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= -0.283! K(o=1.5!,f=0.16) USER MOD Set 1.2: A 50 SER OG : rot -87:sc= 1.78 USER MOD Set 1.3: A 111 HIS : no HD1:sc= -0.0177 K(o=1.5,f=-4.1!) USER MOD Single : A 17 LYS NZ :NH3+ 157:sc= -0.0526 (180deg=-0.412) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -1.86! C(o=-1.9!,f=-3.2!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0986 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.0063 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc=-0.00599 X(o=-0.006,f=-0.006) USER MOD Single : A 59 CYS SG : rot 160:sc= -0.479 USER MOD Single : A 60 GLN : amide:sc= 0.498 K(o=0.5,f=-3.8!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.302 K(o=-0.3,f=-1.7) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -2.44 K(o=-2.4,f=-9.3!) USER MOD Single : A 78 THR OG1 : rot 84:sc= 1.19 USER MOD Single : A 88 THR OG1 : rot 27:sc= 0.195 USER MOD Single : A 89 GLN : amide:sc= -0.348 K(o=-0.35,f=-3.7!) USER MOD Single : A 95 ASN : amide:sc= -5.28! C(o=-5.3!,f=-2.3!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,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 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 35:sc= 0.0951 USER MOD Single : A 109 TYR OH : rot 180:sc= -0.0615 USER MOD Single : A 113 HIS : no HD1:sc= -0.579 X(o=-0.58,f=-0.21) USER MOD Single : A 114 GLN : amide:sc= -1.01 K(o=-1,f=-4.3!) USER MOD Single : A 115 SER OG : rot 32:sc= 0.494 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -2.26! C(o=-2.3!,f=-12!) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 132 N ILE A 13 0.616 -14.004 8.205 1.00 0.00 N ATOM 133 CA ILE A 13 1.605 -13.044 7.732 1.00 0.00 C ATOM 134 C ILE A 13 1.612 -11.790 8.601 1.00 0.00 C ATOM 135 O ILE A 13 0.617 -11.072 8.706 1.00 0.00 O ATOM 136 CB ILE A 13 1.343 -12.640 6.269 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.348 -13.875 5.367 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.384 -11.633 5.804 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.511 -13.715 4.118 1.00 0.00 C ATOM 0 HA ILE A 13 2.577 -13.534 7.796 1.00 0.00 H new ATOM 0 HB ILE A 13 0.360 -12.173 6.207 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.375 -14.101 5.080 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.980 -14.730 5.934 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.186 -11.357 4.768 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.336 -10.744 6.432 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.377 -12.076 5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.561 -14.629 3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.525 -13.520 4.397 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.892 -12.881 3.529 1.00 0.00 H new ATOM 151 N PRO A 14 2.760 -11.518 9.237 1.00 0.00 N ATOM 152 CA PRO A 14 2.926 -10.348 10.106 1.00 0.00 C ATOM 153 C PRO A 14 2.936 -9.041 9.322 1.00 0.00 C ATOM 154 O PRO A 14 3.202 -9.029 8.120 1.00 0.00 O ATOM 155 CB PRO A 14 4.287 -10.587 10.766 1.00 0.00 C ATOM 156 CG PRO A 14 5.024 -11.459 9.809 1.00 0.00 C ATOM 157 CD PRO A 14 3.986 -12.330 9.157 1.00 0.00 C ATOM 0 HA PRO A 14 2.105 -10.247 10.816 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.816 -9.649 10.934 1.00 0.00 H new ATOM 0 HB3 PRO A 14 4.177 -11.070 11.737 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.555 -10.862 9.067 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.770 -12.062 10.326 1.00 0.00 H new ATOM 0 HD2 PRO A 14 4.247 -12.562 8.125 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.873 -13.280 9.679 1.00 0.00 H new ATOM 165 N ASP A 15 2.647 -7.942 10.010 1.00 0.00 N ATOM 166 CA ASP A 15 2.624 -6.628 9.378 1.00 0.00 C ATOM 167 C ASP A 15 4.012 -6.244 8.872 1.00 0.00 C ATOM 168 O ASP A 15 5.018 -6.819 9.291 1.00 0.00 O ATOM 169 CB ASP A 15 2.118 -5.573 10.363 1.00 0.00 C ATOM 170 CG ASP A 15 0.610 -5.608 10.523 1.00 0.00 C ATOM 171 OD1 ASP A 15 -0.093 -5.101 9.625 1.00 0.00 O ATOM 172 OD2 ASP A 15 0.134 -6.140 11.548 1.00 0.00 O ATOM 0 H ASP A 15 2.425 -7.935 11.006 1.00 0.00 H new ATOM 0 HA ASP A 15 1.945 -6.674 8.526 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.587 -5.731 11.334 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.421 -4.584 10.020 1.00 0.00 H new ATOM 177 N LEU A 16 4.058 -5.271 7.969 1.00 0.00 N ATOM 178 CA LEU A 16 5.322 -4.811 7.404 1.00 0.00 C ATOM 179 C LEU A 16 5.367 -3.288 7.339 1.00 0.00 C ATOM 180 O LEU A 16 4.513 -2.657 6.715 1.00 0.00 O ATOM 181 CB LEU A 16 5.523 -5.399 6.007 1.00 0.00 C ATOM 182 CG LEU A 16 6.961 -5.416 5.486 1.00 0.00 C ATOM 183 CD1 LEU A 16 7.137 -6.503 4.438 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.337 -4.056 4.915 1.00 0.00 C ATOM 0 H LEU A 16 3.235 -4.785 7.612 1.00 0.00 H new ATOM 0 HA LEU A 16 6.128 -5.152 8.054 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.146 -6.422 6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.910 -4.834 5.305 1.00 0.00 H new ATOM 0 HG LEU A 16 7.627 -5.635 6.321 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.166 -6.499 4.079 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.910 -7.474 4.879 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.461 -6.316 3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.363 -4.086 4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.666 -3.808 4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.252 -3.298 5.694 1.00 0.00 H new ATOM 196 N LYS A 17 6.370 -2.702 7.984 1.00 0.00 N ATOM 197 CA LYS A 17 6.529 -1.253 7.997 1.00 0.00 C ATOM 198 C LYS A 17 7.158 -0.763 6.697 1.00 0.00 C ATOM 199 O LYS A 17 8.159 -1.311 6.235 1.00 0.00 O ATOM 200 CB LYS A 17 7.392 -0.825 9.186 1.00 0.00 C ATOM 201 CG LYS A 17 7.934 0.589 9.067 1.00 0.00 C ATOM 202 CD LYS A 17 9.027 0.856 10.088 1.00 0.00 C ATOM 203 CE LYS A 17 10.389 0.414 9.574 1.00 0.00 C ATOM 204 NZ LYS A 17 10.852 1.256 8.437 1.00 0.00 N ATOM 0 H LYS A 17 7.085 -3.209 8.505 1.00 0.00 H new ATOM 0 HA LYS A 17 5.540 -0.805 8.093 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.802 -0.903 10.099 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.227 -1.518 9.286 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.327 0.745 8.063 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.123 1.303 9.206 1.00 0.00 H new ATOM 0 HD2 LYS A 17 9.054 1.920 10.324 1.00 0.00 H new ATOM 0 HD3 LYS A 17 8.798 0.329 11.014 1.00 0.00 H new ATOM 0 HE2 LYS A 17 11.117 0.465 10.384 1.00 0.00 H new ATOM 0 HE3 LYS A 17 10.337 -0.628 9.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 11.888 1.204 8.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 10.427 0.910 7.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 10.565 2.243 8.596 1.00 0.00 H new ATOM 218 N VAL A 18 6.566 0.273 6.111 1.00 0.00 N ATOM 219 CA VAL A 18 7.070 0.838 4.866 1.00 0.00 C ATOM 220 C VAL A 18 7.488 2.292 5.052 1.00 0.00 C ATOM 221 O VAL A 18 8.447 2.757 4.435 1.00 0.00 O ATOM 222 CB VAL A 18 6.015 0.758 3.746 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.487 -0.662 3.610 1.00 0.00 C ATOM 224 CG2 VAL A 18 4.880 1.735 4.013 1.00 0.00 C ATOM 0 H VAL A 18 5.736 0.738 6.479 1.00 0.00 H new ATOM 0 HA VAL A 18 7.940 0.247 4.579 1.00 0.00 H new ATOM 0 HB VAL A 18 6.488 1.035 2.804 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.743 -0.699 2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.310 -1.335 3.369 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.029 -0.971 4.549 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.144 1.665 3.212 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.406 1.491 4.964 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.276 2.750 4.055 1.00 0.00 H new ATOM 234 N PHE A 19 6.763 3.006 5.906 1.00 0.00 N ATOM 235 CA PHE A 19 7.059 4.409 6.174 1.00 0.00 C ATOM 236 C PHE A 19 6.767 4.758 7.630 1.00 0.00 C ATOM 237 O PHE A 19 5.693 4.455 8.148 1.00 0.00 O ATOM 238 CB PHE A 19 6.241 5.310 5.247 1.00 0.00 C ATOM 239 CG PHE A 19 6.584 6.767 5.371 1.00 0.00 C ATOM 240 CD1 PHE A 19 7.841 7.229 5.014 1.00 0.00 C ATOM 241 CD2 PHE A 19 5.651 7.675 5.846 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.160 8.569 5.126 1.00 0.00 C ATOM 243 CE2 PHE A 19 5.965 9.016 5.960 1.00 0.00 C ATOM 244 CZ PHE A 19 7.221 9.464 5.601 1.00 0.00 C ATOM 0 H PHE A 19 5.966 2.637 6.425 1.00 0.00 H new ATOM 0 HA PHE A 19 8.120 4.574 5.986 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.398 4.995 4.216 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.181 5.175 5.464 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.580 6.534 4.644 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.668 7.331 6.130 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.143 8.916 4.842 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.228 9.714 6.330 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.469 10.511 5.691 1.00 0.00 H new ATOM 254 N GLU A 20 7.732 5.397 8.284 1.00 0.00 N ATOM 255 CA GLU A 20 7.579 5.786 9.681 1.00 0.00 C ATOM 256 C GLU A 20 8.076 7.211 9.907 1.00 0.00 C ATOM 257 O GLU A 20 9.272 7.486 9.808 1.00 0.00 O ATOM 258 CB GLU A 20 8.341 4.819 10.590 1.00 0.00 C ATOM 259 CG GLU A 20 8.134 5.085 12.071 1.00 0.00 C ATOM 260 CD GLU A 20 9.013 6.206 12.591 1.00 0.00 C ATOM 261 OE1 GLU A 20 8.581 7.376 12.527 1.00 0.00 O ATOM 262 OE2 GLU A 20 10.132 5.913 13.061 1.00 0.00 O ATOM 0 H GLU A 20 8.627 5.656 7.869 1.00 0.00 H new ATOM 0 HA GLU A 20 6.518 5.746 9.928 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.028 3.799 10.365 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.405 4.883 10.363 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.088 5.336 12.248 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.343 4.174 12.633 1.00 0.00 H new ATOM 269 N ARG A 21 7.148 8.114 10.210 1.00 0.00 N ATOM 270 CA ARG A 21 7.491 9.511 10.448 1.00 0.00 C ATOM 271 C ARG A 21 7.075 9.941 11.851 1.00 0.00 C ATOM 272 O ARG A 21 6.125 9.403 12.419 1.00 0.00 O ATOM 273 CB ARG A 21 6.818 10.407 9.407 1.00 0.00 C ATOM 274 CG ARG A 21 7.342 11.834 9.402 1.00 0.00 C ATOM 275 CD ARG A 21 7.120 12.504 8.055 1.00 0.00 C ATOM 276 NE ARG A 21 8.127 13.526 7.779 1.00 0.00 N ATOM 277 CZ ARG A 21 8.043 14.777 8.216 1.00 0.00 C ATOM 278 NH1 ARG A 21 7.005 15.159 8.947 1.00 0.00 N ATOM 279 NH2 ARG A 21 9.000 15.649 7.924 1.00 0.00 N ATOM 0 H ARG A 21 6.154 7.903 10.296 1.00 0.00 H new ATOM 0 HA ARG A 21 8.573 9.614 10.361 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.963 9.972 8.418 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.744 10.424 9.594 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.843 12.409 10.182 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.406 11.833 9.638 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.143 11.751 7.267 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.129 12.957 8.034 1.00 0.00 H new ATOM 0 HE ARG A 21 8.939 13.264 7.220 1.00 0.00 H new ATOM 0 HH11 ARG A 21 6.268 14.491 9.175 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.943 16.121 9.281 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.801 15.358 7.363 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.934 16.610 8.260 1.00 0.00 H new ATOM 293 N GLU A 22 7.793 10.914 12.404 1.00 0.00 N ATOM 294 CA GLU A 22 7.498 11.415 13.741 1.00 0.00 C ATOM 295 C GLU A 22 6.026 11.801 13.865 1.00 0.00 C ATOM 296 O GLU A 22 5.506 11.958 14.969 1.00 0.00 O ATOM 297 CB GLU A 22 8.382 12.622 14.064 1.00 0.00 C ATOM 298 CG GLU A 22 8.096 13.835 13.196 1.00 0.00 C ATOM 299 CD GLU A 22 6.909 14.640 13.689 1.00 0.00 C ATOM 300 OE1 GLU A 22 6.943 15.098 14.850 1.00 0.00 O ATOM 301 OE2 GLU A 22 5.945 14.811 12.913 1.00 0.00 O ATOM 0 H GLU A 22 8.582 11.370 11.947 1.00 0.00 H new ATOM 0 HA GLU A 22 7.708 10.618 14.454 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.243 12.894 15.110 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.428 12.338 13.944 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.978 14.475 13.170 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.909 13.509 12.173 1.00 0.00 H new ATOM 308 N GLY A 23 5.362 11.952 12.724 1.00 0.00 N ATOM 309 CA GLY A 23 3.957 12.319 12.726 1.00 0.00 C ATOM 310 C GLY A 23 3.105 11.352 11.929 1.00 0.00 C ATOM 311 O GLY A 23 2.079 10.873 12.412 1.00 0.00 O ATOM 0 H GLY A 23 5.771 11.827 11.798 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.595 12.355 13.754 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.846 13.322 12.313 1.00 0.00 H new ATOM 315 N VAL A 24 3.528 11.065 10.702 1.00 0.00 N ATOM 316 CA VAL A 24 2.795 10.149 9.835 1.00 0.00 C ATOM 317 C VAL A 24 3.372 8.740 9.911 1.00 0.00 C ATOM 318 O VAL A 24 4.584 8.561 10.026 1.00 0.00 O ATOM 319 CB VAL A 24 2.820 10.623 8.370 1.00 0.00 C ATOM 320 CG1 VAL A 24 1.958 9.719 7.502 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.358 12.069 8.270 1.00 0.00 C ATOM 0 H VAL A 24 4.374 11.453 10.286 1.00 0.00 H new ATOM 0 HA VAL A 24 1.764 10.136 10.188 1.00 0.00 H new ATOM 0 HB VAL A 24 3.846 10.567 8.006 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.988 10.069 6.470 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.338 8.698 7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.930 9.741 7.863 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.382 12.387 7.228 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.341 12.153 8.652 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.020 12.704 8.859 1.00 0.00 H new ATOM 331 N GLN A 25 2.495 7.743 9.846 1.00 0.00 N ATOM 332 CA GLN A 25 2.918 6.349 9.909 1.00 0.00 C ATOM 333 C GLN A 25 2.153 5.503 8.897 1.00 0.00 C ATOM 334 O GLN A 25 0.939 5.648 8.742 1.00 0.00 O ATOM 335 CB GLN A 25 2.710 5.794 11.318 1.00 0.00 C ATOM 336 CG GLN A 25 3.914 5.977 12.229 1.00 0.00 C ATOM 337 CD GLN A 25 3.530 6.068 13.693 1.00 0.00 C ATOM 338 OE1 GLN A 25 2.804 5.218 14.210 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.016 7.102 14.369 1.00 0.00 N ATOM 0 H GLN A 25 1.488 7.875 9.750 1.00 0.00 H new ATOM 0 HA GLN A 25 3.979 6.305 9.663 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.847 6.284 11.768 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.475 4.732 11.250 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.601 5.142 12.089 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.449 6.882 11.941 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.614 7.782 13.900 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.792 7.216 15.357 1.00 0.00 H new ATOM 348 N LEU A 26 2.869 4.619 8.211 1.00 0.00 N ATOM 349 CA LEU A 26 2.257 3.748 7.213 1.00 0.00 C ATOM 350 C LEU A 26 2.533 2.281 7.528 1.00 0.00 C ATOM 351 O LEU A 26 3.648 1.915 7.896 1.00 0.00 O ATOM 352 CB LEU A 26 2.783 4.090 5.818 1.00 0.00 C ATOM 353 CG LEU A 26 1.850 3.765 4.651 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.610 4.643 4.697 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.576 3.934 3.324 1.00 0.00 C ATOM 0 H LEU A 26 3.874 4.486 8.327 1.00 0.00 H new ATOM 0 HA LEU A 26 1.179 3.909 7.238 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.011 5.155 5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.722 3.558 5.665 1.00 0.00 H new ATOM 0 HG LEU A 26 1.537 2.725 4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.041 4.397 3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.078 4.472 5.633 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.903 5.691 4.633 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.896 3.698 2.505 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.920 4.964 3.226 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.433 3.261 3.290 1.00 0.00 H new ATOM 367 N ASN A 27 1.509 1.447 7.378 1.00 0.00 N ATOM 368 CA ASN A 27 1.642 0.019 7.644 1.00 0.00 C ATOM 369 C ASN A 27 1.102 -0.804 6.479 1.00 0.00 C ATOM 370 O ASN A 27 0.135 -0.414 5.824 1.00 0.00 O ATOM 371 CB ASN A 27 0.902 -0.351 8.931 1.00 0.00 C ATOM 372 CG ASN A 27 1.469 0.354 10.148 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.514 -0.031 10.673 1.00 0.00 O ATOM 374 ND2 ASN A 27 0.780 1.395 10.603 1.00 0.00 N ATOM 0 H ASN A 27 0.579 1.735 7.074 1.00 0.00 H new ATOM 0 HA ASN A 27 2.702 -0.206 7.764 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.153 -0.097 8.826 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.957 -1.429 9.081 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.113 1.910 11.418 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.081 1.680 10.137 1.00 0.00 H new ATOM 381 N LEU A 28 1.733 -1.946 6.227 1.00 0.00 N ATOM 382 CA LEU A 28 1.316 -2.826 5.141 1.00 0.00 C ATOM 383 C LEU A 28 0.744 -4.131 5.686 1.00 0.00 C ATOM 384 O LEU A 28 1.372 -4.801 6.506 1.00 0.00 O ATOM 385 CB LEU A 28 2.498 -3.122 4.215 1.00 0.00 C ATOM 386 CG LEU A 28 2.153 -3.380 2.748 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.394 -3.254 1.878 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.520 -4.754 2.583 1.00 0.00 C ATOM 0 H LEU A 28 2.535 -2.284 6.760 1.00 0.00 H new ATOM 0 HA LEU A 28 0.536 -2.317 4.574 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.190 -2.281 4.262 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.027 -3.993 4.602 1.00 0.00 H new ATOM 0 HG LEU A 28 1.431 -2.629 2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.129 -3.441 0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.804 -2.249 1.973 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.139 -3.982 2.199 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.281 -4.921 1.533 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.218 -5.519 2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.607 -4.807 3.176 1.00 0.00 H new ATOM 400 N SER A 29 -0.451 -4.486 5.224 1.00 0.00 N ATOM 401 CA SER A 29 -1.108 -5.710 5.666 1.00 0.00 C ATOM 402 C SER A 29 -1.474 -6.591 4.476 1.00 0.00 C ATOM 403 O SER A 29 -2.105 -6.135 3.522 1.00 0.00 O ATOM 404 CB SER A 29 -2.364 -5.376 6.473 1.00 0.00 C ATOM 405 OG SER A 29 -2.903 -6.536 7.083 1.00 0.00 O ATOM 0 H SER A 29 -0.983 -3.943 4.544 1.00 0.00 H new ATOM 0 HA SER A 29 -0.411 -6.258 6.300 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.123 -4.638 7.238 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.111 -4.925 5.819 1.00 0.00 H new ATOM 0 HG SER A 29 -3.704 -6.295 7.594 1.00 0.00 H new ATOM 411 N PHE A 30 -1.074 -7.857 4.540 1.00 0.00 N ATOM 412 CA PHE A 30 -1.358 -8.803 3.467 1.00 0.00 C ATOM 413 C PHE A 30 -2.571 -9.663 3.808 1.00 0.00 C ATOM 414 O PHE A 30 -2.884 -9.878 4.980 1.00 0.00 O ATOM 415 CB PHE A 30 -0.142 -9.696 3.211 1.00 0.00 C ATOM 416 CG PHE A 30 1.124 -8.927 2.960 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.917 -8.509 4.016 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.520 -8.622 1.668 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.082 -7.802 3.789 1.00 0.00 C ATOM 420 CE2 PHE A 30 2.684 -7.915 1.434 1.00 0.00 C ATOM 421 CZ PHE A 30 3.466 -7.503 2.496 1.00 0.00 C ATOM 0 H PHE A 30 -0.553 -8.251 5.323 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.580 -8.234 2.564 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.005 -10.352 4.069 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.345 -10.336 2.352 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.621 -8.739 5.029 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.912 -8.940 0.834 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.692 -7.483 4.621 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.982 -7.685 0.422 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.375 -6.949 2.316 1.00 0.00 H new ATOM 431 N ILE A 31 -3.251 -10.152 2.777 1.00 0.00 N ATOM 432 CA ILE A 31 -4.430 -10.989 2.967 1.00 0.00 C ATOM 433 C ILE A 31 -4.485 -12.104 1.928 1.00 0.00 C ATOM 434 O ILE A 31 -4.516 -11.845 0.725 1.00 0.00 O ATOM 435 CB ILE A 31 -5.726 -10.162 2.885 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.890 -9.304 4.141 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.928 -11.078 2.702 1.00 0.00 C ATOM 438 CD1 ILE A 31 -5.207 -7.958 4.046 1.00 0.00 C ATOM 0 H ILE A 31 -3.006 -9.983 1.801 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.350 -11.426 3.962 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.663 -9.500 2.021 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.952 -9.151 4.330 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.489 -9.847 4.997 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.837 -10.479 2.646 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.813 -11.650 1.781 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.996 -11.762 3.548 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.365 -7.404 4.971 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.138 -8.103 3.887 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.625 -7.396 3.211 1.00 0.00 H new ATOM 450 N ARG A 32 -4.499 -13.346 2.402 1.00 0.00 N ATOM 451 CA ARG A 32 -4.552 -14.502 1.514 1.00 0.00 C ATOM 452 C ARG A 32 -5.898 -15.212 1.625 1.00 0.00 C ATOM 453 O ARG A 32 -6.117 -16.045 2.504 1.00 0.00 O ATOM 454 CB ARG A 32 -3.420 -15.477 1.844 1.00 0.00 C ATOM 455 CG ARG A 32 -2.037 -14.935 1.525 1.00 0.00 C ATOM 456 CD ARG A 32 -1.651 -15.209 0.080 1.00 0.00 C ATOM 457 NE ARG A 32 -1.442 -16.633 -0.170 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.692 -17.103 -1.161 1.00 0.00 C ATOM 459 NH1 ARG A 32 -0.082 -16.266 -1.989 1.00 0.00 N ATOM 460 NH2 ARG A 32 -0.550 -18.412 -1.324 1.00 0.00 N ATOM 0 H ARG A 32 -4.474 -13.577 3.395 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.431 -14.148 0.490 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.467 -15.729 2.903 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.575 -16.402 1.289 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.014 -13.861 1.712 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.304 -15.390 2.191 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.433 -14.836 -0.581 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.740 -14.661 -0.162 1.00 0.00 H new ATOM 0 HE ARG A 32 -1.897 -17.303 0.450 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.188 -15.259 -1.866 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.493 -16.629 -2.749 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.017 -19.059 -0.688 1.00 0.00 H new ATOM 0 HH22 ARG A 32 0.026 -18.772 -2.085 1.00 0.00 H new ATOM 474 N PRO A 33 -6.822 -14.874 0.713 1.00 0.00 N ATOM 475 CA PRO A 33 -8.162 -15.467 0.687 1.00 0.00 C ATOM 476 C PRO A 33 -8.139 -16.933 0.266 1.00 0.00 C ATOM 477 O PRO A 33 -7.298 -17.364 -0.522 1.00 0.00 O ATOM 478 CB PRO A 33 -8.904 -14.623 -0.353 1.00 0.00 C ATOM 479 CG PRO A 33 -7.833 -14.091 -1.241 1.00 0.00 C ATOM 480 CD PRO A 33 -6.629 -13.888 -0.364 1.00 0.00 C ATOM 0 HA PRO A 33 -8.629 -15.462 1.672 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.620 -15.224 -0.913 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.465 -13.816 0.119 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.614 -14.789 -2.049 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.140 -13.154 -1.704 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.701 -14.064 -0.908 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.582 -12.871 0.026 1.00 0.00 H new ATOM 488 N PRO A 34 -9.086 -17.718 0.802 1.00 0.00 N ATOM 489 CA PRO A 34 -9.196 -19.147 0.494 1.00 0.00 C ATOM 490 C PRO A 34 -9.659 -19.398 -0.937 1.00 0.00 C ATOM 491 O PRO A 34 -9.160 -20.298 -1.611 1.00 0.00 O ATOM 492 CB PRO A 34 -10.246 -19.644 1.491 1.00 0.00 C ATOM 493 CG PRO A 34 -11.064 -18.441 1.812 1.00 0.00 C ATOM 494 CD PRO A 34 -10.122 -17.271 1.748 1.00 0.00 C ATOM 0 HA PRO A 34 -8.236 -19.657 0.575 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.859 -20.435 1.059 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.779 -20.055 2.386 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.881 -18.323 1.100 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.513 -18.527 2.802 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.624 -16.369 1.397 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.700 -17.041 2.726 1.00 0.00 H new ATOM 502 N GLU A 35 -10.616 -18.597 -1.393 1.00 0.00 N ATOM 503 CA GLU A 35 -11.146 -18.734 -2.745 1.00 0.00 C ATOM 504 C GLU A 35 -10.038 -18.579 -3.782 1.00 0.00 C ATOM 505 O GLU A 35 -9.947 -19.358 -4.730 1.00 0.00 O ATOM 506 CB GLU A 35 -12.242 -17.696 -2.995 1.00 0.00 C ATOM 507 CG GLU A 35 -11.768 -16.261 -2.839 1.00 0.00 C ATOM 508 CD GLU A 35 -12.902 -15.302 -2.533 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.860 -15.716 -1.847 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.832 -14.137 -2.978 1.00 0.00 O ATOM 0 H GLU A 35 -11.040 -17.847 -0.847 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.573 -19.732 -2.841 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.637 -17.832 -4.002 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.065 -17.875 -2.303 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.029 -16.211 -2.039 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -11.268 -15.946 -3.755 1.00 0.00 H new ATOM 517 N ASN A 36 -9.196 -17.568 -3.594 1.00 0.00 N ATOM 518 CA ASN A 36 -8.094 -17.309 -4.514 1.00 0.00 C ATOM 519 C ASN A 36 -6.760 -17.294 -3.773 1.00 0.00 C ATOM 520 O ASN A 36 -6.332 -16.273 -3.235 1.00 0.00 O ATOM 521 CB ASN A 36 -8.305 -15.976 -5.234 1.00 0.00 C ATOM 522 CG ASN A 36 -7.624 -15.936 -6.588 1.00 0.00 C ATOM 523 OD1 ASN A 36 -6.614 -16.605 -6.807 1.00 0.00 O ATOM 524 ND2 ASN A 36 -8.175 -15.149 -7.505 1.00 0.00 N ATOM 0 H ASN A 36 -9.256 -16.915 -2.813 1.00 0.00 H new ATOM 0 HA ASN A 36 -8.072 -18.112 -5.251 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -9.373 -15.801 -5.362 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.921 -15.166 -4.613 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -7.761 -15.081 -8.435 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -9.012 -14.612 -7.280 1.00 0.00 H new ATOM 531 N PRO A 37 -6.086 -18.453 -3.745 1.00 0.00 N ATOM 532 CA PRO A 37 -4.790 -18.600 -3.075 1.00 0.00 C ATOM 533 C PRO A 37 -3.675 -17.856 -3.802 1.00 0.00 C ATOM 534 O PRO A 37 -2.701 -17.424 -3.186 1.00 0.00 O ATOM 535 CB PRO A 37 -4.540 -20.109 -3.114 1.00 0.00 C ATOM 536 CG PRO A 37 -5.322 -20.594 -4.285 1.00 0.00 C ATOM 537 CD PRO A 37 -6.537 -19.711 -4.366 1.00 0.00 C ATOM 0 HA PRO A 37 -4.801 -18.182 -2.068 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.479 -20.331 -3.227 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.869 -20.589 -2.192 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.733 -20.532 -5.200 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.606 -21.639 -4.159 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.855 -19.559 -5.397 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.384 -20.142 -3.832 1.00 0.00 H new ATOM 545 N ALA A 38 -3.825 -17.710 -5.114 1.00 0.00 N ATOM 546 CA ALA A 38 -2.831 -17.015 -5.924 1.00 0.00 C ATOM 547 C ALA A 38 -3.054 -15.507 -5.893 1.00 0.00 C ATOM 548 O ALA A 38 -2.283 -14.743 -6.476 1.00 0.00 O ATOM 549 CB ALA A 38 -2.866 -17.527 -7.356 1.00 0.00 C ATOM 0 H ALA A 38 -4.625 -18.063 -5.639 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.847 -17.218 -5.501 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.119 -17.000 -7.949 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.649 -18.595 -7.366 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.855 -17.354 -7.780 1.00 0.00 H new ATOM 555 N LEU A 39 -4.112 -15.084 -5.210 1.00 0.00 N ATOM 556 CA LEU A 39 -4.437 -13.666 -5.104 1.00 0.00 C ATOM 557 C LEU A 39 -3.860 -13.070 -3.824 1.00 0.00 C ATOM 558 O LEU A 39 -3.852 -13.714 -2.774 1.00 0.00 O ATOM 559 CB LEU A 39 -5.953 -13.467 -5.134 1.00 0.00 C ATOM 560 CG LEU A 39 -6.440 -12.017 -5.131 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.304 -11.405 -6.516 1.00 0.00 C ATOM 562 CD2 LEU A 39 -7.882 -11.940 -4.650 1.00 0.00 C ATOM 0 H LEU A 39 -4.759 -15.703 -4.721 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.992 -13.151 -5.956 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.346 -13.960 -6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.383 -13.976 -4.271 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.817 -11.446 -4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.655 -10.373 -6.494 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.258 -11.426 -6.822 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.901 -11.977 -7.227 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.212 -10.901 -4.654 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.519 -12.526 -5.313 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.950 -12.338 -3.638 1.00 0.00 H new ATOM 574 N LEU A 40 -3.380 -11.835 -3.917 1.00 0.00 N ATOM 575 CA LEU A 40 -2.803 -11.149 -2.766 1.00 0.00 C ATOM 576 C LEU A 40 -3.438 -9.775 -2.576 1.00 0.00 C ATOM 577 O LEU A 40 -3.137 -8.833 -3.310 1.00 0.00 O ATOM 578 CB LEU A 40 -1.290 -11.005 -2.940 1.00 0.00 C ATOM 579 CG LEU A 40 -0.509 -10.580 -1.695 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.628 -11.634 -0.605 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.952 -10.331 -2.042 1.00 0.00 C ATOM 0 H LEU A 40 -3.379 -11.288 -4.778 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.005 -11.748 -1.878 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.892 -11.959 -3.286 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.103 -10.276 -3.728 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.937 -9.650 -1.320 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.066 -11.315 0.273 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.677 -11.764 -0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.227 -12.580 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.493 -10.030 -1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.392 -11.245 -2.441 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.019 -9.540 -2.789 1.00 0.00 H new ATOM 593 N LEU A 41 -4.316 -9.668 -1.585 1.00 0.00 N ATOM 594 CA LEU A 41 -4.992 -8.408 -1.295 1.00 0.00 C ATOM 595 C LEU A 41 -4.217 -7.599 -0.261 1.00 0.00 C ATOM 596 O LEU A 41 -4.206 -7.935 0.924 1.00 0.00 O ATOM 597 CB LEU A 41 -6.412 -8.673 -0.792 1.00 0.00 C ATOM 598 CG LEU A 41 -7.276 -9.581 -1.668 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.461 -10.114 -0.878 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.750 -8.834 -2.906 1.00 0.00 C ATOM 0 H LEU A 41 -4.577 -10.438 -0.969 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.041 -7.830 -2.218 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.347 -9.115 0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.922 -7.716 -0.682 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.670 -10.428 -1.990 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.065 -10.758 -1.518 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.101 -10.686 -0.023 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.068 -9.280 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.363 -9.496 -3.518 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.339 -7.968 -2.605 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.887 -8.502 -3.484 1.00 0.00 H new ATOM 612 N ILE A 42 -3.571 -6.530 -0.716 1.00 0.00 N ATOM 613 CA ILE A 42 -2.796 -5.671 0.171 1.00 0.00 C ATOM 614 C ILE A 42 -3.636 -4.503 0.677 1.00 0.00 C ATOM 615 O ILE A 42 -4.277 -3.800 -0.105 1.00 0.00 O ATOM 616 CB ILE A 42 -1.542 -5.121 -0.533 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.561 -6.255 -0.835 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.878 -4.054 0.325 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.332 -5.981 -2.025 1.00 0.00 C ATOM 0 H ILE A 42 -3.569 -6.238 -1.693 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.487 -6.286 1.016 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.844 -4.666 -1.476 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.061 -6.430 0.043 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.122 -7.172 -1.016 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.007 -3.675 -0.186 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.578 -3.236 0.494 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.587 -4.486 1.282 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.001 -6.827 -2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.281 -5.836 -2.914 1.00 0.00 H new ATOM 0 HD13 ILE A 42 0.920 -5.082 -1.839 1.00 0.00 H new ATOM 631 N THR A 43 -3.626 -4.298 1.990 1.00 0.00 N ATOM 632 CA THR A 43 -4.385 -3.215 2.601 1.00 0.00 C ATOM 633 C THR A 43 -3.466 -2.247 3.337 1.00 0.00 C ATOM 634 O THR A 43 -3.018 -2.526 4.450 1.00 0.00 O ATOM 635 CB THR A 43 -5.440 -3.754 3.586 1.00 0.00 C ATOM 636 OG1 THR A 43 -6.015 -4.962 3.076 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.535 -2.725 3.822 1.00 0.00 C ATOM 0 H THR A 43 -3.100 -4.869 2.651 1.00 0.00 H new ATOM 0 HA THR A 43 -4.891 -2.688 1.792 1.00 0.00 H new ATOM 0 HB THR A 43 -4.946 -3.960 4.536 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.683 -5.299 3.709 1.00 0.00 H new ATOM 0 HG21 THR A 43 -7.268 -3.128 4.521 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.098 -1.817 4.238 1.00 0.00 H new ATOM 0 HG23 THR A 43 -7.025 -2.491 2.877 1.00 0.00 H new ATOM 645 N ILE A 44 -3.191 -1.108 2.711 1.00 0.00 N ATOM 646 CA ILE A 44 -2.326 -0.098 3.309 1.00 0.00 C ATOM 647 C ILE A 44 -3.027 0.611 4.463 1.00 0.00 C ATOM 648 O ILE A 44 -4.254 0.712 4.493 1.00 0.00 O ATOM 649 CB ILE A 44 -1.884 0.950 2.271 1.00 0.00 C ATOM 650 CG1 ILE A 44 -1.746 0.306 0.890 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.571 1.593 2.694 1.00 0.00 C ATOM 652 CD1 ILE A 44 -0.917 1.121 -0.078 1.00 0.00 C ATOM 0 H ILE A 44 -3.554 -0.861 1.790 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.445 -0.619 3.686 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.646 1.727 2.214 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.295 -0.680 1.001 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.739 0.156 0.467 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.271 2.332 1.950 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.700 2.082 3.660 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.200 0.827 2.775 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -0.862 0.603 -1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.379 2.098 -0.220 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.088 1.250 0.323 1.00 0.00 H new ATOM 664 N THR A 45 -2.238 1.104 5.413 1.00 0.00 N ATOM 665 CA THR A 45 -2.781 1.805 6.570 1.00 0.00 C ATOM 666 C THR A 45 -1.932 3.021 6.925 1.00 0.00 C ATOM 667 O THR A 45 -0.823 2.886 7.441 1.00 0.00 O ATOM 668 CB THR A 45 -2.870 0.879 7.797 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.695 -0.253 7.499 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.436 1.623 8.997 1.00 0.00 C ATOM 0 H THR A 45 -1.221 1.031 5.404 1.00 0.00 H new ATOM 0 HA THR A 45 -3.784 2.133 6.298 1.00 0.00 H new ATOM 0 HB THR A 45 -1.863 0.540 8.041 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.745 -0.837 8.284 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.489 0.948 9.851 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.790 2.466 9.240 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.435 1.988 8.760 1.00 0.00 H new ATOM 678 N ALA A 46 -2.461 4.208 6.646 1.00 0.00 N ATOM 679 CA ALA A 46 -1.752 5.447 6.939 1.00 0.00 C ATOM 680 C ALA A 46 -2.447 6.227 8.050 1.00 0.00 C ATOM 681 O ALA A 46 -3.551 6.742 7.865 1.00 0.00 O ATOM 682 CB ALA A 46 -1.639 6.300 5.684 1.00 0.00 C ATOM 0 H ALA A 46 -3.378 4.337 6.218 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.750 5.191 7.282 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.107 7.222 5.918 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.092 5.750 4.918 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.637 6.540 5.316 1.00 0.00 H new ATOM 688 N THR A 47 -1.795 6.311 9.205 1.00 0.00 N ATOM 689 CA THR A 47 -2.350 7.027 10.346 1.00 0.00 C ATOM 690 C THR A 47 -1.648 8.364 10.552 1.00 0.00 C ATOM 691 O THR A 47 -0.426 8.457 10.441 1.00 0.00 O ATOM 692 CB THR A 47 -2.238 6.197 11.639 1.00 0.00 C ATOM 693 OG1 THR A 47 -1.021 5.443 11.633 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.424 5.254 11.781 1.00 0.00 C ATOM 0 H THR A 47 -0.881 5.891 9.375 1.00 0.00 H new ATOM 0 HA THR A 47 -3.403 7.203 10.126 1.00 0.00 H new ATOM 0 HB THR A 47 -2.236 6.883 12.486 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.956 4.919 12.459 1.00 0.00 H new ATOM 0 HG21 THR A 47 -3.323 4.678 12.701 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.347 5.833 11.814 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.453 4.574 10.929 1.00 0.00 H new ATOM 702 N ASN A 48 -2.428 9.397 10.854 1.00 0.00 N ATOM 703 CA ASN A 48 -1.879 10.730 11.075 1.00 0.00 C ATOM 704 C ASN A 48 -2.230 11.238 12.471 1.00 0.00 C ATOM 705 O ASN A 48 -3.379 11.151 12.904 1.00 0.00 O ATOM 706 CB ASN A 48 -2.406 11.703 10.019 1.00 0.00 C ATOM 707 CG ASN A 48 -1.762 13.073 10.122 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.669 13.217 10.670 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.439 14.086 9.594 1.00 0.00 N ATOM 0 H ASN A 48 -3.442 9.337 10.951 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.794 10.667 10.992 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -2.222 11.292 9.026 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.486 11.803 10.128 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.056 15.031 9.633 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.342 13.919 9.149 1.00 0.00 H new ATOM 716 N PHE A 49 -1.232 11.768 13.170 1.00 0.00 N ATOM 717 CA PHE A 49 -1.434 12.289 14.516 1.00 0.00 C ATOM 718 C PHE A 49 -0.892 13.711 14.636 1.00 0.00 C ATOM 719 O PHE A 49 -1.039 14.357 15.674 1.00 0.00 O ATOM 720 CB PHE A 49 -0.754 11.383 15.545 1.00 0.00 C ATOM 721 CG PHE A 49 -1.346 10.005 15.614 1.00 0.00 C ATOM 722 CD1 PHE A 49 -2.583 9.796 16.201 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.665 8.917 15.091 1.00 0.00 C ATOM 724 CE1 PHE A 49 -3.130 8.529 16.266 1.00 0.00 C ATOM 725 CE2 PHE A 49 -1.206 7.647 15.153 1.00 0.00 C ATOM 726 CZ PHE A 49 -2.441 7.453 15.741 1.00 0.00 C ATOM 0 H PHE A 49 -0.275 11.848 12.826 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.506 12.310 14.713 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.306 11.303 15.303 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.822 11.849 16.528 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.126 10.634 16.613 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.300 9.064 14.629 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.095 8.380 16.727 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.664 6.808 14.743 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.867 6.462 15.790 1.00 0.00 H new ATOM 736 N SER A 50 -0.266 14.191 13.567 1.00 0.00 N ATOM 737 CA SER A 50 0.303 15.534 13.553 1.00 0.00 C ATOM 738 C SER A 50 -0.783 16.585 13.764 1.00 0.00 C ATOM 739 O SER A 50 -1.973 16.296 13.643 1.00 0.00 O ATOM 740 CB SER A 50 1.027 15.790 12.230 1.00 0.00 C ATOM 741 OG SER A 50 0.141 15.666 11.131 1.00 0.00 O ATOM 0 H SER A 50 -0.140 13.670 12.699 1.00 0.00 H new ATOM 0 HA SER A 50 1.020 15.608 14.371 1.00 0.00 H new ATOM 0 HB2 SER A 50 1.464 16.789 12.238 1.00 0.00 H new ATOM 0 HB3 SER A 50 1.850 15.083 12.119 1.00 0.00 H new ATOM 0 HG SER A 50 0.109 14.731 10.840 1.00 0.00 H new ATOM 747 N GLU A 51 -0.362 17.806 14.081 1.00 0.00 N ATOM 748 CA GLU A 51 -1.298 18.900 14.309 1.00 0.00 C ATOM 749 C GLU A 51 -1.866 19.415 12.990 1.00 0.00 C ATOM 750 O GLU A 51 -2.749 20.272 12.974 1.00 0.00 O ATOM 751 CB GLU A 51 -0.609 20.041 15.060 1.00 0.00 C ATOM 752 CG GLU A 51 0.711 20.469 14.440 1.00 0.00 C ATOM 753 CD GLU A 51 1.215 21.788 14.993 1.00 0.00 C ATOM 754 OE1 GLU A 51 0.429 22.758 15.022 1.00 0.00 O ATOM 755 OE2 GLU A 51 2.395 21.850 15.396 1.00 0.00 O ATOM 0 H GLU A 51 0.620 18.062 14.185 1.00 0.00 H new ATOM 0 HA GLU A 51 -2.121 18.520 14.915 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.280 20.899 15.094 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.433 19.732 16.091 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.459 19.696 14.617 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.590 20.555 13.360 1.00 0.00 H new ATOM 762 N GLY A 52 -1.352 18.885 11.884 1.00 0.00 N ATOM 763 CA GLY A 52 -1.819 19.303 10.575 1.00 0.00 C ATOM 764 C GLY A 52 -2.517 18.186 9.825 1.00 0.00 C ATOM 765 O GLY A 52 -1.888 17.199 9.442 1.00 0.00 O ATOM 0 H GLY A 52 -0.621 18.174 11.871 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.504 20.144 10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.973 19.658 9.987 1.00 0.00 H new ATOM 769 N ASP A 53 -3.819 18.340 9.616 1.00 0.00 N ATOM 770 CA ASP A 53 -4.604 17.336 8.907 1.00 0.00 C ATOM 771 C ASP A 53 -4.096 17.157 7.479 1.00 0.00 C ATOM 772 O ASP A 53 -3.655 18.114 6.842 1.00 0.00 O ATOM 773 CB ASP A 53 -6.081 17.731 8.889 1.00 0.00 C ATOM 774 CG ASP A 53 -6.570 18.206 10.244 1.00 0.00 C ATOM 775 OD1 ASP A 53 -6.240 19.348 10.627 1.00 0.00 O ATOM 776 OD2 ASP A 53 -7.282 17.435 10.920 1.00 0.00 O ATOM 0 H ASP A 53 -4.354 19.151 9.927 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.496 16.388 9.434 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -6.234 18.521 8.153 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.679 16.877 8.569 1.00 0.00 H new ATOM 781 N VAL A 54 -4.160 15.926 6.984 1.00 0.00 N ATOM 782 CA VAL A 54 -3.706 15.621 5.632 1.00 0.00 C ATOM 783 C VAL A 54 -4.880 15.271 4.724 1.00 0.00 C ATOM 784 O VAL A 54 -5.811 14.577 5.133 1.00 0.00 O ATOM 785 CB VAL A 54 -2.702 14.453 5.626 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.237 14.155 4.209 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.518 14.765 6.530 1.00 0.00 C ATOM 0 H VAL A 54 -4.522 15.123 7.499 1.00 0.00 H new ATOM 0 HA VAL A 54 -3.212 16.517 5.255 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.202 13.565 6.012 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.528 13.327 4.225 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.095 13.886 3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.754 15.038 3.791 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.818 13.929 6.514 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.016 15.665 6.175 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.870 14.924 7.549 1.00 0.00 H new ATOM 797 N THR A 55 -4.830 15.757 3.487 1.00 0.00 N ATOM 798 CA THR A 55 -5.889 15.497 2.521 1.00 0.00 C ATOM 799 C THR A 55 -5.322 15.333 1.115 1.00 0.00 C ATOM 800 O THR A 55 -4.122 15.497 0.896 1.00 0.00 O ATOM 801 CB THR A 55 -6.933 16.630 2.512 1.00 0.00 C ATOM 802 OG1 THR A 55 -6.294 17.882 2.240 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.661 16.705 3.846 1.00 0.00 C ATOM 0 H THR A 55 -4.067 16.333 3.131 1.00 0.00 H new ATOM 0 HA THR A 55 -6.374 14.569 2.826 1.00 0.00 H new ATOM 0 HB THR A 55 -7.662 16.417 1.730 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.964 18.597 2.234 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.393 17.512 3.816 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.170 15.760 4.036 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.942 16.897 4.643 1.00 0.00 H new ATOM 811 N HIS A 56 -6.194 15.009 0.165 1.00 0.00 N ATOM 812 CA HIS A 56 -5.779 14.824 -1.221 1.00 0.00 C ATOM 813 C HIS A 56 -4.549 13.925 -1.305 1.00 0.00 C ATOM 814 O HIS A 56 -3.666 14.140 -2.136 1.00 0.00 O ATOM 815 CB HIS A 56 -5.483 16.175 -1.872 1.00 0.00 C ATOM 816 CG HIS A 56 -5.623 16.165 -3.363 1.00 0.00 C ATOM 817 ND1 HIS A 56 -4.564 16.382 -4.220 1.00 0.00 N ATOM 818 CD2 HIS A 56 -6.706 15.961 -4.150 1.00 0.00 C ATOM 819 CE1 HIS A 56 -4.990 16.313 -5.468 1.00 0.00 C ATOM 820 NE2 HIS A 56 -6.286 16.059 -5.454 1.00 0.00 N ATOM 0 H HIS A 56 -7.191 14.869 0.329 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.596 14.342 -1.757 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -6.157 16.924 -1.457 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.469 16.480 -1.613 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.713 15.759 -3.815 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -4.382 16.442 -6.351 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -6.878 15.953 -6.277 1.00 0.00 H new ATOM 828 N PHE A 57 -4.497 12.918 -0.439 1.00 0.00 N ATOM 829 CA PHE A 57 -3.375 11.988 -0.414 1.00 0.00 C ATOM 830 C PHE A 57 -3.563 10.881 -1.447 1.00 0.00 C ATOM 831 O PHE A 57 -4.621 10.255 -1.516 1.00 0.00 O ATOM 832 CB PHE A 57 -3.220 11.379 0.981 1.00 0.00 C ATOM 833 CG PHE A 57 -2.572 10.024 0.975 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.400 9.805 0.270 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.136 8.969 1.674 1.00 0.00 C ATOM 836 CE1 PHE A 57 -0.801 8.560 0.263 1.00 0.00 C ATOM 837 CE2 PHE A 57 -2.542 7.722 1.671 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.373 7.516 0.964 1.00 0.00 C ATOM 0 H PHE A 57 -5.219 12.726 0.255 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.470 12.543 -0.663 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.628 12.053 1.599 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.203 11.301 1.446 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.949 10.617 -0.281 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.050 9.123 2.227 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.113 8.403 -0.290 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.991 6.908 2.221 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.908 6.541 0.959 1.00 0.00 H new ATOM 848 N ILE A 58 -2.529 10.645 -2.248 1.00 0.00 N ATOM 849 CA ILE A 58 -2.580 9.614 -3.277 1.00 0.00 C ATOM 850 C ILE A 58 -1.484 8.574 -3.067 1.00 0.00 C ATOM 851 O ILE A 58 -0.322 8.917 -2.848 1.00 0.00 O ATOM 852 CB ILE A 58 -2.436 10.217 -4.686 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.635 11.112 -5.006 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.301 9.112 -5.724 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.439 12.554 -4.593 1.00 0.00 C ATOM 0 H ILE A 58 -1.646 11.154 -2.204 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.555 9.134 -3.195 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.533 10.827 -4.714 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.832 11.073 -6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.518 10.716 -4.505 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.200 9.554 -6.715 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.419 8.511 -5.503 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.187 8.478 -5.698 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.328 13.130 -4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.272 12.605 -3.517 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.575 12.968 -5.114 1.00 0.00 H new ATOM 867 N CYS A 59 -1.862 7.303 -3.136 1.00 0.00 N ATOM 868 CA CYS A 59 -0.912 6.211 -2.955 1.00 0.00 C ATOM 869 C CYS A 59 -0.804 5.368 -4.222 1.00 0.00 C ATOM 870 O CYS A 59 -1.686 4.563 -4.519 1.00 0.00 O ATOM 871 CB CYS A 59 -1.332 5.332 -1.777 1.00 0.00 C ATOM 872 SG CYS A 59 0.001 4.312 -1.104 1.00 0.00 S ATOM 0 H CYS A 59 -2.820 7.003 -3.316 1.00 0.00 H new ATOM 0 HA CYS A 59 0.066 6.644 -2.745 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.723 5.969 -0.984 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.147 4.682 -2.095 1.00 0.00 H new ATOM 0 HG CYS A 59 -0.303 3.942 0.105 1.00 0.00 H new ATOM 878 N GLN A 60 0.282 5.561 -4.963 1.00 0.00 N ATOM 879 CA GLN A 60 0.504 4.819 -6.199 1.00 0.00 C ATOM 880 C GLN A 60 1.487 3.675 -5.979 1.00 0.00 C ATOM 881 O GLN A 60 2.158 3.610 -4.949 1.00 0.00 O ATOM 882 CB GLN A 60 1.027 5.753 -7.292 1.00 0.00 C ATOM 883 CG GLN A 60 0.143 6.967 -7.529 1.00 0.00 C ATOM 884 CD GLN A 60 0.464 7.678 -8.829 1.00 0.00 C ATOM 885 OE1 GLN A 60 0.973 7.071 -9.773 1.00 0.00 O ATOM 886 NE2 GLN A 60 0.167 8.971 -8.887 1.00 0.00 N ATOM 0 H GLN A 60 1.021 6.224 -4.730 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.450 4.398 -6.516 1.00 0.00 H new ATOM 0 HB2 GLN A 60 2.028 6.090 -7.022 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.119 5.194 -8.223 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -0.901 6.655 -7.538 1.00 0.00 H new ATOM 0 HG3 GLN A 60 0.260 7.664 -6.699 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.254 9.434 -8.082 1.00 0.00 H new ATOM 0 HE22 GLN A 60 0.360 9.501 -9.737 1.00 0.00 H new ATOM 895 N ALA A 61 1.566 2.773 -6.952 1.00 0.00 N ATOM 896 CA ALA A 61 2.469 1.632 -6.865 1.00 0.00 C ATOM 897 C ALA A 61 2.869 1.142 -8.252 1.00 0.00 C ATOM 898 O ALA A 61 2.417 1.675 -9.264 1.00 0.00 O ATOM 899 CB ALA A 61 1.821 0.506 -6.072 1.00 0.00 C ATOM 0 H ALA A 61 1.015 2.811 -7.810 1.00 0.00 H new ATOM 0 HA ALA A 61 3.373 1.953 -6.347 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.506 -0.340 -6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.591 0.855 -5.065 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.901 0.195 -6.567 1.00 0.00 H new ATOM 905 N ALA A 62 3.722 0.123 -8.291 1.00 0.00 N ATOM 906 CA ALA A 62 4.183 -0.440 -9.554 1.00 0.00 C ATOM 907 C ALA A 62 4.552 -1.911 -9.398 1.00 0.00 C ATOM 908 O ALA A 62 5.225 -2.294 -8.441 1.00 0.00 O ATOM 909 CB ALA A 62 5.370 0.351 -10.082 1.00 0.00 C ATOM 0 H ALA A 62 4.108 -0.329 -7.462 1.00 0.00 H new ATOM 0 HA ALA A 62 3.366 -0.372 -10.273 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.704 -0.080 -11.026 1.00 0.00 H new ATOM 0 HB2 ALA A 62 5.074 1.388 -10.242 1.00 0.00 H new ATOM 0 HB3 ALA A 62 6.184 0.313 -9.358 1.00 0.00 H new ATOM 915 N VAL A 63 4.105 -2.732 -10.343 1.00 0.00 N ATOM 916 CA VAL A 63 4.389 -4.162 -10.310 1.00 0.00 C ATOM 917 C VAL A 63 4.860 -4.660 -11.672 1.00 0.00 C ATOM 918 O VAL A 63 4.496 -4.122 -12.717 1.00 0.00 O ATOM 919 CB VAL A 63 3.151 -4.970 -9.880 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.515 -4.355 -8.643 1.00 0.00 C ATOM 921 CG2 VAL A 63 2.147 -5.054 -11.020 1.00 0.00 C ATOM 0 H VAL A 63 3.545 -2.432 -11.141 1.00 0.00 H new ATOM 0 HA VAL A 63 5.183 -4.311 -9.578 1.00 0.00 H new ATOM 0 HB VAL A 63 3.468 -5.983 -9.631 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.642 -4.940 -8.354 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.236 -4.353 -7.826 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.210 -3.331 -8.861 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.278 -5.629 -10.698 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.833 -4.049 -11.303 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.609 -5.544 -11.877 1.00 0.00 H new ATOM 931 N PRO A 64 5.688 -5.715 -11.662 1.00 0.00 N ATOM 932 CA PRO A 64 6.226 -6.311 -12.889 1.00 0.00 C ATOM 933 C PRO A 64 5.156 -7.035 -13.699 1.00 0.00 C ATOM 934 O PRO A 64 4.245 -7.645 -13.139 1.00 0.00 O ATOM 935 CB PRO A 64 7.270 -7.304 -12.372 1.00 0.00 C ATOM 936 CG PRO A 64 6.817 -7.648 -10.996 1.00 0.00 C ATOM 937 CD PRO A 64 6.164 -6.407 -10.452 1.00 0.00 C ATOM 0 HA PRO A 64 6.632 -5.558 -13.565 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.321 -8.190 -13.005 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.266 -6.862 -12.362 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.116 -8.482 -11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.658 -7.951 -10.373 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.343 -6.648 -9.777 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.869 -5.795 -9.890 1.00 0.00 H new ATOM 945 N LYS A 65 5.273 -6.964 -15.021 1.00 0.00 N ATOM 946 CA LYS A 65 4.317 -7.614 -15.909 1.00 0.00 C ATOM 947 C LYS A 65 3.880 -8.963 -15.345 1.00 0.00 C ATOM 948 O LYS A 65 2.697 -9.303 -15.371 1.00 0.00 O ATOM 949 CB LYS A 65 4.929 -7.805 -17.299 1.00 0.00 C ATOM 950 CG LYS A 65 5.016 -6.522 -18.106 1.00 0.00 C ATOM 951 CD LYS A 65 5.988 -6.657 -19.266 1.00 0.00 C ATOM 952 CE LYS A 65 6.262 -5.314 -19.924 1.00 0.00 C ATOM 953 NZ LYS A 65 5.189 -4.938 -20.886 1.00 0.00 N ATOM 0 H LYS A 65 6.021 -6.463 -15.501 1.00 0.00 H new ATOM 0 HA LYS A 65 3.440 -6.972 -15.990 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.929 -8.226 -17.192 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.335 -8.533 -17.852 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.028 -6.263 -18.486 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.333 -5.705 -17.458 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.924 -7.086 -18.909 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.581 -7.348 -20.004 1.00 0.00 H new ATOM 0 HE2 LYS A 65 6.348 -4.545 -19.157 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.219 -5.353 -20.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 5.413 -4.017 -21.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 5.124 -5.659 -21.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.280 -4.875 -20.385 1.00 0.00 H new ATOM 967 N SER A 66 4.841 -9.725 -14.835 1.00 0.00 N ATOM 968 CA SER A 66 4.555 -11.038 -14.267 1.00 0.00 C ATOM 969 C SER A 66 3.306 -10.990 -13.392 1.00 0.00 C ATOM 970 O SER A 66 2.402 -11.814 -13.535 1.00 0.00 O ATOM 971 CB SER A 66 5.748 -11.532 -13.447 1.00 0.00 C ATOM 972 OG SER A 66 6.655 -12.263 -14.254 1.00 0.00 O ATOM 0 H SER A 66 5.825 -9.457 -14.803 1.00 0.00 H new ATOM 0 HA SER A 66 4.376 -11.732 -15.088 1.00 0.00 H new ATOM 0 HB2 SER A 66 6.261 -10.682 -12.997 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.396 -12.161 -12.629 1.00 0.00 H new ATOM 0 HG SER A 66 7.409 -12.566 -13.706 1.00 0.00 H new ATOM 978 N LEU A 67 3.264 -10.021 -12.485 1.00 0.00 N ATOM 979 CA LEU A 67 2.126 -9.864 -11.585 1.00 0.00 C ATOM 980 C LEU A 67 1.201 -8.750 -12.066 1.00 0.00 C ATOM 981 O LEU A 67 1.577 -7.943 -12.915 1.00 0.00 O ATOM 982 CB LEU A 67 2.611 -9.564 -10.166 1.00 0.00 C ATOM 983 CG LEU A 67 3.805 -10.384 -9.677 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.304 -9.856 -8.341 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.432 -11.855 -9.566 1.00 0.00 C ATOM 0 H LEU A 67 4.004 -9.332 -12.353 1.00 0.00 H new ATOM 0 HA LEU A 67 1.566 -10.799 -11.580 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.874 -8.508 -10.109 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.780 -9.723 -9.478 1.00 0.00 H new ATOM 0 HG LEU A 67 4.610 -10.288 -10.405 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.154 -10.452 -8.009 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.611 -8.816 -8.453 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.505 -9.921 -7.603 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.294 -12.424 -9.217 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.611 -11.970 -8.859 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.124 -12.227 -10.543 1.00 0.00 H new ATOM 997 N GLN A 68 -0.008 -8.713 -11.514 1.00 0.00 N ATOM 998 CA GLN A 68 -0.985 -7.696 -11.886 1.00 0.00 C ATOM 999 C GLN A 68 -1.228 -6.728 -10.733 1.00 0.00 C ATOM 1000 O GLN A 68 -0.892 -7.017 -9.584 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.302 -8.353 -12.302 1.00 0.00 C ATOM 1002 CG GLN A 68 -3.090 -7.545 -13.320 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.345 -8.256 -13.785 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -4.322 -9.451 -14.082 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.451 -7.524 -13.851 1.00 0.00 N ATOM 0 H GLN A 68 -0.334 -9.374 -10.809 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.585 -7.134 -12.730 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -2.091 -9.339 -12.717 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.918 -8.505 -11.416 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.362 -6.584 -12.883 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.456 -7.335 -14.181 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.425 -6.537 -13.595 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.326 -7.949 -14.157 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.814 -5.578 -11.047 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.103 -4.565 -10.037 1.00 0.00 C ATOM 1016 C LEU A 69 -3.467 -3.928 -10.279 1.00 0.00 C ATOM 1017 O LEU A 69 -3.877 -3.734 -11.423 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.016 -3.489 -10.040 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.003 -2.544 -8.838 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -0.895 -3.332 -7.542 1.00 0.00 C ATOM 1021 CD2 LEU A 69 0.141 -1.548 -8.955 1.00 0.00 C ATOM 0 H LEU A 69 -2.099 -5.323 -11.993 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.119 -5.053 -9.063 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.046 -3.982 -10.100 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.127 -2.892 -10.945 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.941 -1.989 -8.826 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.887 -2.643 -6.697 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.748 -4.005 -7.453 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.027 -3.913 -7.545 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.135 -0.884 -8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.089 -2.085 -8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.020 -0.961 -9.865 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.163 -3.602 -9.195 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.481 -2.984 -9.291 1.00 0.00 C ATOM 1035 C GLN A 70 -5.642 -1.881 -8.250 1.00 0.00 C ATOM 1036 O GLN A 70 -5.661 -2.146 -7.047 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.575 -4.037 -9.109 1.00 0.00 C ATOM 1038 CG GLN A 70 -7.983 -3.466 -9.161 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.500 -3.316 -10.578 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -8.582 -2.207 -11.107 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -8.853 -4.434 -11.201 1.00 0.00 N ATOM 0 H GLN A 70 -3.837 -3.755 -8.241 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.575 -2.540 -10.282 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.470 -4.795 -9.885 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.430 -4.538 -8.152 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.655 -4.115 -8.600 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.995 -2.493 -8.669 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -8.768 -5.332 -10.724 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.209 -4.395 -12.156 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.757 -0.644 -8.720 1.00 0.00 N ATOM 1051 CA LEU A 71 -5.916 0.501 -7.830 1.00 0.00 C ATOM 1052 C LEU A 71 -7.368 0.649 -7.387 1.00 0.00 C ATOM 1053 O LEU A 71 -8.240 0.980 -8.190 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.450 1.781 -8.525 1.00 0.00 C ATOM 1055 CG LEU A 71 -4.993 2.916 -7.607 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -3.950 3.778 -8.301 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -6.182 3.760 -7.171 1.00 0.00 C ATOM 0 H LEU A 71 -5.743 -0.408 -9.712 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.301 0.331 -6.946 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.627 1.528 -9.194 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.265 2.150 -9.147 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.538 2.478 -6.718 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.637 4.580 -7.632 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.087 3.166 -8.562 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.377 4.207 -9.207 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.839 4.563 -6.518 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.666 4.188 -8.049 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.894 3.135 -6.633 1.00 0.00 H new ATOM 1069 N GLN A 72 -7.619 0.402 -6.105 1.00 0.00 N ATOM 1070 CA GLN A 72 -8.965 0.509 -5.556 1.00 0.00 C ATOM 1071 C GLN A 72 -9.247 1.930 -5.079 1.00 0.00 C ATOM 1072 O GLN A 72 -8.330 2.736 -4.922 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.147 -0.475 -4.400 1.00 0.00 C ATOM 1074 CG GLN A 72 -10.589 -0.612 -3.939 1.00 0.00 C ATOM 1075 CD GLN A 72 -11.541 -0.913 -5.080 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.507 -0.185 -5.306 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.271 -1.992 -5.806 1.00 0.00 N ATOM 0 H GLN A 72 -6.908 0.127 -5.428 1.00 0.00 H new ATOM 0 HA GLN A 72 -9.673 0.264 -6.347 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -8.777 -1.454 -4.705 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.534 -0.151 -3.558 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -10.655 -1.407 -3.197 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -10.898 0.310 -3.447 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -10.459 -2.567 -5.582 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -11.876 -2.246 -6.587 1.00 0.00 H new ATOM 1086 N ALA A 73 -10.521 2.231 -4.851 1.00 0.00 N ATOM 1087 CA ALA A 73 -10.923 3.554 -4.390 1.00 0.00 C ATOM 1088 C ALA A 73 -10.655 3.721 -2.899 1.00 0.00 C ATOM 1089 O ALA A 73 -11.011 2.873 -2.081 1.00 0.00 O ATOM 1090 CB ALA A 73 -12.395 3.794 -4.694 1.00 0.00 C ATOM 0 H ALA A 73 -11.293 1.576 -4.978 1.00 0.00 H new ATOM 0 HA ALA A 73 -10.327 4.294 -4.924 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.682 4.786 -4.344 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.560 3.727 -5.769 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -12.999 3.042 -4.186 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.011 4.840 -2.534 1.00 0.00 N ATOM 1097 CA PRO A 74 -9.680 5.144 -1.139 1.00 0.00 C ATOM 1098 C PRO A 74 -10.917 5.468 -0.307 1.00 0.00 C ATOM 1099 O PRO A 74 -12.040 5.434 -0.809 1.00 0.00 O ATOM 1100 CB PRO A 74 -8.773 6.372 -1.248 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.161 7.015 -2.535 1.00 0.00 C ATOM 1102 CD PRO A 74 -9.557 5.894 -3.456 1.00 0.00 C ATOM 0 HA PRO A 74 -9.214 4.296 -0.637 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -8.920 7.049 -0.407 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -7.721 6.088 -1.248 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -9.987 7.711 -2.390 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -8.332 7.587 -2.951 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.349 6.197 -4.141 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -8.718 5.560 -4.066 1.00 0.00 H new ATOM 1110 N SER A 75 -10.703 5.781 0.966 1.00 0.00 N ATOM 1111 CA SER A 75 -11.801 6.108 1.869 1.00 0.00 C ATOM 1112 C SER A 75 -12.323 7.516 1.601 1.00 0.00 C ATOM 1113 O SER A 75 -13.531 7.737 1.517 1.00 0.00 O ATOM 1114 CB SER A 75 -11.346 5.989 3.324 1.00 0.00 C ATOM 1115 OG SER A 75 -12.112 6.830 4.169 1.00 0.00 O ATOM 0 H SER A 75 -9.779 5.815 1.396 1.00 0.00 H new ATOM 0 HA SER A 75 -12.609 5.399 1.690 1.00 0.00 H new ATOM 0 HB2 SER A 75 -11.440 4.954 3.654 1.00 0.00 H new ATOM 0 HB3 SER A 75 -10.292 6.254 3.401 1.00 0.00 H new ATOM 0 HG SER A 75 -11.802 6.734 5.094 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.403 8.467 1.467 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.789 9.842 1.210 1.00 0.00 C ATOM 1123 C GLY A 76 -10.593 10.765 1.078 1.00 0.00 C ATOM 1124 O GLY A 76 -10.684 11.955 1.374 1.00 0.00 O ATOM 0 H GLY A 76 -10.397 8.309 1.532 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.380 9.885 0.295 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.428 10.194 2.020 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.469 10.213 0.634 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.249 10.995 0.465 1.00 0.00 C ATOM 1130 C ASN A 77 -8.120 12.045 1.564 1.00 0.00 C ATOM 1131 O ASN A 77 -7.589 13.133 1.340 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.238 11.672 -0.907 1.00 0.00 C ATOM 1133 CG ASN A 77 -7.983 10.690 -2.034 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -8.292 9.504 -1.921 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -7.416 11.182 -3.130 1.00 0.00 N ATOM 0 H ASN A 77 -9.377 9.228 0.385 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.399 10.316 0.534 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.194 12.169 -1.071 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.470 12.445 -0.922 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -7.220 10.569 -3.922 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.177 12.172 -3.180 1.00 0.00 H new ATOM 1142 N THR A 78 -8.609 11.711 2.755 1.00 0.00 N ATOM 1143 CA THR A 78 -8.549 12.624 3.889 1.00 0.00 C ATOM 1144 C THR A 78 -8.236 11.877 5.181 1.00 0.00 C ATOM 1145 O THR A 78 -8.743 10.780 5.413 1.00 0.00 O ATOM 1146 CB THR A 78 -9.872 13.393 4.062 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.184 14.108 2.861 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.785 14.365 5.229 1.00 0.00 C ATOM 0 H THR A 78 -9.051 10.814 2.958 1.00 0.00 H new ATOM 0 HA THR A 78 -7.749 13.334 3.680 1.00 0.00 H new ATOM 0 HB THR A 78 -10.662 12.671 4.270 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.632 13.507 2.229 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.731 14.896 5.331 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.577 13.814 6.146 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.984 15.082 5.047 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.399 12.479 6.019 1.00 0.00 N ATOM 1157 CA VAL A 79 -7.020 11.871 7.289 1.00 0.00 C ATOM 1158 C VAL A 79 -7.049 12.895 8.419 1.00 0.00 C ATOM 1159 O VAL A 79 -6.439 13.961 8.339 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.614 11.245 7.214 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.267 10.555 8.524 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.527 10.271 6.049 1.00 0.00 C ATOM 0 H VAL A 79 -6.970 13.387 5.842 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.748 11.087 7.495 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.888 12.041 7.047 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.271 10.119 8.453 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.287 11.283 9.335 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.994 9.768 8.725 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.527 9.838 6.011 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.262 9.477 6.183 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.730 10.799 5.117 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.774 12.565 9.497 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.900 13.442 10.665 1.00 0.00 C ATOM 1174 C PRO A 80 -6.598 13.549 11.452 1.00 0.00 C ATOM 1175 O PRO A 80 -5.950 12.542 11.738 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.979 12.757 11.508 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.916 11.322 11.113 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.527 11.310 9.660 1.00 0.00 C ATOM 0 HA PRO A 80 -8.146 14.465 10.382 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.788 12.883 12.574 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.964 13.179 11.309 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.186 10.783 11.717 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.878 10.833 11.264 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.917 10.441 9.415 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.402 11.279 9.010 1.00 0.00 H new ATOM 1186 N ALA A 81 -6.222 14.775 11.800 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.999 15.013 12.557 1.00 0.00 C ATOM 1188 C ALA A 81 -5.214 14.755 14.044 1.00 0.00 C ATOM 1189 O ALA A 81 -4.296 14.911 14.850 1.00 0.00 O ATOM 1190 CB ALA A 81 -4.507 16.435 12.331 1.00 0.00 C ATOM 0 H ALA A 81 -6.747 15.619 11.570 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.240 14.317 12.201 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.593 16.599 12.902 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.304 16.586 11.271 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -5.271 17.141 12.658 1.00 0.00 H new ATOM 1196 N ARG A 82 -6.432 14.361 14.401 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.768 14.084 15.793 1.00 0.00 C ATOM 1198 C ARG A 82 -7.070 12.602 15.994 1.00 0.00 C ATOM 1199 O ARG A 82 -8.144 12.236 16.471 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.970 14.925 16.227 1.00 0.00 C ATOM 1201 CG ARG A 82 -7.901 16.371 15.765 1.00 0.00 C ATOM 1202 CD ARG A 82 -6.604 17.034 16.204 1.00 0.00 C ATOM 1203 NE ARG A 82 -6.712 18.490 16.220 1.00 0.00 N ATOM 1204 CZ ARG A 82 -5.693 19.300 16.483 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -4.495 18.798 16.750 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -5.870 20.615 16.478 1.00 0.00 N ATOM 0 H ARG A 82 -7.202 14.226 13.746 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.908 14.348 16.408 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.880 14.471 15.836 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -8.044 14.903 17.314 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.982 16.412 14.679 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -8.749 16.924 16.169 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.334 16.680 17.199 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.799 16.738 15.531 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.620 18.908 16.018 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.355 17.788 16.754 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.714 19.422 16.952 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.790 21.005 16.272 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.086 21.236 16.680 1.00 0.00 H new ATOM 1220 N GLY A 83 -6.115 11.753 15.627 1.00 0.00 N ATOM 1221 CA GLY A 83 -6.299 10.321 15.774 1.00 0.00 C ATOM 1222 C GLY A 83 -7.724 9.887 15.493 1.00 0.00 C ATOM 1223 O GLY A 83 -8.506 9.664 16.415 1.00 0.00 O ATOM 0 H GLY A 83 -5.217 12.031 15.231 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.623 9.800 15.096 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -6.025 10.025 16.787 1.00 0.00 H new ATOM 1227 N GLY A 84 -8.063 9.769 14.212 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.403 9.361 13.835 1.00 0.00 C ATOM 1229 C GLY A 84 -9.421 8.033 13.104 1.00 0.00 C ATOM 1230 O GLY A 84 -9.227 6.979 13.711 1.00 0.00 O ATOM 0 H GLY A 84 -7.433 9.949 13.430 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.022 9.288 14.729 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.848 10.128 13.200 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.657 8.082 11.798 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.702 6.873 10.983 1.00 0.00 C ATOM 1236 C LEU A 85 -8.783 6.998 9.772 1.00 0.00 C ATOM 1237 O LEU A 85 -8.991 7.827 8.886 1.00 0.00 O ATOM 1238 CB LEU A 85 -11.134 6.596 10.523 1.00 0.00 C ATOM 1239 CG LEU A 85 -12.216 6.705 11.598 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.478 8.162 11.946 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.498 6.027 11.136 1.00 0.00 C ATOM 0 H LEU A 85 -9.820 8.946 11.281 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.356 6.040 11.595 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.377 7.291 9.719 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.171 5.593 10.099 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.862 6.196 12.495 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.251 8.220 12.713 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.561 8.617 12.320 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.810 8.695 11.055 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -14.257 6.115 11.914 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.855 6.507 10.225 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.301 4.973 10.938 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.741 6.154 9.729 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.771 6.148 8.630 1.00 0.00 C ATOM 1255 C PRO A 86 -7.371 5.628 7.329 1.00 0.00 C ATOM 1256 O PRO A 86 -8.410 4.967 7.335 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.675 5.203 9.129 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.362 4.305 10.099 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.431 5.139 10.750 1.00 0.00 C ATOM 0 HA PRO A 86 -6.414 7.151 8.397 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.236 4.637 8.307 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.864 5.754 9.605 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.795 3.442 9.593 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.661 3.922 10.840 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.308 4.543 11.003 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.078 5.594 11.675 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.711 5.929 6.216 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.180 5.490 4.908 1.00 0.00 C ATOM 1269 C ILE A 87 -6.628 4.111 4.561 1.00 0.00 C ATOM 1270 O ILE A 87 -5.500 3.773 4.920 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.779 6.484 3.803 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.135 7.913 4.218 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.460 6.122 2.491 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.389 8.973 3.439 1.00 0.00 C ATOM 0 H ILE A 87 -5.850 6.475 6.194 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.267 5.441 4.963 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.700 6.426 3.657 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.206 8.064 4.087 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.923 8.038 5.280 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.166 6.834 1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.161 5.118 2.191 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.542 6.154 2.622 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.692 9.961 3.787 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.317 8.848 3.590 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.620 8.875 2.378 1.00 0.00 H new ATOM 1286 N THR A 88 -7.431 3.318 3.857 1.00 0.00 N ATOM 1287 CA THR A 88 -7.024 1.977 3.460 1.00 0.00 C ATOM 1288 C THR A 88 -7.221 1.762 1.964 1.00 0.00 C ATOM 1289 O THR A 88 -8.319 1.951 1.441 1.00 0.00 O ATOM 1290 CB THR A 88 -7.811 0.899 4.230 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.218 1.125 4.088 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.438 0.907 5.705 1.00 0.00 C ATOM 0 H THR A 88 -8.367 3.583 3.550 1.00 0.00 H new ATOM 0 HA THR A 88 -5.965 1.885 3.701 1.00 0.00 H new ATOM 0 HB THR A 88 -7.555 -0.075 3.812 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.390 1.600 3.248 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.006 0.138 6.228 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.372 0.706 5.812 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.668 1.883 6.133 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.152 1.366 1.281 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.209 1.126 -0.156 1.00 0.00 C ATOM 1302 C GLN A 89 -6.016 -0.354 -0.469 1.00 0.00 C ATOM 1303 O GLN A 89 -5.039 -0.968 -0.037 1.00 0.00 O ATOM 1304 CB GLN A 89 -5.144 1.955 -0.876 1.00 0.00 C ATOM 1305 CG GLN A 89 -5.573 3.387 -1.154 1.00 0.00 C ATOM 1306 CD GLN A 89 -6.566 3.488 -2.294 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -7.695 3.006 -2.194 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -6.151 4.117 -3.388 1.00 0.00 N ATOM 0 H GLN A 89 -5.236 1.205 1.700 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.195 1.428 -0.510 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -4.236 1.967 -0.273 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -4.894 1.470 -1.819 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -6.016 3.811 -0.253 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -4.694 3.986 -1.389 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.207 4.501 -3.428 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.776 4.216 -4.188 1.00 0.00 H new ATOM 1317 N LEU A 90 -6.953 -0.921 -1.221 1.00 0.00 N ATOM 1318 CA LEU A 90 -6.886 -2.331 -1.591 1.00 0.00 C ATOM 1319 C LEU A 90 -6.231 -2.504 -2.958 1.00 0.00 C ATOM 1320 O LEU A 90 -6.429 -1.689 -3.860 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.288 -2.942 -1.604 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.483 -4.156 -2.513 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -7.754 -5.367 -1.950 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -9.964 -4.458 -2.690 1.00 0.00 C ATOM 0 H LEU A 90 -7.767 -0.427 -1.586 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.278 -2.848 -0.849 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.546 -3.231 -0.585 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.996 -2.170 -1.905 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.060 -3.925 -3.491 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.904 -6.221 -2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.689 -5.148 -1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.146 -5.600 -0.960 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.083 -5.325 -3.340 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.411 -4.668 -1.718 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.460 -3.597 -3.139 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.453 -3.571 -3.105 1.00 0.00 N ATOM 1337 CA PHE A 91 -4.770 -3.852 -4.363 1.00 0.00 C ATOM 1338 C PHE A 91 -4.826 -5.341 -4.691 1.00 0.00 C ATOM 1339 O PHE A 91 -4.286 -6.170 -3.958 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.314 -3.388 -4.291 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.165 -1.913 -4.047 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.297 -1.393 -2.769 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -2.893 -1.048 -5.094 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.162 -0.037 -2.542 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -2.756 0.310 -4.872 1.00 0.00 C ATOM 1346 CZ PHE A 91 -2.890 0.816 -3.594 1.00 0.00 C ATOM 0 H PHE A 91 -5.280 -4.255 -2.369 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.280 -3.304 -5.155 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -2.807 -3.933 -3.495 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.812 -3.646 -5.224 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.508 -2.055 -1.942 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -2.787 -1.439 -6.095 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.269 0.356 -1.542 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -2.544 0.974 -5.697 1.00 0.00 H new ATOM 0 HZ PHE A 91 -2.782 1.876 -3.417 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.484 -5.672 -5.798 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.612 -7.061 -6.223 1.00 0.00 C ATOM 1358 C ARG A 92 -4.462 -7.456 -7.144 1.00 0.00 C ATOM 1359 O ARG A 92 -4.425 -7.063 -8.311 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.948 -7.276 -6.936 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.146 -7.274 -6.000 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.341 -7.978 -6.623 1.00 0.00 C ATOM 1363 NE ARG A 92 -10.577 -7.709 -5.892 1.00 0.00 N ATOM 1364 CZ ARG A 92 -11.218 -6.547 -5.935 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -10.743 -5.551 -6.670 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -12.337 -6.379 -5.242 1.00 0.00 N ATOM 0 H ARG A 92 -5.936 -4.998 -6.416 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.576 -7.692 -5.335 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.081 -6.494 -7.684 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.916 -8.226 -7.470 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.879 -7.766 -5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.415 -6.247 -5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.454 -7.654 -7.658 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.159 -9.052 -6.644 1.00 0.00 H new ATOM 0 HE ARG A 92 -10.969 -8.455 -5.317 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.883 -5.676 -7.204 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.237 -4.659 -6.701 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.706 -7.143 -4.675 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.829 -5.486 -5.276 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.526 -8.234 -6.613 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.375 -8.683 -7.387 1.00 0.00 C ATOM 1382 C ILE A 93 -2.470 -10.172 -7.700 1.00 0.00 C ATOM 1383 O ILE A 93 -2.989 -10.954 -6.902 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.055 -8.409 -6.644 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.866 -6.905 -6.433 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.119 -8.992 -7.417 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.002 -6.567 -5.237 1.00 0.00 C ATOM 0 H ILE A 93 -3.542 -8.567 -5.649 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.382 -8.117 -8.319 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.098 -8.892 -5.668 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.418 -6.474 -7.328 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.843 -6.438 -6.309 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.045 -8.790 -6.879 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.013 -10.069 -7.521 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.167 -8.535 -8.405 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.089 -5.484 -5.148 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.460 -6.968 -4.333 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.988 -7.005 -5.368 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.963 -10.560 -8.865 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.988 -11.957 -9.284 1.00 0.00 C ATOM 1401 C LEU A 94 -0.578 -12.537 -9.330 1.00 0.00 C ATOM 1402 O LEU A 94 0.299 -12.008 -10.011 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.651 -12.087 -10.657 1.00 0.00 C ATOM 1404 CG LEU A 94 -4.164 -12.307 -10.654 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.497 -13.717 -10.191 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.851 -11.277 -9.769 1.00 0.00 C ATOM 0 H LEU A 94 -1.529 -9.926 -9.537 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.569 -12.520 -8.553 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.437 -11.184 -11.229 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.184 -12.918 -11.186 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.532 -12.184 -11.673 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.578 -13.856 -10.195 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.036 -14.440 -10.864 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.116 -13.868 -9.181 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.927 -11.449 -9.779 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.478 -11.368 -8.749 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.640 -10.276 -10.145 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.369 -13.629 -8.602 1.00 0.00 N ATOM 1419 CA ASN A 95 0.934 -14.282 -8.561 1.00 0.00 C ATOM 1420 C ASN A 95 0.813 -15.761 -8.919 1.00 0.00 C ATOM 1421 O ASN A 95 1.396 -16.631 -8.272 1.00 0.00 O ATOM 1422 CB ASN A 95 1.560 -14.131 -7.174 1.00 0.00 C ATOM 1423 CG ASN A 95 2.848 -14.920 -7.031 1.00 0.00 C ATOM 1424 OD1 ASN A 95 2.860 -16.012 -6.463 1.00 0.00 O ATOM 1425 ND2 ASN A 95 3.940 -14.368 -7.548 1.00 0.00 N ATOM 0 H ASN A 95 -1.085 -14.080 -8.033 1.00 0.00 H new ATOM 0 HA ASN A 95 1.578 -13.800 -9.297 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.760 -13.077 -6.981 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.848 -14.464 -6.419 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.836 -14.852 -7.483 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.883 -13.461 -8.010 1.00 0.00 H new ATOM 1432 N PRO A 96 0.038 -16.053 -9.974 1.00 0.00 N ATOM 1433 CA PRO A 96 -0.177 -17.425 -10.442 1.00 0.00 C ATOM 1434 C PRO A 96 1.075 -18.026 -11.072 1.00 0.00 C ATOM 1435 O PRO A 96 1.198 -19.244 -11.191 1.00 0.00 O ATOM 1436 CB PRO A 96 -1.282 -17.273 -11.491 1.00 0.00 C ATOM 1437 CG PRO A 96 -1.156 -15.869 -11.973 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.687 -15.066 -10.791 1.00 0.00 C ATOM 0 HA PRO A 96 -0.435 -18.098 -9.625 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -1.154 -17.985 -12.307 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.266 -17.457 -11.059 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.446 -15.802 -12.797 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -2.111 -15.496 -12.344 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -0.040 -14.243 -11.095 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.523 -14.629 -10.245 1.00 0.00 H new ATOM 1446 N ASN A 97 2.003 -17.162 -11.472 1.00 0.00 N ATOM 1447 CA ASN A 97 3.247 -17.609 -12.089 1.00 0.00 C ATOM 1448 C ASN A 97 4.261 -18.028 -11.029 1.00 0.00 C ATOM 1449 O ASN A 97 5.432 -18.260 -11.330 1.00 0.00 O ATOM 1450 CB ASN A 97 3.835 -16.498 -12.962 1.00 0.00 C ATOM 1451 CG ASN A 97 3.207 -16.452 -14.341 1.00 0.00 C ATOM 1452 OD1 ASN A 97 3.793 -16.918 -15.318 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.007 -15.889 -14.426 1.00 0.00 N ATOM 0 H ASN A 97 1.917 -16.150 -11.380 1.00 0.00 H new ATOM 0 HA ASN A 97 3.023 -18.474 -12.714 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.691 -15.537 -12.468 1.00 0.00 H new ATOM 0 HB3 ASN A 97 4.910 -16.648 -13.060 1.00 0.00 H new ATOM 0 HD21 ASN A 97 1.534 -15.830 -15.328 1.00 0.00 H new ATOM 0 HD22 ASN A 97 1.558 -15.516 -13.589 1.00 0.00 H new ATOM 1460 N LYS A 98 3.802 -18.125 -9.785 1.00 0.00 N ATOM 1461 CA LYS A 98 4.667 -18.519 -8.679 1.00 0.00 C ATOM 1462 C LYS A 98 6.020 -17.821 -8.771 1.00 0.00 C ATOM 1463 O LYS A 98 7.067 -18.464 -8.704 1.00 0.00 O ATOM 1464 CB LYS A 98 4.863 -20.036 -8.674 1.00 0.00 C ATOM 1465 CG LYS A 98 3.627 -20.808 -8.247 1.00 0.00 C ATOM 1466 CD LYS A 98 3.981 -22.203 -7.758 1.00 0.00 C ATOM 1467 CE LYS A 98 4.678 -22.160 -6.407 1.00 0.00 C ATOM 1468 NZ LYS A 98 4.904 -23.524 -5.855 1.00 0.00 N ATOM 0 H LYS A 98 2.836 -17.936 -9.518 1.00 0.00 H new ATOM 0 HA LYS A 98 4.185 -18.218 -7.749 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.156 -20.359 -9.673 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.686 -20.285 -8.004 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.113 -20.264 -7.455 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.935 -20.880 -9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.075 -22.804 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.628 -22.692 -8.487 1.00 0.00 H new ATOM 0 HE2 LYS A 98 5.634 -21.646 -6.508 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.077 -21.580 -5.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.381 -23.451 -4.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.990 -24.006 -5.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.499 -24.070 -6.511 1.00 0.00 H new ATOM 1482 N ALA A 99 5.990 -16.501 -8.924 1.00 0.00 N ATOM 1483 CA ALA A 99 7.215 -15.716 -9.022 1.00 0.00 C ATOM 1484 C ALA A 99 7.215 -14.572 -8.013 1.00 0.00 C ATOM 1485 O ALA A 99 6.538 -13.559 -8.186 1.00 0.00 O ATOM 1486 CB ALA A 99 7.385 -15.176 -10.434 1.00 0.00 C ATOM 0 H ALA A 99 5.132 -15.953 -8.983 1.00 0.00 H new ATOM 0 HA ALA A 99 8.056 -16.370 -8.792 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.304 -14.592 -10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.438 -16.007 -11.137 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.535 -14.541 -10.686 1.00 0.00 H new ATOM 1492 N PRO A 100 7.992 -14.736 -6.932 1.00 0.00 N ATOM 1493 CA PRO A 100 8.099 -13.727 -5.874 1.00 0.00 C ATOM 1494 C PRO A 100 8.839 -12.477 -6.337 1.00 0.00 C ATOM 1495 O PRO A 100 10.070 -12.441 -6.349 1.00 0.00 O ATOM 1496 CB PRO A 100 8.893 -14.444 -4.779 1.00 0.00 C ATOM 1497 CG PRO A 100 9.680 -15.483 -5.501 1.00 0.00 C ATOM 1498 CD PRO A 100 8.826 -15.919 -6.660 1.00 0.00 C ATOM 0 HA PRO A 100 7.121 -13.373 -5.548 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.545 -13.753 -4.246 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.231 -14.892 -4.039 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.632 -15.081 -5.847 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.909 -16.324 -4.847 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.431 -16.192 -7.525 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.220 -16.789 -6.408 1.00 0.00 H new ATOM 1506 N LEU A 101 8.082 -11.454 -6.717 1.00 0.00 N ATOM 1507 CA LEU A 101 8.666 -10.201 -7.181 1.00 0.00 C ATOM 1508 C LEU A 101 8.572 -9.124 -6.104 1.00 0.00 C ATOM 1509 O LEU A 101 8.107 -9.382 -4.994 1.00 0.00 O ATOM 1510 CB LEU A 101 7.963 -9.728 -8.454 1.00 0.00 C ATOM 1511 CG LEU A 101 8.538 -10.249 -9.771 1.00 0.00 C ATOM 1512 CD1 LEU A 101 9.752 -9.431 -10.186 1.00 0.00 C ATOM 1513 CD2 LEU A 101 8.902 -11.722 -9.648 1.00 0.00 C ATOM 0 H LEU A 101 7.062 -11.468 -6.713 1.00 0.00 H new ATOM 0 HA LEU A 101 9.719 -10.379 -7.400 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.915 -10.022 -8.397 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.988 -8.638 -8.476 1.00 0.00 H new ATOM 0 HG LEU A 101 7.776 -10.146 -10.543 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.147 -9.817 -11.126 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.461 -8.389 -10.316 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.519 -9.500 -9.414 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.310 -12.076 -10.595 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.647 -11.848 -8.862 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.010 -12.298 -9.399 1.00 0.00 H new ATOM 1525 N ARG A 102 9.013 -7.917 -6.441 1.00 0.00 N ATOM 1526 CA ARG A 102 8.977 -6.801 -5.504 1.00 0.00 C ATOM 1527 C ARG A 102 7.822 -5.857 -5.826 1.00 0.00 C ATOM 1528 O ARG A 102 7.114 -6.041 -6.817 1.00 0.00 O ATOM 1529 CB ARG A 102 10.301 -6.034 -5.539 1.00 0.00 C ATOM 1530 CG ARG A 102 10.748 -5.528 -4.177 1.00 0.00 C ATOM 1531 CD ARG A 102 11.535 -4.233 -4.296 1.00 0.00 C ATOM 1532 NE ARG A 102 12.970 -4.474 -4.417 1.00 0.00 N ATOM 1533 CZ ARG A 102 13.583 -4.695 -5.575 1.00 0.00 C ATOM 1534 NH1 ARG A 102 12.889 -4.706 -6.705 1.00 0.00 N ATOM 1535 NH2 ARG A 102 14.893 -4.907 -5.604 1.00 0.00 N ATOM 0 H ARG A 102 9.400 -7.687 -7.356 1.00 0.00 H new ATOM 0 HA ARG A 102 8.825 -7.205 -4.503 1.00 0.00 H new ATOM 0 HB2 ARG A 102 11.076 -6.682 -5.949 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.202 -5.187 -6.218 1.00 0.00 H new ATOM 0 HG2 ARG A 102 9.876 -5.368 -3.543 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.362 -6.285 -3.690 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.186 -3.676 -5.165 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.344 -3.611 -3.421 1.00 0.00 H new ATOM 0 HE ARG A 102 13.533 -4.473 -3.566 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.882 -4.545 -6.687 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.362 -4.876 -7.592 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.430 -4.900 -4.737 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.363 -5.077 -6.493 1.00 0.00 H new ATOM 1549 N LEU A 103 7.637 -4.848 -4.982 1.00 0.00 N ATOM 1550 CA LEU A 103 6.567 -3.875 -5.177 1.00 0.00 C ATOM 1551 C LEU A 103 7.037 -2.469 -4.817 1.00 0.00 C ATOM 1552 O LEU A 103 7.637 -2.254 -3.764 1.00 0.00 O ATOM 1553 CB LEU A 103 5.350 -4.250 -4.329 1.00 0.00 C ATOM 1554 CG LEU A 103 4.331 -3.136 -4.087 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.452 -2.941 -5.313 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.482 -3.446 -2.864 1.00 0.00 C ATOM 0 H LEU A 103 8.213 -4.682 -4.157 1.00 0.00 H new ATOM 0 HA LEU A 103 6.287 -3.886 -6.230 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.839 -5.084 -4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.703 -4.609 -3.362 1.00 0.00 H new ATOM 0 HG LEU A 103 4.873 -2.208 -3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.733 -2.144 -5.122 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.073 -2.672 -6.167 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.919 -3.867 -5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.763 -2.642 -2.707 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.950 -4.384 -3.019 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.124 -3.534 -1.988 1.00 0.00 H new ATOM 1568 N LYS A 104 6.760 -1.515 -5.699 1.00 0.00 N ATOM 1569 CA LYS A 104 7.151 -0.128 -5.475 1.00 0.00 C ATOM 1570 C LYS A 104 5.983 0.684 -4.925 1.00 0.00 C ATOM 1571 O LYS A 104 4.843 0.525 -5.362 1.00 0.00 O ATOM 1572 CB LYS A 104 7.655 0.498 -6.777 1.00 0.00 C ATOM 1573 CG LYS A 104 8.260 1.879 -6.593 1.00 0.00 C ATOM 1574 CD LYS A 104 8.861 2.402 -7.887 1.00 0.00 C ATOM 1575 CE LYS A 104 10.318 1.990 -8.032 1.00 0.00 C ATOM 1576 NZ LYS A 104 11.031 2.821 -9.042 1.00 0.00 N ATOM 0 H LYS A 104 6.266 -1.677 -6.576 1.00 0.00 H new ATOM 0 HA LYS A 104 7.956 -0.117 -4.740 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.401 -0.160 -7.222 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.827 0.564 -7.483 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.493 2.569 -6.242 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.030 1.840 -5.823 1.00 0.00 H new ATOM 0 HD2 LYS A 104 8.289 2.024 -8.734 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.785 3.489 -7.911 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.819 2.081 -7.068 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.372 0.941 -8.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 12.021 2.509 -9.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.569 2.715 -9.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 11.002 3.820 -8.753 1.00 0.00 H new ATOM 1590 N LEU A 105 6.274 1.557 -3.967 1.00 0.00 N ATOM 1591 CA LEU A 105 5.248 2.396 -3.359 1.00 0.00 C ATOM 1592 C LEU A 105 5.598 3.874 -3.502 1.00 0.00 C ATOM 1593 O LEU A 105 6.733 4.280 -3.252 1.00 0.00 O ATOM 1594 CB LEU A 105 5.080 2.041 -1.880 1.00 0.00 C ATOM 1595 CG LEU A 105 4.403 0.702 -1.584 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.603 0.313 -0.128 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.921 0.768 -1.922 1.00 0.00 C ATOM 0 H LEU A 105 7.212 1.702 -3.595 1.00 0.00 H new ATOM 0 HA LEU A 105 4.308 2.212 -3.879 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.065 2.038 -1.413 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.502 2.831 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 105 4.864 -0.063 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.114 -0.642 0.064 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.669 0.224 0.082 1.00 0.00 H new ATOM 0 HD13 LEU A 105 4.169 1.078 0.516 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.455 -0.193 -1.705 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.446 1.545 -1.323 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.799 1.000 -2.980 1.00 0.00 H new ATOM 1609 N ARG A 106 4.615 4.673 -3.903 1.00 0.00 N ATOM 1610 CA ARG A 106 4.819 6.106 -4.079 1.00 0.00 C ATOM 1611 C ARG A 106 3.806 6.903 -3.262 1.00 0.00 C ATOM 1612 O ARG A 106 2.605 6.636 -3.310 1.00 0.00 O ATOM 1613 CB ARG A 106 4.706 6.482 -5.557 1.00 0.00 C ATOM 1614 CG ARG A 106 4.605 7.979 -5.799 1.00 0.00 C ATOM 1615 CD ARG A 106 5.210 8.369 -7.139 1.00 0.00 C ATOM 1616 NE ARG A 106 4.281 8.146 -8.244 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.411 8.713 -9.438 1.00 0.00 C ATOM 1618 NH1 ARG A 106 5.425 9.532 -9.681 1.00 0.00 N ATOM 1619 NH2 ARG A 106 3.525 8.461 -10.393 1.00 0.00 N ATOM 0 H ARG A 106 3.669 4.353 -4.112 1.00 0.00 H new ATOM 0 HA ARG A 106 5.820 6.351 -3.725 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.575 6.094 -6.089 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.828 5.994 -5.981 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.559 8.284 -5.768 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.116 8.513 -4.998 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.499 9.420 -7.114 1.00 0.00 H new ATOM 0 HD3 ARG A 106 6.119 7.792 -7.308 1.00 0.00 H new ATOM 0 HE ARG A 106 3.490 7.521 -8.090 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.108 9.728 -8.950 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.522 9.966 -10.599 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.743 7.832 -10.210 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.625 8.897 -11.310 1.00 0.00 H new ATOM 1633 N LEU A 107 4.299 7.883 -2.512 1.00 0.00 N ATOM 1634 CA LEU A 107 3.438 8.720 -1.683 1.00 0.00 C ATOM 1635 C LEU A 107 3.475 10.171 -2.151 1.00 0.00 C ATOM 1636 O LEU A 107 4.527 10.686 -2.531 1.00 0.00 O ATOM 1637 CB LEU A 107 3.867 8.633 -0.217 1.00 0.00 C ATOM 1638 CG LEU A 107 3.711 7.265 0.448 1.00 0.00 C ATOM 1639 CD1 LEU A 107 4.087 7.341 1.919 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.287 6.752 0.286 1.00 0.00 C ATOM 0 H LEU A 107 5.290 8.117 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 107 2.416 8.353 -1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.913 8.932 -0.147 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.289 9.360 0.354 1.00 0.00 H new ATOM 0 HG LEU A 107 4.386 6.565 -0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.970 6.358 2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.124 7.664 2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.437 8.056 2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.195 5.777 0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.593 7.452 0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.052 6.658 -0.774 1.00 0.00 H new ATOM 1652 N THR A 108 2.320 10.828 -2.119 1.00 0.00 N ATOM 1653 CA THR A 108 2.220 12.220 -2.538 1.00 0.00 C ATOM 1654 C THR A 108 1.021 12.904 -1.891 1.00 0.00 C ATOM 1655 O THR A 108 -0.122 12.489 -2.083 1.00 0.00 O ATOM 1656 CB THR A 108 2.100 12.338 -4.069 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.125 11.410 -4.557 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.439 12.074 -4.739 1.00 0.00 C ATOM 0 H THR A 108 1.440 10.418 -1.807 1.00 0.00 H new ATOM 0 HA THR A 108 3.135 12.715 -2.214 1.00 0.00 H new ATOM 0 HB THR A 108 1.786 13.354 -4.309 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.398 11.326 -3.905 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.329 12.163 -5.820 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.171 12.801 -4.388 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.778 11.068 -4.491 1.00 0.00 H new ATOM 1666 N TYR A 109 1.289 13.956 -1.125 1.00 0.00 N ATOM 1667 CA TYR A 109 0.232 14.697 -0.448 1.00 0.00 C ATOM 1668 C TYR A 109 0.753 16.032 0.078 1.00 0.00 C ATOM 1669 O TYR A 109 1.942 16.332 -0.029 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.341 13.871 0.705 1.00 0.00 C ATOM 1671 CG TYR A 109 0.687 13.488 1.745 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.470 12.350 1.590 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.875 14.262 2.884 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.410 11.995 2.537 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.814 13.915 3.836 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.579 12.781 3.658 1.00 0.00 C ATOM 1677 OH TYR A 109 3.514 12.432 4.605 1.00 0.00 O ATOM 0 H TYR A 109 2.229 14.314 -0.958 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.558 14.896 -1.172 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -1.138 14.438 1.186 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.793 12.965 0.302 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.341 11.733 0.713 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.277 15.150 3.027 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.010 11.107 2.401 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.948 14.528 4.715 1.00 0.00 H new ATOM 0 HH TYR A 109 3.507 13.091 5.330 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.146 16.828 0.645 1.00 0.00 N ATOM 1688 CA ASP A 110 0.221 18.130 1.190 1.00 0.00 C ATOM 1689 C ASP A 110 0.174 18.114 2.715 1.00 0.00 C ATOM 1690 O ASP A 110 -0.809 17.676 3.312 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.714 19.214 0.650 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.050 20.576 0.597 1.00 0.00 C ATOM 1693 OD1 ASP A 110 1.100 20.658 0.119 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -0.683 21.561 1.034 1.00 0.00 O ATOM 0 H ASP A 110 -1.134 16.595 0.739 1.00 0.00 H new ATOM 0 HA ASP A 110 1.242 18.352 0.878 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.048 18.937 -0.350 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -1.602 19.270 1.279 1.00 0.00 H new ATOM 1699 N HIS A 111 1.246 18.594 3.339 1.00 0.00 N ATOM 1700 CA HIS A 111 1.327 18.634 4.795 1.00 0.00 C ATOM 1701 C HIS A 111 1.866 19.980 5.271 1.00 0.00 C ATOM 1702 O HIS A 111 2.837 20.501 4.723 1.00 0.00 O ATOM 1703 CB HIS A 111 2.220 17.504 5.308 1.00 0.00 C ATOM 1704 CG HIS A 111 1.862 17.037 6.686 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.712 16.287 7.470 1.00 0.00 N ATOM 1706 CD2 HIS A 111 0.739 17.219 7.418 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.127 16.026 8.626 1.00 0.00 C ATOM 1708 NE2 HIS A 111 0.928 16.582 8.620 1.00 0.00 N ATOM 0 H HIS A 111 2.069 18.960 2.860 1.00 0.00 H new ATOM 0 HA HIS A 111 0.322 18.502 5.195 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.157 16.661 4.620 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.257 17.841 5.305 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -0.142 17.764 7.114 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.555 15.456 9.437 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.253 16.544 9.384 1.00 0.00 H new ATOM 1716 N PHE A 112 1.229 20.538 6.295 1.00 0.00 N ATOM 1717 CA PHE A 112 1.643 21.824 6.844 1.00 0.00 C ATOM 1718 C PHE A 112 1.904 22.833 5.730 1.00 0.00 C ATOM 1719 O PHE A 112 2.809 23.662 5.827 1.00 0.00 O ATOM 1720 CB PHE A 112 2.900 21.655 7.700 1.00 0.00 C ATOM 1721 CG PHE A 112 2.640 20.999 9.026 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.581 19.619 9.131 1.00 0.00 C ATOM 1723 CD2 PHE A 112 2.454 21.763 10.167 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.342 19.012 10.349 1.00 0.00 C ATOM 1725 CE2 PHE A 112 2.215 21.161 11.388 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.158 19.784 11.479 1.00 0.00 C ATOM 0 H PHE A 112 0.424 20.120 6.761 1.00 0.00 H new ATOM 0 HA PHE A 112 0.834 22.202 7.469 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.629 21.062 7.147 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.348 22.634 7.870 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.724 19.010 8.250 1.00 0.00 H new ATOM 0 HD2 PHE A 112 2.496 22.840 10.102 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.299 17.935 10.417 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.073 21.767 12.271 1.00 0.00 H new ATOM 0 HZ PHE A 112 1.970 19.312 12.432 1.00 0.00 H new ATOM 1736 N HIS A 113 1.104 22.755 4.671 1.00 0.00 N ATOM 1737 CA HIS A 113 1.247 23.661 3.537 1.00 0.00 C ATOM 1738 C HIS A 113 2.565 23.415 2.808 1.00 0.00 C ATOM 1739 O HIS A 113 3.177 24.345 2.283 1.00 0.00 O ATOM 1740 CB HIS A 113 1.174 25.115 4.006 1.00 0.00 C ATOM 1741 CG HIS A 113 0.085 25.368 5.003 1.00 0.00 C ATOM 1742 ND1 HIS A 113 0.120 26.408 5.907 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -1.074 24.709 5.235 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -0.970 26.378 6.653 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -1.712 25.356 6.265 1.00 0.00 N ATOM 0 H HIS A 113 0.351 22.074 4.575 1.00 0.00 H new ATOM 0 HA HIS A 113 0.427 23.469 2.845 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.131 25.395 4.447 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.021 25.760 3.141 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -1.431 23.836 4.708 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -1.213 27.071 7.445 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -2.612 25.091 6.665 1.00 0.00 H new ATOM 1753 N GLN A 114 2.996 22.158 2.782 1.00 0.00 N ATOM 1754 CA GLN A 114 4.242 21.792 2.119 1.00 0.00 C ATOM 1755 C GLN A 114 4.050 20.559 1.242 1.00 0.00 C ATOM 1756 O GLN A 114 3.325 19.633 1.606 1.00 0.00 O ATOM 1757 CB GLN A 114 5.337 21.531 3.154 1.00 0.00 C ATOM 1758 CG GLN A 114 6.421 20.583 2.667 1.00 0.00 C ATOM 1759 CD GLN A 114 7.238 21.165 1.530 1.00 0.00 C ATOM 1760 OE1 GLN A 114 6.982 22.280 1.075 1.00 0.00 O ATOM 1761 NE2 GLN A 114 8.228 20.412 1.066 1.00 0.00 N ATOM 0 H GLN A 114 2.501 21.377 3.212 1.00 0.00 H new ATOM 0 HA GLN A 114 4.544 22.624 1.483 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.795 22.480 3.434 1.00 0.00 H new ATOM 0 HB3 GLN A 114 4.883 21.118 4.055 1.00 0.00 H new ATOM 0 HG2 GLN A 114 7.084 20.338 3.497 1.00 0.00 H new ATOM 0 HG3 GLN A 114 5.962 19.650 2.339 1.00 0.00 H new ATOM 0 HE21 GLN A 114 8.404 19.494 1.473 1.00 0.00 H new ATOM 0 HE22 GLN A 114 8.812 20.752 0.302 1.00 0.00 H new ATOM 1770 N SER A 115 4.704 20.554 0.085 1.00 0.00 N ATOM 1771 CA SER A 115 4.601 19.436 -0.846 1.00 0.00 C ATOM 1772 C SER A 115 5.428 18.249 -0.362 1.00 0.00 C ATOM 1773 O SER A 115 6.653 18.328 -0.266 1.00 0.00 O ATOM 1774 CB SER A 115 5.067 19.862 -2.240 1.00 0.00 C ATOM 1775 OG SER A 115 6.398 20.345 -2.207 1.00 0.00 O ATOM 0 H SER A 115 5.311 21.311 -0.230 1.00 0.00 H new ATOM 0 HA SER A 115 3.556 19.132 -0.897 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.001 19.015 -2.923 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.405 20.637 -2.627 1.00 0.00 H new ATOM 0 HG SER A 115 6.898 19.877 -1.506 1.00 0.00 H new ATOM 1781 N VAL A 116 4.749 17.147 -0.058 1.00 0.00 N ATOM 1782 CA VAL A 116 5.419 15.942 0.415 1.00 0.00 C ATOM 1783 C VAL A 116 5.508 14.894 -0.688 1.00 0.00 C ATOM 1784 O VAL A 116 4.493 14.354 -1.127 1.00 0.00 O ATOM 1785 CB VAL A 116 4.690 15.334 1.628 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.418 14.093 2.122 1.00 0.00 C ATOM 1787 CG2 VAL A 116 4.559 16.363 2.741 1.00 0.00 C ATOM 0 H VAL A 116 3.735 17.064 -0.131 1.00 0.00 H new ATOM 0 HA VAL A 116 6.425 16.236 0.715 1.00 0.00 H new ATOM 0 HB VAL A 116 3.688 15.039 1.317 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.888 13.677 2.979 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.455 13.351 1.324 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.433 14.360 2.417 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.042 15.917 3.590 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.551 16.691 3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.990 17.220 2.379 1.00 0.00 H new ATOM 1797 N GLN A 117 6.729 14.611 -1.131 1.00 0.00 N ATOM 1798 CA GLN A 117 6.950 13.627 -2.184 1.00 0.00 C ATOM 1799 C GLN A 117 8.078 12.671 -1.807 1.00 0.00 C ATOM 1800 O GLN A 117 9.253 13.029 -1.867 1.00 0.00 O ATOM 1801 CB GLN A 117 7.279 14.326 -3.504 1.00 0.00 C ATOM 1802 CG GLN A 117 7.142 13.425 -4.720 1.00 0.00 C ATOM 1803 CD GLN A 117 7.531 14.121 -6.009 1.00 0.00 C ATOM 1804 OE1 GLN A 117 6.711 14.787 -6.641 1.00 0.00 O ATOM 1805 NE2 GLN A 117 8.789 13.971 -6.407 1.00 0.00 N ATOM 0 H GLN A 117 7.580 15.049 -0.777 1.00 0.00 H new ATOM 0 HA GLN A 117 6.033 13.050 -2.305 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.621 15.186 -3.624 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.299 14.709 -3.459 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.767 12.542 -4.585 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.112 13.078 -4.796 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.436 13.410 -5.853 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.108 14.417 -7.267 1.00 0.00 H new ATOM 1814 N GLU A 118 7.710 11.454 -1.419 1.00 0.00 N ATOM 1815 CA GLU A 118 8.692 10.447 -1.032 1.00 0.00 C ATOM 1816 C GLU A 118 8.375 9.102 -1.678 1.00 0.00 C ATOM 1817 O GLU A 118 7.305 8.533 -1.461 1.00 0.00 O ATOM 1818 CB GLU A 118 8.728 10.298 0.491 1.00 0.00 C ATOM 1819 CG GLU A 118 9.072 11.585 1.221 1.00 0.00 C ATOM 1820 CD GLU A 118 10.565 11.843 1.279 1.00 0.00 C ATOM 1821 OE1 GLU A 118 11.228 11.726 0.227 1.00 0.00 O ATOM 1822 OE2 GLU A 118 11.071 12.160 2.375 1.00 0.00 O ATOM 0 H GLU A 118 6.741 11.142 -1.364 1.00 0.00 H new ATOM 0 HA GLU A 118 9.670 10.777 -1.381 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.757 9.943 0.836 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.459 9.534 0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.582 12.422 0.724 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.675 11.540 2.235 1.00 0.00 H new ATOM 1829 N ILE A 119 9.313 8.599 -2.474 1.00 0.00 N ATOM 1830 CA ILE A 119 9.136 7.321 -3.152 1.00 0.00 C ATOM 1831 C ILE A 119 10.136 6.287 -2.647 1.00 0.00 C ATOM 1832 O ILE A 119 11.338 6.401 -2.890 1.00 0.00 O ATOM 1833 CB ILE A 119 9.290 7.467 -4.677 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.238 8.432 -5.229 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.177 6.109 -5.353 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.618 9.888 -5.081 1.00 0.00 C ATOM 0 H ILE A 119 10.204 9.058 -2.665 1.00 0.00 H new ATOM 0 HA ILE A 119 8.124 6.983 -2.928 1.00 0.00 H new ATOM 0 HB ILE A 119 10.278 7.876 -4.890 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.074 8.213 -6.284 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.292 8.258 -4.716 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.288 6.229 -6.431 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.960 5.450 -4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.202 5.674 -5.135 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.827 10.514 -5.493 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.754 10.123 -4.025 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.548 10.078 -5.618 1.00 0.00 H new ATOM 1848 N PHE A 120 9.633 5.278 -1.945 1.00 0.00 N ATOM 1849 CA PHE A 120 10.482 4.222 -1.407 1.00 0.00 C ATOM 1850 C PHE A 120 10.043 2.854 -1.923 1.00 0.00 C ATOM 1851 O PHE A 120 8.880 2.656 -2.272 1.00 0.00 O ATOM 1852 CB PHE A 120 10.445 4.239 0.123 1.00 0.00 C ATOM 1853 CG PHE A 120 9.055 4.295 0.688 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.172 3.244 0.498 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.630 5.399 1.409 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.892 3.292 1.018 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.351 5.453 1.931 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.481 4.399 1.734 1.00 0.00 C ATOM 0 H PHE A 120 8.641 5.169 -1.735 1.00 0.00 H new ATOM 0 HA PHE A 120 11.503 4.406 -1.741 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.946 3.348 0.501 1.00 0.00 H new ATOM 0 HB3 PHE A 120 11.010 5.099 0.483 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.488 2.377 -0.063 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.306 6.227 1.565 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.215 2.465 0.865 1.00 0.00 H new ATOM 0 HE2 PHE A 120 7.033 6.319 2.492 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.481 4.440 2.139 1.00 0.00 H new ATOM 1868 N GLU A 121 10.983 1.916 -1.967 1.00 0.00 N ATOM 1869 CA GLU A 121 10.694 0.567 -2.441 1.00 0.00 C ATOM 1870 C GLU A 121 10.732 -0.434 -1.290 1.00 0.00 C ATOM 1871 O GLU A 121 11.623 -0.389 -0.442 1.00 0.00 O ATOM 1872 CB GLU A 121 11.696 0.157 -3.522 1.00 0.00 C ATOM 1873 CG GLU A 121 12.054 1.282 -4.479 1.00 0.00 C ATOM 1874 CD GLU A 121 13.299 0.982 -5.292 1.00 0.00 C ATOM 1875 OE1 GLU A 121 13.373 -0.116 -5.880 1.00 0.00 O ATOM 1876 OE2 GLU A 121 14.198 1.848 -5.339 1.00 0.00 O ATOM 0 H GLU A 121 11.951 2.065 -1.681 1.00 0.00 H new ATOM 0 HA GLU A 121 9.691 0.566 -2.867 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.606 -0.205 -3.043 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.283 -0.675 -4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.217 1.459 -5.155 1.00 0.00 H new ATOM 0 HG3 GLU A 121 12.207 2.201 -3.913 1.00 0.00 H new ATOM 1883 N VAL A 122 9.757 -1.338 -1.268 1.00 0.00 N ATOM 1884 CA VAL A 122 9.679 -2.351 -0.222 1.00 0.00 C ATOM 1885 C VAL A 122 10.478 -3.594 -0.600 1.00 0.00 C ATOM 1886 O VAL A 122 10.039 -4.401 -1.418 1.00 0.00 O ATOM 1887 CB VAL A 122 8.220 -2.758 0.057 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.152 -3.744 1.213 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.370 -1.529 0.343 1.00 0.00 C ATOM 0 H VAL A 122 9.011 -1.389 -1.962 1.00 0.00 H new ATOM 0 HA VAL A 122 10.104 -1.909 0.679 1.00 0.00 H new ATOM 0 HB VAL A 122 7.822 -3.249 -0.831 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.113 -4.020 1.395 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.726 -4.636 0.964 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.568 -3.283 2.109 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.342 -1.835 0.538 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.765 -1.008 1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.393 -0.862 -0.519 1.00 0.00 H new ATOM 1899 N ASN A 123 11.653 -3.740 0.003 1.00 0.00 N ATOM 1900 CA ASN A 123 12.514 -4.885 -0.271 1.00 0.00 C ATOM 1901 C ASN A 123 12.539 -5.843 0.917 1.00 0.00 C ATOM 1902 O ASN A 123 13.398 -6.719 1.002 1.00 0.00 O ATOM 1903 CB ASN A 123 13.935 -4.416 -0.592 1.00 0.00 C ATOM 1904 CG ASN A 123 13.951 -3.193 -1.489 1.00 0.00 C ATOM 1905 OD1 ASN A 123 12.902 -2.649 -1.833 1.00 0.00 O ATOM 1906 ND2 ASN A 123 15.145 -2.757 -1.872 1.00 0.00 N ATOM 0 H ASN A 123 12.031 -3.081 0.684 1.00 0.00 H new ATOM 0 HA ASN A 123 12.110 -5.414 -1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.458 -4.189 0.337 1.00 0.00 H new ATOM 0 HB3 ASN A 123 14.481 -5.226 -1.076 1.00 0.00 H new ATOM 0 HD21 ASN A 123 15.219 -1.939 -2.476 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.988 -3.240 -1.562 1.00 0.00 H new ATOM 1913 N ASN A 124 11.590 -5.668 1.831 1.00 0.00 N ATOM 1914 CA ASN A 124 11.503 -6.516 3.014 1.00 0.00 C ATOM 1915 C ASN A 124 10.262 -7.403 2.957 1.00 0.00 C ATOM 1916 O ASN A 124 10.027 -8.218 3.850 1.00 0.00 O ATOM 1917 CB ASN A 124 11.474 -5.659 4.281 1.00 0.00 C ATOM 1918 CG ASN A 124 12.345 -4.424 4.163 1.00 0.00 C ATOM 1919 OD1 ASN A 124 13.491 -4.498 3.719 1.00 0.00 O ATOM 1920 ND2 ASN A 124 11.804 -3.278 4.561 1.00 0.00 N ATOM 0 H ASN A 124 10.871 -4.947 1.775 1.00 0.00 H new ATOM 0 HA ASN A 124 12.385 -7.156 3.037 1.00 0.00 H new ATOM 0 HB2 ASN A 124 10.447 -5.358 4.489 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.809 -6.257 5.129 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.342 -2.413 4.505 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.850 -3.263 4.923 1.00 0.00 H new ATOM 1927 N LEU A 125 9.472 -7.238 1.902 1.00 0.00 N ATOM 1928 CA LEU A 125 8.255 -8.023 1.728 1.00 0.00 C ATOM 1929 C LEU A 125 8.440 -9.440 2.261 1.00 0.00 C ATOM 1930 O LEU A 125 9.522 -10.023 2.182 1.00 0.00 O ATOM 1931 CB LEU A 125 7.862 -8.070 0.250 1.00 0.00 C ATOM 1932 CG LEU A 125 7.423 -6.743 -0.370 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.395 -6.845 -1.887 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.058 -6.331 0.164 1.00 0.00 C ATOM 0 H LEU A 125 9.652 -6.568 1.154 1.00 0.00 H new ATOM 0 HA LEU A 125 7.458 -7.542 2.295 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.710 -8.451 -0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.051 -8.789 0.133 1.00 0.00 H new ATOM 0 HG LEU A 125 8.147 -5.977 -0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.080 -5.891 -2.310 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.391 -7.094 -2.253 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.694 -7.624 -2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.761 -5.385 -0.288 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.324 -7.098 -0.084 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.111 -6.216 1.247 1.00 0.00 H new ATOM 1946 N PRO A 126 7.360 -10.010 2.816 1.00 0.00 N ATOM 1947 CA PRO A 126 7.377 -11.366 3.371 1.00 0.00 C ATOM 1948 C PRO A 126 7.505 -12.433 2.289 1.00 0.00 C ATOM 1949 O PRO A 126 7.305 -12.159 1.106 1.00 0.00 O ATOM 1950 CB PRO A 126 6.023 -11.479 4.075 1.00 0.00 C ATOM 1951 CG PRO A 126 5.145 -10.507 3.365 1.00 0.00 C ATOM 1952 CD PRO A 126 6.038 -9.373 2.944 1.00 0.00 C ATOM 0 HA PRO A 126 8.230 -11.525 4.031 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.626 -12.492 4.010 1.00 0.00 H new ATOM 0 HB3 PRO A 126 6.106 -11.237 5.135 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.669 -10.970 2.501 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.347 -10.153 4.017 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.711 -8.932 2.002 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.047 -8.573 3.684 1.00 0.00 H new ATOM 1960 N VAL A 127 7.840 -13.652 2.703 1.00 0.00 N ATOM 1961 CA VAL A 127 7.993 -14.761 1.769 1.00 0.00 C ATOM 1962 C VAL A 127 6.802 -15.710 1.843 1.00 0.00 C ATOM 1963 O VAL A 127 6.466 -16.376 0.865 1.00 0.00 O ATOM 1964 CB VAL A 127 9.285 -15.553 2.045 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.501 -14.646 1.934 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.224 -16.211 3.415 1.00 0.00 C ATOM 0 H VAL A 127 8.010 -13.896 3.679 1.00 0.00 H new ATOM 0 HA VAL A 127 8.047 -14.328 0.770 1.00 0.00 H new ATOM 0 HB VAL A 127 9.377 -16.338 1.294 1.00 0.00 H new ATOM 0 HG11 VAL A 127 11.404 -15.223 2.132 1.00 0.00 H new ATOM 0 HG12 VAL A 127 10.551 -14.226 0.929 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.420 -13.838 2.661 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.145 -16.766 3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.108 -15.445 4.182 1.00 0.00 H new ATOM 0 HG23 VAL A 127 8.375 -16.894 3.453 1.00 0.00 H new ATOM 1976 N GLU A 128 6.169 -15.766 3.011 1.00 0.00 N ATOM 1977 CA GLU A 128 5.015 -16.635 3.212 1.00 0.00 C ATOM 1978 C GLU A 128 4.021 -16.494 2.063 1.00 0.00 C ATOM 1979 O GLU A 128 3.236 -17.403 1.793 1.00 0.00 O ATOM 1980 CB GLU A 128 4.328 -16.307 4.539 1.00 0.00 C ATOM 1981 CG GLU A 128 3.547 -17.472 5.124 1.00 0.00 C ATOM 1982 CD GLU A 128 2.359 -17.021 5.951 1.00 0.00 C ATOM 1983 OE1 GLU A 128 2.569 -16.574 7.098 1.00 0.00 O ATOM 1984 OE2 GLU A 128 1.218 -17.115 5.451 1.00 0.00 O ATOM 0 H GLU A 128 6.435 -15.221 3.831 1.00 0.00 H new ATOM 0 HA GLU A 128 5.368 -17.666 3.239 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.081 -15.987 5.259 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.652 -15.465 4.390 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.199 -18.114 4.315 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.210 -18.074 5.746 1.00 0.00 H new ATOM 1991 N SER A 129 4.061 -15.348 1.391 1.00 0.00 N ATOM 1992 CA SER A 129 3.161 -15.086 0.274 1.00 0.00 C ATOM 1993 C SER A 129 3.371 -16.103 -0.844 1.00 0.00 C ATOM 1994 O SER A 129 2.414 -16.574 -1.458 1.00 0.00 O ATOM 1995 CB SER A 129 3.379 -13.670 -0.262 1.00 0.00 C ATOM 1996 OG SER A 129 4.688 -13.518 -0.783 1.00 0.00 O ATOM 0 H SER A 129 4.707 -14.587 1.600 1.00 0.00 H new ATOM 0 HA SER A 129 2.137 -15.177 0.636 1.00 0.00 H new ATOM 0 HB2 SER A 129 2.647 -13.456 -1.041 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.216 -12.946 0.537 1.00 0.00 H new ATOM 0 HG SER A 129 4.802 -12.605 -1.121 1.00 0.00 H new ATOM 2002 N TRP A 130 4.631 -16.437 -1.101 1.00 0.00 N ATOM 2003 CA TRP A 130 4.968 -17.399 -2.145 1.00 0.00 C ATOM 2004 C TRP A 130 5.405 -18.728 -1.540 1.00 0.00 C ATOM 2005 O TRP A 130 4.928 -19.789 -1.941 1.00 0.00 O ATOM 2006 CB TRP A 130 6.076 -16.843 -3.040 1.00 0.00 C ATOM 2007 CG TRP A 130 7.360 -16.590 -2.309 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.789 -15.401 -1.792 1.00 0.00 C ATOM 2009 CD2 TRP A 130 8.382 -17.549 -2.015 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.016 -15.563 -1.195 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.401 -16.872 -1.317 1.00 0.00 C ATOM 2012 CE3 TRP A 130 8.534 -18.915 -2.271 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.554 -17.515 -0.876 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 9.679 -19.551 -1.833 1.00 0.00 C ATOM 2015 CH2 TRP A 130 10.677 -18.852 -1.141 1.00 0.00 C ATOM 0 H TRP A 130 5.435 -16.057 -0.602 1.00 0.00 H new ATOM 0 HA TRP A 130 4.076 -17.572 -2.747 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.262 -17.544 -3.854 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.735 -15.912 -3.493 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.244 -14.470 -1.845 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.553 -14.828 -0.735 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.770 -19.463 -2.802 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 11.325 -16.978 -0.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 9.807 -20.606 -2.027 1.00 0.00 H new ATOM 0 HH2 TRP A 130 11.560 -19.378 -0.810 1.00 0.00 H new ATOM 2026 N GLN A 131 6.315 -18.662 -0.572 1.00 0.00 N ATOM 2027 CA GLN A 131 6.815 -19.863 0.087 1.00 0.00 C ATOM 2028 C GLN A 131 5.666 -20.709 0.623 1.00 0.00 C ATOM 2029 O GLN A 131 5.846 -21.510 1.541 1.00 0.00 O ATOM 2030 CB GLN A 131 7.762 -19.486 1.228 1.00 0.00 C ATOM 2031 CG GLN A 131 8.553 -20.662 1.776 1.00 0.00 C ATOM 2032 CD GLN A 131 9.791 -20.230 2.536 1.00 0.00 C ATOM 2033 OE1 GLN A 131 9.710 -19.811 3.691 1.00 0.00 O ATOM 2034 NE2 GLN A 131 10.947 -20.330 1.891 1.00 0.00 N ATOM 0 H GLN A 131 6.720 -17.791 -0.228 1.00 0.00 H new ATOM 0 HA GLN A 131 7.361 -20.451 -0.651 1.00 0.00 H new ATOM 0 HB2 GLN A 131 8.457 -18.724 0.875 1.00 0.00 H new ATOM 0 HB3 GLN A 131 7.183 -19.040 2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.914 -21.249 2.435 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.846 -21.313 0.952 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.968 -20.683 0.934 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.814 -20.054 2.352 1.00 0.00 H new