USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1118 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 MET CE :methyl 144:sc= -6.35 (180deg=-12.2!) USER MOD Set 1.2: A 96 THR OG1 : rot -97:sc= -1.36! USER MOD Set 2.1: A 21 GLN : amide:sc= -3.39! C(o=-4.9!,f=-8.8!) USER MOD Set 2.2: A 25 TYR OH : rot 152:sc= -1.51! USER MOD Set 3.1: A 19 THR OG1 : rot 85:sc= -5.06! USER MOD Set 3.2: A 32 GLN : amide:sc= -15.6! C(o=-21!,f=-17!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 170:sc= -1.36 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -3.9! C(o=-3.9!,f=-3.2!) USER MOD Single : A 28 LYS NZ :NH3+ -136:sc= -9.43! (180deg=-13.3!) USER MOD Single : A 29 LYS NZ :NH3+ -149:sc= -0.236 (180deg=-1.48!) USER MOD Single : A 31 MET CE :methyl 156:sc= -0.0565 (180deg=-0.821) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 80:sc= 0.475 USER MOD Single : A 49 SER OG : rot 34:sc= -1.01! USER MOD Single : A 50 SER OG : rot 180:sc= -0.107 USER MOD Single : A 53 LYS NZ :NH3+ -145:sc= -11! (180deg=-16.4!) USER MOD Single : A 54 GLN : amide:sc= -5.96! C(o=-6!,f=-9.1!) USER MOD Single : A 55 LYS NZ :NH3+ 164:sc= -0.258 (180deg=-1.15) USER MOD Single : A 62 SER OG : rot -10:sc= -0.507! USER MOD Single : A 63 SER OG : rot -72:sc= -11.1! USER MOD Single : A 67 LYS NZ :NH3+ -157:sc= -4.09! (180deg=-5.43!) USER MOD Single : A 71 THR OG1 : rot -150:sc= -3.59! USER MOD Single : A 79 ASN : amide:sc= -8.7! C(o=-8.7!,f=-6.2!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 56:sc= -2.37! USER MOD Single : A 93 LYS NZ :NH3+ 153:sc= -16.9! (180deg=-18.3!) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -160:sc=-0.00453 (180deg=-0.461) USER MOD Single : A 99 TYR OH : rot -148:sc= -1.77 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.319! K(o=-0.32!,f=-1.4) USER MOD Single : A 111 GLN : amide:sc= -0.0911 X(o=-0.091,f=-0.0093) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0.0971 USER MOD Single : A 126 ASN : amide:sc= -1.63 K(o=-1.6,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 84:sc= 0.464! USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.742 3.343 -14.305 1.00 0.00 N ATOM 106 CA VAL A 7 114.020 4.640 -13.632 1.00 0.00 C ATOM 107 C VAL A 7 115.527 4.882 -13.549 1.00 0.00 C ATOM 108 O VAL A 7 115.990 5.993 -13.707 1.00 0.00 O ATOM 109 CB VAL A 7 113.438 4.606 -12.217 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.989 4.123 -12.273 1.00 0.00 C ATOM 111 CG2 VAL A 7 114.259 3.649 -11.351 1.00 0.00 C ATOM 0 HA VAL A 7 113.562 5.445 -14.208 1.00 0.00 H new ATOM 0 HB VAL A 7 113.472 5.607 -11.787 1.00 0.00 H new ATOM 0 HG11 VAL A 7 111.574 4.099 -11.265 1.00 0.00 H new ATOM 0 HG12 VAL A 7 111.402 4.803 -12.890 1.00 0.00 H new ATOM 0 HG13 VAL A 7 111.955 3.122 -12.703 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.845 3.624 -10.343 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.225 2.648 -11.782 1.00 0.00 H new ATOM 0 HG23 VAL A 7 115.293 3.991 -11.310 1.00 0.00 H new ATOM 121 N LYS A 8 116.296 3.861 -13.283 1.00 0.00 N ATOM 122 CA LYS A 8 117.771 4.056 -13.168 1.00 0.00 C ATOM 123 C LYS A 8 118.030 5.232 -12.224 1.00 0.00 C ATOM 124 O LYS A 8 119.154 5.640 -12.010 1.00 0.00 O ATOM 125 CB LYS A 8 118.368 4.327 -14.557 1.00 0.00 C ATOM 126 CG LYS A 8 118.812 5.790 -14.686 1.00 0.00 C ATOM 127 CD LYS A 8 119.106 6.104 -16.154 1.00 0.00 C ATOM 128 CE LYS A 8 117.839 6.637 -16.827 1.00 0.00 C ATOM 129 NZ LYS A 8 118.157 7.061 -18.220 1.00 0.00 N ATOM 0 H LYS A 8 115.970 2.905 -13.141 1.00 0.00 H new ATOM 0 HA LYS A 8 118.245 3.160 -12.767 1.00 0.00 H new ATOM 0 HB2 LYS A 8 119.220 3.668 -14.726 1.00 0.00 H new ATOM 0 HB3 LYS A 8 117.630 4.098 -15.326 1.00 0.00 H new ATOM 0 HG2 LYS A 8 118.033 6.453 -14.310 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.700 5.967 -14.080 1.00 0.00 H new ATOM 0 HD2 LYS A 8 119.906 6.841 -16.226 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.452 5.206 -16.666 1.00 0.00 H new ATOM 0 HE2 LYS A 8 117.068 5.866 -16.837 1.00 0.00 H new ATOM 0 HE3 LYS A 8 117.441 7.479 -16.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 117.296 7.423 -18.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 118.879 7.809 -18.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.518 6.247 -18.757 1.00 0.00 H new ATOM 143 N GLY A 9 116.987 5.772 -11.652 1.00 0.00 N ATOM 144 CA GLY A 9 117.153 6.916 -10.717 1.00 0.00 C ATOM 145 C GLY A 9 116.118 7.996 -11.037 1.00 0.00 C ATOM 146 O GLY A 9 116.433 9.005 -11.635 1.00 0.00 O ATOM 0 H GLY A 9 116.024 5.467 -11.795 1.00 0.00 H new ATOM 0 HA2 GLY A 9 117.034 6.578 -9.688 1.00 0.00 H new ATOM 0 HA3 GLY A 9 118.159 7.326 -10.803 1.00 0.00 H new ATOM 150 N ALA A 10 114.886 7.791 -10.640 1.00 0.00 N ATOM 151 CA ALA A 10 113.822 8.801 -10.918 1.00 0.00 C ATOM 152 C ALA A 10 112.483 8.080 -11.064 1.00 0.00 C ATOM 153 O ALA A 10 112.214 7.454 -12.069 1.00 0.00 O ATOM 154 CB ALA A 10 114.132 9.549 -12.217 1.00 0.00 C ATOM 0 H ALA A 10 114.572 6.963 -10.133 1.00 0.00 H new ATOM 0 HA ALA A 10 113.780 9.516 -10.096 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.350 10.283 -12.410 1.00 0.00 H new ATOM 0 HB2 ALA A 10 115.092 10.058 -12.124 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.176 8.840 -13.044 1.00 0.00 H new ATOM 160 N LEU A 11 111.642 8.156 -10.071 1.00 0.00 N ATOM 161 CA LEU A 11 110.328 7.463 -10.165 1.00 0.00 C ATOM 162 C LEU A 11 109.202 8.430 -9.795 1.00 0.00 C ATOM 163 O LEU A 11 109.422 9.608 -9.595 1.00 0.00 O ATOM 164 CB LEU A 11 110.321 6.259 -9.217 1.00 0.00 C ATOM 165 CG LEU A 11 110.161 6.719 -7.764 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.552 5.574 -6.828 1.00 0.00 C ATOM 167 CD2 LEU A 11 111.072 7.916 -7.481 1.00 0.00 C ATOM 0 H LEU A 11 111.807 8.665 -9.203 1.00 0.00 H new ATOM 0 HA LEU A 11 110.171 7.118 -11.187 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.507 5.585 -9.483 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.249 5.697 -9.327 1.00 0.00 H new ATOM 0 HG LEU A 11 109.123 7.009 -7.600 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.440 5.896 -5.793 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.906 4.716 -7.013 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.589 5.293 -7.010 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.947 8.231 -6.445 1.00 0.00 H new ATOM 0 HD22 LEU A 11 112.110 7.631 -7.651 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.808 8.739 -8.145 1.00 0.00 H new ATOM 179 N THR A 12 107.997 7.943 -9.712 1.00 0.00 N ATOM 180 CA THR A 12 106.857 8.837 -9.362 1.00 0.00 C ATOM 181 C THR A 12 107.273 9.791 -8.236 1.00 0.00 C ATOM 182 O THR A 12 108.299 9.619 -7.608 1.00 0.00 O ATOM 183 CB THR A 12 105.668 7.990 -8.900 1.00 0.00 C ATOM 184 OG1 THR A 12 104.479 8.764 -8.979 1.00 0.00 O ATOM 185 CG2 THR A 12 105.889 7.536 -7.457 1.00 0.00 C ATOM 0 H THR A 12 107.751 6.966 -9.871 1.00 0.00 H new ATOM 0 HA THR A 12 106.573 9.418 -10.239 1.00 0.00 H new ATOM 0 HB THR A 12 105.576 7.114 -9.542 1.00 0.00 H new ATOM 0 HG1 THR A 12 103.716 8.223 -8.685 1.00 0.00 H new ATOM 0 HG21 THR A 12 105.041 6.933 -7.131 1.00 0.00 H new ATOM 0 HG22 THR A 12 106.801 6.941 -7.398 1.00 0.00 H new ATOM 0 HG23 THR A 12 105.983 8.409 -6.811 1.00 0.00 H new ATOM 193 N SER A 13 106.476 10.792 -7.976 1.00 0.00 N ATOM 194 CA SER A 13 106.805 11.763 -6.890 1.00 0.00 C ATOM 195 C SER A 13 106.951 11.017 -5.561 1.00 0.00 C ATOM 196 O SER A 13 107.022 11.615 -4.506 1.00 0.00 O ATOM 197 CB SER A 13 105.684 12.795 -6.773 1.00 0.00 C ATOM 198 OG SER A 13 105.924 13.623 -5.643 1.00 0.00 O ATOM 0 H SER A 13 105.605 10.981 -8.472 1.00 0.00 H new ATOM 0 HA SER A 13 107.742 12.267 -7.127 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.635 13.400 -7.678 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.721 12.294 -6.673 1.00 0.00 H new ATOM 0 HG SER A 13 105.303 14.381 -5.655 1.00 0.00 H new ATOM 204 N GLY A 14 106.980 9.715 -5.605 1.00 0.00 N ATOM 205 CA GLY A 14 107.101 8.920 -4.351 1.00 0.00 C ATOM 206 C GLY A 14 108.193 9.506 -3.452 1.00 0.00 C ATOM 207 O GLY A 14 108.132 9.406 -2.243 1.00 0.00 O ATOM 0 H GLY A 14 106.925 9.163 -6.461 1.00 0.00 H new ATOM 0 HA2 GLY A 14 106.148 8.916 -3.822 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.336 7.883 -4.591 1.00 0.00 H new ATOM 211 N ARG A 15 109.200 10.100 -4.023 1.00 0.00 N ATOM 212 CA ARG A 15 110.294 10.666 -3.183 1.00 0.00 C ATOM 213 C ARG A 15 109.749 11.748 -2.243 1.00 0.00 C ATOM 214 O ARG A 15 109.819 11.624 -1.037 1.00 0.00 O ATOM 215 CB ARG A 15 111.371 11.274 -4.085 1.00 0.00 C ATOM 216 CG ARG A 15 110.743 11.721 -5.403 1.00 0.00 C ATOM 217 CD ARG A 15 111.581 12.841 -6.024 1.00 0.00 C ATOM 218 NE ARG A 15 111.584 12.693 -7.507 1.00 0.00 N ATOM 219 CZ ARG A 15 112.340 13.467 -8.238 1.00 0.00 C ATOM 220 NH1 ARG A 15 113.092 14.370 -7.670 1.00 0.00 N ATOM 221 NH2 ARG A 15 112.343 13.338 -9.536 1.00 0.00 N ATOM 0 H ARG A 15 109.315 10.219 -5.029 1.00 0.00 H new ATOM 0 HA ARG A 15 110.722 9.863 -2.584 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.840 12.123 -3.587 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.156 10.542 -4.274 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.680 10.878 -6.091 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.724 12.069 -5.231 1.00 0.00 H new ATOM 0 HD2 ARG A 15 111.173 13.813 -5.745 1.00 0.00 H new ATOM 0 HD3 ARG A 15 112.601 12.802 -5.642 1.00 0.00 H new ATOM 0 HE ARG A 15 110.996 11.988 -7.951 1.00 0.00 H new ATOM 0 HH11 ARG A 15 113.089 14.471 -6.655 1.00 0.00 H new ATOM 0 HH12 ARG A 15 113.683 14.975 -8.241 1.00 0.00 H new ATOM 0 HH21 ARG A 15 111.755 12.633 -9.980 1.00 0.00 H new ATOM 0 HH22 ARG A 15 112.933 13.943 -10.107 1.00 0.00 H new ATOM 235 N GLU A 16 109.226 12.816 -2.778 1.00 0.00 N ATOM 236 CA GLU A 16 108.703 13.907 -1.901 1.00 0.00 C ATOM 237 C GLU A 16 107.279 13.594 -1.438 1.00 0.00 C ATOM 238 O GLU A 16 106.976 13.627 -0.262 1.00 0.00 O ATOM 239 CB GLU A 16 108.692 15.230 -2.675 1.00 0.00 C ATOM 240 CG GLU A 16 108.509 14.955 -4.169 1.00 0.00 C ATOM 241 CD GLU A 16 108.367 16.281 -4.918 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.090 17.277 -4.270 1.00 0.00 O ATOM 243 OE2 GLU A 16 108.537 16.278 -6.126 1.00 0.00 O ATOM 0 H GLU A 16 109.137 12.983 -3.780 1.00 0.00 H new ATOM 0 HA GLU A 16 109.353 13.986 -1.029 1.00 0.00 H new ATOM 0 HB2 GLU A 16 107.886 15.868 -2.312 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.625 15.768 -2.507 1.00 0.00 H new ATOM 0 HG2 GLU A 16 109.363 14.397 -4.554 1.00 0.00 H new ATOM 0 HG3 GLU A 16 107.625 14.337 -4.330 1.00 0.00 H new ATOM 250 N GLU A 17 106.399 13.324 -2.356 1.00 0.00 N ATOM 251 CA GLU A 17 104.984 13.048 -1.984 1.00 0.00 C ATOM 252 C GLU A 17 104.892 11.972 -0.896 1.00 0.00 C ATOM 253 O GLU A 17 104.235 12.156 0.106 1.00 0.00 O ATOM 254 CB GLU A 17 104.222 12.574 -3.224 1.00 0.00 C ATOM 255 CG GLU A 17 102.792 12.198 -2.833 1.00 0.00 C ATOM 256 CD GLU A 17 102.127 13.381 -2.127 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.161 14.469 -2.676 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.595 13.178 -1.048 1.00 0.00 O ATOM 0 H GLU A 17 106.599 13.282 -3.355 1.00 0.00 H new ATOM 0 HA GLU A 17 104.547 13.967 -1.594 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.209 13.361 -3.978 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.726 11.716 -3.668 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.222 11.923 -3.720 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.800 11.327 -2.177 1.00 0.00 H new ATOM 265 N LEU A 18 105.509 10.840 -1.089 1.00 0.00 N ATOM 266 CA LEU A 18 105.400 9.758 -0.065 1.00 0.00 C ATOM 267 C LEU A 18 106.309 10.019 1.144 1.00 0.00 C ATOM 268 O LEU A 18 105.914 9.787 2.270 1.00 0.00 O ATOM 269 CB LEU A 18 105.763 8.414 -0.702 1.00 0.00 C ATOM 270 CG LEU A 18 104.497 7.572 -0.887 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.012 7.066 0.475 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.400 8.423 -1.539 1.00 0.00 C ATOM 0 H LEU A 18 106.080 10.616 -1.904 1.00 0.00 H new ATOM 0 HA LEU A 18 104.371 9.739 0.293 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.248 8.576 -1.665 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.476 7.883 -0.072 1.00 0.00 H new ATOM 0 HG LEU A 18 104.723 6.721 -1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.111 6.467 0.341 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.789 6.455 0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.790 7.916 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.501 7.820 -1.669 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.175 9.278 -0.901 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.743 8.777 -2.511 1.00 0.00 H new ATOM 284 N THR A 19 107.517 10.476 0.950 1.00 0.00 N ATOM 285 CA THR A 19 108.390 10.700 2.136 1.00 0.00 C ATOM 286 C THR A 19 107.782 11.797 3.003 1.00 0.00 C ATOM 287 O THR A 19 107.543 11.606 4.175 1.00 0.00 O ATOM 288 CB THR A 19 109.796 11.101 1.688 1.00 0.00 C ATOM 289 OG1 THR A 19 110.220 10.223 0.658 1.00 0.00 O ATOM 290 CG2 THR A 19 110.766 11.006 2.874 1.00 0.00 C ATOM 0 H THR A 19 107.929 10.699 0.044 1.00 0.00 H new ATOM 0 HA THR A 19 108.462 9.778 2.713 1.00 0.00 H new ATOM 0 HB THR A 19 109.784 12.127 1.319 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.890 10.548 -0.206 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.766 11.293 2.550 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.436 11.676 3.668 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.785 9.982 3.247 1.00 0.00 H new ATOM 298 N ARG A 20 107.514 12.937 2.432 1.00 0.00 N ATOM 299 CA ARG A 20 106.905 14.042 3.220 1.00 0.00 C ATOM 300 C ARG A 20 105.649 13.532 3.927 1.00 0.00 C ATOM 301 O ARG A 20 105.376 13.875 5.060 1.00 0.00 O ATOM 302 CB ARG A 20 106.526 15.181 2.279 1.00 0.00 C ATOM 303 CG ARG A 20 107.791 15.911 1.848 1.00 0.00 C ATOM 304 CD ARG A 20 107.443 16.961 0.791 1.00 0.00 C ATOM 305 NE ARG A 20 106.931 18.189 1.462 1.00 0.00 N ATOM 306 CZ ARG A 20 106.987 19.339 0.849 1.00 0.00 C ATOM 307 NH1 ARG A 20 107.491 19.415 -0.352 1.00 0.00 N ATOM 308 NH2 ARG A 20 106.540 20.415 1.438 1.00 0.00 N ATOM 0 H ARG A 20 107.691 13.151 1.451 1.00 0.00 H new ATOM 0 HA ARG A 20 107.620 14.399 3.961 1.00 0.00 H new ATOM 0 HB2 ARG A 20 106.002 14.790 1.407 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.845 15.871 2.778 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.259 16.388 2.709 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.514 15.201 1.446 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.324 17.199 0.196 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.692 16.568 0.106 1.00 0.00 H new ATOM 0 HE ARG A 20 106.537 18.130 2.401 1.00 0.00 H new ATOM 0 HH11 ARG A 20 107.841 18.575 -0.812 1.00 0.00 H new ATOM 0 HH12 ARG A 20 107.534 20.315 -0.831 1.00 0.00 H new ATOM 0 HH21 ARG A 20 106.147 20.356 2.377 1.00 0.00 H new ATOM 0 HH22 ARG A 20 106.584 21.314 0.959 1.00 0.00 H new ATOM 322 N GLN A 21 104.884 12.712 3.266 1.00 0.00 N ATOM 323 CA GLN A 21 103.649 12.171 3.893 1.00 0.00 C ATOM 324 C GLN A 21 104.032 11.283 5.075 1.00 0.00 C ATOM 325 O GLN A 21 103.219 10.978 5.925 1.00 0.00 O ATOM 326 CB GLN A 21 102.866 11.352 2.872 1.00 0.00 C ATOM 327 CG GLN A 21 102.325 12.277 1.783 1.00 0.00 C ATOM 328 CD GLN A 21 100.947 12.800 2.194 1.00 0.00 C ATOM 329 OE1 GLN A 21 99.952 12.466 1.583 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.846 13.612 3.210 1.00 0.00 N ATOM 0 H GLN A 21 105.062 12.392 2.314 1.00 0.00 H new ATOM 0 HA GLN A 21 103.028 12.997 4.240 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.509 10.591 2.431 1.00 0.00 H new ATOM 0 HB3 GLN A 21 102.044 10.830 3.362 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.010 13.110 1.626 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.254 11.740 0.837 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.681 13.893 3.723 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.932 13.966 3.491 1.00 0.00 H new ATOM 339 N VAL A 22 105.262 10.853 5.128 1.00 0.00 N ATOM 340 CA VAL A 22 105.689 9.969 6.246 1.00 0.00 C ATOM 341 C VAL A 22 105.143 10.529 7.559 1.00 0.00 C ATOM 342 O VAL A 22 104.814 9.793 8.468 1.00 0.00 O ATOM 343 CB VAL A 22 107.220 9.941 6.310 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.678 9.263 7.602 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.770 9.170 5.111 1.00 0.00 C ATOM 0 H VAL A 22 105.988 11.075 4.447 1.00 0.00 H new ATOM 0 HA VAL A 22 105.309 8.960 6.086 1.00 0.00 H new ATOM 0 HB VAL A 22 107.594 10.965 6.290 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.767 9.248 7.639 1.00 0.00 H new ATOM 0 HG12 VAL A 22 107.294 9.816 8.459 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.300 8.241 7.631 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.859 9.151 5.159 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.389 8.149 5.129 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.456 9.659 4.189 1.00 0.00 H new ATOM 355 N GLY A 23 105.025 11.823 7.661 1.00 0.00 N ATOM 356 CA GLY A 23 104.478 12.415 8.912 1.00 0.00 C ATOM 357 C GLY A 23 103.008 12.016 9.036 1.00 0.00 C ATOM 358 O GLY A 23 102.285 12.511 9.877 1.00 0.00 O ATOM 0 H GLY A 23 105.282 12.493 6.936 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.041 12.061 9.776 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.575 13.500 8.891 1.00 0.00 H new ATOM 362 N ARG A 24 102.563 11.120 8.194 1.00 0.00 N ATOM 363 CA ARG A 24 101.142 10.681 8.246 1.00 0.00 C ATOM 364 C ARG A 24 101.073 9.153 8.178 1.00 0.00 C ATOM 365 O ARG A 24 100.336 8.523 8.911 1.00 0.00 O ATOM 366 CB ARG A 24 100.382 11.278 7.060 1.00 0.00 C ATOM 367 CG ARG A 24 98.883 11.294 7.369 1.00 0.00 C ATOM 368 CD ARG A 24 98.601 12.288 8.498 1.00 0.00 C ATOM 369 NE ARG A 24 97.325 13.006 8.220 1.00 0.00 N ATOM 370 CZ ARG A 24 97.262 13.867 7.241 1.00 0.00 C ATOM 371 NH1 ARG A 24 98.315 14.099 6.507 1.00 0.00 N ATOM 372 NH2 ARG A 24 96.145 14.496 6.997 1.00 0.00 N ATOM 0 H ARG A 24 103.127 10.673 7.471 1.00 0.00 H new ATOM 0 HA ARG A 24 100.692 11.022 9.178 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.734 12.290 6.862 1.00 0.00 H new ATOM 0 HB3 ARG A 24 100.572 10.692 6.161 1.00 0.00 H new ATOM 0 HG2 ARG A 24 98.321 11.572 6.478 1.00 0.00 H new ATOM 0 HG3 ARG A 24 98.550 10.297 7.657 1.00 0.00 H new ATOM 0 HD2 ARG A 24 98.535 11.763 9.451 1.00 0.00 H new ATOM 0 HD3 ARG A 24 99.421 13.001 8.583 1.00 0.00 H new ATOM 0 HE ARG A 24 96.502 12.825 8.794 1.00 0.00 H new ATOM 0 HH11 ARG A 24 99.188 13.607 6.698 1.00 0.00 H new ATOM 0 HH12 ARG A 24 98.265 14.772 5.742 1.00 0.00 H new ATOM 0 HH21 ARG A 24 95.322 14.315 7.571 1.00 0.00 H new ATOM 0 HH22 ARG A 24 96.095 15.169 6.232 1.00 0.00 H new ATOM 386 N TYR A 25 101.833 8.548 7.303 1.00 0.00 N ATOM 387 CA TYR A 25 101.800 7.061 7.193 1.00 0.00 C ATOM 388 C TYR A 25 102.907 6.453 8.053 1.00 0.00 C ATOM 389 O TYR A 25 102.799 5.335 8.515 1.00 0.00 O ATOM 390 CB TYR A 25 102.016 6.639 5.738 1.00 0.00 C ATOM 391 CG TYR A 25 101.345 7.622 4.810 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.223 8.342 5.236 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.848 7.812 3.517 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.604 9.249 4.371 1.00 0.00 C ATOM 395 CE2 TYR A 25 101.229 8.717 2.652 1.00 0.00 C ATOM 396 CZ TYR A 25 100.106 9.438 3.078 1.00 0.00 C ATOM 397 OH TYR A 25 99.494 10.332 2.224 1.00 0.00 O ATOM 0 H TYR A 25 102.473 9.018 6.662 1.00 0.00 H new ATOM 0 HA TYR A 25 100.828 6.707 7.537 1.00 0.00 H new ATOM 0 HB2 TYR A 25 103.083 6.590 5.520 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.611 5.640 5.577 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.835 8.197 6.233 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.715 7.258 3.189 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.738 9.804 4.700 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.616 8.861 1.654 1.00 0.00 H new ATOM 0 HH TYR A 25 100.154 10.682 1.589 1.00 0.00 H new ATOM 407 N LYS A 26 103.977 7.169 8.265 1.00 0.00 N ATOM 408 CA LYS A 26 105.084 6.607 9.086 1.00 0.00 C ATOM 409 C LYS A 26 105.587 5.321 8.426 1.00 0.00 C ATOM 410 O LYS A 26 106.485 4.668 8.918 1.00 0.00 O ATOM 411 CB LYS A 26 104.570 6.296 10.496 1.00 0.00 C ATOM 412 CG LYS A 26 104.969 7.426 11.448 1.00 0.00 C ATOM 413 CD LYS A 26 106.375 7.165 11.989 1.00 0.00 C ATOM 414 CE LYS A 26 106.714 8.208 13.056 1.00 0.00 C ATOM 415 NZ LYS A 26 107.983 7.826 13.738 1.00 0.00 N ATOM 0 H LYS A 26 104.131 8.112 7.908 1.00 0.00 H new ATOM 0 HA LYS A 26 105.898 7.329 9.154 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.486 6.184 10.482 1.00 0.00 H new ATOM 0 HB3 LYS A 26 104.984 5.350 10.845 1.00 0.00 H new ATOM 0 HG2 LYS A 26 104.940 8.383 10.926 1.00 0.00 H new ATOM 0 HG3 LYS A 26 104.257 7.491 12.271 1.00 0.00 H new ATOM 0 HD2 LYS A 26 106.432 6.163 12.414 1.00 0.00 H new ATOM 0 HD3 LYS A 26 107.102 7.209 11.178 1.00 0.00 H new ATOM 0 HE2 LYS A 26 106.816 9.192 12.598 1.00 0.00 H new ATOM 0 HE3 LYS A 26 105.904 8.277 13.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 108.214 8.534 14.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 107.869 6.895 14.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 108.753 7.782 13.040 1.00 0.00 H new ATOM 429 N ASN A 27 105.011 4.953 7.311 1.00 0.00 N ATOM 430 CA ASN A 27 105.453 3.713 6.616 1.00 0.00 C ATOM 431 C ASN A 27 106.491 4.070 5.551 1.00 0.00 C ATOM 432 O ASN A 27 106.484 5.153 5.001 1.00 0.00 O ATOM 433 CB ASN A 27 104.249 3.044 5.950 1.00 0.00 C ATOM 434 CG ASN A 27 103.329 2.462 7.025 1.00 0.00 C ATOM 435 OD1 ASN A 27 103.038 3.113 8.009 1.00 0.00 O ATOM 436 ND2 ASN A 27 102.856 1.255 6.879 1.00 0.00 N ATOM 0 H ASN A 27 104.253 5.460 6.853 1.00 0.00 H new ATOM 0 HA ASN A 27 105.894 3.028 7.340 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.705 3.769 5.345 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.584 2.255 5.277 1.00 0.00 H new ATOM 0 HD21 ASN A 27 102.242 0.858 7.591 1.00 0.00 H new ATOM 0 HD22 ASN A 27 103.100 0.708 6.053 1.00 0.00 H new ATOM 443 N LYS A 28 107.386 3.169 5.259 1.00 0.00 N ATOM 444 CA LYS A 28 108.427 3.455 4.233 1.00 0.00 C ATOM 445 C LYS A 28 108.485 2.293 3.236 1.00 0.00 C ATOM 446 O LYS A 28 108.650 2.483 2.042 1.00 0.00 O ATOM 447 CB LYS A 28 109.781 3.613 4.925 1.00 0.00 C ATOM 448 CG LYS A 28 109.922 5.045 5.464 1.00 0.00 C ATOM 449 CD LYS A 28 110.018 5.034 6.994 1.00 0.00 C ATOM 450 CE LYS A 28 108.615 5.012 7.602 1.00 0.00 C ATOM 451 NZ LYS A 28 107.810 6.132 7.038 1.00 0.00 N ATOM 0 H LYS A 28 107.442 2.245 5.687 1.00 0.00 H new ATOM 0 HA LYS A 28 108.183 4.374 3.700 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.869 2.896 5.742 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.587 3.397 4.223 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.811 5.514 5.041 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.067 5.644 5.151 1.00 0.00 H new ATOM 0 HD2 LYS A 28 110.582 4.162 7.326 1.00 0.00 H new ATOM 0 HD3 LYS A 28 110.560 5.914 7.340 1.00 0.00 H new ATOM 0 HE2 LYS A 28 108.130 4.059 7.390 1.00 0.00 H new ATOM 0 HE3 LYS A 28 108.676 5.104 8.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 107.283 6.600 7.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 108.443 6.820 6.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 107.141 5.759 6.335 1.00 0.00 H new ATOM 465 N LYS A 29 108.343 1.092 3.723 1.00 0.00 N ATOM 466 CA LYS A 29 108.379 -0.100 2.829 1.00 0.00 C ATOM 467 C LYS A 29 107.118 -0.123 1.962 1.00 0.00 C ATOM 468 O LYS A 29 106.923 -1.001 1.149 1.00 0.00 O ATOM 469 CB LYS A 29 108.418 -1.367 3.691 1.00 0.00 C ATOM 470 CG LYS A 29 107.645 -1.133 4.991 1.00 0.00 C ATOM 471 CD LYS A 29 106.231 -0.646 4.668 1.00 0.00 C ATOM 472 CE LYS A 29 105.324 -0.872 5.879 1.00 0.00 C ATOM 473 NZ LYS A 29 105.300 -2.323 6.217 1.00 0.00 N ATOM 0 H LYS A 29 108.202 0.883 4.711 1.00 0.00 H new ATOM 0 HA LYS A 29 109.261 -0.055 2.190 1.00 0.00 H new ATOM 0 HB2 LYS A 29 107.983 -2.204 3.144 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.451 -1.634 3.914 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.599 -2.056 5.570 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.162 -0.397 5.606 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.250 0.412 4.407 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.840 -1.181 3.802 1.00 0.00 H new ATOM 0 HE2 LYS A 29 105.685 -0.295 6.730 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.315 -0.521 5.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 104.376 -2.569 6.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 105.457 -2.883 5.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.050 -2.531 6.907 1.00 0.00 H new ATOM 487 N PHE A 30 106.252 0.824 2.151 1.00 0.00 N ATOM 488 CA PHE A 30 104.981 0.846 1.367 1.00 0.00 C ATOM 489 C PHE A 30 105.224 1.208 -0.110 1.00 0.00 C ATOM 490 O PHE A 30 105.216 0.358 -0.981 1.00 0.00 O ATOM 491 CB PHE A 30 104.120 1.948 1.985 1.00 0.00 C ATOM 492 CG PHE A 30 104.957 3.215 2.153 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.290 3.276 1.687 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.397 4.340 2.772 1.00 0.00 C ATOM 495 CE1 PHE A 30 107.037 4.445 1.840 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.156 5.510 2.925 1.00 0.00 C ATOM 497 CZ PHE A 30 106.473 5.560 2.458 1.00 0.00 C ATOM 0 H PHE A 30 106.364 1.590 2.816 1.00 0.00 H new ATOM 0 HA PHE A 30 104.515 -0.139 1.398 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.258 2.150 1.349 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.734 1.624 2.951 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.733 2.414 1.210 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.379 4.307 3.132 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.054 4.486 1.479 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.722 6.375 3.405 1.00 0.00 H new ATOM 0 HZ PHE A 30 107.054 6.463 2.576 1.00 0.00 H new ATOM 507 N MET A 31 105.481 2.459 -0.382 1.00 0.00 N ATOM 508 CA MET A 31 105.766 2.901 -1.769 1.00 0.00 C ATOM 509 C MET A 31 107.218 2.583 -2.102 1.00 0.00 C ATOM 510 O MET A 31 107.540 2.084 -3.161 1.00 0.00 O ATOM 511 CB MET A 31 105.532 4.408 -1.879 1.00 0.00 C ATOM 512 CG MET A 31 106.259 4.953 -3.110 1.00 0.00 C ATOM 513 SD MET A 31 105.943 3.871 -4.526 1.00 0.00 S ATOM 514 CE MET A 31 104.157 4.144 -4.626 1.00 0.00 C ATOM 0 H MET A 31 105.505 3.204 0.315 1.00 0.00 H new ATOM 0 HA MET A 31 105.108 2.383 -2.466 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.465 4.616 -1.953 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.892 4.909 -0.980 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.918 5.965 -3.329 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.330 5.013 -2.916 1.00 0.00 H new ATOM 0 HE1 MET A 31 103.813 3.937 -5.639 1.00 0.00 H new ATOM 0 HE2 MET A 31 103.648 3.480 -3.927 1.00 0.00 H new ATOM 0 HE3 MET A 31 103.932 5.180 -4.372 1.00 0.00 H new ATOM 524 N GLN A 32 108.103 2.896 -1.196 1.00 0.00 N ATOM 525 CA GLN A 32 109.541 2.643 -1.437 1.00 0.00 C ATOM 526 C GLN A 32 109.830 1.142 -1.319 1.00 0.00 C ATOM 527 O GLN A 32 110.737 0.626 -1.938 1.00 0.00 O ATOM 528 CB GLN A 32 110.362 3.443 -0.425 1.00 0.00 C ATOM 529 CG GLN A 32 110.092 4.936 -0.625 1.00 0.00 C ATOM 530 CD GLN A 32 110.951 5.745 0.348 1.00 0.00 C ATOM 531 OE1 GLN A 32 112.087 5.399 0.605 1.00 0.00 O ATOM 532 NE2 GLN A 32 110.453 6.815 0.904 1.00 0.00 N ATOM 0 H GLN A 32 107.884 3.319 -0.294 1.00 0.00 H new ATOM 0 HA GLN A 32 109.816 2.961 -2.443 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.099 3.147 0.590 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.424 3.233 -0.553 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.319 5.223 -1.652 1.00 0.00 H new ATOM 0 HG3 GLN A 32 109.036 5.151 -0.460 1.00 0.00 H new ATOM 0 HE21 GLN A 32 109.499 7.105 0.688 1.00 0.00 H new ATOM 0 HE22 GLN A 32 111.017 7.361 1.555 1.00 0.00 H new ATOM 541 N GLY A 33 109.076 0.428 -0.526 1.00 0.00 N ATOM 542 CA GLY A 33 109.337 -1.030 -0.397 1.00 0.00 C ATOM 543 C GLY A 33 108.878 -1.735 -1.673 1.00 0.00 C ATOM 544 O GLY A 33 109.445 -2.730 -2.078 1.00 0.00 O ATOM 0 H GLY A 33 108.301 0.788 0.031 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.399 -1.209 -0.230 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.807 -1.432 0.466 1.00 0.00 H new ATOM 548 N THR A 34 107.858 -1.227 -2.316 1.00 0.00 N ATOM 549 CA THR A 34 107.382 -1.880 -3.569 1.00 0.00 C ATOM 550 C THR A 34 108.358 -1.579 -4.711 1.00 0.00 C ATOM 551 O THR A 34 108.530 -2.379 -5.609 1.00 0.00 O ATOM 552 CB THR A 34 105.987 -1.366 -3.935 1.00 0.00 C ATOM 553 OG1 THR A 34 105.603 -1.900 -5.194 1.00 0.00 O ATOM 554 CG2 THR A 34 106.006 0.157 -4.011 1.00 0.00 C ATOM 0 H THR A 34 107.339 -0.396 -2.030 1.00 0.00 H new ATOM 0 HA THR A 34 107.332 -2.957 -3.409 1.00 0.00 H new ATOM 0 HB THR A 34 105.273 -1.680 -3.173 1.00 0.00 H new ATOM 0 HG1 THR A 34 104.710 -1.573 -5.429 1.00 0.00 H new ATOM 0 HG21 THR A 34 105.012 0.521 -4.272 1.00 0.00 H new ATOM 0 HG22 THR A 34 106.300 0.566 -3.044 1.00 0.00 H new ATOM 0 HG23 THR A 34 106.719 0.474 -4.771 1.00 0.00 H new ATOM 562 N VAL A 35 109.016 -0.445 -4.689 1.00 0.00 N ATOM 563 CA VAL A 35 109.983 -0.150 -5.787 1.00 0.00 C ATOM 564 C VAL A 35 111.247 -0.977 -5.551 1.00 0.00 C ATOM 565 O VAL A 35 111.746 -1.632 -6.444 1.00 0.00 O ATOM 566 CB VAL A 35 110.341 1.346 -5.825 1.00 0.00 C ATOM 567 CG1 VAL A 35 109.067 2.192 -5.789 1.00 0.00 C ATOM 568 CG2 VAL A 35 111.213 1.705 -4.624 1.00 0.00 C ATOM 0 H VAL A 35 108.927 0.275 -3.972 1.00 0.00 H new ATOM 0 HA VAL A 35 109.528 -0.408 -6.743 1.00 0.00 H new ATOM 0 HB VAL A 35 110.887 1.549 -6.746 1.00 0.00 H new ATOM 0 HG11 VAL A 35 109.331 3.249 -5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 35 108.446 1.951 -6.652 1.00 0.00 H new ATOM 0 HG13 VAL A 35 108.515 1.980 -4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 35 111.462 2.766 -4.659 1.00 0.00 H new ATOM 0 HG22 VAL A 35 110.671 1.490 -3.703 1.00 0.00 H new ATOM 0 HG23 VAL A 35 112.130 1.116 -4.651 1.00 0.00 H new ATOM 578 N ALA A 36 111.763 -0.962 -4.350 1.00 0.00 N ATOM 579 CA ALA A 36 112.987 -1.755 -4.060 1.00 0.00 C ATOM 580 C ALA A 36 112.792 -3.178 -4.582 1.00 0.00 C ATOM 581 O ALA A 36 113.558 -3.662 -5.389 1.00 0.00 O ATOM 582 CB ALA A 36 113.223 -1.791 -2.548 1.00 0.00 C ATOM 0 H ALA A 36 111.389 -0.435 -3.561 1.00 0.00 H new ATOM 0 HA ALA A 36 113.849 -1.299 -4.548 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.120 -2.372 -2.333 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.351 -0.775 -2.175 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.366 -2.252 -2.057 1.00 0.00 H new ATOM 588 N VAL A 37 111.758 -3.846 -4.146 1.00 0.00 N ATOM 589 CA VAL A 37 111.511 -5.228 -4.638 1.00 0.00 C ATOM 590 C VAL A 37 111.444 -5.194 -6.161 1.00 0.00 C ATOM 591 O VAL A 37 111.970 -6.059 -6.840 1.00 0.00 O ATOM 592 CB VAL A 37 110.189 -5.749 -4.073 1.00 0.00 C ATOM 593 CG1 VAL A 37 110.312 -5.919 -2.558 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.074 -4.748 -4.383 1.00 0.00 C ATOM 0 H VAL A 37 111.077 -3.494 -3.473 1.00 0.00 H new ATOM 0 HA VAL A 37 112.315 -5.889 -4.315 1.00 0.00 H new ATOM 0 HB VAL A 37 109.954 -6.711 -4.528 1.00 0.00 H new ATOM 0 HG11 VAL A 37 109.369 -6.290 -2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 37 111.107 -6.631 -2.335 1.00 0.00 H new ATOM 0 HG13 VAL A 37 110.547 -4.957 -2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.131 -5.118 -3.981 1.00 0.00 H new ATOM 0 HG22 VAL A 37 109.311 -3.787 -3.927 1.00 0.00 H new ATOM 0 HG23 VAL A 37 108.985 -4.625 -5.462 1.00 0.00 H new ATOM 604 N CYS A 38 110.821 -4.184 -6.709 1.00 0.00 N ATOM 605 CA CYS A 38 110.749 -4.087 -8.186 1.00 0.00 C ATOM 606 C CYS A 38 112.168 -4.216 -8.726 1.00 0.00 C ATOM 607 O CYS A 38 112.396 -4.693 -9.818 1.00 0.00 O ATOM 608 CB CYS A 38 110.162 -2.732 -8.588 1.00 0.00 C ATOM 609 SG CYS A 38 109.308 -2.890 -10.176 1.00 0.00 S ATOM 0 H CYS A 38 110.364 -3.430 -6.197 1.00 0.00 H new ATOM 0 HA CYS A 38 110.112 -4.873 -8.592 1.00 0.00 H new ATOM 0 HB2 CYS A 38 109.468 -2.383 -7.823 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.955 -1.988 -8.662 1.00 0.00 H new ATOM 0 HG CYS A 38 108.808 -1.739 -10.516 1.00 0.00 H new ATOM 615 N ALA A 39 113.131 -3.793 -7.958 1.00 0.00 N ATOM 616 CA ALA A 39 114.535 -3.906 -8.412 1.00 0.00 C ATOM 617 C ALA A 39 115.032 -5.341 -8.194 1.00 0.00 C ATOM 618 O ALA A 39 115.657 -5.934 -9.049 1.00 0.00 O ATOM 619 CB ALA A 39 115.403 -2.934 -7.619 1.00 0.00 C ATOM 0 H ALA A 39 113.003 -3.375 -7.037 1.00 0.00 H new ATOM 0 HA ALA A 39 114.596 -3.663 -9.473 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.438 -3.016 -7.952 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.049 -1.916 -7.780 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.343 -3.175 -6.558 1.00 0.00 H new ATOM 625 N ARG A 40 114.775 -5.886 -7.035 1.00 0.00 N ATOM 626 CA ARG A 40 115.253 -7.265 -6.720 1.00 0.00 C ATOM 627 C ARG A 40 115.084 -8.190 -7.927 1.00 0.00 C ATOM 628 O ARG A 40 115.964 -8.964 -8.240 1.00 0.00 O ATOM 629 CB ARG A 40 114.461 -7.817 -5.528 1.00 0.00 C ATOM 630 CG ARG A 40 114.832 -9.287 -5.290 1.00 0.00 C ATOM 631 CD ARG A 40 113.607 -10.176 -5.522 1.00 0.00 C ATOM 632 NE ARG A 40 114.051 -11.569 -5.807 1.00 0.00 N ATOM 633 CZ ARG A 40 113.178 -12.538 -5.842 1.00 0.00 C ATOM 634 NH1 ARG A 40 111.916 -12.286 -5.626 1.00 0.00 N ATOM 635 NH2 ARG A 40 113.566 -13.758 -6.092 1.00 0.00 N ATOM 0 H ARG A 40 114.251 -5.432 -6.287 1.00 0.00 H new ATOM 0 HA ARG A 40 116.313 -7.219 -6.471 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.675 -7.230 -4.635 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.391 -7.729 -5.719 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.639 -9.581 -5.962 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.200 -9.418 -4.273 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.962 -10.161 -4.643 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.019 -9.793 -6.356 1.00 0.00 H new ATOM 0 HE ARG A 40 115.038 -11.765 -5.975 1.00 0.00 H new ATOM 0 HH11 ARG A 40 111.613 -11.332 -5.430 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.233 -13.043 -5.653 1.00 0.00 H new ATOM 0 HH21 ARG A 40 114.553 -13.955 -6.260 1.00 0.00 H new ATOM 0 HH22 ARG A 40 112.883 -14.515 -6.119 1.00 0.00 H new ATOM 649 N ILE A 41 113.974 -8.140 -8.604 1.00 0.00 N ATOM 650 CA ILE A 41 113.802 -9.046 -9.780 1.00 0.00 C ATOM 651 C ILE A 41 114.269 -8.361 -11.068 1.00 0.00 C ATOM 652 O ILE A 41 114.535 -9.013 -12.059 1.00 0.00 O ATOM 653 CB ILE A 41 112.336 -9.447 -9.920 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.444 -8.332 -9.377 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.092 -10.730 -9.129 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.825 -7.012 -10.045 1.00 0.00 C ATOM 0 H ILE A 41 113.187 -7.523 -8.402 1.00 0.00 H new ATOM 0 HA ILE A 41 114.410 -9.936 -9.616 1.00 0.00 H new ATOM 0 HB ILE A 41 112.100 -9.613 -10.971 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.396 -8.562 -9.570 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.559 -8.252 -8.296 1.00 0.00 H new ATOM 0 HG21 ILE A 41 111.046 -11.023 -9.224 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.728 -11.524 -9.519 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.327 -10.560 -8.078 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.191 -6.213 -9.660 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.868 -6.783 -9.829 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.688 -7.097 -11.123 1.00 0.00 H new ATOM 668 N ALA A 42 114.361 -7.059 -11.081 1.00 0.00 N ATOM 669 CA ALA A 42 114.797 -6.365 -12.324 1.00 0.00 C ATOM 670 C ALA A 42 116.325 -6.252 -12.349 1.00 0.00 C ATOM 671 O ALA A 42 116.900 -5.726 -13.281 1.00 0.00 O ATOM 672 CB ALA A 42 114.162 -4.975 -12.379 1.00 0.00 C ATOM 0 H ALA A 42 114.154 -6.450 -10.289 1.00 0.00 H new ATOM 0 HA ALA A 42 114.476 -6.939 -13.193 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.480 -4.465 -13.288 1.00 0.00 H new ATOM 0 HB2 ALA A 42 113.076 -5.071 -12.378 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.476 -4.397 -11.510 1.00 0.00 H new ATOM 678 N VAL A 43 116.983 -6.729 -11.324 1.00 0.00 N ATOM 679 CA VAL A 43 118.477 -6.640 -11.276 1.00 0.00 C ATOM 680 C VAL A 43 119.065 -6.705 -12.690 1.00 0.00 C ATOM 681 O VAL A 43 120.091 -6.120 -12.969 1.00 0.00 O ATOM 682 CB VAL A 43 119.034 -7.776 -10.413 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.966 -8.255 -9.433 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.476 -8.945 -11.292 1.00 0.00 C ATOM 0 H VAL A 43 116.551 -7.177 -10.516 1.00 0.00 H new ATOM 0 HA VAL A 43 118.760 -5.685 -10.833 1.00 0.00 H new ATOM 0 HB VAL A 43 119.895 -7.401 -9.860 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.369 -9.063 -8.822 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.666 -7.428 -8.789 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.100 -8.616 -9.987 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.869 -9.744 -10.664 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.623 -9.316 -11.860 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.252 -8.610 -11.981 1.00 0.00 H new ATOM 694 N ALA A 44 118.430 -7.403 -13.585 1.00 0.00 N ATOM 695 CA ALA A 44 118.962 -7.495 -14.974 1.00 0.00 C ATOM 696 C ALA A 44 120.367 -8.102 -14.942 1.00 0.00 C ATOM 697 O ALA A 44 120.862 -8.596 -15.936 1.00 0.00 O ATOM 698 CB ALA A 44 119.024 -6.096 -15.590 1.00 0.00 C ATOM 0 H ALA A 44 117.564 -7.915 -13.417 1.00 0.00 H new ATOM 0 HA ALA A 44 118.307 -8.127 -15.574 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.413 -6.163 -16.606 1.00 0.00 H new ATOM 0 HB2 ALA A 44 118.024 -5.664 -15.612 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.679 -5.464 -14.991 1.00 0.00 H new ATOM 704 N SER A 45 121.013 -8.069 -13.808 1.00 0.00 N ATOM 705 CA SER A 45 122.383 -8.643 -13.714 1.00 0.00 C ATOM 706 C SER A 45 122.320 -10.152 -13.913 1.00 0.00 C ATOM 707 O SER A 45 121.520 -10.663 -14.672 1.00 0.00 O ATOM 708 CB SER A 45 122.969 -8.353 -12.334 1.00 0.00 C ATOM 709 OG SER A 45 124.386 -8.295 -12.429 1.00 0.00 O ATOM 0 H SER A 45 120.650 -7.669 -12.943 1.00 0.00 H new ATOM 0 HA SER A 45 123.010 -8.193 -14.484 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.580 -7.409 -11.952 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.672 -9.130 -11.629 1.00 0.00 H new ATOM 0 HG SER A 45 124.655 -7.421 -12.781 1.00 0.00 H new ATOM 715 N ASP A 46 123.161 -10.864 -13.226 1.00 0.00 N ATOM 716 CA ASP A 46 123.166 -12.347 -13.353 1.00 0.00 C ATOM 717 C ASP A 46 123.201 -12.972 -11.957 1.00 0.00 C ATOM 718 O ASP A 46 124.105 -13.710 -11.621 1.00 0.00 O ATOM 719 CB ASP A 46 124.400 -12.789 -14.142 1.00 0.00 C ATOM 720 CG ASP A 46 124.220 -12.426 -15.617 1.00 0.00 C ATOM 721 OD1 ASP A 46 124.266 -11.247 -15.927 1.00 0.00 O ATOM 722 OD2 ASP A 46 124.040 -13.334 -16.412 1.00 0.00 O ATOM 0 H ASP A 46 123.850 -10.483 -12.578 1.00 0.00 H new ATOM 0 HA ASP A 46 122.267 -12.672 -13.877 1.00 0.00 H new ATOM 0 HB2 ASP A 46 125.292 -12.305 -13.744 1.00 0.00 H new ATOM 0 HB3 ASP A 46 124.546 -13.864 -14.036 1.00 0.00 H new ATOM 727 N GLY A 47 122.227 -12.678 -11.138 1.00 0.00 N ATOM 728 CA GLY A 47 122.216 -13.255 -9.765 1.00 0.00 C ATOM 729 C GLY A 47 120.839 -13.070 -9.129 1.00 0.00 C ATOM 730 O GLY A 47 120.212 -14.015 -8.693 1.00 0.00 O ATOM 0 H GLY A 47 121.442 -12.066 -11.360 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.467 -14.315 -9.805 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.976 -12.770 -9.152 1.00 0.00 H new ATOM 734 N VAL A 48 120.365 -11.858 -9.067 1.00 0.00 N ATOM 735 CA VAL A 48 119.033 -11.606 -8.454 1.00 0.00 C ATOM 736 C VAL A 48 119.122 -11.781 -6.939 1.00 0.00 C ATOM 737 O VAL A 48 120.035 -12.397 -6.426 1.00 0.00 O ATOM 738 CB VAL A 48 118.006 -12.584 -9.028 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.610 -11.962 -8.950 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.348 -12.887 -10.490 1.00 0.00 C ATOM 0 H VAL A 48 120.845 -11.028 -9.416 1.00 0.00 H new ATOM 0 HA VAL A 48 118.721 -10.586 -8.680 1.00 0.00 H new ATOM 0 HB VAL A 48 118.025 -13.509 -8.452 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.878 -12.658 -9.359 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.365 -11.747 -7.910 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.591 -11.037 -9.526 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.616 -13.584 -10.898 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.330 -11.962 -11.067 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.342 -13.331 -10.547 1.00 0.00 H new ATOM 750 N SER A 49 118.181 -11.234 -6.219 1.00 0.00 N ATOM 751 CA SER A 49 118.213 -11.358 -4.737 1.00 0.00 C ATOM 752 C SER A 49 116.849 -11.820 -4.224 1.00 0.00 C ATOM 753 O SER A 49 116.188 -12.638 -4.832 1.00 0.00 O ATOM 754 CB SER A 49 118.550 -9.999 -4.124 1.00 0.00 C ATOM 755 OG SER A 49 118.481 -10.092 -2.708 1.00 0.00 O ATOM 0 H SER A 49 117.392 -10.707 -6.594 1.00 0.00 H new ATOM 0 HA SER A 49 118.970 -12.090 -4.454 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.548 -9.686 -4.431 1.00 0.00 H new ATOM 0 HB3 SER A 49 117.854 -9.242 -4.484 1.00 0.00 H new ATOM 0 HG SER A 49 118.771 -10.984 -2.424 1.00 0.00 H new ATOM 761 N SER A 50 116.430 -11.302 -3.101 1.00 0.00 N ATOM 762 CA SER A 50 115.119 -11.701 -2.525 1.00 0.00 C ATOM 763 C SER A 50 115.167 -11.466 -1.018 1.00 0.00 C ATOM 764 O SER A 50 114.543 -10.564 -0.499 1.00 0.00 O ATOM 765 CB SER A 50 114.858 -13.182 -2.803 1.00 0.00 C ATOM 766 OG SER A 50 114.078 -13.728 -1.747 1.00 0.00 O ATOM 0 H SER A 50 116.947 -10.613 -2.555 1.00 0.00 H new ATOM 0 HA SER A 50 114.319 -11.113 -2.975 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.337 -13.299 -3.753 1.00 0.00 H new ATOM 0 HB3 SER A 50 115.802 -13.720 -2.889 1.00 0.00 H new ATOM 0 HG SER A 50 113.907 -14.677 -1.923 1.00 0.00 H new ATOM 772 N GLU A 51 115.918 -12.267 -0.313 1.00 0.00 N ATOM 773 CA GLU A 51 116.024 -12.087 1.160 1.00 0.00 C ATOM 774 C GLU A 51 116.844 -10.829 1.460 1.00 0.00 C ATOM 775 O GLU A 51 116.621 -10.153 2.445 1.00 0.00 O ATOM 776 CB GLU A 51 116.716 -13.306 1.775 1.00 0.00 C ATOM 777 CG GLU A 51 116.004 -14.581 1.318 1.00 0.00 C ATOM 778 CD GLU A 51 116.699 -15.800 1.926 1.00 0.00 C ATOM 779 OE1 GLU A 51 117.872 -15.693 2.241 1.00 0.00 O ATOM 780 OE2 GLU A 51 116.045 -16.821 2.067 1.00 0.00 O ATOM 0 H GLU A 51 116.463 -13.039 -0.696 1.00 0.00 H new ATOM 0 HA GLU A 51 115.027 -11.983 1.587 1.00 0.00 H new ATOM 0 HB2 GLU A 51 117.763 -13.334 1.474 1.00 0.00 H new ATOM 0 HB3 GLU A 51 116.699 -13.237 2.863 1.00 0.00 H new ATOM 0 HG2 GLU A 51 114.958 -14.555 1.624 1.00 0.00 H new ATOM 0 HG3 GLU A 51 116.017 -14.647 0.230 1.00 0.00 H new ATOM 787 N GLU A 52 117.796 -10.509 0.623 1.00 0.00 N ATOM 788 CA GLU A 52 118.626 -9.296 0.873 1.00 0.00 C ATOM 789 C GLU A 52 117.787 -8.041 0.630 1.00 0.00 C ATOM 790 O GLU A 52 117.715 -7.164 1.467 1.00 0.00 O ATOM 791 CB GLU A 52 119.827 -9.291 -0.076 1.00 0.00 C ATOM 792 CG GLU A 52 121.107 -9.603 0.704 1.00 0.00 C ATOM 793 CD GLU A 52 121.089 -11.065 1.155 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.133 -11.451 1.806 1.00 0.00 O ATOM 795 OE2 GLU A 52 122.031 -11.773 0.840 1.00 0.00 O ATOM 0 H GLU A 52 118.033 -11.033 -0.219 1.00 0.00 H new ATOM 0 HA GLU A 52 118.976 -9.307 1.905 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.682 -10.029 -0.865 1.00 0.00 H new ATOM 0 HB3 GLU A 52 119.914 -8.319 -0.562 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.980 -9.415 0.080 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.187 -8.946 1.570 1.00 0.00 H new ATOM 802 N LYS A 53 117.141 -7.945 -0.503 1.00 0.00 N ATOM 803 CA LYS A 53 116.309 -6.737 -0.763 1.00 0.00 C ATOM 804 C LYS A 53 115.251 -6.641 0.329 1.00 0.00 C ATOM 805 O LYS A 53 114.966 -5.578 0.841 1.00 0.00 O ATOM 806 CB LYS A 53 115.624 -6.835 -2.129 1.00 0.00 C ATOM 807 CG LYS A 53 114.946 -5.502 -2.443 1.00 0.00 C ATOM 808 CD LYS A 53 115.977 -4.528 -3.016 1.00 0.00 C ATOM 809 CE LYS A 53 116.150 -4.784 -4.514 1.00 0.00 C ATOM 810 NZ LYS A 53 117.047 -5.954 -4.718 1.00 0.00 N ATOM 0 H LYS A 53 117.153 -8.641 -1.249 1.00 0.00 H new ATOM 0 HA LYS A 53 116.945 -5.852 -0.762 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.355 -7.076 -2.900 1.00 0.00 H new ATOM 0 HB3 LYS A 53 114.889 -7.639 -2.124 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.136 -5.653 -3.157 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.501 -5.087 -1.539 1.00 0.00 H new ATOM 0 HD2 LYS A 53 115.654 -3.501 -2.848 1.00 0.00 H new ATOM 0 HD3 LYS A 53 116.931 -4.650 -2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 53 115.181 -4.971 -4.976 1.00 0.00 H new ATOM 0 HE3 LYS A 53 116.569 -3.902 -4.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 117.627 -5.803 -5.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 117.668 -6.064 -3.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 116.474 -6.814 -4.838 1.00 0.00 H new ATOM 824 N GLN A 54 114.679 -7.751 0.698 1.00 0.00 N ATOM 825 CA GLN A 54 113.650 -7.736 1.770 1.00 0.00 C ATOM 826 C GLN A 54 114.233 -7.003 2.982 1.00 0.00 C ATOM 827 O GLN A 54 113.557 -6.248 3.659 1.00 0.00 O ATOM 828 CB GLN A 54 113.277 -9.184 2.127 1.00 0.00 C ATOM 829 CG GLN A 54 113.841 -9.570 3.499 1.00 0.00 C ATOM 830 CD GLN A 54 113.062 -8.845 4.599 1.00 0.00 C ATOM 831 OE1 GLN A 54 112.198 -8.038 4.317 1.00 0.00 O ATOM 832 NE2 GLN A 54 113.332 -9.101 5.850 1.00 0.00 N ATOM 0 H GLN A 54 114.881 -8.669 0.302 1.00 0.00 H new ATOM 0 HA GLN A 54 112.747 -7.221 1.442 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.193 -9.294 2.131 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.664 -9.862 1.366 1.00 0.00 H new ATOM 0 HG2 GLN A 54 113.772 -10.648 3.641 1.00 0.00 H new ATOM 0 HG3 GLN A 54 114.898 -9.308 3.555 1.00 0.00 H new ATOM 0 HE21 GLN A 54 114.057 -9.778 6.087 1.00 0.00 H new ATOM 0 HE22 GLN A 54 112.818 -8.624 6.591 1.00 0.00 H new ATOM 841 N LYS A 55 115.498 -7.203 3.244 1.00 0.00 N ATOM 842 CA LYS A 55 116.141 -6.507 4.390 1.00 0.00 C ATOM 843 C LYS A 55 116.146 -5.008 4.099 1.00 0.00 C ATOM 844 O LYS A 55 115.803 -4.200 4.940 1.00 0.00 O ATOM 845 CB LYS A 55 117.580 -7.008 4.555 1.00 0.00 C ATOM 846 CG LYS A 55 117.686 -7.862 5.821 1.00 0.00 C ATOM 847 CD LYS A 55 116.838 -9.125 5.658 1.00 0.00 C ATOM 848 CE LYS A 55 117.269 -10.166 6.693 1.00 0.00 C ATOM 849 NZ LYS A 55 117.750 -9.474 7.923 1.00 0.00 N ATOM 0 H LYS A 55 116.112 -7.820 2.711 1.00 0.00 H new ATOM 0 HA LYS A 55 115.592 -6.708 5.310 1.00 0.00 H new ATOM 0 HB2 LYS A 55 117.874 -7.594 3.684 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.265 -6.162 4.616 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.726 -8.131 6.005 1.00 0.00 H new ATOM 0 HG3 LYS A 55 117.346 -7.292 6.686 1.00 0.00 H new ATOM 0 HD2 LYS A 55 115.782 -8.886 5.785 1.00 0.00 H new ATOM 0 HD3 LYS A 55 116.955 -9.527 4.652 1.00 0.00 H new ATOM 0 HE2 LYS A 55 116.433 -10.822 6.935 1.00 0.00 H new ATOM 0 HE3 LYS A 55 118.059 -10.795 6.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 117.785 -10.152 8.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 118.701 -9.088 7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 117.099 -8.699 8.162 1.00 0.00 H new ATOM 863 N MET A 56 116.527 -4.630 2.908 1.00 0.00 N ATOM 864 CA MET A 56 116.544 -3.184 2.564 1.00 0.00 C ATOM 865 C MET A 56 115.173 -2.577 2.876 1.00 0.00 C ATOM 866 O MET A 56 115.076 -1.527 3.478 1.00 0.00 O ATOM 867 CB MET A 56 116.854 -3.012 1.074 1.00 0.00 C ATOM 868 CG MET A 56 117.077 -1.530 0.771 1.00 0.00 C ATOM 869 SD MET A 56 118.452 -1.346 -0.391 1.00 0.00 S ATOM 870 CE MET A 56 118.763 0.414 -0.097 1.00 0.00 C ATOM 0 H MET A 56 116.826 -5.259 2.163 1.00 0.00 H new ATOM 0 HA MET A 56 117.311 -2.678 3.150 1.00 0.00 H new ATOM 0 HB2 MET A 56 117.741 -3.587 0.807 1.00 0.00 H new ATOM 0 HB3 MET A 56 116.031 -3.398 0.473 1.00 0.00 H new ATOM 0 HG2 MET A 56 116.171 -1.095 0.349 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.292 -0.989 1.692 1.00 0.00 H new ATOM 0 HE1 MET A 56 119.834 0.609 -0.154 1.00 0.00 H new ATOM 0 HE2 MET A 56 118.246 1.006 -0.852 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.397 0.688 0.892 1.00 0.00 H new ATOM 880 N ILE A 57 114.106 -3.227 2.489 1.00 0.00 N ATOM 881 CA ILE A 57 112.762 -2.662 2.797 1.00 0.00 C ATOM 882 C ILE A 57 112.721 -2.339 4.290 1.00 0.00 C ATOM 883 O ILE A 57 112.235 -1.305 4.700 1.00 0.00 O ATOM 884 CB ILE A 57 111.664 -3.673 2.448 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.178 -4.623 1.365 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.416 -2.938 1.937 1.00 0.00 C ATOM 887 CD1 ILE A 57 112.618 -3.820 0.139 1.00 0.00 C ATOM 0 H ILE A 57 114.107 -4.111 1.981 1.00 0.00 H new ATOM 0 HA ILE A 57 112.589 -1.762 2.207 1.00 0.00 H new ATOM 0 HB ILE A 57 111.401 -4.241 3.341 1.00 0.00 H new ATOM 0 HG12 ILE A 57 113.015 -5.207 1.748 1.00 0.00 H new ATOM 0 HG13 ILE A 57 111.396 -5.330 1.087 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.641 -3.664 1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 57 110.049 -2.263 2.710 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.671 -2.364 1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 57 112.983 -4.501 -0.630 1.00 0.00 H new ATOM 0 HD12 ILE A 57 111.770 -3.255 -0.249 1.00 0.00 H new ATOM 0 HD13 ILE A 57 113.414 -3.131 0.422 1.00 0.00 H new ATOM 899 N GLY A 58 113.259 -3.202 5.109 1.00 0.00 N ATOM 900 CA GLY A 58 113.278 -2.907 6.568 1.00 0.00 C ATOM 901 C GLY A 58 113.989 -1.566 6.758 1.00 0.00 C ATOM 902 O GLY A 58 113.543 -0.698 7.491 1.00 0.00 O ATOM 0 H GLY A 58 113.682 -4.089 4.834 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.263 -2.862 6.963 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.797 -3.696 7.112 1.00 0.00 H new ATOM 906 N PHE A 59 115.084 -1.382 6.070 1.00 0.00 N ATOM 907 CA PHE A 59 115.820 -0.096 6.170 1.00 0.00 C ATOM 908 C PHE A 59 114.844 1.024 5.822 1.00 0.00 C ATOM 909 O PHE A 59 114.803 2.049 6.467 1.00 0.00 O ATOM 910 CB PHE A 59 117.001 -0.119 5.191 1.00 0.00 C ATOM 911 CG PHE A 59 117.080 1.169 4.406 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.726 2.282 4.951 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.528 1.239 3.122 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.817 3.467 4.214 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.622 2.422 2.383 1.00 0.00 C ATOM 916 CZ PHE A 59 117.265 3.537 2.928 1.00 0.00 C ATOM 0 H PHE A 59 115.499 -2.071 5.442 1.00 0.00 H new ATOM 0 HA PHE A 59 116.213 0.062 7.174 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.930 -0.272 5.740 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.894 -0.960 4.506 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.155 2.227 5.941 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.029 0.378 2.702 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.313 4.329 4.636 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.198 2.474 1.391 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.336 4.452 2.358 1.00 0.00 H new ATOM 926 N LEU A 60 114.028 0.811 4.826 1.00 0.00 N ATOM 927 CA LEU A 60 113.020 1.840 4.458 1.00 0.00 C ATOM 928 C LEU A 60 112.273 2.236 5.727 1.00 0.00 C ATOM 929 O LEU A 60 112.046 3.399 5.990 1.00 0.00 O ATOM 930 CB LEU A 60 112.045 1.238 3.441 1.00 0.00 C ATOM 931 CG LEU A 60 112.086 2.000 2.108 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.529 2.387 1.742 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.527 1.088 1.014 1.00 0.00 C ATOM 0 H LEU A 60 114.017 -0.032 4.252 1.00 0.00 H new ATOM 0 HA LEU A 60 113.496 2.716 4.017 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.294 0.191 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.033 1.263 3.845 1.00 0.00 H new ATOM 0 HG LEU A 60 111.494 2.911 2.200 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.532 2.925 0.794 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.944 3.024 2.523 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.135 1.486 1.649 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.548 1.612 0.058 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.135 0.186 0.947 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.500 0.816 1.257 1.00 0.00 H new ATOM 945 N ARG A 61 111.909 1.270 6.528 1.00 0.00 N ATOM 946 CA ARG A 61 111.195 1.578 7.796 1.00 0.00 C ATOM 947 C ARG A 61 112.005 2.610 8.579 1.00 0.00 C ATOM 948 O ARG A 61 111.460 3.497 9.205 1.00 0.00 O ATOM 949 CB ARG A 61 111.054 0.299 8.623 1.00 0.00 C ATOM 950 CG ARG A 61 110.493 -0.818 7.740 1.00 0.00 C ATOM 951 CD ARG A 61 110.450 -2.125 8.533 1.00 0.00 C ATOM 952 NE ARG A 61 110.089 -3.247 7.621 1.00 0.00 N ATOM 953 CZ ARG A 61 109.666 -4.379 8.115 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.557 -4.527 9.407 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.352 -5.362 7.316 1.00 0.00 N ATOM 0 H ARG A 61 112.077 0.279 6.356 1.00 0.00 H new ATOM 0 HA ARG A 61 110.203 1.975 7.579 1.00 0.00 H new ATOM 0 HB2 ARG A 61 112.023 0.006 9.028 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.393 0.473 9.472 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.492 -0.556 7.396 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.113 -0.940 6.852 1.00 0.00 H new ATOM 0 HD2 ARG A 61 111.419 -2.315 8.995 1.00 0.00 H new ATOM 0 HD3 ARG A 61 109.721 -2.049 9.340 1.00 0.00 H new ATOM 0 HE ARG A 61 110.172 -3.131 6.611 1.00 0.00 H new ATOM 0 HH11 ARG A 61 109.802 -3.758 10.031 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.226 -5.411 9.793 1.00 0.00 H new ATOM 0 HH21 ARG A 61 109.437 -5.246 6.306 1.00 0.00 H new ATOM 0 HH22 ARG A 61 109.021 -6.247 7.701 1.00 0.00 H new ATOM 969 N SER A 62 113.306 2.503 8.548 1.00 0.00 N ATOM 970 CA SER A 62 114.148 3.488 9.289 1.00 0.00 C ATOM 971 C SER A 62 114.950 4.349 8.298 1.00 0.00 C ATOM 972 O SER A 62 115.771 5.153 8.689 1.00 0.00 O ATOM 973 CB SER A 62 115.107 2.738 10.214 1.00 0.00 C ATOM 974 OG SER A 62 115.968 3.670 10.853 1.00 0.00 O ATOM 0 H SER A 62 113.821 1.780 8.045 1.00 0.00 H new ATOM 0 HA SER A 62 113.504 4.139 9.880 1.00 0.00 H new ATOM 0 HB2 SER A 62 114.546 2.174 10.959 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.692 2.017 9.643 1.00 0.00 H new ATOM 0 HG SER A 62 115.863 4.551 10.436 1.00 0.00 H new ATOM 980 N SER A 63 114.725 4.172 7.021 1.00 0.00 N ATOM 981 CA SER A 63 115.476 4.958 5.992 1.00 0.00 C ATOM 982 C SER A 63 115.550 6.438 6.371 1.00 0.00 C ATOM 983 O SER A 63 115.067 6.854 7.402 1.00 0.00 O ATOM 984 CB SER A 63 114.790 4.825 4.638 1.00 0.00 C ATOM 985 OG SER A 63 115.187 3.603 4.037 1.00 0.00 O ATOM 0 H SER A 63 114.047 3.511 6.643 1.00 0.00 H new ATOM 0 HA SER A 63 116.489 4.560 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 63 113.707 4.850 4.761 1.00 0.00 H new ATOM 0 HB3 SER A 63 115.058 5.665 3.996 1.00 0.00 H new ATOM 0 HG SER A 63 116.119 3.672 3.741 1.00 0.00 H new ATOM 991 N GLU A 64 116.166 7.234 5.534 1.00 0.00 N ATOM 992 CA GLU A 64 116.288 8.688 5.827 1.00 0.00 C ATOM 993 C GLU A 64 114.897 9.314 5.895 1.00 0.00 C ATOM 994 O GLU A 64 114.714 10.372 6.462 1.00 0.00 O ATOM 995 CB GLU A 64 117.100 9.365 4.720 1.00 0.00 C ATOM 996 CG GLU A 64 117.391 10.819 5.109 1.00 0.00 C ATOM 997 CD GLU A 64 118.881 10.979 5.422 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.413 10.135 6.123 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.464 11.943 4.954 1.00 0.00 O ATOM 0 H GLU A 64 116.591 6.934 4.656 1.00 0.00 H new ATOM 0 HA GLU A 64 116.793 8.824 6.783 1.00 0.00 H new ATOM 0 HB2 GLU A 64 118.034 8.827 4.560 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.549 9.333 3.780 1.00 0.00 H new ATOM 0 HG2 GLU A 64 117.106 11.487 4.296 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.795 11.100 5.977 1.00 0.00 H new ATOM 1006 N GLU A 65 113.911 8.669 5.329 1.00 0.00 N ATOM 1007 CA GLU A 65 112.532 9.231 5.378 1.00 0.00 C ATOM 1008 C GLU A 65 112.271 9.756 6.790 1.00 0.00 C ATOM 1009 O GLU A 65 111.320 10.470 7.039 1.00 0.00 O ATOM 1010 CB GLU A 65 111.521 8.132 5.046 1.00 0.00 C ATOM 1011 CG GLU A 65 111.420 7.949 3.523 1.00 0.00 C ATOM 1012 CD GLU A 65 111.949 6.567 3.132 1.00 0.00 C ATOM 1013 OE1 GLU A 65 113.157 6.399 3.119 1.00 0.00 O ATOM 1014 OE2 GLU A 65 111.137 5.702 2.851 1.00 0.00 O ATOM 0 H GLU A 65 114.002 7.780 4.837 1.00 0.00 H new ATOM 0 HA GLU A 65 112.431 10.040 4.654 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.824 7.195 5.513 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.544 8.390 5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.384 8.056 3.202 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.993 8.725 3.015 1.00 0.00 H new ATOM 1021 N LEU A 66 113.125 9.407 7.712 1.00 0.00 N ATOM 1022 CA LEU A 66 112.959 9.879 9.116 1.00 0.00 C ATOM 1023 C LEU A 66 112.705 11.385 9.093 1.00 0.00 C ATOM 1024 O LEU A 66 112.051 11.936 9.957 1.00 0.00 O ATOM 1025 CB LEU A 66 114.251 9.605 9.894 1.00 0.00 C ATOM 1026 CG LEU A 66 114.221 8.210 10.533 1.00 0.00 C ATOM 1027 CD1 LEU A 66 113.445 7.231 9.646 1.00 0.00 C ATOM 1028 CD2 LEU A 66 115.658 7.706 10.700 1.00 0.00 C ATOM 0 H LEU A 66 113.937 8.811 7.552 1.00 0.00 H new ATOM 0 HA LEU A 66 112.126 9.361 9.591 1.00 0.00 H new ATOM 0 HB2 LEU A 66 115.107 9.684 9.224 1.00 0.00 H new ATOM 0 HB3 LEU A 66 114.381 10.361 10.668 1.00 0.00 H new ATOM 0 HG LEU A 66 113.727 8.275 11.503 1.00 0.00 H new ATOM 0 HD11 LEU A 66 113.434 6.247 10.114 1.00 0.00 H new ATOM 0 HD12 LEU A 66 112.422 7.586 9.521 1.00 0.00 H new ATOM 0 HD13 LEU A 66 113.927 7.163 8.671 1.00 0.00 H new ATOM 0 HD21 LEU A 66 115.646 6.715 11.154 1.00 0.00 H new ATOM 0 HD22 LEU A 66 116.140 7.652 9.724 1.00 0.00 H new ATOM 0 HD23 LEU A 66 116.212 8.392 11.341 1.00 0.00 H new ATOM 1040 N LYS A 67 113.228 12.050 8.103 1.00 0.00 N ATOM 1041 CA LYS A 67 113.040 13.522 7.993 1.00 0.00 C ATOM 1042 C LYS A 67 111.638 13.829 7.465 1.00 0.00 C ATOM 1043 O LYS A 67 110.922 14.622 8.038 1.00 0.00 O ATOM 1044 CB LYS A 67 114.079 14.094 7.027 1.00 0.00 C ATOM 1045 CG LYS A 67 114.309 13.101 5.881 1.00 0.00 C ATOM 1046 CD LYS A 67 113.996 13.763 4.542 1.00 0.00 C ATOM 1047 CE LYS A 67 113.736 12.673 3.503 1.00 0.00 C ATOM 1048 NZ LYS A 67 114.947 11.815 3.368 1.00 0.00 N ATOM 0 H LYS A 67 113.784 11.632 7.357 1.00 0.00 H new ATOM 0 HA LYS A 67 113.161 13.974 8.977 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.736 15.050 6.631 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.015 14.283 7.552 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.343 12.755 5.891 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.677 12.223 6.018 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.124 14.411 4.636 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.829 14.393 4.228 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.880 12.068 3.802 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.488 13.124 2.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 114.939 11.347 2.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.800 12.403 3.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 114.948 11.095 4.118 1.00 0.00 H new ATOM 1062 N VAL A 68 111.249 13.218 6.369 1.00 0.00 N ATOM 1063 CA VAL A 68 109.898 13.482 5.794 1.00 0.00 C ATOM 1064 C VAL A 68 110.002 14.663 4.827 1.00 0.00 C ATOM 1065 O VAL A 68 109.216 15.584 4.887 1.00 0.00 O ATOM 1066 CB VAL A 68 108.914 13.824 6.928 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.475 13.771 6.416 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.080 12.819 8.076 1.00 0.00 C ATOM 0 H VAL A 68 111.814 12.546 5.850 1.00 0.00 H new ATOM 0 HA VAL A 68 109.537 12.600 5.265 1.00 0.00 H new ATOM 0 HB VAL A 68 109.129 14.831 7.285 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.791 14.015 7.228 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.350 14.491 5.607 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.257 12.769 6.046 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.383 13.063 8.877 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.875 11.813 7.711 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.100 12.866 8.456 1.00 0.00 H new ATOM 1078 N PHE A 69 110.970 14.648 3.935 1.00 0.00 N ATOM 1079 CA PHE A 69 111.113 15.797 2.983 1.00 0.00 C ATOM 1080 C PHE A 69 112.188 15.540 1.912 1.00 0.00 C ATOM 1081 O PHE A 69 111.905 15.561 0.731 1.00 0.00 O ATOM 1082 CB PHE A 69 111.511 17.058 3.759 1.00 0.00 C ATOM 1083 CG PHE A 69 110.347 17.559 4.578 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.274 18.204 3.952 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.342 17.378 5.966 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.195 18.668 4.715 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.265 17.842 6.729 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.191 18.487 6.104 1.00 0.00 C ATOM 0 H PHE A 69 111.656 13.901 3.827 1.00 0.00 H new ATOM 0 HA PHE A 69 110.151 15.921 2.486 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.356 16.840 4.412 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.836 17.833 3.065 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.278 18.344 2.881 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.170 16.880 6.448 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.366 19.165 4.233 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.262 17.703 7.800 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.359 18.845 6.693 1.00 0.00 H new ATOM 1098 N ASP A 70 113.423 15.351 2.302 1.00 0.00 N ATOM 1099 CA ASP A 70 114.501 15.159 1.280 1.00 0.00 C ATOM 1100 C ASP A 70 114.066 14.144 0.223 1.00 0.00 C ATOM 1101 O ASP A 70 114.327 12.957 0.322 1.00 0.00 O ATOM 1102 CB ASP A 70 115.791 14.679 1.950 1.00 0.00 C ATOM 1103 CG ASP A 70 116.927 14.685 0.926 1.00 0.00 C ATOM 1104 OD1 ASP A 70 116.652 14.429 -0.235 1.00 0.00 O ATOM 1105 OD2 ASP A 70 118.052 14.946 1.319 1.00 0.00 O ATOM 0 H ASP A 70 113.732 15.321 3.274 1.00 0.00 H new ATOM 0 HA ASP A 70 114.684 16.118 0.796 1.00 0.00 H new ATOM 0 HB2 ASP A 70 116.040 15.327 2.790 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.654 13.675 2.352 1.00 0.00 H new ATOM 1110 N THR A 71 113.418 14.619 -0.804 1.00 0.00 N ATOM 1111 CA THR A 71 112.968 13.719 -1.897 1.00 0.00 C ATOM 1112 C THR A 71 114.193 13.169 -2.625 1.00 0.00 C ATOM 1113 O THR A 71 114.200 12.051 -3.101 1.00 0.00 O ATOM 1114 CB THR A 71 112.109 14.516 -2.882 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.652 14.390 -4.188 1.00 0.00 O ATOM 1116 CG2 THR A 71 112.100 15.992 -2.478 1.00 0.00 C ATOM 0 H THR A 71 113.180 15.602 -0.932 1.00 0.00 H new ATOM 0 HA THR A 71 112.384 12.896 -1.484 1.00 0.00 H new ATOM 0 HB THR A 71 111.090 14.130 -2.869 1.00 0.00 H new ATOM 0 HG1 THR A 71 112.455 15.200 -4.704 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.488 16.558 -3.180 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.687 16.092 -1.474 1.00 0.00 H new ATOM 0 HG23 THR A 71 113.119 16.379 -2.491 1.00 0.00 H new ATOM 1124 N ALA A 72 115.233 13.953 -2.716 1.00 0.00 N ATOM 1125 CA ALA A 72 116.462 13.484 -3.413 1.00 0.00 C ATOM 1126 C ALA A 72 117.036 12.277 -2.671 1.00 0.00 C ATOM 1127 O ALA A 72 117.607 11.388 -3.266 1.00 0.00 O ATOM 1128 CB ALA A 72 117.498 14.610 -3.434 1.00 0.00 C ATOM 0 H ALA A 72 115.283 14.899 -2.337 1.00 0.00 H new ATOM 0 HA ALA A 72 116.215 13.200 -4.436 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.398 14.267 -3.944 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.088 15.472 -3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.747 14.895 -2.412 1.00 0.00 H new ATOM 1134 N GLU A 73 116.887 12.241 -1.374 1.00 0.00 N ATOM 1135 CA GLU A 73 117.424 11.091 -0.592 1.00 0.00 C ATOM 1136 C GLU A 73 116.568 9.850 -0.855 1.00 0.00 C ATOM 1137 O GLU A 73 117.056 8.735 -0.872 1.00 0.00 O ATOM 1138 CB GLU A 73 117.385 11.429 0.899 1.00 0.00 C ATOM 1139 CG GLU A 73 118.594 12.294 1.259 1.00 0.00 C ATOM 1140 CD GLU A 73 119.812 11.399 1.495 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.761 10.247 1.097 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.774 11.880 2.071 1.00 0.00 O ATOM 0 H GLU A 73 116.417 12.959 -0.822 1.00 0.00 H new ATOM 0 HA GLU A 73 118.452 10.894 -0.895 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.462 11.957 1.139 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.391 10.513 1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.800 13.002 0.456 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.382 12.880 2.153 1.00 0.00 H new ATOM 1149 N VAL A 74 115.293 10.031 -1.064 1.00 0.00 N ATOM 1150 CA VAL A 74 114.412 8.861 -1.326 1.00 0.00 C ATOM 1151 C VAL A 74 114.813 8.220 -2.658 1.00 0.00 C ATOM 1152 O VAL A 74 115.292 7.096 -2.710 1.00 0.00 O ATOM 1153 CB VAL A 74 112.963 9.340 -1.393 1.00 0.00 C ATOM 1154 CG1 VAL A 74 112.015 8.140 -1.330 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.681 10.274 -0.211 1.00 0.00 C ATOM 0 H VAL A 74 114.825 10.937 -1.064 1.00 0.00 H new ATOM 0 HA VAL A 74 114.514 8.125 -0.529 1.00 0.00 H new ATOM 0 HB VAL A 74 112.804 9.874 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.983 8.488 -1.378 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.213 7.475 -2.171 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.172 7.601 -0.396 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.647 10.617 -0.257 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.844 9.737 0.724 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.351 11.133 -0.258 1.00 0.00 H new ATOM 1165 N ILE A 75 114.646 8.929 -3.739 1.00 0.00 N ATOM 1166 CA ILE A 75 115.044 8.363 -5.052 1.00 0.00 C ATOM 1167 C ILE A 75 116.484 7.886 -4.938 1.00 0.00 C ATOM 1168 O ILE A 75 116.925 7.035 -5.670 1.00 0.00 O ATOM 1169 CB ILE A 75 114.953 9.433 -6.140 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.684 10.698 -5.671 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.484 9.754 -6.421 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.834 11.013 -6.630 1.00 0.00 C ATOM 0 H ILE A 75 114.253 9.870 -3.768 1.00 0.00 H new ATOM 0 HA ILE A 75 114.381 7.540 -5.318 1.00 0.00 H new ATOM 0 HB ILE A 75 115.419 9.066 -7.055 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.990 11.538 -5.632 1.00 0.00 H new ATOM 0 HG13 ILE A 75 116.068 10.555 -4.661 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.420 10.517 -7.197 1.00 0.00 H new ATOM 0 HG22 ILE A 75 112.972 8.852 -6.756 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.011 10.122 -5.510 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.352 11.912 -6.295 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.533 10.177 -6.647 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.438 11.175 -7.632 1.00 0.00 H new ATOM 1184 N GLU A 76 117.222 8.439 -4.019 1.00 0.00 N ATOM 1185 CA GLU A 76 118.639 8.017 -3.856 1.00 0.00 C ATOM 1186 C GLU A 76 118.682 6.525 -3.552 1.00 0.00 C ATOM 1187 O GLU A 76 119.503 5.803 -4.083 1.00 0.00 O ATOM 1188 CB GLU A 76 119.289 8.788 -2.706 1.00 0.00 C ATOM 1189 CG GLU A 76 120.810 8.764 -2.873 1.00 0.00 C ATOM 1190 CD GLU A 76 121.215 9.717 -3.999 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.866 10.883 -3.916 1.00 0.00 O ATOM 1192 OE2 GLU A 76 121.869 9.265 -4.925 1.00 0.00 O ATOM 0 H GLU A 76 116.906 9.164 -3.375 1.00 0.00 H new ATOM 0 HA GLU A 76 119.185 8.226 -4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.930 9.817 -2.695 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.010 8.342 -1.751 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.293 9.058 -1.942 1.00 0.00 H new ATOM 0 HG3 GLU A 76 121.146 7.752 -3.100 1.00 0.00 H new ATOM 1199 N PHE A 77 117.812 6.043 -2.703 1.00 0.00 N ATOM 1200 CA PHE A 77 117.843 4.592 -2.397 1.00 0.00 C ATOM 1201 C PHE A 77 117.297 3.808 -3.594 1.00 0.00 C ATOM 1202 O PHE A 77 117.998 2.998 -4.164 1.00 0.00 O ATOM 1203 CB PHE A 77 117.013 4.305 -1.143 1.00 0.00 C ATOM 1204 CG PHE A 77 115.689 3.695 -1.527 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.604 2.328 -1.819 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.547 4.496 -1.590 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.374 1.766 -2.170 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.319 3.936 -1.944 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.232 2.570 -2.233 1.00 0.00 C ATOM 0 H PHE A 77 117.096 6.584 -2.219 1.00 0.00 H new ATOM 0 HA PHE A 77 118.870 4.280 -2.208 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.557 3.628 -0.484 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.849 5.228 -0.587 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.488 1.709 -1.773 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.614 5.550 -1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.305 0.711 -2.392 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.437 4.557 -1.995 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.281 2.136 -2.505 1.00 0.00 H new ATOM 1219 N PHE A 78 116.068 4.028 -4.004 1.00 0.00 N ATOM 1220 CA PHE A 78 115.565 3.252 -5.172 1.00 0.00 C ATOM 1221 C PHE A 78 116.470 3.502 -6.381 1.00 0.00 C ATOM 1222 O PHE A 78 116.684 2.629 -7.195 1.00 0.00 O ATOM 1223 CB PHE A 78 114.134 3.667 -5.514 1.00 0.00 C ATOM 1224 CG PHE A 78 113.574 2.722 -6.563 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.786 1.336 -6.461 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.845 3.234 -7.644 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.270 0.474 -7.436 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.329 2.367 -8.616 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.541 0.989 -8.512 1.00 0.00 C ATOM 0 H PHE A 78 115.413 4.692 -3.592 1.00 0.00 H new ATOM 0 HA PHE A 78 115.573 2.192 -4.917 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.513 3.644 -4.619 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.119 4.691 -5.886 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.347 0.936 -5.630 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.681 4.298 -7.728 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.435 -0.590 -7.357 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.766 2.764 -9.448 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.142 0.323 -9.262 1.00 0.00 H new ATOM 1239 N ASN A 79 117.005 4.685 -6.504 1.00 0.00 N ATOM 1240 CA ASN A 79 117.897 4.983 -7.663 1.00 0.00 C ATOM 1241 C ASN A 79 119.126 4.082 -7.599 1.00 0.00 C ATOM 1242 O ASN A 79 119.477 3.423 -8.556 1.00 0.00 O ATOM 1243 CB ASN A 79 118.349 6.443 -7.614 1.00 0.00 C ATOM 1244 CG ASN A 79 119.342 6.707 -8.748 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.865 7.796 -8.871 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.625 5.749 -9.587 1.00 0.00 N ATOM 0 H ASN A 79 116.864 5.458 -5.854 1.00 0.00 H new ATOM 0 HA ASN A 79 117.349 4.804 -8.588 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.488 7.105 -7.708 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.813 6.659 -6.652 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.286 5.915 -10.346 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.186 4.834 -9.484 1.00 0.00 H new ATOM 1253 N LYS A 80 119.787 4.046 -6.480 1.00 0.00 N ATOM 1254 CA LYS A 80 120.987 3.181 -6.370 1.00 0.00 C ATOM 1255 C LYS A 80 120.552 1.725 -6.518 1.00 0.00 C ATOM 1256 O LYS A 80 121.281 0.896 -7.022 1.00 0.00 O ATOM 1257 CB LYS A 80 121.649 3.391 -5.008 1.00 0.00 C ATOM 1258 CG LYS A 80 122.629 4.566 -5.093 1.00 0.00 C ATOM 1259 CD LYS A 80 123.959 4.092 -5.689 1.00 0.00 C ATOM 1260 CE LYS A 80 124.562 3.006 -4.797 1.00 0.00 C ATOM 1261 NZ LYS A 80 126.041 3.177 -4.736 1.00 0.00 N ATOM 0 H LYS A 80 119.549 4.575 -5.641 1.00 0.00 H new ATOM 0 HA LYS A 80 121.704 3.434 -7.151 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.891 3.589 -4.250 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.175 2.486 -4.704 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.206 5.360 -5.709 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.794 4.986 -4.101 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.801 3.704 -6.695 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.650 4.931 -5.776 1.00 0.00 H new ATOM 0 HE2 LYS A 80 124.137 3.066 -3.795 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.315 2.020 -5.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.451 2.438 -4.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.439 3.099 -5.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.266 4.113 -4.342 1.00 0.00 H new ATOM 1275 N LEU A 81 119.363 1.408 -6.084 1.00 0.00 N ATOM 1276 CA LEU A 81 118.880 0.004 -6.201 1.00 0.00 C ATOM 1277 C LEU A 81 118.625 -0.343 -7.672 1.00 0.00 C ATOM 1278 O LEU A 81 119.137 -1.314 -8.183 1.00 0.00 O ATOM 1279 CB LEU A 81 117.570 -0.157 -5.413 1.00 0.00 C ATOM 1280 CG LEU A 81 117.793 0.066 -3.908 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.874 -0.873 -3.126 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.252 -0.212 -3.522 1.00 0.00 C ATOM 0 H LEU A 81 118.706 2.060 -5.654 1.00 0.00 H new ATOM 0 HA LEU A 81 119.640 -0.665 -5.798 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.831 0.554 -5.783 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.164 -1.155 -5.579 1.00 0.00 H new ATOM 0 HG LEU A 81 117.567 1.105 -3.670 1.00 0.00 H new ATOM 0 HD11 LEU A 81 117.025 -0.723 -2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.835 -0.660 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.106 -1.907 -3.383 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.383 -0.047 -2.453 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.502 -1.245 -3.763 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.909 0.459 -4.076 1.00 0.00 H new ATOM 1294 N VAL A 82 117.830 0.424 -8.359 1.00 0.00 N ATOM 1295 CA VAL A 82 117.547 0.094 -9.783 1.00 0.00 C ATOM 1296 C VAL A 82 118.835 0.147 -10.621 1.00 0.00 C ATOM 1297 O VAL A 82 119.083 -0.718 -11.431 1.00 0.00 O ATOM 1298 CB VAL A 82 116.510 1.076 -10.338 1.00 0.00 C ATOM 1299 CG1 VAL A 82 116.962 2.517 -10.076 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.343 0.847 -11.844 1.00 0.00 C ATOM 0 H VAL A 82 117.366 1.259 -8.001 1.00 0.00 H new ATOM 0 HA VAL A 82 117.150 -0.920 -9.839 1.00 0.00 H new ATOM 0 HB VAL A 82 115.555 0.910 -9.840 1.00 0.00 H new ATOM 0 HG11 VAL A 82 116.220 3.209 -10.473 1.00 0.00 H new ATOM 0 HG12 VAL A 82 117.068 2.676 -9.003 1.00 0.00 H new ATOM 0 HG13 VAL A 82 117.920 2.692 -10.565 1.00 0.00 H new ATOM 0 HG21 VAL A 82 115.605 1.546 -12.239 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.298 1.007 -12.344 1.00 0.00 H new ATOM 0 HG23 VAL A 82 116.007 -0.174 -12.022 1.00 0.00 H new ATOM 1310 N THR A 83 119.649 1.151 -10.459 1.00 0.00 N ATOM 1311 CA THR A 83 120.897 1.228 -11.278 1.00 0.00 C ATOM 1312 C THR A 83 122.010 0.333 -10.700 1.00 0.00 C ATOM 1313 O THR A 83 122.694 -0.359 -11.427 1.00 0.00 O ATOM 1314 CB THR A 83 121.379 2.679 -11.329 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.128 2.884 -12.519 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.257 2.970 -10.117 1.00 0.00 C ATOM 0 H THR A 83 119.509 1.918 -9.801 1.00 0.00 H new ATOM 0 HA THR A 83 120.668 0.871 -12.282 1.00 0.00 H new ATOM 0 HB THR A 83 120.519 3.349 -11.319 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.437 3.813 -12.555 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.599 4.004 -10.156 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.682 2.812 -9.205 1.00 0.00 H new ATOM 0 HG23 THR A 83 123.119 2.302 -10.123 1.00 0.00 H new ATOM 1324 N SER A 84 122.225 0.368 -9.411 1.00 0.00 N ATOM 1325 CA SER A 84 123.328 -0.452 -8.811 1.00 0.00 C ATOM 1326 C SER A 84 122.946 -1.932 -8.701 1.00 0.00 C ATOM 1327 O SER A 84 123.803 -2.788 -8.608 1.00 0.00 O ATOM 1328 CB SER A 84 123.647 0.073 -7.410 1.00 0.00 C ATOM 1329 OG SER A 84 123.433 1.478 -7.373 1.00 0.00 O ATOM 0 H SER A 84 121.688 0.926 -8.747 1.00 0.00 H new ATOM 0 HA SER A 84 124.195 -0.367 -9.467 1.00 0.00 H new ATOM 0 HB2 SER A 84 123.016 -0.422 -6.672 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.681 -0.156 -7.150 1.00 0.00 H new ATOM 0 HG SER A 84 122.514 1.676 -7.649 1.00 0.00 H new ATOM 1335 N PHE A 85 121.685 -2.250 -8.672 1.00 0.00 N ATOM 1336 CA PHE A 85 121.296 -3.682 -8.522 1.00 0.00 C ATOM 1337 C PHE A 85 121.659 -4.496 -9.768 1.00 0.00 C ATOM 1338 O PHE A 85 121.319 -5.654 -9.871 1.00 0.00 O ATOM 1339 CB PHE A 85 119.797 -3.799 -8.236 1.00 0.00 C ATOM 1340 CG PHE A 85 118.990 -3.662 -9.511 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.537 -3.064 -10.657 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.691 -4.173 -9.549 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.781 -2.983 -11.832 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.936 -4.084 -10.722 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.481 -3.492 -11.865 1.00 0.00 C ATOM 0 H PHE A 85 120.911 -1.590 -8.745 1.00 0.00 H new ATOM 0 HA PHE A 85 121.854 -4.090 -7.679 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.586 -4.761 -7.769 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.497 -3.028 -7.527 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.541 -2.667 -10.632 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.269 -4.638 -8.670 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.204 -2.526 -12.715 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.929 -4.474 -10.745 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.898 -3.428 -12.772 1.00 0.00 H new ATOM 1355 N ASP A 86 122.340 -3.925 -10.721 1.00 0.00 N ATOM 1356 CA ASP A 86 122.693 -4.729 -11.922 1.00 0.00 C ATOM 1357 C ASP A 86 124.021 -5.448 -11.674 1.00 0.00 C ATOM 1358 O ASP A 86 124.590 -6.052 -12.560 1.00 0.00 O ATOM 1359 CB ASP A 86 122.800 -3.840 -13.155 1.00 0.00 C ATOM 1360 CG ASP A 86 123.545 -2.552 -12.802 1.00 0.00 C ATOM 1361 OD1 ASP A 86 123.977 -2.433 -11.668 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.672 -1.706 -13.673 1.00 0.00 O ATOM 0 H ASP A 86 122.662 -2.957 -10.722 1.00 0.00 H new ATOM 0 HA ASP A 86 121.907 -5.463 -12.102 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.325 -4.368 -13.951 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.805 -3.604 -13.532 1.00 0.00 H new ATOM 1367 N PHE A 87 124.499 -5.404 -10.461 1.00 0.00 N ATOM 1368 CA PHE A 87 125.771 -6.103 -10.123 1.00 0.00 C ATOM 1369 C PHE A 87 125.530 -6.933 -8.860 1.00 0.00 C ATOM 1370 O PHE A 87 125.300 -8.124 -8.923 1.00 0.00 O ATOM 1371 CB PHE A 87 126.895 -5.074 -9.887 1.00 0.00 C ATOM 1372 CG PHE A 87 127.691 -5.428 -8.644 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.044 -6.759 -8.382 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.060 -4.422 -7.737 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.754 -7.077 -7.225 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.779 -4.748 -6.582 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.123 -6.077 -6.328 1.00 0.00 C ATOM 0 H PHE A 87 124.060 -4.910 -9.684 1.00 0.00 H new ATOM 0 HA PHE A 87 126.079 -6.751 -10.943 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.556 -5.045 -10.753 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.467 -4.078 -9.779 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.766 -7.538 -9.076 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.788 -3.395 -7.931 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.019 -8.104 -7.023 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.068 -3.973 -5.888 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.676 -6.330 -5.435 1.00 0.00 H new ATOM 1387 N ASP A 88 125.574 -6.312 -7.714 1.00 0.00 N ATOM 1388 CA ASP A 88 125.339 -7.064 -6.452 1.00 0.00 C ATOM 1389 C ASP A 88 123.861 -6.980 -6.094 1.00 0.00 C ATOM 1390 O ASP A 88 123.430 -6.089 -5.390 1.00 0.00 O ATOM 1391 CB ASP A 88 126.159 -6.453 -5.323 1.00 0.00 C ATOM 1392 CG ASP A 88 126.250 -4.940 -5.521 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.531 -4.428 -6.363 1.00 0.00 O ATOM 1394 OD2 ASP A 88 127.035 -4.318 -4.828 1.00 0.00 O ATOM 0 H ASP A 88 125.763 -5.316 -7.598 1.00 0.00 H new ATOM 0 HA ASP A 88 125.635 -8.104 -6.590 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.698 -6.678 -4.361 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.158 -6.889 -5.307 1.00 0.00 H new ATOM 1399 N LEU A 89 123.081 -7.897 -6.576 1.00 0.00 N ATOM 1400 CA LEU A 89 121.630 -7.871 -6.272 1.00 0.00 C ATOM 1401 C LEU A 89 121.432 -7.967 -4.759 1.00 0.00 C ATOM 1402 O LEU A 89 120.763 -7.153 -4.157 1.00 0.00 O ATOM 1403 CB LEU A 89 120.951 -9.050 -6.970 1.00 0.00 C ATOM 1404 CG LEU A 89 121.419 -9.155 -8.438 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.054 -7.846 -8.915 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.452 -10.269 -8.587 1.00 0.00 C ATOM 0 H LEU A 89 123.386 -8.668 -7.170 1.00 0.00 H new ATOM 0 HA LEU A 89 121.188 -6.941 -6.630 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.183 -9.975 -6.442 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.869 -8.926 -6.936 1.00 0.00 H new ATOM 0 HG LEU A 89 120.538 -9.371 -9.043 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.373 -7.953 -9.952 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.324 -7.040 -8.841 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.917 -7.612 -8.292 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.773 -10.331 -9.627 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.313 -10.054 -7.954 1.00 0.00 H new ATOM 0 HD23 LEU A 89 122.009 -11.219 -8.287 1.00 0.00 H new ATOM 1418 N GLU A 90 122.003 -8.958 -4.140 1.00 0.00 N ATOM 1419 CA GLU A 90 121.841 -9.109 -2.666 1.00 0.00 C ATOM 1420 C GLU A 90 122.765 -8.136 -1.909 1.00 0.00 C ATOM 1421 O GLU A 90 122.355 -7.476 -0.972 1.00 0.00 O ATOM 1422 CB GLU A 90 122.189 -10.548 -2.273 1.00 0.00 C ATOM 1423 CG GLU A 90 121.965 -11.472 -3.469 1.00 0.00 C ATOM 1424 CD GLU A 90 122.159 -12.926 -3.035 1.00 0.00 C ATOM 1425 OE1 GLU A 90 121.472 -13.347 -2.119 1.00 0.00 O ATOM 1426 OE2 GLU A 90 122.992 -13.594 -3.627 1.00 0.00 O ATOM 0 H GLU A 90 122.576 -9.672 -4.589 1.00 0.00 H new ATOM 0 HA GLU A 90 120.809 -8.881 -2.400 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.227 -10.606 -1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.571 -10.866 -1.433 1.00 0.00 H new ATOM 0 HG2 GLU A 90 120.960 -11.331 -3.867 1.00 0.00 H new ATOM 0 HG3 GLU A 90 122.663 -11.224 -4.269 1.00 0.00 H new ATOM 1433 N ILE A 91 124.014 -8.064 -2.287 1.00 0.00 N ATOM 1434 CA ILE A 91 124.972 -7.166 -1.564 1.00 0.00 C ATOM 1435 C ILE A 91 124.775 -5.696 -1.960 1.00 0.00 C ATOM 1436 O ILE A 91 125.026 -4.800 -1.177 1.00 0.00 O ATOM 1437 CB ILE A 91 126.406 -7.590 -1.907 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.398 -9.034 -2.418 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.292 -7.496 -0.664 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.813 -9.609 -2.359 1.00 0.00 C ATOM 0 H ILE A 91 124.416 -8.587 -3.065 1.00 0.00 H new ATOM 0 HA ILE A 91 124.786 -7.257 -0.494 1.00 0.00 H new ATOM 0 HB ILE A 91 126.801 -6.927 -2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.723 -9.640 -1.814 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.025 -9.066 -3.442 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.308 -7.799 -0.918 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.300 -6.469 -0.300 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.900 -8.153 0.112 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.804 -10.636 -2.723 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.476 -9.009 -2.982 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.170 -9.592 -1.329 1.00 0.00 H new ATOM 1452 N GLY A 92 124.358 -5.431 -3.166 1.00 0.00 N ATOM 1453 CA GLY A 92 124.186 -4.012 -3.599 1.00 0.00 C ATOM 1454 C GLY A 92 123.212 -3.277 -2.674 1.00 0.00 C ATOM 1455 O GLY A 92 123.515 -2.223 -2.152 1.00 0.00 O ATOM 0 H GLY A 92 124.129 -6.132 -3.871 1.00 0.00 H new ATOM 0 HA2 GLY A 92 125.151 -3.506 -3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.815 -3.982 -4.623 1.00 0.00 H new ATOM 1459 N LYS A 93 122.041 -3.813 -2.483 1.00 0.00 N ATOM 1460 CA LYS A 93 121.039 -3.133 -1.609 1.00 0.00 C ATOM 1461 C LYS A 93 121.379 -3.344 -0.129 1.00 0.00 C ATOM 1462 O LYS A 93 120.878 -2.648 0.733 1.00 0.00 O ATOM 1463 CB LYS A 93 119.635 -3.690 -1.890 1.00 0.00 C ATOM 1464 CG LYS A 93 119.721 -5.022 -2.649 1.00 0.00 C ATOM 1465 CD LYS A 93 119.503 -4.783 -4.149 1.00 0.00 C ATOM 1466 CE LYS A 93 120.786 -4.248 -4.787 1.00 0.00 C ATOM 1467 NZ LYS A 93 121.021 -2.847 -4.339 1.00 0.00 N ATOM 0 H LYS A 93 121.731 -4.694 -2.894 1.00 0.00 H new ATOM 0 HA LYS A 93 121.063 -2.066 -1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 93 119.101 -3.835 -0.951 1.00 0.00 H new ATOM 0 HB3 LYS A 93 119.063 -2.969 -2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.695 -5.483 -2.483 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.971 -5.716 -2.270 1.00 0.00 H new ATOM 0 HD2 LYS A 93 119.207 -5.713 -4.634 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.690 -4.073 -4.298 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.632 -4.876 -4.508 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.706 -4.284 -5.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 122.040 -2.639 -4.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.516 -2.192 -4.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.672 -2.730 -3.366 1.00 0.00 H new ATOM 1481 N GLY A 94 122.208 -4.302 0.179 1.00 0.00 N ATOM 1482 CA GLY A 94 122.548 -4.557 1.610 1.00 0.00 C ATOM 1483 C GLY A 94 123.331 -3.379 2.216 1.00 0.00 C ATOM 1484 O GLY A 94 122.997 -2.893 3.278 1.00 0.00 O ATOM 0 H GLY A 94 122.664 -4.918 -0.494 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.633 -4.720 2.180 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.140 -5.469 1.689 1.00 0.00 H new ATOM 1488 N GLU A 95 124.377 -2.926 1.572 1.00 0.00 N ATOM 1489 CA GLU A 95 125.175 -1.795 2.150 1.00 0.00 C ATOM 1490 C GLU A 95 124.573 -0.449 1.737 1.00 0.00 C ATOM 1491 O GLU A 95 124.484 0.475 2.527 1.00 0.00 O ATOM 1492 CB GLU A 95 126.622 -1.877 1.644 1.00 0.00 C ATOM 1493 CG GLU A 95 127.257 -0.479 1.641 1.00 0.00 C ATOM 1494 CD GLU A 95 126.863 0.258 0.360 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.718 -0.400 -0.658 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.711 1.467 0.418 1.00 0.00 O ATOM 0 H GLU A 95 124.713 -3.285 0.678 1.00 0.00 H new ATOM 0 HA GLU A 95 125.156 -1.874 3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.201 -2.547 2.280 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.641 -2.296 0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.926 0.084 2.514 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.342 -0.561 1.707 1.00 0.00 H new ATOM 1503 N THR A 96 124.181 -0.317 0.504 1.00 0.00 N ATOM 1504 CA THR A 96 123.613 0.979 0.050 1.00 0.00 C ATOM 1505 C THR A 96 122.536 1.445 1.033 1.00 0.00 C ATOM 1506 O THR A 96 122.524 2.584 1.461 1.00 0.00 O ATOM 1507 CB THR A 96 123.015 0.816 -1.345 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.354 -0.436 -1.431 1.00 0.00 O ATOM 1509 CG2 THR A 96 124.138 0.879 -2.379 1.00 0.00 C ATOM 0 H THR A 96 124.229 -1.047 -0.207 1.00 0.00 H new ATOM 0 HA THR A 96 124.404 1.728 0.012 1.00 0.00 H new ATOM 0 HB THR A 96 122.297 1.614 -1.537 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.950 -1.093 -1.848 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.719 0.763 -3.379 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.645 1.841 -2.307 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.852 0.078 -2.190 1.00 0.00 H new ATOM 1517 N MET A 97 121.641 0.574 1.406 1.00 0.00 N ATOM 1518 CA MET A 97 120.576 0.969 2.370 1.00 0.00 C ATOM 1519 C MET A 97 121.230 1.574 3.613 1.00 0.00 C ATOM 1520 O MET A 97 120.621 2.322 4.360 1.00 0.00 O ATOM 1521 CB MET A 97 119.782 -0.275 2.772 1.00 0.00 C ATOM 1522 CG MET A 97 120.621 -1.127 3.728 1.00 0.00 C ATOM 1523 SD MET A 97 120.458 -0.485 5.412 1.00 0.00 S ATOM 1524 CE MET A 97 120.304 -2.082 6.249 1.00 0.00 C ATOM 0 H MET A 97 121.600 -0.394 1.086 1.00 0.00 H new ATOM 0 HA MET A 97 119.909 1.699 1.912 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.847 0.016 3.252 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.519 -0.854 1.887 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.292 -2.165 3.690 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.667 -1.113 3.422 1.00 0.00 H new ATOM 0 HE1 MET A 97 120.191 -1.921 7.321 1.00 0.00 H new ATOM 0 HE2 MET A 97 119.430 -2.610 5.867 1.00 0.00 H new ATOM 0 HE3 MET A 97 121.198 -2.678 6.064 1.00 0.00 H new ATOM 1534 N LYS A 98 122.469 1.245 3.838 1.00 0.00 N ATOM 1535 CA LYS A 98 123.184 1.769 5.031 1.00 0.00 C ATOM 1536 C LYS A 98 123.559 3.237 4.834 1.00 0.00 C ATOM 1537 O LYS A 98 123.431 4.036 5.738 1.00 0.00 O ATOM 1538 CB LYS A 98 124.461 0.954 5.247 1.00 0.00 C ATOM 1539 CG LYS A 98 124.661 0.697 6.742 1.00 0.00 C ATOM 1540 CD LYS A 98 123.822 -0.510 7.170 1.00 0.00 C ATOM 1541 CE LYS A 98 123.639 -0.492 8.689 1.00 0.00 C ATOM 1542 NZ LYS A 98 124.963 -0.299 9.346 1.00 0.00 N ATOM 0 H LYS A 98 123.022 0.630 3.241 1.00 0.00 H new ATOM 0 HA LYS A 98 122.528 1.686 5.897 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.395 0.007 4.711 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.319 1.490 4.842 1.00 0.00 H new ATOM 0 HG2 LYS A 98 125.715 0.514 6.952 1.00 0.00 H new ATOM 0 HG3 LYS A 98 124.370 1.577 7.315 1.00 0.00 H new ATOM 0 HD2 LYS A 98 122.851 -0.485 6.676 1.00 0.00 H new ATOM 0 HD3 LYS A 98 124.312 -1.434 6.863 1.00 0.00 H new ATOM 0 HE2 LYS A 98 122.959 0.310 8.975 1.00 0.00 H new ATOM 0 HE3 LYS A 98 123.188 -1.426 9.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 124.910 -0.617 10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 125.685 -0.853 8.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 125.220 0.708 9.320 1.00 0.00 H new ATOM 1556 N TYR A 99 124.046 3.606 3.681 1.00 0.00 N ATOM 1557 CA TYR A 99 124.443 5.030 3.494 1.00 0.00 C ATOM 1558 C TYR A 99 123.215 5.942 3.525 1.00 0.00 C ATOM 1559 O TYR A 99 123.308 7.081 3.940 1.00 0.00 O ATOM 1560 CB TYR A 99 125.227 5.207 2.187 1.00 0.00 C ATOM 1561 CG TYR A 99 124.293 5.348 1.013 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.540 6.514 0.841 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.198 4.310 0.087 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.688 6.636 -0.263 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.346 4.427 -1.016 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.589 5.592 -1.191 1.00 0.00 C ATOM 1567 OH TYR A 99 121.748 5.713 -2.278 1.00 0.00 O ATOM 0 H TYR A 99 124.184 2.997 2.875 1.00 0.00 H new ATOM 0 HA TYR A 99 125.095 5.315 4.319 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.864 6.088 2.257 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.883 4.350 2.033 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.616 7.318 1.558 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.784 3.413 0.222 1.00 0.00 H new ATOM 0 HE1 TYR A 99 122.107 7.536 -0.399 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.272 3.621 -1.731 1.00 0.00 H new ATOM 0 HH TYR A 99 121.396 4.831 -2.519 1.00 0.00 H new ATOM 1577 N ILE A 100 122.059 5.471 3.122 1.00 0.00 N ATOM 1578 CA ILE A 100 120.867 6.368 3.182 1.00 0.00 C ATOM 1579 C ILE A 100 120.528 6.620 4.650 1.00 0.00 C ATOM 1580 O ILE A 100 120.461 7.748 5.096 1.00 0.00 O ATOM 1581 CB ILE A 100 119.666 5.723 2.488 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.944 5.592 0.990 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.433 6.608 2.695 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.868 4.400 0.747 1.00 0.00 C ATOM 0 H ILE A 100 121.893 4.531 2.764 1.00 0.00 H new ATOM 0 HA ILE A 100 121.095 7.304 2.672 1.00 0.00 H new ATOM 0 HB ILE A 100 119.491 4.734 2.911 1.00 0.00 H new ATOM 0 HG12 ILE A 100 119.009 5.458 0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.404 6.505 0.613 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.573 6.154 2.203 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.231 6.706 3.762 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.617 7.594 2.268 1.00 0.00 H new ATOM 0 HD11 ILE A 100 121.067 4.306 -0.321 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.807 4.553 1.279 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.390 3.490 1.109 1.00 0.00 H new ATOM 1596 N LEU A 101 120.336 5.577 5.413 1.00 0.00 N ATOM 1597 CA LEU A 101 120.027 5.766 6.860 1.00 0.00 C ATOM 1598 C LEU A 101 121.258 6.344 7.550 1.00 0.00 C ATOM 1599 O LEU A 101 121.205 7.384 8.175 1.00 0.00 O ATOM 1600 CB LEU A 101 119.687 4.413 7.487 1.00 0.00 C ATOM 1601 CG LEU A 101 118.344 4.503 8.207 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.849 3.093 8.539 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.511 5.311 9.496 1.00 0.00 C ATOM 0 H LEU A 101 120.379 4.607 5.099 1.00 0.00 H new ATOM 0 HA LEU A 101 119.180 6.442 6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.646 3.644 6.716 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.468 4.120 8.189 1.00 0.00 H new ATOM 0 HG LEU A 101 117.616 4.998 7.564 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.890 3.156 9.053 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.730 2.523 7.618 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.574 2.595 9.183 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.553 5.376 10.011 1.00 0.00 H new ATOM 0 HD22 LEU A 101 119.238 4.819 10.142 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.862 6.314 9.254 1.00 0.00 H new ATOM 1615 N ALA A 102 122.370 5.677 7.434 1.00 0.00 N ATOM 1616 CA ALA A 102 123.607 6.187 8.073 1.00 0.00 C ATOM 1617 C ALA A 102 123.821 7.636 7.649 1.00 0.00 C ATOM 1618 O ALA A 102 123.388 8.557 8.313 1.00 0.00 O ATOM 1619 CB ALA A 102 124.804 5.346 7.626 1.00 0.00 C ATOM 0 H ALA A 102 122.474 4.800 6.923 1.00 0.00 H new ATOM 0 HA ALA A 102 123.511 6.126 9.157 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.711 5.724 8.098 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.649 4.308 7.919 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.907 5.406 6.543 1.00 0.00 H new ATOM 1625 N LEU A 103 124.482 7.845 6.543 1.00 0.00 N ATOM 1626 CA LEU A 103 124.730 9.234 6.069 1.00 0.00 C ATOM 1627 C LEU A 103 125.447 10.027 7.164 1.00 0.00 C ATOM 1628 O LEU A 103 126.101 11.014 6.891 1.00 0.00 O ATOM 1629 CB LEU A 103 123.399 9.910 5.734 1.00 0.00 C ATOM 1630 CG LEU A 103 123.651 11.366 5.340 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.668 11.418 4.199 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.338 12.004 4.880 1.00 0.00 C ATOM 0 H LEU A 103 124.862 7.110 5.946 1.00 0.00 H new ATOM 0 HA LEU A 103 125.353 9.205 5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.906 9.382 4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.730 9.865 6.593 1.00 0.00 H new ATOM 0 HG LEU A 103 124.041 11.912 6.199 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.847 12.456 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.604 10.963 4.525 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.279 10.872 3.340 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.517 13.042 4.599 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.949 11.457 4.021 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.612 11.968 5.692 1.00 0.00 H new ATOM 1644 N LYS A 104 125.336 9.603 8.399 1.00 0.00 N ATOM 1645 CA LYS A 104 126.022 10.333 9.505 1.00 0.00 C ATOM 1646 C LYS A 104 127.284 10.988 8.947 1.00 0.00 C ATOM 1647 O LYS A 104 127.594 12.126 9.239 1.00 0.00 O ATOM 1648 CB LYS A 104 126.409 9.339 10.607 1.00 0.00 C ATOM 1649 CG LYS A 104 126.277 9.990 11.989 1.00 0.00 C ATOM 1650 CD LYS A 104 125.284 9.195 12.842 1.00 0.00 C ATOM 1651 CE LYS A 104 123.917 9.172 12.154 1.00 0.00 C ATOM 1652 NZ LYS A 104 122.843 9.300 13.179 1.00 0.00 N ATOM 0 H LYS A 104 124.800 8.784 8.687 1.00 0.00 H new ATOM 0 HA LYS A 104 125.359 11.092 9.921 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.770 8.458 10.551 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.434 8.999 10.455 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.249 10.022 12.481 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.938 11.021 11.885 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.647 8.177 12.986 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.197 9.645 13.831 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.846 9.987 11.434 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.794 8.243 11.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 121.914 9.284 12.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 122.907 8.508 13.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 122.958 10.197 13.692 1.00 0.00 H new ATOM 1666 N ASP A 105 128.003 10.272 8.127 1.00 0.00 N ATOM 1667 CA ASP A 105 129.237 10.837 7.519 1.00 0.00 C ATOM 1668 C ASP A 105 129.133 10.700 6.000 1.00 0.00 C ATOM 1669 O ASP A 105 128.727 11.617 5.315 1.00 0.00 O ATOM 1670 CB ASP A 105 130.460 10.071 8.029 1.00 0.00 C ATOM 1671 CG ASP A 105 130.829 10.571 9.427 1.00 0.00 C ATOM 1672 OD1 ASP A 105 131.603 11.510 9.513 1.00 0.00 O ATOM 1673 OD2 ASP A 105 130.331 10.006 10.387 1.00 0.00 O ATOM 0 H ASP A 105 127.786 9.314 7.851 1.00 0.00 H new ATOM 0 HA ASP A 105 129.344 11.887 7.791 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.247 9.002 8.058 1.00 0.00 H new ATOM 0 HB3 ASP A 105 131.300 10.210 7.348 1.00 0.00 H new ATOM 1678 N GLN A 106 129.477 9.554 5.471 1.00 0.00 N ATOM 1679 CA GLN A 106 129.380 9.346 3.996 1.00 0.00 C ATOM 1680 C GLN A 106 130.311 8.204 3.571 1.00 0.00 C ATOM 1681 O GLN A 106 129.865 7.179 3.093 1.00 0.00 O ATOM 1682 CB GLN A 106 129.771 10.631 3.254 1.00 0.00 C ATOM 1683 CG GLN A 106 128.510 11.360 2.777 1.00 0.00 C ATOM 1684 CD GLN A 106 128.757 12.870 2.788 1.00 0.00 C ATOM 1685 OE1 GLN A 106 129.248 13.424 1.825 1.00 0.00 O ATOM 1686 NE2 GLN A 106 128.436 13.563 3.846 1.00 0.00 N ATOM 0 H GLN A 106 129.822 8.752 5.999 1.00 0.00 H new ATOM 0 HA GLN A 106 128.351 9.088 3.744 1.00 0.00 H new ATOM 0 HB2 GLN A 106 130.350 11.279 3.911 1.00 0.00 H new ATOM 0 HB3 GLN A 106 130.407 10.391 2.402 1.00 0.00 H new ATOM 0 HG2 GLN A 106 128.246 11.032 1.772 1.00 0.00 H new ATOM 0 HG3 GLN A 106 127.668 11.114 3.424 1.00 0.00 H new ATOM 0 HE21 GLN A 106 128.024 13.098 4.655 1.00 0.00 H new ATOM 0 HE22 GLN A 106 128.597 14.570 3.864 1.00 0.00 H new ATOM 1695 N PRO A 107 131.595 8.383 3.734 1.00 0.00 N ATOM 1696 CA PRO A 107 132.610 7.356 3.352 1.00 0.00 C ATOM 1697 C PRO A 107 132.500 6.063 4.169 1.00 0.00 C ATOM 1698 O PRO A 107 133.032 5.042 3.786 1.00 0.00 O ATOM 1699 CB PRO A 107 133.953 8.039 3.629 1.00 0.00 C ATOM 1700 CG PRO A 107 133.650 9.126 4.604 1.00 0.00 C ATOM 1701 CD PRO A 107 132.228 9.584 4.301 1.00 0.00 C ATOM 0 HA PRO A 107 132.476 7.046 2.316 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.676 7.333 4.039 1.00 0.00 H new ATOM 0 HB3 PRO A 107 134.385 8.442 2.713 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.732 8.764 5.629 1.00 0.00 H new ATOM 0 HG3 PRO A 107 134.355 9.951 4.500 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.714 9.922 5.201 1.00 0.00 H new ATOM 0 HD3 PRO A 107 132.215 10.415 3.596 1.00 0.00 H new ATOM 1709 N GLU A 108 131.827 6.087 5.288 1.00 0.00 N ATOM 1710 CA GLU A 108 131.721 4.838 6.102 1.00 0.00 C ATOM 1711 C GLU A 108 130.755 3.868 5.419 1.00 0.00 C ATOM 1712 O GLU A 108 131.093 2.734 5.126 1.00 0.00 O ATOM 1713 CB GLU A 108 131.208 5.178 7.507 1.00 0.00 C ATOM 1714 CG GLU A 108 131.138 6.697 7.675 1.00 0.00 C ATOM 1715 CD GLU A 108 132.519 7.304 7.422 1.00 0.00 C ATOM 1716 OE1 GLU A 108 133.384 6.584 6.951 1.00 0.00 O ATOM 1717 OE2 GLU A 108 132.689 8.479 7.703 1.00 0.00 O ATOM 0 H GLU A 108 131.352 6.904 5.671 1.00 0.00 H new ATOM 0 HA GLU A 108 132.704 4.373 6.184 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.222 4.739 7.661 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.869 4.749 8.260 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.412 7.117 6.979 1.00 0.00 H new ATOM 0 HG3 GLU A 108 130.798 6.947 8.680 1.00 0.00 H new ATOM 1724 N ALA A 109 129.561 4.309 5.144 1.00 0.00 N ATOM 1725 CA ALA A 109 128.582 3.419 4.467 1.00 0.00 C ATOM 1726 C ALA A 109 129.148 3.023 3.104 1.00 0.00 C ATOM 1727 O ALA A 109 128.973 1.914 2.637 1.00 0.00 O ATOM 1728 CB ALA A 109 127.264 4.170 4.288 1.00 0.00 C ATOM 0 H ALA A 109 129.221 5.247 5.359 1.00 0.00 H new ATOM 0 HA ALA A 109 128.403 2.524 5.063 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.541 3.523 3.792 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.878 4.465 5.264 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.432 5.059 3.681 1.00 0.00 H new ATOM 1734 N ALA A 110 129.843 3.927 2.474 1.00 0.00 N ATOM 1735 CA ALA A 110 130.446 3.624 1.150 1.00 0.00 C ATOM 1736 C ALA A 110 131.593 2.636 1.342 1.00 0.00 C ATOM 1737 O ALA A 110 131.831 1.780 0.513 1.00 0.00 O ATOM 1738 CB ALA A 110 130.978 4.914 0.521 1.00 0.00 C ATOM 0 H ALA A 110 130.020 4.869 2.823 1.00 0.00 H new ATOM 0 HA ALA A 110 129.693 3.190 0.492 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.420 4.690 -0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 110 130.158 5.621 0.392 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.735 5.351 1.172 1.00 0.00 H new ATOM 1744 N GLN A 111 132.302 2.732 2.436 1.00 0.00 N ATOM 1745 CA GLN A 111 133.417 1.777 2.666 1.00 0.00 C ATOM 1746 C GLN A 111 132.871 0.369 2.477 1.00 0.00 C ATOM 1747 O GLN A 111 133.411 -0.424 1.730 1.00 0.00 O ATOM 1748 CB GLN A 111 133.965 1.941 4.084 1.00 0.00 C ATOM 1749 CG GLN A 111 134.813 3.214 4.153 1.00 0.00 C ATOM 1750 CD GLN A 111 136.274 2.847 4.422 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.904 3.413 5.294 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.844 1.918 3.704 1.00 0.00 N ATOM 0 H GLN A 111 132.157 3.424 3.171 1.00 0.00 H new ATOM 0 HA GLN A 111 134.229 1.967 1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.145 1.997 4.799 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.567 1.074 4.357 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.733 3.767 3.217 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.441 3.868 4.942 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.316 1.443 2.972 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.818 1.667 3.875 1.00 0.00 H new ATOM 1761 N LEU A 112 131.778 0.058 3.118 1.00 0.00 N ATOM 1762 CA LEU A 112 131.186 -1.291 2.929 1.00 0.00 C ATOM 1763 C LEU A 112 130.924 -1.469 1.437 1.00 0.00 C ATOM 1764 O LEU A 112 131.175 -2.507 0.866 1.00 0.00 O ATOM 1765 CB LEU A 112 129.870 -1.393 3.701 1.00 0.00 C ATOM 1766 CG LEU A 112 130.159 -1.791 5.149 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.614 -3.253 5.208 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.261 -0.892 5.711 1.00 0.00 C ATOM 0 H LEU A 112 131.276 0.674 3.757 1.00 0.00 H new ATOM 0 HA LEU A 112 131.861 -2.063 3.298 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.344 -0.439 3.673 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.218 -2.130 3.233 1.00 0.00 H new ATOM 0 HG LEU A 112 129.251 -1.675 5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 112 130.818 -3.529 6.243 1.00 0.00 H new ATOM 0 HD12 LEU A 112 129.828 -3.895 4.809 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.520 -3.376 4.614 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.469 -1.173 6.743 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.165 -1.008 5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 112 130.935 0.148 5.677 1.00 0.00 H new ATOM 1780 N ALA A 113 130.442 -0.441 0.797 1.00 0.00 N ATOM 1781 CA ALA A 113 130.184 -0.526 -0.665 1.00 0.00 C ATOM 1782 C ALA A 113 131.481 -0.925 -1.375 1.00 0.00 C ATOM 1783 O ALA A 113 131.465 -1.512 -2.438 1.00 0.00 O ATOM 1784 CB ALA A 113 129.714 0.835 -1.184 1.00 0.00 C ATOM 0 H ALA A 113 130.215 0.456 1.226 1.00 0.00 H new ATOM 0 HA ALA A 113 129.411 -1.269 -0.861 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.526 0.770 -2.256 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.796 1.123 -0.671 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.485 1.582 -0.996 1.00 0.00 H new ATOM 1790 N LEU A 114 132.606 -0.605 -0.790 1.00 0.00 N ATOM 1791 CA LEU A 114 133.911 -0.958 -1.427 1.00 0.00 C ATOM 1792 C LEU A 114 134.100 -2.472 -1.372 1.00 0.00 C ATOM 1793 O LEU A 114 134.265 -3.133 -2.389 1.00 0.00 O ATOM 1794 CB LEU A 114 135.051 -0.272 -0.670 1.00 0.00 C ATOM 1795 CG LEU A 114 136.247 -0.085 -1.605 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.601 -1.424 -2.256 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.894 0.934 -2.692 1.00 0.00 C ATOM 0 H LEU A 114 132.678 -0.114 0.101 1.00 0.00 H new ATOM 0 HA LEU A 114 133.916 -0.625 -2.465 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.719 0.694 -0.290 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.341 -0.872 0.193 1.00 0.00 H new ATOM 0 HG LEU A 114 137.101 0.278 -1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.453 -1.291 -2.922 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.855 -2.149 -1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.747 -1.788 -2.828 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.747 1.066 -3.358 1.00 0.00 H new ATOM 0 HD22 LEU A 114 135.039 0.574 -3.265 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.644 1.888 -2.229 1.00 0.00 H new ATOM 1809 N ARG A 115 134.049 -3.048 -0.203 1.00 0.00 N ATOM 1810 CA ARG A 115 134.196 -4.517 -0.138 1.00 0.00 C ATOM 1811 C ARG A 115 133.153 -5.086 -1.093 1.00 0.00 C ATOM 1812 O ARG A 115 133.440 -5.914 -1.928 1.00 0.00 O ATOM 1813 CB ARG A 115 133.967 -5.015 1.295 1.00 0.00 C ATOM 1814 CG ARG A 115 135.291 -4.990 2.066 1.00 0.00 C ATOM 1815 CD ARG A 115 135.395 -3.689 2.864 1.00 0.00 C ATOM 1816 NE ARG A 115 136.824 -3.419 3.191 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.630 -2.968 2.269 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.186 -2.755 1.061 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.881 -2.730 2.556 1.00 0.00 N ATOM 0 H ARG A 115 133.915 -2.572 0.689 1.00 0.00 H new ATOM 0 HA ARG A 115 135.199 -4.835 -0.421 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.231 -4.386 1.796 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.563 -6.027 1.279 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.348 -5.846 2.738 1.00 0.00 H new ATOM 0 HG3 ARG A 115 136.129 -5.072 1.373 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.980 -2.862 2.287 1.00 0.00 H new ATOM 0 HD3 ARG A 115 134.809 -3.764 3.780 1.00 0.00 H new ATOM 0 HE ARG A 115 137.172 -3.587 4.135 1.00 0.00 H new ATOM 0 HH11 ARG A 115 136.208 -2.941 0.837 1.00 0.00 H new ATOM 0 HH12 ARG A 115 137.816 -2.402 0.341 1.00 0.00 H new ATOM 0 HH21 ARG A 115 139.228 -2.897 3.501 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.511 -2.378 1.836 1.00 0.00 H new ATOM 1833 N VAL A 116 131.953 -4.592 -1.040 1.00 0.00 N ATOM 1834 CA VAL A 116 130.945 -5.076 -2.004 1.00 0.00 C ATOM 1835 C VAL A 116 131.615 -5.028 -3.373 1.00 0.00 C ATOM 1836 O VAL A 116 131.371 -5.845 -4.233 1.00 0.00 O ATOM 1837 CB VAL A 116 129.721 -4.154 -1.965 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.191 -3.916 -3.378 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.620 -4.790 -1.109 1.00 0.00 C ATOM 0 H VAL A 116 131.633 -3.884 -0.379 1.00 0.00 H new ATOM 0 HA VAL A 116 130.605 -6.086 -1.774 1.00 0.00 H new ATOM 0 HB VAL A 116 130.017 -3.199 -1.530 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.322 -3.260 -3.335 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.968 -3.450 -3.984 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.905 -4.868 -3.824 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.752 -4.131 -1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.334 -5.750 -1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.990 -4.942 -0.095 1.00 0.00 H new ATOM 1849 N GLY A 117 132.500 -4.087 -3.564 1.00 0.00 N ATOM 1850 CA GLY A 117 133.221 -4.012 -4.857 1.00 0.00 C ATOM 1851 C GLY A 117 133.786 -5.398 -5.151 1.00 0.00 C ATOM 1852 O GLY A 117 133.620 -5.944 -6.237 1.00 0.00 O ATOM 0 H GLY A 117 132.751 -3.372 -2.881 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.547 -3.696 -5.653 1.00 0.00 H new ATOM 0 HA3 GLY A 117 134.022 -3.275 -4.806 1.00 0.00 H new ATOM 1856 N ILE A 118 134.440 -5.999 -4.185 1.00 0.00 N ATOM 1857 CA ILE A 118 134.979 -7.357 -4.447 1.00 0.00 C ATOM 1858 C ILE A 118 133.835 -8.217 -4.964 1.00 0.00 C ATOM 1859 O ILE A 118 134.029 -9.104 -5.771 1.00 0.00 O ATOM 1860 CB ILE A 118 135.634 -7.986 -3.198 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.751 -7.897 -1.940 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.933 -7.239 -2.912 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.328 -8.397 -2.208 1.00 0.00 C ATOM 0 H ILE A 118 134.617 -5.617 -3.256 1.00 0.00 H new ATOM 0 HA ILE A 118 135.774 -7.291 -5.190 1.00 0.00 H new ATOM 0 HB ILE A 118 135.796 -9.042 -3.415 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.199 -8.486 -1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.714 -6.864 -1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.413 -7.668 -2.032 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.600 -7.328 -3.769 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.715 -6.187 -2.730 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.737 -8.318 -1.296 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.871 -7.791 -2.990 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.363 -9.438 -2.529 1.00 0.00 H new ATOM 1875 N ALA A 119 132.630 -7.947 -4.531 1.00 0.00 N ATOM 1876 CA ALA A 119 131.489 -8.740 -5.034 1.00 0.00 C ATOM 1877 C ALA A 119 131.268 -8.384 -6.500 1.00 0.00 C ATOM 1878 O ALA A 119 130.833 -9.200 -7.282 1.00 0.00 O ATOM 1879 CB ALA A 119 130.232 -8.448 -4.214 1.00 0.00 C ATOM 0 H ALA A 119 132.397 -7.217 -3.857 1.00 0.00 H new ATOM 0 HA ALA A 119 131.705 -9.804 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.401 -9.040 -4.598 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.410 -8.707 -3.170 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.987 -7.389 -4.288 1.00 0.00 H new ATOM 1885 N VAL A 120 131.600 -7.188 -6.908 1.00 0.00 N ATOM 1886 CA VAL A 120 131.418 -6.862 -8.345 1.00 0.00 C ATOM 1887 C VAL A 120 132.091 -7.980 -9.108 1.00 0.00 C ATOM 1888 O VAL A 120 131.571 -8.498 -10.076 1.00 0.00 O ATOM 1889 CB VAL A 120 132.072 -5.524 -8.674 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.926 -5.242 -10.168 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.385 -4.420 -7.873 1.00 0.00 C ATOM 0 H VAL A 120 131.979 -6.443 -6.324 1.00 0.00 H new ATOM 0 HA VAL A 120 130.363 -6.775 -8.607 1.00 0.00 H new ATOM 0 HB VAL A 120 133.130 -5.557 -8.415 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.393 -4.286 -10.405 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.412 -6.034 -10.737 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.869 -5.204 -10.429 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.848 -3.461 -8.104 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.328 -4.385 -8.135 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.488 -4.626 -6.808 1.00 0.00 H new ATOM 1901 N ALA A 121 133.218 -8.408 -8.627 1.00 0.00 N ATOM 1902 CA ALA A 121 133.895 -9.558 -9.273 1.00 0.00 C ATOM 1903 C ALA A 121 133.299 -10.828 -8.656 1.00 0.00 C ATOM 1904 O ALA A 121 133.415 -11.915 -9.186 1.00 0.00 O ATOM 1905 CB ALA A 121 135.399 -9.501 -8.996 1.00 0.00 C ATOM 0 H ALA A 121 133.698 -8.014 -7.818 1.00 0.00 H new ATOM 0 HA ALA A 121 133.750 -9.541 -10.353 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.889 -10.349 -9.474 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.808 -8.573 -9.396 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.573 -9.540 -7.921 1.00 0.00 H new ATOM 1911 N LYS A 122 132.662 -10.675 -7.519 1.00 0.00 N ATOM 1912 CA LYS A 122 132.043 -11.836 -6.811 1.00 0.00 C ATOM 1913 C LYS A 122 130.617 -11.470 -6.363 1.00 0.00 C ATOM 1914 O LYS A 122 130.269 -11.619 -5.209 1.00 0.00 O ATOM 1915 CB LYS A 122 132.892 -12.198 -5.590 1.00 0.00 C ATOM 1916 CG LYS A 122 134.054 -13.094 -6.025 1.00 0.00 C ATOM 1917 CD LYS A 122 133.585 -14.550 -6.082 1.00 0.00 C ATOM 1918 CE LYS A 122 134.280 -15.265 -7.242 1.00 0.00 C ATOM 1919 NZ LYS A 122 134.114 -16.738 -7.088 1.00 0.00 N ATOM 0 H LYS A 122 132.544 -9.779 -7.046 1.00 0.00 H new ATOM 0 HA LYS A 122 131.997 -12.690 -7.486 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.274 -11.293 -5.118 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.281 -12.711 -4.848 1.00 0.00 H new ATOM 0 HG2 LYS A 122 134.422 -12.781 -7.002 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.884 -12.996 -5.325 1.00 0.00 H new ATOM 0 HD2 LYS A 122 133.812 -15.053 -5.142 1.00 0.00 H new ATOM 0 HD3 LYS A 122 132.503 -14.590 -6.212 1.00 0.00 H new ATOM 0 HE2 LYS A 122 133.856 -14.938 -8.191 1.00 0.00 H new ATOM 0 HE3 LYS A 122 135.339 -15.007 -7.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 134.586 -17.225 -7.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 134.538 -17.043 -6.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 133.101 -16.975 -7.091 1.00 0.00 H new ATOM 1933 N SER A 123 129.807 -10.957 -7.252 1.00 0.00 N ATOM 1934 CA SER A 123 128.419 -10.542 -6.867 1.00 0.00 C ATOM 1935 C SER A 123 127.813 -11.546 -5.894 1.00 0.00 C ATOM 1936 O SER A 123 126.813 -11.282 -5.257 1.00 0.00 O ATOM 1937 CB SER A 123 127.544 -10.458 -8.116 1.00 0.00 C ATOM 1938 OG SER A 123 128.363 -10.196 -9.248 1.00 0.00 O ATOM 0 H SER A 123 130.045 -10.806 -8.232 1.00 0.00 H new ATOM 0 HA SER A 123 128.468 -9.566 -6.384 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.999 -11.392 -8.256 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.801 -9.669 -8.001 1.00 0.00 H new ATOM 0 HG SER A 123 127.804 -10.143 -10.051 1.00 0.00 H new ATOM 1944 N ASP A 124 128.408 -12.687 -5.765 1.00 0.00 N ATOM 1945 CA ASP A 124 127.860 -13.697 -4.820 1.00 0.00 C ATOM 1946 C ASP A 124 128.981 -14.634 -4.371 1.00 0.00 C ATOM 1947 O ASP A 124 128.896 -15.837 -4.518 1.00 0.00 O ATOM 1948 CB ASP A 124 126.753 -14.495 -5.513 1.00 0.00 C ATOM 1949 CG ASP A 124 127.375 -15.515 -6.468 1.00 0.00 C ATOM 1950 OD1 ASP A 124 127.950 -15.096 -7.459 1.00 0.00 O ATOM 1951 OD2 ASP A 124 127.264 -16.699 -6.194 1.00 0.00 O ATOM 0 H ASP A 124 129.249 -12.970 -6.269 1.00 0.00 H new ATOM 0 HA ASP A 124 127.444 -13.196 -3.946 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.139 -15.005 -4.770 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.095 -13.822 -6.062 1.00 0.00 H new ATOM 1956 N GLY A 125 130.036 -14.092 -3.822 1.00 0.00 N ATOM 1957 CA GLY A 125 131.159 -14.958 -3.366 1.00 0.00 C ATOM 1958 C GLY A 125 131.959 -14.251 -2.268 1.00 0.00 C ATOM 1959 O GLY A 125 132.469 -14.881 -1.363 1.00 0.00 O ATOM 0 H GLY A 125 130.167 -13.092 -3.671 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.769 -15.904 -2.990 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.811 -15.193 -4.207 1.00 0.00 H new ATOM 1963 N ASN A 126 132.084 -12.951 -2.338 1.00 0.00 N ATOM 1964 CA ASN A 126 132.864 -12.227 -1.293 1.00 0.00 C ATOM 1965 C ASN A 126 131.949 -11.280 -0.508 1.00 0.00 C ATOM 1966 O ASN A 126 130.751 -11.250 -0.710 1.00 0.00 O ATOM 1967 CB ASN A 126 133.996 -11.442 -1.957 1.00 0.00 C ATOM 1968 CG ASN A 126 135.263 -12.299 -1.984 1.00 0.00 C ATOM 1969 OD1 ASN A 126 136.356 -11.795 -1.817 1.00 0.00 O ATOM 1970 ND2 ASN A 126 135.163 -13.584 -2.189 1.00 0.00 N ATOM 0 H ASN A 126 131.682 -12.364 -3.069 1.00 0.00 H new ATOM 0 HA ASN A 126 133.289 -12.949 -0.596 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.712 -11.161 -2.971 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.181 -10.517 -1.410 1.00 0.00 H new ATOM 0 HD21 ASN A 126 136.002 -14.164 -2.209 1.00 0.00 H new ATOM 0 HD22 ASN A 126 134.246 -14.008 -2.329 1.00 0.00 H new ATOM 1977 N PHE A 127 132.509 -10.525 0.401 1.00 0.00 N ATOM 1978 CA PHE A 127 131.690 -9.590 1.231 1.00 0.00 C ATOM 1979 C PHE A 127 131.184 -10.332 2.466 1.00 0.00 C ATOM 1980 O PHE A 127 131.278 -11.539 2.553 1.00 0.00 O ATOM 1981 CB PHE A 127 130.494 -9.064 0.434 1.00 0.00 C ATOM 1982 CG PHE A 127 130.128 -7.698 0.962 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.994 -6.623 0.752 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.935 -7.507 1.671 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.672 -5.355 1.247 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.613 -6.236 2.167 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.483 -5.161 1.955 1.00 0.00 C ATOM 0 H PHE A 127 133.508 -10.516 0.606 1.00 0.00 H new ATOM 0 HA PHE A 127 132.312 -8.745 1.525 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.741 -9.006 -0.626 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.648 -9.745 0.527 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.914 -6.771 0.206 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.264 -8.338 1.835 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.343 -4.525 1.082 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.693 -6.087 2.713 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.236 -4.182 2.338 1.00 0.00 H new ATOM 1997 N ASP A 128 130.650 -9.623 3.422 1.00 0.00 N ATOM 1998 CA ASP A 128 130.142 -10.294 4.645 1.00 0.00 C ATOM 1999 C ASP A 128 131.326 -10.724 5.513 1.00 0.00 C ATOM 2000 O ASP A 128 131.156 -11.301 6.566 1.00 0.00 O ATOM 2001 CB ASP A 128 129.324 -11.520 4.236 1.00 0.00 C ATOM 2002 CG ASP A 128 128.591 -11.229 2.925 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.822 -10.283 2.897 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.811 -11.957 1.972 1.00 0.00 O ATOM 0 H ASP A 128 130.545 -8.609 3.407 1.00 0.00 H new ATOM 0 HA ASP A 128 129.511 -9.610 5.213 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.978 -12.383 4.115 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.607 -11.770 5.018 1.00 0.00 H new ATOM 2009 N ASP A 129 132.528 -10.443 5.083 1.00 0.00 N ATOM 2010 CA ASP A 129 133.718 -10.838 5.890 1.00 0.00 C ATOM 2011 C ASP A 129 134.341 -9.596 6.530 1.00 0.00 C ATOM 2012 O ASP A 129 134.712 -9.605 7.687 1.00 0.00 O ATOM 2013 CB ASP A 129 134.748 -11.516 4.985 1.00 0.00 C ATOM 2014 CG ASP A 129 134.248 -12.909 4.596 1.00 0.00 C ATOM 2015 OD1 ASP A 129 133.988 -13.695 5.492 1.00 0.00 O ATOM 2016 OD2 ASP A 129 134.134 -13.166 3.409 1.00 0.00 O ATOM 0 H ASP A 129 132.736 -9.958 4.210 1.00 0.00 H new ATOM 0 HA ASP A 129 133.409 -11.531 6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 129 134.914 -10.915 4.091 1.00 0.00 H new ATOM 0 HB3 ASP A 129 135.706 -11.592 5.500 1.00 0.00 H new ATOM 2021 N ASP A 130 134.450 -8.523 5.796 1.00 0.00 N ATOM 2022 CA ASP A 130 135.036 -7.287 6.377 1.00 0.00 C ATOM 2023 C ASP A 130 133.926 -6.520 7.084 1.00 0.00 C ATOM 2024 O ASP A 130 134.170 -5.675 7.921 1.00 0.00 O ATOM 2025 CB ASP A 130 135.633 -6.426 5.264 1.00 0.00 C ATOM 2026 CG ASP A 130 136.824 -5.637 5.811 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.787 -6.265 6.221 1.00 0.00 O ATOM 2028 OD2 ASP A 130 136.753 -4.419 5.811 1.00 0.00 O ATOM 0 H ASP A 130 134.159 -8.451 4.821 1.00 0.00 H new ATOM 0 HA ASP A 130 135.826 -7.541 7.084 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.951 -7.056 4.434 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.879 -5.742 4.874 1.00 0.00 H new ATOM 2033 N GLU A 131 132.703 -6.816 6.746 1.00 0.00 N ATOM 2034 CA GLU A 131 131.560 -6.118 7.382 1.00 0.00 C ATOM 2035 C GLU A 131 131.721 -6.156 8.901 1.00 0.00 C ATOM 2036 O GLU A 131 131.252 -5.287 9.594 1.00 0.00 O ATOM 2037 CB GLU A 131 130.256 -6.818 6.987 1.00 0.00 C ATOM 2038 CG GLU A 131 129.964 -6.584 5.500 1.00 0.00 C ATOM 2039 CD GLU A 131 131.272 -6.586 4.706 1.00 0.00 C ATOM 2040 OE1 GLU A 131 131.706 -7.658 4.319 1.00 0.00 O ATOM 2041 OE2 GLU A 131 131.818 -5.515 4.500 1.00 0.00 O ATOM 0 H GLU A 131 132.448 -7.517 6.051 1.00 0.00 H new ATOM 0 HA GLU A 131 131.533 -5.081 7.047 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.332 -7.887 7.187 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.432 -6.439 7.592 1.00 0.00 H new ATOM 0 HG2 GLU A 131 129.299 -7.362 5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.449 -5.633 5.367 1.00 0.00 H new ATOM 2048 N LYS A 132 132.384 -7.153 9.425 1.00 0.00 N ATOM 2049 CA LYS A 132 132.570 -7.225 10.905 1.00 0.00 C ATOM 2050 C LYS A 132 133.556 -6.143 11.342 1.00 0.00 C ATOM 2051 O LYS A 132 133.315 -5.411 12.280 1.00 0.00 O ATOM 2052 CB LYS A 132 133.109 -8.602 11.282 1.00 0.00 C ATOM 2053 CG LYS A 132 132.429 -9.653 10.406 1.00 0.00 C ATOM 2054 CD LYS A 132 132.062 -10.875 11.248 1.00 0.00 C ATOM 2055 CE LYS A 132 133.305 -11.374 11.980 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.212 -12.848 12.173 1.00 0.00 N ATOM 0 H LYS A 132 132.803 -7.917 8.896 1.00 0.00 H new ATOM 0 HA LYS A 132 131.615 -7.066 11.405 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.189 -8.636 11.142 1.00 0.00 H new ATOM 0 HB3 LYS A 132 132.917 -8.807 12.335 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.533 -9.233 9.949 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.094 -9.947 9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 132 131.283 -10.616 11.965 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.660 -11.663 10.611 1.00 0.00 H new ATOM 0 HE2 LYS A 132 134.200 -11.127 11.408 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.396 -10.876 12.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 134.059 -13.187 12.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.366 -13.072 12.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 133.145 -13.316 11.247 1.00 0.00 H new ATOM 2070 N SER A 133 134.658 -6.019 10.657 1.00 0.00 N ATOM 2071 CA SER A 133 135.637 -4.962 11.025 1.00 0.00 C ATOM 2072 C SER A 133 135.119 -3.638 10.470 1.00 0.00 C ATOM 2073 O SER A 133 135.347 -2.576 11.021 1.00 0.00 O ATOM 2074 CB SER A 133 137.000 -5.283 10.411 1.00 0.00 C ATOM 2075 OG SER A 133 137.728 -6.125 11.296 1.00 0.00 O ATOM 0 H SER A 133 134.921 -6.601 9.862 1.00 0.00 H new ATOM 0 HA SER A 133 135.751 -4.905 12.108 1.00 0.00 H new ATOM 0 HB2 SER A 133 136.871 -5.775 9.447 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.555 -4.363 10.227 1.00 0.00 H new ATOM 0 HG SER A 133 138.602 -6.334 10.904 1.00 0.00 H new ATOM 2081 N ALA A 134 134.402 -3.705 9.381 1.00 0.00 N ATOM 2082 CA ALA A 134 133.841 -2.471 8.775 1.00 0.00 C ATOM 2083 C ALA A 134 132.761 -1.912 9.701 1.00 0.00 C ATOM 2084 O ALA A 134 132.809 -0.765 10.098 1.00 0.00 O ATOM 2085 CB ALA A 134 133.235 -2.806 7.413 1.00 0.00 C ATOM 0 H ALA A 134 134.181 -4.568 8.885 1.00 0.00 H new ATOM 0 HA ALA A 134 134.628 -1.728 8.642 1.00 0.00 H new ATOM 0 HB1 ALA A 134 132.822 -1.902 6.966 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.008 -3.213 6.761 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.442 -3.543 7.539 1.00 0.00 H new ATOM 2091 N VAL A 135 131.791 -2.712 10.065 1.00 0.00 N ATOM 2092 CA VAL A 135 130.735 -2.202 10.979 1.00 0.00 C ATOM 2093 C VAL A 135 131.411 -1.665 12.238 1.00 0.00 C ATOM 2094 O VAL A 135 130.975 -0.702 12.830 1.00 0.00 O ATOM 2095 CB VAL A 135 129.748 -3.315 11.342 1.00 0.00 C ATOM 2096 CG1 VAL A 135 128.904 -3.669 10.111 1.00 0.00 C ATOM 2097 CG2 VAL A 135 130.511 -4.551 11.823 1.00 0.00 C ATOM 0 H VAL A 135 131.688 -3.683 9.771 1.00 0.00 H new ATOM 0 HA VAL A 135 130.173 -1.409 10.485 1.00 0.00 H new ATOM 0 HB VAL A 135 129.093 -2.971 12.143 1.00 0.00 H new ATOM 0 HG11 VAL A 135 128.201 -4.461 10.368 1.00 0.00 H new ATOM 0 HG12 VAL A 135 128.353 -2.788 9.782 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.557 -4.010 9.308 1.00 0.00 H new ATOM 0 HG21 VAL A 135 129.803 -5.339 12.080 1.00 0.00 H new ATOM 0 HG22 VAL A 135 131.172 -4.902 11.031 1.00 0.00 H new ATOM 0 HG23 VAL A 135 131.102 -4.294 12.702 1.00 0.00 H new ATOM 2107 N ARG A 136 132.490 -2.273 12.643 1.00 0.00 N ATOM 2108 CA ARG A 136 133.209 -1.783 13.850 1.00 0.00 C ATOM 2109 C ARG A 136 133.455 -0.283 13.694 1.00 0.00 C ATOM 2110 O ARG A 136 133.111 0.514 14.548 1.00 0.00 O ATOM 2111 CB ARG A 136 134.553 -2.513 13.957 1.00 0.00 C ATOM 2112 CG ARG A 136 135.178 -2.279 15.342 1.00 0.00 C ATOM 2113 CD ARG A 136 135.516 -3.622 16.007 1.00 0.00 C ATOM 2114 NE ARG A 136 136.985 -3.698 16.245 1.00 0.00 N ATOM 2115 CZ ARG A 136 137.787 -4.033 15.271 1.00 0.00 C ATOM 2116 NH1 ARG A 136 137.303 -4.300 14.089 1.00 0.00 N ATOM 2117 NH2 ARG A 136 139.074 -4.101 15.480 1.00 0.00 N ATOM 0 H ARG A 136 132.905 -3.088 12.190 1.00 0.00 H new ATOM 0 HA ARG A 136 132.619 -1.970 14.747 1.00 0.00 H new ATOM 0 HB2 ARG A 136 134.409 -3.581 13.791 1.00 0.00 H new ATOM 0 HB3 ARG A 136 135.230 -2.158 13.180 1.00 0.00 H new ATOM 0 HG2 ARG A 136 136.081 -1.676 15.244 1.00 0.00 H new ATOM 0 HG3 ARG A 136 134.487 -1.718 15.971 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.978 -3.720 16.950 1.00 0.00 H new ATOM 0 HD3 ARG A 136 135.196 -4.447 15.370 1.00 0.00 H new ATOM 0 HE ARG A 136 137.364 -3.488 17.169 1.00 0.00 H new ATOM 0 HH11 ARG A 136 136.298 -4.247 13.926 1.00 0.00 H new ATOM 0 HH12 ARG A 136 137.930 -4.562 13.328 1.00 0.00 H new ATOM 0 HH21 ARG A 136 139.452 -3.892 16.404 1.00 0.00 H new ATOM 0 HH22 ARG A 136 139.701 -4.363 14.719 1.00 0.00 H new ATOM 2131 N GLU A 137 134.044 0.104 12.597 1.00 0.00 N ATOM 2132 CA GLU A 137 134.319 1.549 12.360 1.00 0.00 C ATOM 2133 C GLU A 137 133.023 2.272 11.976 1.00 0.00 C ATOM 2134 O GLU A 137 132.870 3.451 12.221 1.00 0.00 O ATOM 2135 CB GLU A 137 135.336 1.693 11.225 1.00 0.00 C ATOM 2136 CG GLU A 137 136.598 0.898 11.566 1.00 0.00 C ATOM 2137 CD GLU A 137 137.499 0.817 10.333 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.056 1.224 9.272 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.617 0.348 10.470 1.00 0.00 O ATOM 0 H GLU A 137 134.348 -0.521 11.851 1.00 0.00 H new ATOM 0 HA GLU A 137 134.719 1.992 13.272 1.00 0.00 H new ATOM 0 HB2 GLU A 137 134.907 1.332 10.290 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.585 2.744 11.076 1.00 0.00 H new ATOM 0 HG2 GLU A 137 137.131 1.376 12.388 1.00 0.00 H new ATOM 0 HG3 GLU A 137 136.330 -0.104 11.900 1.00 0.00 H new ATOM 2146 N ILE A 138 132.092 1.584 11.369 1.00 0.00 N ATOM 2147 CA ILE A 138 130.818 2.252 10.969 1.00 0.00 C ATOM 2148 C ILE A 138 130.016 2.613 12.225 1.00 0.00 C ATOM 2149 O ILE A 138 129.650 3.747 12.434 1.00 0.00 O ATOM 2150 CB ILE A 138 130.005 1.302 10.070 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.428 2.079 8.878 1.00 0.00 C ATOM 2152 CG2 ILE A 138 128.851 0.666 10.857 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.346 1.927 7.661 1.00 0.00 C ATOM 0 H ILE A 138 132.158 0.594 11.134 1.00 0.00 H new ATOM 0 HA ILE A 138 131.036 3.165 10.415 1.00 0.00 H new ATOM 0 HB ILE A 138 130.671 0.516 9.715 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.431 1.709 8.640 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.324 3.133 9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.289 -0.001 10.204 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.252 0.099 11.697 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.191 1.449 11.231 1.00 0.00 H new ATOM 0 HD11 ILE A 138 129.930 2.481 6.820 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.335 2.319 7.900 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.428 0.873 7.396 1.00 0.00 H new ATOM 2165 N ALA A 139 129.743 1.656 13.061 1.00 0.00 N ATOM 2166 CA ALA A 139 128.971 1.936 14.298 1.00 0.00 C ATOM 2167 C ALA A 139 129.658 3.051 15.084 1.00 0.00 C ATOM 2168 O ALA A 139 129.018 3.928 15.629 1.00 0.00 O ATOM 2169 CB ALA A 139 128.927 0.671 15.155 1.00 0.00 C ATOM 0 H ALA A 139 130.024 0.683 12.939 1.00 0.00 H new ATOM 0 HA ALA A 139 127.958 2.244 14.037 1.00 0.00 H new ATOM 0 HB1 ALA A 139 128.362 0.868 16.066 1.00 0.00 H new ATOM 0 HB2 ALA A 139 128.446 -0.131 14.595 1.00 0.00 H new ATOM 0 HB3 ALA A 139 129.942 0.373 15.416 1.00 0.00 H new ATOM 2175 N ARG A 140 130.959 3.015 15.156 1.00 0.00 N ATOM 2176 CA ARG A 140 131.691 4.062 15.918 1.00 0.00 C ATOM 2177 C ARG A 140 131.710 5.375 15.120 1.00 0.00 C ATOM 2178 O ARG A 140 131.576 6.447 15.676 1.00 0.00 O ATOM 2179 CB ARG A 140 133.124 3.570 16.184 1.00 0.00 C ATOM 2180 CG ARG A 140 134.148 4.654 15.824 1.00 0.00 C ATOM 2181 CD ARG A 140 133.917 5.895 16.691 1.00 0.00 C ATOM 2182 NE ARG A 140 133.802 7.096 15.817 1.00 0.00 N ATOM 2183 CZ ARG A 140 134.040 8.283 16.303 1.00 0.00 C ATOM 2184 NH1 ARG A 140 134.375 8.419 17.557 1.00 0.00 N ATOM 2185 NH2 ARG A 140 133.942 9.334 15.536 1.00 0.00 N ATOM 0 H ARG A 140 131.547 2.305 14.719 1.00 0.00 H new ATOM 0 HA ARG A 140 131.191 4.249 16.868 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.231 3.297 17.234 1.00 0.00 H new ATOM 0 HB3 ARG A 140 133.319 2.671 15.600 1.00 0.00 H new ATOM 0 HG2 ARG A 140 135.159 4.276 15.976 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.060 4.915 14.769 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.010 5.775 17.283 1.00 0.00 H new ATOM 0 HD3 ARG A 140 134.741 6.020 17.393 1.00 0.00 H new ATOM 0 HE ARG A 140 133.537 6.990 14.838 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.451 7.597 18.157 1.00 0.00 H new ATOM 0 HH12 ARG A 140 134.561 9.347 17.937 1.00 0.00 H new ATOM 0 HH21 ARG A 140 133.679 9.228 14.556 1.00 0.00 H new ATOM 0 HH22 ARG A 140 134.128 10.262 15.916 1.00 0.00 H new ATOM 2199 N SER A 141 131.875 5.304 13.826 1.00 0.00 N ATOM 2200 CA SER A 141 131.904 6.554 13.011 1.00 0.00 C ATOM 2201 C SER A 141 130.513 7.190 12.999 1.00 0.00 C ATOM 2202 O SER A 141 130.359 8.379 13.194 1.00 0.00 O ATOM 2203 CB SER A 141 132.322 6.220 11.579 1.00 0.00 C ATOM 2204 OG SER A 141 133.570 5.539 11.601 1.00 0.00 O ATOM 0 H SER A 141 131.991 4.438 13.299 1.00 0.00 H new ATOM 0 HA SER A 141 132.619 7.252 13.446 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.564 5.599 11.102 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.403 7.133 10.989 1.00 0.00 H new ATOM 0 HG SER A 141 133.419 4.585 11.765 1.00 0.00 H new ATOM 2210 N LEU A 142 129.499 6.403 12.775 1.00 0.00 N ATOM 2211 CA LEU A 142 128.117 6.949 12.751 1.00 0.00 C ATOM 2212 C LEU A 142 127.585 7.019 14.185 1.00 0.00 C ATOM 2213 O LEU A 142 127.306 8.084 14.698 1.00 0.00 O ATOM 2214 CB LEU A 142 127.224 6.037 11.906 1.00 0.00 C ATOM 2215 CG LEU A 142 127.994 5.568 10.667 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.192 4.484 9.953 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.205 6.745 9.715 1.00 0.00 C ATOM 0 H LEU A 142 129.570 5.399 12.607 1.00 0.00 H new ATOM 0 HA LEU A 142 128.118 7.948 12.315 1.00 0.00 H new ATOM 0 HB2 LEU A 142 126.904 5.177 12.495 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.322 6.571 11.606 1.00 0.00 H new ATOM 0 HG LEU A 142 128.961 5.171 10.974 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.738 4.149 9.071 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.039 3.641 10.627 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.225 4.887 9.650 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.753 6.408 8.835 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.238 7.144 9.409 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.775 7.524 10.221 1.00 0.00 H new ATOM 2229 N GLY A 143 127.456 5.897 14.847 1.00 0.00 N ATOM 2230 CA GLY A 143 126.959 5.928 16.253 1.00 0.00 C ATOM 2231 C GLY A 143 126.137 4.674 16.573 1.00 0.00 C ATOM 2232 O GLY A 143 125.171 4.737 17.308 1.00 0.00 O ATOM 0 H GLY A 143 127.671 4.971 14.478 1.00 0.00 H new ATOM 0 HA2 GLY A 143 127.803 5.999 16.939 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.347 6.817 16.407 1.00 0.00 H new ATOM 2236 N PHE A 144 126.506 3.532 16.049 1.00 0.00 N ATOM 2237 CA PHE A 144 125.727 2.295 16.363 1.00 0.00 C ATOM 2238 C PHE A 144 126.559 1.376 17.258 1.00 0.00 C ATOM 2239 O PHE A 144 127.516 1.795 17.875 1.00 0.00 O ATOM 2240 CB PHE A 144 125.368 1.539 15.080 1.00 0.00 C ATOM 2241 CG PHE A 144 125.052 2.503 13.965 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.446 3.733 14.245 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.362 2.159 12.646 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.150 4.618 13.202 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.068 3.042 11.603 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.461 4.273 11.881 1.00 0.00 C ATOM 0 H PHE A 144 127.303 3.403 15.425 1.00 0.00 H new ATOM 0 HA PHE A 144 124.810 2.590 16.873 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.197 0.895 14.787 1.00 0.00 H new ATOM 0 HB3 PHE A 144 124.510 0.891 15.261 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.207 3.999 15.264 1.00 0.00 H new ATOM 0 HD2 PHE A 144 125.830 1.209 12.432 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.682 5.567 13.416 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.309 2.775 10.584 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.233 4.956 11.076 1.00 0.00 H new ATOM 2256 N ASP A 145 126.199 0.119 17.327 1.00 0.00 N ATOM 2257 CA ASP A 145 126.966 -0.839 18.175 1.00 0.00 C ATOM 2258 C ASP A 145 128.373 -1.015 17.594 1.00 0.00 C ATOM 2259 O ASP A 145 128.540 -1.560 16.522 1.00 0.00 O ATOM 2260 CB ASP A 145 126.251 -2.192 18.182 1.00 0.00 C ATOM 2261 CG ASP A 145 125.284 -2.254 19.366 1.00 0.00 C ATOM 2262 OD1 ASP A 145 124.937 -1.202 19.877 1.00 0.00 O ATOM 2263 OD2 ASP A 145 124.907 -3.352 19.741 1.00 0.00 O ATOM 0 H ASP A 145 125.405 -0.284 16.831 1.00 0.00 H new ATOM 0 HA ASP A 145 127.034 -0.454 19.192 1.00 0.00 H new ATOM 0 HB2 ASP A 145 125.708 -2.333 17.248 1.00 0.00 H new ATOM 0 HB3 ASP A 145 126.980 -3.000 18.252 1.00 0.00 H new ATOM 2268 N PRO A 146 129.380 -0.549 18.287 1.00 0.00 N ATOM 2269 CA PRO A 146 130.790 -0.651 17.818 1.00 0.00 C ATOM 2270 C PRO A 146 131.170 -2.065 17.362 1.00 0.00 C ATOM 2271 O PRO A 146 131.826 -2.799 18.074 1.00 0.00 O ATOM 2272 CB PRO A 146 131.619 -0.252 19.040 1.00 0.00 C ATOM 2273 CG PRO A 146 130.717 0.585 19.882 1.00 0.00 C ATOM 2274 CD PRO A 146 129.287 0.128 19.591 1.00 0.00 C ATOM 0 HA PRO A 146 130.957 -0.018 16.946 1.00 0.00 H new ATOM 0 HB2 PRO A 146 131.960 -1.131 19.586 1.00 0.00 H new ATOM 0 HB3 PRO A 146 132.508 0.305 18.745 1.00 0.00 H new ATOM 0 HG2 PRO A 146 130.953 0.464 20.939 1.00 0.00 H new ATOM 0 HG3 PRO A 146 130.840 1.642 19.647 1.00 0.00 H new ATOM 0 HD2 PRO A 146 128.920 -0.547 20.364 1.00 0.00 H new ATOM 0 HD3 PRO A 146 128.599 0.973 19.552 1.00 0.00 H new ATOM 2282 N ALA A 147 130.784 -2.444 16.172 1.00 0.00 N ATOM 2283 CA ALA A 147 131.146 -3.794 15.659 1.00 0.00 C ATOM 2284 C ALA A 147 130.203 -4.855 16.210 1.00 0.00 C ATOM 2285 O ALA A 147 130.078 -5.026 17.406 1.00 0.00 O ATOM 2286 CB ALA A 147 132.570 -4.141 16.080 1.00 0.00 C ATOM 0 H ALA A 147 130.232 -1.873 15.532 1.00 0.00 H new ATOM 0 HA ALA A 147 131.067 -3.775 14.572 1.00 0.00 H new ATOM 0 HB1 ALA A 147 132.830 -5.130 15.702 1.00 0.00 H new ATOM 0 HB2 ALA A 147 133.260 -3.403 15.671 1.00 0.00 H new ATOM 0 HB3 ALA A 147 132.639 -4.139 17.168 1.00 0.00 H new ATOM 2292 N GLU A 148 129.565 -5.589 15.342 1.00 0.00 N ATOM 2293 CA GLU A 148 128.650 -6.669 15.801 1.00 0.00 C ATOM 2294 C GLU A 148 127.622 -6.983 14.707 1.00 0.00 C ATOM 2295 O GLU A 148 126.480 -7.283 14.995 1.00 0.00 O ATOM 2296 CB GLU A 148 127.914 -6.225 17.075 1.00 0.00 C ATOM 2297 CG GLU A 148 128.598 -6.825 18.310 1.00 0.00 C ATOM 2298 CD GLU A 148 128.561 -5.814 19.457 1.00 0.00 C ATOM 2299 OE1 GLU A 148 127.488 -5.595 19.994 1.00 0.00 O ATOM 2300 OE2 GLU A 148 129.607 -5.274 19.779 1.00 0.00 O ATOM 0 H GLU A 148 129.639 -5.486 14.330 1.00 0.00 H new ATOM 0 HA GLU A 148 129.239 -7.561 16.013 1.00 0.00 H new ATOM 0 HB2 GLU A 148 127.911 -5.137 17.143 1.00 0.00 H new ATOM 0 HB3 GLU A 148 126.873 -6.545 17.034 1.00 0.00 H new ATOM 0 HG2 GLU A 148 128.095 -7.745 18.606 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.630 -7.087 18.076 1.00 0.00 H new ATOM 2307 N PHE A 149 128.002 -6.916 13.455 1.00 0.00 N ATOM 2308 CA PHE A 149 127.013 -7.210 12.376 1.00 0.00 C ATOM 2309 C PHE A 149 127.514 -8.357 11.503 1.00 0.00 C ATOM 2310 O PHE A 149 126.966 -9.441 11.515 1.00 0.00 O ATOM 2311 CB PHE A 149 126.814 -5.966 11.512 1.00 0.00 C ATOM 2312 CG PHE A 149 126.508 -4.782 12.396 1.00 0.00 C ATOM 2313 CD1 PHE A 149 127.462 -4.330 13.314 1.00 0.00 C ATOM 2314 CD2 PHE A 149 125.271 -4.137 12.299 1.00 0.00 C ATOM 2315 CE1 PHE A 149 127.182 -3.235 14.134 1.00 0.00 C ATOM 2316 CE2 PHE A 149 124.989 -3.039 13.120 1.00 0.00 C ATOM 2317 CZ PHE A 149 125.946 -2.589 14.038 1.00 0.00 C ATOM 0 H PHE A 149 128.941 -6.674 13.138 1.00 0.00 H new ATOM 0 HA PHE A 149 126.066 -7.496 12.833 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.711 -5.772 10.924 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.999 -6.127 10.807 1.00 0.00 H new ATOM 0 HD1 PHE A 149 128.417 -4.829 13.389 1.00 0.00 H new ATOM 0 HD2 PHE A 149 124.534 -4.486 11.591 1.00 0.00 H new ATOM 0 HE1 PHE A 149 127.920 -2.887 14.842 1.00 0.00 H new ATOM 0 HE2 PHE A 149 124.034 -2.539 13.046 1.00 0.00 H new ATOM 0 HZ PHE A 149 125.729 -1.742 14.672 1.00 0.00 H new ATOM 2327 N GLY A 150 128.543 -8.130 10.739 1.00 0.00 N ATOM 2328 CA GLY A 150 129.060 -9.210 9.865 1.00 0.00 C ATOM 2329 C GLY A 150 127.888 -9.950 9.223 1.00 0.00 C ATOM 2330 O GLY A 150 127.659 -11.112 9.488 1.00 0.00 O ATOM 0 H GLY A 150 129.046 -7.244 10.683 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.706 -8.790 9.093 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.667 -9.904 10.446 1.00 0.00 H new