USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=16 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 : amide:sc= 0.925 K(o=1.4,f=-0.081) USER MOD Set 1.2: A 50 SER OG : rot -76:sc= 0.324 USER MOD Set 1.3: A 111 HIS : no HD1:sc= 0.128 K(o=1.4,f=-1.2) USER MOD Single : A 17 LYS NZ :NH3+ -167:sc= 1.06 (180deg=0.817) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 ASN : amide:sc= -0.32 X(o=-0.32,f=-0.0024) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0307 K(o=-0.031,f=-1.4) 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 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.116 X(o=-0.12,f=-0.0093) USER MOD Single : A 59 CYS SG : rot 140:sc= -0.947 USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 110:sc= -0.501 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 70 GLN : amide:sc=-0.00929 X(o=-0.0093,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.17 K(o=-0.17,f=-1.4) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.23 K(o=-0.23,f=-3.9!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 28:sc= 0.414 USER MOD Single : A 89 GLN : amide:sc= -2.52! C(o=-2.5!,f=-2.7!) USER MOD Single : A 95 ASN : amide:sc= -2.95! K(o=-3!,f=-0.73) USER MOD Single : A 97 ASN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= -0.014 (180deg=-0.014) USER MOD Single : A 108 THR OG1 : rot 37:sc= 0.0883 USER MOD Single : A 109 TYR OH : rot 180:sc= -0.168 USER MOD Single : A 113 HIS : no HD1:sc= -0.115 X(o=-0.11,f=0) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -5.24! K(o=-5.2!,f=-2.4) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 124 ASN : amide:sc= -1.53 X(o=-1.5,f=-1) USER MOD Single : A 129 SER OG : rot 180:sc= -0.539 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 132 N ILE A 13 0.822 -13.957 8.166 1.00 0.00 N ATOM 133 CA ILE A 13 1.769 -12.915 7.786 1.00 0.00 C ATOM 134 C ILE A 13 1.601 -11.675 8.657 1.00 0.00 C ATOM 135 O ILE A 13 0.574 -10.998 8.626 1.00 0.00 O ATOM 136 CB ILE A 13 1.602 -12.516 6.307 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.487 -13.764 5.430 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.771 -11.652 5.857 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.729 -13.530 4.142 1.00 0.00 C ATOM 0 HA ILE A 13 2.768 -13.327 7.933 1.00 0.00 H new ATOM 0 HB ILE A 13 0.685 -11.936 6.203 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.488 -14.125 5.193 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.990 -14.552 5.996 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.639 -11.378 4.810 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.812 -10.749 6.466 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.701 -12.209 5.972 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.687 -14.457 3.571 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.284 -13.199 4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.237 -12.765 3.555 1.00 0.00 H new ATOM 151 N PRO A 14 2.636 -11.368 9.453 1.00 0.00 N ATOM 152 CA PRO A 14 2.629 -10.206 10.347 1.00 0.00 C ATOM 153 C PRO A 14 2.698 -8.887 9.584 1.00 0.00 C ATOM 154 O PRO A 14 3.149 -8.844 8.440 1.00 0.00 O ATOM 155 CB PRO A 14 3.890 -10.401 11.193 1.00 0.00 C ATOM 156 CG PRO A 14 4.791 -11.229 10.343 1.00 0.00 C ATOM 157 CD PRO A 14 3.892 -12.130 9.542 1.00 0.00 C ATOM 0 HA PRO A 14 1.711 -10.148 10.932 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.350 -9.445 11.444 1.00 0.00 H new ATOM 0 HB3 PRO A 14 3.662 -10.902 12.134 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.397 -10.601 9.690 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.480 -11.810 10.956 1.00 0.00 H new ATOM 0 HD2 PRO A 14 4.307 -12.337 8.556 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.745 -13.091 10.034 1.00 0.00 H new ATOM 165 N ASP A 15 2.247 -7.814 10.225 1.00 0.00 N ATOM 166 CA ASP A 15 2.259 -6.494 9.607 1.00 0.00 C ATOM 167 C ASP A 15 3.684 -6.062 9.275 1.00 0.00 C ATOM 168 O ASP A 15 4.648 -6.566 9.853 1.00 0.00 O ATOM 169 CB ASP A 15 1.605 -5.467 10.534 1.00 0.00 C ATOM 170 CG ASP A 15 2.503 -5.077 11.691 1.00 0.00 C ATOM 171 OD1 ASP A 15 3.361 -4.189 11.503 1.00 0.00 O ATOM 172 OD2 ASP A 15 2.348 -5.659 12.785 1.00 0.00 O ATOM 0 H ASP A 15 1.869 -7.833 11.172 1.00 0.00 H new ATOM 0 HA ASP A 15 1.690 -6.550 8.679 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.348 -4.576 9.961 1.00 0.00 H new ATOM 0 HB3 ASP A 15 0.672 -5.875 10.923 1.00 0.00 H new ATOM 177 N LEU A 16 3.811 -5.127 8.340 1.00 0.00 N ATOM 178 CA LEU A 16 5.119 -4.627 7.930 1.00 0.00 C ATOM 179 C LEU A 16 5.167 -3.105 8.003 1.00 0.00 C ATOM 180 O LEU A 16 4.132 -2.439 8.004 1.00 0.00 O ATOM 181 CB LEU A 16 5.440 -5.092 6.508 1.00 0.00 C ATOM 182 CG LEU A 16 6.924 -5.255 6.175 1.00 0.00 C ATOM 183 CD1 LEU A 16 7.399 -6.655 6.530 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.175 -4.962 4.703 1.00 0.00 C ATOM 0 H LEU A 16 3.024 -4.700 7.851 1.00 0.00 H new ATOM 0 HA LEU A 16 5.866 -5.028 8.615 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.943 -6.047 6.338 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.007 -4.378 5.807 1.00 0.00 H new ATOM 0 HG LEU A 16 7.492 -4.539 6.769 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.457 -6.753 6.286 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.255 -6.829 7.596 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.826 -7.388 5.962 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.236 -5.083 4.484 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.597 -5.654 4.091 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.872 -3.939 4.479 1.00 0.00 H new ATOM 196 N LYS A 17 6.377 -2.559 8.061 1.00 0.00 N ATOM 197 CA LYS A 17 6.563 -1.114 8.131 1.00 0.00 C ATOM 198 C LYS A 17 7.292 -0.599 6.894 1.00 0.00 C ATOM 199 O LYS A 17 8.385 -1.062 6.568 1.00 0.00 O ATOM 200 CB LYS A 17 7.348 -0.741 9.391 1.00 0.00 C ATOM 201 CG LYS A 17 7.492 0.758 9.595 1.00 0.00 C ATOM 202 CD LYS A 17 7.925 1.088 11.014 1.00 0.00 C ATOM 203 CE LYS A 17 9.438 1.051 11.158 1.00 0.00 C ATOM 204 NZ LYS A 17 9.870 1.343 12.553 1.00 0.00 N ATOM 0 H LYS A 17 7.244 -3.096 8.061 1.00 0.00 H new ATOM 0 HA LYS A 17 5.579 -0.647 8.172 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.850 -1.172 10.260 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.340 -1.189 9.337 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.222 1.154 8.889 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.543 1.248 9.380 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.557 2.077 11.287 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.475 0.377 11.707 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.807 0.069 10.862 1.00 0.00 H new ATOM 0 HE3 LYS A 17 9.885 1.778 10.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 10.894 1.526 12.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 9.363 2.180 12.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.655 0.527 13.161 1.00 0.00 H new ATOM 218 N VAL A 18 6.680 0.362 6.210 1.00 0.00 N ATOM 219 CA VAL A 18 7.272 0.942 5.010 1.00 0.00 C ATOM 220 C VAL A 18 7.642 2.404 5.232 1.00 0.00 C ATOM 221 O VAL A 18 8.632 2.894 4.688 1.00 0.00 O ATOM 222 CB VAL A 18 6.315 0.843 3.807 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.969 -0.610 3.518 1.00 0.00 C ATOM 224 CG2 VAL A 18 5.056 1.659 4.061 1.00 0.00 C ATOM 0 H VAL A 18 5.775 0.756 6.466 1.00 0.00 H new ATOM 0 HA VAL A 18 8.174 0.370 4.794 1.00 0.00 H new ATOM 0 HB VAL A 18 6.816 1.253 2.930 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.292 -0.660 2.665 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.881 -1.163 3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.486 -1.050 4.391 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.391 1.578 3.201 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.550 1.280 4.949 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.325 2.704 4.215 1.00 0.00 H new ATOM 234 N PHE A 19 6.841 3.097 6.034 1.00 0.00 N ATOM 235 CA PHE A 19 7.084 4.504 6.328 1.00 0.00 C ATOM 236 C PHE A 19 6.722 4.828 7.775 1.00 0.00 C ATOM 237 O PHE A 19 5.671 4.421 8.268 1.00 0.00 O ATOM 238 CB PHE A 19 6.278 5.392 5.378 1.00 0.00 C ATOM 239 CG PHE A 19 6.664 6.842 5.440 1.00 0.00 C ATOM 240 CD1 PHE A 19 7.689 7.335 4.648 1.00 0.00 C ATOM 241 CD2 PHE A 19 6.002 7.713 6.291 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.046 8.669 4.703 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.355 9.048 6.350 1.00 0.00 C ATOM 244 CZ PHE A 19 7.379 9.526 5.556 1.00 0.00 C ATOM 0 H PHE A 19 6.017 2.707 6.492 1.00 0.00 H new ATOM 0 HA PHE A 19 8.146 4.701 6.185 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.410 5.032 4.358 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.218 5.296 5.615 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.215 6.669 3.980 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.201 7.344 6.915 1.00 0.00 H new ATOM 0 HE1 PHE A 19 8.846 9.041 4.080 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.831 9.717 7.016 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.658 10.568 5.602 1.00 0.00 H new ATOM 254 N GLU A 20 7.601 5.563 8.448 1.00 0.00 N ATOM 255 CA GLU A 20 7.374 5.941 9.838 1.00 0.00 C ATOM 256 C GLU A 20 7.834 7.373 10.095 1.00 0.00 C ATOM 257 O GLU A 20 8.977 7.730 9.809 1.00 0.00 O ATOM 258 CB GLU A 20 8.109 4.981 10.777 1.00 0.00 C ATOM 259 CG GLU A 20 8.084 5.415 12.233 1.00 0.00 C ATOM 260 CD GLU A 20 9.136 4.713 13.069 1.00 0.00 C ATOM 261 OE1 GLU A 20 10.300 5.166 13.060 1.00 0.00 O ATOM 262 OE2 GLU A 20 8.796 3.711 13.733 1.00 0.00 O ATOM 0 H GLU A 20 8.476 5.908 8.054 1.00 0.00 H new ATOM 0 HA GLU A 20 6.303 5.881 10.034 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.661 3.991 10.694 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.145 4.890 10.452 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.240 6.492 12.290 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.098 5.213 12.652 1.00 0.00 H new ATOM 269 N ARG A 21 6.936 8.188 10.637 1.00 0.00 N ATOM 270 CA ARG A 21 7.248 9.582 10.931 1.00 0.00 C ATOM 271 C ARG A 21 6.721 9.978 12.307 1.00 0.00 C ATOM 272 O ARG A 21 5.738 9.418 12.790 1.00 0.00 O ATOM 273 CB ARG A 21 6.650 10.497 9.861 1.00 0.00 C ATOM 274 CG ARG A 21 7.042 11.957 10.020 1.00 0.00 C ATOM 275 CD ARG A 21 6.642 12.777 8.803 1.00 0.00 C ATOM 276 NE ARG A 21 7.681 12.775 7.777 1.00 0.00 N ATOM 277 CZ ARG A 21 7.598 13.467 6.646 1.00 0.00 C ATOM 278 NH1 ARG A 21 6.531 14.214 6.399 1.00 0.00 N ATOM 279 NH2 ARG A 21 8.585 13.414 5.760 1.00 0.00 N ATOM 0 H ARG A 21 5.986 7.908 10.882 1.00 0.00 H new ATOM 0 HA ARG A 21 8.332 9.694 10.930 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.968 10.149 8.878 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.563 10.416 9.891 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.565 12.368 10.910 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.119 12.031 10.172 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.718 12.378 8.384 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.436 13.803 9.109 1.00 0.00 H new ATOM 0 HE ARG A 21 8.516 12.212 7.937 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.771 14.258 7.078 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.470 14.744 5.530 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.408 12.842 5.947 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.520 13.946 4.892 1.00 0.00 H new ATOM 293 N GLU A 22 7.382 10.948 12.931 1.00 0.00 N ATOM 294 CA GLU A 22 6.981 11.417 14.252 1.00 0.00 C ATOM 295 C GLU A 22 5.460 11.485 14.366 1.00 0.00 C ATOM 296 O GLU A 22 4.903 11.363 15.456 1.00 0.00 O ATOM 297 CB GLU A 22 7.586 12.794 14.534 1.00 0.00 C ATOM 298 CG GLU A 22 9.105 12.808 14.507 1.00 0.00 C ATOM 299 CD GLU A 22 9.716 12.488 15.858 1.00 0.00 C ATOM 300 OE1 GLU A 22 9.356 11.443 16.440 1.00 0.00 O ATOM 301 OE2 GLU A 22 10.554 13.283 16.332 1.00 0.00 O ATOM 0 H GLU A 22 8.197 11.424 12.543 1.00 0.00 H new ATOM 0 HA GLU A 22 7.353 10.706 14.990 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.211 13.504 13.797 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.245 13.138 15.510 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.458 12.084 13.772 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.450 13.789 14.180 1.00 0.00 H new ATOM 308 N GLY A 23 4.795 11.681 13.232 1.00 0.00 N ATOM 309 CA GLY A 23 3.347 11.763 13.225 1.00 0.00 C ATOM 310 C GLY A 23 2.720 10.874 12.169 1.00 0.00 C ATOM 311 O GLY A 23 1.719 10.205 12.425 1.00 0.00 O ATOM 0 H GLY A 23 5.234 11.785 12.317 1.00 0.00 H new ATOM 0 HA2 GLY A 23 2.966 11.480 14.206 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.046 12.796 13.051 1.00 0.00 H new ATOM 315 N VAL A 24 3.310 10.868 10.978 1.00 0.00 N ATOM 316 CA VAL A 24 2.803 10.055 9.879 1.00 0.00 C ATOM 317 C VAL A 24 3.376 8.643 9.929 1.00 0.00 C ATOM 318 O VAL A 24 4.593 8.458 9.955 1.00 0.00 O ATOM 319 CB VAL A 24 3.139 10.685 8.514 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.368 9.992 7.401 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.843 12.177 8.529 1.00 0.00 C ATOM 0 H VAL A 24 4.139 11.417 10.750 1.00 0.00 H new ATOM 0 HA VAL A 24 1.720 10.008 9.993 1.00 0.00 H new ATOM 0 HB VAL A 24 4.204 10.550 8.324 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.618 10.451 6.445 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.634 8.935 7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.298 10.093 7.582 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.086 12.606 7.557 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.786 12.336 8.742 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.445 12.660 9.299 1.00 0.00 H new ATOM 331 N GLN A 25 2.492 7.652 9.943 1.00 0.00 N ATOM 332 CA GLN A 25 2.910 6.256 9.991 1.00 0.00 C ATOM 333 C GLN A 25 2.165 5.428 8.949 1.00 0.00 C ATOM 334 O GLN A 25 0.960 5.594 8.755 1.00 0.00 O ATOM 335 CB GLN A 25 2.670 5.677 11.386 1.00 0.00 C ATOM 336 CG GLN A 25 3.849 5.853 12.330 1.00 0.00 C ATOM 337 CD GLN A 25 3.429 5.902 13.785 1.00 0.00 C ATOM 338 OE1 GLN A 25 3.610 6.915 14.462 1.00 0.00 O ATOM 339 NE2 GLN A 25 2.864 4.806 14.277 1.00 0.00 N ATOM 0 H GLN A 25 1.482 7.789 9.922 1.00 0.00 H new ATOM 0 HA GLN A 25 3.976 6.215 9.767 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.792 6.154 11.822 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.444 4.615 11.295 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.551 5.031 12.186 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.378 6.772 12.077 1.00 0.00 H new ATOM 0 HE21 GLN A 25 2.733 3.988 13.681 1.00 0.00 H new ATOM 0 HE22 GLN A 25 2.561 4.781 15.251 1.00 0.00 H new ATOM 348 N LEU A 26 2.890 4.538 8.280 1.00 0.00 N ATOM 349 CA LEU A 26 2.298 3.683 7.256 1.00 0.00 C ATOM 350 C LEU A 26 2.584 2.213 7.542 1.00 0.00 C ATOM 351 O LEU A 26 3.732 1.823 7.753 1.00 0.00 O ATOM 352 CB LEU A 26 2.836 4.061 5.875 1.00 0.00 C ATOM 353 CG LEU A 26 1.898 3.803 4.696 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.688 4.722 4.766 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.635 3.989 3.378 1.00 0.00 C ATOM 0 H LEU A 26 3.888 4.389 8.428 1.00 0.00 H new ATOM 0 HA LEU A 26 1.218 3.833 7.272 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.092 5.120 5.884 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.761 3.511 5.704 1.00 0.00 H new ATOM 0 HG LEU A 26 1.549 2.772 4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.031 4.524 3.919 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.147 4.541 5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.018 5.761 4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.952 3.801 2.550 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.012 5.009 3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.469 3.290 3.326 1.00 0.00 H new ATOM 367 N ASN A 27 1.532 1.400 7.545 1.00 0.00 N ATOM 368 CA ASN A 27 1.671 -0.029 7.802 1.00 0.00 C ATOM 369 C ASN A 27 1.185 -0.846 6.610 1.00 0.00 C ATOM 370 O ASN A 27 0.219 -0.476 5.941 1.00 0.00 O ATOM 371 CB ASN A 27 0.887 -0.420 9.057 1.00 0.00 C ATOM 372 CG ASN A 27 1.404 0.275 10.302 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.073 -0.337 11.135 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.094 1.559 10.434 1.00 0.00 N ATOM 0 H ASN A 27 0.575 1.706 7.372 1.00 0.00 H new ATOM 0 HA ASN A 27 2.728 -0.244 7.960 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.165 -0.172 8.917 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.945 -1.500 9.196 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.413 2.079 11.251 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.537 2.025 9.718 1.00 0.00 H new ATOM 381 N LEU A 28 1.861 -1.960 6.348 1.00 0.00 N ATOM 382 CA LEU A 28 1.498 -2.832 5.236 1.00 0.00 C ATOM 383 C LEU A 28 0.889 -4.135 5.742 1.00 0.00 C ATOM 384 O LEU A 28 1.486 -4.835 6.560 1.00 0.00 O ATOM 385 CB LEU A 28 2.727 -3.131 4.375 1.00 0.00 C ATOM 386 CG LEU A 28 2.453 -3.468 2.909 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.758 -3.582 2.135 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.651 -4.756 2.799 1.00 0.00 C ATOM 0 H LEU A 28 2.663 -2.280 6.890 1.00 0.00 H new ATOM 0 HA LEU A 28 0.753 -2.316 4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.390 -2.266 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.266 -3.965 4.824 1.00 0.00 H new ATOM 0 HG LEU A 28 1.865 -2.660 2.474 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.544 -3.822 1.094 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.295 -2.635 2.186 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.372 -4.371 2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.465 -4.980 1.749 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.212 -5.574 3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.700 -4.638 3.318 1.00 0.00 H new ATOM 400 N SER A 29 -0.303 -4.456 5.249 1.00 0.00 N ATOM 401 CA SER A 29 -0.995 -5.674 5.653 1.00 0.00 C ATOM 402 C SER A 29 -1.214 -6.596 4.457 1.00 0.00 C ATOM 403 O SER A 29 -1.724 -6.175 3.419 1.00 0.00 O ATOM 404 CB SER A 29 -2.339 -5.333 6.300 1.00 0.00 C ATOM 405 OG SER A 29 -2.742 -6.347 7.203 1.00 0.00 O ATOM 0 H SER A 29 -0.810 -3.889 4.569 1.00 0.00 H new ATOM 0 HA SER A 29 -0.371 -6.192 6.381 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.261 -4.382 6.827 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.097 -5.208 5.527 1.00 0.00 H new ATOM 0 HG SER A 29 -3.603 -6.105 7.604 1.00 0.00 H new ATOM 411 N PHE A 30 -0.823 -7.857 4.611 1.00 0.00 N ATOM 412 CA PHE A 30 -0.974 -8.840 3.544 1.00 0.00 C ATOM 413 C PHE A 30 -2.148 -9.773 3.827 1.00 0.00 C ATOM 414 O PHE A 30 -2.339 -10.222 4.958 1.00 0.00 O ATOM 415 CB PHE A 30 0.312 -9.653 3.385 1.00 0.00 C ATOM 416 CG PHE A 30 1.534 -8.807 3.171 1.00 0.00 C ATOM 417 CD1 PHE A 30 2.273 -8.348 4.249 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.944 -8.469 1.890 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.399 -7.569 4.055 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.068 -7.691 1.690 1.00 0.00 C ATOM 421 CZ PHE A 30 3.796 -7.239 2.774 1.00 0.00 C ATOM 0 H PHE A 30 -0.399 -8.222 5.464 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.174 -8.305 2.616 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.456 -10.267 4.274 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.200 -10.334 2.542 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.966 -8.602 5.253 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.378 -8.818 1.039 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.967 -7.219 4.904 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.377 -7.436 0.687 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.674 -6.629 2.620 1.00 0.00 H new ATOM 431 N ILE A 31 -2.930 -10.060 2.792 1.00 0.00 N ATOM 432 CA ILE A 31 -4.084 -10.939 2.929 1.00 0.00 C ATOM 433 C ILE A 31 -4.150 -11.942 1.782 1.00 0.00 C ATOM 434 O ILE A 31 -4.128 -11.564 0.611 1.00 0.00 O ATOM 435 CB ILE A 31 -5.400 -10.140 2.973 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.559 -9.452 4.330 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.584 -11.052 2.693 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.908 -8.088 4.397 1.00 0.00 C ATOM 0 H ILE A 31 -2.785 -9.697 1.850 1.00 0.00 H new ATOM 0 HA ILE A 31 -3.962 -11.474 3.871 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.368 -9.373 2.199 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.621 -9.350 4.554 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.130 -10.089 5.103 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.506 -10.472 2.728 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.473 -11.499 1.705 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.622 -11.840 3.445 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.061 -7.660 5.388 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.840 -8.185 4.205 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.354 -7.435 3.647 1.00 0.00 H new ATOM 450 N ARG A 32 -4.233 -13.223 2.127 1.00 0.00 N ATOM 451 CA ARG A 32 -4.303 -14.281 1.126 1.00 0.00 C ATOM 452 C ARG A 32 -5.562 -15.123 1.312 1.00 0.00 C ATOM 453 O ARG A 32 -5.653 -15.956 2.214 1.00 0.00 O ATOM 454 CB ARG A 32 -3.063 -15.173 1.209 1.00 0.00 C ATOM 455 CG ARG A 32 -1.818 -14.544 0.605 1.00 0.00 C ATOM 456 CD ARG A 32 -0.766 -15.593 0.279 1.00 0.00 C ATOM 457 NE ARG A 32 -1.339 -16.749 -0.404 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.750 -17.939 -0.457 1.00 0.00 C ATOM 459 NH1 ARG A 32 0.424 -18.127 0.131 1.00 0.00 N ATOM 460 NH2 ARG A 32 -1.334 -18.942 -1.098 1.00 0.00 N ATOM 0 H ARG A 32 -4.253 -13.553 3.092 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.341 -13.814 0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.868 -15.413 2.254 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.268 -16.114 0.699 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.086 -14.002 -0.302 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.403 -13.815 1.301 1.00 0.00 H new ATOM 0 HD2 ARG A 32 0.007 -15.148 -0.348 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.282 -15.919 1.200 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.241 -16.637 -0.866 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.876 -17.357 0.625 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.875 -19.041 0.089 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.237 -18.801 -1.551 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.881 -19.855 -1.138 1.00 0.00 H new ATOM 474 N PRO A 33 -6.556 -14.901 0.440 1.00 0.00 N ATOM 475 CA PRO A 33 -7.828 -15.629 0.487 1.00 0.00 C ATOM 476 C PRO A 33 -7.673 -17.092 0.088 1.00 0.00 C ATOM 477 O PRO A 33 -6.806 -17.456 -0.707 1.00 0.00 O ATOM 478 CB PRO A 33 -8.699 -14.887 -0.529 1.00 0.00 C ATOM 479 CG PRO A 33 -7.731 -14.265 -1.476 1.00 0.00 C ATOM 480 CD PRO A 33 -6.516 -13.922 -0.660 1.00 0.00 C ATOM 0 HA PRO A 33 -8.248 -15.652 1.493 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.374 -15.570 -1.045 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.318 -14.133 -0.043 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.478 -14.953 -2.283 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.155 -13.374 -1.938 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.601 -14.012 -1.245 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.557 -12.898 -0.288 1.00 0.00 H new ATOM 488 N PRO A 34 -8.533 -17.954 0.652 1.00 0.00 N ATOM 489 CA PRO A 34 -8.512 -19.392 0.369 1.00 0.00 C ATOM 490 C PRO A 34 -8.970 -19.710 -1.050 1.00 0.00 C ATOM 491 O PRO A 34 -8.416 -20.589 -1.709 1.00 0.00 O ATOM 492 CB PRO A 34 -9.494 -19.969 1.391 1.00 0.00 C ATOM 493 CG PRO A 34 -10.418 -18.844 1.706 1.00 0.00 C ATOM 494 CD PRO A 34 -9.591 -17.591 1.608 1.00 0.00 C ATOM 0 HA PRO A 34 -7.507 -19.808 0.442 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.035 -20.823 0.982 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.976 -20.318 2.284 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.253 -18.817 1.006 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.842 -18.955 2.704 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.182 -16.747 1.252 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.178 -17.306 2.575 1.00 0.00 H new ATOM 502 N GLU A 35 -9.986 -18.990 -1.514 1.00 0.00 N ATOM 503 CA GLU A 35 -10.519 -19.197 -2.856 1.00 0.00 C ATOM 504 C GLU A 35 -9.462 -18.894 -3.914 1.00 0.00 C ATOM 505 O GLU A 35 -9.312 -19.632 -4.886 1.00 0.00 O ATOM 506 CB GLU A 35 -11.750 -18.316 -3.082 1.00 0.00 C ATOM 507 CG GLU A 35 -11.442 -16.828 -3.077 1.00 0.00 C ATOM 508 CD GLU A 35 -12.691 -15.974 -2.977 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.246 -15.865 -1.863 1.00 0.00 O ATOM 510 OE2 GLU A 35 -13.114 -15.416 -4.010 1.00 0.00 O ATOM 0 H GLU A 35 -10.457 -18.259 -0.981 1.00 0.00 H new ATOM 0 HA GLU A 35 -10.809 -20.244 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.206 -18.581 -4.036 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.486 -18.529 -2.307 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -10.783 -16.600 -2.240 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.902 -16.570 -3.988 1.00 0.00 H new ATOM 517 N ASN A 36 -8.731 -17.801 -3.716 1.00 0.00 N ATOM 518 CA ASN A 36 -7.689 -17.399 -4.653 1.00 0.00 C ATOM 519 C ASN A 36 -6.343 -17.268 -3.946 1.00 0.00 C ATOM 520 O ASN A 36 -6.004 -16.223 -3.391 1.00 0.00 O ATOM 521 CB ASN A 36 -8.058 -16.072 -5.320 1.00 0.00 C ATOM 522 CG ASN A 36 -8.911 -16.266 -6.559 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.496 -17.329 -6.763 1.00 0.00 O ATOM 524 ND2 ASN A 36 -8.985 -15.235 -7.393 1.00 0.00 N ATOM 0 H ASN A 36 -8.841 -17.179 -2.915 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.605 -18.171 -5.417 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.595 -15.447 -4.607 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.147 -15.538 -5.589 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.544 -15.306 -8.243 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.483 -14.372 -7.183 1.00 0.00 H new ATOM 531 N PRO A 37 -5.556 -18.354 -3.967 1.00 0.00 N ATOM 532 CA PRO A 37 -4.234 -18.386 -3.334 1.00 0.00 C ATOM 533 C PRO A 37 -3.219 -17.515 -4.067 1.00 0.00 C ATOM 534 O PRO A 37 -2.347 -16.907 -3.448 1.00 0.00 O ATOM 535 CB PRO A 37 -3.835 -19.861 -3.421 1.00 0.00 C ATOM 536 CG PRO A 37 -4.597 -20.392 -4.586 1.00 0.00 C ATOM 537 CD PRO A 37 -5.895 -19.634 -4.611 1.00 0.00 C ATOM 0 HA PRO A 37 -4.260 -17.997 -2.316 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.761 -19.972 -3.567 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.089 -20.395 -2.505 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.043 -20.248 -5.513 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.772 -21.463 -4.483 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.255 -19.488 -5.629 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.679 -20.162 -4.068 1.00 0.00 H new ATOM 545 N ALA A 38 -3.339 -17.460 -5.390 1.00 0.00 N ATOM 546 CA ALA A 38 -2.434 -16.662 -6.207 1.00 0.00 C ATOM 547 C ALA A 38 -2.794 -15.182 -6.140 1.00 0.00 C ATOM 548 O ALA A 38 -2.124 -14.342 -6.741 1.00 0.00 O ATOM 549 CB ALA A 38 -2.456 -17.149 -7.648 1.00 0.00 C ATOM 0 H ALA A 38 -4.055 -17.959 -5.918 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.426 -16.781 -5.811 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.775 -16.544 -8.247 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.142 -18.192 -7.684 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.467 -17.060 -8.047 1.00 0.00 H new ATOM 555 N LEU A 39 -3.857 -14.870 -5.406 1.00 0.00 N ATOM 556 CA LEU A 39 -4.307 -13.490 -5.261 1.00 0.00 C ATOM 557 C LEU A 39 -3.798 -12.885 -3.957 1.00 0.00 C ATOM 558 O LEU A 39 -4.089 -13.388 -2.871 1.00 0.00 O ATOM 559 CB LEU A 39 -5.835 -13.424 -5.305 1.00 0.00 C ATOM 560 CG LEU A 39 -6.448 -12.024 -5.265 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.326 -11.348 -6.621 1.00 0.00 C ATOM 562 CD2 LEU A 39 -7.905 -12.093 -4.830 1.00 0.00 C ATOM 0 H LEU A 39 -4.423 -15.553 -4.903 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.900 -12.912 -6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.174 -13.921 -6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.228 -13.995 -4.464 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.899 -11.428 -4.536 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.768 -10.353 -6.572 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.274 -11.265 -6.893 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.849 -11.941 -7.371 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.326 -11.088 -4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.467 -12.705 -5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.967 -12.535 -3.836 1.00 0.00 H new ATOM 574 N LEU A 40 -3.039 -11.800 -4.071 1.00 0.00 N ATOM 575 CA LEU A 40 -2.491 -11.124 -2.901 1.00 0.00 C ATOM 576 C LEU A 40 -3.201 -9.797 -2.656 1.00 0.00 C ATOM 577 O LEU A 40 -3.063 -8.853 -3.436 1.00 0.00 O ATOM 578 CB LEU A 40 -0.990 -10.887 -3.080 1.00 0.00 C ATOM 579 CG LEU A 40 -0.261 -10.267 -1.888 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.162 -11.266 -0.745 1.00 0.00 C ATOM 581 CD2 LEU A 40 1.123 -9.787 -2.300 1.00 0.00 C ATOM 0 H LEU A 40 -2.790 -11.370 -4.962 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.650 -11.765 -2.034 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.517 -11.841 -3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.845 -10.240 -3.945 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.834 -9.406 -1.543 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.360 -10.807 0.095 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.163 -11.562 -0.432 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.389 -12.146 -1.078 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.627 -9.349 -1.439 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.705 -10.631 -2.671 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.029 -9.038 -3.086 1.00 0.00 H new ATOM 593 N LEU A 41 -3.960 -9.729 -1.568 1.00 0.00 N ATOM 594 CA LEU A 41 -4.691 -8.516 -1.219 1.00 0.00 C ATOM 595 C LEU A 41 -3.930 -7.703 -0.177 1.00 0.00 C ATOM 596 O LEU A 41 -3.785 -8.127 0.971 1.00 0.00 O ATOM 597 CB LEU A 41 -6.082 -8.870 -0.691 1.00 0.00 C ATOM 598 CG LEU A 41 -6.889 -9.859 -1.532 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.084 -10.377 -0.748 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.342 -9.209 -2.831 1.00 0.00 C ATOM 0 H LEU A 41 -4.085 -10.500 -0.912 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.794 -7.911 -2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.974 -9.282 0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.658 -7.949 -0.597 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.247 -10.705 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.646 -11.080 -1.363 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.737 -10.882 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.727 -9.542 -0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.915 -9.928 -3.417 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.966 -8.344 -2.607 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.470 -8.889 -3.401 1.00 0.00 H new ATOM 612 N ILE A 42 -3.448 -6.533 -0.583 1.00 0.00 N ATOM 613 CA ILE A 42 -2.705 -5.660 0.317 1.00 0.00 C ATOM 614 C ILE A 42 -3.566 -4.490 0.782 1.00 0.00 C ATOM 615 O ILE A 42 -4.365 -3.949 0.017 1.00 0.00 O ATOM 616 CB ILE A 42 -1.432 -5.112 -0.354 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.413 -6.234 -0.557 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.834 -3.990 0.482 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.785 -5.821 -1.383 1.00 0.00 C ATOM 0 H ILE A 42 -3.559 -6.168 -1.529 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.420 -6.263 1.179 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.699 -4.708 -1.331 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.070 -6.582 0.417 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.905 -7.077 -1.042 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.065 -3.613 -0.005 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.560 -3.183 0.580 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.579 -4.370 1.471 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.465 -6.667 -1.486 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.453 -5.500 -2.370 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.301 -4.998 -0.889 1.00 0.00 H new ATOM 631 N THR A 43 -3.396 -4.101 2.042 1.00 0.00 N ATOM 632 CA THR A 43 -4.155 -2.994 2.609 1.00 0.00 C ATOM 633 C THR A 43 -3.238 -2.002 3.314 1.00 0.00 C ATOM 634 O THR A 43 -2.512 -2.364 4.240 1.00 0.00 O ATOM 635 CB THR A 43 -5.216 -3.494 3.608 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.781 -4.726 3.146 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.318 -2.462 3.790 1.00 0.00 C ATOM 0 H THR A 43 -2.739 -4.537 2.689 1.00 0.00 H new ATOM 0 HA THR A 43 -4.654 -2.495 1.778 1.00 0.00 H new ATOM 0 HB THR A 43 -4.729 -3.655 4.570 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.453 -5.038 3.787 1.00 0.00 H new ATOM 0 HG21 THR A 43 -7.055 -2.838 4.500 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.889 -1.535 4.169 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.801 -2.273 2.831 1.00 0.00 H new ATOM 645 N ILE A 44 -3.277 -0.750 2.871 1.00 0.00 N ATOM 646 CA ILE A 44 -2.450 0.295 3.462 1.00 0.00 C ATOM 647 C ILE A 44 -3.165 0.970 4.628 1.00 0.00 C ATOM 648 O ILE A 44 -4.390 1.102 4.627 1.00 0.00 O ATOM 649 CB ILE A 44 -2.065 1.364 2.422 1.00 0.00 C ATOM 650 CG1 ILE A 44 -1.948 0.736 1.032 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.760 2.041 2.816 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.434 1.692 -0.022 1.00 0.00 C ATOM 0 H ILE A 44 -3.872 -0.435 2.105 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.544 -0.189 3.826 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.849 2.120 2.393 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.282 -0.125 1.086 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.926 0.363 0.727 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.501 2.794 2.071 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.877 2.518 3.789 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.034 1.296 2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.377 1.179 -0.982 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.112 2.541 -0.105 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.442 2.046 0.260 1.00 0.00 H new ATOM 664 N THR A 45 -2.393 1.398 5.622 1.00 0.00 N ATOM 665 CA THR A 45 -2.952 2.060 6.793 1.00 0.00 C ATOM 666 C THR A 45 -2.159 3.312 7.148 1.00 0.00 C ATOM 667 O THR A 45 -1.190 3.252 7.904 1.00 0.00 O ATOM 668 CB THR A 45 -2.975 1.118 8.013 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.888 0.040 7.782 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.380 1.872 9.270 1.00 0.00 C ATOM 0 H THR A 45 -1.378 1.298 5.639 1.00 0.00 H new ATOM 0 HA THR A 45 -3.974 2.341 6.539 1.00 0.00 H new ATOM 0 HB THR A 45 -1.971 0.718 8.156 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.896 -0.555 8.561 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.389 1.187 10.118 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.666 2.674 9.459 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.375 2.296 9.135 1.00 0.00 H new ATOM 678 N ALA A 46 -2.577 4.447 6.597 1.00 0.00 N ATOM 679 CA ALA A 46 -1.907 5.715 6.857 1.00 0.00 C ATOM 680 C ALA A 46 -2.558 6.451 8.024 1.00 0.00 C ATOM 681 O ALA A 46 -3.713 6.870 7.941 1.00 0.00 O ATOM 682 CB ALA A 46 -1.920 6.585 5.609 1.00 0.00 C ATOM 0 H ALA A 46 -3.377 4.514 5.968 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.873 5.502 7.127 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.416 7.529 5.818 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.403 6.069 4.800 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.951 6.782 5.313 1.00 0.00 H new ATOM 688 N THR A 47 -1.811 6.604 9.112 1.00 0.00 N ATOM 689 CA THR A 47 -2.316 7.287 10.297 1.00 0.00 C ATOM 690 C THR A 47 -1.586 8.606 10.524 1.00 0.00 C ATOM 691 O THR A 47 -0.371 8.691 10.353 1.00 0.00 O ATOM 692 CB THR A 47 -2.172 6.410 11.555 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.814 5.979 11.699 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.088 5.199 11.478 1.00 0.00 C ATOM 0 H THR A 47 -0.853 6.264 9.198 1.00 0.00 H new ATOM 0 HA THR A 47 -3.373 7.486 10.121 1.00 0.00 H new ATOM 0 HB THR A 47 -2.457 7.007 12.421 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.731 5.423 12.502 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.969 4.595 12.377 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.123 5.530 11.398 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.830 4.602 10.603 1.00 0.00 H new ATOM 702 N ASN A 48 -2.336 9.633 10.910 1.00 0.00 N ATOM 703 CA ASN A 48 -1.760 10.949 11.161 1.00 0.00 C ATOM 704 C ASN A 48 -2.162 11.465 12.539 1.00 0.00 C ATOM 705 O ASN A 48 -3.343 11.482 12.887 1.00 0.00 O ATOM 706 CB ASN A 48 -2.207 11.938 10.083 1.00 0.00 C ATOM 707 CG ASN A 48 -1.549 13.296 10.236 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.446 13.407 10.773 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.224 14.337 9.764 1.00 0.00 N ATOM 0 H ASN A 48 -3.344 9.579 11.056 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.674 10.855 11.131 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.970 11.531 9.100 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.290 12.055 10.127 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -1.832 15.276 9.839 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.135 14.198 9.327 1.00 0.00 H new ATOM 716 N PHE A 49 -1.172 11.885 13.320 1.00 0.00 N ATOM 717 CA PHE A 49 -1.422 12.402 14.660 1.00 0.00 C ATOM 718 C PHE A 49 -0.935 13.843 14.787 1.00 0.00 C ATOM 719 O PHE A 49 -1.501 14.637 15.538 1.00 0.00 O ATOM 720 CB PHE A 49 -0.730 11.524 15.705 1.00 0.00 C ATOM 721 CG PHE A 49 -1.338 10.157 15.836 1.00 0.00 C ATOM 722 CD1 PHE A 49 -2.431 9.946 16.661 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.816 9.083 15.133 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.991 8.688 16.783 1.00 0.00 C ATOM 725 CE2 PHE A 49 -1.372 7.823 15.251 1.00 0.00 C ATOM 726 CZ PHE A 49 -2.462 7.626 16.076 1.00 0.00 C ATOM 0 H PHE A 49 -0.189 11.877 13.048 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.498 12.384 14.835 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.323 11.421 15.442 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.769 12.025 16.672 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.850 10.773 17.215 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.035 9.232 14.485 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.842 8.536 17.431 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.955 6.994 14.699 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.900 6.643 16.168 1.00 0.00 H new ATOM 736 N SER A 50 0.120 14.172 14.048 1.00 0.00 N ATOM 737 CA SER A 50 0.687 15.515 14.081 1.00 0.00 C ATOM 738 C SER A 50 -0.415 16.571 14.055 1.00 0.00 C ATOM 739 O SER A 50 -1.524 16.314 13.588 1.00 0.00 O ATOM 740 CB SER A 50 1.633 15.721 12.896 1.00 0.00 C ATOM 741 OG SER A 50 0.918 16.091 11.730 1.00 0.00 O ATOM 0 H SER A 50 0.599 13.527 13.419 1.00 0.00 H new ATOM 0 HA SER A 50 1.248 15.623 15.009 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.363 16.493 13.139 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.191 14.804 12.708 1.00 0.00 H new ATOM 0 HG SER A 50 0.473 15.302 11.355 1.00 0.00 H new ATOM 747 N GLU A 51 -0.099 17.758 14.562 1.00 0.00 N ATOM 748 CA GLU A 51 -1.062 18.853 14.598 1.00 0.00 C ATOM 749 C GLU A 51 -1.512 19.228 13.189 1.00 0.00 C ATOM 750 O GLU A 51 -2.596 19.778 12.998 1.00 0.00 O ATOM 751 CB GLU A 51 -0.455 20.073 15.294 1.00 0.00 C ATOM 752 CG GLU A 51 0.029 19.791 16.706 1.00 0.00 C ATOM 753 CD GLU A 51 0.116 21.045 17.555 1.00 0.00 C ATOM 754 OE1 GLU A 51 -0.946 21.608 17.893 1.00 0.00 O ATOM 755 OE2 GLU A 51 1.247 21.462 17.880 1.00 0.00 O ATOM 0 H GLU A 51 0.815 17.986 14.953 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.933 18.519 15.162 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.381 20.441 14.699 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.198 20.869 15.326 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.647 19.080 17.182 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.010 19.318 16.662 1.00 0.00 H new ATOM 762 N GLY A 52 -0.670 18.927 12.205 1.00 0.00 N ATOM 763 CA GLY A 52 -0.998 19.241 10.827 1.00 0.00 C ATOM 764 C GLY A 52 -1.844 18.166 10.173 1.00 0.00 C ATOM 765 O GLY A 52 -1.494 16.986 10.206 1.00 0.00 O ATOM 0 H GLY A 52 0.233 18.472 12.338 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.531 20.191 10.791 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.077 19.371 10.258 1.00 0.00 H new ATOM 769 N ASP A 53 -2.960 18.573 9.578 1.00 0.00 N ATOM 770 CA ASP A 53 -3.858 17.636 8.915 1.00 0.00 C ATOM 771 C ASP A 53 -3.380 17.336 7.497 1.00 0.00 C ATOM 772 O ASP A 53 -2.735 18.168 6.859 1.00 0.00 O ATOM 773 CB ASP A 53 -5.280 18.199 8.878 1.00 0.00 C ATOM 774 CG ASP A 53 -5.669 18.874 10.178 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.116 19.954 10.474 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.527 18.323 10.899 1.00 0.00 O ATOM 0 H ASP A 53 -3.264 19.546 9.542 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.858 16.706 9.484 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.363 18.916 8.061 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.982 17.392 8.667 1.00 0.00 H new ATOM 781 N VAL A 54 -3.700 16.141 7.011 1.00 0.00 N ATOM 782 CA VAL A 54 -3.303 15.730 5.670 1.00 0.00 C ATOM 783 C VAL A 54 -4.518 15.564 4.764 1.00 0.00 C ATOM 784 O VAL A 54 -5.489 14.898 5.125 1.00 0.00 O ATOM 785 CB VAL A 54 -2.512 14.408 5.698 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.276 13.897 4.285 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.194 14.592 6.434 1.00 0.00 C ATOM 0 H VAL A 54 -4.233 15.441 7.526 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.663 16.519 5.274 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.101 13.664 6.234 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.716 12.963 4.325 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.235 13.725 3.795 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.708 14.637 3.721 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.648 13.649 6.444 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.597 15.351 5.928 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.390 14.909 7.458 1.00 0.00 H new ATOM 797 N THR A 55 -4.457 16.172 3.583 1.00 0.00 N ATOM 798 CA THR A 55 -5.552 16.092 2.625 1.00 0.00 C ATOM 799 C THR A 55 -5.044 15.712 1.239 1.00 0.00 C ATOM 800 O THR A 55 -3.839 15.570 1.027 1.00 0.00 O ATOM 801 CB THR A 55 -6.315 17.428 2.531 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.402 18.494 2.250 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.059 17.718 3.826 1.00 0.00 C ATOM 0 H THR A 55 -3.660 16.725 3.268 1.00 0.00 H new ATOM 0 HA THR A 55 -6.230 15.319 2.985 1.00 0.00 H new ATOM 0 HB THR A 55 -7.042 17.351 1.723 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.894 19.339 2.190 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.590 18.666 3.736 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.774 16.919 4.022 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.347 17.778 4.649 1.00 0.00 H new ATOM 811 N HIS A 56 -5.968 15.549 0.299 1.00 0.00 N ATOM 812 CA HIS A 56 -5.613 15.186 -1.069 1.00 0.00 C ATOM 813 C HIS A 56 -4.519 14.123 -1.081 1.00 0.00 C ATOM 814 O HIS A 56 -3.550 14.223 -1.834 1.00 0.00 O ATOM 815 CB HIS A 56 -5.149 16.421 -1.842 1.00 0.00 C ATOM 816 CG HIS A 56 -5.356 16.314 -3.321 1.00 0.00 C ATOM 817 ND1 HIS A 56 -4.442 16.775 -4.245 1.00 0.00 N ATOM 818 CD2 HIS A 56 -6.380 15.792 -4.036 1.00 0.00 C ATOM 819 CE1 HIS A 56 -4.895 16.544 -5.464 1.00 0.00 C ATOM 820 NE2 HIS A 56 -6.069 15.947 -5.365 1.00 0.00 N ATOM 0 H HIS A 56 -6.969 15.662 0.459 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.500 14.776 -1.553 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.685 17.295 -1.471 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.090 16.588 -1.643 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.275 15.338 -3.636 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -4.391 16.800 -6.385 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -6.650 15.649 -6.148 1.00 0.00 H new ATOM 828 N PHE A 57 -4.681 13.105 -0.242 1.00 0.00 N ATOM 829 CA PHE A 57 -3.707 12.023 -0.156 1.00 0.00 C ATOM 830 C PHE A 57 -3.842 11.073 -1.342 1.00 0.00 C ATOM 831 O PHE A 57 -4.949 10.685 -1.717 1.00 0.00 O ATOM 832 CB PHE A 57 -3.885 11.251 1.153 1.00 0.00 C ATOM 833 CG PHE A 57 -3.157 9.938 1.178 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.841 9.851 0.753 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.789 8.789 1.626 1.00 0.00 C ATOM 836 CE1 PHE A 57 -1.168 8.644 0.776 1.00 0.00 C ATOM 837 CE2 PHE A 57 -3.121 7.579 1.651 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.809 7.506 1.224 1.00 0.00 C ATOM 0 H PHE A 57 -5.477 13.007 0.388 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.710 12.463 -0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -3.534 11.868 1.980 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.947 11.072 1.318 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.335 10.737 0.399 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.815 8.839 1.959 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.142 8.591 0.444 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.624 6.691 2.004 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.286 6.561 1.241 1.00 0.00 H new ATOM 848 N ILE A 58 -2.708 10.704 -1.929 1.00 0.00 N ATOM 849 CA ILE A 58 -2.699 9.800 -3.072 1.00 0.00 C ATOM 850 C ILE A 58 -1.585 8.767 -2.947 1.00 0.00 C ATOM 851 O ILE A 58 -0.410 9.117 -2.834 1.00 0.00 O ATOM 852 CB ILE A 58 -2.527 10.567 -4.396 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.769 11.412 -4.687 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.259 9.599 -5.539 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.539 12.488 -5.724 1.00 0.00 C ATOM 0 H ILE A 58 -1.784 11.017 -1.632 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.663 9.292 -3.079 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.670 11.234 -4.303 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.572 10.758 -5.026 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.107 11.878 -3.761 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.140 10.157 -6.468 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.348 9.037 -5.334 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.097 8.909 -5.635 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.462 13.047 -5.879 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.758 13.165 -5.378 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.231 12.028 -6.663 1.00 0.00 H new ATOM 867 N CYS A 59 -1.961 7.493 -2.971 1.00 0.00 N ATOM 868 CA CYS A 59 -0.992 6.408 -2.862 1.00 0.00 C ATOM 869 C CYS A 59 -0.903 5.625 -4.168 1.00 0.00 C ATOM 870 O CYS A 59 -1.806 4.860 -4.506 1.00 0.00 O ATOM 871 CB CYS A 59 -1.374 5.469 -1.716 1.00 0.00 C ATOM 872 SG CYS A 59 -0.021 4.415 -1.144 1.00 0.00 S ATOM 0 H CYS A 59 -2.929 7.186 -3.065 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.015 6.845 -2.654 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.736 6.064 -0.878 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.201 4.837 -2.039 1.00 0.00 H new ATOM 0 HG CYS A 59 -0.056 4.329 0.153 1.00 0.00 H new ATOM 878 N GLN A 60 0.190 5.824 -4.898 1.00 0.00 N ATOM 879 CA GLN A 60 0.395 5.138 -6.168 1.00 0.00 C ATOM 880 C GLN A 60 1.257 3.894 -5.982 1.00 0.00 C ATOM 881 O GLN A 60 2.080 3.827 -5.069 1.00 0.00 O ATOM 882 CB GLN A 60 1.050 6.080 -7.180 1.00 0.00 C ATOM 883 CG GLN A 60 0.223 7.319 -7.481 1.00 0.00 C ATOM 884 CD GLN A 60 0.961 8.315 -8.354 1.00 0.00 C ATOM 885 OE1 GLN A 60 1.475 7.966 -9.417 1.00 0.00 O ATOM 886 NE2 GLN A 60 1.018 9.565 -7.908 1.00 0.00 N ATOM 0 H GLN A 60 0.947 6.454 -4.632 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.579 4.829 -6.547 1.00 0.00 H new ATOM 0 HB2 GLN A 60 2.024 6.387 -6.800 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.226 5.537 -8.108 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -0.702 7.023 -7.976 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.057 7.800 -6.544 1.00 0.00 H new ATOM 0 HE21 GLN A 60 0.578 9.811 -7.021 1.00 0.00 H new ATOM 0 HE22 GLN A 60 1.502 10.279 -8.452 1.00 0.00 H new ATOM 895 N ALA A 61 1.062 2.909 -6.853 1.00 0.00 N ATOM 896 CA ALA A 61 1.822 1.667 -6.785 1.00 0.00 C ATOM 897 C ALA A 61 2.189 1.172 -8.180 1.00 0.00 C ATOM 898 O ALA A 61 1.530 1.510 -9.163 1.00 0.00 O ATOM 899 CB ALA A 61 1.032 0.605 -6.036 1.00 0.00 C ATOM 0 H ALA A 61 0.384 2.947 -7.614 1.00 0.00 H new ATOM 0 HA ALA A 61 2.747 1.864 -6.243 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.612 -0.317 -5.993 1.00 0.00 H new ATOM 0 HB2 ALA A 61 0.826 0.952 -5.023 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.091 0.418 -6.554 1.00 0.00 H new ATOM 905 N ALA A 62 3.245 0.369 -8.259 1.00 0.00 N ATOM 906 CA ALA A 62 3.699 -0.174 -9.533 1.00 0.00 C ATOM 907 C ALA A 62 4.240 -1.590 -9.365 1.00 0.00 C ATOM 908 O ALA A 62 5.168 -1.823 -8.591 1.00 0.00 O ATOM 909 CB ALA A 62 4.759 0.729 -10.144 1.00 0.00 C ATOM 0 H ALA A 62 3.802 0.080 -7.455 1.00 0.00 H new ATOM 0 HA ALA A 62 2.843 -0.218 -10.206 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.089 0.311 -11.095 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.340 1.722 -10.310 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.609 0.803 -9.466 1.00 0.00 H new ATOM 915 N VAL A 63 3.653 -2.533 -10.095 1.00 0.00 N ATOM 916 CA VAL A 63 4.076 -3.927 -10.028 1.00 0.00 C ATOM 917 C VAL A 63 4.669 -4.386 -11.355 1.00 0.00 C ATOM 918 O VAL A 63 4.305 -3.901 -12.427 1.00 0.00 O ATOM 919 CB VAL A 63 2.903 -4.852 -9.654 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.212 -4.356 -8.393 1.00 0.00 C ATOM 921 CG2 VAL A 63 1.917 -4.954 -10.807 1.00 0.00 C ATOM 0 H VAL A 63 2.883 -2.357 -10.740 1.00 0.00 H new ATOM 0 HA VAL A 63 4.839 -3.989 -9.252 1.00 0.00 H new ATOM 0 HB VAL A 63 3.298 -5.848 -9.455 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.386 -5.022 -8.145 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.926 -4.340 -7.569 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.828 -3.349 -8.560 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.095 -5.612 -10.525 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.526 -3.964 -11.040 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.422 -5.360 -11.683 1.00 0.00 H new ATOM 931 N PRO A 64 5.604 -5.345 -11.285 1.00 0.00 N ATOM 932 CA PRO A 64 6.267 -5.893 -12.472 1.00 0.00 C ATOM 933 C PRO A 64 5.325 -6.737 -13.324 1.00 0.00 C ATOM 934 O PRO A 64 4.466 -7.447 -12.801 1.00 0.00 O ATOM 935 CB PRO A 64 7.382 -6.762 -11.887 1.00 0.00 C ATOM 936 CG PRO A 64 6.897 -7.138 -10.529 1.00 0.00 C ATOM 937 CD PRO A 64 6.086 -5.969 -10.041 1.00 0.00 C ATOM 0 HA PRO A 64 6.625 -5.108 -13.137 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.560 -7.644 -12.502 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.323 -6.215 -11.834 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.292 -8.044 -10.568 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.732 -7.341 -9.859 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.260 -6.290 -9.406 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.690 -5.278 -9.453 1.00 0.00 H new ATOM 945 N LYS A 65 5.492 -6.655 -14.640 1.00 0.00 N ATOM 946 CA LYS A 65 4.658 -7.413 -15.566 1.00 0.00 C ATOM 947 C LYS A 65 4.286 -8.769 -14.977 1.00 0.00 C ATOM 948 O LYS A 65 3.139 -9.206 -15.076 1.00 0.00 O ATOM 949 CB LYS A 65 5.386 -7.605 -16.898 1.00 0.00 C ATOM 950 CG LYS A 65 4.454 -7.883 -18.065 1.00 0.00 C ATOM 951 CD LYS A 65 5.200 -7.875 -19.389 1.00 0.00 C ATOM 952 CE LYS A 65 4.496 -8.731 -20.431 1.00 0.00 C ATOM 953 NZ LYS A 65 5.037 -8.497 -21.798 1.00 0.00 N ATOM 0 H LYS A 65 6.197 -6.071 -15.089 1.00 0.00 H new ATOM 0 HA LYS A 65 3.742 -6.848 -15.738 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.970 -6.711 -17.115 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.091 -8.431 -16.802 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.972 -8.850 -17.924 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.664 -7.133 -18.087 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.284 -6.851 -19.754 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.214 -8.244 -19.238 1.00 0.00 H new ATOM 0 HE2 LYS A 65 4.607 -9.784 -20.172 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.428 -8.511 -20.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.531 -9.099 -22.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.908 -7.498 -22.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.050 -8.731 -21.815 1.00 0.00 H new ATOM 967 N SER A 66 5.261 -9.431 -14.363 1.00 0.00 N ATOM 968 CA SER A 66 5.036 -10.740 -13.760 1.00 0.00 C ATOM 969 C SER A 66 3.733 -10.755 -12.967 1.00 0.00 C ATOM 970 O SER A 66 2.903 -11.650 -13.131 1.00 0.00 O ATOM 971 CB SER A 66 6.206 -11.112 -12.847 1.00 0.00 C ATOM 972 OG SER A 66 6.081 -12.442 -12.375 1.00 0.00 O ATOM 0 H SER A 66 6.215 -9.082 -14.270 1.00 0.00 H new ATOM 0 HA SER A 66 4.962 -11.475 -14.562 1.00 0.00 H new ATOM 0 HB2 SER A 66 7.145 -11.002 -13.390 1.00 0.00 H new ATOM 0 HB3 SER A 66 6.245 -10.425 -12.002 1.00 0.00 H new ATOM 0 HG SER A 66 6.767 -13.003 -12.793 1.00 0.00 H new ATOM 978 N LEU A 67 3.560 -9.758 -12.107 1.00 0.00 N ATOM 979 CA LEU A 67 2.357 -9.655 -11.287 1.00 0.00 C ATOM 980 C LEU A 67 1.424 -8.574 -11.822 1.00 0.00 C ATOM 981 O LEU A 67 1.815 -7.764 -12.662 1.00 0.00 O ATOM 982 CB LEU A 67 2.731 -9.349 -9.835 1.00 0.00 C ATOM 983 CG LEU A 67 3.959 -10.079 -9.290 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.497 -9.370 -8.056 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.620 -11.527 -8.970 1.00 0.00 C ATOM 0 H LEU A 67 4.237 -9.009 -11.959 1.00 0.00 H new ATOM 0 HA LEU A 67 1.836 -10.611 -11.328 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.900 -8.276 -9.743 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.878 -9.593 -9.202 1.00 0.00 H new ATOM 0 HG LEU A 67 4.734 -10.069 -10.056 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.371 -9.904 -7.682 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.779 -8.350 -8.316 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.727 -9.348 -7.284 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.506 -12.031 -8.583 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.829 -11.558 -8.221 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.282 -12.030 -9.876 1.00 0.00 H new ATOM 997 N GLN A 68 0.190 -8.567 -11.329 1.00 0.00 N ATOM 998 CA GLN A 68 -0.799 -7.585 -11.757 1.00 0.00 C ATOM 999 C GLN A 68 -1.139 -6.625 -10.622 1.00 0.00 C ATOM 1000 O GLN A 68 -0.917 -6.930 -9.449 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.067 -8.286 -12.246 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.815 -7.511 -13.320 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.249 -7.975 -13.482 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -5.086 -7.759 -12.605 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -4.540 -8.616 -14.608 1.00 0.00 N ATOM 0 H GLN A 68 -0.149 -9.231 -10.633 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.371 -7.010 -12.578 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.801 -9.268 -12.637 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.732 -8.449 -11.398 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -2.806 -6.450 -13.070 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.293 -7.618 -14.271 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -3.815 -8.773 -15.308 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.489 -8.951 -14.773 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.680 -5.464 -10.977 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.051 -4.459 -9.988 1.00 0.00 C ATOM 1016 C LEU A 69 -3.434 -3.888 -10.285 1.00 0.00 C ATOM 1017 O LEU A 69 -3.760 -3.592 -11.434 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.017 -3.333 -9.963 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.182 -2.294 -8.853 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.238 -2.971 -7.492 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.048 -1.280 -8.899 1.00 0.00 C ATOM 0 H LEU A 69 -1.871 -5.196 -11.942 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.079 -4.940 -9.010 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.026 -3.779 -9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.047 -2.818 -10.923 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.122 -1.766 -9.013 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.356 -2.216 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.084 -3.658 -7.462 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.315 -3.525 -7.323 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.182 -0.548 -8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.904 -1.793 -8.765 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.053 -0.772 -9.863 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.242 -3.734 -9.240 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.589 -3.196 -9.390 1.00 0.00 C ATOM 1035 C GLN A 70 -5.932 -2.258 -8.238 1.00 0.00 C ATOM 1036 O GLN A 70 -5.780 -2.613 -7.068 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.610 -4.334 -9.459 1.00 0.00 C ATOM 1038 CG GLN A 70 -6.765 -4.929 -10.849 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.050 -5.718 -11.006 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -8.029 -6.943 -11.131 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -9.179 -5.019 -10.999 1.00 0.00 N ATOM 0 H GLN A 70 -3.987 -3.974 -8.282 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.625 -2.628 -10.319 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.311 -5.121 -8.767 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -7.578 -3.963 -9.121 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -6.743 -4.128 -11.588 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -5.916 -5.579 -11.058 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.150 -4.005 -10.893 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -10.075 -5.496 -11.100 1.00 0.00 H new ATOM 1050 N LEU A 71 -6.395 -1.060 -8.575 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.759 -0.069 -7.568 1.00 0.00 C ATOM 1052 C LEU A 71 -8.261 -0.092 -7.300 1.00 0.00 C ATOM 1053 O LEU A 71 -9.064 0.168 -8.196 1.00 0.00 O ATOM 1054 CB LEU A 71 -6.332 1.329 -8.021 1.00 0.00 C ATOM 1055 CG LEU A 71 -6.226 2.387 -6.922 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -5.184 3.433 -7.288 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -7.578 3.040 -6.678 1.00 0.00 C ATOM 0 H LEU A 71 -6.527 -0.751 -9.538 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.239 -0.319 -6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.364 1.249 -8.515 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.044 1.680 -8.768 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.911 1.897 -6.001 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.122 4.178 -6.495 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.214 2.952 -7.411 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.469 3.919 -8.221 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.483 3.790 -5.893 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.923 3.517 -7.596 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.298 2.282 -6.370 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.631 -0.403 -6.062 1.00 0.00 N ATOM 1070 CA GLN A 72 -10.036 -0.458 -5.677 1.00 0.00 C ATOM 1071 C GLN A 72 -10.526 0.908 -5.207 1.00 0.00 C ATOM 1072 O GLN A 72 -9.728 1.786 -4.881 1.00 0.00 O ATOM 1073 CB GLN A 72 -10.243 -1.495 -4.571 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.703 -1.717 -4.211 1.00 0.00 C ATOM 1075 CD GLN A 72 -12.532 -2.181 -5.392 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -13.531 -1.555 -5.748 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -12.121 -3.283 -6.008 1.00 0.00 N ATOM 0 H GLN A 72 -7.978 -0.621 -5.309 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.615 -0.750 -6.553 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.807 -2.443 -4.887 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.702 -1.177 -3.680 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.768 -2.457 -3.413 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -12.122 -0.790 -3.820 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.287 -3.770 -5.679 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.639 -3.642 -6.810 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.843 1.080 -5.177 1.00 0.00 N ATOM 1087 CA ALA A 73 -12.439 2.339 -4.746 1.00 0.00 C ATOM 1088 C ALA A 73 -12.040 2.673 -3.312 1.00 0.00 C ATOM 1089 O ALA A 73 -12.364 1.953 -2.368 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.954 2.276 -4.872 1.00 0.00 C ATOM 0 H ALA A 73 -12.518 0.364 -5.446 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.063 3.131 -5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.386 3.223 -4.547 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.225 2.091 -5.911 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.338 1.469 -4.248 1.00 0.00 H new ATOM 1096 N PRO A 74 -11.317 3.790 -3.144 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.857 4.245 -1.829 1.00 0.00 C ATOM 1098 C PRO A 74 -12.003 4.737 -0.952 1.00 0.00 C ATOM 1099 O PRO A 74 -13.170 4.661 -1.338 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.907 5.397 -2.164 1.00 0.00 C ATOM 1101 CG PRO A 74 -10.371 5.898 -3.488 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.893 4.696 -4.225 1.00 0.00 C ATOM 0 HA PRO A 74 -10.390 3.441 -1.260 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.952 6.180 -1.407 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.873 5.056 -2.210 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -11.150 6.652 -3.369 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -9.554 6.367 -4.036 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -11.724 4.956 -4.880 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -10.124 4.243 -4.850 1.00 0.00 H new ATOM 1110 N SER A 75 -11.664 5.243 0.229 1.00 0.00 N ATOM 1111 CA SER A 75 -12.666 5.746 1.162 1.00 0.00 C ATOM 1112 C SER A 75 -12.710 7.271 1.143 1.00 0.00 C ATOM 1113 O SER A 75 -13.776 7.873 1.261 1.00 0.00 O ATOM 1114 CB SER A 75 -12.368 5.251 2.579 1.00 0.00 C ATOM 1115 OG SER A 75 -13.425 5.574 3.465 1.00 0.00 O ATOM 0 H SER A 75 -10.703 5.316 0.563 1.00 0.00 H new ATOM 0 HA SER A 75 -13.639 5.368 0.849 1.00 0.00 H new ATOM 0 HB2 SER A 75 -12.217 4.172 2.566 1.00 0.00 H new ATOM 0 HB3 SER A 75 -11.440 5.698 2.936 1.00 0.00 H new ATOM 0 HG SER A 75 -13.211 5.246 4.363 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.543 7.889 0.992 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.469 9.338 0.959 1.00 0.00 C ATOM 1123 C GLY A 76 -10.046 9.843 0.832 1.00 0.00 C ATOM 1124 O GLY A 76 -9.098 9.147 1.193 1.00 0.00 O ATOM 0 H GLY A 76 -10.647 7.412 0.892 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.059 9.710 0.122 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.915 9.742 1.868 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.895 11.059 0.316 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.576 11.656 0.140 1.00 0.00 C ATOM 1130 C ASN A 77 -8.286 12.668 1.243 1.00 0.00 C ATOM 1131 O ASN A 77 -7.726 13.736 0.991 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.480 12.335 -1.228 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.578 11.344 -2.373 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -9.174 10.276 -2.235 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -7.991 11.696 -3.511 1.00 0.00 N ATOM 0 H ASN A 77 -10.669 11.650 0.013 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.833 10.860 0.197 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.276 13.073 -1.321 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.535 12.874 -1.298 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.023 11.071 -4.316 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.508 12.592 -3.580 1.00 0.00 H new ATOM 1142 N THR A 78 -8.670 12.326 2.469 1.00 0.00 N ATOM 1143 CA THR A 78 -8.452 13.204 3.612 1.00 0.00 C ATOM 1144 C THR A 78 -8.174 12.401 4.877 1.00 0.00 C ATOM 1145 O THR A 78 -8.749 11.332 5.085 1.00 0.00 O ATOM 1146 CB THR A 78 -9.666 14.120 3.856 1.00 0.00 C ATOM 1147 OG1 THR A 78 -9.918 14.919 2.694 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.429 15.024 5.057 1.00 0.00 C ATOM 0 H THR A 78 -9.134 11.446 2.696 1.00 0.00 H new ATOM 0 HA THR A 78 -7.583 13.819 3.377 1.00 0.00 H new ATOM 0 HB THR A 78 -10.533 13.491 4.060 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.692 15.497 2.856 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.300 15.662 5.210 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.266 14.414 5.945 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.551 15.645 4.877 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.289 12.922 5.721 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.935 12.253 6.968 1.00 0.00 C ATOM 1158 C VAL A 79 -6.919 13.237 8.133 1.00 0.00 C ATOM 1159 O VAL A 79 -6.261 14.276 8.091 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.558 11.570 6.868 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.197 10.903 8.185 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.546 10.562 5.728 1.00 0.00 C ATOM 0 H VAL A 79 -6.804 13.805 5.564 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.696 11.494 7.147 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.807 12.332 6.657 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.221 10.426 8.096 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.163 11.653 8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.947 10.151 8.430 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.566 10.089 5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.306 9.802 5.907 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.757 11.073 4.788 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.661 12.902 9.199 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.748 13.742 10.398 1.00 0.00 C ATOM 1174 C PRO A 80 -6.443 13.762 11.187 1.00 0.00 C ATOM 1175 O PRO A 80 -5.812 12.725 11.387 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.858 13.078 11.216 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.859 11.657 10.770 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.470 11.678 9.318 1.00 0.00 C ATOM 0 HA PRO A 80 -7.947 14.785 10.152 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.663 13.157 12.285 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.822 13.551 11.032 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.155 11.064 11.354 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.843 11.207 10.904 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.900 10.791 9.042 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.345 11.710 8.668 1.00 0.00 H new ATOM 1186 N ALA A 81 -6.046 14.949 11.635 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.818 15.103 12.405 1.00 0.00 C ATOM 1188 C ALA A 81 -5.085 14.952 13.899 1.00 0.00 C ATOM 1189 O ALA A 81 -4.205 15.199 14.724 1.00 0.00 O ATOM 1190 CB ALA A 81 -4.179 16.452 12.115 1.00 0.00 C ATOM 0 H ALA A 81 -6.557 15.818 11.478 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.128 14.315 12.104 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.263 16.553 12.697 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.944 16.522 11.053 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.871 17.249 12.387 1.00 0.00 H new ATOM 1196 N ARG A 82 -6.304 14.546 14.240 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.686 14.365 15.635 1.00 0.00 C ATOM 1198 C ARG A 82 -6.983 12.898 15.931 1.00 0.00 C ATOM 1199 O ARG A 82 -8.029 12.565 16.486 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.910 15.221 15.966 1.00 0.00 C ATOM 1201 CG ARG A 82 -9.106 14.946 15.069 1.00 0.00 C ATOM 1202 CD ARG A 82 -9.089 15.831 13.832 1.00 0.00 C ATOM 1203 NE ARG A 82 -10.436 16.121 13.348 1.00 0.00 N ATOM 1204 CZ ARG A 82 -11.235 17.030 13.897 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -10.823 17.733 14.943 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -12.447 17.237 13.400 1.00 0.00 N ATOM 0 H ARG A 82 -7.043 14.336 13.569 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.850 14.682 16.259 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.196 15.045 17.003 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.640 16.274 15.884 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -9.104 13.898 14.768 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -10.027 15.116 15.627 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.577 16.766 14.062 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.518 15.341 13.043 1.00 0.00 H new ATOM 0 HE ARG A 82 -10.783 15.597 12.544 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.891 17.577 15.328 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -11.438 18.430 15.363 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -12.767 16.698 12.595 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -13.059 17.935 13.823 1.00 0.00 H new ATOM 1220 N GLY A 83 -6.054 12.024 15.555 1.00 0.00 N ATOM 1221 CA GLY A 83 -6.235 10.603 15.788 1.00 0.00 C ATOM 1222 C GLY A 83 -7.626 10.128 15.421 1.00 0.00 C ATOM 1223 O GLY A 83 -8.287 9.451 16.208 1.00 0.00 O ATOM 0 H GLY A 83 -5.180 12.275 15.093 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.499 10.046 15.207 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -6.045 10.383 16.838 1.00 0.00 H new ATOM 1227 N GLY A 84 -8.075 10.485 14.221 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.395 10.083 13.773 1.00 0.00 C ATOM 1229 C GLY A 84 -9.413 8.677 13.207 1.00 0.00 C ATOM 1230 O GLY A 84 -9.234 7.703 13.939 1.00 0.00 O ATOM 0 H GLY A 84 -7.548 11.045 13.552 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.093 10.144 14.608 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.746 10.782 13.013 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.631 8.569 11.901 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.673 7.271 11.237 1.00 0.00 C ATOM 1236 C LEU A 85 -8.825 7.280 9.969 1.00 0.00 C ATOM 1237 O LEU A 85 -9.054 8.062 9.046 1.00 0.00 O ATOM 1238 CB LEU A 85 -11.116 6.897 10.897 1.00 0.00 C ATOM 1239 CG LEU A 85 -12.088 6.832 12.075 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.643 8.213 12.387 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.218 5.855 11.781 1.00 0.00 C ATOM 0 H LEU A 85 -9.781 9.365 11.281 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.263 6.527 11.920 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.498 7.621 10.177 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.111 5.926 10.402 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.544 6.476 12.950 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.333 8.146 13.228 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.824 8.885 12.642 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -13.171 8.599 11.515 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.900 5.822 12.630 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.760 6.182 10.893 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.804 4.861 11.609 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.824 6.390 9.920 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.924 6.274 8.768 1.00 0.00 C ATOM 1255 C PRO A 86 -7.623 5.701 7.541 1.00 0.00 C ATOM 1256 O PRO A 86 -8.705 5.123 7.645 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.839 5.313 9.262 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.501 4.508 10.326 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.493 5.427 10.984 1.00 0.00 C ATOM 0 HA PRO A 86 -6.542 7.244 8.450 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.475 4.678 8.454 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.978 5.855 9.654 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.999 3.636 9.903 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.772 4.140 11.048 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.376 4.887 11.326 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.065 5.922 11.856 1.00 0.00 H new ATOM 1267 N ILE A 87 -7.000 5.866 6.379 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.563 5.364 5.132 1.00 0.00 C ATOM 1269 C ILE A 87 -7.041 3.966 4.817 1.00 0.00 C ATOM 1270 O ILE A 87 -5.993 3.554 5.316 1.00 0.00 O ATOM 1271 CB ILE A 87 -7.239 6.298 3.952 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.693 7.726 4.264 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.902 5.793 2.679 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.960 8.781 3.465 1.00 0.00 C ATOM 0 H ILE A 87 -6.105 6.344 6.275 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.644 5.324 5.267 1.00 0.00 H new ATOM 0 HB ILE A 87 -6.160 6.304 3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.762 7.810 4.067 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.548 7.921 5.327 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.664 6.464 1.854 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.536 4.792 2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.982 5.761 2.820 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.333 9.768 3.738 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.893 8.724 3.680 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.125 8.612 2.401 1.00 0.00 H new ATOM 1286 N THR A 88 -7.779 3.239 3.983 1.00 0.00 N ATOM 1287 CA THR A 88 -7.391 1.887 3.600 1.00 0.00 C ATOM 1288 C THR A 88 -7.667 1.634 2.122 1.00 0.00 C ATOM 1289 O THR A 88 -8.808 1.723 1.671 1.00 0.00 O ATOM 1290 CB THR A 88 -8.136 0.831 4.438 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.551 1.001 4.296 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.752 0.935 5.906 1.00 0.00 C ATOM 0 H THR A 88 -8.648 3.564 3.560 1.00 0.00 H new ATOM 0 HA THR A 88 -6.321 1.800 3.787 1.00 0.00 H new ATOM 0 HB THR A 88 -7.851 -0.156 4.074 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.746 1.401 3.423 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.291 0.179 6.477 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.679 0.775 6.014 1.00 0.00 H new ATOM 0 HG23 THR A 88 -8.010 1.926 6.280 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.615 1.319 1.374 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.745 1.053 -0.053 1.00 0.00 C ATOM 1302 C GLN A 89 -6.519 -0.425 -0.355 1.00 0.00 C ATOM 1303 O GLN A 89 -5.579 -1.037 0.154 1.00 0.00 O ATOM 1304 CB GLN A 89 -5.751 1.904 -0.845 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.033 1.939 -2.338 1.00 0.00 C ATOM 1306 CD GLN A 89 -6.964 3.070 -2.730 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -6.627 4.245 -2.583 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -8.142 2.720 -3.233 1.00 0.00 N ATOM 0 H GLN A 89 -5.663 1.242 1.733 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.759 1.316 -0.354 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.768 2.922 -0.457 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -4.745 1.517 -0.683 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.093 2.044 -2.879 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.473 0.989 -2.643 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -8.379 1.733 -3.337 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.810 3.438 -3.515 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.388 -0.994 -1.184 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.284 -2.401 -1.553 1.00 0.00 C ATOM 1319 C LEU A 90 -6.545 -2.564 -2.877 1.00 0.00 C ATOM 1320 O LEU A 90 -6.660 -1.725 -3.771 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.676 -3.027 -1.653 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.792 -4.268 -2.538 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -8.095 -5.454 -1.890 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.254 -4.592 -2.813 1.00 0.00 C ATOM 0 H LEU A 90 -8.172 -0.502 -1.613 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.717 -2.913 -0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.007 -3.290 -0.648 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.366 -2.272 -2.029 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.301 -4.059 -3.488 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.188 -6.328 -2.535 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.040 -5.221 -1.745 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.556 -5.664 -0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.318 -5.478 -3.444 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.768 -4.780 -1.871 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.724 -3.750 -3.321 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.787 -3.649 -2.997 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.029 -3.922 -4.212 1.00 0.00 C ATOM 1338 C PHE A 91 -5.071 -5.408 -4.556 1.00 0.00 C ATOM 1339 O PHE A 91 -4.639 -6.251 -3.770 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.578 -3.466 -4.048 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.439 -1.993 -3.789 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.304 -1.101 -4.841 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.443 -1.500 -2.494 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.175 0.255 -4.607 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.316 -0.145 -2.254 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.180 0.733 -3.311 1.00 0.00 C ATOM 0 H PHE A 91 -5.681 -4.354 -2.267 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.487 -3.364 -5.029 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.123 -4.016 -3.224 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.021 -3.723 -4.949 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.300 -1.470 -5.856 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.547 -2.182 -1.663 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.070 0.940 -5.436 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.323 0.227 -1.240 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.078 1.792 -3.125 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.595 -5.722 -5.737 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.695 -7.106 -6.185 1.00 0.00 C ATOM 1358 C ARG A 92 -4.533 -7.464 -7.106 1.00 0.00 C ATOM 1359 O ARG A 92 -4.488 -7.036 -8.260 1.00 0.00 O ATOM 1360 CB ARG A 92 -7.023 -7.334 -6.909 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.174 -7.678 -5.977 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.366 -8.229 -6.743 1.00 0.00 C ATOM 1363 NE ARG A 92 -10.204 -9.086 -5.909 1.00 0.00 N ATOM 1364 CZ ARG A 92 -11.227 -9.794 -6.377 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.535 -9.747 -7.666 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -11.942 -10.551 -5.555 1.00 0.00 N ATOM 0 H ARG A 92 -5.957 -5.037 -6.400 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.652 -7.751 -5.307 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.279 -6.437 -7.472 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.899 -8.140 -7.632 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.842 -8.411 -5.242 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.475 -6.788 -5.425 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.963 -7.402 -7.128 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.013 -8.795 -7.605 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.993 -9.145 -4.913 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.986 -9.167 -8.301 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.320 -10.291 -8.023 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.707 -10.590 -4.563 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.727 -11.094 -5.915 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.596 -8.251 -6.589 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.434 -8.667 -7.365 1.00 0.00 C ATOM 1382 C ILE A 93 -2.538 -10.135 -7.765 1.00 0.00 C ATOM 1383 O ILE A 93 -3.184 -10.932 -7.083 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.127 -8.452 -6.580 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.816 -6.958 -6.464 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.023 -9.186 -7.255 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.028 -6.600 -5.223 1.00 0.00 C ATOM 0 H ILE A 93 -3.619 -8.614 -5.636 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.415 -8.048 -8.262 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.253 -8.857 -5.576 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.256 -6.642 -7.344 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.752 -6.399 -6.464 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.940 -9.025 -6.689 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.198 -10.253 -7.292 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.151 -8.807 -8.269 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.156 -5.526 -5.206 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.596 -6.885 -4.337 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.924 -7.131 -5.230 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.896 -10.487 -8.874 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.914 -11.860 -9.365 1.00 0.00 C ATOM 1401 C LEU A 94 -0.507 -12.449 -9.387 1.00 0.00 C ATOM 1402 O LEU A 94 0.395 -11.903 -10.021 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.523 -11.913 -10.768 1.00 0.00 C ATOM 1404 CG LEU A 94 -4.036 -12.130 -10.834 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.384 -13.569 -10.486 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.755 -11.165 -9.903 1.00 0.00 C ATOM 0 H LEU A 94 -1.357 -9.840 -9.450 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.526 -12.454 -8.687 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.287 -10.980 -11.281 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.036 -12.714 -11.324 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.368 -11.934 -11.854 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.464 -13.705 -10.538 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.899 -14.242 -11.193 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.038 -13.793 -9.477 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.830 -11.334 -9.963 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.419 -11.329 -8.879 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.532 -10.140 -10.199 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.328 -13.567 -8.692 1.00 0.00 N ATOM 1419 CA ASN A 95 0.969 -14.231 -8.633 1.00 0.00 C ATOM 1420 C ASN A 95 0.855 -15.687 -9.077 1.00 0.00 C ATOM 1421 O ASN A 95 1.409 -16.595 -8.458 1.00 0.00 O ATOM 1422 CB ASN A 95 1.537 -14.162 -7.214 1.00 0.00 C ATOM 1423 CG ASN A 95 2.905 -14.806 -7.107 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.159 -15.606 -6.206 1.00 0.00 O ATOM 1425 ND2 ASN A 95 3.796 -14.458 -8.028 1.00 0.00 N ATOM 0 H ASN A 95 -1.065 -14.032 -8.162 1.00 0.00 H new ATOM 0 HA ASN A 95 1.646 -13.714 -9.313 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.604 -13.120 -6.903 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.851 -14.657 -6.526 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.734 -14.858 -8.007 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.542 -13.791 -8.757 1.00 0.00 H new ATOM 1432 N PRO A 96 0.121 -15.914 -10.176 1.00 0.00 N ATOM 1433 CA PRO A 96 -0.081 -17.257 -10.729 1.00 0.00 C ATOM 1434 C PRO A 96 1.192 -17.830 -11.341 1.00 0.00 C ATOM 1435 O PRO A 96 1.343 -19.045 -11.459 1.00 0.00 O ATOM 1436 CB PRO A 96 -1.144 -17.040 -11.809 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.993 -15.612 -12.207 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.567 -14.879 -10.965 1.00 0.00 C ATOM 0 HA PRO A 96 -0.374 -17.974 -9.962 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.988 -17.706 -12.658 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.145 -17.241 -11.426 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.251 -15.504 -12.998 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.931 -15.213 -12.593 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.095 -14.045 -11.198 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.422 -14.467 -10.429 1.00 0.00 H new ATOM 1446 N ASN A 97 2.106 -16.946 -11.729 1.00 0.00 N ATOM 1447 CA ASN A 97 3.367 -17.365 -12.330 1.00 0.00 C ATOM 1448 C ASN A 97 4.328 -17.892 -11.268 1.00 0.00 C ATOM 1449 O ASN A 97 5.382 -18.442 -11.586 1.00 0.00 O ATOM 1450 CB ASN A 97 4.011 -16.198 -13.081 1.00 0.00 C ATOM 1451 CG ASN A 97 3.487 -16.063 -14.498 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.233 -16.221 -15.465 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.199 -15.769 -14.627 1.00 0.00 N ATOM 0 H ASN A 97 1.997 -15.936 -11.638 1.00 0.00 H new ATOM 0 HA ASN A 97 3.155 -18.169 -13.034 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.824 -15.272 -12.537 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.092 -16.339 -13.108 1.00 0.00 H new ATOM 0 HD21 ASN A 97 1.790 -15.665 -15.556 1.00 0.00 H new ATOM 0 HD22 ASN A 97 1.618 -15.647 -13.797 1.00 0.00 H new ATOM 1460 N LYS A 98 3.955 -17.721 -10.004 1.00 0.00 N ATOM 1461 CA LYS A 98 4.780 -18.180 -8.894 1.00 0.00 C ATOM 1462 C LYS A 98 6.142 -17.493 -8.907 1.00 0.00 C ATOM 1463 O LYS A 98 7.148 -18.079 -8.508 1.00 0.00 O ATOM 1464 CB LYS A 98 4.963 -19.698 -8.961 1.00 0.00 C ATOM 1465 CG LYS A 98 3.684 -20.476 -8.704 1.00 0.00 C ATOM 1466 CD LYS A 98 3.941 -21.973 -8.659 1.00 0.00 C ATOM 1467 CE LYS A 98 2.703 -22.764 -9.053 1.00 0.00 C ATOM 1468 NZ LYS A 98 1.845 -23.074 -7.877 1.00 0.00 N ATOM 0 H LYS A 98 3.086 -17.267 -9.723 1.00 0.00 H new ATOM 0 HA LYS A 98 4.271 -17.922 -7.965 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.350 -19.966 -9.944 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.714 -19.998 -8.230 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.244 -20.153 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.959 -20.254 -9.487 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.762 -22.222 -9.331 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.253 -22.260 -7.655 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.127 -22.196 -9.783 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.004 -23.693 -9.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 1.012 -23.614 -8.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.387 -23.638 -7.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.536 -22.188 -7.429 1.00 0.00 H new ATOM 1482 N ALA A 99 6.166 -16.247 -9.369 1.00 0.00 N ATOM 1483 CA ALA A 99 7.404 -15.479 -9.431 1.00 0.00 C ATOM 1484 C ALA A 99 7.413 -14.368 -8.387 1.00 0.00 C ATOM 1485 O ALA A 99 6.752 -13.340 -8.533 1.00 0.00 O ATOM 1486 CB ALA A 99 7.596 -14.899 -10.824 1.00 0.00 C ATOM 0 H ALA A 99 5.343 -15.748 -9.706 1.00 0.00 H new ATOM 0 HA ALA A 99 8.232 -16.153 -9.213 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.524 -14.328 -10.856 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.643 -15.709 -11.552 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.759 -14.244 -11.064 1.00 0.00 H new ATOM 1492 N PRO A 100 8.180 -14.576 -7.306 1.00 0.00 N ATOM 1493 CA PRO A 100 8.294 -13.602 -6.216 1.00 0.00 C ATOM 1494 C PRO A 100 9.055 -12.349 -6.636 1.00 0.00 C ATOM 1495 O PRO A 100 10.242 -12.410 -6.959 1.00 0.00 O ATOM 1496 CB PRO A 100 9.071 -14.364 -5.140 1.00 0.00 C ATOM 1497 CG PRO A 100 9.848 -15.391 -5.888 1.00 0.00 C ATOM 1498 CD PRO A 100 8.996 -15.778 -7.066 1.00 0.00 C ATOM 0 HA PRO A 100 7.319 -13.245 -5.885 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.730 -13.699 -4.582 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.398 -14.826 -4.418 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.808 -14.992 -6.215 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.060 -16.255 -5.259 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.603 -16.032 -7.935 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.376 -16.647 -6.845 1.00 0.00 H new ATOM 1506 N LEU A 101 8.365 -11.214 -6.628 1.00 0.00 N ATOM 1507 CA LEU A 101 8.976 -9.945 -7.008 1.00 0.00 C ATOM 1508 C LEU A 101 8.693 -8.870 -5.962 1.00 0.00 C ATOM 1509 O LEU A 101 8.084 -9.142 -4.927 1.00 0.00 O ATOM 1510 CB LEU A 101 8.455 -9.493 -8.373 1.00 0.00 C ATOM 1511 CG LEU A 101 9.052 -10.204 -9.588 1.00 0.00 C ATOM 1512 CD1 LEU A 101 8.289 -11.485 -9.885 1.00 0.00 C ATOM 1513 CD2 LEU A 101 9.046 -9.284 -10.800 1.00 0.00 C ATOM 0 H LEU A 101 7.382 -11.146 -6.363 1.00 0.00 H new ATOM 0 HA LEU A 101 10.054 -10.093 -7.069 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.374 -9.631 -8.391 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.641 -8.424 -8.475 1.00 0.00 H new ATOM 0 HG LEU A 101 10.085 -10.466 -9.361 1.00 0.00 H new ATOM 0 HD11 LEU A 101 8.728 -11.977 -10.753 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.345 -12.150 -9.023 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.246 -11.247 -10.092 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.474 -9.806 -11.655 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.021 -8.991 -11.029 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.638 -8.394 -10.584 1.00 0.00 H new ATOM 1525 N ARG A 102 9.138 -7.649 -6.241 1.00 0.00 N ATOM 1526 CA ARG A 102 8.933 -6.534 -5.325 1.00 0.00 C ATOM 1527 C ARG A 102 7.835 -5.605 -5.837 1.00 0.00 C ATOM 1528 O ARG A 102 7.280 -5.819 -6.916 1.00 0.00 O ATOM 1529 CB ARG A 102 10.234 -5.750 -5.141 1.00 0.00 C ATOM 1530 CG ARG A 102 11.364 -6.577 -4.549 1.00 0.00 C ATOM 1531 CD ARG A 102 12.669 -5.798 -4.524 1.00 0.00 C ATOM 1532 NE ARG A 102 13.785 -6.614 -4.052 1.00 0.00 N ATOM 1533 CZ ARG A 102 14.461 -7.454 -4.828 1.00 0.00 C ATOM 1534 NH1 ARG A 102 14.137 -7.587 -6.107 1.00 0.00 N ATOM 1535 NH2 ARG A 102 15.464 -8.162 -4.325 1.00 0.00 N ATOM 0 H ARG A 102 9.643 -7.407 -7.094 1.00 0.00 H new ATOM 0 HA ARG A 102 8.623 -6.940 -4.362 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.551 -5.356 -6.107 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.044 -4.894 -4.494 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.101 -6.882 -3.536 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.494 -7.488 -5.133 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.889 -5.427 -5.525 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.559 -4.927 -3.879 1.00 0.00 H new ATOM 0 HE ARG A 102 14.060 -6.534 -3.073 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.367 -7.044 -6.497 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.658 -8.233 -6.701 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.716 -8.062 -3.342 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.983 -8.807 -4.921 1.00 0.00 H new ATOM 1549 N LEU A 103 7.528 -4.575 -5.057 1.00 0.00 N ATOM 1550 CA LEU A 103 6.496 -3.613 -5.431 1.00 0.00 C ATOM 1551 C LEU A 103 7.003 -2.183 -5.274 1.00 0.00 C ATOM 1552 O LEU A 103 7.735 -1.871 -4.334 1.00 0.00 O ATOM 1553 CB LEU A 103 5.245 -3.820 -4.577 1.00 0.00 C ATOM 1554 CG LEU A 103 4.253 -2.656 -4.546 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.332 -2.707 -5.754 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.446 -2.677 -3.256 1.00 0.00 C ATOM 0 H LEU A 103 7.978 -4.384 -4.162 1.00 0.00 H new ATOM 0 HA LEU A 103 6.244 -3.776 -6.479 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.724 -4.706 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.558 -4.032 -3.555 1.00 0.00 H new ATOM 0 HG LEU A 103 4.816 -1.723 -4.584 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.633 -1.871 -5.714 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.925 -2.642 -6.666 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.776 -3.645 -5.749 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.746 -1.842 -3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.894 -3.614 -3.188 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.120 -2.590 -2.404 1.00 0.00 H new ATOM 1568 N LYS A 104 6.607 -1.316 -6.199 1.00 0.00 N ATOM 1569 CA LYS A 104 7.016 0.083 -6.163 1.00 0.00 C ATOM 1570 C LYS A 104 5.925 0.954 -5.550 1.00 0.00 C ATOM 1571 O LYS A 104 4.847 1.113 -6.125 1.00 0.00 O ATOM 1572 CB LYS A 104 7.345 0.576 -7.574 1.00 0.00 C ATOM 1573 CG LYS A 104 8.108 1.889 -7.597 1.00 0.00 C ATOM 1574 CD LYS A 104 8.852 2.080 -8.908 1.00 0.00 C ATOM 1575 CE LYS A 104 9.155 3.547 -9.169 1.00 0.00 C ATOM 1576 NZ LYS A 104 10.448 3.963 -8.560 1.00 0.00 N ATOM 0 H LYS A 104 6.002 -1.558 -6.984 1.00 0.00 H new ATOM 0 HA LYS A 104 7.908 0.159 -5.541 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.932 -0.185 -8.088 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.417 0.695 -8.134 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.414 2.716 -7.448 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.816 1.914 -6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.783 1.514 -8.885 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.256 1.679 -9.728 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.186 3.726 -10.244 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.350 4.161 -8.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 10.618 4.969 -8.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.410 3.816 -7.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 11.220 3.394 -8.963 1.00 0.00 H new ATOM 1590 N LEU A 105 6.210 1.518 -4.382 1.00 0.00 N ATOM 1591 CA LEU A 105 5.253 2.375 -3.691 1.00 0.00 C ATOM 1592 C LEU A 105 5.634 3.845 -3.837 1.00 0.00 C ATOM 1593 O LEU A 105 6.795 4.215 -3.665 1.00 0.00 O ATOM 1594 CB LEU A 105 5.179 2.001 -2.210 1.00 0.00 C ATOM 1595 CG LEU A 105 4.288 0.807 -1.864 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.469 0.411 -0.407 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.829 1.128 -2.154 1.00 0.00 C ATOM 0 H LEU A 105 7.097 1.397 -3.893 1.00 0.00 H new ATOM 0 HA LEU A 105 4.274 2.225 -4.147 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.189 1.790 -1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.823 2.868 -1.654 1.00 0.00 H new ATOM 0 HG LEU A 105 4.584 -0.036 -2.488 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.827 -0.440 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.510 0.139 -0.231 1.00 0.00 H new ATOM 0 HD13 LEU A 105 4.200 1.250 0.234 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.210 0.267 -1.902 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.519 1.985 -1.556 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.711 1.362 -3.212 1.00 0.00 H new ATOM 1609 N ARG A 106 4.648 4.678 -4.154 1.00 0.00 N ATOM 1610 CA ARG A 106 4.880 6.108 -4.321 1.00 0.00 C ATOM 1611 C ARG A 106 3.848 6.921 -3.545 1.00 0.00 C ATOM 1612 O ARG A 106 2.642 6.763 -3.740 1.00 0.00 O ATOM 1613 CB ARG A 106 4.830 6.484 -5.804 1.00 0.00 C ATOM 1614 CG ARG A 106 4.849 7.983 -6.053 1.00 0.00 C ATOM 1615 CD ARG A 106 5.203 8.303 -7.497 1.00 0.00 C ATOM 1616 NE ARG A 106 5.049 9.724 -7.795 1.00 0.00 N ATOM 1617 CZ ARG A 106 5.677 10.338 -8.792 1.00 0.00 C ATOM 1618 NH1 ARG A 106 6.496 9.658 -9.582 1.00 0.00 N ATOM 1619 NH2 ARG A 106 5.485 11.634 -9.001 1.00 0.00 N ATOM 0 H ARG A 106 3.681 4.387 -4.300 1.00 0.00 H new ATOM 0 HA ARG A 106 5.870 6.338 -3.927 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.679 6.029 -6.314 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.928 6.062 -6.247 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.873 8.405 -5.814 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.572 8.455 -5.387 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.232 8.001 -7.694 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.566 7.721 -8.164 1.00 0.00 H new ATOM 0 HE ARG A 106 4.425 10.275 -7.206 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.645 8.661 -9.425 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.977 10.132 -10.347 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.855 12.160 -8.396 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.968 12.104 -9.767 1.00 0.00 H new ATOM 1633 N LEU A 107 4.330 7.790 -2.663 1.00 0.00 N ATOM 1634 CA LEU A 107 3.450 8.628 -1.856 1.00 0.00 C ATOM 1635 C LEU A 107 3.541 10.088 -2.288 1.00 0.00 C ATOM 1636 O LEU A 107 4.631 10.612 -2.517 1.00 0.00 O ATOM 1637 CB LEU A 107 3.808 8.499 -0.374 1.00 0.00 C ATOM 1638 CG LEU A 107 3.581 7.124 0.254 1.00 0.00 C ATOM 1639 CD1 LEU A 107 4.139 7.084 1.668 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.099 6.775 0.253 1.00 0.00 C ATOM 0 H LEU A 107 5.325 7.933 -2.489 1.00 0.00 H new ATOM 0 HA LEU A 107 2.426 8.287 -2.007 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.858 8.764 -0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.226 9.232 0.185 1.00 0.00 H new ATOM 0 HG LEU A 107 4.109 6.381 -0.344 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.968 6.097 2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.209 7.288 1.643 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.640 7.837 2.277 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.956 5.793 0.704 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.549 7.521 0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.729 6.761 -0.772 1.00 0.00 H new ATOM 1652 N THR A 108 2.388 10.741 -2.395 1.00 0.00 N ATOM 1653 CA THR A 108 2.337 12.141 -2.798 1.00 0.00 C ATOM 1654 C THR A 108 1.185 12.868 -2.115 1.00 0.00 C ATOM 1655 O THR A 108 0.017 12.624 -2.419 1.00 0.00 O ATOM 1656 CB THR A 108 2.185 12.281 -4.325 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.200 11.359 -4.805 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.511 12.026 -5.026 1.00 0.00 C ATOM 0 H THR A 108 1.477 10.323 -2.208 1.00 0.00 H new ATOM 0 HA THR A 108 3.280 12.593 -2.491 1.00 0.00 H new ATOM 0 HB THR A 108 1.866 13.300 -4.545 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.475 11.284 -4.150 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.379 12.130 -6.103 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.251 12.748 -4.679 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.855 11.017 -4.799 1.00 0.00 H new ATOM 1666 N TYR A 109 1.520 13.763 -1.192 1.00 0.00 N ATOM 1667 CA TYR A 109 0.512 14.525 -0.465 1.00 0.00 C ATOM 1668 C TYR A 109 1.103 15.815 0.094 1.00 0.00 C ATOM 1669 O TYR A 109 2.305 16.059 -0.015 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.072 13.684 0.671 1.00 0.00 C ATOM 1671 CG TYR A 109 0.955 13.251 1.693 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.766 12.146 1.466 1.00 0.00 C ATOM 1673 CD2 TYR A 109 1.113 13.945 2.886 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.705 11.746 2.397 1.00 0.00 C ATOM 1675 CE2 TYR A 109 2.050 13.553 3.822 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.843 12.453 3.573 1.00 0.00 C ATOM 1677 OH TYR A 109 3.777 12.058 4.504 1.00 0.00 O ATOM 0 H TYR A 109 2.482 13.978 -0.930 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.284 14.784 -1.163 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -0.852 14.257 1.172 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.548 12.799 0.249 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.661 11.590 0.546 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.492 14.806 3.085 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.327 10.885 2.205 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.161 14.105 4.744 1.00 0.00 H new ATOM 0 HH TYR A 109 3.747 12.663 5.275 1.00 0.00 H new ATOM 1687 N ASP A 110 0.250 16.638 0.694 1.00 0.00 N ATOM 1688 CA ASP A 110 0.687 17.903 1.273 1.00 0.00 C ATOM 1689 C ASP A 110 0.537 17.886 2.791 1.00 0.00 C ATOM 1690 O ASP A 110 -0.544 17.619 3.317 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.117 19.063 0.682 1.00 0.00 C ATOM 1692 CG ASP A 110 0.158 19.264 -0.795 1.00 0.00 C ATOM 1693 OD1 ASP A 110 1.274 19.709 -1.135 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -0.743 18.978 -1.611 1.00 0.00 O ATOM 0 H ASP A 110 -0.748 16.452 0.792 1.00 0.00 H new ATOM 0 HA ASP A 110 1.741 18.041 1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.181 18.876 0.828 1.00 0.00 H new ATOM 0 HB3 ASP A 110 0.123 19.979 1.221 1.00 0.00 H new ATOM 1699 N HIS A 111 1.630 18.172 3.492 1.00 0.00 N ATOM 1700 CA HIS A 111 1.621 18.190 4.950 1.00 0.00 C ATOM 1701 C HIS A 111 2.128 19.527 5.481 1.00 0.00 C ATOM 1702 O HIS A 111 3.067 20.108 4.936 1.00 0.00 O ATOM 1703 CB HIS A 111 2.481 17.051 5.500 1.00 0.00 C ATOM 1704 CG HIS A 111 2.122 16.651 6.898 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.969 15.934 7.716 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.001 16.873 7.622 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.383 15.731 8.883 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.188 16.291 8.852 1.00 0.00 N ATOM 0 H HIS A 111 2.533 18.394 3.073 1.00 0.00 H new ATOM 0 HA HIS A 111 0.592 18.054 5.284 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.383 16.184 4.846 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.528 17.352 5.475 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.122 17.408 7.294 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.809 15.198 9.720 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.513 16.291 9.617 1.00 0.00 H new ATOM 1716 N PHE A 112 1.499 20.012 6.547 1.00 0.00 N ATOM 1717 CA PHE A 112 1.885 21.282 7.150 1.00 0.00 C ATOM 1718 C PHE A 112 2.251 22.305 6.078 1.00 0.00 C ATOM 1719 O PHE A 112 3.224 23.046 6.217 1.00 0.00 O ATOM 1720 CB PHE A 112 3.065 21.081 8.103 1.00 0.00 C ATOM 1721 CG PHE A 112 2.653 20.683 9.491 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.073 21.606 10.347 1.00 0.00 C ATOM 1723 CD2 PHE A 112 2.845 19.387 9.941 1.00 0.00 C ATOM 1724 CE1 PHE A 112 1.694 21.243 11.626 1.00 0.00 C ATOM 1725 CE2 PHE A 112 2.467 19.018 11.218 1.00 0.00 C ATOM 1726 CZ PHE A 112 1.890 19.947 12.061 1.00 0.00 C ATOM 0 H PHE A 112 0.720 19.545 7.011 1.00 0.00 H new ATOM 0 HA PHE A 112 1.033 21.662 7.713 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.725 20.316 7.695 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.642 22.005 8.154 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.915 22.620 10.011 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.296 18.656 9.286 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.245 21.972 12.284 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.623 18.004 11.556 1.00 0.00 H new ATOM 0 HZ PHE A 112 1.592 19.661 13.059 1.00 0.00 H new ATOM 1736 N HIS A 113 1.464 22.338 5.007 1.00 0.00 N ATOM 1737 CA HIS A 113 1.704 23.269 3.910 1.00 0.00 C ATOM 1738 C HIS A 113 3.066 23.016 3.272 1.00 0.00 C ATOM 1739 O HIS A 113 3.833 23.949 3.034 1.00 0.00 O ATOM 1740 CB HIS A 113 1.622 24.712 4.411 1.00 0.00 C ATOM 1741 CG HIS A 113 0.303 25.057 5.029 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -0.610 25.901 4.433 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -0.257 24.666 6.198 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -1.673 26.015 5.209 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -1.484 25.275 6.287 1.00 0.00 N ATOM 0 H HIS A 113 0.655 21.731 4.876 1.00 0.00 H new ATOM 0 HA HIS A 113 0.934 23.110 3.155 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.412 24.879 5.143 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.812 25.389 3.578 1.00 0.00 H new ATOM 0 HD2 HIS A 113 0.181 23.999 6.926 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.548 26.612 4.998 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -2.142 25.173 7.059 1.00 0.00 H new ATOM 1753 N GLN A 114 3.360 21.749 2.997 1.00 0.00 N ATOM 1754 CA GLN A 114 4.630 21.375 2.388 1.00 0.00 C ATOM 1755 C GLN A 114 4.452 20.194 1.439 1.00 0.00 C ATOM 1756 O GLN A 114 3.665 19.285 1.704 1.00 0.00 O ATOM 1757 CB GLN A 114 5.655 21.025 3.468 1.00 0.00 C ATOM 1758 CG GLN A 114 6.729 20.057 2.998 1.00 0.00 C ATOM 1759 CD GLN A 114 7.905 19.982 3.952 1.00 0.00 C ATOM 1760 OE1 GLN A 114 7.781 19.480 5.070 1.00 0.00 O ATOM 1761 NE2 GLN A 114 9.055 20.480 3.515 1.00 0.00 N ATOM 0 H GLN A 114 2.736 20.965 3.186 1.00 0.00 H new ATOM 0 HA GLN A 114 4.993 22.228 1.815 1.00 0.00 H new ATOM 0 HB2 GLN A 114 6.131 21.942 3.816 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.136 20.591 4.323 1.00 0.00 H new ATOM 0 HG2 GLN A 114 6.294 19.064 2.885 1.00 0.00 H new ATOM 0 HG3 GLN A 114 7.083 20.363 2.014 1.00 0.00 H new ATOM 0 HE21 GLN A 114 9.113 20.887 2.581 1.00 0.00 H new ATOM 0 HE22 GLN A 114 9.881 20.456 4.113 1.00 0.00 H new ATOM 1770 N SER A 115 5.187 20.215 0.332 1.00 0.00 N ATOM 1771 CA SER A 115 5.107 19.148 -0.659 1.00 0.00 C ATOM 1772 C SER A 115 5.841 17.901 -0.176 1.00 0.00 C ATOM 1773 O SER A 115 7.045 17.936 0.081 1.00 0.00 O ATOM 1774 CB SER A 115 5.695 19.616 -1.992 1.00 0.00 C ATOM 1775 OG SER A 115 5.068 18.963 -3.083 1.00 0.00 O ATOM 0 H SER A 115 5.845 20.959 0.099 1.00 0.00 H new ATOM 0 HA SER A 115 4.056 18.897 -0.802 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.571 20.695 -2.089 1.00 0.00 H new ATOM 0 HB3 SER A 115 6.766 19.416 -2.011 1.00 0.00 H new ATOM 0 HG SER A 115 5.460 19.280 -3.923 1.00 0.00 H new ATOM 1781 N VAL A 116 5.107 16.799 -0.055 1.00 0.00 N ATOM 1782 CA VAL A 116 5.687 15.540 0.396 1.00 0.00 C ATOM 1783 C VAL A 116 5.636 14.486 -0.704 1.00 0.00 C ATOM 1784 O VAL A 116 4.576 13.933 -0.997 1.00 0.00 O ATOM 1785 CB VAL A 116 4.960 15.002 1.643 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.554 13.670 2.074 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.024 16.016 2.775 1.00 0.00 C ATOM 0 H VAL A 116 4.110 16.753 -0.263 1.00 0.00 H new ATOM 0 HA VAL A 116 6.727 15.744 0.651 1.00 0.00 H new ATOM 0 HB VAL A 116 3.912 14.840 1.390 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.028 13.305 2.956 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.451 12.947 1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.610 13.802 2.310 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.506 15.620 3.648 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.066 16.212 3.029 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.547 16.944 2.460 1.00 0.00 H new ATOM 1797 N GLN A 117 6.787 14.212 -1.308 1.00 0.00 N ATOM 1798 CA GLN A 117 6.873 13.224 -2.376 1.00 0.00 C ATOM 1799 C GLN A 117 8.047 12.278 -2.150 1.00 0.00 C ATOM 1800 O GLN A 117 9.206 12.673 -2.273 1.00 0.00 O ATOM 1801 CB GLN A 117 7.015 13.918 -3.732 1.00 0.00 C ATOM 1802 CG GLN A 117 6.995 12.959 -4.912 1.00 0.00 C ATOM 1803 CD GLN A 117 8.359 12.363 -5.203 1.00 0.00 C ATOM 1804 OE1 GLN A 117 9.135 12.913 -5.984 1.00 0.00 O ATOM 1805 NE2 GLN A 117 8.657 11.233 -4.574 1.00 0.00 N ATOM 0 H GLN A 117 7.673 14.660 -1.076 1.00 0.00 H new ATOM 0 HA GLN A 117 5.953 12.639 -2.370 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.207 14.640 -3.848 1.00 0.00 H new ATOM 0 HB3 GLN A 117 7.949 14.480 -3.747 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.287 12.155 -4.710 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.636 13.485 -5.797 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.983 10.812 -3.935 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.560 10.786 -4.730 1.00 0.00 H new ATOM 1814 N GLU A 118 7.739 11.028 -1.819 1.00 0.00 N ATOM 1815 CA GLU A 118 8.771 10.026 -1.575 1.00 0.00 C ATOM 1816 C GLU A 118 8.424 8.709 -2.263 1.00 0.00 C ATOM 1817 O GLU A 118 7.289 8.237 -2.187 1.00 0.00 O ATOM 1818 CB GLU A 118 8.946 9.799 -0.072 1.00 0.00 C ATOM 1819 CG GLU A 118 9.455 11.021 0.674 1.00 0.00 C ATOM 1820 CD GLU A 118 10.959 11.185 0.566 1.00 0.00 C ATOM 1821 OE1 GLU A 118 11.480 11.141 -0.568 1.00 0.00 O ATOM 1822 OE2 GLU A 118 11.614 11.357 1.615 1.00 0.00 O ATOM 0 H GLU A 118 6.784 10.685 -1.714 1.00 0.00 H new ATOM 0 HA GLU A 118 9.708 10.397 -1.991 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.990 9.496 0.355 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.641 8.974 0.084 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.967 11.912 0.280 1.00 0.00 H new ATOM 0 HG3 GLU A 118 9.176 10.943 1.725 1.00 0.00 H new ATOM 1829 N ILE A 119 9.409 8.122 -2.934 1.00 0.00 N ATOM 1830 CA ILE A 119 9.209 6.860 -3.635 1.00 0.00 C ATOM 1831 C ILE A 119 10.164 5.788 -3.120 1.00 0.00 C ATOM 1832 O ILE A 119 11.383 5.944 -3.185 1.00 0.00 O ATOM 1833 CB ILE A 119 9.408 7.022 -5.153 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.414 8.041 -5.714 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.251 5.680 -5.854 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.925 8.775 -6.934 1.00 0.00 C ATOM 0 H ILE A 119 10.353 8.500 -3.007 1.00 0.00 H new ATOM 0 HA ILE A 119 8.182 6.551 -3.442 1.00 0.00 H new ATOM 0 HB ILE A 119 10.418 7.389 -5.335 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.487 7.529 -5.970 1.00 0.00 H new ATOM 0 HG13 ILE A 119 8.173 8.767 -4.938 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.394 5.811 -6.927 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.994 4.980 -5.471 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.252 5.286 -5.667 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.169 9.481 -7.277 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.836 9.316 -6.678 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.139 8.058 -7.727 1.00 0.00 H new ATOM 1848 N PHE A 120 9.601 4.698 -2.609 1.00 0.00 N ATOM 1849 CA PHE A 120 10.401 3.598 -2.084 1.00 0.00 C ATOM 1850 C PHE A 120 9.816 2.252 -2.500 1.00 0.00 C ATOM 1851 O PHE A 120 8.613 2.131 -2.728 1.00 0.00 O ATOM 1852 CB PHE A 120 10.483 3.682 -0.558 1.00 0.00 C ATOM 1853 CG PHE A 120 9.157 3.940 0.100 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.279 2.897 0.350 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.789 5.224 0.467 1.00 0.00 C ATOM 1856 CE1 PHE A 120 7.059 3.130 0.956 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.570 5.463 1.073 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.703 4.415 1.317 1.00 0.00 C ATOM 0 H PHE A 120 8.593 4.553 -2.547 1.00 0.00 H new ATOM 0 HA PHE A 120 11.405 3.681 -2.500 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.896 2.750 -0.172 1.00 0.00 H new ATOM 0 HB3 PHE A 120 11.177 4.476 -0.282 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.551 1.891 0.068 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.462 6.047 0.278 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.385 2.308 1.147 1.00 0.00 H new ATOM 0 HE2 PHE A 120 7.295 6.468 1.356 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.749 4.600 1.789 1.00 0.00 H new ATOM 1868 N GLU A 121 10.676 1.243 -2.595 1.00 0.00 N ATOM 1869 CA GLU A 121 10.245 -0.094 -2.985 1.00 0.00 C ATOM 1870 C GLU A 121 10.370 -1.068 -1.817 1.00 0.00 C ATOM 1871 O GLU A 121 11.465 -1.305 -1.306 1.00 0.00 O ATOM 1872 CB GLU A 121 11.070 -0.595 -4.172 1.00 0.00 C ATOM 1873 CG GLU A 121 11.102 0.372 -5.343 1.00 0.00 C ATOM 1874 CD GLU A 121 11.733 1.703 -4.984 1.00 0.00 C ATOM 1875 OE1 GLU A 121 12.974 1.758 -4.857 1.00 0.00 O ATOM 1876 OE2 GLU A 121 10.984 2.692 -4.829 1.00 0.00 O ATOM 0 H GLU A 121 11.675 1.326 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 121 9.197 -0.038 -3.279 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.091 -0.784 -3.840 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.663 -1.548 -4.510 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.657 -0.078 -6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 121 10.085 0.540 -5.698 1.00 0.00 H new ATOM 1883 N VAL A 122 9.240 -1.630 -1.399 1.00 0.00 N ATOM 1884 CA VAL A 122 9.222 -2.579 -0.292 1.00 0.00 C ATOM 1885 C VAL A 122 10.073 -3.805 -0.605 1.00 0.00 C ATOM 1886 O VAL A 122 9.668 -4.672 -1.377 1.00 0.00 O ATOM 1887 CB VAL A 122 7.787 -3.033 0.035 1.00 0.00 C ATOM 1888 CG1 VAL A 122 7.779 -3.940 1.256 1.00 0.00 C ATOM 1889 CG2 VAL A 122 6.884 -1.828 0.250 1.00 0.00 C ATOM 0 H VAL A 122 8.325 -1.444 -1.810 1.00 0.00 H new ATOM 0 HA VAL A 122 9.638 -2.063 0.574 1.00 0.00 H new ATOM 0 HB VAL A 122 7.402 -3.601 -0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.757 -4.251 1.472 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.392 -4.820 1.060 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.183 -3.400 2.113 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.874 -2.167 0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.264 -1.232 1.079 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.866 -1.221 -0.655 1.00 0.00 H new ATOM 1899 N ASN A 123 11.254 -3.869 0.001 1.00 0.00 N ATOM 1900 CA ASN A 123 12.162 -4.990 -0.213 1.00 0.00 C ATOM 1901 C ASN A 123 12.108 -5.966 0.959 1.00 0.00 C ATOM 1902 O ASN A 123 12.686 -7.050 0.903 1.00 0.00 O ATOM 1903 CB ASN A 123 13.593 -4.484 -0.404 1.00 0.00 C ATOM 1904 CG ASN A 123 14.278 -4.175 0.914 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.941 -5.033 1.498 1.00 0.00 O ATOM 1906 ND2 ASN A 123 14.120 -2.945 1.389 1.00 0.00 N ATOM 0 H ASN A 123 11.604 -3.159 0.644 1.00 0.00 H new ATOM 0 HA ASN A 123 11.845 -5.515 -1.114 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.171 -5.234 -0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.579 -3.586 -1.022 1.00 0.00 H new ATOM 0 HD21 ASN A 123 14.557 -2.679 2.272 1.00 0.00 H new ATOM 0 HD22 ASN A 123 13.562 -2.266 0.871 1.00 0.00 H new ATOM 1913 N ASN A 124 11.409 -5.571 2.018 1.00 0.00 N ATOM 1914 CA ASN A 124 11.279 -6.411 3.204 1.00 0.00 C ATOM 1915 C ASN A 124 9.978 -7.207 3.166 1.00 0.00 C ATOM 1916 O ASN A 124 9.379 -7.489 4.205 1.00 0.00 O ATOM 1917 CB ASN A 124 11.329 -5.554 4.470 1.00 0.00 C ATOM 1918 CG ASN A 124 11.511 -6.385 5.725 1.00 0.00 C ATOM 1919 OD1 ASN A 124 12.374 -7.261 5.782 1.00 0.00 O ATOM 1920 ND2 ASN A 124 10.696 -6.114 6.737 1.00 0.00 N ATOM 0 H ASN A 124 10.924 -4.676 2.080 1.00 0.00 H new ATOM 0 HA ASN A 124 12.113 -7.112 3.215 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.148 -4.839 4.389 1.00 0.00 H new ATOM 0 HB3 ASN A 124 10.408 -4.976 4.551 1.00 0.00 H new ATOM 0 HD21 ASN A 124 10.771 -6.641 7.607 1.00 0.00 H new ATOM 0 HD22 ASN A 124 9.995 -5.379 6.645 1.00 0.00 H new ATOM 1927 N LEU A 125 9.545 -7.567 1.963 1.00 0.00 N ATOM 1928 CA LEU A 125 8.315 -8.331 1.789 1.00 0.00 C ATOM 1929 C LEU A 125 8.452 -9.727 2.389 1.00 0.00 C ATOM 1930 O LEU A 125 9.522 -10.335 2.371 1.00 0.00 O ATOM 1931 CB LEU A 125 7.961 -8.435 0.305 1.00 0.00 C ATOM 1932 CG LEU A 125 7.600 -7.122 -0.392 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.907 -7.205 -1.879 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.133 -6.784 -0.166 1.00 0.00 C ATOM 0 H LEU A 125 10.028 -7.342 1.093 1.00 0.00 H new ATOM 0 HA LEU A 125 7.514 -7.807 2.311 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.806 -8.881 -0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.121 -9.122 0.199 1.00 0.00 H new ATOM 0 HG LEU A 125 8.206 -6.325 0.039 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.644 -6.262 -2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.970 -7.400 -2.021 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.328 -8.013 -2.326 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.894 -5.847 -0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.509 -7.582 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.944 -6.681 0.902 1.00 0.00 H new ATOM 1946 N PRO A 126 7.342 -10.249 2.933 1.00 0.00 N ATOM 1947 CA PRO A 126 7.312 -11.581 3.546 1.00 0.00 C ATOM 1948 C PRO A 126 7.451 -12.696 2.516 1.00 0.00 C ATOM 1949 O PRO A 126 7.286 -12.472 1.317 1.00 0.00 O ATOM 1950 CB PRO A 126 5.934 -11.634 4.210 1.00 0.00 C ATOM 1951 CG PRO A 126 5.101 -10.676 3.431 1.00 0.00 C ATOM 1952 CD PRO A 126 6.032 -9.581 2.990 1.00 0.00 C ATOM 0 HA PRO A 126 8.140 -11.730 4.239 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.517 -12.640 4.176 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.989 -11.347 5.260 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.642 -11.167 2.573 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.291 -10.277 4.042 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.745 -9.176 2.020 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.036 -8.749 3.694 1.00 0.00 H new ATOM 1960 N VAL A 127 7.755 -13.900 2.991 1.00 0.00 N ATOM 1961 CA VAL A 127 7.914 -15.052 2.112 1.00 0.00 C ATOM 1962 C VAL A 127 6.737 -16.012 2.245 1.00 0.00 C ATOM 1963 O VAL A 127 6.611 -16.964 1.476 1.00 0.00 O ATOM 1964 CB VAL A 127 9.219 -15.812 2.413 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.427 -14.977 2.016 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.285 -16.195 3.884 1.00 0.00 C ATOM 0 H VAL A 127 7.896 -14.103 3.981 1.00 0.00 H new ATOM 0 HA VAL A 127 7.953 -14.669 1.092 1.00 0.00 H new ATOM 0 HB VAL A 127 9.231 -16.728 1.822 1.00 0.00 H new ATOM 0 HG11 VAL A 127 11.340 -15.530 2.236 1.00 0.00 H new ATOM 0 HG12 VAL A 127 10.383 -14.758 0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.424 -14.043 2.578 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.214 -16.731 4.079 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.251 -15.294 4.496 1.00 0.00 H new ATOM 0 HG23 VAL A 127 8.438 -16.834 4.132 1.00 0.00 H new ATOM 1976 N GLU A 128 5.879 -15.754 3.226 1.00 0.00 N ATOM 1977 CA GLU A 128 4.712 -16.597 3.460 1.00 0.00 C ATOM 1978 C GLU A 128 3.701 -16.454 2.326 1.00 0.00 C ATOM 1979 O GLU A 128 2.765 -17.245 2.211 1.00 0.00 O ATOM 1980 CB GLU A 128 4.053 -16.236 4.793 1.00 0.00 C ATOM 1981 CG GLU A 128 4.641 -16.976 5.983 1.00 0.00 C ATOM 1982 CD GLU A 128 4.092 -16.481 7.307 1.00 0.00 C ATOM 1983 OE1 GLU A 128 2.927 -16.032 7.335 1.00 0.00 O ATOM 1984 OE2 GLU A 128 4.826 -16.544 8.315 1.00 0.00 O ATOM 0 H GLU A 128 5.969 -14.969 3.871 1.00 0.00 H new ATOM 0 HA GLU A 128 5.047 -17.634 3.497 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.151 -15.163 4.958 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.987 -16.453 4.732 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.432 -18.041 5.883 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.725 -16.862 5.978 1.00 0.00 H new ATOM 1991 N SER A 129 3.897 -15.438 1.491 1.00 0.00 N ATOM 1992 CA SER A 129 3.001 -15.188 0.368 1.00 0.00 C ATOM 1993 C SER A 129 3.193 -16.236 -0.724 1.00 0.00 C ATOM 1994 O SER A 129 2.231 -16.670 -1.358 1.00 0.00 O ATOM 1995 CB SER A 129 3.244 -13.790 -0.203 1.00 0.00 C ATOM 1996 OG SER A 129 2.293 -13.476 -1.206 1.00 0.00 O ATOM 0 H SER A 129 4.668 -14.775 1.571 1.00 0.00 H new ATOM 0 HA SER A 129 1.975 -15.251 0.732 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.190 -13.052 0.598 1.00 0.00 H new ATOM 0 HB3 SER A 129 4.249 -13.734 -0.620 1.00 0.00 H new ATOM 0 HG SER A 129 2.469 -12.577 -1.554 1.00 0.00 H new ATOM 2002 N TRP A 130 4.440 -16.638 -0.937 1.00 0.00 N ATOM 2003 CA TRP A 130 4.759 -17.636 -1.952 1.00 0.00 C ATOM 2004 C TRP A 130 5.125 -18.969 -1.309 1.00 0.00 C ATOM 2005 O TRP A 130 4.609 -20.016 -1.697 1.00 0.00 O ATOM 2006 CB TRP A 130 5.911 -17.147 -2.833 1.00 0.00 C ATOM 2007 CG TRP A 130 7.163 -16.854 -2.064 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.602 -15.629 -1.648 1.00 0.00 C ATOM 2009 CD2 TRP A 130 8.139 -17.803 -1.622 1.00 0.00 C ATOM 2010 NE1 TRP A 130 8.792 -15.760 -0.973 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.143 -17.084 -0.943 1.00 0.00 C ATOM 2012 CE3 TRP A 130 8.263 -19.191 -1.731 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.253 -17.708 -0.379 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 9.365 -19.808 -1.171 1.00 0.00 C ATOM 2015 CH2 TRP A 130 10.348 -19.067 -0.501 1.00 0.00 C ATOM 0 H TRP A 130 5.247 -16.289 -0.421 1.00 0.00 H new ATOM 0 HA TRP A 130 3.874 -17.784 -2.571 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.126 -17.902 -3.590 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.598 -16.246 -3.361 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.089 -14.695 -1.824 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.327 -14.995 -0.561 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.510 -19.771 -2.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 11.012 -17.139 0.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 9.471 -20.880 -1.251 1.00 0.00 H new ATOM 0 HH2 TRP A 130 11.197 -19.579 -0.073 1.00 0.00 H new ATOM 2026 N GLN A 131 6.018 -18.922 -0.325 1.00 0.00 N ATOM 2027 CA GLN A 131 6.452 -20.127 0.370 1.00 0.00 C ATOM 2028 C GLN A 131 5.258 -21.002 0.740 1.00 0.00 C ATOM 2029 O GLN A 131 4.150 -20.504 0.944 1.00 0.00 O ATOM 2030 CB GLN A 131 7.240 -19.760 1.628 1.00 0.00 C ATOM 2031 CG GLN A 131 7.850 -20.959 2.336 1.00 0.00 C ATOM 2032 CD GLN A 131 8.960 -20.570 3.292 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.722 -20.337 4.477 1.00 0.00 O ATOM 2034 NE2 GLN A 131 10.184 -20.499 2.780 1.00 0.00 N ATOM 0 H GLN A 131 6.454 -18.062 0.008 1.00 0.00 H new ATOM 0 HA GLN A 131 7.098 -20.691 -0.303 1.00 0.00 H new ATOM 0 HB2 GLN A 131 8.035 -19.065 1.359 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.580 -19.237 2.320 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.071 -21.487 2.886 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.242 -21.654 1.593 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.336 -20.700 1.792 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.972 -20.243 3.375 1.00 0.00 H new