 141 0.756 0.020 -12.058 1.00 0.00 O ATOM 2184 CB ARG A 141 0.431 -1.946 -9.362 1.00 0.00 C ATOM 2185 CG ARG A 141 1.464 -2.663 -10.220 1.00 0.00 C ATOM 2186 CD ARG A 141 0.813 -3.643 -11.183 1.00 0.00 C ATOM 2187 NE ARG A 141 1.690 -4.772 -11.489 1.00 0.00 N ATOM 2188 CZ ARG A 141 1.546 -5.554 -12.556 1.00 0.00 C ATOM 2189 NH1 ARG A 141 0.559 -5.340 -13.418 1.00 0.00 N ATOM 2190 NH2 ARG A 141 2.393 -6.554 -12.764 1.00 0.00 N ATOM 0 H ARG A 141 -0.909 -2.042 -11.706 1.00 0.00 H new ATOM 0 HA ARG A 141 -0.867 -0.231 -9.363 1.00 0.00 H new ATOM 0 HB2 ARG A 141 0.931 -1.518 -8.493 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -0.286 -2.677 -8.989 1.00 0.00 H new ATOM 0 HG2 ARG A 141 2.042 -1.930 -10.782 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.165 -3.196 -9.577 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -0.117 -4.013 -10.751 1.00 0.00 H new ATOM 0 HD3 ARG A 141 0.552 -3.126 -12.106 1.00 0.00 H new ATOM 0 HE ARG A 141 2.457 -4.972 -10.847 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -0.095 -4.572 -13.264 1.00 0.00 H new ATOM 0 HH12 ARG A 141 0.455 -5.943 -14.234 1.00 0.00 H new ATOM 0 HH21 ARG A 141 3.154 -6.723 -12.106 1.00 0.00 H new ATOM 0 HH22 ARG A 141 2.283 -7.154 -13.582 1.00 0.00 H new ATOM 2204 N GLY A 142 1.362 0.910 -10.080 1.00 0.00 N ATOM 2205 CA GLY A 142 2.331 1.809 -10.682 1.00 0.00 C ATOM 2206 C GLY A 142 3.340 1.063 -11.535 1.00 0.00 C ATOM 2207 O GLY A 142 3.181 -0.132 -11.785 1.00 0.00 O ATOM 0 H GLY A 142 1.288 0.978 -9.065 1.00 0.00 H new ATOM 0 HA2 GLY A 142 1.811 2.546 -11.295 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.853 2.358 -9.898 1.00 0.00 H new ATOM 2211 N ALA A 143 4.381 1.753 -11.989 1.00 0.00 N ATOM 2212 CA ALA A 143 5.393 1.112 -12.818 1.00 0.00 C ATOM 2213 C ALA A 143 6.489 0.475 -11.965 1.00 0.00 C ATOM 2214 O ALA A 143 7.404 1.154 -11.501 1.00 0.00 O ATOM 2215 CB ALA A 143 5.999 2.121 -13.781 1.00 0.00 C ATOM 0 H ALA A 143 4.545 2.742 -11.800 1.00 0.00 H new ATOM 0 HA ALA A 143 4.907 0.320 -13.388 1.00 0.00 H new ATOM 0 HB1 ALA A 143 6.754 1.630 -14.395 1.00 0.00 H new ATOM 0 HB2 ALA A 143 5.217 2.527 -14.423 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.461 2.931 -13.216 1.00 0.00 H new ATOM 2221 N ILE A 144 6.396 -0.841 -11.781 1.00 0.00 N ATOM 2222 CA ILE A 144 7.389 -1.579 -11.005 1.00 0.00 C ATOM 2223 C ILE A 144 8.551 -2.023 -11.892 1.00 0.00 C ATOM 2224 O ILE A 144 8.388 -2.891 -12.748 1.00 0.00 O ATOM 2225 CB ILE A 144 6.768 -2.803 -10.278 1.00 0.00 C ATOM 2226 CG1 ILE A 144 6.415 -3.939 -11.252 1.00 0.00 C ATOM 2227 CG2 ILE A 144 5.533 -2.377 -9.498 1.00 0.00 C ATOM 2228 CD1 ILE A 144 5.317 -3.594 -12.233 1.00 0.00 C ATOM 0 H ILE A 144 5.644 -1.417 -12.159 1.00 0.00 H new ATOM 0 HA ILE A 144 7.767 -0.899 -10.242 1.00 0.00 H new ATOM 0 HB ILE A 144 7.519 -3.188 -9.588 1.00 0.00 H new ATOM 0 HG12 ILE A 144 7.310 -4.217 -11.808 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.112 -4.814 -10.678 1.00 0.00 H new ATOM 0 HG21 ILE A 144 5.106 -3.243 -8.992 1.00 0.00 H new ATOM 0 HG22 ILE A 144 5.811 -1.625 -8.759 1.00 0.00 H new ATOM 0 HG23 ILE A 144 4.797 -1.957 -10.183 1.00 0.00 H new ATOM 0 HD11 ILE A 144 5.129 -4.448 -12.884 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.407 -3.346 -11.688 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.623 -2.739 -12.836 1.00 0.00 H new ATOM 2240 N ASN A 145 9.723 -1.420 -11.708 1.00 0.00 N ATOM 2241 CA ASN A 145 10.873 -1.787 -12.529 1.00 0.00 C ATOM 2242 C ASN A 145 11.986 -2.460 -11.725 1.00 0.00 C ATOM 2243 O ASN A 145 12.169 -3.675 -11.803 1.00 0.00 O ATOM 2244 CB ASN A 145 11.427 -0.545 -13.232 1.00 0.00 C ATOM 2245 CG ASN A 145 10.765 -0.298 -14.573 1.00 0.00 C ATOM 2246 OD1 ASN A 145 11.438 -0.196 -15.600 1.00 0.00 O ATOM 2247 ND2 ASN A 145 9.441 -0.199 -14.573 1.00 0.00 N ATOM 0 H ASN A 145 9.900 -0.693 -11.015 1.00 0.00 H new ATOM 0 HA ASN A 145 10.521 -2.513 -13.262 1.00 0.00 H new ATOM 0 HB2 ASN A 145 11.283 0.326 -12.593 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.501 -0.661 -13.376 1.00 0.00 H new ATOM 0 HD21 ASN A 145 8.942 -0.032 -15.447 1.00 0.00 H new ATOM 0 HD22 ASN A 145 8.923 -0.290 -13.699 1.00 0.00 H new ATOM 2254 N SER A 146 12.749 -1.662 -10.979 1.00 0.00 N ATOM 2255 CA SER A 146 13.866 -2.187 -10.195 1.00 0.00 C ATOM 2256 C SER A 146 13.545 -2.383 -8.711 1.00 0.00 C ATOM 2257 O SER A 146 13.663 -3.487 -8.180 1.00 0.00 O ATOM 2258 CB SER A 146 15.074 -1.260 -10.334 1.00 0.00 C ATOM 2259 OG SER A 146 14.699 0.096 -10.170 1.00 0.00 O ATOM 0 H SER A 146 12.615 -0.654 -10.901 1.00 0.00 H new ATOM 0 HA SER A 146 14.083 -3.176 -10.599 1.00 0.00 H new ATOM 0 HB2 SER A 146 15.826 -1.525 -9.591 1.00 0.00 H new ATOM 0 HB3 SER A 146 15.531 -1.398 -11.314 1.00 0.00 H new ATOM 0 HG SER A 146 15.490 0.667 -10.262 1.00 0.00 H new ATOM 2265 N LYS A 147 13.201 -1.288 -8.037 1.00 0.00 N ATOM 2266 CA LYS A 147 12.936 -1.311 -6.598 1.00 0.00 C ATOM 2267 C LYS A 147 11.746 -2.178 -6.203 1.00 0.00 C ATOM 2268 O LYS A 147 11.847 -2.968 -5.278 1.00 0.00 O ATOM 2269 CB LYS A 147 12.719 0.111 -6.070 1.00 0.00 C ATOM 2270 CG LYS A 147 13.172 0.303 -4.626 1.00 0.00 C ATOM 2271 CD LYS A 147 11.997 0.283 -3.655 1.00 0.00 C ATOM 2272 CE LYS A 147 12.427 0.667 -2.243 1.00 0.00 C ATOM 2273 NZ LYS A 147 11.349 0.422 -1.240 1.00 0.00 N ATOM 0 H LYS A 147 13.098 -0.368 -8.466 1.00 0.00 H new ATOM 0 HA LYS A 147 13.821 -1.759 -6.145 1.00 0.00 H new ATOM 0 HB2 LYS A 147 13.258 0.812 -6.707 1.00 0.00 H new ATOM 0 HB3 LYS A 147 11.661 0.360 -6.146 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.877 -0.484 -4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 147 13.702 1.251 -4.535 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.227 0.972 -4.001 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.552 -0.712 -3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 147 13.314 0.097 -1.967 1.00 0.00 H new ATOM 0 HE3 LYS A 147 12.706 1.720 -2.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 11.168 1.295 -0.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 10.479 0.130 -1.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.648 -0.330 -0.586 1.00 0.00 H new ATOM 2287 N GLN A 148 10.610 -2.000 -6.859 1.00 0.00 N ATOM 2288 CA GLN A 148 9.406 -2.746 -6.494 1.00 0.00 C ATOM 2289 C GLN A 148 9.604 -4.265 -6.513 1.00 0.00 C ATOM 2290 O GLN A 148 9.288 -4.946 -5.533 1.00 0.00 O ATOM 2291 CB GLN A 148 8.262 -2.363 -7.429 1.00 0.00 C ATOM 2292 CG GLN A 148 7.429 -1.201 -6.915 1.00 0.00 C ATOM 2293 CD GLN A 148 7.226 -0.119 -7.959 1.00 0.00 C ATOM 2294 OE1 GLN A 148 5.971 0.153 -8.293 1.00 0.00 O flip ATOM 2295 NE2 GLN A 148 8.189 0.464 -8.459 1.00 0.00 N flip ATOM 0 H GLN A 148 10.492 -1.354 -7.639 1.00 0.00 H new ATOM 0 HA GLN A 148 9.167 -2.475 -5.466 1.00 0.00 H new ATOM 0 HB2 GLN A 148 8.671 -2.104 -8.405 1.00 0.00 H new ATOM 0 HB3 GLN A 148 7.615 -3.228 -7.574 1.00 0.00 H new ATOM 0 HG2 GLN A 148 6.457 -1.572 -6.589 1.00 0.00 H new ATOM 0 HG3 GLN A 148 7.916 -0.769 -6.040 1.00 0.00 H new ATOM 0 HE21 GLN A 148 9.137 0.222 -8.172 1.00 0.00 H new ATOM 0 HE22 GLN A 148 8.038 1.189 -9.160 1.00 0.00 H new ATOM 2304 N LEU A 149 10.109 -4.802 -7.616 1.00 0.00 N ATOM 2305 CA LEU A 149 10.312 -6.245 -7.726 1.00 0.00 C ATOM 2306 C LEU A 149 11.527 -6.714 -6.927 1.00 0.00 C ATOM 2307 O LEU A 149 11.490 -7.768 -6.291 1.00 0.00 O ATOM 2308 CB LEU A 149 10.450 -6.656 -9.192 1.00 0.00 C ATOM 2309 CG LEU A 149 9.148 -7.116 -9.852 1.00 0.00 C ATOM 2310 CD1 LEU A 149 8.610 -8.367 -9.167 1.00 0.00 C ATOM 2311 CD2 LEU A 149 8.114 -6.000 -9.815 1.00 0.00 C ATOM 0 H LEU A 149 10.384 -4.269 -8.441 1.00 0.00 H new ATOM 0 HA LEU A 149 9.433 -6.730 -7.301 1.00 0.00 H new ATOM 0 HB2 LEU A 149 10.849 -5.813 -9.756 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.181 -7.461 -9.262 1.00 0.00 H new ATOM 0 HG LEU A 149 9.357 -7.361 -10.893 1.00 0.00 H new ATOM 0 HD11 LEU A 149 7.684 -8.677 -9.651 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.345 -9.168 -9.243 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.415 -8.151 -8.116 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.193 -6.341 -10.288 1.00 0.00 H new ATOM 0 HD22 LEU A 149 7.911 -5.727 -8.780 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.497 -5.131 -10.351 1.00 0.00 H new ATOM 2323 N THR A 150 12.603 -5.939 -6.969 1.00 0.00 N ATOM 2324 CA THR A 150 13.826 -6.295 -6.253 1.00 0.00 C ATOM 2325 C THR A 150 13.650 -6.156 -4.742 1.00 0.00 C ATOM 2326 O THR A 150 14.231 -6.916 -3.967 1.00 0.00 O ATOM 2327 CB THR A 150 14.987 -5.417 -6.723 1.00 0.00 C ATOM 2328 OG1 THR A 150 15.137 -5.495 -8.129 1.00 0.00 O ATOM 2329 CG2 THR A 150 16.313 -5.794 -6.099 1.00 0.00 C ATOM 0 H THR A 150 12.656 -5.063 -7.488 1.00 0.00 H new ATOM 0 HA THR A 150 14.048 -7.339 -6.474 1.00 0.00 H new ATOM 0 HB THR A 150 14.730 -4.406 -6.408 1.00 0.00 H new ATOM 0 HG1 THR A 150 14.617 -4.781 -8.554 1.00 0.00 H new ATOM 0 HG21 THR A 150 17.093 -5.132 -6.475 1.00 0.00 H new ATOM 0 HG22 THR A 150 16.246 -5.697 -5.015 1.00 0.00 H new ATOM 0 HG23 THR A 150 16.556 -6.825 -6.356 1.00 0.00 H new ATOM 2337 N TYR A 151 12.851 -5.179 -4.329 1.00 0.00 N ATOM 2338 CA TYR A 151 12.610 -4.940 -2.911 1.00 0.00 C ATOM 2339 C TYR A 151 11.761 -6.053 -2.304 1.00 0.00 C ATOM 2340 O TYR A 151 12.131 -6.634 -1.280 1.00 0.00 O ATOM 2341 CB TYR A 151 11.946 -3.569 -2.725 1.00 0.00 C ATOM 2342 CG TYR A 151 11.015 -3.456 -1.544 1.00 0.00 C ATOM 2343 CD1 TYR A 151 11.379 -3.918 -0.287 1.00 0.00 C ATOM 2344 CD2 TYR A 151 9.768 -2.873 -1.697 1.00 0.00 C ATOM 2345 CE1 TYR A 151 10.519 -3.803 0.786 1.00 0.00 C ATOM 2346 CE2 TYR A 151 8.904 -2.752 -0.635 1.00 0.00 C ATOM 2347 CZ TYR A 151 9.282 -3.219 0.608 1.00 0.00 C ATOM 2348 OH TYR A 151 8.426 -3.102 1.677 1.00 0.00 O ATOM 0 H TYR A 151 12.360 -4.541 -4.955 1.00 0.00 H new ATOM 0 HA TYR A 151 13.565 -4.940 -2.385 1.00 0.00 H new ATOM 0 HB2 TYR A 151 12.728 -2.816 -2.623 1.00 0.00 H new ATOM 0 HB3 TYR A 151 11.388 -3.329 -3.630 1.00 0.00 H new ATOM 0 HD1 TYR A 151 12.348 -4.374 -0.147 1.00 0.00 H new ATOM 0 HD2 TYR A 151 9.469 -2.507 -2.668 1.00 0.00 H new ATOM 0 HE1 TYR A 151 10.813 -4.168 1.759 1.00 0.00 H new ATOM 0 HE2 TYR A 151 7.935 -2.294 -0.772 1.00 0.00 H new ATOM 0 HH TYR A 151 8.314 -3.977 2.103 1.00 0.00 H new ATOM 2358 N LEU A 152 10.634 -6.374 -2.935 1.00 0.00 N ATOM 2359 CA LEU A 152 9.790 -7.440 -2.415 1.00 0.00 C ATOM 2360 C LEU A 152 10.536 -8.764 -2.487 1.00 0.00 C ATOM 2361 O LEU A 152 10.365 -9.635 -1.630 1.00 0.00 O ATOM 2362 CB LEU A 152 8.455 -7.522 -3.152 1.00 0.00 C ATOM 2363 CG LEU A 152 7.245 -7.652 -2.224 1.00 0.00 C ATOM 2364 CD1 LEU A 152 5.956 -7.758 -3.017 1.00 0.00 C ATOM 2365 CD2 LEU A 152 7.409 -8.853 -1.305 1.00 0.00 C ATOM 0 H LEU A 152 10.293 -5.924 -3.784 1.00 0.00 H new ATOM 0 HA LEU A 152 9.560 -7.215 -1.374 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.335 -6.631 -3.768 1.00 0.00 H new ATOM 0 HB3 LEU A 152 8.476 -8.376 -3.829 1.00 0.00 H new ATOM 0 HG LEU A 152 7.188 -6.751 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.114 -7.849 -2.331 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.831 -6.865 -3.629 1.00 0.00 H new ATOM 0 HD13 LEU A 152 5.996 -8.636 -3.661 1.00 0.00 H new ATOM 0 HD21 LEU A 152 6.541 -8.932 -0.651 1.00 0.00 H new ATOM 0 HD22 LEU A 152 7.496 -9.760 -1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 152 8.308 -8.729 -0.701 1.00 0.00 H new ATOM 2377 N GLU A 153 11.401 -8.894 -3.491 1.00 0.00 N ATOM 2378 CA GLU A 153 12.207 -10.095 -3.635 1.00 0.00 C ATOM 2379 C GLU A 153 13.095 -10.227 -2.405 1.00 0.00 C ATOM 2380 O GLU A 153 13.290 -11.320 -1.872 1.00 0.00 O ATOM 2381 CB GLU A 153 13.060 -10.024 -4.903 1.00 0.00 C ATOM 2382 CG GLU A 153 13.871 -11.284 -5.163 1.00 0.00 C ATOM 2383 CD GLU A 153 14.728 -11.179 -6.408 1.00 0.00 C ATOM 2384 OE1 GLU A 153 14.260 -10.588 -7.404 1.00 0.00 O ATOM 2385 OE2 GLU A 153 15.869 -11.689 -6.389 1.00 0.00 O ATOM 0 H GLU A 153 11.558 -8.187 -4.209 1.00 0.00 H new ATOM 0 HA GLU A 153 11.557 -10.966 -3.721 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.410 -9.837 -5.758 1.00 0.00 H new ATOM 0 HB3 GLU A 153 13.739 -9.174 -4.827 1.00 0.00 H new ATOM 0 HG2 GLU A 153 14.510 -11.485 -4.303 1.00 0.00 H new ATOM 0 HG3 GLU A 153 13.195 -12.133 -5.263 1.00 0.00 H new ATOM 2392 N LYS A 154 13.595 -9.083 -1.940 1.00 0.00 N ATOM 2393 CA LYS A 154 14.427 -9.032 -0.744 1.00 0.00 C ATOM 2394 C LYS A 154 13.580 -9.406 0.471 1.00 0.00 C ATOM 2395 O LYS A 154 14.091 -9.910 1.471 1.00 0.00 O ATOM 2396 CB LYS A 154 15.029 -7.629 -0.576 1.00 0.00 C ATOM 2397 CG LYS A 154 15.355 -7.251 0.864 1.00 0.00 C ATOM 2398 CD LYS A 154 14.140 -6.680 1.583 1.00 0.00 C ATOM 2399 CE LYS A 154 14.436 -5.317 2.193 1.00 0.00 C ATOM 2400 NZ LYS A 154 13.339 -4.859 3.092 1.00 0.00 N ATOM 0 H LYS A 154 13.436 -8.176 -2.378 1.00 0.00 H new ATOM 0 HA LYS A 154 15.249 -9.742 -0.839 1.00 0.00 H new ATOM 0 HB2 LYS A 154 15.940 -7.565 -1.171 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.331 -6.897 -0.982 1.00 0.00 H new ATOM 0 HG2 LYS A 154 15.715 -8.130 1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 154 16.162 -6.519 0.875 1.00 0.00 H new ATOM 0 HD2 LYS A 154 13.310 -6.592 0.882 1.00 0.00 H new ATOM 0 HD3 LYS A 154 13.824 -7.369 2.367 1.00 0.00 H new ATOM 0 HE2 LYS A 154 15.369 -5.366 2.755 1.00 0.00 H new ATOM 0 HE3 LYS A 154 14.581 -4.587 1.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.477 -3.855 3.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 12.424 -4.981 2.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 13.349 -5.422 3.967 1.00 0.00 H new ATOM 2414 N TYR A 155 12.275 -9.162 0.359 1.00 0.00 N ATOM 2415 CA TYR A 155 11.337 -9.478 1.427 1.00 0.00 C ATOM 2416 C TYR A 155 11.261 -10.987 1.622 1.00 0.00 C ATOM 2417 O TYR A 155 11.229 -11.480 2.750 1.00 0.00 O ATOM 2418 CB TYR A 155 9.949 -8.935 1.073 1.00 0.00 C ATOM 2419 CG TYR A 155 9.331 -8.054 2.135 1.00 0.00 C ATOM 2420 CD1 TYR A 155 9.611 -8.242 3.483 1.00 0.00 C ATOM 2421 CD2 TYR A 155 8.456 -7.036 1.783 1.00 0.00 C ATOM 2422 CE1 TYR A 155 9.035 -7.438 4.449 1.00 0.00 C ATOM 2423 CE2 TYR A 155 7.878 -6.227 2.739 1.00 0.00 C ATOM 2424 CZ TYR A 155 8.169 -6.432 4.071 1.00 0.00 C ATOM 2425 OH TYR A 155 7.593 -5.631 5.030 1.00 0.00 O ATOM 0 H TYR A 155 11.845 -8.744 -0.466 1.00 0.00 H new ATOM 0 HA TYR A 155 11.682 -9.015 2.352 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.020 -8.368 0.145 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.282 -9.775 0.883 1.00 0.00 H new ATOM 0 HD1 TYR A 155 10.289 -9.028 3.781 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.223 -6.874 0.741 1.00 0.00 H new ATOM 0 HE1 TYR A 155 9.261 -7.596 5.493 1.00 0.00 H new ATOM 0 HE2 TYR A 155 7.202 -5.438 2.446 1.00 0.00 H new ATOM 0 HH TYR A 155 8.071 -5.742 5.879 1.00 0.00 H new ATOM 2435 N ARG A 156 11.241 -11.713 0.510 1.00 0.00 N ATOM 2436 CA ARG A 156 11.180 -13.169 0.546 1.00 0.00 C ATOM 2437 C ARG A 156 12.531 -13.767 0.158 1.00 0.00 C ATOM 2438 O ARG A 156 12.768 -14.088 -1.007 1.00 0.00 O ATOM 2439 CB ARG A 156 10.086 -13.680 -0.396 1.00 0.00 C ATOM 2440 CG ARG A 156 9.114 -14.642 0.268 1.00 0.00 C ATOM 2441 CD ARG A 156 9.483 -16.091 -0.006 1.00 0.00 C ATOM 2442 NE ARG A 156 8.469 -16.773 -0.807 1.00 0.00 N ATOM 2443 CZ ARG A 156 8.354 -18.096 -0.887 1.00 0.00 C ATOM 2444 NH1 ARG A 156 9.188 -18.885 -0.220 1.00 0.00 N ATOM 2445 NH2 ARG A 156 7.402 -18.635 -1.638 1.00 0.00 N ATOM 0 H ARG A 156 11.266 -11.316 -0.429 1.00 0.00 H new ATOM 0 HA ARG A 156 10.939 -13.480 1.562 1.00 0.00 H new ATOM 0 HB2 ARG A 156 9.530 -12.829 -0.790 1.00 0.00 H new ATOM 0 HB3 ARG A 156 10.553 -14.177 -1.246 1.00 0.00 H new ATOM 0 HG2 ARG A 156 9.105 -14.466 1.344 1.00 0.00 H new ATOM 0 HG3 ARG A 156 8.105 -14.448 -0.095 1.00 0.00 H new ATOM 0 HD2 ARG A 156 10.441 -16.129 -0.525 1.00 0.00 H new ATOM 0 HD3 ARG A 156 9.612 -16.617 0.940 1.00 0.00 H new ATOM 0 HE ARG A 156 7.811 -16.201 -1.336 1.00 0.00 H new ATOM 0 HH11 ARG A 156 9.923 -18.478 0.358 1.00 0.00 H new ATOM 0 HH12 ARG A 156 9.094 -19.899 -0.286 1.00 0.00 H new ATOM 0 HH21 ARG A 156 6.758 -18.035 -2.154 1.00 0.00 H new ATOM 0 HH22 ARG A 156 7.314 -19.649 -1.699 1.00 0.00 H new