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 27 ASN :FLIP amide:sc= -0.0476 F(o=-4.1,f=-3.1) USER MOD Set 1.2: A 106 HIS :FLIP no HD1:sc= -3.04 F(o=-4.1!,f=-3.1) USER MOD Set 2.1: A 46 THR OG1 : rot 57:sc= -4.09! USER MOD Set 2.2: A 101 SER OG : rot -112:sc= 1.15 USER MOD Set 3.1: A 29 THR OG1 : rot 180:sc= 0.037 USER MOD Set 3.2: A 32 THR OG1 : rot 43:sc= 1.17 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -106:sc= -0.573 (180deg=-2.2!) USER MOD Single : A 19 HIS : no HD1:sc= -0.025 X(o=-0.025,f=-0.16) USER MOD Single : A 20 MET CE :methyl 176:sc= -6.73! (180deg=-7.39!) USER MOD Single : A 25 THR OG1 : rot -120:sc= -0.995 USER MOD Single : A 26 HIS :FLIP no HD1:sc= -6.35! C(o=-7!,f=-6.4!) USER MOD Single : A 30 ASN : amide:sc= -0.0211 X(o=-0.021,f=-0.42) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0342 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot -105:sc= -0.306 USER MOD Single : A 47 THR OG1 : rot -130:sc= -0.345 USER MOD Single : A 52 CYS SG : rot 180:sc= 0.02 USER MOD Single : A 55 THR OG1 : rot 104:sc= 1.99 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -130:sc= -1.58! USER MOD Single : A 63 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.203) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 148:sc= -1.24 (180deg=-3.11!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= -0.0046 (180deg=-0.105) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot -80:sc= -2.14! USER MOD Single : A 107 CYS SG : rot 180:sc= -1.61 USER MOD Single : A 125 SER OG : rot 79:sc= -0.809! USER MOD Single : A 127 MET CE :methyl -109:sc= -6.13! (180deg=-11.7!) USER MOD Single : A 128 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00654) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -1.07 K(o=-1.1,f=-3.9!) USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= -0.0559 X(o=-0.056,f=-0.41) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ -176:sc= -0.38 (180deg=-0.389) USER MOD Single : A 148 GLN :FLIP amide:sc= -4.47! C(o=-7!,f=-4.5!) USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 TYR OH : rot -53:sc= -6.37! USER MOD Single : A 154 LYS NZ :NH3+ -124:sc= 0.77 (180deg=-0.51) USER MOD Single : A 155 TYR OH : rot 30:sc= -0.676 USER MOD ----------------------------------------------------------------- ATOM 158 N ALA A 11 -13.125 5.131 -10.687 1.00 0.00 N ATOM 159 CA ALA A 11 -13.783 4.110 -9.883 1.00 0.00 C ATOM 160 C ALA A 11 -12.820 3.512 -8.860 1.00 0.00 C ATOM 161 O ALA A 11 -11.652 3.269 -9.165 1.00 0.00 O ATOM 162 CB ALA A 11 -14.350 3.019 -10.778 1.00 0.00 C ATOM 0 HA ALA A 11 -14.602 4.581 -9.340 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.839 2.262 -10.164 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -15.076 3.453 -11.466 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.542 2.558 -11.347 1.00 0.00 H new ATOM 168 N PRO A 12 -13.297 3.262 -7.627 1.00 0.00 N ATOM 169 CA PRO A 12 -12.469 2.687 -6.563 1.00 0.00 C ATOM 170 C PRO A 12 -12.179 1.208 -6.789 1.00 0.00 C ATOM 171 O PRO A 12 -12.829 0.556 -7.606 1.00 0.00 O ATOM 172 CB PRO A 12 -13.324 2.879 -5.309 1.00 0.00 C ATOM 173 CG PRO A 12 -14.726 2.887 -5.809 1.00 0.00 C ATOM 174 CD PRO A 12 -14.678 3.519 -7.175 1.00 0.00 C ATOM 0 HA PRO A 12 -11.490 3.162 -6.506 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.163 2.074 -4.592 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -13.079 3.812 -4.801 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -15.127 1.875 -5.862 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.375 3.452 -5.140 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -15.410 3.074 -7.849 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.893 4.587 -7.131 1.00 0.00 H new ATOM 182 N VAL A 13 -11.202 0.682 -6.058 1.00 0.00 N ATOM 183 CA VAL A 13 -10.831 -0.722 -6.175 1.00 0.00 C ATOM 184 C VAL A 13 -10.506 -1.304 -4.807 1.00 0.00 C ATOM 185 O VAL A 13 -9.691 -0.755 -4.068 1.00 0.00 O ATOM 186 CB VAL A 13 -9.617 -0.909 -7.104 1.00 0.00 C ATOM 187 CG1 VAL A 13 -9.372 -2.385 -7.373 1.00 0.00 C ATOM 188 CG2 VAL A 13 -9.820 -0.149 -8.406 1.00 0.00 C ATOM 0 H VAL A 13 -10.653 1.208 -5.378 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.684 -1.247 -6.604 1.00 0.00 H new ATOM 0 HB VAL A 13 -8.736 -0.504 -6.606 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.510 -2.497 -8.031 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.179 -2.899 -6.432 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.251 -2.819 -7.849 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.952 -0.292 -9.050 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.712 -0.522 -8.910 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.942 0.913 -8.192 1.00 0.00 H new ATOM 198 N GLU A 14 -11.153 -2.410 -4.466 1.00 0.00 N ATOM 199 CA GLU A 14 -10.933 -3.044 -3.176 1.00 0.00 C ATOM 200 C GLU A 14 -10.342 -4.444 -3.323 1.00 0.00 C ATOM 201 O GLU A 14 -10.792 -5.239 -4.148 1.00 0.00 O ATOM 202 CB GLU A 14 -12.246 -3.116 -2.396 1.00 0.00 C ATOM 203 CG GLU A 14 -13.300 -3.994 -3.052 1.00 0.00 C ATOM 204 CD GLU A 14 -13.832 -5.067 -2.122 1.00 0.00 C ATOM 205 OE1 GLU A 14 -13.047 -5.579 -1.297 1.00 0.00 O ATOM 206 OE2 GLU A 14 -15.033 -5.394 -2.219 1.00 0.00 O ATOM 0 H GLU A 14 -11.831 -2.884 -5.062 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.214 -2.434 -2.629 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.043 -3.495 -1.394 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.646 -2.108 -2.281 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -14.127 -3.370 -3.390 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.874 -4.466 -3.937 1.00 0.00 H new ATOM 213 N VAL A 15 -9.346 -4.739 -2.495 1.00 0.00 N ATOM 214 CA VAL A 15 -8.699 -6.047 -2.496 1.00 0.00 C ATOM 215 C VAL A 15 -9.137 -6.818 -1.254 1.00 0.00 C ATOM 216 O VAL A 15 -9.222 -6.248 -0.167 1.00 0.00 O ATOM 217 CB VAL A 15 -7.152 -5.938 -2.520 1.00 0.00 C ATOM 218 CG1 VAL A 15 -6.563 -6.866 -3.574 1.00 0.00 C ATOM 219 CG2 VAL A 15 -6.704 -4.503 -2.769 1.00 0.00 C ATOM 0 H VAL A 15 -8.967 -4.085 -1.810 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.002 -6.571 -3.403 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.783 -6.243 -1.541 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.477 -6.774 -3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.840 -7.896 -3.348 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.950 -6.594 -4.556 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.615 -4.459 -2.780 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.091 -4.162 -3.729 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -7.085 -3.860 -1.976 1.00 0.00 H new ATOM 229 N SER A 16 -9.443 -8.103 -1.412 1.00 0.00 N ATOM 230 CA SER A 16 -9.901 -8.902 -0.280 1.00 0.00 C ATOM 231 C SER A 16 -9.184 -10.242 -0.202 1.00 0.00 C ATOM 232 O SER A 16 -9.120 -10.989 -1.177 1.00 0.00 O ATOM 233 CB SER A 16 -11.412 -9.126 -0.369 1.00 0.00 C ATOM 234 OG SER A 16 -11.885 -8.902 -1.685 1.00 0.00 O ATOM 0 H SER A 16 -9.384 -8.606 -2.297 1.00 0.00 H new ATOM 0 HA SER A 16 -9.666 -8.346 0.628 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.650 -10.144 -0.062 1.00 0.00 H new ATOM 0 HB3 SER A 16 -11.923 -8.457 0.323 1.00 0.00 H new ATOM 0 HG SER A 16 -12.853 -9.053 -1.715 1.00 0.00 H new ATOM 240 N TYR A 17 -8.661 -10.542 0.981 1.00 0.00 N ATOM 241 CA TYR A 17 -7.958 -11.793 1.217 1.00 0.00 C ATOM 242 C TYR A 17 -8.207 -12.279 2.644 1.00 0.00 C ATOM 243 O TYR A 17 -8.102 -11.508 3.599 1.00 0.00 O ATOM 244 CB TYR A 17 -6.457 -11.615 0.966 1.00 0.00 C ATOM 245 CG TYR A 17 -5.598 -12.687 1.598 1.00 0.00 C ATOM 246 CD1 TYR A 17 -5.493 -13.951 1.032 1.00 0.00 C ATOM 247 CD2 TYR A 17 -4.896 -12.432 2.766 1.00 0.00 C ATOM 248 CE1 TYR A 17 -4.711 -14.930 1.615 1.00 0.00 C ATOM 249 CE2 TYR A 17 -4.111 -13.401 3.354 1.00 0.00 C ATOM 250 CZ TYR A 17 -4.020 -14.650 2.775 1.00 0.00 C ATOM 251 OH TYR A 17 -3.239 -15.620 3.358 1.00 0.00 O ATOM 0 H TYR A 17 -8.712 -9.930 1.795 1.00 0.00 H new ATOM 0 HA TYR A 17 -8.338 -12.544 0.524 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -6.277 -11.606 -0.109 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -6.147 -10.643 1.349 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -6.031 -14.172 0.122 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -4.965 -11.456 3.224 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -4.641 -15.909 1.165 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -3.570 -13.183 4.263 1.00 0.00 H new ATOM 0 HH TYR A 17 -2.820 -15.260 4.167 1.00 0.00 H new ATOM 261 N LYS A 18 -8.539 -13.559 2.781 1.00 0.00 N ATOM 262 CA LYS A 18 -8.805 -14.150 4.087 1.00 0.00 C ATOM 263 C LYS A 18 -10.037 -13.513 4.744 1.00 0.00 C ATOM 264 O LYS A 18 -11.168 -13.823 4.371 1.00 0.00 O ATOM 265 CB LYS A 18 -7.575 -14.022 4.993 1.00 0.00 C ATOM 266 CG LYS A 18 -6.444 -14.967 4.619 1.00 0.00 C ATOM 267 CD LYS A 18 -6.692 -16.371 5.151 1.00 0.00 C ATOM 268 CE LYS A 18 -7.250 -17.286 4.072 1.00 0.00 C ATOM 269 NZ LYS A 18 -8.676 -17.633 4.320 1.00 0.00 N ATOM 0 H LYS A 18 -8.630 -14.209 2.000 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.018 -15.209 3.942 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -7.209 -12.996 4.952 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -7.872 -14.214 6.024 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.340 -15.001 3.534 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.504 -14.586 5.018 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.760 -16.786 5.535 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.389 -16.326 5.988 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.159 -16.800 3.101 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.657 -18.199 4.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -8.741 -18.616 4.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.067 -16.997 5.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.217 -17.529 3.438 1.00 0.00 H new ATOM 283 N HIS A 19 -9.823 -12.630 5.723 1.00 0.00 N ATOM 284 CA HIS A 19 -10.933 -11.978 6.413 1.00 0.00 C ATOM 285 C HIS A 19 -10.761 -10.459 6.459 1.00 0.00 C ATOM 286 O HIS A 19 -11.453 -9.775 7.213 1.00 0.00 O ATOM 287 CB HIS A 19 -11.066 -12.527 7.834 1.00 0.00 C ATOM 288 CG HIS A 19 -12.484 -12.713 8.274 1.00 0.00 C ATOM 289 ND1 HIS A 19 -13.530 -11.958 7.786 1.00 0.00 N ATOM 290 CD2 HIS A 19 -13.032 -13.576 9.162 1.00 0.00 C ATOM 291 CE1 HIS A 19 -14.658 -12.345 8.354 1.00 0.00 C ATOM 292 NE2 HIS A 19 -14.383 -13.326 9.193 1.00 0.00 N ATOM 0 H HIS A 19 -8.898 -12.353 6.052 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.841 -12.195 5.850 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -10.547 -13.484 7.895 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -10.566 -11.848 8.525 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -12.505 -14.322 9.739 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -15.637 -11.930 8.164 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -15.063 -13.819 9.771 1.00 0.00 H new ATOM 300 N MET A 20 -9.841 -9.933 5.656 1.00 0.00 N ATOM 301 CA MET A 20 -9.593 -8.492 5.622 1.00 0.00 C ATOM 302 C MET A 20 -9.861 -7.925 4.232 1.00 0.00 C ATOM 303 O MET A 20 -10.045 -8.673 3.271 1.00 0.00 O ATOM 304 CB MET A 20 -8.157 -8.174 6.053 1.00 0.00 C ATOM 305 CG MET A 20 -7.191 -9.339 5.905 1.00 0.00 C ATOM 306 SD MET A 20 -5.477 -8.802 5.774 1.00 0.00 S ATOM 307 CE MET A 20 -5.387 -8.407 4.031 1.00 0.00 C ATOM 0 H MET A 20 -9.257 -10.478 5.022 1.00 0.00 H new ATOM 0 HA MET A 20 -10.279 -8.021 6.326 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.790 -7.334 5.463 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.165 -7.853 7.094 1.00 0.00 H new ATOM 0 HG2 MET A 20 -7.295 -10.004 6.762 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.456 -9.916 5.019 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.406 -7.991 3.802 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.543 -9.312 3.444 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.157 -7.677 3.783 1.00 0.00 H new ATOM 317 N ARG A 21 -9.890 -6.598 4.132 1.00 0.00 N ATOM 318 CA ARG A 21 -10.145 -5.938 2.857 1.00 0.00 C ATOM 319 C ARG A 21 -9.293 -4.683 2.690 1.00 0.00 C ATOM 320 O ARG A 21 -8.732 -4.161 3.655 1.00 0.00 O ATOM 321 CB ARG A 21 -11.627 -5.577 2.737 1.00 0.00 C ATOM 322 CG ARG A 21 -12.522 -6.766 2.429 1.00 0.00 C ATOM 323 CD ARG A 21 -13.925 -6.565 2.976 1.00 0.00 C ATOM 324 NE ARG A 21 -14.026 -6.952 4.381 1.00 0.00 N ATOM 325 CZ ARG A 21 -14.135 -8.212 4.797 1.00 0.00 C ATOM 326 NH1 ARG A 21 -14.157 -9.208 3.921 1.00 0.00 N ATOM 327 NH2 ARG A 21 -14.223 -8.477 6.094 1.00 0.00 N ATOM 0 H ARG A 21 -9.741 -5.962 4.916 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.874 -6.636 2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.956 -5.117 3.669 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.748 -4.830 1.953 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.569 -6.917 1.351 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -12.089 -7.669 2.859 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -14.210 -5.519 2.867 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -14.631 -7.151 2.387 1.00 0.00 H new ATOM 0 HE ARG A 21 -14.012 -6.214 5.085 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -14.090 -9.011 2.923 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -14.241 -10.171 4.246 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -14.207 -7.715 6.772 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -14.307 -9.442 6.413 1.00 0.00 H new ATOM 341 N PHE A 22 -9.209 -4.207 1.453 1.00 0.00 N ATOM 342 CA PHE A 22 -8.439 -3.010 1.121 1.00 0.00 C ATOM 343 C PHE A 22 -9.255 -2.107 0.203 1.00 0.00 C ATOM 344 O PHE A 22 -10.077 -2.588 -0.573 1.00 0.00 O ATOM 345 CB PHE A 22 -7.130 -3.404 0.428 1.00 0.00 C ATOM 346 CG PHE A 22 -5.947 -3.489 1.352 1.00 0.00 C ATOM 347 CD1 PHE A 22 -5.406 -2.343 1.910 1.00 0.00 C ATOM 348 CD2 PHE A 22 -5.371 -4.715 1.655 1.00 0.00 C ATOM 349 CE1 PHE A 22 -4.315 -2.416 2.755 1.00 0.00 C ATOM 350 CE2 PHE A 22 -4.279 -4.792 2.497 1.00 0.00 C ATOM 351 CZ PHE A 22 -3.751 -3.642 3.049 1.00 0.00 C ATOM 0 H PHE A 22 -9.671 -4.638 0.652 1.00 0.00 H new ATOM 0 HA PHE A 22 -8.208 -2.472 2.040 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.266 -4.369 -0.060 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.914 -2.678 -0.356 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.842 -1.381 1.682 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.781 -5.618 1.228 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.904 -1.515 3.185 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.838 -5.752 2.724 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.899 -3.701 3.709 1.00 0.00 H new ATOM 361 N LEU A 23 -9.024 -0.801 0.289 1.00 0.00 N ATOM 362 CA LEU A 23 -9.747 0.151 -0.551 1.00 0.00 C ATOM 363 C LEU A 23 -8.788 1.048 -1.312 1.00 0.00 C ATOM 364 O LEU A 23 -7.828 1.569 -0.750 1.00 0.00 O ATOM 365 CB LEU A 23 -10.686 1.025 0.282 1.00 0.00 C ATOM 366 CG LEU A 23 -12.028 0.393 0.630 1.00 0.00 C ATOM 367 CD1 LEU A 23 -12.718 -0.140 -0.621 1.00 0.00 C ATOM 368 CD2 LEU A 23 -11.832 -0.710 1.656 1.00 0.00 C ATOM 0 H LEU A 23 -8.348 -0.379 0.926 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.334 -0.434 -1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.179 1.294 1.209 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.870 1.952 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.673 1.158 1.062 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.674 -0.586 -0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.887 0.679 -1.320 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.087 -0.894 -1.091 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.796 -1.156 1.899 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.171 -1.474 1.247 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.388 -0.292 2.559 1.00 0.00 H new ATOM 380 N ILE A 24 -9.072 1.239 -2.589 1.00 0.00 N ATOM 381 CA ILE A 24 -8.256 2.097 -3.429 1.00 0.00 C ATOM 382 C ILE A 24 -9.110 3.256 -3.942 1.00 0.00 C ATOM 383 O ILE A 24 -9.967 3.070 -4.806 1.00 0.00 O ATOM 384 CB ILE A 24 -7.663 1.310 -4.620 1.00 0.00 C ATOM 385 CG1 ILE A 24 -6.586 0.331 -4.130 1.00 0.00 C ATOM 386 CG2 ILE A 24 -7.096 2.253 -5.671 1.00 0.00 C ATOM 387 CD1 ILE A 24 -5.260 0.988 -3.793 1.00 0.00 C ATOM 0 H ILE A 24 -9.864 0.810 -3.067 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.427 2.482 -2.835 1.00 0.00 H new ATOM 0 HB ILE A 24 -8.466 0.738 -5.084 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -6.957 -0.188 -3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -6.420 -0.425 -4.898 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.686 1.672 -6.497 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.889 2.903 -6.042 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.307 2.860 -5.227 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.554 0.230 -3.455 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.864 1.484 -4.679 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.409 1.723 -3.002 1.00 0.00 H new ATOM 399 N THR A 25 -8.889 4.446 -3.393 1.00 0.00 N ATOM 400 CA THR A 25 -9.660 5.620 -3.789 1.00 0.00 C ATOM 401 C THR A 25 -8.759 6.810 -4.097 1.00 0.00 C ATOM 402 O THR A 25 -7.588 6.834 -3.727 1.00 0.00 O ATOM 403 CB THR A 25 -10.652 5.994 -2.687 1.00 0.00 C ATOM 404 OG1 THR A 25 -10.101 5.737 -1.408 1.00 0.00 O ATOM 405 CG2 THR A 25 -11.964 5.246 -2.782 1.00 0.00 C ATOM 0 H THR A 25 -8.186 4.623 -2.676 1.00 0.00 H new ATOM 0 HA THR A 25 -10.203 5.365 -4.699 1.00 0.00 H new ATOM 0 HB THR A 25 -10.849 7.057 -2.825 1.00 0.00 H new ATOM 0 HG1 THR A 25 -10.664 5.090 -0.933 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.621 5.559 -1.970 1.00 0.00 H new ATOM 0 HG22 THR A 25 -12.439 5.465 -3.738 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.778 4.175 -2.706 1.00 0.00 H new ATOM 413 N HIS A 26 -9.331 7.797 -4.777 1.00 0.00 N ATOM 414 CA HIS A 26 -8.614 9.009 -5.157 1.00 0.00 C ATOM 415 C HIS A 26 -8.550 9.999 -4.000 1.00 0.00 C ATOM 416 O HIS A 26 -9.410 10.001 -3.123 1.00 0.00 O ATOM 417 CB HIS A 26 -9.260 9.664 -6.384 1.00 0.00 C ATOM 418 CG HIS A 26 -10.729 9.919 -6.244 1.00 0.00 C ATOM 419 ND1 HIS A 26 -11.792 9.090 -6.381 1.00 0.00 N flip ATOM 420 CD2 HIS A 26 -11.252 11.160 -5.946 1.00 0.00 C flip ATOM 421 CE1 HIS A 26 -12.923 9.840 -6.167 1.00 0.00 C flip ATOM 422 NE2 HIS A 26 -12.571 11.085 -5.905 1.00 0.00 N flip ATOM 0 H HIS A 26 -10.305 7.780 -5.080 1.00 0.00 H new ATOM 0 HA HIS A 26 -7.595 8.721 -5.414 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.756 10.610 -6.584 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -9.095 9.025 -7.252 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -10.673 12.055 -5.773 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -13.937 9.470 -6.207 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -13.208 11.857 -5.705 1.00 0.00 H new ATOM 430 N ASN A 27 -7.512 10.826 -3.996 1.00 0.00 N ATOM 431 CA ASN A 27 -7.326 11.808 -2.937 1.00 0.00 C ATOM 432 C ASN A 27 -8.490 12.792 -2.935 1.00 0.00 C ATOM 433 O ASN A 27 -9.167 12.964 -3.950 1.00 0.00 O ATOM 434 CB ASN A 27 -6.003 12.553 -3.122 1.00 0.00 C ATOM 435 CG ASN A 27 -4.922 12.055 -2.184 1.00 0.00 C ATOM 436 OD1 ASN A 27 -4.409 10.860 -2.453 1.00 0.00 O flip ATOM 437 ND2 ASN A 27 -4.551 12.736 -1.228 1.00 0.00 N flip ATOM 0 H ASN A 27 -6.787 10.836 -4.714 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.296 11.289 -1.979 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.666 12.439 -4.152 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -6.163 13.618 -2.955 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -4.973 13.649 -1.058 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -3.822 12.387 -0.606 1.00 0.00 H new ATOM 444 N PRO A 28 -8.774 13.415 -1.781 1.00 0.00 N ATOM 445 CA PRO A 28 -9.902 14.338 -1.647 1.00 0.00 C ATOM 446 C PRO A 28 -9.890 15.450 -2.682 1.00 0.00 C ATOM 447 O PRO A 28 -8.850 16.040 -2.972 1.00 0.00 O ATOM 448 CB PRO A 28 -9.730 14.915 -0.241 1.00 0.00 C ATOM 449 CG PRO A 28 -8.956 13.882 0.502 1.00 0.00 C ATOM 450 CD PRO A 28 -8.050 13.236 -0.508 1.00 0.00 C ATOM 0 HA PRO A 28 -10.852 13.828 -1.803 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -9.198 15.866 -0.266 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.695 15.102 0.231 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.380 14.333 1.311 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.621 13.147 0.955 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.070 13.713 -0.532 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -7.885 12.182 -0.284 1.00 0.00 H new ATOM 458 N THR A 29 -11.066 15.721 -3.239 1.00 0.00 N ATOM 459 CA THR A 29 -11.221 16.756 -4.249 1.00 0.00 C ATOM 460 C THR A 29 -11.745 18.036 -3.614 1.00 0.00 C ATOM 461 O THR A 29 -12.551 17.996 -2.685 1.00 0.00 O ATOM 462 CB THR A 29 -12.172 16.290 -5.351 1.00 0.00 C ATOM 463 OG1 THR A 29 -13.183 15.451 -4.820 1.00 0.00 O ATOM 464 CG2 THR A 29 -11.477 15.527 -6.459 1.00 0.00 C ATOM 0 H THR A 29 -11.930 15.233 -3.004 1.00 0.00 H new ATOM 0 HA THR A 29 -10.245 16.955 -4.692 1.00 0.00 H new ATOM 0 HB THR A 29 -12.596 17.202 -5.771 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.782 15.165 -5.541 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.209 15.226 -7.208 1.00 0.00 H new ATOM 0 HG22 THR A 29 -10.724 16.164 -6.923 1.00 0.00 H new ATOM 0 HG23 THR A 29 -10.996 14.641 -6.044 1.00 0.00 H new ATOM 472 N ASN A 30 -11.269 19.168 -4.109 1.00 0.00 N ATOM 473 CA ASN A 30 -11.673 20.462 -3.581 1.00 0.00 C ATOM 474 C ASN A 30 -13.157 20.744 -3.808 1.00 0.00 C ATOM 475 O ASN A 30 -13.699 21.688 -3.233 1.00 0.00 O ATOM 476 CB ASN A 30 -10.835 21.573 -4.215 1.00 0.00 C ATOM 477 CG ASN A 30 -10.582 22.724 -3.262 1.00 0.00 C ATOM 478 OD1 ASN A 30 -11.301 22.900 -2.278 1.00 0.00 O ATOM 479 ND2 ASN A 30 -9.556 23.517 -3.550 1.00 0.00 N ATOM 0 H ASN A 30 -10.601 19.217 -4.878 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.504 20.437 -2.505 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -9.881 21.161 -4.544 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -11.344 21.946 -5.103 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -9.338 24.309 -2.945 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -8.986 23.334 -4.376 1.00 0.00 H new ATOM 486 N ALA A 31 -13.818 19.950 -4.652 1.00 0.00 N ATOM 487 CA ALA A 31 -15.232 20.186 -4.922 1.00 0.00 C ATOM 488 C ALA A 31 -16.155 19.366 -4.018 1.00 0.00 C ATOM 489 O ALA A 31 -17.246 19.823 -3.679 1.00 0.00 O ATOM 490 CB ALA A 31 -15.537 19.890 -6.383 1.00 0.00 C ATOM 0 H ALA A 31 -13.408 19.158 -5.148 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.427 21.236 -4.705 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -16.595 20.068 -6.577 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.936 20.540 -7.019 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.299 18.849 -6.601 1.00 0.00 H new ATOM 496 N THR A 32 -15.725 18.173 -3.607 1.00 0.00 N ATOM 497 CA THR A 32 -16.555 17.357 -2.721 1.00 0.00 C ATOM 498 C THR A 32 -15.733 16.654 -1.642 1.00 0.00 C ATOM 499 O THR A 32 -15.311 15.512 -1.824 1.00 0.00 O ATOM 500 CB THR A 32 -17.328 16.319 -3.535 1.00 0.00 C ATOM 501 OG1 THR A 32 -16.440 15.405 -4.154 1.00 0.00 O ATOM 502 CG2 THR A 32 -18.188 16.929 -4.621 1.00 0.00 C ATOM 0 H THR A 32 -14.830 17.758 -3.865 1.00 0.00 H new ATOM 0 HA THR A 32 -17.250 18.031 -2.220 1.00 0.00 H new ATOM 0 HB THR A 32 -17.978 15.816 -2.819 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.742 15.145 -3.517 1.00 0.00 H new ATOM 0 HG21 THR A 32 -18.709 16.138 -5.160 1.00 0.00 H new ATOM 0 HG22 THR A 32 -18.917 17.603 -4.172 1.00 0.00 H new ATOM 0 HG23 THR A 32 -17.558 17.486 -5.314 1.00 0.00 H new ATOM 510 N LEU A 33 -15.537 17.317 -0.510 1.00 0.00 N ATOM 511 CA LEU A 33 -14.800 16.720 0.600 1.00 0.00 C ATOM 512 C LEU A 33 -15.691 15.780 1.416 1.00 0.00 C ATOM 513 O LEU A 33 -15.334 14.632 1.682 1.00 0.00 O ATOM 514 CB LEU A 33 -14.189 17.801 1.492 1.00 0.00 C ATOM 515 CG LEU A 33 -12.660 17.881 1.439 1.00 0.00 C ATOM 516 CD1 LEU A 33 -12.034 16.640 2.057 1.00 0.00 C ATOM 517 CD2 LEU A 33 -12.184 18.048 0.005 1.00 0.00 C ATOM 0 H LEU A 33 -15.875 18.263 -0.335 1.00 0.00 H new ATOM 0 HA LEU A 33 -13.988 16.127 0.179 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -14.601 18.768 1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -14.495 17.619 2.522 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.346 18.751 2.016 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -10.948 16.718 2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -12.346 16.555 3.098 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.359 15.756 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.096 18.103 -0.013 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -12.514 17.196 -0.590 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -12.601 18.965 -0.412 1.00 0.00 H new ATOM 529 N SER A 34 -16.845 16.304 1.833 1.00 0.00 N ATOM 530 CA SER A 34 -17.803 15.557 2.650 1.00 0.00 C ATOM 531 C SER A 34 -18.250 14.254 1.988 1.00 0.00 C ATOM 532 O SER A 34 -18.302 13.207 2.632 1.00 0.00 O ATOM 533 CB SER A 34 -19.025 16.427 2.945 1.00 0.00 C ATOM 534 OG SER A 34 -18.834 17.193 4.121 1.00 0.00 O ATOM 0 H SER A 34 -17.141 17.255 1.615 1.00 0.00 H new ATOM 0 HA SER A 34 -17.295 15.293 3.578 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.215 17.091 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 34 -19.906 15.795 3.058 1.00 0.00 H new ATOM 0 HG SER A 34 -19.629 17.742 4.287 1.00 0.00 H new ATOM 540 N THR A 35 -18.592 14.318 0.710 1.00 0.00 N ATOM 541 CA THR A 35 -19.050 13.133 -0.006 1.00 0.00 C ATOM 542 C THR A 35 -18.005 12.023 0.042 1.00 0.00 C ATOM 543 O THR A 35 -18.340 10.835 0.041 1.00 0.00 O ATOM 544 CB THR A 35 -19.371 13.483 -1.460 1.00 0.00 C ATOM 545 OG1 THR A 35 -19.981 14.759 -1.545 1.00 0.00 O ATOM 546 CG2 THR A 35 -20.296 12.488 -2.124 1.00 0.00 C ATOM 0 H THR A 35 -18.562 15.170 0.150 1.00 0.00 H new ATOM 0 HA THR A 35 -19.955 12.774 0.485 1.00 0.00 H new ATOM 0 HB THR A 35 -18.413 13.467 -1.980 1.00 0.00 H new ATOM 0 HG1 THR A 35 -20.177 14.966 -2.483 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.483 12.795 -3.153 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.833 11.501 -2.119 1.00 0.00 H new ATOM 0 HG23 THR A 35 -21.240 12.449 -1.580 1.00 0.00 H new ATOM 554 N PHE A 36 -16.737 12.414 0.075 1.00 0.00 N ATOM 555 CA PHE A 36 -15.647 11.448 0.105 1.00 0.00 C ATOM 556 C PHE A 36 -15.497 10.792 1.473 1.00 0.00 C ATOM 557 O PHE A 36 -15.381 9.572 1.567 1.00 0.00 O ATOM 558 CB PHE A 36 -14.333 12.121 -0.289 1.00 0.00 C ATOM 559 CG PHE A 36 -13.542 11.361 -1.316 1.00 0.00 C ATOM 560 CD1 PHE A 36 -13.764 10.009 -1.540 1.00 0.00 C ATOM 561 CD2 PHE A 36 -12.570 12.004 -2.052 1.00 0.00 C ATOM 562 CE1 PHE A 36 -13.026 9.318 -2.479 1.00 0.00 C ATOM 563 CE2 PHE A 36 -11.828 11.319 -2.993 1.00 0.00 C ATOM 564 CZ PHE A 36 -12.057 9.974 -3.206 1.00 0.00 C ATOM 0 H PHE A 36 -16.439 13.390 0.082 1.00 0.00 H new ATOM 0 HA PHE A 36 -15.891 10.666 -0.614 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -14.548 13.117 -0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.721 12.251 0.604 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -14.524 9.492 -0.972 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.387 13.056 -1.891 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.207 8.266 -2.644 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.069 11.835 -3.562 1.00 0.00 H new ATOM 0 HZ PHE A 36 -11.477 9.437 -3.942 1.00 0.00 H new ATOM 574 N ILE A 37 -15.497 11.592 2.533 1.00 0.00 N ATOM 575 CA ILE A 37 -15.355 11.050 3.876 1.00 0.00 C ATOM 576 C ILE A 37 -16.424 10.001 4.146 1.00 0.00 C ATOM 577 O ILE A 37 -16.165 8.976 4.776 1.00 0.00 O ATOM 578 CB ILE A 37 -15.448 12.145 4.953 1.00 0.00 C ATOM 579 CG1 ILE A 37 -16.622 13.085 4.680 1.00 0.00 C ATOM 580 CG2 ILE A 37 -14.143 12.925 5.040 1.00 0.00 C ATOM 581 CD1 ILE A 37 -16.921 14.028 5.825 1.00 0.00 C ATOM 0 H ILE A 37 -15.593 12.607 2.489 1.00 0.00 H new ATOM 0 HA ILE A 37 -14.365 10.596 3.928 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.623 11.659 5.913 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -16.408 13.669 3.785 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.511 12.491 4.468 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.229 13.694 5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.330 12.246 5.297 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -13.934 13.394 4.078 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -17.765 14.665 5.561 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -17.166 13.451 6.717 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -16.047 14.648 6.023 1.00 0.00 H new ATOM 593 N GLU A 38 -17.624 10.272 3.659 1.00 0.00 N ATOM 594 CA GLU A 38 -18.747 9.361 3.833 1.00 0.00 C ATOM 595 C GLU A 38 -18.515 8.039 3.101 1.00 0.00 C ATOM 596 O GLU A 38 -18.652 6.968 3.690 1.00 0.00 O ATOM 597 CB GLU A 38 -20.037 10.013 3.332 1.00 0.00 C ATOM 598 CG GLU A 38 -20.773 10.806 4.400 1.00 0.00 C ATOM 599 CD GLU A 38 -21.874 10.004 5.067 1.00 0.00 C ATOM 600 OE1 GLU A 38 -21.555 9.156 5.926 1.00 0.00 O ATOM 601 OE2 GLU A 38 -23.057 10.223 4.727 1.00 0.00 O ATOM 0 H GLU A 38 -17.847 11.120 3.137 1.00 0.00 H new ATOM 0 HA GLU A 38 -18.838 9.146 4.898 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.800 10.675 2.499 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -20.699 9.238 2.945 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -20.061 11.138 5.156 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -21.202 11.702 3.951 1.00 0.00 H new ATOM 608 N ASP A 39 -18.179 8.115 1.812 1.00 0.00 N ATOM 609 CA ASP A 39 -17.950 6.908 1.014 1.00 0.00 C ATOM 610 C ASP A 39 -16.694 6.157 1.461 1.00 0.00 C ATOM 611 O ASP A 39 -16.730 4.943 1.698 1.00 0.00 O ATOM 612 CB ASP A 39 -17.831 7.274 -0.467 1.00 0.00 C ATOM 613 CG ASP A 39 -19.177 7.303 -1.165 1.00 0.00 C ATOM 614 OD1 ASP A 39 -20.170 7.705 -0.524 1.00 0.00 O ATOM 615 OD2 ASP A 39 -19.238 6.923 -2.353 1.00 0.00 O ATOM 0 H ASP A 39 -18.060 8.990 1.302 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.805 6.249 1.165 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.355 8.250 -0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -17.182 6.554 -0.965 1.00 0.00 H new ATOM 620 N LEU A 40 -15.584 6.883 1.580 1.00 0.00 N ATOM 621 CA LEU A 40 -14.320 6.283 1.997 1.00 0.00 C ATOM 622 C LEU A 40 -14.481 5.572 3.333 1.00 0.00 C ATOM 623 O LEU A 40 -14.031 4.439 3.506 1.00 0.00 O ATOM 624 CB LEU A 40 -13.225 7.351 2.090 1.00 0.00 C ATOM 625 CG LEU A 40 -12.950 8.107 0.787 1.00 0.00 C ATOM 626 CD1 LEU A 40 -11.997 9.269 1.027 1.00 0.00 C ATOM 627 CD2 LEU A 40 -12.386 7.169 -0.267 1.00 0.00 C ATOM 0 H LEU A 40 -15.535 7.885 1.394 1.00 0.00 H new ATOM 0 HA LEU A 40 -14.025 5.548 1.248 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.505 8.071 2.859 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.301 6.876 2.419 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.896 8.509 0.423 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.816 9.791 0.088 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.438 9.959 1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.053 8.890 1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.197 7.725 -1.185 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.453 6.736 0.093 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.103 6.372 -0.466 1.00 0.00 H new ATOM 639 N LYS A 41 -15.148 6.237 4.269 1.00 0.00 N ATOM 640 CA LYS A 41 -15.394 5.661 5.582 1.00 0.00 C ATOM 641 C LYS A 41 -16.529 4.645 5.504 1.00 0.00 C ATOM 642 O LYS A 41 -16.599 3.712 6.304 1.00 0.00 O ATOM 643 CB LYS A 41 -15.741 6.758 6.590 1.00 0.00 C ATOM 644 CG LYS A 41 -15.427 6.384 8.029 1.00 0.00 C ATOM 645 CD LYS A 41 -15.653 7.557 8.971 1.00 0.00 C ATOM 646 CE LYS A 41 -14.928 7.357 10.292 1.00 0.00 C ATOM 647 NZ LYS A 41 -15.629 6.378 11.168 1.00 0.00 N ATOM 0 H LYS A 41 -15.527 7.175 4.141 1.00 0.00 H new ATOM 0 HA LYS A 41 -14.488 5.156 5.915 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -15.193 7.664 6.331 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.802 6.993 6.508 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -16.053 5.546 8.333 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -14.392 6.051 8.102 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -15.305 8.476 8.499 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -16.721 7.677 9.155 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -13.913 7.010 10.100 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.846 8.313 10.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.103 6.270 12.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -16.589 6.721 11.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -15.685 5.458 10.685 1.00 0.00 H new ATOM 661 N LYS A 42 -17.417 4.838 4.530 1.00 0.00 N ATOM 662 CA LYS A 42 -18.553 3.947 4.336 1.00 0.00 C ATOM 663 C LYS A 42 -18.103 2.494 4.231 1.00 0.00 C ATOM 664 O LYS A 42 -18.704 1.610 4.842 1.00 0.00 O ATOM 665 CB LYS A 42 -19.335 4.343 3.082 1.00 0.00 C ATOM 666 CG LYS A 42 -20.718 4.900 3.377 1.00 0.00 C ATOM 667 CD LYS A 42 -21.594 4.903 2.134 1.00 0.00 C ATOM 668 CE LYS A 42 -22.394 6.191 2.018 1.00 0.00 C ATOM 669 NZ LYS A 42 -23.746 5.956 1.440 1.00 0.00 N ATOM 0 H LYS A 42 -17.369 5.607 3.862 1.00 0.00 H new ATOM 0 HA LYS A 42 -19.203 4.042 5.206 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -18.763 5.087 2.528 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.434 3.471 2.435 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.193 4.304 4.157 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.628 5.916 3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -20.971 4.780 1.248 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -22.275 4.052 2.166 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -22.495 6.646 3.004 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -21.851 6.901 1.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -24.259 6.859 1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -23.651 5.546 0.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -24.274 5.299 2.049 1.00 0.00 H new ATOM 683 N TYR A 43 -17.049 2.241 3.455 1.00 0.00 N ATOM 684 CA TYR A 43 -16.558 0.879 3.299 1.00 0.00 C ATOM 685 C TYR A 43 -16.056 0.330 4.630 1.00 0.00 C ATOM 686 O TYR A 43 -16.262 -0.842 4.945 1.00 0.00 O ATOM 687 CB TYR A 43 -15.443 0.820 2.260 1.00 0.00 C ATOM 688 CG TYR A 43 -15.102 -0.587 1.832 1.00 0.00 C ATOM 689 CD1 TYR A 43 -14.439 -1.444 2.695 1.00 0.00 C ATOM 690 CD2 TYR A 43 -15.442 -1.060 0.570 1.00 0.00 C ATOM 691 CE1 TYR A 43 -14.118 -2.733 2.319 1.00 0.00 C ATOM 692 CE2 TYR A 43 -15.128 -2.349 0.185 1.00 0.00 C ATOM 693 CZ TYR A 43 -14.465 -3.182 1.062 1.00 0.00 C ATOM 694 OH TYR A 43 -14.149 -4.466 0.682 1.00 0.00 O ATOM 0 H TYR A 43 -16.530 2.948 2.935 1.00 0.00 H new ATOM 0 HA TYR A 43 -17.389 0.263 2.956 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.740 1.397 1.384 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.551 1.295 2.667 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -14.168 -1.097 3.681 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.959 -0.410 -0.120 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.598 -3.386 3.005 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.400 -2.703 -0.798 1.00 0.00 H new ATOM 0 HH TYR A 43 -13.398 -4.446 0.053 1.00 0.00 H new ATOM 704 N GLY A 44 -15.406 1.186 5.415 1.00 0.00 N ATOM 705 CA GLY A 44 -14.900 0.761 6.707 1.00 0.00 C ATOM 706 C GLY A 44 -13.826 1.679 7.251 1.00 0.00 C ATOM 707 O GLY A 44 -13.523 2.710 6.650 1.00 0.00 O ATOM 0 H GLY A 44 -15.222 2.161 5.180 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.725 0.715 7.417 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.498 -0.248 6.620 1.00 0.00 H new ATOM 711 N ALA A 45 -13.275 1.332 8.415 1.00 0.00 N ATOM 712 CA ALA A 45 -12.263 2.176 9.043 1.00 0.00 C ATOM 713 C ALA A 45 -10.996 1.439 9.495 1.00 0.00 C ATOM 714 O ALA A 45 -11.043 0.532 10.327 1.00 0.00 O ATOM 715 CB ALA A 45 -12.889 2.889 10.218 1.00 0.00 C ATOM 0 H ALA A 45 -13.509 0.486 8.934 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.927 2.875 8.277 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.144 3.524 10.697 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.720 3.503 9.870 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.256 2.155 10.935 1.00 0.00 H new ATOM 721 N THR A 46 -9.862 1.893 8.968 1.00 0.00 N ATOM 722 CA THR A 46 -8.538 1.368 9.315 1.00 0.00 C ATOM 723 C THR A 46 -7.485 2.355 8.832 1.00 0.00 C ATOM 724 O THR A 46 -7.823 3.453 8.391 1.00 0.00 O ATOM 725 CB THR A 46 -8.280 -0.026 8.737 1.00 0.00 C ATOM 726 OG1 THR A 46 -9.422 -0.839 8.870 1.00 0.00 O ATOM 727 CG2 THR A 46 -7.139 -0.759 9.410 1.00 0.00 C ATOM 0 H THR A 46 -9.833 2.645 8.279 1.00 0.00 H new ATOM 0 HA THR A 46 -8.488 1.256 10.398 1.00 0.00 H new ATOM 0 HB THR A 46 -8.022 0.146 7.692 1.00 0.00 H new ATOM 0 HG1 THR A 46 -10.183 -0.409 8.427 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.014 -1.739 8.949 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.220 -0.184 9.296 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.361 -0.882 10.470 1.00 0.00 H new ATOM 735 N THR A 47 -6.216 1.976 8.897 1.00 0.00 N ATOM 736 CA THR A 47 -5.163 2.861 8.442 1.00 0.00 C ATOM 737 C THR A 47 -5.291 3.075 6.938 1.00 0.00 C ATOM 738 O THR A 47 -5.985 2.323 6.244 1.00 0.00 O ATOM 739 CB THR A 47 -3.790 2.271 8.766 1.00 0.00 C ATOM 740 OG1 THR A 47 -2.766 2.994 8.103 1.00 0.00 O ATOM 741 CG2 THR A 47 -3.658 0.815 8.368 1.00 0.00 C ATOM 0 H THR A 47 -5.898 1.075 9.255 1.00 0.00 H new ATOM 0 HA THR A 47 -5.260 3.817 8.956 1.00 0.00 H new ATOM 0 HB THR A 47 -3.688 2.346 9.849 1.00 0.00 H new ATOM 0 HG1 THR A 47 -2.175 2.369 7.634 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.661 0.457 8.625 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.404 0.224 8.899 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.814 0.716 7.294 1.00 0.00 H new ATOM 749 N VAL A 48 -4.650 4.118 6.441 1.00 0.00 N ATOM 750 CA VAL A 48 -4.718 4.443 5.026 1.00 0.00 C ATOM 751 C VAL A 48 -3.352 4.851 4.498 1.00 0.00 C ATOM 752 O VAL A 48 -2.625 5.591 5.152 1.00 0.00 O ATOM 753 CB VAL A 48 -5.724 5.588 4.777 1.00 0.00 C ATOM 754 CG1 VAL A 48 -5.786 5.963 3.302 1.00 0.00 C ATOM 755 CG2 VAL A 48 -7.101 5.204 5.297 1.00 0.00 C ATOM 0 H VAL A 48 -4.077 4.754 6.995 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.052 3.550 4.498 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.378 6.466 5.323 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.503 6.772 3.162 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.801 6.290 2.968 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.098 5.096 2.719 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.800 6.021 5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -7.448 4.308 4.782 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.044 5.008 6.368 1.00 0.00 H new ATOM 765 N VAL A 49 -3.004 4.376 3.308 1.00 0.00 N ATOM 766 CA VAL A 49 -1.723 4.728 2.716 1.00 0.00 C ATOM 767 C VAL A 49 -1.915 5.541 1.444 1.00 0.00 C ATOM 768 O VAL A 49 -2.255 5.006 0.382 1.00 0.00 O ATOM 769 CB VAL A 49 -0.874 3.478 2.406 1.00 0.00 C ATOM 770 CG1 VAL A 49 -1.573 2.577 1.402 1.00 0.00 C ATOM 771 CG2 VAL A 49 0.504 3.879 1.903 1.00 0.00 C ATOM 0 H VAL A 49 -3.583 3.755 2.742 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.191 5.332 3.450 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.752 2.915 3.331 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.952 1.704 1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.532 2.255 1.808 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.738 3.125 0.474 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.088 2.984 1.690 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.401 4.471 0.993 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.012 4.470 2.665 1.00 0.00 H new ATOM 781 N ARG A 50 -1.677 6.840 1.556 1.00 0.00 N ATOM 782 CA ARG A 50 -1.797 7.731 0.417 1.00 0.00 C ATOM 783 C ARG A 50 -0.439 8.319 0.070 1.00 0.00 C ATOM 784 O ARG A 50 0.091 9.141 0.819 1.00 0.00 O ATOM 785 CB ARG A 50 -2.796 8.851 0.716 1.00 0.00 C ATOM 786 CG ARG A 50 -2.580 9.517 2.065 1.00 0.00 C ATOM 787 CD ARG A 50 -3.553 10.666 2.283 1.00 0.00 C ATOM 788 NE ARG A 50 -2.883 11.861 2.791 1.00 0.00 N ATOM 789 CZ ARG A 50 -3.409 13.082 2.743 1.00 0.00 C ATOM 790 NH1 ARG A 50 -4.610 13.275 2.211 1.00 0.00 N ATOM 791 NH2 ARG A 50 -2.734 14.115 3.228 1.00 0.00 N ATOM 0 H ARG A 50 -1.400 7.298 2.424 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.163 7.159 -0.435 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.727 9.606 -0.067 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.807 8.444 0.679 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.702 8.780 2.859 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.557 9.888 2.129 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.052 10.902 1.343 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.327 10.358 2.986 1.00 0.00 H new ATOM 0 HE ARG A 50 -1.958 11.753 3.207 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.135 12.485 1.836 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.008 14.214 2.177 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -1.811 13.974 3.638 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -3.138 15.051 3.191 1.00 0.00 H new ATOM 805 N VAL A 51 0.119 7.926 -1.066 1.00 0.00 N ATOM 806 CA VAL A 51 1.405 8.466 -1.473 1.00 0.00 C ATOM 807 C VAL A 51 1.209 9.455 -2.602 1.00 0.00 C ATOM 808 O VAL A 51 1.211 9.095 -3.779 1.00 0.00 O ATOM 809 CB VAL A 51 2.379 7.363 -1.929 1.00 0.00 C ATOM 810 CG1 VAL A 51 3.800 7.906 -2.017 1.00 0.00 C ATOM 811 CG2 VAL A 51 2.312 6.166 -0.990 1.00 0.00 C ATOM 0 H VAL A 51 -0.290 7.249 -1.710 1.00 0.00 H new ATOM 0 HA VAL A 51 1.841 8.961 -0.605 1.00 0.00 H new ATOM 0 HB VAL A 51 2.081 7.030 -2.923 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.473 7.112 -2.341 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.833 8.725 -2.735 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.112 8.270 -1.038 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.007 5.398 -1.329 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.581 6.479 0.019 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.299 5.763 -0.986 1.00 0.00 H new ATOM 821 N CYS A 52 1.043 10.709 -2.222 1.00 0.00 N ATOM 822 CA CYS A 52 0.846 11.781 -3.175 1.00 0.00 C ATOM 823 C CYS A 52 1.223 13.106 -2.546 1.00 0.00 C ATOM 824 O CYS A 52 1.457 13.186 -1.339 1.00 0.00 O ATOM 825 CB CYS A 52 -0.607 11.816 -3.654 1.00 0.00 C ATOM 826 SG CYS A 52 -0.809 12.399 -5.353 1.00 0.00 S ATOM 0 H CYS A 52 1.041 11.010 -1.247 1.00 0.00 H new ATOM 0 HA CYS A 52 1.487 11.602 -4.038 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -1.030 10.815 -3.572 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.182 12.460 -2.989 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.070 12.391 -5.667 1.00 0.00 H new ATOM 832 N GLU A 53 1.262 14.146 -3.355 1.00 0.00 N ATOM 833 CA GLU A 53 1.590 15.464 -2.850 1.00 0.00 C ATOM 834 C GLU A 53 0.463 15.935 -1.937 1.00 0.00 C ATOM 835 O GLU A 53 -0.714 15.834 -2.284 1.00 0.00 O ATOM 836 CB GLU A 53 1.823 16.433 -4.009 1.00 0.00 C ATOM 837 CG GLU A 53 2.464 15.783 -5.235 1.00 0.00 C ATOM 838 CD GLU A 53 3.474 14.689 -4.893 1.00 0.00 C ATOM 839 OE1 GLU A 53 4.510 15.014 -4.275 1.00 0.00 O ATOM 840 OE2 GLU A 53 3.227 13.506 -5.243 1.00 0.00 O ATOM 0 H GLU A 53 1.072 14.105 -4.356 1.00 0.00 H new ATOM 0 HA GLU A 53 2.514 15.426 -2.273 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.869 16.874 -4.300 1.00 0.00 H new ATOM 0 HB3 GLU A 53 2.460 17.249 -3.667 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.680 15.358 -5.862 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.961 16.553 -5.825 1.00 0.00 H new ATOM 847 N VAL A 54 0.829 16.399 -0.753 1.00 0.00 N ATOM 848 CA VAL A 54 -0.154 16.832 0.239 1.00 0.00 C ATOM 849 C VAL A 54 -0.785 18.180 -0.092 1.00 0.00 C ATOM 850 O VAL A 54 -0.094 19.191 -0.212 1.00 0.00 O ATOM 851 CB VAL A 54 0.474 16.912 1.644 1.00 0.00 C ATOM 852 CG1 VAL A 54 0.974 15.545 2.084 1.00 0.00 C ATOM 853 CG2 VAL A 54 1.601 17.934 1.671 1.00 0.00 C ATOM 0 H VAL A 54 1.799 16.487 -0.451 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.940 16.077 0.220 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.294 17.236 2.346 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.414 15.621 3.078 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.140 14.843 2.109 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.727 15.189 1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 54 2.031 17.975 2.672 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.372 17.645 0.957 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.209 18.915 1.404 1.00 0.00 H new ATOM 863 N THR A 55 -2.114 18.186 -0.202 1.00 0.00 N ATOM 864 CA THR A 55 -2.853 19.411 -0.480 1.00 0.00 C ATOM 865 C THR A 55 -3.841 19.705 0.650 1.00 0.00 C ATOM 866 O THR A 55 -3.906 20.824 1.158 1.00 0.00 O ATOM 867 CB THR A 55 -3.598 19.294 -1.810 1.00 0.00 C ATOM 868 OG1 THR A 55 -4.484 18.189 -1.794 1.00 0.00 O ATOM 869 CG2 THR A 55 -2.676 19.125 -2.999 1.00 0.00 C ATOM 0 H THR A 55 -2.697 17.355 -0.102 1.00 0.00 H new ATOM 0 HA THR A 55 -2.142 20.234 -0.548 1.00 0.00 H new ATOM 0 HB THR A 55 -4.140 20.233 -1.920 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.403 18.508 -1.677 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.268 19.048 -3.911 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.012 19.986 -3.070 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.083 18.219 -2.874 1.00 0.00 H new ATOM 877 N TYR A 56 -4.599 18.682 1.049 1.00 0.00 N ATOM 878 CA TYR A 56 -5.574 18.818 2.132 1.00 0.00 C ATOM 879 C TYR A 56 -5.404 17.689 3.149 1.00 0.00 C ATOM 880 O TYR A 56 -6.101 16.676 3.082 1.00 0.00 O ATOM 881 CB TYR A 56 -7.002 18.805 1.571 1.00 0.00 C ATOM 882 CG TYR A 56 -7.092 19.198 0.112 1.00 0.00 C ATOM 883 CD1 TYR A 56 -6.855 20.508 -0.286 1.00 0.00 C ATOM 884 CD2 TYR A 56 -7.411 18.261 -0.863 1.00 0.00 C ATOM 885 CE1 TYR A 56 -6.934 20.873 -1.617 1.00 0.00 C ATOM 886 CE2 TYR A 56 -7.489 18.620 -2.196 1.00 0.00 C ATOM 887 CZ TYR A 56 -7.251 19.926 -2.566 1.00 0.00 C ATOM 888 OH TYR A 56 -7.329 20.286 -3.892 1.00 0.00 O ATOM 0 H TYR A 56 -4.556 17.750 0.638 1.00 0.00 H new ATOM 0 HA TYR A 56 -5.400 19.771 2.632 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.421 17.806 1.695 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -7.619 19.485 2.159 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -6.605 21.252 0.456 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.601 17.237 -0.576 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -6.748 21.895 -1.911 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.735 17.881 -2.944 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.561 19.501 -4.431 1.00 0.00 H new ATOM 898 N ASP A 57 -4.469 17.858 4.077 1.00 0.00 N ATOM 899 CA ASP A 57 -4.207 16.838 5.092 1.00 0.00 C ATOM 900 C ASP A 57 -5.223 16.857 6.237 1.00 0.00 C ATOM 901 O ASP A 57 -5.567 15.811 6.785 1.00 0.00 O ATOM 902 CB ASP A 57 -2.797 17.016 5.657 1.00 0.00 C ATOM 903 CG ASP A 57 -2.544 18.429 6.146 1.00 0.00 C ATOM 904 OD1 ASP A 57 -2.554 19.357 5.310 1.00 0.00 O ATOM 905 OD2 ASP A 57 -2.337 18.607 7.364 1.00 0.00 O ATOM 0 H ASP A 57 -3.880 18.688 4.150 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.300 15.871 4.597 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.648 16.317 6.480 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.066 16.764 4.889 1.00 0.00 H new ATOM 910 N LYS A 58 -5.671 18.050 6.621 1.00 0.00 N ATOM 911 CA LYS A 58 -6.613 18.195 7.733 1.00 0.00 C ATOM 912 C LYS A 58 -8.057 17.877 7.345 1.00 0.00 C ATOM 913 O LYS A 58 -8.753 17.150 8.053 1.00 0.00 O ATOM 914 CB LYS A 58 -6.540 19.615 8.297 1.00 0.00 C ATOM 915 CG LYS A 58 -5.122 20.086 8.578 1.00 0.00 C ATOM 916 CD LYS A 58 -4.962 21.570 8.291 1.00 0.00 C ATOM 917 CE LYS A 58 -3.515 21.929 7.992 1.00 0.00 C ATOM 918 NZ LYS A 58 -2.862 22.610 9.144 1.00 0.00 N ATOM 0 H LYS A 58 -5.399 18.929 6.181 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.316 17.467 8.488 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.009 20.302 7.592 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.119 19.661 9.220 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.871 19.886 9.620 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.421 19.518 7.967 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.589 21.847 7.443 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.311 22.147 9.148 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.960 21.024 7.743 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.475 22.578 7.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -1.877 22.838 8.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.376 23.487 9.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -2.877 21.982 9.973 1.00 0.00 H new ATOM 932 N THR A 59 -8.511 18.453 6.239 1.00 0.00 N ATOM 933 CA THR A 59 -9.886 18.265 5.773 1.00 0.00 C ATOM 934 C THR A 59 -10.350 16.807 5.859 1.00 0.00 C ATOM 935 O THR A 59 -11.333 16.505 6.533 1.00 0.00 O ATOM 936 CB THR A 59 -10.032 18.771 4.336 1.00 0.00 C ATOM 937 OG1 THR A 59 -8.828 19.364 3.890 1.00 0.00 O ATOM 938 CG2 THR A 59 -11.134 19.796 4.173 1.00 0.00 C ATOM 0 H THR A 59 -7.946 19.058 5.643 1.00 0.00 H new ATOM 0 HA THR A 59 -10.524 18.846 6.439 1.00 0.00 H new ATOM 0 HB THR A 59 -10.283 17.891 3.743 1.00 0.00 H new ATOM 0 HG1 THR A 59 -9.020 20.244 3.503 1.00 0.00 H new ATOM 0 HG21 THR A 59 -11.184 20.113 3.131 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.087 19.355 4.465 1.00 0.00 H new ATOM 0 HG23 THR A 59 -10.925 20.659 4.806 1.00 0.00 H new ATOM 946 N PRO A 60 -9.669 15.888 5.157 1.00 0.00 N ATOM 947 CA PRO A 60 -10.044 14.466 5.142 1.00 0.00 C ATOM 948 C PRO A 60 -9.799 13.748 6.468 1.00 0.00 C ATOM 949 O PRO A 60 -10.542 12.837 6.832 1.00 0.00 O ATOM 950 CB PRO A 60 -9.146 13.878 4.051 1.00 0.00 C ATOM 951 CG PRO A 60 -7.967 14.787 4.001 1.00 0.00 C ATOM 952 CD PRO A 60 -8.497 16.160 4.304 1.00 0.00 C ATOM 0 HA PRO A 60 -11.113 14.346 4.966 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -8.849 12.857 4.290 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.660 13.843 3.091 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -7.212 14.489 4.729 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.492 14.758 3.020 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.757 16.772 4.819 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.775 16.694 3.395 1.00 0.00 H new ATOM 960 N LEU A 61 -8.745 14.138 7.172 1.00 0.00 N ATOM 961 CA LEU A 61 -8.399 13.502 8.440 1.00 0.00 C ATOM 962 C LEU A 61 -9.379 13.850 9.558 1.00 0.00 C ATOM 963 O LEU A 61 -9.796 12.978 10.321 1.00 0.00 O ATOM 964 CB LEU A 61 -6.983 13.887 8.847 1.00 0.00 C ATOM 965 CG LEU A 61 -5.918 12.869 8.454 1.00 0.00 C ATOM 966 CD1 LEU A 61 -5.886 11.717 9.446 1.00 0.00 C ATOM 967 CD2 LEU A 61 -6.167 12.354 7.043 1.00 0.00 C ATOM 0 H LEU A 61 -8.115 14.889 6.889 1.00 0.00 H new ATOM 0 HA LEU A 61 -8.459 12.425 8.286 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.736 14.847 8.394 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.954 14.027 9.928 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.947 13.364 8.473 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.120 11.001 9.148 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.658 12.100 10.441 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.857 11.223 9.461 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.397 11.629 6.779 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -7.146 11.877 6.997 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.136 13.187 6.341 1.00 0.00 H new ATOM 979 N GLU A 62 -9.728 15.126 9.668 1.00 0.00 N ATOM 980 CA GLU A 62 -10.641 15.579 10.713 1.00 0.00 C ATOM 981 C GLU A 62 -12.087 15.198 10.415 1.00 0.00 C ATOM 982 O GLU A 62 -12.886 15.009 11.332 1.00 0.00 O ATOM 983 CB GLU A 62 -10.530 17.095 10.888 1.00 0.00 C ATOM 984 CG GLU A 62 -10.958 17.581 12.263 1.00 0.00 C ATOM 985 CD GLU A 62 -10.175 18.797 12.720 1.00 0.00 C ATOM 986 OE1 GLU A 62 -8.928 18.751 12.680 1.00 0.00 O ATOM 987 OE2 GLU A 62 -10.811 19.796 13.119 1.00 0.00 O ATOM 0 H GLU A 62 -9.394 15.865 9.049 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.351 15.080 11.637 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.498 17.399 10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.142 17.586 10.131 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -12.021 17.823 12.244 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -10.827 16.776 12.986 1.00 0.00 H new ATOM 994 N LYS A 63 -12.427 15.101 9.135 1.00 0.00 N ATOM 995 CA LYS A 63 -13.788 14.759 8.737 1.00 0.00 C ATOM 996 C LYS A 63 -14.043 13.256 8.805 1.00 0.00 C ATOM 997 O LYS A 63 -15.159 12.825 9.099 1.00 0.00 O ATOM 998 CB LYS A 63 -14.072 15.268 7.323 1.00 0.00 C ATOM 999 CG LYS A 63 -14.731 16.638 7.290 1.00 0.00 C ATOM 1000 CD LYS A 63 -13.756 17.720 6.854 1.00 0.00 C ATOM 1001 CE LYS A 63 -14.443 19.070 6.723 1.00 0.00 C ATOM 1002 NZ LYS A 63 -14.902 19.327 5.330 1.00 0.00 N ATOM 0 H LYS A 63 -11.783 15.253 8.359 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.462 15.244 9.443 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.136 15.311 6.766 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -14.715 14.552 6.811 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -15.581 16.617 6.607 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -15.122 16.878 8.279 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -12.944 17.793 7.578 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -13.308 17.444 5.899 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -15.297 19.110 7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -13.756 19.858 7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -14.480 20.212 4.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -14.609 18.540 4.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -15.939 19.409 5.316 1.00 0.00 H new ATOM 1016 N ASP A 64 -13.021 12.457 8.514 1.00 0.00 N ATOM 1017 CA ASP A 64 -13.174 11.003 8.530 1.00 0.00 C ATOM 1018 C ASP A 64 -12.604 10.376 9.805 1.00 0.00 C ATOM 1019 O ASP A 64 -12.860 9.207 10.094 1.00 0.00 O ATOM 1020 CB ASP A 64 -12.498 10.399 7.296 1.00 0.00 C ATOM 1021 CG ASP A 64 -13.461 9.607 6.435 1.00 0.00 C ATOM 1022 OD1 ASP A 64 -14.686 9.772 6.606 1.00 0.00 O ATOM 1023 OD2 ASP A 64 -12.989 8.822 5.585 1.00 0.00 O ATOM 0 H ASP A 64 -12.087 12.785 8.267 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.241 10.782 8.511 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.056 11.198 6.700 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.682 9.750 7.614 1.00 0.00 H new ATOM 1028 N GLY A 65 -11.847 11.152 10.573 1.00 0.00 N ATOM 1029 CA GLY A 65 -11.272 10.643 11.809 1.00 0.00 C ATOM 1030 C GLY A 65 -10.565 9.304 11.643 1.00 0.00 C ATOM 1031 O GLY A 65 -10.421 8.553 12.608 1.00 0.00 O ATOM 0 H GLY A 65 -11.620 12.124 10.364 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.563 11.374 12.199 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -12.062 10.538 12.552 1.00 0.00 H new ATOM 1035 N ILE A 66 -10.117 9.005 10.425 1.00 0.00 N ATOM 1036 CA ILE A 66 -9.415 7.750 10.152 1.00 0.00 C ATOM 1037 C ILE A 66 -7.906 7.952 10.199 1.00 0.00 C ATOM 1038 O ILE A 66 -7.403 9.015 9.834 1.00 0.00 O ATOM 1039 CB ILE A 66 -9.781 7.167 8.772 1.00 0.00 C ATOM 1040 CG1 ILE A 66 -11.284 7.260 8.525 1.00 0.00 C ATOM 1041 CG2 ILE A 66 -9.315 5.722 8.669 1.00 0.00 C ATOM 1042 CD1 ILE A 66 -11.673 6.965 7.094 1.00 0.00 C ATOM 0 H ILE A 66 -10.227 9.612 9.613 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.728 7.050 10.927 1.00 0.00 H new ATOM 0 HB ILE A 66 -9.273 7.754 8.007 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.798 6.562 9.186 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.628 8.260 8.789 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.580 5.323 7.690 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.234 5.678 8.798 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.797 5.128 9.445 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -12.754 7.048 6.986 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -11.186 7.679 6.430 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.359 5.954 6.833 1.00 0.00 H new ATOM 1054 N THR A 67 -7.184 6.924 10.630 1.00 0.00 N ATOM 1055 CA THR A 67 -5.731 6.999 10.699 1.00 0.00 C ATOM 1056 C THR A 67 -5.144 6.804 9.307 1.00 0.00 C ATOM 1057 O THR A 67 -5.545 5.898 8.579 1.00 0.00 O ATOM 1058 CB THR A 67 -5.184 5.937 11.656 1.00 0.00 C ATOM 1059 OG1 THR A 67 -6.000 5.834 12.809 1.00 0.00 O ATOM 1060 CG2 THR A 67 -3.770 6.220 12.117 1.00 0.00 C ATOM 0 H THR A 67 -7.579 6.034 10.935 1.00 0.00 H new ATOM 0 HA THR A 67 -5.445 7.981 11.077 1.00 0.00 H new ATOM 0 HB THR A 67 -5.185 5.007 11.088 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.635 5.149 13.408 1.00 0.00 H new ATOM 0 HG21 THR A 67 -3.443 5.430 12.793 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.106 6.257 11.253 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.742 7.177 12.638 1.00 0.00 H new ATOM 1068 N VAL A 68 -4.213 7.670 8.927 1.00 0.00 N ATOM 1069 CA VAL A 68 -3.609 7.584 7.605 1.00 0.00 C ATOM 1070 C VAL A 68 -2.139 7.982 7.619 1.00 0.00 C ATOM 1071 O VAL A 68 -1.701 8.784 8.443 1.00 0.00 O ATOM 1072 CB VAL A 68 -4.361 8.480 6.600 1.00 0.00 C ATOM 1073 CG1 VAL A 68 -4.379 9.919 7.087 1.00 0.00 C ATOM 1074 CG2 VAL A 68 -3.739 8.392 5.212 1.00 0.00 C ATOM 0 H VAL A 68 -3.863 8.432 9.508 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.682 6.541 7.298 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.388 8.122 6.529 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.913 10.540 6.368 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.881 9.970 8.053 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.356 10.281 7.190 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.290 9.034 4.525 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.700 8.717 5.258 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.782 7.362 4.859 1.00 0.00 H new ATOM 1084 N VAL A 69 -1.396 7.426 6.672 1.00 0.00 N ATOM 1085 CA VAL A 69 0.018 7.717 6.521 1.00 0.00 C ATOM 1086 C VAL A 69 0.207 8.657 5.339 1.00 0.00 C ATOM 1087 O VAL A 69 -0.334 8.419 4.257 1.00 0.00 O ATOM 1088 CB VAL A 69 0.844 6.433 6.288 1.00 0.00 C ATOM 1089 CG1 VAL A 69 2.320 6.683 6.555 1.00 0.00 C ATOM 1090 CG2 VAL A 69 0.328 5.297 7.160 1.00 0.00 C ATOM 0 H VAL A 69 -1.759 6.761 5.989 1.00 0.00 H new ATOM 0 HA VAL A 69 0.371 8.181 7.442 1.00 0.00 H new ATOM 0 HB VAL A 69 0.732 6.143 5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 69 2.881 5.764 6.384 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.684 7.461 5.884 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.454 7.003 7.588 1.00 0.00 H new ATOM 0 HG21 VAL A 69 0.923 4.402 6.981 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.405 5.580 8.210 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.715 5.095 6.915 1.00 0.00 H new ATOM 1100 N ASP A 70 0.954 9.732 5.547 1.00 0.00 N ATOM 1101 CA ASP A 70 1.177 10.705 4.489 1.00 0.00 C ATOM 1102 C ASP A 70 2.543 10.514 3.851 1.00 0.00 C ATOM 1103 O ASP A 70 3.572 10.842 4.442 1.00 0.00 O ATOM 1104 CB ASP A 70 1.052 12.126 5.039 1.00 0.00 C ATOM 1105 CG ASP A 70 -0.389 12.588 5.124 1.00 0.00 C ATOM 1106 OD1 ASP A 70 -1.255 11.768 5.492 1.00 0.00 O ATOM 1107 OD2 ASP A 70 -0.651 13.772 4.823 1.00 0.00 O ATOM 0 H ASP A 70 1.412 9.951 6.432 1.00 0.00 H new ATOM 0 HA ASP A 70 0.416 10.550 3.724 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.504 12.170 6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.613 12.810 4.402 1.00 0.00 H new ATOM 1112 N TRP A 71 2.540 9.984 2.635 1.00 0.00 N ATOM 1113 CA TRP A 71 3.772 9.749 1.902 1.00 0.00 C ATOM 1114 C TRP A 71 3.892 10.723 0.730 1.00 0.00 C ATOM 1115 O TRP A 71 3.217 10.563 -0.284 1.00 0.00 O ATOM 1116 CB TRP A 71 3.776 8.327 1.352 1.00 0.00 C ATOM 1117 CG TRP A 71 4.321 7.286 2.276 1.00 0.00 C ATOM 1118 CD1 TRP A 71 4.039 7.098 3.602 1.00 0.00 C ATOM 1119 CD2 TRP A 71 5.244 6.262 1.914 1.00 0.00 C ATOM 1120 NE1 TRP A 71 4.737 6.016 4.079 1.00 0.00 N ATOM 1121 CE2 TRP A 71 5.484 5.488 3.061 1.00 0.00 C ATOM 1122 CE3 TRP A 71 5.893 5.929 0.724 1.00 0.00 C ATOM 1123 CZ2 TRP A 71 6.342 4.399 3.050 1.00 0.00 C ATOM 1124 CZ3 TRP A 71 6.747 4.848 0.714 1.00 0.00 C ATOM 1125 CH2 TRP A 71 6.964 4.094 1.871 1.00 0.00 C ATOM 0 H TRP A 71 1.694 9.709 2.136 1.00 0.00 H new ATOM 0 HA TRP A 71 4.610 9.895 2.583 1.00 0.00 H new ATOM 0 HB2 TRP A 71 2.754 8.055 1.087 1.00 0.00 H new ATOM 0 HB3 TRP A 71 4.359 8.313 0.431 1.00 0.00 H new ATOM 0 HD1 TRP A 71 3.367 7.710 4.186 1.00 0.00 H new ATOM 0 HE1 TRP A 71 4.704 5.663 5.036 1.00 0.00 H new ATOM 0 HE3 TRP A 71 5.729 6.508 -0.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 6.513 3.813 3.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 7.256 4.579 -0.200 1.00 0.00 H new ATOM 0 HH2 TRP A 71 7.638 3.251 1.833 1.00 0.00 H new ATOM 1136 N PRO A 72 4.735 11.755 0.852 1.00 0.00 N ATOM 1137 CA PRO A 72 4.923 12.752 -0.179 1.00 0.00 C ATOM 1138 C PRO A 72 6.247 12.597 -0.922 1.00 0.00 C ATOM 1139 O PRO A 72 7.215 12.063 -0.380 1.00 0.00 O ATOM 1140 CB PRO A 72 4.925 14.012 0.665 1.00 0.00 C ATOM 1141 CG PRO A 72 5.612 13.606 1.945 1.00 0.00 C ATOM 1142 CD PRO A 72 5.553 12.090 2.019 1.00 0.00 C ATOM 0 HA PRO A 72 4.175 12.712 -0.971 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.458 14.822 0.168 1.00 0.00 H new ATOM 0 HB3 PRO A 72 3.911 14.366 0.853 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.645 13.953 1.955 1.00 0.00 H new ATOM 0 HG3 PRO A 72 5.117 14.054 2.807 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.545 11.641 1.964 1.00 0.00 H new ATOM 0 HD3 PRO A 72 5.098 11.745 2.948 1.00 0.00 H new ATOM 1260 N LYS A 82 13.854 2.702 3.173 1.00 0.00 N ATOM 1261 CA LYS A 82 13.513 2.870 4.581 1.00 0.00 C ATOM 1262 C LYS A 82 12.060 3.294 4.746 1.00 0.00 C ATOM 1263 O LYS A 82 11.371 2.833 5.657 1.00 0.00 O ATOM 1264 CB LYS A 82 14.434 3.903 5.232 1.00 0.00 C ATOM 1265 CG LYS A 82 14.821 3.560 6.660 1.00 0.00 C ATOM 1266 CD LYS A 82 15.991 4.404 7.139 1.00 0.00 C ATOM 1267 CE LYS A 82 17.319 3.834 6.667 1.00 0.00 C ATOM 1268 NZ LYS A 82 17.600 4.183 5.248 1.00 0.00 N ATOM 0 HA LYS A 82 13.649 1.908 5.076 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.339 3.999 4.632 1.00 0.00 H new ATOM 0 HB3 LYS A 82 13.940 4.875 5.222 1.00 0.00 H new ATOM 0 HG2 LYS A 82 13.966 3.716 7.317 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.083 2.504 6.723 1.00 0.00 H new ATOM 0 HD2 LYS A 82 15.880 5.424 6.771 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.982 4.455 8.228 1.00 0.00 H new ATOM 0 HE2 LYS A 82 18.122 4.212 7.300 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.309 2.750 6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.626 4.284 5.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 17.241 3.430 4.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.130 5.080 5.011 1.00 0.00 H new ATOM 1282 N VAL A 83 11.587 4.161 3.854 1.00 0.00 N ATOM 1283 CA VAL A 83 10.207 4.618 3.915 1.00 0.00 C ATOM 1284 C VAL A 83 9.258 3.429 3.816 1.00 0.00 C ATOM 1285 O VAL A 83 8.304 3.320 4.585 1.00 0.00 O ATOM 1286 CB VAL A 83 9.883 5.628 2.795 1.00 0.00 C ATOM 1287 CG1 VAL A 83 10.685 6.907 2.983 1.00 0.00 C ATOM 1288 CG2 VAL A 83 10.146 5.021 1.426 1.00 0.00 C ATOM 0 H VAL A 83 12.134 4.556 3.089 1.00 0.00 H new ATOM 0 HA VAL A 83 10.074 5.123 4.872 1.00 0.00 H new ATOM 0 HB VAL A 83 8.823 5.876 2.854 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.444 7.608 2.184 1.00 0.00 H new ATOM 0 HG12 VAL A 83 10.437 7.354 3.946 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.750 6.676 2.954 1.00 0.00 H new ATOM 0 HG21 VAL A 83 9.910 5.752 0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 83 11.196 4.737 1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.521 4.138 1.293 1.00 0.00 H new ATOM 1298 N VAL A 84 9.550 2.521 2.887 1.00 0.00 N ATOM 1299 CA VAL A 84 8.740 1.323 2.704 1.00 0.00 C ATOM 1300 C VAL A 84 8.603 0.593 4.030 1.00 0.00 C ATOM 1301 O VAL A 84 7.534 0.085 4.372 1.00 0.00 O ATOM 1302 CB VAL A 84 9.365 0.396 1.628 1.00 0.00 C ATOM 1303 CG1 VAL A 84 9.673 -0.994 2.176 1.00 0.00 C ATOM 1304 CG2 VAL A 84 8.454 0.305 0.413 1.00 0.00 C ATOM 0 H VAL A 84 10.343 2.594 2.250 1.00 0.00 H new ATOM 0 HA VAL A 84 7.749 1.615 2.356 1.00 0.00 H new ATOM 0 HB VAL A 84 10.314 0.839 1.327 1.00 0.00 H new ATOM 0 HG11 VAL A 84 10.109 -1.608 1.388 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.378 -0.911 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.752 -1.458 2.530 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.906 -0.349 -0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.487 -0.100 0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.315 1.299 -0.012 1.00 0.00 H new ATOM 1314 N GLU A 85 9.693 0.569 4.779 1.00 0.00 N ATOM 1315 CA GLU A 85 9.704 -0.075 6.083 1.00 0.00 C ATOM 1316 C GLU A 85 8.839 0.704 7.080 1.00 0.00 C ATOM 1317 O GLU A 85 8.257 0.122 7.997 1.00 0.00 O ATOM 1318 CB GLU A 85 11.136 -0.193 6.610 1.00 0.00 C ATOM 1319 CG GLU A 85 12.121 -0.749 5.590 1.00 0.00 C ATOM 1320 CD GLU A 85 11.998 -2.251 5.407 1.00 0.00 C ATOM 1321 OE1 GLU A 85 11.096 -2.853 6.028 1.00 0.00 O ATOM 1322 OE2 GLU A 85 12.803 -2.826 4.642 1.00 0.00 O ATOM 0 H GLU A 85 10.582 0.988 4.507 1.00 0.00 H new ATOM 0 HA GLU A 85 9.287 -1.076 5.970 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.477 0.791 6.932 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.138 -0.835 7.491 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.959 -0.257 4.631 1.00 0.00 H new ATOM 0 HG3 GLU A 85 13.136 -0.508 5.905 1.00 0.00 H new ATOM 1329 N ASP A 86 8.770 2.027 6.905 1.00 0.00 N ATOM 1330 CA ASP A 86 7.993 2.882 7.804 1.00 0.00 C ATOM 1331 C ASP A 86 6.493 2.588 7.731 1.00 0.00 C ATOM 1332 O ASP A 86 5.849 2.373 8.761 1.00 0.00 O ATOM 1333 CB ASP A 86 8.244 4.354 7.476 1.00 0.00 C ATOM 1334 CG ASP A 86 8.269 5.227 8.716 1.00 0.00 C ATOM 1335 OD1 ASP A 86 7.245 5.274 9.429 1.00 0.00 O ATOM 1336 OD2 ASP A 86 9.312 5.862 8.973 1.00 0.00 O ATOM 0 H ASP A 86 9.242 2.527 6.151 1.00 0.00 H new ATOM 0 HA ASP A 86 8.324 2.666 8.820 1.00 0.00 H new ATOM 0 HB2 ASP A 86 9.193 4.449 6.949 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.467 4.710 6.800 1.00 0.00 H new ATOM 1341 N TRP A 87 5.934 2.563 6.523 1.00 0.00 N ATOM 1342 CA TRP A 87 4.511 2.279 6.373 1.00 0.00 C ATOM 1343 C TRP A 87 4.234 0.823 6.735 1.00 0.00 C ATOM 1344 O TRP A 87 3.187 0.499 7.296 1.00 0.00 O ATOM 1345 CB TRP A 87 4.032 2.590 4.946 1.00 0.00 C ATOM 1346 CG TRP A 87 3.150 1.531 4.354 1.00 0.00 C ATOM 1347 CD1 TRP A 87 3.537 0.532 3.514 1.00 0.00 C ATOM 1348 CD2 TRP A 87 1.738 1.360 4.559 1.00 0.00 C ATOM 1349 NE1 TRP A 87 2.461 -0.250 3.183 1.00 0.00 N ATOM 1350 CE2 TRP A 87 1.344 0.238 3.807 1.00 0.00 C ATOM 1351 CE3 TRP A 87 0.771 2.045 5.301 1.00 0.00 C ATOM 1352 CZ2 TRP A 87 0.027 -0.215 3.774 1.00 0.00 C ATOM 1353 CZ3 TRP A 87 -0.539 1.594 5.269 1.00 0.00 C ATOM 1354 CH2 TRP A 87 -0.901 0.473 4.509 1.00 0.00 C ATOM 0 H TRP A 87 6.434 2.732 5.650 1.00 0.00 H new ATOM 0 HA TRP A 87 3.954 2.923 7.053 1.00 0.00 H new ATOM 0 HB2 TRP A 87 3.491 3.536 4.953 1.00 0.00 H new ATOM 0 HB3 TRP A 87 4.902 2.725 4.303 1.00 0.00 H new ATOM 0 HD1 TRP A 87 4.546 0.378 3.160 1.00 0.00 H new ATOM 0 HE1 TRP A 87 2.488 -1.065 2.570 1.00 0.00 H new ATOM 0 HE3 TRP A 87 1.040 2.910 5.889 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -0.252 -1.079 3.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -1.294 2.115 5.839 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -1.930 0.146 4.503 1.00 0.00 H new ATOM 1365 N LEU A 88 5.187 -0.051 6.416 1.00 0.00 N ATOM 1366 CA LEU A 88 5.053 -1.471 6.718 1.00 0.00 C ATOM 1367 C LEU A 88 4.781 -1.675 8.203 1.00 0.00 C ATOM 1368 O LEU A 88 3.921 -2.468 8.586 1.00 0.00 O ATOM 1369 CB LEU A 88 6.319 -2.225 6.307 1.00 0.00 C ATOM 1370 CG LEU A 88 6.280 -2.837 4.907 1.00 0.00 C ATOM 1371 CD1 LEU A 88 7.602 -3.516 4.585 1.00 0.00 C ATOM 1372 CD2 LEU A 88 5.128 -3.824 4.792 1.00 0.00 C ATOM 0 H LEU A 88 6.058 0.201 5.949 1.00 0.00 H new ATOM 0 HA LEU A 88 4.210 -1.866 6.151 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.166 -1.541 6.365 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.501 -3.020 7.030 1.00 0.00 H new ATOM 0 HG LEU A 88 6.122 -2.037 4.184 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.556 -3.946 3.584 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.408 -2.783 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.791 -4.306 5.311 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.114 -4.251 3.789 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.257 -4.621 5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.187 -3.308 4.980 1.00 0.00 H new ATOM 1384 N SER A 89 5.516 -0.944 9.036 1.00 0.00 N ATOM 1385 CA SER A 89 5.347 -1.034 10.478 1.00 0.00 C ATOM 1386 C SER A 89 3.995 -0.463 10.889 1.00 0.00 C ATOM 1387 O SER A 89 3.312 -1.016 11.752 1.00 0.00 O ATOM 1388 CB SER A 89 6.472 -0.284 11.195 1.00 0.00 C ATOM 1389 OG SER A 89 6.885 -0.976 12.361 1.00 0.00 O ATOM 0 H SER A 89 6.233 -0.284 8.735 1.00 0.00 H new ATOM 0 HA SER A 89 5.388 -2.085 10.765 1.00 0.00 H new ATOM 0 HB2 SER A 89 7.320 -0.163 10.521 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.133 0.717 11.463 1.00 0.00 H new ATOM 0 HG SER A 89 7.605 -0.477 12.800 1.00 0.00 H new ATOM 1395 N LEU A 90 3.612 0.645 10.260 1.00 0.00 N ATOM 1396 CA LEU A 90 2.336 1.290 10.555 1.00 0.00 C ATOM 1397 C LEU A 90 1.172 0.330 10.316 1.00 0.00 C ATOM 1398 O LEU A 90 0.320 0.137 11.187 1.00 0.00 O ATOM 1399 CB LEU A 90 2.169 2.542 9.688 1.00 0.00 C ATOM 1400 CG LEU A 90 1.120 3.544 10.175 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -0.283 3.001 9.949 1.00 0.00 C ATOM 1402 CD2 LEU A 90 1.335 3.876 11.644 1.00 0.00 C ATOM 0 H LEU A 90 4.166 1.114 9.544 1.00 0.00 H new ATOM 0 HA LEU A 90 2.333 1.578 11.606 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.131 3.051 9.626 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.907 2.230 8.677 1.00 0.00 H new ATOM 0 HG LEU A 90 1.230 4.462 9.598 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.015 3.727 10.301 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.436 2.819 8.885 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.405 2.067 10.498 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.579 4.590 11.970 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.255 2.966 12.238 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.326 4.311 11.778 1.00 0.00 H new ATOM 1414 N VAL A 91 1.146 -0.281 9.135 1.00 0.00 N ATOM 1415 CA VAL A 91 0.090 -1.224 8.791 1.00 0.00 C ATOM 1416 C VAL A 91 0.278 -2.543 9.530 1.00 0.00 C ATOM 1417 O VAL A 91 -0.692 -3.182 9.934 1.00 0.00 O ATOM 1418 CB VAL A 91 0.033 -1.496 7.275 1.00 0.00 C ATOM 1419 CG1 VAL A 91 1.336 -2.116 6.790 1.00 0.00 C ATOM 1420 CG2 VAL A 91 -1.152 -2.391 6.936 1.00 0.00 C ATOM 0 H VAL A 91 1.842 -0.140 8.403 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.851 -0.766 9.095 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.101 -0.544 6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.274 -2.300 5.717 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.162 -1.434 6.994 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.506 -3.058 7.310 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.176 -2.572 5.861 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.053 -3.341 7.462 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -2.077 -1.902 7.242 1.00 0.00 H new ATOM 1430 N LYS A 92 1.534 -2.947 9.707 1.00 0.00 N ATOM 1431 CA LYS A 92 1.845 -4.190 10.404 1.00 0.00 C ATOM 1432 C LYS A 92 1.150 -4.233 11.759 1.00 0.00 C ATOM 1433 O LYS A 92 0.575 -5.251 12.143 1.00 0.00 O ATOM 1434 CB LYS A 92 3.358 -4.333 10.588 1.00 0.00 C ATOM 1435 CG LYS A 92 4.034 -5.116 9.475 1.00 0.00 C ATOM 1436 CD LYS A 92 4.181 -6.584 9.837 1.00 0.00 C ATOM 1437 CE LYS A 92 5.145 -6.781 10.996 1.00 0.00 C ATOM 1438 NZ LYS A 92 6.472 -7.274 10.537 1.00 0.00 N ATOM 0 H LYS A 92 2.350 -2.432 9.378 1.00 0.00 H new ATOM 0 HA LYS A 92 1.482 -5.021 9.799 1.00 0.00 H new ATOM 0 HB2 LYS A 92 3.804 -3.340 10.645 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.555 -4.827 11.540 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.452 -5.023 8.558 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.017 -4.690 9.274 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.206 -6.994 10.100 1.00 0.00 H new ATOM 0 HD3 LYS A 92 4.536 -7.140 8.969 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.272 -5.837 11.527 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.720 -7.491 11.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 7.100 -7.395 11.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 6.355 -8.187 10.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 6.890 -6.585 9.880 1.00 0.00 H new ATOM 1452 N ALA A 93 1.202 -3.116 12.476 1.00 0.00 N ATOM 1453 CA ALA A 93 0.571 -3.019 13.786 1.00 0.00 C ATOM 1454 C ALA A 93 -0.945 -2.920 13.655 1.00 0.00 C ATOM 1455 O ALA A 93 -1.684 -3.570 14.394 1.00 0.00 O ATOM 1456 CB ALA A 93 1.117 -1.821 14.548 1.00 0.00 C ATOM 0 H ALA A 93 1.675 -2.265 12.172 1.00 0.00 H new ATOM 0 HA ALA A 93 0.804 -3.926 14.344 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.637 -1.761 15.525 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.193 -1.933 14.679 1.00 0.00 H new ATOM 0 HB3 ALA A 93 0.913 -0.909 13.987 1.00 0.00 H new ATOM 1462 N LYS A 94 -1.401 -2.102 12.711 1.00 0.00 N ATOM 1463 CA LYS A 94 -2.832 -1.917 12.486 1.00 0.00 C ATOM 1464 C LYS A 94 -3.489 -3.210 12.004 1.00 0.00 C ATOM 1465 O LYS A 94 -4.680 -3.431 12.229 1.00 0.00 O ATOM 1466 CB LYS A 94 -3.067 -0.800 11.469 1.00 0.00 C ATOM 1467 CG LYS A 94 -3.845 0.380 12.030 1.00 0.00 C ATOM 1468 CD LYS A 94 -2.932 1.353 12.759 1.00 0.00 C ATOM 1469 CE LYS A 94 -3.719 2.268 13.683 1.00 0.00 C ATOM 1470 NZ LYS A 94 -4.200 1.552 14.896 1.00 0.00 N ATOM 0 H LYS A 94 -0.802 -1.557 12.090 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.288 -1.639 13.436 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.104 -0.447 11.100 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.606 -1.206 10.613 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.357 0.898 11.219 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.613 0.019 12.713 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.194 0.797 13.337 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.383 1.952 12.033 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.092 3.108 13.982 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.571 2.682 13.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.519 2.244 15.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.992 0.928 14.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.425 0.983 15.293 1.00 0.00 H new ATOM 1484 N PHE A 95 -2.712 -4.059 11.339 1.00 0.00 N ATOM 1485 CA PHE A 95 -3.226 -5.324 10.823 1.00 0.00 C ATOM 1486 C PHE A 95 -3.252 -6.390 11.915 1.00 0.00 C ATOM 1487 O PHE A 95 -4.200 -7.168 12.013 1.00 0.00 O ATOM 1488 CB PHE A 95 -2.377 -5.804 9.640 1.00 0.00 C ATOM 1489 CG PHE A 95 -3.047 -5.644 8.300 1.00 0.00 C ATOM 1490 CD1 PHE A 95 -3.978 -4.637 8.085 1.00 0.00 C ATOM 1491 CD2 PHE A 95 -2.743 -6.502 7.253 1.00 0.00 C ATOM 1492 CE1 PHE A 95 -4.591 -4.492 6.856 1.00 0.00 C ATOM 1493 CE2 PHE A 95 -3.353 -6.359 6.023 1.00 0.00 C ATOM 1494 CZ PHE A 95 -4.277 -5.354 5.823 1.00 0.00 C ATOM 0 H PHE A 95 -1.724 -3.895 11.145 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.248 -5.157 10.481 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.437 -5.252 9.633 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -2.128 -6.855 9.787 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -4.226 -3.959 8.888 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -2.021 -7.291 7.402 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.315 -3.706 6.703 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -3.107 -7.034 5.217 1.00 0.00 H new ATOM 0 HZ PHE A 95 -4.754 -5.241 4.861 1.00 0.00 H new ATOM 1504 N CYS A 96 -2.206 -6.419 12.733 1.00 0.00 N ATOM 1505 CA CYS A 96 -2.112 -7.391 13.816 1.00 0.00 C ATOM 1506 C CYS A 96 -3.176 -7.129 14.878 1.00 0.00 C ATOM 1507 O CYS A 96 -3.849 -8.052 15.337 1.00 0.00 O ATOM 1508 CB CYS A 96 -0.720 -7.347 14.450 1.00 0.00 C ATOM 1509 SG CYS A 96 -0.295 -8.824 15.401 1.00 0.00 S ATOM 0 H CYS A 96 -1.412 -5.782 12.667 1.00 0.00 H new ATOM 0 HA CYS A 96 -2.281 -8.382 13.396 1.00 0.00 H new ATOM 0 HB2 CYS A 96 0.022 -7.209 13.663 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -0.657 -6.477 15.103 1.00 0.00 H new ATOM 0 HG CYS A 96 0.900 -8.693 15.895 1.00 0.00 H new ATOM 1515 N GLU A 97 -3.319 -5.867 15.265 1.00 0.00 N ATOM 1516 CA GLU A 97 -4.299 -5.482 16.276 1.00 0.00 C ATOM 1517 C GLU A 97 -5.710 -5.467 15.695 1.00 0.00 C ATOM 1518 O GLU A 97 -6.681 -5.764 16.392 1.00 0.00 O ATOM 1519 CB GLU A 97 -3.958 -4.107 16.850 1.00 0.00 C ATOM 1520 CG GLU A 97 -4.542 -3.862 18.231 1.00 0.00 C ATOM 1521 CD GLU A 97 -3.771 -2.817 19.013 1.00 0.00 C ATOM 1522 OE1 GLU A 97 -2.564 -3.029 19.258 1.00 0.00 O ATOM 1523 OE2 GLU A 97 -4.372 -1.787 19.383 1.00 0.00 O ATOM 0 H GLU A 97 -2.769 -5.092 14.895 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.264 -6.222 17.076 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.874 -4.002 16.899 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -4.322 -3.338 16.169 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.580 -3.544 18.131 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.548 -4.798 18.790 1.00 0.00 H new ATOM 1530 N ALA A 98 -5.819 -5.116 14.417 1.00 0.00 N ATOM 1531 CA ALA A 98 -7.114 -5.058 13.749 1.00 0.00 C ATOM 1532 C ALA A 98 -7.264 -6.186 12.732 1.00 0.00 C ATOM 1533 O ALA A 98 -6.948 -6.016 11.554 1.00 0.00 O ATOM 1534 CB ALA A 98 -7.297 -3.707 13.073 1.00 0.00 C ATOM 0 H ALA A 98 -5.027 -4.868 13.824 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.889 -5.184 14.505 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.268 -3.676 12.578 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.246 -2.916 13.821 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.508 -3.560 12.335 1.00 0.00 H new ATOM 1540 N PRO A 99 -7.754 -7.357 13.175 1.00 0.00 N ATOM 1541 CA PRO A 99 -7.948 -8.514 12.297 1.00 0.00 C ATOM 1542 C PRO A 99 -9.194 -8.380 11.427 1.00 0.00 C ATOM 1543 O PRO A 99 -10.315 -8.338 11.934 1.00 0.00 O ATOM 1544 CB PRO A 99 -8.107 -9.670 13.283 1.00 0.00 C ATOM 1545 CG PRO A 99 -8.706 -9.047 14.497 1.00 0.00 C ATOM 1546 CD PRO A 99 -8.158 -7.644 14.565 1.00 0.00 C ATOM 0 HA PRO A 99 -7.125 -8.640 11.593 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.752 -10.450 12.879 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -7.147 -10.134 13.508 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.794 -9.037 14.433 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -8.445 -9.611 15.393 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.910 -6.937 14.917 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -7.312 -7.577 15.249 1.00 0.00 H new ATOM 1554 N GLY A 100 -8.991 -8.312 10.115 1.00 0.00 N ATOM 1555 CA GLY A 100 -10.108 -8.183 9.197 1.00 0.00 C ATOM 1556 C GLY A 100 -10.772 -6.823 9.278 1.00 0.00 C ATOM 1557 O GLY A 100 -11.989 -6.727 9.447 1.00 0.00 O ATOM 0 H GLY A 100 -8.073 -8.344 9.671 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.759 -8.353 8.179 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.844 -8.957 9.415 1.00 0.00 H new ATOM 1561 N SER A 101 -9.973 -5.767 9.163 1.00 0.00 N ATOM 1562 CA SER A 101 -10.488 -4.406 9.228 1.00 0.00 C ATOM 1563 C SER A 101 -10.619 -3.797 7.830 1.00 0.00 C ATOM 1564 O SER A 101 -10.423 -4.483 6.826 1.00 0.00 O ATOM 1565 CB SER A 101 -9.576 -3.544 10.103 1.00 0.00 C ATOM 1566 OG SER A 101 -10.253 -2.388 10.563 1.00 0.00 O ATOM 0 H SER A 101 -8.964 -5.829 9.024 1.00 0.00 H new ATOM 0 HA SER A 101 -11.483 -4.437 9.672 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.227 -4.128 10.955 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.694 -3.250 9.535 1.00 0.00 H new ATOM 0 HG SER A 101 -9.860 -1.592 10.148 1.00 0.00 H new ATOM 1572 N CYS A 102 -10.967 -2.512 7.770 1.00 0.00 N ATOM 1573 CA CYS A 102 -11.141 -1.822 6.492 1.00 0.00 C ATOM 1574 C CYS A 102 -10.078 -0.743 6.271 1.00 0.00 C ATOM 1575 O CYS A 102 -10.050 0.263 6.973 1.00 0.00 O ATOM 1576 CB CYS A 102 -12.528 -1.197 6.472 1.00 0.00 C ATOM 1577 SG CYS A 102 -13.803 -2.323 5.851 1.00 0.00 S ATOM 0 H CYS A 102 -11.134 -1.928 8.590 1.00 0.00 H new ATOM 0 HA CYS A 102 -11.030 -2.547 5.686 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -12.792 -0.879 7.481 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -12.508 -0.302 5.851 1.00 0.00 H new ATOM 0 HG CYS A 102 -13.769 -2.343 4.552 1.00 0.00 H new ATOM 1583 N VAL A 103 -9.221 -0.951 5.268 1.00 0.00 N ATOM 1584 CA VAL A 103 -8.154 0.003 4.951 1.00 0.00 C ATOM 1585 C VAL A 103 -8.444 0.786 3.675 1.00 0.00 C ATOM 1586 O VAL A 103 -9.112 0.292 2.768 1.00 0.00 O ATOM 1587 CB VAL A 103 -6.789 -0.714 4.801 1.00 0.00 C ATOM 1588 CG1 VAL A 103 -5.777 0.155 4.053 1.00 0.00 C ATOM 1589 CG2 VAL A 103 -6.248 -1.111 6.166 1.00 0.00 C ATOM 0 H VAL A 103 -9.245 -1.771 4.662 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.111 0.702 5.786 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.949 -1.616 4.210 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.831 -0.380 3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.158 0.382 3.057 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.619 1.084 4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.289 -1.614 6.045 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.116 -0.219 6.778 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.952 -1.785 6.654 1.00 0.00 H new ATOM 1599 N ALA A 104 -7.916 2.009 3.611 1.00 0.00 N ATOM 1600 CA ALA A 104 -8.095 2.865 2.440 1.00 0.00 C ATOM 1601 C ALA A 104 -6.740 3.249 1.840 1.00 0.00 C ATOM 1602 O ALA A 104 -5.756 3.397 2.558 1.00 0.00 O ATOM 1603 CB ALA A 104 -8.901 4.104 2.806 1.00 0.00 C ATOM 0 H ALA A 104 -7.361 2.428 4.357 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.651 2.309 1.685 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -9.025 4.731 1.923 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.880 3.804 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -8.375 4.665 3.578 1.00 0.00 H new ATOM 1609 N VAL A 105 -6.691 3.378 0.516 1.00 0.00 N ATOM 1610 CA VAL A 105 -5.444 3.712 -0.179 1.00 0.00 C ATOM 1611 C VAL A 105 -5.677 4.707 -1.324 1.00 0.00 C ATOM 1612 O VAL A 105 -6.812 4.933 -1.737 1.00 0.00 O ATOM 1613 CB VAL A 105 -4.790 2.430 -0.747 1.00 0.00 C ATOM 1614 CG1 VAL A 105 -3.534 2.748 -1.547 1.00 0.00 C ATOM 1615 CG2 VAL A 105 -4.481 1.446 0.374 1.00 0.00 C ATOM 0 H VAL A 105 -7.496 3.257 -0.098 1.00 0.00 H new ATOM 0 HA VAL A 105 -4.782 4.178 0.551 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.504 1.968 -1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -3.103 1.823 -1.930 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.790 3.402 -2.381 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.809 3.247 -0.904 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.022 0.550 -0.044 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.795 1.908 1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.405 1.175 0.885 1.00 0.00 H new ATOM 1625 N HIS A 106 -4.590 5.294 -1.836 1.00 0.00 N ATOM 1626 CA HIS A 106 -4.673 6.256 -2.941 1.00 0.00 C ATOM 1627 C HIS A 106 -5.118 5.560 -4.235 1.00 0.00 C ATOM 1628 O HIS A 106 -4.958 4.349 -4.387 1.00 0.00 O ATOM 1629 CB HIS A 106 -3.323 6.958 -3.148 1.00 0.00 C ATOM 1630 CG HIS A 106 -3.126 7.507 -4.530 1.00 0.00 C ATOM 1631 ND1 HIS A 106 -2.915 6.878 -5.711 1.00 0.00 N flip ATOM 1632 CD2 HIS A 106 -3.148 8.854 -4.818 1.00 0.00 C flip ATOM 1633 CE1 HIS A 106 -2.819 7.846 -6.680 1.00 0.00 C flip ATOM 1634 NE2 HIS A 106 -2.962 9.031 -6.114 1.00 0.00 N flip ATOM 0 H HIS A 106 -3.642 5.120 -1.503 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.418 7.008 -2.682 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -3.235 7.772 -2.429 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.521 6.252 -2.931 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.295 9.644 -4.096 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.654 7.668 -7.732 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -2.934 9.930 -6.596 1.00 0.00 H new ATOM 1642 N CYS A 107 -5.712 6.336 -5.147 1.00 0.00 N ATOM 1643 CA CYS A 107 -6.227 5.807 -6.414 1.00 0.00 C ATOM 1644 C CYS A 107 -5.118 5.362 -7.369 1.00 0.00 C ATOM 1645 O CYS A 107 -4.458 6.178 -8.012 1.00 0.00 O ATOM 1646 CB CYS A 107 -7.107 6.855 -7.100 1.00 0.00 C ATOM 1647 SG CYS A 107 -7.774 6.340 -8.701 1.00 0.00 S ATOM 0 H CYS A 107 -5.849 7.340 -5.030 1.00 0.00 H new ATOM 0 HA CYS A 107 -6.815 4.922 -6.170 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -7.936 7.105 -6.438 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -6.525 7.766 -7.239 1.00 0.00 H new ATOM 0 HG CYS A 107 -8.504 7.296 -9.195 1.00 0.00 H new ATOM 1653 N VAL A 108 -4.949 4.046 -7.457 1.00 0.00 N ATOM 1654 CA VAL A 108 -3.961 3.422 -8.332 1.00 0.00 C ATOM 1655 C VAL A 108 -4.391 3.436 -9.802 1.00 0.00 C ATOM 1656 O VAL A 108 -3.693 2.891 -10.656 1.00 0.00 O ATOM 1657 CB VAL A 108 -3.672 1.970 -7.921 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -2.364 1.504 -8.535 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -3.638 1.836 -6.407 1.00 0.00 C ATOM 0 H VAL A 108 -5.499 3.377 -6.918 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.056 4.020 -8.223 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.475 1.335 -8.295 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.169 0.474 -8.237 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -2.431 1.561 -9.621 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.551 2.142 -8.188 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.432 0.800 -6.138 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.856 2.478 -6.002 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.602 2.133 -5.994 1.00 0.00 H new ATOM 1669 N ALA A 109 -5.553 4.018 -10.098 1.00 0.00 N ATOM 1670 CA ALA A 109 -6.060 4.035 -11.470 1.00 0.00 C ATOM 1671 C ALA A 109 -5.092 4.729 -12.430 1.00 0.00 C ATOM 1672 O ALA A 109 -5.263 4.666 -13.647 1.00 0.00 O ATOM 1673 CB ALA A 109 -7.421 4.714 -11.517 1.00 0.00 C ATOM 0 H ALA A 109 -6.155 4.479 -9.415 1.00 0.00 H new ATOM 0 HA ALA A 109 -6.159 3.000 -11.796 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.789 4.721 -12.543 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -8.121 4.169 -10.884 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.329 5.739 -11.158 1.00 0.00 H new ATOM 1679 N GLY A 110 -4.055 5.350 -11.881 1.00 0.00 N ATOM 1680 CA GLY A 110 -3.052 5.998 -12.703 1.00 0.00 C ATOM 1681 C GLY A 110 -1.678 5.446 -12.386 1.00 0.00 C ATOM 1682 O GLY A 110 -1.454 4.239 -12.481 1.00 0.00 O ATOM 0 H GLY A 110 -3.891 5.416 -10.876 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.280 5.842 -13.757 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -3.069 7.074 -12.529 1.00 0.00 H new ATOM 1686 N LEU A 111 -0.770 6.317 -11.972 1.00 0.00 N ATOM 1687 CA LEU A 111 0.570 5.893 -11.594 1.00 0.00 C ATOM 1688 C LEU A 111 0.941 6.522 -10.258 1.00 0.00 C ATOM 1689 O LEU A 111 0.833 7.736 -10.086 1.00 0.00 O ATOM 1690 CB LEU A 111 1.597 6.275 -12.669 1.00 0.00 C ATOM 1691 CG LEU A 111 1.703 5.311 -13.861 1.00 0.00 C ATOM 1692 CD1 LEU A 111 2.997 5.550 -14.626 1.00 0.00 C ATOM 1693 CD2 LEU A 111 1.627 3.861 -13.402 1.00 0.00 C ATOM 0 H LEU A 111 -0.936 7.320 -11.889 1.00 0.00 H new ATOM 0 HA LEU A 111 0.579 4.807 -11.500 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.348 7.266 -13.048 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.577 6.351 -12.198 1.00 0.00 H new ATOM 0 HG LEU A 111 0.860 5.505 -14.524 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.056 4.859 -15.467 1.00 0.00 H new ATOM 0 HD12 LEU A 111 3.016 6.575 -14.997 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.847 5.388 -13.963 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.705 3.201 -14.266 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.446 3.654 -12.713 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.676 3.688 -12.898 1.00 0.00 H new ATOM 1705 N GLY A 112 1.363 5.695 -9.310 1.00 0.00 N ATOM 1706 CA GLY A 112 1.720 6.208 -8.003 1.00 0.00 C ATOM 1707 C GLY A 112 2.567 5.248 -7.195 1.00 0.00 C ATOM 1708 O GLY A 112 3.288 4.418 -7.749 1.00 0.00 O ATOM 0 H GLY A 112 1.464 4.686 -9.422 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.261 7.146 -8.124 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.810 6.434 -7.448 1.00 0.00 H new ATOM 1712 N ARG A 113 2.492 5.384 -5.877 1.00 0.00 N ATOM 1713 CA ARG A 113 3.267 4.548 -4.968 1.00 0.00 C ATOM 1714 C ARG A 113 2.367 3.784 -3.981 1.00 0.00 C ATOM 1715 O ARG A 113 2.809 2.834 -3.322 1.00 0.00 O ATOM 1716 CB ARG A 113 4.260 5.431 -4.207 1.00 0.00 C ATOM 1717 CG ARG A 113 4.990 6.445 -5.089 1.00 0.00 C ATOM 1718 CD ARG A 113 4.109 7.641 -5.465 1.00 0.00 C ATOM 1719 NE ARG A 113 4.903 8.852 -5.699 1.00 0.00 N ATOM 1720 CZ ARG A 113 4.421 10.100 -5.633 1.00 0.00 C ATOM 1721 NH1 ARG A 113 3.151 10.325 -5.331 1.00 0.00 N ATOM 1722 NH2 ARG A 113 5.216 11.133 -5.873 1.00 0.00 N ATOM 0 H ARG A 113 1.898 6.070 -5.411 1.00 0.00 H new ATOM 0 HA ARG A 113 3.801 3.802 -5.556 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.727 5.965 -3.421 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.996 4.794 -3.717 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.878 6.802 -4.567 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.332 5.950 -5.998 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.537 7.403 -6.362 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.389 7.827 -4.668 1.00 0.00 H new ATOM 0 HE ARG A 113 5.890 8.736 -5.928 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.525 9.542 -5.145 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.799 11.281 -5.285 1.00 0.00 H new ATOM 0 HH21 ARG A 113 6.196 10.978 -6.108 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.847 12.083 -5.822 1.00 0.00 H new ATOM 1736 N ALA A 114 1.108 4.209 -3.877 1.00 0.00 N ATOM 1737 CA ALA A 114 0.151 3.581 -2.969 1.00 0.00 C ATOM 1738 C ALA A 114 0.048 2.067 -3.173 1.00 0.00 C ATOM 1739 O ALA A 114 0.063 1.311 -2.201 1.00 0.00 O ATOM 1740 CB ALA A 114 -1.218 4.222 -3.135 1.00 0.00 C ATOM 0 H ALA A 114 0.727 4.989 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 114 0.518 3.742 -1.955 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.926 3.749 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -1.152 5.286 -2.907 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.559 4.092 -4.162 1.00 0.00 H new ATOM 1746 N PRO A 115 -0.071 1.593 -4.428 1.00 0.00 N ATOM 1747 CA PRO A 115 -0.191 0.159 -4.718 1.00 0.00 C ATOM 1748 C PRO A 115 0.924 -0.658 -4.081 1.00 0.00 C ATOM 1749 O PRO A 115 0.666 -1.675 -3.436 1.00 0.00 O ATOM 1750 CB PRO A 115 -0.094 0.083 -6.250 1.00 0.00 C ATOM 1751 CG PRO A 115 0.398 1.425 -6.679 1.00 0.00 C ATOM 1752 CD PRO A 115 -0.125 2.389 -5.659 1.00 0.00 C ATOM 0 HA PRO A 115 -1.117 -0.253 -4.316 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.591 -0.706 -6.562 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -1.063 -0.142 -6.695 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.487 1.449 -6.719 1.00 0.00 H new ATOM 0 HG3 PRO A 115 0.037 1.675 -7.676 1.00 0.00 H new ATOM 0 HD2 PRO A 115 0.491 3.286 -5.592 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -1.139 2.716 -5.889 1.00 0.00 H new ATOM 1760 N VAL A 116 2.162 -0.209 -4.252 1.00 0.00 N ATOM 1761 CA VAL A 116 3.300 -0.911 -3.676 1.00 0.00 C ATOM 1762 C VAL A 116 3.123 -1.069 -2.175 1.00 0.00 C ATOM 1763 O VAL A 116 3.210 -2.175 -1.642 1.00 0.00 O ATOM 1764 CB VAL A 116 4.626 -0.171 -3.941 1.00 0.00 C ATOM 1765 CG1 VAL A 116 5.805 -0.982 -3.423 1.00 0.00 C ATOM 1766 CG2 VAL A 116 4.790 0.123 -5.420 1.00 0.00 C ATOM 0 H VAL A 116 2.401 0.630 -4.780 1.00 0.00 H new ATOM 0 HA VAL A 116 3.343 -1.889 -4.155 1.00 0.00 H new ATOM 0 HB VAL A 116 4.600 0.778 -3.405 1.00 0.00 H new ATOM 0 HG11 VAL A 116 6.732 -0.443 -3.619 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.696 -1.137 -2.350 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.833 -1.947 -3.928 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.732 0.646 -5.585 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.791 -0.813 -5.979 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.964 0.748 -5.761 1.00 0.00 H new ATOM 1776 N LEU A 117 2.872 0.048 -1.500 1.00 0.00 N ATOM 1777 CA LEU A 117 2.685 0.042 -0.053 1.00 0.00 C ATOM 1778 C LEU A 117 1.597 -0.943 0.374 1.00 0.00 C ATOM 1779 O LEU A 117 1.797 -1.745 1.288 1.00 0.00 O ATOM 1780 CB LEU A 117 2.347 1.451 0.443 1.00 0.00 C ATOM 1781 CG LEU A 117 3.368 2.541 0.088 1.00 0.00 C ATOM 1782 CD1 LEU A 117 3.428 3.589 1.188 1.00 0.00 C ATOM 1783 CD2 LEU A 117 4.750 1.945 -0.150 1.00 0.00 C ATOM 0 H LEU A 117 2.793 0.969 -1.931 1.00 0.00 H new ATOM 0 HA LEU A 117 3.622 -0.284 0.399 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.378 1.738 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.238 1.419 1.527 1.00 0.00 H new ATOM 0 HG LEU A 117 3.042 3.018 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.156 4.355 0.922 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.446 4.048 1.308 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.724 3.117 2.125 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.452 2.741 -0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 117 5.086 1.434 0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.702 1.232 -0.973 1.00 0.00 H new ATOM 1795 N VAL A 118 0.442 -0.885 -0.282 1.00 0.00 N ATOM 1796 CA VAL A 118 -0.666 -1.776 0.057 1.00 0.00 C ATOM 1797 C VAL A 118 -0.217 -3.229 0.094 1.00 0.00 C ATOM 1798 O VAL A 118 -0.483 -3.947 1.057 1.00 0.00 O ATOM 1799 CB VAL A 118 -1.827 -1.648 -0.942 1.00 0.00 C ATOM 1800 CG1 VAL A 118 -3.049 -2.398 -0.436 1.00 0.00 C ATOM 1801 CG2 VAL A 118 -2.156 -0.187 -1.191 1.00 0.00 C ATOM 0 H VAL A 118 0.248 -0.237 -1.045 1.00 0.00 H new ATOM 0 HA VAL A 118 -1.010 -1.473 1.046 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.521 -2.094 -1.888 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.862 -2.297 -1.155 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.803 -3.453 -0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.360 -1.983 0.523 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.980 -0.115 -1.901 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.443 0.286 -0.252 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.281 0.319 -1.599 1.00 0.00 H new ATOM 1811 N ALA A 119 0.469 -3.657 -0.956 1.00 0.00 N ATOM 1812 CA ALA A 119 0.954 -5.025 -1.035 1.00 0.00 C ATOM 1813 C ALA A 119 1.820 -5.361 0.178 1.00 0.00 C ATOM 1814 O ALA A 119 1.671 -6.422 0.786 1.00 0.00 O ATOM 1815 CB ALA A 119 1.735 -5.234 -2.324 1.00 0.00 C ATOM 0 H ALA A 119 0.701 -3.077 -1.763 1.00 0.00 H new ATOM 0 HA ALA A 119 0.095 -5.697 -1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 119 2.092 -6.263 -2.370 1.00 0.00 H new ATOM 0 HB2 ALA A 119 1.087 -5.036 -3.178 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.586 -4.553 -2.348 1.00 0.00 H new ATOM 1821 N LEU A 120 2.720 -4.444 0.525 1.00 0.00 N ATOM 1822 CA LEU A 120 3.611 -4.637 1.669 1.00 0.00 C ATOM 1823 C LEU A 120 2.810 -4.867 2.945 1.00 0.00 C ATOM 1824 O LEU A 120 3.252 -5.573 3.849 1.00 0.00 O ATOM 1825 CB LEU A 120 4.545 -3.434 1.857 1.00 0.00 C ATOM 1826 CG LEU A 120 4.883 -2.651 0.588 1.00 0.00 C ATOM 1827 CD1 LEU A 120 5.937 -1.594 0.878 1.00 0.00 C ATOM 1828 CD2 LEU A 120 5.347 -3.589 -0.520 1.00 0.00 C ATOM 0 H LEU A 120 2.852 -3.561 0.032 1.00 0.00 H new ATOM 0 HA LEU A 120 4.218 -5.519 1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.087 -2.751 2.572 1.00 0.00 H new ATOM 0 HB3 LEU A 120 5.475 -3.786 2.303 1.00 0.00 H new ATOM 0 HG LEU A 120 3.979 -2.147 0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.165 -1.047 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.560 -0.902 1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.842 -2.075 1.248 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.582 -3.009 -1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.236 -4.127 -0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.555 -4.302 -0.748 1.00 0.00 H new ATOM 1840 N ALA A 121 1.627 -4.269 3.014 1.00 0.00 N ATOM 1841 CA ALA A 121 0.772 -4.423 4.183 1.00 0.00 C ATOM 1842 C ALA A 121 0.177 -5.825 4.231 1.00 0.00 C ATOM 1843 O ALA A 121 0.162 -6.470 5.278 1.00 0.00 O ATOM 1844 CB ALA A 121 -0.331 -3.377 4.176 1.00 0.00 C ATOM 0 H ALA A 121 1.240 -3.677 2.279 1.00 0.00 H new ATOM 0 HA ALA A 121 1.381 -4.278 5.075 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.961 -3.506 5.056 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.112 -2.381 4.190 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.936 -3.492 3.277 1.00 0.00 H new ATOM 1850 N LEU A 122 -0.303 -6.293 3.085 1.00 0.00 N ATOM 1851 CA LEU A 122 -0.889 -7.625 2.986 1.00 0.00 C ATOM 1852 C LEU A 122 0.184 -8.702 3.136 1.00 0.00 C ATOM 1853 O LEU A 122 -0.121 -9.872 3.366 1.00 0.00 O ATOM 1854 CB LEU A 122 -1.602 -7.785 1.641 1.00 0.00 C ATOM 1855 CG LEU A 122 -3.005 -8.386 1.716 1.00 0.00 C ATOM 1856 CD1 LEU A 122 -3.484 -8.797 0.331 1.00 0.00 C ATOM 1857 CD2 LEU A 122 -3.027 -9.577 2.663 1.00 0.00 C ATOM 0 H LEU A 122 -0.298 -5.769 2.210 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.612 -7.742 3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.668 -6.807 1.164 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.989 -8.414 0.995 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.684 -7.626 2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -4.485 -9.223 0.404 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.508 -7.923 -0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.803 -9.540 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -4.034 -9.991 2.703 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.335 -10.339 2.305 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.727 -9.255 3.660 1.00 0.00 H new ATOM 1869 N ILE A 123 1.440 -8.296 2.996 1.00 0.00 N ATOM 1870 CA ILE A 123 2.569 -9.210 3.103 1.00 0.00 C ATOM 1871 C ILE A 123 2.596 -9.927 4.455 1.00 0.00 C ATOM 1872 O ILE A 123 2.876 -11.123 4.528 1.00 0.00 O ATOM 1873 CB ILE A 123 3.890 -8.441 2.881 1.00 0.00 C ATOM 1874 CG1 ILE A 123 4.109 -8.239 1.375 1.00 0.00 C ATOM 1875 CG2 ILE A 123 5.061 -9.157 3.544 1.00 0.00 C ATOM 1876 CD1 ILE A 123 5.556 -8.125 0.951 1.00 0.00 C ATOM 0 H ILE A 123 1.703 -7.329 2.806 1.00 0.00 H new ATOM 0 HA ILE A 123 2.456 -9.971 2.331 1.00 0.00 H new ATOM 0 HB ILE A 123 3.825 -7.461 3.353 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.654 -9.074 0.841 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.582 -7.337 1.064 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.977 -8.593 3.371 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.880 -9.235 4.616 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.164 -10.156 3.120 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.609 -7.985 -0.129 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.015 -7.272 1.451 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.088 -9.036 1.225 1.00 0.00 H new ATOM 1888 N GLU A 124 2.315 -9.186 5.515 1.00 0.00 N ATOM 1889 CA GLU A 124 2.313 -9.737 6.869 1.00 0.00 C ATOM 1890 C GLU A 124 1.382 -10.947 7.009 1.00 0.00 C ATOM 1891 O GLU A 124 1.454 -11.676 7.998 1.00 0.00 O ATOM 1892 CB GLU A 124 1.914 -8.656 7.879 1.00 0.00 C ATOM 1893 CG GLU A 124 0.462 -8.222 7.774 1.00 0.00 C ATOM 1894 CD GLU A 124 0.208 -6.878 8.426 1.00 0.00 C ATOM 1895 OE1 GLU A 124 0.171 -6.820 9.673 1.00 0.00 O ATOM 1896 OE2 GLU A 124 0.043 -5.882 7.690 1.00 0.00 O ATOM 0 H GLU A 124 2.083 -8.194 5.467 1.00 0.00 H new ATOM 0 HA GLU A 124 3.327 -10.080 7.075 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.100 -9.028 8.887 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.554 -7.786 7.737 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.177 -8.172 6.723 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.173 -8.974 8.241 1.00 0.00 H new ATOM 1903 N SER A 125 0.485 -11.137 6.044 1.00 0.00 N ATOM 1904 CA SER A 125 -0.480 -12.236 6.100 1.00 0.00 C ATOM 1905 C SER A 125 0.108 -13.575 5.647 1.00 0.00 C ATOM 1906 O SER A 125 -0.631 -14.539 5.448 1.00 0.00 O ATOM 1907 CB SER A 125 -1.706 -11.897 5.252 1.00 0.00 C ATOM 1908 OG SER A 125 -1.892 -10.495 5.163 1.00 0.00 O ATOM 0 H SER A 125 0.405 -10.547 5.216 1.00 0.00 H new ATOM 0 HA SER A 125 -0.764 -12.351 7.146 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.588 -12.316 4.253 1.00 0.00 H new ATOM 0 HB3 SER A 125 -2.592 -12.358 5.688 1.00 0.00 H new ATOM 0 HG SER A 125 -1.269 -10.123 4.504 1.00 0.00 H new ATOM 1914 N GLY A 126 1.425 -13.643 5.488 1.00 0.00 N ATOM 1915 CA GLY A 126 2.049 -14.886 5.064 1.00 0.00 C ATOM 1916 C GLY A 126 2.756 -14.749 3.733 1.00 0.00 C ATOM 1917 O GLY A 126 3.947 -14.444 3.689 1.00 0.00 O ATOM 0 H GLY A 126 2.069 -12.867 5.643 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.764 -15.208 5.821 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.290 -15.665 4.991 1.00 0.00 H new ATOM 1921 N MET A 127 2.022 -14.967 2.644 1.00 0.00 N ATOM 1922 CA MET A 127 2.599 -14.852 1.307 1.00 0.00 C ATOM 1923 C MET A 127 3.058 -13.418 1.068 1.00 0.00 C ATOM 1924 O MET A 127 2.367 -12.625 0.439 1.00 0.00 O ATOM 1925 CB MET A 127 1.603 -15.286 0.218 1.00 0.00 C ATOM 1926 CG MET A 127 0.136 -15.037 0.551 1.00 0.00 C ATOM 1927 SD MET A 127 -0.907 -15.001 -0.922 1.00 0.00 S ATOM 1928 CE MET A 127 -2.244 -13.934 -0.387 1.00 0.00 C ATOM 0 H MET A 127 1.035 -15.222 2.660 1.00 0.00 H new ATOM 0 HA MET A 127 3.456 -15.522 1.248 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.845 -14.760 -0.705 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.741 -16.350 0.024 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.218 -15.817 1.225 1.00 0.00 H new ATOM 0 HG3 MET A 127 0.042 -14.090 1.082 1.00 0.00 H new ATOM 0 HE1 MET A 127 -3.149 -14.526 -0.251 1.00 0.00 H new ATOM 0 HE2 MET A 127 -1.975 -13.459 0.557 1.00 0.00 H new ATOM 0 HE3 MET A 127 -2.422 -13.167 -1.141 1.00 0.00 H new ATOM 1938 N LYS A 128 4.217 -13.090 1.618 1.00 0.00 N ATOM 1939 CA LYS A 128 4.775 -11.747 1.522 1.00 0.00 C ATOM 1940 C LYS A 128 5.080 -11.329 0.086 1.00 0.00 C ATOM 1941 O LYS A 128 4.437 -10.432 -0.461 1.00 0.00 O ATOM 1942 CB LYS A 128 6.075 -11.703 2.335 1.00 0.00 C ATOM 1943 CG LYS A 128 5.939 -12.271 3.739 1.00 0.00 C ATOM 1944 CD LYS A 128 6.852 -11.553 4.720 1.00 0.00 C ATOM 1945 CE LYS A 128 7.186 -12.432 5.914 1.00 0.00 C ATOM 1946 NZ LYS A 128 5.975 -12.773 6.709 1.00 0.00 N ATOM 0 H LYS A 128 4.797 -13.745 2.143 1.00 0.00 H new ATOM 0 HA LYS A 128 4.029 -11.052 1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 128 6.846 -12.259 1.801 1.00 0.00 H new ATOM 0 HB3 LYS A 128 6.416 -10.670 2.402 1.00 0.00 H new ATOM 0 HG2 LYS A 128 4.904 -12.181 4.070 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.179 -13.334 3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 128 7.772 -11.259 4.214 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.371 -10.638 5.064 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.663 -13.349 5.568 1.00 0.00 H new ATOM 0 HE3 LYS A 128 7.906 -11.920 6.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.252 -13.331 7.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.505 -11.898 7.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.320 -13.329 6.123 1.00 0.00 H new ATOM 1960 N TYR A 129 6.061 -11.971 -0.516 1.00 0.00 N ATOM 1961 CA TYR A 129 6.454 -11.651 -1.879 1.00 0.00 C ATOM 1962 C TYR A 129 5.428 -12.187 -2.870 1.00 0.00 C ATOM 1963 O TYR A 129 5.214 -11.615 -3.940 1.00 0.00 O ATOM 1964 CB TYR A 129 7.839 -12.239 -2.147 1.00 0.00 C ATOM 1965 CG TYR A 129 8.472 -11.806 -3.450 1.00 0.00 C ATOM 1966 CD1 TYR A 129 8.286 -10.524 -3.948 1.00 0.00 C ATOM 1967 CD2 TYR A 129 9.273 -12.680 -4.176 1.00 0.00 C ATOM 1968 CE1 TYR A 129 8.877 -10.127 -5.134 1.00 0.00 C ATOM 1969 CE2 TYR A 129 9.864 -12.291 -5.361 1.00 0.00 C ATOM 1970 CZ TYR A 129 9.663 -11.014 -5.836 1.00 0.00 C ATOM 1971 OH TYR A 129 10.253 -10.621 -7.016 1.00 0.00 O ATOM 0 H TYR A 129 6.603 -12.719 -0.084 1.00 0.00 H new ATOM 0 HA TYR A 129 6.496 -10.569 -2.005 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.501 -11.960 -1.328 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.764 -13.326 -2.140 1.00 0.00 H new ATOM 0 HD1 TYR A 129 7.670 -9.825 -3.401 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.436 -13.682 -3.806 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.723 -9.126 -5.508 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.481 -12.985 -5.913 1.00 0.00 H new ATOM 0 HH TYR A 129 10.775 -11.364 -7.384 1.00 0.00 H new ATOM 1981 N GLU A 130 4.794 -13.288 -2.493 1.00 0.00 N ATOM 1982 CA GLU A 130 3.785 -13.923 -3.329 1.00 0.00 C ATOM 1983 C GLU A 130 2.484 -13.122 -3.369 1.00 0.00 C ATOM 1984 O GLU A 130 1.924 -12.906 -4.442 1.00 0.00 O ATOM 1985 CB GLU A 130 3.506 -15.342 -2.832 1.00 0.00 C ATOM 1986 CG GLU A 130 4.505 -16.370 -3.340 1.00 0.00 C ATOM 1987 CD GLU A 130 4.806 -17.445 -2.316 1.00 0.00 C ATOM 1988 OE1 GLU A 130 3.852 -17.961 -1.697 1.00 0.00 O ATOM 1989 OE2 GLU A 130 5.999 -17.771 -2.130 1.00 0.00 O ATOM 0 H GLU A 130 4.962 -13.763 -1.606 1.00 0.00 H new ATOM 0 HA GLU A 130 4.181 -13.960 -4.344 1.00 0.00 H new ATOM 0 HB2 GLU A 130 3.516 -15.345 -1.742 1.00 0.00 H new ATOM 0 HB3 GLU A 130 2.504 -15.637 -3.143 1.00 0.00 H new ATOM 0 HG2 GLU A 130 4.114 -16.835 -4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 130 5.431 -15.866 -3.615 1.00 0.00 H new ATOM 1996 N ASP A 131 1.993 -12.691 -2.206 1.00 0.00 N ATOM 1997 CA ASP A 131 0.743 -11.932 -2.159 1.00 0.00 C ATOM 1998 C ASP A 131 0.908 -10.559 -2.777 1.00 0.00 C ATOM 1999 O ASP A 131 0.079 -10.122 -3.570 1.00 0.00 O ATOM 2000 CB ASP A 131 0.248 -11.767 -0.723 1.00 0.00 C ATOM 2001 CG ASP A 131 -1.151 -11.186 -0.657 1.00 0.00 C ATOM 2002 OD1 ASP A 131 -1.821 -11.129 -1.710 1.00 0.00 O ATOM 2003 OD2 ASP A 131 -1.578 -10.789 0.448 1.00 0.00 O ATOM 0 H ASP A 131 2.432 -12.851 -1.299 1.00 0.00 H new ATOM 0 HA ASP A 131 0.010 -12.500 -2.732 1.00 0.00 H new ATOM 0 HB2 ASP A 131 0.260 -12.736 -0.224 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.934 -11.119 -0.177 1.00 0.00 H new ATOM 2008 N ALA A 132 1.969 -9.869 -2.396 1.00 0.00 N ATOM 2009 CA ALA A 132 2.209 -8.534 -2.905 1.00 0.00 C ATOM 2010 C ALA A 132 2.330 -8.517 -4.423 1.00 0.00 C ATOM 2011 O ALA A 132 1.682 -7.714 -5.084 1.00 0.00 O ATOM 2012 CB ALA A 132 3.446 -7.937 -2.264 1.00 0.00 C ATOM 0 H ALA A 132 2.672 -10.210 -1.741 1.00 0.00 H new ATOM 0 HA ALA A 132 1.346 -7.923 -2.642 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.612 -6.934 -2.658 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.307 -7.885 -1.184 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.310 -8.562 -2.489 1.00 0.00 H new ATOM 2018 N ILE A 133 3.161 -9.392 -4.978 1.00 0.00 N ATOM 2019 CA ILE A 133 3.344 -9.433 -6.425 1.00 0.00 C ATOM 2020 C ILE A 133 2.127 -10.022 -7.142 1.00 0.00 C ATOM 2021 O ILE A 133 1.784 -9.588 -8.238 1.00 0.00 O ATOM 2022 CB ILE A 133 4.607 -10.230 -6.817 1.00 0.00 C ATOM 2023 CG1 ILE A 133 5.823 -9.700 -6.059 1.00 0.00 C ATOM 2024 CG2 ILE A 133 4.840 -10.156 -8.321 1.00 0.00 C ATOM 2025 CD1 ILE A 133 6.173 -8.268 -6.402 1.00 0.00 C ATOM 0 H ILE A 133 3.712 -10.074 -4.457 1.00 0.00 H new ATOM 0 HA ILE A 133 3.466 -8.398 -6.744 1.00 0.00 H new ATOM 0 HB ILE A 133 4.457 -11.275 -6.545 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.633 -9.772 -4.988 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.681 -10.337 -6.274 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.734 -10.723 -8.579 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.981 -10.576 -8.843 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.972 -9.116 -8.618 1.00 0.00 H new ATOM 0 HD11 ILE A 133 7.046 -7.959 -5.827 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.395 -8.193 -7.467 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.331 -7.620 -6.160 1.00 0.00 H new ATOM 2037 N GLN A 134 1.484 -11.014 -6.534 1.00 0.00 N ATOM 2038 CA GLN A 134 0.320 -11.651 -7.151 1.00 0.00 C ATOM 2039 C GLN A 134 -0.926 -10.766 -7.090 1.00 0.00 C ATOM 2040 O GLN A 134 -1.605 -10.571 -8.101 1.00 0.00 O ATOM 2041 CB GLN A 134 0.029 -12.994 -6.480 1.00 0.00 C ATOM 2042 CG GLN A 134 1.066 -14.063 -6.783 1.00 0.00 C ATOM 2043 CD GLN A 134 0.813 -15.351 -6.024 1.00 0.00 C ATOM 2044 OE1 GLN A 134 1.034 -15.427 -4.816 1.00 0.00 O ATOM 2045 NE2 GLN A 134 0.345 -16.372 -6.732 1.00 0.00 N ATOM 0 H GLN A 134 1.744 -11.393 -5.623 1.00 0.00 H new ATOM 0 HA GLN A 134 0.564 -11.809 -8.201 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -0.025 -12.848 -5.401 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -0.950 -13.348 -6.803 1.00 0.00 H new ATOM 0 HG2 GLN A 134 1.067 -14.270 -7.853 1.00 0.00 H new ATOM 0 HG3 GLN A 134 2.057 -13.685 -6.530 1.00 0.00 H new ATOM 0 HE21 GLN A 134 0.176 -16.264 -7.732 1.00 0.00 H new ATOM 0 HE22 GLN A 134 0.154 -17.264 -6.276 1.00 0.00 H new ATOM 2054 N PHE A 135 -1.232 -10.240 -5.908 1.00 0.00 N ATOM 2055 CA PHE A 135 -2.410 -9.392 -5.742 1.00 0.00 C ATOM 2056 C PHE A 135 -2.219 -8.054 -6.450 1.00 0.00 C ATOM 2057 O PHE A 135 -3.159 -7.513 -7.033 1.00 0.00 O ATOM 2058 CB PHE A 135 -2.716 -9.180 -4.249 1.00 0.00 C ATOM 2059 CG PHE A 135 -4.071 -9.679 -3.804 1.00 0.00 C ATOM 2060 CD1 PHE A 135 -4.745 -10.670 -4.507 1.00 0.00 C ATOM 2061 CD2 PHE A 135 -4.670 -9.152 -2.670 1.00 0.00 C ATOM 2062 CE1 PHE A 135 -5.983 -11.117 -4.089 1.00 0.00 C ATOM 2063 CE2 PHE A 135 -5.907 -9.596 -2.248 1.00 0.00 C ATOM 2064 CZ PHE A 135 -6.564 -10.579 -2.959 1.00 0.00 C ATOM 0 H PHE A 135 -0.687 -10.383 -5.058 1.00 0.00 H new ATOM 0 HA PHE A 135 -3.262 -9.897 -6.198 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -1.948 -9.682 -3.660 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -2.645 -8.116 -4.025 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.295 -11.096 -5.392 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -4.161 -8.383 -2.108 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -6.496 -11.887 -4.646 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -6.360 -9.175 -1.363 1.00 0.00 H new ATOM 0 HZ PHE A 135 -7.532 -10.927 -2.631 1.00 0.00 H new ATOM 2074 N ILE A 136 -1.001 -7.526 -6.403 1.00 0.00 N ATOM 2075 CA ILE A 136 -0.701 -6.257 -7.052 1.00 0.00 C ATOM 2076 C ILE A 136 -0.614 -6.412 -8.570 1.00 0.00 C ATOM 2077 O ILE A 136 -0.881 -5.471 -9.312 1.00 0.00 O ATOM 2078 CB ILE A 136 0.610 -5.639 -6.514 1.00 0.00 C ATOM 2079 CG1 ILE A 136 0.571 -4.117 -6.642 1.00 0.00 C ATOM 2080 CG2 ILE A 136 1.824 -6.205 -7.241 1.00 0.00 C ATOM 2081 CD1 ILE A 136 1.371 -3.406 -5.574 1.00 0.00 C ATOM 0 H ILE A 136 -0.209 -7.955 -5.924 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.524 -5.582 -6.817 1.00 0.00 H new ATOM 0 HB ILE A 136 0.699 -5.900 -5.460 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.953 -3.832 -7.622 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.465 -3.782 -6.594 1.00 0.00 H new ATOM 0 HG21 ILE A 136 2.731 -5.752 -6.841 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.864 -7.285 -7.097 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.746 -5.984 -8.305 1.00 0.00 H new ATOM 0 HD11 ILE A 136 1.301 -2.329 -5.723 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.975 -3.663 -4.591 1.00 0.00 H new ATOM 0 HD13 ILE A 136 2.415 -3.714 -5.636 1.00 0.00 H new ATOM 2093 N ARG A 137 -0.231 -7.604 -9.026 1.00 0.00 N ATOM 2094 CA ARG A 137 -0.109 -7.867 -10.457 1.00 0.00 C ATOM 2095 C ARG A 137 -1.479 -7.893 -11.125 1.00 0.00 C ATOM 2096 O ARG A 137 -1.680 -7.275 -12.170 1.00 0.00 O ATOM 2097 CB ARG A 137 0.624 -9.187 -10.706 1.00 0.00 C ATOM 2098 CG ARG A 137 0.792 -9.522 -12.178 1.00 0.00 C ATOM 2099 CD ARG A 137 -0.313 -10.439 -12.674 1.00 0.00 C ATOM 2100 NE ARG A 137 0.027 -11.849 -12.500 1.00 0.00 N ATOM 2101 CZ ARG A 137 -0.529 -12.838 -13.198 1.00 0.00 C ATOM 2102 NH1 ARG A 137 -1.455 -12.577 -14.113 1.00 0.00 N ATOM 2103 NH2 ARG A 137 -0.159 -14.092 -12.978 1.00 0.00 N ATOM 0 H ARG A 137 -0.001 -8.398 -8.428 1.00 0.00 H new ATOM 0 HA ARG A 137 0.474 -7.057 -10.896 1.00 0.00 H new ATOM 0 HB2 ARG A 137 1.607 -9.140 -10.238 1.00 0.00 H new ATOM 0 HB3 ARG A 137 0.077 -9.994 -10.219 1.00 0.00 H new ATOM 0 HG2 ARG A 137 0.792 -8.602 -12.763 1.00 0.00 H new ATOM 0 HG3 ARG A 137 1.759 -9.999 -12.335 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -1.235 -10.219 -12.136 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -0.504 -10.239 -13.728 1.00 0.00 H new ATOM 0 HE ARG A 137 0.732 -12.090 -11.803 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -1.745 -11.614 -14.285 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -1.877 -13.339 -14.644 1.00 0.00 H new ATOM 0 HH21 ARG A 137 0.551 -14.298 -12.275 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -0.584 -14.850 -13.512 1.00 0.00 H new ATOM 2117 N GLN A 138 -2.425 -8.603 -10.514 1.00 0.00 N ATOM 2118 CA GLN A 138 -3.777 -8.689 -11.060 1.00 0.00 C ATOM 2119 C GLN A 138 -4.393 -7.296 -11.152 1.00 0.00 C ATOM 2120 O GLN A 138 -5.041 -6.951 -12.140 1.00 0.00 O ATOM 2121 CB GLN A 138 -4.648 -9.597 -10.186 1.00 0.00 C ATOM 2122 CG GLN A 138 -5.112 -10.859 -10.895 1.00 0.00 C ATOM 2123 CD GLN A 138 -6.356 -10.632 -11.732 1.00 0.00 C ATOM 2124 OE1 GLN A 138 -6.280 -10.494 -12.952 1.00 0.00 O ATOM 2125 NE2 GLN A 138 -7.510 -10.592 -11.077 1.00 0.00 N ATOM 0 H GLN A 138 -2.282 -9.123 -9.648 1.00 0.00 H new ATOM 0 HA GLN A 138 -3.724 -9.118 -12.061 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -4.087 -9.876 -9.294 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.521 -9.037 -9.851 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.310 -11.228 -11.535 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -5.312 -11.634 -10.156 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -7.526 -10.711 -10.064 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -8.381 -10.442 -11.587 1.00 0.00 H new ATOM 2134 N LYS A 139 -4.164 -6.500 -10.116 1.00 0.00 N ATOM 2135 CA LYS A 139 -4.666 -5.133 -10.057 1.00 0.00 C ATOM 2136 C LYS A 139 -3.678 -4.181 -10.724 1.00 0.00 C ATOM 2137 O LYS A 139 -2.481 -4.456 -10.768 1.00 0.00 O ATOM 2138 CB LYS A 139 -4.906 -4.714 -8.604 1.00 0.00 C ATOM 2139 CG LYS A 139 -6.357 -4.375 -8.301 1.00 0.00 C ATOM 2140 CD LYS A 139 -7.041 -5.491 -7.527 1.00 0.00 C ATOM 2141 CE LYS A 139 -7.836 -6.401 -8.449 1.00 0.00 C ATOM 2142 NZ LYS A 139 -8.111 -7.723 -7.822 1.00 0.00 N ATOM 0 H LYS A 139 -3.627 -6.782 -9.296 1.00 0.00 H new ATOM 0 HA LYS A 139 -5.614 -5.087 -10.592 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -4.584 -5.520 -7.944 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -4.284 -3.848 -8.377 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -6.403 -3.451 -7.725 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -6.892 -4.197 -9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -6.293 -6.076 -6.993 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -7.705 -5.061 -6.777 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -8.779 -5.920 -8.710 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -7.285 -6.547 -9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -8.655 -8.314 -8.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -7.212 -8.194 -7.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -8.659 -7.586 -6.949 1.00 0.00 H new ATOM 2156 N ARG A 140 -4.174 -3.068 -11.250 1.00 0.00 N ATOM 2157 CA ARG A 140 -3.304 -2.103 -11.911 1.00 0.00 C ATOM 2158 C ARG A 140 -2.462 -1.364 -10.879 1.00 0.00 C ATOM 2159 O ARG A 140 -2.990 -0.681 -10.004 1.00 0.00 O ATOM 2160 CB ARG A 140 -4.132 -1.104 -12.722 1.00 0.00 C ATOM 2161 CG ARG A 140 -3.464 -0.665 -14.017 1.00 0.00 C ATOM 2162 CD ARG A 140 -2.305 0.286 -13.756 1.00 0.00 C ATOM 2163 NE ARG A 140 -2.647 1.671 -14.069 1.00 0.00 N ATOM 2164 CZ ARG A 140 -2.950 2.103 -15.291 1.00 0.00 C ATOM 2165 NH1 ARG A 140 -2.948 1.263 -16.319 1.00 0.00 N ATOM 2166 NH2 ARG A 140 -3.252 3.379 -15.487 1.00 0.00 N ATOM 0 H ARG A 140 -5.161 -2.813 -11.233 1.00 0.00 H new ATOM 0 HA ARG A 140 -2.643 -2.641 -12.590 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -5.098 -1.551 -12.955 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -4.328 -0.225 -12.108 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -3.102 -1.541 -14.555 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -4.198 -0.177 -14.658 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -2.007 0.215 -12.710 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.446 -0.018 -14.354 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.654 2.348 -13.306 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -2.713 0.281 -16.175 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.181 1.600 -17.253 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.252 4.030 -14.701 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -3.484 3.710 -16.423 1.00 0.00 H new ATOM 2180 N ARG A 141 -1.145 -1.528 -10.982 1.00 0.00 N ATOM 2181 CA ARG A 141 -0.209 -0.899 -10.055 1.00 0.00 C ATOM 2182 C ARG A 141 0.660 0.135 -10.764 1.00 0.00 C ATOM 2183 O ARG A 141 0.755 0.143 -11.992 1.00 0.00 O ATOM 2184 CB ARG A 141 0.680 -1.962 -9.407 1.00 0.00 C ATOM 2185 CG ARG A 141 1.652 -2.609 -10.379 1.00 0.00 C ATOM 2186 CD ARG A 141 1.964 -4.043 -9.989 1.00 0.00 C ATOM 2187 NE ARG A 141 2.264 -4.872 -11.156 1.00 0.00 N ATOM 2188 CZ ARG A 141 3.101 -5.908 -11.141 1.00 0.00 C ATOM 2189 NH1 ARG A 141 3.728 -6.255 -10.024 1.00 0.00 N ATOM 2190 NH2 ARG A 141 3.312 -6.602 -12.253 1.00 0.00 N ATOM 0 H ARG A 141 -0.700 -2.095 -11.704 1.00 0.00 H new ATOM 0 HA ARG A 141 -0.789 -0.389 -9.286 1.00 0.00 H new ATOM 0 HB2 ARG A 141 1.242 -1.507 -8.591 1.00 0.00 H new ATOM 0 HB3 ARG A 141 0.049 -2.734 -8.967 1.00 0.00 H new ATOM 0 HG2 ARG A 141 1.230 -2.589 -11.384 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.576 -2.031 -10.409 1.00 0.00 H new ATOM 0 HD2 ARG A 141 2.813 -4.057 -9.306 1.00 0.00 H new ATOM 0 HD3 ARG A 141 1.115 -4.466 -9.452 1.00 0.00 H new ATOM 0 HE ARG A 141 1.803 -4.642 -12.037 1.00 0.00 H new ATOM 0 HH11 ARG A 141 3.571 -5.727 -9.166 1.00 0.00 H new ATOM 0 HH12 ARG A 141 4.367 -7.050 -10.024 1.00 0.00 H new ATOM 0 HH21 ARG A 141 2.834 -6.341 -13.115 1.00 0.00 H new ATOM 0 HH22 ARG A 141 3.952 -7.396 -12.245 1.00 0.00 H new ATOM 2204 N GLY A 142 1.302 0.999 -9.981 1.00 0.00 N ATOM 2205 CA GLY A 142 2.168 2.015 -10.551 1.00 0.00 C ATOM 2206 C GLY A 142 3.277 1.409 -11.390 1.00 0.00 C ATOM 2207 O GLY A 142 3.197 0.243 -11.776 1.00 0.00 O ATOM 0 H GLY A 142 1.237 1.013 -8.963 1.00 0.00 H new ATOM 0 HA2 GLY A 142 1.576 2.692 -11.167 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.604 2.611 -9.750 1.00 0.00 H new ATOM 2211 N ALA A 143 4.315 2.189 -11.679 1.00 0.00 N ATOM 2212 CA ALA A 143 5.422 1.685 -12.481 1.00 0.00 C ATOM 2213 C ALA A 143 6.507 1.058 -11.607 1.00 0.00 C ATOM 2214 O ALA A 143 7.343 1.761 -11.038 1.00 0.00 O ATOM 2215 CB ALA A 143 6.010 2.808 -13.324 1.00 0.00 C ATOM 0 H ALA A 143 4.412 3.158 -11.375 1.00 0.00 H new ATOM 0 HA ALA A 143 5.033 0.907 -13.138 1.00 0.00 H new ATOM 0 HB1 ALA A 143 6.837 2.421 -13.920 1.00 0.00 H new ATOM 0 HB2 ALA A 143 5.241 3.207 -13.986 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.374 3.601 -12.671 1.00 0.00 H new ATOM 2221 N ILE A 144 6.502 -0.271 -11.527 1.00 0.00 N ATOM 2222 CA ILE A 144 7.499 -1.001 -10.746 1.00 0.00 C ATOM 2223 C ILE A 144 8.733 -1.295 -11.596 1.00 0.00 C ATOM 2224 O ILE A 144 8.668 -2.115 -12.513 1.00 0.00 O ATOM 2225 CB ILE A 144 6.924 -2.328 -10.205 1.00 0.00 C ATOM 2226 CG1 ILE A 144 6.308 -3.156 -11.345 1.00 0.00 C ATOM 2227 CG2 ILE A 144 5.896 -2.055 -9.113 1.00 0.00 C ATOM 2228 CD1 ILE A 144 4.810 -2.986 -11.510 1.00 0.00 C ATOM 0 H ILE A 144 5.817 -0.865 -11.994 1.00 0.00 H new ATOM 0 HA ILE A 144 7.780 -0.371 -9.902 1.00 0.00 H new ATOM 0 HB ILE A 144 7.738 -2.908 -9.770 1.00 0.00 H new ATOM 0 HG12 ILE A 144 6.797 -2.883 -12.280 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.524 -4.210 -11.169 1.00 0.00 H new ATOM 0 HG21 ILE A 144 5.500 -3.000 -8.742 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.370 -1.514 -8.294 1.00 0.00 H new ATOM 0 HG23 ILE A 144 5.082 -1.456 -9.521 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.462 -3.606 -12.336 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.306 -3.288 -10.592 1.00 0.00 H new ATOM 0 HD13 ILE A 144 4.583 -1.941 -11.721 1.00 0.00 H new ATOM 2240 N ASN A 145 9.856 -0.631 -11.321 1.00 0.00 N ATOM 2241 CA ASN A 145 11.054 -0.872 -12.122 1.00 0.00 C ATOM 2242 C ASN A 145 12.197 -1.531 -11.344 1.00 0.00 C ATOM 2243 O ASN A 145 12.457 -2.723 -11.508 1.00 0.00 O ATOM 2244 CB ASN A 145 11.542 0.446 -12.730 1.00 0.00 C ATOM 2245 CG ASN A 145 11.530 0.424 -14.247 1.00 0.00 C ATOM 2246 OD1 ASN A 145 10.628 -0.145 -14.864 1.00 0.00 O ATOM 2247 ND2 ASN A 145 12.534 1.043 -14.855 1.00 0.00 N ATOM 0 H ASN A 145 9.961 0.056 -10.575 1.00 0.00 H new ATOM 0 HA ASN A 145 10.764 -1.576 -12.902 1.00 0.00 H new ATOM 0 HB2 ASN A 145 10.911 1.261 -12.376 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.554 0.651 -12.381 1.00 0.00 H new ATOM 0 HD21 ASN A 145 12.580 1.061 -15.874 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.259 1.501 -14.304 1.00 0.00 H new ATOM 2254 N SER A 146 12.908 -0.746 -10.534 1.00 0.00 N ATOM 2255 CA SER A 146 14.053 -1.268 -9.785 1.00 0.00 C ATOM 2256 C SER A 146 13.765 -1.591 -8.317 1.00 0.00 C ATOM 2257 O SER A 146 13.949 -2.723 -7.874 1.00 0.00 O ATOM 2258 CB SER A 146 15.212 -0.273 -9.862 1.00 0.00 C ATOM 2259 OG SER A 146 15.865 -0.348 -11.119 1.00 0.00 O ATOM 0 H SER A 146 12.715 0.244 -10.380 1.00 0.00 H new ATOM 0 HA SER A 146 14.306 -2.217 -10.259 1.00 0.00 H new ATOM 0 HB2 SER A 146 14.839 0.738 -9.702 1.00 0.00 H new ATOM 0 HB3 SER A 146 15.926 -0.479 -9.065 1.00 0.00 H new ATOM 0 HG SER A 146 16.601 0.299 -11.144 1.00 0.00 H new ATOM 2265 N LYS A 147 13.383 -0.567 -7.556 1.00 0.00 N ATOM 2266 CA LYS A 147 13.152 -0.709 -6.117 1.00 0.00 C ATOM 2267 C LYS A 147 11.999 -1.637 -5.757 1.00 0.00 C ATOM 2268 O LYS A 147 12.126 -2.447 -4.849 1.00 0.00 O ATOM 2269 CB LYS A 147 12.909 0.660 -5.481 1.00 0.00 C ATOM 2270 CG LYS A 147 13.335 0.739 -4.020 1.00 0.00 C ATOM 2271 CD LYS A 147 12.244 0.236 -3.083 1.00 0.00 C ATOM 2272 CE LYS A 147 12.720 0.208 -1.635 1.00 0.00 C ATOM 2273 NZ LYS A 147 11.587 0.084 -0.670 1.00 0.00 N ATOM 0 H LYS A 147 13.226 0.375 -7.913 1.00 0.00 H new ATOM 0 HA LYS A 147 14.059 -1.167 -5.722 1.00 0.00 H new ATOM 0 HB2 LYS A 147 13.450 1.416 -6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 147 11.849 0.903 -5.555 1.00 0.00 H new ATOM 0 HG2 LYS A 147 14.240 0.150 -3.873 1.00 0.00 H new ATOM 0 HG3 LYS A 147 13.582 1.770 -3.769 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.367 0.878 -3.166 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.936 -0.765 -3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 147 13.406 -0.628 -1.496 1.00 0.00 H new ATOM 0 HE3 LYS A 147 13.279 1.119 -1.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 11.952 0.137 0.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 10.910 0.857 -0.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.109 -0.829 -0.811 1.00 0.00 H new ATOM 2287 N GLN A 148 10.866 -1.489 -6.417 1.00 0.00 N ATOM 2288 CA GLN A 148 9.693 -2.292 -6.084 1.00 0.00 C ATOM 2289 C GLN A 148 9.950 -3.800 -6.149 1.00 0.00 C ATOM 2290 O GLN A 148 9.651 -4.524 -5.195 1.00 0.00 O ATOM 2291 CB GLN A 148 8.539 -1.921 -7.007 1.00 0.00 C ATOM 2292 CG GLN A 148 7.741 -0.728 -6.511 1.00 0.00 C ATOM 2293 CD GLN A 148 7.597 0.359 -7.559 1.00 0.00 C ATOM 2294 OE1 GLN A 148 6.379 0.547 -8.055 1.00 0.00 O flip ATOM 2295 NE2 GLN A 148 8.568 1.023 -7.917 1.00 0.00 N flip ATOM 0 H GLN A 148 10.728 -0.828 -7.181 1.00 0.00 H new ATOM 0 HA GLN A 148 9.440 -2.066 -5.048 1.00 0.00 H new ATOM 0 HB2 GLN A 148 8.932 -1.701 -8.000 1.00 0.00 H new ATOM 0 HB3 GLN A 148 7.874 -2.778 -7.110 1.00 0.00 H new ATOM 0 HG2 GLN A 148 6.751 -1.062 -6.202 1.00 0.00 H new ATOM 0 HG3 GLN A 148 8.227 -0.313 -5.628 1.00 0.00 H new ATOM 0 HE21 GLN A 148 9.486 0.845 -7.509 1.00 0.00 H new ATOM 0 HE22 GLN A 148 8.456 1.752 -8.622 1.00 0.00 H new ATOM 2304 N LEU A 149 10.487 -4.282 -7.263 1.00 0.00 N ATOM 2305 CA LEU A 149 10.744 -5.713 -7.411 1.00 0.00 C ATOM 2306 C LEU A 149 11.966 -6.160 -6.610 1.00 0.00 C ATOM 2307 O LEU A 149 11.978 -7.257 -6.050 1.00 0.00 O ATOM 2308 CB LEU A 149 10.910 -6.081 -8.887 1.00 0.00 C ATOM 2309 CG LEU A 149 9.646 -6.628 -9.559 1.00 0.00 C ATOM 2310 CD1 LEU A 149 9.070 -7.795 -8.764 1.00 0.00 C ATOM 2311 CD2 LEU A 149 8.610 -5.523 -9.715 1.00 0.00 C ATOM 0 H LEU A 149 10.751 -3.714 -8.068 1.00 0.00 H new ATOM 0 HA LEU A 149 9.878 -6.240 -7.010 1.00 0.00 H new ATOM 0 HB2 LEU A 149 11.241 -5.197 -9.432 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.702 -6.825 -8.975 1.00 0.00 H new ATOM 0 HG LEU A 149 9.915 -6.995 -10.549 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.174 -8.166 -9.261 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.809 -8.594 -8.704 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.815 -7.460 -7.759 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.718 -5.926 -10.194 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.348 -5.128 -8.733 1.00 0.00 H new ATOM 0 HD23 LEU A 149 9.022 -4.723 -10.330 1.00 0.00 H new ATOM 2323 N THR A 150 12.991 -5.318 -6.557 1.00 0.00 N ATOM 2324 CA THR A 150 14.206 -5.652 -5.821 1.00 0.00 C ATOM 2325 C THR A 150 13.962 -5.606 -4.313 1.00 0.00 C ATOM 2326 O THR A 150 14.501 -6.419 -3.561 1.00 0.00 O ATOM 2327 CB THR A 150 15.345 -4.700 -6.203 1.00 0.00 C ATOM 2328 OG1 THR A 150 16.598 -5.242 -5.824 1.00 0.00 O ATOM 2329 CG2 THR A 150 15.231 -3.328 -5.571 1.00 0.00 C ATOM 0 H THR A 150 13.007 -4.405 -7.011 1.00 0.00 H new ATOM 0 HA THR A 150 14.494 -6.668 -6.090 1.00 0.00 H new ATOM 0 HB THR A 150 15.269 -4.587 -7.284 1.00 0.00 H new ATOM 0 HG1 THR A 150 17.313 -4.621 -6.077 1.00 0.00 H new ATOM 0 HG21 THR A 150 16.072 -2.711 -5.887 1.00 0.00 H new ATOM 0 HG22 THR A 150 14.298 -2.859 -5.885 1.00 0.00 H new ATOM 0 HG23 THR A 150 15.241 -3.426 -4.485 1.00 0.00 H new ATOM 2337 N TYR A 151 13.148 -4.649 -3.882 1.00 0.00 N ATOM 2338 CA TYR A 151 12.836 -4.495 -2.466 1.00 0.00 C ATOM 2339 C TYR A 151 12.049 -5.695 -1.956 1.00 0.00 C ATOM 2340 O TYR A 151 12.402 -6.288 -0.934 1.00 0.00 O ATOM 2341 CB TYR A 151 12.051 -3.192 -2.234 1.00 0.00 C ATOM 2342 CG TYR A 151 10.889 -3.312 -1.272 1.00 0.00 C ATOM 2343 CD1 TYR A 151 11.069 -3.798 0.018 1.00 0.00 C ATOM 2344 CD2 TYR A 151 9.610 -2.940 -1.661 1.00 0.00 C ATOM 2345 CE1 TYR A 151 10.005 -3.909 0.891 1.00 0.00 C ATOM 2346 CE2 TYR A 151 8.542 -3.047 -0.797 1.00 0.00 C ATOM 2347 CZ TYR A 151 8.745 -3.532 0.480 1.00 0.00 C ATOM 2348 OH TYR A 151 7.683 -3.643 1.348 1.00 0.00 O ATOM 0 H TYR A 151 12.693 -3.969 -4.491 1.00 0.00 H new ATOM 0 HA TYR A 151 13.771 -4.441 -1.908 1.00 0.00 H new ATOM 0 HB2 TYR A 151 12.738 -2.433 -1.859 1.00 0.00 H new ATOM 0 HB3 TYR A 151 11.675 -2.836 -3.193 1.00 0.00 H new ATOM 0 HD1 TYR A 151 12.056 -4.093 0.342 1.00 0.00 H new ATOM 0 HD2 TYR A 151 9.449 -2.560 -2.659 1.00 0.00 H new ATOM 0 HE1 TYR A 151 10.159 -4.289 1.890 1.00 0.00 H new ATOM 0 HE2 TYR A 151 7.553 -2.754 -1.116 1.00 0.00 H new ATOM 0 HH TYR A 151 7.640 -4.558 1.698 1.00 0.00 H new ATOM 2358 N LEU A 152 10.982 -6.054 -2.661 1.00 0.00 N ATOM 2359 CA LEU A 152 10.171 -7.184 -2.242 1.00 0.00 C ATOM 2360 C LEU A 152 10.955 -8.481 -2.364 1.00 0.00 C ATOM 2361 O LEU A 152 10.772 -9.405 -1.569 1.00 0.00 O ATOM 2362 CB LEU A 152 8.867 -7.256 -3.032 1.00 0.00 C ATOM 2363 CG LEU A 152 7.613 -7.224 -2.157 1.00 0.00 C ATOM 2364 CD1 LEU A 152 6.365 -7.484 -2.977 1.00 0.00 C ATOM 2365 CD2 LEU A 152 7.723 -8.237 -1.028 1.00 0.00 C ATOM 0 H LEU A 152 10.665 -5.587 -3.510 1.00 0.00 H new ATOM 0 HA LEU A 152 9.911 -7.039 -1.193 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.831 -6.422 -3.733 1.00 0.00 H new ATOM 0 HB3 LEU A 152 8.862 -8.171 -3.625 1.00 0.00 H new ATOM 0 HG LEU A 152 7.533 -6.226 -1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.490 -7.455 -2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.270 -6.719 -3.748 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.436 -8.465 -3.446 1.00 0.00 H new ATOM 0 HD21 LEU A 152 6.822 -8.199 -0.416 1.00 0.00 H new ATOM 0 HD22 LEU A 152 7.836 -9.237 -1.446 1.00 0.00 H new ATOM 0 HD23 LEU A 152 8.590 -8.001 -0.411 1.00 0.00 H new ATOM 2377 N GLU A 153 11.856 -8.539 -3.340 1.00 0.00 N ATOM 2378 CA GLU A 153 12.686 -9.719 -3.522 1.00 0.00 C ATOM 2379 C GLU A 153 13.538 -9.921 -2.273 1.00 0.00 C ATOM 2380 O GLU A 153 13.755 -11.045 -1.823 1.00 0.00 O ATOM 2381 CB GLU A 153 13.579 -9.566 -4.755 1.00 0.00 C ATOM 2382 CG GLU A 153 14.276 -10.852 -5.165 1.00 0.00 C ATOM 2383 CD GLU A 153 15.727 -10.635 -5.545 1.00 0.00 C ATOM 2384 OE1 GLU A 153 15.981 -9.915 -6.533 1.00 0.00 O ATOM 2385 OE2 GLU A 153 16.610 -11.184 -4.853 1.00 0.00 O ATOM 0 H GLU A 153 12.027 -7.789 -4.010 1.00 0.00 H new ATOM 0 HA GLU A 153 12.048 -10.589 -3.676 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.975 -9.208 -5.589 1.00 0.00 H new ATOM 0 HB3 GLU A 153 14.331 -8.803 -4.556 1.00 0.00 H new ATOM 0 HG2 GLU A 153 14.223 -11.567 -4.344 1.00 0.00 H new ATOM 0 HG3 GLU A 153 13.746 -11.295 -6.008 1.00 0.00 H new ATOM 2392 N LYS A 154 13.989 -8.801 -1.705 1.00 0.00 N ATOM 2393 CA LYS A 154 14.790 -8.816 -0.484 1.00 0.00 C ATOM 2394 C LYS A 154 13.893 -9.092 0.723 1.00 0.00 C ATOM 2395 O LYS A 154 14.355 -9.559 1.765 1.00 0.00 O ATOM 2396 CB LYS A 154 15.516 -7.470 -0.316 1.00 0.00 C ATOM 2397 CG LYS A 154 15.897 -7.133 1.122 1.00 0.00 C ATOM 2398 CD LYS A 154 14.733 -6.508 1.880 1.00 0.00 C ATOM 2399 CE LYS A 154 15.032 -5.072 2.290 1.00 0.00 C ATOM 2400 NZ LYS A 154 14.404 -4.721 3.597 1.00 0.00 N ATOM 0 H LYS A 154 13.811 -7.868 -2.076 1.00 0.00 H new ATOM 0 HA LYS A 154 15.536 -9.608 -0.554 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.420 -7.480 -0.925 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.878 -6.676 -0.705 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.221 -8.039 1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 154 16.743 -6.446 1.123 1.00 0.00 H new ATOM 0 HD2 LYS A 154 13.839 -6.529 1.256 1.00 0.00 H new ATOM 0 HD3 LYS A 154 14.516 -7.102 2.768 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.111 -4.931 2.357 1.00 0.00 H new ATOM 0 HE3 LYS A 154 14.669 -4.392 1.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.799 -3.884 3.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 13.828 -5.520 3.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 15.147 -4.514 4.295 1.00 0.00 H new ATOM 2414 N TYR A 155 12.606 -8.796 0.564 1.00 0.00 N ATOM 2415 CA TYR A 155 11.624 -9.003 1.621 1.00 0.00 C ATOM 2416 C TYR A 155 11.455 -10.490 1.909 1.00 0.00 C ATOM 2417 O TYR A 155 11.409 -10.910 3.065 1.00 0.00 O ATOM 2418 CB TYR A 155 10.287 -8.401 1.187 1.00 0.00 C ATOM 2419 CG TYR A 155 9.421 -7.883 2.314 1.00 0.00 C ATOM 2420 CD1 TYR A 155 9.519 -8.396 3.602 1.00 0.00 C ATOM 2421 CD2 TYR A 155 8.489 -6.882 2.077 1.00 0.00 C ATOM 2422 CE1 TYR A 155 8.711 -7.922 4.620 1.00 0.00 C ATOM 2423 CE2 TYR A 155 7.681 -6.403 3.085 1.00 0.00 C ATOM 2424 CZ TYR A 155 7.793 -6.926 4.355 1.00 0.00 C ATOM 2425 OH TYR A 155 6.987 -6.452 5.365 1.00 0.00 O ATOM 0 H TYR A 155 12.217 -8.408 -0.296 1.00 0.00 H new ATOM 0 HA TYR A 155 11.970 -8.514 2.532 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.482 -7.583 0.494 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.727 -9.157 0.637 1.00 0.00 H new ATOM 0 HD1 TYR A 155 10.236 -9.176 3.811 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.395 -6.471 1.083 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.798 -8.329 5.617 1.00 0.00 H new ATOM 0 HE2 TYR A 155 6.964 -5.622 2.881 1.00 0.00 H new ATOM 0 HH TYR A 155 7.457 -6.528 6.222 1.00 0.00 H new ATOM 2435 N ARG A 156 11.373 -11.284 0.846 1.00 0.00 N ATOM 2436 CA ARG A 156 11.219 -12.728 0.980 1.00 0.00 C ATOM 2437 C ARG A 156 12.520 -13.444 0.616 1.00 0.00 C ATOM 2438 O ARG A 156 12.965 -13.388 -0.531 1.00 0.00 O ATOM 2439 CB ARG A 156 10.082 -13.227 0.085 1.00 0.00 C ATOM 2440 CG ARG A 156 9.831 -14.721 0.196 1.00 0.00 C ATOM 2441 CD ARG A 156 8.639 -15.150 -0.643 1.00 0.00 C ATOM 2442 NE ARG A 156 8.159 -16.480 -0.275 1.00 0.00 N ATOM 2443 CZ ARG A 156 7.387 -16.724 0.782 1.00 0.00 C ATOM 2444 NH1 ARG A 156 7.005 -15.732 1.576 1.00 0.00 N ATOM 2445 NH2 ARG A 156 6.997 -17.963 1.045 1.00 0.00 N ATOM 0 H ARG A 156 11.411 -10.952 -0.118 1.00 0.00 H new ATOM 0 HA ARG A 156 10.976 -12.950 2.019 1.00 0.00 H new ATOM 0 HB2 ARG A 156 9.167 -12.693 0.343 1.00 0.00 H new ATOM 0 HB3 ARG A 156 10.313 -12.982 -0.952 1.00 0.00 H new ATOM 0 HG2 ARG A 156 10.719 -15.265 -0.127 1.00 0.00 H new ATOM 0 HG3 ARG A 156 9.657 -14.985 1.239 1.00 0.00 H new ATOM 0 HD2 ARG A 156 7.832 -14.427 -0.522 1.00 0.00 H new ATOM 0 HD3 ARG A 156 8.917 -15.144 -1.697 1.00 0.00 H new ATOM 0 HE ARG A 156 8.431 -17.268 -0.862 1.00 0.00 H new ATOM 0 HH11 ARG A 156 7.303 -14.777 1.378 1.00 0.00 H new ATOM 0 HH12 ARG A 156 6.414 -15.925 2.384 1.00 0.00 H new ATOM 0 HH21 ARG A 156 7.288 -18.729 0.438 1.00 0.00 H new ATOM 0 HH22 ARG A 156 6.406 -18.150 1.855 1.00 0.00 H new