USER MOD reduce.3.24.130724 H: found=0, std=0, add=1163, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1167 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 156 THR OG1 : rot 180:sc= -0.0449 USER MOD Set 1.2: A 157 THR OG1 : rot 129:sc= 0.596 USER MOD Set 2.1: A 81 ASN : amide:sc= 0.0897 K(o=0.09,f=-6.2!) USER MOD Set 2.2: A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -162:sc= -0.0824 (180deg=-0.553) USER MOD Single : A 18 MET CE :methyl 165:sc= -0.454 (180deg=-0.766) USER MOD Single : A 22 GLN :FLIP amide:sc= -0.0949 F(o=-1.2!,f=-0.095) USER MOD Single : A 26 THR OG1 : rot -26:sc= 0.0423 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 163:sc= -0.0641 (180deg=-0.412) USER MOD Single : A 38 GLN : amide:sc= 0.31 X(o=0.31,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.37 K(o=-1.4,f=-7.8!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 180:sc= -0.778 USER MOD Single : A 62 CYS SG : rot -147:sc= -3.03 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.103 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -2.23! X(o=-2.2!,f=-1.8) USER MOD Single : A 77 ASN : amide:sc= -3.37! C(o=-3.4!,f=-6.8!) USER MOD Single : A 80 HIS : no HD1:sc= -1.77 X(o=-1.8,f=-2.2!) USER MOD Single : A 83 LYS NZ :NH3+ -178:sc= 0.27 (180deg=0.268) USER MOD Single : A 88 MET CE :methyl -160:sc= -0.19 (180deg=-0.877) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 90 HIS : no HE2:sc= 0.0923 K(o=0.092,f=-1.4) USER MOD Single : A 93 GLN : amide:sc= -0.0223 K(o=-0.022,f=-0.82) USER MOD Single : A 94 MET CE :methyl -152:sc= -0.23 (180deg=-2.57) USER MOD Single : A 95 LYS NZ :NH3+ 167:sc=-0.00213 (180deg=-0.153) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ -175:sc= -2.38 (180deg=-2.56) USER MOD Single : A 114 MET CE :methyl 129:sc= -0.17 (180deg=-0.837) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -158:sc= -0.0211 (180deg=-0.249) USER MOD Single : A 118 LYS NZ :NH3+ 166:sc= -0.0128 (180deg=-0.232) USER MOD Single : A 119 CYS SG : rot 88:sc= 0.951 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 MET CE :methyl -147:sc= -0.604 (180deg=-2.65) USER MOD Single : A 129 SER OG : rot -97:sc= 1.21 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.0806 X(o=-0.081,f=-0.55) USER MOD Single : A 137 CYS SG : rot 31:sc=-0.00865 USER MOD Single : A 147 SER OG : rot 180:sc= -0.0678 USER MOD Single : A 150 CYS SG : rot -48:sc= -1.04 USER MOD Single : A 154 THR OG1 : rot -110:sc= 0.65 USER MOD Single : A 160 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 162 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 163 THR OG1 : rot 180:sc= 0 USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 MET CE :methyl 144:sc= -0.993 (180deg=-3.77!) USER MOD Single : A 169 HIS :FLIP no HD1:sc= 0.00965 F(o=-1.6,f=0.0097) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 214 N ILE A 16 30.010 16.124 7.173 1.00 4.74 N ATOM 215 CA ILE A 16 29.114 15.523 6.191 1.00 4.26 C ATOM 216 C ILE A 16 29.871 15.114 4.926 1.00 3.73 C ATOM 217 O ILE A 16 30.876 15.728 4.562 1.00 3.57 O ATOM 218 CB ILE A 16 27.952 16.485 5.833 1.00 4.00 C ATOM 219 CG1 ILE A 16 26.600 15.780 6.005 1.00 4.44 C ATOM 220 CG2 ILE A 16 28.094 17.036 4.418 1.00 3.10 C ATOM 221 CD1 ILE A 16 26.419 14.564 5.119 1.00 4.12 C ATOM 0 HA ILE A 16 28.692 14.625 6.642 1.00 4.26 H new ATOM 0 HB ILE A 16 27.997 17.330 6.520 1.00 4.00 H new ATOM 0 HG12 ILE A 16 26.490 15.477 7.046 1.00 4.44 H new ATOM 0 HG13 ILE A 16 25.802 16.492 5.794 1.00 4.44 H new ATOM 0 HG21 ILE A 16 27.262 17.706 4.203 1.00 3.10 H new ATOM 0 HG22 ILE A 16 29.032 17.584 4.334 1.00 3.10 H new ATOM 0 HG23 ILE A 16 28.090 16.212 3.705 1.00 3.10 H new ATOM 0 HD11 ILE A 16 25.439 14.124 5.301 1.00 4.12 H new ATOM 0 HD12 ILE A 16 26.494 14.861 4.073 1.00 4.12 H new ATOM 0 HD13 ILE A 16 27.194 13.831 5.345 1.00 4.12 H new ATOM 233 N LYS A 17 29.365 14.080 4.259 1.00 3.63 N ATOM 234 CA LYS A 17 29.972 13.568 3.035 1.00 3.33 C ATOM 235 C LYS A 17 28.949 13.570 1.902 1.00 2.84 C ATOM 236 O LYS A 17 27.830 13.087 2.068 1.00 3.10 O ATOM 237 CB LYS A 17 30.496 12.148 3.270 1.00 3.97 C ATOM 238 CG LYS A 17 31.072 11.484 2.030 1.00 4.67 C ATOM 239 CD LYS A 17 32.413 12.085 1.642 1.00 5.07 C ATOM 240 CE LYS A 17 33.030 11.346 0.467 1.00 5.85 C ATOM 241 NZ LYS A 17 33.189 9.892 0.748 1.00 6.09 N ATOM 0 H LYS A 17 28.527 13.576 4.550 1.00 3.63 H new ATOM 0 HA LYS A 17 30.806 14.212 2.755 1.00 3.33 H new ATOM 0 HB2 LYS A 17 31.265 12.179 4.042 1.00 3.97 H new ATOM 0 HB3 LYS A 17 29.683 11.532 3.654 1.00 3.97 H new ATOM 0 HG2 LYS A 17 31.191 10.416 2.211 1.00 4.67 H new ATOM 0 HG3 LYS A 17 30.372 11.591 1.201 1.00 4.67 H new ATOM 0 HD2 LYS A 17 32.282 13.136 1.385 1.00 5.07 H new ATOM 0 HD3 LYS A 17 33.091 12.047 2.495 1.00 5.07 H new ATOM 0 HE2 LYS A 17 32.404 11.479 -0.415 1.00 5.85 H new ATOM 0 HE3 LYS A 17 34.003 11.780 0.236 1.00 5.85 H new ATOM 0 HZ1 LYS A 17 33.871 9.482 0.078 1.00 6.09 H new ATOM 0 HZ2 LYS A 17 33.537 9.762 1.719 1.00 6.09 H new ATOM 0 HZ3 LYS A 17 32.271 9.416 0.643 1.00 6.09 H new ATOM 255 N MET A 18 29.335 14.117 0.750 1.00 2.38 N ATOM 256 CA MET A 18 28.432 14.191 -0.392 1.00 2.12 C ATOM 257 C MET A 18 29.066 13.634 -1.661 1.00 2.26 C ATOM 258 O MET A 18 30.269 13.757 -1.884 1.00 2.37 O ATOM 259 CB MET A 18 27.987 15.630 -0.629 1.00 1.82 C ATOM 260 CG MET A 18 27.279 16.250 0.565 1.00 2.03 C ATOM 261 SD MET A 18 26.552 17.857 0.189 1.00 2.43 S ATOM 262 CE MET A 18 25.286 17.394 -0.989 1.00 3.14 C ATOM 0 H MET A 18 30.261 14.512 0.586 1.00 2.38 H new ATOM 0 HA MET A 18 27.565 13.576 -0.153 1.00 2.12 H new ATOM 0 HB2 MET A 18 28.859 16.235 -0.879 1.00 1.82 H new ATOM 0 HB3 MET A 18 27.321 15.659 -1.491 1.00 1.82 H new ATOM 0 HG2 MET A 18 26.496 15.574 0.909 1.00 2.03 H new ATOM 0 HG3 MET A 18 27.988 16.360 1.385 1.00 2.03 H new ATOM 0 HE1 MET A 18 24.585 18.219 -1.113 1.00 3.14 H new ATOM 0 HE2 MET A 18 25.749 17.164 -1.949 1.00 3.14 H new ATOM 0 HE3 MET A 18 24.753 16.516 -0.624 1.00 3.14 H new ATOM 272 N PHE A 19 28.227 13.015 -2.479 1.00 2.46 N ATOM 273 CA PHE A 19 28.648 12.427 -3.741 1.00 2.77 C ATOM 274 C PHE A 19 27.770 12.932 -4.892 1.00 2.74 C ATOM 275 O PHE A 19 26.544 12.915 -4.798 1.00 2.74 O ATOM 276 CB PHE A 19 28.564 10.905 -3.631 1.00 3.31 C ATOM 277 CG PHE A 19 28.669 10.194 -4.950 1.00 3.72 C ATOM 278 CD1 PHE A 19 29.878 10.132 -5.625 1.00 4.18 C ATOM 279 CD2 PHE A 19 27.558 9.588 -5.514 1.00 3.78 C ATOM 280 CE1 PHE A 19 29.976 9.480 -6.839 1.00 4.66 C ATOM 281 CE2 PHE A 19 27.650 8.935 -6.728 1.00 4.26 C ATOM 282 CZ PHE A 19 28.861 8.880 -7.391 1.00 4.68 C ATOM 0 H PHE A 19 27.232 12.906 -2.285 1.00 2.46 H new ATOM 0 HA PHE A 19 29.676 12.721 -3.953 1.00 2.77 H new ATOM 0 HB2 PHE A 19 29.360 10.553 -2.975 1.00 3.31 H new ATOM 0 HB3 PHE A 19 27.619 10.636 -3.158 1.00 3.31 H new ATOM 0 HD1 PHE A 19 30.753 10.599 -5.197 1.00 4.18 H new ATOM 0 HD2 PHE A 19 26.610 9.627 -4.999 1.00 3.78 H new ATOM 0 HE1 PHE A 19 30.923 9.439 -7.356 1.00 4.66 H new ATOM 0 HE2 PHE A 19 26.776 8.468 -7.158 1.00 4.26 H new ATOM 0 HZ PHE A 19 28.936 8.369 -8.339 1.00 4.68 H new ATOM 292 N VAL A 20 28.394 13.367 -5.984 1.00 2.86 N ATOM 293 CA VAL A 20 27.639 13.874 -7.130 1.00 3.00 C ATOM 294 C VAL A 20 27.989 13.127 -8.412 1.00 3.64 C ATOM 295 O VAL A 20 29.125 12.692 -8.608 1.00 3.85 O ATOM 296 CB VAL A 20 27.856 15.384 -7.365 1.00 2.66 C ATOM 297 CG1 VAL A 20 27.897 16.148 -6.054 1.00 2.37 C ATOM 298 CG2 VAL A 20 29.112 15.630 -8.180 1.00 2.99 C ATOM 0 H VAL A 20 29.407 13.380 -6.101 1.00 2.86 H new ATOM 0 HA VAL A 20 26.591 13.706 -6.882 1.00 3.00 H new ATOM 0 HB VAL A 20 27.005 15.757 -7.935 1.00 2.66 H new ATOM 0 HG11 VAL A 20 28.051 17.208 -6.255 1.00 2.37 H new ATOM 0 HG12 VAL A 20 26.954 16.013 -5.524 1.00 2.37 H new ATOM 0 HG13 VAL A 20 28.715 15.773 -5.440 1.00 2.37 H new ATOM 0 HG21 VAL A 20 29.243 16.701 -8.332 1.00 2.99 H new ATOM 0 HG22 VAL A 20 29.975 15.231 -7.647 1.00 2.99 H new ATOM 0 HG23 VAL A 20 29.021 15.135 -9.147 1.00 2.99 H new ATOM 308 N GLY A 21 26.991 12.991 -9.278 1.00 3.97 N ATOM 309 CA GLY A 21 27.174 12.299 -10.539 1.00 4.60 C ATOM 310 C GLY A 21 26.702 13.124 -11.719 1.00 4.93 C ATOM 311 O GLY A 21 25.715 13.854 -11.617 1.00 4.85 O ATOM 0 H GLY A 21 26.049 13.352 -9.126 1.00 3.97 H new ATOM 0 HA2 GLY A 21 28.228 12.055 -10.668 1.00 4.60 H new ATOM 0 HA3 GLY A 21 26.629 11.356 -10.516 1.00 4.60 H new ATOM 315 N GLN A 22 27.414 13.016 -12.840 1.00 5.36 N ATOM 316 CA GLN A 22 27.061 13.750 -14.051 1.00 5.79 C ATOM 317 C GLN A 22 27.176 15.255 -13.825 1.00 5.48 C ATOM 318 O GLN A 22 26.375 16.039 -14.334 1.00 5.53 O ATOM 319 CB GLN A 22 25.644 13.386 -14.506 1.00 6.13 C ATOM 320 CG GLN A 22 25.319 13.856 -15.913 1.00 6.35 C ATOM 321 CD GLN A 22 26.127 13.137 -16.977 1.00 7.21 C ATOM 322 OE1 GLN A 22 26.473 11.881 -16.716 1.00 7.79 O flip ATOM 323 NE2 GLN A 22 26.432 13.702 -18.027 1.00 7.55 N flip ATOM 0 H GLN A 22 28.240 12.425 -12.933 1.00 5.36 H new ATOM 0 HA GLN A 22 27.762 13.467 -14.836 1.00 5.79 H new ATOM 0 HB2 GLN A 22 25.522 12.304 -14.456 1.00 6.13 H new ATOM 0 HB3 GLN A 22 24.925 13.821 -13.811 1.00 6.13 H new ATOM 0 HG2 GLN A 22 24.257 13.703 -16.105 1.00 6.35 H new ATOM 0 HG3 GLN A 22 25.505 14.928 -15.985 1.00 6.35 H new ATOM 0 HE21 GLN A 22 26.146 14.668 -18.188 1.00 7.55 H new ATOM 0 HE22 GLN A 22 26.970 13.204 -18.736 1.00 7.55 H new ATOM 332 N VAL A 23 28.178 15.649 -13.055 1.00 5.25 N ATOM 333 CA VAL A 23 28.416 17.056 -12.767 1.00 5.09 C ATOM 334 C VAL A 23 29.287 17.681 -13.853 1.00 5.64 C ATOM 335 O VAL A 23 30.264 17.074 -14.283 1.00 5.87 O ATOM 336 CB VAL A 23 29.109 17.231 -11.400 1.00 4.52 C ATOM 337 CG1 VAL A 23 30.348 16.356 -11.325 1.00 4.57 C ATOM 338 CG2 VAL A 23 29.468 18.690 -11.155 1.00 4.51 C ATOM 0 H VAL A 23 28.843 15.012 -12.616 1.00 5.25 H new ATOM 0 HA VAL A 23 27.448 17.557 -12.741 1.00 5.09 H new ATOM 0 HB VAL A 23 28.414 16.921 -10.620 1.00 4.52 H new ATOM 0 HG11 VAL A 23 30.829 16.488 -10.356 1.00 4.57 H new ATOM 0 HG12 VAL A 23 30.064 15.311 -11.450 1.00 4.57 H new ATOM 0 HG13 VAL A 23 31.042 16.640 -12.116 1.00 4.57 H new ATOM 0 HG21 VAL A 23 29.955 18.787 -10.185 1.00 4.51 H new ATOM 0 HG22 VAL A 23 30.145 19.034 -11.937 1.00 4.51 H new ATOM 0 HG23 VAL A 23 28.561 19.295 -11.168 1.00 4.51 H new ATOM 348 N PRO A 24 28.940 18.893 -14.332 1.00 5.91 N ATOM 349 CA PRO A 24 29.724 19.579 -15.361 1.00 6.48 C ATOM 350 C PRO A 24 31.089 20.010 -14.834 1.00 6.48 C ATOM 351 O PRO A 24 31.326 21.191 -14.579 1.00 7.01 O ATOM 352 CB PRO A 24 28.868 20.799 -15.710 1.00 6.70 C ATOM 353 CG PRO A 24 28.036 21.037 -14.506 1.00 6.51 C ATOM 354 CD PRO A 24 27.760 19.680 -13.926 1.00 5.77 C ATOM 0 HA PRO A 24 29.933 18.940 -16.219 1.00 6.48 H new ATOM 0 HB2 PRO A 24 29.489 21.665 -15.939 1.00 6.70 H new ATOM 0 HB3 PRO A 24 28.249 20.610 -16.587 1.00 6.70 H new ATOM 0 HG2 PRO A 24 28.558 21.670 -13.789 1.00 6.51 H new ATOM 0 HG3 PRO A 24 27.109 21.547 -14.766 1.00 6.51 H new ATOM 0 HD2 PRO A 24 27.656 19.719 -12.842 1.00 5.77 H new ATOM 0 HD3 PRO A 24 26.837 19.254 -14.320 1.00 5.77 H new ATOM 362 N ARG A 25 31.985 19.039 -14.675 1.00 6.06 N ATOM 363 CA ARG A 25 33.324 19.307 -14.168 1.00 6.01 C ATOM 364 C ARG A 25 34.286 19.648 -15.301 1.00 6.40 C ATOM 365 O ARG A 25 35.505 19.616 -15.126 1.00 6.39 O ATOM 366 CB ARG A 25 33.845 18.101 -13.371 1.00 5.95 C ATOM 367 CG ARG A 25 33.402 16.748 -13.917 1.00 5.62 C ATOM 368 CD ARG A 25 33.899 16.525 -15.337 1.00 5.99 C ATOM 369 NE ARG A 25 35.308 16.874 -15.481 1.00 6.24 N ATOM 370 CZ ARG A 25 35.935 16.955 -16.652 1.00 6.85 C ATOM 371 NH1 ARG A 25 35.279 16.713 -17.779 1.00 7.30 N ATOM 372 NH2 ARG A 25 37.221 17.277 -16.695 1.00 7.24 N ATOM 0 H ARG A 25 31.805 18.058 -14.891 1.00 6.06 H new ATOM 0 HA ARG A 25 33.265 20.170 -13.505 1.00 6.01 H new ATOM 0 HB2 ARG A 25 34.934 18.134 -13.355 1.00 5.95 H new ATOM 0 HB3 ARG A 25 33.509 18.190 -12.338 1.00 5.95 H new ATOM 0 HG2 ARG A 25 33.777 15.954 -13.271 1.00 5.62 H new ATOM 0 HG3 ARG A 25 32.314 16.686 -13.898 1.00 5.62 H new ATOM 0 HD2 ARG A 25 33.754 15.481 -15.613 1.00 5.99 H new ATOM 0 HD3 ARG A 25 33.304 17.123 -16.028 1.00 5.99 H new ATOM 0 HE ARG A 25 35.844 17.067 -14.635 1.00 6.24 H new ATOM 0 HH11 ARG A 25 34.290 16.464 -17.750 1.00 7.30 H new ATOM 0 HH12 ARG A 25 35.763 16.776 -18.675 1.00 7.30 H new ATOM 0 HH21 ARG A 25 37.729 17.463 -15.830 1.00 7.24 H new ATOM 0 HH22 ARG A 25 37.701 17.339 -17.593 1.00 7.24 H new ATOM 386 N THR A 26 33.732 19.975 -16.466 1.00 6.80 N ATOM 387 CA THR A 26 34.542 20.325 -17.624 1.00 7.23 C ATOM 388 C THR A 26 35.226 21.669 -17.411 1.00 7.16 C ATOM 389 O THR A 26 36.184 22.012 -18.106 1.00 7.49 O ATOM 390 CB THR A 26 33.695 20.387 -18.908 1.00 7.59 C ATOM 391 OG1 THR A 26 34.516 20.759 -20.023 1.00 8.00 O ATOM 392 CG2 THR A 26 32.554 21.383 -18.759 1.00 7.42 C ATOM 0 H THR A 26 32.726 20.004 -16.631 1.00 6.80 H new ATOM 0 HA THR A 26 35.294 19.545 -17.740 1.00 7.23 H new ATOM 0 HB THR A 26 33.272 19.398 -19.083 1.00 7.59 H new ATOM 0 HG1 THR A 26 35.287 21.273 -19.704 1.00 8.00 H new ATOM 0 HG21 THR A 26 31.971 21.408 -19.679 1.00 7.42 H new ATOM 0 HG22 THR A 26 31.913 21.081 -17.931 1.00 7.42 H new ATOM 0 HG23 THR A 26 32.960 22.375 -18.560 1.00 7.42 H new ATOM 400 N TRP A 27 34.721 22.423 -16.443 1.00 6.78 N ATOM 401 CA TRP A 27 35.272 23.732 -16.117 1.00 6.78 C ATOM 402 C TRP A 27 36.475 23.588 -15.191 1.00 6.52 C ATOM 403 O TRP A 27 37.223 22.613 -15.280 1.00 6.48 O ATOM 404 CB TRP A 27 34.197 24.599 -15.459 1.00 6.61 C ATOM 405 CG TRP A 27 32.955 24.745 -16.285 1.00 6.78 C ATOM 406 CD1 TRP A 27 32.885 25.000 -17.625 1.00 7.11 C ATOM 407 CD2 TRP A 27 31.604 24.653 -15.822 1.00 6.87 C ATOM 408 NE1 TRP A 27 31.572 25.066 -18.024 1.00 7.30 N ATOM 409 CE2 TRP A 27 30.766 24.858 -16.934 1.00 7.14 C ATOM 410 CE3 TRP A 27 31.019 24.415 -14.573 1.00 7.00 C ATOM 411 CZ2 TRP A 27 29.377 24.831 -16.836 1.00 7.39 C ATOM 412 CZ3 TRP A 27 29.640 24.389 -14.477 1.00 7.36 C ATOM 413 CH2 TRP A 27 28.833 24.597 -15.602 1.00 7.49 C ATOM 0 H TRP A 27 33.926 22.148 -15.867 1.00 6.78 H new ATOM 0 HA TRP A 27 35.602 24.214 -17.037 1.00 6.78 H new ATOM 0 HB2 TRP A 27 33.933 24.166 -14.494 1.00 6.61 H new ATOM 0 HB3 TRP A 27 34.610 25.588 -15.262 1.00 6.61 H new ATOM 0 HD1 TRP A 27 33.737 25.131 -18.276 1.00 7.11 H new ATOM 0 HE1 TRP A 27 31.249 25.241 -18.976 1.00 7.30 H new ATOM 0 HE3 TRP A 27 31.634 24.255 -13.700 1.00 7.00 H new ATOM 0 HZ2 TRP A 27 28.752 24.989 -17.702 1.00 7.39 H new ATOM 0 HZ3 TRP A 27 29.178 24.205 -13.518 1.00 7.36 H new ATOM 0 HH2 TRP A 27 27.759 24.572 -15.494 1.00 7.49 H new ATOM 424 N SER A 28 36.666 24.561 -14.305 1.00 6.41 N ATOM 425 CA SER A 28 37.777 24.524 -13.363 1.00 6.22 C ATOM 426 C SER A 28 37.340 23.898 -12.044 1.00 5.65 C ATOM 427 O SER A 28 36.148 23.826 -11.746 1.00 5.37 O ATOM 428 CB SER A 28 38.318 25.935 -13.122 1.00 6.54 C ATOM 429 OG SER A 28 38.820 26.502 -14.319 1.00 6.97 O ATOM 0 H SER A 28 36.067 25.382 -14.221 1.00 6.41 H new ATOM 0 HA SER A 28 38.570 23.912 -13.792 1.00 6.22 H new ATOM 0 HB2 SER A 28 37.526 26.568 -12.721 1.00 6.54 H new ATOM 0 HB3 SER A 28 39.109 25.901 -12.373 1.00 6.54 H new ATOM 0 HG SER A 28 39.158 27.404 -14.137 1.00 6.97 H new ATOM 435 N GLU A 29 38.308 23.444 -11.258 1.00 5.49 N ATOM 436 CA GLU A 29 38.018 22.819 -9.971 1.00 4.97 C ATOM 437 C GLU A 29 37.590 23.861 -8.944 1.00 4.84 C ATOM 438 O GLU A 29 36.598 23.682 -8.238 1.00 4.48 O ATOM 439 CB GLU A 29 39.249 22.071 -9.460 1.00 4.89 C ATOM 440 CG GLU A 29 38.972 21.207 -8.239 1.00 4.40 C ATOM 441 CD GLU A 29 40.216 20.503 -7.729 1.00 4.54 C ATOM 442 OE1 GLU A 29 40.982 21.129 -6.966 1.00 4.58 O ATOM 443 OE2 GLU A 29 40.424 19.326 -8.094 1.00 4.76 O ATOM 0 H GLU A 29 39.300 23.496 -11.488 1.00 5.49 H new ATOM 0 HA GLU A 29 37.199 22.114 -10.114 1.00 4.97 H new ATOM 0 HB2 GLU A 29 39.639 21.441 -10.260 1.00 4.89 H new ATOM 0 HB3 GLU A 29 40.027 22.794 -9.215 1.00 4.89 H new ATOM 0 HG2 GLU A 29 38.559 21.829 -7.445 1.00 4.40 H new ATOM 0 HG3 GLU A 29 38.215 20.464 -8.488 1.00 4.40 H new ATOM 450 N LYS A 30 38.330 24.962 -8.893 1.00 5.20 N ATOM 451 CA LYS A 30 38.052 26.032 -7.946 1.00 5.23 C ATOM 452 C LYS A 30 36.607 26.505 -8.066 1.00 5.19 C ATOM 453 O LYS A 30 35.911 26.656 -7.059 1.00 4.95 O ATOM 454 CB LYS A 30 39.026 27.192 -8.182 1.00 5.76 C ATOM 455 CG LYS A 30 38.649 28.485 -7.473 1.00 6.10 C ATOM 456 CD LYS A 30 37.858 29.412 -8.383 1.00 6.00 C ATOM 457 CE LYS A 30 37.607 30.759 -7.725 1.00 6.45 C ATOM 458 NZ LYS A 30 38.877 31.475 -7.422 1.00 7.08 N ATOM 0 H LYS A 30 39.131 25.136 -9.500 1.00 5.20 H new ATOM 0 HA LYS A 30 38.191 25.652 -6.934 1.00 5.23 H new ATOM 0 HB2 LYS A 30 40.020 26.888 -7.853 1.00 5.76 H new ATOM 0 HB3 LYS A 30 39.090 27.385 -9.253 1.00 5.76 H new ATOM 0 HG2 LYS A 30 38.060 28.255 -6.585 1.00 6.10 H new ATOM 0 HG3 LYS A 30 39.553 28.991 -7.133 1.00 6.10 H new ATOM 0 HD2 LYS A 30 38.401 29.558 -9.317 1.00 6.00 H new ATOM 0 HD3 LYS A 30 36.905 28.947 -8.638 1.00 6.00 H new ATOM 0 HE2 LYS A 30 36.991 31.374 -8.381 1.00 6.45 H new ATOM 0 HE3 LYS A 30 37.044 30.613 -6.803 1.00 6.45 H new ATOM 0 HZ1 LYS A 30 38.676 32.481 -7.249 1.00 7.08 H new ATOM 0 HZ2 LYS A 30 39.317 31.059 -6.576 1.00 7.08 H new ATOM 0 HZ3 LYS A 30 39.527 31.386 -8.229 1.00 7.08 H new ATOM 472 N ASP A 31 36.150 26.715 -9.295 1.00 5.49 N ATOM 473 CA ASP A 31 34.782 27.157 -9.530 1.00 5.55 C ATOM 474 C ASP A 31 33.798 26.150 -8.951 1.00 5.01 C ATOM 475 O ASP A 31 32.807 26.522 -8.320 1.00 4.91 O ATOM 476 CB ASP A 31 34.527 27.340 -11.028 1.00 6.02 C ATOM 477 CG ASP A 31 33.100 27.757 -11.324 1.00 6.57 C ATOM 478 OD1 ASP A 31 32.814 28.972 -11.266 1.00 6.91 O ATOM 479 OD2 ASP A 31 32.269 26.871 -11.611 1.00 6.86 O ATOM 0 H ASP A 31 36.705 26.587 -10.141 1.00 5.49 H new ATOM 0 HA ASP A 31 34.639 28.117 -9.034 1.00 5.55 H new ATOM 0 HB2 ASP A 31 35.211 28.092 -11.421 1.00 6.02 H new ATOM 0 HB3 ASP A 31 34.745 26.407 -11.548 1.00 6.02 H new ATOM 484 N LEU A 32 34.098 24.869 -9.151 1.00 4.72 N ATOM 485 CA LEU A 32 33.263 23.792 -8.660 1.00 4.23 C ATOM 486 C LEU A 32 33.065 23.935 -7.161 1.00 3.82 C ATOM 487 O LEU A 32 31.970 23.734 -6.644 1.00 3.55 O ATOM 488 CB LEU A 32 33.923 22.450 -8.980 1.00 4.13 C ATOM 489 CG LEU A 32 33.064 21.213 -8.735 1.00 3.86 C ATOM 490 CD1 LEU A 32 32.360 20.789 -10.015 1.00 4.25 C ATOM 491 CD2 LEU A 32 33.919 20.084 -8.188 1.00 3.73 C ATOM 0 H LEU A 32 34.926 24.556 -9.657 1.00 4.72 H new ATOM 0 HA LEU A 32 32.289 23.836 -9.147 1.00 4.23 H new ATOM 0 HB2 LEU A 32 34.227 22.456 -10.027 1.00 4.13 H new ATOM 0 HB3 LEU A 32 34.832 22.362 -8.384 1.00 4.13 H new ATOM 0 HG LEU A 32 32.300 21.457 -7.996 1.00 3.86 H new ATOM 0 HD11 LEU A 32 31.752 19.905 -9.820 1.00 4.25 H new ATOM 0 HD12 LEU A 32 31.720 21.600 -10.364 1.00 4.25 H new ATOM 0 HD13 LEU A 32 33.102 20.558 -10.779 1.00 4.25 H new ATOM 0 HD21 LEU A 32 33.296 19.206 -8.017 1.00 3.73 H new ATOM 0 HD22 LEU A 32 34.701 19.839 -8.906 1.00 3.73 H new ATOM 0 HD23 LEU A 32 34.374 20.395 -7.248 1.00 3.73 H new ATOM 503 N ARG A 33 34.127 24.310 -6.463 1.00 3.89 N ATOM 504 CA ARG A 33 34.050 24.478 -5.025 1.00 3.67 C ATOM 505 C ARG A 33 32.985 25.513 -4.681 1.00 3.83 C ATOM 506 O ARG A 33 32.142 25.292 -3.811 1.00 3.57 O ATOM 507 CB ARG A 33 35.404 24.912 -4.460 1.00 3.95 C ATOM 508 CG ARG A 33 36.553 23.998 -4.855 1.00 4.34 C ATOM 509 CD ARG A 33 37.836 24.372 -4.131 1.00 4.72 C ATOM 510 NE ARG A 33 38.941 23.484 -4.478 1.00 5.30 N ATOM 511 CZ ARG A 33 40.105 23.464 -3.833 1.00 5.77 C ATOM 512 NH1 ARG A 33 40.316 24.286 -2.813 1.00 5.63 N ATOM 513 NH2 ARG A 33 41.058 22.622 -4.209 1.00 6.56 N ATOM 0 H ARG A 33 35.044 24.502 -6.868 1.00 3.89 H new ATOM 0 HA ARG A 33 33.780 23.522 -4.577 1.00 3.67 H new ATOM 0 HB2 ARG A 33 35.623 25.924 -4.801 1.00 3.95 H new ATOM 0 HB3 ARG A 33 35.339 24.950 -3.373 1.00 3.95 H new ATOM 0 HG2 ARG A 33 36.293 22.965 -4.626 1.00 4.34 H new ATOM 0 HG3 ARG A 33 36.712 24.056 -5.932 1.00 4.34 H new ATOM 0 HD2 ARG A 33 38.105 25.399 -4.378 1.00 4.72 H new ATOM 0 HD3 ARG A 33 37.668 24.337 -3.055 1.00 4.72 H new ATOM 0 HE ARG A 33 38.814 22.842 -5.260 1.00 5.30 H new ATOM 0 HH11 ARG A 33 39.585 24.935 -2.522 1.00 5.63 H new ATOM 0 HH12 ARG A 33 41.209 24.269 -2.320 1.00 5.63 H new ATOM 0 HH21 ARG A 33 40.899 21.989 -4.993 1.00 6.56 H new ATOM 0 HH22 ARG A 33 41.950 22.607 -3.714 1.00 6.56 H new ATOM 527 N GLU A 34 33.007 26.629 -5.408 1.00 4.29 N ATOM 528 CA GLU A 34 32.055 27.707 -5.181 1.00 4.54 C ATOM 529 C GLU A 34 30.643 27.261 -5.521 1.00 4.17 C ATOM 530 O GLU A 34 29.675 27.711 -4.908 1.00 4.17 O ATOM 531 CB GLU A 34 32.426 28.936 -6.016 1.00 5.12 C ATOM 532 CG GLU A 34 33.876 29.364 -5.861 1.00 5.67 C ATOM 533 CD GLU A 34 34.217 30.578 -6.702 1.00 6.50 C ATOM 534 OE1 GLU A 34 34.443 30.415 -7.919 1.00 6.86 O ATOM 535 OE2 GLU A 34 34.263 31.695 -6.143 1.00 6.88 O ATOM 0 H GLU A 34 33.675 26.807 -6.158 1.00 4.29 H new ATOM 0 HA GLU A 34 32.093 27.971 -4.124 1.00 4.54 H new ATOM 0 HB2 GLU A 34 32.229 28.723 -7.067 1.00 5.12 H new ATOM 0 HB3 GLU A 34 31.779 29.766 -5.732 1.00 5.12 H new ATOM 0 HG2 GLU A 34 34.076 29.585 -4.813 1.00 5.67 H new ATOM 0 HG3 GLU A 34 34.528 28.537 -6.142 1.00 5.67 H new ATOM 542 N LEU A 35 30.531 26.363 -6.489 1.00 3.97 N ATOM 543 CA LEU A 35 29.235 25.862 -6.905 1.00 3.73 C ATOM 544 C LEU A 35 28.627 25.043 -5.781 1.00 3.22 C ATOM 545 O LEU A 35 27.413 25.033 -5.582 1.00 3.17 O ATOM 546 CB LEU A 35 29.385 25.079 -8.225 1.00 3.73 C ATOM 547 CG LEU A 35 29.471 23.544 -8.171 1.00 4.04 C ATOM 548 CD1 LEU A 35 28.223 22.937 -7.549 1.00 4.24 C ATOM 549 CD2 LEU A 35 29.668 22.989 -9.571 1.00 4.42 C ATOM 0 H LEU A 35 31.322 25.969 -6.998 1.00 3.97 H new ATOM 0 HA LEU A 35 28.545 26.682 -7.105 1.00 3.73 H new ATOM 0 HB2 LEU A 35 28.539 25.340 -8.861 1.00 3.73 H new ATOM 0 HB3 LEU A 35 30.283 25.442 -8.724 1.00 3.73 H new ATOM 0 HG LEU A 35 30.323 23.278 -7.546 1.00 4.04 H new ATOM 0 HD11 LEU A 35 28.319 21.851 -7.527 1.00 4.24 H new ATOM 0 HD12 LEU A 35 28.104 23.311 -6.532 1.00 4.24 H new ATOM 0 HD13 LEU A 35 27.350 23.213 -8.141 1.00 4.24 H new ATOM 0 HD21 LEU A 35 29.728 21.902 -9.526 1.00 4.42 H new ATOM 0 HD22 LEU A 35 28.826 23.280 -10.200 1.00 4.42 H new ATOM 0 HD23 LEU A 35 30.591 23.386 -9.993 1.00 4.42 H new ATOM 561 N PHE A 36 29.492 24.366 -5.044 1.00 2.92 N ATOM 562 CA PHE A 36 29.056 23.548 -3.914 1.00 2.53 C ATOM 563 C PHE A 36 28.624 24.417 -2.735 1.00 2.79 C ATOM 564 O PHE A 36 27.840 23.986 -1.889 1.00 2.71 O ATOM 565 CB PHE A 36 30.173 22.600 -3.470 1.00 2.33 C ATOM 566 CG PHE A 36 30.328 21.391 -4.344 1.00 2.64 C ATOM 567 CD1 PHE A 36 29.241 20.584 -4.640 1.00 3.18 C ATOM 568 CD2 PHE A 36 31.567 21.055 -4.861 1.00 2.74 C ATOM 569 CE1 PHE A 36 29.387 19.467 -5.439 1.00 3.84 C ATOM 570 CE2 PHE A 36 31.719 19.940 -5.660 1.00 3.25 C ATOM 571 CZ PHE A 36 30.628 19.144 -5.950 1.00 3.84 C ATOM 0 H PHE A 36 30.499 24.364 -5.204 1.00 2.92 H new ATOM 0 HA PHE A 36 28.199 22.962 -4.246 1.00 2.53 H new ATOM 0 HB2 PHE A 36 31.115 23.147 -3.454 1.00 2.33 H new ATOM 0 HB3 PHE A 36 29.975 22.275 -2.449 1.00 2.33 H new ATOM 0 HD1 PHE A 36 28.268 20.831 -4.241 1.00 3.18 H new ATOM 0 HD2 PHE A 36 32.424 21.672 -4.637 1.00 2.74 H new ATOM 0 HE1 PHE A 36 28.532 18.847 -5.664 1.00 3.84 H new ATOM 0 HE2 PHE A 36 32.691 19.690 -6.059 1.00 3.25 H new ATOM 0 HZ PHE A 36 30.746 18.271 -6.575 1.00 3.84 H new ATOM 581 N GLU A 37 29.144 25.642 -2.683 1.00 3.23 N ATOM 582 CA GLU A 37 28.823 26.568 -1.599 1.00 3.62 C ATOM 583 C GLU A 37 27.325 26.850 -1.518 1.00 3.69 C ATOM 584 O GLU A 37 26.815 27.224 -0.461 1.00 3.94 O ATOM 585 CB GLU A 37 29.591 27.880 -1.771 1.00 4.13 C ATOM 586 CG GLU A 37 31.090 27.738 -1.570 1.00 4.40 C ATOM 587 CD GLU A 37 31.798 29.078 -1.508 1.00 5.13 C ATOM 588 OE1 GLU A 37 31.922 29.633 -0.396 1.00 5.27 O ATOM 589 OE2 GLU A 37 32.229 29.572 -2.571 1.00 5.70 O ATOM 0 H GLU A 37 29.789 26.016 -3.379 1.00 3.23 H new ATOM 0 HA GLU A 37 29.125 26.092 -0.666 1.00 3.62 H new ATOM 0 HB2 GLU A 37 29.402 28.273 -2.770 1.00 4.13 H new ATOM 0 HB3 GLU A 37 29.206 28.613 -1.062 1.00 4.13 H new ATOM 0 HG2 GLU A 37 31.279 27.188 -0.648 1.00 4.40 H new ATOM 0 HG3 GLU A 37 31.508 27.147 -2.385 1.00 4.40 H new ATOM 596 N GLN A 38 26.623 26.675 -2.633 1.00 3.55 N ATOM 597 CA GLN A 38 25.186 26.925 -2.677 1.00 3.66 C ATOM 598 C GLN A 38 24.425 26.026 -1.703 1.00 3.45 C ATOM 599 O GLN A 38 23.212 26.168 -1.540 1.00 3.63 O ATOM 600 CB GLN A 38 24.646 26.714 -4.092 1.00 3.66 C ATOM 601 CG GLN A 38 25.410 27.484 -5.155 1.00 4.03 C ATOM 602 CD GLN A 38 24.792 27.343 -6.532 1.00 4.19 C ATOM 603 OE1 GLN A 38 23.943 28.142 -6.928 1.00 4.53 O ATOM 604 NE2 GLN A 38 25.214 26.324 -7.267 1.00 4.12 N ATOM 0 H GLN A 38 27.025 26.362 -3.517 1.00 3.55 H new ATOM 0 HA GLN A 38 25.032 27.962 -2.379 1.00 3.66 H new ATOM 0 HB2 GLN A 38 24.680 25.651 -4.330 1.00 3.66 H new ATOM 0 HB3 GLN A 38 23.598 27.014 -4.121 1.00 3.66 H new ATOM 0 HG2 GLN A 38 25.443 28.539 -4.882 1.00 4.03 H new ATOM 0 HG3 GLN A 38 26.441 27.130 -5.185 1.00 4.03 H new ATOM 0 HE21 GLN A 38 25.920 25.687 -6.898 1.00 4.12 H new ATOM 0 HE22 GLN A 38 24.833 26.177 -8.202 1.00 4.12 H new ATOM 613 N TYR A 39 25.135 25.103 -1.060 1.00 3.16 N ATOM 614 CA TYR A 39 24.510 24.185 -0.115 1.00 3.09 C ATOM 615 C TYR A 39 25.119 24.318 1.280 1.00 3.43 C ATOM 616 O TYR A 39 24.565 23.812 2.255 1.00 3.70 O ATOM 617 CB TYR A 39 24.650 22.747 -0.615 1.00 2.67 C ATOM 618 CG TYR A 39 24.093 22.538 -2.007 1.00 2.49 C ATOM 619 CD1 TYR A 39 24.851 22.841 -3.131 1.00 2.40 C ATOM 620 CD2 TYR A 39 22.812 22.036 -2.195 1.00 2.65 C ATOM 621 CE1 TYR A 39 24.347 22.648 -4.404 1.00 2.52 C ATOM 622 CE2 TYR A 39 22.301 21.840 -3.464 1.00 2.74 C ATOM 623 CZ TYR A 39 23.070 22.165 -4.566 1.00 2.70 C ATOM 624 OH TYR A 39 22.566 21.955 -5.829 1.00 3.03 O ATOM 0 H TYR A 39 26.140 24.972 -1.176 1.00 3.16 H new ATOM 0 HA TYR A 39 23.453 24.443 -0.044 1.00 3.09 H new ATOM 0 HB2 TYR A 39 25.704 22.469 -0.608 1.00 2.67 H new ATOM 0 HB3 TYR A 39 24.139 22.078 0.077 1.00 2.67 H new ATOM 0 HD1 TYR A 39 25.850 23.233 -3.009 1.00 2.40 H new ATOM 0 HD2 TYR A 39 22.205 21.795 -1.335 1.00 2.65 H new ATOM 0 HE1 TYR A 39 24.954 22.876 -5.268 1.00 2.52 H new ATOM 0 HE2 TYR A 39 21.308 21.436 -3.594 1.00 2.74 H new ATOM 0 HH TYR A 39 21.651 21.611 -5.763 1.00 3.03 H new ATOM 634 N GLY A 40 26.257 25.002 1.368 1.00 3.54 N ATOM 635 CA GLY A 40 26.910 25.186 2.654 1.00 3.95 C ATOM 636 C GLY A 40 28.384 25.518 2.522 1.00 4.02 C ATOM 637 O GLY A 40 28.846 25.908 1.451 1.00 3.95 O ATOM 0 H GLY A 40 26.737 25.430 0.576 1.00 3.54 H new ATOM 0 HA2 GLY A 40 26.409 25.986 3.199 1.00 3.95 H new ATOM 0 HA3 GLY A 40 26.798 24.278 3.246 1.00 3.95 H new ATOM 641 N ALA A 41 29.122 25.366 3.618 1.00 4.22 N ATOM 642 CA ALA A 41 30.553 25.653 3.623 1.00 4.36 C ATOM 643 C ALA A 41 31.365 24.416 3.254 1.00 3.96 C ATOM 644 O ALA A 41 31.420 23.448 4.012 1.00 3.97 O ATOM 645 CB ALA A 41 30.980 26.180 4.984 1.00 4.90 C ATOM 0 H ALA A 41 28.753 25.046 4.513 1.00 4.22 H new ATOM 0 HA ALA A 41 30.747 26.418 2.871 1.00 4.36 H new ATOM 0 HB1 ALA A 41 32.050 26.390 4.974 1.00 4.90 H new ATOM 0 HB2 ALA A 41 30.433 27.096 5.208 1.00 4.90 H new ATOM 0 HB3 ALA A 41 30.764 25.433 5.748 1.00 4.90 H new ATOM 651 N VAL A 42 31.995 24.457 2.084 1.00 3.69 N ATOM 652 CA VAL A 42 32.806 23.342 1.611 1.00 3.34 C ATOM 653 C VAL A 42 34.105 23.239 2.403 1.00 3.70 C ATOM 654 O VAL A 42 34.467 24.158 3.139 1.00 4.23 O ATOM 655 CB VAL A 42 33.137 23.488 0.112 1.00 3.12 C ATOM 656 CG1 VAL A 42 31.863 23.649 -0.702 1.00 2.79 C ATOM 657 CG2 VAL A 42 34.077 24.662 -0.121 1.00 3.91 C ATOM 0 H VAL A 42 31.959 25.252 1.446 1.00 3.69 H new ATOM 0 HA VAL A 42 32.221 22.434 1.758 1.00 3.34 H new ATOM 0 HB VAL A 42 33.642 22.580 -0.217 1.00 3.12 H new ATOM 0 HG11 VAL A 42 32.116 23.751 -1.757 1.00 2.79 H new ATOM 0 HG12 VAL A 42 31.230 22.773 -0.563 1.00 2.79 H new ATOM 0 HG13 VAL A 42 31.329 24.539 -0.370 1.00 2.79 H new ATOM 0 HG21 VAL A 42 34.297 24.746 -1.185 1.00 3.91 H new ATOM 0 HG22 VAL A 42 33.604 25.581 0.226 1.00 3.91 H new ATOM 0 HG23 VAL A 42 35.004 24.501 0.429 1.00 3.91 H new ATOM 667 N TYR A 43 34.807 22.118 2.250 1.00 3.46 N ATOM 668 CA TYR A 43 36.062 21.907 2.960 1.00 3.81 C ATOM 669 C TYR A 43 37.053 21.115 2.112 1.00 3.64 C ATOM 670 O TYR A 43 38.147 21.592 1.812 1.00 3.92 O ATOM 671 CB TYR A 43 35.805 21.174 4.280 1.00 4.02 C ATOM 672 CG TYR A 43 37.050 20.969 5.114 1.00 4.43 C ATOM 673 CD1 TYR A 43 37.500 21.956 5.981 1.00 4.86 C ATOM 674 CD2 TYR A 43 37.775 19.787 5.031 1.00 4.46 C ATOM 675 CE1 TYR A 43 38.638 21.770 6.744 1.00 5.24 C ATOM 676 CE2 TYR A 43 38.913 19.595 5.791 1.00 4.87 C ATOM 677 CZ TYR A 43 39.338 20.591 6.650 1.00 5.22 C ATOM 678 OH TYR A 43 40.473 20.401 7.401 1.00 5.63 O ATOM 0 H TYR A 43 34.528 21.347 1.644 1.00 3.46 H new ATOM 0 HA TYR A 43 36.497 22.885 3.168 1.00 3.81 H new ATOM 0 HB2 TYR A 43 35.077 21.738 4.863 1.00 4.02 H new ATOM 0 HB3 TYR A 43 35.358 20.203 4.065 1.00 4.02 H new ATOM 0 HD1 TYR A 43 36.952 22.884 6.061 1.00 4.86 H new ATOM 0 HD2 TYR A 43 37.444 19.006 4.362 1.00 4.46 H new ATOM 0 HE1 TYR A 43 38.976 22.549 7.412 1.00 5.24 H new ATOM 0 HE2 TYR A 43 39.468 18.671 5.714 1.00 4.87 H new ATOM 0 HH TYR A 43 40.844 19.513 7.215 1.00 5.63 H new ATOM 688 N GLU A 44 36.663 19.904 1.730 1.00 3.26 N ATOM 689 CA GLU A 44 37.525 19.042 0.925 1.00 3.20 C ATOM 690 C GLU A 44 36.774 18.480 -0.277 1.00 2.81 C ATOM 691 O GLU A 44 35.721 17.862 -0.130 1.00 2.54 O ATOM 692 CB GLU A 44 38.069 17.898 1.781 1.00 3.40 C ATOM 693 CG GLU A 44 38.985 16.950 1.022 1.00 3.50 C ATOM 694 CD GLU A 44 40.270 17.617 0.570 1.00 4.22 C ATOM 695 OE1 GLU A 44 40.255 18.271 -0.495 1.00 4.91 O ATOM 696 OE2 GLU A 44 41.288 17.487 1.279 1.00 4.36 O ATOM 0 H GLU A 44 35.758 19.496 1.963 1.00 3.26 H new ATOM 0 HA GLU A 44 38.356 19.644 0.556 1.00 3.20 H new ATOM 0 HB2 GLU A 44 38.614 18.316 2.627 1.00 3.40 H new ATOM 0 HB3 GLU A 44 37.232 17.332 2.189 1.00 3.40 H new ATOM 0 HG2 GLU A 44 39.226 16.098 1.657 1.00 3.50 H new ATOM 0 HG3 GLU A 44 38.457 16.560 0.152 1.00 3.50 H new ATOM 703 N ILE A 45 37.327 18.695 -1.465 1.00 2.90 N ATOM 704 CA ILE A 45 36.714 18.209 -2.694 1.00 2.73 C ATOM 705 C ILE A 45 37.709 17.404 -3.520 1.00 3.01 C ATOM 706 O ILE A 45 38.861 17.806 -3.689 1.00 3.32 O ATOM 707 CB ILE A 45 36.170 19.371 -3.543 1.00 2.75 C ATOM 708 CG1 ILE A 45 34.985 20.027 -2.835 1.00 2.52 C ATOM 709 CG2 ILE A 45 35.763 18.876 -4.925 1.00 2.81 C ATOM 710 CD1 ILE A 45 34.685 21.427 -3.320 1.00 2.72 C ATOM 0 H ILE A 45 38.200 19.204 -1.603 1.00 2.90 H new ATOM 0 HA ILE A 45 35.884 17.564 -2.406 1.00 2.73 H new ATOM 0 HB ILE A 45 36.957 20.115 -3.666 1.00 2.75 H new ATOM 0 HG12 ILE A 45 34.100 19.406 -2.976 1.00 2.52 H new ATOM 0 HG13 ILE A 45 35.185 20.058 -1.764 1.00 2.52 H new ATOM 0 HG21 ILE A 45 35.380 19.711 -5.512 1.00 2.81 H new ATOM 0 HG22 ILE A 45 36.630 18.446 -5.427 1.00 2.81 H new ATOM 0 HG23 ILE A 45 34.987 18.117 -4.826 1.00 2.81 H new ATOM 0 HD11 ILE A 45 33.832 21.827 -2.772 1.00 2.72 H new ATOM 0 HD12 ILE A 45 35.554 22.064 -3.154 1.00 2.72 H new ATOM 0 HD13 ILE A 45 34.452 21.401 -4.385 1.00 2.72 H new ATOM 722 N ASN A 46 37.257 16.265 -4.031 1.00 2.98 N ATOM 723 CA ASN A 46 38.106 15.397 -4.835 1.00 3.34 C ATOM 724 C ASN A 46 37.398 14.949 -6.107 1.00 3.49 C ATOM 725 O ASN A 46 36.195 14.679 -6.101 1.00 3.30 O ATOM 726 CB ASN A 46 38.515 14.164 -4.032 1.00 3.44 C ATOM 727 CG ASN A 46 39.428 14.491 -2.865 1.00 3.89 C ATOM 728 OD1 ASN A 46 39.329 15.557 -2.259 1.00 4.29 O ATOM 729 ND2 ASN A 46 40.329 13.569 -2.544 1.00 4.16 N ATOM 0 H ASN A 46 36.305 15.921 -3.902 1.00 2.98 H new ATOM 0 HA ASN A 46 38.991 15.970 -5.110 1.00 3.34 H new ATOM 0 HB2 ASN A 46 37.620 13.668 -3.657 1.00 3.44 H new ATOM 0 HB3 ASN A 46 39.018 13.458 -4.693 1.00 3.44 H new ATOM 0 HD21 ASN A 46 40.972 13.732 -1.769 1.00 4.16 H new ATOM 0 HD22 ASN A 46 40.378 12.698 -3.072 1.00 4.16 H new ATOM 736 N VAL A 47 38.155 14.871 -7.195 1.00 3.90 N ATOM 737 CA VAL A 47 37.618 14.427 -8.473 1.00 4.21 C ATOM 738 C VAL A 47 38.291 13.132 -8.888 1.00 4.58 C ATOM 739 O VAL A 47 39.506 12.988 -8.759 1.00 4.76 O ATOM 740 CB VAL A 47 37.838 15.457 -9.594 1.00 4.49 C ATOM 741 CG1 VAL A 47 36.639 15.484 -10.532 1.00 4.76 C ATOM 742 CG2 VAL A 47 38.111 16.839 -9.021 1.00 4.27 C ATOM 0 H VAL A 47 39.146 15.111 -7.216 1.00 3.90 H new ATOM 0 HA VAL A 47 36.546 14.291 -8.333 1.00 4.21 H new ATOM 0 HB VAL A 47 38.716 15.157 -10.166 1.00 4.49 H new ATOM 0 HG11 VAL A 47 36.810 16.218 -11.320 1.00 4.76 H new ATOM 0 HG12 VAL A 47 36.503 14.498 -10.977 1.00 4.76 H new ATOM 0 HG13 VAL A 47 35.744 15.755 -9.971 1.00 4.76 H new ATOM 0 HG21 VAL A 47 38.263 17.547 -9.836 1.00 4.27 H new ATOM 0 HG22 VAL A 47 37.261 17.157 -8.417 1.00 4.27 H new ATOM 0 HG23 VAL A 47 39.005 16.805 -8.399 1.00 4.27 H new ATOM 752 N LEU A 48 37.506 12.193 -9.387 1.00 4.75 N ATOM 753 CA LEU A 48 38.049 10.920 -9.817 1.00 5.16 C ATOM 754 C LEU A 48 38.711 11.065 -11.179 1.00 5.98 C ATOM 755 O LEU A 48 38.843 12.172 -11.701 1.00 6.68 O ATOM 756 CB LEU A 48 36.958 9.841 -9.839 1.00 5.21 C ATOM 757 CG LEU A 48 36.367 9.483 -8.468 1.00 4.88 C ATOM 758 CD1 LEU A 48 37.468 9.191 -7.456 1.00 4.66 C ATOM 759 CD2 LEU A 48 35.473 10.600 -7.970 1.00 4.67 C ATOM 0 H LEU A 48 36.497 12.288 -9.503 1.00 4.75 H new ATOM 0 HA LEU A 48 38.808 10.604 -9.102 1.00 5.16 H new ATOM 0 HB2 LEU A 48 36.150 10.177 -10.489 1.00 5.21 H new ATOM 0 HB3 LEU A 48 37.372 8.937 -10.286 1.00 5.21 H new ATOM 0 HG LEU A 48 35.767 8.580 -8.584 1.00 4.88 H new ATOM 0 HD11 LEU A 48 37.021 8.940 -6.494 1.00 4.66 H new ATOM 0 HD12 LEU A 48 38.070 8.353 -7.806 1.00 4.66 H new ATOM 0 HD13 LEU A 48 38.101 10.071 -7.343 1.00 4.66 H new ATOM 0 HD21 LEU A 48 35.062 10.331 -6.997 1.00 4.67 H new ATOM 0 HD22 LEU A 48 36.054 11.517 -7.877 1.00 4.67 H new ATOM 0 HD23 LEU A 48 34.659 10.757 -8.677 1.00 4.67 H new ATOM 771 N ARG A 49 39.124 9.943 -11.742 1.00 6.10 N ATOM 772 CA ARG A 49 39.807 9.929 -13.024 1.00 6.94 C ATOM 773 C ARG A 49 41.120 10.696 -12.915 1.00 7.60 C ATOM 774 O ARG A 49 42.134 10.112 -12.536 1.00 7.80 O ATOM 775 CB ARG A 49 38.917 10.499 -14.129 1.00 7.01 C ATOM 776 CG ARG A 49 38.143 9.430 -14.888 1.00 6.73 C ATOM 777 CD ARG A 49 37.442 8.458 -13.951 1.00 6.74 C ATOM 778 NE ARG A 49 36.746 7.401 -14.678 1.00 6.98 N ATOM 779 CZ ARG A 49 36.594 6.164 -14.215 1.00 7.61 C ATOM 780 NH1 ARG A 49 37.091 5.830 -13.032 1.00 8.05 N ATOM 781 NH2 ARG A 49 35.945 5.259 -14.935 1.00 8.04 N ATOM 0 H ARG A 49 38.996 9.020 -11.326 1.00 6.10 H new ATOM 0 HA ARG A 49 40.030 8.897 -13.294 1.00 6.94 H new ATOM 0 HB2 ARG A 49 38.213 11.206 -13.691 1.00 7.01 H new ATOM 0 HB3 ARG A 49 39.535 11.059 -14.831 1.00 7.01 H new ATOM 0 HG2 ARG A 49 37.405 9.907 -15.533 1.00 6.73 H new ATOM 0 HG3 ARG A 49 38.826 8.880 -15.536 1.00 6.73 H new ATOM 0 HD2 ARG A 49 38.174 8.013 -13.277 1.00 6.74 H new ATOM 0 HD3 ARG A 49 36.729 9.002 -13.332 1.00 6.74 H new ATOM 0 HE ARG A 49 36.354 7.624 -15.593 1.00 6.98 H new ATOM 0 HH11 ARG A 49 37.591 6.523 -12.475 1.00 8.05 H new ATOM 0 HH12 ARG A 49 36.973 4.880 -12.679 1.00 8.05 H new ATOM 0 HH21 ARG A 49 35.561 5.511 -15.846 1.00 8.04 H new ATOM 0 HH22 ARG A 49 35.829 4.311 -14.578 1.00 8.04 H new ATOM 929 N LYS A 59 35.031 10.521 -15.516 1.00 6.67 N ATOM 930 CA LYS A 59 33.737 9.874 -15.328 1.00 6.51 C ATOM 931 C LYS A 59 32.642 10.893 -15.023 1.00 6.29 C ATOM 932 O LYS A 59 31.454 10.607 -15.178 1.00 6.35 O ATOM 933 CB LYS A 59 33.818 8.847 -14.200 1.00 6.45 C ATOM 934 CG LYS A 59 34.167 9.452 -12.852 1.00 6.21 C ATOM 935 CD LYS A 59 34.469 8.378 -11.820 1.00 6.05 C ATOM 936 CE LYS A 59 33.245 7.524 -11.525 1.00 6.48 C ATOM 937 NZ LYS A 59 33.513 6.517 -10.462 1.00 6.59 N ATOM 0 HA LYS A 59 33.481 9.369 -16.259 1.00 6.51 H new ATOM 0 HB2 LYS A 59 32.861 8.331 -14.121 1.00 6.45 H new ATOM 0 HB3 LYS A 59 34.565 8.096 -14.456 1.00 6.45 H new ATOM 0 HG2 LYS A 59 35.031 10.108 -12.959 1.00 6.21 H new ATOM 0 HG3 LYS A 59 33.339 10.070 -12.504 1.00 6.21 H new ATOM 0 HD2 LYS A 59 35.278 7.743 -12.181 1.00 6.05 H new ATOM 0 HD3 LYS A 59 34.818 8.845 -10.899 1.00 6.05 H new ATOM 0 HE2 LYS A 59 32.420 8.166 -11.217 1.00 6.48 H new ATOM 0 HE3 LYS A 59 32.930 7.015 -12.436 1.00 6.48 H new ATOM 0 HZ1 LYS A 59 32.654 5.956 -10.291 1.00 6.59 H new ATOM 0 HZ2 LYS A 59 34.283 5.888 -10.766 1.00 6.59 H new ATOM 0 HZ3 LYS A 59 33.789 7.003 -9.585 1.00 6.59 H new ATOM 951 N GLY A 60 33.045 12.086 -14.589 1.00 6.22 N ATOM 952 CA GLY A 60 32.081 13.123 -14.270 1.00 6.09 C ATOM 953 C GLY A 60 31.476 12.950 -12.891 1.00 5.44 C ATOM 954 O GLY A 60 30.327 13.326 -12.658 1.00 5.15 O ATOM 0 H GLY A 60 34.021 12.351 -14.453 1.00 6.22 H new ATOM 0 HA2 GLY A 60 32.567 14.097 -14.330 1.00 6.09 H new ATOM 0 HA3 GLY A 60 31.286 13.117 -15.015 1.00 6.09 H new ATOM 958 N CYS A 61 32.253 12.382 -11.975 1.00 5.25 N ATOM 959 CA CYS A 61 31.794 12.159 -10.608 1.00 4.69 C ATOM 960 C CYS A 61 32.789 12.731 -9.606 1.00 4.28 C ATOM 961 O CYS A 61 33.997 12.540 -9.741 1.00 4.52 O ATOM 962 CB CYS A 61 31.592 10.664 -10.352 1.00 4.94 C ATOM 963 SG CYS A 61 30.367 9.890 -11.433 1.00 5.62 S ATOM 0 H CYS A 61 33.206 12.067 -12.155 1.00 5.25 H new ATOM 0 HA CYS A 61 30.840 12.671 -10.480 1.00 4.69 H new ATOM 0 HB2 CYS A 61 32.546 10.153 -10.477 1.00 4.94 H new ATOM 0 HB3 CYS A 61 31.288 10.522 -9.315 1.00 4.94 H new ATOM 0 HG CYS A 61 30.268 8.627 -11.142 1.00 5.62 H new ATOM 969 N CYS A 62 32.278 13.446 -8.608 1.00 3.72 N ATOM 970 CA CYS A 62 33.129 14.048 -7.584 1.00 3.34 C ATOM 971 C CYS A 62 32.427 14.064 -6.230 1.00 2.85 C ATOM 972 O CYS A 62 31.203 14.173 -6.160 1.00 2.73 O ATOM 973 CB CYS A 62 33.547 15.464 -7.986 1.00 3.28 C ATOM 974 SG CYS A 62 32.185 16.649 -8.075 1.00 2.98 S ATOM 0 H CYS A 62 31.281 13.623 -8.486 1.00 3.72 H new ATOM 0 HA CYS A 62 34.027 13.437 -7.496 1.00 3.34 H new ATOM 0 HB2 CYS A 62 34.284 15.829 -7.270 1.00 3.28 H new ATOM 0 HB3 CYS A 62 34.040 15.422 -8.957 1.00 3.28 H new ATOM 0 HG CYS A 62 32.427 17.518 -9.011 1.00 2.98 H new ATOM 980 N PHE A 63 33.204 13.957 -5.155 1.00 2.68 N ATOM 981 CA PHE A 63 32.636 13.959 -3.810 1.00 2.38 C ATOM 982 C PHE A 63 33.209 15.105 -2.982 1.00 2.10 C ATOM 983 O PHE A 63 34.399 15.412 -3.056 1.00 2.27 O ATOM 984 CB PHE A 63 32.877 12.616 -3.111 1.00 2.72 C ATOM 985 CG PHE A 63 34.307 12.154 -3.125 1.00 3.01 C ATOM 986 CD1 PHE A 63 34.806 11.429 -4.195 1.00 3.36 C ATOM 987 CD2 PHE A 63 35.150 12.427 -2.057 1.00 3.06 C ATOM 988 CE1 PHE A 63 36.115 10.988 -4.204 1.00 3.65 C ATOM 989 CE2 PHE A 63 36.460 11.986 -2.059 1.00 3.39 C ATOM 990 CZ PHE A 63 36.942 11.266 -3.134 1.00 3.65 C ATOM 0 H PHE A 63 34.220 13.869 -5.188 1.00 2.68 H new ATOM 0 HA PHE A 63 31.560 14.106 -3.900 1.00 2.38 H new ATOM 0 HB2 PHE A 63 32.544 12.694 -2.076 1.00 2.72 H new ATOM 0 HB3 PHE A 63 32.258 11.856 -3.588 1.00 2.72 H new ATOM 0 HD1 PHE A 63 34.163 11.206 -5.033 1.00 3.36 H new ATOM 0 HD2 PHE A 63 34.778 12.991 -1.214 1.00 3.06 H new ATOM 0 HE1 PHE A 63 36.491 10.427 -5.047 1.00 3.65 H new ATOM 0 HE2 PHE A 63 37.105 12.204 -1.221 1.00 3.39 H new ATOM 0 HZ PHE A 63 37.965 10.921 -3.138 1.00 3.65 H new ATOM 1000 N VAL A 64 32.338 15.730 -2.194 1.00 1.83 N ATOM 1001 CA VAL A 64 32.708 16.878 -1.373 1.00 1.80 C ATOM 1002 C VAL A 64 32.387 16.665 0.103 1.00 1.98 C ATOM 1003 O VAL A 64 31.426 15.981 0.453 1.00 2.06 O ATOM 1004 CB VAL A 64 31.983 18.149 -1.859 1.00 1.69 C ATOM 1005 CG1 VAL A 64 30.482 17.919 -1.915 1.00 1.96 C ATOM 1006 CG2 VAL A 64 32.309 19.339 -0.967 1.00 2.19 C ATOM 0 H VAL A 64 31.359 15.456 -2.107 1.00 1.83 H new ATOM 0 HA VAL A 64 33.787 16.996 -1.477 1.00 1.80 H new ATOM 0 HB VAL A 64 32.336 18.375 -2.865 1.00 1.69 H new ATOM 0 HG11 VAL A 64 29.987 18.827 -2.260 1.00 1.96 H new ATOM 0 HG12 VAL A 64 30.264 17.103 -2.604 1.00 1.96 H new ATOM 0 HG13 VAL A 64 30.116 17.662 -0.921 1.00 1.96 H new ATOM 0 HG21 VAL A 64 31.785 20.222 -1.332 1.00 2.19 H new ATOM 0 HG22 VAL A 64 31.993 19.126 0.054 1.00 2.19 H new ATOM 0 HG23 VAL A 64 33.383 19.522 -0.983 1.00 2.19 H new ATOM 1016 N THR A 65 33.204 17.268 0.960 1.00 2.26 N ATOM 1017 CA THR A 65 33.018 17.183 2.401 1.00 2.63 C ATOM 1018 C THR A 65 32.860 18.590 2.970 1.00 2.83 C ATOM 1019 O THR A 65 33.625 19.493 2.632 1.00 2.93 O ATOM 1020 CB THR A 65 34.211 16.487 3.088 1.00 3.06 C ATOM 1021 OG1 THR A 65 34.371 15.163 2.566 1.00 3.07 O ATOM 1022 CG2 THR A 65 34.009 16.422 4.596 1.00 3.50 C ATOM 0 H THR A 65 34.009 17.826 0.676 1.00 2.26 H new ATOM 0 HA THR A 65 32.124 16.590 2.594 1.00 2.63 H new ATOM 0 HB THR A 65 35.109 17.070 2.884 1.00 3.06 H new ATOM 0 HG1 THR A 65 35.131 14.728 3.005 1.00 3.07 H new ATOM 0 HG21 THR A 65 34.864 15.927 5.057 1.00 3.50 H new ATOM 0 HG22 THR A 65 33.917 17.432 4.995 1.00 3.50 H new ATOM 0 HG23 THR A 65 33.102 15.860 4.818 1.00 3.50 H new ATOM 1030 N PHE A 66 31.862 18.769 3.827 1.00 3.01 N ATOM 1031 CA PHE A 66 31.584 20.079 4.405 1.00 3.31 C ATOM 1032 C PHE A 66 32.209 20.247 5.786 1.00 3.79 C ATOM 1033 O PHE A 66 32.828 19.328 6.321 1.00 3.94 O ATOM 1034 CB PHE A 66 30.072 20.308 4.481 1.00 3.27 C ATOM 1035 CG PHE A 66 29.440 20.589 3.145 1.00 3.23 C ATOM 1036 CD1 PHE A 66 29.595 19.705 2.088 1.00 3.49 C ATOM 1037 CD2 PHE A 66 28.693 21.739 2.946 1.00 3.34 C ATOM 1038 CE1 PHE A 66 29.017 19.963 0.860 1.00 3.79 C ATOM 1039 CE2 PHE A 66 28.113 22.002 1.719 1.00 3.52 C ATOM 1040 CZ PHE A 66 28.276 21.113 0.675 1.00 3.72 C ATOM 0 H PHE A 66 31.234 18.027 4.136 1.00 3.01 H new ATOM 0 HA PHE A 66 32.036 20.825 3.752 1.00 3.31 H new ATOM 0 HB2 PHE A 66 29.601 19.428 4.919 1.00 3.27 H new ATOM 0 HB3 PHE A 66 29.872 21.144 5.152 1.00 3.27 H new ATOM 0 HD1 PHE A 66 30.174 18.804 2.226 1.00 3.49 H new ATOM 0 HD2 PHE A 66 28.562 22.438 3.759 1.00 3.34 H new ATOM 0 HE1 PHE A 66 29.145 19.266 0.045 1.00 3.79 H new ATOM 0 HE2 PHE A 66 27.533 22.902 1.577 1.00 3.52 H new ATOM 0 HZ PHE A 66 27.825 21.317 -0.285 1.00 3.72 H new ATOM 1050 N TYR A 67 32.039 21.442 6.344 1.00 4.15 N ATOM 1051 CA TYR A 67 32.570 21.772 7.659 1.00 4.67 C ATOM 1052 C TYR A 67 31.431 22.106 8.618 1.00 4.93 C ATOM 1053 O TYR A 67 31.602 22.096 9.837 1.00 5.34 O ATOM 1054 CB TYR A 67 33.540 22.953 7.544 1.00 5.09 C ATOM 1055 CG TYR A 67 34.085 23.442 8.868 1.00 5.42 C ATOM 1056 CD1 TYR A 67 35.151 22.799 9.483 1.00 5.82 C ATOM 1057 CD2 TYR A 67 33.532 24.549 9.498 1.00 5.58 C ATOM 1058 CE1 TYR A 67 35.652 23.248 10.691 1.00 6.28 C ATOM 1059 CE2 TYR A 67 34.027 25.004 10.704 1.00 6.07 C ATOM 1060 CZ TYR A 67 35.086 24.349 11.296 1.00 6.38 C ATOM 1061 OH TYR A 67 35.582 24.799 12.498 1.00 6.97 O ATOM 0 H TYR A 67 31.531 22.205 5.898 1.00 4.15 H new ATOM 0 HA TYR A 67 33.110 20.911 8.054 1.00 4.67 H new ATOM 0 HB2 TYR A 67 34.375 22.662 6.906 1.00 5.09 H new ATOM 0 HB3 TYR A 67 33.031 23.779 7.046 1.00 5.09 H new ATOM 0 HD1 TYR A 67 35.595 21.935 9.011 1.00 5.82 H new ATOM 0 HD2 TYR A 67 32.701 25.062 9.037 1.00 5.58 H new ATOM 0 HE1 TYR A 67 36.482 22.739 11.158 1.00 6.28 H new ATOM 0 HE2 TYR A 67 33.587 25.868 11.181 1.00 6.07 H new ATOM 0 HH TYR A 67 35.073 25.584 12.789 1.00 6.97 H new ATOM 1071 N THR A 68 30.265 22.397 8.049 1.00 4.78 N ATOM 1072 CA THR A 68 29.083 22.728 8.832 1.00 5.09 C ATOM 1073 C THR A 68 27.970 21.726 8.553 1.00 4.71 C ATOM 1074 O THR A 68 27.154 21.920 7.651 1.00 4.43 O ATOM 1075 CB THR A 68 28.578 24.149 8.519 1.00 5.46 C ATOM 1076 OG1 THR A 68 28.410 24.310 7.105 1.00 5.14 O ATOM 1077 CG2 THR A 68 29.549 25.198 9.042 1.00 6.11 C ATOM 0 H THR A 68 30.115 22.410 7.040 1.00 4.78 H new ATOM 0 HA THR A 68 29.364 22.685 9.884 1.00 5.09 H new ATOM 0 HB THR A 68 27.618 24.286 9.017 1.00 5.46 H new ATOM 0 HG1 THR A 68 28.087 25.216 6.915 1.00 5.14 H new ATOM 0 HG21 THR A 68 29.170 26.193 8.809 1.00 6.11 H new ATOM 0 HG22 THR A 68 29.651 25.093 10.122 1.00 6.11 H new ATOM 0 HG23 THR A 68 30.522 25.060 8.570 1.00 6.11 H new ATOM 1085 N ARG A 69 27.952 20.652 9.332 1.00 4.80 N ATOM 1086 CA ARG A 69 26.954 19.602 9.173 1.00 4.60 C ATOM 1087 C ARG A 69 25.541 20.171 9.234 1.00 4.68 C ATOM 1088 O ARG A 69 24.647 19.707 8.526 1.00 4.42 O ATOM 1089 CB ARG A 69 27.137 18.522 10.245 1.00 4.95 C ATOM 1090 CG ARG A 69 26.768 18.963 11.659 1.00 5.58 C ATOM 1091 CD ARG A 69 27.717 20.025 12.196 1.00 5.81 C ATOM 1092 NE ARG A 69 29.099 19.782 11.790 1.00 5.91 N ATOM 1093 CZ ARG A 69 30.100 19.591 12.645 1.00 6.49 C ATOM 1094 NH1 ARG A 69 29.873 19.607 13.953 1.00 7.00 N ATOM 1095 NH2 ARG A 69 31.328 19.385 12.194 1.00 6.63 N ATOM 0 H ARG A 69 28.621 20.485 10.084 1.00 4.80 H new ATOM 0 HA ARG A 69 27.096 19.152 8.191 1.00 4.60 H new ATOM 0 HB2 ARG A 69 26.530 17.657 9.978 1.00 4.95 H new ATOM 0 HB3 ARG A 69 28.177 18.196 10.240 1.00 4.95 H new ATOM 0 HG2 ARG A 69 25.750 19.353 11.662 1.00 5.58 H new ATOM 0 HG3 ARG A 69 26.780 18.098 12.322 1.00 5.58 H new ATOM 0 HD2 ARG A 69 27.402 21.006 11.840 1.00 5.81 H new ATOM 0 HD3 ARG A 69 27.658 20.047 13.284 1.00 5.81 H new ATOM 0 HE ARG A 69 29.309 19.757 10.792 1.00 5.91 H new ATOM 0 HH11 ARG A 69 28.929 19.766 14.305 1.00 7.00 H new ATOM 0 HH12 ARG A 69 30.643 19.460 14.606 1.00 7.00 H new ATOM 0 HH21 ARG A 69 31.507 19.373 11.190 1.00 6.63 H new ATOM 0 HH22 ARG A 69 32.095 19.239 12.851 1.00 6.63 H new ATOM 1109 N LYS A 70 25.350 21.187 10.066 1.00 5.09 N ATOM 1110 CA LYS A 70 24.043 21.814 10.210 1.00 5.26 C ATOM 1111 C LYS A 70 23.568 22.345 8.867 1.00 4.89 C ATOM 1112 O LYS A 70 22.397 22.216 8.508 1.00 4.81 O ATOM 1113 CB LYS A 70 24.102 22.950 11.235 1.00 5.77 C ATOM 1114 CG LYS A 70 22.789 23.699 11.393 1.00 5.89 C ATOM 1115 CD LYS A 70 22.424 23.893 12.857 1.00 6.19 C ATOM 1116 CE LYS A 70 22.055 22.575 13.522 1.00 6.65 C ATOM 1117 NZ LYS A 70 21.693 22.757 14.956 1.00 6.82 N ATOM 0 H LYS A 70 26.081 21.593 10.650 1.00 5.09 H new ATOM 0 HA LYS A 70 23.336 21.064 10.565 1.00 5.26 H new ATOM 0 HB2 LYS A 70 24.395 22.540 12.202 1.00 5.77 H new ATOM 0 HB3 LYS A 70 24.879 23.655 10.939 1.00 5.77 H new ATOM 0 HG2 LYS A 70 22.863 24.671 10.905 1.00 5.89 H new ATOM 0 HG3 LYS A 70 21.994 23.149 10.890 1.00 5.89 H new ATOM 0 HD2 LYS A 70 23.264 24.345 13.385 1.00 6.19 H new ATOM 0 HD3 LYS A 70 21.587 24.587 12.935 1.00 6.19 H new ATOM 0 HE2 LYS A 70 21.217 22.123 12.991 1.00 6.65 H new ATOM 0 HE3 LYS A 70 22.893 21.882 13.444 1.00 6.65 H new ATOM 0 HZ1 LYS A 70 21.448 21.836 15.372 1.00 6.82 H new ATOM 0 HZ2 LYS A 70 22.501 23.165 15.469 1.00 6.82 H new ATOM 0 HZ3 LYS A 70 20.877 23.398 15.029 1.00 6.82 H new ATOM 1131 N ALA A 71 24.496 22.935 8.125 1.00 4.71 N ATOM 1132 CA ALA A 71 24.197 23.485 6.813 1.00 4.41 C ATOM 1133 C ALA A 71 23.772 22.383 5.849 1.00 3.94 C ATOM 1134 O ALA A 71 22.893 22.584 5.009 1.00 3.77 O ATOM 1135 CB ALA A 71 25.415 24.218 6.273 1.00 4.40 C ATOM 0 H ALA A 71 25.468 23.044 8.414 1.00 4.71 H new ATOM 0 HA ALA A 71 23.370 24.188 6.909 1.00 4.41 H new ATOM 0 HB1 ALA A 71 25.186 24.628 5.290 1.00 4.40 H new ATOM 0 HB2 ALA A 71 25.682 25.028 6.951 1.00 4.40 H new ATOM 0 HB3 ALA A 71 26.251 23.523 6.191 1.00 4.40 H new ATOM 1141 N ALA A 72 24.394 21.216 5.990 1.00 3.78 N ATOM 1142 CA ALA A 72 24.097 20.078 5.127 1.00 3.40 C ATOM 1143 C ALA A 72 22.625 19.698 5.195 1.00 3.51 C ATOM 1144 O ALA A 72 22.066 19.182 4.227 1.00 3.28 O ATOM 1145 CB ALA A 72 24.967 18.891 5.507 1.00 3.39 C ATOM 0 H ALA A 72 25.108 21.034 6.695 1.00 3.78 H new ATOM 0 HA ALA A 72 24.319 20.368 4.100 1.00 3.40 H new ATOM 0 HB1 ALA A 72 24.736 18.048 4.856 1.00 3.39 H new ATOM 0 HB2 ALA A 72 26.018 19.159 5.395 1.00 3.39 H new ATOM 0 HB3 ALA A 72 24.772 18.614 6.543 1.00 3.39 H new ATOM 1151 N LEU A 73 21.996 19.964 6.336 1.00 3.95 N ATOM 1152 CA LEU A 73 20.587 19.637 6.520 1.00 4.16 C ATOM 1153 C LEU A 73 19.744 20.259 5.416 1.00 4.02 C ATOM 1154 O LEU A 73 18.885 19.600 4.829 1.00 3.99 O ATOM 1155 CB LEU A 73 20.102 20.128 7.886 1.00 4.66 C ATOM 1156 CG LEU A 73 20.861 19.560 9.089 1.00 4.93 C ATOM 1157 CD1 LEU A 73 20.389 20.221 10.374 1.00 5.43 C ATOM 1158 CD2 LEU A 73 20.685 18.051 9.169 1.00 4.92 C ATOM 0 H LEU A 73 22.438 20.403 7.144 1.00 3.95 H new ATOM 0 HA LEU A 73 20.478 18.553 6.473 1.00 4.16 H new ATOM 0 HB2 LEU A 73 20.175 21.215 7.911 1.00 4.66 H new ATOM 0 HB3 LEU A 73 19.046 19.877 7.991 1.00 4.66 H new ATOM 0 HG LEU A 73 21.922 19.774 8.960 1.00 4.93 H new ATOM 0 HD11 LEU A 73 20.938 19.806 11.219 1.00 5.43 H new ATOM 0 HD12 LEU A 73 20.567 21.295 10.317 1.00 5.43 H new ATOM 0 HD13 LEU A 73 19.323 20.036 10.508 1.00 5.43 H new ATOM 0 HD21 LEU A 73 21.232 17.666 10.030 1.00 4.92 H new ATOM 0 HD22 LEU A 73 19.627 17.813 9.275 1.00 4.92 H new ATOM 0 HD23 LEU A 73 21.071 17.591 8.259 1.00 4.92 H new ATOM 1170 N GLU A 74 20.008 21.529 5.124 1.00 4.00 N ATOM 1171 CA GLU A 74 19.274 22.237 4.086 1.00 3.94 C ATOM 1172 C GLU A 74 19.516 21.591 2.726 1.00 3.55 C ATOM 1173 O GLU A 74 18.610 21.506 1.903 1.00 3.57 O ATOM 1174 CB GLU A 74 19.690 23.710 4.051 1.00 4.07 C ATOM 1175 CG GLU A 74 20.114 24.252 5.408 1.00 4.42 C ATOM 1176 CD GLU A 74 19.994 25.761 5.500 1.00 4.73 C ATOM 1177 OE1 GLU A 74 20.977 26.456 5.171 1.00 4.77 O ATOM 1178 OE2 GLU A 74 18.915 26.246 5.900 1.00 4.99 O ATOM 0 H GLU A 74 20.723 22.086 5.591 1.00 4.00 H new ATOM 0 HA GLU A 74 18.210 22.178 4.315 1.00 3.94 H new ATOM 0 HB2 GLU A 74 20.513 23.830 3.347 1.00 4.07 H new ATOM 0 HB3 GLU A 74 18.859 24.306 3.674 1.00 4.07 H new ATOM 0 HG2 GLU A 74 19.501 23.795 6.185 1.00 4.42 H new ATOM 0 HG3 GLU A 74 21.146 23.961 5.604 1.00 4.42 H new ATOM 1185 N ALA A 75 20.740 21.118 2.508 1.00 3.24 N ATOM 1186 CA ALA A 75 21.093 20.481 1.250 1.00 2.89 C ATOM 1187 C ALA A 75 20.173 19.303 0.973 1.00 2.95 C ATOM 1188 O ALA A 75 19.820 19.037 -0.173 1.00 2.87 O ATOM 1189 CB ALA A 75 22.545 20.026 1.273 1.00 2.61 C ATOM 0 H ALA A 75 21.500 21.165 3.187 1.00 3.24 H new ATOM 0 HA ALA A 75 20.971 21.210 0.449 1.00 2.89 H new ATOM 0 HB1 ALA A 75 22.793 19.551 0.324 1.00 2.61 H new ATOM 0 HB2 ALA A 75 23.194 20.888 1.428 1.00 2.61 H new ATOM 0 HB3 ALA A 75 22.690 19.312 2.084 1.00 2.61 H new ATOM 1195 N GLN A 76 19.772 18.614 2.038 1.00 3.20 N ATOM 1196 CA GLN A 76 18.891 17.463 1.912 1.00 3.38 C ATOM 1197 C GLN A 76 17.595 17.855 1.212 1.00 3.55 C ATOM 1198 O GLN A 76 17.131 17.160 0.309 1.00 3.58 O ATOM 1199 CB GLN A 76 18.581 16.876 3.290 1.00 3.75 C ATOM 1200 CG GLN A 76 19.819 16.595 4.128 1.00 3.74 C ATOM 1201 CD GLN A 76 20.811 15.692 3.422 1.00 3.45 C ATOM 1202 OE1 GLN A 76 20.749 14.469 3.543 1.00 3.63 O ATOM 1203 NE2 GLN A 76 21.735 16.294 2.682 1.00 3.07 N ATOM 0 H GLN A 76 20.044 18.835 2.996 1.00 3.20 H new ATOM 0 HA GLN A 76 19.399 16.708 1.312 1.00 3.38 H new ATOM 0 HB2 GLN A 76 17.935 17.567 3.832 1.00 3.75 H new ATOM 0 HB3 GLN A 76 18.021 15.949 3.163 1.00 3.75 H new ATOM 0 HG2 GLN A 76 20.306 17.538 4.377 1.00 3.74 H new ATOM 0 HG3 GLN A 76 19.519 16.133 5.069 1.00 3.74 H new ATOM 0 HE21 GLN A 76 21.748 17.311 2.611 1.00 3.07 H new ATOM 0 HE22 GLN A 76 22.432 15.739 2.185 1.00 3.07 H new ATOM 1212 N ASN A 77 17.026 18.984 1.623 1.00 3.74 N ATOM 1213 CA ASN A 77 15.780 19.462 1.039 1.00 3.96 C ATOM 1214 C ASN A 77 15.983 19.811 -0.430 1.00 3.80 C ATOM 1215 O ASN A 77 15.062 19.712 -1.242 1.00 3.98 O ATOM 1216 CB ASN A 77 15.257 20.676 1.823 1.00 4.24 C ATOM 1217 CG ASN A 77 15.561 22.016 1.169 1.00 4.49 C ATOM 1218 OD1 ASN A 77 16.635 22.230 0.609 1.00 4.84 O ATOM 1219 ND2 ASN A 77 14.605 22.934 1.243 1.00 4.70 N ATOM 0 H ASN A 77 17.407 19.582 2.356 1.00 3.74 H new ATOM 0 HA ASN A 77 15.035 18.668 1.100 1.00 3.96 H new ATOM 0 HB2 ASN A 77 14.178 20.579 1.944 1.00 4.24 H new ATOM 0 HB3 ASN A 77 15.692 20.665 2.822 1.00 4.24 H new ATOM 0 HD21 ASN A 77 14.748 23.854 0.827 1.00 4.70 H new ATOM 0 HD22 ASN A 77 13.727 22.719 1.716 1.00 4.70 H new ATOM 1226 N ALA A 78 17.201 20.222 -0.758 1.00 3.52 N ATOM 1227 CA ALA A 78 17.550 20.603 -2.114 1.00 3.42 C ATOM 1228 C ALA A 78 17.757 19.395 -3.025 1.00 3.30 C ATOM 1229 O ALA A 78 17.605 19.503 -4.241 1.00 3.41 O ATOM 1230 CB ALA A 78 18.795 21.474 -2.092 1.00 3.23 C ATOM 0 H ALA A 78 17.970 20.299 -0.092 1.00 3.52 H new ATOM 0 HA ALA A 78 16.713 21.166 -2.527 1.00 3.42 H new ATOM 0 HB1 ALA A 78 19.057 21.760 -3.111 1.00 3.23 H new ATOM 0 HB2 ALA A 78 18.602 22.370 -1.502 1.00 3.23 H new ATOM 0 HB3 ALA A 78 19.620 20.918 -1.648 1.00 3.23 H new ATOM 1236 N LEU A 79 18.105 18.246 -2.445 1.00 3.16 N ATOM 1237 CA LEU A 79 18.350 17.046 -3.244 1.00 3.14 C ATOM 1238 C LEU A 79 17.963 15.757 -2.525 1.00 3.35 C ATOM 1239 O LEU A 79 17.041 15.063 -2.950 1.00 3.66 O ATOM 1240 CB LEU A 79 19.827 16.998 -3.635 1.00 2.85 C ATOM 1241 CG LEU A 79 20.807 17.345 -2.507 1.00 2.57 C ATOM 1242 CD1 LEU A 79 21.585 16.115 -2.067 1.00 2.41 C ATOM 1243 CD2 LEU A 79 21.754 18.450 -2.948 1.00 2.50 C ATOM 0 H LEU A 79 18.222 18.121 -1.439 1.00 3.16 H new ATOM 0 HA LEU A 79 17.717 17.111 -4.129 1.00 3.14 H new ATOM 0 HB2 LEU A 79 20.058 15.998 -4.002 1.00 2.85 H new ATOM 0 HB3 LEU A 79 19.991 17.687 -4.463 1.00 2.85 H new ATOM 0 HG LEU A 79 20.232 17.703 -1.653 1.00 2.57 H new ATOM 0 HD11 LEU A 79 22.273 16.387 -1.267 1.00 2.41 H new ATOM 0 HD12 LEU A 79 20.891 15.355 -1.707 1.00 2.41 H new ATOM 0 HD13 LEU A 79 22.149 15.720 -2.912 1.00 2.41 H new ATOM 0 HD21 LEU A 79 22.443 18.684 -2.136 1.00 2.50 H new ATOM 0 HD22 LEU A 79 22.319 18.119 -3.819 1.00 2.50 H new ATOM 0 HD23 LEU A 79 21.180 19.340 -3.205 1.00 2.50 H new ATOM 1255 N HIS A 80 18.671 15.435 -1.448 1.00 3.27 N ATOM 1256 CA HIS A 80 18.418 14.204 -0.707 1.00 3.53 C ATOM 1257 C HIS A 80 18.764 12.998 -1.581 1.00 3.49 C ATOM 1258 O HIS A 80 19.646 13.081 -2.437 1.00 3.37 O ATOM 1259 CB HIS A 80 16.958 14.133 -0.243 1.00 3.94 C ATOM 1260 CG HIS A 80 16.801 13.612 1.154 1.00 4.25 C ATOM 1261 ND1 HIS A 80 16.472 14.418 2.224 1.00 4.68 N ATOM 1262 CD2 HIS A 80 16.925 12.360 1.654 1.00 4.44 C ATOM 1263 CE1 HIS A 80 16.403 13.685 3.322 1.00 4.89 C ATOM 1264 NE2 HIS A 80 16.673 12.432 3.002 1.00 4.71 N ATOM 0 H HIS A 80 19.424 16.009 -1.069 1.00 3.27 H new ATOM 0 HA HIS A 80 19.050 14.194 0.181 1.00 3.53 H new ATOM 0 HB2 HIS A 80 16.517 15.128 -0.303 1.00 3.94 H new ATOM 0 HB3 HIS A 80 16.398 13.494 -0.926 1.00 3.94 H new ATOM 0 HD2 HIS A 80 17.176 11.470 1.096 1.00 4.44 H new ATOM 0 HE1 HIS A 80 16.166 14.048 4.311 1.00 4.89 H new ATOM 0 HE2 HIS A 80 16.691 11.645 3.651 1.00 4.71 H new ATOM 1273 N ASN A 81 18.075 11.880 -1.372 1.00 3.77 N ATOM 1274 CA ASN A 81 18.332 10.669 -2.146 1.00 3.89 C ATOM 1275 C ASN A 81 17.715 10.737 -3.542 1.00 3.88 C ATOM 1276 O ASN A 81 18.113 9.992 -4.438 1.00 4.01 O ATOM 1277 CB ASN A 81 17.806 9.445 -1.399 1.00 4.31 C ATOM 1278 CG ASN A 81 16.313 9.515 -1.138 1.00 4.75 C ATOM 1279 OD1 ASN A 81 15.742 10.599 -1.023 1.00 4.86 O ATOM 1280 ND2 ASN A 81 15.674 8.355 -1.038 1.00 5.40 N ATOM 0 H ASN A 81 17.336 11.787 -0.675 1.00 3.77 H new ATOM 0 HA ASN A 81 19.412 10.584 -2.269 1.00 3.89 H new ATOM 0 HB2 ASN A 81 18.028 8.548 -1.978 1.00 4.31 H new ATOM 0 HB3 ASN A 81 18.333 9.350 -0.449 1.00 4.31 H new ATOM 0 HD21 ASN A 81 14.670 8.340 -0.859 1.00 5.40 H new ATOM 0 HD22 ASN A 81 16.187 7.480 -1.140 1.00 5.40 H new ATOM 1287 N MET A 82 16.749 11.629 -3.727 1.00 3.89 N ATOM 1288 CA MET A 82 16.084 11.769 -5.022 1.00 4.02 C ATOM 1289 C MET A 82 16.015 13.229 -5.460 1.00 3.90 C ATOM 1290 O MET A 82 15.489 14.082 -4.745 1.00 4.17 O ATOM 1291 CB MET A 82 14.675 11.173 -4.960 1.00 4.60 C ATOM 1292 CG MET A 82 14.067 11.195 -3.569 1.00 4.89 C ATOM 1293 SD MET A 82 12.278 11.420 -3.595 1.00 5.67 S ATOM 1294 CE MET A 82 11.904 11.359 -1.846 1.00 5.71 C ATOM 0 H MET A 82 16.409 12.263 -3.004 1.00 3.89 H new ATOM 0 HA MET A 82 16.674 11.224 -5.759 1.00 4.02 H new ATOM 0 HB2 MET A 82 14.026 11.725 -5.640 1.00 4.60 H new ATOM 0 HB3 MET A 82 14.709 10.144 -5.317 1.00 4.60 H new ATOM 0 HG2 MET A 82 14.304 10.262 -3.058 1.00 4.89 H new ATOM 0 HG3 MET A 82 14.522 11.999 -2.991 1.00 4.89 H new ATOM 0 HE1 MET A 82 10.831 11.484 -1.699 1.00 5.71 H new ATOM 0 HE2 MET A 82 12.216 10.397 -1.440 1.00 5.71 H new ATOM 0 HE3 MET A 82 12.436 12.159 -1.332 1.00 5.71 H new ATOM 1304 N LYS A 83 16.540 13.503 -6.651 1.00 3.68 N ATOM 1305 CA LYS A 83 16.548 14.856 -7.200 1.00 3.64 C ATOM 1306 C LYS A 83 16.371 14.825 -8.716 1.00 3.70 C ATOM 1307 O LYS A 83 16.877 13.926 -9.389 1.00 3.74 O ATOM 1308 CB LYS A 83 17.861 15.558 -6.843 1.00 3.51 C ATOM 1309 CG LYS A 83 17.986 16.960 -7.418 1.00 3.75 C ATOM 1310 CD LYS A 83 16.972 17.910 -6.804 1.00 3.35 C ATOM 1311 CE LYS A 83 17.131 19.320 -7.349 1.00 3.68 C ATOM 1312 NZ LYS A 83 16.159 20.265 -6.736 1.00 4.16 N ATOM 0 H LYS A 83 16.967 12.803 -7.257 1.00 3.68 H new ATOM 0 HA LYS A 83 15.715 15.409 -6.766 1.00 3.64 H new ATOM 0 HB2 LYS A 83 17.950 15.612 -5.758 1.00 3.51 H new ATOM 0 HB3 LYS A 83 18.694 14.953 -7.201 1.00 3.51 H new ATOM 0 HG2 LYS A 83 18.993 17.338 -7.241 1.00 3.75 H new ATOM 0 HG3 LYS A 83 17.844 16.925 -8.498 1.00 3.75 H new ATOM 0 HD2 LYS A 83 15.964 17.551 -7.010 1.00 3.35 H new ATOM 0 HD3 LYS A 83 17.092 17.922 -5.721 1.00 3.35 H new ATOM 0 HE2 LYS A 83 18.146 19.670 -7.160 1.00 3.68 H new ATOM 0 HE3 LYS A 83 16.994 19.309 -8.430 1.00 3.68 H new ATOM 0 HZ1 LYS A 83 16.278 21.208 -7.159 1.00 4.16 H new ATOM 0 HZ2 LYS A 83 15.191 19.927 -6.909 1.00 4.16 H new ATOM 0 HZ3 LYS A 83 16.329 20.321 -5.711 1.00 4.16 H new ATOM 1326 N VAL A 84 15.651 15.809 -9.251 1.00 4.00 N ATOM 1327 CA VAL A 84 15.421 15.886 -10.690 1.00 4.21 C ATOM 1328 C VAL A 84 15.773 17.271 -11.232 1.00 4.29 C ATOM 1329 O VAL A 84 15.246 18.286 -10.775 1.00 4.68 O ATOM 1330 CB VAL A 84 13.956 15.552 -11.045 1.00 4.91 C ATOM 1331 CG1 VAL A 84 12.994 16.431 -10.257 1.00 5.39 C ATOM 1332 CG2 VAL A 84 13.717 15.697 -12.542 1.00 5.32 C ATOM 0 H VAL A 84 15.219 16.560 -8.712 1.00 4.00 H new ATOM 0 HA VAL A 84 16.072 15.146 -11.156 1.00 4.21 H new ATOM 0 HB VAL A 84 13.769 14.514 -10.770 1.00 4.91 H new ATOM 0 HG11 VAL A 84 11.968 16.178 -10.524 1.00 5.39 H new ATOM 0 HG12 VAL A 84 13.142 16.267 -9.190 1.00 5.39 H new ATOM 0 HG13 VAL A 84 13.182 17.478 -10.493 1.00 5.39 H new ATOM 0 HG21 VAL A 84 12.678 15.457 -12.770 1.00 5.32 H new ATOM 0 HG22 VAL A 84 13.927 16.722 -12.846 1.00 5.32 H new ATOM 0 HG23 VAL A 84 14.374 15.016 -13.083 1.00 5.32 H new ATOM 1342 N LEU A 85 16.675 17.299 -12.208 1.00 4.15 N ATOM 1343 CA LEU A 85 17.112 18.549 -12.824 1.00 4.34 C ATOM 1344 C LEU A 85 16.625 18.667 -14.268 1.00 4.70 C ATOM 1345 O LEU A 85 16.474 17.659 -14.957 1.00 4.80 O ATOM 1346 CB LEU A 85 18.631 18.681 -12.771 1.00 4.21 C ATOM 1347 CG LEU A 85 19.172 19.309 -11.489 1.00 4.11 C ATOM 1348 CD1 LEU A 85 19.210 18.286 -10.365 1.00 3.90 C ATOM 1349 CD2 LEU A 85 20.549 19.905 -11.730 1.00 4.45 C ATOM 0 H LEU A 85 17.120 16.465 -12.592 1.00 4.15 H new ATOM 0 HA LEU A 85 16.668 19.362 -12.250 1.00 4.34 H new ATOM 0 HB2 LEU A 85 19.072 17.691 -12.889 1.00 4.21 H new ATOM 0 HB3 LEU A 85 18.960 19.280 -13.620 1.00 4.21 H new ATOM 0 HG LEU A 85 18.501 20.114 -11.188 1.00 4.11 H new ATOM 0 HD11 LEU A 85 19.599 18.754 -9.460 1.00 3.90 H new ATOM 0 HD12 LEU A 85 18.203 17.914 -10.177 1.00 3.90 H new ATOM 0 HD13 LEU A 85 19.856 17.456 -10.650 1.00 3.90 H new ATOM 0 HD21 LEU A 85 20.920 20.349 -10.806 1.00 4.45 H new ATOM 0 HD22 LEU A 85 21.233 19.121 -12.057 1.00 4.45 H new ATOM 0 HD23 LEU A 85 20.483 20.673 -12.500 1.00 4.45 H new ATOM 1361 N PRO A 86 16.363 19.911 -14.731 1.00 5.11 N ATOM 1362 CA PRO A 86 15.898 20.201 -16.085 1.00 5.57 C ATOM 1363 C PRO A 86 16.296 19.137 -17.103 1.00 5.64 C ATOM 1364 O PRO A 86 15.440 18.521 -17.738 1.00 5.96 O ATOM 1365 CB PRO A 86 16.621 21.514 -16.374 1.00 5.85 C ATOM 1366 CG PRO A 86 16.699 22.213 -15.051 1.00 5.81 C ATOM 1367 CD PRO A 86 16.533 21.164 -13.973 1.00 5.38 C ATOM 0 HA PRO A 86 14.811 20.238 -16.158 1.00 5.57 H new ATOM 0 HB2 PRO A 86 17.615 21.335 -16.785 1.00 5.85 H new ATOM 0 HB3 PRO A 86 16.076 22.112 -17.105 1.00 5.85 H new ATOM 0 HG2 PRO A 86 17.655 22.725 -14.944 1.00 5.81 H new ATOM 0 HG3 PRO A 86 15.920 22.971 -14.971 1.00 5.81 H new ATOM 0 HD2 PRO A 86 17.403 21.121 -13.318 1.00 5.38 H new ATOM 0 HD3 PRO A 86 15.669 21.371 -13.342 1.00 5.38 H new ATOM 1375 N GLY A 87 17.598 18.928 -17.253 1.00 5.51 N ATOM 1376 CA GLY A 87 18.088 17.943 -18.196 1.00 5.74 C ATOM 1377 C GLY A 87 18.193 18.491 -19.605 1.00 6.21 C ATOM 1378 O GLY A 87 17.911 17.788 -20.576 1.00 6.52 O ATOM 0 H GLY A 87 18.324 19.425 -16.737 1.00 5.51 H new ATOM 0 HA2 GLY A 87 19.068 17.591 -17.873 1.00 5.74 H new ATOM 0 HA3 GLY A 87 17.422 17.080 -18.194 1.00 5.74 H new ATOM 1382 N MET A 88 18.597 19.753 -19.716 1.00 6.40 N ATOM 1383 CA MET A 88 18.746 20.400 -21.013 1.00 6.91 C ATOM 1384 C MET A 88 20.223 20.517 -21.377 1.00 6.86 C ATOM 1385 O MET A 88 20.773 21.617 -21.447 1.00 7.07 O ATOM 1386 CB MET A 88 18.096 21.785 -20.991 1.00 7.26 C ATOM 1387 CG MET A 88 18.008 22.442 -22.360 1.00 7.46 C ATOM 1388 SD MET A 88 17.305 24.102 -22.290 1.00 7.81 S ATOM 1389 CE MET A 88 15.723 23.773 -21.518 1.00 8.29 C ATOM 0 H MET A 88 18.827 20.348 -18.920 1.00 6.40 H new ATOM 0 HA MET A 88 18.247 19.791 -21.767 1.00 6.91 H new ATOM 0 HB2 MET A 88 17.093 21.699 -20.574 1.00 7.26 H new ATOM 0 HB3 MET A 88 18.664 22.432 -20.323 1.00 7.26 H new ATOM 0 HG2 MET A 88 19.004 22.492 -22.800 1.00 7.46 H new ATOM 0 HG3 MET A 88 17.400 21.821 -23.018 1.00 7.46 H new ATOM 0 HE1 MET A 88 15.040 24.598 -21.721 1.00 8.29 H new ATOM 0 HE2 MET A 88 15.306 22.850 -21.921 1.00 8.29 H new ATOM 0 HE3 MET A 88 15.858 23.670 -20.441 1.00 8.29 H new ATOM 1399 N HIS A 89 20.862 19.369 -21.597 1.00 6.83 N ATOM 1400 CA HIS A 89 22.279 19.326 -21.944 1.00 6.90 C ATOM 1401 C HIS A 89 23.130 19.921 -20.825 1.00 6.45 C ATOM 1402 O HIS A 89 24.324 20.169 -21.001 1.00 6.58 O ATOM 1403 CB HIS A 89 22.534 20.073 -23.256 1.00 7.63 C ATOM 1404 CG HIS A 89 21.779 19.509 -24.420 1.00 8.02 C ATOM 1405 ND1 HIS A 89 20.713 20.157 -25.011 1.00 8.70 N ATOM 1406 CD2 HIS A 89 21.939 18.352 -25.103 1.00 8.06 C ATOM 1407 CE1 HIS A 89 20.252 19.421 -26.007 1.00 9.11 C ATOM 1408 NE2 HIS A 89 20.979 18.322 -26.084 1.00 8.74 N ATOM 0 H HIS A 89 20.417 18.453 -21.540 1.00 6.83 H new ATOM 0 HA HIS A 89 22.563 18.282 -22.075 1.00 6.90 H new ATOM 0 HB2 HIS A 89 22.260 21.120 -23.128 1.00 7.63 H new ATOM 0 HB3 HIS A 89 23.601 20.048 -23.478 1.00 7.63 H new ATOM 0 HD2 HIS A 89 22.683 17.593 -24.912 1.00 8.06 H new ATOM 0 HE1 HIS A 89 19.422 19.675 -26.649 1.00 9.11 H new ATOM 0 HE2 HIS A 89 20.849 17.572 -26.763 1.00 8.74 H new ATOM 1417 N HIS A 90 22.505 20.145 -19.670 1.00 6.08 N ATOM 1418 CA HIS A 90 23.195 20.706 -18.513 1.00 5.77 C ATOM 1419 C HIS A 90 22.672 20.098 -17.209 1.00 5.44 C ATOM 1420 O HIS A 90 22.344 20.828 -16.273 1.00 5.60 O ATOM 1421 CB HIS A 90 23.007 22.227 -18.473 1.00 6.09 C ATOM 1422 CG HIS A 90 23.592 22.941 -19.653 1.00 6.55 C ATOM 1423 ND1 HIS A 90 22.831 23.410 -20.703 1.00 7.04 N ATOM 1424 CD2 HIS A 90 24.874 23.274 -19.943 1.00 6.91 C ATOM 1425 CE1 HIS A 90 23.617 23.998 -21.586 1.00 7.58 C ATOM 1426 NE2 HIS A 90 24.861 23.929 -21.148 1.00 7.51 N ATOM 0 H HIS A 90 21.517 19.945 -19.512 1.00 6.08 H new ATOM 0 HA HIS A 90 24.254 20.468 -18.609 1.00 5.77 H new ATOM 0 HB2 HIS A 90 21.942 22.450 -18.417 1.00 6.09 H new ATOM 0 HB3 HIS A 90 23.463 22.616 -17.562 1.00 6.09 H new ATOM 0 HD1 HIS A 90 21.819 23.317 -20.785 1.00 7.04 H new ATOM 0 HD2 HIS A 90 25.743 23.063 -19.338 1.00 6.91 H new ATOM 0 HE1 HIS A 90 23.297 24.457 -22.510 1.00 7.58 H new ATOM 1435 N PRO A 91 22.585 18.753 -17.116 1.00 5.15 N ATOM 1436 CA PRO A 91 22.087 18.081 -15.923 1.00 4.98 C ATOM 1437 C PRO A 91 23.186 17.686 -14.943 1.00 4.84 C ATOM 1438 O PRO A 91 24.249 17.207 -15.339 1.00 5.14 O ATOM 1439 CB PRO A 91 21.456 16.833 -16.517 1.00 5.10 C ATOM 1440 CG PRO A 91 22.386 16.464 -17.622 1.00 5.17 C ATOM 1441 CD PRO A 91 22.941 17.768 -18.162 1.00 5.17 C ATOM 0 HA PRO A 91 21.421 18.718 -15.340 1.00 4.98 H new ATOM 0 HB2 PRO A 91 21.373 16.035 -15.779 1.00 5.10 H new ATOM 0 HB3 PRO A 91 20.450 17.030 -16.888 1.00 5.10 H new ATOM 0 HG2 PRO A 91 23.187 15.821 -17.258 1.00 5.17 H new ATOM 0 HG3 PRO A 91 21.863 15.911 -18.402 1.00 5.17 H new ATOM 0 HD2 PRO A 91 24.019 17.714 -18.312 1.00 5.17 H new ATOM 0 HD3 PRO A 91 22.498 18.026 -19.124 1.00 5.17 H new ATOM 1449 N ILE A 92 22.916 17.896 -13.661 1.00 4.52 N ATOM 1450 CA ILE A 92 23.845 17.527 -12.605 1.00 4.42 C ATOM 1451 C ILE A 92 23.070 16.853 -11.482 1.00 3.99 C ATOM 1452 O ILE A 92 21.925 17.208 -11.211 1.00 3.99 O ATOM 1453 CB ILE A 92 24.670 18.739 -12.081 1.00 4.77 C ATOM 1454 CG1 ILE A 92 24.715 18.794 -10.539 1.00 4.68 C ATOM 1455 CG2 ILE A 92 24.137 20.043 -12.662 1.00 5.46 C ATOM 1456 CD1 ILE A 92 23.556 19.535 -9.898 1.00 4.43 C ATOM 0 H ILE A 92 22.052 18.324 -13.327 1.00 4.52 H new ATOM 0 HA ILE A 92 24.576 16.831 -13.017 1.00 4.42 H new ATOM 0 HB ILE A 92 25.697 18.603 -12.420 1.00 4.77 H new ATOM 0 HG12 ILE A 92 24.735 17.775 -10.153 1.00 4.68 H new ATOM 0 HG13 ILE A 92 25.647 19.270 -10.233 1.00 4.68 H new ATOM 0 HG21 ILE A 92 24.727 20.878 -12.284 1.00 5.46 H new ATOM 0 HG22 ILE A 92 24.207 20.012 -13.749 1.00 5.46 H new ATOM 0 HG23 ILE A 92 23.095 20.173 -12.369 1.00 5.46 H new ATOM 0 HD11 ILE A 92 23.671 19.523 -8.814 1.00 4.43 H new ATOM 0 HD12 ILE A 92 23.544 20.567 -10.250 1.00 4.43 H new ATOM 0 HD13 ILE A 92 22.619 19.049 -10.169 1.00 4.43 H new ATOM 1468 N GLN A 93 23.691 15.881 -10.835 1.00 3.75 N ATOM 1469 CA GLN A 93 23.028 15.149 -9.768 1.00 3.44 C ATOM 1470 C GLN A 93 23.814 15.242 -8.473 1.00 3.12 C ATOM 1471 O GLN A 93 25.008 14.945 -8.437 1.00 3.04 O ATOM 1472 CB GLN A 93 22.854 13.686 -10.178 1.00 3.51 C ATOM 1473 CG GLN A 93 22.041 13.507 -11.452 1.00 3.77 C ATOM 1474 CD GLN A 93 20.588 13.908 -11.277 1.00 3.84 C ATOM 1475 OE1 GLN A 93 20.030 13.802 -10.184 1.00 4.15 O ATOM 1476 NE2 GLN A 93 19.968 14.372 -12.355 1.00 4.02 N ATOM 0 H GLN A 93 24.647 15.582 -11.028 1.00 3.75 H new ATOM 0 HA GLN A 93 22.048 15.595 -9.599 1.00 3.44 H new ATOM 0 HB2 GLN A 93 23.837 13.236 -10.317 1.00 3.51 H new ATOM 0 HB3 GLN A 93 22.368 13.145 -9.367 1.00 3.51 H new ATOM 0 HG2 GLN A 93 22.485 14.103 -12.249 1.00 3.77 H new ATOM 0 HG3 GLN A 93 22.091 12.465 -11.767 1.00 3.77 H new ATOM 0 HE21 GLN A 93 20.469 14.443 -13.241 1.00 4.02 H new ATOM 0 HE22 GLN A 93 18.991 14.658 -12.298 1.00 4.02 H new ATOM 1485 N MET A 94 23.137 15.657 -7.407 1.00 3.01 N ATOM 1486 CA MET A 94 23.780 15.792 -6.110 1.00 2.75 C ATOM 1487 C MET A 94 23.057 14.982 -5.048 1.00 2.77 C ATOM 1488 O MET A 94 21.858 15.142 -4.833 1.00 2.91 O ATOM 1489 CB MET A 94 23.828 17.255 -5.683 1.00 2.65 C ATOM 1490 CG MET A 94 24.730 17.495 -4.486 1.00 2.30 C ATOM 1491 SD MET A 94 24.945 19.245 -4.115 1.00 2.33 S ATOM 1492 CE MET A 94 25.818 19.789 -5.581 1.00 2.41 C ATOM 0 H MET A 94 22.147 15.904 -7.418 1.00 3.01 H new ATOM 0 HA MET A 94 24.796 15.410 -6.210 1.00 2.75 H new ATOM 0 HB2 MET A 94 24.176 17.861 -6.520 1.00 2.65 H new ATOM 0 HB3 MET A 94 22.819 17.591 -5.444 1.00 2.65 H new ATOM 0 HG2 MET A 94 24.311 16.992 -3.614 1.00 2.30 H new ATOM 0 HG3 MET A 94 25.705 17.046 -4.675 1.00 2.30 H new ATOM 0 HE1 MET A 94 26.443 20.647 -5.335 1.00 2.41 H new ATOM 0 HE2 MET A 94 26.444 18.978 -5.953 1.00 2.41 H new ATOM 0 HE3 MET A 94 25.098 20.073 -6.349 1.00 2.41 H new ATOM 1502 N LYS A 95 23.801 14.097 -4.410 1.00 2.73 N ATOM 1503 CA LYS A 95 23.272 13.256 -3.352 1.00 2.87 C ATOM 1504 C LYS A 95 24.343 13.065 -2.280 1.00 2.75 C ATOM 1505 O LYS A 95 25.519 13.037 -2.606 1.00 2.63 O ATOM 1506 CB LYS A 95 22.790 11.936 -3.938 1.00 3.24 C ATOM 1507 CG LYS A 95 23.879 11.112 -4.601 1.00 3.26 C ATOM 1508 CD LYS A 95 23.293 10.197 -5.661 1.00 3.68 C ATOM 1509 CE LYS A 95 22.954 10.968 -6.926 1.00 3.80 C ATOM 1510 NZ LYS A 95 24.177 11.356 -7.683 1.00 4.40 N ATOM 0 H LYS A 95 24.789 13.941 -4.611 1.00 2.73 H new ATOM 0 HA LYS A 95 22.412 13.730 -2.879 1.00 2.87 H new ATOM 0 HB2 LYS A 95 22.335 11.344 -3.144 1.00 3.24 H new ATOM 0 HB3 LYS A 95 22.009 12.141 -4.670 1.00 3.24 H new ATOM 0 HG2 LYS A 95 24.617 11.774 -5.053 1.00 3.26 H new ATOM 0 HG3 LYS A 95 24.400 10.519 -3.850 1.00 3.26 H new ATOM 0 HD2 LYS A 95 24.004 9.405 -5.895 1.00 3.68 H new ATOM 0 HD3 LYS A 95 22.395 9.716 -5.274 1.00 3.68 H new ATOM 0 HE2 LYS A 95 22.311 10.359 -7.562 1.00 3.80 H new ATOM 0 HE3 LYS A 95 22.389 11.863 -6.666 1.00 3.80 H new ATOM 0 HZ1 LYS A 95 23.908 11.680 -8.634 1.00 4.40 H new ATOM 0 HZ2 LYS A 95 24.667 12.124 -7.181 1.00 4.40 H new ATOM 0 HZ3 LYS A 95 24.811 10.535 -7.763 1.00 4.40 H new ATOM 1524 N PRO A 96 23.984 12.930 -0.988 1.00 2.85 N ATOM 1525 CA PRO A 96 24.966 12.788 0.075 1.00 2.87 C ATOM 1526 C PRO A 96 25.076 11.382 0.677 1.00 3.26 C ATOM 1527 O PRO A 96 24.100 10.806 1.154 1.00 3.59 O ATOM 1528 CB PRO A 96 24.393 13.754 1.113 1.00 2.87 C ATOM 1529 CG PRO A 96 22.901 13.745 0.889 1.00 2.97 C ATOM 1530 CD PRO A 96 22.642 13.036 -0.424 1.00 3.03 C ATOM 0 HA PRO A 96 25.979 12.982 -0.277 1.00 2.87 H new ATOM 0 HB2 PRO A 96 24.640 13.434 2.125 1.00 2.87 H new ATOM 0 HB3 PRO A 96 24.803 14.756 0.986 1.00 2.87 H new ATOM 0 HG2 PRO A 96 22.394 13.234 1.707 1.00 2.97 H new ATOM 0 HG3 PRO A 96 22.512 14.763 0.858 1.00 2.97 H new ATOM 0 HD2 PRO A 96 22.185 12.058 -0.275 1.00 3.03 H new ATOM 0 HD3 PRO A 96 21.973 13.606 -1.069 1.00 3.03 H new ATOM 1538 N ALA A 97 26.315 10.873 0.643 1.00 3.26 N ATOM 1539 CA ALA A 97 26.700 9.557 1.164 1.00 3.66 C ATOM 1540 C ALA A 97 25.529 8.581 1.325 1.00 3.56 C ATOM 1541 O ALA A 97 24.840 8.262 0.365 1.00 3.83 O ATOM 1542 CB ALA A 97 27.446 9.736 2.478 1.00 3.99 C ATOM 0 H ALA A 97 27.101 11.383 0.239 1.00 3.26 H new ATOM 0 HA ALA A 97 27.351 9.098 0.420 1.00 3.66 H new ATOM 0 HB1 ALA A 97 27.734 8.760 2.869 1.00 3.99 H new ATOM 0 HB2 ALA A 97 28.339 10.338 2.310 1.00 3.99 H new ATOM 0 HB3 ALA A 97 26.800 10.239 3.198 1.00 3.99 H new ATOM 1548 N ASP A 98 25.339 8.087 2.544 1.00 3.37 N ATOM 1549 CA ASP A 98 24.263 7.139 2.850 1.00 3.32 C ATOM 1550 C ASP A 98 22.927 7.839 2.893 1.00 3.17 C ATOM 1551 O ASP A 98 21.889 7.221 2.687 1.00 3.27 O ATOM 1552 CB ASP A 98 24.530 6.438 4.183 1.00 3.42 C ATOM 1553 CG ASP A 98 25.796 5.604 4.154 1.00 3.94 C ATOM 1554 OD1 ASP A 98 26.874 6.148 4.475 1.00 4.23 O ATOM 1555 OD2 ASP A 98 25.710 4.406 3.811 1.00 4.40 O ATOM 0 H ASP A 98 25.921 8.328 3.346 1.00 3.37 H new ATOM 0 HA ASP A 98 24.237 6.391 2.057 1.00 3.32 H new ATOM 0 HB2 ASP A 98 24.608 7.184 4.974 1.00 3.42 H new ATOM 0 HB3 ASP A 98 23.683 5.799 4.430 1.00 3.42 H new ATOM 1560 N SER A 99 22.955 9.130 3.152 1.00 3.17 N ATOM 1561 CA SER A 99 21.737 9.909 3.209 1.00 3.44 C ATOM 1562 C SER A 99 20.932 9.740 1.928 1.00 3.74 C ATOM 1563 O SER A 99 19.722 9.965 1.910 1.00 4.12 O ATOM 1564 CB SER A 99 22.051 11.383 3.433 1.00 3.73 C ATOM 1565 OG SER A 99 22.394 11.636 4.784 1.00 3.81 O ATOM 0 H SER A 99 23.808 9.661 3.326 1.00 3.17 H new ATOM 0 HA SER A 99 21.144 9.545 4.048 1.00 3.44 H new ATOM 0 HB2 SER A 99 22.873 11.685 2.784 1.00 3.73 H new ATOM 0 HB3 SER A 99 21.187 11.987 3.155 1.00 3.73 H new ATOM 0 HG SER A 99 22.592 12.589 4.898 1.00 3.81 H new ATOM 1571 N GLU A 100 21.613 9.345 0.858 1.00 3.82 N ATOM 1572 CA GLU A 100 20.963 9.178 -0.432 1.00 4.40 C ATOM 1573 C GLU A 100 20.832 7.728 -0.855 1.00 4.57 C ATOM 1574 O GLU A 100 21.031 7.401 -2.024 1.00 5.20 O ATOM 1575 CB GLU A 100 21.719 9.929 -1.502 1.00 4.96 C ATOM 1576 CG GLU A 100 23.197 9.594 -1.559 1.00 4.97 C ATOM 1577 CD GLU A 100 23.494 8.263 -2.228 1.00 5.69 C ATOM 1578 OE1 GLU A 100 23.639 8.239 -3.468 1.00 6.33 O ATOM 1579 OE2 GLU A 100 23.583 7.245 -1.512 1.00 5.72 O ATOM 0 H GLU A 100 22.611 9.136 0.860 1.00 3.82 H new ATOM 0 HA GLU A 100 19.957 9.580 -0.315 1.00 4.40 H new ATOM 0 HB2 GLU A 100 21.270 9.712 -2.471 1.00 4.96 H new ATOM 0 HB3 GLU A 100 21.605 10.999 -1.330 1.00 4.96 H new ATOM 0 HG2 GLU A 100 23.720 10.386 -2.096 1.00 4.97 H new ATOM 0 HG3 GLU A 100 23.597 9.579 -0.545 1.00 4.97 H new ATOM 1689 N ARG A 108 10.398 0.902 3.461 1.00 2.89 N ATOM 1690 CA ARG A 108 9.088 0.427 3.880 1.00 3.04 C ATOM 1691 C ARG A 108 8.085 0.685 2.778 1.00 2.46 C ATOM 1692 O ARG A 108 7.628 1.815 2.596 1.00 1.90 O ATOM 1693 CB ARG A 108 8.661 1.192 5.124 1.00 3.22 C ATOM 1694 CG ARG A 108 9.219 2.609 5.177 1.00 2.91 C ATOM 1695 CD ARG A 108 10.276 2.751 6.258 1.00 3.48 C ATOM 1696 NE ARG A 108 11.082 3.955 6.083 1.00 3.38 N ATOM 1697 CZ ARG A 108 12.304 4.104 6.589 1.00 3.81 C ATOM 1698 NH1 ARG A 108 12.854 3.132 7.304 1.00 4.30 N ATOM 1699 NH2 ARG A 108 12.977 5.227 6.380 1.00 3.91 N ATOM 0 HA ARG A 108 9.135 -0.641 4.093 1.00 3.04 H new ATOM 0 HB2 ARG A 108 7.572 1.235 5.161 1.00 3.22 H new ATOM 0 HB3 ARG A 108 8.988 0.646 6.009 1.00 3.22 H new ATOM 0 HG2 ARG A 108 9.649 2.868 4.210 1.00 2.91 H new ATOM 0 HG3 ARG A 108 8.409 3.313 5.364 1.00 2.91 H new ATOM 0 HD2 ARG A 108 9.793 2.777 7.235 1.00 3.48 H new ATOM 0 HD3 ARG A 108 10.925 1.876 6.247 1.00 3.48 H new ATOM 0 HE ARG A 108 10.687 4.725 5.543 1.00 3.38 H new ATOM 0 HH11 ARG A 108 12.340 2.266 7.468 1.00 4.30 H new ATOM 0 HH12 ARG A 108 13.791 3.250 7.690 1.00 4.30 H new ATOM 0 HH21 ARG A 108 12.558 5.978 5.831 1.00 3.91 H new ATOM 0 HH22 ARG A 108 13.913 5.340 6.768 1.00 3.91 H new ATOM 1713 N LYS A 109 7.642 -0.396 2.156 1.00 2.91 N ATOM 1714 CA LYS A 109 6.703 -0.311 1.050 1.00 2.73 C ATOM 1715 C LYS A 109 5.488 -1.218 1.194 1.00 3.05 C ATOM 1716 O LYS A 109 5.582 -2.340 1.691 1.00 3.83 O ATOM 1717 CB LYS A 109 7.424 -0.616 -0.261 1.00 3.38 C ATOM 1718 CG LYS A 109 7.858 0.629 -1.013 1.00 3.27 C ATOM 1719 CD LYS A 109 6.666 1.336 -1.636 1.00 3.31 C ATOM 1720 CE LYS A 109 7.100 2.488 -2.526 1.00 3.81 C ATOM 1721 NZ LYS A 109 5.938 3.156 -3.173 1.00 4.37 N ATOM 0 H LYS A 109 7.920 -1.347 2.400 1.00 2.91 H new ATOM 0 HA LYS A 109 6.320 0.709 1.054 1.00 2.73 H new ATOM 0 HB2 LYS A 109 8.301 -1.229 -0.051 1.00 3.38 H new ATOM 0 HB3 LYS A 109 6.767 -1.207 -0.899 1.00 3.38 H new ATOM 0 HG2 LYS A 109 8.372 1.308 -0.333 1.00 3.27 H new ATOM 0 HG3 LYS A 109 8.571 0.357 -1.791 1.00 3.27 H new ATOM 0 HD2 LYS A 109 6.085 0.623 -2.221 1.00 3.31 H new ATOM 0 HD3 LYS A 109 6.012 1.711 -0.848 1.00 3.31 H new ATOM 0 HE2 LYS A 109 7.654 3.216 -1.933 1.00 3.81 H new ATOM 0 HE3 LYS A 109 7.780 2.118 -3.293 1.00 3.81 H new ATOM 0 HZ1 LYS A 109 6.279 3.880 -3.837 1.00 4.37 H new ATOM 0 HZ2 LYS A 109 5.376 2.450 -3.690 1.00 4.37 H new ATOM 0 HZ3 LYS A 109 5.346 3.605 -2.445 1.00 4.37 H new ATOM 1735 N LEU A 110 4.350 -0.708 0.749 1.00 2.58 N ATOM 1736 CA LEU A 110 3.107 -1.467 0.725 1.00 2.86 C ATOM 1737 C LEU A 110 2.527 -1.389 -0.680 1.00 3.03 C ATOM 1738 O LEU A 110 2.613 -0.345 -1.330 1.00 2.83 O ATOM 1739 CB LEU A 110 2.087 -0.949 1.744 1.00 2.44 C ATOM 1740 CG LEU A 110 2.315 -1.394 3.194 1.00 3.17 C ATOM 1741 CD1 LEU A 110 2.527 -2.901 3.275 1.00 4.14 C ATOM 1742 CD2 LEU A 110 3.496 -0.653 3.795 1.00 3.11 C ATOM 0 H LEU A 110 4.261 0.244 0.394 1.00 2.58 H new ATOM 0 HA LEU A 110 3.326 -2.499 0.999 1.00 2.86 H new ATOM 0 HB2 LEU A 110 2.090 0.141 1.712 1.00 2.44 H new ATOM 0 HB3 LEU A 110 1.094 -1.274 1.435 1.00 2.44 H new ATOM 0 HG LEU A 110 1.423 -1.149 3.770 1.00 3.17 H new ATOM 0 HD11 LEU A 110 2.686 -3.191 4.314 1.00 4.14 H new ATOM 0 HD12 LEU A 110 1.647 -3.414 2.886 1.00 4.14 H new ATOM 0 HD13 LEU A 110 3.399 -3.178 2.683 1.00 4.14 H new ATOM 0 HD21 LEU A 110 3.645 -0.980 4.824 1.00 3.11 H new ATOM 0 HD22 LEU A 110 4.393 -0.865 3.213 1.00 3.11 H new ATOM 0 HD23 LEU A 110 3.299 0.419 3.780 1.00 3.11 H new ATOM 1754 N PHE A 111 1.936 -2.478 -1.148 1.00 3.75 N ATOM 1755 CA PHE A 111 1.377 -2.504 -2.493 1.00 4.24 C ATOM 1756 C PHE A 111 -0.098 -2.862 -2.479 1.00 4.19 C ATOM 1757 O PHE A 111 -0.495 -3.905 -1.963 1.00 4.56 O ATOM 1758 CB PHE A 111 2.150 -3.507 -3.357 1.00 5.34 C ATOM 1759 CG PHE A 111 1.459 -3.857 -4.647 1.00 6.09 C ATOM 1760 CD1 PHE A 111 1.487 -2.982 -5.721 1.00 6.18 C ATOM 1761 CD2 PHE A 111 0.785 -5.059 -4.786 1.00 6.87 C ATOM 1762 CE1 PHE A 111 0.857 -3.299 -6.909 1.00 6.97 C ATOM 1763 CE2 PHE A 111 0.151 -5.381 -5.971 1.00 7.61 C ATOM 1764 CZ PHE A 111 0.177 -4.507 -7.027 1.00 7.63 C ATOM 0 H PHE A 111 1.831 -3.347 -0.624 1.00 3.75 H new ATOM 0 HA PHE A 111 1.473 -1.504 -2.916 1.00 4.24 H new ATOM 0 HB2 PHE A 111 3.134 -3.095 -3.583 1.00 5.34 H new ATOM 0 HB3 PHE A 111 2.310 -4.419 -2.782 1.00 5.34 H new ATOM 0 HD1 PHE A 111 2.008 -2.040 -5.628 1.00 6.18 H new ATOM 0 HD2 PHE A 111 0.755 -5.753 -3.959 1.00 6.87 H new ATOM 0 HE1 PHE A 111 0.892 -2.612 -7.742 1.00 6.97 H new ATOM 0 HE2 PHE A 111 -0.367 -6.324 -6.066 1.00 7.61 H new ATOM 0 HZ PHE A 111 -0.329 -4.756 -7.948 1.00 7.63 H new ATOM 1774 N ILE A 112 -0.904 -1.984 -3.064 1.00 3.92 N ATOM 1775 CA ILE A 112 -2.339 -2.189 -3.147 1.00 3.86 C ATOM 1776 C ILE A 112 -2.748 -2.357 -4.607 1.00 4.75 C ATOM 1777 O ILE A 112 -2.521 -1.468 -5.430 1.00 5.06 O ATOM 1778 CB ILE A 112 -3.119 -1.020 -2.515 1.00 2.95 C ATOM 1779 CG1 ILE A 112 -2.642 -0.759 -1.081 1.00 2.19 C ATOM 1780 CG2 ILE A 112 -4.604 -1.326 -2.526 1.00 2.90 C ATOM 1781 CD1 ILE A 112 -1.392 0.090 -0.992 1.00 2.02 C ATOM 0 H ILE A 112 -0.581 -1.116 -3.491 1.00 3.92 H new ATOM 0 HA ILE A 112 -2.584 -3.092 -2.587 1.00 3.86 H new ATOM 0 HB ILE A 112 -2.935 -0.121 -3.104 1.00 2.95 H new ATOM 0 HG12 ILE A 112 -3.442 -0.268 -0.527 1.00 2.19 H new ATOM 0 HG13 ILE A 112 -2.455 -1.715 -0.592 1.00 2.19 H new ATOM 0 HG21 ILE A 112 -5.150 -0.496 -2.078 1.00 2.90 H new ATOM 0 HG22 ILE A 112 -4.939 -1.468 -3.554 1.00 2.90 H new ATOM 0 HG23 ILE A 112 -4.792 -2.235 -1.954 1.00 2.90 H new ATOM 0 HD11 ILE A 112 -1.120 0.229 0.054 1.00 2.02 H new ATOM 0 HD12 ILE A 112 -0.576 -0.408 -1.516 1.00 2.02 H new ATOM 0 HD13 ILE A 112 -1.579 1.061 -1.450 1.00 2.02 H new ATOM 1793 N GLY A 113 -3.360 -3.497 -4.919 1.00 5.33 N ATOM 1794 CA GLY A 113 -3.744 -3.785 -6.287 1.00 6.24 C ATOM 1795 C GLY A 113 -5.105 -3.263 -6.701 1.00 6.09 C ATOM 1796 O GLY A 113 -5.219 -2.571 -7.711 1.00 6.49 O ATOM 0 H GLY A 113 -3.596 -4.226 -4.246 1.00 5.33 H new ATOM 0 HA2 GLY A 113 -2.993 -3.363 -6.954 1.00 6.24 H new ATOM 0 HA3 GLY A 113 -3.728 -4.865 -6.432 1.00 6.24 H new ATOM 1800 N MET A 114 -6.140 -3.593 -5.939 1.00 5.69 N ATOM 1801 CA MET A 114 -7.491 -3.174 -6.293 1.00 5.55 C ATOM 1802 C MET A 114 -8.187 -2.396 -5.181 1.00 4.56 C ATOM 1803 O MET A 114 -8.587 -2.958 -4.162 1.00 4.05 O ATOM 1804 CB MET A 114 -8.321 -4.400 -6.665 1.00 6.00 C ATOM 1805 CG MET A 114 -8.252 -5.505 -5.626 1.00 5.90 C ATOM 1806 SD MET A 114 -8.672 -7.124 -6.300 1.00 7.01 S ATOM 1807 CE MET A 114 -7.308 -7.385 -7.432 1.00 7.54 C ATOM 0 H MET A 114 -6.073 -4.143 -5.082 1.00 5.69 H new ATOM 0 HA MET A 114 -7.405 -2.497 -7.143 1.00 5.55 H new ATOM 0 HB2 MET A 114 -9.360 -4.100 -6.799 1.00 6.00 H new ATOM 0 HB3 MET A 114 -7.975 -4.788 -7.623 1.00 6.00 H new ATOM 0 HG2 MET A 114 -7.247 -5.541 -5.206 1.00 5.90 H new ATOM 0 HG3 MET A 114 -8.931 -5.270 -4.807 1.00 5.90 H new ATOM 0 HE1 MET A 114 -6.862 -8.362 -7.246 1.00 7.54 H new ATOM 0 HE2 MET A 114 -7.673 -7.342 -8.458 1.00 7.54 H new ATOM 0 HE3 MET A 114 -6.557 -6.609 -7.282 1.00 7.54 H new ATOM 1817 N ILE A 115 -8.321 -1.095 -5.396 1.00 4.53 N ATOM 1818 CA ILE A 115 -9.008 -0.222 -4.447 1.00 3.90 C ATOM 1819 C ILE A 115 -10.160 0.516 -5.114 1.00 4.44 C ATOM 1820 O ILE A 115 -10.189 0.672 -6.336 1.00 5.25 O ATOM 1821 CB ILE A 115 -8.066 0.801 -3.792 1.00 3.67 C ATOM 1822 CG1 ILE A 115 -6.973 1.226 -4.771 1.00 4.42 C ATOM 1823 CG2 ILE A 115 -7.475 0.218 -2.522 1.00 2.85 C ATOM 1824 CD1 ILE A 115 -6.105 2.354 -4.263 1.00 4.43 C ATOM 0 H ILE A 115 -7.962 -0.616 -6.222 1.00 4.53 H new ATOM 0 HA ILE A 115 -9.394 -0.876 -3.665 1.00 3.90 H new ATOM 0 HB ILE A 115 -8.635 1.692 -3.526 1.00 3.67 H new ATOM 0 HG12 ILE A 115 -6.342 0.365 -4.992 1.00 4.42 H new ATOM 0 HG13 ILE A 115 -7.437 1.531 -5.709 1.00 4.42 H new ATOM 0 HG21 ILE A 115 -6.808 0.948 -2.063 1.00 2.85 H new ATOM 0 HG22 ILE A 115 -8.278 -0.028 -1.827 1.00 2.85 H new ATOM 0 HG23 ILE A 115 -6.914 -0.685 -2.763 1.00 2.85 H new ATOM 0 HD11 ILE A 115 -5.353 2.600 -5.012 1.00 4.43 H new ATOM 0 HD12 ILE A 115 -6.724 3.230 -4.069 1.00 4.43 H new ATOM 0 HD13 ILE A 115 -5.612 2.047 -3.341 1.00 4.43 H new ATOM 1836 N SER A 116 -11.108 0.965 -4.302 1.00 4.14 N ATOM 1837 CA SER A 116 -12.279 1.673 -4.796 1.00 4.74 C ATOM 1838 C SER A 116 -11.894 3.021 -5.395 1.00 5.61 C ATOM 1839 O SER A 116 -11.018 3.716 -4.884 1.00 5.67 O ATOM 1840 CB SER A 116 -13.278 1.877 -3.658 1.00 4.50 C ATOM 1841 OG SER A 116 -13.913 0.659 -3.308 1.00 4.35 O ATOM 0 H SER A 116 -11.087 0.849 -3.289 1.00 4.14 H new ATOM 0 HA SER A 116 -12.737 1.070 -5.580 1.00 4.74 H new ATOM 0 HB2 SER A 116 -12.764 2.285 -2.788 1.00 4.50 H new ATOM 0 HB3 SER A 116 -14.029 2.609 -3.957 1.00 4.50 H new ATOM 0 HG SER A 116 -14.545 0.818 -2.577 1.00 4.35 H new ATOM 1847 N LYS A 117 -12.563 3.375 -6.488 1.00 6.37 N ATOM 1848 CA LYS A 117 -12.299 4.628 -7.187 1.00 7.35 C ATOM 1849 C LYS A 117 -12.520 5.833 -6.279 1.00 7.65 C ATOM 1850 O LYS A 117 -12.059 6.936 -6.580 1.00 8.40 O ATOM 1851 CB LYS A 117 -13.190 4.744 -8.427 1.00 8.11 C ATOM 1852 CG LYS A 117 -12.904 3.695 -9.493 1.00 8.25 C ATOM 1853 CD LYS A 117 -13.522 2.351 -9.143 1.00 7.50 C ATOM 1854 CE LYS A 117 -12.474 1.250 -9.089 1.00 7.13 C ATOM 1855 NZ LYS A 117 -11.784 1.077 -10.397 1.00 7.69 N ATOM 0 H LYS A 117 -13.297 2.807 -6.911 1.00 6.37 H new ATOM 0 HA LYS A 117 -11.253 4.620 -7.492 1.00 7.35 H new ATOM 0 HB2 LYS A 117 -14.233 4.662 -8.122 1.00 8.11 H new ATOM 0 HB3 LYS A 117 -13.062 5.735 -8.863 1.00 8.11 H new ATOM 0 HG2 LYS A 117 -13.294 4.036 -10.452 1.00 8.25 H new ATOM 0 HG3 LYS A 117 -11.826 3.580 -9.610 1.00 8.25 H new ATOM 0 HD2 LYS A 117 -14.026 2.422 -8.179 1.00 7.50 H new ATOM 0 HD3 LYS A 117 -14.281 2.095 -9.882 1.00 7.50 H new ATOM 0 HE2 LYS A 117 -11.739 1.485 -8.319 1.00 7.13 H new ATOM 0 HE3 LYS A 117 -12.948 0.311 -8.801 1.00 7.13 H new ATOM 0 HZ1 LYS A 117 -11.371 0.124 -10.448 1.00 7.69 H new ATOM 0 HZ2 LYS A 117 -12.469 1.199 -11.170 1.00 7.69 H new ATOM 0 HZ3 LYS A 117 -11.030 1.787 -10.488 1.00 7.69 H new ATOM 1869 N LYS A 118 -13.228 5.625 -5.174 1.00 7.20 N ATOM 1870 CA LYS A 118 -13.499 6.701 -4.226 1.00 7.69 C ATOM 1871 C LYS A 118 -12.377 6.809 -3.199 1.00 7.36 C ATOM 1872 O LYS A 118 -12.626 6.877 -1.996 1.00 7.36 O ATOM 1873 CB LYS A 118 -14.837 6.467 -3.518 1.00 7.64 C ATOM 1874 CG LYS A 118 -16.054 6.804 -4.370 1.00 7.99 C ATOM 1875 CD LYS A 118 -16.241 5.811 -5.506 1.00 7.52 C ATOM 1876 CE LYS A 118 -17.459 6.155 -6.350 1.00 7.69 C ATOM 1877 NZ LYS A 118 -17.336 7.497 -6.982 1.00 7.78 N ATOM 0 H LYS A 118 -13.624 4.722 -4.912 1.00 7.20 H new ATOM 0 HA LYS A 118 -13.554 7.637 -4.782 1.00 7.69 H new ATOM 0 HB2 LYS A 118 -14.897 5.422 -3.213 1.00 7.64 H new ATOM 0 HB3 LYS A 118 -14.865 7.067 -2.608 1.00 7.64 H new ATOM 0 HG2 LYS A 118 -16.946 6.811 -3.743 1.00 7.99 H new ATOM 0 HG3 LYS A 118 -15.944 7.808 -4.779 1.00 7.99 H new ATOM 0 HD2 LYS A 118 -15.351 5.804 -6.135 1.00 7.52 H new ATOM 0 HD3 LYS A 118 -16.351 4.806 -5.098 1.00 7.52 H new ATOM 0 HE2 LYS A 118 -17.589 5.399 -7.125 1.00 7.69 H new ATOM 0 HE3 LYS A 118 -18.352 6.128 -5.726 1.00 7.69 H new ATOM 0 HZ1 LYS A 118 -18.057 7.598 -7.725 1.00 7.78 H new ATOM 0 HZ2 LYS A 118 -17.476 8.234 -6.262 1.00 7.78 H new ATOM 0 HZ3 LYS A 118 -16.390 7.598 -7.401 1.00 7.78 H new ATOM 1891 N CYS A 119 -11.137 6.825 -3.684 1.00 7.20 N ATOM 1892 CA CYS A 119 -9.976 6.919 -2.808 1.00 6.89 C ATOM 1893 C CYS A 119 -9.015 8.008 -3.268 1.00 7.58 C ATOM 1894 O CYS A 119 -8.661 8.084 -4.445 1.00 7.88 O ATOM 1895 CB CYS A 119 -9.238 5.581 -2.758 1.00 5.83 C ATOM 1896 SG CYS A 119 -10.224 4.215 -2.100 1.00 5.00 S ATOM 0 H CYS A 119 -10.913 6.774 -4.678 1.00 7.20 H new ATOM 0 HA CYS A 119 -10.338 7.176 -1.813 1.00 6.89 H new ATOM 0 HB2 CYS A 119 -8.907 5.324 -3.764 1.00 5.83 H new ATOM 0 HB3 CYS A 119 -8.343 5.695 -2.147 1.00 5.83 H new ATOM 0 HG CYS A 119 -10.890 3.656 -3.066 1.00 5.00 H new ATOM 1902 N THR A 120 -8.597 8.849 -2.328 1.00 7.94 N ATOM 1903 CA THR A 120 -7.656 9.922 -2.621 1.00 8.60 C ATOM 1904 C THR A 120 -6.316 9.626 -1.964 1.00 8.03 C ATOM 1905 O THR A 120 -6.268 8.948 -0.938 1.00 7.32 O ATOM 1906 CB THR A 120 -8.170 11.284 -2.125 1.00 9.61 C ATOM 1907 OG1 THR A 120 -9.565 11.420 -2.420 1.00 9.96 O ATOM 1908 CG2 THR A 120 -7.398 12.421 -2.777 1.00 10.47 C ATOM 0 H THR A 120 -8.897 8.807 -1.354 1.00 7.94 H new ATOM 0 HA THR A 120 -7.543 9.973 -3.704 1.00 8.60 H new ATOM 0 HB THR A 120 -8.021 11.333 -1.046 1.00 9.61 H new ATOM 0 HG1 THR A 120 -9.884 12.289 -2.099 1.00 9.96 H new ATOM 0 HG21 THR A 120 -7.778 13.375 -2.412 1.00 10.47 H new ATOM 0 HG22 THR A 120 -6.340 12.332 -2.528 1.00 10.47 H new ATOM 0 HG23 THR A 120 -7.522 12.371 -3.859 1.00 10.47 H new ATOM 1916 N GLU A 121 -5.233 10.124 -2.543 1.00 8.38 N ATOM 1917 CA GLU A 121 -3.910 9.869 -1.989 1.00 7.86 C ATOM 1918 C GLU A 121 -3.806 10.368 -0.550 1.00 7.95 C ATOM 1919 O GLU A 121 -3.389 9.627 0.341 1.00 7.23 O ATOM 1920 CB GLU A 121 -2.841 10.526 -2.870 1.00 8.41 C ATOM 1921 CG GLU A 121 -1.507 10.746 -2.172 1.00 8.20 C ATOM 1922 CD GLU A 121 -0.507 11.476 -3.046 1.00 8.99 C ATOM 1923 OE1 GLU A 121 0.142 10.814 -3.882 1.00 9.38 O ATOM 1924 OE2 GLU A 121 -0.370 12.707 -2.892 1.00 9.31 O ATOM 0 H GLU A 121 -5.242 10.700 -3.385 1.00 8.38 H new ATOM 0 HA GLU A 121 -3.745 8.792 -1.975 1.00 7.86 H new ATOM 0 HB2 GLU A 121 -2.679 9.904 -3.751 1.00 8.41 H new ATOM 0 HB3 GLU A 121 -3.217 11.487 -3.223 1.00 8.41 H new ATOM 0 HG2 GLU A 121 -1.669 11.316 -1.257 1.00 8.20 H new ATOM 0 HG3 GLU A 121 -1.092 9.782 -1.878 1.00 8.20 H new ATOM 1931 N ASN A 122 -4.250 11.595 -0.311 1.00 8.92 N ATOM 1932 CA ASN A 122 -4.196 12.165 1.028 1.00 9.27 C ATOM 1933 C ASN A 122 -5.095 11.383 1.969 1.00 8.93 C ATOM 1934 O ASN A 122 -4.704 11.041 3.086 1.00 8.77 O ATOM 1935 CB ASN A 122 -4.613 13.637 1.003 1.00 10.46 C ATOM 1936 CG ASN A 122 -5.230 14.087 2.314 1.00 10.98 C ATOM 1937 OD1 ASN A 122 -6.450 14.189 2.435 1.00 11.25 O ATOM 1938 ND2 ASN A 122 -4.387 14.342 3.308 1.00 11.25 N ATOM 0 H ASN A 122 -4.648 12.210 -1.021 1.00 8.92 H new ATOM 0 HA ASN A 122 -3.169 12.102 1.388 1.00 9.27 H new ATOM 0 HB2 ASN A 122 -3.742 14.255 0.784 1.00 10.46 H new ATOM 0 HB3 ASN A 122 -5.328 13.795 0.195 1.00 10.46 H new ATOM 0 HD21 ASN A 122 -4.744 14.636 4.217 1.00 11.25 H new ATOM 0 HD22 ASN A 122 -3.382 14.244 3.162 1.00 11.25 H new ATOM 1945 N ASP A 123 -6.301 11.095 1.498 1.00 8.91 N ATOM 1946 CA ASP A 123 -7.270 10.353 2.286 1.00 8.65 C ATOM 1947 C ASP A 123 -6.707 9.003 2.702 1.00 7.63 C ATOM 1948 O ASP A 123 -6.992 8.513 3.794 1.00 7.63 O ATOM 1949 CB ASP A 123 -8.555 10.153 1.484 1.00 8.67 C ATOM 1950 CG ASP A 123 -9.737 9.794 2.363 1.00 8.97 C ATOM 1951 OD1 ASP A 123 -10.331 10.715 2.964 1.00 9.52 O ATOM 1952 OD2 ASP A 123 -10.070 8.594 2.449 1.00 8.72 O ATOM 0 H ASP A 123 -6.630 11.366 0.571 1.00 8.91 H new ATOM 0 HA ASP A 123 -7.492 10.928 3.185 1.00 8.65 H new ATOM 0 HB2 ASP A 123 -8.781 11.065 0.932 1.00 8.67 H new ATOM 0 HB3 ASP A 123 -8.401 9.364 0.748 1.00 8.67 H new ATOM 1957 N ILE A 124 -5.882 8.416 1.836 1.00 6.86 N ATOM 1958 CA ILE A 124 -5.299 7.116 2.119 1.00 5.85 C ATOM 1959 C ILE A 124 -4.518 7.158 3.421 1.00 6.05 C ATOM 1960 O ILE A 124 -4.639 6.262 4.258 1.00 5.79 O ATOM 1961 CB ILE A 124 -4.383 6.652 0.966 1.00 5.17 C ATOM 1962 CG1 ILE A 124 -5.219 6.059 -0.170 1.00 4.90 C ATOM 1963 CG2 ILE A 124 -3.347 5.645 1.453 1.00 4.29 C ATOM 1964 CD1 ILE A 124 -6.004 4.821 0.218 1.00 4.19 C ATOM 0 H ILE A 124 -5.607 8.820 0.941 1.00 6.86 H new ATOM 0 HA ILE A 124 -6.114 6.398 2.216 1.00 5.85 H new ATOM 0 HB ILE A 124 -3.847 7.523 0.589 1.00 5.17 H new ATOM 0 HG12 ILE A 124 -5.914 6.818 -0.530 1.00 4.90 H new ATOM 0 HG13 ILE A 124 -4.559 5.811 -1.001 1.00 4.90 H new ATOM 0 HG21 ILE A 124 -2.718 5.338 0.618 1.00 4.29 H new ATOM 0 HG22 ILE A 124 -2.728 6.104 2.224 1.00 4.29 H new ATOM 0 HG23 ILE A 124 -3.854 4.773 1.866 1.00 4.29 H new ATOM 0 HD11 ILE A 124 -6.569 4.464 -0.643 1.00 4.19 H new ATOM 0 HD12 ILE A 124 -5.316 4.043 0.549 1.00 4.19 H new ATOM 0 HD13 ILE A 124 -6.692 5.065 1.027 1.00 4.19 H new ATOM 1976 N ARG A 125 -3.746 8.224 3.601 1.00 6.68 N ATOM 1977 CA ARG A 125 -2.948 8.381 4.803 1.00 7.01 C ATOM 1978 C ARG A 125 -3.834 8.264 6.034 1.00 7.61 C ATOM 1979 O ARG A 125 -3.488 7.582 6.997 1.00 7.60 O ATOM 1980 CB ARG A 125 -2.242 9.737 4.800 1.00 7.78 C ATOM 1981 CG ARG A 125 -1.330 9.954 5.998 1.00 8.22 C ATOM 1982 CD ARG A 125 -1.114 11.434 6.273 1.00 8.67 C ATOM 1983 NE ARG A 125 -2.353 12.098 6.670 1.00 9.09 N ATOM 1984 CZ ARG A 125 -2.412 13.352 7.109 1.00 9.67 C ATOM 1985 NH1 ARG A 125 -1.309 14.082 7.201 1.00 9.86 N ATOM 1986 NH2 ARG A 125 -3.579 13.879 7.454 1.00 10.27 N ATOM 0 H ARG A 125 -3.658 8.988 2.930 1.00 6.68 H new ATOM 0 HA ARG A 125 -2.195 7.593 4.827 1.00 7.01 H new ATOM 0 HB2 ARG A 125 -1.655 9.829 3.886 1.00 7.78 H new ATOM 0 HB3 ARG A 125 -2.992 10.527 4.778 1.00 7.78 H new ATOM 0 HG2 ARG A 125 -1.764 9.479 6.878 1.00 8.22 H new ATOM 0 HG3 ARG A 125 -0.369 9.472 5.817 1.00 8.22 H new ATOM 0 HD2 ARG A 125 -0.370 11.553 7.060 1.00 8.67 H new ATOM 0 HD3 ARG A 125 -0.714 11.915 5.381 1.00 8.67 H new ATOM 0 HE ARG A 125 -3.223 11.569 6.607 1.00 9.09 H new ATOM 0 HH11 ARG A 125 -0.409 13.682 6.934 1.00 9.86 H new ATOM 0 HH12 ARG A 125 -1.360 15.043 7.538 1.00 9.86 H new ATOM 0 HH21 ARG A 125 -4.431 13.323 7.383 1.00 10.27 H new ATOM 0 HH22 ARG A 125 -3.625 14.841 7.791 1.00 10.27 H new ATOM 2000 N VAL A 126 -5.001 8.898 5.972 1.00 8.22 N ATOM 2001 CA VAL A 126 -5.938 8.883 7.086 1.00 8.90 C ATOM 2002 C VAL A 126 -6.274 7.457 7.497 1.00 8.37 C ATOM 2003 O VAL A 126 -6.264 7.126 8.682 1.00 8.88 O ATOM 2004 CB VAL A 126 -7.241 9.626 6.735 1.00 9.46 C ATOM 2005 CG1 VAL A 126 -8.181 9.655 7.932 1.00 10.20 C ATOM 2006 CG2 VAL A 126 -6.940 11.037 6.250 1.00 10.10 C ATOM 0 H VAL A 126 -5.319 9.428 5.161 1.00 8.22 H new ATOM 0 HA VAL A 126 -5.452 9.394 7.917 1.00 8.90 H new ATOM 0 HB VAL A 126 -7.736 9.087 5.927 1.00 9.46 H new ATOM 0 HG11 VAL A 126 -9.095 10.184 7.664 1.00 10.20 H new ATOM 0 HG12 VAL A 126 -8.425 8.635 8.227 1.00 10.20 H new ATOM 0 HG13 VAL A 126 -7.696 10.167 8.763 1.00 10.20 H new ATOM 0 HG21 VAL A 126 -7.873 11.545 6.007 1.00 10.10 H new ATOM 0 HG22 VAL A 126 -6.420 11.588 7.034 1.00 10.10 H new ATOM 0 HG23 VAL A 126 -6.311 10.990 5.361 1.00 10.10 H new ATOM 2016 N MET A 127 -6.547 6.606 6.516 1.00 7.45 N ATOM 2017 CA MET A 127 -6.887 5.220 6.797 1.00 7.01 C ATOM 2018 C MET A 127 -5.713 4.517 7.465 1.00 6.90 C ATOM 2019 O MET A 127 -5.886 3.770 8.431 1.00 7.35 O ATOM 2020 CB MET A 127 -7.263 4.486 5.510 1.00 6.01 C ATOM 2021 CG MET A 127 -7.986 3.172 5.752 1.00 5.80 C ATOM 2022 SD MET A 127 -7.681 1.960 4.453 1.00 4.71 S ATOM 2023 CE MET A 127 -5.971 1.540 4.782 1.00 4.35 C ATOM 0 H MET A 127 -6.539 6.850 5.526 1.00 7.45 H new ATOM 0 HA MET A 127 -7.744 5.208 7.471 1.00 7.01 H new ATOM 0 HB2 MET A 127 -7.896 5.134 4.903 1.00 6.01 H new ATOM 0 HB3 MET A 127 -6.358 4.293 4.933 1.00 6.01 H new ATOM 0 HG2 MET A 127 -7.670 2.759 6.710 1.00 5.80 H new ATOM 0 HG3 MET A 127 -9.057 3.359 5.824 1.00 5.80 H new ATOM 0 HE1 MET A 127 -5.465 1.313 3.844 1.00 4.35 H new ATOM 0 HE2 MET A 127 -5.476 2.382 5.267 1.00 4.35 H new ATOM 0 HE3 MET A 127 -5.930 0.669 5.436 1.00 4.35 H new ATOM 2033 N PHE A 128 -4.515 4.796 6.968 1.00 6.45 N ATOM 2034 CA PHE A 128 -3.312 4.175 7.497 1.00 6.34 C ATOM 2035 C PHE A 128 -2.952 4.769 8.852 1.00 7.39 C ATOM 2036 O PHE A 128 -2.250 4.142 9.646 1.00 7.66 O ATOM 2037 CB PHE A 128 -2.149 4.325 6.511 1.00 5.52 C ATOM 2038 CG PHE A 128 -2.174 3.324 5.392 1.00 4.45 C ATOM 2039 CD1 PHE A 128 -2.996 3.512 4.293 1.00 4.02 C ATOM 2040 CD2 PHE A 128 -1.376 2.192 5.441 1.00 4.07 C ATOM 2041 CE1 PHE A 128 -3.019 2.591 3.262 1.00 3.10 C ATOM 2042 CE2 PHE A 128 -1.396 1.268 4.414 1.00 3.27 C ATOM 2043 CZ PHE A 128 -2.219 1.469 3.323 1.00 2.70 C ATOM 0 H PHE A 128 -4.352 5.448 6.200 1.00 6.45 H new ATOM 0 HA PHE A 128 -3.507 3.111 7.634 1.00 6.34 H new ATOM 0 HB2 PHE A 128 -2.170 5.330 6.089 1.00 5.52 H new ATOM 0 HB3 PHE A 128 -1.209 4.227 7.054 1.00 5.52 H new ATOM 0 HD1 PHE A 128 -3.626 4.388 4.241 1.00 4.02 H new ATOM 0 HD2 PHE A 128 -0.731 2.030 6.292 1.00 4.07 H new ATOM 0 HE1 PHE A 128 -3.663 2.750 2.410 1.00 3.10 H new ATOM 0 HE2 PHE A 128 -0.769 0.390 4.464 1.00 3.27 H new ATOM 0 HZ PHE A 128 -2.236 0.748 2.519 1.00 2.70 H new ATOM 2053 N SER A 129 -3.431 5.985 9.111 1.00 8.07 N ATOM 2054 CA SER A 129 -3.152 6.659 10.373 1.00 9.09 C ATOM 2055 C SER A 129 -3.702 5.847 11.539 1.00 9.73 C ATOM 2056 O SER A 129 -3.231 5.970 12.670 1.00 10.48 O ATOM 2057 CB SER A 129 -3.755 8.065 10.383 1.00 9.77 C ATOM 2058 OG SER A 129 -5.125 8.033 10.738 1.00 10.65 O ATOM 0 H SER A 129 -4.012 6.520 8.465 1.00 8.07 H new ATOM 0 HA SER A 129 -2.071 6.746 10.480 1.00 9.09 H new ATOM 0 HB2 SER A 129 -3.209 8.693 11.087 1.00 9.77 H new ATOM 0 HB3 SER A 129 -3.642 8.519 9.398 1.00 9.77 H new ATOM 0 HG SER A 129 -5.674 8.052 9.926 1.00 10.65 H new ATOM 2064 N SER A 130 -4.707 5.021 11.254 1.00 9.49 N ATOM 2065 CA SER A 130 -5.319 4.187 12.280 1.00 10.16 C ATOM 2066 C SER A 130 -4.300 3.210 12.858 1.00 10.26 C ATOM 2067 O SER A 130 -4.442 2.744 13.989 1.00 11.09 O ATOM 2068 CB SER A 130 -6.509 3.419 11.698 1.00 9.81 C ATOM 2069 OG SER A 130 -7.502 4.307 11.218 1.00 10.25 O ATOM 0 H SER A 130 -5.112 4.913 10.324 1.00 9.49 H new ATOM 0 HA SER A 130 -5.673 4.835 13.082 1.00 10.16 H new ATOM 0 HB2 SER A 130 -6.169 2.775 10.887 1.00 9.81 H new ATOM 0 HB3 SER A 130 -6.936 2.770 12.462 1.00 9.81 H new ATOM 0 HG SER A 130 -8.251 3.793 10.850 1.00 10.25 H new ATOM 2075 N PHE A 131 -3.273 2.907 12.071 1.00 9.46 N ATOM 2076 CA PHE A 131 -2.226 1.987 12.493 1.00 9.57 C ATOM 2077 C PHE A 131 -1.087 2.731 13.187 1.00 9.98 C ATOM 2078 O PHE A 131 -0.787 2.475 14.353 1.00 10.80 O ATOM 2079 CB PHE A 131 -1.689 1.216 11.285 1.00 8.58 C ATOM 2080 CG PHE A 131 -2.768 0.645 10.409 1.00 8.00 C ATOM 2081 CD1 PHE A 131 -3.648 -0.308 10.900 1.00 8.07 C ATOM 2082 CD2 PHE A 131 -2.905 1.064 9.097 1.00 7.49 C ATOM 2083 CE1 PHE A 131 -4.644 -0.830 10.096 1.00 7.58 C ATOM 2084 CE2 PHE A 131 -3.898 0.545 8.288 1.00 6.97 C ATOM 2085 CZ PHE A 131 -4.767 -0.403 8.787 1.00 6.97 C ATOM 0 H PHE A 131 -3.144 3.288 11.134 1.00 9.46 H new ATOM 0 HA PHE A 131 -2.657 1.285 13.206 1.00 9.57 H new ATOM 0 HB2 PHE A 131 -1.062 1.880 10.690 1.00 8.58 H new ATOM 0 HB3 PHE A 131 -1.051 0.405 11.636 1.00 8.58 H new ATOM 0 HD1 PHE A 131 -3.554 -0.646 11.921 1.00 8.07 H new ATOM 0 HD2 PHE A 131 -2.227 1.806 8.701 1.00 7.49 H new ATOM 0 HE1 PHE A 131 -5.325 -1.570 10.490 1.00 7.58 H new ATOM 0 HE2 PHE A 131 -3.994 0.881 7.266 1.00 6.97 H new ATOM 0 HZ PHE A 131 -5.543 -0.811 8.156 1.00 6.97 H new ATOM 2095 N GLY A 132 -0.453 3.653 12.462 1.00 9.45 N ATOM 2096 CA GLY A 132 0.648 4.412 13.030 1.00 9.82 C ATOM 2097 C GLY A 132 0.986 5.657 12.229 1.00 9.42 C ATOM 2098 O GLY A 132 0.094 6.355 11.747 1.00 9.41 O ATOM 0 H GLY A 132 -0.682 3.886 11.496 1.00 9.45 H new ATOM 0 HA2 GLY A 132 0.395 4.701 14.050 1.00 9.82 H new ATOM 0 HA3 GLY A 132 1.530 3.774 13.089 1.00 9.82 H new ATOM 2102 N GLN A 133 2.281 5.933 12.091 1.00 9.20 N ATOM 2103 CA GLN A 133 2.748 7.104 11.352 1.00 8.95 C ATOM 2104 C GLN A 133 3.073 6.754 9.901 1.00 7.78 C ATOM 2105 O GLN A 133 3.770 5.779 9.626 1.00 7.16 O ATOM 2106 CB GLN A 133 3.983 7.698 12.037 1.00 9.43 C ATOM 2107 CG GLN A 133 4.672 8.785 11.227 1.00 9.26 C ATOM 2108 CD GLN A 133 3.752 9.943 10.896 1.00 9.65 C ATOM 2109 OE1 GLN A 133 2.837 10.262 11.656 1.00 10.41 O ATOM 2110 NE2 GLN A 133 3.990 10.579 9.755 1.00 9.25 N ATOM 0 H GLN A 133 3.028 5.359 12.483 1.00 9.20 H new ATOM 0 HA GLN A 133 1.946 7.842 11.349 1.00 8.95 H new ATOM 0 HB2 GLN A 133 3.689 8.109 13.003 1.00 9.43 H new ATOM 0 HB3 GLN A 133 4.697 6.898 12.235 1.00 9.43 H new ATOM 0 HG2 GLN A 133 5.531 9.158 11.784 1.00 9.26 H new ATOM 0 HG3 GLN A 133 5.055 8.355 10.301 1.00 9.26 H new ATOM 0 HE21 GLN A 133 4.759 10.280 9.156 1.00 9.25 H new ATOM 0 HE22 GLN A 133 3.403 11.366 9.478 1.00 9.25 H new ATOM 2119 N ILE A 134 2.565 7.568 8.979 1.00 7.58 N ATOM 2120 CA ILE A 134 2.794 7.356 7.554 1.00 6.58 C ATOM 2121 C ILE A 134 3.919 8.245 7.042 1.00 6.62 C ATOM 2122 O ILE A 134 3.837 9.471 7.119 1.00 7.42 O ATOM 2123 CB ILE A 134 1.511 7.630 6.734 1.00 6.45 C ATOM 2124 CG1 ILE A 134 0.554 6.446 6.840 1.00 6.02 C ATOM 2125 CG2 ILE A 134 1.836 7.923 5.272 1.00 5.90 C ATOM 2126 CD1 ILE A 134 -0.053 6.287 8.213 1.00 6.94 C ATOM 0 H ILE A 134 1.990 8.383 9.195 1.00 7.58 H new ATOM 0 HA ILE A 134 3.079 6.312 7.427 1.00 6.58 H new ATOM 0 HB ILE A 134 1.029 8.514 7.151 1.00 6.45 H new ATOM 0 HG12 ILE A 134 -0.246 6.568 6.109 1.00 6.02 H new ATOM 0 HG13 ILE A 134 1.088 5.532 6.579 1.00 6.02 H new ATOM 0 HG21 ILE A 134 0.912 8.111 4.725 1.00 5.90 H new ATOM 0 HG22 ILE A 134 2.479 8.801 5.211 1.00 5.90 H new ATOM 0 HG23 ILE A 134 2.349 7.067 4.835 1.00 5.90 H new ATOM 0 HD11 ILE A 134 -0.723 5.427 8.217 1.00 6.94 H new ATOM 0 HD12 ILE A 134 0.739 6.134 8.946 1.00 6.94 H new ATOM 0 HD13 ILE A 134 -0.615 7.185 8.469 1.00 6.94 H new ATOM 2138 N GLU A 135 4.970 7.621 6.517 1.00 5.83 N ATOM 2139 CA GLU A 135 6.098 8.366 5.979 1.00 5.88 C ATOM 2140 C GLU A 135 5.711 9.007 4.657 1.00 5.91 C ATOM 2141 O GLU A 135 5.981 10.185 4.423 1.00 6.67 O ATOM 2142 CB GLU A 135 7.311 7.455 5.790 1.00 5.10 C ATOM 2143 CG GLU A 135 8.256 7.451 6.978 1.00 5.50 C ATOM 2144 CD GLU A 135 9.506 6.632 6.730 1.00 6.06 C ATOM 2145 OE1 GLU A 135 10.085 6.751 5.628 1.00 6.00 O ATOM 2146 OE2 GLU A 135 9.909 5.871 7.635 1.00 6.66 O ATOM 0 H GLU A 135 5.062 6.607 6.454 1.00 5.83 H new ATOM 0 HA GLU A 135 6.367 9.147 6.690 1.00 5.88 H new ATOM 0 HB2 GLU A 135 6.966 6.437 5.607 1.00 5.10 H new ATOM 0 HB3 GLU A 135 7.858 7.771 4.902 1.00 5.10 H new ATOM 0 HG2 GLU A 135 8.540 8.477 7.214 1.00 5.50 H new ATOM 0 HG3 GLU A 135 7.735 7.056 7.850 1.00 5.50 H new ATOM 2153 N GLU A 136 5.076 8.222 3.793 1.00 5.21 N ATOM 2154 CA GLU A 136 4.639 8.721 2.497 1.00 5.43 C ATOM 2155 C GLU A 136 3.331 8.064 2.072 1.00 5.05 C ATOM 2156 O GLU A 136 3.124 6.869 2.285 1.00 4.20 O ATOM 2157 CB GLU A 136 5.717 8.486 1.438 1.00 5.17 C ATOM 2158 CG GLU A 136 5.442 9.205 0.126 1.00 5.90 C ATOM 2159 CD GLU A 136 6.642 9.202 -0.802 1.00 5.96 C ATOM 2160 OE1 GLU A 136 7.725 9.653 -0.374 1.00 6.14 O ATOM 2161 OE2 GLU A 136 6.498 8.750 -1.956 1.00 5.95 O ATOM 0 H GLU A 136 4.854 7.242 3.967 1.00 5.21 H new ATOM 0 HA GLU A 136 4.469 9.794 2.591 1.00 5.43 H new ATOM 0 HB2 GLU A 136 6.679 8.816 1.830 1.00 5.17 H new ATOM 0 HB3 GLU A 136 5.801 7.416 1.247 1.00 5.17 H new ATOM 0 HG2 GLU A 136 4.599 8.730 -0.375 1.00 5.90 H new ATOM 0 HG3 GLU A 136 5.150 10.234 0.334 1.00 5.90 H new ATOM 2168 N CYS A 137 2.452 8.854 1.467 1.00 5.74 N ATOM 2169 CA CYS A 137 1.167 8.355 0.996 1.00 5.52 C ATOM 2170 C CYS A 137 1.014 8.650 -0.489 1.00 5.95 C ATOM 2171 O CYS A 137 1.128 9.799 -0.917 1.00 6.88 O ATOM 2172 CB CYS A 137 0.023 9.001 1.782 1.00 6.14 C ATOM 2173 SG CYS A 137 0.034 10.810 1.755 1.00 7.54 S ATOM 0 H CYS A 137 2.607 9.847 1.291 1.00 5.74 H new ATOM 0 HA CYS A 137 1.128 7.277 1.153 1.00 5.52 H new ATOM 0 HB2 CYS A 137 -0.926 8.648 1.377 1.00 6.14 H new ATOM 0 HB3 CYS A 137 0.073 8.664 2.817 1.00 6.14 H new ATOM 0 HG CYS A 137 0.542 11.224 0.632 1.00 7.54 H new ATOM 2179 N ARG A 138 0.763 7.609 -1.276 1.00 5.43 N ATOM 2180 CA ARG A 138 0.627 7.769 -2.715 1.00 6.08 C ATOM 2181 C ARG A 138 -0.522 6.941 -3.271 1.00 5.90 C ATOM 2182 O ARG A 138 -0.754 5.808 -2.850 1.00 5.02 O ATOM 2183 CB ARG A 138 1.927 7.382 -3.420 1.00 6.07 C ATOM 2184 CG ARG A 138 3.053 7.012 -2.468 1.00 5.34 C ATOM 2185 CD ARG A 138 4.280 6.521 -3.218 1.00 5.40 C ATOM 2186 NE ARG A 138 5.332 6.072 -2.309 1.00 4.64 N ATOM 2187 CZ ARG A 138 6.614 5.986 -2.651 1.00 4.78 C ATOM 2188 NH1 ARG A 138 7.003 6.316 -3.877 1.00 5.71 N ATOM 2189 NH2 ARG A 138 7.511 5.571 -1.768 1.00 4.08 N ATOM 0 H ARG A 138 0.651 6.652 -0.942 1.00 5.43 H new ATOM 0 HA ARG A 138 0.408 8.820 -2.904 1.00 6.08 H new ATOM 0 HB2 ARG A 138 1.733 6.539 -4.084 1.00 6.07 H new ATOM 0 HB3 ARG A 138 2.251 8.213 -4.046 1.00 6.07 H new ATOM 0 HG2 ARG A 138 3.318 7.879 -1.863 1.00 5.34 H new ATOM 0 HG3 ARG A 138 2.711 6.237 -1.782 1.00 5.34 H new ATOM 0 HD2 ARG A 138 3.997 5.702 -3.879 1.00 5.40 H new ATOM 0 HD3 ARG A 138 4.664 7.322 -3.850 1.00 5.40 H new ATOM 0 HE ARG A 138 5.068 5.810 -1.359 1.00 4.64 H new ATOM 0 HH11 ARG A 138 6.317 6.637 -4.561 1.00 5.71 H new ATOM 0 HH12 ARG A 138 7.987 6.249 -4.135 1.00 5.71 H new ATOM 0 HH21 ARG A 138 7.218 5.317 -0.825 1.00 4.08 H new ATOM 0 HH22 ARG A 138 8.494 5.506 -2.032 1.00 4.08 H new ATOM 2203 N ILE A 139 -1.236 7.525 -4.221 1.00 6.77 N ATOM 2204 CA ILE A 139 -2.349 6.857 -4.869 1.00 6.80 C ATOM 2205 C ILE A 139 -2.227 6.989 -6.376 1.00 7.75 C ATOM 2206 O ILE A 139 -1.715 7.986 -6.883 1.00 8.55 O ATOM 2207 CB ILE A 139 -3.731 7.380 -4.398 1.00 6.95 C ATOM 2208 CG1 ILE A 139 -4.437 6.279 -3.601 1.00 5.96 C ATOM 2209 CG2 ILE A 139 -4.592 7.839 -5.579 1.00 7.85 C ATOM 2210 CD1 ILE A 139 -5.897 6.550 -3.309 1.00 6.13 C ATOM 0 H ILE A 139 -1.060 8.470 -4.562 1.00 6.77 H new ATOM 0 HA ILE A 139 -2.297 5.807 -4.581 1.00 6.80 H new ATOM 0 HB ILE A 139 -3.579 8.251 -3.760 1.00 6.95 H new ATOM 0 HG12 ILE A 139 -4.358 5.342 -4.152 1.00 5.96 H new ATOM 0 HG13 ILE A 139 -3.911 6.138 -2.657 1.00 5.96 H new ATOM 0 HG21 ILE A 139 -5.553 8.199 -5.211 1.00 7.85 H new ATOM 0 HG22 ILE A 139 -4.083 8.643 -6.110 1.00 7.85 H new ATOM 0 HG23 ILE A 139 -4.754 7.002 -6.258 1.00 7.85 H new ATOM 0 HD11 ILE A 139 -6.315 5.719 -2.742 1.00 6.13 H new ATOM 0 HD12 ILE A 139 -5.988 7.468 -2.728 1.00 6.13 H new ATOM 0 HD13 ILE A 139 -6.441 6.659 -4.247 1.00 6.13 H new ATOM 2222 N LEU A 140 -2.698 5.980 -7.081 1.00 7.74 N ATOM 2223 CA LEU A 140 -2.647 5.992 -8.526 1.00 8.72 C ATOM 2224 C LEU A 140 -4.054 5.923 -9.084 1.00 9.04 C ATOM 2225 O LEU A 140 -4.827 4.986 -8.799 1.00 8.48 O ATOM 2226 CB LEU A 140 -1.822 4.812 -9.040 1.00 8.72 C ATOM 2227 CG LEU A 140 -0.509 4.569 -8.300 1.00 8.18 C ATOM 2228 CD1 LEU A 140 0.117 3.257 -8.745 1.00 8.31 C ATOM 2229 CD2 LEU A 140 0.455 5.725 -8.527 1.00 8.71 C ATOM 0 H LEU A 140 -3.119 5.144 -6.676 1.00 7.74 H new ATOM 0 HA LEU A 140 -2.172 6.916 -8.856 1.00 8.72 H new ATOM 0 HB2 LEU A 140 -2.429 3.909 -8.977 1.00 8.72 H new ATOM 0 HB3 LEU A 140 -1.602 4.975 -10.095 1.00 8.72 H new ATOM 0 HG LEU A 140 -0.722 4.505 -7.233 1.00 8.18 H new ATOM 0 HD11 LEU A 140 1.052 3.099 -8.208 1.00 8.31 H new ATOM 0 HD12 LEU A 140 -0.567 2.436 -8.531 1.00 8.31 H new ATOM 0 HD13 LEU A 140 0.316 3.294 -9.816 1.00 8.31 H new ATOM 0 HD21 LEU A 140 1.385 5.534 -7.992 1.00 8.71 H new ATOM 0 HD22 LEU A 140 0.663 5.821 -9.593 1.00 8.71 H new ATOM 0 HD23 LEU A 140 0.008 6.649 -8.159 1.00 8.71 H new ATOM 2241 N ARG A 141 -4.346 6.938 -9.892 1.00 9.99 N ATOM 2242 CA ARG A 141 -5.634 7.120 -10.533 1.00 10.47 C ATOM 2243 C ARG A 141 -5.433 7.507 -11.998 1.00 11.63 C ATOM 2244 O ARG A 141 -4.446 8.159 -12.337 1.00 12.15 O ATOM 2245 CB ARG A 141 -6.442 8.193 -9.799 1.00 10.48 C ATOM 2246 CG ARG A 141 -5.623 9.387 -9.332 1.00 10.88 C ATOM 2247 CD ARG A 141 -6.518 10.548 -8.931 1.00 11.35 C ATOM 2248 NE ARG A 141 -7.661 10.106 -8.134 1.00 11.42 N ATOM 2249 CZ ARG A 141 -8.015 10.659 -6.978 1.00 11.99 C ATOM 2250 NH1 ARG A 141 -7.312 11.668 -6.478 1.00 12.56 N ATOM 2251 NH2 ARG A 141 -9.073 10.206 -6.319 1.00 12.08 N ATOM 0 H ARG A 141 -3.675 7.671 -10.121 1.00 9.99 H new ATOM 0 HA ARG A 141 -6.190 6.183 -10.491 1.00 10.47 H new ATOM 0 HB2 ARG A 141 -7.235 8.547 -10.457 1.00 10.48 H new ATOM 0 HB3 ARG A 141 -6.925 7.739 -8.934 1.00 10.48 H new ATOM 0 HG2 ARG A 141 -5.001 9.095 -8.486 1.00 10.88 H new ATOM 0 HG3 ARG A 141 -4.949 9.703 -10.129 1.00 10.88 H new ATOM 0 HD2 ARG A 141 -5.938 11.274 -8.362 1.00 11.35 H new ATOM 0 HD3 ARG A 141 -6.875 11.057 -9.826 1.00 11.35 H new ATOM 0 HE ARG A 141 -8.219 9.328 -8.485 1.00 11.42 H new ATOM 0 HH11 ARG A 141 -6.498 12.021 -6.981 1.00 12.56 H new ATOM 0 HH12 ARG A 141 -7.586 12.090 -5.591 1.00 12.56 H new ATOM 0 HH21 ARG A 141 -9.617 9.431 -6.699 1.00 12.08 H new ATOM 0 HH22 ARG A 141 -9.342 10.632 -5.432 1.00 12.08 H new ATOM 2265 N GLY A 142 -6.360 7.113 -12.864 1.00 12.05 N ATOM 2266 CA GLY A 142 -6.220 7.430 -14.275 1.00 13.16 C ATOM 2267 C GLY A 142 -7.259 8.427 -14.764 1.00 13.83 C ATOM 2268 O GLY A 142 -8.365 8.485 -14.226 1.00 13.45 O ATOM 0 H GLY A 142 -7.198 6.585 -12.619 1.00 12.05 H new ATOM 0 HA2 GLY A 142 -5.224 7.834 -14.454 1.00 13.16 H new ATOM 0 HA3 GLY A 142 -6.302 6.513 -14.858 1.00 13.16 H new ATOM 2272 N PRO A 143 -6.922 9.232 -15.792 1.00 14.87 N ATOM 2273 CA PRO A 143 -7.826 10.251 -16.342 1.00 15.64 C ATOM 2274 C PRO A 143 -9.045 9.662 -17.045 1.00 15.86 C ATOM 2275 O PRO A 143 -9.826 10.391 -17.656 1.00 16.55 O ATOM 2276 CB PRO A 143 -6.950 11.004 -17.348 1.00 16.66 C ATOM 2277 CG PRO A 143 -5.893 10.030 -17.731 1.00 16.59 C ATOM 2278 CD PRO A 143 -5.627 9.208 -16.503 1.00 15.42 C ATOM 0 HA PRO A 143 -8.239 10.877 -15.551 1.00 15.64 H new ATOM 0 HB2 PRO A 143 -7.528 11.323 -18.215 1.00 16.66 H new ATOM 0 HB3 PRO A 143 -6.519 11.902 -16.904 1.00 16.66 H new ATOM 0 HG2 PRO A 143 -6.222 9.401 -18.558 1.00 16.59 H new ATOM 0 HG3 PRO A 143 -4.990 10.543 -18.061 1.00 16.59 H new ATOM 0 HD2 PRO A 143 -5.326 8.192 -16.757 1.00 15.42 H new ATOM 0 HD3 PRO A 143 -4.828 9.636 -15.898 1.00 15.42 H new ATOM 2286 N ASP A 144 -9.208 8.346 -16.966 1.00 15.31 N ATOM 2287 CA ASP A 144 -10.344 7.683 -17.596 1.00 15.50 C ATOM 2288 C ASP A 144 -11.653 8.230 -17.038 1.00 15.23 C ATOM 2289 O ASP A 144 -12.694 8.170 -17.692 1.00 15.58 O ATOM 2290 CB ASP A 144 -10.276 6.172 -17.371 1.00 14.89 C ATOM 2291 CG ASP A 144 -11.428 5.438 -18.028 1.00 15.23 C ATOM 2292 OD1 ASP A 144 -12.477 5.269 -17.372 1.00 15.02 O ATOM 2293 OD2 ASP A 144 -11.283 5.033 -19.201 1.00 15.79 O ATOM 0 H ASP A 144 -8.571 7.719 -16.474 1.00 15.31 H new ATOM 0 HA ASP A 144 -10.304 7.881 -18.667 1.00 15.50 H new ATOM 0 HB2 ASP A 144 -9.334 5.791 -17.765 1.00 14.89 H new ATOM 0 HB3 ASP A 144 -10.281 5.966 -16.301 1.00 14.89 H new ATOM 2298 N GLY A 145 -11.585 8.766 -15.827 1.00 14.64 N ATOM 2299 CA GLY A 145 -12.760 9.321 -15.181 1.00 14.42 C ATOM 2300 C GLY A 145 -12.806 8.971 -13.711 1.00 13.31 C ATOM 2301 O GLY A 145 -13.590 9.538 -12.948 1.00 13.11 O ATOM 0 H GLY A 145 -10.729 8.827 -15.275 1.00 14.64 H new ATOM 0 HA2 GLY A 145 -12.762 10.405 -15.298 1.00 14.42 H new ATOM 0 HA3 GLY A 145 -13.657 8.946 -15.673 1.00 14.42 H new ATOM 2305 N LEU A 146 -11.955 8.029 -13.315 1.00 12.64 N ATOM 2306 CA LEU A 146 -11.882 7.583 -11.931 1.00 11.55 C ATOM 2307 C LEU A 146 -10.504 7.001 -11.626 1.00 11.12 C ATOM 2308 O LEU A 146 -9.665 6.876 -12.520 1.00 11.67 O ATOM 2309 CB LEU A 146 -12.980 6.546 -11.634 1.00 10.90 C ATOM 2310 CG LEU A 146 -13.171 5.422 -12.670 1.00 11.20 C ATOM 2311 CD1 LEU A 146 -13.860 5.944 -13.922 1.00 12.22 C ATOM 2312 CD2 LEU A 146 -11.843 4.769 -13.027 1.00 11.35 C ATOM 0 H LEU A 146 -11.302 7.557 -13.941 1.00 12.64 H new ATOM 0 HA LEU A 146 -12.043 8.447 -11.287 1.00 11.55 H new ATOM 0 HB2 LEU A 146 -12.762 6.086 -10.670 1.00 10.90 H new ATOM 0 HB3 LEU A 146 -13.927 7.075 -11.528 1.00 10.90 H new ATOM 0 HG LEU A 146 -13.811 4.664 -12.217 1.00 11.20 H new ATOM 0 HD11 LEU A 146 -13.982 5.130 -14.636 1.00 12.22 H new ATOM 0 HD12 LEU A 146 -14.839 6.345 -13.658 1.00 12.22 H new ATOM 0 HD13 LEU A 146 -13.254 6.731 -14.370 1.00 12.22 H new ATOM 0 HD21 LEU A 146 -12.011 3.980 -13.760 1.00 11.35 H new ATOM 0 HD22 LEU A 146 -11.171 5.517 -13.447 1.00 11.35 H new ATOM 0 HD23 LEU A 146 -11.395 4.342 -12.130 1.00 11.35 H new ATOM 2324 N SER A 147 -10.272 6.647 -10.367 1.00 10.17 N ATOM 2325 CA SER A 147 -8.999 6.070 -9.966 1.00 9.69 C ATOM 2326 C SER A 147 -8.860 4.641 -10.476 1.00 9.46 C ATOM 2327 O SER A 147 -9.715 3.794 -10.221 1.00 8.99 O ATOM 2328 CB SER A 147 -8.864 6.096 -8.442 1.00 8.75 C ATOM 2329 OG SER A 147 -7.625 5.544 -8.030 1.00 8.22 O ATOM 0 H SER A 147 -10.948 6.750 -9.610 1.00 10.17 H new ATOM 0 HA SER A 147 -8.203 6.670 -10.407 1.00 9.69 H new ATOM 0 HB2 SER A 147 -8.945 7.122 -8.084 1.00 8.75 H new ATOM 0 HB3 SER A 147 -9.683 5.535 -7.992 1.00 8.75 H new ATOM 0 HG SER A 147 -7.563 5.574 -7.052 1.00 8.22 H new ATOM 2335 N ARG A 148 -7.773 4.390 -11.211 1.00 9.89 N ATOM 2336 CA ARG A 148 -7.484 3.067 -11.751 1.00 9.93 C ATOM 2337 C ARG A 148 -7.720 2.003 -10.692 1.00 8.90 C ATOM 2338 O ARG A 148 -8.123 0.881 -10.994 1.00 8.92 O ATOM 2339 CB ARG A 148 -6.029 2.996 -12.215 1.00 10.37 C ATOM 2340 CG ARG A 148 -5.041 3.223 -11.086 1.00 9.67 C ATOM 2341 CD ARG A 148 -3.617 2.924 -11.508 1.00 9.77 C ATOM 2342 NE ARG A 148 -3.473 1.566 -12.025 1.00 10.74 N ATOM 2343 CZ ARG A 148 -2.304 1.005 -12.313 1.00 11.24 C ATOM 2344 NH1 ARG A 148 -1.176 1.682 -12.138 1.00 10.90 N ATOM 2345 NH2 ARG A 148 -2.261 -0.236 -12.778 1.00 12.22 N ATOM 0 H ARG A 148 -7.075 5.096 -11.445 1.00 9.89 H new ATOM 0 HA ARG A 148 -8.147 2.889 -12.598 1.00 9.93 H new ATOM 0 HB2 ARG A 148 -5.843 2.021 -12.664 1.00 10.37 H new ATOM 0 HB3 ARG A 148 -5.863 3.742 -12.992 1.00 10.37 H new ATOM 0 HG2 ARG A 148 -5.109 4.257 -10.747 1.00 9.67 H new ATOM 0 HG3 ARG A 148 -5.308 2.592 -10.238 1.00 9.67 H new ATOM 0 HD2 ARG A 148 -3.308 3.637 -12.272 1.00 9.77 H new ATOM 0 HD3 ARG A 148 -2.950 3.060 -10.656 1.00 9.77 H new ATOM 0 HE ARG A 148 -4.319 1.016 -12.174 1.00 10.74 H new ATOM 0 HH11 ARG A 148 -1.205 2.637 -11.781 1.00 10.90 H new ATOM 0 HH12 ARG A 148 -0.281 1.247 -12.360 1.00 10.90 H new ATOM 0 HH21 ARG A 148 -3.126 -0.760 -12.915 1.00 12.22 H new ATOM 0 HH22 ARG A 148 -1.363 -0.667 -12.999 1.00 12.22 H new ATOM 2359 N GLY A 149 -7.453 2.375 -9.444 1.00 8.07 N ATOM 2360 CA GLY A 149 -7.639 1.464 -8.341 1.00 7.06 C ATOM 2361 C GLY A 149 -6.338 0.887 -7.825 1.00 6.63 C ATOM 2362 O GLY A 149 -6.304 -0.264 -7.395 1.00 6.24 O ATOM 0 H GLY A 149 -7.109 3.299 -9.181 1.00 8.07 H new ATOM 0 HA2 GLY A 149 -8.147 1.984 -7.529 1.00 7.06 H new ATOM 0 HA3 GLY A 149 -8.292 0.650 -8.655 1.00 7.06 H new ATOM 2366 N CYS A 150 -5.257 1.672 -7.858 1.00 6.80 N ATOM 2367 CA CYS A 150 -3.975 1.175 -7.362 1.00 6.41 C ATOM 2368 C CYS A 150 -3.288 2.230 -6.514 1.00 5.95 C ATOM 2369 O CYS A 150 -3.336 3.405 -6.839 1.00 6.46 O ATOM 2370 CB CYS A 150 -3.078 0.746 -8.520 1.00 7.32 C ATOM 2371 SG CYS A 150 -3.882 -0.355 -9.708 1.00 8.04 S ATOM 0 H CYS A 150 -5.243 2.628 -8.213 1.00 6.80 H new ATOM 0 HA CYS A 150 -4.164 0.302 -6.737 1.00 6.41 H new ATOM 0 HB2 CYS A 150 -2.729 1.636 -9.044 1.00 7.32 H new ATOM 0 HB3 CYS A 150 -2.197 0.247 -8.117 1.00 7.32 H new ATOM 0 HG CYS A 150 -4.495 -1.308 -9.071 1.00 8.04 H new ATOM 2377 N ALA A 151 -2.661 1.808 -5.418 1.00 5.10 N ATOM 2378 CA ALA A 151 -2.004 2.749 -4.513 1.00 4.66 C ATOM 2379 C ALA A 151 -0.749 2.178 -3.852 1.00 4.11 C ATOM 2380 O ALA A 151 -0.638 0.971 -3.643 1.00 3.84 O ATOM 2381 CB ALA A 151 -2.990 3.213 -3.461 1.00 4.12 C ATOM 0 H ALA A 151 -2.594 0.830 -5.137 1.00 5.10 H new ATOM 0 HA ALA A 151 -1.672 3.594 -5.116 1.00 4.66 H new ATOM 0 HB1 ALA A 151 -2.499 3.915 -2.787 1.00 4.12 H new ATOM 0 HB2 ALA A 151 -3.834 3.705 -3.945 1.00 4.12 H new ATOM 0 HB3 ALA A 151 -3.348 2.354 -2.893 1.00 4.12 H new ATOM 2387 N PHE A 152 0.201 3.064 -3.548 1.00 4.15 N ATOM 2388 CA PHE A 152 1.447 2.678 -2.886 1.00 3.65 C ATOM 2389 C PHE A 152 1.604 3.462 -1.582 1.00 3.07 C ATOM 2390 O PHE A 152 1.221 4.630 -1.503 1.00 3.60 O ATOM 2391 CB PHE A 152 2.652 2.938 -3.794 1.00 4.44 C ATOM 2392 CG PHE A 152 2.821 1.919 -4.884 1.00 5.27 C ATOM 2393 CD1 PHE A 152 2.160 2.059 -6.092 1.00 5.74 C ATOM 2394 CD2 PHE A 152 3.647 0.822 -4.698 1.00 5.76 C ATOM 2395 CE1 PHE A 152 2.318 1.124 -7.096 1.00 6.61 C ATOM 2396 CE2 PHE A 152 3.808 -0.116 -5.698 1.00 6.72 C ATOM 2397 CZ PHE A 152 3.143 0.034 -6.898 1.00 7.13 C ATOM 0 H PHE A 152 0.129 4.061 -3.752 1.00 4.15 H new ATOM 0 HA PHE A 152 1.404 1.611 -2.668 1.00 3.65 H new ATOM 0 HB2 PHE A 152 2.549 3.925 -4.245 1.00 4.44 H new ATOM 0 HB3 PHE A 152 3.556 2.958 -3.185 1.00 4.44 H new ATOM 0 HD1 PHE A 152 1.513 2.909 -6.251 1.00 5.74 H new ATOM 0 HD2 PHE A 152 4.170 0.700 -3.761 1.00 5.76 H new ATOM 0 HE1 PHE A 152 1.797 1.245 -8.034 1.00 6.61 H new ATOM 0 HE2 PHE A 152 4.454 -0.967 -5.541 1.00 6.72 H new ATOM 0 HZ PHE A 152 3.267 -0.700 -7.681 1.00 7.13 H new ATOM 2407 N VAL A 153 2.166 2.819 -0.559 1.00 2.26 N ATOM 2408 CA VAL A 153 2.343 3.459 0.745 1.00 2.07 C ATOM 2409 C VAL A 153 3.695 3.122 1.377 1.00 1.71 C ATOM 2410 O VAL A 153 4.241 2.041 1.171 1.00 1.46 O ATOM 2411 CB VAL A 153 1.218 3.070 1.734 1.00 1.96 C ATOM 2412 CG1 VAL A 153 1.484 3.654 3.116 1.00 2.68 C ATOM 2413 CG2 VAL A 153 -0.137 3.534 1.222 1.00 2.36 C ATOM 0 H VAL A 153 2.506 1.858 -0.607 1.00 2.26 H new ATOM 0 HA VAL A 153 2.301 4.531 0.555 1.00 2.07 H new ATOM 0 HB VAL A 153 1.206 1.983 1.813 1.00 1.96 H new ATOM 0 HG11 VAL A 153 0.680 3.367 3.793 1.00 2.68 H new ATOM 0 HG12 VAL A 153 2.432 3.273 3.496 1.00 2.68 H new ATOM 0 HG13 VAL A 153 1.531 4.741 3.049 1.00 2.68 H new ATOM 0 HG21 VAL A 153 -0.912 3.249 1.934 1.00 2.36 H new ATOM 0 HG22 VAL A 153 -0.131 4.618 1.107 1.00 2.36 H new ATOM 0 HG23 VAL A 153 -0.341 3.068 0.258 1.00 2.36 H new ATOM 2423 N THR A 154 4.222 4.073 2.146 1.00 2.20 N ATOM 2424 CA THR A 154 5.493 3.905 2.841 1.00 2.13 C ATOM 2425 C THR A 154 5.246 4.046 4.334 1.00 2.87 C ATOM 2426 O THR A 154 4.707 5.062 4.787 1.00 3.63 O ATOM 2427 CB THR A 154 6.523 4.958 2.397 1.00 2.53 C ATOM 2428 OG1 THR A 154 6.778 4.837 0.994 1.00 2.59 O ATOM 2429 CG2 THR A 154 7.827 4.814 3.166 1.00 2.45 C ATOM 0 H THR A 154 3.780 4.979 2.303 1.00 2.20 H new ATOM 0 HA THR A 154 5.895 2.921 2.601 1.00 2.13 H new ATOM 0 HB THR A 154 6.106 5.942 2.609 1.00 2.53 H new ATOM 0 HG1 THR A 154 7.685 4.492 0.855 1.00 2.59 H new ATOM 0 HG21 THR A 154 8.534 5.572 2.829 1.00 2.45 H new ATOM 0 HG22 THR A 154 7.637 4.943 4.232 1.00 2.45 H new ATOM 0 HG23 THR A 154 8.246 3.823 2.989 1.00 2.45 H new ATOM 2437 N PHE A 155 5.664 3.041 5.102 1.00 3.05 N ATOM 2438 CA PHE A 155 5.394 3.048 6.550 1.00 4.10 C ATOM 2439 C PHE A 155 6.644 2.914 7.419 1.00 4.59 C ATOM 2440 O PHE A 155 7.393 1.951 7.307 1.00 4.50 O ATOM 2441 CB PHE A 155 4.418 1.922 6.890 1.00 4.47 C ATOM 2442 CG PHE A 155 3.414 2.298 7.940 1.00 5.26 C ATOM 2443 CD1 PHE A 155 3.822 2.625 9.223 1.00 6.22 C ATOM 2444 CD2 PHE A 155 2.062 2.326 7.642 1.00 5.12 C ATOM 2445 CE1 PHE A 155 2.899 2.975 10.189 1.00 7.05 C ATOM 2446 CE2 PHE A 155 1.135 2.674 8.602 1.00 5.96 C ATOM 2447 CZ PHE A 155 1.553 3.000 9.878 1.00 6.93 C ATOM 0 H PHE A 155 6.179 2.228 4.763 1.00 3.05 H new ATOM 0 HA PHE A 155 4.967 4.025 6.776 1.00 4.10 H new ATOM 0 HB2 PHE A 155 3.890 1.623 5.984 1.00 4.47 H new ATOM 0 HB3 PHE A 155 4.982 1.054 7.232 1.00 4.47 H new ATOM 0 HD1 PHE A 155 4.873 2.606 9.470 1.00 6.22 H new ATOM 0 HD2 PHE A 155 1.730 2.072 6.646 1.00 5.12 H new ATOM 0 HE1 PHE A 155 3.229 3.229 11.186 1.00 7.05 H new ATOM 0 HE2 PHE A 155 0.083 2.692 8.357 1.00 5.96 H new ATOM 0 HZ PHE A 155 0.829 3.274 10.631 1.00 6.93 H new ATOM 2457 N THR A 156 6.803 3.861 8.343 1.00 5.34 N ATOM 2458 CA THR A 156 7.946 3.903 9.258 1.00 5.91 C ATOM 2459 C THR A 156 8.450 2.516 9.658 1.00 6.07 C ATOM 2460 O THR A 156 9.525 2.096 9.231 1.00 5.70 O ATOM 2461 CB THR A 156 7.604 4.694 10.534 1.00 7.03 C ATOM 2462 OG1 THR A 156 6.475 4.107 11.193 1.00 7.51 O ATOM 2463 CG2 THR A 156 7.301 6.144 10.197 1.00 7.22 C ATOM 0 H THR A 156 6.140 4.624 8.479 1.00 5.34 H new ATOM 0 HA THR A 156 8.743 4.403 8.707 1.00 5.91 H new ATOM 0 HB THR A 156 8.466 4.659 11.200 1.00 7.03 H new ATOM 0 HG1 THR A 156 6.268 4.617 12.004 1.00 7.51 H new ATOM 0 HG21 THR A 156 7.061 6.688 11.111 1.00 7.22 H new ATOM 0 HG22 THR A 156 8.172 6.597 9.723 1.00 7.22 H new ATOM 0 HG23 THR A 156 6.452 6.189 9.515 1.00 7.22 H new ATOM 2471 N THR A 157 7.682 1.808 10.482 1.00 6.77 N ATOM 2472 CA THR A 157 8.080 0.482 10.933 1.00 7.26 C ATOM 2473 C THR A 157 7.380 -0.602 10.128 1.00 6.99 C ATOM 2474 O THR A 157 6.160 -0.572 9.954 1.00 6.85 O ATOM 2475 CB THR A 157 7.772 0.283 12.428 1.00 8.46 C ATOM 2476 OG1 THR A 157 6.418 0.653 12.702 1.00 8.78 O ATOM 2477 CG2 THR A 157 8.715 1.111 13.290 1.00 8.87 C ATOM 0 H THR A 157 6.786 2.130 10.848 1.00 6.77 H new ATOM 0 HA THR A 157 9.156 0.403 10.781 1.00 7.26 H new ATOM 0 HB THR A 157 7.916 -0.770 12.669 1.00 8.46 H new ATOM 0 HG1 THR A 157 5.975 -0.069 13.195 1.00 8.78 H new ATOM 0 HG21 THR A 157 8.478 0.954 14.342 1.00 8.87 H new ATOM 0 HG22 THR A 157 9.744 0.806 13.100 1.00 8.87 H new ATOM 0 HG23 THR A 157 8.599 2.167 13.045 1.00 8.87 H new ATOM 2485 N ARG A 158 8.163 -1.559 9.638 1.00 7.05 N ATOM 2486 CA ARG A 158 7.621 -2.656 8.847 1.00 7.06 C ATOM 2487 C ARG A 158 6.527 -3.390 9.608 1.00 7.86 C ATOM 2488 O ARG A 158 5.506 -3.759 9.030 1.00 7.67 O ATOM 2489 CB ARG A 158 8.723 -3.633 8.429 1.00 7.38 C ATOM 2490 CG ARG A 158 9.874 -3.730 9.414 1.00 7.76 C ATOM 2491 CD ARG A 158 9.515 -4.570 10.629 1.00 8.64 C ATOM 2492 NE ARG A 158 9.478 -3.772 11.853 1.00 8.78 N ATOM 2493 CZ ARG A 158 9.727 -4.263 13.064 1.00 9.57 C ATOM 2494 NH1 ARG A 158 10.038 -5.544 13.215 1.00 10.24 N ATOM 2495 NH2 ARG A 158 9.667 -3.472 14.126 1.00 9.80 N ATOM 0 H ARG A 158 9.173 -1.596 9.775 1.00 7.05 H new ATOM 0 HA ARG A 158 7.185 -2.226 7.946 1.00 7.06 H new ATOM 0 HB2 ARG A 158 8.286 -4.623 8.300 1.00 7.38 H new ATOM 0 HB3 ARG A 158 9.115 -3.328 7.458 1.00 7.38 H new ATOM 0 HG2 ARG A 158 10.741 -4.164 8.917 1.00 7.76 H new ATOM 0 HG3 ARG A 158 10.160 -2.729 9.737 1.00 7.76 H new ATOM 0 HD2 ARG A 158 8.543 -5.039 10.472 1.00 8.64 H new ATOM 0 HD3 ARG A 158 10.242 -5.374 10.742 1.00 8.64 H new ATOM 0 HE ARG A 158 9.248 -2.781 11.774 1.00 8.78 H new ATOM 0 HH11 ARG A 158 10.087 -6.156 12.401 1.00 10.24 H new ATOM 0 HH12 ARG A 158 10.228 -5.916 14.145 1.00 10.24 H new ATOM 0 HH21 ARG A 158 9.430 -2.486 14.015 1.00 9.80 H new ATOM 0 HH22 ARG A 158 9.858 -3.849 15.054 1.00 9.80 H new ATOM 2509 N ALA A 159 6.737 -3.594 10.905 1.00 8.79 N ATOM 2510 CA ALA A 159 5.752 -4.284 11.723 1.00 9.64 C ATOM 2511 C ALA A 159 4.408 -3.581 11.619 1.00 9.32 C ATOM 2512 O ALA A 159 3.377 -4.215 11.384 1.00 9.45 O ATOM 2513 CB ALA A 159 6.212 -4.349 13.171 1.00 10.64 C ATOM 0 H ALA A 159 7.573 -3.294 11.406 1.00 8.79 H new ATOM 0 HA ALA A 159 5.643 -5.305 11.356 1.00 9.64 H new ATOM 0 HB1 ALA A 159 5.462 -4.869 13.768 1.00 10.64 H new ATOM 0 HB2 ALA A 159 7.158 -4.887 13.228 1.00 10.64 H new ATOM 0 HB3 ALA A 159 6.345 -3.338 13.556 1.00 10.64 H new ATOM 2519 N MET A 160 4.436 -2.260 11.755 1.00 8.95 N ATOM 2520 CA MET A 160 3.225 -1.462 11.654 1.00 8.73 C ATOM 2521 C MET A 160 2.618 -1.630 10.273 1.00 7.79 C ATOM 2522 O MET A 160 1.399 -1.701 10.119 1.00 7.78 O ATOM 2523 CB MET A 160 3.524 0.013 11.922 1.00 8.63 C ATOM 2524 CG MET A 160 3.432 0.398 13.391 1.00 9.38 C ATOM 2525 SD MET A 160 4.437 -0.657 14.453 1.00 10.41 S ATOM 2526 CE MET A 160 4.142 0.094 16.052 1.00 11.44 C ATOM 0 H MET A 160 5.284 -1.722 11.935 1.00 8.95 H new ATOM 0 HA MET A 160 2.515 -1.807 12.405 1.00 8.73 H new ATOM 0 HB2 MET A 160 4.525 0.244 11.557 1.00 8.63 H new ATOM 0 HB3 MET A 160 2.827 0.626 11.350 1.00 8.63 H new ATOM 0 HG2 MET A 160 3.749 1.434 13.511 1.00 9.38 H new ATOM 0 HG3 MET A 160 2.392 0.344 13.712 1.00 9.38 H new ATOM 0 HE1 MET A 160 4.698 -0.448 16.817 1.00 11.44 H new ATOM 0 HE2 MET A 160 4.471 1.133 16.032 1.00 11.44 H new ATOM 0 HE3 MET A 160 3.077 0.055 16.281 1.00 11.44 H new ATOM 2536 N ALA A 161 3.486 -1.721 9.271 1.00 7.04 N ATOM 2537 CA ALA A 161 3.047 -1.890 7.899 1.00 6.16 C ATOM 2538 C ALA A 161 2.302 -3.206 7.750 1.00 6.64 C ATOM 2539 O ALA A 161 1.282 -3.283 7.063 1.00 6.28 O ATOM 2540 CB ALA A 161 4.238 -1.841 6.955 1.00 5.48 C ATOM 0 H ALA A 161 4.498 -1.680 9.388 1.00 7.04 H new ATOM 0 HA ALA A 161 2.370 -1.075 7.641 1.00 6.16 H new ATOM 0 HB1 ALA A 161 3.894 -1.969 5.929 1.00 5.48 H new ATOM 0 HB2 ALA A 161 4.740 -0.878 7.052 1.00 5.48 H new ATOM 0 HB3 ALA A 161 4.935 -2.640 7.207 1.00 5.48 H new ATOM 2546 N GLN A 162 2.806 -4.233 8.427 1.00 7.56 N ATOM 2547 CA GLN A 162 2.199 -5.550 8.371 1.00 8.22 C ATOM 2548 C GLN A 162 0.809 -5.510 8.986 1.00 8.56 C ATOM 2549 O GLN A 162 -0.088 -6.243 8.569 1.00 8.70 O ATOM 2550 CB GLN A 162 3.076 -6.569 9.099 1.00 9.22 C ATOM 2551 CG GLN A 162 4.420 -6.804 8.424 1.00 9.05 C ATOM 2552 CD GLN A 162 5.292 -7.784 9.183 1.00 10.06 C ATOM 2553 OE1 GLN A 162 5.211 -7.889 10.406 1.00 10.94 O ATOM 2554 NE2 GLN A 162 6.138 -8.509 8.456 1.00 9.99 N ATOM 0 H GLN A 162 3.634 -4.174 9.020 1.00 7.56 H new ATOM 0 HA GLN A 162 2.111 -5.853 7.328 1.00 8.22 H new ATOM 0 HB2 GLN A 162 3.246 -6.227 10.120 1.00 9.22 H new ATOM 0 HB3 GLN A 162 2.541 -7.516 9.165 1.00 9.22 H new ATOM 0 HG2 GLN A 162 4.254 -7.178 7.414 1.00 9.05 H new ATOM 0 HG3 GLN A 162 4.946 -5.854 8.330 1.00 9.05 H new ATOM 0 HE21 GLN A 162 6.172 -8.390 7.444 1.00 9.99 H new ATOM 0 HE22 GLN A 162 6.752 -9.184 8.911 1.00 9.99 H new ATOM 2563 N THR A 163 0.633 -4.632 9.969 1.00 8.76 N ATOM 2564 CA THR A 163 -0.651 -4.489 10.633 1.00 9.19 C ATOM 2565 C THR A 163 -1.718 -4.080 9.626 1.00 8.39 C ATOM 2566 O THR A 163 -2.852 -4.560 9.676 1.00 8.67 O ATOM 2567 CB THR A 163 -0.587 -3.451 11.773 1.00 9.62 C ATOM 2568 OG1 THR A 163 0.329 -3.891 12.782 1.00 10.45 O ATOM 2569 CG2 THR A 163 -1.960 -3.234 12.392 1.00 10.08 C ATOM 0 H THR A 163 1.363 -4.012 10.320 1.00 8.76 H new ATOM 0 HA THR A 163 -0.909 -5.455 11.068 1.00 9.19 H new ATOM 0 HB THR A 163 -0.244 -2.506 11.352 1.00 9.62 H new ATOM 0 HG1 THR A 163 0.366 -3.227 13.502 1.00 10.45 H new ATOM 0 HG21 THR A 163 -1.886 -2.498 13.193 1.00 10.08 H new ATOM 0 HG22 THR A 163 -2.650 -2.873 11.629 1.00 10.08 H new ATOM 0 HG23 THR A 163 -2.329 -4.176 12.798 1.00 10.08 H new ATOM 2577 N ALA A 164 -1.335 -3.209 8.693 1.00 7.40 N ATOM 2578 CA ALA A 164 -2.257 -2.738 7.670 1.00 6.57 C ATOM 2579 C ALA A 164 -2.789 -3.903 6.859 1.00 6.51 C ATOM 2580 O ALA A 164 -3.966 -3.945 6.506 1.00 6.33 O ATOM 2581 CB ALA A 164 -1.570 -1.743 6.750 1.00 5.56 C ATOM 0 H ALA A 164 -0.395 -2.819 8.628 1.00 7.40 H new ATOM 0 HA ALA A 164 -3.091 -2.242 8.167 1.00 6.57 H new ATOM 0 HB1 ALA A 164 -2.275 -1.402 5.992 1.00 5.56 H new ATOM 0 HB2 ALA A 164 -1.222 -0.890 7.332 1.00 5.56 H new ATOM 0 HB3 ALA A 164 -0.720 -2.223 6.265 1.00 5.56 H new ATOM 2587 N ILE A 165 -1.909 -4.864 6.592 1.00 6.81 N ATOM 2588 CA ILE A 165 -2.268 -6.034 5.814 1.00 7.06 C ATOM 2589 C ILE A 165 -3.477 -6.726 6.426 1.00 7.79 C ATOM 2590 O ILE A 165 -4.405 -7.117 5.721 1.00 7.66 O ATOM 2591 CB ILE A 165 -1.076 -7.014 5.723 1.00 7.65 C ATOM 2592 CG1 ILE A 165 0.043 -6.388 4.883 1.00 6.92 C ATOM 2593 CG2 ILE A 165 -1.506 -8.351 5.138 1.00 8.25 C ATOM 2594 CD1 ILE A 165 1.307 -7.220 4.823 1.00 7.54 C ATOM 0 H ILE A 165 -0.939 -4.850 6.907 1.00 6.81 H new ATOM 0 HA ILE A 165 -2.525 -5.711 4.805 1.00 7.06 H new ATOM 0 HB ILE A 165 -0.703 -7.202 6.730 1.00 7.65 H new ATOM 0 HG12 ILE A 165 -0.324 -6.229 3.869 1.00 6.92 H new ATOM 0 HG13 ILE A 165 0.285 -5.407 5.292 1.00 6.92 H new ATOM 0 HG21 ILE A 165 -0.646 -9.019 5.087 1.00 8.25 H new ATOM 0 HG22 ILE A 165 -2.273 -8.795 5.772 1.00 8.25 H new ATOM 0 HG23 ILE A 165 -1.907 -8.198 4.136 1.00 8.25 H new ATOM 0 HD11 ILE A 165 2.050 -6.709 4.210 1.00 7.54 H new ATOM 0 HD12 ILE A 165 1.700 -7.358 5.830 1.00 7.54 H new ATOM 0 HD13 ILE A 165 1.082 -8.192 4.385 1.00 7.54 H new ATOM 2606 N LYS A 166 -3.479 -6.837 7.747 1.00 8.61 N ATOM 2607 CA LYS A 166 -4.579 -7.475 8.456 1.00 9.40 C ATOM 2608 C LYS A 166 -5.889 -6.761 8.150 1.00 8.92 C ATOM 2609 O LYS A 166 -6.911 -7.385 7.865 1.00 9.17 O ATOM 2610 CB LYS A 166 -4.326 -7.423 9.965 1.00 10.41 C ATOM 2611 CG LYS A 166 -4.960 -8.554 10.764 1.00 11.21 C ATOM 2612 CD LYS A 166 -6.383 -8.850 10.326 1.00 11.56 C ATOM 2613 CE LYS A 166 -7.154 -9.590 11.406 1.00 12.63 C ATOM 2614 NZ LYS A 166 -6.617 -10.960 11.634 1.00 13.37 N ATOM 0 H LYS A 166 -2.731 -6.493 8.349 1.00 8.61 H new ATOM 0 HA LYS A 166 -4.646 -8.512 8.128 1.00 9.40 H new ATOM 0 HB2 LYS A 166 -3.250 -7.435 10.138 1.00 10.41 H new ATOM 0 HB3 LYS A 166 -4.700 -6.474 10.348 1.00 10.41 H new ATOM 0 HG2 LYS A 166 -4.355 -9.454 10.655 1.00 11.21 H new ATOM 0 HG3 LYS A 166 -4.956 -8.293 11.822 1.00 11.21 H new ATOM 0 HD2 LYS A 166 -6.893 -7.917 10.087 1.00 11.56 H new ATOM 0 HD3 LYS A 166 -6.368 -9.447 9.414 1.00 11.56 H new ATOM 0 HE2 LYS A 166 -7.110 -9.024 12.336 1.00 12.63 H new ATOM 0 HE3 LYS A 166 -8.204 -9.655 11.122 1.00 12.63 H new ATOM 0 HZ1 LYS A 166 -7.171 -11.431 12.378 1.00 13.37 H new ATOM 0 HZ2 LYS A 166 -6.683 -11.510 10.754 1.00 13.37 H new ATOM 0 HZ3 LYS A 166 -5.622 -10.898 11.930 1.00 13.37 H new ATOM 2628 N ALA A 167 -5.835 -5.441 8.199 1.00 8.28 N ATOM 2629 CA ALA A 167 -7.001 -4.608 7.971 1.00 7.90 C ATOM 2630 C ALA A 167 -7.380 -4.530 6.496 1.00 6.96 C ATOM 2631 O ALA A 167 -8.532 -4.264 6.162 1.00 6.80 O ATOM 2632 CB ALA A 167 -6.758 -3.227 8.548 1.00 7.77 C ATOM 0 H ALA A 167 -4.982 -4.918 8.398 1.00 8.28 H new ATOM 0 HA ALA A 167 -7.848 -5.067 8.480 1.00 7.90 H new ATOM 0 HB1 ALA A 167 -7.634 -2.602 8.376 1.00 7.77 H new ATOM 0 HB2 ALA A 167 -6.574 -3.308 9.619 1.00 7.77 H new ATOM 0 HB3 ALA A 167 -5.891 -2.778 8.064 1.00 7.77 H new ATOM 2638 N MET A 168 -6.410 -4.748 5.613 1.00 6.41 N ATOM 2639 CA MET A 168 -6.665 -4.676 4.176 1.00 5.59 C ATOM 2640 C MET A 168 -6.745 -6.066 3.557 1.00 6.06 C ATOM 2641 O MET A 168 -7.818 -6.519 3.157 1.00 6.21 O ATOM 2642 CB MET A 168 -5.571 -3.863 3.485 1.00 4.61 C ATOM 2643 CG MET A 168 -5.502 -2.413 3.936 1.00 4.37 C ATOM 2644 SD MET A 168 -6.834 -1.401 3.255 1.00 4.25 S ATOM 2645 CE MET A 168 -8.127 -1.652 4.469 1.00 4.06 C ATOM 0 H MET A 168 -5.447 -4.974 5.863 1.00 6.41 H new ATOM 0 HA MET A 168 -7.627 -4.183 4.033 1.00 5.59 H new ATOM 0 HB2 MET A 168 -4.607 -4.337 3.671 1.00 4.61 H new ATOM 0 HB3 MET A 168 -5.737 -3.891 2.408 1.00 4.61 H new ATOM 0 HG2 MET A 168 -5.543 -2.374 5.025 1.00 4.37 H new ATOM 0 HG3 MET A 168 -4.543 -1.990 3.638 1.00 4.37 H new ATOM 0 HE1 MET A 168 -8.692 -0.729 4.595 1.00 4.06 H new ATOM 0 HE2 MET A 168 -8.796 -2.443 4.130 1.00 4.06 H new ATOM 0 HE3 MET A 168 -7.681 -1.937 5.422 1.00 4.06 H new ATOM 2655 N HIS A 169 -5.599 -6.731 3.479 1.00 6.40 N ATOM 2656 CA HIS A 169 -5.515 -8.069 2.903 1.00 7.11 C ATOM 2657 C HIS A 169 -6.553 -9.009 3.512 1.00 8.00 C ATOM 2658 O HIS A 169 -6.961 -9.984 2.882 1.00 8.44 O ATOM 2659 CB HIS A 169 -4.110 -8.633 3.116 1.00 7.58 C ATOM 2660 CG HIS A 169 -3.707 -9.645 2.090 1.00 8.20 C ATOM 2661 ND1 HIS A 169 -3.585 -9.544 0.744 1.00 9.21 N flip ATOM 2662 CD2 HIS A 169 -3.367 -10.945 2.405 1.00 8.09 C flip ATOM 2663 CE1 HIS A 169 -3.181 -10.770 0.279 1.00 9.66 C flip ATOM 2664 NE2 HIS A 169 -3.055 -11.596 1.300 1.00 9.05 N flip ATOM 0 H HIS A 169 -4.707 -6.362 3.810 1.00 6.40 H new ATOM 0 HA HIS A 169 -5.723 -7.992 1.836 1.00 7.11 H new ATOM 0 HB2 HIS A 169 -3.393 -7.812 3.105 1.00 7.58 H new ATOM 0 HB3 HIS A 169 -4.057 -9.090 4.104 1.00 7.58 H new ATOM 0 HD2 HIS A 169 -3.358 -11.364 3.400 1.00 8.09 H new ATOM 0 HE1 HIS A 169 -2.996 -11.019 -0.756 1.00 9.66 H new ATOM 0 HE2 HIS A 169 -2.765 -12.572 1.245 1.00 9.05 H new ATOM 2834 N VAL A 182 -6.290 -6.548 -1.974 1.00 5.55 N ATOM 2835 CA VAL A 182 -4.983 -7.150 -1.768 1.00 6.08 C ATOM 2836 C VAL A 182 -3.920 -6.105 -1.436 1.00 5.39 C ATOM 2837 O VAL A 182 -3.717 -5.148 -2.184 1.00 4.91 O ATOM 2838 CB VAL A 182 -4.550 -7.952 -3.013 1.00 6.97 C ATOM 2839 CG1 VAL A 182 -4.901 -7.194 -4.283 1.00 6.80 C ATOM 2840 CG2 VAL A 182 -3.061 -8.272 -2.967 1.00 7.45 C ATOM 0 HA VAL A 182 -5.073 -7.824 -0.916 1.00 6.08 H new ATOM 0 HB VAL A 182 -5.094 -8.896 -3.015 1.00 6.97 H new ATOM 0 HG11 VAL A 182 -4.588 -7.774 -5.151 1.00 6.80 H new ATOM 0 HG12 VAL A 182 -5.978 -7.031 -4.324 1.00 6.80 H new ATOM 0 HG13 VAL A 182 -4.389 -6.232 -4.286 1.00 6.80 H new ATOM 0 HG21 VAL A 182 -2.783 -8.838 -3.856 1.00 7.45 H new ATOM 0 HG22 VAL A 182 -2.490 -7.344 -2.934 1.00 7.45 H new ATOM 0 HG23 VAL A 182 -2.843 -8.864 -2.078 1.00 7.45 H new ATOM 2850 N VAL A 183 -3.246 -6.301 -0.304 1.00 5.50 N ATOM 2851 CA VAL A 183 -2.190 -5.395 0.136 1.00 4.93 C ATOM 2852 C VAL A 183 -1.053 -6.177 0.788 1.00 5.68 C ATOM 2853 O VAL A 183 -1.274 -6.920 1.746 1.00 6.34 O ATOM 2854 CB VAL A 183 -2.720 -4.350 1.137 1.00 4.22 C ATOM 2855 CG1 VAL A 183 -1.607 -3.406 1.576 1.00 3.70 C ATOM 2856 CG2 VAL A 183 -3.883 -3.574 0.536 1.00 3.54 C ATOM 0 H VAL A 183 -3.415 -7.084 0.327 1.00 5.50 H new ATOM 0 HA VAL A 183 -1.822 -4.876 -0.749 1.00 4.93 H new ATOM 0 HB VAL A 183 -3.082 -4.877 2.020 1.00 4.22 H new ATOM 0 HG11 VAL A 183 -2.005 -2.677 2.282 1.00 3.70 H new ATOM 0 HG12 VAL A 183 -0.812 -3.978 2.054 1.00 3.70 H new ATOM 0 HG13 VAL A 183 -1.206 -2.886 0.706 1.00 3.70 H new ATOM 0 HG21 VAL A 183 -4.243 -2.841 1.258 1.00 3.54 H new ATOM 0 HG22 VAL A 183 -3.551 -3.061 -0.366 1.00 3.54 H new ATOM 0 HG23 VAL A 183 -4.689 -4.263 0.285 1.00 3.54 H new ATOM 2866 N LYS A 184 0.162 -6.011 0.268 1.00 5.70 N ATOM 2867 CA LYS A 184 1.318 -6.721 0.810 1.00 6.41 C ATOM 2868 C LYS A 184 2.597 -5.898 0.709 1.00 5.98 C ATOM 2869 O LYS A 184 2.792 -5.132 -0.234 1.00 5.49 O ATOM 2870 CB LYS A 184 1.494 -8.067 0.101 1.00 7.46 C ATOM 2871 CG LYS A 184 1.613 -7.958 -1.412 1.00 7.98 C ATOM 2872 CD LYS A 184 3.065 -7.864 -1.856 1.00 8.81 C ATOM 2873 CE LYS A 184 3.184 -7.867 -3.371 1.00 8.99 C ATOM 2874 NZ LYS A 184 4.604 -7.903 -3.820 1.00 9.80 N ATOM 0 H LYS A 184 0.370 -5.398 -0.520 1.00 5.70 H new ATOM 0 HA LYS A 184 1.127 -6.894 1.869 1.00 6.41 H new ATOM 0 HB2 LYS A 184 2.386 -8.558 0.491 1.00 7.46 H new ATOM 0 HB3 LYS A 184 0.646 -8.707 0.343 1.00 7.46 H new ATOM 0 HG2 LYS A 184 1.145 -8.826 -1.877 1.00 7.98 H new ATOM 0 HG3 LYS A 184 1.069 -7.079 -1.758 1.00 7.98 H new ATOM 0 HD2 LYS A 184 3.511 -6.953 -1.457 1.00 8.81 H new ATOM 0 HD3 LYS A 184 3.628 -8.702 -1.444 1.00 8.81 H new ATOM 0 HE2 LYS A 184 2.654 -8.730 -3.774 1.00 8.99 H new ATOM 0 HE3 LYS A 184 2.699 -6.978 -3.774 1.00 8.99 H new ATOM 0 HZ1 LYS A 184 4.640 -7.904 -4.859 1.00 9.80 H new ATOM 0 HZ2 LYS A 184 5.104 -7.066 -3.457 1.00 9.80 H new ATOM 0 HZ3 LYS A 184 5.061 -8.764 -3.457 1.00 9.80 H new ATOM 2888 N PHE A 185 3.463 -6.072 1.705 1.00 6.30 N ATOM 2889 CA PHE A 185 4.741 -5.372 1.767 1.00 5.99 C ATOM 2890 C PHE A 185 5.548 -5.584 0.488 1.00 6.35 C ATOM 2891 O PHE A 185 5.999 -6.694 0.208 1.00 7.24 O ATOM 2892 CB PHE A 185 5.541 -5.876 2.969 1.00 6.57 C ATOM 2893 CG PHE A 185 6.478 -4.860 3.556 1.00 6.08 C ATOM 2894 CD1 PHE A 185 7.669 -4.545 2.923 1.00 5.74 C ATOM 2895 CD2 PHE A 185 6.167 -4.226 4.748 1.00 6.14 C ATOM 2896 CE1 PHE A 185 8.534 -3.615 3.470 1.00 5.34 C ATOM 2897 CE2 PHE A 185 7.026 -3.297 5.299 1.00 5.81 C ATOM 2898 CZ PHE A 185 8.212 -2.991 4.660 1.00 5.34 C ATOM 0 H PHE A 185 3.297 -6.702 2.490 1.00 6.30 H new ATOM 0 HA PHE A 185 4.544 -4.305 1.873 1.00 5.99 H new ATOM 0 HB2 PHE A 185 4.846 -6.202 3.743 1.00 6.57 H new ATOM 0 HB3 PHE A 185 6.116 -6.752 2.667 1.00 6.57 H new ATOM 0 HD1 PHE A 185 7.925 -5.031 1.993 1.00 5.74 H new ATOM 0 HD2 PHE A 185 5.241 -4.462 5.252 1.00 6.14 H new ATOM 0 HE1 PHE A 185 9.460 -3.377 2.968 1.00 5.34 H new ATOM 0 HE2 PHE A 185 6.771 -2.810 6.229 1.00 5.81 H new ATOM 0 HZ PHE A 185 8.886 -2.265 5.090 1.00 5.34 H new ATOM 2908 N ALA A 186 5.730 -4.515 -0.284 1.00 5.78 N ATOM 2909 CA ALA A 186 6.486 -4.590 -1.529 1.00 6.30 C ATOM 2910 C ALA A 186 7.964 -4.856 -1.255 1.00 6.85 C ATOM 2911 O ALA A 186 8.742 -3.925 -1.046 1.00 6.41 O ATOM 2912 CB ALA A 186 6.321 -3.305 -2.328 1.00 5.74 C ATOM 0 H ALA A 186 5.364 -3.588 -0.068 1.00 5.78 H new ATOM 0 HA ALA A 186 6.093 -5.421 -2.114 1.00 6.30 H new ATOM 0 HB1 ALA A 186 6.891 -3.377 -3.254 1.00 5.74 H new ATOM 0 HB2 ALA A 186 5.267 -3.155 -2.561 1.00 5.74 H new ATOM 0 HB3 ALA A 186 6.687 -2.462 -1.741 1.00 5.74 H new