USER MOD reduce.3.24.130724 H: found=0, std=0, add=461, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 462 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 279 GLN : amide:sc= -0.45 K(o=-0.45,f=-2.3!) USER MOD Set 1.2: A 283 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 238 GLN :FLIP amide:sc= -0.0947 F(o=-0.64,f=-0.095) USER MOD Single : A 240 GLN :FLIP amide:sc= -1.54 F(o=-3.2!,f=-1.5) USER MOD Single : A 242 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 243 ASN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : A 244 MET CE :methyl 133:sc= -1.41 (180deg=-6.58!) USER MOD Single : A 246 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 249 GLN : amide:sc= -2.06 K(o=-2.1,f=-3.7!) USER MOD Single : A 250 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 251 ASN : amide:sc= -0.34 X(o=-0.34,f=-0.02) USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 261 GLN : amide:sc= -1.24 K(o=-1.2,f=-7.7!) USER MOD Single : A 264 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 266 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.062) USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 271 GLN : amide:sc= -0.399 K(o=-0.4,f=-2!) USER MOD Single : A 272 GLN : amide:sc= -1.69! C(o=-1.7!,f=-6.7!) USER MOD Single : A 274 SER OG : rot 180:sc= 0 USER MOD Single : A 276 HIS : no HD1:sc= -12.9! C(o=-13!,f=-13!) USER MOD Single : A 277 GLN : amide:sc= -0.224 K(o=-0.22,f=-2.1!) USER MOD Single : A 282 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.024) USER MOD Single : A 285 ASN : amide:sc= -4.08! C(o=-4.1!,f=-6.1!) USER MOD ----------------------------------------------------------------- ATOM 29 N LEU A 232 -0.921 -3.190 -14.131 1.00 0.00 N ATOM 30 CA LEU A 232 0.013 -2.800 -13.083 1.00 0.00 C ATOM 31 C LEU A 232 1.321 -2.304 -13.687 1.00 0.00 C ATOM 32 O LEU A 232 2.033 -1.503 -13.081 1.00 0.00 O ATOM 33 CB LEU A 232 0.281 -3.981 -12.147 1.00 0.00 C ATOM 34 CG LEU A 232 0.340 -3.633 -10.659 1.00 0.00 C ATOM 35 CD1 LEU A 232 1.703 -3.067 -10.297 1.00 0.00 C ATOM 36 CD2 LEU A 232 -0.762 -2.647 -10.298 1.00 0.00 C ATOM 0 HA LEU A 232 -0.434 -1.988 -12.509 1.00 0.00 H new ATOM 0 HB2 LEU A 232 -0.498 -4.728 -12.298 1.00 0.00 H new ATOM 0 HB3 LEU A 232 1.226 -4.444 -12.433 1.00 0.00 H new ATOM 0 HG LEU A 232 0.185 -4.547 -10.085 1.00 0.00 H new ATOM 0 HD11 LEU A 232 1.726 -2.825 -9.234 1.00 0.00 H new ATOM 0 HD12 LEU A 232 2.474 -3.805 -10.518 1.00 0.00 H new ATOM 0 HD13 LEU A 232 1.888 -2.164 -10.879 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -0.705 -2.411 -9.235 1.00 0.00 H new ATOM 0 HD22 LEU A 232 -0.638 -1.734 -10.880 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -1.733 -3.090 -10.520 1.00 0.00 H new ATOM 48 N GLU A 233 1.628 -2.781 -14.889 1.00 0.00 N ATOM 49 CA GLU A 233 2.848 -2.382 -15.579 1.00 0.00 C ATOM 50 C GLU A 233 3.152 -0.910 -15.323 1.00 0.00 C ATOM 51 O GLU A 233 4.175 -0.571 -14.727 1.00 0.00 O ATOM 52 CB GLU A 233 2.714 -2.634 -17.082 1.00 0.00 C ATOM 53 CG GLU A 233 2.367 -4.074 -17.429 1.00 0.00 C ATOM 54 CD GLU A 233 3.469 -5.045 -17.054 1.00 0.00 C ATOM 55 OE1 GLU A 233 3.989 -4.945 -15.922 1.00 0.00 O ATOM 56 OE2 GLU A 233 3.813 -5.905 -17.891 1.00 0.00 O ATOM 0 H GLU A 233 1.049 -3.444 -15.405 1.00 0.00 H new ATOM 0 HA GLU A 233 3.672 -2.981 -15.191 1.00 0.00 H new ATOM 0 HB2 GLU A 233 1.944 -1.976 -17.485 1.00 0.00 H new ATOM 0 HB3 GLU A 233 3.650 -2.366 -17.572 1.00 0.00 H new ATOM 0 HG2 GLU A 233 1.448 -4.357 -16.915 1.00 0.00 H new ATOM 0 HG3 GLU A 233 2.170 -4.149 -18.498 1.00 0.00 H new ATOM 63 N PHE A 234 2.252 -0.040 -15.769 1.00 0.00 N ATOM 64 CA PHE A 234 2.424 1.395 -15.579 1.00 0.00 C ATOM 65 C PHE A 234 2.487 1.730 -14.094 1.00 0.00 C ATOM 66 O PHE A 234 3.247 2.603 -13.675 1.00 0.00 O ATOM 67 CB PHE A 234 1.283 2.164 -16.244 1.00 0.00 C ATOM 68 CG PHE A 234 -0.065 1.581 -15.960 1.00 0.00 C ATOM 69 CD1 PHE A 234 -0.597 0.603 -16.782 1.00 0.00 C ATOM 70 CD2 PHE A 234 -0.798 2.007 -14.865 1.00 0.00 C ATOM 71 CE1 PHE A 234 -1.836 0.058 -16.518 1.00 0.00 C ATOM 72 CE2 PHE A 234 -2.039 1.467 -14.597 1.00 0.00 C ATOM 73 CZ PHE A 234 -2.557 0.491 -15.424 1.00 0.00 C ATOM 0 H PHE A 234 1.399 -0.303 -16.263 1.00 0.00 H new ATOM 0 HA PHE A 234 3.363 1.693 -16.046 1.00 0.00 H new ATOM 0 HB2 PHE A 234 1.303 3.199 -15.902 1.00 0.00 H new ATOM 0 HB3 PHE A 234 1.445 2.181 -17.322 1.00 0.00 H new ATOM 0 HD1 PHE A 234 -0.036 0.263 -17.640 1.00 0.00 H new ATOM 0 HD2 PHE A 234 -0.394 2.769 -14.215 1.00 0.00 H new ATOM 0 HE1 PHE A 234 -2.241 -0.706 -17.166 1.00 0.00 H new ATOM 0 HE2 PHE A 234 -2.604 1.807 -13.742 1.00 0.00 H new ATOM 0 HZ PHE A 234 -3.527 0.066 -15.215 1.00 0.00 H new ATOM 83 N LEU A 235 1.689 1.022 -13.303 1.00 0.00 N ATOM 84 CA LEU A 235 1.656 1.232 -11.861 1.00 0.00 C ATOM 85 C LEU A 235 3.015 0.914 -11.249 1.00 0.00 C ATOM 86 O LEU A 235 3.468 1.591 -10.326 1.00 0.00 O ATOM 87 CB LEU A 235 0.576 0.357 -11.222 1.00 0.00 C ATOM 88 CG LEU A 235 -0.583 1.121 -10.585 1.00 0.00 C ATOM 89 CD1 LEU A 235 -0.237 1.527 -9.160 1.00 0.00 C ATOM 90 CD2 LEU A 235 -0.937 2.340 -11.422 1.00 0.00 C ATOM 0 H LEU A 235 1.055 0.296 -13.637 1.00 0.00 H new ATOM 0 HA LEU A 235 1.420 2.279 -11.669 1.00 0.00 H new ATOM 0 HB2 LEU A 235 0.175 -0.312 -11.983 1.00 0.00 H new ATOM 0 HB3 LEU A 235 1.041 -0.269 -10.460 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.453 0.465 -10.549 1.00 0.00 H new ATOM 0 HD11 LEU A 235 -1.075 2.070 -8.723 1.00 0.00 H new ATOM 0 HD12 LEU A 235 -0.033 0.635 -8.567 1.00 0.00 H new ATOM 0 HD13 LEU A 235 0.646 2.167 -9.168 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.765 2.874 -10.955 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -0.071 2.999 -11.489 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -1.229 2.022 -12.423 1.00 0.00 H new ATOM 102 N ARG A 236 3.663 -0.120 -11.777 1.00 0.00 N ATOM 103 CA ARG A 236 4.974 -0.531 -11.294 1.00 0.00 C ATOM 104 C ARG A 236 6.028 0.508 -11.657 1.00 0.00 C ATOM 105 O ARG A 236 6.983 0.727 -10.913 1.00 0.00 O ATOM 106 CB ARG A 236 5.355 -1.889 -11.886 1.00 0.00 C ATOM 107 CG ARG A 236 4.861 -3.072 -11.069 1.00 0.00 C ATOM 108 CD ARG A 236 4.388 -4.210 -11.961 1.00 0.00 C ATOM 109 NE ARG A 236 5.472 -4.751 -12.774 1.00 0.00 N ATOM 110 CZ ARG A 236 5.352 -5.831 -13.538 1.00 0.00 C ATOM 111 NH1 ARG A 236 4.198 -6.484 -13.592 1.00 0.00 N ATOM 112 NH2 ARG A 236 6.385 -6.260 -14.250 1.00 0.00 N ATOM 0 H ARG A 236 3.299 -0.689 -12.541 1.00 0.00 H new ATOM 0 HA ARG A 236 4.928 -0.617 -10.208 1.00 0.00 H new ATOM 0 HB2 ARG A 236 4.950 -1.962 -12.896 1.00 0.00 H new ATOM 0 HB3 ARG A 236 6.440 -1.946 -11.972 1.00 0.00 H new ATOM 0 HG2 ARG A 236 5.662 -3.426 -10.420 1.00 0.00 H new ATOM 0 HG3 ARG A 236 4.044 -2.752 -10.422 1.00 0.00 H new ATOM 0 HD2 ARG A 236 3.966 -5.003 -11.344 1.00 0.00 H new ATOM 0 HD3 ARG A 236 3.589 -3.853 -12.612 1.00 0.00 H new ATOM 0 HE ARG A 236 6.373 -4.273 -12.755 1.00 0.00 H new ATOM 0 HH11 ARG A 236 3.401 -6.157 -13.046 1.00 0.00 H new ATOM 0 HH12 ARG A 236 4.108 -7.313 -14.179 1.00 0.00 H new ATOM 0 HH21 ARG A 236 7.274 -5.761 -14.212 1.00 0.00 H new ATOM 0 HH22 ARG A 236 6.291 -7.089 -14.836 1.00 0.00 H new ATOM 126 N ASP A 237 5.843 1.148 -12.808 1.00 0.00 N ATOM 127 CA ASP A 237 6.775 2.168 -13.274 1.00 0.00 C ATOM 128 C ASP A 237 6.573 3.475 -12.517 1.00 0.00 C ATOM 129 O ASP A 237 7.538 4.125 -12.110 1.00 0.00 O ATOM 130 CB ASP A 237 6.600 2.403 -14.776 1.00 0.00 C ATOM 131 CG ASP A 237 7.575 1.591 -15.606 1.00 0.00 C ATOM 132 OD1 ASP A 237 7.614 0.354 -15.435 1.00 0.00 O ATOM 133 OD2 ASP A 237 8.300 2.192 -16.426 1.00 0.00 O ATOM 0 H ASP A 237 5.056 0.978 -13.434 1.00 0.00 H new ATOM 0 HA ASP A 237 7.788 1.812 -13.085 1.00 0.00 H new ATOM 0 HB2 ASP A 237 5.581 2.147 -15.065 1.00 0.00 H new ATOM 0 HB3 ASP A 237 6.736 3.462 -14.993 1.00 0.00 H new ATOM 138 N GLN A 238 5.314 3.858 -12.331 1.00 0.00 N ATOM 139 CA GLN A 238 4.984 5.089 -11.622 1.00 0.00 C ATOM 140 C GLN A 238 5.287 4.956 -10.132 1.00 0.00 C ATOM 141 O GLN A 238 5.470 3.851 -9.622 1.00 0.00 O ATOM 142 CB GLN A 238 3.510 5.442 -11.826 1.00 0.00 C ATOM 143 CG GLN A 238 3.227 6.126 -13.154 1.00 0.00 C ATOM 144 CD GLN A 238 2.318 7.331 -13.008 1.00 0.00 C ATOM 145 OE1 GLN A 238 1.405 7.273 -12.045 1.00 0.00 O flip ATOM 146 NE2 GLN A 238 2.435 8.305 -13.753 1.00 0.00 N flip ATOM 0 H GLN A 238 4.505 3.333 -12.662 1.00 0.00 H new ATOM 0 HA GLN A 238 5.600 5.890 -12.030 1.00 0.00 H new ATOM 0 HB2 GLN A 238 2.914 4.531 -11.762 1.00 0.00 H new ATOM 0 HB3 GLN A 238 3.185 6.093 -11.015 1.00 0.00 H new ATOM 0 HG2 GLN A 238 4.169 6.439 -13.605 1.00 0.00 H new ATOM 0 HG3 GLN A 238 2.769 5.410 -13.837 1.00 0.00 H new ATOM 0 HE21 GLN A 238 3.150 8.308 -14.480 1.00 0.00 H new ATOM 0 HE22 GLN A 238 1.817 9.109 -13.643 1.00 0.00 H new ATOM 155 N PRO A 239 5.346 6.090 -9.418 1.00 0.00 N ATOM 156 CA PRO A 239 5.631 6.110 -7.983 1.00 0.00 C ATOM 157 C PRO A 239 4.401 5.803 -7.132 1.00 0.00 C ATOM 158 O PRO A 239 4.391 6.054 -5.927 1.00 0.00 O ATOM 159 CB PRO A 239 6.093 7.545 -7.754 1.00 0.00 C ATOM 160 CG PRO A 239 5.331 8.343 -8.757 1.00 0.00 C ATOM 161 CD PRO A 239 5.146 7.448 -9.958 1.00 0.00 C ATOM 0 HA PRO A 239 6.360 5.351 -7.698 1.00 0.00 H new ATOM 0 HB2 PRO A 239 5.878 7.874 -6.737 1.00 0.00 H new ATOM 0 HB3 PRO A 239 7.168 7.645 -7.901 1.00 0.00 H new ATOM 0 HG2 PRO A 239 4.368 8.657 -8.354 1.00 0.00 H new ATOM 0 HG3 PRO A 239 5.874 9.249 -9.027 1.00 0.00 H new ATOM 0 HD2 PRO A 239 4.154 7.563 -10.394 1.00 0.00 H new ATOM 0 HD3 PRO A 239 5.867 7.677 -10.743 1.00 0.00 H new ATOM 169 N GLN A 240 3.366 5.259 -7.765 1.00 0.00 N ATOM 170 CA GLN A 240 2.135 4.922 -7.059 1.00 0.00 C ATOM 171 C GLN A 240 2.444 4.278 -5.712 1.00 0.00 C ATOM 172 O GLN A 240 1.810 4.584 -4.704 1.00 0.00 O ATOM 173 CB GLN A 240 1.282 3.975 -7.904 1.00 0.00 C ATOM 174 CG GLN A 240 0.087 4.653 -8.557 1.00 0.00 C ATOM 175 CD GLN A 240 -0.904 5.188 -7.541 1.00 0.00 C ATOM 176 OE1 GLN A 240 -1.497 4.290 -6.762 1.00 0.00 O flip ATOM 177 NE2 GLN A 240 -1.134 6.394 -7.457 1.00 0.00 N flip ATOM 0 H GLN A 240 3.355 5.043 -8.762 1.00 0.00 H new ATOM 0 HA GLN A 240 1.579 5.843 -6.885 1.00 0.00 H new ATOM 0 HB2 GLN A 240 1.906 3.531 -8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 240 0.927 3.159 -7.274 1.00 0.00 H new ATOM 0 HG2 GLN A 240 0.437 5.472 -9.185 1.00 0.00 H new ATOM 0 HG3 GLN A 240 -0.417 3.942 -9.212 1.00 0.00 H new ATOM 0 HE21 GLN A 240 -0.656 7.049 -8.076 1.00 0.00 H new ATOM 0 HE22 GLN A 240 -1.803 6.739 -6.769 1.00 0.00 H new ATOM 186 N PHE A 241 3.428 3.385 -5.707 1.00 0.00 N ATOM 187 CA PHE A 241 3.828 2.696 -4.484 1.00 0.00 C ATOM 188 C PHE A 241 4.476 3.667 -3.502 1.00 0.00 C ATOM 189 O PHE A 241 4.237 3.598 -2.297 1.00 0.00 O ATOM 190 CB PHE A 241 4.790 1.548 -4.797 1.00 0.00 C ATOM 191 CG PHE A 241 5.661 1.799 -5.992 1.00 0.00 C ATOM 192 CD1 PHE A 241 5.243 1.424 -7.259 1.00 0.00 C ATOM 193 CD2 PHE A 241 6.895 2.413 -5.850 1.00 0.00 C ATOM 194 CE1 PHE A 241 6.040 1.656 -8.361 1.00 0.00 C ATOM 195 CE2 PHE A 241 7.696 2.648 -6.950 1.00 0.00 C ATOM 196 CZ PHE A 241 7.268 2.269 -8.207 1.00 0.00 C ATOM 0 H PHE A 241 3.963 3.121 -6.534 1.00 0.00 H new ATOM 0 HA PHE A 241 2.930 2.283 -4.025 1.00 0.00 H new ATOM 0 HB2 PHE A 241 5.423 1.370 -3.928 1.00 0.00 H new ATOM 0 HB3 PHE A 241 4.214 0.638 -4.964 1.00 0.00 H new ATOM 0 HD1 PHE A 241 4.283 0.945 -7.385 1.00 0.00 H new ATOM 0 HD2 PHE A 241 7.234 2.711 -4.869 1.00 0.00 H new ATOM 0 HE1 PHE A 241 5.704 1.358 -9.343 1.00 0.00 H new ATOM 0 HE2 PHE A 241 8.656 3.128 -6.827 1.00 0.00 H new ATOM 0 HZ PHE A 241 7.893 2.452 -9.069 1.00 0.00 H new ATOM 206 N GLN A 242 5.296 4.572 -4.026 1.00 0.00 N ATOM 207 CA GLN A 242 5.977 5.559 -3.196 1.00 0.00 C ATOM 208 C GLN A 242 4.991 6.600 -2.673 1.00 0.00 C ATOM 209 O GLN A 242 4.846 6.780 -1.464 1.00 0.00 O ATOM 210 CB GLN A 242 7.087 6.246 -3.991 1.00 0.00 C ATOM 211 CG GLN A 242 8.486 5.869 -3.532 1.00 0.00 C ATOM 212 CD GLN A 242 9.419 5.574 -4.690 1.00 0.00 C ATOM 213 OE1 GLN A 242 9.816 6.476 -5.428 1.00 0.00 O ATOM 214 NE2 GLN A 242 9.774 4.305 -4.856 1.00 0.00 N ATOM 0 H GLN A 242 5.505 4.642 -5.022 1.00 0.00 H new ATOM 0 HA GLN A 242 6.418 5.040 -2.345 1.00 0.00 H new ATOM 0 HB2 GLN A 242 6.978 5.991 -5.045 1.00 0.00 H new ATOM 0 HB3 GLN A 242 6.966 7.326 -3.910 1.00 0.00 H new ATOM 0 HG2 GLN A 242 8.900 6.681 -2.935 1.00 0.00 H new ATOM 0 HG3 GLN A 242 8.429 4.994 -2.884 1.00 0.00 H new ATOM 0 HE21 GLN A 242 9.421 3.589 -4.221 1.00 0.00 H new ATOM 0 HE22 GLN A 242 10.400 4.046 -5.619 1.00 0.00 H new ATOM 223 N ASN A 243 4.314 7.280 -3.593 1.00 0.00 N ATOM 224 CA ASN A 243 3.340 8.301 -3.222 1.00 0.00 C ATOM 225 C ASN A 243 2.407 7.782 -2.134 1.00 0.00 C ATOM 226 O ASN A 243 2.136 8.475 -1.151 1.00 0.00 O ATOM 227 CB ASN A 243 2.529 8.731 -4.445 1.00 0.00 C ATOM 228 CG ASN A 243 2.929 10.103 -4.951 1.00 0.00 C ATOM 229 OD1 ASN A 243 3.602 10.229 -5.974 1.00 0.00 O ATOM 230 ND2 ASN A 243 2.518 11.141 -4.232 1.00 0.00 N ATOM 0 H ASN A 243 4.421 7.143 -4.598 1.00 0.00 H new ATOM 0 HA ASN A 243 3.880 9.165 -2.835 1.00 0.00 H new ATOM 0 HB2 ASN A 243 2.663 8.000 -5.242 1.00 0.00 H new ATOM 0 HB3 ASN A 243 1.469 8.735 -4.191 1.00 0.00 H new ATOM 0 HD21 ASN A 243 2.759 12.089 -4.521 1.00 0.00 H new ATOM 0 HD22 ASN A 243 1.962 10.990 -3.390 1.00 0.00 H new ATOM 237 N MET A 244 1.923 6.558 -2.311 1.00 0.00 N ATOM 238 CA MET A 244 1.026 5.947 -1.339 1.00 0.00 C ATOM 239 C MET A 244 1.775 5.632 -0.050 1.00 0.00 C ATOM 240 O MET A 244 1.518 6.233 0.993 1.00 0.00 O ATOM 241 CB MET A 244 0.416 4.664 -1.910 1.00 0.00 C ATOM 242 CG MET A 244 -0.521 4.905 -3.081 1.00 0.00 C ATOM 243 SD MET A 244 -0.666 3.468 -4.161 1.00 0.00 S ATOM 244 CE MET A 244 -0.948 2.168 -2.961 1.00 0.00 C ATOM 0 H MET A 244 2.136 5.971 -3.117 1.00 0.00 H new ATOM 0 HA MET A 244 0.225 6.653 -1.120 1.00 0.00 H new ATOM 0 HB2 MET A 244 1.220 4.000 -2.229 1.00 0.00 H new ATOM 0 HB3 MET A 244 -0.129 4.148 -1.120 1.00 0.00 H new ATOM 0 HG2 MET A 244 -1.508 5.172 -2.703 1.00 0.00 H new ATOM 0 HG3 MET A 244 -0.161 5.755 -3.660 1.00 0.00 H new ATOM 0 HE1 MET A 244 -1.782 1.547 -3.287 1.00 0.00 H new ATOM 0 HE2 MET A 244 -0.052 1.554 -2.872 1.00 0.00 H new ATOM 0 HE3 MET A 244 -1.182 2.611 -1.993 1.00 0.00 H new ATOM 254 N ARG A 245 2.701 4.685 -0.133 1.00 0.00 N ATOM 255 CA ARG A 245 3.491 4.281 1.021 1.00 0.00 C ATOM 256 C ARG A 245 3.946 5.489 1.833 1.00 0.00 C ATOM 257 O ARG A 245 4.143 5.388 3.040 1.00 0.00 O ATOM 258 CB ARG A 245 4.709 3.467 0.572 1.00 0.00 C ATOM 259 CG ARG A 245 5.911 4.323 0.207 1.00 0.00 C ATOM 260 CD ARG A 245 7.025 3.491 -0.406 1.00 0.00 C ATOM 261 NE ARG A 245 8.156 4.315 -0.826 1.00 0.00 N ATOM 262 CZ ARG A 245 9.396 3.855 -0.952 1.00 0.00 C ATOM 263 NH1 ARG A 245 9.663 2.581 -0.698 1.00 0.00 N ATOM 264 NH2 ARG A 245 10.370 4.669 -1.336 1.00 0.00 N ATOM 0 H ARG A 245 2.923 4.181 -0.992 1.00 0.00 H new ATOM 0 HA ARG A 245 2.858 3.662 1.657 1.00 0.00 H new ATOM 0 HB2 ARG A 245 4.991 2.780 1.370 1.00 0.00 H new ATOM 0 HB3 ARG A 245 4.432 2.858 -0.289 1.00 0.00 H new ATOM 0 HG2 ARG A 245 5.606 5.098 -0.496 1.00 0.00 H new ATOM 0 HG3 ARG A 245 6.282 4.829 1.098 1.00 0.00 H new ATOM 0 HD2 ARG A 245 7.365 2.751 0.318 1.00 0.00 H new ATOM 0 HD3 ARG A 245 6.637 2.943 -1.265 1.00 0.00 H new ATOM 0 HE ARG A 245 7.984 5.299 -1.034 1.00 0.00 H new ATOM 0 HH11 ARG A 245 8.915 1.952 -0.405 1.00 0.00 H new ATOM 0 HH12 ARG A 245 10.616 2.230 -0.796 1.00 0.00 H new ATOM 0 HH21 ARG A 245 10.167 5.649 -1.535 1.00 0.00 H new ATOM 0 HH22 ARG A 245 11.322 4.315 -1.433 1.00 0.00 H new ATOM 278 N GLN A 246 4.120 6.626 1.167 1.00 0.00 N ATOM 279 CA GLN A 246 4.564 7.842 1.844 1.00 0.00 C ATOM 280 C GLN A 246 3.438 8.453 2.680 1.00 0.00 C ATOM 281 O GLN A 246 3.555 8.566 3.901 1.00 0.00 O ATOM 282 CB GLN A 246 5.117 8.852 0.824 1.00 0.00 C ATOM 283 CG GLN A 246 4.217 10.052 0.557 1.00 0.00 C ATOM 284 CD GLN A 246 4.952 11.186 -0.132 1.00 0.00 C ATOM 285 OE1 GLN A 246 5.136 11.174 -1.349 1.00 0.00 O ATOM 286 NE2 GLN A 246 5.377 12.174 0.646 1.00 0.00 N ATOM 0 H GLN A 246 3.962 6.732 0.165 1.00 0.00 H new ATOM 0 HA GLN A 246 5.369 7.578 2.530 1.00 0.00 H new ATOM 0 HB2 GLN A 246 6.083 9.212 1.178 1.00 0.00 H new ATOM 0 HB3 GLN A 246 5.296 8.334 -0.118 1.00 0.00 H new ATOM 0 HG2 GLN A 246 3.375 9.740 -0.061 1.00 0.00 H new ATOM 0 HG3 GLN A 246 3.805 10.410 1.500 1.00 0.00 H new ATOM 0 HE21 GLN A 246 5.203 12.143 1.651 1.00 0.00 H new ATOM 0 HE22 GLN A 246 5.878 12.964 0.239 1.00 0.00 H new ATOM 295 N VAL A 247 2.351 8.844 2.021 1.00 0.00 N ATOM 296 CA VAL A 247 1.216 9.436 2.719 1.00 0.00 C ATOM 297 C VAL A 247 0.798 8.568 3.900 1.00 0.00 C ATOM 298 O VAL A 247 0.587 9.061 5.008 1.00 0.00 O ATOM 299 CB VAL A 247 0.010 9.624 1.779 1.00 0.00 C ATOM 300 CG1 VAL A 247 0.232 10.808 0.852 1.00 0.00 C ATOM 301 CG2 VAL A 247 -0.248 8.353 0.983 1.00 0.00 C ATOM 0 H VAL A 247 2.233 8.762 1.011 1.00 0.00 H new ATOM 0 HA VAL A 247 1.535 10.414 3.079 1.00 0.00 H new ATOM 0 HB VAL A 247 -0.871 9.831 2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -0.631 10.924 0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 247 0.362 11.714 1.444 1.00 0.00 H new ATOM 0 HG13 VAL A 247 1.124 10.637 0.250 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -1.103 8.504 0.324 1.00 0.00 H new ATOM 0 HG22 VAL A 247 0.632 8.113 0.386 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -0.458 7.531 1.668 1.00 0.00 H new ATOM 311 N ILE A 248 0.685 7.270 3.648 1.00 0.00 N ATOM 312 CA ILE A 248 0.298 6.314 4.672 1.00 0.00 C ATOM 313 C ILE A 248 1.447 6.053 5.647 1.00 0.00 C ATOM 314 O ILE A 248 1.218 5.773 6.822 1.00 0.00 O ATOM 315 CB ILE A 248 -0.164 4.981 4.050 1.00 0.00 C ATOM 316 CG1 ILE A 248 0.886 4.468 3.049 1.00 0.00 C ATOM 317 CG2 ILE A 248 -1.530 5.156 3.388 1.00 0.00 C ATOM 318 CD1 ILE A 248 0.312 4.014 1.721 1.00 0.00 C ATOM 0 H ILE A 248 0.858 6.854 2.733 1.00 0.00 H new ATOM 0 HA ILE A 248 -0.537 6.753 5.219 1.00 0.00 H new ATOM 0 HB ILE A 248 -0.266 4.234 4.837 1.00 0.00 H new ATOM 0 HG12 ILE A 248 1.613 5.259 2.866 1.00 0.00 H new ATOM 0 HG13 ILE A 248 1.426 3.636 3.501 1.00 0.00 H new ATOM 0 HG21 ILE A 248 -1.847 4.209 2.952 1.00 0.00 H new ATOM 0 HG22 ILE A 248 -2.258 5.473 4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 248 -1.461 5.911 2.605 1.00 0.00 H new ATOM 0 HD11 ILE A 248 1.119 3.668 1.075 1.00 0.00 H new ATOM 0 HD12 ILE A 248 -0.393 3.200 1.889 1.00 0.00 H new ATOM 0 HD13 ILE A 248 -0.203 4.847 1.243 1.00 0.00 H new ATOM 330 N GLN A 249 2.684 6.157 5.160 1.00 0.00 N ATOM 331 CA GLN A 249 3.851 5.939 6.012 1.00 0.00 C ATOM 332 C GLN A 249 3.776 6.845 7.231 1.00 0.00 C ATOM 333 O GLN A 249 3.585 6.379 8.355 1.00 0.00 O ATOM 334 CB GLN A 249 5.147 6.202 5.239 1.00 0.00 C ATOM 335 CG GLN A 249 6.324 6.583 6.125 1.00 0.00 C ATOM 336 CD GLN A 249 7.570 6.917 5.327 1.00 0.00 C ATOM 337 OE1 GLN A 249 8.539 6.158 5.319 1.00 0.00 O ATOM 338 NE2 GLN A 249 7.550 8.060 4.652 1.00 0.00 N ATOM 0 H GLN A 249 2.902 6.388 4.191 1.00 0.00 H new ATOM 0 HA GLN A 249 3.853 4.898 6.337 1.00 0.00 H new ATOM 0 HB2 GLN A 249 5.407 5.310 4.670 1.00 0.00 H new ATOM 0 HB3 GLN A 249 4.973 7.001 4.518 1.00 0.00 H new ATOM 0 HG2 GLN A 249 6.049 7.441 6.739 1.00 0.00 H new ATOM 0 HG3 GLN A 249 6.543 5.761 6.806 1.00 0.00 H new ATOM 0 HE21 GLN A 249 6.725 8.659 4.687 1.00 0.00 H new ATOM 0 HE22 GLN A 249 8.360 8.339 4.098 1.00 0.00 H new ATOM 347 N GLN A 250 3.901 8.146 7.000 1.00 0.00 N ATOM 348 CA GLN A 250 3.816 9.115 8.080 1.00 0.00 C ATOM 349 C GLN A 250 2.368 9.230 8.524 1.00 0.00 C ATOM 350 O GLN A 250 2.054 9.106 9.708 1.00 0.00 O ATOM 351 CB GLN A 250 4.341 10.479 7.624 1.00 0.00 C ATOM 352 CG GLN A 250 5.634 10.398 6.831 1.00 0.00 C ATOM 353 CD GLN A 250 6.041 11.735 6.243 1.00 0.00 C ATOM 354 OE1 GLN A 250 5.412 12.235 5.310 1.00 0.00 O ATOM 355 NE2 GLN A 250 7.099 12.324 6.789 1.00 0.00 N ATOM 0 H GLN A 250 4.061 8.551 6.078 1.00 0.00 H new ATOM 0 HA GLN A 250 4.432 8.780 8.915 1.00 0.00 H new ATOM 0 HB2 GLN A 250 3.580 10.967 7.014 1.00 0.00 H new ATOM 0 HB3 GLN A 250 4.500 11.109 8.499 1.00 0.00 H new ATOM 0 HG2 GLN A 250 6.431 10.032 7.478 1.00 0.00 H new ATOM 0 HG3 GLN A 250 5.518 9.672 6.027 1.00 0.00 H new ATOM 0 HE21 GLN A 250 7.591 11.874 7.561 1.00 0.00 H new ATOM 0 HE22 GLN A 250 7.419 13.226 6.436 1.00 0.00 H new ATOM 364 N ASN A 251 1.491 9.445 7.550 1.00 0.00 N ATOM 365 CA ASN A 251 0.062 9.547 7.796 1.00 0.00 C ATOM 366 C ASN A 251 -0.645 8.230 7.465 1.00 0.00 C ATOM 367 O ASN A 251 -1.400 8.162 6.496 1.00 0.00 O ATOM 368 CB ASN A 251 -0.540 10.684 6.970 1.00 0.00 C ATOM 369 CG ASN A 251 -0.934 11.873 7.823 1.00 0.00 C ATOM 370 OD1 ASN A 251 -1.983 12.482 7.615 1.00 0.00 O ATOM 371 ND2 ASN A 251 -0.090 12.213 8.791 1.00 0.00 N ATOM 0 H ASN A 251 1.752 9.553 6.570 1.00 0.00 H new ATOM 0 HA ASN A 251 -0.084 9.761 8.855 1.00 0.00 H new ATOM 0 HB2 ASN A 251 0.181 11.003 6.217 1.00 0.00 H new ATOM 0 HB3 ASN A 251 -1.417 10.317 6.436 1.00 0.00 H new ATOM 0 HD21 ASN A 251 -0.301 13.006 9.396 1.00 0.00 H new ATOM 0 HD22 ASN A 251 0.769 11.681 8.929 1.00 0.00 H new ATOM 378 N PRO A 252 -0.421 7.160 8.254 1.00 0.00 N ATOM 379 CA PRO A 252 -1.057 5.853 8.014 1.00 0.00 C ATOM 380 C PRO A 252 -2.532 5.826 8.412 1.00 0.00 C ATOM 381 O PRO A 252 -3.102 4.757 8.630 1.00 0.00 O ATOM 382 CB PRO A 252 -0.258 4.916 8.919 1.00 0.00 C ATOM 383 CG PRO A 252 0.175 5.786 10.047 1.00 0.00 C ATOM 384 CD PRO A 252 0.463 7.129 9.433 1.00 0.00 C ATOM 0 HA PRO A 252 -1.046 5.586 6.957 1.00 0.00 H new ATOM 0 HB2 PRO A 252 -0.868 4.083 9.269 1.00 0.00 H new ATOM 0 HB3 PRO A 252 0.596 4.487 8.395 1.00 0.00 H new ATOM 0 HG2 PRO A 252 -0.604 5.861 10.806 1.00 0.00 H new ATOM 0 HG3 PRO A 252 1.060 5.381 10.537 1.00 0.00 H new ATOM 0 HD2 PRO A 252 0.241 7.943 10.123 1.00 0.00 H new ATOM 0 HD3 PRO A 252 1.512 7.226 9.152 1.00 0.00 H new ATOM 392 N ALA A 253 -3.140 7.001 8.512 1.00 0.00 N ATOM 393 CA ALA A 253 -4.544 7.105 8.891 1.00 0.00 C ATOM 394 C ALA A 253 -5.460 6.917 7.688 1.00 0.00 C ATOM 395 O ALA A 253 -6.597 6.465 7.825 1.00 0.00 O ATOM 396 CB ALA A 253 -4.826 8.442 9.561 1.00 0.00 C ATOM 0 H ALA A 253 -2.683 7.896 8.336 1.00 0.00 H new ATOM 0 HA ALA A 253 -4.750 6.306 9.603 1.00 0.00 H new ATOM 0 HB1 ALA A 253 -5.880 8.497 9.835 1.00 0.00 H new ATOM 0 HB2 ALA A 253 -4.213 8.536 10.457 1.00 0.00 H new ATOM 0 HB3 ALA A 253 -4.588 9.252 8.871 1.00 0.00 H new ATOM 402 N LEU A 254 -4.963 7.281 6.512 1.00 0.00 N ATOM 403 CA LEU A 254 -5.743 7.168 5.286 1.00 0.00 C ATOM 404 C LEU A 254 -5.771 5.734 4.766 1.00 0.00 C ATOM 405 O LEU A 254 -6.588 5.398 3.909 1.00 0.00 O ATOM 406 CB LEU A 254 -5.179 8.100 4.213 1.00 0.00 C ATOM 407 CG LEU A 254 -3.948 7.570 3.478 1.00 0.00 C ATOM 408 CD1 LEU A 254 -4.134 7.689 1.974 1.00 0.00 C ATOM 409 CD2 LEU A 254 -2.699 8.316 3.924 1.00 0.00 C ATOM 0 H LEU A 254 -4.024 7.657 6.382 1.00 0.00 H new ATOM 0 HA LEU A 254 -6.767 7.460 5.519 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -5.961 8.302 3.481 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -4.924 9.052 4.678 1.00 0.00 H new ATOM 0 HG LEU A 254 -3.825 6.516 3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -3.248 7.307 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -5.005 7.110 1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -4.282 8.735 1.707 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -1.832 7.926 3.391 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -2.812 9.378 3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -2.557 8.180 4.996 1.00 0.00 H new ATOM 421 N LEU A 255 -4.879 4.888 5.277 1.00 0.00 N ATOM 422 CA LEU A 255 -4.830 3.498 4.836 1.00 0.00 C ATOM 423 C LEU A 255 -4.522 3.441 3.346 1.00 0.00 C ATOM 424 O LEU A 255 -5.116 4.182 2.565 1.00 0.00 O ATOM 425 CB LEU A 255 -6.180 2.817 5.117 1.00 0.00 C ATOM 426 CG LEU A 255 -6.283 1.324 4.758 1.00 0.00 C ATOM 427 CD1 LEU A 255 -5.984 1.083 3.286 1.00 0.00 C ATOM 428 CD2 LEU A 255 -5.358 0.498 5.636 1.00 0.00 C ATOM 0 H LEU A 255 -4.190 5.137 5.987 1.00 0.00 H new ATOM 0 HA LEU A 255 -4.045 2.975 5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 255 -6.405 2.929 6.178 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -6.954 3.354 4.569 1.00 0.00 H new ATOM 0 HG LEU A 255 -7.310 1.008 4.942 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -6.066 0.018 3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -6.698 1.635 2.675 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -4.973 1.423 3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -5.445 -0.555 5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -4.329 0.826 5.490 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -5.636 0.629 6.682 1.00 0.00 H new ATOM 440 N PRO A 256 -3.595 2.561 2.925 1.00 0.00 N ATOM 441 CA PRO A 256 -3.229 2.411 1.511 1.00 0.00 C ATOM 442 C PRO A 256 -4.422 1.995 0.653 1.00 0.00 C ATOM 443 O PRO A 256 -4.385 0.967 -0.022 1.00 0.00 O ATOM 444 CB PRO A 256 -2.174 1.296 1.519 1.00 0.00 C ATOM 445 CG PRO A 256 -2.359 0.597 2.823 1.00 0.00 C ATOM 446 CD PRO A 256 -2.832 1.646 3.787 1.00 0.00 C ATOM 0 HA PRO A 256 -2.870 3.348 1.086 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -2.316 0.613 0.682 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -1.167 1.705 1.430 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -3.087 -0.209 2.734 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -1.425 0.148 3.161 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -3.453 1.220 4.575 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -1.999 2.151 4.276 1.00 0.00 H new ATOM 454 N ALA A 257 -5.476 2.804 0.683 1.00 0.00 N ATOM 455 CA ALA A 257 -6.678 2.530 -0.086 1.00 0.00 C ATOM 456 C ALA A 257 -6.399 2.701 -1.567 1.00 0.00 C ATOM 457 O ALA A 257 -7.057 2.094 -2.410 1.00 0.00 O ATOM 458 CB ALA A 257 -7.822 3.435 0.346 1.00 0.00 C ATOM 0 H ALA A 257 -5.519 3.660 1.237 1.00 0.00 H new ATOM 0 HA ALA A 257 -6.976 1.499 0.102 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -8.709 3.208 -0.246 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -8.038 3.270 1.401 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -7.540 4.477 0.192 1.00 0.00 H new ATOM 464 N LEU A 258 -5.412 3.533 -1.877 1.00 0.00 N ATOM 465 CA LEU A 258 -5.043 3.778 -3.260 1.00 0.00 C ATOM 466 C LEU A 258 -5.112 2.478 -4.054 1.00 0.00 C ATOM 467 O LEU A 258 -5.651 2.433 -5.162 1.00 0.00 O ATOM 468 CB LEU A 258 -3.636 4.373 -3.343 1.00 0.00 C ATOM 469 CG LEU A 258 -3.585 5.900 -3.430 1.00 0.00 C ATOM 470 CD1 LEU A 258 -4.647 6.416 -4.390 1.00 0.00 C ATOM 471 CD2 LEU A 258 -3.762 6.519 -2.052 1.00 0.00 C ATOM 0 H LEU A 258 -4.857 4.045 -1.191 1.00 0.00 H new ATOM 0 HA LEU A 258 -5.745 4.494 -3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -3.071 4.055 -2.467 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.133 3.957 -4.216 1.00 0.00 H new ATOM 0 HG LEU A 258 -2.607 6.191 -3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.596 7.504 -4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -4.474 6.000 -5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.633 6.115 -4.037 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.723 7.605 -2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -4.726 6.220 -1.640 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -2.964 6.176 -1.394 1.00 0.00 H new ATOM 483 N LEU A 259 -4.575 1.416 -3.461 1.00 0.00 N ATOM 484 CA LEU A 259 -4.582 0.102 -4.088 1.00 0.00 C ATOM 485 C LEU A 259 -6.002 -0.448 -4.141 1.00 0.00 C ATOM 486 O LEU A 259 -6.409 -1.060 -5.128 1.00 0.00 O ATOM 487 CB LEU A 259 -3.664 -0.854 -3.316 1.00 0.00 C ATOM 488 CG LEU A 259 -4.135 -2.310 -3.246 1.00 0.00 C ATOM 489 CD1 LEU A 259 -5.313 -2.449 -2.294 1.00 0.00 C ATOM 490 CD2 LEU A 259 -4.504 -2.816 -4.632 1.00 0.00 C ATOM 0 H LEU A 259 -4.129 1.442 -2.544 1.00 0.00 H new ATOM 0 HA LEU A 259 -4.209 0.195 -5.108 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -2.676 -0.832 -3.776 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -3.550 -0.478 -2.299 1.00 0.00 H new ATOM 0 HG LEU A 259 -3.315 -2.918 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -5.632 -3.491 -2.259 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -5.014 -2.127 -1.296 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -6.138 -1.829 -2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 259 -4.836 -3.852 -4.565 1.00 0.00 H new ATOM 0 HD22 LEU A 259 -5.307 -2.203 -5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 259 -3.633 -2.756 -5.285 1.00 0.00 H new ATOM 502 N GLN A 260 -6.752 -0.215 -3.068 1.00 0.00 N ATOM 503 CA GLN A 260 -8.133 -0.676 -2.984 1.00 0.00 C ATOM 504 C GLN A 260 -8.980 -0.034 -4.076 1.00 0.00 C ATOM 505 O GLN A 260 -9.828 -0.689 -4.681 1.00 0.00 O ATOM 506 CB GLN A 260 -8.719 -0.351 -1.609 1.00 0.00 C ATOM 507 CG GLN A 260 -9.356 -1.548 -0.923 1.00 0.00 C ATOM 508 CD GLN A 260 -8.630 -1.944 0.348 1.00 0.00 C ATOM 509 OE1 GLN A 260 -7.852 -2.898 0.360 1.00 0.00 O ATOM 510 NE2 GLN A 260 -8.882 -1.211 1.427 1.00 0.00 N ATOM 0 H GLN A 260 -6.426 0.291 -2.244 1.00 0.00 H new ATOM 0 HA GLN A 260 -8.142 -1.757 -3.126 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -7.929 0.046 -0.971 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -9.466 0.435 -1.718 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -10.395 -1.317 -0.687 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -9.366 -2.394 -1.610 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -9.534 -0.429 1.371 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -8.423 -1.430 2.311 1.00 0.00 H new ATOM 519 N GLN A 261 -8.738 1.249 -4.329 1.00 0.00 N ATOM 520 CA GLN A 261 -9.472 1.976 -5.355 1.00 0.00 C ATOM 521 C GLN A 261 -9.105 1.447 -6.733 1.00 0.00 C ATOM 522 O GLN A 261 -9.943 1.384 -7.632 1.00 0.00 O ATOM 523 CB GLN A 261 -9.171 3.473 -5.270 1.00 0.00 C ATOM 524 CG GLN A 261 -10.246 4.270 -4.550 1.00 0.00 C ATOM 525 CD GLN A 261 -10.428 3.835 -3.110 1.00 0.00 C ATOM 526 OE1 GLN A 261 -9.700 2.977 -2.611 1.00 0.00 O ATOM 527 NE2 GLN A 261 -11.404 4.428 -2.432 1.00 0.00 N ATOM 0 H GLN A 261 -8.039 1.805 -3.837 1.00 0.00 H new ATOM 0 HA GLN A 261 -10.539 1.827 -5.190 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -8.220 3.615 -4.757 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -9.051 3.869 -6.279 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -9.987 5.328 -4.576 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -11.192 4.160 -5.081 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -11.984 5.134 -2.885 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -11.574 4.177 -1.458 1.00 0.00 H new ATOM 536 N LEU A 262 -7.844 1.062 -6.890 1.00 0.00 N ATOM 537 CA LEU A 262 -7.360 0.528 -8.157 1.00 0.00 C ATOM 538 C LEU A 262 -7.890 -0.886 -8.383 1.00 0.00 C ATOM 539 O LEU A 262 -8.446 -1.191 -9.438 1.00 0.00 O ATOM 540 CB LEU A 262 -5.830 0.524 -8.183 1.00 0.00 C ATOM 541 CG LEU A 262 -5.185 1.882 -8.462 1.00 0.00 C ATOM 542 CD1 LEU A 262 -3.927 2.057 -7.626 1.00 0.00 C ATOM 543 CD2 LEU A 262 -4.866 2.025 -9.943 1.00 0.00 C ATOM 0 H LEU A 262 -7.138 1.110 -6.155 1.00 0.00 H new ATOM 0 HA LEU A 262 -7.725 1.169 -8.959 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -5.466 0.156 -7.224 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -5.496 -0.183 -8.943 1.00 0.00 H new ATOM 0 HG LEU A 262 -5.893 2.663 -8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -3.482 3.029 -7.838 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -4.182 1.998 -6.568 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -3.214 1.270 -7.872 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -4.408 2.997 -10.124 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -4.176 1.237 -10.244 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -5.785 1.944 -10.523 1.00 0.00 H new ATOM 555 N GLY A 263 -7.721 -1.745 -7.381 1.00 0.00 N ATOM 556 CA GLY A 263 -8.190 -3.114 -7.490 1.00 0.00 C ATOM 557 C GLY A 263 -9.701 -3.204 -7.483 1.00 0.00 C ATOM 558 O GLY A 263 -10.281 -4.113 -8.077 1.00 0.00 O ATOM 0 H GLY A 263 -7.268 -1.517 -6.496 1.00 0.00 H new ATOM 0 HA2 GLY A 263 -7.806 -3.556 -8.410 1.00 0.00 H new ATOM 0 HA3 GLY A 263 -7.789 -3.700 -6.663 1.00 0.00 H new ATOM 562 N GLN A 264 -10.338 -2.251 -6.816 1.00 0.00 N ATOM 563 CA GLN A 264 -11.794 -2.213 -6.738 1.00 0.00 C ATOM 564 C GLN A 264 -12.365 -1.551 -7.984 1.00 0.00 C ATOM 565 O GLN A 264 -13.364 -2.004 -8.543 1.00 0.00 O ATOM 566 CB GLN A 264 -12.246 -1.456 -5.489 1.00 0.00 C ATOM 567 CG GLN A 264 -11.925 -2.177 -4.191 1.00 0.00 C ATOM 568 CD GLN A 264 -12.902 -3.297 -3.892 1.00 0.00 C ATOM 569 OE1 GLN A 264 -12.558 -4.477 -3.977 1.00 0.00 O ATOM 570 NE2 GLN A 264 -14.129 -2.934 -3.538 1.00 0.00 N ATOM 0 H GLN A 264 -9.870 -1.493 -6.320 1.00 0.00 H new ATOM 0 HA GLN A 264 -12.165 -3.236 -6.676 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -11.771 -0.475 -5.477 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -13.322 -1.288 -5.545 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -10.916 -2.585 -4.246 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -11.936 -1.461 -3.369 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -14.372 -1.945 -3.480 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -14.829 -3.644 -3.324 1.00 0.00 H new ATOM 579 N GLU A 265 -11.711 -0.480 -8.415 1.00 0.00 N ATOM 580 CA GLU A 265 -12.131 0.252 -9.600 1.00 0.00 C ATOM 581 C GLU A 265 -12.439 -0.712 -10.737 1.00 0.00 C ATOM 582 O GLU A 265 -13.589 -0.856 -11.151 1.00 0.00 O ATOM 583 CB GLU A 265 -11.033 1.239 -10.016 1.00 0.00 C ATOM 584 CG GLU A 265 -10.971 1.508 -11.512 1.00 0.00 C ATOM 585 CD GLU A 265 -12.339 1.740 -12.120 1.00 0.00 C ATOM 586 OE1 GLU A 265 -13.335 1.729 -11.366 1.00 0.00 O ATOM 587 OE2 GLU A 265 -12.417 1.935 -13.352 1.00 0.00 O ATOM 0 H GLU A 265 -10.883 -0.098 -7.958 1.00 0.00 H new ATOM 0 HA GLU A 265 -13.039 0.810 -9.370 1.00 0.00 H new ATOM 0 HB2 GLU A 265 -11.192 2.183 -9.495 1.00 0.00 H new ATOM 0 HB3 GLU A 265 -10.068 0.852 -9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 265 -10.344 2.380 -11.695 1.00 0.00 H new ATOM 0 HG3 GLU A 265 -10.495 0.663 -12.010 1.00 0.00 H new ATOM 594 N ASN A 266 -11.402 -1.372 -11.236 1.00 0.00 N ATOM 595 CA ASN A 266 -11.560 -2.326 -12.322 1.00 0.00 C ATOM 596 C ASN A 266 -11.509 -3.756 -11.799 1.00 0.00 C ATOM 597 O ASN A 266 -10.455 -4.236 -11.383 1.00 0.00 O ATOM 598 CB ASN A 266 -10.474 -2.116 -13.379 1.00 0.00 C ATOM 599 CG ASN A 266 -11.048 -1.742 -14.732 1.00 0.00 C ATOM 600 OD1 ASN A 266 -10.656 -2.294 -15.759 1.00 0.00 O ATOM 601 ND2 ASN A 266 -11.983 -0.798 -14.738 1.00 0.00 N ATOM 0 H ASN A 266 -10.443 -1.263 -10.905 1.00 0.00 H new ATOM 0 HA ASN A 266 -12.535 -2.160 -12.779 1.00 0.00 H new ATOM 0 HB2 ASN A 266 -9.794 -1.332 -13.046 1.00 0.00 H new ATOM 0 HB3 ASN A 266 -9.885 -3.028 -13.477 1.00 0.00 H new ATOM 0 HD21 ASN A 266 -12.406 -0.504 -15.619 1.00 0.00 H new ATOM 0 HD22 ASN A 266 -12.278 -0.367 -13.862 1.00 0.00 H new ATOM 608 N PRO A 267 -12.649 -4.459 -11.818 1.00 0.00 N ATOM 609 CA PRO A 267 -12.728 -5.842 -11.347 1.00 0.00 C ATOM 610 C PRO A 267 -11.589 -6.693 -11.893 1.00 0.00 C ATOM 611 O PRO A 267 -11.229 -7.717 -11.311 1.00 0.00 O ATOM 612 CB PRO A 267 -14.071 -6.320 -11.896 1.00 0.00 C ATOM 613 CG PRO A 267 -14.900 -5.086 -11.988 1.00 0.00 C ATOM 614 CD PRO A 267 -13.950 -3.962 -12.305 1.00 0.00 C ATOM 0 HA PRO A 267 -12.647 -5.919 -10.263 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -13.955 -6.793 -12.871 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -14.529 -7.057 -11.237 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.659 -5.184 -12.764 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -15.425 -4.899 -11.051 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -13.923 -3.749 -13.374 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.240 -3.039 -11.803 1.00 0.00 H new ATOM 622 N GLN A 268 -11.025 -6.259 -13.014 1.00 0.00 N ATOM 623 CA GLN A 268 -9.924 -6.976 -13.646 1.00 0.00 C ATOM 624 C GLN A 268 -8.578 -6.404 -13.214 1.00 0.00 C ATOM 625 O GLN A 268 -7.535 -7.028 -13.416 1.00 0.00 O ATOM 626 CB GLN A 268 -10.053 -6.912 -15.168 1.00 0.00 C ATOM 627 CG GLN A 268 -10.602 -8.189 -15.785 1.00 0.00 C ATOM 628 CD GLN A 268 -10.990 -8.013 -17.240 1.00 0.00 C ATOM 629 OE1 GLN A 268 -12.116 -7.628 -17.552 1.00 0.00 O ATOM 630 NE2 GLN A 268 -10.054 -8.295 -18.140 1.00 0.00 N ATOM 0 H GLN A 268 -11.313 -5.412 -13.505 1.00 0.00 H new ATOM 0 HA GLN A 268 -9.973 -8.017 -13.327 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -10.705 -6.080 -15.435 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -9.074 -6.701 -15.599 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -9.854 -8.978 -15.705 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -11.473 -8.517 -15.218 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -9.133 -8.611 -17.836 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -10.256 -8.195 -19.135 1.00 0.00 H new ATOM 639 N LEU A 269 -8.602 -5.213 -12.621 1.00 0.00 N ATOM 640 CA LEU A 269 -7.377 -4.566 -12.168 1.00 0.00 C ATOM 641 C LEU A 269 -6.741 -5.346 -11.023 1.00 0.00 C ATOM 642 O LEU A 269 -5.567 -5.705 -11.084 1.00 0.00 O ATOM 643 CB LEU A 269 -7.651 -3.127 -11.729 1.00 0.00 C ATOM 644 CG LEU A 269 -6.528 -2.138 -12.045 1.00 0.00 C ATOM 645 CD1 LEU A 269 -6.807 -1.412 -13.352 1.00 0.00 C ATOM 646 CD2 LEU A 269 -6.352 -1.142 -10.909 1.00 0.00 C ATOM 0 H LEU A 269 -9.453 -4.679 -12.444 1.00 0.00 H new ATOM 0 HA LEU A 269 -6.682 -4.549 -13.007 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -8.566 -2.783 -12.211 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -7.833 -3.118 -10.654 1.00 0.00 H new ATOM 0 HG LEU A 269 -5.600 -2.700 -12.154 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -5.997 -0.713 -13.560 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -6.878 -2.137 -14.163 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -7.747 -0.865 -13.271 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -5.548 -0.448 -11.155 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -7.279 -0.587 -10.765 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -6.102 -1.676 -9.992 1.00 0.00 H new ATOM 658 N LEU A 270 -7.522 -5.605 -9.980 1.00 0.00 N ATOM 659 CA LEU A 270 -7.031 -6.344 -8.823 1.00 0.00 C ATOM 660 C LEU A 270 -6.449 -7.691 -9.241 1.00 0.00 C ATOM 661 O LEU A 270 -5.262 -7.953 -9.051 1.00 0.00 O ATOM 662 CB LEU A 270 -8.160 -6.556 -7.811 1.00 0.00 C ATOM 663 CG LEU A 270 -7.721 -7.122 -6.460 1.00 0.00 C ATOM 664 CD1 LEU A 270 -6.366 -6.560 -6.060 1.00 0.00 C ATOM 665 CD2 LEU A 270 -8.762 -6.818 -5.392 1.00 0.00 C ATOM 0 H LEU A 270 -8.497 -5.314 -9.912 1.00 0.00 H new ATOM 0 HA LEU A 270 -6.239 -5.756 -8.359 1.00 0.00 H new ATOM 0 HB2 LEU A 270 -8.660 -5.602 -7.643 1.00 0.00 H new ATOM 0 HB3 LEU A 270 -8.897 -7.230 -8.248 1.00 0.00 H new ATOM 0 HG LEU A 270 -7.629 -8.204 -6.554 1.00 0.00 H new ATOM 0 HD11 LEU A 270 -6.070 -6.974 -5.096 1.00 0.00 H new ATOM 0 HD12 LEU A 270 -5.624 -6.828 -6.813 1.00 0.00 H new ATOM 0 HD13 LEU A 270 -6.430 -5.475 -5.984 1.00 0.00 H new ATOM 0 HD21 LEU A 270 -8.434 -7.228 -4.437 1.00 0.00 H new ATOM 0 HD22 LEU A 270 -8.885 -5.739 -5.301 1.00 0.00 H new ATOM 0 HD23 LEU A 270 -9.714 -7.269 -5.673 1.00 0.00 H new ATOM 677 N GLN A 271 -7.296 -8.542 -9.811 1.00 0.00 N ATOM 678 CA GLN A 271 -6.868 -9.863 -10.256 1.00 0.00 C ATOM 679 C GLN A 271 -5.467 -9.807 -10.856 1.00 0.00 C ATOM 680 O GLN A 271 -4.572 -10.540 -10.435 1.00 0.00 O ATOM 681 CB GLN A 271 -7.853 -10.421 -11.285 1.00 0.00 C ATOM 682 CG GLN A 271 -9.284 -10.494 -10.778 1.00 0.00 C ATOM 683 CD GLN A 271 -9.878 -11.883 -10.909 1.00 0.00 C ATOM 684 OE1 GLN A 271 -9.154 -12.873 -11.023 1.00 0.00 O ATOM 685 NE2 GLN A 271 -11.203 -11.964 -10.893 1.00 0.00 N ATOM 0 H GLN A 271 -8.282 -8.340 -9.975 1.00 0.00 H new ATOM 0 HA GLN A 271 -6.847 -10.522 -9.388 1.00 0.00 H new ATOM 0 HB2 GLN A 271 -7.824 -9.798 -12.179 1.00 0.00 H new ATOM 0 HB3 GLN A 271 -7.530 -11.419 -11.582 1.00 0.00 H new ATOM 0 HG2 GLN A 271 -9.311 -10.188 -9.732 1.00 0.00 H new ATOM 0 HG3 GLN A 271 -9.899 -9.786 -11.333 1.00 0.00 H new ATOM 0 HE21 GLN A 271 -11.765 -11.118 -10.797 1.00 0.00 H new ATOM 0 HE22 GLN A 271 -11.659 -12.872 -10.977 1.00 0.00 H new ATOM 694 N GLN A 272 -5.287 -8.933 -11.839 1.00 0.00 N ATOM 695 CA GLN A 272 -3.996 -8.780 -12.500 1.00 0.00 C ATOM 696 C GLN A 272 -2.962 -8.188 -11.546 1.00 0.00 C ATOM 697 O GLN A 272 -1.807 -8.613 -11.525 1.00 0.00 O ATOM 698 CB GLN A 272 -4.140 -7.890 -13.735 1.00 0.00 C ATOM 699 CG GLN A 272 -5.040 -8.478 -14.808 1.00 0.00 C ATOM 700 CD GLN A 272 -4.452 -9.719 -15.450 1.00 0.00 C ATOM 701 OE1 GLN A 272 -3.794 -10.522 -14.788 1.00 0.00 O ATOM 702 NE2 GLN A 272 -4.689 -9.883 -16.746 1.00 0.00 N ATOM 0 H GLN A 272 -6.019 -8.319 -12.196 1.00 0.00 H new ATOM 0 HA GLN A 272 -3.651 -9.767 -12.809 1.00 0.00 H new ATOM 0 HB2 GLN A 272 -4.537 -6.922 -13.430 1.00 0.00 H new ATOM 0 HB3 GLN A 272 -3.152 -7.710 -14.160 1.00 0.00 H new ATOM 0 HG2 GLN A 272 -6.007 -8.724 -14.370 1.00 0.00 H new ATOM 0 HG3 GLN A 272 -5.220 -7.727 -15.577 1.00 0.00 H new ATOM 0 HE21 GLN A 272 -5.240 -9.192 -17.255 1.00 0.00 H new ATOM 0 HE22 GLN A 272 -4.320 -10.700 -17.232 1.00 0.00 H new ATOM 711 N ILE A 273 -3.386 -7.206 -10.756 1.00 0.00 N ATOM 712 CA ILE A 273 -2.501 -6.557 -9.797 1.00 0.00 C ATOM 713 C ILE A 273 -1.743 -7.597 -8.978 1.00 0.00 C ATOM 714 O ILE A 273 -0.622 -7.355 -8.532 1.00 0.00 O ATOM 715 CB ILE A 273 -3.292 -5.620 -8.854 1.00 0.00 C ATOM 716 CG1 ILE A 273 -3.618 -4.307 -9.567 1.00 0.00 C ATOM 717 CG2 ILE A 273 -2.517 -5.347 -7.569 1.00 0.00 C ATOM 718 CD1 ILE A 273 -4.738 -3.525 -8.913 1.00 0.00 C ATOM 0 H ILE A 273 -4.339 -6.842 -10.762 1.00 0.00 H new ATOM 0 HA ILE A 273 -1.785 -5.957 -10.359 1.00 0.00 H new ATOM 0 HB ILE A 273 -4.223 -6.119 -8.585 1.00 0.00 H new ATOM 0 HG12 ILE A 273 -2.722 -3.687 -9.597 1.00 0.00 H new ATOM 0 HG13 ILE A 273 -3.891 -4.522 -10.600 1.00 0.00 H new ATOM 0 HG21 ILE A 273 -3.099 -4.686 -6.927 1.00 0.00 H new ATOM 0 HG22 ILE A 273 -2.332 -6.287 -7.049 1.00 0.00 H new ATOM 0 HG23 ILE A 273 -1.566 -4.873 -7.811 1.00 0.00 H new ATOM 0 HD11 ILE A 273 -4.915 -2.606 -9.472 1.00 0.00 H new ATOM 0 HD12 ILE A 273 -5.647 -4.127 -8.907 1.00 0.00 H new ATOM 0 HD13 ILE A 273 -4.460 -3.279 -7.888 1.00 0.00 H new ATOM 730 N SER A 274 -2.363 -8.757 -8.792 1.00 0.00 N ATOM 731 CA SER A 274 -1.747 -9.838 -8.034 1.00 0.00 C ATOM 732 C SER A 274 -0.326 -10.099 -8.525 1.00 0.00 C ATOM 733 O SER A 274 0.502 -10.650 -7.800 1.00 0.00 O ATOM 734 CB SER A 274 -2.585 -11.112 -8.158 1.00 0.00 C ATOM 735 OG SER A 274 -1.989 -12.187 -7.453 1.00 0.00 O ATOM 0 H SER A 274 -3.291 -8.972 -9.156 1.00 0.00 H new ATOM 0 HA SER A 274 -1.702 -9.541 -6.986 1.00 0.00 H new ATOM 0 HB2 SER A 274 -3.587 -10.930 -7.770 1.00 0.00 H new ATOM 0 HB3 SER A 274 -2.693 -11.379 -9.209 1.00 0.00 H new ATOM 0 HG SER A 274 -2.545 -12.988 -7.547 1.00 0.00 H new ATOM 741 N ARG A 275 -0.053 -9.697 -9.763 1.00 0.00 N ATOM 742 CA ARG A 275 1.266 -9.884 -10.356 1.00 0.00 C ATOM 743 C ARG A 275 2.354 -9.281 -9.472 1.00 0.00 C ATOM 744 O ARG A 275 3.241 -9.987 -8.994 1.00 0.00 O ATOM 745 CB ARG A 275 1.316 -9.252 -11.749 1.00 0.00 C ATOM 746 CG ARG A 275 2.596 -9.559 -12.509 1.00 0.00 C ATOM 747 CD ARG A 275 2.867 -11.055 -12.565 1.00 0.00 C ATOM 748 NE ARG A 275 1.739 -11.795 -13.125 1.00 0.00 N ATOM 749 CZ ARG A 275 1.758 -13.105 -13.351 1.00 0.00 C ATOM 750 NH1 ARG A 275 2.841 -13.814 -13.062 1.00 0.00 N ATOM 751 NH2 ARG A 275 0.694 -13.707 -13.864 1.00 0.00 N ATOM 0 H ARG A 275 -0.729 -9.239 -10.375 1.00 0.00 H new ATOM 0 HA ARG A 275 1.448 -10.955 -10.443 1.00 0.00 H new ATOM 0 HB2 ARG A 275 0.464 -9.605 -12.330 1.00 0.00 H new ATOM 0 HB3 ARG A 275 1.210 -8.171 -11.653 1.00 0.00 H new ATOM 0 HG2 ARG A 275 2.522 -9.163 -13.522 1.00 0.00 H new ATOM 0 HG3 ARG A 275 3.435 -9.054 -12.030 1.00 0.00 H new ATOM 0 HD2 ARG A 275 3.757 -11.240 -13.167 1.00 0.00 H new ATOM 0 HD3 ARG A 275 3.079 -11.423 -11.561 1.00 0.00 H new ATOM 0 HE ARG A 275 0.890 -11.278 -13.355 1.00 0.00 H new ATOM 0 HH11 ARG A 275 3.661 -13.354 -12.666 1.00 0.00 H new ATOM 0 HH12 ARG A 275 2.854 -14.819 -13.236 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -0.141 -13.165 -14.086 1.00 0.00 H new ATOM 0 HH22 ARG A 275 0.710 -14.712 -14.037 1.00 0.00 H new ATOM 765 N HIS A 276 2.279 -7.972 -9.259 1.00 0.00 N ATOM 766 CA HIS A 276 3.259 -7.276 -8.433 1.00 0.00 C ATOM 767 C HIS A 276 2.753 -7.115 -7.004 1.00 0.00 C ATOM 768 O HIS A 276 2.715 -6.009 -6.468 1.00 0.00 O ATOM 769 CB HIS A 276 3.579 -5.906 -9.032 1.00 0.00 C ATOM 770 CG HIS A 276 5.030 -5.722 -9.355 1.00 0.00 C ATOM 771 ND1 HIS A 276 5.827 -4.784 -8.734 1.00 0.00 N ATOM 772 CD2 HIS A 276 5.830 -6.368 -10.237 1.00 0.00 C ATOM 773 CE1 HIS A 276 7.053 -4.859 -9.220 1.00 0.00 C ATOM 774 NE2 HIS A 276 7.081 -5.812 -10.133 1.00 0.00 N ATOM 0 H HIS A 276 1.551 -7.372 -9.646 1.00 0.00 H new ATOM 0 HA HIS A 276 4.169 -7.876 -8.409 1.00 0.00 H new ATOM 0 HB2 HIS A 276 2.992 -5.769 -9.940 1.00 0.00 H new ATOM 0 HB3 HIS A 276 3.269 -5.130 -8.332 1.00 0.00 H new ATOM 0 HD2 HIS A 276 5.538 -7.170 -10.898 1.00 0.00 H new ATOM 0 HE1 HIS A 276 7.890 -4.245 -8.921 1.00 0.00 H new ATOM 0 HE2 HIS A 276 7.900 -6.090 -10.674 1.00 0.00 H new ATOM 783 N GLN A 277 2.363 -8.229 -6.392 1.00 0.00 N ATOM 784 CA GLN A 277 1.858 -8.214 -5.024 1.00 0.00 C ATOM 785 C GLN A 277 2.996 -8.043 -4.023 1.00 0.00 C ATOM 786 O GLN A 277 2.913 -7.223 -3.108 1.00 0.00 O ATOM 787 CB GLN A 277 1.094 -9.506 -4.729 1.00 0.00 C ATOM 788 CG GLN A 277 0.683 -9.652 -3.273 1.00 0.00 C ATOM 789 CD GLN A 277 0.846 -11.069 -2.760 1.00 0.00 C ATOM 790 OE1 GLN A 277 1.137 -11.988 -3.524 1.00 0.00 O ATOM 791 NE2 GLN A 277 0.657 -11.252 -1.458 1.00 0.00 N ATOM 0 H GLN A 277 2.387 -9.154 -6.822 1.00 0.00 H new ATOM 0 HA GLN A 277 1.181 -7.366 -4.922 1.00 0.00 H new ATOM 0 HB2 GLN A 277 0.202 -9.542 -5.355 1.00 0.00 H new ATOM 0 HB3 GLN A 277 1.714 -10.357 -5.010 1.00 0.00 H new ATOM 0 HG2 GLN A 277 1.281 -8.977 -2.661 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -0.357 -9.346 -3.161 1.00 0.00 H new ATOM 0 HE21 GLN A 277 0.417 -10.460 -0.861 1.00 0.00 H new ATOM 0 HE22 GLN A 277 0.752 -12.184 -1.055 1.00 0.00 H new ATOM 800 N GLU A 278 4.058 -8.822 -4.203 1.00 0.00 N ATOM 801 CA GLU A 278 5.212 -8.757 -3.315 1.00 0.00 C ATOM 802 C GLU A 278 5.898 -7.398 -3.412 1.00 0.00 C ATOM 803 O GLU A 278 6.118 -6.730 -2.401 1.00 0.00 O ATOM 804 CB GLU A 278 6.208 -9.869 -3.653 1.00 0.00 C ATOM 805 CG GLU A 278 6.496 -10.802 -2.488 1.00 0.00 C ATOM 806 CD GLU A 278 7.352 -10.149 -1.418 1.00 0.00 C ATOM 807 OE1 GLU A 278 7.182 -8.935 -1.183 1.00 0.00 O ATOM 808 OE2 GLU A 278 8.190 -10.853 -0.818 1.00 0.00 O ATOM 0 H GLU A 278 4.143 -9.505 -4.956 1.00 0.00 H new ATOM 0 HA GLU A 278 4.859 -8.894 -2.293 1.00 0.00 H new ATOM 0 HB2 GLU A 278 5.819 -10.452 -4.487 1.00 0.00 H new ATOM 0 HB3 GLU A 278 7.143 -9.419 -3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 278 5.554 -11.128 -2.046 1.00 0.00 H new ATOM 0 HG3 GLU A 278 7.001 -11.695 -2.858 1.00 0.00 H new ATOM 815 N GLN A 279 6.232 -6.993 -4.633 1.00 0.00 N ATOM 816 CA GLN A 279 6.892 -5.712 -4.858 1.00 0.00 C ATOM 817 C GLN A 279 5.989 -4.555 -4.441 1.00 0.00 C ATOM 818 O GLN A 279 6.323 -3.791 -3.536 1.00 0.00 O ATOM 819 CB GLN A 279 7.282 -5.562 -6.329 1.00 0.00 C ATOM 820 CG GLN A 279 8.770 -5.341 -6.544 1.00 0.00 C ATOM 821 CD GLN A 279 9.118 -3.878 -6.746 1.00 0.00 C ATOM 822 OE1 GLN A 279 8.258 -3.003 -6.641 1.00 0.00 O ATOM 823 NE2 GLN A 279 10.384 -3.607 -7.037 1.00 0.00 N ATOM 0 H GLN A 279 6.057 -7.532 -5.481 1.00 0.00 H new ATOM 0 HA GLN A 279 7.794 -5.687 -4.247 1.00 0.00 H new ATOM 0 HB2 GLN A 279 6.974 -6.456 -6.871 1.00 0.00 H new ATOM 0 HB3 GLN A 279 6.733 -4.724 -6.758 1.00 0.00 H new ATOM 0 HG2 GLN A 279 9.319 -5.726 -5.685 1.00 0.00 H new ATOM 0 HG3 GLN A 279 9.097 -5.912 -7.413 1.00 0.00 H new ATOM 0 HE21 GLN A 279 11.063 -4.364 -7.114 1.00 0.00 H new ATOM 0 HE22 GLN A 279 10.678 -2.641 -7.184 1.00 0.00 H new ATOM 832 N PHE A 280 4.845 -4.431 -5.106 1.00 0.00 N ATOM 833 CA PHE A 280 3.898 -3.365 -4.800 1.00 0.00 C ATOM 834 C PHE A 280 3.818 -3.137 -3.295 1.00 0.00 C ATOM 835 O PHE A 280 4.012 -2.020 -2.814 1.00 0.00 O ATOM 836 CB PHE A 280 2.514 -3.703 -5.354 1.00 0.00 C ATOM 837 CG PHE A 280 1.496 -2.624 -5.116 1.00 0.00 C ATOM 838 CD1 PHE A 280 0.851 -2.520 -3.895 1.00 0.00 C ATOM 839 CD2 PHE A 280 1.187 -1.713 -6.113 1.00 0.00 C ATOM 840 CE1 PHE A 280 -0.085 -1.528 -3.672 1.00 0.00 C ATOM 841 CE2 PHE A 280 0.252 -0.718 -5.896 1.00 0.00 C ATOM 842 CZ PHE A 280 -0.385 -0.626 -4.673 1.00 0.00 C ATOM 0 H PHE A 280 4.552 -5.054 -5.859 1.00 0.00 H new ATOM 0 HA PHE A 280 4.250 -2.449 -5.274 1.00 0.00 H new ATOM 0 HB2 PHE A 280 2.595 -3.886 -6.425 1.00 0.00 H new ATOM 0 HB3 PHE A 280 2.164 -4.629 -4.898 1.00 0.00 H new ATOM 0 HD1 PHE A 280 1.082 -3.222 -3.108 1.00 0.00 H new ATOM 0 HD2 PHE A 280 1.682 -1.781 -7.070 1.00 0.00 H new ATOM 0 HE1 PHE A 280 -0.581 -1.459 -2.715 1.00 0.00 H new ATOM 0 HE2 PHE A 280 0.020 -0.014 -6.681 1.00 0.00 H new ATOM 0 HZ PHE A 280 -1.116 0.150 -4.501 1.00 0.00 H new ATOM 852 N ILE A 281 3.539 -4.204 -2.553 1.00 0.00 N ATOM 853 CA ILE A 281 3.445 -4.116 -1.104 1.00 0.00 C ATOM 854 C ILE A 281 4.814 -3.842 -0.498 1.00 0.00 C ATOM 855 O ILE A 281 4.926 -3.192 0.543 1.00 0.00 O ATOM 856 CB ILE A 281 2.870 -5.407 -0.490 1.00 0.00 C ATOM 857 CG1 ILE A 281 1.612 -5.841 -1.244 1.00 0.00 C ATOM 858 CG2 ILE A 281 2.565 -5.197 0.985 1.00 0.00 C ATOM 859 CD1 ILE A 281 1.273 -7.304 -1.058 1.00 0.00 C ATOM 0 H ILE A 281 3.375 -5.137 -2.932 1.00 0.00 H new ATOM 0 HA ILE A 281 2.768 -3.293 -0.875 1.00 0.00 H new ATOM 0 HB ILE A 281 3.614 -6.199 -0.580 1.00 0.00 H new ATOM 0 HG12 ILE A 281 0.770 -5.235 -0.909 1.00 0.00 H new ATOM 0 HG13 ILE A 281 1.747 -5.639 -2.307 1.00 0.00 H new ATOM 0 HG21 ILE A 281 2.159 -6.116 1.407 1.00 0.00 H new ATOM 0 HG22 ILE A 281 3.481 -4.929 1.511 1.00 0.00 H new ATOM 0 HG23 ILE A 281 1.836 -4.395 1.095 1.00 0.00 H new ATOM 0 HD11 ILE A 281 0.370 -7.543 -1.620 1.00 0.00 H new ATOM 0 HD12 ILE A 281 2.098 -7.918 -1.419 1.00 0.00 H new ATOM 0 HD13 ILE A 281 1.106 -7.507 -0.000 1.00 0.00 H new ATOM 871 N GLN A 282 5.855 -4.333 -1.162 1.00 0.00 N ATOM 872 CA GLN A 282 7.219 -4.130 -0.694 1.00 0.00 C ATOM 873 C GLN A 282 7.461 -2.653 -0.407 1.00 0.00 C ATOM 874 O GLN A 282 8.048 -2.294 0.614 1.00 0.00 O ATOM 875 CB GLN A 282 8.223 -4.632 -1.735 1.00 0.00 C ATOM 876 CG GLN A 282 9.487 -5.218 -1.127 1.00 0.00 C ATOM 877 CD GLN A 282 10.739 -4.804 -1.874 1.00 0.00 C ATOM 878 OE1 GLN A 282 11.511 -5.647 -2.330 1.00 0.00 O ATOM 879 NE2 GLN A 282 10.947 -3.498 -2.002 1.00 0.00 N ATOM 0 H GLN A 282 5.779 -4.873 -2.024 1.00 0.00 H new ATOM 0 HA GLN A 282 7.357 -4.698 0.226 1.00 0.00 H new ATOM 0 HB2 GLN A 282 7.743 -5.389 -2.355 1.00 0.00 H new ATOM 0 HB3 GLN A 282 8.495 -3.807 -2.393 1.00 0.00 H new ATOM 0 HG2 GLN A 282 9.567 -4.900 -0.087 1.00 0.00 H new ATOM 0 HG3 GLN A 282 9.414 -6.306 -1.123 1.00 0.00 H new ATOM 0 HE21 GLN A 282 10.280 -2.834 -1.608 1.00 0.00 H new ATOM 0 HE22 GLN A 282 11.773 -3.159 -2.494 1.00 0.00 H new ATOM 888 N MET A 283 6.988 -1.802 -1.312 1.00 0.00 N ATOM 889 CA MET A 283 7.135 -0.362 -1.156 1.00 0.00 C ATOM 890 C MET A 283 6.128 0.167 -0.141 1.00 0.00 C ATOM 891 O MET A 283 6.482 0.919 0.767 1.00 0.00 O ATOM 892 CB MET A 283 6.942 0.341 -2.500 1.00 0.00 C ATOM 893 CG MET A 283 8.242 0.613 -3.240 1.00 0.00 C ATOM 894 SD MET A 283 9.404 -0.762 -3.131 1.00 0.00 S ATOM 895 CE MET A 283 10.366 -0.510 -4.619 1.00 0.00 C ATOM 0 H MET A 283 6.500 -2.086 -2.161 1.00 0.00 H new ATOM 0 HA MET A 283 8.142 -0.155 -0.793 1.00 0.00 H new ATOM 0 HB2 MET A 283 6.297 -0.271 -3.130 1.00 0.00 H new ATOM 0 HB3 MET A 283 6.424 1.286 -2.335 1.00 0.00 H new ATOM 0 HG2 MET A 283 8.023 0.816 -4.288 1.00 0.00 H new ATOM 0 HG3 MET A 283 8.707 1.510 -2.832 1.00 0.00 H new ATOM 0 HE1 MET A 283 11.130 -1.284 -4.694 1.00 0.00 H new ATOM 0 HE2 MET A 283 9.711 -0.561 -5.489 1.00 0.00 H new ATOM 0 HE3 MET A 283 10.844 0.469 -4.582 1.00 0.00 H new ATOM 905 N LEU A 284 4.871 -0.241 -0.297 1.00 0.00 N ATOM 906 CA LEU A 284 3.815 0.182 0.612 1.00 0.00 C ATOM 907 C LEU A 284 4.322 0.170 2.048 1.00 0.00 C ATOM 908 O LEU A 284 4.060 1.093 2.820 1.00 0.00 O ATOM 909 CB LEU A 284 2.597 -0.735 0.479 1.00 0.00 C ATOM 910 CG LEU A 284 1.262 -0.107 0.883 1.00 0.00 C ATOM 911 CD1 LEU A 284 1.358 0.499 2.273 1.00 0.00 C ATOM 912 CD2 LEU A 284 0.839 0.945 -0.131 1.00 0.00 C ATOM 0 H LEU A 284 4.562 -0.863 -1.044 1.00 0.00 H new ATOM 0 HA LEU A 284 3.518 1.198 0.350 1.00 0.00 H new ATOM 0 HB2 LEU A 284 2.525 -1.069 -0.556 1.00 0.00 H new ATOM 0 HB3 LEU A 284 2.762 -1.623 1.089 1.00 0.00 H new ATOM 0 HG LEU A 284 0.504 -0.890 0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 284 0.399 0.941 2.544 1.00 0.00 H new ATOM 0 HD12 LEU A 284 1.615 -0.279 2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 284 2.129 1.270 2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 284 -0.113 1.381 0.173 1.00 0.00 H new ATOM 0 HD22 LEU A 284 1.597 1.727 -0.182 1.00 0.00 H new ATOM 0 HD23 LEU A 284 0.730 0.482 -1.112 1.00 0.00 H new ATOM 924 N ASN A 285 5.061 -0.880 2.391 1.00 0.00 N ATOM 925 CA ASN A 285 5.622 -1.016 3.728 1.00 0.00 C ATOM 926 C ASN A 285 7.000 -0.368 3.792 1.00 0.00 C ATOM 927 O ASN A 285 7.920 -0.907 4.407 1.00 0.00 O ATOM 928 CB ASN A 285 5.718 -2.491 4.118 1.00 0.00 C ATOM 929 CG ASN A 285 6.763 -3.237 3.311 1.00 0.00 C ATOM 930 OD1 ASN A 285 6.486 -3.727 2.216 1.00 0.00 O ATOM 931 ND2 ASN A 285 7.973 -3.329 3.851 1.00 0.00 N ATOM 0 H ASN A 285 5.285 -1.649 1.760 1.00 0.00 H new ATOM 0 HA ASN A 285 4.962 -0.510 4.432 1.00 0.00 H new ATOM 0 HB2 ASN A 285 5.959 -2.568 5.178 1.00 0.00 H new ATOM 0 HB3 ASN A 285 4.747 -2.965 3.976 1.00 0.00 H new ATOM 0 HD21 ASN A 285 8.717 -3.821 3.355 1.00 0.00 H new ATOM 0 HD22 ASN A 285 8.159 -2.908 4.761 1.00 0.00 H new ATOM 938 N GLU A 286 7.129 0.790 3.143 1.00 0.00 N ATOM 939 CA GLU A 286 8.389 1.529 3.110 1.00 0.00 C ATOM 940 C GLU A 286 9.212 1.281 4.370 1.00 0.00 C ATOM 941 O GLU A 286 8.665 1.038 5.446 1.00 0.00 O ATOM 942 CB GLU A 286 8.118 3.028 2.955 1.00 0.00 C ATOM 943 CG GLU A 286 7.567 3.679 4.213 1.00 0.00 C ATOM 944 CD GLU A 286 6.245 3.077 4.648 1.00 0.00 C ATOM 945 OE1 GLU A 286 5.226 3.329 3.972 1.00 0.00 O ATOM 946 OE2 GLU A 286 6.230 2.352 5.666 1.00 0.00 O ATOM 0 H GLU A 286 6.370 1.238 2.630 1.00 0.00 H new ATOM 0 HA GLU A 286 8.962 1.173 2.254 1.00 0.00 H new ATOM 0 HB2 GLU A 286 9.044 3.529 2.672 1.00 0.00 H new ATOM 0 HB3 GLU A 286 7.412 3.179 2.139 1.00 0.00 H new ATOM 0 HG2 GLU A 286 8.293 3.575 5.020 1.00 0.00 H new ATOM 0 HG3 GLU A 286 7.436 4.747 4.038 1.00 0.00 H new