USER MOD reduce.3.24.130724 H: found=0, std=0, add=488, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 489 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 276 HIS : no HD1:sc= -13.4! C(o=-14!,f=-11!) USER MOD Set 1.2: A 279 GLN : amide:sc= -0.361 K(o=-14,f=-20!) USER MOD Set 2.1: A 274 SER OG : rot 30:sc= 0.52 USER MOD Set 2.2: A 277 GLN : amide:sc= 0.506 K(o=1,f=-0.18) USER MOD Set 3.1: A 268 GLN : amide:sc= -0.399 K(o=-0.66,f=0.57) USER MOD Set 3.2: A 271 GLN : amide:sc= -0.259 K(o=-0.66,f=0.57) USER MOD Set 4.1: A 246 GLN : amide:sc= -1.17 X(o=-1.2,f=-1) USER MOD Set 4.2: A 250 GLN : amide:sc= -0.0167 X(o=-1.2,f=-1) USER MOD Single : A 230 ASN : amide:sc= -7.35! C(o=-7.3!,f=-4.1!) USER MOD Single : A 238 GLN : amide:sc= -0.616 X(o=-0.62,f=-0.17) USER MOD Single : A 240 GLN : amide:sc= -0.803 K(o=-0.8,f=-0.25) USER MOD Single : A 242 GLN : amide:sc= -0.0125 X(o=-0.012,f=-0.16) USER MOD Single : A 243 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 244 MET CE :methyl -178:sc= -3.8! (180deg=-3.84!) USER MOD Single : A 249 GLN : amide:sc= -4.71! C(o=-4.7!,f=-13!) USER MOD Single : A 251 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 260 GLN : amide:sc= -2.16 K(o=-2.2,f=-5.6!) USER MOD Single : A 261 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 264 GLN : amide:sc= -3.66! C(o=-3.7!,f=-4.9!) USER MOD Single : A 266 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 272 GLN : amide:sc= -2.02 K(o=-2,f=-4.9!) USER MOD Single : A 282 GLN : amide:sc= -0.8 K(o=-0.8,f=-4.5!) USER MOD Single : A 283 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 285 ASN : amide:sc= 0.444 X(o=0.44,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 230 -1.393 -6.968 -17.890 1.00 0.00 N ATOM 2 CA ASN A 230 -1.793 -6.558 -16.519 1.00 0.00 C ATOM 3 C ASN A 230 -1.811 -5.040 -16.379 1.00 0.00 C ATOM 4 O ASN A 230 -1.074 -4.332 -17.065 1.00 0.00 O ATOM 5 CB ASN A 230 -0.805 -7.166 -15.520 1.00 0.00 C ATOM 6 CG ASN A 230 -0.867 -8.679 -15.496 1.00 0.00 C ATOM 7 OD1 ASN A 230 -0.764 -9.334 -16.534 1.00 0.00 O ATOM 8 ND2 ASN A 230 -1.036 -9.246 -14.307 1.00 0.00 N ATOM 0 HA ASN A 230 -2.802 -6.919 -16.320 1.00 0.00 H new ATOM 0 HB2 ASN A 230 0.207 -6.850 -15.775 1.00 0.00 H new ATOM 0 HB3 ASN A 230 -1.017 -6.780 -14.523 1.00 0.00 H new ATOM 0 HD21 ASN A 230 -1.085 -10.262 -14.229 1.00 0.00 H new ATOM 0 HD22 ASN A 230 -1.117 -8.666 -13.472 1.00 0.00 H new ATOM 15 N PRO A 231 -2.660 -4.522 -15.479 1.00 0.00 N ATOM 16 CA PRO A 231 -2.783 -3.088 -15.236 1.00 0.00 C ATOM 17 C PRO A 231 -1.745 -2.582 -14.241 1.00 0.00 C ATOM 18 O PRO A 231 -1.904 -1.514 -13.650 1.00 0.00 O ATOM 19 CB PRO A 231 -4.185 -2.973 -14.649 1.00 0.00 C ATOM 20 CG PRO A 231 -4.376 -4.248 -13.898 1.00 0.00 C ATOM 21 CD PRO A 231 -3.570 -5.301 -14.621 1.00 0.00 C ATOM 0 HA PRO A 231 -2.623 -2.494 -16.136 1.00 0.00 H new ATOM 0 HB2 PRO A 231 -4.271 -2.108 -13.992 1.00 0.00 H new ATOM 0 HB3 PRO A 231 -4.935 -2.856 -15.431 1.00 0.00 H new ATOM 0 HG2 PRO A 231 -4.040 -4.144 -12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 231 -5.430 -4.523 -13.864 1.00 0.00 H new ATOM 0 HD2 PRO A 231 -3.019 -5.932 -13.923 1.00 0.00 H new ATOM 0 HD3 PRO A 231 -4.209 -5.959 -15.210 1.00 0.00 H new ATOM 29 N LEU A 232 -0.682 -3.358 -14.060 1.00 0.00 N ATOM 30 CA LEU A 232 0.383 -2.994 -13.137 1.00 0.00 C ATOM 31 C LEU A 232 1.534 -2.323 -13.877 1.00 0.00 C ATOM 32 O LEU A 232 2.289 -1.543 -13.297 1.00 0.00 O ATOM 33 CB LEU A 232 0.890 -4.233 -12.395 1.00 0.00 C ATOM 34 CG LEU A 232 0.747 -4.178 -10.874 1.00 0.00 C ATOM 35 CD1 LEU A 232 1.903 -3.403 -10.257 1.00 0.00 C ATOM 36 CD2 LEU A 232 -0.584 -3.552 -10.485 1.00 0.00 C ATOM 0 H LEU A 232 -0.536 -4.245 -14.542 1.00 0.00 H new ATOM 0 HA LEU A 232 -0.022 -2.287 -12.413 1.00 0.00 H new ATOM 0 HB2 LEU A 232 0.351 -5.105 -12.764 1.00 0.00 H new ATOM 0 HB3 LEU A 232 1.942 -4.381 -12.641 1.00 0.00 H new ATOM 0 HG LEU A 232 0.772 -5.197 -10.489 1.00 0.00 H new ATOM 0 HD11 LEU A 232 1.785 -3.374 -9.174 1.00 0.00 H new ATOM 0 HD12 LEU A 232 2.844 -3.893 -10.506 1.00 0.00 H new ATOM 0 HD13 LEU A 232 1.909 -2.386 -10.649 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -0.668 -3.521 -9.399 1.00 0.00 H new ATOM 0 HD22 LEU A 232 -0.639 -2.538 -10.882 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -1.400 -4.147 -10.895 1.00 0.00 H new ATOM 48 N GLU A 233 1.659 -2.632 -15.163 1.00 0.00 N ATOM 49 CA GLU A 233 2.716 -2.060 -15.987 1.00 0.00 C ATOM 50 C GLU A 233 2.881 -0.572 -15.700 1.00 0.00 C ATOM 51 O GLU A 233 3.968 -0.113 -15.347 1.00 0.00 O ATOM 52 CB GLU A 233 2.410 -2.277 -17.469 1.00 0.00 C ATOM 53 CG GLU A 233 2.218 -3.738 -17.842 1.00 0.00 C ATOM 54 CD GLU A 233 3.483 -4.554 -17.664 1.00 0.00 C ATOM 55 OE1 GLU A 233 4.312 -4.576 -18.598 1.00 0.00 O ATOM 56 OE2 GLU A 233 3.646 -5.171 -16.590 1.00 0.00 O ATOM 0 H GLU A 233 1.041 -3.276 -15.657 1.00 0.00 H new ATOM 0 HA GLU A 233 3.650 -2.565 -15.740 1.00 0.00 H new ATOM 0 HB2 GLU A 233 1.509 -1.722 -17.731 1.00 0.00 H new ATOM 0 HB3 GLU A 233 3.224 -1.862 -18.064 1.00 0.00 H new ATOM 0 HG2 GLU A 233 1.425 -4.165 -17.228 1.00 0.00 H new ATOM 0 HG3 GLU A 233 1.890 -3.805 -18.879 1.00 0.00 H new ATOM 63 N PHE A 234 1.795 0.180 -15.851 1.00 0.00 N ATOM 64 CA PHE A 234 1.829 1.618 -15.604 1.00 0.00 C ATOM 65 C PHE A 234 1.965 1.904 -14.112 1.00 0.00 C ATOM 66 O PHE A 234 2.653 2.843 -13.711 1.00 0.00 O ATOM 67 CB PHE A 234 0.583 2.305 -16.169 1.00 0.00 C ATOM 68 CG PHE A 234 -0.692 1.579 -15.873 1.00 0.00 C ATOM 69 CD1 PHE A 234 -1.132 0.561 -16.702 1.00 0.00 C ATOM 70 CD2 PHE A 234 -1.450 1.914 -14.765 1.00 0.00 C ATOM 71 CE1 PHE A 234 -2.306 -0.109 -16.431 1.00 0.00 C ATOM 72 CE2 PHE A 234 -2.625 1.247 -14.488 1.00 0.00 C ATOM 73 CZ PHE A 234 -3.052 0.234 -15.322 1.00 0.00 C ATOM 0 H PHE A 234 0.886 -0.179 -16.141 1.00 0.00 H new ATOM 0 HA PHE A 234 2.701 2.025 -16.117 1.00 0.00 H new ATOM 0 HB2 PHE A 234 0.519 3.314 -15.761 1.00 0.00 H new ATOM 0 HB3 PHE A 234 0.692 2.404 -17.249 1.00 0.00 H new ATOM 0 HD1 PHE A 234 -0.550 0.289 -17.570 1.00 0.00 H new ATOM 0 HD2 PHE A 234 -1.118 2.706 -14.110 1.00 0.00 H new ATOM 0 HE1 PHE A 234 -2.641 -0.900 -17.085 1.00 0.00 H new ATOM 0 HE2 PHE A 234 -3.209 1.517 -13.621 1.00 0.00 H new ATOM 0 HZ PHE A 234 -3.971 -0.291 -15.107 1.00 0.00 H new ATOM 83 N LEU A 235 1.319 1.080 -13.293 1.00 0.00 N ATOM 84 CA LEU A 235 1.386 1.239 -11.843 1.00 0.00 C ATOM 85 C LEU A 235 2.820 1.058 -11.360 1.00 0.00 C ATOM 86 O LEU A 235 3.295 1.790 -10.492 1.00 0.00 O ATOM 87 CB LEU A 235 0.474 0.224 -11.150 1.00 0.00 C ATOM 88 CG LEU A 235 -0.870 0.772 -10.667 1.00 0.00 C ATOM 89 CD1 LEU A 235 -1.410 1.800 -11.646 1.00 0.00 C ATOM 90 CD2 LEU A 235 -1.867 -0.362 -10.479 1.00 0.00 C ATOM 0 H LEU A 235 0.745 0.298 -13.607 1.00 0.00 H new ATOM 0 HA LEU A 235 1.048 2.244 -11.591 1.00 0.00 H new ATOM 0 HB2 LEU A 235 0.285 -0.599 -11.839 1.00 0.00 H new ATOM 0 HB3 LEU A 235 1.006 -0.192 -10.295 1.00 0.00 H new ATOM 0 HG LEU A 235 -0.718 1.262 -9.705 1.00 0.00 H new ATOM 0 HD11 LEU A 235 -2.367 2.178 -11.285 1.00 0.00 H new ATOM 0 HD12 LEU A 235 -0.703 2.625 -11.734 1.00 0.00 H new ATOM 0 HD13 LEU A 235 -1.548 1.335 -12.622 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -2.819 0.043 -10.135 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -2.014 -0.878 -11.428 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -1.483 -1.065 -9.739 1.00 0.00 H new ATOM 102 N ARG A 236 3.506 0.075 -11.937 1.00 0.00 N ATOM 103 CA ARG A 236 4.889 -0.211 -11.579 1.00 0.00 C ATOM 104 C ARG A 236 5.805 0.911 -12.047 1.00 0.00 C ATOM 105 O ARG A 236 6.783 1.250 -11.380 1.00 0.00 O ATOM 106 CB ARG A 236 5.334 -1.537 -12.201 1.00 0.00 C ATOM 107 CG ARG A 236 5.330 -2.701 -11.224 1.00 0.00 C ATOM 108 CD ARG A 236 5.396 -4.036 -11.947 1.00 0.00 C ATOM 109 NE ARG A 236 6.768 -4.516 -12.087 1.00 0.00 N ATOM 110 CZ ARG A 236 7.167 -5.336 -13.053 1.00 0.00 C ATOM 111 NH1 ARG A 236 6.300 -5.767 -13.959 1.00 0.00 N ATOM 112 NH2 ARG A 236 8.433 -5.727 -13.114 1.00 0.00 N ATOM 0 H ARG A 236 3.123 -0.538 -12.657 1.00 0.00 H new ATOM 0 HA ARG A 236 4.953 -0.287 -10.494 1.00 0.00 H new ATOM 0 HB2 ARG A 236 4.677 -1.774 -13.038 1.00 0.00 H new ATOM 0 HB3 ARG A 236 6.338 -1.419 -12.608 1.00 0.00 H new ATOM 0 HG2 ARG A 236 6.179 -2.611 -10.546 1.00 0.00 H new ATOM 0 HG3 ARG A 236 4.428 -2.661 -10.613 1.00 0.00 H new ATOM 0 HD2 ARG A 236 4.808 -4.773 -11.401 1.00 0.00 H new ATOM 0 HD3 ARG A 236 4.944 -3.936 -12.934 1.00 0.00 H new ATOM 0 HE ARG A 236 7.459 -4.204 -11.405 1.00 0.00 H new ATOM 0 HH11 ARG A 236 5.326 -5.469 -13.915 1.00 0.00 H new ATOM 0 HH12 ARG A 236 6.608 -6.397 -14.700 1.00 0.00 H new ATOM 0 HH21 ARG A 236 9.102 -5.398 -12.418 1.00 0.00 H new ATOM 0 HH22 ARG A 236 8.737 -6.357 -13.857 1.00 0.00 H new ATOM 126 N ASP A 237 5.478 1.486 -13.200 1.00 0.00 N ATOM 127 CA ASP A 237 6.267 2.574 -13.763 1.00 0.00 C ATOM 128 C ASP A 237 6.092 3.845 -12.940 1.00 0.00 C ATOM 129 O ASP A 237 7.034 4.615 -12.758 1.00 0.00 O ATOM 130 CB ASP A 237 5.859 2.831 -15.214 1.00 0.00 C ATOM 131 CG ASP A 237 6.887 3.649 -15.969 1.00 0.00 C ATOM 132 OD1 ASP A 237 7.966 3.917 -15.400 1.00 0.00 O ATOM 133 OD2 ASP A 237 6.614 4.023 -17.129 1.00 0.00 O ATOM 0 H ASP A 237 4.671 1.216 -13.762 1.00 0.00 H new ATOM 0 HA ASP A 237 7.317 2.284 -13.737 1.00 0.00 H new ATOM 0 HB2 ASP A 237 5.714 1.877 -15.722 1.00 0.00 H new ATOM 0 HB3 ASP A 237 4.901 3.351 -15.232 1.00 0.00 H new ATOM 138 N GLN A 238 4.877 4.055 -12.444 1.00 0.00 N ATOM 139 CA GLN A 238 4.572 5.231 -11.637 1.00 0.00 C ATOM 140 C GLN A 238 5.080 5.056 -10.210 1.00 0.00 C ATOM 141 O GLN A 238 5.383 3.943 -9.779 1.00 0.00 O ATOM 142 CB GLN A 238 3.065 5.491 -11.626 1.00 0.00 C ATOM 143 CG GLN A 238 2.606 6.459 -12.705 1.00 0.00 C ATOM 144 CD GLN A 238 1.450 5.916 -13.521 1.00 0.00 C ATOM 145 OE1 GLN A 238 1.345 6.175 -14.720 1.00 0.00 O ATOM 146 NE2 GLN A 238 0.574 5.155 -12.874 1.00 0.00 N ATOM 0 H GLN A 238 4.087 3.426 -12.587 1.00 0.00 H new ATOM 0 HA GLN A 238 5.078 6.088 -12.082 1.00 0.00 H new ATOM 0 HB2 GLN A 238 2.541 4.544 -11.752 1.00 0.00 H new ATOM 0 HB3 GLN A 238 2.780 5.885 -10.651 1.00 0.00 H new ATOM 0 HG2 GLN A 238 2.309 7.400 -12.242 1.00 0.00 H new ATOM 0 HG3 GLN A 238 3.442 6.681 -13.369 1.00 0.00 H new ATOM 0 HE21 GLN A 238 0.699 4.966 -11.880 1.00 0.00 H new ATOM 0 HE22 GLN A 238 -0.224 4.760 -13.372 1.00 0.00 H new ATOM 155 N PRO A 239 5.177 6.162 -9.457 1.00 0.00 N ATOM 156 CA PRO A 239 5.648 6.142 -8.073 1.00 0.00 C ATOM 157 C PRO A 239 4.551 5.746 -7.089 1.00 0.00 C ATOM 158 O PRO A 239 4.682 5.956 -5.883 1.00 0.00 O ATOM 159 CB PRO A 239 6.075 7.589 -7.844 1.00 0.00 C ATOM 160 CG PRO A 239 5.158 8.387 -8.708 1.00 0.00 C ATOM 161 CD PRO A 239 4.836 7.526 -9.904 1.00 0.00 C ATOM 0 HA PRO A 239 6.441 5.411 -7.915 1.00 0.00 H new ATOM 0 HB2 PRO A 239 5.979 7.871 -6.795 1.00 0.00 H new ATOM 0 HB3 PRO A 239 7.118 7.744 -8.121 1.00 0.00 H new ATOM 0 HG2 PRO A 239 4.250 8.654 -8.167 1.00 0.00 H new ATOM 0 HG3 PRO A 239 5.630 9.319 -9.017 1.00 0.00 H new ATOM 0 HD2 PRO A 239 3.785 7.605 -10.182 1.00 0.00 H new ATOM 0 HD3 PRO A 239 5.420 7.819 -10.777 1.00 0.00 H new ATOM 169 N GLN A 240 3.469 5.176 -7.611 1.00 0.00 N ATOM 170 CA GLN A 240 2.349 4.755 -6.777 1.00 0.00 C ATOM 171 C GLN A 240 2.842 4.079 -5.501 1.00 0.00 C ATOM 172 O GLN A 240 2.429 4.437 -4.400 1.00 0.00 O ATOM 173 CB GLN A 240 1.438 3.803 -7.556 1.00 0.00 C ATOM 174 CG GLN A 240 -0.006 3.821 -7.082 1.00 0.00 C ATOM 175 CD GLN A 240 -0.958 4.353 -8.134 1.00 0.00 C ATOM 176 OE1 GLN A 240 -1.880 5.109 -7.828 1.00 0.00 O ATOM 177 NE2 GLN A 240 -0.740 3.960 -9.384 1.00 0.00 N ATOM 0 H GLN A 240 3.344 4.995 -8.607 1.00 0.00 H new ATOM 0 HA GLN A 240 1.782 5.643 -6.497 1.00 0.00 H new ATOM 0 HB2 GLN A 240 1.468 4.068 -8.613 1.00 0.00 H new ATOM 0 HB3 GLN A 240 1.828 2.789 -7.470 1.00 0.00 H new ATOM 0 HG2 GLN A 240 -0.306 2.811 -6.804 1.00 0.00 H new ATOM 0 HG3 GLN A 240 -0.082 4.435 -6.184 1.00 0.00 H new ATOM 0 HE21 GLN A 240 0.036 3.332 -9.593 1.00 0.00 H new ATOM 0 HE22 GLN A 240 -1.349 4.286 -10.135 1.00 0.00 H new ATOM 186 N PHE A 241 3.726 3.099 -5.656 1.00 0.00 N ATOM 187 CA PHE A 241 4.271 2.378 -4.508 1.00 0.00 C ATOM 188 C PHE A 241 4.888 3.344 -3.503 1.00 0.00 C ATOM 189 O PHE A 241 4.610 3.274 -2.306 1.00 0.00 O ATOM 190 CB PHE A 241 5.318 1.354 -4.953 1.00 0.00 C ATOM 191 CG PHE A 241 6.001 1.707 -6.242 1.00 0.00 C ATOM 192 CD1 PHE A 241 7.156 2.473 -6.243 1.00 0.00 C ATOM 193 CD2 PHE A 241 5.487 1.274 -7.452 1.00 0.00 C ATOM 194 CE1 PHE A 241 7.784 2.799 -7.428 1.00 0.00 C ATOM 195 CE2 PHE A 241 6.110 1.597 -8.640 1.00 0.00 C ATOM 196 CZ PHE A 241 7.260 2.361 -8.628 1.00 0.00 C ATOM 0 H PHE A 241 4.080 2.786 -6.560 1.00 0.00 H new ATOM 0 HA PHE A 241 3.447 1.851 -4.028 1.00 0.00 H new ATOM 0 HB2 PHE A 241 6.070 1.253 -4.170 1.00 0.00 H new ATOM 0 HB3 PHE A 241 4.838 0.381 -5.061 1.00 0.00 H new ATOM 0 HD1 PHE A 241 7.569 2.818 -5.307 1.00 0.00 H new ATOM 0 HD2 PHE A 241 4.588 0.676 -7.466 1.00 0.00 H new ATOM 0 HE1 PHE A 241 8.684 3.396 -7.417 1.00 0.00 H new ATOM 0 HE2 PHE A 241 5.699 1.253 -9.578 1.00 0.00 H new ATOM 0 HZ PHE A 241 7.749 2.616 -9.556 1.00 0.00 H new ATOM 206 N GLN A 242 5.730 4.247 -3.998 1.00 0.00 N ATOM 207 CA GLN A 242 6.392 5.228 -3.145 1.00 0.00 C ATOM 208 C GLN A 242 5.399 6.266 -2.630 1.00 0.00 C ATOM 209 O GLN A 242 5.262 6.462 -1.422 1.00 0.00 O ATOM 210 CB GLN A 242 7.518 5.921 -3.915 1.00 0.00 C ATOM 211 CG GLN A 242 8.312 6.908 -3.075 1.00 0.00 C ATOM 212 CD GLN A 242 8.889 8.043 -3.900 1.00 0.00 C ATOM 213 OE1 GLN A 242 8.170 8.719 -4.635 1.00 0.00 O ATOM 214 NE2 GLN A 242 10.194 8.255 -3.782 1.00 0.00 N ATOM 0 H GLN A 242 5.970 4.319 -4.987 1.00 0.00 H new ATOM 0 HA GLN A 242 6.813 4.702 -2.288 1.00 0.00 H new ATOM 0 HB2 GLN A 242 8.196 5.164 -4.309 1.00 0.00 H new ATOM 0 HB3 GLN A 242 7.093 6.445 -4.771 1.00 0.00 H new ATOM 0 HG2 GLN A 242 7.668 7.319 -2.298 1.00 0.00 H new ATOM 0 HG3 GLN A 242 9.122 6.381 -2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 242 10.752 7.669 -3.160 1.00 0.00 H new ATOM 0 HE22 GLN A 242 10.639 9.003 -4.313 1.00 0.00 H new ATOM 223 N ASN A 243 4.711 6.931 -3.551 1.00 0.00 N ATOM 224 CA ASN A 243 3.734 7.950 -3.185 1.00 0.00 C ATOM 225 C ASN A 243 2.748 7.411 -2.153 1.00 0.00 C ATOM 226 O ASN A 243 2.568 7.998 -1.086 1.00 0.00 O ATOM 227 CB ASN A 243 2.980 8.435 -4.424 1.00 0.00 C ATOM 228 CG ASN A 243 1.982 9.531 -4.102 1.00 0.00 C ATOM 229 OD1 ASN A 243 2.325 10.533 -3.475 1.00 0.00 O ATOM 230 ND2 ASN A 243 0.739 9.345 -4.532 1.00 0.00 N ATOM 0 H ASN A 243 4.811 6.783 -4.555 1.00 0.00 H new ATOM 0 HA ASN A 243 4.271 8.790 -2.745 1.00 0.00 H new ATOM 0 HB2 ASN A 243 3.695 8.803 -5.160 1.00 0.00 H new ATOM 0 HB3 ASN A 243 2.457 7.594 -4.880 1.00 0.00 H new ATOM 0 HD21 ASN A 243 0.024 10.049 -4.346 1.00 0.00 H new ATOM 0 HD22 ASN A 243 0.499 8.499 -5.048 1.00 0.00 H new ATOM 237 N MET A 244 2.112 6.291 -2.481 1.00 0.00 N ATOM 238 CA MET A 244 1.144 5.673 -1.581 1.00 0.00 C ATOM 239 C MET A 244 1.773 5.386 -0.225 1.00 0.00 C ATOM 240 O MET A 244 1.415 5.997 0.780 1.00 0.00 O ATOM 241 CB MET A 244 0.614 4.371 -2.183 1.00 0.00 C ATOM 242 CG MET A 244 -0.162 4.567 -3.472 1.00 0.00 C ATOM 243 SD MET A 244 -0.647 3.006 -4.233 1.00 0.00 S ATOM 244 CE MET A 244 -0.748 1.946 -2.793 1.00 0.00 C ATOM 0 H MET A 244 2.249 5.794 -3.361 1.00 0.00 H new ATOM 0 HA MET A 244 0.318 6.371 -1.446 1.00 0.00 H new ATOM 0 HB2 MET A 244 1.452 3.701 -2.372 1.00 0.00 H new ATOM 0 HB3 MET A 244 -0.029 3.879 -1.453 1.00 0.00 H new ATOM 0 HG2 MET A 244 -1.053 5.160 -3.269 1.00 0.00 H new ATOM 0 HG3 MET A 244 0.446 5.136 -4.175 1.00 0.00 H new ATOM 0 HE1 MET A 244 -1.004 0.933 -3.104 1.00 0.00 H new ATOM 0 HE2 MET A 244 0.214 1.936 -2.280 1.00 0.00 H new ATOM 0 HE3 MET A 244 -1.515 2.323 -2.117 1.00 0.00 H new ATOM 254 N ARG A 245 2.713 4.448 -0.211 1.00 0.00 N ATOM 255 CA ARG A 245 3.401 4.060 1.015 1.00 0.00 C ATOM 256 C ARG A 245 3.851 5.278 1.812 1.00 0.00 C ATOM 257 O ARG A 245 4.008 5.199 3.024 1.00 0.00 O ATOM 258 CB ARG A 245 4.611 3.182 0.686 1.00 0.00 C ATOM 259 CG ARG A 245 5.853 3.974 0.314 1.00 0.00 C ATOM 260 CD ARG A 245 7.010 3.060 -0.049 1.00 0.00 C ATOM 261 NE ARG A 245 8.227 3.807 -0.344 1.00 0.00 N ATOM 262 CZ ARG A 245 9.449 3.298 -0.227 1.00 0.00 C ATOM 263 NH1 ARG A 245 9.612 2.047 0.182 1.00 0.00 N ATOM 264 NH2 ARG A 245 10.509 4.039 -0.519 1.00 0.00 N ATOM 0 H ARG A 245 3.018 3.939 -1.041 1.00 0.00 H new ATOM 0 HA ARG A 245 2.696 3.496 1.626 1.00 0.00 H new ATOM 0 HB2 ARG A 245 4.836 2.551 1.546 1.00 0.00 H new ATOM 0 HB3 ARG A 245 4.354 2.517 -0.138 1.00 0.00 H new ATOM 0 HG2 ARG A 245 5.629 4.630 -0.527 1.00 0.00 H new ATOM 0 HG3 ARG A 245 6.141 4.613 1.149 1.00 0.00 H new ATOM 0 HD2 ARG A 245 7.199 2.371 0.774 1.00 0.00 H new ATOM 0 HD3 ARG A 245 6.737 2.456 -0.914 1.00 0.00 H new ATOM 0 HE ARG A 245 8.135 4.773 -0.657 1.00 0.00 H new ATOM 0 HH11 ARG A 245 8.799 1.474 0.407 1.00 0.00 H new ATOM 0 HH12 ARG A 245 10.551 1.658 0.271 1.00 0.00 H new ATOM 0 HH21 ARG A 245 10.387 5.001 -0.834 1.00 0.00 H new ATOM 0 HH22 ARG A 245 11.446 3.647 -0.429 1.00 0.00 H new ATOM 278 N GLN A 246 4.073 6.394 1.128 1.00 0.00 N ATOM 279 CA GLN A 246 4.525 7.614 1.792 1.00 0.00 C ATOM 280 C GLN A 246 3.420 8.249 2.634 1.00 0.00 C ATOM 281 O GLN A 246 3.505 8.278 3.864 1.00 0.00 O ATOM 282 CB GLN A 246 5.033 8.618 0.758 1.00 0.00 C ATOM 283 CG GLN A 246 5.266 10.009 1.323 1.00 0.00 C ATOM 284 CD GLN A 246 5.925 9.982 2.689 1.00 0.00 C ATOM 285 OE1 GLN A 246 6.891 9.251 2.910 1.00 0.00 O ATOM 286 NE2 GLN A 246 5.405 10.782 3.612 1.00 0.00 N ATOM 0 H GLN A 246 3.949 6.481 0.119 1.00 0.00 H new ATOM 0 HA GLN A 246 5.337 7.339 2.465 1.00 0.00 H new ATOM 0 HB2 GLN A 246 5.965 8.247 0.332 1.00 0.00 H new ATOM 0 HB3 GLN A 246 4.313 8.682 -0.058 1.00 0.00 H new ATOM 0 HG2 GLN A 246 5.891 10.577 0.634 1.00 0.00 H new ATOM 0 HG3 GLN A 246 4.313 10.532 1.394 1.00 0.00 H new ATOM 0 HE21 GLN A 246 4.604 11.371 3.384 1.00 0.00 H new ATOM 0 HE22 GLN A 246 5.807 10.808 4.549 1.00 0.00 H new ATOM 295 N VAL A 247 2.386 8.760 1.972 1.00 0.00 N ATOM 296 CA VAL A 247 1.276 9.394 2.675 1.00 0.00 C ATOM 297 C VAL A 247 0.803 8.524 3.832 1.00 0.00 C ATOM 298 O VAL A 247 0.595 9.007 4.945 1.00 0.00 O ATOM 299 CB VAL A 247 0.089 9.663 1.731 1.00 0.00 C ATOM 300 CG1 VAL A 247 0.395 10.831 0.807 1.00 0.00 C ATOM 301 CG2 VAL A 247 -0.251 8.415 0.931 1.00 0.00 C ATOM 0 H VAL A 247 2.294 8.748 0.956 1.00 0.00 H new ATOM 0 HA VAL A 247 1.643 10.346 3.059 1.00 0.00 H new ATOM 0 HB VAL A 247 -0.779 9.926 2.335 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -0.455 11.006 0.148 1.00 0.00 H new ATOM 0 HG12 VAL A 247 0.583 11.725 1.401 1.00 0.00 H new ATOM 0 HG13 VAL A 247 1.277 10.600 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -1.092 8.624 0.270 1.00 0.00 H new ATOM 0 HG22 VAL A 247 0.613 8.117 0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -0.518 7.607 1.613 1.00 0.00 H new ATOM 311 N ILE A 248 0.638 7.240 3.554 1.00 0.00 N ATOM 312 CA ILE A 248 0.193 6.284 4.552 1.00 0.00 C ATOM 313 C ILE A 248 1.315 5.947 5.532 1.00 0.00 C ATOM 314 O ILE A 248 1.056 5.597 6.683 1.00 0.00 O ATOM 315 CB ILE A 248 -0.332 4.996 3.888 1.00 0.00 C ATOM 316 CG1 ILE A 248 0.741 4.395 2.966 1.00 0.00 C ATOM 317 CG2 ILE A 248 -1.619 5.295 3.119 1.00 0.00 C ATOM 318 CD1 ILE A 248 0.188 3.771 1.698 1.00 0.00 C ATOM 0 H ILE A 248 0.808 6.834 2.634 1.00 0.00 H new ATOM 0 HA ILE A 248 -0.623 6.747 5.107 1.00 0.00 H new ATOM 0 HB ILE A 248 -0.558 4.260 4.660 1.00 0.00 H new ATOM 0 HG12 ILE A 248 1.451 5.176 2.694 1.00 0.00 H new ATOM 0 HG13 ILE A 248 1.297 3.638 3.519 1.00 0.00 H new ATOM 0 HG21 ILE A 248 -1.985 4.380 2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 248 -2.373 5.678 3.807 1.00 0.00 H new ATOM 0 HG23 ILE A 248 -1.418 6.040 2.349 1.00 0.00 H new ATOM 0 HD11 ILE A 248 1.008 3.370 1.102 1.00 0.00 H new ATOM 0 HD12 ILE A 248 -0.499 2.966 1.958 1.00 0.00 H new ATOM 0 HD13 ILE A 248 -0.343 4.528 1.121 1.00 0.00 H new ATOM 330 N GLN A 249 2.564 6.070 5.080 1.00 0.00 N ATOM 331 CA GLN A 249 3.711 5.790 5.941 1.00 0.00 C ATOM 332 C GLN A 249 3.650 6.665 7.182 1.00 0.00 C ATOM 333 O GLN A 249 3.456 6.174 8.294 1.00 0.00 O ATOM 334 CB GLN A 249 5.030 6.027 5.194 1.00 0.00 C ATOM 335 CG GLN A 249 6.197 6.396 6.100 1.00 0.00 C ATOM 336 CD GLN A 249 6.296 5.497 7.317 1.00 0.00 C ATOM 337 OE1 GLN A 249 5.392 4.711 7.598 1.00 0.00 O ATOM 338 NE2 GLN A 249 7.400 5.611 8.047 1.00 0.00 N ATOM 0 H GLN A 249 2.805 6.359 4.132 1.00 0.00 H new ATOM 0 HA GLN A 249 3.672 4.741 6.236 1.00 0.00 H new ATOM 0 HB2 GLN A 249 5.287 5.126 4.636 1.00 0.00 H new ATOM 0 HB3 GLN A 249 4.884 6.823 4.464 1.00 0.00 H new ATOM 0 HG2 GLN A 249 7.126 6.337 5.533 1.00 0.00 H new ATOM 0 HG3 GLN A 249 6.087 7.431 6.425 1.00 0.00 H new ATOM 0 HE21 GLN A 249 8.124 6.277 7.776 1.00 0.00 H new ATOM 0 HE22 GLN A 249 7.524 5.033 8.878 1.00 0.00 H new ATOM 347 N GLN A 250 3.796 7.968 6.980 1.00 0.00 N ATOM 348 CA GLN A 250 3.734 8.914 8.081 1.00 0.00 C ATOM 349 C GLN A 250 2.292 9.051 8.542 1.00 0.00 C ATOM 350 O GLN A 250 1.988 8.918 9.727 1.00 0.00 O ATOM 351 CB GLN A 250 4.285 10.276 7.654 1.00 0.00 C ATOM 352 CG GLN A 250 5.725 10.227 7.171 1.00 0.00 C ATOM 353 CD GLN A 250 6.388 11.591 7.174 1.00 0.00 C ATOM 354 OE1 GLN A 250 7.371 11.815 7.880 1.00 0.00 O ATOM 355 NE2 GLN A 250 5.850 12.512 6.383 1.00 0.00 N ATOM 0 H GLN A 250 3.958 8.391 6.066 1.00 0.00 H new ATOM 0 HA GLN A 250 4.346 8.545 8.904 1.00 0.00 H new ATOM 0 HB2 GLN A 250 3.658 10.679 6.859 1.00 0.00 H new ATOM 0 HB3 GLN A 250 4.216 10.966 8.495 1.00 0.00 H new ATOM 0 HG2 GLN A 250 6.295 9.549 7.807 1.00 0.00 H new ATOM 0 HG3 GLN A 250 5.752 9.816 6.162 1.00 0.00 H new ATOM 0 HE21 GLN A 250 5.035 12.283 5.814 1.00 0.00 H new ATOM 0 HE22 GLN A 250 6.252 13.449 6.344 1.00 0.00 H new ATOM 364 N ASN A 251 1.408 9.303 7.582 1.00 0.00 N ATOM 365 CA ASN A 251 -0.012 9.438 7.854 1.00 0.00 C ATOM 366 C ASN A 251 -0.768 8.149 7.521 1.00 0.00 C ATOM 367 O ASN A 251 -1.564 8.130 6.581 1.00 0.00 O ATOM 368 CB ASN A 251 -0.595 10.604 7.055 1.00 0.00 C ATOM 369 CG ASN A 251 -0.650 11.887 7.862 1.00 0.00 C ATOM 370 OD1 ASN A 251 0.125 12.813 7.630 1.00 0.00 O ATOM 371 ND2 ASN A 251 -1.571 11.945 8.818 1.00 0.00 N ATOM 0 H ASN A 251 1.657 9.418 6.600 1.00 0.00 H new ATOM 0 HA ASN A 251 -0.130 9.636 8.919 1.00 0.00 H new ATOM 0 HB2 ASN A 251 0.007 10.766 6.161 1.00 0.00 H new ATOM 0 HB3 ASN A 251 -1.599 10.345 6.720 1.00 0.00 H new ATOM 0 HD21 ASN A 251 -1.656 12.782 9.394 1.00 0.00 H new ATOM 0 HD22 ASN A 251 -2.193 11.152 8.975 1.00 0.00 H new ATOM 378 N PRO A 252 -0.554 7.055 8.275 1.00 0.00 N ATOM 379 CA PRO A 252 -1.248 5.781 8.030 1.00 0.00 C ATOM 380 C PRO A 252 -2.691 5.801 8.530 1.00 0.00 C ATOM 381 O PRO A 252 -3.223 4.776 8.956 1.00 0.00 O ATOM 382 CB PRO A 252 -0.429 4.787 8.851 1.00 0.00 C ATOM 383 CG PRO A 252 0.081 5.596 9.991 1.00 0.00 C ATOM 384 CD PRO A 252 0.367 6.961 9.425 1.00 0.00 C ATOM 0 HA PRO A 252 -1.313 5.546 6.968 1.00 0.00 H new ATOM 0 HB2 PRO A 252 -1.041 3.954 9.195 1.00 0.00 H new ATOM 0 HB3 PRO A 252 0.387 4.363 8.266 1.00 0.00 H new ATOM 0 HG2 PRO A 252 -0.655 5.651 10.793 1.00 0.00 H new ATOM 0 HG3 PRO A 252 0.981 5.151 10.415 1.00 0.00 H new ATOM 0 HD2 PRO A 252 0.178 7.747 10.156 1.00 0.00 H new ATOM 0 HD3 PRO A 252 1.408 7.057 9.115 1.00 0.00 H new ATOM 392 N ALA A 253 -3.315 6.973 8.488 1.00 0.00 N ATOM 393 CA ALA A 253 -4.689 7.129 8.949 1.00 0.00 C ATOM 394 C ALA A 253 -5.692 6.766 7.862 1.00 0.00 C ATOM 395 O ALA A 253 -6.702 6.115 8.128 1.00 0.00 O ATOM 396 CB ALA A 253 -4.938 8.549 9.436 1.00 0.00 C ATOM 0 H ALA A 253 -2.889 7.831 8.138 1.00 0.00 H new ATOM 0 HA ALA A 253 -4.830 6.440 9.782 1.00 0.00 H new ATOM 0 HB1 ALA A 253 -5.970 8.642 9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 253 -4.263 8.774 10.262 1.00 0.00 H new ATOM 0 HB3 ALA A 253 -4.760 9.250 8.620 1.00 0.00 H new ATOM 402 N LEU A 254 -5.419 7.211 6.642 1.00 0.00 N ATOM 403 CA LEU A 254 -6.311 6.953 5.518 1.00 0.00 C ATOM 404 C LEU A 254 -6.141 5.540 4.973 1.00 0.00 C ATOM 405 O LEU A 254 -6.973 5.067 4.199 1.00 0.00 O ATOM 406 CB LEU A 254 -6.063 7.971 4.404 1.00 0.00 C ATOM 407 CG LEU A 254 -4.821 7.709 3.552 1.00 0.00 C ATOM 408 CD1 LEU A 254 -5.185 7.669 2.075 1.00 0.00 C ATOM 409 CD2 LEU A 254 -3.763 8.771 3.812 1.00 0.00 C ATOM 0 H LEU A 254 -4.587 7.752 6.405 1.00 0.00 H new ATOM 0 HA LEU A 254 -7.334 7.051 5.882 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -6.935 7.991 3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -5.976 8.961 4.851 1.00 0.00 H new ATOM 0 HG LEU A 254 -4.411 6.738 3.831 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -4.288 7.482 1.484 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -5.908 6.872 1.900 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -5.620 8.624 1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -2.886 8.569 3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -4.164 9.753 3.561 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -3.480 8.753 4.865 1.00 0.00 H new ATOM 421 N LEU A 255 -5.063 4.869 5.364 1.00 0.00 N ATOM 422 CA LEU A 255 -4.808 3.517 4.884 1.00 0.00 C ATOM 423 C LEU A 255 -4.670 3.538 3.368 1.00 0.00 C ATOM 424 O LEU A 255 -5.540 4.056 2.674 1.00 0.00 O ATOM 425 CB LEU A 255 -5.954 2.582 5.303 1.00 0.00 C ATOM 426 CG LEU A 255 -5.944 1.175 4.686 1.00 0.00 C ATOM 427 CD1 LEU A 255 -6.183 1.232 3.185 1.00 0.00 C ATOM 428 CD2 LEU A 255 -4.639 0.460 4.997 1.00 0.00 C ATOM 0 H LEU A 255 -4.359 5.235 6.005 1.00 0.00 H new ATOM 0 HA LEU A 255 -3.882 3.145 5.323 1.00 0.00 H new ATOM 0 HB2 LEU A 255 -5.933 2.480 6.388 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -6.898 3.062 5.046 1.00 0.00 H new ATOM 0 HG LEU A 255 -6.760 0.608 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -6.170 0.222 2.776 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -7.152 1.691 2.988 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -5.398 1.824 2.714 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -4.654 -0.534 4.551 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -3.805 1.030 4.587 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -4.521 0.371 6.077 1.00 0.00 H new ATOM 440 N PRO A 256 -3.572 2.982 2.836 1.00 0.00 N ATOM 441 CA PRO A 256 -3.318 2.944 1.400 1.00 0.00 C ATOM 442 C PRO A 256 -4.585 2.685 0.594 1.00 0.00 C ATOM 443 O PRO A 256 -4.875 1.548 0.220 1.00 0.00 O ATOM 444 CB PRO A 256 -2.326 1.783 1.232 1.00 0.00 C ATOM 445 CG PRO A 256 -1.968 1.322 2.617 1.00 0.00 C ATOM 446 CD PRO A 256 -2.486 2.353 3.584 1.00 0.00 C ATOM 0 HA PRO A 256 -2.937 3.897 1.033 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -2.772 0.972 0.657 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -1.438 2.107 0.690 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -2.410 0.347 2.823 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -0.888 1.210 2.717 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -2.842 1.898 4.508 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -1.715 3.072 3.860 1.00 0.00 H new ATOM 454 N ALA A 257 -5.334 3.749 0.328 1.00 0.00 N ATOM 455 CA ALA A 257 -6.566 3.645 -0.437 1.00 0.00 C ATOM 456 C ALA A 257 -6.257 3.592 -1.922 1.00 0.00 C ATOM 457 O ALA A 257 -7.021 3.037 -2.710 1.00 0.00 O ATOM 458 CB ALA A 257 -7.500 4.806 -0.131 1.00 0.00 C ATOM 0 H ALA A 257 -5.107 4.695 0.633 1.00 0.00 H new ATOM 0 HA ALA A 257 -7.070 2.723 -0.147 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -8.413 4.702 -0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -7.748 4.804 0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -7.009 5.745 -0.387 1.00 0.00 H new ATOM 464 N LEU A 258 -5.124 4.175 -2.296 1.00 0.00 N ATOM 465 CA LEU A 258 -4.706 4.195 -3.686 1.00 0.00 C ATOM 466 C LEU A 258 -4.807 2.800 -4.294 1.00 0.00 C ATOM 467 O LEU A 258 -5.403 2.611 -5.357 1.00 0.00 O ATOM 468 CB LEU A 258 -3.276 4.721 -3.804 1.00 0.00 C ATOM 469 CG LEU A 258 -3.111 6.205 -3.471 1.00 0.00 C ATOM 470 CD1 LEU A 258 -4.237 7.019 -4.089 1.00 0.00 C ATOM 471 CD2 LEU A 258 -3.066 6.410 -1.963 1.00 0.00 C ATOM 0 H LEU A 258 -4.481 4.639 -1.654 1.00 0.00 H new ATOM 0 HA LEU A 258 -5.370 4.862 -4.236 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.634 4.140 -3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -2.923 4.549 -4.821 1.00 0.00 H new ATOM 0 HG LEU A 258 -2.167 6.551 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.103 8.072 -3.842 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -4.223 6.896 -5.172 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.193 6.673 -3.697 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -2.948 7.471 -1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -3.993 6.048 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -2.224 5.858 -1.546 1.00 0.00 H new ATOM 483 N LEU A 259 -4.233 1.820 -3.602 1.00 0.00 N ATOM 484 CA LEU A 259 -4.267 0.439 -4.061 1.00 0.00 C ATOM 485 C LEU A 259 -5.691 -0.096 -4.009 1.00 0.00 C ATOM 486 O LEU A 259 -6.099 -0.898 -4.850 1.00 0.00 O ATOM 487 CB LEU A 259 -3.347 -0.430 -3.201 1.00 0.00 C ATOM 488 CG LEU A 259 -3.669 -1.926 -3.216 1.00 0.00 C ATOM 489 CD1 LEU A 259 -4.887 -2.219 -2.355 1.00 0.00 C ATOM 490 CD2 LEU A 259 -3.895 -2.407 -4.641 1.00 0.00 C ATOM 0 H LEU A 259 -3.739 1.959 -2.721 1.00 0.00 H new ATOM 0 HA LEU A 259 -3.915 0.406 -5.092 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -2.320 -0.291 -3.540 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -3.394 -0.074 -2.172 1.00 0.00 H new ATOM 0 HG LEU A 259 -2.818 -2.465 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -5.100 -3.288 -2.378 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -4.690 -1.911 -1.328 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -5.746 -1.669 -2.740 1.00 0.00 H new ATOM 0 HD21 LEU A 259 -4.123 -3.473 -4.633 1.00 0.00 H new ATOM 0 HD22 LEU A 259 -4.729 -1.861 -5.081 1.00 0.00 H new ATOM 0 HD23 LEU A 259 -2.995 -2.233 -5.231 1.00 0.00 H new ATOM 502 N GLN A 260 -6.446 0.362 -3.015 1.00 0.00 N ATOM 503 CA GLN A 260 -7.831 -0.058 -2.851 1.00 0.00 C ATOM 504 C GLN A 260 -8.668 0.388 -4.044 1.00 0.00 C ATOM 505 O GLN A 260 -9.503 -0.364 -4.547 1.00 0.00 O ATOM 506 CB GLN A 260 -8.413 0.516 -1.558 1.00 0.00 C ATOM 507 CG GLN A 260 -9.068 -0.528 -0.669 1.00 0.00 C ATOM 508 CD GLN A 260 -9.850 -1.558 -1.459 1.00 0.00 C ATOM 509 OE1 GLN A 260 -10.575 -1.221 -2.395 1.00 0.00 O ATOM 510 NE2 GLN A 260 -9.704 -2.825 -1.088 1.00 0.00 N ATOM 0 H GLN A 260 -6.120 1.025 -2.311 1.00 0.00 H new ATOM 0 HA GLN A 260 -7.855 -1.146 -2.794 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -7.618 1.009 -0.999 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -9.148 1.281 -1.809 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -8.301 -1.032 -0.081 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -9.736 -0.032 0.036 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -9.093 -3.060 -0.306 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -10.203 -3.563 -1.585 1.00 0.00 H new ATOM 519 N GLN A 261 -8.431 1.615 -4.498 1.00 0.00 N ATOM 520 CA GLN A 261 -9.155 2.162 -5.637 1.00 0.00 C ATOM 521 C GLN A 261 -8.746 1.447 -6.920 1.00 0.00 C ATOM 522 O GLN A 261 -9.546 1.293 -7.841 1.00 0.00 O ATOM 523 CB GLN A 261 -8.890 3.662 -5.769 1.00 0.00 C ATOM 524 CG GLN A 261 -10.148 4.482 -6.002 1.00 0.00 C ATOM 525 CD GLN A 261 -9.845 5.909 -6.415 1.00 0.00 C ATOM 526 OE1 GLN A 261 -9.929 6.258 -7.592 1.00 0.00 O ATOM 527 NE2 GLN A 261 -9.490 6.743 -5.444 1.00 0.00 N ATOM 0 H GLN A 261 -7.742 2.249 -4.093 1.00 0.00 H new ATOM 0 HA GLN A 261 -10.221 2.007 -5.472 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -8.397 4.017 -4.864 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -8.199 3.829 -6.595 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -10.751 4.004 -6.774 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -10.746 4.490 -5.091 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -9.433 6.410 -4.481 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -9.274 7.716 -5.661 1.00 0.00 H new ATOM 536 N LEU A 262 -7.491 1.010 -6.968 1.00 0.00 N ATOM 537 CA LEU A 262 -6.969 0.308 -8.135 1.00 0.00 C ATOM 538 C LEU A 262 -7.618 -1.067 -8.279 1.00 0.00 C ATOM 539 O LEU A 262 -8.159 -1.403 -9.332 1.00 0.00 O ATOM 540 CB LEU A 262 -5.450 0.157 -8.026 1.00 0.00 C ATOM 541 CG LEU A 262 -4.661 1.460 -8.157 1.00 0.00 C ATOM 542 CD1 LEU A 262 -3.184 1.219 -7.883 1.00 0.00 C ATOM 543 CD2 LEU A 262 -4.857 2.064 -9.539 1.00 0.00 C ATOM 0 H LEU A 262 -6.817 1.130 -6.212 1.00 0.00 H new ATOM 0 HA LEU A 262 -7.208 0.898 -9.020 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -5.213 -0.299 -7.065 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -5.112 -0.534 -8.798 1.00 0.00 H new ATOM 0 HG LEU A 262 -5.036 2.167 -7.417 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -2.638 2.157 -7.981 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -3.060 0.831 -6.872 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -2.794 0.496 -8.600 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -4.288 2.991 -9.615 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -4.508 1.361 -10.296 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -5.915 2.273 -9.698 1.00 0.00 H new ATOM 555 N GLY A 263 -7.557 -1.860 -7.213 1.00 0.00 N ATOM 556 CA GLY A 263 -8.137 -3.190 -7.241 1.00 0.00 C ATOM 557 C GLY A 263 -9.652 -3.170 -7.190 1.00 0.00 C ATOM 558 O GLY A 263 -10.308 -4.090 -7.678 1.00 0.00 O ATOM 0 H GLY A 263 -7.116 -1.604 -6.330 1.00 0.00 H new ATOM 0 HA2 GLY A 263 -7.815 -3.703 -8.147 1.00 0.00 H new ATOM 0 HA3 GLY A 263 -7.757 -3.765 -6.397 1.00 0.00 H new ATOM 562 N GLN A 264 -10.208 -2.120 -6.598 1.00 0.00 N ATOM 563 CA GLN A 264 -11.656 -1.985 -6.487 1.00 0.00 C ATOM 564 C GLN A 264 -12.242 -1.407 -7.768 1.00 0.00 C ATOM 565 O GLN A 264 -13.297 -1.837 -8.232 1.00 0.00 O ATOM 566 CB GLN A 264 -12.023 -1.098 -5.295 1.00 0.00 C ATOM 567 CG GLN A 264 -11.913 0.390 -5.586 1.00 0.00 C ATOM 568 CD GLN A 264 -13.158 0.949 -6.246 1.00 0.00 C ATOM 569 OE1 GLN A 264 -13.077 1.655 -7.253 1.00 0.00 O ATOM 570 NE2 GLN A 264 -14.320 0.637 -5.683 1.00 0.00 N ATOM 0 H GLN A 264 -9.679 -1.350 -6.188 1.00 0.00 H new ATOM 0 HA GLN A 264 -12.078 -2.978 -6.328 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -13.043 -1.324 -4.985 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -11.373 -1.344 -4.456 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -11.728 0.926 -4.655 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -11.053 0.567 -6.232 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -14.341 0.049 -4.850 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -15.191 0.985 -6.084 1.00 0.00 H new ATOM 579 N GLU A 265 -11.542 -0.433 -8.340 1.00 0.00 N ATOM 580 CA GLU A 265 -11.984 0.201 -9.573 1.00 0.00 C ATOM 581 C GLU A 265 -12.374 -0.854 -10.598 1.00 0.00 C ATOM 582 O GLU A 265 -13.544 -0.988 -10.955 1.00 0.00 O ATOM 583 CB GLU A 265 -10.873 1.102 -10.128 1.00 0.00 C ATOM 584 CG GLU A 265 -10.872 1.227 -11.645 1.00 0.00 C ATOM 585 CD GLU A 265 -12.255 1.485 -12.210 1.00 0.00 C ATOM 586 OE1 GLU A 265 -13.128 1.957 -11.451 1.00 0.00 O ATOM 587 OE2 GLU A 265 -12.466 1.213 -13.410 1.00 0.00 O ATOM 0 H GLU A 265 -10.666 -0.067 -7.968 1.00 0.00 H new ATOM 0 HA GLU A 265 -12.859 0.815 -9.360 1.00 0.00 H new ATOM 0 HB2 GLU A 265 -10.975 2.096 -9.693 1.00 0.00 H new ATOM 0 HB3 GLU A 265 -9.908 0.711 -9.806 1.00 0.00 H new ATOM 0 HG2 GLU A 265 -10.207 2.039 -11.938 1.00 0.00 H new ATOM 0 HG3 GLU A 265 -10.470 0.312 -12.081 1.00 0.00 H new ATOM 594 N ASN A 266 -11.384 -1.605 -11.061 1.00 0.00 N ATOM 595 CA ASN A 266 -11.623 -2.653 -12.041 1.00 0.00 C ATOM 596 C ASN A 266 -11.599 -4.026 -11.378 1.00 0.00 C ATOM 597 O ASN A 266 -10.537 -4.534 -11.018 1.00 0.00 O ATOM 598 CB ASN A 266 -10.578 -2.590 -13.157 1.00 0.00 C ATOM 599 CG ASN A 266 -11.184 -2.211 -14.494 1.00 0.00 C ATOM 600 OD1 ASN A 266 -11.829 -3.028 -15.150 1.00 0.00 O ATOM 601 ND2 ASN A 266 -10.977 -0.965 -14.906 1.00 0.00 N ATOM 0 H ASN A 266 -10.410 -1.508 -10.774 1.00 0.00 H new ATOM 0 HA ASN A 266 -12.610 -2.494 -12.475 1.00 0.00 H new ATOM 0 HB2 ASN A 266 -9.809 -1.865 -12.891 1.00 0.00 H new ATOM 0 HB3 ASN A 266 -10.086 -3.558 -13.245 1.00 0.00 H new ATOM 0 HD21 ASN A 266 -11.359 -0.653 -15.799 1.00 0.00 H new ATOM 0 HD22 ASN A 266 -10.436 -0.321 -14.330 1.00 0.00 H new ATOM 608 N PRO A 267 -12.776 -4.646 -11.212 1.00 0.00 N ATOM 609 CA PRO A 267 -12.889 -5.967 -10.593 1.00 0.00 C ATOM 610 C PRO A 267 -11.861 -6.950 -11.144 1.00 0.00 C ATOM 611 O PRO A 267 -11.521 -7.939 -10.494 1.00 0.00 O ATOM 612 CB PRO A 267 -14.304 -6.404 -10.965 1.00 0.00 C ATOM 613 CG PRO A 267 -15.065 -5.130 -11.099 1.00 0.00 C ATOM 614 CD PRO A 267 -14.087 -4.108 -11.619 1.00 0.00 C ATOM 0 HA PRO A 267 -12.706 -5.938 -9.519 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.312 -6.971 -11.896 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -14.736 -7.046 -10.197 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.905 -5.249 -11.784 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -15.478 -4.820 -10.139 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -14.158 -4.000 -12.701 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.268 -3.124 -11.188 1.00 0.00 H new ATOM 622 N GLN A 268 -11.367 -6.666 -12.345 1.00 0.00 N ATOM 623 CA GLN A 268 -10.375 -7.521 -12.985 1.00 0.00 C ATOM 624 C GLN A 268 -8.964 -7.010 -12.714 1.00 0.00 C ATOM 625 O GLN A 268 -7.997 -7.770 -12.763 1.00 0.00 O ATOM 626 CB GLN A 268 -10.626 -7.587 -14.493 1.00 0.00 C ATOM 627 CG GLN A 268 -11.547 -8.723 -14.906 1.00 0.00 C ATOM 628 CD GLN A 268 -10.791 -9.910 -15.472 1.00 0.00 C ATOM 629 OE1 GLN A 268 -10.794 -10.143 -16.680 1.00 0.00 O ATOM 630 NE2 GLN A 268 -10.141 -10.668 -14.597 1.00 0.00 N ATOM 0 H GLN A 268 -11.638 -5.850 -12.894 1.00 0.00 H new ATOM 0 HA GLN A 268 -10.467 -8.522 -12.565 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -11.057 -6.642 -14.823 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -9.672 -7.699 -15.007 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -12.129 -9.046 -14.043 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -12.255 -8.359 -15.651 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -10.166 -10.437 -13.604 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -9.616 -11.482 -14.918 1.00 0.00 H new ATOM 639 N LEU A 269 -8.853 -5.716 -12.428 1.00 0.00 N ATOM 640 CA LEU A 269 -7.560 -5.103 -12.150 1.00 0.00 C ATOM 641 C LEU A 269 -6.798 -5.901 -11.099 1.00 0.00 C ATOM 642 O LEU A 269 -5.681 -6.354 -11.338 1.00 0.00 O ATOM 643 CB LEU A 269 -7.741 -3.658 -11.677 1.00 0.00 C ATOM 644 CG LEU A 269 -6.753 -2.654 -12.275 1.00 0.00 C ATOM 645 CD1 LEU A 269 -7.074 -2.397 -13.739 1.00 0.00 C ATOM 646 CD2 LEU A 269 -6.775 -1.352 -11.489 1.00 0.00 C ATOM 0 H LEU A 269 -9.643 -5.073 -12.383 1.00 0.00 H new ATOM 0 HA LEU A 269 -6.982 -5.102 -13.074 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -8.754 -3.336 -11.919 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -7.649 -3.633 -10.591 1.00 0.00 H new ATOM 0 HG LEU A 269 -5.751 -3.078 -12.212 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -6.361 -1.681 -14.147 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -7.008 -3.332 -14.295 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -8.083 -1.994 -13.825 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -6.066 -0.650 -11.928 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -7.777 -0.924 -11.521 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -6.497 -1.548 -10.453 1.00 0.00 H new ATOM 658 N LEU A 270 -7.412 -6.068 -9.933 1.00 0.00 N ATOM 659 CA LEU A 270 -6.792 -6.811 -8.842 1.00 0.00 C ATOM 660 C LEU A 270 -6.147 -8.095 -9.354 1.00 0.00 C ATOM 661 O LEU A 270 -4.963 -8.341 -9.126 1.00 0.00 O ATOM 662 CB LEU A 270 -7.829 -7.142 -7.768 1.00 0.00 C ATOM 663 CG LEU A 270 -7.285 -7.896 -6.554 1.00 0.00 C ATOM 664 CD1 LEU A 270 -7.174 -6.967 -5.355 1.00 0.00 C ATOM 665 CD2 LEU A 270 -8.172 -9.087 -6.226 1.00 0.00 C ATOM 0 H LEU A 270 -8.338 -5.699 -9.719 1.00 0.00 H new ATOM 0 HA LEU A 270 -6.014 -6.184 -8.406 1.00 0.00 H new ATOM 0 HB2 LEU A 270 -8.284 -6.213 -7.425 1.00 0.00 H new ATOM 0 HB3 LEU A 270 -8.622 -7.737 -8.221 1.00 0.00 H new ATOM 0 HG LEU A 270 -6.288 -8.265 -6.796 1.00 0.00 H new ATOM 0 HD11 LEU A 270 -6.785 -7.521 -4.500 1.00 0.00 H new ATOM 0 HD12 LEU A 270 -6.498 -6.145 -5.593 1.00 0.00 H new ATOM 0 HD13 LEU A 270 -8.159 -6.568 -5.111 1.00 0.00 H new ATOM 0 HD21 LEU A 270 -7.770 -9.612 -5.360 1.00 0.00 H new ATOM 0 HD22 LEU A 270 -9.181 -8.739 -6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 270 -8.202 -9.765 -7.079 1.00 0.00 H new ATOM 677 N GLN A 271 -6.934 -8.911 -10.047 1.00 0.00 N ATOM 678 CA GLN A 271 -6.440 -10.171 -10.589 1.00 0.00 C ATOM 679 C GLN A 271 -5.005 -10.025 -11.086 1.00 0.00 C ATOM 680 O GLN A 271 -4.093 -10.675 -10.577 1.00 0.00 O ATOM 681 CB GLN A 271 -7.338 -10.648 -11.732 1.00 0.00 C ATOM 682 CG GLN A 271 -8.760 -10.967 -11.297 1.00 0.00 C ATOM 683 CD GLN A 271 -9.196 -12.360 -11.709 1.00 0.00 C ATOM 684 OE1 GLN A 271 -10.123 -12.523 -12.503 1.00 0.00 O ATOM 685 NE2 GLN A 271 -8.528 -13.373 -11.170 1.00 0.00 N ATOM 0 H GLN A 271 -7.916 -8.722 -10.246 1.00 0.00 H new ATOM 0 HA GLN A 271 -6.457 -10.911 -9.789 1.00 0.00 H new ATOM 0 HB2 GLN A 271 -7.367 -9.880 -12.505 1.00 0.00 H new ATOM 0 HB3 GLN A 271 -6.897 -11.537 -12.183 1.00 0.00 H new ATOM 0 HG2 GLN A 271 -8.835 -10.872 -10.214 1.00 0.00 H new ATOM 0 HG3 GLN A 271 -9.441 -10.234 -11.729 1.00 0.00 H new ATOM 0 HE21 GLN A 271 -7.766 -13.191 -10.516 1.00 0.00 H new ATOM 0 HE22 GLN A 271 -8.776 -14.333 -11.410 1.00 0.00 H new ATOM 694 N GLN A 272 -4.815 -9.170 -12.086 1.00 0.00 N ATOM 695 CA GLN A 272 -3.491 -8.941 -12.654 1.00 0.00 C ATOM 696 C GLN A 272 -2.594 -8.194 -11.672 1.00 0.00 C ATOM 697 O GLN A 272 -1.419 -8.524 -11.519 1.00 0.00 O ATOM 698 CB GLN A 272 -3.604 -8.155 -13.962 1.00 0.00 C ATOM 699 CG GLN A 272 -4.014 -9.008 -15.151 1.00 0.00 C ATOM 700 CD GLN A 272 -5.023 -10.077 -14.783 1.00 0.00 C ATOM 701 OE1 GLN A 272 -6.138 -9.774 -14.358 1.00 0.00 O ATOM 702 NE2 GLN A 272 -4.637 -11.337 -14.943 1.00 0.00 N ATOM 0 H GLN A 272 -5.560 -8.625 -12.519 1.00 0.00 H new ATOM 0 HA GLN A 272 -3.040 -9.912 -12.859 1.00 0.00 H new ATOM 0 HB2 GLN A 272 -4.331 -7.353 -13.833 1.00 0.00 H new ATOM 0 HB3 GLN A 272 -2.645 -7.684 -14.177 1.00 0.00 H new ATOM 0 HG2 GLN A 272 -4.436 -8.367 -15.925 1.00 0.00 H new ATOM 0 HG3 GLN A 272 -3.129 -9.481 -15.576 1.00 0.00 H new ATOM 0 HE21 GLN A 272 -3.703 -11.543 -15.298 1.00 0.00 H new ATOM 0 HE22 GLN A 272 -5.274 -12.099 -14.711 1.00 0.00 H new ATOM 711 N ILE A 273 -3.153 -7.187 -11.005 1.00 0.00 N ATOM 712 CA ILE A 273 -2.396 -6.402 -10.037 1.00 0.00 C ATOM 713 C ILE A 273 -1.542 -7.313 -9.163 1.00 0.00 C ATOM 714 O ILE A 273 -0.497 -6.905 -8.657 1.00 0.00 O ATOM 715 CB ILE A 273 -3.330 -5.553 -9.145 1.00 0.00 C ATOM 716 CG1 ILE A 273 -3.868 -4.355 -9.929 1.00 0.00 C ATOM 717 CG2 ILE A 273 -2.602 -5.083 -7.890 1.00 0.00 C ATOM 718 CD1 ILE A 273 -4.628 -3.363 -9.075 1.00 0.00 C ATOM 0 H ILE A 273 -4.124 -6.897 -11.117 1.00 0.00 H new ATOM 0 HA ILE A 273 -1.748 -5.727 -10.597 1.00 0.00 H new ATOM 0 HB ILE A 273 -4.170 -6.177 -8.838 1.00 0.00 H new ATOM 0 HG12 ILE A 273 -3.035 -3.843 -10.411 1.00 0.00 H new ATOM 0 HG13 ILE A 273 -4.523 -4.715 -10.722 1.00 0.00 H new ATOM 0 HG21 ILE A 273 -3.279 -4.487 -7.278 1.00 0.00 H new ATOM 0 HG22 ILE A 273 -2.264 -5.948 -7.320 1.00 0.00 H new ATOM 0 HG23 ILE A 273 -1.742 -4.477 -8.174 1.00 0.00 H new ATOM 0 HD11 ILE A 273 -4.979 -2.541 -9.698 1.00 0.00 H new ATOM 0 HD12 ILE A 273 -5.482 -3.859 -8.614 1.00 0.00 H new ATOM 0 HD13 ILE A 273 -3.971 -2.974 -8.297 1.00 0.00 H new ATOM 730 N SER A 274 -1.993 -8.550 -8.995 1.00 0.00 N ATOM 731 CA SER A 274 -1.270 -9.525 -8.188 1.00 0.00 C ATOM 732 C SER A 274 0.132 -9.747 -8.743 1.00 0.00 C ATOM 733 O SER A 274 0.997 -10.307 -8.069 1.00 0.00 O ATOM 734 CB SER A 274 -2.033 -10.850 -8.149 1.00 0.00 C ATOM 735 OG SER A 274 -1.923 -11.466 -6.878 1.00 0.00 O ATOM 0 H SER A 274 -2.857 -8.902 -9.407 1.00 0.00 H new ATOM 0 HA SER A 274 -1.185 -9.135 -7.174 1.00 0.00 H new ATOM 0 HB2 SER A 274 -3.083 -10.675 -8.382 1.00 0.00 H new ATOM 0 HB3 SER A 274 -1.644 -11.520 -8.916 1.00 0.00 H new ATOM 0 HG SER A 274 -1.816 -10.777 -6.189 1.00 0.00 H new ATOM 741 N ARG A 275 0.351 -9.302 -9.977 1.00 0.00 N ATOM 742 CA ARG A 275 1.646 -9.449 -10.627 1.00 0.00 C ATOM 743 C ARG A 275 2.761 -8.865 -9.765 1.00 0.00 C ATOM 744 O ARG A 275 3.721 -9.555 -9.422 1.00 0.00 O ATOM 745 CB ARG A 275 1.633 -8.762 -11.995 1.00 0.00 C ATOM 746 CG ARG A 275 2.551 -9.416 -13.014 1.00 0.00 C ATOM 747 CD ARG A 275 3.835 -9.912 -12.368 1.00 0.00 C ATOM 748 NE ARG A 275 4.803 -10.375 -13.359 1.00 0.00 N ATOM 749 CZ ARG A 275 4.819 -11.608 -13.853 1.00 0.00 C ATOM 750 NH1 ARG A 275 3.921 -12.497 -13.451 1.00 0.00 N ATOM 751 NH2 ARG A 275 5.732 -11.954 -14.750 1.00 0.00 N ATOM 0 H ARG A 275 -0.355 -8.836 -10.547 1.00 0.00 H new ATOM 0 HA ARG A 275 1.836 -10.514 -10.761 1.00 0.00 H new ATOM 0 HB2 ARG A 275 0.614 -8.763 -12.383 1.00 0.00 H new ATOM 0 HB3 ARG A 275 1.926 -7.719 -11.871 1.00 0.00 H new ATOM 0 HG2 ARG A 275 2.035 -10.251 -13.488 1.00 0.00 H new ATOM 0 HG3 ARG A 275 2.791 -8.701 -13.801 1.00 0.00 H new ATOM 0 HD2 ARG A 275 4.277 -9.110 -11.777 1.00 0.00 H new ATOM 0 HD3 ARG A 275 3.604 -10.725 -11.680 1.00 0.00 H new ATOM 0 HE ARG A 275 5.506 -9.715 -13.690 1.00 0.00 H new ATOM 0 HH11 ARG A 275 3.217 -12.234 -12.762 1.00 0.00 H new ATOM 0 HH12 ARG A 275 3.935 -13.443 -13.831 1.00 0.00 H new ATOM 0 HH21 ARG A 275 6.424 -11.273 -15.062 1.00 0.00 H new ATOM 0 HH22 ARG A 275 5.742 -12.901 -15.128 1.00 0.00 H new ATOM 765 N HIS A 276 2.631 -7.588 -9.420 1.00 0.00 N ATOM 766 CA HIS A 276 3.631 -6.914 -8.600 1.00 0.00 C ATOM 767 C HIS A 276 3.173 -6.811 -7.149 1.00 0.00 C ATOM 768 O HIS A 276 3.834 -6.178 -6.326 1.00 0.00 O ATOM 769 CB HIS A 276 3.922 -5.519 -9.154 1.00 0.00 C ATOM 770 CG HIS A 276 5.377 -5.163 -9.134 1.00 0.00 C ATOM 771 ND1 HIS A 276 6.369 -6.019 -9.567 1.00 0.00 N ATOM 772 CD2 HIS A 276 6.008 -4.034 -8.728 1.00 0.00 C ATOM 773 CE1 HIS A 276 7.544 -5.433 -9.428 1.00 0.00 C ATOM 774 NE2 HIS A 276 7.353 -4.230 -8.922 1.00 0.00 N ATOM 0 H HIS A 276 1.844 -7.000 -9.695 1.00 0.00 H new ATOM 0 HA HIS A 276 4.544 -7.508 -8.631 1.00 0.00 H new ATOM 0 HB2 HIS A 276 3.555 -5.459 -10.179 1.00 0.00 H new ATOM 0 HB3 HIS A 276 3.367 -4.782 -8.573 1.00 0.00 H new ATOM 0 HD2 HIS A 276 5.540 -3.147 -8.327 1.00 0.00 H new ATOM 0 HE1 HIS A 276 8.500 -5.865 -9.685 1.00 0.00 H new ATOM 0 HE2 HIS A 276 8.087 -3.554 -8.709 1.00 0.00 H new ATOM 783 N GLN A 277 2.042 -7.434 -6.838 1.00 0.00 N ATOM 784 CA GLN A 277 1.506 -7.407 -5.483 1.00 0.00 C ATOM 785 C GLN A 277 2.631 -7.487 -4.456 1.00 0.00 C ATOM 786 O GLN A 277 2.808 -6.581 -3.641 1.00 0.00 O ATOM 787 CB GLN A 277 0.523 -8.562 -5.276 1.00 0.00 C ATOM 788 CG GLN A 277 0.308 -8.925 -3.816 1.00 0.00 C ATOM 789 CD GLN A 277 -0.467 -10.216 -3.645 1.00 0.00 C ATOM 790 OE1 GLN A 277 -1.518 -10.409 -4.256 1.00 0.00 O ATOM 791 NE2 GLN A 277 0.049 -11.109 -2.809 1.00 0.00 N ATOM 0 H GLN A 277 1.480 -7.963 -7.505 1.00 0.00 H new ATOM 0 HA GLN A 277 0.977 -6.464 -5.345 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -0.436 -8.296 -5.720 1.00 0.00 H new ATOM 0 HB3 GLN A 277 0.889 -9.439 -5.810 1.00 0.00 H new ATOM 0 HG2 GLN A 277 1.275 -9.018 -3.322 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -0.227 -8.116 -3.319 1.00 0.00 H new ATOM 0 HE21 GLN A 277 0.923 -10.907 -2.323 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -0.429 -11.997 -2.653 1.00 0.00 H new ATOM 800 N GLU A 278 3.390 -8.577 -4.503 1.00 0.00 N ATOM 801 CA GLU A 278 4.500 -8.775 -3.578 1.00 0.00 C ATOM 802 C GLU A 278 5.384 -7.533 -3.519 1.00 0.00 C ATOM 803 O GLU A 278 5.724 -7.053 -2.438 1.00 0.00 O ATOM 804 CB GLU A 278 5.332 -9.988 -3.999 1.00 0.00 C ATOM 805 CG GLU A 278 5.311 -11.122 -2.986 1.00 0.00 C ATOM 806 CD GLU A 278 4.499 -12.311 -3.460 1.00 0.00 C ATOM 807 OE1 GLU A 278 4.351 -12.477 -4.690 1.00 0.00 O ATOM 808 OE2 GLU A 278 4.012 -13.077 -2.603 1.00 0.00 O ATOM 0 H GLU A 278 3.257 -9.336 -5.171 1.00 0.00 H new ATOM 0 HA GLU A 278 4.087 -8.954 -2.585 1.00 0.00 H new ATOM 0 HB2 GLU A 278 4.961 -10.359 -4.955 1.00 0.00 H new ATOM 0 HB3 GLU A 278 6.363 -9.673 -4.158 1.00 0.00 H new ATOM 0 HG2 GLU A 278 6.333 -11.442 -2.783 1.00 0.00 H new ATOM 0 HG3 GLU A 278 4.899 -10.757 -2.045 1.00 0.00 H new ATOM 815 N GLN A 279 5.749 -7.017 -4.687 1.00 0.00 N ATOM 816 CA GLN A 279 6.590 -5.829 -4.769 1.00 0.00 C ATOM 817 C GLN A 279 5.820 -4.590 -4.326 1.00 0.00 C ATOM 818 O GLN A 279 6.253 -3.863 -3.431 1.00 0.00 O ATOM 819 CB GLN A 279 7.107 -5.639 -6.196 1.00 0.00 C ATOM 820 CG GLN A 279 8.205 -6.617 -6.580 1.00 0.00 C ATOM 821 CD GLN A 279 7.659 -7.910 -7.155 1.00 0.00 C ATOM 822 OE1 GLN A 279 6.737 -8.507 -6.599 1.00 0.00 O ATOM 823 NE2 GLN A 279 8.227 -8.349 -8.272 1.00 0.00 N ATOM 0 H GLN A 279 5.475 -7.403 -5.591 1.00 0.00 H new ATOM 0 HA GLN A 279 7.439 -5.968 -4.100 1.00 0.00 H new ATOM 0 HB2 GLN A 279 6.275 -5.747 -6.892 1.00 0.00 H new ATOM 0 HB3 GLN A 279 7.483 -4.622 -6.305 1.00 0.00 H new ATOM 0 HG2 GLN A 279 8.865 -6.149 -7.311 1.00 0.00 H new ATOM 0 HG3 GLN A 279 8.810 -6.841 -5.702 1.00 0.00 H new ATOM 0 HE21 GLN A 279 8.989 -7.821 -8.698 1.00 0.00 H new ATOM 0 HE22 GLN A 279 7.902 -9.214 -8.704 1.00 0.00 H new ATOM 832 N PHE A 280 4.675 -4.354 -4.959 1.00 0.00 N ATOM 833 CA PHE A 280 3.843 -3.203 -4.629 1.00 0.00 C ATOM 834 C PHE A 280 3.669 -3.078 -3.120 1.00 0.00 C ATOM 835 O PHE A 280 3.964 -2.036 -2.535 1.00 0.00 O ATOM 836 CB PHE A 280 2.475 -3.325 -5.303 1.00 0.00 C ATOM 837 CG PHE A 280 1.993 -2.041 -5.917 1.00 0.00 C ATOM 838 CD1 PHE A 280 2.408 -1.663 -7.184 1.00 0.00 C ATOM 839 CD2 PHE A 280 1.124 -1.211 -5.226 1.00 0.00 C ATOM 840 CE1 PHE A 280 1.966 -0.483 -7.751 1.00 0.00 C ATOM 841 CE2 PHE A 280 0.679 -0.029 -5.787 1.00 0.00 C ATOM 842 CZ PHE A 280 1.100 0.335 -7.051 1.00 0.00 C ATOM 0 H PHE A 280 4.303 -4.944 -5.703 1.00 0.00 H new ATOM 0 HA PHE A 280 4.342 -2.306 -4.997 1.00 0.00 H new ATOM 0 HB2 PHE A 280 2.527 -4.091 -6.076 1.00 0.00 H new ATOM 0 HB3 PHE A 280 1.745 -3.663 -4.567 1.00 0.00 H new ATOM 0 HD1 PHE A 280 3.085 -2.299 -7.735 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.791 -1.491 -4.238 1.00 0.00 H new ATOM 0 HE1 PHE A 280 2.297 -0.201 -8.740 1.00 0.00 H new ATOM 0 HE2 PHE A 280 0.003 0.609 -5.238 1.00 0.00 H new ATOM 0 HZ PHE A 280 0.753 1.258 -7.492 1.00 0.00 H new ATOM 852 N ILE A 281 3.193 -4.149 -2.494 1.00 0.00 N ATOM 853 CA ILE A 281 2.987 -4.158 -1.052 1.00 0.00 C ATOM 854 C ILE A 281 4.320 -4.123 -0.318 1.00 0.00 C ATOM 855 O ILE A 281 4.415 -3.614 0.799 1.00 0.00 O ATOM 856 CB ILE A 281 2.192 -5.396 -0.596 1.00 0.00 C ATOM 857 CG1 ILE A 281 0.974 -5.611 -1.496 1.00 0.00 C ATOM 858 CG2 ILE A 281 1.763 -5.242 0.855 1.00 0.00 C ATOM 859 CD1 ILE A 281 0.324 -6.967 -1.322 1.00 0.00 C ATOM 0 H ILE A 281 2.943 -5.020 -2.962 1.00 0.00 H new ATOM 0 HA ILE A 281 2.410 -3.266 -0.808 1.00 0.00 H new ATOM 0 HB ILE A 281 2.836 -6.272 -0.676 1.00 0.00 H new ATOM 0 HG12 ILE A 281 0.237 -4.835 -1.288 1.00 0.00 H new ATOM 0 HG13 ILE A 281 1.276 -5.493 -2.537 1.00 0.00 H new ATOM 0 HG21 ILE A 281 1.202 -6.124 1.164 1.00 0.00 H new ATOM 0 HG22 ILE A 281 2.645 -5.134 1.486 1.00 0.00 H new ATOM 0 HG23 ILE A 281 1.134 -4.358 0.956 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -0.532 -7.049 -1.991 1.00 0.00 H new ATOM 0 HD12 ILE A 281 1.045 -7.749 -1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -0.010 -7.081 -0.291 1.00 0.00 H new ATOM 871 N GLN A 282 5.352 -4.663 -0.957 1.00 0.00 N ATOM 872 CA GLN A 282 6.685 -4.689 -0.368 1.00 0.00 C ATOM 873 C GLN A 282 7.112 -3.285 0.044 1.00 0.00 C ATOM 874 O GLN A 282 7.609 -3.075 1.152 1.00 0.00 O ATOM 875 CB GLN A 282 7.695 -5.273 -1.358 1.00 0.00 C ATOM 876 CG GLN A 282 8.409 -6.510 -0.838 1.00 0.00 C ATOM 877 CD GLN A 282 9.342 -7.120 -1.867 1.00 0.00 C ATOM 878 OE1 GLN A 282 8.998 -7.236 -3.043 1.00 0.00 O ATOM 879 NE2 GLN A 282 10.532 -7.513 -1.426 1.00 0.00 N ATOM 0 H GLN A 282 5.291 -5.088 -1.882 1.00 0.00 H new ATOM 0 HA GLN A 282 6.656 -5.322 0.519 1.00 0.00 H new ATOM 0 HB2 GLN A 282 7.180 -5.524 -2.285 1.00 0.00 H new ATOM 0 HB3 GLN A 282 8.436 -4.511 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 282 8.979 -6.248 0.054 1.00 0.00 H new ATOM 0 HG3 GLN A 282 7.670 -7.253 -0.538 1.00 0.00 H new ATOM 0 HE21 GLN A 282 10.775 -7.397 -0.442 1.00 0.00 H new ATOM 0 HE22 GLN A 282 11.203 -7.930 -2.071 1.00 0.00 H new ATOM 888 N MET A 283 6.905 -2.326 -0.852 1.00 0.00 N ATOM 889 CA MET A 283 7.259 -0.939 -0.582 1.00 0.00 C ATOM 890 C MET A 283 6.227 -0.294 0.337 1.00 0.00 C ATOM 891 O MET A 283 6.573 0.457 1.246 1.00 0.00 O ATOM 892 CB MET A 283 7.360 -0.151 -1.889 1.00 0.00 C ATOM 893 CG MET A 283 8.523 -0.579 -2.768 1.00 0.00 C ATOM 894 SD MET A 283 8.467 0.171 -4.408 1.00 0.00 S ATOM 895 CE MET A 283 10.066 0.975 -4.468 1.00 0.00 C ATOM 0 H MET A 283 6.494 -2.485 -1.772 1.00 0.00 H new ATOM 0 HA MET A 283 8.229 -0.923 -0.085 1.00 0.00 H new ATOM 0 HB2 MET A 283 6.431 -0.268 -2.447 1.00 0.00 H new ATOM 0 HB3 MET A 283 7.461 0.909 -1.658 1.00 0.00 H new ATOM 0 HG2 MET A 283 9.460 -0.309 -2.281 1.00 0.00 H new ATOM 0 HG3 MET A 283 8.517 -1.664 -2.869 1.00 0.00 H new ATOM 0 HE1 MET A 283 10.181 1.484 -5.425 1.00 0.00 H new ATOM 0 HE2 MET A 283 10.138 1.702 -3.659 1.00 0.00 H new ATOM 0 HE3 MET A 283 10.853 0.229 -4.357 1.00 0.00 H new ATOM 905 N LEU A 284 4.957 -0.602 0.096 1.00 0.00 N ATOM 906 CA LEU A 284 3.871 -0.062 0.904 1.00 0.00 C ATOM 907 C LEU A 284 4.266 -0.029 2.375 1.00 0.00 C ATOM 908 O LEU A 284 3.840 0.851 3.124 1.00 0.00 O ATOM 909 CB LEU A 284 2.607 -0.904 0.719 1.00 0.00 C ATOM 910 CG LEU A 284 1.294 -0.168 0.988 1.00 0.00 C ATOM 911 CD1 LEU A 284 1.182 0.198 2.460 1.00 0.00 C ATOM 912 CD2 LEU A 284 1.191 1.072 0.114 1.00 0.00 C ATOM 0 H LEU A 284 4.655 -1.224 -0.654 1.00 0.00 H new ATOM 0 HA LEU A 284 3.669 0.957 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 284 2.589 -1.286 -0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 284 2.664 -1.768 1.381 1.00 0.00 H new ATOM 0 HG LEU A 284 0.466 -0.831 0.737 1.00 0.00 H new ATOM 0 HD11 LEU A 284 0.242 0.721 2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 284 1.210 -0.709 3.064 1.00 0.00 H new ATOM 0 HD13 LEU A 284 2.014 0.845 2.738 1.00 0.00 H new ATOM 0 HD21 LEU A 284 0.251 1.584 0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 284 2.023 1.741 0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 284 1.225 0.781 -0.936 1.00 0.00 H new ATOM 924 N ASN A 285 5.086 -0.991 2.779 1.00 0.00 N ATOM 925 CA ASN A 285 5.549 -1.075 4.157 1.00 0.00 C ATOM 926 C ASN A 285 6.853 -0.304 4.328 1.00 0.00 C ATOM 927 O ASN A 285 7.731 -0.715 5.087 1.00 0.00 O ATOM 928 CB ASN A 285 5.746 -2.535 4.565 1.00 0.00 C ATOM 929 CG ASN A 285 5.393 -2.782 6.018 1.00 0.00 C ATOM 930 OD1 ASN A 285 4.342 -3.343 6.328 1.00 0.00 O ATOM 931 ND2 ASN A 285 6.273 -2.363 6.921 1.00 0.00 N ATOM 0 H ASN A 285 5.445 -1.726 2.169 1.00 0.00 H new ATOM 0 HA ASN A 285 4.791 -0.630 4.802 1.00 0.00 H new ATOM 0 HB2 ASN A 285 5.130 -3.173 3.931 1.00 0.00 H new ATOM 0 HB3 ASN A 285 6.784 -2.821 4.392 1.00 0.00 H new ATOM 0 HD21 ASN A 285 6.090 -2.502 7.915 1.00 0.00 H new ATOM 0 HD22 ASN A 285 7.132 -1.902 6.621 1.00 0.00 H new ATOM 938 N GLU A 286 6.965 0.812 3.609 1.00 0.00 N ATOM 939 CA GLU A 286 8.158 1.658 3.660 1.00 0.00 C ATOM 940 C GLU A 286 8.859 1.552 5.011 1.00 0.00 C ATOM 941 O GLU A 286 8.218 1.602 6.062 1.00 0.00 O ATOM 942 CB GLU A 286 7.781 3.115 3.386 1.00 0.00 C ATOM 943 CG GLU A 286 8.981 4.028 3.188 1.00 0.00 C ATOM 944 CD GLU A 286 9.835 4.147 4.435 1.00 0.00 C ATOM 945 OE1 GLU A 286 9.265 4.159 5.546 1.00 0.00 O ATOM 946 OE2 GLU A 286 11.074 4.229 4.300 1.00 0.00 O ATOM 0 H GLU A 286 6.239 1.154 2.980 1.00 0.00 H new ATOM 0 HA GLU A 286 8.847 1.309 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 286 7.152 3.158 2.497 1.00 0.00 H new ATOM 0 HB3 GLU A 286 7.184 3.489 4.217 1.00 0.00 H new ATOM 0 HG2 GLU A 286 9.591 3.647 2.369 1.00 0.00 H new ATOM 0 HG3 GLU A 286 8.635 5.019 2.893 1.00 0.00 H new ATOM 953 N PRO A 287 10.191 1.400 4.995 1.00 0.00 N ATOM 954 CA PRO A 287 10.992 1.284 6.218 1.00 0.00 C ATOM 955 C PRO A 287 10.982 2.567 7.042 1.00 0.00 C ATOM 956 O PRO A 287 11.425 3.618 6.579 1.00 0.00 O ATOM 957 CB PRO A 287 12.403 0.991 5.698 1.00 0.00 C ATOM 958 CG PRO A 287 12.415 1.521 4.306 1.00 0.00 C ATOM 959 CD PRO A 287 11.021 1.332 3.781 1.00 0.00 C ATOM 0 HA PRO A 287 10.604 0.515 6.886 1.00 0.00 H new ATOM 0 HB2 PRO A 287 13.160 1.478 6.313 1.00 0.00 H new ATOM 0 HB3 PRO A 287 12.617 -0.078 5.716 1.00 0.00 H new ATOM 0 HG2 PRO A 287 12.698 2.573 4.291 1.00 0.00 H new ATOM 0 HG3 PRO A 287 13.140 0.987 3.691 1.00 0.00 H new ATOM 0 HD2 PRO A 287 10.752 2.109 3.065 1.00 0.00 H new ATOM 0 HD3 PRO A 287 10.910 0.376 3.270 1.00 0.00 H new ATOM 967 N PRO A 288 10.472 2.494 8.280 1.00 0.00 N ATOM 968 CA PRO A 288 10.402 3.650 9.178 1.00 0.00 C ATOM 969 C PRO A 288 11.743 4.362 9.311 1.00 0.00 C ATOM 970 O PRO A 288 12.666 3.858 9.951 1.00 0.00 O ATOM 971 CB PRO A 288 9.990 3.035 10.517 1.00 0.00 C ATOM 972 CG PRO A 288 9.267 1.785 10.153 1.00 0.00 C ATOM 973 CD PRO A 288 9.926 1.274 8.901 1.00 0.00 C ATOM 0 HA PRO A 288 9.711 4.409 8.811 1.00 0.00 H new ATOM 0 HB2 PRO A 288 10.859 2.823 11.139 1.00 0.00 H new ATOM 0 HB3 PRO A 288 9.350 3.712 11.083 1.00 0.00 H new ATOM 0 HG2 PRO A 288 9.331 1.050 10.955 1.00 0.00 H new ATOM 0 HG3 PRO A 288 8.208 1.982 9.984 1.00 0.00 H new ATOM 0 HD2 PRO A 288 10.711 0.552 9.126 1.00 0.00 H new ATOM 0 HD3 PRO A 288 9.212 0.775 8.246 1.00 0.00 H new TER 981 PRO A 288