USER MOD reduce.3.24.130724 H: found=0, std=0, add=863, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 864 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 79 ASN : amide:sc= 0.0764 X(o=-0.47,f=-0.14) USER MOD Set 1.2: A 93 ASN : amide:sc= -0.55 X(o=-0.47,f=-0.13) USER MOD Set 2.1: A 42 THR OG1 : rot -69:sc= 0.995 USER MOD Set 2.2: A 43 CYS SG : rot -4:sc= -0.12 USER MOD Set 3.1: A 39 ASN :FLIP amide:sc= 1.01 F(o=0.12,f=2.2) USER MOD Set 3.2: A 54 TYR OH : rot 154:sc= 1.18 USER MOD Set 4.1: A 36 TYR OH : rot 58:sc= -0.0285 USER MOD Set 4.2: A 85 MET CE :methyl -174:sc= -0.344 (180deg=-0.567) USER MOD Single : A 28 THR OG1 : rot 136:sc= 0.0071 USER MOD Single : A 29 SER OG : rot 180:sc= -0.246 USER MOD Single : A 31 LYS NZ :NH3+ -133:sc= 1.27 (180deg=-0.0569) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN :FLIP amide:sc= -0.917 F(o=-2.5,f=-0.92) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0.093) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 THR OG1 : rot 88:sc= 1.27 USER MOD Single : A 61 MET CE :methyl 158:sc= -0.175 (180deg=-0.677) USER MOD Single : A 64 THR OG1 : rot 162:sc= 0.451 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 72:sc= 1.24 USER MOD Single : A 68 THR OG1 : rot -19:sc= 0.322 USER MOD Single : A 69 MET CE :methyl -154:sc= -0.333 (180deg=-2.86) USER MOD Single : A 88 CYS SG : rot 41:sc= -3.65! USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN :FLIP amide:sc= -0.0139 F(o=-1,f=-0.014) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 136:sc= 0.561 (180deg=-0.109) USER MOD Single : A 113 HIS : no HE2:sc= 0.301 K(o=0.3,f=-1.2) USER MOD Single : A 114 SER OG : rot 46:sc= 0.349 USER MOD Single : A 116 THR OG1 : rot 110:sc= 0.0633 USER MOD Single : A 123 SER OG : rot -39:sc= -1.14 USER MOD Single : A 126 LYS NZ :NH3+ -166:sc= -0.028 (180deg=-0.241) USER MOD Single : A 128 CYS SG : rot 180:sc= -0.414 USER MOD Single : A 135 CYS SG : rot -27:sc= 0.106 USER MOD ----------------------------------------------------------------- ATOM 130 N ALA A 27 7.027 -14.182 -12.808 1.00 0.00 N ATOM 131 CA ALA A 27 7.073 -15.404 -11.977 1.00 0.00 C ATOM 132 C ALA A 27 7.719 -16.611 -12.723 1.00 0.00 C ATOM 133 O ALA A 27 8.262 -17.514 -12.078 1.00 0.00 O ATOM 134 CB ALA A 27 5.650 -15.753 -11.504 1.00 0.00 C ATOM 0 HA ALA A 27 7.709 -15.199 -11.115 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.681 -16.654 -10.891 1.00 0.00 H new ATOM 0 HB2 ALA A 27 5.249 -14.927 -10.916 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.011 -15.925 -12.370 1.00 0.00 H new ATOM 140 N THR A 28 7.663 -16.596 -14.076 1.00 0.00 N ATOM 141 CA THR A 28 8.226 -17.648 -14.950 1.00 0.00 C ATOM 142 C THR A 28 9.768 -17.764 -14.807 1.00 0.00 C ATOM 143 O THR A 28 10.462 -16.749 -14.624 1.00 0.00 O ATOM 144 CB THR A 28 7.851 -17.356 -16.443 1.00 0.00 C ATOM 145 OG1 THR A 28 6.449 -17.077 -16.549 1.00 0.00 O ATOM 146 CG2 THR A 28 8.178 -18.523 -17.379 1.00 0.00 C ATOM 0 H THR A 28 7.218 -15.840 -14.597 1.00 0.00 H new ATOM 0 HA THR A 28 7.795 -18.599 -14.638 1.00 0.00 H new ATOM 0 HB THR A 28 8.449 -16.497 -16.748 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.313 -16.302 -17.134 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.896 -18.261 -18.399 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.247 -18.732 -17.340 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.624 -19.408 -17.065 1.00 0.00 H new ATOM 154 N SER A 29 10.285 -19.006 -14.903 1.00 0.00 N ATOM 155 CA SER A 29 11.723 -19.306 -14.774 1.00 0.00 C ATOM 156 C SER A 29 12.427 -19.139 -16.138 1.00 0.00 C ATOM 157 O SER A 29 11.812 -19.421 -17.175 1.00 0.00 O ATOM 158 CB SER A 29 11.904 -20.758 -14.269 1.00 0.00 C ATOM 159 OG SER A 29 13.270 -21.095 -14.088 1.00 0.00 O ATOM 0 H SER A 29 9.712 -19.833 -15.073 1.00 0.00 H new ATOM 0 HA SER A 29 12.168 -18.613 -14.060 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.373 -20.882 -13.325 1.00 0.00 H new ATOM 0 HB3 SER A 29 11.452 -21.448 -14.982 1.00 0.00 H new ATOM 0 HG SER A 29 13.339 -22.018 -13.767 1.00 0.00 H new ATOM 165 N PRO A 30 13.747 -18.726 -16.160 1.00 0.00 N ATOM 166 CA PRO A 30 14.556 -18.634 -17.411 1.00 0.00 C ATOM 167 C PRO A 30 14.752 -19.999 -18.091 1.00 0.00 C ATOM 168 O PRO A 30 15.205 -20.048 -19.229 1.00 0.00 O ATOM 169 CB PRO A 30 15.921 -18.081 -16.915 1.00 0.00 C ATOM 170 CG PRO A 30 15.968 -18.522 -15.491 1.00 0.00 C ATOM 171 CD PRO A 30 14.566 -18.327 -14.981 1.00 0.00 C ATOM 0 HA PRO A 30 14.069 -18.011 -18.161 1.00 0.00 H new ATOM 0 HB2 PRO A 30 16.753 -18.487 -17.490 1.00 0.00 H new ATOM 0 HB3 PRO A 30 15.972 -16.996 -17.003 1.00 0.00 H new ATOM 0 HG2 PRO A 30 16.277 -19.564 -15.410 1.00 0.00 H new ATOM 0 HG3 PRO A 30 16.683 -17.932 -14.918 1.00 0.00 H new ATOM 0 HD2 PRO A 30 14.358 -18.950 -14.111 1.00 0.00 H new ATOM 0 HD3 PRO A 30 14.380 -17.294 -14.686 1.00 0.00 H new ATOM 179 N LYS A 31 14.448 -21.090 -17.354 1.00 0.00 N ATOM 180 CA LYS A 31 14.578 -22.468 -17.848 1.00 0.00 C ATOM 181 C LYS A 31 13.596 -22.708 -19.017 1.00 0.00 C ATOM 182 O LYS A 31 14.008 -23.084 -20.115 1.00 0.00 O ATOM 183 CB LYS A 31 14.340 -23.499 -16.683 1.00 0.00 C ATOM 184 CG LYS A 31 15.353 -24.681 -16.565 1.00 0.00 C ATOM 185 CD LYS A 31 15.399 -25.667 -17.783 1.00 0.00 C ATOM 186 CE LYS A 31 16.305 -25.188 -18.943 1.00 0.00 C ATOM 187 NZ LYS A 31 16.558 -26.243 -19.955 1.00 0.00 N ATOM 0 H LYS A 31 14.104 -21.033 -16.395 1.00 0.00 H new ATOM 0 HA LYS A 31 15.592 -22.615 -18.219 1.00 0.00 H new ATOM 0 HB2 LYS A 31 14.346 -22.952 -15.740 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.341 -23.919 -16.801 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.351 -24.266 -16.420 1.00 0.00 H new ATOM 0 HG3 LYS A 31 15.112 -25.252 -15.669 1.00 0.00 H new ATOM 0 HD2 LYS A 31 15.751 -26.639 -17.438 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.387 -25.810 -18.161 1.00 0.00 H new ATOM 0 HE2 LYS A 31 15.840 -24.330 -19.429 1.00 0.00 H new ATOM 0 HE3 LYS A 31 17.257 -24.847 -18.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 17.574 -26.275 -20.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 16.257 -27.165 -19.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 16.021 -26.030 -20.820 1.00 0.00 H new ATOM 201 N THR A 32 12.301 -22.470 -18.763 1.00 0.00 N ATOM 202 CA THR A 32 11.240 -22.687 -19.766 1.00 0.00 C ATOM 203 C THR A 32 11.220 -21.544 -20.808 1.00 0.00 C ATOM 204 O THR A 32 10.734 -21.739 -21.932 1.00 0.00 O ATOM 205 CB THR A 32 9.839 -22.854 -19.087 1.00 0.00 C ATOM 206 OG1 THR A 32 8.843 -23.212 -20.061 1.00 0.00 O ATOM 207 CG2 THR A 32 9.402 -21.584 -18.356 1.00 0.00 C ATOM 0 H THR A 32 11.958 -22.125 -17.866 1.00 0.00 H new ATOM 0 HA THR A 32 11.465 -23.616 -20.290 1.00 0.00 H new ATOM 0 HB THR A 32 9.936 -23.653 -18.352 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.974 -23.314 -19.619 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.425 -21.745 -17.900 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.129 -21.342 -17.581 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.340 -20.759 -19.066 1.00 0.00 H new ATOM 215 N ILE A 33 11.749 -20.353 -20.421 1.00 0.00 N ATOM 216 CA ILE A 33 11.974 -19.239 -21.363 1.00 0.00 C ATOM 217 C ILE A 33 12.993 -19.689 -22.427 1.00 0.00 C ATOM 218 O ILE A 33 12.738 -19.571 -23.621 1.00 0.00 O ATOM 219 CB ILE A 33 12.462 -17.919 -20.633 1.00 0.00 C ATOM 220 CG1 ILE A 33 11.385 -17.419 -19.616 1.00 0.00 C ATOM 221 CG2 ILE A 33 12.832 -16.794 -21.640 1.00 0.00 C ATOM 222 CD1 ILE A 33 10.032 -17.094 -20.229 1.00 0.00 C ATOM 0 H ILE A 33 12.026 -20.146 -19.461 1.00 0.00 H new ATOM 0 HA ILE A 33 11.025 -18.990 -21.837 1.00 0.00 H new ATOM 0 HB ILE A 33 13.370 -18.171 -20.085 1.00 0.00 H new ATOM 0 HG12 ILE A 33 11.247 -18.182 -18.850 1.00 0.00 H new ATOM 0 HG13 ILE A 33 11.764 -16.529 -19.115 1.00 0.00 H new ATOM 0 HG21 ILE A 33 13.160 -15.910 -21.093 1.00 0.00 H new ATOM 0 HG22 ILE A 33 13.636 -17.138 -22.290 1.00 0.00 H new ATOM 0 HG23 ILE A 33 11.959 -16.544 -22.243 1.00 0.00 H new ATOM 0 HD11 ILE A 33 9.351 -16.756 -19.448 1.00 0.00 H new ATOM 0 HD12 ILE A 33 10.150 -16.307 -20.974 1.00 0.00 H new ATOM 0 HD13 ILE A 33 9.624 -17.986 -20.705 1.00 0.00 H new ATOM 234 N LEU A 34 14.110 -20.271 -21.944 1.00 0.00 N ATOM 235 CA LEU A 34 15.184 -20.857 -22.773 1.00 0.00 C ATOM 236 C LEU A 34 14.579 -21.869 -23.766 1.00 0.00 C ATOM 237 O LEU A 34 14.754 -21.730 -24.975 1.00 0.00 O ATOM 238 CB LEU A 34 16.234 -21.518 -21.809 1.00 0.00 C ATOM 239 CG LEU A 34 17.570 -22.099 -22.395 1.00 0.00 C ATOM 240 CD1 LEU A 34 17.381 -23.432 -23.148 1.00 0.00 C ATOM 241 CD2 LEU A 34 18.298 -21.054 -23.256 1.00 0.00 C ATOM 0 H LEU A 34 14.295 -20.348 -20.944 1.00 0.00 H new ATOM 0 HA LEU A 34 15.689 -20.095 -23.367 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.504 -20.773 -21.061 1.00 0.00 H new ATOM 0 HB3 LEU A 34 15.729 -22.329 -21.284 1.00 0.00 H new ATOM 0 HG LEU A 34 18.203 -22.334 -21.540 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.344 -23.776 -23.526 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.970 -24.179 -22.468 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.695 -23.285 -23.982 1.00 0.00 H new ATOM 0 HD21 LEU A 34 19.219 -21.484 -23.648 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.656 -20.754 -24.084 1.00 0.00 H new ATOM 0 HD23 LEU A 34 18.535 -20.182 -22.647 1.00 0.00 H new ATOM 253 N GLU A 35 13.857 -22.865 -23.213 1.00 0.00 N ATOM 254 CA GLU A 35 13.197 -23.939 -23.983 1.00 0.00 C ATOM 255 C GLU A 35 12.341 -23.414 -25.154 1.00 0.00 C ATOM 256 O GLU A 35 12.551 -23.836 -26.292 1.00 0.00 O ATOM 257 CB GLU A 35 12.331 -24.831 -23.048 1.00 0.00 C ATOM 258 CG GLU A 35 13.128 -25.604 -21.980 1.00 0.00 C ATOM 259 CD GLU A 35 14.215 -26.514 -22.585 1.00 0.00 C ATOM 260 OE1 GLU A 35 13.866 -27.556 -23.178 1.00 0.00 O ATOM 261 OE2 GLU A 35 15.418 -26.192 -22.478 1.00 0.00 O ATOM 0 H GLU A 35 13.714 -22.947 -22.206 1.00 0.00 H new ATOM 0 HA GLU A 35 13.998 -24.534 -24.421 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.594 -24.202 -22.548 1.00 0.00 H new ATOM 0 HB3 GLU A 35 11.779 -25.546 -23.658 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.594 -24.894 -21.297 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.441 -26.210 -21.389 1.00 0.00 H new ATOM 268 N TYR A 36 11.389 -22.489 -24.872 1.00 0.00 N ATOM 269 CA TYR A 36 10.431 -22.009 -25.893 1.00 0.00 C ATOM 270 C TYR A 36 11.131 -21.105 -26.938 1.00 0.00 C ATOM 271 O TYR A 36 10.715 -21.066 -28.098 1.00 0.00 O ATOM 272 CB TYR A 36 9.169 -21.333 -25.236 1.00 0.00 C ATOM 273 CG TYR A 36 9.145 -19.787 -25.097 1.00 0.00 C ATOM 274 CD1 TYR A 36 8.820 -18.973 -26.191 1.00 0.00 C ATOM 275 CD2 TYR A 36 9.385 -19.148 -23.880 1.00 0.00 C ATOM 276 CE1 TYR A 36 8.746 -17.605 -26.079 1.00 0.00 C ATOM 277 CE2 TYR A 36 9.297 -17.767 -23.763 1.00 0.00 C ATOM 278 CZ TYR A 36 8.981 -17.005 -24.870 1.00 0.00 C ATOM 279 OH TYR A 36 8.867 -15.643 -24.766 1.00 0.00 O ATOM 0 H TYR A 36 11.267 -22.065 -23.952 1.00 0.00 H new ATOM 0 HA TYR A 36 10.056 -22.876 -26.437 1.00 0.00 H new ATOM 0 HB2 TYR A 36 8.295 -21.627 -25.817 1.00 0.00 H new ATOM 0 HB3 TYR A 36 9.047 -21.757 -24.239 1.00 0.00 H new ATOM 0 HD1 TYR A 36 8.622 -19.433 -27.148 1.00 0.00 H new ATOM 0 HD2 TYR A 36 9.644 -19.738 -23.013 1.00 0.00 H new ATOM 0 HE1 TYR A 36 8.503 -17.004 -26.943 1.00 0.00 H new ATOM 0 HE2 TYR A 36 9.475 -17.291 -22.810 1.00 0.00 H new ATOM 0 HH TYR A 36 7.963 -15.369 -25.028 1.00 0.00 H new ATOM 289 N ILE A 37 12.189 -20.378 -26.505 1.00 0.00 N ATOM 290 CA ILE A 37 13.035 -19.555 -27.402 1.00 0.00 C ATOM 291 C ILE A 37 13.713 -20.451 -28.461 1.00 0.00 C ATOM 292 O ILE A 37 13.604 -20.204 -29.670 1.00 0.00 O ATOM 293 CB ILE A 37 14.113 -18.729 -26.570 1.00 0.00 C ATOM 294 CG1 ILE A 37 13.436 -17.530 -25.820 1.00 0.00 C ATOM 295 CG2 ILE A 37 15.294 -18.230 -27.439 1.00 0.00 C ATOM 296 CD1 ILE A 37 14.380 -16.669 -24.988 1.00 0.00 C ATOM 0 H ILE A 37 12.479 -20.346 -25.528 1.00 0.00 H new ATOM 0 HA ILE A 37 12.399 -18.835 -27.917 1.00 0.00 H new ATOM 0 HB ILE A 37 14.532 -19.418 -25.837 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.943 -16.894 -26.555 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.658 -17.924 -25.166 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.995 -17.674 -26.816 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.804 -19.084 -27.885 1.00 0.00 H new ATOM 0 HG23 ILE A 37 14.916 -17.580 -28.228 1.00 0.00 H new ATOM 0 HD11 ILE A 37 13.816 -15.868 -24.510 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.855 -17.284 -24.224 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.145 -16.238 -25.634 1.00 0.00 H new ATOM 308 N ILE A 38 14.370 -21.515 -27.987 1.00 0.00 N ATOM 309 CA ILE A 38 15.081 -22.480 -28.847 1.00 0.00 C ATOM 310 C ILE A 38 14.088 -23.197 -29.767 1.00 0.00 C ATOM 311 O ILE A 38 14.326 -23.323 -30.971 1.00 0.00 O ATOM 312 CB ILE A 38 15.875 -23.514 -27.970 1.00 0.00 C ATOM 313 CG1 ILE A 38 16.916 -22.763 -27.084 1.00 0.00 C ATOM 314 CG2 ILE A 38 16.542 -24.625 -28.829 1.00 0.00 C ATOM 315 CD1 ILE A 38 17.905 -21.904 -27.850 1.00 0.00 C ATOM 0 H ILE A 38 14.427 -21.736 -26.993 1.00 0.00 H new ATOM 0 HA ILE A 38 15.797 -21.939 -29.466 1.00 0.00 H new ATOM 0 HB ILE A 38 15.165 -24.024 -27.319 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.380 -22.131 -26.376 1.00 0.00 H new ATOM 0 HG13 ILE A 38 17.471 -23.497 -26.500 1.00 0.00 H new ATOM 0 HG21 ILE A 38 17.079 -25.315 -28.178 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.775 -25.169 -29.380 1.00 0.00 H new ATOM 0 HG23 ILE A 38 17.241 -24.171 -29.532 1.00 0.00 H new ATOM 0 HD11 ILE A 38 18.587 -21.422 -27.150 1.00 0.00 H new ATOM 0 HD12 ILE A 38 18.473 -22.529 -28.538 1.00 0.00 H new ATOM 0 HD13 ILE A 38 17.366 -21.142 -28.413 1.00 0.00 H new ATOM 327 N ASN A 39 12.953 -23.598 -29.176 1.00 0.00 N ATOM 328 CA ASN A 39 11.851 -24.259 -29.886 1.00 0.00 C ATOM 329 C ASN A 39 11.270 -23.329 -30.968 1.00 0.00 C ATOM 330 O ASN A 39 10.770 -23.809 -31.959 1.00 0.00 O ATOM 331 CB ASN A 39 10.756 -24.707 -28.880 1.00 0.00 C ATOM 332 CG ASN A 39 9.557 -25.407 -29.543 1.00 0.00 C ATOM 333 OD1 ASN A 39 8.521 -24.646 -29.851 1.00 0.00 O flip ATOM 334 ND2 ASN A 39 9.559 -26.621 -29.758 1.00 0.00 N flip ATOM 0 H ASN A 39 12.774 -23.470 -28.180 1.00 0.00 H new ATOM 0 HA ASN A 39 12.236 -25.148 -30.385 1.00 0.00 H new ATOM 0 HB2 ASN A 39 11.201 -25.382 -28.149 1.00 0.00 H new ATOM 0 HB3 ASN A 39 10.399 -23.835 -28.333 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.374 -27.182 -29.509 1.00 0.00 H new ATOM 0 HD22 ASN A 39 8.746 -27.065 -30.185 1.00 0.00 H new ATOM 341 N PHE A 40 11.354 -22.001 -30.765 1.00 0.00 N ATOM 342 CA PHE A 40 10.928 -21.002 -31.771 1.00 0.00 C ATOM 343 C PHE A 40 11.908 -20.951 -32.967 1.00 0.00 C ATOM 344 O PHE A 40 11.485 -20.884 -34.129 1.00 0.00 O ATOM 345 CB PHE A 40 10.794 -19.597 -31.119 1.00 0.00 C ATOM 346 CG PHE A 40 10.463 -18.459 -32.093 1.00 0.00 C ATOM 347 CD1 PHE A 40 9.345 -18.535 -32.934 1.00 0.00 C ATOM 348 CD2 PHE A 40 11.271 -17.327 -32.175 1.00 0.00 C ATOM 349 CE1 PHE A 40 9.059 -17.519 -33.822 1.00 0.00 C ATOM 350 CE2 PHE A 40 10.979 -16.312 -33.058 1.00 0.00 C ATOM 351 CZ PHE A 40 9.876 -16.405 -33.883 1.00 0.00 C ATOM 0 H PHE A 40 11.716 -21.589 -29.905 1.00 0.00 H new ATOM 0 HA PHE A 40 9.953 -21.308 -32.151 1.00 0.00 H new ATOM 0 HB2 PHE A 40 10.017 -19.640 -30.356 1.00 0.00 H new ATOM 0 HB3 PHE A 40 11.728 -19.359 -30.610 1.00 0.00 H new ATOM 0 HD1 PHE A 40 8.699 -19.399 -32.886 1.00 0.00 H new ATOM 0 HD2 PHE A 40 12.138 -17.245 -31.537 1.00 0.00 H new ATOM 0 HE1 PHE A 40 8.198 -17.593 -34.469 1.00 0.00 H new ATOM 0 HE2 PHE A 40 11.615 -15.440 -33.105 1.00 0.00 H new ATOM 0 HZ PHE A 40 9.651 -15.608 -34.576 1.00 0.00 H new ATOM 361 N PHE A 41 13.218 -20.949 -32.669 1.00 0.00 N ATOM 362 CA PHE A 41 14.262 -20.846 -33.714 1.00 0.00 C ATOM 363 C PHE A 41 14.541 -22.190 -34.422 1.00 0.00 C ATOM 364 O PHE A 41 15.183 -22.200 -35.473 1.00 0.00 O ATOM 365 CB PHE A 41 15.561 -20.242 -33.122 1.00 0.00 C ATOM 366 CG PHE A 41 15.389 -18.795 -32.647 1.00 0.00 C ATOM 367 CD1 PHE A 41 15.154 -17.771 -33.564 1.00 0.00 C ATOM 368 CD2 PHE A 41 15.444 -18.459 -31.298 1.00 0.00 C ATOM 369 CE1 PHE A 41 14.982 -16.467 -33.144 1.00 0.00 C ATOM 370 CE2 PHE A 41 15.273 -17.153 -30.882 1.00 0.00 C ATOM 371 CZ PHE A 41 15.041 -16.160 -31.802 1.00 0.00 C ATOM 0 H PHE A 41 13.583 -21.017 -31.719 1.00 0.00 H new ATOM 0 HA PHE A 41 13.879 -20.174 -34.482 1.00 0.00 H new ATOM 0 HB2 PHE A 41 15.891 -20.856 -32.284 1.00 0.00 H new ATOM 0 HB3 PHE A 41 16.348 -20.280 -33.875 1.00 0.00 H new ATOM 0 HD1 PHE A 41 15.106 -18.001 -34.618 1.00 0.00 H new ATOM 0 HD2 PHE A 41 15.623 -19.231 -30.565 1.00 0.00 H new ATOM 0 HE1 PHE A 41 14.801 -15.687 -33.868 1.00 0.00 H new ATOM 0 HE2 PHE A 41 15.322 -16.912 -29.830 1.00 0.00 H new ATOM 0 HZ PHE A 41 14.905 -15.140 -31.474 1.00 0.00 H new ATOM 381 N THR A 42 14.070 -23.318 -33.858 1.00 0.00 N ATOM 382 CA THR A 42 14.263 -24.662 -34.470 1.00 0.00 C ATOM 383 C THR A 42 12.934 -25.260 -34.992 1.00 0.00 C ATOM 384 O THR A 42 12.944 -26.106 -35.894 1.00 0.00 O ATOM 385 CB THR A 42 14.933 -25.659 -33.458 1.00 0.00 C ATOM 386 OG1 THR A 42 14.116 -25.815 -32.281 1.00 0.00 O ATOM 387 CG2 THR A 42 16.342 -25.197 -33.038 1.00 0.00 C ATOM 0 H THR A 42 13.552 -23.334 -32.979 1.00 0.00 H new ATOM 0 HA THR A 42 14.929 -24.521 -35.321 1.00 0.00 H new ATOM 0 HB THR A 42 15.025 -26.615 -33.973 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.120 -24.981 -31.767 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.767 -25.916 -32.338 1.00 0.00 H new ATOM 0 HG22 THR A 42 16.980 -25.128 -33.919 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.277 -24.220 -32.559 1.00 0.00 H new ATOM 395 N CYS A 43 11.803 -24.805 -34.431 1.00 0.00 N ATOM 396 CA CYS A 43 10.448 -25.339 -34.723 1.00 0.00 C ATOM 397 C CYS A 43 9.408 -24.207 -34.561 1.00 0.00 C ATOM 398 O CYS A 43 9.778 -23.035 -34.546 1.00 0.00 O ATOM 399 CB CYS A 43 10.138 -26.520 -33.765 1.00 0.00 C ATOM 400 SG CYS A 43 11.320 -27.885 -33.847 1.00 0.00 S ATOM 0 H CYS A 43 11.795 -24.045 -33.751 1.00 0.00 H new ATOM 0 HA CYS A 43 10.404 -25.708 -35.748 1.00 0.00 H new ATOM 0 HB2 CYS A 43 10.108 -26.143 -32.743 1.00 0.00 H new ATOM 0 HB3 CYS A 43 9.143 -26.904 -33.992 1.00 0.00 H new ATOM 0 HG CYS A 43 12.187 -27.653 -34.788 1.00 0.00 H new ATOM 406 N GLY A 44 8.111 -24.549 -34.488 1.00 0.00 N ATOM 407 CA GLY A 44 7.074 -23.572 -34.120 1.00 0.00 C ATOM 408 C GLY A 44 5.764 -23.800 -34.848 1.00 0.00 C ATOM 409 O GLY A 44 5.677 -24.660 -35.735 1.00 0.00 O ATOM 0 H GLY A 44 7.758 -25.487 -34.677 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.900 -23.622 -33.045 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.435 -22.567 -34.338 1.00 0.00 H new ATOM 413 N GLY A 45 4.736 -23.026 -34.460 1.00 0.00 N ATOM 414 CA GLY A 45 3.423 -23.066 -35.120 1.00 0.00 C ATOM 415 C GLY A 45 2.365 -23.828 -34.333 1.00 0.00 C ATOM 416 O GLY A 45 1.252 -24.025 -34.834 1.00 0.00 O ATOM 0 H GLY A 45 4.792 -22.362 -33.688 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.077 -22.045 -35.283 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.534 -23.526 -36.102 1.00 0.00 H new ATOM 420 N ILE A 46 2.706 -24.275 -33.103 1.00 0.00 N ATOM 421 CA ILE A 46 1.741 -24.911 -32.184 1.00 0.00 C ATOM 422 C ILE A 46 0.796 -23.824 -31.622 1.00 0.00 C ATOM 423 O ILE A 46 0.941 -23.376 -30.487 1.00 0.00 O ATOM 424 CB ILE A 46 2.485 -25.676 -31.014 1.00 0.00 C ATOM 425 CG1 ILE A 46 3.468 -26.750 -31.584 1.00 0.00 C ATOM 426 CG2 ILE A 46 1.485 -26.301 -30.001 1.00 0.00 C ATOM 427 CD1 ILE A 46 4.366 -27.403 -30.545 1.00 0.00 C ATOM 0 H ILE A 46 3.650 -24.205 -32.724 1.00 0.00 H new ATOM 0 HA ILE A 46 1.158 -25.652 -32.731 1.00 0.00 H new ATOM 0 HB ILE A 46 3.073 -24.940 -30.465 1.00 0.00 H new ATOM 0 HG12 ILE A 46 2.887 -27.526 -32.082 1.00 0.00 H new ATOM 0 HG13 ILE A 46 4.094 -26.283 -32.344 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.037 -26.816 -29.215 1.00 0.00 H new ATOM 0 HG22 ILE A 46 0.875 -25.513 -29.559 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.841 -27.012 -30.518 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.013 -28.133 -31.031 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.977 -26.641 -30.062 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.752 -27.904 -29.796 1.00 0.00 H new ATOM 439 N ARG A 47 -0.186 -23.403 -32.435 1.00 0.00 N ATOM 440 CA ARG A 47 -1.034 -22.221 -32.143 1.00 0.00 C ATOM 441 C ARG A 47 -2.053 -22.456 -30.995 1.00 0.00 C ATOM 442 O ARG A 47 -2.969 -21.655 -30.822 1.00 0.00 O ATOM 443 CB ARG A 47 -1.713 -21.704 -33.467 1.00 0.00 C ATOM 444 CG ARG A 47 -2.301 -22.787 -34.421 1.00 0.00 C ATOM 445 CD ARG A 47 -3.570 -23.486 -33.902 1.00 0.00 C ATOM 446 NE ARG A 47 -4.693 -22.545 -33.764 1.00 0.00 N ATOM 447 CZ ARG A 47 -5.993 -22.870 -33.805 1.00 0.00 C ATOM 448 NH1 ARG A 47 -6.386 -24.133 -33.942 1.00 0.00 N ATOM 449 NH2 ARG A 47 -6.895 -21.912 -33.706 1.00 0.00 N ATOM 0 H ARG A 47 -0.419 -23.867 -33.313 1.00 0.00 H new ATOM 0 HA ARG A 47 -0.380 -21.435 -31.765 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.516 -21.020 -33.193 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -0.976 -21.124 -34.023 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -2.527 -22.322 -35.381 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -1.537 -23.542 -34.605 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.849 -24.288 -34.586 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.362 -23.948 -32.937 1.00 0.00 H new ATOM 0 HE ARG A 47 -4.463 -21.561 -33.625 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.693 -24.877 -34.018 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.381 -24.357 -33.971 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.599 -20.942 -33.600 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.888 -22.142 -33.735 1.00 0.00 H new ATOM 463 N ARG A 48 -1.881 -23.554 -30.224 1.00 0.00 N ATOM 464 CA ARG A 48 -2.661 -23.825 -29.006 1.00 0.00 C ATOM 465 C ARG A 48 -2.004 -23.161 -27.770 1.00 0.00 C ATOM 466 O ARG A 48 -2.703 -22.714 -26.850 1.00 0.00 O ATOM 467 CB ARG A 48 -2.794 -25.353 -28.785 1.00 0.00 C ATOM 468 CG ARG A 48 -3.751 -25.732 -27.641 1.00 0.00 C ATOM 469 CD ARG A 48 -3.857 -27.246 -27.402 1.00 0.00 C ATOM 470 NE ARG A 48 -4.837 -27.547 -26.341 1.00 0.00 N ATOM 471 CZ ARG A 48 -4.572 -27.649 -25.029 1.00 0.00 C ATOM 472 NH1 ARG A 48 -3.334 -27.504 -24.563 1.00 0.00 N ATOM 473 NH2 ARG A 48 -5.563 -27.891 -24.181 1.00 0.00 N ATOM 0 H ARG A 48 -1.193 -24.277 -30.435 1.00 0.00 H new ATOM 0 HA ARG A 48 -3.655 -23.398 -29.135 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -3.144 -25.815 -29.708 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -1.808 -25.768 -28.575 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -3.414 -25.251 -26.723 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -4.743 -25.338 -27.863 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.152 -27.744 -28.326 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -2.881 -27.643 -27.123 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.804 -27.691 -26.631 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -2.566 -27.312 -25.206 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.153 -27.585 -23.562 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -6.516 -27.998 -24.528 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -5.372 -27.970 -23.182 1.00 0.00 H new ATOM 487 N ARG A 49 -0.642 -23.123 -27.736 1.00 0.00 N ATOM 488 CA ARG A 49 0.123 -22.448 -26.644 1.00 0.00 C ATOM 489 C ARG A 49 1.180 -21.440 -27.184 1.00 0.00 C ATOM 490 O ARG A 49 1.735 -20.656 -26.405 1.00 0.00 O ATOM 491 CB ARG A 49 0.794 -23.494 -25.683 1.00 0.00 C ATOM 492 CG ARG A 49 0.496 -23.315 -24.161 1.00 0.00 C ATOM 493 CD ARG A 49 1.013 -21.993 -23.536 1.00 0.00 C ATOM 494 NE ARG A 49 0.246 -20.803 -23.963 1.00 0.00 N ATOM 495 CZ ARG A 49 0.409 -19.556 -23.502 1.00 0.00 C ATOM 496 NH1 ARG A 49 1.206 -19.307 -22.458 1.00 0.00 N ATOM 497 NH2 ARG A 49 -0.251 -18.554 -24.072 1.00 0.00 N ATOM 0 H ARG A 49 -0.052 -23.550 -28.450 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.605 -21.872 -26.073 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.471 -24.491 -25.981 1.00 0.00 H new ATOM 0 HB3 ARG A 49 1.873 -23.452 -25.829 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -0.582 -23.372 -24.009 1.00 0.00 H new ATOM 0 HG3 ARG A 49 0.939 -24.151 -23.620 1.00 0.00 H new ATOM 0 HD2 ARG A 49 0.971 -22.073 -22.450 1.00 0.00 H new ATOM 0 HD3 ARG A 49 2.060 -21.857 -23.806 1.00 0.00 H new ATOM 0 HE ARG A 49 -0.472 -20.945 -24.673 1.00 0.00 H new ATOM 0 HH11 ARG A 49 1.701 -20.072 -22.000 1.00 0.00 H new ATOM 0 HH12 ARG A 49 1.319 -18.352 -22.119 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -0.878 -18.737 -24.856 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -0.131 -17.602 -23.726 1.00 0.00 H new ATOM 511 N ASN A 50 1.467 -21.452 -28.495 1.00 0.00 N ATOM 512 CA ASN A 50 2.590 -20.656 -29.064 1.00 0.00 C ATOM 513 C ASN A 50 2.162 -19.217 -29.381 1.00 0.00 C ATOM 514 O ASN A 50 3.011 -18.340 -29.479 1.00 0.00 O ATOM 515 CB ASN A 50 3.196 -21.319 -30.343 1.00 0.00 C ATOM 516 CG ASN A 50 4.073 -22.560 -30.081 1.00 0.00 C ATOM 517 OD1 ASN A 50 3.815 -23.303 -29.002 1.00 0.00 O flip ATOM 518 ND2 ASN A 50 4.981 -22.859 -30.862 1.00 0.00 N flip ATOM 0 H ASN A 50 0.948 -21.996 -29.184 1.00 0.00 H new ATOM 0 HA ASN A 50 3.362 -20.631 -28.295 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.380 -21.603 -31.008 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.793 -20.576 -30.871 1.00 0.00 H new ATOM 0 HD21 ASN A 50 5.162 -22.278 -31.681 1.00 0.00 H new ATOM 0 HD22 ASN A 50 5.551 -23.687 -30.689 1.00 0.00 H new ATOM 525 N GLU A 51 0.851 -18.989 -29.531 1.00 0.00 N ATOM 526 CA GLU A 51 0.310 -17.721 -30.053 1.00 0.00 C ATOM 527 C GLU A 51 0.762 -16.485 -29.210 1.00 0.00 C ATOM 528 O GLU A 51 1.532 -15.662 -29.712 1.00 0.00 O ATOM 529 CB GLU A 51 -1.250 -17.813 -30.228 1.00 0.00 C ATOM 530 CG GLU A 51 -2.108 -17.891 -28.944 1.00 0.00 C ATOM 531 CD GLU A 51 -1.736 -19.038 -27.997 1.00 0.00 C ATOM 532 OE1 GLU A 51 -1.769 -20.184 -28.448 1.00 0.00 O ATOM 533 OE2 GLU A 51 -1.323 -18.783 -26.831 1.00 0.00 O ATOM 0 H GLU A 51 0.134 -19.675 -29.295 1.00 0.00 H new ATOM 0 HA GLU A 51 0.735 -17.559 -31.043 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.576 -16.944 -30.799 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.469 -18.692 -30.833 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.018 -16.948 -28.405 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.155 -17.997 -29.228 1.00 0.00 H new ATOM 540 N THR A 52 0.359 -16.397 -27.927 1.00 0.00 N ATOM 541 CA THR A 52 0.706 -15.262 -27.061 1.00 0.00 C ATOM 542 C THR A 52 2.131 -15.423 -26.500 1.00 0.00 C ATOM 543 O THR A 52 2.915 -14.466 -26.486 1.00 0.00 O ATOM 544 CB THR A 52 -0.305 -15.105 -25.880 1.00 0.00 C ATOM 545 OG1 THR A 52 -1.643 -15.066 -26.391 1.00 0.00 O ATOM 546 CG2 THR A 52 -0.037 -13.824 -25.051 1.00 0.00 C ATOM 0 H THR A 52 -0.212 -17.107 -27.468 1.00 0.00 H new ATOM 0 HA THR A 52 0.657 -14.363 -27.675 1.00 0.00 H new ATOM 0 HB THR A 52 -0.175 -15.964 -25.222 1.00 0.00 H new ATOM 0 HG1 THR A 52 -2.274 -14.969 -25.648 1.00 0.00 H new ATOM 0 HG21 THR A 52 -0.763 -13.756 -24.241 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.969 -13.865 -24.634 1.00 0.00 H new ATOM 0 HG23 THR A 52 -0.128 -12.949 -25.694 1.00 0.00 H new ATOM 554 N GLN A 53 2.445 -16.665 -26.059 1.00 0.00 N ATOM 555 CA GLN A 53 3.714 -17.009 -25.377 1.00 0.00 C ATOM 556 C GLN A 53 4.934 -16.595 -26.212 1.00 0.00 C ATOM 557 O GLN A 53 5.892 -16.008 -25.696 1.00 0.00 O ATOM 558 CB GLN A 53 3.751 -18.539 -25.066 1.00 0.00 C ATOM 559 CG GLN A 53 5.050 -19.073 -24.403 1.00 0.00 C ATOM 560 CD GLN A 53 5.345 -18.441 -23.035 1.00 0.00 C ATOM 561 OE1 GLN A 53 6.040 -17.430 -22.937 1.00 0.00 O ATOM 562 NE2 GLN A 53 4.812 -19.028 -21.974 1.00 0.00 N ATOM 0 H GLN A 53 1.818 -17.462 -26.168 1.00 0.00 H new ATOM 0 HA GLN A 53 3.759 -16.453 -24.440 1.00 0.00 H new ATOM 0 HB2 GLN A 53 2.911 -18.776 -24.413 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.594 -19.082 -25.998 1.00 0.00 H new ATOM 0 HG2 GLN A 53 4.970 -20.154 -24.285 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.892 -18.886 -25.070 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.240 -19.865 -22.088 1.00 0.00 H new ATOM 0 HE22 GLN A 53 4.973 -18.643 -21.043 1.00 0.00 H new ATOM 571 N TYR A 54 4.860 -16.882 -27.517 1.00 0.00 N ATOM 572 CA TYR A 54 5.934 -16.561 -28.457 1.00 0.00 C ATOM 573 C TYR A 54 5.777 -15.122 -28.955 1.00 0.00 C ATOM 574 O TYR A 54 6.778 -14.498 -29.236 1.00 0.00 O ATOM 575 CB TYR A 54 5.991 -17.585 -29.632 1.00 0.00 C ATOM 576 CG TYR A 54 6.412 -19.017 -29.210 1.00 0.00 C ATOM 577 CD1 TYR A 54 5.855 -19.642 -28.088 1.00 0.00 C ATOM 578 CD2 TYR A 54 7.367 -19.737 -29.925 1.00 0.00 C ATOM 579 CE1 TYR A 54 6.233 -20.902 -27.698 1.00 0.00 C ATOM 580 CE2 TYR A 54 7.747 -21.010 -29.535 1.00 0.00 C ATOM 581 CZ TYR A 54 7.177 -21.584 -28.423 1.00 0.00 C ATOM 582 OH TYR A 54 7.554 -22.838 -28.025 1.00 0.00 O ATOM 0 H TYR A 54 4.057 -17.341 -27.947 1.00 0.00 H new ATOM 0 HA TYR A 54 6.889 -16.637 -27.937 1.00 0.00 H new ATOM 0 HB2 TYR A 54 5.010 -17.632 -30.106 1.00 0.00 H new ATOM 0 HB3 TYR A 54 6.691 -17.220 -30.383 1.00 0.00 H new ATOM 0 HD1 TYR A 54 5.106 -19.117 -27.513 1.00 0.00 H new ATOM 0 HD2 TYR A 54 7.819 -19.294 -30.800 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.789 -21.355 -26.824 1.00 0.00 H new ATOM 0 HE2 TYR A 54 8.489 -21.551 -30.103 1.00 0.00 H new ATOM 0 HH TYR A 54 7.871 -23.346 -28.801 1.00 0.00 H new ATOM 592 N GLN A 55 4.526 -14.580 -29.023 1.00 0.00 N ATOM 593 CA GLN A 55 4.289 -13.167 -29.450 1.00 0.00 C ATOM 594 C GLN A 55 5.081 -12.185 -28.557 1.00 0.00 C ATOM 595 O GLN A 55 5.549 -11.155 -29.043 1.00 0.00 O ATOM 596 CB GLN A 55 2.778 -12.782 -29.428 1.00 0.00 C ATOM 597 CG GLN A 55 2.485 -11.357 -29.955 1.00 0.00 C ATOM 598 CD GLN A 55 1.050 -10.893 -29.701 1.00 0.00 C ATOM 599 OE1 GLN A 55 0.759 -10.314 -28.659 1.00 0.00 O ATOM 600 NE2 GLN A 55 0.156 -11.085 -30.666 1.00 0.00 N ATOM 0 H GLN A 55 3.675 -15.093 -28.791 1.00 0.00 H new ATOM 0 HA GLN A 55 4.639 -13.093 -30.480 1.00 0.00 H new ATOM 0 HB2 GLN A 55 2.221 -13.502 -30.028 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.407 -12.864 -28.406 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.173 -10.656 -29.484 1.00 0.00 H new ATOM 0 HG3 GLN A 55 2.683 -11.327 -31.026 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.426 -11.570 -31.522 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.800 -10.748 -30.550 1.00 0.00 H new ATOM 609 N GLU A 56 5.228 -12.541 -27.261 1.00 0.00 N ATOM 610 CA GLU A 56 6.078 -11.790 -26.307 1.00 0.00 C ATOM 611 C GLU A 56 7.531 -11.709 -26.824 1.00 0.00 C ATOM 612 O GLU A 56 8.150 -10.645 -26.826 1.00 0.00 O ATOM 613 CB GLU A 56 6.047 -12.458 -24.900 1.00 0.00 C ATOM 614 CG GLU A 56 4.634 -12.696 -24.329 1.00 0.00 C ATOM 615 CD GLU A 56 3.745 -11.438 -24.322 1.00 0.00 C ATOM 616 OE1 GLU A 56 4.005 -10.522 -23.508 1.00 0.00 O ATOM 617 OE2 GLU A 56 2.779 -11.364 -25.111 1.00 0.00 O ATOM 0 H GLU A 56 4.765 -13.351 -26.848 1.00 0.00 H new ATOM 0 HA GLU A 56 5.680 -10.779 -26.221 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.567 -13.414 -24.956 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.605 -11.832 -24.203 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.142 -13.473 -24.914 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.723 -13.072 -23.310 1.00 0.00 H new ATOM 624 N LEU A 57 8.043 -12.859 -27.284 1.00 0.00 N ATOM 625 CA LEU A 57 9.402 -12.975 -27.839 1.00 0.00 C ATOM 626 C LEU A 57 9.514 -12.186 -29.167 1.00 0.00 C ATOM 627 O LEU A 57 10.496 -11.477 -29.380 1.00 0.00 O ATOM 628 CB LEU A 57 9.767 -14.473 -28.041 1.00 0.00 C ATOM 629 CG LEU A 57 11.233 -14.783 -28.483 1.00 0.00 C ATOM 630 CD1 LEU A 57 12.256 -14.307 -27.427 1.00 0.00 C ATOM 631 CD2 LEU A 57 11.410 -16.287 -28.790 1.00 0.00 C ATOM 0 H LEU A 57 7.526 -13.738 -27.282 1.00 0.00 H new ATOM 0 HA LEU A 57 10.112 -12.542 -27.135 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.575 -14.999 -27.106 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.091 -14.891 -28.787 1.00 0.00 H new ATOM 0 HG LEU A 57 11.426 -14.226 -29.399 1.00 0.00 H new ATOM 0 HD11 LEU A 57 13.265 -14.539 -27.768 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.159 -13.231 -27.286 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.066 -14.815 -26.482 1.00 0.00 H new ATOM 0 HD21 LEU A 57 12.439 -16.477 -29.096 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.183 -16.870 -27.897 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.733 -16.576 -29.594 1.00 0.00 H new ATOM 643 N ILE A 58 8.472 -12.291 -30.025 1.00 0.00 N ATOM 644 CA ILE A 58 8.401 -11.610 -31.339 1.00 0.00 C ATOM 645 C ILE A 58 8.486 -10.081 -31.159 1.00 0.00 C ATOM 646 O ILE A 58 9.281 -9.427 -31.835 1.00 0.00 O ATOM 647 CB ILE A 58 7.079 -12.012 -32.162 1.00 0.00 C ATOM 648 CG1 ILE A 58 7.262 -13.353 -32.960 1.00 0.00 C ATOM 649 CG2 ILE A 58 6.598 -10.893 -33.139 1.00 0.00 C ATOM 650 CD1 ILE A 58 7.511 -14.593 -32.131 1.00 0.00 C ATOM 0 H ILE A 58 7.648 -12.857 -29.822 1.00 0.00 H new ATOM 0 HA ILE A 58 9.257 -11.946 -31.925 1.00 0.00 H new ATOM 0 HB ILE A 58 6.309 -12.150 -31.403 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.369 -13.518 -33.563 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.096 -13.230 -33.651 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.703 -11.228 -33.663 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.371 -9.989 -32.574 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.384 -10.680 -33.863 1.00 0.00 H new ATOM 0 HD11 ILE A 58 7.621 -15.455 -32.789 1.00 0.00 H new ATOM 0 HD12 ILE A 58 8.422 -14.463 -31.547 1.00 0.00 H new ATOM 0 HD13 ILE A 58 6.669 -14.756 -31.458 1.00 0.00 H new ATOM 662 N GLU A 59 7.673 -9.531 -30.232 1.00 0.00 N ATOM 663 CA GLU A 59 7.565 -8.071 -30.039 1.00 0.00 C ATOM 664 C GLU A 59 8.852 -7.506 -29.408 1.00 0.00 C ATOM 665 O GLU A 59 9.377 -6.499 -29.886 1.00 0.00 O ATOM 666 CB GLU A 59 6.309 -7.680 -29.194 1.00 0.00 C ATOM 667 CG GLU A 59 6.299 -8.208 -27.747 1.00 0.00 C ATOM 668 CD GLU A 59 5.168 -7.632 -26.884 1.00 0.00 C ATOM 669 OE1 GLU A 59 5.373 -6.561 -26.270 1.00 0.00 O ATOM 670 OE2 GLU A 59 4.076 -8.231 -26.824 1.00 0.00 O ATOM 0 H GLU A 59 7.082 -10.077 -29.606 1.00 0.00 H new ATOM 0 HA GLU A 59 7.439 -7.623 -31.025 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.234 -6.593 -29.167 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.419 -8.049 -29.704 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.210 -9.294 -27.767 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.255 -7.975 -27.279 1.00 0.00 H new ATOM 677 N THR A 60 9.382 -8.192 -28.370 1.00 0.00 N ATOM 678 CA THR A 60 10.577 -7.728 -27.639 1.00 0.00 C ATOM 679 C THR A 60 11.820 -7.739 -28.564 1.00 0.00 C ATOM 680 O THR A 60 12.635 -6.801 -28.531 1.00 0.00 O ATOM 681 CB THR A 60 10.826 -8.597 -26.355 1.00 0.00 C ATOM 682 OG1 THR A 60 9.602 -8.727 -25.618 1.00 0.00 O ATOM 683 CG2 THR A 60 11.884 -7.979 -25.419 1.00 0.00 C ATOM 0 H THR A 60 8.998 -9.070 -28.021 1.00 0.00 H new ATOM 0 HA THR A 60 10.400 -6.702 -27.317 1.00 0.00 H new ATOM 0 HB THR A 60 11.191 -9.566 -26.695 1.00 0.00 H new ATOM 0 HG1 THR A 60 9.101 -9.501 -25.950 1.00 0.00 H new ATOM 0 HG21 THR A 60 12.017 -8.620 -24.547 1.00 0.00 H new ATOM 0 HG22 THR A 60 12.831 -7.888 -25.951 1.00 0.00 H new ATOM 0 HG23 THR A 60 11.552 -6.992 -25.096 1.00 0.00 H new ATOM 691 N MET A 61 11.928 -8.791 -29.416 1.00 0.00 N ATOM 692 CA MET A 61 12.988 -8.876 -30.441 1.00 0.00 C ATOM 693 C MET A 61 12.821 -7.756 -31.484 1.00 0.00 C ATOM 694 O MET A 61 13.762 -7.018 -31.732 1.00 0.00 O ATOM 695 CB MET A 61 13.026 -10.262 -31.155 1.00 0.00 C ATOM 696 CG MET A 61 13.567 -11.422 -30.303 1.00 0.00 C ATOM 697 SD MET A 61 13.842 -12.938 -31.255 1.00 0.00 S ATOM 698 CE MET A 61 15.130 -12.429 -32.402 1.00 0.00 C ATOM 0 H MET A 61 11.292 -9.589 -29.409 1.00 0.00 H new ATOM 0 HA MET A 61 13.937 -8.753 -29.919 1.00 0.00 H new ATOM 0 HB2 MET A 61 12.017 -10.512 -31.482 1.00 0.00 H new ATOM 0 HB3 MET A 61 13.639 -10.174 -32.052 1.00 0.00 H new ATOM 0 HG2 MET A 61 14.505 -11.117 -29.839 1.00 0.00 H new ATOM 0 HG3 MET A 61 12.865 -11.630 -29.496 1.00 0.00 H new ATOM 0 HE1 MET A 61 15.663 -13.308 -32.765 1.00 0.00 H new ATOM 0 HE2 MET A 61 14.680 -11.904 -33.245 1.00 0.00 H new ATOM 0 HE3 MET A 61 15.829 -11.766 -31.893 1.00 0.00 H new ATOM 708 N ALA A 62 11.607 -7.623 -32.053 1.00 0.00 N ATOM 709 CA ALA A 62 11.301 -6.624 -33.110 1.00 0.00 C ATOM 710 C ALA A 62 11.672 -5.190 -32.676 1.00 0.00 C ATOM 711 O ALA A 62 12.182 -4.405 -33.484 1.00 0.00 O ATOM 712 CB ALA A 62 9.815 -6.702 -33.499 1.00 0.00 C ATOM 0 H ALA A 62 10.807 -8.202 -31.797 1.00 0.00 H new ATOM 0 HA ALA A 62 11.912 -6.866 -33.979 1.00 0.00 H new ATOM 0 HB1 ALA A 62 9.603 -5.966 -34.274 1.00 0.00 H new ATOM 0 HB2 ALA A 62 9.589 -7.700 -33.875 1.00 0.00 H new ATOM 0 HB3 ALA A 62 9.199 -6.496 -32.624 1.00 0.00 H new ATOM 718 N GLU A 63 11.436 -4.885 -31.386 1.00 0.00 N ATOM 719 CA GLU A 63 11.744 -3.570 -30.798 1.00 0.00 C ATOM 720 C GLU A 63 13.261 -3.369 -30.627 1.00 0.00 C ATOM 721 O GLU A 63 13.812 -2.374 -31.115 1.00 0.00 O ATOM 722 CB GLU A 63 11.001 -3.387 -29.449 1.00 0.00 C ATOM 723 CG GLU A 63 9.460 -3.379 -29.555 1.00 0.00 C ATOM 724 CD GLU A 63 8.921 -2.289 -30.498 1.00 0.00 C ATOM 725 OE1 GLU A 63 8.944 -1.102 -30.115 1.00 0.00 O ATOM 726 OE2 GLU A 63 8.485 -2.610 -31.626 1.00 0.00 O ATOM 0 H GLU A 63 11.027 -5.544 -30.723 1.00 0.00 H new ATOM 0 HA GLU A 63 11.391 -2.805 -31.489 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.301 -4.188 -28.773 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.325 -2.450 -28.996 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.122 -4.354 -29.907 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.035 -3.233 -28.562 1.00 0.00 H new ATOM 733 N THR A 64 13.938 -4.322 -29.953 1.00 0.00 N ATOM 734 CA THR A 64 15.396 -4.216 -29.685 1.00 0.00 C ATOM 735 C THR A 64 16.223 -4.267 -30.993 1.00 0.00 C ATOM 736 O THR A 64 17.344 -3.741 -31.059 1.00 0.00 O ATOM 737 CB THR A 64 15.884 -5.309 -28.675 1.00 0.00 C ATOM 738 OG1 THR A 64 17.228 -5.033 -28.246 1.00 0.00 O ATOM 739 CG2 THR A 64 15.838 -6.720 -29.272 1.00 0.00 C ATOM 0 H THR A 64 13.506 -5.170 -29.585 1.00 0.00 H new ATOM 0 HA THR A 64 15.560 -3.242 -29.223 1.00 0.00 H new ATOM 0 HB THR A 64 15.200 -5.274 -27.827 1.00 0.00 H new ATOM 0 HG1 THR A 64 17.418 -5.532 -27.424 1.00 0.00 H new ATOM 0 HG21 THR A 64 16.186 -7.440 -28.531 1.00 0.00 H new ATOM 0 HG22 THR A 64 14.814 -6.961 -29.559 1.00 0.00 H new ATOM 0 HG23 THR A 64 16.481 -6.764 -30.151 1.00 0.00 H new ATOM 747 N LEU A 65 15.633 -4.893 -32.030 1.00 0.00 N ATOM 748 CA LEU A 65 16.203 -4.945 -33.379 1.00 0.00 C ATOM 749 C LEU A 65 16.086 -3.562 -34.038 1.00 0.00 C ATOM 750 O LEU A 65 17.098 -2.976 -34.398 1.00 0.00 O ATOM 751 CB LEU A 65 15.508 -6.053 -34.251 1.00 0.00 C ATOM 752 CG LEU A 65 16.245 -7.429 -34.370 1.00 0.00 C ATOM 753 CD1 LEU A 65 17.610 -7.265 -35.063 1.00 0.00 C ATOM 754 CD2 LEU A 65 16.389 -8.133 -33.007 1.00 0.00 C ATOM 0 H LEU A 65 14.740 -5.379 -31.948 1.00 0.00 H new ATOM 0 HA LEU A 65 17.257 -5.213 -33.306 1.00 0.00 H new ATOM 0 HB2 LEU A 65 14.515 -6.235 -33.840 1.00 0.00 H new ATOM 0 HB3 LEU A 65 15.369 -5.655 -35.256 1.00 0.00 H new ATOM 0 HG LEU A 65 15.624 -8.073 -34.992 1.00 0.00 H new ATOM 0 HD11 LEU A 65 18.101 -8.235 -35.133 1.00 0.00 H new ATOM 0 HD12 LEU A 65 17.463 -6.859 -36.064 1.00 0.00 H new ATOM 0 HD13 LEU A 65 18.233 -6.584 -34.483 1.00 0.00 H new ATOM 0 HD21 LEU A 65 16.906 -9.083 -33.141 1.00 0.00 H new ATOM 0 HD22 LEU A 65 16.962 -7.500 -32.329 1.00 0.00 H new ATOM 0 HD23 LEU A 65 15.401 -8.315 -32.585 1.00 0.00 H new ATOM 766 N LYS A 66 14.843 -3.030 -34.154 1.00 0.00 N ATOM 767 CA LYS A 66 14.571 -1.764 -34.889 1.00 0.00 C ATOM 768 C LYS A 66 15.295 -0.551 -34.247 1.00 0.00 C ATOM 769 O LYS A 66 15.539 0.456 -34.921 1.00 0.00 O ATOM 770 CB LYS A 66 13.043 -1.495 -35.003 1.00 0.00 C ATOM 771 CG LYS A 66 12.349 -1.088 -33.684 1.00 0.00 C ATOM 772 CD LYS A 66 10.820 -0.907 -33.833 1.00 0.00 C ATOM 773 CE LYS A 66 10.440 0.165 -34.869 1.00 0.00 C ATOM 774 NZ LYS A 66 8.966 0.306 -35.011 1.00 0.00 N ATOM 0 H LYS A 66 14.011 -3.457 -33.748 1.00 0.00 H new ATOM 0 HA LYS A 66 14.972 -1.890 -35.895 1.00 0.00 H new ATOM 0 HB2 LYS A 66 12.883 -0.706 -35.738 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.559 -2.393 -35.388 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.547 -1.847 -32.927 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.786 -0.157 -33.323 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.374 -1.858 -34.122 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.396 -0.637 -32.866 1.00 0.00 H new ATOM 0 HE2 LYS A 66 10.869 1.123 -34.574 1.00 0.00 H new ATOM 0 HE3 LYS A 66 10.874 -0.094 -35.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 8.754 1.038 -35.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.559 -0.600 -35.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 8.554 0.579 -34.096 1.00 0.00 H new ATOM 788 N SER A 67 15.632 -0.681 -32.944 1.00 0.00 N ATOM 789 CA SER A 67 16.425 0.311 -32.200 1.00 0.00 C ATOM 790 C SER A 67 17.829 0.518 -32.826 1.00 0.00 C ATOM 791 O SER A 67 18.333 1.638 -32.869 1.00 0.00 O ATOM 792 CB SER A 67 16.556 -0.140 -30.731 1.00 0.00 C ATOM 793 OG SER A 67 15.282 -0.265 -30.116 1.00 0.00 O ATOM 0 H SER A 67 15.357 -1.485 -32.379 1.00 0.00 H new ATOM 0 HA SER A 67 15.906 1.268 -32.250 1.00 0.00 H new ATOM 0 HB2 SER A 67 17.079 -1.095 -30.686 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.160 0.580 -30.179 1.00 0.00 H new ATOM 0 HG SER A 67 14.822 -1.053 -30.473 1.00 0.00 H new ATOM 799 N THR A 68 18.440 -0.578 -33.308 1.00 0.00 N ATOM 800 CA THR A 68 19.803 -0.565 -33.896 1.00 0.00 C ATOM 801 C THR A 68 19.769 -0.774 -35.428 1.00 0.00 C ATOM 802 O THR A 68 20.793 -0.621 -36.099 1.00 0.00 O ATOM 803 CB THR A 68 20.706 -1.642 -33.207 1.00 0.00 C ATOM 804 OG1 THR A 68 22.050 -1.597 -33.727 1.00 0.00 O ATOM 805 CG2 THR A 68 20.139 -3.060 -33.358 1.00 0.00 C ATOM 0 H THR A 68 18.008 -1.502 -33.304 1.00 0.00 H new ATOM 0 HA THR A 68 20.233 0.420 -33.713 1.00 0.00 H new ATOM 0 HB THR A 68 20.723 -1.400 -32.144 1.00 0.00 H new ATOM 0 HG1 THR A 68 22.051 -1.136 -34.592 1.00 0.00 H new ATOM 0 HG21 THR A 68 20.801 -3.771 -32.864 1.00 0.00 H new ATOM 0 HG22 THR A 68 19.150 -3.107 -32.902 1.00 0.00 H new ATOM 0 HG23 THR A 68 20.063 -3.311 -34.416 1.00 0.00 H new ATOM 813 N MET A 69 18.587 -1.123 -35.977 1.00 0.00 N ATOM 814 CA MET A 69 18.369 -1.201 -37.440 1.00 0.00 C ATOM 815 C MET A 69 18.229 0.230 -37.997 1.00 0.00 C ATOM 816 O MET A 69 17.394 0.986 -37.485 1.00 0.00 O ATOM 817 CB MET A 69 17.091 -2.033 -37.774 1.00 0.00 C ATOM 818 CG MET A 69 17.221 -3.542 -37.502 1.00 0.00 C ATOM 819 SD MET A 69 18.330 -4.378 -38.648 1.00 0.00 S ATOM 820 CE MET A 69 17.453 -4.156 -40.196 1.00 0.00 C ATOM 0 H MET A 69 17.762 -1.357 -35.425 1.00 0.00 H new ATOM 0 HA MET A 69 19.221 -1.701 -37.901 1.00 0.00 H new ATOM 0 HB2 MET A 69 16.257 -1.643 -37.192 1.00 0.00 H new ATOM 0 HB3 MET A 69 16.842 -1.887 -38.825 1.00 0.00 H new ATOM 0 HG2 MET A 69 17.581 -3.691 -36.484 1.00 0.00 H new ATOM 0 HG3 MET A 69 16.234 -4.001 -37.561 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.722 -4.957 -40.885 1.00 0.00 H new ATOM 0 HE2 MET A 69 16.379 -4.181 -40.012 1.00 0.00 H new ATOM 0 HE3 MET A 69 17.724 -3.195 -40.633 1.00 0.00 H new ATOM 830 N PRO A 70 19.067 0.643 -39.023 1.00 0.00 N ATOM 831 CA PRO A 70 18.954 1.978 -39.666 1.00 0.00 C ATOM 832 C PRO A 70 17.533 2.211 -40.213 1.00 0.00 C ATOM 833 O PRO A 70 16.932 3.263 -39.966 1.00 0.00 O ATOM 834 CB PRO A 70 20.033 1.956 -40.793 1.00 0.00 C ATOM 835 CG PRO A 70 20.404 0.510 -40.956 1.00 0.00 C ATOM 836 CD PRO A 70 20.189 -0.137 -39.605 1.00 0.00 C ATOM 0 HA PRO A 70 19.121 2.800 -38.970 1.00 0.00 H new ATOM 0 HB2 PRO A 70 19.640 2.369 -41.722 1.00 0.00 H new ATOM 0 HB3 PRO A 70 20.900 2.556 -40.519 1.00 0.00 H new ATOM 0 HG2 PRO A 70 19.787 0.034 -41.718 1.00 0.00 H new ATOM 0 HG3 PRO A 70 21.441 0.408 -41.276 1.00 0.00 H new ATOM 0 HD2 PRO A 70 19.937 -1.193 -39.701 1.00 0.00 H new ATOM 0 HD3 PRO A 70 21.083 -0.078 -38.985 1.00 0.00 H new ATOM 844 N ASP A 71 17.004 1.205 -40.947 1.00 0.00 N ATOM 845 CA ASP A 71 15.570 1.129 -41.303 1.00 0.00 C ATOM 846 C ASP A 71 15.111 -0.341 -41.268 1.00 0.00 C ATOM 847 O ASP A 71 14.534 -0.797 -40.275 1.00 0.00 O ATOM 848 CB ASP A 71 15.283 1.712 -42.729 1.00 0.00 C ATOM 849 CG ASP A 71 15.718 3.172 -42.901 1.00 0.00 C ATOM 850 OD1 ASP A 71 14.950 4.077 -42.533 1.00 0.00 O ATOM 851 OD2 ASP A 71 16.844 3.415 -43.388 1.00 0.00 O ATOM 0 H ASP A 71 17.557 0.427 -41.307 1.00 0.00 H new ATOM 0 HA ASP A 71 15.021 1.726 -40.575 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.796 1.100 -43.471 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.215 1.634 -42.935 1.00 0.00 H new ATOM 856 N ARG A 72 15.473 -1.101 -42.331 1.00 0.00 N ATOM 857 CA ARG A 72 14.922 -2.456 -42.627 1.00 0.00 C ATOM 858 C ARG A 72 15.930 -3.224 -43.508 1.00 0.00 C ATOM 859 O ARG A 72 16.632 -2.605 -44.314 1.00 0.00 O ATOM 860 CB ARG A 72 13.555 -2.374 -43.406 1.00 0.00 C ATOM 861 CG ARG A 72 12.422 -1.567 -42.728 1.00 0.00 C ATOM 862 CD ARG A 72 11.850 -2.249 -41.469 1.00 0.00 C ATOM 863 NE ARG A 72 10.914 -3.329 -41.806 1.00 0.00 N ATOM 864 CZ ARG A 72 9.581 -3.215 -41.791 1.00 0.00 C ATOM 865 NH1 ARG A 72 9.008 -2.073 -41.443 1.00 0.00 N ATOM 866 NH2 ARG A 72 8.827 -4.253 -42.122 1.00 0.00 N ATOM 0 H ARG A 72 16.162 -0.792 -43.016 1.00 0.00 H new ATOM 0 HA ARG A 72 14.753 -2.963 -41.677 1.00 0.00 H new ATOM 0 HB2 ARG A 72 13.746 -1.937 -44.386 1.00 0.00 H new ATOM 0 HB3 ARG A 72 13.197 -3.390 -43.575 1.00 0.00 H new ATOM 0 HG2 ARG A 72 12.801 -0.581 -42.457 1.00 0.00 H new ATOM 0 HG3 ARG A 72 11.616 -1.413 -43.446 1.00 0.00 H new ATOM 0 HD2 ARG A 72 12.668 -2.651 -40.871 1.00 0.00 H new ATOM 0 HD3 ARG A 72 11.341 -1.507 -40.854 1.00 0.00 H new ATOM 0 HE ARG A 72 11.309 -4.232 -42.071 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.584 -1.272 -41.184 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.991 -1.995 -41.434 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.263 -5.136 -42.387 1.00 0.00 H new ATOM 0 HH22 ARG A 72 7.811 -4.169 -42.111 1.00 0.00 H new ATOM 880 N GLY A 73 16.010 -4.559 -43.338 1.00 0.00 N ATOM 881 CA GLY A 73 16.783 -5.438 -44.246 1.00 0.00 C ATOM 882 C GLY A 73 18.303 -5.446 -44.017 1.00 0.00 C ATOM 883 O GLY A 73 19.003 -6.311 -44.557 1.00 0.00 O ATOM 0 H GLY A 73 15.547 -5.056 -42.577 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.411 -6.457 -44.142 1.00 0.00 H new ATOM 0 HA3 GLY A 73 16.589 -5.132 -45.274 1.00 0.00 H new ATOM 887 N ALA A 74 18.812 -4.470 -43.243 1.00 0.00 N ATOM 888 CA ALA A 74 20.249 -4.347 -42.901 1.00 0.00 C ATOM 889 C ALA A 74 20.723 -5.537 -42.025 1.00 0.00 C ATOM 890 O ALA A 74 19.878 -6.215 -41.413 1.00 0.00 O ATOM 891 CB ALA A 74 20.479 -3.001 -42.187 1.00 0.00 C ATOM 0 H ALA A 74 18.236 -3.736 -42.832 1.00 0.00 H new ATOM 0 HA ALA A 74 20.840 -4.374 -43.816 1.00 0.00 H new ATOM 0 HB1 ALA A 74 21.534 -2.901 -41.931 1.00 0.00 H new ATOM 0 HB2 ALA A 74 20.186 -2.184 -42.847 1.00 0.00 H new ATOM 0 HB3 ALA A 74 19.880 -2.965 -41.277 1.00 0.00 H new ATOM 897 N PRO A 75 22.071 -5.842 -41.975 1.00 0.00 N ATOM 898 CA PRO A 75 22.614 -6.904 -41.096 1.00 0.00 C ATOM 899 C PRO A 75 22.294 -6.632 -39.608 1.00 0.00 C ATOM 900 O PRO A 75 22.693 -5.596 -39.057 1.00 0.00 O ATOM 901 CB PRO A 75 24.149 -6.868 -41.363 1.00 0.00 C ATOM 902 CG PRO A 75 24.284 -6.210 -42.705 1.00 0.00 C ATOM 903 CD PRO A 75 23.155 -5.205 -42.780 1.00 0.00 C ATOM 0 HA PRO A 75 22.176 -7.879 -41.307 1.00 0.00 H new ATOM 0 HB2 PRO A 75 24.673 -6.305 -40.591 1.00 0.00 H new ATOM 0 HB3 PRO A 75 24.574 -7.872 -41.369 1.00 0.00 H new ATOM 0 HG2 PRO A 75 25.252 -5.720 -42.806 1.00 0.00 H new ATOM 0 HG3 PRO A 75 24.212 -6.942 -43.510 1.00 0.00 H new ATOM 0 HD2 PRO A 75 23.448 -4.240 -42.367 1.00 0.00 H new ATOM 0 HD3 PRO A 75 22.841 -5.029 -43.809 1.00 0.00 H new ATOM 911 N LEU A 76 21.557 -7.571 -39.000 1.00 0.00 N ATOM 912 CA LEU A 76 21.213 -7.561 -37.562 1.00 0.00 C ATOM 913 C LEU A 76 22.489 -7.570 -36.655 1.00 0.00 C ATOM 914 O LEU A 76 23.538 -8.069 -37.086 1.00 0.00 O ATOM 915 CB LEU A 76 20.243 -8.765 -37.250 1.00 0.00 C ATOM 916 CG LEU A 76 20.481 -10.127 -38.013 1.00 0.00 C ATOM 917 CD1 LEU A 76 21.801 -10.819 -37.624 1.00 0.00 C ATOM 918 CD2 LEU A 76 19.290 -11.087 -37.817 1.00 0.00 C ATOM 0 H LEU A 76 21.174 -8.375 -39.497 1.00 0.00 H new ATOM 0 HA LEU A 76 20.694 -6.631 -37.328 1.00 0.00 H new ATOM 0 HB2 LEU A 76 20.296 -8.968 -36.180 1.00 0.00 H new ATOM 0 HB3 LEU A 76 19.225 -8.437 -37.462 1.00 0.00 H new ATOM 0 HG LEU A 76 20.562 -9.871 -39.069 1.00 0.00 H new ATOM 0 HD11 LEU A 76 21.903 -11.749 -38.184 1.00 0.00 H new ATOM 0 HD12 LEU A 76 22.639 -10.162 -37.856 1.00 0.00 H new ATOM 0 HD13 LEU A 76 21.796 -11.037 -36.556 1.00 0.00 H new ATOM 0 HD21 LEU A 76 19.480 -12.017 -38.353 1.00 0.00 H new ATOM 0 HD22 LEU A 76 19.165 -11.299 -36.755 1.00 0.00 H new ATOM 0 HD23 LEU A 76 18.382 -10.624 -38.204 1.00 0.00 H new ATOM 930 N PRO A 77 22.423 -6.990 -35.400 1.00 0.00 N ATOM 931 CA PRO A 77 23.596 -6.895 -34.485 1.00 0.00 C ATOM 932 C PRO A 77 24.058 -8.279 -34.012 1.00 0.00 C ATOM 933 O PRO A 77 23.285 -9.231 -34.034 1.00 0.00 O ATOM 934 CB PRO A 77 23.053 -6.056 -33.296 1.00 0.00 C ATOM 935 CG PRO A 77 21.587 -6.352 -33.290 1.00 0.00 C ATOM 936 CD PRO A 77 21.202 -6.416 -34.755 1.00 0.00 C ATOM 0 HA PRO A 77 24.468 -6.451 -34.965 1.00 0.00 H new ATOM 0 HB2 PRO A 77 23.523 -6.344 -32.356 1.00 0.00 H new ATOM 0 HB3 PRO A 77 23.246 -4.992 -33.436 1.00 0.00 H new ATOM 0 HG2 PRO A 77 21.375 -7.293 -32.783 1.00 0.00 H new ATOM 0 HG3 PRO A 77 21.028 -5.576 -32.767 1.00 0.00 H new ATOM 0 HD2 PRO A 77 20.327 -7.046 -34.915 1.00 0.00 H new ATOM 0 HD3 PRO A 77 20.962 -5.430 -35.152 1.00 0.00 H new ATOM 944 N GLU A 78 25.311 -8.361 -33.537 1.00 0.00 N ATOM 945 CA GLU A 78 25.909 -9.619 -33.070 1.00 0.00 C ATOM 946 C GLU A 78 25.404 -9.946 -31.651 1.00 0.00 C ATOM 947 O GLU A 78 25.541 -11.074 -31.183 1.00 0.00 O ATOM 948 CB GLU A 78 27.469 -9.569 -33.082 1.00 0.00 C ATOM 949 CG GLU A 78 28.134 -9.092 -34.402 1.00 0.00 C ATOM 950 CD GLU A 78 28.042 -7.570 -34.625 1.00 0.00 C ATOM 951 OE1 GLU A 78 28.682 -6.817 -33.859 1.00 0.00 O ATOM 952 OE2 GLU A 78 27.305 -7.113 -35.527 1.00 0.00 O ATOM 0 H GLU A 78 25.936 -7.558 -33.467 1.00 0.00 H new ATOM 0 HA GLU A 78 25.602 -10.404 -33.761 1.00 0.00 H new ATOM 0 HB2 GLU A 78 27.796 -8.911 -32.277 1.00 0.00 H new ATOM 0 HB3 GLU A 78 27.845 -10.566 -32.851 1.00 0.00 H new ATOM 0 HG2 GLU A 78 29.183 -9.387 -34.398 1.00 0.00 H new ATOM 0 HG3 GLU A 78 27.663 -9.603 -35.242 1.00 0.00 H new ATOM 959 N ASN A 79 24.843 -8.940 -30.960 1.00 0.00 N ATOM 960 CA ASN A 79 24.260 -9.116 -29.624 1.00 0.00 C ATOM 961 C ASN A 79 22.862 -8.497 -29.610 1.00 0.00 C ATOM 962 O ASN A 79 22.705 -7.304 -29.884 1.00 0.00 O ATOM 963 CB ASN A 79 25.172 -8.485 -28.541 1.00 0.00 C ATOM 964 CG ASN A 79 26.549 -9.158 -28.476 1.00 0.00 C ATOM 965 OD1 ASN A 79 26.768 -10.078 -27.689 1.00 0.00 O ATOM 966 ND2 ASN A 79 27.464 -8.742 -29.342 1.00 0.00 N ATOM 0 H ASN A 79 24.782 -7.985 -31.313 1.00 0.00 H new ATOM 0 HA ASN A 79 24.179 -10.178 -29.394 1.00 0.00 H new ATOM 0 HB2 ASN A 79 25.299 -7.423 -28.750 1.00 0.00 H new ATOM 0 HB3 ASN A 79 24.685 -8.563 -27.569 1.00 0.00 H new ATOM 0 HD21 ASN A 79 28.381 -9.188 -29.369 1.00 0.00 H new ATOM 0 HD22 ASN A 79 27.250 -7.976 -29.981 1.00 0.00 H new ATOM 973 N ILE A 80 21.847 -9.334 -29.326 1.00 0.00 N ATOM 974 CA ILE A 80 20.430 -8.932 -29.291 1.00 0.00 C ATOM 975 C ILE A 80 19.950 -8.977 -27.822 1.00 0.00 C ATOM 976 O ILE A 80 19.907 -10.056 -27.219 1.00 0.00 O ATOM 977 CB ILE A 80 19.526 -9.864 -30.210 1.00 0.00 C ATOM 978 CG1 ILE A 80 19.965 -9.838 -31.726 1.00 0.00 C ATOM 979 CG2 ILE A 80 18.032 -9.495 -30.089 1.00 0.00 C ATOM 980 CD1 ILE A 80 21.214 -10.640 -32.077 1.00 0.00 C ATOM 0 H ILE A 80 21.991 -10.321 -29.112 1.00 0.00 H new ATOM 0 HA ILE A 80 20.336 -7.921 -29.688 1.00 0.00 H new ATOM 0 HB ILE A 80 19.673 -10.880 -29.843 1.00 0.00 H new ATOM 0 HG12 ILE A 80 19.137 -10.211 -32.329 1.00 0.00 H new ATOM 0 HG13 ILE A 80 20.130 -8.801 -32.018 1.00 0.00 H new ATOM 0 HG21 ILE A 80 17.442 -10.151 -30.730 1.00 0.00 H new ATOM 0 HG22 ILE A 80 17.711 -9.614 -29.054 1.00 0.00 H new ATOM 0 HG23 ILE A 80 17.887 -8.460 -30.398 1.00 0.00 H new ATOM 0 HD11 ILE A 80 21.418 -10.548 -33.144 1.00 0.00 H new ATOM 0 HD12 ILE A 80 22.063 -10.257 -31.511 1.00 0.00 H new ATOM 0 HD13 ILE A 80 21.055 -11.689 -31.827 1.00 0.00 H new ATOM 992 N ILE A 81 19.607 -7.801 -27.249 1.00 0.00 N ATOM 993 CA ILE A 81 19.350 -7.652 -25.793 1.00 0.00 C ATOM 994 C ILE A 81 17.849 -7.692 -25.468 1.00 0.00 C ATOM 995 O ILE A 81 17.082 -6.826 -25.901 1.00 0.00 O ATOM 996 CB ILE A 81 19.956 -6.310 -25.232 1.00 0.00 C ATOM 997 CG1 ILE A 81 21.478 -6.239 -25.554 1.00 0.00 C ATOM 998 CG2 ILE A 81 19.698 -6.150 -23.704 1.00 0.00 C ATOM 999 CD1 ILE A 81 22.310 -7.350 -24.949 1.00 0.00 C ATOM 0 H ILE A 81 19.500 -6.934 -27.775 1.00 0.00 H new ATOM 0 HA ILE A 81 19.840 -8.499 -25.312 1.00 0.00 H new ATOM 0 HB ILE A 81 19.452 -5.479 -25.726 1.00 0.00 H new ATOM 0 HG12 ILE A 81 21.607 -6.256 -26.636 1.00 0.00 H new ATOM 0 HG13 ILE A 81 21.865 -5.282 -25.202 1.00 0.00 H new ATOM 0 HG21 ILE A 81 20.132 -5.212 -23.358 1.00 0.00 H new ATOM 0 HG22 ILE A 81 18.625 -6.145 -23.515 1.00 0.00 H new ATOM 0 HG23 ILE A 81 20.157 -6.981 -23.169 1.00 0.00 H new ATOM 0 HD11 ILE A 81 23.355 -7.215 -25.228 1.00 0.00 H new ATOM 0 HD12 ILE A 81 22.218 -7.323 -23.863 1.00 0.00 H new ATOM 0 HD13 ILE A 81 21.956 -8.312 -25.319 1.00 0.00 H new ATOM 1011 N LEU A 82 17.452 -8.716 -24.705 1.00 0.00 N ATOM 1012 CA LEU A 82 16.087 -8.875 -24.163 1.00 0.00 C ATOM 1013 C LEU A 82 16.174 -9.012 -22.621 1.00 0.00 C ATOM 1014 O LEU A 82 15.946 -10.086 -22.060 1.00 0.00 O ATOM 1015 CB LEU A 82 15.377 -10.118 -24.798 1.00 0.00 C ATOM 1016 CG LEU A 82 14.768 -9.973 -26.233 1.00 0.00 C ATOM 1017 CD1 LEU A 82 15.833 -9.770 -27.314 1.00 0.00 C ATOM 1018 CD2 LEU A 82 13.849 -11.173 -26.573 1.00 0.00 C ATOM 0 H LEU A 82 18.079 -9.475 -24.438 1.00 0.00 H new ATOM 0 HA LEU A 82 15.491 -7.998 -24.415 1.00 0.00 H new ATOM 0 HB2 LEU A 82 16.098 -10.935 -24.824 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.575 -10.422 -24.126 1.00 0.00 H new ATOM 0 HG LEU A 82 14.162 -9.067 -26.222 1.00 0.00 H new ATOM 0 HD11 LEU A 82 15.351 -9.676 -28.287 1.00 0.00 H new ATOM 0 HD12 LEU A 82 16.400 -8.864 -27.101 1.00 0.00 H new ATOM 0 HD13 LEU A 82 16.508 -10.626 -27.325 1.00 0.00 H new ATOM 0 HD21 LEU A 82 13.440 -11.046 -27.575 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.426 -12.097 -26.531 1.00 0.00 H new ATOM 0 HD23 LEU A 82 13.033 -11.222 -25.852 1.00 0.00 H new ATOM 1030 N ASP A 83 16.558 -7.904 -21.964 1.00 0.00 N ATOM 1031 CA ASP A 83 16.708 -7.814 -20.497 1.00 0.00 C ATOM 1032 C ASP A 83 15.417 -8.139 -19.704 1.00 0.00 C ATOM 1033 O ASP A 83 15.479 -8.712 -18.608 1.00 0.00 O ATOM 1034 CB ASP A 83 17.232 -6.401 -20.119 1.00 0.00 C ATOM 1035 CG ASP A 83 17.466 -6.224 -18.607 1.00 0.00 C ATOM 1036 OD1 ASP A 83 18.320 -6.939 -18.045 1.00 0.00 O ATOM 1037 OD2 ASP A 83 16.806 -5.376 -17.971 1.00 0.00 O ATOM 0 H ASP A 83 16.777 -7.030 -22.443 1.00 0.00 H new ATOM 0 HA ASP A 83 17.426 -8.582 -20.211 1.00 0.00 H new ATOM 0 HB2 ASP A 83 18.166 -6.213 -20.649 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.517 -5.652 -20.459 1.00 0.00 H new ATOM 1042 N ASP A 84 14.256 -7.796 -20.268 1.00 0.00 N ATOM 1043 CA ASP A 84 12.972 -7.764 -19.520 1.00 0.00 C ATOM 1044 C ASP A 84 12.073 -8.978 -19.843 1.00 0.00 C ATOM 1045 O ASP A 84 10.850 -8.910 -19.661 1.00 0.00 O ATOM 1046 CB ASP A 84 12.226 -6.429 -19.831 1.00 0.00 C ATOM 1047 CG ASP A 84 13.068 -5.185 -19.497 1.00 0.00 C ATOM 1048 OD1 ASP A 84 13.837 -4.726 -20.370 1.00 0.00 O ATOM 1049 OD2 ASP A 84 12.975 -4.664 -18.361 1.00 0.00 O ATOM 0 H ASP A 84 14.167 -7.532 -21.249 1.00 0.00 H new ATOM 0 HA ASP A 84 13.201 -7.820 -18.456 1.00 0.00 H new ATOM 0 HB2 ASP A 84 11.955 -6.406 -20.887 1.00 0.00 H new ATOM 0 HB3 ASP A 84 11.296 -6.396 -19.263 1.00 0.00 H new ATOM 1054 N MET A 85 12.682 -10.112 -20.258 1.00 0.00 N ATOM 1055 CA MET A 85 11.915 -11.312 -20.658 1.00 0.00 C ATOM 1056 C MET A 85 11.584 -12.173 -19.435 1.00 0.00 C ATOM 1057 O MET A 85 12.343 -13.074 -19.080 1.00 0.00 O ATOM 1058 CB MET A 85 12.672 -12.135 -21.735 1.00 0.00 C ATOM 1059 CG MET A 85 12.490 -11.609 -23.163 1.00 0.00 C ATOM 1060 SD MET A 85 10.760 -11.564 -23.689 1.00 0.00 S ATOM 1061 CE MET A 85 10.250 -13.257 -23.375 1.00 0.00 C ATOM 0 H MET A 85 13.694 -10.220 -20.324 1.00 0.00 H new ATOM 0 HA MET A 85 10.978 -10.979 -21.103 1.00 0.00 H new ATOM 0 HB2 MET A 85 13.735 -12.140 -21.493 1.00 0.00 H new ATOM 0 HB3 MET A 85 12.331 -13.169 -21.693 1.00 0.00 H new ATOM 0 HG2 MET A 85 12.910 -10.605 -23.230 1.00 0.00 H new ATOM 0 HG3 MET A 85 13.056 -12.238 -23.850 1.00 0.00 H new ATOM 0 HE1 MET A 85 9.238 -13.408 -23.750 1.00 0.00 H new ATOM 0 HE2 MET A 85 10.930 -13.942 -23.881 1.00 0.00 H new ATOM 0 HE3 MET A 85 10.272 -13.451 -22.303 1.00 0.00 H new ATOM 1071 N ASP A 86 10.450 -11.844 -18.780 1.00 0.00 N ATOM 1072 CA ASP A 86 9.967 -12.543 -17.574 1.00 0.00 C ATOM 1073 C ASP A 86 10.990 -12.398 -16.423 1.00 0.00 C ATOM 1074 O ASP A 86 11.141 -13.290 -15.573 1.00 0.00 O ATOM 1075 CB ASP A 86 9.634 -14.034 -17.889 1.00 0.00 C ATOM 1076 CG ASP A 86 8.456 -14.200 -18.875 1.00 0.00 C ATOM 1077 OD1 ASP A 86 8.614 -13.857 -20.069 1.00 0.00 O ATOM 1078 OD2 ASP A 86 7.381 -14.684 -18.467 1.00 0.00 O ATOM 0 H ASP A 86 9.842 -11.081 -19.077 1.00 0.00 H new ATOM 0 HA ASP A 86 9.038 -12.078 -17.244 1.00 0.00 H new ATOM 0 HB2 ASP A 86 10.518 -14.517 -18.305 1.00 0.00 H new ATOM 0 HB3 ASP A 86 9.396 -14.551 -16.959 1.00 0.00 H new ATOM 1083 N GLY A 87 11.658 -11.220 -16.399 1.00 0.00 N ATOM 1084 CA GLY A 87 12.696 -10.907 -15.413 1.00 0.00 C ATOM 1085 C GLY A 87 14.069 -11.479 -15.780 1.00 0.00 C ATOM 1086 O GLY A 87 15.028 -11.346 -15.007 1.00 0.00 O ATOM 0 H GLY A 87 11.486 -10.467 -17.066 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.776 -9.825 -15.310 1.00 0.00 H new ATOM 0 HA3 GLY A 87 12.395 -11.298 -14.441 1.00 0.00 H new ATOM 1090 N CYS A 88 14.156 -12.120 -16.959 1.00 0.00 N ATOM 1091 CA CYS A 88 15.379 -12.771 -17.453 1.00 0.00 C ATOM 1092 C CYS A 88 16.040 -11.898 -18.531 1.00 0.00 C ATOM 1093 O CYS A 88 15.370 -11.479 -19.497 1.00 0.00 O ATOM 1094 CB CYS A 88 15.047 -14.163 -18.040 1.00 0.00 C ATOM 1095 SG CYS A 88 13.912 -15.145 -17.028 1.00 0.00 S ATOM 0 H CYS A 88 13.368 -12.201 -17.602 1.00 0.00 H new ATOM 0 HA CYS A 88 16.069 -12.895 -16.618 1.00 0.00 H new ATOM 0 HB2 CYS A 88 14.612 -14.032 -19.031 1.00 0.00 H new ATOM 0 HB3 CYS A 88 15.975 -14.720 -18.170 1.00 0.00 H new ATOM 0 HG CYS A 88 12.971 -14.378 -16.564 1.00 0.00 H new ATOM 1101 N ARG A 89 17.340 -11.613 -18.335 1.00 0.00 N ATOM 1102 CA ARG A 89 18.202 -10.996 -19.353 1.00 0.00 C ATOM 1103 C ARG A 89 18.677 -12.090 -20.318 1.00 0.00 C ATOM 1104 O ARG A 89 19.582 -12.869 -19.992 1.00 0.00 O ATOM 1105 CB ARG A 89 19.409 -10.264 -18.681 1.00 0.00 C ATOM 1106 CG ARG A 89 20.559 -9.811 -19.632 1.00 0.00 C ATOM 1107 CD ARG A 89 20.185 -8.691 -20.607 1.00 0.00 C ATOM 1108 NE ARG A 89 21.358 -8.260 -21.393 1.00 0.00 N ATOM 1109 CZ ARG A 89 22.170 -7.233 -21.082 1.00 0.00 C ATOM 1110 NH1 ARG A 89 21.913 -6.442 -20.045 1.00 0.00 N ATOM 1111 NH2 ARG A 89 23.250 -7.002 -21.817 1.00 0.00 N ATOM 0 H ARG A 89 17.823 -11.807 -17.458 1.00 0.00 H new ATOM 0 HA ARG A 89 17.643 -10.245 -19.911 1.00 0.00 H new ATOM 0 HB2 ARG A 89 19.029 -9.385 -18.161 1.00 0.00 H new ATOM 0 HB3 ARG A 89 19.831 -10.925 -17.924 1.00 0.00 H new ATOM 0 HG2 ARG A 89 21.402 -9.479 -19.026 1.00 0.00 H new ATOM 0 HG3 ARG A 89 20.898 -10.674 -20.205 1.00 0.00 H new ATOM 0 HD2 ARG A 89 19.399 -9.036 -21.279 1.00 0.00 H new ATOM 0 HD3 ARG A 89 19.781 -7.843 -20.054 1.00 0.00 H new ATOM 0 HE ARG A 89 21.571 -8.784 -22.242 1.00 0.00 H new ATOM 0 HH11 ARG A 89 21.088 -6.608 -19.469 1.00 0.00 H new ATOM 0 HH12 ARG A 89 22.541 -5.669 -19.826 1.00 0.00 H new ATOM 0 HH21 ARG A 89 23.462 -7.602 -22.614 1.00 0.00 H new ATOM 0 HH22 ARG A 89 23.868 -6.225 -21.585 1.00 0.00 H new ATOM 1125 N VAL A 90 18.013 -12.181 -21.484 1.00 0.00 N ATOM 1126 CA VAL A 90 18.420 -13.093 -22.565 1.00 0.00 C ATOM 1127 C VAL A 90 19.138 -12.299 -23.670 1.00 0.00 C ATOM 1128 O VAL A 90 18.546 -11.458 -24.357 1.00 0.00 O ATOM 1129 CB VAL A 90 17.237 -14.002 -23.113 1.00 0.00 C ATOM 1130 CG1 VAL A 90 15.878 -13.289 -23.119 1.00 0.00 C ATOM 1131 CG2 VAL A 90 17.563 -14.608 -24.507 1.00 0.00 C ATOM 0 H VAL A 90 17.184 -11.628 -21.702 1.00 0.00 H new ATOM 0 HA VAL A 90 19.126 -13.811 -22.147 1.00 0.00 H new ATOM 0 HB VAL A 90 17.150 -14.826 -22.405 1.00 0.00 H new ATOM 0 HG11 VAL A 90 15.114 -13.965 -23.504 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.619 -12.990 -22.103 1.00 0.00 H new ATOM 0 HG13 VAL A 90 15.934 -12.405 -23.754 1.00 0.00 H new ATOM 0 HG21 VAL A 90 16.727 -15.222 -24.842 1.00 0.00 H new ATOM 0 HG22 VAL A 90 17.732 -13.804 -25.223 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.459 -15.224 -24.435 1.00 0.00 H new ATOM 1141 N GLU A 91 20.448 -12.565 -23.783 1.00 0.00 N ATOM 1142 CA GLU A 91 21.348 -11.938 -24.743 1.00 0.00 C ATOM 1143 C GLU A 91 21.722 -12.980 -25.807 1.00 0.00 C ATOM 1144 O GLU A 91 22.343 -14.008 -25.489 1.00 0.00 O ATOM 1145 CB GLU A 91 22.605 -11.410 -24.001 1.00 0.00 C ATOM 1146 CG GLU A 91 23.637 -10.689 -24.895 1.00 0.00 C ATOM 1147 CD GLU A 91 24.818 -10.108 -24.095 1.00 0.00 C ATOM 1148 OE1 GLU A 91 24.609 -9.143 -23.326 1.00 0.00 O ATOM 1149 OE2 GLU A 91 25.951 -10.613 -24.216 1.00 0.00 O ATOM 0 H GLU A 91 20.918 -13.245 -23.186 1.00 0.00 H new ATOM 0 HA GLU A 91 20.867 -11.091 -25.232 1.00 0.00 H new ATOM 0 HB2 GLU A 91 22.284 -10.724 -23.217 1.00 0.00 H new ATOM 0 HB3 GLU A 91 23.097 -12.249 -23.509 1.00 0.00 H new ATOM 0 HG2 GLU A 91 24.018 -11.389 -25.639 1.00 0.00 H new ATOM 0 HG3 GLU A 91 23.141 -9.884 -25.438 1.00 0.00 H new ATOM 1156 N PHE A 92 21.291 -12.738 -27.050 1.00 0.00 N ATOM 1157 CA PHE A 92 21.603 -13.601 -28.191 1.00 0.00 C ATOM 1158 C PHE A 92 22.983 -13.211 -28.740 1.00 0.00 C ATOM 1159 O PHE A 92 23.160 -12.097 -29.236 1.00 0.00 O ATOM 1160 CB PHE A 92 20.517 -13.452 -29.286 1.00 0.00 C ATOM 1161 CG PHE A 92 19.093 -13.795 -28.821 1.00 0.00 C ATOM 1162 CD1 PHE A 92 18.250 -12.830 -28.271 1.00 0.00 C ATOM 1163 CD2 PHE A 92 18.597 -15.087 -28.952 1.00 0.00 C ATOM 1164 CE1 PHE A 92 16.968 -13.153 -27.867 1.00 0.00 C ATOM 1165 CE2 PHE A 92 17.318 -15.408 -28.545 1.00 0.00 C ATOM 1166 CZ PHE A 92 16.500 -14.441 -28.007 1.00 0.00 C ATOM 0 H PHE A 92 20.713 -11.933 -27.292 1.00 0.00 H new ATOM 0 HA PHE A 92 21.620 -14.644 -27.875 1.00 0.00 H new ATOM 0 HB2 PHE A 92 20.528 -12.426 -29.654 1.00 0.00 H new ATOM 0 HB3 PHE A 92 20.776 -14.095 -30.127 1.00 0.00 H new ATOM 0 HD1 PHE A 92 18.604 -11.816 -28.159 1.00 0.00 H new ATOM 0 HD2 PHE A 92 19.225 -15.854 -29.381 1.00 0.00 H new ATOM 0 HE1 PHE A 92 16.331 -12.393 -27.440 1.00 0.00 H new ATOM 0 HE2 PHE A 92 16.958 -16.421 -28.649 1.00 0.00 H new ATOM 0 HZ PHE A 92 15.496 -14.691 -27.696 1.00 0.00 H new ATOM 1176 N ASN A 93 23.945 -14.129 -28.624 1.00 0.00 N ATOM 1177 CA ASN A 93 25.337 -13.926 -29.061 1.00 0.00 C ATOM 1178 C ASN A 93 25.546 -14.617 -30.407 1.00 0.00 C ATOM 1179 O ASN A 93 25.282 -15.813 -30.539 1.00 0.00 O ATOM 1180 CB ASN A 93 26.322 -14.503 -28.008 1.00 0.00 C ATOM 1181 CG ASN A 93 26.187 -13.877 -26.614 1.00 0.00 C ATOM 1182 OD1 ASN A 93 26.337 -14.560 -25.600 1.00 0.00 O ATOM 1183 ND2 ASN A 93 25.962 -12.570 -26.548 1.00 0.00 N ATOM 0 H ASN A 93 23.781 -15.050 -28.218 1.00 0.00 H new ATOM 0 HA ASN A 93 25.530 -12.858 -29.165 1.00 0.00 H new ATOM 0 HB2 ASN A 93 26.163 -15.578 -27.928 1.00 0.00 H new ATOM 0 HB3 ASN A 93 27.342 -14.357 -28.363 1.00 0.00 H new ATOM 0 HD21 ASN A 93 25.910 -12.107 -25.641 1.00 0.00 H new ATOM 0 HD22 ASN A 93 25.842 -12.029 -27.405 1.00 0.00 H new ATOM 1190 N LEU A 94 26.006 -13.861 -31.408 1.00 0.00 N ATOM 1191 CA LEU A 94 26.252 -14.380 -32.759 1.00 0.00 C ATOM 1192 C LEU A 94 27.757 -14.582 -32.955 1.00 0.00 C ATOM 1193 O LEU A 94 28.555 -13.792 -32.430 1.00 0.00 O ATOM 1194 CB LEU A 94 25.704 -13.413 -33.838 1.00 0.00 C ATOM 1195 CG LEU A 94 24.225 -12.962 -33.672 1.00 0.00 C ATOM 1196 CD1 LEU A 94 23.757 -12.133 -34.880 1.00 0.00 C ATOM 1197 CD2 LEU A 94 23.282 -14.139 -33.417 1.00 0.00 C ATOM 0 H LEU A 94 26.219 -12.869 -31.305 1.00 0.00 H new ATOM 0 HA LEU A 94 25.732 -15.332 -32.867 1.00 0.00 H new ATOM 0 HB2 LEU A 94 26.334 -12.523 -33.851 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.808 -13.892 -34.812 1.00 0.00 H new ATOM 0 HG LEU A 94 24.188 -12.327 -32.787 1.00 0.00 H new ATOM 0 HD11 LEU A 94 22.719 -11.832 -34.735 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.382 -11.245 -34.976 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.837 -12.733 -35.786 1.00 0.00 H new ATOM 0 HD21 LEU A 94 22.262 -13.771 -33.308 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.330 -14.832 -34.257 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.581 -14.654 -32.504 1.00 0.00 H new ATOM 1209 N PRO A 95 28.174 -15.625 -33.722 1.00 0.00 N ATOM 1210 CA PRO A 95 29.592 -15.866 -34.037 1.00 0.00 C ATOM 1211 C PRO A 95 30.077 -14.970 -35.203 1.00 0.00 C ATOM 1212 O PRO A 95 29.406 -13.998 -35.588 1.00 0.00 O ATOM 1213 CB PRO A 95 29.587 -17.359 -34.423 1.00 0.00 C ATOM 1214 CG PRO A 95 28.269 -17.549 -35.099 1.00 0.00 C ATOM 1215 CD PRO A 95 27.294 -16.647 -34.360 1.00 0.00 C ATOM 0 HA PRO A 95 30.271 -15.631 -33.217 1.00 0.00 H new ATOM 0 HB2 PRO A 95 30.416 -17.603 -35.087 1.00 0.00 H new ATOM 0 HB3 PRO A 95 29.682 -17.999 -33.546 1.00 0.00 H new ATOM 0 HG2 PRO A 95 28.328 -17.281 -36.154 1.00 0.00 H new ATOM 0 HG3 PRO A 95 27.951 -18.591 -35.052 1.00 0.00 H new ATOM 0 HD2 PRO A 95 26.577 -16.189 -35.041 1.00 0.00 H new ATOM 0 HD3 PRO A 95 26.720 -17.201 -33.617 1.00 0.00 H new ATOM 1223 N GLY A 96 31.249 -15.311 -35.739 1.00 0.00 N ATOM 1224 CA GLY A 96 31.814 -14.632 -36.893 1.00 0.00 C ATOM 1225 C GLY A 96 32.615 -15.586 -37.754 1.00 0.00 C ATOM 1226 O GLY A 96 32.458 -16.803 -37.661 1.00 0.00 O ATOM 0 H GLY A 96 31.831 -16.068 -35.380 1.00 0.00 H new ATOM 0 HA2 GLY A 96 31.013 -14.189 -37.485 1.00 0.00 H new ATOM 0 HA3 GLY A 96 32.454 -13.815 -36.560 1.00 0.00 H new ATOM 1230 N GLU A 97 33.472 -15.007 -38.600 1.00 0.00 N ATOM 1231 CA GLU A 97 34.428 -15.752 -39.444 1.00 0.00 C ATOM 1232 C GLU A 97 35.468 -16.515 -38.582 1.00 0.00 C ATOM 1233 O GLU A 97 36.048 -17.506 -39.022 1.00 0.00 O ATOM 1234 CB GLU A 97 35.118 -14.758 -40.410 1.00 0.00 C ATOM 1235 CG GLU A 97 35.770 -13.551 -39.710 1.00 0.00 C ATOM 1236 CD GLU A 97 36.328 -12.519 -40.694 1.00 0.00 C ATOM 1237 OE1 GLU A 97 35.537 -11.707 -41.218 1.00 0.00 O ATOM 1238 OE2 GLU A 97 37.551 -12.531 -40.966 1.00 0.00 O ATOM 0 H GLU A 97 33.527 -13.996 -38.724 1.00 0.00 H new ATOM 0 HA GLU A 97 33.890 -16.504 -40.022 1.00 0.00 H new ATOM 0 HB2 GLU A 97 35.881 -15.290 -40.978 1.00 0.00 H new ATOM 0 HB3 GLU A 97 34.382 -14.395 -41.127 1.00 0.00 H new ATOM 0 HG2 GLU A 97 35.034 -13.070 -39.066 1.00 0.00 H new ATOM 0 HG3 GLU A 97 36.575 -13.903 -39.066 1.00 0.00 H new ATOM 1245 N ASN A 98 35.664 -16.037 -37.338 1.00 0.00 N ATOM 1246 CA ASN A 98 36.558 -16.665 -36.336 1.00 0.00 C ATOM 1247 C ASN A 98 35.931 -17.952 -35.743 1.00 0.00 C ATOM 1248 O ASN A 98 36.581 -18.667 -34.984 1.00 0.00 O ATOM 1249 CB ASN A 98 36.872 -15.648 -35.204 1.00 0.00 C ATOM 1250 CG ASN A 98 37.547 -14.371 -35.715 1.00 0.00 C ATOM 1251 OD1 ASN A 98 36.874 -13.426 -36.120 1.00 0.00 O ATOM 1252 ND2 ASN A 98 38.870 -14.331 -35.705 1.00 0.00 N ATOM 0 H ASN A 98 35.203 -15.195 -36.993 1.00 0.00 H new ATOM 0 HA ASN A 98 37.484 -16.950 -36.836 1.00 0.00 H new ATOM 0 HB2 ASN A 98 35.946 -15.383 -34.694 1.00 0.00 H new ATOM 0 HB3 ASN A 98 37.518 -16.123 -34.466 1.00 0.00 H new ATOM 0 HD21 ASN A 98 39.358 -13.500 -36.039 1.00 0.00 H new ATOM 0 HD22 ASN A 98 39.402 -15.131 -35.363 1.00 0.00 H new ATOM 1259 N ASN A 99 34.651 -18.216 -36.081 1.00 0.00 N ATOM 1260 CA ASN A 99 33.921 -19.436 -35.677 1.00 0.00 C ATOM 1261 C ASN A 99 33.268 -20.067 -36.915 1.00 0.00 C ATOM 1262 O ASN A 99 32.180 -19.647 -37.328 1.00 0.00 O ATOM 1263 CB ASN A 99 32.848 -19.110 -34.597 1.00 0.00 C ATOM 1264 CG ASN A 99 33.443 -18.883 -33.211 1.00 0.00 C ATOM 1265 OD1 ASN A 99 33.479 -19.791 -32.382 1.00 0.00 O ATOM 1266 ND2 ASN A 99 33.966 -17.691 -32.971 1.00 0.00 N ATOM 0 H ASN A 99 34.090 -17.581 -36.648 1.00 0.00 H new ATOM 0 HA ASN A 99 34.625 -20.144 -35.239 1.00 0.00 H new ATOM 0 HB2 ASN A 99 32.296 -18.220 -34.899 1.00 0.00 H new ATOM 0 HB3 ASN A 99 32.130 -19.929 -34.548 1.00 0.00 H new ATOM 0 HD21 ASN A 99 34.417 -17.503 -32.076 1.00 0.00 H new ATOM 0 HD22 ASN A 99 33.918 -16.961 -33.681 1.00 0.00 H new ATOM 1273 N GLU A 100 33.945 -21.076 -37.505 1.00 0.00 N ATOM 1274 CA GLU A 100 33.457 -21.784 -38.712 1.00 0.00 C ATOM 1275 C GLU A 100 32.188 -22.623 -38.420 1.00 0.00 C ATOM 1276 O GLU A 100 31.469 -23.003 -39.352 1.00 0.00 O ATOM 1277 CB GLU A 100 34.574 -22.686 -39.305 1.00 0.00 C ATOM 1278 CG GLU A 100 35.796 -21.917 -39.849 1.00 0.00 C ATOM 1279 CD GLU A 100 36.820 -22.837 -40.535 1.00 0.00 C ATOM 1280 OE1 GLU A 100 36.577 -23.259 -41.685 1.00 0.00 O ATOM 1281 OE2 GLU A 100 37.870 -23.141 -39.935 1.00 0.00 O ATOM 0 H GLU A 100 34.841 -21.422 -37.161 1.00 0.00 H new ATOM 0 HA GLU A 100 33.187 -21.024 -39.445 1.00 0.00 H new ATOM 0 HB2 GLU A 100 34.911 -23.380 -38.534 1.00 0.00 H new ATOM 0 HB3 GLU A 100 34.150 -23.286 -40.110 1.00 0.00 H new ATOM 0 HG2 GLU A 100 35.458 -21.163 -40.560 1.00 0.00 H new ATOM 0 HG3 GLU A 100 36.281 -21.388 -39.029 1.00 0.00 H new ATOM 1288 N ALA A 101 31.939 -22.899 -37.120 1.00 0.00 N ATOM 1289 CA ALA A 101 30.748 -23.631 -36.652 1.00 0.00 C ATOM 1290 C ALA A 101 29.456 -22.879 -37.015 1.00 0.00 C ATOM 1291 O ALA A 101 28.470 -23.500 -37.431 1.00 0.00 O ATOM 1292 CB ALA A 101 30.839 -23.865 -35.136 1.00 0.00 C ATOM 0 H ALA A 101 32.564 -22.617 -36.365 1.00 0.00 H new ATOM 0 HA ALA A 101 30.716 -24.598 -37.155 1.00 0.00 H new ATOM 0 HB1 ALA A 101 29.955 -24.406 -34.798 1.00 0.00 H new ATOM 0 HB2 ALA A 101 31.731 -24.450 -34.911 1.00 0.00 H new ATOM 0 HB3 ALA A 101 30.895 -22.905 -34.622 1.00 0.00 H new ATOM 1298 N GLY A 102 29.499 -21.539 -36.877 1.00 0.00 N ATOM 1299 CA GLY A 102 28.392 -20.673 -37.280 1.00 0.00 C ATOM 1300 C GLY A 102 27.096 -20.955 -36.521 1.00 0.00 C ATOM 1301 O GLY A 102 26.064 -21.260 -37.134 1.00 0.00 O ATOM 0 H GLY A 102 30.297 -21.038 -36.486 1.00 0.00 H new ATOM 0 HA2 GLY A 102 28.678 -19.633 -37.123 1.00 0.00 H new ATOM 0 HA3 GLY A 102 28.213 -20.797 -38.348 1.00 0.00 H new ATOM 1305 N GLN A 103 27.159 -20.910 -35.179 1.00 0.00 N ATOM 1306 CA GLN A 103 25.989 -21.150 -34.311 1.00 0.00 C ATOM 1307 C GLN A 103 25.813 -20.004 -33.310 1.00 0.00 C ATOM 1308 O GLN A 103 26.791 -19.469 -32.786 1.00 0.00 O ATOM 1309 CB GLN A 103 26.108 -22.501 -33.558 1.00 0.00 C ATOM 1310 CG GLN A 103 26.204 -23.737 -34.479 1.00 0.00 C ATOM 1311 CD GLN A 103 26.020 -25.074 -33.756 1.00 0.00 C ATOM 1312 OE1 GLN A 103 25.154 -25.112 -32.746 1.00 0.00 O flip ATOM 1313 NE2 GLN A 103 26.613 -26.079 -34.142 1.00 0.00 N flip ATOM 0 H GLN A 103 28.017 -20.707 -34.666 1.00 0.00 H new ATOM 0 HA GLN A 103 25.110 -21.196 -34.953 1.00 0.00 H new ATOM 0 HB2 GLN A 103 26.990 -22.470 -32.918 1.00 0.00 H new ATOM 0 HB3 GLN A 103 25.244 -22.616 -32.904 1.00 0.00 H new ATOM 0 HG2 GLN A 103 25.450 -23.653 -35.261 1.00 0.00 H new ATOM 0 HG3 GLN A 103 27.176 -23.734 -34.972 1.00 0.00 H new ATOM 0 HE21 GLN A 103 27.271 -26.016 -34.919 1.00 0.00 H new ATOM 0 HE22 GLN A 103 26.447 -26.976 -33.685 1.00 0.00 H new ATOM 1322 N VAL A 104 24.547 -19.640 -33.081 1.00 0.00 N ATOM 1323 CA VAL A 104 24.132 -18.619 -32.117 1.00 0.00 C ATOM 1324 C VAL A 104 24.089 -19.208 -30.697 1.00 0.00 C ATOM 1325 O VAL A 104 23.448 -20.237 -30.469 1.00 0.00 O ATOM 1326 CB VAL A 104 22.712 -18.069 -32.512 1.00 0.00 C ATOM 1327 CG1 VAL A 104 22.173 -17.015 -31.509 1.00 0.00 C ATOM 1328 CG2 VAL A 104 22.734 -17.530 -33.955 1.00 0.00 C ATOM 0 H VAL A 104 23.761 -20.061 -33.576 1.00 0.00 H new ATOM 0 HA VAL A 104 24.855 -17.803 -32.132 1.00 0.00 H new ATOM 0 HB VAL A 104 22.013 -18.904 -32.464 1.00 0.00 H new ATOM 0 HG11 VAL A 104 21.191 -16.672 -31.834 1.00 0.00 H new ATOM 0 HG12 VAL A 104 22.092 -17.463 -30.519 1.00 0.00 H new ATOM 0 HG13 VAL A 104 22.858 -16.168 -31.469 1.00 0.00 H new ATOM 0 HG21 VAL A 104 21.746 -17.152 -34.217 1.00 0.00 H new ATOM 0 HG22 VAL A 104 23.463 -16.723 -34.031 1.00 0.00 H new ATOM 0 HG23 VAL A 104 23.009 -18.333 -34.639 1.00 0.00 H new ATOM 1338 N ILE A 105 24.775 -18.544 -29.758 1.00 0.00 N ATOM 1339 CA ILE A 105 24.789 -18.932 -28.339 1.00 0.00 C ATOM 1340 C ILE A 105 23.857 -17.979 -27.578 1.00 0.00 C ATOM 1341 O ILE A 105 24.154 -16.791 -27.446 1.00 0.00 O ATOM 1342 CB ILE A 105 26.245 -18.892 -27.707 1.00 0.00 C ATOM 1343 CG1 ILE A 105 27.208 -19.954 -28.358 1.00 0.00 C ATOM 1344 CG2 ILE A 105 26.194 -19.091 -26.166 1.00 0.00 C ATOM 1345 CD1 ILE A 105 27.676 -19.653 -29.772 1.00 0.00 C ATOM 0 H ILE A 105 25.339 -17.719 -29.961 1.00 0.00 H new ATOM 0 HA ILE A 105 24.448 -19.964 -28.259 1.00 0.00 H new ATOM 0 HB ILE A 105 26.649 -17.903 -27.922 1.00 0.00 H new ATOM 0 HG12 ILE A 105 28.086 -20.057 -27.721 1.00 0.00 H new ATOM 0 HG13 ILE A 105 26.702 -20.919 -28.362 1.00 0.00 H new ATOM 0 HG21 ILE A 105 27.206 -19.059 -25.761 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.598 -18.297 -25.716 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.743 -20.057 -25.939 1.00 0.00 H new ATOM 0 HD11 ILE A 105 28.333 -20.452 -30.116 1.00 0.00 H new ATOM 0 HD12 ILE A 105 26.813 -19.583 -30.434 1.00 0.00 H new ATOM 0 HD13 ILE A 105 28.219 -18.708 -29.782 1.00 0.00 H new ATOM 1357 N VAL A 106 22.721 -18.495 -27.104 1.00 0.00 N ATOM 1358 CA VAL A 106 21.739 -17.701 -26.352 1.00 0.00 C ATOM 1359 C VAL A 106 22.040 -17.816 -24.842 1.00 0.00 C ATOM 1360 O VAL A 106 22.364 -18.908 -24.342 1.00 0.00 O ATOM 1361 CB VAL A 106 20.264 -18.149 -26.686 1.00 0.00 C ATOM 1362 CG1 VAL A 106 20.039 -18.157 -28.216 1.00 0.00 C ATOM 1363 CG2 VAL A 106 19.920 -19.519 -26.079 1.00 0.00 C ATOM 0 H VAL A 106 22.454 -19.471 -27.228 1.00 0.00 H new ATOM 0 HA VAL A 106 21.823 -16.655 -26.648 1.00 0.00 H new ATOM 0 HB VAL A 106 19.592 -17.422 -26.231 1.00 0.00 H new ATOM 0 HG11 VAL A 106 19.017 -18.468 -28.432 1.00 0.00 H new ATOM 0 HG12 VAL A 106 20.205 -17.156 -28.613 1.00 0.00 H new ATOM 0 HG13 VAL A 106 20.736 -18.853 -28.683 1.00 0.00 H new ATOM 0 HG21 VAL A 106 18.894 -19.784 -26.336 1.00 0.00 H new ATOM 0 HG22 VAL A 106 20.600 -20.273 -26.475 1.00 0.00 H new ATOM 0 HG23 VAL A 106 20.021 -19.472 -24.995 1.00 0.00 H new ATOM 1373 N ARG A 107 21.968 -16.675 -24.138 1.00 0.00 N ATOM 1374 CA ARG A 107 22.304 -16.584 -22.706 1.00 0.00 C ATOM 1375 C ARG A 107 21.116 -15.997 -21.927 1.00 0.00 C ATOM 1376 O ARG A 107 20.985 -14.776 -21.835 1.00 0.00 O ATOM 1377 CB ARG A 107 23.573 -15.693 -22.536 1.00 0.00 C ATOM 1378 CG ARG A 107 24.117 -15.578 -21.093 1.00 0.00 C ATOM 1379 CD ARG A 107 24.635 -16.909 -20.547 1.00 0.00 C ATOM 1380 NE ARG A 107 25.201 -16.765 -19.193 1.00 0.00 N ATOM 1381 CZ ARG A 107 26.061 -17.625 -18.618 1.00 0.00 C ATOM 1382 NH1 ARG A 107 26.488 -18.702 -19.269 1.00 0.00 N ATOM 1383 NH2 ARG A 107 26.499 -17.403 -17.390 1.00 0.00 N ATOM 0 H ARG A 107 21.675 -15.787 -24.546 1.00 0.00 H new ATOM 0 HA ARG A 107 22.513 -17.578 -22.309 1.00 0.00 H new ATOM 0 HB2 ARG A 107 24.363 -16.091 -23.173 1.00 0.00 H new ATOM 0 HB3 ARG A 107 23.344 -14.692 -22.900 1.00 0.00 H new ATOM 0 HG2 ARG A 107 24.922 -14.843 -21.071 1.00 0.00 H new ATOM 0 HG3 ARG A 107 23.327 -15.206 -20.441 1.00 0.00 H new ATOM 0 HD2 ARG A 107 23.821 -17.634 -20.525 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.397 -17.305 -21.219 1.00 0.00 H new ATOM 0 HE ARG A 107 24.918 -15.949 -18.650 1.00 0.00 H new ATOM 0 HH11 ARG A 107 26.164 -18.886 -20.218 1.00 0.00 H new ATOM 0 HH12 ARG A 107 27.140 -19.345 -18.819 1.00 0.00 H new ATOM 0 HH21 ARG A 107 26.185 -16.579 -16.878 1.00 0.00 H new ATOM 0 HH22 ARG A 107 27.151 -18.056 -16.955 1.00 0.00 H new ATOM 1397 N VAL A 108 20.254 -16.869 -21.370 1.00 0.00 N ATOM 1398 CA VAL A 108 19.068 -16.440 -20.596 1.00 0.00 C ATOM 1399 C VAL A 108 19.400 -16.549 -19.089 1.00 0.00 C ATOM 1400 O VAL A 108 19.351 -17.637 -18.517 1.00 0.00 O ATOM 1401 CB VAL A 108 17.798 -17.337 -20.926 1.00 0.00 C ATOM 1402 CG1 VAL A 108 16.503 -16.720 -20.358 1.00 0.00 C ATOM 1403 CG2 VAL A 108 17.671 -17.622 -22.440 1.00 0.00 C ATOM 0 H VAL A 108 20.356 -17.881 -21.441 1.00 0.00 H new ATOM 0 HA VAL A 108 18.827 -15.412 -20.867 1.00 0.00 H new ATOM 0 HB VAL A 108 17.949 -18.296 -20.430 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.656 -17.361 -20.604 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.588 -16.630 -19.275 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.349 -15.733 -20.794 1.00 0.00 H new ATOM 0 HG21 VAL A 108 16.790 -18.238 -22.622 1.00 0.00 H new ATOM 0 HG22 VAL A 108 17.573 -16.681 -22.981 1.00 0.00 H new ATOM 0 HG23 VAL A 108 18.560 -18.149 -22.787 1.00 0.00 H new ATOM 1413 N SER A 109 19.707 -15.413 -18.449 1.00 0.00 N ATOM 1414 CA SER A 109 20.179 -15.369 -17.050 1.00 0.00 C ATOM 1415 C SER A 109 19.211 -14.559 -16.178 1.00 0.00 C ATOM 1416 O SER A 109 18.675 -13.538 -16.626 1.00 0.00 O ATOM 1417 CB SER A 109 21.605 -14.766 -17.003 1.00 0.00 C ATOM 1418 OG SER A 109 21.663 -13.505 -17.664 1.00 0.00 O ATOM 0 H SER A 109 19.636 -14.493 -18.884 1.00 0.00 H new ATOM 0 HA SER A 109 20.213 -16.383 -16.652 1.00 0.00 H new ATOM 0 HB2 SER A 109 21.917 -14.648 -15.965 1.00 0.00 H new ATOM 0 HB3 SER A 109 22.308 -15.455 -17.471 1.00 0.00 H new ATOM 0 HG SER A 109 22.576 -13.151 -17.615 1.00 0.00 H new ATOM 1424 N LYS A 110 19.002 -15.029 -14.930 1.00 0.00 N ATOM 1425 CA LYS A 110 18.066 -14.417 -13.977 1.00 0.00 C ATOM 1426 C LYS A 110 18.458 -14.797 -12.538 1.00 0.00 C ATOM 1427 O LYS A 110 18.248 -15.945 -12.118 1.00 0.00 O ATOM 1428 CB LYS A 110 16.621 -14.874 -14.292 1.00 0.00 C ATOM 1429 CG LYS A 110 15.538 -14.278 -13.370 1.00 0.00 C ATOM 1430 CD LYS A 110 14.137 -14.826 -13.703 1.00 0.00 C ATOM 1431 CE LYS A 110 13.046 -14.264 -12.795 1.00 0.00 C ATOM 1432 NZ LYS A 110 11.731 -14.884 -13.079 1.00 0.00 N ATOM 0 H LYS A 110 19.483 -15.848 -14.558 1.00 0.00 H new ATOM 0 HA LYS A 110 18.113 -13.332 -14.071 1.00 0.00 H new ATOM 0 HB2 LYS A 110 16.387 -14.607 -15.323 1.00 0.00 H new ATOM 0 HB3 LYS A 110 16.576 -15.961 -14.226 1.00 0.00 H new ATOM 0 HG2 LYS A 110 15.780 -14.505 -12.332 1.00 0.00 H new ATOM 0 HG3 LYS A 110 15.536 -13.192 -13.467 1.00 0.00 H new ATOM 0 HD2 LYS A 110 13.897 -14.589 -14.740 1.00 0.00 H new ATOM 0 HD3 LYS A 110 14.148 -15.913 -13.619 1.00 0.00 H new ATOM 0 HE2 LYS A 110 13.314 -14.437 -11.753 1.00 0.00 H new ATOM 0 HE3 LYS A 110 12.978 -13.185 -12.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 11.258 -15.121 -12.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.141 -14.217 -13.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.869 -15.751 -13.637 1.00 0.00 H new ATOM 1446 N GLY A 111 19.037 -13.826 -11.806 1.00 0.00 N ATOM 1447 CA GLY A 111 19.446 -14.019 -10.414 1.00 0.00 C ATOM 1448 C GLY A 111 20.551 -15.068 -10.275 1.00 0.00 C ATOM 1449 O GLY A 111 21.681 -14.838 -10.713 1.00 0.00 O ATOM 0 H GLY A 111 19.231 -12.892 -12.167 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.795 -13.071 -10.005 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.582 -14.323 -9.822 1.00 0.00 H new ATOM 1453 N ASP A 112 20.199 -16.232 -9.705 1.00 0.00 N ATOM 1454 CA ASP A 112 21.127 -17.370 -9.513 1.00 0.00 C ATOM 1455 C ASP A 112 21.231 -18.224 -10.794 1.00 0.00 C ATOM 1456 O ASP A 112 22.221 -18.938 -10.998 1.00 0.00 O ATOM 1457 CB ASP A 112 20.644 -18.255 -8.328 1.00 0.00 C ATOM 1458 CG ASP A 112 19.283 -18.930 -8.591 1.00 0.00 C ATOM 1459 OD1 ASP A 112 18.247 -18.225 -8.606 1.00 0.00 O ATOM 1460 OD2 ASP A 112 19.237 -20.158 -8.815 1.00 0.00 O ATOM 0 H ASP A 112 19.257 -16.416 -9.360 1.00 0.00 H new ATOM 0 HA ASP A 112 22.115 -16.968 -9.288 1.00 0.00 H new ATOM 0 HB2 ASP A 112 21.391 -19.023 -8.128 1.00 0.00 H new ATOM 0 HB3 ASP A 112 20.571 -17.641 -7.430 1.00 0.00 H new ATOM 1465 N HIS A 113 20.192 -18.146 -11.646 1.00 0.00 N ATOM 1466 CA HIS A 113 20.079 -18.956 -12.868 1.00 0.00 C ATOM 1467 C HIS A 113 20.884 -18.342 -14.021 1.00 0.00 C ATOM 1468 O HIS A 113 21.029 -17.118 -14.126 1.00 0.00 O ATOM 1469 CB HIS A 113 18.587 -19.118 -13.287 1.00 0.00 C ATOM 1470 CG HIS A 113 17.885 -20.346 -12.759 1.00 0.00 C ATOM 1471 ND1 HIS A 113 17.876 -20.703 -11.431 1.00 0.00 N ATOM 1472 CD2 HIS A 113 17.189 -21.318 -13.407 1.00 0.00 C ATOM 1473 CE1 HIS A 113 17.194 -21.819 -11.282 1.00 0.00 C ATOM 1474 NE2 HIS A 113 16.768 -22.215 -12.465 1.00 0.00 N ATOM 0 H HIS A 113 19.404 -17.515 -11.503 1.00 0.00 H new ATOM 0 HA HIS A 113 20.493 -19.940 -12.648 1.00 0.00 H new ATOM 0 HB2 HIS A 113 18.038 -18.237 -12.953 1.00 0.00 H new ATOM 0 HB3 HIS A 113 18.535 -19.133 -14.376 1.00 0.00 H new ATOM 0 HD1 HIS A 113 18.328 -20.184 -10.678 1.00 0.00 H new ATOM 0 HD2 HIS A 113 17.003 -21.372 -14.470 1.00 0.00 H new ATOM 0 HE1 HIS A 113 17.013 -22.326 -10.346 1.00 0.00 H new ATOM 1483 N SER A 114 21.371 -19.227 -14.888 1.00 0.00 N ATOM 1484 CA SER A 114 22.038 -18.895 -16.140 1.00 0.00 C ATOM 1485 C SER A 114 21.863 -20.096 -17.085 1.00 0.00 C ATOM 1486 O SER A 114 22.565 -21.104 -16.966 1.00 0.00 O ATOM 1487 CB SER A 114 23.531 -18.557 -15.889 1.00 0.00 C ATOM 1488 OG SER A 114 24.179 -19.592 -15.165 1.00 0.00 O ATOM 0 H SER A 114 21.308 -20.233 -14.730 1.00 0.00 H new ATOM 0 HA SER A 114 21.599 -18.008 -16.596 1.00 0.00 H new ATOM 0 HB2 SER A 114 24.037 -18.405 -16.842 1.00 0.00 H new ATOM 0 HB3 SER A 114 23.606 -17.621 -15.336 1.00 0.00 H new ATOM 0 HG SER A 114 23.939 -20.460 -15.550 1.00 0.00 H new ATOM 1494 N GLU A 115 20.880 -19.988 -17.981 1.00 0.00 N ATOM 1495 CA GLU A 115 20.496 -21.036 -18.930 1.00 0.00 C ATOM 1496 C GLU A 115 21.066 -20.685 -20.309 1.00 0.00 C ATOM 1497 O GLU A 115 20.638 -19.709 -20.930 1.00 0.00 O ATOM 1498 CB GLU A 115 18.946 -21.167 -18.983 1.00 0.00 C ATOM 1499 CG GLU A 115 18.268 -21.490 -17.629 1.00 0.00 C ATOM 1500 CD GLU A 115 18.817 -22.756 -16.932 1.00 0.00 C ATOM 1501 OE1 GLU A 115 18.977 -23.802 -17.601 1.00 0.00 O ATOM 1502 OE2 GLU A 115 19.094 -22.706 -15.718 1.00 0.00 O ATOM 0 H GLU A 115 20.313 -19.145 -18.069 1.00 0.00 H new ATOM 0 HA GLU A 115 20.900 -21.997 -18.611 1.00 0.00 H new ATOM 0 HB2 GLU A 115 18.531 -20.235 -19.366 1.00 0.00 H new ATOM 0 HB3 GLU A 115 18.687 -21.949 -19.697 1.00 0.00 H new ATOM 0 HG2 GLU A 115 18.392 -20.638 -16.961 1.00 0.00 H new ATOM 0 HG3 GLU A 115 17.197 -21.614 -17.792 1.00 0.00 H new ATOM 1509 N THR A 116 22.041 -21.475 -20.770 1.00 0.00 N ATOM 1510 CA THR A 116 22.756 -21.226 -22.024 1.00 0.00 C ATOM 1511 C THR A 116 22.505 -22.388 -22.999 1.00 0.00 C ATOM 1512 O THR A 116 22.572 -23.564 -22.606 1.00 0.00 O ATOM 1513 CB THR A 116 24.289 -21.049 -21.754 1.00 0.00 C ATOM 1514 OG1 THR A 116 24.485 -20.151 -20.650 1.00 0.00 O ATOM 1515 CG2 THR A 116 25.036 -20.495 -22.978 1.00 0.00 C ATOM 0 H THR A 116 22.358 -22.311 -20.279 1.00 0.00 H new ATOM 0 HA THR A 116 22.385 -20.304 -22.471 1.00 0.00 H new ATOM 0 HB THR A 116 24.692 -22.036 -21.528 1.00 0.00 H new ATOM 0 HG1 THR A 116 24.822 -20.651 -19.877 1.00 0.00 H new ATOM 0 HG21 THR A 116 26.095 -20.390 -22.741 1.00 0.00 H new ATOM 0 HG22 THR A 116 24.918 -21.180 -23.817 1.00 0.00 H new ATOM 0 HG23 THR A 116 24.626 -19.521 -23.245 1.00 0.00 H new ATOM 1523 N ARG A 117 22.204 -22.057 -24.266 1.00 0.00 N ATOM 1524 CA ARG A 117 21.914 -23.065 -25.315 1.00 0.00 C ATOM 1525 C ARG A 117 22.530 -22.606 -26.647 1.00 0.00 C ATOM 1526 O ARG A 117 22.911 -21.433 -26.788 1.00 0.00 O ATOM 1527 CB ARG A 117 20.375 -23.254 -25.468 1.00 0.00 C ATOM 1528 CG ARG A 117 19.905 -24.651 -25.966 1.00 0.00 C ATOM 1529 CD ARG A 117 19.856 -25.687 -24.833 1.00 0.00 C ATOM 1530 NE ARG A 117 19.284 -26.974 -25.265 1.00 0.00 N ATOM 1531 CZ ARG A 117 19.052 -28.020 -24.456 1.00 0.00 C ATOM 1532 NH1 ARG A 117 19.419 -27.978 -23.179 1.00 0.00 N ATOM 1533 NH2 ARG A 117 18.451 -29.106 -24.927 1.00 0.00 N ATOM 0 H ARG A 117 22.154 -21.093 -24.596 1.00 0.00 H new ATOM 0 HA ARG A 117 22.351 -24.021 -25.028 1.00 0.00 H new ATOM 0 HB2 ARG A 117 19.907 -23.058 -24.503 1.00 0.00 H new ATOM 0 HB3 ARG A 117 20.004 -22.499 -26.161 1.00 0.00 H new ATOM 0 HG2 ARG A 117 18.916 -24.560 -26.416 1.00 0.00 H new ATOM 0 HG3 ARG A 117 20.579 -25.002 -26.747 1.00 0.00 H new ATOM 0 HD2 ARG A 117 20.864 -25.851 -24.452 1.00 0.00 H new ATOM 0 HD3 ARG A 117 19.265 -25.290 -24.008 1.00 0.00 H new ATOM 0 HE ARG A 117 19.047 -27.078 -26.252 1.00 0.00 H new ATOM 0 HH11 ARG A 117 19.880 -27.147 -22.808 1.00 0.00 H new ATOM 0 HH12 ARG A 117 19.239 -28.776 -22.570 1.00 0.00 H new ATOM 0 HH21 ARG A 117 18.165 -29.147 -25.905 1.00 0.00 H new ATOM 0 HH22 ARG A 117 18.276 -29.900 -24.311 1.00 0.00 H new ATOM 1547 N GLU A 118 22.618 -23.526 -27.625 1.00 0.00 N ATOM 1548 CA GLU A 118 23.158 -23.235 -28.965 1.00 0.00 C ATOM 1549 C GLU A 118 22.148 -23.653 -30.049 1.00 0.00 C ATOM 1550 O GLU A 118 21.536 -24.721 -29.967 1.00 0.00 O ATOM 1551 CB GLU A 118 24.515 -23.958 -29.172 1.00 0.00 C ATOM 1552 CG GLU A 118 25.598 -23.568 -28.144 1.00 0.00 C ATOM 1553 CD GLU A 118 26.914 -24.332 -28.334 1.00 0.00 C ATOM 1554 OE1 GLU A 118 26.933 -25.559 -28.099 1.00 0.00 O ATOM 1555 OE2 GLU A 118 27.937 -23.718 -28.711 1.00 0.00 O ATOM 0 H GLU A 118 22.316 -24.493 -27.508 1.00 0.00 H new ATOM 0 HA GLU A 118 23.328 -22.161 -29.047 1.00 0.00 H new ATOM 0 HB2 GLU A 118 24.352 -25.035 -29.122 1.00 0.00 H new ATOM 0 HB3 GLU A 118 24.883 -23.737 -30.174 1.00 0.00 H new ATOM 0 HG2 GLU A 118 25.792 -22.498 -28.219 1.00 0.00 H new ATOM 0 HG3 GLU A 118 25.219 -23.754 -27.139 1.00 0.00 H new ATOM 1562 N ILE A 119 21.991 -22.776 -31.045 1.00 0.00 N ATOM 1563 CA ILE A 119 21.137 -22.970 -32.236 1.00 0.00 C ATOM 1564 C ILE A 119 21.947 -22.593 -33.493 1.00 0.00 C ATOM 1565 O ILE A 119 22.894 -21.823 -33.377 1.00 0.00 O ATOM 1566 CB ILE A 119 19.820 -22.086 -32.165 1.00 0.00 C ATOM 1567 CG1 ILE A 119 20.147 -20.626 -31.713 1.00 0.00 C ATOM 1568 CG2 ILE A 119 18.751 -22.736 -31.263 1.00 0.00 C ATOM 1569 CD1 ILE A 119 18.960 -19.679 -31.661 1.00 0.00 C ATOM 0 H ILE A 119 22.470 -21.876 -31.051 1.00 0.00 H new ATOM 0 HA ILE A 119 20.830 -24.015 -32.276 1.00 0.00 H new ATOM 0 HB ILE A 119 19.401 -22.033 -33.170 1.00 0.00 H new ATOM 0 HG12 ILE A 119 20.604 -20.664 -30.724 1.00 0.00 H new ATOM 0 HG13 ILE A 119 20.892 -20.211 -32.393 1.00 0.00 H new ATOM 0 HG21 ILE A 119 17.863 -22.104 -31.237 1.00 0.00 H new ATOM 0 HG22 ILE A 119 18.487 -23.716 -31.660 1.00 0.00 H new ATOM 0 HG23 ILE A 119 19.146 -22.848 -30.253 1.00 0.00 H new ATOM 0 HD11 ILE A 119 19.295 -18.694 -31.336 1.00 0.00 H new ATOM 0 HD12 ILE A 119 18.512 -19.602 -32.652 1.00 0.00 H new ATOM 0 HD13 ILE A 119 18.220 -20.061 -30.957 1.00 0.00 H new ATOM 1581 N PRO A 120 21.623 -23.151 -34.703 1.00 0.00 N ATOM 1582 CA PRO A 120 22.260 -22.718 -35.976 1.00 0.00 C ATOM 1583 C PRO A 120 22.071 -21.198 -36.254 1.00 0.00 C ATOM 1584 O PRO A 120 21.049 -20.610 -35.864 1.00 0.00 O ATOM 1585 CB PRO A 120 21.557 -23.594 -37.059 1.00 0.00 C ATOM 1586 CG PRO A 120 20.340 -24.172 -36.391 1.00 0.00 C ATOM 1587 CD PRO A 120 20.674 -24.276 -34.922 1.00 0.00 C ATOM 0 HA PRO A 120 23.342 -22.852 -35.958 1.00 0.00 H new ATOM 0 HB2 PRO A 120 21.280 -22.995 -37.927 1.00 0.00 H new ATOM 0 HB3 PRO A 120 22.220 -24.383 -37.415 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.470 -23.534 -36.548 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.097 -25.151 -36.805 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.784 -24.178 -34.300 1.00 0.00 H new ATOM 0 HD3 PRO A 120 21.128 -25.237 -34.680 1.00 0.00 H new ATOM 1595 N LEU A 121 23.076 -20.575 -36.916 1.00 0.00 N ATOM 1596 CA LEU A 121 23.036 -19.136 -37.279 1.00 0.00 C ATOM 1597 C LEU A 121 21.926 -18.904 -38.313 1.00 0.00 C ATOM 1598 O LEU A 121 21.142 -17.964 -38.175 1.00 0.00 O ATOM 1599 CB LEU A 121 24.433 -18.656 -37.823 1.00 0.00 C ATOM 1600 CG LEU A 121 24.758 -17.106 -37.818 1.00 0.00 C ATOM 1601 CD1 LEU A 121 26.251 -16.854 -38.143 1.00 0.00 C ATOM 1602 CD2 LEU A 121 23.869 -16.288 -38.790 1.00 0.00 C ATOM 0 H LEU A 121 23.929 -21.049 -37.211 1.00 0.00 H new ATOM 0 HA LEU A 121 22.816 -18.546 -36.389 1.00 0.00 H new ATOM 0 HB2 LEU A 121 25.205 -19.158 -37.240 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.528 -19.011 -38.849 1.00 0.00 H new ATOM 0 HG LEU A 121 24.535 -16.759 -36.809 1.00 0.00 H new ATOM 0 HD11 LEU A 121 26.450 -15.782 -38.134 1.00 0.00 H new ATOM 0 HD12 LEU A 121 26.874 -17.345 -37.395 1.00 0.00 H new ATOM 0 HD13 LEU A 121 26.482 -17.257 -39.129 1.00 0.00 H new ATOM 0 HD21 LEU A 121 24.145 -15.235 -38.736 1.00 0.00 H new ATOM 0 HD22 LEU A 121 24.015 -16.650 -39.808 1.00 0.00 H new ATOM 0 HD23 LEU A 121 22.822 -16.404 -38.510 1.00 0.00 H new ATOM 1614 N ALA A 122 21.871 -19.804 -39.319 1.00 0.00 N ATOM 1615 CA ALA A 122 20.948 -19.717 -40.463 1.00 0.00 C ATOM 1616 C ALA A 122 19.495 -19.579 -39.997 1.00 0.00 C ATOM 1617 O ALA A 122 18.796 -18.661 -40.432 1.00 0.00 O ATOM 1618 CB ALA A 122 21.115 -20.945 -41.379 1.00 0.00 C ATOM 0 H ALA A 122 22.478 -20.623 -39.356 1.00 0.00 H new ATOM 0 HA ALA A 122 21.197 -18.821 -41.032 1.00 0.00 H new ATOM 0 HB1 ALA A 122 20.427 -20.868 -42.221 1.00 0.00 H new ATOM 0 HB2 ALA A 122 22.139 -20.985 -41.750 1.00 0.00 H new ATOM 0 HB3 ALA A 122 20.898 -21.852 -40.815 1.00 0.00 H new ATOM 1624 N SER A 123 19.087 -20.468 -39.061 1.00 0.00 N ATOM 1625 CA SER A 123 17.714 -20.501 -38.526 1.00 0.00 C ATOM 1626 C SER A 123 17.370 -19.187 -37.818 1.00 0.00 C ATOM 1627 O SER A 123 16.402 -18.522 -38.194 1.00 0.00 O ATOM 1628 CB SER A 123 17.521 -21.688 -37.559 1.00 0.00 C ATOM 1629 OG SER A 123 18.410 -21.617 -36.456 1.00 0.00 O ATOM 0 H SER A 123 19.700 -21.177 -38.660 1.00 0.00 H new ATOM 0 HA SER A 123 17.037 -20.630 -39.370 1.00 0.00 H new ATOM 0 HB2 SER A 123 16.493 -21.699 -37.197 1.00 0.00 H new ATOM 0 HB3 SER A 123 17.680 -22.624 -38.095 1.00 0.00 H new ATOM 0 HG SER A 123 19.285 -21.300 -36.761 1.00 0.00 H new ATOM 1635 N PHE A 124 18.210 -18.817 -36.823 1.00 0.00 N ATOM 1636 CA PHE A 124 18.040 -17.596 -36.021 1.00 0.00 C ATOM 1637 C PHE A 124 17.905 -16.360 -36.915 1.00 0.00 C ATOM 1638 O PHE A 124 17.015 -15.526 -36.699 1.00 0.00 O ATOM 1639 CB PHE A 124 19.239 -17.411 -35.039 1.00 0.00 C ATOM 1640 CG PHE A 124 19.206 -16.088 -34.243 1.00 0.00 C ATOM 1641 CD1 PHE A 124 18.507 -15.995 -33.044 1.00 0.00 C ATOM 1642 CD2 PHE A 124 19.841 -14.931 -34.722 1.00 0.00 C ATOM 1643 CE1 PHE A 124 18.443 -14.801 -32.352 1.00 0.00 C ATOM 1644 CE2 PHE A 124 19.776 -13.742 -34.024 1.00 0.00 C ATOM 1645 CZ PHE A 124 19.076 -13.676 -32.840 1.00 0.00 C ATOM 0 H PHE A 124 19.028 -19.365 -36.557 1.00 0.00 H new ATOM 0 HA PHE A 124 17.122 -17.706 -35.444 1.00 0.00 H new ATOM 0 HB2 PHE A 124 19.251 -18.244 -34.337 1.00 0.00 H new ATOM 0 HB3 PHE A 124 20.169 -17.458 -35.606 1.00 0.00 H new ATOM 0 HD1 PHE A 124 18.008 -16.867 -32.649 1.00 0.00 H new ATOM 0 HD2 PHE A 124 20.389 -14.972 -35.652 1.00 0.00 H new ATOM 0 HE1 PHE A 124 17.894 -14.748 -31.423 1.00 0.00 H new ATOM 0 HE2 PHE A 124 20.274 -12.863 -34.406 1.00 0.00 H new ATOM 0 HZ PHE A 124 19.022 -12.746 -32.294 1.00 0.00 H new ATOM 1655 N GLU A 125 18.803 -16.260 -37.913 1.00 0.00 N ATOM 1656 CA GLU A 125 18.920 -15.064 -38.741 1.00 0.00 C ATOM 1657 C GLU A 125 17.674 -14.901 -39.609 1.00 0.00 C ATOM 1658 O GLU A 125 17.058 -13.848 -39.572 1.00 0.00 O ATOM 1659 CB GLU A 125 20.192 -15.062 -39.636 1.00 0.00 C ATOM 1660 CG GLU A 125 20.495 -13.670 -40.253 1.00 0.00 C ATOM 1661 CD GLU A 125 21.538 -13.670 -41.379 1.00 0.00 C ATOM 1662 OE1 GLU A 125 22.677 -14.117 -41.156 1.00 0.00 O ATOM 1663 OE2 GLU A 125 21.220 -13.190 -42.490 1.00 0.00 O ATOM 0 H GLU A 125 19.458 -17.002 -38.159 1.00 0.00 H new ATOM 0 HA GLU A 125 19.013 -14.220 -38.057 1.00 0.00 H new ATOM 0 HB2 GLU A 125 21.048 -15.385 -39.043 1.00 0.00 H new ATOM 0 HB3 GLU A 125 20.067 -15.790 -40.438 1.00 0.00 H new ATOM 0 HG2 GLU A 125 19.566 -13.251 -40.639 1.00 0.00 H new ATOM 0 HG3 GLU A 125 20.839 -13.006 -39.460 1.00 0.00 H new ATOM 1670 N LYS A 126 17.298 -15.966 -40.361 1.00 0.00 N ATOM 1671 CA LYS A 126 16.145 -15.910 -41.297 1.00 0.00 C ATOM 1672 C LYS A 126 14.821 -15.686 -40.548 1.00 0.00 C ATOM 1673 O LYS A 126 13.894 -15.081 -41.096 1.00 0.00 O ATOM 1674 CB LYS A 126 16.092 -17.157 -42.247 1.00 0.00 C ATOM 1675 CG LYS A 126 15.969 -18.569 -41.602 1.00 0.00 C ATOM 1676 CD LYS A 126 14.553 -18.941 -41.100 1.00 0.00 C ATOM 1677 CE LYS A 126 14.455 -20.396 -40.611 1.00 0.00 C ATOM 1678 NZ LYS A 126 14.712 -21.358 -41.705 1.00 0.00 N ATOM 0 H LYS A 126 17.773 -16.869 -40.339 1.00 0.00 H new ATOM 0 HA LYS A 126 16.295 -15.044 -41.942 1.00 0.00 H new ATOM 0 HB2 LYS A 126 15.247 -17.025 -42.923 1.00 0.00 H new ATOM 0 HB3 LYS A 126 16.994 -17.148 -42.859 1.00 0.00 H new ATOM 0 HG2 LYS A 126 16.286 -19.314 -42.332 1.00 0.00 H new ATOM 0 HG3 LYS A 126 16.662 -18.630 -40.763 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.273 -18.270 -40.288 1.00 0.00 H new ATOM 0 HD3 LYS A 126 13.835 -18.784 -41.905 1.00 0.00 H new ATOM 0 HE2 LYS A 126 15.172 -20.559 -39.807 1.00 0.00 H new ATOM 0 HE3 LYS A 126 13.464 -20.574 -40.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 14.410 -22.308 -41.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 14.178 -21.073 -42.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 15.728 -21.370 -41.925 1.00 0.00 H new ATOM 1692 N ILE A 127 14.745 -16.192 -39.300 1.00 0.00 N ATOM 1693 CA ILE A 127 13.611 -15.939 -38.395 1.00 0.00 C ATOM 1694 C ILE A 127 13.547 -14.436 -38.056 1.00 0.00 C ATOM 1695 O ILE A 127 12.494 -13.812 -38.175 1.00 0.00 O ATOM 1696 CB ILE A 127 13.720 -16.797 -37.067 1.00 0.00 C ATOM 1697 CG1 ILE A 127 13.434 -18.315 -37.326 1.00 0.00 C ATOM 1698 CG2 ILE A 127 12.795 -16.251 -35.956 1.00 0.00 C ATOM 1699 CD1 ILE A 127 12.016 -18.642 -37.766 1.00 0.00 C ATOM 0 H ILE A 127 15.468 -16.786 -38.894 1.00 0.00 H new ATOM 0 HA ILE A 127 12.695 -16.239 -38.904 1.00 0.00 H new ATOM 0 HB ILE A 127 14.750 -16.707 -36.722 1.00 0.00 H new ATOM 0 HG12 ILE A 127 14.125 -18.673 -38.089 1.00 0.00 H new ATOM 0 HG13 ILE A 127 13.651 -18.870 -36.413 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.898 -16.866 -35.062 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.073 -15.223 -35.724 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.760 -16.279 -36.298 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.921 -19.717 -37.919 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.313 -18.322 -36.997 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.795 -18.122 -38.698 1.00 0.00 H new ATOM 1711 N CYS A 128 14.701 -13.875 -37.658 1.00 0.00 N ATOM 1712 CA CYS A 128 14.820 -12.467 -37.253 1.00 0.00 C ATOM 1713 C CYS A 128 14.594 -11.530 -38.458 1.00 0.00 C ATOM 1714 O CYS A 128 14.069 -10.429 -38.298 1.00 0.00 O ATOM 1715 CB CYS A 128 16.196 -12.214 -36.614 1.00 0.00 C ATOM 1716 SG CYS A 128 16.398 -10.561 -35.917 1.00 0.00 S ATOM 0 H CYS A 128 15.581 -14.389 -37.608 1.00 0.00 H new ATOM 0 HA CYS A 128 14.049 -12.252 -36.513 1.00 0.00 H new ATOM 0 HB2 CYS A 128 16.359 -12.950 -35.827 1.00 0.00 H new ATOM 0 HB3 CYS A 128 16.968 -12.375 -37.366 1.00 0.00 H new ATOM 0 HG CYS A 128 17.587 -10.449 -35.403 1.00 0.00 H new ATOM 1722 N ARG A 129 14.974 -12.003 -39.672 1.00 0.00 N ATOM 1723 CA ARG A 129 14.717 -11.288 -40.944 1.00 0.00 C ATOM 1724 C ARG A 129 13.205 -11.248 -41.187 1.00 0.00 C ATOM 1725 O ARG A 129 12.648 -10.203 -41.510 1.00 0.00 O ATOM 1726 CB ARG A 129 15.411 -11.985 -42.157 1.00 0.00 C ATOM 1727 CG ARG A 129 16.951 -12.053 -42.105 1.00 0.00 C ATOM 1728 CD ARG A 129 17.640 -10.679 -42.123 1.00 0.00 C ATOM 1729 NE ARG A 129 19.112 -10.827 -42.154 1.00 0.00 N ATOM 1730 CZ ARG A 129 19.986 -9.907 -42.594 1.00 0.00 C ATOM 1731 NH1 ARG A 129 19.572 -8.723 -43.039 1.00 0.00 N ATOM 1732 NH2 ARG A 129 21.284 -10.187 -42.600 1.00 0.00 N ATOM 0 H ARG A 129 15.466 -12.888 -39.794 1.00 0.00 H new ATOM 0 HA ARG A 129 15.128 -10.282 -40.858 1.00 0.00 H new ATOM 0 HB2 ARG A 129 15.024 -13.001 -42.237 1.00 0.00 H new ATOM 0 HB3 ARG A 129 15.120 -11.461 -43.067 1.00 0.00 H new ATOM 0 HG2 ARG A 129 17.250 -12.586 -41.203 1.00 0.00 H new ATOM 0 HG3 ARG A 129 17.307 -12.637 -42.953 1.00 0.00 H new ATOM 0 HD2 ARG A 129 17.309 -10.113 -42.994 1.00 0.00 H new ATOM 0 HD3 ARG A 129 17.346 -10.109 -41.242 1.00 0.00 H new ATOM 0 HE ARG A 129 19.497 -11.707 -41.810 1.00 0.00 H new ATOM 0 HH11 ARG A 129 18.576 -8.502 -43.050 1.00 0.00 H new ATOM 0 HH12 ARG A 129 20.250 -8.037 -43.369 1.00 0.00 H new ATOM 0 HH21 ARG A 129 21.611 -11.096 -42.272 1.00 0.00 H new ATOM 0 HH22 ARG A 129 21.954 -9.493 -42.933 1.00 0.00 H new ATOM 1746 N ALA A 130 12.561 -12.416 -40.977 1.00 0.00 N ATOM 1747 CA ALA A 130 11.107 -12.585 -41.129 1.00 0.00 C ATOM 1748 C ALA A 130 10.347 -11.692 -40.139 1.00 0.00 C ATOM 1749 O ALA A 130 9.288 -11.199 -40.466 1.00 0.00 O ATOM 1750 CB ALA A 130 10.706 -14.060 -40.953 1.00 0.00 C ATOM 0 H ALA A 130 13.041 -13.271 -40.696 1.00 0.00 H new ATOM 0 HA ALA A 130 10.835 -12.278 -42.139 1.00 0.00 H new ATOM 0 HB1 ALA A 130 9.627 -14.160 -41.070 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.210 -14.666 -41.705 1.00 0.00 H new ATOM 0 HB3 ALA A 130 10.997 -14.400 -39.959 1.00 0.00 H new ATOM 1756 N LEU A 131 10.909 -11.478 -38.933 1.00 0.00 N ATOM 1757 CA LEU A 131 10.320 -10.556 -37.935 1.00 0.00 C ATOM 1758 C LEU A 131 10.413 -9.110 -38.444 1.00 0.00 C ATOM 1759 O LEU A 131 9.424 -8.378 -38.441 1.00 0.00 O ATOM 1760 CB LEU A 131 11.017 -10.699 -36.552 1.00 0.00 C ATOM 1761 CG LEU A 131 10.900 -12.103 -35.872 1.00 0.00 C ATOM 1762 CD1 LEU A 131 11.560 -12.115 -34.470 1.00 0.00 C ATOM 1763 CD2 LEU A 131 9.426 -12.572 -35.807 1.00 0.00 C ATOM 0 H LEU A 131 11.770 -11.930 -38.624 1.00 0.00 H new ATOM 0 HA LEU A 131 9.271 -10.819 -37.801 1.00 0.00 H new ATOM 0 HB2 LEU A 131 12.074 -10.462 -36.673 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.598 -9.953 -35.876 1.00 0.00 H new ATOM 0 HG LEU A 131 11.447 -12.814 -36.492 1.00 0.00 H new ATOM 0 HD11 LEU A 131 11.459 -13.107 -34.029 1.00 0.00 H new ATOM 0 HD12 LEU A 131 12.617 -11.865 -34.563 1.00 0.00 H new ATOM 0 HD13 LEU A 131 11.069 -11.381 -33.830 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.376 -13.551 -35.329 1.00 0.00 H new ATOM 0 HD22 LEU A 131 8.842 -11.856 -35.229 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.021 -12.640 -36.817 1.00 0.00 H new ATOM 1775 N LEU A 132 11.610 -8.751 -38.939 1.00 0.00 N ATOM 1776 CA LEU A 132 11.908 -7.412 -39.479 1.00 0.00 C ATOM 1777 C LEU A 132 11.041 -7.082 -40.707 1.00 0.00 C ATOM 1778 O LEU A 132 10.760 -5.924 -40.955 1.00 0.00 O ATOM 1779 CB LEU A 132 13.420 -7.303 -39.838 1.00 0.00 C ATOM 1780 CG LEU A 132 14.401 -7.289 -38.621 1.00 0.00 C ATOM 1781 CD1 LEU A 132 15.883 -7.392 -39.067 1.00 0.00 C ATOM 1782 CD2 LEU A 132 14.158 -6.040 -37.738 1.00 0.00 C ATOM 0 H LEU A 132 12.406 -9.388 -38.976 1.00 0.00 H new ATOM 0 HA LEU A 132 11.668 -6.683 -38.705 1.00 0.00 H new ATOM 0 HB2 LEU A 132 13.683 -8.140 -40.485 1.00 0.00 H new ATOM 0 HB3 LEU A 132 13.573 -6.392 -40.417 1.00 0.00 H new ATOM 0 HG LEU A 132 14.194 -8.175 -38.020 1.00 0.00 H new ATOM 0 HD11 LEU A 132 16.529 -7.379 -38.189 1.00 0.00 H new ATOM 0 HD12 LEU A 132 16.034 -8.322 -39.615 1.00 0.00 H new ATOM 0 HD13 LEU A 132 16.129 -6.548 -39.711 1.00 0.00 H new ATOM 0 HD21 LEU A 132 14.851 -6.049 -36.896 1.00 0.00 H new ATOM 0 HD22 LEU A 132 14.318 -5.139 -38.330 1.00 0.00 H new ATOM 0 HD23 LEU A 132 13.134 -6.052 -37.365 1.00 0.00 H new ATOM 1794 N PHE A 133 10.636 -8.108 -41.476 1.00 0.00 N ATOM 1795 CA PHE A 133 9.832 -7.916 -42.700 1.00 0.00 C ATOM 1796 C PHE A 133 8.315 -7.947 -42.390 1.00 0.00 C ATOM 1797 O PHE A 133 7.553 -7.104 -42.882 1.00 0.00 O ATOM 1798 CB PHE A 133 10.210 -8.981 -43.780 1.00 0.00 C ATOM 1799 CG PHE A 133 11.697 -9.002 -44.200 1.00 0.00 C ATOM 1800 CD1 PHE A 133 12.535 -7.896 -43.995 1.00 0.00 C ATOM 1801 CD2 PHE A 133 12.257 -10.139 -44.788 1.00 0.00 C ATOM 1802 CE1 PHE A 133 13.865 -7.934 -44.357 1.00 0.00 C ATOM 1803 CE2 PHE A 133 13.594 -10.170 -45.156 1.00 0.00 C ATOM 1804 CZ PHE A 133 14.397 -9.067 -44.938 1.00 0.00 C ATOM 0 H PHE A 133 10.853 -9.084 -41.272 1.00 0.00 H new ATOM 0 HA PHE A 133 10.062 -6.929 -43.101 1.00 0.00 H new ATOM 0 HB2 PHE A 133 9.943 -9.968 -43.401 1.00 0.00 H new ATOM 0 HB3 PHE A 133 9.602 -8.805 -44.667 1.00 0.00 H new ATOM 0 HD1 PHE A 133 12.132 -7.000 -43.546 1.00 0.00 H new ATOM 0 HD2 PHE A 133 11.639 -11.008 -44.959 1.00 0.00 H new ATOM 0 HE1 PHE A 133 14.493 -7.073 -44.185 1.00 0.00 H new ATOM 0 HE2 PHE A 133 14.008 -11.057 -45.613 1.00 0.00 H new ATOM 0 HZ PHE A 133 15.439 -9.091 -45.222 1.00 0.00 H new ATOM 1814 N ARG A 134 7.899 -8.904 -41.539 1.00 0.00 N ATOM 1815 CA ARG A 134 6.471 -9.172 -41.214 1.00 0.00 C ATOM 1816 C ARG A 134 5.943 -8.266 -40.083 1.00 0.00 C ATOM 1817 O ARG A 134 4.741 -8.298 -39.783 1.00 0.00 O ATOM 1818 CB ARG A 134 6.261 -10.668 -40.844 1.00 0.00 C ATOM 1819 CG ARG A 134 6.595 -11.658 -41.987 1.00 0.00 C ATOM 1820 CD ARG A 134 6.259 -13.112 -41.621 1.00 0.00 C ATOM 1821 NE ARG A 134 4.813 -13.300 -41.399 1.00 0.00 N ATOM 1822 CZ ARG A 134 4.229 -14.440 -40.998 1.00 0.00 C ATOM 1823 NH1 ARG A 134 4.944 -15.537 -40.766 1.00 0.00 N ATOM 1824 NH2 ARG A 134 2.916 -14.479 -40.833 1.00 0.00 N ATOM 0 H ARG A 134 8.545 -9.523 -41.049 1.00 0.00 H new ATOM 0 HA ARG A 134 5.897 -8.940 -42.111 1.00 0.00 H new ATOM 0 HB2 ARG A 134 6.880 -10.907 -39.979 1.00 0.00 H new ATOM 0 HB3 ARG A 134 5.223 -10.814 -40.544 1.00 0.00 H new ATOM 0 HG2 ARG A 134 6.042 -11.375 -42.882 1.00 0.00 H new ATOM 0 HG3 ARG A 134 7.655 -11.583 -42.230 1.00 0.00 H new ATOM 0 HD2 ARG A 134 6.593 -13.775 -42.419 1.00 0.00 H new ATOM 0 HD3 ARG A 134 6.805 -13.396 -40.721 1.00 0.00 H new ATOM 0 HE ARG A 134 4.206 -12.497 -41.564 1.00 0.00 H new ATOM 0 HH11 ARG A 134 5.956 -15.522 -40.892 1.00 0.00 H new ATOM 0 HH12 ARG A 134 4.480 -16.393 -40.462 1.00 0.00 H new ATOM 0 HH21 ARG A 134 2.355 -13.646 -41.010 1.00 0.00 H new ATOM 0 HH22 ARG A 134 2.466 -15.342 -40.528 1.00 0.00 H new ATOM 1838 N CYS A 135 6.846 -7.468 -39.457 1.00 0.00 N ATOM 1839 CA CYS A 135 6.493 -6.497 -38.380 1.00 0.00 C ATOM 1840 C CYS A 135 5.394 -5.479 -38.802 1.00 0.00 C ATOM 1841 O CYS A 135 4.842 -4.762 -37.952 1.00 0.00 O ATOM 1842 CB CYS A 135 7.761 -5.744 -37.917 1.00 0.00 C ATOM 1843 SG CYS A 135 7.526 -4.720 -36.448 1.00 0.00 S ATOM 0 H CYS A 135 7.841 -7.477 -39.682 1.00 0.00 H new ATOM 0 HA CYS A 135 6.077 -7.079 -37.558 1.00 0.00 H new ATOM 0 HB2 CYS A 135 8.548 -6.471 -37.716 1.00 0.00 H new ATOM 0 HB3 CYS A 135 8.112 -5.112 -38.733 1.00 0.00 H new ATOM 0 HG CYS A 135 6.283 -4.347 -36.373 1.00 0.00 H new ATOM 1849 N GLU A 136 5.113 -5.419 -40.121 1.00 0.00 N ATOM 1850 CA GLU A 136 4.000 -4.643 -40.705 1.00 0.00 C ATOM 1851 C GLU A 136 2.646 -5.054 -40.086 1.00 0.00 C ATOM 1852 O GLU A 136 1.892 -4.207 -39.591 1.00 0.00 O ATOM 1853 CB GLU A 136 3.957 -4.861 -42.252 1.00 0.00 C ATOM 1854 CG GLU A 136 5.271 -4.558 -42.994 1.00 0.00 C ATOM 1855 CD GLU A 136 5.704 -3.090 -42.873 1.00 0.00 C ATOM 1856 OE1 GLU A 136 6.303 -2.720 -41.850 1.00 0.00 O ATOM 1857 OE2 GLU A 136 5.429 -2.298 -43.792 1.00 0.00 O ATOM 0 H GLU A 136 5.663 -5.917 -40.821 1.00 0.00 H new ATOM 0 HA GLU A 136 4.171 -3.589 -40.486 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.678 -5.896 -42.449 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.170 -4.233 -42.669 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.060 -5.198 -42.599 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.153 -4.811 -44.048 1.00 0.00 H new