USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 796 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 98 ASN : amide:sc= 0.249 X(o=-0.49,f=-0.26) USER MOD Set 1.2: A 100 GLN : amide:sc= -0.736 K(o=-0.49,f=0.88) USER MOD Set 2.1: A 55 SER OG : rot -142:sc= 0.276 USER MOD Set 2.2: A 57 SER OG : rot 110:sc= 0.944 USER MOD Set 3.1: A 56 LYS NZ :NH3+ 151:sc= 0.777 (180deg=-0.31) USER MOD Set 3.2: A 61 GLN : amide:sc= -1.35 K(o=-0.57,f=-2.5) USER MOD Set 4.1: A 12 THR OG1 : rot -83:sc= 1.29 USER MOD Set 4.2: A 120 LYS NZ :NH3+ -138:sc= -1.28 (180deg=-4.67!) USER MOD Single : A 16 LYS NZ :NH3+ 177:sc=-0.000267 (180deg=-0.0218) USER MOD Single : A 17 SER OG : rot 77:sc= 1.21 USER MOD Single : A 23 GLN : amide:sc= -0.0631 X(o=-0.063,f=-0.54) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0665 USER MOD Single : A 45 MET CE :methyl -141:sc= -2.02! (180deg=-3.95!) USER MOD Single : A 46 ASN : amide:sc= 0.76 K(o=0.76,f=-3.2!) USER MOD Single : A 47 MET CE :methyl 161:sc= -0.123 (180deg=-0.563) USER MOD Single : A 59 LYS NZ :NH3+ -167:sc= 1.83 (180deg=1.53) USER MOD Single : A 62 SER OG : rot 180:sc=-0.00777 USER MOD Single : A 67 LYS NZ :NH3+ -170:sc= 0.49 (180deg=0.286) USER MOD Single : A 69 SER OG : rot 84:sc= 0.798 USER MOD Single : A 71 TYR OH : rot 44:sc= 1.31 USER MOD Single : A 72 SER OG : rot 180:sc=-0.00434 USER MOD Single : A 74 HIS : no HD1:sc= -0.642 K(o=-0.64,f=-1.2) USER MOD Single : A 75 ASN : amide:sc= -3.39! C(o=-3.4!,f=-6.3!) USER MOD Single : A 81 LYS NZ :NH3+ -168:sc= 0.84! (180deg=0.681!) USER MOD Single : A 82 LYS NZ :NH3+ -167:sc= 2.06 (180deg=1.69) USER MOD Single : A 87 LYS NZ :NH3+ 161:sc= 1.83 (180deg=1.61) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.336 K(o=-0.34,f=-9.5!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= 0.543 K(o=0.54,f=-0.011) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc=-0.00242 X(o=-0.0024,f=-0.32) USER MOD Single : A 113 THR OG1 : rot -160:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0.403 X(o=0.4,f=-0.09) USER MOD Single : A 118 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 124 MET CE :methyl 162:sc= -0.174 (180deg=-0.594) USER MOD ----------------------------------------------------------------- ATOM 141 N ARG A 9 -4.845 -16.609 -3.924 1.00 0.00 N ATOM 142 CA ARG A 9 -3.612 -16.116 -4.477 1.00 0.00 C ATOM 143 C ARG A 9 -2.618 -15.763 -3.384 1.00 0.00 C ATOM 144 O ARG A 9 -2.888 -14.898 -2.571 1.00 0.00 O ATOM 145 CB ARG A 9 -3.898 -14.862 -5.316 1.00 0.00 C ATOM 146 CG ARG A 9 -4.770 -15.040 -6.576 1.00 0.00 C ATOM 147 CD ARG A 9 -6.218 -15.447 -6.252 1.00 0.00 C ATOM 148 NE ARG A 9 -7.120 -15.242 -7.375 1.00 0.00 N ATOM 149 CZ ARG A 9 -8.307 -15.809 -7.574 1.00 0.00 C ATOM 150 NH1 ARG A 9 -8.730 -16.808 -6.806 1.00 0.00 N ATOM 151 NH2 ARG A 9 -9.066 -15.380 -8.568 1.00 0.00 N ATOM 0 HA ARG A 9 -3.179 -16.901 -5.097 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -4.381 -14.128 -4.672 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -2.943 -14.436 -5.624 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -4.778 -14.107 -7.140 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -4.321 -15.797 -7.218 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -6.240 -16.497 -5.960 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -6.571 -14.871 -5.397 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.806 -14.588 -8.092 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -8.141 -17.153 -6.048 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -9.643 -17.229 -6.975 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -8.739 -14.624 -9.170 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -9.978 -15.805 -8.733 1.00 0.00 H new ATOM 165 N ASP A 10 -1.479 -16.415 -3.395 1.00 0.00 N ATOM 166 CA ASP A 10 -0.406 -16.143 -2.420 1.00 0.00 C ATOM 167 C ASP A 10 0.416 -14.993 -2.931 1.00 0.00 C ATOM 168 O ASP A 10 1.324 -15.167 -3.726 1.00 0.00 O ATOM 169 CB ASP A 10 0.483 -17.389 -2.226 1.00 0.00 C ATOM 170 CG ASP A 10 1.592 -17.276 -1.182 1.00 0.00 C ATOM 171 OD1 ASP A 10 2.735 -16.897 -1.518 1.00 0.00 O ATOM 172 OD2 ASP A 10 1.372 -17.654 -0.009 1.00 0.00 O ATOM 0 H ASP A 10 -1.254 -17.147 -4.068 1.00 0.00 H new ATOM 0 HA ASP A 10 -0.843 -15.892 -1.453 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -0.158 -18.227 -1.954 1.00 0.00 H new ATOM 0 HB3 ASP A 10 0.940 -17.635 -3.184 1.00 0.00 H new ATOM 177 N VAL A 11 0.036 -13.810 -2.548 1.00 0.00 N ATOM 178 CA VAL A 11 0.753 -12.607 -2.993 1.00 0.00 C ATOM 179 C VAL A 11 1.915 -12.328 -2.095 1.00 0.00 C ATOM 180 O VAL A 11 1.961 -11.329 -1.399 1.00 0.00 O ATOM 181 CB VAL A 11 -0.137 -11.339 -3.036 1.00 0.00 C ATOM 182 CG1 VAL A 11 -1.019 -11.319 -4.242 1.00 0.00 C ATOM 183 CG2 VAL A 11 -0.980 -11.236 -1.774 1.00 0.00 C ATOM 0 H VAL A 11 -0.758 -13.632 -1.933 1.00 0.00 H new ATOM 0 HA VAL A 11 1.083 -12.823 -4.009 1.00 0.00 H new ATOM 0 HB VAL A 11 0.529 -10.478 -3.095 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.626 -10.414 -4.234 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.405 -11.336 -5.142 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -1.670 -12.193 -4.231 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -1.598 -10.340 -1.822 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.620 -12.114 -1.691 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -0.326 -11.180 -0.903 1.00 0.00 H new ATOM 193 N THR A 12 2.854 -13.168 -2.072 1.00 0.00 N ATOM 194 CA THR A 12 3.893 -12.913 -1.155 1.00 0.00 C ATOM 195 C THR A 12 5.124 -12.358 -1.799 1.00 0.00 C ATOM 196 O THR A 12 5.966 -11.738 -1.138 1.00 0.00 O ATOM 197 CB THR A 12 4.138 -14.071 -0.222 1.00 0.00 C ATOM 198 OG1 THR A 12 4.670 -15.211 -0.924 1.00 0.00 O ATOM 199 CG2 THR A 12 2.820 -14.466 0.379 1.00 0.00 C ATOM 0 H THR A 12 2.937 -14.007 -2.646 1.00 0.00 H new ATOM 0 HA THR A 12 3.547 -12.106 -0.510 1.00 0.00 H new ATOM 0 HB THR A 12 4.859 -13.764 0.536 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.936 -15.716 -1.332 1.00 0.00 H new ATOM 0 HG21 THR A 12 2.967 -15.304 1.060 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.403 -13.622 0.927 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.132 -14.760 -0.414 1.00 0.00 H new ATOM 207 N ASP A 13 5.194 -12.510 -3.086 1.00 0.00 N ATOM 208 CA ASP A 13 6.245 -11.945 -3.887 1.00 0.00 C ATOM 209 C ASP A 13 5.883 -10.494 -4.164 1.00 0.00 C ATOM 210 O ASP A 13 6.743 -9.598 -4.121 1.00 0.00 O ATOM 211 CB ASP A 13 6.393 -12.737 -5.204 1.00 0.00 C ATOM 212 CG ASP A 13 5.126 -12.725 -6.051 1.00 0.00 C ATOM 213 OD1 ASP A 13 4.025 -12.986 -5.479 1.00 0.00 O ATOM 214 OD2 ASP A 13 5.216 -12.421 -7.248 1.00 0.00 O ATOM 0 H ASP A 13 4.509 -13.041 -3.624 1.00 0.00 H new ATOM 0 HA ASP A 13 7.200 -11.997 -3.364 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.215 -12.317 -5.784 1.00 0.00 H new ATOM 0 HB3 ASP A 13 6.660 -13.768 -4.973 1.00 0.00 H new ATOM 219 N ASP A 14 4.587 -10.262 -4.338 1.00 0.00 N ATOM 220 CA ASP A 14 4.039 -8.923 -4.601 1.00 0.00 C ATOM 221 C ASP A 14 4.192 -8.069 -3.364 1.00 0.00 C ATOM 222 O ASP A 14 4.911 -7.055 -3.360 1.00 0.00 O ATOM 223 CB ASP A 14 2.547 -9.019 -4.998 1.00 0.00 C ATOM 224 CG ASP A 14 1.849 -7.657 -5.103 1.00 0.00 C ATOM 225 OD1 ASP A 14 1.377 -7.159 -4.065 1.00 0.00 O ATOM 226 OD2 ASP A 14 1.745 -7.103 -6.225 1.00 0.00 O ATOM 0 H ASP A 14 3.879 -10.995 -4.302 1.00 0.00 H new ATOM 0 HA ASP A 14 4.586 -8.469 -5.427 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.467 -9.533 -5.956 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.023 -9.630 -4.263 1.00 0.00 H new ATOM 231 N VAL A 15 3.592 -8.544 -2.289 1.00 0.00 N ATOM 232 CA VAL A 15 3.605 -7.864 -1.016 1.00 0.00 C ATOM 233 C VAL A 15 5.037 -7.658 -0.485 1.00 0.00 C ATOM 234 O VAL A 15 5.347 -6.617 0.095 1.00 0.00 O ATOM 235 CB VAL A 15 2.695 -8.601 0.014 1.00 0.00 C ATOM 236 CG1 VAL A 15 2.790 -7.962 1.398 1.00 0.00 C ATOM 237 CG2 VAL A 15 1.236 -8.566 -0.476 1.00 0.00 C ATOM 0 H VAL A 15 3.077 -9.424 -2.279 1.00 0.00 H new ATOM 0 HA VAL A 15 3.191 -6.867 -1.167 1.00 0.00 H new ATOM 0 HB VAL A 15 3.036 -9.633 0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.144 -8.499 2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 15 3.820 -8.009 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.474 -6.920 1.340 1.00 0.00 H new ATOM 0 HG21 VAL A 15 0.598 -9.081 0.243 1.00 0.00 H new ATOM 0 HG22 VAL A 15 0.910 -7.531 -0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.165 -9.062 -1.444 1.00 0.00 H new ATOM 247 N LYS A 16 5.928 -8.623 -0.729 1.00 0.00 N ATOM 248 CA LYS A 16 7.315 -8.482 -0.284 1.00 0.00 C ATOM 249 C LYS A 16 7.996 -7.344 -1.031 1.00 0.00 C ATOM 250 O LYS A 16 8.749 -6.579 -0.437 1.00 0.00 O ATOM 251 CB LYS A 16 8.100 -9.784 -0.481 1.00 0.00 C ATOM 252 CG LYS A 16 9.560 -9.768 0.005 1.00 0.00 C ATOM 253 CD LYS A 16 9.687 -9.459 1.503 1.00 0.00 C ATOM 254 CE LYS A 16 8.914 -10.448 2.369 1.00 0.00 C ATOM 255 NZ LYS A 16 9.358 -11.861 2.179 1.00 0.00 N ATOM 0 H LYS A 16 5.720 -9.492 -1.221 1.00 0.00 H new ATOM 0 HA LYS A 16 7.302 -8.253 0.782 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.573 -10.585 0.038 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.093 -10.033 -1.542 1.00 0.00 H new ATOM 0 HG2 LYS A 16 10.017 -10.736 -0.201 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.119 -9.024 -0.563 1.00 0.00 H new ATOM 0 HD2 LYS A 16 10.739 -9.477 1.787 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.322 -8.450 1.695 1.00 0.00 H new ATOM 0 HE2 LYS A 16 9.032 -10.174 3.417 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.852 -10.372 2.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 8.833 -12.480 2.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 9.174 -12.154 1.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 10.376 -11.935 2.377 1.00 0.00 H new ATOM 269 N SER A 17 7.717 -7.235 -2.313 1.00 0.00 N ATOM 270 CA SER A 17 8.277 -6.184 -3.126 1.00 0.00 C ATOM 271 C SER A 17 7.762 -4.821 -2.658 1.00 0.00 C ATOM 272 O SER A 17 8.534 -3.873 -2.535 1.00 0.00 O ATOM 273 CB SER A 17 7.965 -6.436 -4.598 1.00 0.00 C ATOM 274 OG SER A 17 8.503 -7.688 -5.001 1.00 0.00 O ATOM 0 H SER A 17 7.098 -7.871 -2.816 1.00 0.00 H new ATOM 0 HA SER A 17 9.361 -6.180 -3.015 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.887 -6.426 -4.757 1.00 0.00 H new ATOM 0 HB3 SER A 17 8.384 -5.637 -5.209 1.00 0.00 H new ATOM 0 HG SER A 17 7.934 -8.412 -4.666 1.00 0.00 H new ATOM 280 N ILE A 18 6.470 -4.755 -2.349 1.00 0.00 N ATOM 281 CA ILE A 18 5.850 -3.547 -1.821 1.00 0.00 C ATOM 282 C ILE A 18 6.560 -3.103 -0.542 1.00 0.00 C ATOM 283 O ILE A 18 7.003 -1.946 -0.426 1.00 0.00 O ATOM 284 CB ILE A 18 4.339 -3.778 -1.522 1.00 0.00 C ATOM 285 CG1 ILE A 18 3.545 -3.960 -2.825 1.00 0.00 C ATOM 286 CG2 ILE A 18 3.758 -2.659 -0.657 1.00 0.00 C ATOM 287 CD1 ILE A 18 2.063 -4.210 -2.619 1.00 0.00 C ATOM 0 H ILE A 18 5.825 -5.538 -2.458 1.00 0.00 H new ATOM 0 HA ILE A 18 5.941 -2.767 -2.577 1.00 0.00 H new ATOM 0 HB ILE A 18 4.250 -4.700 -0.948 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.670 -3.069 -3.441 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.969 -4.795 -3.382 1.00 0.00 H new ATOM 0 HG21 ILE A 18 2.702 -2.855 -0.470 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.293 -2.617 0.292 1.00 0.00 H new ATOM 0 HG23 ILE A 18 3.864 -1.706 -1.176 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.576 -4.327 -3.587 1.00 0.00 H new ATOM 0 HD12 ILE A 18 1.925 -5.117 -2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 18 1.621 -3.365 -2.091 1.00 0.00 H new ATOM 299 N VAL A 19 6.698 -4.033 0.390 1.00 0.00 N ATOM 300 CA VAL A 19 7.311 -3.750 1.670 1.00 0.00 C ATOM 301 C VAL A 19 8.772 -3.400 1.530 1.00 0.00 C ATOM 302 O VAL A 19 9.248 -2.520 2.226 1.00 0.00 O ATOM 303 CB VAL A 19 7.141 -4.906 2.669 1.00 0.00 C ATOM 304 CG1 VAL A 19 7.812 -4.585 4.011 1.00 0.00 C ATOM 305 CG2 VAL A 19 5.683 -5.169 2.874 1.00 0.00 C ATOM 0 H VAL A 19 6.389 -4.999 0.278 1.00 0.00 H new ATOM 0 HA VAL A 19 6.784 -2.882 2.067 1.00 0.00 H new ATOM 0 HB VAL A 19 7.624 -5.794 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.674 -5.422 4.696 1.00 0.00 H new ATOM 0 HG12 VAL A 19 8.877 -4.416 3.854 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.362 -3.689 4.438 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.557 -5.988 3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.203 -4.273 3.267 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.224 -5.438 1.922 1.00 0.00 H new ATOM 315 N ARG A 20 9.465 -4.068 0.608 1.00 0.00 N ATOM 316 CA ARG A 20 10.888 -3.828 0.396 1.00 0.00 C ATOM 317 C ARG A 20 11.097 -2.350 0.124 1.00 0.00 C ATOM 318 O ARG A 20 11.835 -1.686 0.836 1.00 0.00 O ATOM 319 CB ARG A 20 11.406 -4.611 -0.810 1.00 0.00 C ATOM 320 CG ARG A 20 12.908 -4.871 -0.772 1.00 0.00 C ATOM 321 CD ARG A 20 13.494 -4.992 -2.167 1.00 0.00 C ATOM 322 NE ARG A 20 13.702 -3.667 -2.749 1.00 0.00 N ATOM 323 CZ ARG A 20 13.715 -3.327 -4.026 1.00 0.00 C ATOM 324 NH1 ARG A 20 13.429 -4.228 -4.975 1.00 0.00 N ATOM 325 NH2 ARG A 20 14.005 -2.067 -4.355 1.00 0.00 N ATOM 0 H ARG A 20 9.062 -4.779 -0.003 1.00 0.00 H new ATOM 0 HA ARG A 20 11.428 -4.150 1.287 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.882 -5.565 -0.865 1.00 0.00 H new ATOM 0 HB3 ARG A 20 11.164 -4.062 -1.720 1.00 0.00 H new ATOM 0 HG2 ARG A 20 13.404 -4.060 -0.238 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.105 -5.787 -0.214 1.00 0.00 H new ATOM 0 HD2 ARG A 20 14.441 -5.531 -2.125 1.00 0.00 H new ATOM 0 HD3 ARG A 20 12.824 -5.573 -2.801 1.00 0.00 H new ATOM 0 HE ARG A 20 13.857 -2.908 -2.085 1.00 0.00 H new ATOM 0 HH11 ARG A 20 13.198 -5.187 -4.715 1.00 0.00 H new ATOM 0 HH12 ARG A 20 13.442 -3.955 -5.958 1.00 0.00 H new ATOM 0 HH21 ARG A 20 14.212 -1.384 -3.626 1.00 0.00 H new ATOM 0 HH22 ARG A 20 14.020 -1.786 -5.336 1.00 0.00 H new ATOM 339 N PHE A 21 10.334 -1.839 -0.845 1.00 0.00 N ATOM 340 CA PHE A 21 10.435 -0.450 -1.270 1.00 0.00 C ATOM 341 C PHE A 21 10.075 0.529 -0.178 1.00 0.00 C ATOM 342 O PHE A 21 10.753 1.532 -0.003 1.00 0.00 O ATOM 343 CB PHE A 21 9.585 -0.167 -2.497 1.00 0.00 C ATOM 344 CG PHE A 21 10.164 -0.640 -3.797 1.00 0.00 C ATOM 345 CD1 PHE A 21 10.977 0.193 -4.531 1.00 0.00 C ATOM 346 CD2 PHE A 21 9.861 -1.881 -4.302 1.00 0.00 C ATOM 347 CE1 PHE A 21 11.486 -0.206 -5.748 1.00 0.00 C ATOM 348 CE2 PHE A 21 10.357 -2.292 -5.520 1.00 0.00 C ATOM 349 CZ PHE A 21 11.172 -1.452 -6.248 1.00 0.00 C ATOM 0 H PHE A 21 9.633 -2.378 -1.353 1.00 0.00 H new ATOM 0 HA PHE A 21 11.486 -0.305 -1.521 1.00 0.00 H new ATOM 0 HB2 PHE A 21 8.610 -0.635 -2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.416 0.908 -2.562 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.220 1.173 -4.148 1.00 0.00 H new ATOM 0 HD2 PHE A 21 9.224 -2.545 -3.736 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.129 0.456 -6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.108 -3.270 -5.904 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.562 -1.768 -7.204 1.00 0.00 H new ATOM 359 N VAL A 22 9.011 0.270 0.551 1.00 0.00 N ATOM 360 CA VAL A 22 8.620 1.194 1.581 1.00 0.00 C ATOM 361 C VAL A 22 9.565 1.136 2.783 1.00 0.00 C ATOM 362 O VAL A 22 9.831 2.160 3.407 1.00 0.00 O ATOM 363 CB VAL A 22 7.133 1.070 2.005 1.00 0.00 C ATOM 364 CG1 VAL A 22 6.217 1.425 0.842 1.00 0.00 C ATOM 365 CG2 VAL A 22 6.819 -0.316 2.511 1.00 0.00 C ATOM 0 H VAL A 22 8.417 -0.553 0.451 1.00 0.00 H new ATOM 0 HA VAL A 22 8.710 2.184 1.135 1.00 0.00 H new ATOM 0 HB VAL A 22 6.960 1.773 2.820 1.00 0.00 H new ATOM 0 HG11 VAL A 22 5.177 1.333 1.156 1.00 0.00 H new ATOM 0 HG12 VAL A 22 6.411 2.450 0.526 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.406 0.747 0.010 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.769 -0.369 2.800 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.016 -1.044 1.724 1.00 0.00 H new ATOM 0 HG23 VAL A 22 7.445 -0.538 3.375 1.00 0.00 H new ATOM 375 N GLN A 23 10.090 -0.054 3.077 1.00 0.00 N ATOM 376 CA GLN A 23 11.068 -0.227 4.147 1.00 0.00 C ATOM 377 C GLN A 23 12.375 0.507 3.813 1.00 0.00 C ATOM 378 O GLN A 23 12.890 1.271 4.631 1.00 0.00 O ATOM 379 CB GLN A 23 11.343 -1.718 4.402 1.00 0.00 C ATOM 380 CG GLN A 23 12.312 -1.991 5.551 1.00 0.00 C ATOM 381 CD GLN A 23 11.798 -1.492 6.893 1.00 0.00 C ATOM 382 OE1 GLN A 23 10.606 -1.461 7.145 1.00 0.00 O ATOM 383 NE2 GLN A 23 12.696 -1.089 7.751 1.00 0.00 N ATOM 0 H GLN A 23 9.852 -0.915 2.585 1.00 0.00 H new ATOM 0 HA GLN A 23 10.651 0.206 5.056 1.00 0.00 H new ATOM 0 HB2 GLN A 23 10.398 -2.219 4.612 1.00 0.00 H new ATOM 0 HB3 GLN A 23 11.744 -2.163 3.491 1.00 0.00 H new ATOM 0 HG2 GLN A 23 12.498 -3.063 5.615 1.00 0.00 H new ATOM 0 HG3 GLN A 23 13.268 -1.514 5.334 1.00 0.00 H new ATOM 0 HE21 GLN A 23 13.686 -1.128 7.509 1.00 0.00 H new ATOM 0 HE22 GLN A 23 12.407 -0.735 8.663 1.00 0.00 H new ATOM 392 N GLU A 24 12.896 0.299 2.594 1.00 0.00 N ATOM 393 CA GLU A 24 14.143 0.955 2.160 1.00 0.00 C ATOM 394 C GLU A 24 13.922 2.455 1.979 1.00 0.00 C ATOM 395 O GLU A 24 14.862 3.253 1.980 1.00 0.00 O ATOM 396 CB GLU A 24 14.706 0.305 0.881 1.00 0.00 C ATOM 397 CG GLU A 24 13.791 0.394 -0.327 1.00 0.00 C ATOM 398 CD GLU A 24 14.198 -0.542 -1.439 1.00 0.00 C ATOM 399 OE1 GLU A 24 14.338 -1.744 -1.176 1.00 0.00 O ATOM 400 OE2 GLU A 24 14.356 -0.106 -2.597 1.00 0.00 O ATOM 0 H GLU A 24 12.478 -0.314 1.894 1.00 0.00 H new ATOM 0 HA GLU A 24 14.890 0.817 2.942 1.00 0.00 H new ATOM 0 HB2 GLU A 24 15.657 0.779 0.636 1.00 0.00 H new ATOM 0 HB3 GLU A 24 14.916 -0.745 1.085 1.00 0.00 H new ATOM 0 HG2 GLU A 24 12.770 0.166 -0.021 1.00 0.00 H new ATOM 0 HG3 GLU A 24 13.790 1.418 -0.702 1.00 0.00 H new ATOM 675 N PHE A 43 2.570 8.830 4.402 1.00 0.00 N ATOM 676 CA PHE A 43 2.264 7.471 4.066 1.00 0.00 C ATOM 677 C PHE A 43 0.841 7.151 4.443 1.00 0.00 C ATOM 678 O PHE A 43 0.502 7.125 5.599 1.00 0.00 O ATOM 679 CB PHE A 43 3.223 6.504 4.779 1.00 0.00 C ATOM 680 CG PHE A 43 4.678 6.733 4.458 1.00 0.00 C ATOM 681 CD1 PHE A 43 5.255 6.155 3.340 1.00 0.00 C ATOM 682 CD2 PHE A 43 5.466 7.528 5.278 1.00 0.00 C ATOM 683 CE1 PHE A 43 6.587 6.364 3.046 1.00 0.00 C ATOM 684 CE2 PHE A 43 6.798 7.740 4.988 1.00 0.00 C ATOM 685 CZ PHE A 43 7.359 7.159 3.870 1.00 0.00 C ATOM 0 HA PHE A 43 2.386 7.350 2.990 1.00 0.00 H new ATOM 0 HB2 PHE A 43 3.081 6.596 5.856 1.00 0.00 H new ATOM 0 HB3 PHE A 43 2.959 5.482 4.509 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.656 5.534 2.691 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.031 7.986 6.154 1.00 0.00 H new ATOM 0 HE1 PHE A 43 7.026 5.906 2.172 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.400 8.360 5.635 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.401 7.326 3.639 1.00 0.00 H new ATOM 695 N THR A 44 0.018 6.984 3.462 1.00 0.00 N ATOM 696 CA THR A 44 -1.351 6.558 3.622 1.00 0.00 C ATOM 697 C THR A 44 -1.514 5.428 2.631 1.00 0.00 C ATOM 698 O THR A 44 -0.732 5.385 1.660 1.00 0.00 O ATOM 699 CB THR A 44 -2.359 7.709 3.274 1.00 0.00 C ATOM 700 OG1 THR A 44 -2.207 8.112 1.908 1.00 0.00 O ATOM 701 CG2 THR A 44 -2.139 8.930 4.155 1.00 0.00 C ATOM 0 H THR A 44 0.280 7.143 2.489 1.00 0.00 H new ATOM 0 HA THR A 44 -1.558 6.265 4.651 1.00 0.00 H new ATOM 0 HB THR A 44 -3.361 7.316 3.446 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.844 8.829 1.706 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.855 9.707 3.886 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.279 8.654 5.200 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.126 9.305 4.011 1.00 0.00 H new ATOM 709 N MET A 45 -2.465 4.509 2.825 1.00 0.00 N ATOM 710 CA MET A 45 -2.607 3.405 1.862 1.00 0.00 C ATOM 711 C MET A 45 -2.904 3.933 0.469 1.00 0.00 C ATOM 712 O MET A 45 -2.401 3.425 -0.514 1.00 0.00 O ATOM 713 CB MET A 45 -3.680 2.360 2.241 1.00 0.00 C ATOM 714 CG MET A 45 -5.129 2.864 2.258 1.00 0.00 C ATOM 715 SD MET A 45 -6.332 1.510 2.211 1.00 0.00 S ATOM 716 CE MET A 45 -5.818 0.538 3.631 1.00 0.00 C ATOM 0 H MET A 45 -3.124 4.501 3.604 1.00 0.00 H new ATOM 0 HA MET A 45 -1.644 2.894 1.883 1.00 0.00 H new ATOM 0 HB2 MET A 45 -3.613 1.528 1.540 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.442 1.964 3.228 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.293 3.461 3.155 1.00 0.00 H new ATOM 0 HG3 MET A 45 -5.292 3.521 1.404 1.00 0.00 H new ATOM 0 HE1 MET A 45 -5.901 -0.523 3.395 1.00 0.00 H new ATOM 0 HE2 MET A 45 -4.783 0.775 3.879 1.00 0.00 H new ATOM 0 HE3 MET A 45 -6.458 0.771 4.482 1.00 0.00 H new ATOM 726 N ASN A 46 -3.657 5.015 0.411 1.00 0.00 N ATOM 727 CA ASN A 46 -4.099 5.571 -0.855 1.00 0.00 C ATOM 728 C ASN A 46 -2.923 6.242 -1.568 1.00 0.00 C ATOM 729 O ASN A 46 -2.823 6.202 -2.789 1.00 0.00 O ATOM 730 CB ASN A 46 -5.247 6.557 -0.621 1.00 0.00 C ATOM 731 CG ASN A 46 -6.151 6.743 -1.835 1.00 0.00 C ATOM 732 OD1 ASN A 46 -5.736 6.644 -2.989 1.00 0.00 O ATOM 733 ND2 ASN A 46 -7.406 6.985 -1.575 1.00 0.00 N ATOM 0 H ASN A 46 -3.977 5.530 1.231 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.469 4.770 -1.495 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.848 6.209 0.219 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.832 7.524 -0.336 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.073 7.097 -2.339 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.721 7.062 -0.608 1.00 0.00 H new ATOM 740 N MET A 47 -2.000 6.812 -0.780 1.00 0.00 N ATOM 741 CA MET A 47 -0.785 7.427 -1.327 1.00 0.00 C ATOM 742 C MET A 47 0.074 6.333 -1.920 1.00 0.00 C ATOM 743 O MET A 47 0.645 6.491 -2.986 1.00 0.00 O ATOM 744 CB MET A 47 0.008 8.148 -0.219 1.00 0.00 C ATOM 745 CG MET A 47 1.299 8.848 -0.673 1.00 0.00 C ATOM 746 SD MET A 47 1.026 10.257 -1.779 1.00 0.00 S ATOM 747 CE MET A 47 0.029 11.335 -0.749 1.00 0.00 C ATOM 0 H MET A 47 -2.073 6.859 0.236 1.00 0.00 H new ATOM 0 HA MET A 47 -1.061 8.159 -2.086 1.00 0.00 H new ATOM 0 HB2 MET A 47 -0.643 8.890 0.244 1.00 0.00 H new ATOM 0 HB3 MET A 47 0.262 7.421 0.552 1.00 0.00 H new ATOM 0 HG2 MET A 47 1.843 9.191 0.207 1.00 0.00 H new ATOM 0 HG3 MET A 47 1.935 8.121 -1.178 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.066 12.351 -1.143 1.00 0.00 H new ATOM 0 HE2 MET A 47 -1.003 10.984 -0.747 1.00 0.00 H new ATOM 0 HE3 MET A 47 0.417 11.327 0.269 1.00 0.00 H new ATOM 757 N LEU A 48 0.111 5.200 -1.226 1.00 0.00 N ATOM 758 CA LEU A 48 0.888 4.058 -1.665 1.00 0.00 C ATOM 759 C LEU A 48 0.348 3.519 -2.982 1.00 0.00 C ATOM 760 O LEU A 48 1.113 3.193 -3.857 1.00 0.00 O ATOM 761 CB LEU A 48 0.916 2.956 -0.597 1.00 0.00 C ATOM 762 CG LEU A 48 1.474 3.355 0.778 1.00 0.00 C ATOM 763 CD1 LEU A 48 1.495 2.167 1.720 1.00 0.00 C ATOM 764 CD2 LEU A 48 2.861 3.970 0.655 1.00 0.00 C ATOM 0 H LEU A 48 -0.394 5.053 -0.352 1.00 0.00 H new ATOM 0 HA LEU A 48 1.914 4.392 -1.822 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -0.100 2.587 -0.460 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.509 2.125 -0.979 1.00 0.00 H new ATOM 0 HG LEU A 48 0.810 4.111 1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.894 2.476 2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.481 1.788 1.850 1.00 0.00 H new ATOM 0 HD13 LEU A 48 2.125 1.382 1.301 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.228 4.241 1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.540 3.248 0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.810 4.862 0.030 1.00 0.00 H new ATOM 776 N VAL A 49 -0.980 3.471 -3.113 1.00 0.00 N ATOM 777 CA VAL A 49 -1.650 3.046 -4.297 1.00 0.00 C ATOM 778 C VAL A 49 -1.351 3.997 -5.439 1.00 0.00 C ATOM 779 O VAL A 49 -1.037 3.581 -6.560 1.00 0.00 O ATOM 780 CB VAL A 49 -3.160 3.061 -4.020 1.00 0.00 C ATOM 781 CG1 VAL A 49 -3.936 2.825 -5.252 1.00 0.00 C ATOM 782 CG2 VAL A 49 -3.511 2.044 -2.983 1.00 0.00 C ATOM 0 H VAL A 49 -1.618 3.739 -2.364 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.312 2.047 -4.572 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.419 4.051 -3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.001 2.842 -5.020 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.710 3.605 -5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.671 1.853 -5.668 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.585 2.068 -2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.225 1.053 -3.334 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -2.979 2.269 -2.058 1.00 0.00 H new ATOM 792 N ASP A 50 -1.455 5.267 -5.136 1.00 0.00 N ATOM 793 CA ASP A 50 -1.240 6.326 -6.114 1.00 0.00 C ATOM 794 C ASP A 50 0.192 6.241 -6.654 1.00 0.00 C ATOM 795 O ASP A 50 0.420 6.291 -7.868 1.00 0.00 O ATOM 796 CB ASP A 50 -1.515 7.697 -5.485 1.00 0.00 C ATOM 797 CG ASP A 50 -1.772 8.768 -6.514 1.00 0.00 C ATOM 798 OD1 ASP A 50 -0.845 9.403 -6.982 1.00 0.00 O ATOM 799 OD2 ASP A 50 -2.955 8.985 -6.889 1.00 0.00 O ATOM 0 H ASP A 50 -1.692 5.606 -4.203 1.00 0.00 H new ATOM 0 HA ASP A 50 -1.933 6.198 -6.946 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.377 7.622 -4.822 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.664 7.987 -4.869 1.00 0.00 H new ATOM 804 N ILE A 51 1.133 6.043 -5.745 1.00 0.00 N ATOM 805 CA ILE A 51 2.540 5.846 -6.075 1.00 0.00 C ATOM 806 C ILE A 51 2.745 4.542 -6.860 1.00 0.00 C ATOM 807 O ILE A 51 3.409 4.531 -7.897 1.00 0.00 O ATOM 808 CB ILE A 51 3.414 5.836 -4.779 1.00 0.00 C ATOM 809 CG1 ILE A 51 3.463 7.241 -4.188 1.00 0.00 C ATOM 810 CG2 ILE A 51 4.820 5.299 -5.033 1.00 0.00 C ATOM 811 CD1 ILE A 51 4.254 7.373 -2.921 1.00 0.00 C ATOM 0 H ILE A 51 0.941 6.014 -4.744 1.00 0.00 H new ATOM 0 HA ILE A 51 2.854 6.679 -6.704 1.00 0.00 H new ATOM 0 HB ILE A 51 2.950 5.158 -4.063 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.884 7.917 -4.933 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.443 7.573 -3.997 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.388 5.312 -4.103 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.757 4.277 -5.405 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.320 5.924 -5.772 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.228 8.409 -2.582 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.823 6.729 -2.154 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.287 7.078 -3.105 1.00 0.00 H new ATOM 823 N PHE A 52 2.140 3.475 -6.366 1.00 0.00 N ATOM 824 CA PHE A 52 2.252 2.129 -6.927 1.00 0.00 C ATOM 825 C PHE A 52 1.813 2.114 -8.390 1.00 0.00 C ATOM 826 O PHE A 52 2.493 1.530 -9.243 1.00 0.00 O ATOM 827 CB PHE A 52 1.408 1.163 -6.074 1.00 0.00 C ATOM 828 CG PHE A 52 1.605 -0.306 -6.322 1.00 0.00 C ATOM 829 CD1 PHE A 52 2.856 -0.882 -6.192 1.00 0.00 C ATOM 830 CD2 PHE A 52 0.530 -1.118 -6.627 1.00 0.00 C ATOM 831 CE1 PHE A 52 3.037 -2.237 -6.368 1.00 0.00 C ATOM 832 CE2 PHE A 52 0.702 -2.474 -6.811 1.00 0.00 C ATOM 833 CZ PHE A 52 1.958 -3.035 -6.680 1.00 0.00 C ATOM 0 H PHE A 52 1.540 3.517 -5.542 1.00 0.00 H new ATOM 0 HA PHE A 52 3.293 1.806 -6.904 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.621 1.362 -5.024 1.00 0.00 H new ATOM 0 HB3 PHE A 52 0.356 1.397 -6.236 1.00 0.00 H new ATOM 0 HD1 PHE A 52 3.705 -0.260 -5.949 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.455 -0.687 -6.722 1.00 0.00 H new ATOM 0 HE1 PHE A 52 4.020 -2.671 -6.262 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.145 -3.097 -7.057 1.00 0.00 H new ATOM 0 HZ PHE A 52 2.094 -4.097 -6.822 1.00 0.00 H new ATOM 843 N LEU A 53 0.705 2.782 -8.679 1.00 0.00 N ATOM 844 CA LEU A 53 0.211 2.900 -10.045 1.00 0.00 C ATOM 845 C LEU A 53 0.999 3.936 -10.866 1.00 0.00 C ATOM 846 O LEU A 53 1.113 3.808 -12.081 1.00 0.00 O ATOM 847 CB LEU A 53 -1.307 3.184 -10.105 1.00 0.00 C ATOM 848 CG LEU A 53 -2.269 1.962 -10.102 1.00 0.00 C ATOM 849 CD1 LEU A 53 -2.177 1.109 -8.860 1.00 0.00 C ATOM 850 CD2 LEU A 53 -3.690 2.396 -10.302 1.00 0.00 C ATOM 0 H LEU A 53 0.128 3.253 -7.982 1.00 0.00 H new ATOM 0 HA LEU A 53 0.376 1.925 -10.504 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.564 3.816 -9.255 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.505 3.765 -11.006 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.943 1.342 -10.937 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.879 0.279 -8.936 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.164 0.720 -8.760 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.422 1.712 -7.986 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.342 1.522 -10.296 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.981 3.071 -9.497 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.782 2.910 -11.259 1.00 0.00 H new ATOM 862 N GLY A 54 1.547 4.944 -10.203 1.00 0.00 N ATOM 863 CA GLY A 54 2.350 5.943 -10.903 1.00 0.00 C ATOM 864 C GLY A 54 1.594 7.229 -11.180 1.00 0.00 C ATOM 865 O GLY A 54 1.913 7.973 -12.124 1.00 0.00 O ATOM 0 H GLY A 54 1.455 5.093 -9.198 1.00 0.00 H new ATOM 0 HA2 GLY A 54 3.235 6.170 -10.309 1.00 0.00 H new ATOM 0 HA3 GLY A 54 2.699 5.523 -11.847 1.00 0.00 H new ATOM 869 N SER A 55 0.657 7.527 -10.328 1.00 0.00 N ATOM 870 CA SER A 55 -0.216 8.667 -10.474 1.00 0.00 C ATOM 871 C SER A 55 0.491 9.970 -10.000 1.00 0.00 C ATOM 872 O SER A 55 1.716 9.994 -9.802 1.00 0.00 O ATOM 873 CB SER A 55 -1.465 8.381 -9.667 1.00 0.00 C ATOM 874 OG SER A 55 -2.492 9.347 -9.842 1.00 0.00 O ATOM 0 H SER A 55 0.470 6.975 -9.491 1.00 0.00 H new ATOM 0 HA SER A 55 -0.477 8.825 -11.520 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.850 7.400 -9.945 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.201 8.332 -8.611 1.00 0.00 H new ATOM 0 HG SER A 55 -2.944 9.503 -8.986 1.00 0.00 H new ATOM 880 N LYS A 56 -0.248 11.067 -9.893 1.00 0.00 N ATOM 881 CA LYS A 56 0.347 12.342 -9.500 1.00 0.00 C ATOM 882 C LYS A 56 -0.252 12.950 -8.239 1.00 0.00 C ATOM 883 O LYS A 56 0.114 14.079 -7.847 1.00 0.00 O ATOM 884 CB LYS A 56 0.448 13.372 -10.658 1.00 0.00 C ATOM 885 CG LYS A 56 1.637 13.127 -11.607 1.00 0.00 C ATOM 886 CD LYS A 56 1.454 11.897 -12.484 1.00 0.00 C ATOM 887 CE LYS A 56 2.792 11.320 -12.926 1.00 0.00 C ATOM 888 NZ LYS A 56 3.580 10.821 -11.760 1.00 0.00 N ATOM 0 H LYS A 56 -1.252 11.102 -10.071 1.00 0.00 H new ATOM 0 HA LYS A 56 1.372 12.078 -9.240 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -0.476 13.347 -11.235 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.533 14.373 -10.235 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.774 14.002 -12.242 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.547 13.015 -11.018 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.893 11.139 -11.937 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.863 12.160 -13.361 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.624 10.505 -13.630 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.363 12.084 -13.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.195 10.040 -12.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.164 11.593 -11.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.931 10.482 -11.022 1.00 0.00 H new ATOM 902 N SER A 57 -1.108 12.212 -7.556 1.00 0.00 N ATOM 903 CA SER A 57 -1.614 12.672 -6.276 1.00 0.00 C ATOM 904 C SER A 57 -0.489 12.389 -5.287 1.00 0.00 C ATOM 905 O SER A 57 -0.271 13.126 -4.308 1.00 0.00 O ATOM 906 CB SER A 57 -2.858 11.891 -5.883 1.00 0.00 C ATOM 907 OG SER A 57 -3.668 11.639 -7.015 1.00 0.00 O ATOM 0 H SER A 57 -1.463 11.305 -7.860 1.00 0.00 H new ATOM 0 HA SER A 57 -1.892 13.726 -6.302 1.00 0.00 H new ATOM 0 HB2 SER A 57 -2.570 10.948 -5.419 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.426 12.452 -5.141 1.00 0.00 H new ATOM 0 HG SER A 57 -3.634 10.685 -7.236 1.00 0.00 H new ATOM 913 N ALA A 58 0.241 11.342 -5.630 1.00 0.00 N ATOM 914 CA ALA A 58 1.437 10.891 -5.019 1.00 0.00 C ATOM 915 C ALA A 58 2.404 12.039 -4.879 1.00 0.00 C ATOM 916 O ALA A 58 2.762 12.697 -5.859 1.00 0.00 O ATOM 917 CB ALA A 58 2.034 9.829 -5.918 1.00 0.00 C ATOM 0 H ALA A 58 -0.029 10.748 -6.414 1.00 0.00 H new ATOM 0 HA ALA A 58 1.233 10.488 -4.027 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.959 9.458 -5.478 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.328 9.006 -6.027 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.245 10.258 -6.898 1.00 0.00 H new ATOM 923 N LYS A 59 2.792 12.321 -3.678 1.00 0.00 N ATOM 924 CA LYS A 59 3.707 13.408 -3.437 1.00 0.00 C ATOM 925 C LYS A 59 5.121 12.902 -3.231 1.00 0.00 C ATOM 926 O LYS A 59 6.020 13.660 -2.881 1.00 0.00 O ATOM 927 CB LYS A 59 3.230 14.306 -2.292 1.00 0.00 C ATOM 928 CG LYS A 59 1.914 15.102 -2.544 1.00 0.00 C ATOM 929 CD LYS A 59 2.057 16.308 -3.528 1.00 0.00 C ATOM 930 CE LYS A 59 2.084 15.943 -5.030 1.00 0.00 C ATOM 931 NZ LYS A 59 0.830 15.307 -5.484 1.00 0.00 N ATOM 0 H LYS A 59 2.494 11.818 -2.842 1.00 0.00 H new ATOM 0 HA LYS A 59 3.724 14.033 -4.330 1.00 0.00 H new ATOM 0 HB2 LYS A 59 3.091 13.687 -1.406 1.00 0.00 H new ATOM 0 HB3 LYS A 59 4.023 15.018 -2.062 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.161 14.418 -2.936 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.541 15.472 -1.589 1.00 0.00 H new ATOM 0 HD2 LYS A 59 1.230 16.996 -3.354 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.974 16.845 -3.286 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.262 16.845 -5.616 1.00 0.00 H new ATOM 0 HE3 LYS A 59 2.919 15.269 -5.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 0.975 14.886 -6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 0.554 14.564 -4.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 0.077 16.023 -5.537 1.00 0.00 H new ATOM 945 N ILE A 60 5.316 11.634 -3.496 1.00 0.00 N ATOM 946 CA ILE A 60 6.615 11.024 -3.426 1.00 0.00 C ATOM 947 C ILE A 60 6.837 10.305 -4.745 1.00 0.00 C ATOM 948 O ILE A 60 6.044 9.465 -5.119 1.00 0.00 O ATOM 949 CB ILE A 60 6.714 10.008 -2.255 1.00 0.00 C ATOM 950 CG1 ILE A 60 6.335 10.685 -0.927 1.00 0.00 C ATOM 951 CG2 ILE A 60 8.132 9.444 -2.177 1.00 0.00 C ATOM 952 CD1 ILE A 60 6.306 9.750 0.256 1.00 0.00 C ATOM 0 H ILE A 60 4.570 10.994 -3.768 1.00 0.00 H new ATOM 0 HA ILE A 60 7.371 11.789 -3.248 1.00 0.00 H new ATOM 0 HB ILE A 60 6.017 9.190 -2.436 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.045 11.487 -0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 60 5.354 11.148 -1.035 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.196 8.732 -1.354 1.00 0.00 H new ATOM 0 HG22 ILE A 60 8.375 8.940 -3.112 1.00 0.00 H new ATOM 0 HG23 ILE A 60 8.838 10.257 -2.009 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.030 10.306 1.152 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.575 8.961 0.079 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.292 9.306 0.393 1.00 0.00 H new ATOM 964 N GLN A 61 7.875 10.670 -5.463 1.00 0.00 N ATOM 965 CA GLN A 61 8.149 10.084 -6.785 1.00 0.00 C ATOM 966 C GLN A 61 9.318 9.103 -6.694 1.00 0.00 C ATOM 967 O GLN A 61 10.078 8.935 -7.636 1.00 0.00 O ATOM 968 CB GLN A 61 8.478 11.197 -7.808 1.00 0.00 C ATOM 969 CG GLN A 61 7.385 12.221 -8.020 1.00 0.00 C ATOM 970 CD GLN A 61 6.078 11.628 -8.500 1.00 0.00 C ATOM 971 OE1 GLN A 61 5.830 11.485 -9.711 1.00 0.00 O ATOM 972 NE2 GLN A 61 5.194 11.336 -7.572 1.00 0.00 N ATOM 0 H GLN A 61 8.554 11.371 -5.165 1.00 0.00 H new ATOM 0 HA GLN A 61 7.260 9.549 -7.118 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.380 11.714 -7.480 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.708 10.731 -8.766 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.211 12.752 -7.084 1.00 0.00 H new ATOM 0 HG3 GLN A 61 7.727 12.959 -8.746 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.427 11.464 -6.587 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.275 10.981 -7.837 1.00 0.00 H new ATOM 981 N SER A 62 9.449 8.444 -5.568 1.00 0.00 N ATOM 982 CA SER A 62 10.546 7.530 -5.361 1.00 0.00 C ATOM 983 C SER A 62 10.085 6.292 -4.584 1.00 0.00 C ATOM 984 O SER A 62 9.471 6.410 -3.518 1.00 0.00 O ATOM 985 CB SER A 62 11.674 8.254 -4.624 1.00 0.00 C ATOM 986 OG SER A 62 12.056 9.428 -5.336 1.00 0.00 O ATOM 0 H SER A 62 8.808 8.524 -4.779 1.00 0.00 H new ATOM 0 HA SER A 62 10.916 7.188 -6.328 1.00 0.00 H new ATOM 0 HB2 SER A 62 11.349 8.520 -3.618 1.00 0.00 H new ATOM 0 HB3 SER A 62 12.532 7.590 -4.516 1.00 0.00 H new ATOM 0 HG SER A 62 12.777 9.883 -4.853 1.00 0.00 H new ATOM 992 N GLY A 63 10.360 5.127 -5.135 1.00 0.00 N ATOM 993 CA GLY A 63 9.978 3.880 -4.519 1.00 0.00 C ATOM 994 C GLY A 63 9.298 3.000 -5.531 1.00 0.00 C ATOM 995 O GLY A 63 9.766 2.891 -6.667 1.00 0.00 O ATOM 0 H GLY A 63 10.854 5.022 -6.021 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.858 3.377 -4.119 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.309 4.068 -3.679 1.00 0.00 H new ATOM 999 N ILE A 64 8.166 2.428 -5.161 1.00 0.00 N ATOM 1000 CA ILE A 64 7.349 1.583 -6.062 1.00 0.00 C ATOM 1001 C ILE A 64 6.569 2.412 -7.071 1.00 0.00 C ATOM 1002 O ILE A 64 5.517 1.978 -7.554 1.00 0.00 O ATOM 1003 CB ILE A 64 6.327 0.710 -5.294 1.00 0.00 C ATOM 1004 CG1 ILE A 64 5.780 1.410 -4.028 1.00 0.00 C ATOM 1005 CG2 ILE A 64 6.835 -0.685 -5.047 1.00 0.00 C ATOM 1006 CD1 ILE A 64 4.734 0.615 -3.273 1.00 0.00 C ATOM 0 H ILE A 64 7.772 2.527 -4.225 1.00 0.00 H new ATOM 0 HA ILE A 64 8.069 0.944 -6.573 1.00 0.00 H new ATOM 0 HB ILE A 64 5.463 0.590 -5.947 1.00 0.00 H new ATOM 0 HG12 ILE A 64 6.612 1.621 -3.357 1.00 0.00 H new ATOM 0 HG13 ILE A 64 5.351 2.370 -4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 64 6.081 -1.256 -4.505 1.00 0.00 H new ATOM 0 HG22 ILE A 64 7.043 -1.171 -6.000 1.00 0.00 H new ATOM 0 HG23 ILE A 64 7.750 -0.640 -4.456 1.00 0.00 H new ATOM 0 HD11 ILE A 64 4.407 1.181 -2.401 1.00 0.00 H new ATOM 0 HD12 ILE A 64 3.881 0.426 -3.924 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.161 -0.334 -2.950 1.00 0.00 H new ATOM 1018 N PHE A 65 7.127 3.538 -7.454 1.00 0.00 N ATOM 1019 CA PHE A 65 6.453 4.460 -8.297 1.00 0.00 C ATOM 1020 C PHE A 65 6.249 3.864 -9.679 1.00 0.00 C ATOM 1021 O PHE A 65 7.223 3.569 -10.402 1.00 0.00 O ATOM 1022 CB PHE A 65 7.185 5.805 -8.376 1.00 0.00 C ATOM 1023 CG PHE A 65 6.238 6.886 -8.748 1.00 0.00 C ATOM 1024 CD1 PHE A 65 5.557 7.557 -7.766 1.00 0.00 C ATOM 1025 CD2 PHE A 65 5.956 7.175 -10.067 1.00 0.00 C ATOM 1026 CE1 PHE A 65 4.631 8.468 -8.057 1.00 0.00 C ATOM 1027 CE2 PHE A 65 5.025 8.122 -10.375 1.00 0.00 C ATOM 1028 CZ PHE A 65 4.355 8.765 -9.364 1.00 0.00 C ATOM 0 H PHE A 65 8.066 3.828 -7.181 1.00 0.00 H new ATOM 0 HA PHE A 65 5.475 4.657 -7.858 1.00 0.00 H new ATOM 0 HB2 PHE A 65 7.647 6.032 -7.415 1.00 0.00 H new ATOM 0 HB3 PHE A 65 7.988 5.747 -9.111 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.777 7.341 -6.731 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.473 6.650 -10.857 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.099 8.971 -7.263 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.816 8.365 -11.406 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.608 9.508 -9.601 1.00 0.00 H new ATOM 1038 N GLY A 66 4.997 3.620 -10.001 1.00 0.00 N ATOM 1039 CA GLY A 66 4.621 3.064 -11.271 1.00 0.00 C ATOM 1040 C GLY A 66 5.168 1.673 -11.467 1.00 0.00 C ATOM 1041 O GLY A 66 5.642 1.334 -12.550 1.00 0.00 O ATOM 0 H GLY A 66 4.210 3.805 -9.380 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.534 3.039 -11.348 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.982 3.711 -12.070 1.00 0.00 H new ATOM 1045 N LYS A 67 5.209 0.889 -10.406 1.00 0.00 N ATOM 1046 CA LYS A 67 5.675 -0.482 -10.521 1.00 0.00 C ATOM 1047 C LYS A 67 4.494 -1.437 -10.563 1.00 0.00 C ATOM 1048 O LYS A 67 4.576 -2.505 -11.140 1.00 0.00 O ATOM 1049 CB LYS A 67 6.652 -0.846 -9.391 1.00 0.00 C ATOM 1050 CG LYS A 67 7.960 -0.012 -9.307 1.00 0.00 C ATOM 1051 CD LYS A 67 9.023 -0.323 -10.398 1.00 0.00 C ATOM 1052 CE LYS A 67 8.676 0.180 -11.807 1.00 0.00 C ATOM 1053 NZ LYS A 67 8.468 1.654 -11.863 1.00 0.00 N ATOM 0 H LYS A 67 4.930 1.172 -9.467 1.00 0.00 H new ATOM 0 HA LYS A 67 6.226 -0.575 -11.457 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.125 -0.750 -8.441 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.924 -1.896 -9.501 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.701 1.045 -9.368 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.411 -0.174 -8.328 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.972 0.119 -10.095 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.173 -1.402 -10.441 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.478 -0.095 -12.493 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.773 -0.322 -12.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.074 1.914 -12.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.807 1.940 -11.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.378 2.138 -11.725 1.00 0.00 H new ATOM 1067 N GLY A 68 3.391 -1.011 -10.004 1.00 0.00 N ATOM 1068 CA GLY A 68 2.203 -1.817 -9.985 1.00 0.00 C ATOM 1069 C GLY A 68 1.097 -1.103 -10.688 1.00 0.00 C ATOM 1070 O GLY A 68 -0.007 -0.990 -10.189 1.00 0.00 O ATOM 0 H GLY A 68 3.293 -0.102 -9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 68 2.395 -2.775 -10.468 1.00 0.00 H new ATOM 0 HA3 GLY A 68 1.914 -2.031 -8.956 1.00 0.00 H new ATOM 1074 N SER A 69 1.395 -0.667 -11.886 1.00 0.00 N ATOM 1075 CA SER A 69 0.502 0.144 -12.688 1.00 0.00 C ATOM 1076 C SER A 69 -0.510 -0.759 -13.420 1.00 0.00 C ATOM 1077 O SER A 69 -1.269 -0.324 -14.265 1.00 0.00 O ATOM 1078 CB SER A 69 1.357 0.971 -13.676 1.00 0.00 C ATOM 1079 OG SER A 69 0.644 2.044 -14.250 1.00 0.00 O ATOM 0 H SER A 69 2.284 -0.868 -12.345 1.00 0.00 H new ATOM 0 HA SER A 69 -0.071 0.827 -12.061 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.232 1.360 -13.155 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.722 0.318 -14.469 1.00 0.00 H new ATOM 0 HG SER A 69 0.667 2.814 -13.644 1.00 0.00 H new ATOM 1085 N ALA A 70 -0.515 -2.030 -13.052 1.00 0.00 N ATOM 1086 CA ALA A 70 -1.435 -2.972 -13.636 1.00 0.00 C ATOM 1087 C ALA A 70 -2.579 -3.231 -12.681 1.00 0.00 C ATOM 1088 O ALA A 70 -3.420 -4.096 -12.902 1.00 0.00 O ATOM 1089 CB ALA A 70 -0.729 -4.258 -14.036 1.00 0.00 C ATOM 0 H ALA A 70 0.111 -2.426 -12.351 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.845 -2.543 -14.550 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.450 -4.948 -14.473 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.048 -4.034 -14.767 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.278 -4.715 -13.155 1.00 0.00 H new ATOM 1095 N TYR A 71 -2.591 -2.482 -11.625 1.00 0.00 N ATOM 1096 CA TYR A 71 -3.650 -2.545 -10.667 1.00 0.00 C ATOM 1097 C TYR A 71 -4.579 -1.400 -10.899 1.00 0.00 C ATOM 1098 O TYR A 71 -4.189 -0.399 -11.463 1.00 0.00 O ATOM 1099 CB TYR A 71 -3.111 -2.453 -9.238 1.00 0.00 C ATOM 1100 CG TYR A 71 -2.450 -3.721 -8.718 1.00 0.00 C ATOM 1101 CD1 TYR A 71 -1.180 -4.113 -9.140 1.00 0.00 C ATOM 1102 CD2 TYR A 71 -3.114 -4.535 -7.807 1.00 0.00 C ATOM 1103 CE1 TYR A 71 -0.594 -5.277 -8.664 1.00 0.00 C ATOM 1104 CE2 TYR A 71 -2.536 -5.698 -7.329 1.00 0.00 C ATOM 1105 CZ TYR A 71 -1.279 -6.065 -7.759 1.00 0.00 C ATOM 1106 OH TYR A 71 -0.717 -7.224 -7.290 1.00 0.00 O ATOM 0 H TYR A 71 -1.862 -1.805 -11.401 1.00 0.00 H new ATOM 0 HA TYR A 71 -4.165 -3.498 -10.786 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.388 -1.638 -9.190 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.933 -2.190 -8.572 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.644 -3.500 -9.849 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -4.100 -4.254 -7.466 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.391 -5.565 -8.999 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -3.068 -6.316 -6.621 1.00 0.00 H new ATOM 0 HH TYR A 71 0.224 -7.064 -7.066 1.00 0.00 H new ATOM 1116 N SER A 72 -5.802 -1.550 -10.512 1.00 0.00 N ATOM 1117 CA SER A 72 -6.690 -0.447 -10.533 1.00 0.00 C ATOM 1118 C SER A 72 -6.707 0.124 -9.121 1.00 0.00 C ATOM 1119 O SER A 72 -6.280 -0.561 -8.167 1.00 0.00 O ATOM 1120 CB SER A 72 -8.089 -0.860 -11.011 1.00 0.00 C ATOM 1121 OG SER A 72 -8.980 0.254 -11.054 1.00 0.00 O ATOM 0 H SER A 72 -6.204 -2.426 -10.179 1.00 0.00 H new ATOM 0 HA SER A 72 -6.357 0.311 -11.243 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.018 -1.308 -12.002 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.491 -1.623 -10.344 1.00 0.00 H new ATOM 0 HG SER A 72 -9.861 -0.043 -11.364 1.00 0.00 H new ATOM 1127 N ARG A 73 -7.223 1.337 -8.975 1.00 0.00 N ATOM 1128 CA ARG A 73 -7.202 2.067 -7.700 1.00 0.00 C ATOM 1129 C ARG A 73 -7.804 1.266 -6.572 1.00 0.00 C ATOM 1130 O ARG A 73 -7.260 1.219 -5.480 1.00 0.00 O ATOM 1131 CB ARG A 73 -7.958 3.397 -7.810 1.00 0.00 C ATOM 1132 CG ARG A 73 -7.378 4.387 -8.802 1.00 0.00 C ATOM 1133 CD ARG A 73 -5.966 4.810 -8.424 1.00 0.00 C ATOM 1134 NE ARG A 73 -5.885 5.476 -7.109 1.00 0.00 N ATOM 1135 CZ ARG A 73 -5.099 6.533 -6.856 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -4.451 7.119 -7.848 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -4.972 7.018 -5.623 1.00 0.00 N ATOM 0 H ARG A 73 -7.670 1.850 -9.735 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.151 2.253 -7.478 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.990 3.188 -8.090 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.983 3.865 -6.826 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.369 3.941 -9.797 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.019 5.267 -8.853 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -5.321 3.931 -8.418 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.580 5.484 -9.189 1.00 0.00 H new ATOM 0 HE ARG A 73 -6.460 5.111 -6.349 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -4.550 6.767 -8.800 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -3.852 7.923 -7.661 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.477 6.585 -4.850 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -4.369 7.823 -5.451 1.00 0.00 H new ATOM 1151 N HIS A 74 -8.880 0.576 -6.861 1.00 0.00 N ATOM 1152 CA HIS A 74 -9.602 -0.084 -5.789 1.00 0.00 C ATOM 1153 C HIS A 74 -9.040 -1.456 -5.511 1.00 0.00 C ATOM 1154 O HIS A 74 -9.197 -1.972 -4.439 1.00 0.00 O ATOM 1155 CB HIS A 74 -11.135 -0.150 -6.009 1.00 0.00 C ATOM 1156 CG HIS A 74 -11.849 -0.381 -4.699 1.00 0.00 C ATOM 1157 ND1 HIS A 74 -12.445 -1.562 -4.315 1.00 0.00 N ATOM 1158 CD2 HIS A 74 -11.936 0.430 -3.633 1.00 0.00 C ATOM 1159 CE1 HIS A 74 -12.839 -1.457 -3.068 1.00 0.00 C ATOM 1160 NE2 HIS A 74 -12.536 -0.260 -2.624 1.00 0.00 N ATOM 0 H HIS A 74 -9.270 0.455 -7.796 1.00 0.00 H new ATOM 0 HA HIS A 74 -9.452 0.543 -4.910 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -11.484 0.779 -6.461 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -11.374 -0.953 -6.706 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -11.590 1.452 -3.584 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -13.333 -2.231 -2.499 1.00 0.00 H new ATOM 0 HE2 HIS A 74 -12.719 0.093 -1.685 1.00 0.00 H new ATOM 1169 N ASN A 75 -8.359 -2.014 -6.471 1.00 0.00 N ATOM 1170 CA ASN A 75 -7.800 -3.352 -6.324 1.00 0.00 C ATOM 1171 C ASN A 75 -6.524 -3.263 -5.521 1.00 0.00 C ATOM 1172 O ASN A 75 -6.252 -4.089 -4.646 1.00 0.00 O ATOM 1173 CB ASN A 75 -7.547 -3.978 -7.700 1.00 0.00 C ATOM 1174 CG ASN A 75 -8.812 -4.013 -8.540 1.00 0.00 C ATOM 1175 OD1 ASN A 75 -9.114 -3.062 -9.243 1.00 0.00 O ATOM 1176 ND2 ASN A 75 -9.540 -5.085 -8.489 1.00 0.00 N ATOM 0 H ASN A 75 -8.170 -1.572 -7.371 1.00 0.00 H new ATOM 0 HA ASN A 75 -8.507 -3.993 -5.797 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -6.778 -3.410 -8.223 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -7.165 -4.991 -7.575 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -10.392 -5.150 -9.046 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -9.261 -5.863 -7.892 1.00 0.00 H new ATOM 1183 N ALA A 76 -5.763 -2.214 -5.783 1.00 0.00 N ATOM 1184 CA ALA A 76 -4.553 -1.961 -5.046 1.00 0.00 C ATOM 1185 C ALA A 76 -4.888 -1.688 -3.583 1.00 0.00 C ATOM 1186 O ALA A 76 -4.302 -2.283 -2.684 1.00 0.00 O ATOM 1187 CB ALA A 76 -3.814 -0.790 -5.647 1.00 0.00 C ATOM 0 H ALA A 76 -5.970 -1.525 -6.506 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.910 -2.839 -5.101 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.900 -0.607 -5.082 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.561 -1.013 -6.684 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.447 0.097 -5.610 1.00 0.00 H new ATOM 1193 N GLU A 77 -5.888 -0.843 -3.347 1.00 0.00 N ATOM 1194 CA GLU A 77 -6.263 -0.501 -1.978 1.00 0.00 C ATOM 1195 C GLU A 77 -6.971 -1.659 -1.296 1.00 0.00 C ATOM 1196 O GLU A 77 -6.985 -1.752 -0.086 1.00 0.00 O ATOM 1197 CB GLU A 77 -7.076 0.790 -1.930 1.00 0.00 C ATOM 1198 CG GLU A 77 -8.477 0.733 -2.501 1.00 0.00 C ATOM 1199 CD GLU A 77 -9.538 0.565 -1.432 1.00 0.00 C ATOM 1200 OE1 GLU A 77 -9.816 1.535 -0.723 1.00 0.00 O ATOM 1201 OE2 GLU A 77 -10.118 -0.521 -1.289 1.00 0.00 O ATOM 0 H GLU A 77 -6.445 -0.389 -4.071 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.349 -0.315 -1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.145 1.110 -0.890 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.522 1.561 -2.465 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.674 1.647 -3.062 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.544 -0.095 -3.207 1.00 0.00 H new ATOM 1208 N ARG A 78 -7.499 -2.559 -2.102 1.00 0.00 N ATOM 1209 CA ARG A 78 -8.157 -3.775 -1.625 1.00 0.00 C ATOM 1210 C ARG A 78 -7.105 -4.639 -0.959 1.00 0.00 C ATOM 1211 O ARG A 78 -7.348 -5.292 0.057 1.00 0.00 O ATOM 1212 CB ARG A 78 -8.803 -4.537 -2.817 1.00 0.00 C ATOM 1213 CG ARG A 78 -9.340 -5.935 -2.509 1.00 0.00 C ATOM 1214 CD ARG A 78 -10.550 -5.924 -1.586 1.00 0.00 C ATOM 1215 NE ARG A 78 -11.776 -5.413 -2.232 1.00 0.00 N ATOM 1216 CZ ARG A 78 -12.896 -5.076 -1.583 1.00 0.00 C ATOM 1217 NH1 ARG A 78 -12.951 -5.159 -0.245 1.00 0.00 N ATOM 1218 NH2 ARG A 78 -13.947 -4.647 -2.261 1.00 0.00 N ATOM 0 H ARG A 78 -7.487 -2.472 -3.118 1.00 0.00 H new ATOM 0 HA ARG A 78 -8.947 -3.527 -0.917 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.622 -3.933 -3.207 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.062 -4.621 -3.612 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.609 -6.428 -3.443 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -8.548 -6.529 -2.052 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -10.733 -6.937 -1.227 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.326 -5.311 -0.713 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.768 -5.310 -3.247 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -12.137 -5.480 0.280 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.806 -4.901 0.247 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.903 -4.573 -3.277 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.802 -4.390 -1.768 1.00 0.00 H new ATOM 1232 N LEU A 79 -5.925 -4.593 -1.518 1.00 0.00 N ATOM 1233 CA LEU A 79 -4.816 -5.354 -1.029 1.00 0.00 C ATOM 1234 C LEU A 79 -4.253 -4.714 0.199 1.00 0.00 C ATOM 1235 O LEU A 79 -3.983 -5.390 1.179 1.00 0.00 O ATOM 1236 CB LEU A 79 -3.778 -5.386 -2.054 1.00 0.00 C ATOM 1237 CG LEU A 79 -2.897 -6.588 -2.066 1.00 0.00 C ATOM 1238 CD1 LEU A 79 -2.049 -6.441 -3.218 1.00 0.00 C ATOM 1239 CD2 LEU A 79 -2.033 -6.743 -0.832 1.00 0.00 C ATOM 0 H LEU A 79 -5.709 -4.019 -2.333 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.153 -6.363 -0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.258 -5.304 -3.029 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.150 -4.503 -1.933 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.525 -7.478 -2.090 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.375 -7.295 -3.285 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.663 -6.392 -4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.466 -5.525 -3.126 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.424 -7.643 -0.925 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.383 -5.874 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.669 -6.824 0.050 1.00 0.00 H new ATOM 1251 N PHE A 80 -4.078 -3.404 0.163 1.00 0.00 N ATOM 1252 CA PHE A 80 -3.601 -2.698 1.344 1.00 0.00 C ATOM 1253 C PHE A 80 -4.607 -2.839 2.463 1.00 0.00 C ATOM 1254 O PHE A 80 -4.284 -2.701 3.627 1.00 0.00 O ATOM 1255 CB PHE A 80 -3.277 -1.229 1.061 1.00 0.00 C ATOM 1256 CG PHE A 80 -2.072 -1.030 0.179 1.00 0.00 C ATOM 1257 CD1 PHE A 80 -0.792 -1.129 0.702 1.00 0.00 C ATOM 1258 CD2 PHE A 80 -2.214 -0.746 -1.161 1.00 0.00 C ATOM 1259 CE1 PHE A 80 0.317 -0.949 -0.105 1.00 0.00 C ATOM 1260 CE2 PHE A 80 -1.113 -0.563 -1.974 1.00 0.00 C ATOM 1261 CZ PHE A 80 0.152 -0.664 -1.447 1.00 0.00 C ATOM 0 H PHE A 80 -4.254 -2.816 -0.652 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.661 -3.157 1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -4.141 -0.760 0.590 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -3.112 -0.714 2.008 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -0.659 -1.349 1.751 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -3.205 -0.665 -1.584 1.00 0.00 H new ATOM 0 HE1 PHE A 80 1.310 -1.031 0.313 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -1.246 -0.341 -3.023 1.00 0.00 H new ATOM 0 HZ PHE A 80 1.015 -0.521 -2.080 1.00 0.00 H new ATOM 1271 N LYS A 81 -5.810 -3.223 2.089 1.00 0.00 N ATOM 1272 CA LYS A 81 -6.852 -3.455 3.063 1.00 0.00 C ATOM 1273 C LYS A 81 -6.779 -4.857 3.581 1.00 0.00 C ATOM 1274 O LYS A 81 -7.153 -5.132 4.718 1.00 0.00 O ATOM 1275 CB LYS A 81 -8.253 -3.099 2.565 1.00 0.00 C ATOM 1276 CG LYS A 81 -8.524 -1.612 2.635 1.00 0.00 C ATOM 1277 CD LYS A 81 -9.923 -1.249 2.187 1.00 0.00 C ATOM 1278 CE LYS A 81 -10.202 0.226 2.458 1.00 0.00 C ATOM 1279 NZ LYS A 81 -9.255 1.120 1.760 1.00 0.00 N ATOM 0 H LYS A 81 -6.088 -3.380 1.120 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.667 -2.768 3.889 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.368 -3.440 1.536 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.995 -3.630 3.162 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.374 -1.268 3.658 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.800 -1.086 2.013 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.037 -1.458 1.123 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -10.652 -1.866 2.713 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.219 0.463 2.145 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.148 0.411 3.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.353 2.087 2.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -8.283 0.786 1.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -9.462 1.117 0.741 1.00 0.00 H new ATOM 1293 N LYS A 82 -6.234 -5.737 2.767 1.00 0.00 N ATOM 1294 CA LYS A 82 -6.040 -7.093 3.167 1.00 0.00 C ATOM 1295 C LYS A 82 -4.909 -7.086 4.175 1.00 0.00 C ATOM 1296 O LYS A 82 -5.035 -7.592 5.268 1.00 0.00 O ATOM 1297 CB LYS A 82 -5.690 -7.942 1.937 1.00 0.00 C ATOM 1298 CG LYS A 82 -5.544 -9.427 2.188 1.00 0.00 C ATOM 1299 CD LYS A 82 -6.829 -10.035 2.724 1.00 0.00 C ATOM 1300 CE LYS A 82 -6.738 -11.545 2.778 1.00 0.00 C ATOM 1301 NZ LYS A 82 -5.700 -12.039 3.699 1.00 0.00 N ATOM 0 H LYS A 82 -5.919 -5.524 1.820 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.937 -7.523 3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -6.463 -7.793 1.183 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.757 -7.570 1.514 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.264 -9.927 1.261 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.736 -9.598 2.899 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.031 -9.644 3.721 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.666 -9.741 2.091 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.704 -11.949 3.082 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.535 -11.925 1.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.539 -13.052 3.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.816 -11.516 3.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.012 -11.898 4.681 1.00 0.00 H new ATOM 1315 N LEU A 83 -3.851 -6.385 3.813 1.00 0.00 N ATOM 1316 CA LEU A 83 -2.679 -6.237 4.641 1.00 0.00 C ATOM 1317 C LEU A 83 -2.952 -5.616 5.997 1.00 0.00 C ATOM 1318 O LEU A 83 -2.342 -6.013 6.986 1.00 0.00 O ATOM 1319 CB LEU A 83 -1.663 -5.435 3.922 1.00 0.00 C ATOM 1320 CG LEU A 83 -1.177 -6.081 2.662 1.00 0.00 C ATOM 1321 CD1 LEU A 83 -0.274 -5.163 1.943 1.00 0.00 C ATOM 1322 CD2 LEU A 83 -0.486 -7.407 2.943 1.00 0.00 C ATOM 0 H LEU A 83 -3.785 -5.896 2.920 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.315 -7.245 4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.085 -4.459 3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -0.814 -5.261 4.583 1.00 0.00 H new ATOM 0 HG LEU A 83 -2.042 -6.294 2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.076 -5.640 1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -0.810 -4.247 1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.580 -4.923 2.576 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.147 -7.846 2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.371 -7.240 3.596 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -1.186 -8.086 3.430 1.00 0.00 H new ATOM 1334 N ILE A 84 -3.850 -4.635 6.061 1.00 0.00 N ATOM 1335 CA ILE A 84 -4.150 -4.005 7.336 1.00 0.00 C ATOM 1336 C ILE A 84 -5.065 -4.869 8.190 1.00 0.00 C ATOM 1337 O ILE A 84 -5.109 -4.718 9.420 1.00 0.00 O ATOM 1338 CB ILE A 84 -4.669 -2.525 7.207 1.00 0.00 C ATOM 1339 CG1 ILE A 84 -5.980 -2.393 6.405 1.00 0.00 C ATOM 1340 CG2 ILE A 84 -3.595 -1.636 6.610 1.00 0.00 C ATOM 1341 CD1 ILE A 84 -7.256 -2.691 7.178 1.00 0.00 C ATOM 0 H ILE A 84 -4.369 -4.269 5.263 1.00 0.00 H new ATOM 0 HA ILE A 84 -3.197 -3.925 7.859 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.898 -2.197 8.221 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.044 -1.379 6.011 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -5.930 -3.065 5.548 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.971 -0.616 6.528 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.715 -1.648 7.252 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.327 -2.004 5.620 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.117 -2.568 6.521 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.226 -3.715 7.549 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.341 -2.003 8.019 1.00 0.00 H new ATOM 1353 N LEU A 85 -5.809 -5.753 7.533 1.00 0.00 N ATOM 1354 CA LEU A 85 -6.662 -6.696 8.197 1.00 0.00 C ATOM 1355 C LEU A 85 -5.791 -7.835 8.740 1.00 0.00 C ATOM 1356 O LEU A 85 -5.902 -8.206 9.906 1.00 0.00 O ATOM 1357 CB LEU A 85 -7.695 -7.217 7.177 1.00 0.00 C ATOM 1358 CG LEU A 85 -8.979 -7.844 7.728 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -9.984 -8.040 6.604 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -8.730 -9.175 8.430 1.00 0.00 C ATOM 0 H LEU A 85 -5.827 -5.825 6.516 1.00 0.00 H new ATOM 0 HA LEU A 85 -7.195 -6.238 9.030 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -7.977 -6.386 6.530 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -7.202 -7.958 6.548 1.00 0.00 H new ATOM 0 HG LEU A 85 -9.376 -7.154 8.472 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.895 -8.486 7.004 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.220 -7.075 6.154 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.559 -8.699 5.847 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -9.675 -9.573 8.800 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.290 -9.881 7.726 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.048 -9.023 9.266 1.00 0.00 H new ATOM 1372 N ASP A 86 -4.899 -8.343 7.886 1.00 0.00 N ATOM 1373 CA ASP A 86 -3.989 -9.447 8.240 1.00 0.00 C ATOM 1374 C ASP A 86 -2.944 -8.978 9.249 1.00 0.00 C ATOM 1375 O ASP A 86 -2.305 -9.795 9.923 1.00 0.00 O ATOM 1376 CB ASP A 86 -3.265 -10.021 7.007 1.00 0.00 C ATOM 1377 CG ASP A 86 -4.166 -10.585 5.920 1.00 0.00 C ATOM 1378 OD1 ASP A 86 -5.131 -11.322 6.218 1.00 0.00 O ATOM 1379 OD2 ASP A 86 -3.890 -10.336 4.727 1.00 0.00 O ATOM 0 H ASP A 86 -4.783 -8.005 6.931 1.00 0.00 H new ATOM 0 HA ASP A 86 -4.606 -10.233 8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.648 -9.235 6.571 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -2.589 -10.809 7.339 1.00 0.00 H new ATOM 1384 N LYS A 87 -2.742 -7.644 9.294 1.00 0.00 N ATOM 1385 CA LYS A 87 -1.893 -6.963 10.268 1.00 0.00 C ATOM 1386 C LYS A 87 -0.464 -6.927 9.888 1.00 0.00 C ATOM 1387 O LYS A 87 0.407 -6.620 10.695 1.00 0.00 O ATOM 1388 CB LYS A 87 -2.078 -7.451 11.689 1.00 0.00 C ATOM 1389 CG LYS A 87 -2.871 -6.474 12.500 1.00 0.00 C ATOM 1390 CD LYS A 87 -4.333 -6.475 12.119 1.00 0.00 C ATOM 1391 CE LYS A 87 -5.043 -5.256 12.665 1.00 0.00 C ATOM 1392 NZ LYS A 87 -4.517 -4.014 12.049 1.00 0.00 N ATOM 0 H LYS A 87 -3.181 -7.003 8.633 1.00 0.00 H new ATOM 0 HA LYS A 87 -2.247 -5.932 10.248 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -2.584 -8.416 11.681 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -1.104 -7.606 12.153 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -2.772 -6.717 13.558 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -2.462 -5.473 12.363 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.428 -6.498 11.033 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.810 -7.378 12.500 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.113 -5.337 12.472 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -4.917 -5.211 13.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.204 -3.244 12.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -3.617 -3.756 12.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.360 -4.170 11.033 1.00 0.00 H new ATOM 1406 N ILE A 88 -0.226 -7.204 8.646 1.00 0.00 N ATOM 1407 CA ILE A 88 1.056 -7.013 8.061 1.00 0.00 C ATOM 1408 C ILE A 88 1.308 -5.498 8.008 1.00 0.00 C ATOM 1409 O ILE A 88 2.410 -5.017 8.289 1.00 0.00 O ATOM 1410 CB ILE A 88 1.134 -7.699 6.657 1.00 0.00 C ATOM 1411 CG1 ILE A 88 1.341 -9.225 6.773 1.00 0.00 C ATOM 1412 CG2 ILE A 88 2.222 -7.105 5.790 1.00 0.00 C ATOM 1413 CD1 ILE A 88 0.195 -10.005 7.360 1.00 0.00 C ATOM 0 H ILE A 88 -0.927 -7.574 8.004 1.00 0.00 H new ATOM 0 HA ILE A 88 1.840 -7.484 8.654 1.00 0.00 H new ATOM 0 HB ILE A 88 0.173 -7.511 6.179 1.00 0.00 H new ATOM 0 HG12 ILE A 88 1.551 -9.619 5.779 1.00 0.00 H new ATOM 0 HG13 ILE A 88 2.227 -9.406 7.382 1.00 0.00 H new ATOM 0 HG21 ILE A 88 2.237 -7.613 4.826 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.027 -6.044 5.637 1.00 0.00 H new ATOM 0 HG23 ILE A 88 3.187 -7.229 6.281 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.454 -11.063 7.392 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.007 -9.650 8.371 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.693 -9.867 6.743 1.00 0.00 H new ATOM 1425 N LEU A 89 0.258 -4.761 7.677 1.00 0.00 N ATOM 1426 CA LEU A 89 0.272 -3.314 7.782 1.00 0.00 C ATOM 1427 C LEU A 89 -0.675 -2.874 8.873 1.00 0.00 C ATOM 1428 O LEU A 89 -1.701 -3.526 9.115 1.00 0.00 O ATOM 1429 CB LEU A 89 -0.091 -2.606 6.458 1.00 0.00 C ATOM 1430 CG LEU A 89 1.032 -2.396 5.433 1.00 0.00 C ATOM 1431 CD1 LEU A 89 2.135 -1.558 6.041 1.00 0.00 C ATOM 1432 CD2 LEU A 89 1.583 -3.705 4.958 1.00 0.00 C ATOM 0 H LEU A 89 -0.620 -5.148 7.331 1.00 0.00 H new ATOM 0 HA LEU A 89 1.294 -3.024 8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.882 -3.180 5.976 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.509 -1.630 6.703 1.00 0.00 H new ATOM 0 HG LEU A 89 0.614 -1.873 4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.928 -1.413 5.308 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.734 -0.589 6.338 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.538 -2.067 6.916 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.377 -3.524 4.233 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.985 -4.259 5.806 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.789 -4.285 4.489 1.00 0.00 H new ATOM 1444 N ASP A 90 -0.344 -1.795 9.530 1.00 0.00 N ATOM 1445 CA ASP A 90 -1.181 -1.241 10.575 1.00 0.00 C ATOM 1446 C ASP A 90 -1.327 0.247 10.386 1.00 0.00 C ATOM 1447 O ASP A 90 -0.411 1.007 10.665 1.00 0.00 O ATOM 1448 CB ASP A 90 -0.644 -1.550 12.005 1.00 0.00 C ATOM 1449 CG ASP A 90 -0.949 -2.957 12.498 1.00 0.00 C ATOM 1450 OD1 ASP A 90 -2.144 -3.273 12.724 1.00 0.00 O ATOM 1451 OD2 ASP A 90 -0.009 -3.750 12.729 1.00 0.00 O ATOM 0 H ASP A 90 0.514 -1.270 9.360 1.00 0.00 H new ATOM 0 HA ASP A 90 -2.156 -1.721 10.491 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.436 -1.400 12.015 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -1.072 -0.832 12.704 1.00 0.00 H new ATOM 1456 N GLU A 91 -2.438 0.657 9.834 1.00 0.00 N ATOM 1457 CA GLU A 91 -2.727 2.072 9.688 1.00 0.00 C ATOM 1458 C GLU A 91 -3.678 2.536 10.781 1.00 0.00 C ATOM 1459 O GLU A 91 -4.411 1.718 11.355 1.00 0.00 O ATOM 1460 CB GLU A 91 -3.287 2.407 8.292 1.00 0.00 C ATOM 1461 CG GLU A 91 -4.581 1.722 7.902 1.00 0.00 C ATOM 1462 CD GLU A 91 -5.075 2.185 6.537 1.00 0.00 C ATOM 1463 OE1 GLU A 91 -4.237 2.388 5.624 1.00 0.00 O ATOM 1464 OE2 GLU A 91 -6.300 2.322 6.355 1.00 0.00 O ATOM 0 H GLU A 91 -3.163 0.036 9.475 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.786 2.612 9.792 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.441 3.485 8.235 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.529 2.154 7.550 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.431 0.642 7.888 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.343 1.928 8.654 1.00 0.00 H new ATOM 1471 N ASP A 92 -3.654 3.826 11.064 1.00 0.00 N ATOM 1472 CA ASP A 92 -4.528 4.421 12.078 1.00 0.00 C ATOM 1473 C ASP A 92 -5.146 5.691 11.465 1.00 0.00 C ATOM 1474 O ASP A 92 -4.805 6.051 10.320 1.00 0.00 O ATOM 1475 CB ASP A 92 -3.754 4.739 13.383 1.00 0.00 C ATOM 1476 CG ASP A 92 -4.678 4.951 14.595 1.00 0.00 C ATOM 1477 OD1 ASP A 92 -5.276 6.042 14.716 1.00 0.00 O ATOM 1478 OD2 ASP A 92 -4.813 4.024 15.411 1.00 0.00 O ATOM 0 H ASP A 92 -3.035 4.493 10.604 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.312 3.717 12.358 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.064 3.923 13.598 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.151 5.634 13.232 1.00 0.00 H new ATOM 1483 N LEU A 93 -5.972 6.393 12.199 1.00 0.00 N ATOM 1484 CA LEU A 93 -6.754 7.472 11.642 1.00 0.00 C ATOM 1485 C LEU A 93 -6.230 8.856 11.999 1.00 0.00 C ATOM 1486 O LEU A 93 -5.636 9.083 13.037 1.00 0.00 O ATOM 1487 CB LEU A 93 -8.228 7.348 12.052 1.00 0.00 C ATOM 1488 CG LEU A 93 -8.971 6.090 11.574 1.00 0.00 C ATOM 1489 CD1 LEU A 93 -10.394 6.080 12.107 1.00 0.00 C ATOM 1490 CD2 LEU A 93 -8.978 6.013 10.051 1.00 0.00 C ATOM 0 H LEU A 93 -6.122 6.235 13.195 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.663 7.373 10.560 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.283 7.384 13.140 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.761 8.222 11.677 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.446 5.217 11.961 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.906 5.183 11.759 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -10.374 6.088 13.197 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -10.923 6.962 11.748 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.509 5.115 9.735 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.478 6.892 9.645 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -7.952 5.976 9.684 1.00 0.00 H new ATOM 1502 N TYR A 94 -6.472 9.763 11.103 1.00 0.00 N ATOM 1503 CA TYR A 94 -6.146 11.141 11.233 1.00 0.00 C ATOM 1504 C TYR A 94 -7.284 11.907 10.623 1.00 0.00 C ATOM 1505 O TYR A 94 -7.621 11.700 9.463 1.00 0.00 O ATOM 1506 CB TYR A 94 -4.834 11.446 10.491 1.00 0.00 C ATOM 1507 CG TYR A 94 -4.523 12.923 10.327 1.00 0.00 C ATOM 1508 CD1 TYR A 94 -3.941 13.660 11.348 1.00 0.00 C ATOM 1509 CD2 TYR A 94 -4.808 13.575 9.129 1.00 0.00 C ATOM 1510 CE1 TYR A 94 -3.653 15.004 11.182 1.00 0.00 C ATOM 1511 CE2 TYR A 94 -4.527 14.912 8.957 1.00 0.00 C ATOM 1512 CZ TYR A 94 -3.950 15.623 9.985 1.00 0.00 C ATOM 1513 OH TYR A 94 -3.653 16.959 9.807 1.00 0.00 O ATOM 0 H TYR A 94 -6.926 9.545 10.216 1.00 0.00 H new ATOM 0 HA TYR A 94 -6.003 11.419 12.277 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -4.011 10.973 11.028 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -4.876 10.986 9.504 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.709 13.178 12.286 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -5.258 13.021 8.319 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -3.198 15.565 11.985 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -4.758 15.400 8.021 1.00 0.00 H new ATOM 0 HH TYR A 94 -3.926 17.238 8.908 1.00 0.00 H new ATOM 1523 N ILE A 95 -7.909 12.737 11.374 1.00 0.00 N ATOM 1524 CA ILE A 95 -8.994 13.471 10.852 1.00 0.00 C ATOM 1525 C ILE A 95 -8.662 14.951 10.912 1.00 0.00 C ATOM 1526 O ILE A 95 -7.870 15.381 11.755 1.00 0.00 O ATOM 1527 CB ILE A 95 -10.301 13.127 11.620 1.00 0.00 C ATOM 1528 CG1 ILE A 95 -11.505 13.543 10.834 1.00 0.00 C ATOM 1529 CG2 ILE A 95 -10.344 13.810 12.967 1.00 0.00 C ATOM 1530 CD1 ILE A 95 -12.782 13.059 11.434 1.00 0.00 C ATOM 0 H ILE A 95 -7.686 12.923 12.352 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.164 13.202 9.809 1.00 0.00 H new ATOM 0 HB ILE A 95 -10.310 12.047 11.765 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.530 14.631 10.765 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.419 13.161 9.817 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.271 13.549 13.478 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.494 13.485 13.567 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.298 14.890 12.829 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.620 13.391 10.822 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.773 11.970 11.478 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.887 13.462 12.441 1.00 0.00 H new ATOM 1542 N ASN A 96 -9.193 15.698 10.000 1.00 0.00 N ATOM 1543 CA ASN A 96 -8.968 17.118 9.974 1.00 0.00 C ATOM 1544 C ASN A 96 -10.177 17.851 10.530 1.00 0.00 C ATOM 1545 O ASN A 96 -11.164 17.230 10.910 1.00 0.00 O ATOM 1546 CB ASN A 96 -8.631 17.617 8.549 1.00 0.00 C ATOM 1547 CG ASN A 96 -9.664 17.279 7.498 1.00 0.00 C ATOM 1548 OD1 ASN A 96 -10.833 17.035 7.783 1.00 0.00 O ATOM 1549 ND2 ASN A 96 -9.254 17.376 6.288 1.00 0.00 N ATOM 0 H ASN A 96 -9.793 15.350 9.252 1.00 0.00 H new ATOM 0 HA ASN A 96 -8.105 17.332 10.605 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -8.504 18.699 8.579 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -7.674 17.192 8.247 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -9.908 17.249 5.516 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -8.273 17.580 6.097 1.00 0.00 H new ATOM 1556 N ALA A 97 -10.125 19.169 10.499 1.00 0.00 N ATOM 1557 CA ALA A 97 -11.187 20.035 11.029 1.00 0.00 C ATOM 1558 C ALA A 97 -12.433 20.059 10.118 1.00 0.00 C ATOM 1559 O ALA A 97 -13.326 20.868 10.298 1.00 0.00 O ATOM 1560 CB ALA A 97 -10.633 21.439 11.187 1.00 0.00 C ATOM 0 H ALA A 97 -9.339 19.685 10.103 1.00 0.00 H new ATOM 0 HA ALA A 97 -11.506 19.636 11.992 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -11.410 22.095 11.580 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -9.790 21.422 11.877 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -10.301 21.810 10.217 1.00 0.00 H new ATOM 1566 N ASN A 98 -12.475 19.162 9.166 1.00 0.00 N ATOM 1567 CA ASN A 98 -13.577 19.073 8.223 1.00 0.00 C ATOM 1568 C ASN A 98 -14.342 17.791 8.526 1.00 0.00 C ATOM 1569 O ASN A 98 -15.345 17.498 7.893 1.00 0.00 O ATOM 1570 CB ASN A 98 -12.985 18.990 6.807 1.00 0.00 C ATOM 1571 CG ASN A 98 -13.908 19.300 5.641 1.00 0.00 C ATOM 1572 OD1 ASN A 98 -13.450 19.791 4.625 1.00 0.00 O ATOM 1573 ND2 ASN A 98 -15.146 18.990 5.726 1.00 0.00 N ATOM 0 H ASN A 98 -11.745 18.466 9.017 1.00 0.00 H new ATOM 0 HA ASN A 98 -14.240 19.935 8.299 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -12.138 19.674 6.756 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -12.591 17.984 6.666 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -15.768 19.153 4.934 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -15.511 18.580 6.585 1.00 0.00 H new ATOM 1580 N ASP A 99 -13.821 17.034 9.503 1.00 0.00 N ATOM 1581 CA ASP A 99 -14.357 15.711 9.908 1.00 0.00 C ATOM 1582 C ASP A 99 -14.095 14.686 8.774 1.00 0.00 C ATOM 1583 O ASP A 99 -14.711 13.642 8.657 1.00 0.00 O ATOM 1584 CB ASP A 99 -15.856 15.800 10.322 1.00 0.00 C ATOM 1585 CG ASP A 99 -16.401 14.530 10.979 1.00 0.00 C ATOM 1586 OD1 ASP A 99 -15.955 14.211 12.110 1.00 0.00 O ATOM 1587 OD2 ASP A 99 -17.308 13.893 10.400 1.00 0.00 O ATOM 0 H ASP A 99 -13.006 17.320 10.045 1.00 0.00 H new ATOM 0 HA ASP A 99 -13.835 15.363 10.800 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -15.982 16.635 11.011 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -16.453 16.023 9.438 1.00 0.00 H new ATOM 1592 N GLN A 100 -13.081 14.981 7.977 1.00 0.00 N ATOM 1593 CA GLN A 100 -12.668 14.077 6.932 1.00 0.00 C ATOM 1594 C GLN A 100 -11.502 13.259 7.431 1.00 0.00 C ATOM 1595 O GLN A 100 -10.392 13.785 7.636 1.00 0.00 O ATOM 1596 CB GLN A 100 -12.326 14.794 5.615 1.00 0.00 C ATOM 1597 CG GLN A 100 -13.528 15.406 4.907 1.00 0.00 C ATOM 1598 CD GLN A 100 -13.188 15.908 3.512 1.00 0.00 C ATOM 1599 OE1 GLN A 100 -13.269 15.170 2.549 1.00 0.00 O ATOM 1600 NE2 GLN A 100 -12.850 17.167 3.383 1.00 0.00 N ATOM 0 H GLN A 100 -12.534 15.839 8.039 1.00 0.00 H new ATOM 0 HA GLN A 100 -13.508 13.424 6.696 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -11.600 15.581 5.821 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -11.845 14.084 4.942 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -14.323 14.663 4.839 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -13.915 16.233 5.503 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -12.789 17.766 4.207 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -12.648 17.549 2.459 1.00 0.00 H new ATOM 1609 N ALA A 101 -11.772 12.009 7.703 1.00 0.00 N ATOM 1610 CA ALA A 101 -10.791 11.103 8.242 1.00 0.00 C ATOM 1611 C ALA A 101 -10.010 10.410 7.154 1.00 0.00 C ATOM 1612 O ALA A 101 -10.579 9.853 6.218 1.00 0.00 O ATOM 1613 CB ALA A 101 -11.457 10.073 9.147 1.00 0.00 C ATOM 0 H ALA A 101 -12.689 11.587 7.555 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.089 11.695 8.829 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -10.701 9.396 9.546 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -11.959 10.582 9.970 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.188 9.503 8.573 1.00 0.00 H new ATOM 1619 N ILE A 102 -8.722 10.454 7.282 1.00 0.00 N ATOM 1620 CA ILE A 102 -7.834 9.778 6.390 1.00 0.00 C ATOM 1621 C ILE A 102 -6.938 8.870 7.234 1.00 0.00 C ATOM 1622 O ILE A 102 -6.699 9.156 8.405 1.00 0.00 O ATOM 1623 CB ILE A 102 -7.001 10.778 5.517 1.00 0.00 C ATOM 1624 CG1 ILE A 102 -6.130 10.030 4.483 1.00 0.00 C ATOM 1625 CG2 ILE A 102 -6.154 11.689 6.387 1.00 0.00 C ATOM 1626 CD1 ILE A 102 -5.360 10.936 3.542 1.00 0.00 C ATOM 0 H ILE A 102 -8.249 10.971 8.023 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.405 9.182 5.678 1.00 0.00 H new ATOM 0 HB ILE A 102 -7.706 11.401 4.967 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.423 9.393 5.014 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.770 9.374 3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.587 12.372 5.755 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.801 12.262 7.051 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -5.465 11.088 6.981 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.776 10.330 2.850 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -6.059 11.556 2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -4.691 11.575 4.118 1.00 0.00 H new ATOM 1638 N ALA A 103 -6.501 7.782 6.684 1.00 0.00 N ATOM 1639 CA ALA A 103 -5.703 6.841 7.424 1.00 0.00 C ATOM 1640 C ALA A 103 -4.269 6.863 6.944 1.00 0.00 C ATOM 1641 O ALA A 103 -4.013 6.891 5.732 1.00 0.00 O ATOM 1642 CB ALA A 103 -6.291 5.452 7.299 1.00 0.00 C ATOM 0 H ALA A 103 -6.682 7.517 5.716 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.709 7.128 8.476 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.680 4.746 7.862 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.307 5.450 7.695 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -6.310 5.158 6.250 1.00 0.00 H new ATOM 1648 N TYR A 104 -3.346 6.885 7.881 1.00 0.00 N ATOM 1649 CA TYR A 104 -1.928 6.866 7.569 1.00 0.00 C ATOM 1650 C TYR A 104 -1.362 5.508 7.893 1.00 0.00 C ATOM 1651 O TYR A 104 -1.703 4.923 8.915 1.00 0.00 O ATOM 1652 CB TYR A 104 -1.134 7.965 8.298 1.00 0.00 C ATOM 1653 CG TYR A 104 -1.326 9.381 7.765 1.00 0.00 C ATOM 1654 CD1 TYR A 104 -2.519 10.064 7.922 1.00 0.00 C ATOM 1655 CD2 TYR A 104 -0.286 10.030 7.098 1.00 0.00 C ATOM 1656 CE1 TYR A 104 -2.674 11.350 7.434 1.00 0.00 C ATOM 1657 CE2 TYR A 104 -0.435 11.317 6.610 1.00 0.00 C ATOM 1658 CZ TYR A 104 -1.632 11.972 6.782 1.00 0.00 C ATOM 1659 OH TYR A 104 -1.795 13.266 6.298 1.00 0.00 O ATOM 0 H TYR A 104 -3.554 6.916 8.879 1.00 0.00 H new ATOM 0 HA TYR A 104 -1.828 7.072 6.503 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -1.413 7.952 9.352 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -0.074 7.717 8.246 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -3.342 9.586 8.433 1.00 0.00 H new ATOM 0 HD2 TYR A 104 0.655 9.518 6.960 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -3.613 11.867 7.565 1.00 0.00 H new ATOM 0 HE2 TYR A 104 0.383 11.803 6.098 1.00 0.00 H new ATOM 0 HH TYR A 104 -0.966 13.560 5.865 1.00 0.00 H new ATOM 1669 N VAL A 105 -0.444 5.066 7.078 1.00 0.00 N ATOM 1670 CA VAL A 105 0.071 3.724 7.134 1.00 0.00 C ATOM 1671 C VAL A 105 1.351 3.615 7.908 1.00 0.00 C ATOM 1672 O VAL A 105 2.276 4.416 7.760 1.00 0.00 O ATOM 1673 CB VAL A 105 0.231 3.116 5.697 1.00 0.00 C ATOM 1674 CG1 VAL A 105 1.148 1.898 5.675 1.00 0.00 C ATOM 1675 CG2 VAL A 105 -1.108 2.684 5.230 1.00 0.00 C ATOM 0 H VAL A 105 -0.025 5.637 6.344 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.670 3.138 7.678 1.00 0.00 H new ATOM 0 HB VAL A 105 0.671 3.881 5.058 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.223 1.518 4.656 1.00 0.00 H new ATOM 0 HG12 VAL A 105 2.139 2.182 6.030 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.739 1.123 6.323 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -1.024 2.257 4.231 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.507 1.934 5.913 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -1.778 3.543 5.202 1.00 0.00 H new ATOM 1685 N MET A 106 1.364 2.618 8.748 1.00 0.00 N ATOM 1686 CA MET A 106 2.497 2.258 9.552 1.00 0.00 C ATOM 1687 C MET A 106 2.645 0.750 9.455 1.00 0.00 C ATOM 1688 O MET A 106 1.805 0.074 8.841 1.00 0.00 O ATOM 1689 CB MET A 106 2.302 2.670 11.028 1.00 0.00 C ATOM 1690 CG MET A 106 2.066 4.157 11.250 1.00 0.00 C ATOM 1691 SD MET A 106 1.877 4.581 12.992 1.00 0.00 S ATOM 1692 CE MET A 106 1.510 6.329 12.871 1.00 0.00 C ATOM 0 H MET A 106 0.557 2.013 8.896 1.00 0.00 H new ATOM 0 HA MET A 106 3.386 2.775 9.192 1.00 0.00 H new ATOM 0 HB2 MET A 106 1.456 2.117 11.436 1.00 0.00 H new ATOM 0 HB3 MET A 106 3.183 2.368 11.594 1.00 0.00 H new ATOM 0 HG2 MET A 106 2.901 4.719 10.832 1.00 0.00 H new ATOM 0 HG3 MET A 106 1.172 4.464 10.707 1.00 0.00 H new ATOM 0 HE1 MET A 106 1.366 6.740 13.870 1.00 0.00 H new ATOM 0 HE2 MET A 106 2.339 6.842 12.384 1.00 0.00 H new ATOM 0 HE3 MET A 106 0.601 6.470 12.286 1.00 0.00 H new ATOM 1702 N LEU A 107 3.665 0.222 10.048 1.00 0.00 N ATOM 1703 CA LEU A 107 3.916 -1.194 10.018 1.00 0.00 C ATOM 1704 C LEU A 107 3.950 -1.681 11.445 1.00 0.00 C ATOM 1705 O LEU A 107 4.591 -1.048 12.288 1.00 0.00 O ATOM 1706 CB LEU A 107 5.236 -1.546 9.257 1.00 0.00 C ATOM 1707 CG LEU A 107 6.595 -1.033 9.824 1.00 0.00 C ATOM 1708 CD1 LEU A 107 7.743 -1.740 9.125 1.00 0.00 C ATOM 1709 CD2 LEU A 107 6.762 0.477 9.638 1.00 0.00 C ATOM 0 H LEU A 107 4.356 0.759 10.572 1.00 0.00 H new ATOM 0 HA LEU A 107 3.121 -1.695 9.466 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.297 -2.632 9.189 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.140 -1.168 8.239 1.00 0.00 H new ATOM 0 HG LEU A 107 6.602 -1.250 10.892 1.00 0.00 H new ATOM 0 HD11 LEU A 107 8.690 -1.378 9.525 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.665 -2.814 9.293 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.699 -1.536 8.055 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.722 0.790 10.047 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.724 0.719 8.576 1.00 0.00 H new ATOM 0 HD23 LEU A 107 5.959 0.999 10.158 1.00 0.00 H new ATOM 1721 N GLY A 108 3.253 -2.756 11.739 1.00 0.00 N ATOM 1722 CA GLY A 108 3.181 -3.169 13.105 1.00 0.00 C ATOM 1723 C GLY A 108 3.257 -4.664 13.340 1.00 0.00 C ATOM 1724 O GLY A 108 4.316 -5.291 13.161 1.00 0.00 O ATOM 0 H GLY A 108 2.747 -3.337 11.070 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.992 -2.691 13.654 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.248 -2.799 13.529 1.00 0.00 H new ATOM 1728 N ASN A 109 2.110 -5.220 13.646 1.00 0.00 N ATOM 1729 CA ASN A 109 1.934 -6.584 14.173 1.00 0.00 C ATOM 1730 C ASN A 109 2.648 -7.679 13.395 1.00 0.00 C ATOM 1731 O ASN A 109 3.417 -8.462 13.965 1.00 0.00 O ATOM 1732 CB ASN A 109 0.448 -6.920 14.289 1.00 0.00 C ATOM 1733 CG ASN A 109 -0.267 -6.162 15.390 1.00 0.00 C ATOM 1734 OD1 ASN A 109 -0.359 -6.636 16.516 1.00 0.00 O ATOM 1735 ND2 ASN A 109 -0.772 -4.989 15.082 1.00 0.00 N ATOM 0 H ASN A 109 1.224 -4.726 13.536 1.00 0.00 H new ATOM 0 HA ASN A 109 2.409 -6.567 15.154 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.039 -6.705 13.338 1.00 0.00 H new ATOM 0 HB3 ASN A 109 0.340 -7.990 14.468 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -1.260 -4.442 15.791 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -0.676 -4.626 14.134 1.00 0.00 H new ATOM 1742 N LYS A 110 2.393 -7.772 12.124 1.00 0.00 N ATOM 1743 CA LYS A 110 2.975 -8.828 11.335 1.00 0.00 C ATOM 1744 C LYS A 110 3.996 -8.283 10.365 1.00 0.00 C ATOM 1745 O LYS A 110 4.415 -8.972 9.442 1.00 0.00 O ATOM 1746 CB LYS A 110 1.885 -9.620 10.603 1.00 0.00 C ATOM 1747 CG LYS A 110 0.833 -10.236 11.516 1.00 0.00 C ATOM 1748 CD LYS A 110 1.448 -11.177 12.530 1.00 0.00 C ATOM 1749 CE LYS A 110 0.395 -11.745 13.456 1.00 0.00 C ATOM 1750 NZ LYS A 110 1.000 -12.615 14.491 1.00 0.00 N ATOM 0 H LYS A 110 1.788 -7.133 11.608 1.00 0.00 H new ATOM 0 HA LYS A 110 3.493 -9.509 12.010 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.389 -8.960 9.892 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.357 -10.415 10.025 1.00 0.00 H new ATOM 0 HG2 LYS A 110 0.294 -9.444 12.036 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.102 -10.777 10.915 1.00 0.00 H new ATOM 0 HD2 LYS A 110 1.959 -11.990 12.013 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.201 -10.647 13.113 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.148 -10.931 13.935 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.331 -12.316 12.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.253 -12.989 15.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 1.498 -13.405 14.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.675 -12.063 15.058 1.00 0.00 H new ATOM 1764 N ALA A 111 4.484 -7.090 10.646 1.00 0.00 N ATOM 1765 CA ALA A 111 5.468 -6.443 9.786 1.00 0.00 C ATOM 1766 C ALA A 111 6.784 -7.103 10.044 1.00 0.00 C ATOM 1767 O ALA A 111 7.611 -7.302 9.161 1.00 0.00 O ATOM 1768 CB ALA A 111 5.549 -4.966 10.086 1.00 0.00 C ATOM 0 H ALA A 111 4.217 -6.544 11.465 1.00 0.00 H new ATOM 0 HA ALA A 111 5.185 -6.545 8.738 1.00 0.00 H new ATOM 0 HB1 ALA A 111 6.289 -4.502 9.434 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.576 -4.506 9.915 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.841 -4.821 11.126 1.00 0.00 H new ATOM 1774 N GLN A 112 6.925 -7.490 11.274 1.00 0.00 N ATOM 1775 CA GLN A 112 8.024 -8.262 11.743 1.00 0.00 C ATOM 1776 C GLN A 112 8.042 -9.637 11.041 1.00 0.00 C ATOM 1777 O GLN A 112 9.097 -10.163 10.686 1.00 0.00 O ATOM 1778 CB GLN A 112 7.882 -8.392 13.260 1.00 0.00 C ATOM 1779 CG GLN A 112 8.659 -9.515 13.878 1.00 0.00 C ATOM 1780 CD GLN A 112 10.162 -9.417 13.662 1.00 0.00 C ATOM 1781 OE1 GLN A 112 10.720 -8.338 13.569 1.00 0.00 O ATOM 1782 NE2 GLN A 112 10.811 -10.547 13.537 1.00 0.00 N ATOM 0 H GLN A 112 6.249 -7.266 12.004 1.00 0.00 H new ATOM 0 HA GLN A 112 8.974 -7.780 11.512 1.00 0.00 H new ATOM 0 HB2 GLN A 112 8.198 -7.456 13.720 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.827 -8.525 13.500 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.456 -9.538 14.949 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.303 -10.460 13.466 1.00 0.00 H new ATOM 0 HE21 GLN A 112 10.313 -11.433 13.621 1.00 0.00 H new ATOM 0 HE22 GLN A 112 11.815 -10.541 13.356 1.00 0.00 H new ATOM 1791 N THR A 113 6.870 -10.179 10.796 1.00 0.00 N ATOM 1792 CA THR A 113 6.749 -11.448 10.132 1.00 0.00 C ATOM 1793 C THR A 113 7.179 -11.293 8.652 1.00 0.00 C ATOM 1794 O THR A 113 7.709 -12.225 8.037 1.00 0.00 O ATOM 1795 CB THR A 113 5.298 -11.953 10.244 1.00 0.00 C ATOM 1796 OG1 THR A 113 4.893 -11.859 11.627 1.00 0.00 O ATOM 1797 CG2 THR A 113 5.184 -13.405 9.794 1.00 0.00 C ATOM 0 H THR A 113 5.980 -9.751 11.052 1.00 0.00 H new ATOM 0 HA THR A 113 7.400 -12.183 10.604 1.00 0.00 H new ATOM 0 HB THR A 113 4.660 -11.345 9.603 1.00 0.00 H new ATOM 0 HG1 THR A 113 4.125 -12.448 11.784 1.00 0.00 H new ATOM 0 HG21 THR A 113 4.149 -13.734 9.884 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.502 -13.490 8.755 1.00 0.00 H new ATOM 0 HG23 THR A 113 5.819 -14.031 10.421 1.00 0.00 H new ATOM 1805 N VAL A 114 6.995 -10.084 8.120 1.00 0.00 N ATOM 1806 CA VAL A 114 7.409 -9.753 6.764 1.00 0.00 C ATOM 1807 C VAL A 114 8.922 -9.784 6.668 1.00 0.00 C ATOM 1808 O VAL A 114 9.486 -10.337 5.712 1.00 0.00 O ATOM 1809 CB VAL A 114 6.937 -8.345 6.337 1.00 0.00 C ATOM 1810 CG1 VAL A 114 7.273 -8.086 4.879 1.00 0.00 C ATOM 1811 CG2 VAL A 114 5.459 -8.140 6.581 1.00 0.00 C ATOM 0 H VAL A 114 6.555 -9.311 8.619 1.00 0.00 H new ATOM 0 HA VAL A 114 6.954 -10.492 6.105 1.00 0.00 H new ATOM 0 HB VAL A 114 7.472 -7.626 6.958 1.00 0.00 H new ATOM 0 HG11 VAL A 114 6.932 -7.089 4.599 1.00 0.00 H new ATOM 0 HG12 VAL A 114 8.351 -8.154 4.737 1.00 0.00 H new ATOM 0 HG13 VAL A 114 6.777 -8.828 4.254 1.00 0.00 H new ATOM 0 HG21 VAL A 114 5.174 -7.136 6.266 1.00 0.00 H new ATOM 0 HG22 VAL A 114 4.891 -8.875 6.011 1.00 0.00 H new ATOM 0 HG23 VAL A 114 5.245 -8.261 7.643 1.00 0.00 H new ATOM 1821 N LEU A 115 9.560 -9.209 7.671 1.00 0.00 N ATOM 1822 CA LEU A 115 11.020 -9.125 7.753 1.00 0.00 C ATOM 1823 C LEU A 115 11.616 -10.504 7.949 1.00 0.00 C ATOM 1824 O LEU A 115 12.691 -10.801 7.452 1.00 0.00 O ATOM 1825 CB LEU A 115 11.417 -8.215 8.911 1.00 0.00 C ATOM 1826 CG LEU A 115 10.813 -6.815 8.878 1.00 0.00 C ATOM 1827 CD1 LEU A 115 11.181 -6.042 10.134 1.00 0.00 C ATOM 1828 CD2 LEU A 115 11.255 -6.052 7.633 1.00 0.00 C ATOM 0 H LEU A 115 9.081 -8.781 8.463 1.00 0.00 H new ATOM 0 HA LEU A 115 11.404 -8.710 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 115 11.127 -8.696 9.845 1.00 0.00 H new ATOM 0 HB3 LEU A 115 12.503 -8.124 8.924 1.00 0.00 H new ATOM 0 HG LEU A 115 9.729 -6.921 8.841 1.00 0.00 H new ATOM 0 HD11 LEU A 115 10.740 -5.046 10.090 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.802 -6.569 11.010 1.00 0.00 H new ATOM 0 HD13 LEU A 115 12.265 -5.956 10.204 1.00 0.00 H new ATOM 0 HD21 LEU A 115 10.808 -5.058 7.638 1.00 0.00 H new ATOM 0 HD22 LEU A 115 12.341 -5.962 7.628 1.00 0.00 H new ATOM 0 HD23 LEU A 115 10.932 -6.591 6.742 1.00 0.00 H new ATOM 1840 N ASN A 116 10.882 -11.351 8.658 1.00 0.00 N ATOM 1841 CA ASN A 116 11.294 -12.731 8.881 1.00 0.00 C ATOM 1842 C ASN A 116 11.116 -13.494 7.565 1.00 0.00 C ATOM 1843 O ASN A 116 11.745 -14.515 7.328 1.00 0.00 O ATOM 1844 CB ASN A 116 10.407 -13.360 9.981 1.00 0.00 C ATOM 1845 CG ASN A 116 10.924 -14.683 10.593 1.00 0.00 C ATOM 1846 OD1 ASN A 116 10.638 -14.973 11.743 1.00 0.00 O ATOM 1847 ND2 ASN A 116 11.660 -15.482 9.856 1.00 0.00 N ATOM 0 H ASN A 116 9.992 -11.105 9.091 1.00 0.00 H new ATOM 0 HA ASN A 116 12.334 -12.776 9.203 1.00 0.00 H new ATOM 0 HB2 ASN A 116 10.288 -12.633 10.784 1.00 0.00 H new ATOM 0 HB3 ASN A 116 9.416 -13.538 9.563 1.00 0.00 H new ATOM 0 HD21 ASN A 116 12.002 -16.361 10.243 1.00 0.00 H new ATOM 0 HD22 ASN A 116 11.889 -15.223 8.896 1.00 0.00 H new ATOM 1854 N GLY A 117 10.241 -12.980 6.722 1.00 0.00 N ATOM 1855 CA GLY A 117 10.006 -13.571 5.430 1.00 0.00 C ATOM 1856 C GLY A 117 8.792 -14.465 5.401 1.00 0.00 C ATOM 1857 O GLY A 117 8.197 -14.664 4.342 1.00 0.00 O ATOM 0 H GLY A 117 9.681 -12.150 6.916 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.884 -12.779 4.691 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.882 -14.149 5.136 1.00 0.00 H new ATOM 1861 N ASN A 118 8.370 -14.894 6.572 1.00 0.00 N ATOM 1862 CA ASN A 118 7.294 -15.895 6.762 1.00 0.00 C ATOM 1863 C ASN A 118 5.888 -15.316 6.613 1.00 0.00 C ATOM 1864 O ASN A 118 4.917 -15.888 7.106 1.00 0.00 O ATOM 1865 CB ASN A 118 7.422 -16.556 8.148 1.00 0.00 C ATOM 1866 CG ASN A 118 8.639 -17.449 8.287 1.00 0.00 C ATOM 1867 OD1 ASN A 118 9.115 -18.027 7.328 1.00 0.00 O ATOM 1868 ND2 ASN A 118 9.146 -17.578 9.492 1.00 0.00 N ATOM 0 H ASN A 118 8.763 -14.559 7.452 1.00 0.00 H new ATOM 0 HA ASN A 118 7.425 -16.631 5.969 1.00 0.00 H new ATOM 0 HB2 ASN A 118 7.465 -15.777 8.910 1.00 0.00 H new ATOM 0 HB3 ASN A 118 6.526 -17.145 8.344 1.00 0.00 H new ATOM 0 HD21 ASN A 118 9.959 -18.175 9.642 1.00 0.00 H new ATOM 0 HD22 ASN A 118 8.726 -17.081 10.278 1.00 0.00 H new ATOM 1875 N LEU A 119 5.759 -14.237 5.899 1.00 0.00 N ATOM 1876 CA LEU A 119 4.471 -13.619 5.732 1.00 0.00 C ATOM 1877 C LEU A 119 3.821 -14.123 4.449 1.00 0.00 C ATOM 1878 O LEU A 119 4.308 -13.938 3.337 1.00 0.00 O ATOM 1879 CB LEU A 119 4.519 -12.041 5.826 1.00 0.00 C ATOM 1880 CG LEU A 119 5.042 -11.215 4.620 1.00 0.00 C ATOM 1881 CD1 LEU A 119 6.217 -11.870 3.969 1.00 0.00 C ATOM 1882 CD2 LEU A 119 3.934 -10.875 3.617 1.00 0.00 C ATOM 0 H LEU A 119 6.527 -13.765 5.422 1.00 0.00 H new ATOM 0 HA LEU A 119 3.842 -13.918 6.571 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.508 -11.697 6.043 1.00 0.00 H new ATOM 0 HB3 LEU A 119 5.135 -11.785 6.688 1.00 0.00 H new ATOM 0 HG LEU A 119 5.390 -10.262 5.019 1.00 0.00 H new ATOM 0 HD11 LEU A 119 6.554 -11.262 3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 119 7.026 -11.969 4.693 1.00 0.00 H new ATOM 0 HD13 LEU A 119 5.930 -12.858 3.609 1.00 0.00 H new ATOM 0 HD21 LEU A 119 4.353 -10.297 2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.499 -11.796 3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.160 -10.290 4.114 1.00 0.00 H new ATOM 1894 N LYS A 120 2.860 -14.863 4.620 1.00 0.00 N ATOM 1895 CA LYS A 120 2.063 -15.285 3.537 1.00 0.00 C ATOM 1896 C LYS A 120 0.603 -15.090 3.735 1.00 0.00 C ATOM 1897 O LYS A 120 0.004 -15.674 4.629 1.00 0.00 O ATOM 1898 CB LYS A 120 2.442 -16.630 2.944 1.00 0.00 C ATOM 1899 CG LYS A 120 2.680 -17.777 3.872 1.00 0.00 C ATOM 1900 CD LYS A 120 2.893 -19.089 3.070 1.00 0.00 C ATOM 1901 CE LYS A 120 4.059 -19.051 2.015 1.00 0.00 C ATOM 1902 NZ LYS A 120 3.810 -18.158 0.817 1.00 0.00 N ATOM 0 H LYS A 120 2.568 -15.222 5.529 1.00 0.00 H new ATOM 0 HA LYS A 120 2.322 -14.581 2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 120 1.652 -16.922 2.252 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.347 -16.489 2.353 1.00 0.00 H new ATOM 0 HG2 LYS A 120 3.554 -17.576 4.491 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.831 -17.889 4.546 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.089 -19.898 3.774 1.00 0.00 H new ATOM 0 HD3 LYS A 120 1.965 -19.334 2.553 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.969 -18.719 2.514 1.00 0.00 H new ATOM 0 HE3 LYS A 120 4.242 -20.066 1.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 4.132 -18.639 -0.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 2.793 -17.954 0.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 4.334 -17.267 0.933 1.00 0.00 H new ATOM 1916 N VAL A 121 0.050 -14.225 2.922 1.00 0.00 N ATOM 1917 CA VAL A 121 -1.346 -13.949 2.935 1.00 0.00 C ATOM 1918 C VAL A 121 -1.871 -14.124 1.537 1.00 0.00 C ATOM 1919 O VAL A 121 -1.093 -14.310 0.579 1.00 0.00 O ATOM 1920 CB VAL A 121 -1.694 -12.518 3.433 1.00 0.00 C ATOM 1921 CG1 VAL A 121 -1.001 -12.184 4.731 1.00 0.00 C ATOM 1922 CG2 VAL A 121 -1.456 -11.466 2.365 1.00 0.00 C ATOM 0 H VAL A 121 0.572 -13.691 2.227 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.809 -14.642 3.637 1.00 0.00 H new ATOM 0 HB VAL A 121 -2.764 -12.510 3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.274 -11.175 5.040 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.306 -12.894 5.500 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.079 -12.241 4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.713 -10.483 2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.406 -11.476 2.072 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.078 -11.682 1.496 1.00 0.00 H new ATOM 1932 N ASP A 122 -3.131 -14.032 1.419 1.00 0.00 N ATOM 1933 CA ASP A 122 -3.807 -14.217 0.187 1.00 0.00 C ATOM 1934 C ASP A 122 -4.333 -12.899 -0.371 1.00 0.00 C ATOM 1935 O ASP A 122 -4.262 -11.857 0.285 1.00 0.00 O ATOM 1936 CB ASP A 122 -4.952 -15.149 0.418 1.00 0.00 C ATOM 1937 CG ASP A 122 -5.985 -14.553 1.357 1.00 0.00 C ATOM 1938 OD1 ASP A 122 -5.703 -14.468 2.592 1.00 0.00 O ATOM 1939 OD2 ASP A 122 -7.047 -14.119 0.884 1.00 0.00 O ATOM 0 H ASP A 122 -3.751 -13.818 2.200 1.00 0.00 H new ATOM 0 HA ASP A 122 -3.106 -14.627 -0.540 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -5.423 -15.389 -0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.580 -16.085 0.834 1.00 0.00 H new ATOM 1944 N PHE A 123 -4.851 -12.964 -1.587 1.00 0.00 N ATOM 1945 CA PHE A 123 -5.425 -11.836 -2.279 1.00 0.00 C ATOM 1946 C PHE A 123 -6.389 -12.351 -3.359 1.00 0.00 C ATOM 1947 O PHE A 123 -6.392 -13.560 -3.681 1.00 0.00 O ATOM 1948 CB PHE A 123 -4.305 -10.944 -2.883 1.00 0.00 C ATOM 1949 CG PHE A 123 -4.769 -9.720 -3.648 1.00 0.00 C ATOM 1950 CD1 PHE A 123 -5.510 -8.728 -3.022 1.00 0.00 C ATOM 1951 CD2 PHE A 123 -4.456 -9.568 -4.993 1.00 0.00 C ATOM 1952 CE1 PHE A 123 -5.932 -7.613 -3.725 1.00 0.00 C ATOM 1953 CE2 PHE A 123 -4.874 -8.455 -5.697 1.00 0.00 C ATOM 1954 CZ PHE A 123 -5.614 -7.478 -5.062 1.00 0.00 C ATOM 0 H PHE A 123 -4.882 -13.828 -2.128 1.00 0.00 H new ATOM 0 HA PHE A 123 -5.986 -11.216 -1.580 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.653 -10.616 -2.073 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -3.700 -11.557 -3.551 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -5.760 -8.827 -1.976 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.878 -10.330 -5.495 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -6.510 -6.848 -3.228 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.622 -8.350 -6.742 1.00 0.00 H new ATOM 0 HZ PHE A 123 -5.944 -6.608 -5.611 1.00 0.00 H new ATOM 1964 N MET A 124 -7.187 -11.440 -3.885 1.00 0.00 N ATOM 1965 CA MET A 124 -8.192 -11.678 -4.892 1.00 0.00 C ATOM 1966 C MET A 124 -8.153 -10.476 -5.842 1.00 0.00 C ATOM 1967 O MET A 124 -8.351 -9.362 -5.379 1.00 0.00 O ATOM 1968 CB MET A 124 -9.551 -11.747 -4.181 1.00 0.00 C ATOM 1969 CG MET A 124 -10.758 -11.938 -5.077 1.00 0.00 C ATOM 1970 SD MET A 124 -10.786 -13.520 -5.954 1.00 0.00 S ATOM 1971 CE MET A 124 -10.738 -14.688 -4.580 1.00 0.00 C ATOM 0 H MET A 124 -7.145 -10.461 -3.602 1.00 0.00 H new ATOM 0 HA MET A 124 -8.025 -12.602 -5.445 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.522 -12.567 -3.463 1.00 0.00 H new ATOM 0 HB3 MET A 124 -9.688 -10.828 -3.611 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.662 -11.854 -4.473 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.786 -11.130 -5.808 1.00 0.00 H new ATOM 0 HE1 MET A 124 -11.066 -15.669 -4.924 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.719 -14.760 -4.199 1.00 0.00 H new ATOM 0 HE3 MET A 124 -11.399 -14.342 -3.785 1.00 0.00 H new