USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 965 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 48 ASN :FLIP amide:sc= -0.379 F(o=-1.4,f=-0.58) USER MOD Set 1.2: A 50 SER OG : rot 121:sc= 1.12 USER MOD Set 1.3: A 111 HIS : no HE2:sc= -1.32 K(o=-0.58,f=-6.4!) USER MOD Single : A 17 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.584) USER MOD Single : A 25 GLN : amide:sc= -0.019 K(o=-0.019,f=-1.4) USER MOD Single : A 27 ASN : amide:sc= -0.102 X(o=-0.1,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0486 K(o=-0.049,f=-0.92!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0327 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.331 X(o=-0.33,f=-0.0011) USER MOD Single : A 59 CYS SG : rot 160:sc= -0.761 USER MOD Single : A 60 GLN : amide:sc= 0.882 K(o=0.88,f=-6.1!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 72 GLN : amide:sc= -5.67! C(o=-5.7!,f=-9.3!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -1.07 X(o=-1.1,f=-1.2) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -1.28 K(o=-1.3,f=-2.4!) USER MOD Single : A 95 ASN :FLIP amide:sc= -3.74! C(o=-4.4!,f=-3.7!) USER MOD Single : A 97 ASN : amide:sc= -0.353 X(o=-0.35,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0127) USER MOD Single : A 104 LYS NZ :NH3+ -137:sc= -0.0793 (180deg=-1.75) USER MOD Single : A 108 THR OG1 : rot 44:sc= 1.07 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 114 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 129 SER OG : rot -100:sc= 0.092 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 132 N ILE A 13 0.150 -13.784 8.236 1.00 0.00 N ATOM 133 CA ILE A 13 1.184 -12.881 7.746 1.00 0.00 C ATOM 134 C ILE A 13 1.315 -11.656 8.645 1.00 0.00 C ATOM 135 O ILE A 13 0.362 -10.905 8.855 1.00 0.00 O ATOM 136 CB ILE A 13 0.893 -12.419 6.306 1.00 0.00 C ATOM 137 CG1 ILE A 13 0.747 -13.628 5.379 1.00 0.00 C ATOM 138 CG2 ILE A 13 1.997 -11.496 5.812 1.00 0.00 C ATOM 139 CD1 ILE A 13 -0.112 -13.357 4.164 1.00 0.00 C ATOM 0 HA ILE A 13 2.121 -13.439 7.757 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.046 -11.865 6.301 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.737 -13.946 5.051 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.316 -14.457 5.941 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.777 -11.178 4.793 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.057 -10.621 6.460 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.949 -12.026 5.829 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.171 -14.257 3.552 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.113 -13.069 4.483 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.329 -12.550 3.579 1.00 0.00 H new ATOM 151 N PRO A 14 2.523 -11.446 9.188 1.00 0.00 N ATOM 152 CA PRO A 14 2.808 -10.312 10.071 1.00 0.00 C ATOM 153 C PRO A 14 2.804 -8.981 9.325 1.00 0.00 C ATOM 154 O PRO A 14 2.930 -8.945 8.101 1.00 0.00 O ATOM 155 CB PRO A 14 4.209 -10.621 10.605 1.00 0.00 C ATOM 156 CG PRO A 14 4.828 -11.489 9.565 1.00 0.00 C ATOM 157 CD PRO A 14 3.704 -12.301 8.981 1.00 0.00 C ATOM 0 HA PRO A 14 2.054 -10.203 10.851 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.786 -9.708 10.754 1.00 0.00 H new ATOM 0 HB3 PRO A 14 4.162 -11.129 11.568 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.317 -10.890 8.797 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.591 -12.135 9.999 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.867 -12.512 7.924 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.598 -13.262 9.485 1.00 0.00 H new ATOM 165 N ASP A 15 2.659 -7.891 10.070 1.00 0.00 N ATOM 166 CA ASP A 15 2.641 -6.558 9.479 1.00 0.00 C ATOM 167 C ASP A 15 4.003 -6.205 8.891 1.00 0.00 C ATOM 168 O ASP A 15 4.993 -6.897 9.132 1.00 0.00 O ATOM 169 CB ASP A 15 2.239 -5.519 10.526 1.00 0.00 C ATOM 170 CG ASP A 15 2.087 -4.131 9.936 1.00 0.00 C ATOM 171 OD1 ASP A 15 3.115 -3.443 9.765 1.00 0.00 O ATOM 172 OD2 ASP A 15 0.939 -3.732 9.645 1.00 0.00 O ATOM 0 H ASP A 15 2.552 -7.904 11.084 1.00 0.00 H new ATOM 0 HA ASP A 15 1.906 -6.555 8.674 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.299 -5.819 10.989 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.990 -5.495 11.316 1.00 0.00 H new ATOM 177 N LEU A 16 4.046 -5.126 8.117 1.00 0.00 N ATOM 178 CA LEU A 16 5.287 -4.681 7.493 1.00 0.00 C ATOM 179 C LEU A 16 5.354 -3.159 7.438 1.00 0.00 C ATOM 180 O LEU A 16 4.493 -2.509 6.843 1.00 0.00 O ATOM 181 CB LEU A 16 5.407 -5.260 6.082 1.00 0.00 C ATOM 182 CG LEU A 16 6.829 -5.481 5.566 1.00 0.00 C ATOM 183 CD1 LEU A 16 6.821 -6.401 4.355 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.485 -4.151 5.223 1.00 0.00 C ATOM 0 H LEU A 16 3.236 -4.543 7.907 1.00 0.00 H new ATOM 0 HA LEU A 16 6.119 -5.040 8.099 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.880 -6.214 6.056 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.891 -4.592 5.392 1.00 0.00 H new ATOM 0 HG LEU A 16 7.411 -5.958 6.355 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.842 -6.546 4.002 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.392 -7.364 4.632 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.223 -5.953 3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.497 -4.328 4.857 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.903 -3.647 4.451 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.526 -3.525 6.114 1.00 0.00 H new ATOM 196 N LYS A 17 6.383 -2.594 8.060 1.00 0.00 N ATOM 197 CA LYS A 17 6.566 -1.147 8.080 1.00 0.00 C ATOM 198 C LYS A 17 7.217 -0.663 6.789 1.00 0.00 C ATOM 199 O LYS A 17 8.325 -1.078 6.447 1.00 0.00 O ATOM 200 CB LYS A 17 7.422 -0.737 9.280 1.00 0.00 C ATOM 201 CG LYS A 17 7.749 0.746 9.316 1.00 0.00 C ATOM 202 CD LYS A 17 8.980 1.025 10.162 1.00 0.00 C ATOM 203 CE LYS A 17 8.616 1.221 11.626 1.00 0.00 C ATOM 204 NZ LYS A 17 8.440 -0.078 12.333 1.00 0.00 N ATOM 0 H LYS A 17 7.104 -3.117 8.558 1.00 0.00 H new ATOM 0 HA LYS A 17 5.584 -0.683 8.167 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.900 -1.008 10.198 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.352 -1.305 9.263 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.914 1.108 8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.898 1.297 9.717 1.00 0.00 H new ATOM 0 HD2 LYS A 17 9.683 0.197 10.068 1.00 0.00 H new ATOM 0 HD3 LYS A 17 9.485 1.916 9.789 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.396 1.800 12.120 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.696 1.801 11.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 8.614 0.054 13.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.469 -0.422 12.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.114 -0.774 11.954 1.00 0.00 H new ATOM 218 N VAL A 18 6.523 0.217 6.075 1.00 0.00 N ATOM 219 CA VAL A 18 7.035 0.760 4.822 1.00 0.00 C ATOM 220 C VAL A 18 7.520 2.194 5.002 1.00 0.00 C ATOM 221 O VAL A 18 8.453 2.634 4.330 1.00 0.00 O ATOM 222 CB VAL A 18 5.963 0.727 3.716 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.526 -0.704 3.439 1.00 0.00 C ATOM 224 CG2 VAL A 18 4.773 1.592 4.103 1.00 0.00 C ATOM 0 H VAL A 18 5.604 0.570 6.343 1.00 0.00 H new ATOM 0 HA VAL A 18 7.873 0.131 4.524 1.00 0.00 H new ATOM 0 HB VAL A 18 6.395 1.133 2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.769 -0.708 2.655 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.386 -1.291 3.116 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.110 -1.140 4.347 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.025 1.557 3.311 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.338 1.218 5.030 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.103 2.621 4.246 1.00 0.00 H new ATOM 234 N PHE A 19 6.880 2.919 5.913 1.00 0.00 N ATOM 235 CA PHE A 19 7.246 4.305 6.182 1.00 0.00 C ATOM 236 C PHE A 19 6.922 4.683 7.624 1.00 0.00 C ATOM 237 O PHE A 19 5.895 4.279 8.167 1.00 0.00 O ATOM 238 CB PHE A 19 6.514 5.243 5.220 1.00 0.00 C ATOM 239 CG PHE A 19 6.810 6.696 5.459 1.00 0.00 C ATOM 240 CD1 PHE A 19 8.117 7.154 5.498 1.00 0.00 C ATOM 241 CD2 PHE A 19 5.780 7.605 5.645 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.393 8.490 5.717 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.050 8.943 5.864 1.00 0.00 C ATOM 244 CZ PHE A 19 7.358 9.386 5.902 1.00 0.00 C ATOM 0 H PHE A 19 6.105 2.570 6.478 1.00 0.00 H new ATOM 0 HA PHE A 19 8.321 4.407 6.031 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.789 4.988 4.197 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.440 5.079 5.312 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.930 6.458 5.355 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.756 7.264 5.619 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.417 8.833 5.744 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.239 9.642 6.005 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.571 10.430 6.076 1.00 0.00 H new ATOM 254 N GLU A 20 7.808 5.461 8.239 1.00 0.00 N ATOM 255 CA GLU A 20 7.617 5.893 9.618 1.00 0.00 C ATOM 256 C GLU A 20 8.069 7.339 9.804 1.00 0.00 C ATOM 257 O GLU A 20 9.263 7.636 9.770 1.00 0.00 O ATOM 258 CB GLU A 20 8.389 4.979 10.573 1.00 0.00 C ATOM 259 CG GLU A 20 8.305 5.410 12.028 1.00 0.00 C ATOM 260 CD GLU A 20 8.745 4.319 12.985 1.00 0.00 C ATOM 261 OE1 GLU A 20 9.968 4.112 13.126 1.00 0.00 O ATOM 262 OE2 GLU A 20 7.866 3.673 13.593 1.00 0.00 O ATOM 0 H GLU A 20 8.664 5.804 7.804 1.00 0.00 H new ATOM 0 HA GLU A 20 6.553 5.831 9.847 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.005 3.963 10.481 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.436 4.952 10.270 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.927 6.293 12.178 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.280 5.699 12.259 1.00 0.00 H new ATOM 269 N ARG A 21 7.105 8.233 9.999 1.00 0.00 N ATOM 270 CA ARG A 21 7.403 9.648 10.187 1.00 0.00 C ATOM 271 C ARG A 21 7.117 10.077 11.623 1.00 0.00 C ATOM 272 O ARG A 21 6.199 9.563 12.263 1.00 0.00 O ATOM 273 CB ARG A 21 6.581 10.497 9.217 1.00 0.00 C ATOM 274 CG ARG A 21 6.871 11.986 9.315 1.00 0.00 C ATOM 275 CD ARG A 21 8.000 12.396 8.383 1.00 0.00 C ATOM 276 NE ARG A 21 9.313 12.114 8.957 1.00 0.00 N ATOM 277 CZ ARG A 21 10.443 12.649 8.506 1.00 0.00 C ATOM 278 NH1 ARG A 21 10.419 13.490 7.482 1.00 0.00 N ATOM 279 NH2 ARG A 21 11.599 12.342 9.082 1.00 0.00 N ATOM 0 H ARG A 21 6.112 8.003 10.031 1.00 0.00 H new ATOM 0 HA ARG A 21 8.463 9.801 9.984 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.778 10.163 8.198 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.521 10.328 9.408 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.971 12.550 9.069 1.00 0.00 H new ATOM 0 HG3 ARG A 21 7.135 12.240 10.342 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.898 11.868 7.435 1.00 0.00 H new ATOM 0 HD3 ARG A 21 7.921 13.461 8.164 1.00 0.00 H new ATOM 0 HE ARG A 21 9.366 11.471 9.747 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.532 13.728 7.038 1.00 0.00 H new ATOM 0 HH12 ARG A 21 11.288 13.899 7.138 1.00 0.00 H new ATOM 0 HH21 ARG A 21 11.620 11.696 9.871 1.00 0.00 H new ATOM 0 HH22 ARG A 21 12.466 12.753 8.736 1.00 0.00 H new ATOM 293 N GLU A 22 7.909 11.020 12.123 1.00 0.00 N ATOM 294 CA GLU A 22 7.741 11.516 13.484 1.00 0.00 C ATOM 295 C GLU A 22 6.268 11.764 13.794 1.00 0.00 C ATOM 296 O GLU A 22 5.854 11.741 14.953 1.00 0.00 O ATOM 297 CB GLU A 22 8.540 12.805 13.683 1.00 0.00 C ATOM 298 CG GLU A 22 8.076 13.951 12.800 1.00 0.00 C ATOM 299 CD GLU A 22 8.661 15.286 13.220 1.00 0.00 C ATOM 300 OE1 GLU A 22 8.414 15.705 14.370 1.00 0.00 O ATOM 301 OE2 GLU A 22 9.364 15.911 12.399 1.00 0.00 O ATOM 0 H GLU A 22 8.673 11.456 11.606 1.00 0.00 H new ATOM 0 HA GLU A 22 8.116 10.756 14.170 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.468 13.110 14.727 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.592 12.605 13.481 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.356 13.745 11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.988 14.010 12.830 1.00 0.00 H new ATOM 308 N GLY A 23 5.481 12.003 12.750 1.00 0.00 N ATOM 309 CA GLY A 23 4.063 12.253 12.931 1.00 0.00 C ATOM 310 C GLY A 23 3.198 11.260 12.180 1.00 0.00 C ATOM 311 O GLY A 23 2.253 10.703 12.738 1.00 0.00 O ATOM 0 H GLY A 23 5.800 12.028 11.782 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.822 12.209 13.993 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.829 13.262 12.593 1.00 0.00 H new ATOM 315 N VAL A 24 3.521 11.037 10.910 1.00 0.00 N ATOM 316 CA VAL A 24 2.767 10.105 10.081 1.00 0.00 C ATOM 317 C VAL A 24 3.342 8.696 10.176 1.00 0.00 C ATOM 318 O VAL A 24 4.527 8.517 10.454 1.00 0.00 O ATOM 319 CB VAL A 24 2.758 10.546 8.606 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.045 9.514 7.744 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.107 11.913 8.462 1.00 0.00 C ATOM 0 H VAL A 24 4.301 11.490 10.433 1.00 0.00 H new ATOM 0 HA VAL A 24 1.744 10.103 10.457 1.00 0.00 H new ATOM 0 HB VAL A 24 3.789 10.622 8.262 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.049 9.843 6.705 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.559 8.556 7.823 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.016 9.403 8.086 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.110 12.209 7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.080 11.867 8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.665 12.645 9.046 1.00 0.00 H new ATOM 331 N GLN A 25 2.494 7.700 9.942 1.00 0.00 N ATOM 332 CA GLN A 25 2.919 6.306 10.002 1.00 0.00 C ATOM 333 C GLN A 25 2.192 5.470 8.953 1.00 0.00 C ATOM 334 O GLN A 25 0.969 5.542 8.825 1.00 0.00 O ATOM 335 CB GLN A 25 2.663 5.732 11.396 1.00 0.00 C ATOM 336 CG GLN A 25 3.830 5.913 12.353 1.00 0.00 C ATOM 337 CD GLN A 25 3.407 5.855 13.807 1.00 0.00 C ATOM 338 OE1 GLN A 25 2.241 5.609 14.117 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.355 6.082 14.709 1.00 0.00 N ATOM 0 H GLN A 25 1.510 7.832 9.709 1.00 0.00 H new ATOM 0 HA GLN A 25 3.988 6.269 9.793 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.779 6.209 11.820 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.439 4.669 11.306 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.573 5.139 12.164 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.311 6.871 12.156 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.309 6.282 14.407 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.129 6.056 15.703 1.00 0.00 H new ATOM 348 N LEU A 26 2.952 4.679 8.204 1.00 0.00 N ATOM 349 CA LEU A 26 2.381 3.829 7.166 1.00 0.00 C ATOM 350 C LEU A 26 2.699 2.360 7.427 1.00 0.00 C ATOM 351 O LEU A 26 3.854 1.994 7.640 1.00 0.00 O ATOM 352 CB LEU A 26 2.913 4.240 5.792 1.00 0.00 C ATOM 353 CG LEU A 26 2.020 3.904 4.597 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.701 4.656 4.688 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.731 4.226 3.292 1.00 0.00 C ATOM 0 H LEU A 26 3.965 4.609 8.296 1.00 0.00 H new ATOM 0 HA LEU A 26 1.299 3.956 7.183 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.086 5.316 5.799 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.881 3.762 5.642 1.00 0.00 H new ATOM 0 HG LEU A 26 1.807 2.835 4.617 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.079 4.404 3.829 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.184 4.375 5.606 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.894 5.729 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.080 3.980 2.453 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.975 5.288 3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.648 3.641 3.223 1.00 0.00 H new ATOM 367 N ASN A 27 1.666 1.523 7.408 1.00 0.00 N ATOM 368 CA ASN A 27 1.836 0.094 7.642 1.00 0.00 C ATOM 369 C ASN A 27 1.335 -0.716 6.450 1.00 0.00 C ATOM 370 O ASN A 27 0.574 -0.215 5.621 1.00 0.00 O ATOM 371 CB ASN A 27 1.091 -0.329 8.909 1.00 0.00 C ATOM 372 CG ASN A 27 1.596 0.391 10.145 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.398 -0.150 10.907 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.128 1.616 10.348 1.00 0.00 N ATOM 0 H ASN A 27 0.703 1.810 7.233 1.00 0.00 H new ATOM 0 HA ASN A 27 2.900 -0.103 7.771 1.00 0.00 H new ATOM 0 HB2 ASN A 27 0.027 -0.129 8.785 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.199 -1.405 9.049 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.432 2.150 11.163 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.465 2.024 9.689 1.00 0.00 H new ATOM 381 N LEU A 28 1.767 -1.969 6.369 1.00 0.00 N ATOM 382 CA LEU A 28 1.362 -2.850 5.279 1.00 0.00 C ATOM 383 C LEU A 28 0.783 -4.154 5.818 1.00 0.00 C ATOM 384 O LEU A 28 1.216 -4.654 6.856 1.00 0.00 O ATOM 385 CB LEU A 28 2.554 -3.147 4.367 1.00 0.00 C ATOM 386 CG LEU A 28 2.219 -3.513 2.921 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.426 -3.297 2.022 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.738 -4.954 2.834 1.00 0.00 C ATOM 0 H LEU A 28 2.398 -2.398 7.045 1.00 0.00 H new ATOM 0 HA LEU A 28 0.589 -2.342 4.703 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.205 -2.273 4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.125 -3.966 4.805 1.00 0.00 H new ATOM 0 HG LEU A 28 1.416 -2.861 2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.168 -3.563 0.997 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.726 -2.250 2.061 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.250 -3.923 2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.504 -5.198 1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.520 -5.621 3.196 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.845 -5.077 3.446 1.00 0.00 H new ATOM 400 N SER A 29 -0.197 -4.699 5.106 1.00 0.00 N ATOM 401 CA SER A 29 -0.837 -5.944 5.513 1.00 0.00 C ATOM 402 C SER A 29 -1.146 -6.819 4.302 1.00 0.00 C ATOM 403 O SER A 29 -1.708 -6.351 3.311 1.00 0.00 O ATOM 404 CB SER A 29 -2.124 -5.652 6.287 1.00 0.00 C ATOM 405 OG SER A 29 -1.839 -5.188 7.595 1.00 0.00 O ATOM 0 H SER A 29 -0.566 -4.298 4.244 1.00 0.00 H new ATOM 0 HA SER A 29 -0.146 -6.483 6.161 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.712 -4.905 5.753 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.731 -6.555 6.343 1.00 0.00 H new ATOM 0 HG SER A 29 -2.678 -5.007 8.068 1.00 0.00 H new ATOM 411 N PHE A 30 -0.775 -8.092 4.389 1.00 0.00 N ATOM 412 CA PHE A 30 -1.011 -9.033 3.300 1.00 0.00 C ATOM 413 C PHE A 30 -2.168 -9.971 3.633 1.00 0.00 C ATOM 414 O PHE A 30 -2.359 -10.353 4.788 1.00 0.00 O ATOM 415 CB PHE A 30 0.254 -9.846 3.018 1.00 0.00 C ATOM 416 CG PHE A 30 1.482 -9.000 2.837 1.00 0.00 C ATOM 417 CD1 PHE A 30 2.137 -8.463 3.933 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.982 -8.743 1.570 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.268 -7.684 3.771 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.112 -7.966 1.402 1.00 0.00 C ATOM 421 CZ PHE A 30 3.755 -7.435 2.503 1.00 0.00 C ATOM 0 H PHE A 30 -0.310 -8.496 5.202 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.274 -8.462 2.410 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.420 -10.542 3.840 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.099 -10.444 2.120 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.760 -8.655 4.927 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.483 -9.154 0.705 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.769 -7.271 4.634 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.493 -7.774 0.410 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.637 -6.826 2.372 1.00 0.00 H new ATOM 431 N ILE A 31 -2.937 -10.337 2.613 1.00 0.00 N ATOM 432 CA ILE A 31 -4.074 -11.229 2.796 1.00 0.00 C ATOM 433 C ILE A 31 -4.120 -12.293 1.704 1.00 0.00 C ATOM 434 O ILE A 31 -4.014 -11.984 0.517 1.00 0.00 O ATOM 435 CB ILE A 31 -5.404 -10.453 2.796 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.505 -9.572 4.043 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.580 -11.417 2.726 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.783 -8.250 3.908 1.00 0.00 C ATOM 0 H ILE A 31 -2.793 -10.029 1.651 1.00 0.00 H new ATOM 0 HA ILE A 31 -3.944 -11.711 3.765 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.433 -9.810 1.916 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.556 -9.382 4.260 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.097 -10.115 4.896 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.513 -10.853 2.727 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.513 -12.007 1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.557 -12.082 3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.897 -7.678 4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.724 -8.431 3.722 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.207 -7.687 3.076 1.00 0.00 H new ATOM 450 N ARG A 32 -4.279 -13.547 2.114 1.00 0.00 N ATOM 451 CA ARG A 32 -4.339 -14.657 1.171 1.00 0.00 C ATOM 452 C ARG A 32 -5.656 -15.417 1.309 1.00 0.00 C ATOM 453 O ARG A 32 -5.821 -16.269 2.181 1.00 0.00 O ATOM 454 CB ARG A 32 -3.163 -15.610 1.396 1.00 0.00 C ATOM 455 CG ARG A 32 -1.852 -15.105 0.816 1.00 0.00 C ATOM 456 CD ARG A 32 -1.715 -15.471 -0.654 1.00 0.00 C ATOM 457 NE ARG A 32 -1.758 -16.915 -0.865 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.725 -17.721 -0.642 1.00 0.00 C ATOM 459 NH1 ARG A 32 0.424 -17.226 -0.203 1.00 0.00 N ATOM 460 NH2 ARG A 32 -0.842 -19.025 -0.857 1.00 0.00 N ATOM 0 H ARG A 32 -4.369 -13.820 3.093 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.279 -14.248 0.163 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.038 -15.774 2.466 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.399 -16.577 0.951 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.796 -14.022 0.929 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.018 -15.528 1.377 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.516 -14.998 -1.221 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.775 -15.076 -1.040 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.628 -17.328 -1.202 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.517 -16.224 -0.035 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.215 -17.847 -0.033 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.725 -19.409 -1.194 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.049 -19.643 -0.686 1.00 0.00 H new ATOM 474 N PRO A 33 -6.616 -15.101 0.427 1.00 0.00 N ATOM 475 CA PRO A 33 -7.935 -15.741 0.430 1.00 0.00 C ATOM 476 C PRO A 33 -7.872 -17.199 -0.013 1.00 0.00 C ATOM 477 O PRO A 33 -7.063 -17.582 -0.859 1.00 0.00 O ATOM 478 CB PRO A 33 -8.734 -14.911 -0.577 1.00 0.00 C ATOM 479 CG PRO A 33 -7.709 -14.329 -1.487 1.00 0.00 C ATOM 480 CD PRO A 33 -6.489 -14.094 -0.640 1.00 0.00 C ATOM 0 HA PRO A 33 -8.374 -15.765 1.427 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.444 -15.530 -1.125 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.310 -14.131 -0.079 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.488 -15.008 -2.310 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.063 -13.397 -1.928 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.571 -14.228 -1.212 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.469 -13.082 -0.237 1.00 0.00 H new ATOM 488 N PRO A 34 -8.745 -18.034 0.571 1.00 0.00 N ATOM 489 CA PRO A 34 -8.808 -19.463 0.251 1.00 0.00 C ATOM 490 C PRO A 34 -9.350 -19.720 -1.151 1.00 0.00 C ATOM 491 O PRO A 34 -8.884 -20.618 -1.851 1.00 0.00 O ATOM 492 CB PRO A 34 -9.768 -20.020 1.306 1.00 0.00 C ATOM 493 CG PRO A 34 -10.618 -18.860 1.695 1.00 0.00 C ATOM 494 CD PRO A 34 -9.737 -17.647 1.588 1.00 0.00 C ATOM 0 HA PRO A 34 -7.822 -19.928 0.264 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.370 -20.834 0.903 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.226 -20.419 2.163 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.484 -18.773 1.038 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.998 -18.978 2.710 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.302 -16.766 1.283 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.264 -17.409 2.541 1.00 0.00 H new ATOM 502 N GLU A 35 -10.337 -18.926 -1.553 1.00 0.00 N ATOM 503 CA GLU A 35 -10.942 -19.069 -2.872 1.00 0.00 C ATOM 504 C GLU A 35 -9.900 -18.884 -3.972 1.00 0.00 C ATOM 505 O GLU A 35 -9.879 -19.627 -4.952 1.00 0.00 O ATOM 506 CB GLU A 35 -12.074 -18.055 -3.051 1.00 0.00 C ATOM 507 CG GLU A 35 -11.610 -16.609 -3.002 1.00 0.00 C ATOM 508 CD GLU A 35 -12.715 -15.629 -3.345 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.631 -16.009 -4.103 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.662 -14.482 -2.855 1.00 0.00 O ATOM 0 H GLU A 35 -10.734 -18.178 -0.985 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.351 -20.077 -2.948 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.566 -18.238 -4.006 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.820 -18.215 -2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.230 -16.387 -2.005 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.781 -16.474 -3.697 1.00 0.00 H new ATOM 517 N ASN A 36 -9.038 -17.887 -3.800 1.00 0.00 N ATOM 518 CA ASN A 36 -7.994 -17.603 -4.778 1.00 0.00 C ATOM 519 C ASN A 36 -6.629 -17.506 -4.103 1.00 0.00 C ATOM 520 O ASN A 36 -6.234 -16.457 -3.594 1.00 0.00 O ATOM 521 CB ASN A 36 -8.302 -16.302 -5.521 1.00 0.00 C ATOM 522 CG ASN A 36 -9.201 -16.521 -6.722 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.806 -17.583 -6.874 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.293 -15.515 -7.584 1.00 0.00 N ATOM 0 H ASN A 36 -9.042 -17.263 -2.993 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.968 -18.424 -5.494 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.779 -15.600 -4.837 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.369 -15.844 -5.848 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.883 -15.605 -8.411 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.774 -14.653 -7.419 1.00 0.00 H new ATOM 531 N PRO A 37 -5.890 -18.625 -4.098 1.00 0.00 N ATOM 532 CA PRO A 37 -4.558 -18.691 -3.491 1.00 0.00 C ATOM 533 C PRO A 37 -3.522 -17.894 -4.276 1.00 0.00 C ATOM 534 O PRO A 37 -2.465 -17.544 -3.751 1.00 0.00 O ATOM 535 CB PRO A 37 -4.224 -20.185 -3.529 1.00 0.00 C ATOM 536 CG PRO A 37 -5.033 -20.725 -4.658 1.00 0.00 C ATOM 537 CD PRO A 37 -6.298 -19.912 -4.687 1.00 0.00 C ATOM 0 HA PRO A 37 -4.546 -18.263 -2.489 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.159 -20.349 -3.692 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.482 -20.672 -2.589 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.493 -20.640 -5.601 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.252 -21.783 -4.510 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.673 -19.788 -5.703 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.093 -20.384 -4.109 1.00 0.00 H new ATOM 545 N ALA A 38 -3.833 -17.609 -5.537 1.00 0.00 N ATOM 546 CA ALA A 38 -2.930 -16.850 -6.393 1.00 0.00 C ATOM 547 C ALA A 38 -3.223 -15.356 -6.314 1.00 0.00 C ATOM 548 O ALA A 38 -2.531 -14.543 -6.928 1.00 0.00 O ATOM 549 CB ALA A 38 -3.035 -17.335 -7.832 1.00 0.00 C ATOM 0 H ALA A 38 -4.703 -17.892 -5.988 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.912 -17.013 -6.039 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.355 -16.760 -8.460 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.768 -18.391 -7.881 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -4.057 -17.203 -8.187 1.00 0.00 H new ATOM 555 N LEU A 39 -4.254 -15.000 -5.554 1.00 0.00 N ATOM 556 CA LEU A 39 -4.640 -13.602 -5.395 1.00 0.00 C ATOM 557 C LEU A 39 -4.105 -13.036 -4.083 1.00 0.00 C ATOM 558 O LEU A 39 -4.471 -13.495 -3.001 1.00 0.00 O ATOM 559 CB LEU A 39 -6.162 -13.465 -5.439 1.00 0.00 C ATOM 560 CG LEU A 39 -6.714 -12.049 -5.268 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.700 -11.307 -6.596 1.00 0.00 C ATOM 562 CD2 LEU A 39 -8.122 -12.091 -4.694 1.00 0.00 C ATOM 0 H LEU A 39 -4.837 -15.660 -5.039 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.206 -13.035 -6.218 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.515 -13.858 -6.392 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.586 -14.096 -4.658 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.074 -11.512 -4.568 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.096 -10.301 -6.455 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.677 -11.245 -6.968 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.317 -11.842 -7.318 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.499 -11.075 -4.579 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.774 -12.645 -5.369 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.104 -12.583 -3.722 1.00 0.00 H new ATOM 574 N LEU A 40 -3.238 -12.035 -4.187 1.00 0.00 N ATOM 575 CA LEU A 40 -2.653 -11.403 -3.009 1.00 0.00 C ATOM 576 C LEU A 40 -3.278 -10.035 -2.759 1.00 0.00 C ATOM 577 O LEU A 40 -2.997 -9.072 -3.474 1.00 0.00 O ATOM 578 CB LEU A 40 -1.140 -11.262 -3.180 1.00 0.00 C ATOM 579 CG LEU A 40 -0.401 -10.548 -2.048 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.415 -11.393 -0.784 1.00 0.00 C ATOM 581 CD2 LEU A 40 1.028 -10.229 -2.462 1.00 0.00 C ATOM 0 H LEU A 40 -2.924 -11.643 -5.075 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.857 -12.038 -2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.713 -12.258 -3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.948 -10.724 -4.109 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.916 -9.610 -1.839 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.116 -10.868 0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.446 -11.570 -0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.075 -12.347 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.539 -9.721 -1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.553 -11.154 -2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.017 -9.583 -3.340 1.00 0.00 H new ATOM 593 N LEU A 41 -4.126 -9.955 -1.739 1.00 0.00 N ATOM 594 CA LEU A 41 -4.789 -8.703 -1.392 1.00 0.00 C ATOM 595 C LEU A 41 -3.998 -7.942 -0.333 1.00 0.00 C ATOM 596 O LEU A 41 -3.862 -8.401 0.802 1.00 0.00 O ATOM 597 CB LEU A 41 -6.207 -8.977 -0.887 1.00 0.00 C ATOM 598 CG LEU A 41 -7.069 -9.882 -1.767 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.381 -10.211 -1.071 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.329 -9.225 -3.115 1.00 0.00 C ATOM 0 H LEU A 41 -4.370 -10.742 -1.138 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.842 -8.088 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.138 -9.426 0.104 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.720 -8.023 -0.769 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.528 -10.813 -1.937 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.981 -10.856 -1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.176 -10.724 -0.131 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.927 -9.289 -0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.944 -9.884 -3.728 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.849 -8.279 -2.964 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.380 -9.041 -3.619 1.00 0.00 H new ATOM 612 N ILE A 42 -3.481 -6.778 -0.710 1.00 0.00 N ATOM 613 CA ILE A 42 -2.707 -5.953 0.209 1.00 0.00 C ATOM 614 C ILE A 42 -3.521 -4.759 0.695 1.00 0.00 C ATOM 615 O ILE A 42 -4.351 -4.218 -0.038 1.00 0.00 O ATOM 616 CB ILE A 42 -1.411 -5.442 -0.448 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.390 -6.577 -0.562 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.835 -4.281 0.348 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.774 -6.253 -1.472 1.00 0.00 C ATOM 0 H ILE A 42 -3.584 -6.385 -1.645 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.450 -6.585 1.059 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.645 -5.087 -1.452 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.009 -6.813 0.432 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.892 -7.471 -0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.080 -3.931 -0.129 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.560 -3.468 0.382 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.612 -4.611 1.363 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.457 -7.102 -1.505 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.404 -6.045 -2.476 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.301 -5.378 -1.091 1.00 0.00 H new ATOM 631 N THR A 43 -3.278 -4.350 1.936 1.00 0.00 N ATOM 632 CA THR A 43 -3.988 -3.219 2.521 1.00 0.00 C ATOM 633 C THR A 43 -3.022 -2.255 3.201 1.00 0.00 C ATOM 634 O THR A 43 -2.117 -2.675 3.923 1.00 0.00 O ATOM 635 CB THR A 43 -5.038 -3.685 3.548 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.606 -4.933 3.136 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.139 -2.647 3.705 1.00 0.00 C ATOM 0 H THR A 43 -2.595 -4.785 2.556 1.00 0.00 H new ATOM 0 HA THR A 43 -4.493 -2.706 1.703 1.00 0.00 H new ATOM 0 HB THR A 43 -4.542 -3.813 4.510 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.271 -5.223 3.795 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.869 -2.998 4.435 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.707 -1.707 4.047 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.632 -2.491 2.745 1.00 0.00 H new ATOM 645 N ILE A 44 -3.220 -0.962 2.965 1.00 0.00 N ATOM 646 CA ILE A 44 -2.367 0.061 3.557 1.00 0.00 C ATOM 647 C ILE A 44 -3.086 0.791 4.686 1.00 0.00 C ATOM 648 O ILE A 44 -4.315 0.856 4.715 1.00 0.00 O ATOM 649 CB ILE A 44 -1.910 1.089 2.505 1.00 0.00 C ATOM 650 CG1 ILE A 44 -1.796 0.428 1.130 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.581 1.708 2.913 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.432 1.394 0.024 1.00 0.00 C ATOM 0 H ILE A 44 -3.963 -0.599 2.368 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.492 -0.451 3.958 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.655 1.882 2.445 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.044 -0.360 1.176 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.744 -0.051 0.886 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.271 2.432 2.160 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.693 2.209 3.874 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.174 0.926 2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.369 0.857 -0.922 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.196 2.168 -0.049 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.469 1.854 0.245 1.00 0.00 H new ATOM 664 N THR A 45 -2.311 1.341 5.616 1.00 0.00 N ATOM 665 CA THR A 45 -2.873 2.067 6.748 1.00 0.00 C ATOM 666 C THR A 45 -2.023 3.283 7.097 1.00 0.00 C ATOM 667 O THR A 45 -0.928 3.152 7.644 1.00 0.00 O ATOM 668 CB THR A 45 -2.992 1.165 7.990 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.710 -0.030 7.661 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.703 1.893 9.121 1.00 0.00 C ATOM 0 H THR A 45 -1.292 1.297 5.607 1.00 0.00 H new ATOM 0 HA THR A 45 -3.869 2.396 6.450 1.00 0.00 H new ATOM 0 HB THR A 45 -1.986 0.905 8.321 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.780 -0.599 8.456 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.775 1.236 9.988 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.140 2.787 9.389 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.704 2.178 8.797 1.00 0.00 H new ATOM 678 N ALA A 46 -2.534 4.468 6.777 1.00 0.00 N ATOM 679 CA ALA A 46 -1.823 5.708 7.060 1.00 0.00 C ATOM 680 C ALA A 46 -2.480 6.469 8.207 1.00 0.00 C ATOM 681 O ALA A 46 -3.634 6.889 8.108 1.00 0.00 O ATOM 682 CB ALA A 46 -1.763 6.578 5.813 1.00 0.00 C ATOM 0 H ALA A 46 -3.438 4.595 6.322 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.807 5.454 7.362 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.229 7.501 6.039 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.242 6.042 5.020 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.775 6.815 5.486 1.00 0.00 H new ATOM 688 N THR A 47 -1.739 6.643 9.297 1.00 0.00 N ATOM 689 CA THR A 47 -2.250 7.351 10.463 1.00 0.00 C ATOM 690 C THR A 47 -1.556 8.697 10.638 1.00 0.00 C ATOM 691 O THR A 47 -0.369 8.836 10.344 1.00 0.00 O ATOM 692 CB THR A 47 -2.068 6.522 11.749 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.730 6.017 11.820 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.056 5.365 11.790 1.00 0.00 C ATOM 0 H THR A 47 -0.782 6.303 9.396 1.00 0.00 H new ATOM 0 HA THR A 47 -3.314 7.513 10.291 1.00 0.00 H new ATOM 0 HB THR A 47 -2.257 7.171 12.604 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.621 5.493 12.641 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.909 4.794 12.707 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.074 5.755 11.764 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.894 4.717 10.929 1.00 0.00 H new ATOM 702 N ASN A 48 -2.302 9.685 11.120 1.00 0.00 N ATOM 703 CA ASN A 48 -1.757 11.021 11.333 1.00 0.00 C ATOM 704 C ASN A 48 -2.001 11.484 12.766 1.00 0.00 C ATOM 705 O ASN A 48 -3.070 11.255 13.331 1.00 0.00 O ATOM 706 CB ASN A 48 -2.383 12.013 10.351 1.00 0.00 C ATOM 707 CG ASN A 48 -1.681 13.357 10.362 1.00 0.00 C ATOM 708 OD1 ASN A 48 -2.415 14.411 10.023 1.00 0.00 O flip ATOM 709 ND2 ASN A 48 -0.493 13.448 10.672 1.00 0.00 N flip ATOM 0 H ASN A 48 -3.286 9.586 11.371 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.682 10.980 11.160 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -2.347 11.596 9.345 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.435 12.153 10.601 1.00 0.00 H new ATOM 0 HD21 ASN A 48 0.033 12.612 10.926 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -0.035 14.359 10.675 1.00 0.00 H new ATOM 716 N PHE A 49 -1.001 12.139 13.349 1.00 0.00 N ATOM 717 CA PHE A 49 -1.106 12.635 14.716 1.00 0.00 C ATOM 718 C PHE A 49 -0.717 14.109 14.791 1.00 0.00 C ATOM 719 O PHE A 49 -1.252 14.862 15.604 1.00 0.00 O ATOM 720 CB PHE A 49 -0.214 11.813 15.649 1.00 0.00 C ATOM 721 CG PHE A 49 -0.709 10.412 15.870 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.729 10.157 16.773 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.154 9.350 15.175 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.184 8.869 16.978 1.00 0.00 C ATOM 725 CE2 PHE A 49 -0.606 8.059 15.376 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.623 7.818 16.278 1.00 0.00 C ATOM 0 H PHE A 49 -0.109 12.338 12.896 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.144 12.534 15.034 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.793 11.773 15.234 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.142 12.321 16.611 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.173 10.974 17.322 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.641 9.533 14.468 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.978 8.683 17.686 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.164 7.240 14.828 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.979 6.811 16.436 1.00 0.00 H new ATOM 736 N SER A 50 0.217 14.512 13.937 1.00 0.00 N ATOM 737 CA SER A 50 0.681 15.894 13.908 1.00 0.00 C ATOM 738 C SER A 50 -0.497 16.862 13.861 1.00 0.00 C ATOM 739 O SER A 50 -1.648 16.449 13.722 1.00 0.00 O ATOM 740 CB SER A 50 1.593 16.124 12.701 1.00 0.00 C ATOM 741 OG SER A 50 0.966 15.703 11.502 1.00 0.00 O ATOM 0 H SER A 50 0.668 13.901 13.256 1.00 0.00 H new ATOM 0 HA SER A 50 1.246 16.080 14.821 1.00 0.00 H new ATOM 0 HB2 SER A 50 1.848 17.181 12.630 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.527 15.579 12.838 1.00 0.00 H new ATOM 0 HG SER A 50 0.895 16.462 10.886 1.00 0.00 H new ATOM 747 N GLU A 51 -0.200 18.153 13.979 1.00 0.00 N ATOM 748 CA GLU A 51 -1.235 19.180 13.951 1.00 0.00 C ATOM 749 C GLU A 51 -1.760 19.385 12.533 1.00 0.00 C ATOM 750 O GLU A 51 -2.960 19.552 12.321 1.00 0.00 O ATOM 751 CB GLU A 51 -0.690 20.499 14.501 1.00 0.00 C ATOM 752 CG GLU A 51 0.032 20.353 15.830 1.00 0.00 C ATOM 753 CD GLU A 51 0.176 21.672 16.564 1.00 0.00 C ATOM 754 OE1 GLU A 51 -0.745 22.031 17.328 1.00 0.00 O ATOM 755 OE2 GLU A 51 1.210 22.346 16.374 1.00 0.00 O ATOM 0 H GLU A 51 0.748 18.512 14.095 1.00 0.00 H new ATOM 0 HA GLU A 51 -2.060 18.846 14.580 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.006 20.932 13.771 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.515 21.201 14.621 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.512 19.649 16.459 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.021 19.928 15.657 1.00 0.00 H new ATOM 762 N GLY A 52 -0.849 19.372 11.563 1.00 0.00 N ATOM 763 CA GLY A 52 -1.238 19.558 10.178 1.00 0.00 C ATOM 764 C GLY A 52 -2.019 18.379 9.631 1.00 0.00 C ATOM 765 O GLY A 52 -1.602 17.230 9.775 1.00 0.00 O ATOM 0 H GLY A 52 0.151 19.236 11.713 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.842 20.461 10.092 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.346 19.712 9.571 1.00 0.00 H new ATOM 769 N ASP A 53 -3.155 18.663 9.004 1.00 0.00 N ATOM 770 CA ASP A 53 -3.996 17.617 8.435 1.00 0.00 C ATOM 771 C ASP A 53 -3.446 17.149 7.091 1.00 0.00 C ATOM 772 O ASP A 53 -2.846 17.926 6.349 1.00 0.00 O ATOM 773 CB ASP A 53 -5.430 18.122 8.265 1.00 0.00 C ATOM 774 CG ASP A 53 -5.491 19.614 8.002 1.00 0.00 C ATOM 775 OD1 ASP A 53 -4.755 20.091 7.112 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.275 20.305 8.685 1.00 0.00 O ATOM 0 H ASP A 53 -3.515 19.609 8.877 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.996 16.771 9.122 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.904 17.591 7.439 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.003 17.891 9.163 1.00 0.00 H new ATOM 781 N VAL A 54 -3.654 15.872 6.785 1.00 0.00 N ATOM 782 CA VAL A 54 -3.180 15.300 5.531 1.00 0.00 C ATOM 783 C VAL A 54 -4.332 15.071 4.560 1.00 0.00 C ATOM 784 O VAL A 54 -5.133 14.152 4.733 1.00 0.00 O ATOM 785 CB VAL A 54 -2.448 13.965 5.765 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.324 13.188 4.463 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.079 14.209 6.382 1.00 0.00 C ATOM 0 H VAL A 54 -4.148 15.214 7.389 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.483 16.018 5.100 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.034 13.367 6.463 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.804 12.248 4.648 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.318 12.981 4.067 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.761 13.778 3.740 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.576 13.255 6.540 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.482 14.827 5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.196 14.720 7.337 1.00 0.00 H new ATOM 797 N THR A 55 -4.412 15.915 3.535 1.00 0.00 N ATOM 798 CA THR A 55 -5.467 15.806 2.535 1.00 0.00 C ATOM 799 C THR A 55 -4.885 15.587 1.143 1.00 0.00 C ATOM 800 O THR A 55 -3.667 15.551 0.967 1.00 0.00 O ATOM 801 CB THR A 55 -6.354 17.065 2.517 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.583 18.203 2.116 1.00 0.00 O ATOM 803 CG2 THR A 55 -6.966 17.316 3.887 1.00 0.00 C ATOM 0 H THR A 55 -3.758 16.682 3.376 1.00 0.00 H new ATOM 0 HA THR A 55 -6.076 14.945 2.810 1.00 0.00 H new ATOM 0 HB THR A 55 -7.160 16.904 1.801 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.155 18.999 2.106 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.588 18.210 3.849 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.577 16.461 4.175 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.172 17.457 4.620 1.00 0.00 H new ATOM 811 N HIS A 56 -5.763 15.443 0.156 1.00 0.00 N ATOM 812 CA HIS A 56 -5.336 15.229 -1.222 1.00 0.00 C ATOM 813 C HIS A 56 -4.161 14.257 -1.282 1.00 0.00 C ATOM 814 O HIS A 56 -3.205 14.467 -2.029 1.00 0.00 O ATOM 815 CB HIS A 56 -4.946 16.558 -1.869 1.00 0.00 C ATOM 816 CG HIS A 56 -6.098 17.498 -2.047 1.00 0.00 C ATOM 817 ND1 HIS A 56 -6.388 18.115 -3.246 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.036 17.925 -1.170 1.00 0.00 C ATOM 819 CE1 HIS A 56 -7.454 18.882 -3.098 1.00 0.00 C ATOM 820 NE2 HIS A 56 -7.867 18.784 -1.847 1.00 0.00 N ATOM 0 H HIS A 56 -6.774 15.471 0.285 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.172 14.796 -1.772 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.185 17.041 -1.257 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.495 16.361 -2.842 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.116 17.643 -0.131 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.910 19.486 -3.869 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -8.672 19.268 -1.449 1.00 0.00 H new ATOM 828 N PHE A 57 -4.239 13.192 -0.490 1.00 0.00 N ATOM 829 CA PHE A 57 -3.182 12.189 -0.452 1.00 0.00 C ATOM 830 C PHE A 57 -3.383 11.145 -1.547 1.00 0.00 C ATOM 831 O PHE A 57 -4.473 10.591 -1.699 1.00 0.00 O ATOM 832 CB PHE A 57 -3.147 11.507 0.917 1.00 0.00 C ATOM 833 CG PHE A 57 -2.570 10.121 0.882 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.283 9.903 0.416 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.314 9.035 1.314 1.00 0.00 C ATOM 836 CE1 PHE A 57 -0.749 8.629 0.382 1.00 0.00 C ATOM 837 CE2 PHE A 57 -2.785 7.758 1.283 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.502 7.555 0.816 1.00 0.00 C ATOM 0 H PHE A 57 -5.023 13.002 0.134 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.231 12.693 -0.625 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.561 12.118 1.604 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.160 11.460 1.317 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.690 10.739 0.075 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.319 9.188 1.679 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.255 8.473 0.017 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.375 6.920 1.624 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.087 6.558 0.790 1.00 0.00 H new ATOM 848 N ILE A 58 -2.326 10.883 -2.307 1.00 0.00 N ATOM 849 CA ILE A 58 -2.385 9.907 -3.388 1.00 0.00 C ATOM 850 C ILE A 58 -1.393 8.772 -3.159 1.00 0.00 C ATOM 851 O ILE A 58 -0.226 9.008 -2.843 1.00 0.00 O ATOM 852 CB ILE A 58 -2.096 10.559 -4.753 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.224 11.520 -5.133 1.00 0.00 C ATOM 854 CG2 ILE A 58 -1.918 9.492 -5.823 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.040 12.916 -4.582 1.00 0.00 C ATOM 0 H ILE A 58 -1.418 11.333 -2.194 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.398 9.505 -3.394 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.169 11.128 -4.678 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.294 11.573 -6.219 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.170 11.117 -4.772 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.714 9.969 -6.782 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.083 8.844 -5.555 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.829 8.898 -5.899 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.877 13.542 -4.891 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.000 12.875 -3.493 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.110 13.338 -4.964 1.00 0.00 H new ATOM 867 N CYS A 59 -1.863 7.540 -3.321 1.00 0.00 N ATOM 868 CA CYS A 59 -1.017 6.368 -3.132 1.00 0.00 C ATOM 869 C CYS A 59 -0.952 5.533 -4.407 1.00 0.00 C ATOM 870 O CYS A 59 -1.907 4.839 -4.755 1.00 0.00 O ATOM 871 CB CYS A 59 -1.541 5.515 -1.976 1.00 0.00 C ATOM 872 SG CYS A 59 -0.276 4.505 -1.171 1.00 0.00 S ATOM 0 H CYS A 59 -2.826 7.327 -3.583 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.011 6.712 -2.893 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.995 6.170 -1.232 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.329 4.861 -2.349 1.00 0.00 H new ATOM 0 HG CYS A 59 -0.684 4.162 0.014 1.00 0.00 H new ATOM 878 N GLN A 60 0.179 5.608 -5.101 1.00 0.00 N ATOM 879 CA GLN A 60 0.366 4.861 -6.339 1.00 0.00 C ATOM 880 C GLN A 60 1.352 3.715 -6.140 1.00 0.00 C ATOM 881 O GLN A 60 2.109 3.696 -5.169 1.00 0.00 O ATOM 882 CB GLN A 60 0.863 5.790 -7.449 1.00 0.00 C ATOM 883 CG GLN A 60 -0.023 7.005 -7.667 1.00 0.00 C ATOM 884 CD GLN A 60 0.487 7.908 -8.773 1.00 0.00 C ATOM 885 OE1 GLN A 60 1.542 7.658 -9.358 1.00 0.00 O ATOM 886 NE2 GLN A 60 -0.260 8.966 -9.067 1.00 0.00 N ATOM 0 H GLN A 60 0.979 6.178 -4.827 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.597 4.441 -6.629 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.872 6.125 -7.207 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.929 5.227 -8.380 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.033 6.675 -7.910 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.088 7.574 -6.739 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -1.127 9.136 -8.557 1.00 0.00 H new ATOM 0 HE22 GLN A 60 0.033 9.609 -9.802 1.00 0.00 H new ATOM 895 N ALA A 61 1.337 2.760 -7.064 1.00 0.00 N ATOM 896 CA ALA A 61 2.231 1.611 -6.990 1.00 0.00 C ATOM 897 C ALA A 61 2.534 1.062 -8.380 1.00 0.00 C ATOM 898 O ALA A 61 1.884 1.429 -9.358 1.00 0.00 O ATOM 899 CB ALA A 61 1.625 0.527 -6.112 1.00 0.00 C ATOM 0 H ALA A 61 0.715 2.759 -7.873 1.00 0.00 H new ATOM 0 HA ALA A 61 3.170 1.940 -6.545 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.303 -0.325 -6.066 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.466 0.919 -5.108 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.671 0.209 -6.533 1.00 0.00 H new ATOM 905 N ALA A 62 3.525 0.180 -8.459 1.00 0.00 N ATOM 906 CA ALA A 62 3.913 -0.421 -9.729 1.00 0.00 C ATOM 907 C ALA A 62 4.322 -1.879 -9.544 1.00 0.00 C ATOM 908 O ALA A 62 4.971 -2.232 -8.560 1.00 0.00 O ATOM 909 CB ALA A 62 5.047 0.371 -10.363 1.00 0.00 C ATOM 0 H ALA A 62 4.074 -0.134 -7.659 1.00 0.00 H new ATOM 0 HA ALA A 62 3.050 -0.395 -10.394 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.327 -0.089 -11.311 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.721 1.396 -10.539 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.907 0.374 -9.694 1.00 0.00 H new ATOM 915 N VAL A 63 3.938 -2.722 -10.498 1.00 0.00 N ATOM 916 CA VAL A 63 4.266 -4.141 -10.440 1.00 0.00 C ATOM 917 C VAL A 63 4.685 -4.665 -11.809 1.00 0.00 C ATOM 918 O VAL A 63 4.237 -4.183 -12.850 1.00 0.00 O ATOM 919 CB VAL A 63 3.074 -4.972 -9.928 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.451 -4.315 -8.706 1.00 0.00 C ATOM 921 CG2 VAL A 63 2.041 -5.155 -11.030 1.00 0.00 C ATOM 0 H VAL A 63 3.400 -2.446 -11.319 1.00 0.00 H new ATOM 0 HA VAL A 63 5.098 -4.245 -9.744 1.00 0.00 H new ATOM 0 HB VAL A 63 3.438 -5.957 -9.635 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.611 -4.916 -8.358 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.196 -4.240 -7.914 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.099 -3.317 -8.969 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.206 -5.744 -10.652 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.679 -4.180 -11.355 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.497 -5.673 -11.874 1.00 0.00 H new ATOM 931 N PRO A 64 5.567 -5.676 -11.811 1.00 0.00 N ATOM 932 CA PRO A 64 6.066 -6.288 -13.046 1.00 0.00 C ATOM 933 C PRO A 64 4.992 -7.093 -13.769 1.00 0.00 C ATOM 934 O PRO A 64 4.042 -7.576 -13.152 1.00 0.00 O ATOM 935 CB PRO A 64 7.187 -7.209 -12.558 1.00 0.00 C ATOM 936 CG PRO A 64 6.829 -7.525 -11.146 1.00 0.00 C ATOM 937 CD PRO A 64 6.144 -6.299 -10.609 1.00 0.00 C ATOM 0 HA PRO A 64 6.394 -5.540 -13.768 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.248 -8.114 -13.163 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.158 -6.718 -12.620 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.172 -8.393 -11.095 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.718 -7.763 -10.562 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.375 -6.555 -9.881 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.847 -5.633 -10.109 1.00 0.00 H new ATOM 945 N LYS A 65 5.148 -7.235 -15.081 1.00 0.00 N ATOM 946 CA LYS A 65 4.193 -7.984 -15.889 1.00 0.00 C ATOM 947 C LYS A 65 3.747 -9.252 -15.169 1.00 0.00 C ATOM 948 O LYS A 65 2.552 -9.487 -14.988 1.00 0.00 O ATOM 949 CB LYS A 65 4.810 -8.344 -17.243 1.00 0.00 C ATOM 950 CG LYS A 65 5.180 -7.134 -18.083 1.00 0.00 C ATOM 951 CD LYS A 65 5.899 -7.540 -19.359 1.00 0.00 C ATOM 952 CE LYS A 65 7.397 -7.678 -19.135 1.00 0.00 C ATOM 953 NZ LYS A 65 8.156 -7.633 -20.416 1.00 0.00 N ATOM 0 H LYS A 65 5.928 -6.841 -15.608 1.00 0.00 H new ATOM 0 HA LYS A 65 3.319 -7.353 -16.051 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.702 -8.948 -17.077 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.106 -8.962 -17.801 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.279 -6.575 -18.334 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.817 -6.467 -17.502 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.495 -8.486 -19.720 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.713 -6.797 -20.135 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.742 -6.877 -18.480 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.603 -8.618 -18.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.173 -7.730 -20.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.846 -8.412 -21.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.980 -6.725 -20.892 1.00 0.00 H new ATOM 967 N SER A 66 4.715 -10.065 -14.758 1.00 0.00 N ATOM 968 CA SER A 66 4.421 -11.311 -14.059 1.00 0.00 C ATOM 969 C SER A 66 3.208 -11.150 -13.148 1.00 0.00 C ATOM 970 O SER A 66 2.279 -11.958 -13.183 1.00 0.00 O ATOM 971 CB SER A 66 5.632 -11.758 -13.239 1.00 0.00 C ATOM 972 OG SER A 66 6.757 -11.982 -14.072 1.00 0.00 O ATOM 0 H SER A 66 5.709 -9.884 -14.897 1.00 0.00 H new ATOM 0 HA SER A 66 4.195 -12.073 -14.805 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.872 -10.998 -12.495 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.390 -12.671 -12.696 1.00 0.00 H new ATOM 0 HG SER A 66 7.519 -12.265 -13.524 1.00 0.00 H new ATOM 978 N LEU A 67 3.223 -10.100 -12.334 1.00 0.00 N ATOM 979 CA LEU A 67 2.124 -9.831 -11.413 1.00 0.00 C ATOM 980 C LEU A 67 1.239 -8.704 -11.935 1.00 0.00 C ATOM 981 O LEU A 67 1.624 -7.973 -12.847 1.00 0.00 O ATOM 982 CB LEU A 67 2.670 -9.467 -10.030 1.00 0.00 C ATOM 983 CG LEU A 67 3.857 -10.296 -9.538 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.574 -9.579 -8.405 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.396 -11.676 -9.092 1.00 0.00 C ATOM 0 H LEU A 67 3.983 -9.421 -12.293 1.00 0.00 H new ATOM 0 HA LEU A 67 1.520 -10.735 -11.333 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.965 -8.418 -10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.861 -9.562 -9.306 1.00 0.00 H new ATOM 0 HG LEU A 67 4.557 -10.419 -10.364 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.416 -10.183 -8.067 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.938 -8.614 -8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.882 -9.425 -7.577 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.254 -12.252 -8.745 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.675 -11.574 -8.281 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.928 -12.192 -9.930 1.00 0.00 H new ATOM 997 N GLN A 68 0.053 -8.570 -11.350 1.00 0.00 N ATOM 998 CA GLN A 68 -0.885 -7.531 -11.756 1.00 0.00 C ATOM 999 C GLN A 68 -1.176 -6.578 -10.601 1.00 0.00 C ATOM 1000 O GLN A 68 -0.887 -6.883 -9.443 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.188 -8.158 -12.256 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.901 -7.323 -13.307 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.169 -7.981 -13.813 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -4.157 -8.683 -14.825 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.274 -7.758 -13.111 1.00 0.00 N ATOM 0 H GLN A 68 -0.281 -9.168 -10.594 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.429 -6.962 -12.566 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.972 -9.142 -12.671 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.857 -8.309 -11.409 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.145 -6.348 -12.886 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.227 -7.149 -14.146 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.239 -7.170 -12.278 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.157 -8.175 -13.404 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.750 -5.424 -10.923 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.080 -4.426 -9.912 1.00 0.00 C ATOM 1016 C LEU A 69 -3.396 -3.729 -10.243 1.00 0.00 C ATOM 1017 O LEU A 69 -3.683 -3.448 -11.406 1.00 0.00 O ATOM 1018 CB LEU A 69 -0.957 -3.393 -9.801 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.202 -2.236 -8.831 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.100 -2.716 -7.391 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.218 -1.105 -9.090 1.00 0.00 C ATOM 0 H LEU A 69 -1.996 -5.156 -11.876 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.191 -4.937 -8.956 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.045 -3.908 -9.498 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.774 -2.977 -10.792 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.211 -1.857 -8.995 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.277 -1.879 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.845 -3.491 -7.212 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.104 -3.122 -7.212 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.407 -0.291 -8.391 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.800 -1.470 -8.955 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.341 -0.743 -10.111 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.189 -3.454 -9.213 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.474 -2.789 -9.396 1.00 0.00 C ATOM 1035 C GLN A 70 -5.767 -1.841 -8.237 1.00 0.00 C ATOM 1036 O GLN A 70 -5.963 -2.275 -7.101 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.594 -3.823 -9.520 1.00 0.00 C ATOM 1038 CG GLN A 70 -7.973 -3.208 -9.703 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.170 -2.620 -11.087 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -7.697 -1.521 -11.380 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -8.872 -3.349 -11.946 1.00 0.00 N ATOM 0 H GLN A 70 -3.965 -3.681 -8.244 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.425 -2.205 -10.315 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.382 -4.477 -10.366 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.600 -4.449 -8.627 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.733 -3.969 -9.524 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.121 -2.428 -8.956 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.245 -4.254 -11.661 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.038 -3.004 -12.891 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.794 -0.546 -8.531 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.062 0.464 -7.513 1.00 0.00 C ATOM 1052 C LEU A 71 -7.551 0.525 -7.186 1.00 0.00 C ATOM 1053 O LEU A 71 -8.362 0.928 -8.019 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.575 1.835 -7.986 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.267 2.853 -6.887 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.172 3.808 -7.336 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -6.524 3.622 -6.505 1.00 0.00 C ATOM 0 H LEU A 71 -5.634 -0.170 -9.466 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.521 0.186 -6.608 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.675 1.692 -8.584 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.332 2.260 -8.645 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.913 2.314 -6.008 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.966 4.525 -6.541 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.266 3.244 -7.559 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.497 4.340 -8.230 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.286 4.342 -5.722 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.907 4.149 -7.378 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.280 2.926 -6.141 1.00 0.00 H new ATOM 1069 N GLN A 72 -7.901 0.125 -5.968 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.292 0.137 -5.531 1.00 0.00 C ATOM 1071 C GLN A 72 -9.675 1.501 -4.968 1.00 0.00 C ATOM 1072 O GLN A 72 -8.852 2.186 -4.361 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.527 -0.947 -4.478 1.00 0.00 C ATOM 1074 CG GLN A 72 -10.988 -1.117 -4.094 1.00 0.00 C ATOM 1075 CD GLN A 72 -11.709 -2.121 -4.972 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.043 -3.221 -4.531 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.955 -1.747 -6.222 1.00 0.00 N ATOM 0 H GLN A 72 -7.241 -0.211 -5.267 1.00 0.00 H new ATOM 0 HA GLN A 72 -9.920 -0.066 -6.398 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.146 -1.896 -4.855 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.951 -0.705 -3.585 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.051 -1.438 -3.054 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.492 -0.153 -4.162 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.661 -0.826 -6.546 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.439 -2.381 -6.858 1.00 0.00 H new ATOM 1086 N ALA A 73 -10.929 1.890 -5.173 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.421 3.172 -4.684 1.00 0.00 C ATOM 1088 C ALA A 73 -11.380 3.231 -3.161 1.00 0.00 C ATOM 1089 O ALA A 73 -12.082 2.494 -2.468 1.00 0.00 O ATOM 1090 CB ALA A 73 -12.835 3.422 -5.187 1.00 0.00 C ATOM 0 H ALA A 73 -11.623 1.336 -5.675 1.00 0.00 H new ATOM 0 HA ALA A 73 -10.767 3.955 -5.069 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.189 4.383 -4.814 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.837 3.433 -6.277 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.493 2.629 -4.831 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.539 4.127 -2.624 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.387 4.303 -1.177 1.00 0.00 C ATOM 1098 C PRO A 74 -11.621 4.931 -0.537 1.00 0.00 C ATOM 1099 O PRO A 74 -12.593 5.250 -1.221 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.186 5.244 -1.058 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.163 5.994 -2.345 1.00 0.00 C ATOM 1102 CD PRO A 74 -9.672 5.039 -3.389 1.00 0.00 C ATOM 0 HA PRO A 74 -10.253 3.351 -0.663 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.294 5.919 -0.209 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.261 4.688 -0.907 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -9.791 6.883 -2.290 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -8.154 6.331 -2.583 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.226 5.557 -4.172 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -8.857 4.504 -3.876 1.00 0.00 H new ATOM 1110 N SER A 75 -11.574 5.106 0.780 1.00 0.00 N ATOM 1111 CA SER A 75 -12.690 5.693 1.513 1.00 0.00 C ATOM 1112 C SER A 75 -12.680 7.214 1.391 1.00 0.00 C ATOM 1113 O SER A 75 -13.711 7.833 1.132 1.00 0.00 O ATOM 1114 CB SER A 75 -12.628 5.288 2.987 1.00 0.00 C ATOM 1115 OG SER A 75 -13.870 5.515 3.631 1.00 0.00 O ATOM 0 H SER A 75 -10.776 4.850 1.361 1.00 0.00 H new ATOM 0 HA SER A 75 -13.616 5.317 1.079 1.00 0.00 H new ATOM 0 HB2 SER A 75 -12.361 4.234 3.067 1.00 0.00 H new ATOM 0 HB3 SER A 75 -11.845 5.855 3.490 1.00 0.00 H new ATOM 0 HG SER A 75 -13.805 5.247 4.571 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.506 7.809 1.579 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.383 9.252 1.486 1.00 0.00 C ATOM 1123 C GLY A 76 -9.941 9.716 1.548 1.00 0.00 C ATOM 1124 O GLY A 76 -9.146 9.190 2.325 1.00 0.00 O ATOM 0 H GLY A 76 -10.638 7.318 1.794 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.831 9.592 0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.946 9.715 2.297 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.603 10.703 0.725 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.246 11.236 0.687 1.00 0.00 C ATOM 1130 C ASN A 77 -8.050 12.301 1.763 1.00 0.00 C ATOM 1131 O ASN A 77 -7.370 13.304 1.543 1.00 0.00 O ATOM 1132 CB ASN A 77 -7.945 11.827 -0.692 1.00 0.00 C ATOM 1133 CG ASN A 77 -7.441 10.784 -1.670 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -7.615 9.583 -1.459 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -6.811 11.239 -2.747 1.00 0.00 N ATOM 0 H ASN A 77 -10.250 11.150 0.075 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.555 10.416 0.881 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -8.848 12.289 -1.091 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.200 12.617 -0.591 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -6.449 10.585 -3.440 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -6.690 12.243 -2.881 1.00 0.00 H new ATOM 1142 N THR A 78 -8.650 12.075 2.927 1.00 0.00 N ATOM 1143 CA THR A 78 -8.543 13.014 4.037 1.00 0.00 C ATOM 1144 C THR A 78 -8.235 12.290 5.342 1.00 0.00 C ATOM 1145 O THR A 78 -8.949 11.367 5.735 1.00 0.00 O ATOM 1146 CB THR A 78 -9.837 13.831 4.209 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.155 14.508 2.988 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.692 14.844 5.334 1.00 0.00 C ATOM 0 H THR A 78 -9.215 11.250 3.126 1.00 0.00 H new ATOM 0 HA THR A 78 -7.723 13.692 3.799 1.00 0.00 H new ATOM 0 HB THR A 78 -10.644 13.143 4.463 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.980 15.024 3.105 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.618 15.409 5.436 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.480 14.323 6.268 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.874 15.527 5.105 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.168 12.713 6.012 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.767 12.106 7.275 1.00 0.00 C ATOM 1158 C VAL A 79 -6.728 13.140 8.394 1.00 0.00 C ATOM 1159 O VAL A 79 -6.048 14.163 8.305 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.384 11.436 7.161 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -4.988 10.802 8.486 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.383 10.403 6.045 1.00 0.00 C ATOM 0 H VAL A 79 -6.565 13.475 5.701 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.512 11.347 7.512 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.647 12.201 6.917 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.009 10.334 8.387 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.947 11.570 9.259 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.725 10.048 8.763 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.398 9.940 5.979 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.130 9.638 6.256 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.619 10.889 5.099 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.474 12.869 9.476 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.541 13.764 10.635 1.00 0.00 C ATOM 1174 C PRO A 80 -6.235 13.792 11.422 1.00 0.00 C ATOM 1175 O PRO A 80 -5.705 12.749 11.801 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.663 13.162 11.483 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.695 11.722 11.102 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.309 11.669 9.650 1.00 0.00 C ATOM 0 HA PRO A 80 -7.718 14.799 10.341 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.464 13.285 12.548 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.618 13.647 11.278 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.002 11.142 11.711 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.688 11.299 11.258 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.759 10.758 9.413 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.184 11.690 9.000 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.721 14.994 11.664 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.479 15.158 12.408 1.00 0.00 C ATOM 1188 C ALA A 81 -4.690 14.893 13.894 1.00 0.00 C ATOM 1189 O ALA A 81 -3.753 14.979 14.689 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.915 16.555 12.193 1.00 0.00 C ATOM 0 H ALA A 81 -6.146 15.868 11.355 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.762 14.427 12.034 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.987 16.663 12.755 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.717 16.708 11.132 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.636 17.296 12.538 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.926 14.573 14.264 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.260 14.298 15.656 1.00 0.00 C ATOM 1198 C ARG A 82 -6.564 12.817 15.860 1.00 0.00 C ATOM 1199 O ARG A 82 -7.609 12.455 16.399 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.460 15.141 16.091 1.00 0.00 C ATOM 1201 CG ARG A 82 -7.308 16.621 15.784 1.00 0.00 C ATOM 1202 CD ARG A 82 -6.089 17.211 16.475 1.00 0.00 C ATOM 1203 NE ARG A 82 -6.263 18.630 16.775 1.00 0.00 N ATOM 1204 CZ ARG A 82 -5.554 19.279 17.692 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -4.628 18.640 18.394 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -5.770 20.570 17.908 1.00 0.00 N ATOM 0 H ARG A 82 -6.712 14.498 13.619 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.398 14.562 16.269 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.355 14.766 15.595 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.612 15.015 17.163 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.221 16.763 14.707 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -8.203 17.154 16.105 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.897 16.666 17.399 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.213 17.080 15.840 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.967 19.151 16.252 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.459 17.648 18.231 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -4.085 19.141 19.097 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.481 21.065 17.370 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.225 21.067 18.612 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.642 11.963 15.424 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.830 10.531 15.567 1.00 0.00 C ATOM 1222 C GLY A 83 -7.269 10.110 15.339 1.00 0.00 C ATOM 1223 O GLY A 83 -7.933 9.624 16.253 1.00 0.00 O ATOM 0 H GLY A 83 -4.769 12.238 14.974 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.186 10.010 14.859 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.519 10.225 16.566 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.752 10.299 14.115 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.118 9.931 13.792 1.00 0.00 C ATOM 1229 C GLY A 84 -9.211 8.574 13.123 1.00 0.00 C ATOM 1230 O GLY A 84 -9.141 7.540 13.788 1.00 0.00 O ATOM 0 H GLY A 84 -7.222 10.700 13.341 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.714 9.924 14.704 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.549 10.687 13.135 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.370 8.576 11.804 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.474 7.335 11.044 1.00 0.00 C ATOM 1236 C LEU A 85 -8.566 7.369 9.819 1.00 0.00 C ATOM 1237 O LEU A 85 -8.706 8.215 8.935 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.923 7.099 10.613 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.960 7.063 11.735 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.335 8.474 12.160 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.195 6.291 11.296 1.00 0.00 C ATOM 0 H LEU A 85 -9.430 9.423 11.239 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.154 6.515 11.687 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.204 7.884 9.911 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.970 6.154 10.071 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.522 6.551 12.592 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.074 8.429 12.960 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.446 8.995 12.516 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.754 9.011 11.309 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.922 6.276 12.108 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.635 6.774 10.424 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.914 5.269 11.042 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.613 6.427 9.762 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.665 6.326 8.649 1.00 0.00 C ATOM 1255 C PRO A 86 -7.334 5.866 7.358 1.00 0.00 C ATOM 1256 O PRO A 86 -8.498 5.464 7.360 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.660 5.277 9.133 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.417 4.451 10.115 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.389 5.387 10.781 1.00 0.00 C ATOM 0 HA PRO A 86 -6.215 7.289 8.409 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.292 4.670 8.306 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.791 5.745 9.596 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.940 3.635 9.617 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.746 4.001 10.846 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.316 4.880 11.049 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.978 5.806 11.700 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.591 5.928 6.258 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.112 5.516 4.961 1.00 0.00 C ATOM 1269 C ILE A 87 -6.605 4.130 4.578 1.00 0.00 C ATOM 1270 O ILE A 87 -5.509 3.727 4.972 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.724 6.516 3.855 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.232 7.917 4.202 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.279 6.063 2.513 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.622 9.009 3.352 1.00 0.00 C ATOM 0 H ILE A 87 -5.627 6.260 6.239 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.198 5.490 5.052 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.637 6.552 3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.316 7.941 4.087 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.019 8.122 5.251 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -6.997 6.780 1.742 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -6.873 5.083 2.264 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.366 6.002 2.571 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.028 9.975 3.654 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.540 9.013 3.486 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.857 8.828 2.303 1.00 0.00 H new ATOM 1286 N THR A 88 -7.407 3.404 3.807 1.00 0.00 N ATOM 1287 CA THR A 88 -7.040 2.063 3.370 1.00 0.00 C ATOM 1288 C THR A 88 -7.324 1.871 1.885 1.00 0.00 C ATOM 1289 O THR A 88 -8.380 2.265 1.391 1.00 0.00 O ATOM 1290 CB THR A 88 -7.796 0.985 4.170 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.208 1.190 4.055 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.391 1.014 5.636 1.00 0.00 C ATOM 0 H THR A 88 -8.316 3.722 3.472 1.00 0.00 H new ATOM 0 HA THR A 88 -5.970 1.954 3.549 1.00 0.00 H new ATOM 0 HB THR A 88 -7.536 0.010 3.758 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.681 0.500 4.565 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.938 0.244 6.180 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.320 0.827 5.721 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.624 1.991 6.059 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.376 1.262 1.180 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.526 1.019 -0.250 1.00 0.00 C ATOM 1302 C GLN A 89 -6.340 -0.460 -0.573 1.00 0.00 C ATOM 1303 O GLN A 89 -5.353 -1.075 -0.168 1.00 0.00 O ATOM 1304 CB GLN A 89 -5.519 1.856 -1.040 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.001 2.233 -2.432 1.00 0.00 C ATOM 1306 CD GLN A 89 -5.405 3.539 -2.921 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -4.200 3.637 -3.154 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -6.249 4.552 -3.080 1.00 0.00 N ATOM 0 H GLN A 89 -5.497 0.928 1.575 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.536 1.311 -0.538 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.298 2.766 -0.482 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -4.585 1.300 -1.126 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.743 1.436 -3.130 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.088 2.313 -2.427 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.240 4.427 -2.875 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -5.906 5.455 -3.407 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.294 -1.026 -1.303 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.236 -2.434 -1.681 1.00 0.00 C ATOM 1319 C LEU A 90 -6.520 -2.611 -3.016 1.00 0.00 C ATOM 1320 O LEU A 90 -6.643 -1.776 -3.913 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.647 -3.019 -1.764 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.818 -4.232 -2.679 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -8.143 -5.455 -2.075 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.293 -4.506 -2.932 1.00 0.00 C ATOM 0 H LEU A 90 -8.118 -0.532 -1.645 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.673 -2.967 -0.915 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.962 -3.300 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.324 -2.235 -2.103 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.341 -4.013 -3.634 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.275 -6.309 -2.740 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.079 -5.257 -1.946 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.591 -5.677 -1.106 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.395 -5.373 -3.585 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.794 -4.705 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.748 -3.637 -3.408 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.774 -3.703 -3.141 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.040 -3.991 -4.368 1.00 0.00 C ATOM 1338 C PHE A 91 -5.144 -5.469 -4.730 1.00 0.00 C ATOM 1339 O PHE A 91 -4.871 -6.342 -3.906 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.570 -3.595 -4.211 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.374 -2.158 -3.822 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.375 -1.781 -2.488 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.189 -1.183 -4.789 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.196 -0.459 -2.128 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.009 0.141 -4.434 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.012 0.503 -3.102 1.00 0.00 C ATOM 0 H PHE A 91 -5.661 -4.403 -2.408 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.484 -3.406 -5.174 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.109 -4.233 -3.457 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.049 -3.783 -5.150 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.517 -2.529 -1.722 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.185 -1.461 -5.833 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.200 -0.178 -1.085 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -2.866 0.891 -5.198 1.00 0.00 H new ATOM 0 HZ PHE A 91 -2.871 1.536 -2.822 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.541 -5.742 -5.969 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.683 -7.114 -6.441 1.00 0.00 C ATOM 1358 C ARG A 92 -4.495 -7.516 -7.310 1.00 0.00 C ATOM 1359 O ARG A 92 -4.399 -7.116 -8.471 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.983 -7.271 -7.232 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.215 -7.428 -6.355 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.454 -7.731 -7.183 1.00 0.00 C ATOM 1363 NE ARG A 92 -9.778 -6.642 -8.101 1.00 0.00 N ATOM 1364 CZ ARG A 92 -10.974 -6.483 -8.658 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.952 -7.337 -8.392 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -11.192 -5.466 -9.483 1.00 0.00 N ATOM 0 H ARG A 92 -5.770 -5.031 -6.664 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.713 -7.770 -5.571 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.114 -6.401 -7.875 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.899 -8.140 -7.884 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -8.051 -8.231 -5.636 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.374 -6.515 -5.782 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.296 -8.648 -7.750 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.300 -7.909 -6.519 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.047 -5.967 -8.327 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.788 -8.119 -7.758 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.869 -7.212 -8.821 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -10.442 -4.807 -9.689 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.110 -5.344 -9.911 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.593 -8.308 -6.740 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.412 -8.764 -7.462 1.00 0.00 C ATOM 1382 C ILE A 93 -2.510 -10.249 -7.793 1.00 0.00 C ATOM 1383 O ILE A 93 -3.011 -11.043 -6.996 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.126 -8.514 -6.653 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.895 -7.012 -6.472 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.067 -9.159 -7.342 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.157 -6.663 -5.199 1.00 0.00 C ATOM 0 H ILE A 93 -3.658 -8.647 -5.780 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.367 -8.190 -8.387 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.241 -8.966 -5.668 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.331 -6.634 -7.325 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.858 -6.502 -6.476 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.968 -8.973 -6.758 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.097 -10.233 -7.424 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.186 -8.733 -8.338 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.029 -5.582 -5.137 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.730 -7.010 -4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.821 -7.145 -5.202 1.00 0.00 H new ATOM 1399 N LEU A 94 -2.027 -10.619 -8.974 1.00 0.00 N ATOM 1400 CA LEU A 94 -2.058 -12.011 -9.412 1.00 0.00 C ATOM 1401 C LEU A 94 -0.660 -12.620 -9.389 1.00 0.00 C ATOM 1402 O LEU A 94 0.268 -12.091 -9.998 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.647 -12.110 -10.820 1.00 0.00 C ATOM 1404 CG LEU A 94 -4.167 -12.259 -10.903 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.619 -13.523 -10.187 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.856 -11.036 -10.316 1.00 0.00 C ATOM 0 H LEU A 94 -1.609 -9.975 -9.646 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.689 -12.570 -8.721 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.359 -11.218 -11.376 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.190 -12.962 -11.324 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.448 -12.340 -11.953 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.703 -13.613 -10.256 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.153 -14.391 -10.652 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.325 -13.472 -9.139 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.937 -11.160 -10.384 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.568 -10.923 -9.271 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.557 -10.148 -10.873 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.519 -13.737 -8.683 1.00 0.00 N ATOM 1419 CA ASN A 95 0.766 -14.420 -8.582 1.00 0.00 C ATOM 1420 C ASN A 95 0.634 -15.888 -8.973 1.00 0.00 C ATOM 1421 O ASN A 95 1.153 -16.784 -8.306 1.00 0.00 O ATOM 1422 CB ASN A 95 1.317 -14.307 -7.159 1.00 0.00 C ATOM 1423 CG ASN A 95 2.614 -15.071 -6.978 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.712 -14.490 -7.447 1.00 0.00 O flip ATOM 1425 ND2 ASN A 95 2.629 -16.170 -6.424 1.00 0.00 N flip ATOM 0 H ASN A 95 -1.278 -14.188 -8.173 1.00 0.00 H new ATOM 0 HA ASN A 95 1.460 -13.940 -9.272 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.481 -13.257 -6.918 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.576 -14.684 -6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.761 -16.579 -6.079 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.510 -16.672 -6.310 1.00 0.00 H new ATOM 1432 N PRO A 96 -0.077 -16.144 -10.081 1.00 0.00 N ATOM 1433 CA PRO A 96 -0.293 -17.503 -10.587 1.00 0.00 C ATOM 1434 C PRO A 96 0.983 -18.123 -11.145 1.00 0.00 C ATOM 1435 O PRO A 96 1.042 -19.327 -11.393 1.00 0.00 O ATOM 1436 CB PRO A 96 -1.324 -17.306 -11.702 1.00 0.00 C ATOM 1437 CG PRO A 96 -1.134 -15.898 -12.149 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.725 -15.126 -10.925 1.00 0.00 C ATOM 0 HA PRO A 96 -0.619 -18.184 -9.801 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -1.160 -18.007 -12.521 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.338 -17.472 -11.338 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.370 -15.834 -12.924 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -2.054 -15.496 -12.574 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -0.041 -14.314 -11.172 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.585 -14.678 -10.426 1.00 0.00 H new ATOM 1446 N ASN A 97 2.003 -17.294 -11.340 1.00 0.00 N ATOM 1447 CA ASN A 97 3.279 -17.762 -11.869 1.00 0.00 C ATOM 1448 C ASN A 97 4.233 -18.134 -10.738 1.00 0.00 C ATOM 1449 O ASN A 97 5.330 -18.640 -10.977 1.00 0.00 O ATOM 1450 CB ASN A 97 3.913 -16.687 -12.753 1.00 0.00 C ATOM 1451 CG ASN A 97 3.105 -16.419 -14.008 1.00 0.00 C ATOM 1452 OD1 ASN A 97 2.818 -15.269 -14.342 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.733 -17.483 -14.710 1.00 0.00 N ATOM 0 H ASN A 97 1.971 -16.294 -11.140 1.00 0.00 H new ATOM 0 HA ASN A 97 3.091 -18.652 -12.469 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.011 -15.763 -12.183 1.00 0.00 H new ATOM 0 HB3 ASN A 97 4.920 -16.997 -13.032 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.187 -17.365 -15.564 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.993 -18.418 -14.396 1.00 0.00 H new ATOM 1460 N LYS A 98 3.807 -17.882 -9.505 1.00 0.00 N ATOM 1461 CA LYS A 98 4.621 -18.192 -8.335 1.00 0.00 C ATOM 1462 C LYS A 98 6.002 -17.554 -8.449 1.00 0.00 C ATOM 1463 O LYS A 98 7.016 -18.195 -8.177 1.00 0.00 O ATOM 1464 CB LYS A 98 4.759 -19.707 -8.171 1.00 0.00 C ATOM 1465 CG LYS A 98 3.507 -20.377 -7.632 1.00 0.00 C ATOM 1466 CD LYS A 98 3.789 -21.797 -7.172 1.00 0.00 C ATOM 1467 CE LYS A 98 3.763 -22.776 -8.336 1.00 0.00 C ATOM 1468 NZ LYS A 98 2.372 -23.105 -8.753 1.00 0.00 N ATOM 0 H LYS A 98 2.902 -17.464 -9.290 1.00 0.00 H new ATOM 0 HA LYS A 98 4.122 -17.782 -7.457 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.010 -20.147 -9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.591 -19.917 -7.499 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.112 -19.795 -6.799 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.739 -20.390 -8.405 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.763 -21.836 -6.684 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.049 -22.094 -6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.304 -22.350 -9.181 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.283 -23.691 -8.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.395 -23.838 -9.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.837 -23.456 -7.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.911 -22.251 -9.127 1.00 0.00 H new ATOM 1482 N ALA A 99 6.033 -16.288 -8.853 1.00 0.00 N ATOM 1483 CA ALA A 99 7.289 -15.563 -8.999 1.00 0.00 C ATOM 1484 C ALA A 99 7.352 -14.376 -8.044 1.00 0.00 C ATOM 1485 O ALA A 99 6.704 -13.349 -8.249 1.00 0.00 O ATOM 1486 CB ALA A 99 7.465 -15.098 -10.437 1.00 0.00 C ATOM 0 H ALA A 99 5.202 -15.743 -9.085 1.00 0.00 H new ATOM 0 HA ALA A 99 8.104 -16.241 -8.746 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.407 -14.558 -10.532 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.474 -15.963 -11.101 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.640 -14.440 -10.710 1.00 0.00 H new ATOM 1492 N PRO A 100 8.150 -14.516 -6.976 1.00 0.00 N ATOM 1493 CA PRO A 100 8.316 -13.465 -5.968 1.00 0.00 C ATOM 1494 C PRO A 100 9.084 -12.263 -6.506 1.00 0.00 C ATOM 1495 O PRO A 100 10.302 -12.319 -6.680 1.00 0.00 O ATOM 1496 CB PRO A 100 9.114 -14.157 -4.861 1.00 0.00 C ATOM 1497 CG PRO A 100 9.848 -15.254 -5.552 1.00 0.00 C ATOM 1498 CD PRO A 100 8.952 -15.713 -6.669 1.00 0.00 C ATOM 0 HA PRO A 100 7.358 -13.065 -5.635 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.802 -13.464 -4.377 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.457 -14.548 -4.085 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.804 -14.901 -5.939 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.065 -16.072 -4.865 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.526 -16.045 -7.534 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.324 -16.550 -6.363 1.00 0.00 H new ATOM 1506 N LEU A 101 8.366 -11.176 -6.768 1.00 0.00 N ATOM 1507 CA LEU A 101 8.981 -9.959 -7.286 1.00 0.00 C ATOM 1508 C LEU A 101 8.936 -8.842 -6.248 1.00 0.00 C ATOM 1509 O LEU A 101 8.510 -9.053 -5.112 1.00 0.00 O ATOM 1510 CB LEU A 101 8.272 -9.510 -8.565 1.00 0.00 C ATOM 1511 CG LEU A 101 8.759 -10.154 -9.863 1.00 0.00 C ATOM 1512 CD1 LEU A 101 10.233 -9.854 -10.088 1.00 0.00 C ATOM 1513 CD2 LEU A 101 8.517 -11.656 -9.837 1.00 0.00 C ATOM 0 H LEU A 101 7.357 -11.113 -6.630 1.00 0.00 H new ATOM 0 HA LEU A 101 10.024 -10.177 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.207 -9.716 -8.458 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.380 -8.429 -8.656 1.00 0.00 H new ATOM 0 HG LEU A 101 8.192 -9.729 -10.691 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.562 -10.321 -11.017 1.00 0.00 H new ATOM 0 HD12 LEU A 101 10.379 -8.776 -10.152 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.816 -10.250 -9.257 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.870 -12.098 -10.769 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.057 -12.097 -8.999 1.00 0.00 H new ATOM 0 HD23 LEU A 101 7.451 -11.851 -9.724 1.00 0.00 H new ATOM 1525 N ARG A 102 9.377 -7.653 -6.646 1.00 0.00 N ATOM 1526 CA ARG A 102 9.387 -6.503 -5.751 1.00 0.00 C ATOM 1527 C ARG A 102 8.201 -5.585 -6.032 1.00 0.00 C ATOM 1528 O ARG A 102 7.419 -5.827 -6.953 1.00 0.00 O ATOM 1529 CB ARG A 102 10.695 -5.724 -5.901 1.00 0.00 C ATOM 1530 CG ARG A 102 10.963 -5.251 -7.320 1.00 0.00 C ATOM 1531 CD ARG A 102 11.798 -6.259 -8.095 1.00 0.00 C ATOM 1532 NE ARG A 102 13.230 -6.023 -7.933 1.00 0.00 N ATOM 1533 CZ ARG A 102 14.166 -6.880 -8.327 1.00 0.00 C ATOM 1534 NH1 ARG A 102 13.821 -8.023 -8.903 1.00 0.00 N ATOM 1535 NH2 ARG A 102 15.449 -6.594 -8.145 1.00 0.00 N ATOM 0 H ARG A 102 9.732 -7.461 -7.583 1.00 0.00 H new ATOM 0 HA ARG A 102 9.306 -6.870 -4.728 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.671 -4.860 -5.237 1.00 0.00 H new ATOM 0 HB3 ARG A 102 11.523 -6.354 -5.575 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.016 -5.088 -7.835 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.480 -4.292 -7.293 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.556 -7.267 -7.757 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.539 -6.207 -9.153 1.00 0.00 H new ATOM 0 HE ARG A 102 13.528 -5.152 -7.493 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.836 -8.246 -9.044 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.541 -8.680 -9.205 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.718 -5.715 -7.702 1.00 0.00 H new ATOM 0 HH22 ARG A 102 16.166 -7.253 -8.448 1.00 0.00 H new ATOM 1549 N LEU A 103 8.073 -4.531 -5.234 1.00 0.00 N ATOM 1550 CA LEU A 103 6.982 -3.576 -5.396 1.00 0.00 C ATOM 1551 C LEU A 103 7.465 -2.150 -5.153 1.00 0.00 C ATOM 1552 O LEU A 103 8.275 -1.901 -4.260 1.00 0.00 O ATOM 1553 CB LEU A 103 5.839 -3.910 -4.436 1.00 0.00 C ATOM 1554 CG LEU A 103 4.808 -2.803 -4.209 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.762 -2.813 -5.313 1.00 0.00 C ATOM 1556 CD2 LEU A 103 4.150 -2.960 -2.846 1.00 0.00 C ATOM 0 H LEU A 103 8.711 -4.316 -4.468 1.00 0.00 H new ATOM 0 HA LEU A 103 6.620 -3.647 -6.422 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.320 -4.791 -4.814 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.269 -4.182 -3.472 1.00 0.00 H new ATOM 0 HG LEU A 103 5.322 -1.842 -4.234 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.037 -2.019 -5.135 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.247 -2.652 -6.276 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.251 -3.776 -5.321 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.419 -2.164 -2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.649 -3.927 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.910 -2.902 -2.066 1.00 0.00 H new ATOM 1568 N LYS A 104 6.962 -1.216 -5.952 1.00 0.00 N ATOM 1569 CA LYS A 104 7.338 0.187 -5.823 1.00 0.00 C ATOM 1570 C LYS A 104 6.161 1.023 -5.331 1.00 0.00 C ATOM 1571 O LYS A 104 5.152 1.161 -6.024 1.00 0.00 O ATOM 1572 CB LYS A 104 7.838 0.728 -7.164 1.00 0.00 C ATOM 1573 CG LYS A 104 8.680 1.986 -7.037 1.00 0.00 C ATOM 1574 CD LYS A 104 9.437 2.282 -8.321 1.00 0.00 C ATOM 1575 CE LYS A 104 8.607 3.128 -9.274 1.00 0.00 C ATOM 1576 NZ LYS A 104 7.656 2.301 -10.067 1.00 0.00 N ATOM 0 H LYS A 104 6.292 -1.405 -6.697 1.00 0.00 H new ATOM 0 HA LYS A 104 8.141 0.256 -5.089 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.426 -0.044 -7.661 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.981 0.938 -7.804 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.038 2.831 -6.789 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.387 1.871 -6.215 1.00 0.00 H new ATOM 0 HD2 LYS A 104 10.366 2.802 -8.086 1.00 0.00 H new ATOM 0 HD3 LYS A 104 9.710 1.346 -8.808 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.052 3.875 -8.707 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.269 3.668 -9.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.661 2.619 -11.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.944 1.303 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.698 2.403 -9.676 1.00 0.00 H new ATOM 1590 N LEU A 105 6.297 1.581 -4.133 1.00 0.00 N ATOM 1591 CA LEU A 105 5.245 2.406 -3.549 1.00 0.00 C ATOM 1592 C LEU A 105 5.589 3.887 -3.662 1.00 0.00 C ATOM 1593 O LEU A 105 6.729 4.290 -3.426 1.00 0.00 O ATOM 1594 CB LEU A 105 5.031 2.030 -2.082 1.00 0.00 C ATOM 1595 CG LEU A 105 4.160 0.801 -1.824 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.210 0.409 -0.355 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.725 1.062 -2.259 1.00 0.00 C ATOM 0 H LEU A 105 7.125 1.477 -3.547 1.00 0.00 H new ATOM 0 HA LEU A 105 4.324 2.223 -4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.006 1.862 -1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.582 2.882 -1.571 1.00 0.00 H new ATOM 0 HG LEU A 105 4.552 -0.027 -2.414 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.584 -0.468 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.238 0.178 -0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.844 1.235 0.255 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.120 0.176 -2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.322 1.905 -1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.704 1.293 -3.324 1.00 0.00 H new ATOM 1609 N ARG A 106 4.597 4.695 -4.021 1.00 0.00 N ATOM 1610 CA ARG A 106 4.794 6.132 -4.164 1.00 0.00 C ATOM 1611 C ARG A 106 3.744 6.906 -3.373 1.00 0.00 C ATOM 1612 O ARG A 106 2.542 6.728 -3.575 1.00 0.00 O ATOM 1613 CB ARG A 106 4.734 6.533 -5.639 1.00 0.00 C ATOM 1614 CG ARG A 106 4.744 8.036 -5.863 1.00 0.00 C ATOM 1615 CD ARG A 106 5.397 8.398 -7.188 1.00 0.00 C ATOM 1616 NE ARG A 106 4.431 8.433 -8.283 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.772 8.550 -9.561 1.00 0.00 C ATOM 1618 NH1 ARG A 106 6.049 8.642 -9.904 1.00 0.00 N ATOM 1619 NH2 ARG A 106 3.834 8.574 -10.500 1.00 0.00 N ATOM 0 H ARG A 106 3.648 4.378 -4.218 1.00 0.00 H new ATOM 0 HA ARG A 106 5.779 6.379 -3.767 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.582 6.091 -6.162 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.832 6.114 -6.084 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.722 8.414 -5.845 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.279 8.523 -5.048 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.880 9.371 -7.100 1.00 0.00 H new ATOM 0 HD3 ARG A 106 6.178 7.673 -7.417 1.00 0.00 H new ATOM 0 HE ARG A 106 3.440 8.364 -8.053 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.773 8.623 -9.185 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.308 8.732 -10.886 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.850 8.503 -10.240 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.097 8.664 -11.481 1.00 0.00 H new ATOM 1633 N LEU A 107 4.206 7.766 -2.471 1.00 0.00 N ATOM 1634 CA LEU A 107 3.307 8.568 -1.648 1.00 0.00 C ATOM 1635 C LEU A 107 3.522 10.057 -1.899 1.00 0.00 C ATOM 1636 O LEU A 107 4.633 10.568 -1.757 1.00 0.00 O ATOM 1637 CB LEU A 107 3.522 8.252 -0.167 1.00 0.00 C ATOM 1638 CG LEU A 107 3.697 6.775 0.186 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.947 6.608 1.677 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.477 5.975 -0.245 1.00 0.00 C ATOM 0 H LEU A 107 5.197 7.926 -2.291 1.00 0.00 H new ATOM 0 HA LEU A 107 2.282 8.317 -1.922 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.404 8.794 0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.672 8.641 0.394 1.00 0.00 H new ATOM 0 HG LEU A 107 4.565 6.394 -0.352 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.069 5.550 1.909 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.852 7.148 1.957 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.100 7.006 2.235 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.620 4.926 0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.592 6.358 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.344 6.067 -1.323 1.00 0.00 H new ATOM 1652 N THR A 108 2.450 10.750 -2.271 1.00 0.00 N ATOM 1653 CA THR A 108 2.521 12.181 -2.540 1.00 0.00 C ATOM 1654 C THR A 108 1.299 12.905 -1.987 1.00 0.00 C ATOM 1655 O THR A 108 0.195 12.773 -2.515 1.00 0.00 O ATOM 1656 CB THR A 108 2.631 12.463 -4.050 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.418 12.083 -4.710 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.803 11.707 -4.658 1.00 0.00 C ATOM 0 H THR A 108 1.523 10.343 -2.393 1.00 0.00 H new ATOM 0 HA THR A 108 3.416 12.553 -2.042 1.00 0.00 H new ATOM 0 HB THR A 108 2.798 13.532 -4.186 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.650 12.385 -4.182 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.860 11.922 -5.725 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.728 12.020 -4.174 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.661 10.636 -4.511 1.00 0.00 H new ATOM 1666 N TYR A 109 1.504 13.671 -0.921 1.00 0.00 N ATOM 1667 CA TYR A 109 0.418 14.416 -0.295 1.00 0.00 C ATOM 1668 C TYR A 109 0.896 15.787 0.173 1.00 0.00 C ATOM 1669 O TYR A 109 2.038 16.176 -0.074 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.152 13.631 0.888 1.00 0.00 C ATOM 1671 CG TYR A 109 0.881 13.277 1.933 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.741 12.200 1.752 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.998 14.018 3.102 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.686 11.872 2.705 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.941 13.699 4.060 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.782 12.625 3.857 1.00 0.00 C ATOM 1677 OH TYR A 109 3.722 12.302 4.809 1.00 0.00 O ATOM 0 H TYR A 109 2.412 13.792 -0.472 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.366 14.559 -1.039 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -0.943 14.218 1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.611 12.714 0.518 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.669 11.609 0.851 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.340 14.859 3.265 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.346 11.031 2.549 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.019 14.287 4.962 1.00 0.00 H new ATOM 0 HH TYR A 109 3.659 12.931 5.558 1.00 0.00 H new ATOM 1687 N ASP A 110 0.015 16.514 0.851 1.00 0.00 N ATOM 1688 CA ASP A 110 0.346 17.841 1.356 1.00 0.00 C ATOM 1689 C ASP A 110 0.194 17.898 2.873 1.00 0.00 C ATOM 1690 O ASP A 110 -0.861 17.568 3.415 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.546 18.897 0.702 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.188 19.138 -0.751 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.366 18.217 -1.387 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -0.461 20.248 -1.253 1.00 0.00 O ATOM 0 H ASP A 110 -0.934 16.207 1.064 1.00 0.00 H new ATOM 0 HA ASP A 110 1.386 18.049 1.104 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.587 18.581 0.769 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.461 19.833 1.254 1.00 0.00 H new ATOM 1699 N HIS A 111 1.256 18.319 3.554 1.00 0.00 N ATOM 1700 CA HIS A 111 1.241 18.419 5.009 1.00 0.00 C ATOM 1701 C HIS A 111 1.722 19.793 5.464 1.00 0.00 C ATOM 1702 O HIS A 111 2.789 20.254 5.059 1.00 0.00 O ATOM 1703 CB HIS A 111 2.118 17.329 5.625 1.00 0.00 C ATOM 1704 CG HIS A 111 1.671 16.899 6.989 1.00 0.00 C ATOM 1705 ND1 HIS A 111 1.992 15.675 7.535 1.00 0.00 N ATOM 1706 CD2 HIS A 111 0.925 17.541 7.919 1.00 0.00 C ATOM 1707 CE1 HIS A 111 1.461 15.580 8.741 1.00 0.00 C ATOM 1708 NE2 HIS A 111 0.809 16.700 8.998 1.00 0.00 N ATOM 0 H HIS A 111 2.137 18.596 3.121 1.00 0.00 H new ATOM 0 HA HIS A 111 0.214 18.283 5.347 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.124 16.462 4.964 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.144 17.691 5.685 1.00 0.00 H new ATOM 0 HD1 HIS A 111 2.552 14.955 7.079 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.501 18.530 7.829 1.00 0.00 H new ATOM 0 HE1 HIS A 111 1.545 14.731 9.404 1.00 0.00 H new ATOM 1716 N PHE A 112 0.927 20.443 6.307 1.00 0.00 N ATOM 1717 CA PHE A 112 1.270 21.766 6.816 1.00 0.00 C ATOM 1718 C PHE A 112 1.367 22.778 5.678 1.00 0.00 C ATOM 1719 O PHE A 112 2.235 23.653 5.682 1.00 0.00 O ATOM 1720 CB PHE A 112 2.595 21.713 7.581 1.00 0.00 C ATOM 1721 CG PHE A 112 2.457 21.188 8.982 1.00 0.00 C ATOM 1722 CD1 PHE A 112 1.818 21.937 9.957 1.00 0.00 C ATOM 1723 CD2 PHE A 112 2.967 19.946 9.323 1.00 0.00 C ATOM 1724 CE1 PHE A 112 1.692 21.456 11.246 1.00 0.00 C ATOM 1725 CE2 PHE A 112 2.842 19.459 10.611 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.203 20.215 11.573 1.00 0.00 C ATOM 0 H PHE A 112 0.041 20.075 6.652 1.00 0.00 H new ATOM 0 HA PHE A 112 0.479 22.084 7.495 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.297 21.084 7.033 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.025 22.714 7.617 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.414 22.907 9.707 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.468 19.351 8.574 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.194 22.050 11.998 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.244 18.489 10.864 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.103 19.837 12.580 1.00 0.00 H new ATOM 1736 N HIS A 113 0.471 22.653 4.705 1.00 0.00 N ATOM 1737 CA HIS A 113 0.455 23.556 3.559 1.00 0.00 C ATOM 1738 C HIS A 113 1.767 23.474 2.785 1.00 0.00 C ATOM 1739 O HIS A 113 2.309 24.493 2.357 1.00 0.00 O ATOM 1740 CB HIS A 113 0.209 24.993 4.020 1.00 0.00 C ATOM 1741 CG HIS A 113 -1.226 25.285 4.332 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -2.149 25.634 3.369 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -1.896 25.277 5.508 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -3.325 25.830 3.939 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -3.198 25.619 5.237 1.00 0.00 N ATOM 0 H HIS A 113 -0.254 21.935 4.687 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.356 23.251 2.897 1.00 0.00 H new ATOM 0 HB2 HIS A 113 0.812 25.190 4.906 1.00 0.00 H new ATOM 0 HB3 HIS A 113 0.550 25.678 3.244 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -1.483 25.045 6.479 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -4.235 26.114 3.431 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -3.946 25.697 5.926 1.00 0.00 H new ATOM 1753 N GLN A 114 2.270 22.257 2.609 1.00 0.00 N ATOM 1754 CA GLN A 114 3.519 22.044 1.887 1.00 0.00 C ATOM 1755 C GLN A 114 3.488 20.724 1.123 1.00 0.00 C ATOM 1756 O GLN A 114 2.831 19.770 1.539 1.00 0.00 O ATOM 1757 CB GLN A 114 4.702 22.058 2.856 1.00 0.00 C ATOM 1758 CG GLN A 114 4.877 23.381 3.583 1.00 0.00 C ATOM 1759 CD GLN A 114 5.682 23.244 4.860 1.00 0.00 C ATOM 1760 OE1 GLN A 114 6.389 22.255 5.059 1.00 0.00 O ATOM 1761 NE2 GLN A 114 5.579 24.237 5.735 1.00 0.00 N ATOM 0 H GLN A 114 1.832 21.404 2.956 1.00 0.00 H new ATOM 0 HA GLN A 114 3.637 22.856 1.169 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.568 21.264 3.591 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.615 21.832 2.305 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.371 24.092 2.921 1.00 0.00 H new ATOM 0 HG3 GLN A 114 3.896 23.794 3.819 1.00 0.00 H new ATOM 0 HE21 GLN A 114 4.982 25.038 5.530 1.00 0.00 H new ATOM 0 HE22 GLN A 114 6.097 24.199 6.613 1.00 0.00 H new ATOM 1770 N SER A 115 4.201 20.678 0.003 1.00 0.00 N ATOM 1771 CA SER A 115 4.252 19.477 -0.822 1.00 0.00 C ATOM 1772 C SER A 115 5.120 18.405 -0.169 1.00 0.00 C ATOM 1773 O SER A 115 6.333 18.567 -0.039 1.00 0.00 O ATOM 1774 CB SER A 115 4.795 19.810 -2.213 1.00 0.00 C ATOM 1775 OG SER A 115 3.980 20.770 -2.862 1.00 0.00 O ATOM 0 H SER A 115 4.752 21.459 -0.354 1.00 0.00 H new ATOM 0 HA SER A 115 3.238 19.090 -0.919 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.813 20.190 -2.128 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.843 18.903 -2.815 1.00 0.00 H new ATOM 0 HG SER A 115 4.349 20.967 -3.748 1.00 0.00 H new ATOM 1781 N VAL A 116 4.488 17.310 0.241 1.00 0.00 N ATOM 1782 CA VAL A 116 5.200 16.210 0.881 1.00 0.00 C ATOM 1783 C VAL A 116 5.055 14.922 0.079 1.00 0.00 C ATOM 1784 O VAL A 116 4.000 14.289 0.090 1.00 0.00 O ATOM 1785 CB VAL A 116 4.692 15.970 2.315 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.457 14.830 2.969 1.00 0.00 C ATOM 1787 CG2 VAL A 116 4.807 17.243 3.140 1.00 0.00 C ATOM 0 H VAL A 116 3.484 17.161 0.141 1.00 0.00 H new ATOM 0 HA VAL A 116 6.252 16.494 0.920 1.00 0.00 H new ATOM 0 HB VAL A 116 3.640 15.689 2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.084 14.675 3.981 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.318 13.918 2.388 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.518 15.078 3.007 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.444 17.056 4.150 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.850 17.557 3.182 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.210 18.030 2.680 1.00 0.00 H new ATOM 1797 N GLN A 117 6.122 14.539 -0.614 1.00 0.00 N ATOM 1798 CA GLN A 117 6.113 13.325 -1.422 1.00 0.00 C ATOM 1799 C GLN A 117 7.364 12.491 -1.166 1.00 0.00 C ATOM 1800 O GLN A 117 8.485 12.991 -1.265 1.00 0.00 O ATOM 1801 CB GLN A 117 6.015 13.676 -2.908 1.00 0.00 C ATOM 1802 CG GLN A 117 7.366 13.853 -3.581 1.00 0.00 C ATOM 1803 CD GLN A 117 7.257 14.497 -4.949 1.00 0.00 C ATOM 1804 OE1 GLN A 117 7.393 15.713 -5.088 1.00 0.00 O ATOM 1805 NE2 GLN A 117 7.009 13.683 -5.969 1.00 0.00 N ATOM 0 H GLN A 117 7.004 15.051 -0.632 1.00 0.00 H new ATOM 0 HA GLN A 117 5.241 12.736 -1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 117 5.462 12.890 -3.423 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.440 14.595 -3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.007 14.465 -2.946 1.00 0.00 H new ATOM 0 HG3 GLN A 117 7.849 12.881 -3.679 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.904 12.681 -5.808 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.924 14.060 -6.913 1.00 0.00 H new ATOM 1814 N GLU A 118 7.164 11.219 -0.836 1.00 0.00 N ATOM 1815 CA GLU A 118 8.278 10.317 -0.564 1.00 0.00 C ATOM 1816 C GLU A 118 8.100 8.995 -1.305 1.00 0.00 C ATOM 1817 O GLU A 118 7.026 8.393 -1.272 1.00 0.00 O ATOM 1818 CB GLU A 118 8.400 10.060 0.939 1.00 0.00 C ATOM 1819 CG GLU A 118 9.035 11.210 1.704 1.00 0.00 C ATOM 1820 CD GLU A 118 10.550 11.157 1.684 1.00 0.00 C ATOM 1821 OE1 GLU A 118 11.142 11.524 0.647 1.00 0.00 O ATOM 1822 OE2 GLU A 118 11.144 10.749 2.703 1.00 0.00 O ATOM 0 H GLU A 118 6.243 10.790 -0.751 1.00 0.00 H new ATOM 0 HA GLU A 118 9.192 10.792 -0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.408 9.867 1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.992 9.158 1.098 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.702 12.155 1.274 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.688 11.190 2.737 1.00 0.00 H new ATOM 1829 N ILE A 119 9.159 8.550 -1.971 1.00 0.00 N ATOM 1830 CA ILE A 119 9.120 7.299 -2.719 1.00 0.00 C ATOM 1831 C ILE A 119 10.057 6.263 -2.107 1.00 0.00 C ATOM 1832 O ILE A 119 11.226 6.546 -1.844 1.00 0.00 O ATOM 1833 CB ILE A 119 9.505 7.514 -4.195 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.493 8.435 -4.879 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.589 6.179 -4.920 1.00 0.00 C ATOM 1836 CD1 ILE A 119 9.085 9.251 -6.007 1.00 0.00 C ATOM 0 H ILE A 119 10.055 9.036 -2.008 1.00 0.00 H new ATOM 0 HA ILE A 119 8.095 6.933 -2.669 1.00 0.00 H new ATOM 0 HB ILE A 119 10.485 7.989 -4.235 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.672 7.833 -5.269 1.00 0.00 H new ATOM 0 HG13 ILE A 119 8.069 9.111 -4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.862 6.347 -5.962 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.344 5.553 -4.444 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.622 5.679 -4.875 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.311 9.881 -6.446 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.887 9.879 -5.620 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.484 8.582 -6.770 1.00 0.00 H new ATOM 1848 N PHE A 120 9.536 5.061 -1.883 1.00 0.00 N ATOM 1849 CA PHE A 120 10.326 3.982 -1.303 1.00 0.00 C ATOM 1850 C PHE A 120 9.890 2.629 -1.859 1.00 0.00 C ATOM 1851 O PHE A 120 8.822 2.508 -2.457 1.00 0.00 O ATOM 1852 CB PHE A 120 10.192 3.986 0.222 1.00 0.00 C ATOM 1853 CG PHE A 120 8.769 3.926 0.698 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.015 2.776 0.526 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.185 5.019 1.318 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.705 2.718 0.964 1.00 0.00 C ATOM 1857 CE2 PHE A 120 6.876 4.966 1.759 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.135 3.814 1.580 1.00 0.00 C ATOM 0 H PHE A 120 8.570 4.810 -2.094 1.00 0.00 H new ATOM 0 HA PHE A 120 11.370 4.146 -1.570 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.739 3.136 0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.662 4.886 0.618 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.456 1.916 0.044 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.759 5.923 1.458 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.128 1.816 0.824 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.433 5.824 2.243 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.111 3.771 1.921 1.00 0.00 H new ATOM 1868 N GLU A 121 10.727 1.616 -1.657 1.00 0.00 N ATOM 1869 CA GLU A 121 10.429 0.273 -2.140 1.00 0.00 C ATOM 1870 C GLU A 121 10.541 -0.748 -1.012 1.00 0.00 C ATOM 1871 O GLU A 121 11.454 -0.682 -0.188 1.00 0.00 O ATOM 1872 CB GLU A 121 11.376 -0.105 -3.281 1.00 0.00 C ATOM 1873 CG GLU A 121 11.188 0.736 -4.532 1.00 0.00 C ATOM 1874 CD GLU A 121 12.205 0.414 -5.610 1.00 0.00 C ATOM 1875 OE1 GLU A 121 12.010 -0.587 -6.330 1.00 0.00 O ATOM 1876 OE2 GLU A 121 13.195 1.165 -5.733 1.00 0.00 O ATOM 0 H GLU A 121 11.615 1.700 -1.163 1.00 0.00 H new ATOM 0 HA GLU A 121 9.404 0.267 -2.511 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.405 -0.003 -2.936 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.226 -1.155 -3.533 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.184 0.576 -4.925 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.263 1.791 -4.270 1.00 0.00 H new ATOM 1883 N VAL A 122 9.606 -1.693 -0.980 1.00 0.00 N ATOM 1884 CA VAL A 122 9.599 -2.728 0.046 1.00 0.00 C ATOM 1885 C VAL A 122 10.525 -3.880 -0.330 1.00 0.00 C ATOM 1886 O VAL A 122 10.420 -4.444 -1.419 1.00 0.00 O ATOM 1887 CB VAL A 122 8.180 -3.279 0.278 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.093 -3.980 1.625 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.153 -2.161 0.182 1.00 0.00 C ATOM 0 H VAL A 122 8.843 -1.762 -1.654 1.00 0.00 H new ATOM 0 HA VAL A 122 9.955 -2.264 0.966 1.00 0.00 H new ATOM 0 HB VAL A 122 7.961 -4.011 -0.500 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.083 -4.363 1.771 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.802 -4.808 1.651 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.332 -3.273 2.419 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.156 -2.568 0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.367 -1.405 0.937 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.199 -1.708 -0.808 1.00 0.00 H new ATOM 1899 N ASN A 123 11.430 -4.225 0.579 1.00 0.00 N ATOM 1900 CA ASN A 123 12.375 -5.311 0.343 1.00 0.00 C ATOM 1901 C ASN A 123 12.306 -6.345 1.463 1.00 0.00 C ATOM 1902 O ASN A 123 12.945 -7.394 1.392 1.00 0.00 O ATOM 1903 CB ASN A 123 13.798 -4.761 0.229 1.00 0.00 C ATOM 1904 CG ASN A 123 14.076 -4.153 -1.132 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.608 -4.815 -2.024 1.00 0.00 O ATOM 1906 ND2 ASN A 123 13.715 -2.886 -1.299 1.00 0.00 N ATOM 0 H ASN A 123 11.530 -3.769 1.486 1.00 0.00 H new ATOM 0 HA ASN A 123 12.104 -5.797 -0.594 1.00 0.00 H new ATOM 0 HB2 ASN A 123 13.956 -4.007 1.000 1.00 0.00 H new ATOM 0 HB3 ASN A 123 14.511 -5.564 0.418 1.00 0.00 H new ATOM 0 HD21 ASN A 123 13.876 -2.424 -2.194 1.00 0.00 H new ATOM 0 HD22 ASN A 123 13.277 -2.375 -0.532 1.00 0.00 H new ATOM 1913 N ASN A 124 11.526 -6.041 2.494 1.00 0.00 N ATOM 1914 CA ASN A 124 11.372 -6.944 3.629 1.00 0.00 C ATOM 1915 C ASN A 124 10.081 -7.748 3.515 1.00 0.00 C ATOM 1916 O ASN A 124 9.586 -8.294 4.502 1.00 0.00 O ATOM 1917 CB ASN A 124 11.381 -6.155 4.940 1.00 0.00 C ATOM 1918 CG ASN A 124 12.460 -5.090 4.967 1.00 0.00 C ATOM 1919 OD1 ASN A 124 13.606 -5.342 4.596 1.00 0.00 O ATOM 1920 ND2 ASN A 124 12.096 -3.891 5.407 1.00 0.00 N ATOM 0 H ASN A 124 10.990 -5.176 2.568 1.00 0.00 H new ATOM 0 HA ASN A 124 12.212 -7.638 3.625 1.00 0.00 H new ATOM 0 HB2 ASN A 124 10.408 -5.686 5.085 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.531 -6.842 5.773 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.778 -3.134 5.447 1.00 0.00 H new ATOM 0 HD22 ASN A 124 11.134 -3.727 5.705 1.00 0.00 H new ATOM 1927 N LEU A 125 9.538 -7.816 2.304 1.00 0.00 N ATOM 1928 CA LEU A 125 8.304 -8.554 2.059 1.00 0.00 C ATOM 1929 C LEU A 125 8.382 -9.958 2.650 1.00 0.00 C ATOM 1930 O LEU A 125 9.414 -10.626 2.590 1.00 0.00 O ATOM 1931 CB LEU A 125 8.024 -8.635 0.557 1.00 0.00 C ATOM 1932 CG LEU A 125 7.518 -7.351 -0.101 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.594 -7.463 -1.616 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.093 -7.050 0.342 1.00 0.00 C ATOM 0 H LEU A 125 9.933 -7.369 1.477 1.00 0.00 H new ATOM 0 HA LEU A 125 7.488 -8.020 2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.941 -8.941 0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.289 -9.421 0.387 1.00 0.00 H new ATOM 0 HG LEU A 125 8.157 -6.527 0.215 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.230 -6.540 -2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.628 -7.631 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.979 -8.298 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.749 -6.133 -0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.441 -7.875 0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.067 -6.926 1.425 1.00 0.00 H new ATOM 1946 N PRO A 126 7.265 -10.418 3.232 1.00 0.00 N ATOM 1947 CA PRO A 126 7.181 -11.748 3.843 1.00 0.00 C ATOM 1948 C PRO A 126 7.217 -12.865 2.805 1.00 0.00 C ATOM 1949 O PRO A 126 6.808 -12.676 1.660 1.00 0.00 O ATOM 1950 CB PRO A 126 5.827 -11.726 4.557 1.00 0.00 C ATOM 1951 CG PRO A 126 5.022 -10.718 3.812 1.00 0.00 C ATOM 1952 CD PRO A 126 5.998 -9.675 3.340 1.00 0.00 C ATOM 0 HA PRO A 126 8.024 -11.947 4.505 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.352 -12.707 4.535 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.937 -11.449 5.605 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.504 -11.177 2.970 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.259 -10.277 4.453 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.699 -9.249 2.382 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.076 -8.848 4.046 1.00 0.00 H new ATOM 1960 N VAL A 127 7.709 -14.031 3.214 1.00 0.00 N ATOM 1961 CA VAL A 127 7.797 -15.179 2.320 1.00 0.00 C ATOM 1962 C VAL A 127 6.420 -15.775 2.054 1.00 0.00 C ATOM 1963 O VAL A 127 6.128 -16.215 0.942 1.00 0.00 O ATOM 1964 CB VAL A 127 8.714 -16.273 2.900 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.163 -15.810 2.901 1.00 0.00 C ATOM 1966 CG2 VAL A 127 8.266 -16.653 4.304 1.00 0.00 C ATOM 0 H VAL A 127 8.052 -14.205 4.159 1.00 0.00 H new ATOM 0 HA VAL A 127 8.221 -14.818 1.383 1.00 0.00 H new ATOM 0 HB VAL A 127 8.641 -17.158 2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 127 10.796 -16.596 3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 127 10.476 -15.591 1.880 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.257 -14.911 3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 127 8.924 -17.427 4.699 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.309 -15.776 4.950 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.243 -17.029 4.270 1.00 0.00 H new ATOM 1976 N GLU A 128 5.576 -15.785 3.081 1.00 0.00 N ATOM 1977 CA GLU A 128 4.228 -16.327 2.957 1.00 0.00 C ATOM 1978 C GLU A 128 3.594 -15.910 1.633 1.00 0.00 C ATOM 1979 O GLU A 128 2.839 -16.671 1.027 1.00 0.00 O ATOM 1980 CB GLU A 128 3.356 -15.858 4.123 1.00 0.00 C ATOM 1981 CG GLU A 128 3.643 -16.583 5.428 1.00 0.00 C ATOM 1982 CD GLU A 128 2.853 -17.870 5.565 1.00 0.00 C ATOM 1983 OE1 GLU A 128 1.723 -17.933 5.036 1.00 0.00 O ATOM 1984 OE2 GLU A 128 3.365 -18.814 6.202 1.00 0.00 O ATOM 0 H GLU A 128 5.802 -15.424 4.008 1.00 0.00 H new ATOM 0 HA GLU A 128 4.298 -17.415 2.980 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.506 -14.789 4.271 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.307 -16.000 3.861 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.708 -16.806 5.489 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.407 -15.925 6.264 1.00 0.00 H new ATOM 1991 N SER A 129 3.905 -14.696 1.191 1.00 0.00 N ATOM 1992 CA SER A 129 3.362 -14.175 -0.058 1.00 0.00 C ATOM 1993 C SER A 129 3.421 -15.230 -1.158 1.00 0.00 C ATOM 1994 O SER A 129 2.474 -15.393 -1.928 1.00 0.00 O ATOM 1995 CB SER A 129 4.133 -12.926 -0.492 1.00 0.00 C ATOM 1996 OG SER A 129 5.408 -13.267 -1.007 1.00 0.00 O ATOM 0 H SER A 129 4.530 -14.055 1.679 1.00 0.00 H new ATOM 0 HA SER A 129 2.318 -13.909 0.111 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.563 -12.388 -1.250 1.00 0.00 H new ATOM 0 HB3 SER A 129 4.249 -12.253 0.357 1.00 0.00 H new ATOM 0 HG SER A 129 6.088 -13.125 -0.316 1.00 0.00 H new ATOM 2002 N TRP A 130 4.539 -15.943 -1.225 1.00 0.00 N ATOM 2003 CA TRP A 130 4.723 -16.984 -2.231 1.00 0.00 C ATOM 2004 C TRP A 130 4.707 -18.368 -1.591 1.00 0.00 C ATOM 2005 O TRP A 130 4.085 -19.294 -2.111 1.00 0.00 O ATOM 2006 CB TRP A 130 6.038 -16.770 -2.981 1.00 0.00 C ATOM 2007 CG TRP A 130 7.242 -16.797 -2.089 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.906 -15.720 -1.574 1.00 0.00 C ATOM 2009 CD2 TRP A 130 7.926 -17.960 -1.608 1.00 0.00 C ATOM 2010 NE1 TRP A 130 8.962 -16.143 -0.803 1.00 0.00 N ATOM 2011 CE2 TRP A 130 8.995 -17.512 -0.807 1.00 0.00 C ATOM 2012 CE3 TRP A 130 7.739 -19.334 -1.775 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 9.871 -18.392 -0.176 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 8.610 -20.206 -1.149 1.00 0.00 C ATOM 2015 CH2 TRP A 130 9.664 -19.733 -0.357 1.00 0.00 C ATOM 0 H TRP A 130 5.332 -15.820 -0.595 1.00 0.00 H new ATOM 0 HA TRP A 130 3.896 -16.922 -2.938 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.143 -17.542 -3.744 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.000 -15.812 -3.500 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.640 -14.688 -1.747 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.615 -15.536 -0.308 1.00 0.00 H new ATOM 0 HE3 TRP A 130 6.928 -19.709 -2.382 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.685 -18.029 0.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 8.475 -21.270 -1.273 1.00 0.00 H new ATOM 0 HH2 TRP A 130 10.326 -20.440 0.120 1.00 0.00 H new ATOM 2026 N GLN A 131 5.394 -18.501 -0.461 1.00 0.00 N ATOM 2027 CA GLN A 131 5.459 -19.773 0.248 1.00 0.00 C ATOM 2028 C GLN A 131 4.112 -20.115 0.876 1.00 0.00 C ATOM 2029 O GLN A 131 3.574 -19.346 1.674 1.00 0.00 O ATOM 2030 CB GLN A 131 6.541 -19.726 1.327 1.00 0.00 C ATOM 2031 CG GLN A 131 6.799 -21.069 1.990 1.00 0.00 C ATOM 2032 CD GLN A 131 8.177 -21.156 2.616 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.952 -22.065 2.316 1.00 0.00 O ATOM 2034 NE2 GLN A 131 8.490 -20.208 3.492 1.00 0.00 N ATOM 0 H GLN A 131 5.913 -17.744 -0.017 1.00 0.00 H new ATOM 0 HA GLN A 131 5.711 -20.550 -0.474 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.469 -19.365 0.883 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.250 -19.004 2.090 1.00 0.00 H new ATOM 0 HG2 GLN A 131 6.044 -21.242 2.757 1.00 0.00 H new ATOM 0 HG3 GLN A 131 6.689 -21.862 1.250 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.817 -19.473 3.711 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.403 -20.214 3.946 1.00 0.00 H new