USER MOD reduce.3.24.130724 H: found=0, std=0, add=762, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 760 hydrogens (6 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 NoAdj-H: A 341 AZH HN2 : A 341 AZH N : A 340 PHE C :(H bumps) USER MOD Set 1.1: A 320 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 321 THR OG1 : rot 180:sc= 0 USER MOD Single : A 317 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.24) USER MOD Single : A 326 ASN : amide:sc= -0.451 K(o=-0.45,f=-2.6!) USER MOD Single : A 339 SER OG : rot 180:sc= -0.138 USER MOD Single : A 341 AZH NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 SER OG : rot -160:sc= -0.468 USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 358 GLN :FLIP amide:sc= -4.5! C(o=-5.2!,f=-4.5!) USER MOD Single : A 361 SER OG : rot -177:sc= -3.33! USER MOD Single : A 363 ASN : amide:sc= -5.93! C(o=-5.9!,f=-11!) USER MOD Single : A 369 ASN : amide:sc= -0.0685 K(o=-0.068,f=-1.5!) USER MOD Single : A 371 SER OG : rot 180:sc= 0.0582 USER MOD Single : A 372 HIS : no HD1:sc= 0.551 K(o=0.55,f=-1.8!) USER MOD Single : A 374 GLN : amide:sc= -1.61 X(o=-1.6,f=-2.1) USER MOD Single : A 380 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 384 GLN : amide:sc= -0.0197 X(o=-0.02,f=0) USER MOD Single : A 385 THR OG1 : rot -14:sc= 0.636 USER MOD Single : A 387 THR OG1 : rot 50:sc= 0.442 USER MOD Single : A 391 GLN : amide:sc= -2.6 K(o=-2.6,f=-4.3!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 LYS NZ :NH3+ -166:sc= -0.847 (180deg=-1.14) USER MOD Single : A 397 TYR OH : rot 180:sc= 0 USER MOD Single : A 398 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 301 0.613 4.274 -6.696 1.00 72.53 N ATOM 2 CA PHE A 301 2.033 3.945 -6.730 1.00 21.15 C ATOM 3 C PHE A 301 2.436 3.146 -5.495 1.00 43.23 C ATOM 4 O PHE A 301 3.162 2.156 -5.591 1.00 1.32 O ATOM 5 CB PHE A 301 2.872 5.221 -6.822 1.00 3.41 C ATOM 6 CG PHE A 301 3.028 5.737 -8.224 1.00 14.35 C ATOM 7 CD1 PHE A 301 2.048 6.531 -8.797 1.00 60.43 C ATOM 8 CD2 PHE A 301 4.153 5.426 -8.970 1.00 14.25 C ATOM 9 CE1 PHE A 301 2.188 7.007 -10.087 1.00 5.42 C ATOM 10 CE2 PHE A 301 4.299 5.899 -10.260 1.00 51.51 C ATOM 11 CZ PHE A 301 3.315 6.690 -10.820 1.00 31.11 C ATOM 0 HA PHE A 301 2.217 3.333 -7.613 1.00 21.15 H new ATOM 0 HB2 PHE A 301 2.411 5.995 -6.208 1.00 3.41 H new ATOM 0 HB3 PHE A 301 3.859 5.028 -6.403 1.00 3.41 H new ATOM 0 HD1 PHE A 301 1.164 6.781 -8.229 1.00 60.43 H new ATOM 0 HD2 PHE A 301 4.925 4.806 -8.538 1.00 14.25 H new ATOM 0 HE1 PHE A 301 1.417 7.626 -10.521 1.00 5.42 H new ATOM 0 HE2 PHE A 301 5.182 5.650 -10.830 1.00 51.51 H new ATOM 0 HZ PHE A 301 3.426 7.060 -11.829 1.00 31.11 H new ATOM 21 N LEU A 302 1.960 3.582 -4.334 1.00 31.32 N ATOM 22 CA LEU A 302 2.270 2.909 -3.077 1.00 2.43 C ATOM 23 C LEU A 302 0.994 2.535 -2.331 1.00 4.33 C ATOM 24 O LEU A 302 -0.078 3.073 -2.604 1.00 13.12 O ATOM 25 CB LEU A 302 3.145 3.804 -2.198 1.00 30.21 C ATOM 26 CG LEU A 302 4.647 3.764 -2.485 1.00 34.55 C ATOM 27 CD1 LEU A 302 5.199 2.366 -2.248 1.00 51.52 C ATOM 28 CD2 LEU A 302 4.931 4.216 -3.911 1.00 21.25 C ATOM 0 H LEU A 302 1.357 4.399 -4.237 1.00 31.32 H new ATOM 0 HA LEU A 302 2.815 1.994 -3.308 1.00 2.43 H new ATOM 0 HB2 LEU A 302 2.802 4.833 -2.306 1.00 30.21 H new ATOM 0 HB3 LEU A 302 2.987 3.523 -1.157 1.00 30.21 H new ATOM 0 HG LEU A 302 5.146 4.451 -1.801 1.00 34.55 H new ATOM 0 HD11 LEU A 302 6.269 2.357 -2.457 1.00 51.52 H new ATOM 0 HD12 LEU A 302 5.030 2.079 -1.210 1.00 51.52 H new ATOM 0 HD13 LEU A 302 4.694 1.659 -2.907 1.00 51.52 H new ATOM 0 HD21 LEU A 302 6.004 4.181 -4.097 1.00 21.25 H new ATOM 0 HD22 LEU A 302 4.420 3.555 -4.611 1.00 21.25 H new ATOM 0 HD23 LEU A 302 4.572 5.236 -4.048 1.00 21.25 H new ATOM 40 N GLY A 303 1.118 1.611 -1.383 1.00 1.21 N ATOM 41 CA GLY A 303 -0.033 1.183 -0.609 1.00 22.04 C ATOM 42 C GLY A 303 0.140 1.437 0.875 1.00 53.15 C ATOM 43 O GLY A 303 -0.386 2.413 1.409 1.00 32.33 O ATOM 0 H GLY A 303 1.995 1.151 -1.137 1.00 1.21 H new ATOM 0 HA2 GLY A 303 -0.921 1.707 -0.963 1.00 22.04 H new ATOM 0 HA3 GLY A 303 -0.204 0.119 -0.775 1.00 22.04 H new ATOM 47 N GLU A 304 0.876 0.554 1.543 1.00 5.50 N ATOM 48 CA GLU A 304 1.113 0.688 2.976 1.00 71.23 C ATOM 49 C GLU A 304 2.129 -0.345 3.458 1.00 1.45 C ATOM 50 O GLU A 304 2.665 -1.120 2.665 1.00 15.22 O ATOM 51 CB GLU A 304 -0.197 0.528 3.750 1.00 12.11 C ATOM 52 CG GLU A 304 -1.044 -0.642 3.277 1.00 54.44 C ATOM 53 CD GLU A 304 -2.257 -0.877 4.157 1.00 32.23 C ATOM 54 OE1 GLU A 304 -2.963 -1.883 3.938 1.00 41.30 O ATOM 55 OE2 GLU A 304 -2.499 -0.054 5.065 1.00 11.04 O1- ATOM 0 H GLU A 304 1.318 -0.260 1.116 1.00 5.50 H new ATOM 0 HA GLU A 304 1.516 1.684 3.160 1.00 71.23 H new ATOM 0 HB2 GLU A 304 0.030 0.397 4.808 1.00 12.11 H new ATOM 0 HB3 GLU A 304 -0.777 1.446 3.659 1.00 12.11 H new ATOM 0 HG2 GLU A 304 -1.372 -0.458 2.254 1.00 54.44 H new ATOM 0 HG3 GLU A 304 -0.433 -1.544 3.259 1.00 54.44 H new ATOM 62 N GLU A 305 2.390 -0.346 4.761 1.00 4.34 N ATOM 63 CA GLU A 305 3.343 -1.281 5.347 1.00 73.11 C ATOM 64 C GLU A 305 3.144 -1.386 6.856 1.00 22.04 C ATOM 65 O GLU A 305 2.370 -0.630 7.445 1.00 50.04 O ATOM 66 CB GLU A 305 4.777 -0.843 5.040 1.00 25.12 C ATOM 67 CG GLU A 305 5.332 -1.435 3.756 1.00 74.14 C ATOM 68 CD GLU A 305 6.848 -1.420 3.714 1.00 63.31 C ATOM 69 OE1 GLU A 305 7.455 -2.502 3.861 1.00 34.11 O ATOM 70 OE2 GLU A 305 7.427 -0.328 3.536 1.00 5.44 O1- ATOM 0 H GLU A 305 1.956 0.289 5.430 1.00 4.34 H new ATOM 0 HA GLU A 305 3.168 -2.262 4.905 1.00 73.11 H new ATOM 0 HB2 GLU A 305 4.809 0.244 4.973 1.00 25.12 H new ATOM 0 HB3 GLU A 305 5.421 -1.130 5.871 1.00 25.12 H new ATOM 0 HG2 GLU A 305 4.980 -2.461 3.651 1.00 74.14 H new ATOM 0 HG3 GLU A 305 4.943 -0.876 2.905 1.00 74.14 H new ATOM 77 N ASP A 306 3.847 -2.328 7.476 1.00 12.31 N ATOM 78 CA ASP A 306 3.749 -2.533 8.916 1.00 0.04 C ATOM 79 C ASP A 306 4.654 -1.559 9.666 1.00 4.53 C ATOM 80 O ASP A 306 5.511 -1.972 10.449 1.00 53.15 O ATOM 81 CB ASP A 306 4.118 -3.972 9.275 1.00 34.52 C ATOM 82 CG ASP A 306 2.989 -4.946 9.003 1.00 60.34 C ATOM 83 OD1 ASP A 306 2.352 -5.404 9.976 1.00 34.53 O ATOM 84 OD2 ASP A 306 2.738 -5.248 7.818 1.00 31.24 O1- ATOM 0 H ASP A 306 4.491 -2.962 7.003 1.00 12.31 H new ATOM 0 HA ASP A 306 2.718 -2.347 9.215 1.00 0.04 H new ATOM 0 HB2 ASP A 306 4.997 -4.271 8.704 1.00 34.52 H new ATOM 0 HB3 ASP A 306 4.390 -4.022 10.329 1.00 34.52 H new ATOM 89 N ILE A 307 4.458 -0.269 9.421 1.00 74.43 N ATOM 90 CA ILE A 307 5.256 0.762 10.073 1.00 30.41 C ATOM 91 C ILE A 307 4.762 2.156 9.702 1.00 24.23 C ATOM 92 O ILE A 307 4.550 2.476 8.532 1.00 72.11 O ATOM 93 CB ILE A 307 6.745 0.640 9.700 1.00 71.05 C ATOM 94 CG1 ILE A 307 7.580 1.627 10.519 1.00 11.13 C ATOM 95 CG2 ILE A 307 6.940 0.882 8.211 1.00 31.35 C ATOM 96 CD1 ILE A 307 8.047 1.068 11.845 1.00 60.33 C ATOM 0 H ILE A 307 3.753 0.088 8.776 1.00 74.43 H new ATOM 0 HA ILE A 307 5.146 0.615 11.147 1.00 30.41 H new ATOM 0 HB ILE A 307 7.081 -0.371 9.931 1.00 71.05 H new ATOM 0 HG12 ILE A 307 8.449 1.928 9.934 1.00 11.13 H new ATOM 0 HG13 ILE A 307 6.991 2.526 10.700 1.00 11.13 H new ATOM 0 HG21 ILE A 307 7.998 0.792 7.963 1.00 31.35 H new ATOM 0 HG22 ILE A 307 6.371 0.145 7.645 1.00 31.35 H new ATOM 0 HG23 ILE A 307 6.591 1.883 7.956 1.00 31.35 H new ATOM 0 HD11 ILE A 307 8.633 1.822 12.372 1.00 60.33 H new ATOM 0 HD12 ILE A 307 7.182 0.793 12.449 1.00 60.33 H new ATOM 0 HD13 ILE A 307 8.663 0.186 11.671 1.00 60.33 H new ATOM 108 N PRO A 308 4.577 3.009 10.721 1.00 21.42 N ATOM 109 CA PRO A 308 4.109 4.385 10.527 1.00 72.42 C ATOM 110 C PRO A 308 5.157 5.263 9.853 1.00 30.13 C ATOM 111 O PRO A 308 5.794 6.095 10.500 1.00 23.10 O ATOM 112 CB PRO A 308 3.840 4.872 11.952 1.00 13.44 C ATOM 113 CG PRO A 308 4.726 4.040 12.812 1.00 1.02 C ATOM 114 CD PRO A 308 4.811 2.696 12.141 1.00 0.13 C ATOM 0 HA PRO A 308 3.237 4.431 9.875 1.00 72.42 H new ATOM 0 HB2 PRO A 308 4.069 5.932 12.057 1.00 13.44 H new ATOM 0 HB3 PRO A 308 2.792 4.744 12.223 1.00 13.44 H new ATOM 0 HG2 PRO A 308 5.713 4.492 12.907 1.00 1.02 H new ATOM 0 HG3 PRO A 308 4.319 3.948 13.819 1.00 1.02 H new ATOM 0 HD2 PRO A 308 5.785 2.231 12.295 1.00 0.13 H new ATOM 0 HD3 PRO A 308 4.063 2.005 12.529 1.00 0.13 H new ATOM 122 N ARG A 309 5.331 5.075 8.549 1.00 25.12 N ATOM 123 CA ARG A 309 6.304 5.851 7.787 1.00 12.43 C ATOM 124 C ARG A 309 5.705 6.325 6.466 1.00 12.01 C ATOM 125 O ARG A 309 6.209 5.998 5.393 1.00 52.10 O ATOM 126 CB ARG A 309 7.557 5.016 7.520 1.00 1.03 C ATOM 127 CG ARG A 309 8.175 4.426 8.777 1.00 51.05 C ATOM 128 CD ARG A 309 9.188 5.374 9.400 1.00 43.32 C ATOM 129 NE ARG A 309 10.557 5.038 9.021 1.00 11.10 N ATOM 130 CZ ARG A 309 11.625 5.407 9.720 1.00 51.43 C ATOM 131 NH1 ARG A 309 11.481 6.121 10.829 1.00 34.12 N1+ ATOM 132 NH2 ARG A 309 12.839 5.062 9.312 1.00 12.41 N ATOM 0 H ARG A 309 4.811 4.392 7.997 1.00 25.12 H new ATOM 0 HA ARG A 309 6.577 6.725 8.378 1.00 12.43 H new ATOM 0 HB2 ARG A 309 7.305 4.207 6.835 1.00 1.03 H new ATOM 0 HB3 ARG A 309 8.298 5.638 7.019 1.00 1.03 H new ATOM 0 HG2 ARG A 309 7.390 4.205 9.500 1.00 51.05 H new ATOM 0 HG3 ARG A 309 8.661 3.481 8.535 1.00 51.05 H new ATOM 0 HD2 ARG A 309 8.967 6.395 9.091 1.00 43.32 H new ATOM 0 HD3 ARG A 309 9.094 5.342 10.485 1.00 43.32 H new ATOM 0 HE ARG A 309 10.702 4.490 8.173 1.00 11.10 H new ATOM 0 HH11 ARG A 309 10.549 6.388 11.146 1.00 34.12 H new ATOM 0 HH12 ARG A 309 12.302 6.403 11.364 1.00 34.12 H new ATOM 0 HH21 ARG A 309 12.954 4.513 8.460 1.00 12.41 H new ATOM 0 HH22 ARG A 309 13.658 5.346 9.850 1.00 12.41 H new ATOM 146 N GLU A 310 4.628 7.100 6.555 1.00 11.14 N ATOM 147 CA GLU A 310 3.961 7.618 5.366 1.00 40.13 C ATOM 148 C GLU A 310 4.653 8.880 4.861 1.00 13.32 C ATOM 149 O GLU A 310 5.290 9.614 5.617 1.00 4.03 O ATOM 150 CB GLU A 310 2.491 7.916 5.669 1.00 64.21 C ATOM 151 CG GLU A 310 2.292 8.949 6.765 1.00 34.43 C ATOM 152 CD GLU A 310 1.021 8.719 7.560 1.00 1.43 C ATOM 153 OE1 GLU A 310 0.684 7.545 7.816 1.00 31.20 O ATOM 154 OE2 GLU A 310 0.362 9.716 7.924 1.00 74.01 O1- ATOM 0 H GLU A 310 4.200 7.382 7.437 1.00 11.14 H new ATOM 0 HA GLU A 310 4.018 6.857 4.588 1.00 40.13 H new ATOM 0 HB2 GLU A 310 2.005 8.267 4.758 1.00 64.21 H new ATOM 0 HB3 GLU A 310 1.994 6.990 5.959 1.00 64.21 H new ATOM 0 HG2 GLU A 310 3.147 8.926 7.440 1.00 34.43 H new ATOM 0 HG3 GLU A 310 2.263 9.944 6.321 1.00 34.43 H new ATOM 161 N PRO A 311 4.528 9.139 3.551 1.00 23.33 N ATOM 162 CA PRO A 311 5.135 10.311 2.914 1.00 11.24 C ATOM 163 C PRO A 311 4.462 11.613 3.336 1.00 75.02 C ATOM 164 O PRO A 311 3.316 11.613 3.785 1.00 3.11 O ATOM 165 CB PRO A 311 4.917 10.056 1.420 1.00 13.14 C ATOM 166 CG PRO A 311 3.724 9.167 1.358 1.00 53.03 C ATOM 167 CD PRO A 311 3.783 8.307 2.590 1.00 40.00 C ATOM 0 HA PRO A 311 6.182 10.429 3.192 1.00 11.24 H new ATOM 0 HB2 PRO A 311 4.745 10.987 0.880 1.00 13.14 H new ATOM 0 HB3 PRO A 311 5.788 9.582 0.968 1.00 13.14 H new ATOM 0 HG2 PRO A 311 2.804 9.750 1.333 1.00 53.03 H new ATOM 0 HG3 PRO A 311 3.739 8.557 0.455 1.00 53.03 H new ATOM 0 HD2 PRO A 311 2.786 8.063 2.958 1.00 40.00 H new ATOM 0 HD3 PRO A 311 4.292 7.363 2.397 1.00 40.00 H new ATOM 175 N ARG A 312 5.180 12.721 3.186 1.00 61.33 N ATOM 176 CA ARG A 312 4.653 14.030 3.551 1.00 65.13 C ATOM 177 C ARG A 312 5.268 15.126 2.686 1.00 34.14 C ATOM 178 O ARG A 312 6.477 15.354 2.723 1.00 42.20 O ATOM 179 CB ARG A 312 4.925 14.318 5.029 1.00 62.32 C ATOM 180 CG ARG A 312 4.557 15.731 5.451 1.00 71.50 C ATOM 181 CD ARG A 312 4.724 15.926 6.950 1.00 52.51 C ATOM 182 NE ARG A 312 4.159 17.192 7.405 1.00 34.31 N ATOM 183 CZ ARG A 312 3.816 17.435 8.665 1.00 20.31 C ATOM 184 NH1 ARG A 312 3.981 16.501 9.591 1.00 13.53 N1+ ATOM 185 NH2 ARG A 312 3.307 18.613 9.001 1.00 35.04 N ATOM 0 H ARG A 312 6.129 12.738 2.814 1.00 61.33 H new ATOM 0 HA ARG A 312 3.576 14.020 3.381 1.00 65.13 H new ATOM 0 HB2 ARG A 312 4.365 13.608 5.638 1.00 62.32 H new ATOM 0 HB3 ARG A 312 5.982 14.150 5.235 1.00 62.32 H new ATOM 0 HG2 ARG A 312 5.184 16.446 4.918 1.00 71.50 H new ATOM 0 HG3 ARG A 312 3.525 15.939 5.169 1.00 71.50 H new ATOM 0 HD2 ARG A 312 4.242 15.104 7.478 1.00 52.51 H new ATOM 0 HD3 ARG A 312 5.783 15.890 7.204 1.00 52.51 H new ATOM 0 HE ARG A 312 4.020 17.932 6.717 1.00 34.31 H new ATOM 0 HH11 ARG A 312 4.372 15.594 9.336 1.00 13.53 H new ATOM 0 HH12 ARG A 312 3.717 16.689 10.558 1.00 13.53 H new ATOM 0 HH21 ARG A 312 3.178 19.334 8.291 1.00 35.04 H new ATOM 0 HH22 ARG A 312 3.044 18.798 9.969 1.00 35.04 H new ATOM 199 N ARG A 313 4.428 15.799 1.909 1.00 22.33 N ATOM 200 CA ARG A 313 4.888 16.870 1.032 1.00 23.35 C ATOM 201 C ARG A 313 4.863 18.213 1.756 1.00 52.24 C ATOM 202 O ARG A 313 3.940 18.501 2.518 1.00 13.30 O ATOM 203 CB ARG A 313 4.019 16.939 -0.225 1.00 11.12 C ATOM 204 CG ARG A 313 3.500 15.586 -0.681 1.00 71.14 C ATOM 205 CD ARG A 313 3.404 15.507 -2.197 1.00 15.11 C ATOM 206 NE ARG A 313 2.206 16.170 -2.704 1.00 62.02 N ATOM 207 CZ ARG A 313 2.053 16.544 -3.970 1.00 31.34 C ATOM 208 NH1 ARG A 313 3.018 16.322 -4.852 1.00 41.44 N1+ ATOM 209 NH2 ARG A 313 0.933 17.142 -4.355 1.00 33.42 N ATOM 0 H ARG A 313 3.424 15.622 1.868 1.00 22.33 H new ATOM 0 HA ARG A 313 5.916 16.652 0.742 1.00 23.35 H new ATOM 0 HB2 ARG A 313 3.172 17.598 -0.035 1.00 11.12 H new ATOM 0 HB3 ARG A 313 4.598 17.388 -1.032 1.00 11.12 H new ATOM 0 HG2 ARG A 313 4.161 14.800 -0.316 1.00 71.14 H new ATOM 0 HG3 ARG A 313 2.518 15.406 -0.243 1.00 71.14 H new ATOM 0 HD2 ARG A 313 4.288 15.966 -2.641 1.00 15.11 H new ATOM 0 HD3 ARG A 313 3.398 14.462 -2.506 1.00 15.11 H new ATOM 0 HE ARG A 313 1.445 16.356 -2.051 1.00 62.02 H new ATOM 0 HH11 ARG A 313 3.881 15.863 -4.559 1.00 41.44 H new ATOM 0 HH12 ARG A 313 2.898 16.610 -5.823 1.00 41.44 H new ATOM 0 HH21 ARG A 313 0.189 17.315 -3.679 1.00 33.42 H new ATOM 0 HH22 ARG A 313 0.816 17.429 -5.327 1.00 33.42 H new ATOM 223 N ILE A 314 5.882 19.031 1.511 1.00 33.21 N ATOM 224 CA ILE A 314 5.976 20.343 2.138 1.00 40.53 C ATOM 225 C ILE A 314 5.810 21.456 1.110 1.00 21.34 C ATOM 226 O ILE A 314 6.550 21.525 0.128 1.00 73.33 O ATOM 227 CB ILE A 314 7.322 20.525 2.864 1.00 44.43 C ATOM 228 CG1 ILE A 314 7.627 19.304 3.733 1.00 61.03 C ATOM 229 CG2 ILE A 314 7.302 21.791 3.708 1.00 71.22 C ATOM 230 CD1 ILE A 314 6.551 19.004 4.753 1.00 71.22 C ATOM 0 H ILE A 314 6.654 18.808 0.883 1.00 33.21 H new ATOM 0 HA ILE A 314 5.169 20.403 2.868 1.00 40.53 H new ATOM 0 HB ILE A 314 8.110 20.622 2.117 1.00 44.43 H new ATOM 0 HG12 ILE A 314 7.759 18.434 3.090 1.00 61.03 H new ATOM 0 HG13 ILE A 314 8.573 19.464 4.251 1.00 61.03 H new ATOM 0 HG21 ILE A 314 8.260 21.906 4.215 1.00 71.22 H new ATOM 0 HG22 ILE A 314 7.126 22.654 3.066 1.00 71.22 H new ATOM 0 HG23 ILE A 314 6.506 21.722 4.449 1.00 71.22 H new ATOM 0 HD11 ILE A 314 6.834 18.126 5.333 1.00 71.22 H new ATOM 0 HD12 ILE A 314 6.434 19.858 5.421 1.00 71.22 H new ATOM 0 HD13 ILE A 314 5.608 18.812 4.241 1.00 71.22 H new ATOM 242 N VAL A 315 4.835 22.330 1.344 1.00 31.44 N ATOM 243 CA VAL A 315 4.574 23.444 0.439 1.00 40.55 C ATOM 244 C VAL A 315 5.555 24.586 0.676 1.00 12.11 C ATOM 245 O VAL A 315 5.713 25.059 1.802 1.00 32.30 O ATOM 246 CB VAL A 315 3.137 23.974 0.603 1.00 44.24 C ATOM 247 CG1 VAL A 315 2.898 24.437 2.032 1.00 25.10 C ATOM 248 CG2 VAL A 315 2.870 25.101 -0.383 1.00 1.35 C ATOM 0 H VAL A 315 4.214 22.288 2.152 1.00 31.44 H new ATOM 0 HA VAL A 315 4.701 23.065 -0.575 1.00 40.55 H new ATOM 0 HB VAL A 315 2.442 23.162 0.389 1.00 44.24 H new ATOM 0 HG11 VAL A 315 1.878 24.808 2.128 1.00 25.10 H new ATOM 0 HG12 VAL A 315 3.046 23.601 2.715 1.00 25.10 H new ATOM 0 HG13 VAL A 315 3.599 25.235 2.278 1.00 25.10 H new ATOM 0 HG21 VAL A 315 1.850 25.464 -0.254 1.00 1.35 H new ATOM 0 HG22 VAL A 315 3.571 25.916 -0.202 1.00 1.35 H new ATOM 0 HG23 VAL A 315 2.997 24.732 -1.401 1.00 1.35 H new ATOM 258 N ILE A 316 6.213 25.024 -0.392 1.00 54.32 N ATOM 259 CA ILE A 316 7.178 26.113 -0.301 1.00 55.43 C ATOM 260 C ILE A 316 7.032 27.076 -1.473 1.00 70.43 C ATOM 261 O ILE A 316 6.534 26.706 -2.537 1.00 42.24 O ATOM 262 CB ILE A 316 8.623 25.582 -0.263 1.00 34.42 C ATOM 263 CG1 ILE A 316 8.732 24.401 0.704 1.00 73.45 C ATOM 264 CG2 ILE A 316 9.585 26.691 0.135 1.00 33.44 C ATOM 265 CD1 ILE A 316 10.105 23.769 0.736 1.00 54.32 C ATOM 0 H ILE A 316 6.096 24.642 -1.330 1.00 54.32 H new ATOM 0 HA ILE A 316 6.970 26.643 0.629 1.00 55.43 H new ATOM 0 HB ILE A 316 8.892 25.235 -1.261 1.00 34.42 H new ATOM 0 HG12 ILE A 316 8.473 24.739 1.708 1.00 73.45 H new ATOM 0 HG13 ILE A 316 7.999 23.644 0.424 1.00 73.45 H new ATOM 0 HG21 ILE A 316 10.602 26.300 0.157 1.00 33.44 H new ATOM 0 HG22 ILE A 316 9.524 27.503 -0.590 1.00 33.44 H new ATOM 0 HG23 ILE A 316 9.319 27.066 1.123 1.00 33.44 H new ATOM 0 HD11 ILE A 316 10.107 22.939 1.443 1.00 54.32 H new ATOM 0 HD12 ILE A 316 10.359 23.400 -0.258 1.00 54.32 H new ATOM 0 HD13 ILE A 316 10.840 24.512 1.046 1.00 54.32 H new ATOM 277 N HIS A 317 7.473 28.314 -1.272 1.00 51.30 N ATOM 278 CA HIS A 317 7.394 29.332 -2.314 1.00 43.21 C ATOM 279 C HIS A 317 8.314 28.987 -3.482 1.00 13.34 C ATOM 280 O HIS A 317 9.093 28.036 -3.411 1.00 63.44 O ATOM 281 CB HIS A 317 7.764 30.703 -1.747 1.00 41.34 C ATOM 282 CG HIS A 317 7.078 31.841 -2.437 1.00 52.43 C ATOM 283 ND1 HIS A 317 7.742 32.742 -3.243 1.00 2.41 N ATOM 284 CD2 HIS A 317 5.779 32.222 -2.440 1.00 21.05 C ATOM 285 CE1 HIS A 317 6.881 33.629 -3.710 1.00 43.42 C ATOM 286 NE2 HIS A 317 5.683 33.335 -3.238 1.00 50.44 N ATOM 0 H HIS A 317 7.888 28.636 -0.398 1.00 51.30 H new ATOM 0 HA HIS A 317 6.367 29.363 -2.679 1.00 43.21 H new ATOM 0 HB2 HIS A 317 7.514 30.728 -0.686 1.00 41.34 H new ATOM 0 HB3 HIS A 317 8.843 30.840 -1.823 1.00 41.34 H new ATOM 0 HD2 HIS A 317 4.969 31.740 -1.913 1.00 21.05 H new ATOM 0 HE1 HIS A 317 7.117 34.454 -4.366 1.00 43.42 H new ATOM 0 HE2 HIS A 317 4.825 33.851 -3.435 1.00 50.44 H new ATOM 294 N ARG A 318 8.219 29.765 -4.555 1.00 45.32 N ATOM 295 CA ARG A 318 9.040 29.540 -5.738 1.00 11.31 C ATOM 296 C ARG A 318 10.502 29.329 -5.353 1.00 1.25 C ATOM 297 O ARG A 318 11.129 30.202 -4.755 1.00 61.32 O ATOM 298 CB ARG A 318 8.921 30.723 -6.700 1.00 33.22 C ATOM 299 CG ARG A 318 9.894 30.660 -7.867 1.00 11.42 C ATOM 300 CD ARG A 318 9.804 31.904 -8.736 1.00 63.51 C ATOM 301 NE ARG A 318 10.420 33.064 -8.096 1.00 71.10 N ATOM 302 CZ ARG A 318 10.164 34.319 -8.446 1.00 33.32 C ATOM 303 NH1 ARG A 318 9.307 34.576 -9.425 1.00 12.41 N1+ ATOM 304 NH2 ARG A 318 10.765 35.321 -7.817 1.00 25.43 N ATOM 0 H ARG A 318 7.581 30.557 -4.629 1.00 45.32 H new ATOM 0 HA ARG A 318 8.679 28.639 -6.234 1.00 11.31 H new ATOM 0 HB2 ARG A 318 7.903 30.764 -7.088 1.00 33.22 H new ATOM 0 HB3 ARG A 318 9.089 31.648 -6.148 1.00 33.22 H new ATOM 0 HG2 ARG A 318 10.911 30.552 -7.489 1.00 11.42 H new ATOM 0 HG3 ARG A 318 9.683 29.777 -8.471 1.00 11.42 H new ATOM 0 HD2 ARG A 318 10.293 31.715 -9.692 1.00 63.51 H new ATOM 0 HD3 ARG A 318 8.758 32.121 -8.951 1.00 63.51 H new ATOM 0 HE ARG A 318 11.083 32.901 -7.339 1.00 71.10 H new ATOM 0 HH11 ARG A 318 8.843 33.809 -9.911 1.00 12.41 H new ATOM 0 HH12 ARG A 318 9.112 35.541 -9.692 1.00 12.41 H new ATOM 0 HH21 ARG A 318 11.425 35.128 -7.063 1.00 25.43 H new ATOM 0 HH22 ARG A 318 10.567 36.285 -8.087 1.00 25.43 H new ATOM 318 N GLY A 319 11.037 28.162 -5.699 1.00 2.41 N ATOM 319 CA GLY A 319 12.420 27.857 -5.381 1.00 4.11 C ATOM 320 C GLY A 319 13.249 27.568 -6.616 1.00 43.43 C ATOM 321 O GLY A 319 12.977 26.615 -7.345 1.00 74.24 O ATOM 0 H GLY A 319 10.538 27.423 -6.194 1.00 2.41 H new ATOM 0 HA2 GLY A 319 12.859 28.696 -4.841 1.00 4.11 H new ATOM 0 HA3 GLY A 319 12.455 26.995 -4.714 1.00 4.11 H new ATOM 325 N SER A 320 14.263 28.394 -6.853 1.00 0.31 N ATOM 326 CA SER A 320 15.131 28.225 -8.012 1.00 42.33 C ATOM 327 C SER A 320 16.356 27.387 -7.657 1.00 20.34 C ATOM 328 O SER A 320 16.795 26.544 -8.440 1.00 74.13 O ATOM 329 CB SER A 320 15.572 29.589 -8.549 1.00 43.33 C ATOM 330 OG SER A 320 16.237 30.340 -7.547 1.00 62.43 O ATOM 0 H SER A 320 14.503 29.187 -6.258 1.00 0.31 H new ATOM 0 HA SER A 320 14.566 27.703 -8.784 1.00 42.33 H new ATOM 0 HB2 SER A 320 16.234 29.450 -9.404 1.00 43.33 H new ATOM 0 HB3 SER A 320 14.703 30.142 -8.906 1.00 43.33 H new ATOM 0 HG SER A 320 16.510 31.206 -7.915 1.00 62.43 H new ATOM 336 N THR A 321 16.902 27.623 -6.469 1.00 23.22 N ATOM 337 CA THR A 321 18.076 26.892 -6.008 1.00 15.11 C ATOM 338 C THR A 321 17.818 26.231 -4.658 1.00 25.31 C ATOM 339 O THR A 321 18.672 25.522 -4.130 1.00 62.45 O ATOM 340 CB THR A 321 19.303 27.816 -5.888 1.00 41.23 C ATOM 341 OG1 THR A 321 19.212 28.876 -6.846 1.00 51.11 O ATOM 342 CG2 THR A 321 20.590 27.037 -6.107 1.00 70.02 C ATOM 0 H THR A 321 16.550 28.315 -5.808 1.00 23.22 H new ATOM 0 HA THR A 321 18.281 26.123 -6.753 1.00 15.11 H new ATOM 0 HB THR A 321 19.318 28.236 -4.882 1.00 41.23 H new ATOM 0 HG1 THR A 321 19.994 29.460 -6.763 1.00 51.11 H new ATOM 0 HG21 THR A 321 21.443 27.710 -6.017 1.00 70.02 H new ATOM 0 HG22 THR A 321 20.670 26.249 -5.358 1.00 70.02 H new ATOM 0 HG23 THR A 321 20.582 26.593 -7.102 1.00 70.02 H new ATOM 350 N GLY A 322 16.632 26.469 -4.105 1.00 65.43 N ATOM 351 CA GLY A 322 16.283 25.889 -2.822 1.00 14.41 C ATOM 352 C GLY A 322 17.329 26.160 -1.759 1.00 54.00 C ATOM 353 O GLY A 322 17.558 25.331 -0.877 1.00 54.15 O ATOM 0 H GLY A 322 15.908 27.053 -4.523 1.00 65.43 H new ATOM 0 HA2 GLY A 322 15.324 26.290 -2.494 1.00 14.41 H new ATOM 0 HA3 GLY A 322 16.156 24.812 -2.936 1.00 14.41 H new ATOM 357 N LEU A 323 17.967 27.322 -1.843 1.00 44.11 N ATOM 358 CA LEU A 323 18.997 27.700 -0.881 1.00 53.22 C ATOM 359 C LEU A 323 18.490 27.543 0.550 1.00 21.34 C ATOM 360 O LEU A 323 19.259 27.245 1.462 1.00 53.33 O ATOM 361 CB LEU A 323 19.442 29.143 -1.121 1.00 4.54 C ATOM 362 CG LEU A 323 20.890 29.470 -0.754 1.00 31.10 C ATOM 363 CD1 LEU A 323 21.818 29.158 -1.918 1.00 64.24 C ATOM 364 CD2 LEU A 323 21.021 30.929 -0.342 1.00 62.04 C ATOM 0 H LEU A 323 17.790 28.019 -2.567 1.00 44.11 H new ATOM 0 HA LEU A 323 19.850 27.036 -1.020 1.00 53.22 H new ATOM 0 HB2 LEU A 323 19.294 29.377 -2.175 1.00 4.54 H new ATOM 0 HB3 LEU A 323 18.787 29.803 -0.553 1.00 4.54 H new ATOM 0 HG LEU A 323 21.179 28.848 0.093 1.00 31.10 H new ATOM 0 HD11 LEU A 323 22.844 29.397 -1.639 1.00 64.24 H new ATOM 0 HD12 LEU A 323 21.746 28.099 -2.167 1.00 64.24 H new ATOM 0 HD13 LEU A 323 21.529 29.754 -2.784 1.00 64.24 H new ATOM 0 HD21 LEU A 323 22.058 31.143 -0.085 1.00 62.04 H new ATOM 0 HD22 LEU A 323 20.713 31.570 -1.168 1.00 62.04 H new ATOM 0 HD23 LEU A 323 20.386 31.121 0.522 1.00 62.04 H new ATOM 376 N GLY A 324 17.189 27.744 0.737 1.00 31.44 N ATOM 377 CA GLY A 324 16.601 27.619 2.058 1.00 71.03 C ATOM 378 C GLY A 324 16.983 26.320 2.740 1.00 75.42 C ATOM 379 O GLY A 324 17.099 26.265 3.965 1.00 21.33 O ATOM 0 H GLY A 324 16.532 27.991 -0.003 1.00 31.44 H new ATOM 0 HA2 GLY A 324 16.921 28.458 2.676 1.00 71.03 H new ATOM 0 HA3 GLY A 324 15.516 27.678 1.977 1.00 71.03 H new ATOM 383 N PHE A 325 17.174 25.270 1.948 1.00 4.13 N ATOM 384 CA PHE A 325 17.541 23.965 2.484 1.00 14.42 C ATOM 385 C PHE A 325 18.699 23.360 1.696 1.00 41.24 C ATOM 386 O PHE A 325 19.059 23.849 0.626 1.00 35.12 O ATOM 387 CB PHE A 325 16.339 23.020 2.451 1.00 21.14 C ATOM 388 CG PHE A 325 15.574 23.068 1.159 1.00 31.11 C ATOM 389 CD1 PHE A 325 15.858 22.176 0.137 1.00 40.52 C ATOM 390 CD2 PHE A 325 14.571 24.004 0.967 1.00 75.11 C ATOM 391 CE1 PHE A 325 15.156 22.219 -1.053 1.00 43.35 C ATOM 392 CE2 PHE A 325 13.865 24.051 -0.221 1.00 45.35 C ATOM 393 CZ PHE A 325 14.158 23.156 -1.232 1.00 14.33 C ATOM 0 H PHE A 325 17.081 25.298 0.933 1.00 4.13 H new ATOM 0 HA PHE A 325 17.859 24.101 3.518 1.00 14.42 H new ATOM 0 HB2 PHE A 325 16.684 22.000 2.622 1.00 21.14 H new ATOM 0 HB3 PHE A 325 15.667 23.271 3.272 1.00 21.14 H new ATOM 0 HD1 PHE A 325 16.636 21.439 0.272 1.00 40.52 H new ATOM 0 HD2 PHE A 325 14.338 24.705 1.754 1.00 75.11 H new ATOM 0 HE1 PHE A 325 15.388 21.520 -1.843 1.00 43.35 H new ATOM 0 HE2 PHE A 325 13.086 24.786 -0.358 1.00 45.35 H new ATOM 0 HZ PHE A 325 13.607 23.189 -2.160 1.00 14.33 H new ATOM 403 N ASN A 326 19.280 22.292 2.234 1.00 34.25 N ATOM 404 CA ASN A 326 20.398 21.620 1.583 1.00 15.45 C ATOM 405 C ASN A 326 19.998 20.222 1.121 1.00 33.43 C ATOM 406 O ASN A 326 18.943 19.712 1.497 1.00 71.11 O ATOM 407 CB ASN A 326 21.592 21.533 2.536 1.00 1.21 C ATOM 408 CG ASN A 326 22.906 21.346 1.801 1.00 30.05 C ATOM 409 OD1 ASN A 326 23.380 20.223 1.630 1.00 60.34 O ATOM 410 ND2 ASN A 326 23.500 22.450 1.362 1.00 72.14 N ATOM 0 H ASN A 326 18.995 21.874 3.119 1.00 34.25 H new ATOM 0 HA ASN A 326 20.682 22.205 0.708 1.00 15.45 H new ATOM 0 HB2 ASN A 326 21.641 22.441 3.137 1.00 1.21 H new ATOM 0 HB3 ASN A 326 21.443 20.702 3.226 1.00 1.21 H new ATOM 0 HD21 ASN A 326 24.386 22.387 0.860 1.00 72.14 H new ATOM 0 HD22 ASN A 326 23.070 23.360 1.527 1.00 72.14 H new ATOM 417 N ILE A 327 20.849 19.609 0.305 1.00 51.31 N ATOM 418 CA ILE A 327 20.586 18.270 -0.206 1.00 54.35 C ATOM 419 C ILE A 327 21.875 17.465 -0.331 1.00 32.34 C ATOM 420 O ILE A 327 22.865 17.942 -0.886 1.00 43.12 O ATOM 421 CB ILE A 327 19.890 18.318 -1.580 1.00 72.32 C ATOM 422 CG1 ILE A 327 20.672 19.215 -2.541 1.00 41.43 C ATOM 423 CG2 ILE A 327 18.459 18.814 -1.430 1.00 53.13 C ATOM 424 CD1 ILE A 327 20.058 19.303 -3.919 1.00 72.34 C ATOM 0 H ILE A 327 21.726 20.019 -0.016 1.00 51.31 H new ATOM 0 HA ILE A 327 19.925 17.784 0.511 1.00 54.35 H new ATOM 0 HB ILE A 327 19.864 17.310 -1.994 1.00 72.32 H new ATOM 0 HG12 ILE A 327 20.739 20.217 -2.117 1.00 41.43 H new ATOM 0 HG13 ILE A 327 21.691 18.838 -2.629 1.00 41.43 H new ATOM 0 HG21 ILE A 327 17.979 18.843 -2.408 1.00 53.13 H new ATOM 0 HG22 ILE A 327 17.907 18.140 -0.775 1.00 53.13 H new ATOM 0 HG23 ILE A 327 18.464 19.815 -0.999 1.00 53.13 H new ATOM 0 HD11 ILE A 327 20.665 19.955 -4.547 1.00 72.34 H new ATOM 0 HD12 ILE A 327 20.016 18.308 -4.363 1.00 72.34 H new ATOM 0 HD13 ILE A 327 19.049 19.709 -3.843 1.00 72.34 H new ATOM 436 N ILE A 328 21.856 16.242 0.188 1.00 11.01 N ATOM 437 CA ILE A 328 23.022 15.370 0.133 1.00 13.42 C ATOM 438 C ILE A 328 22.668 14.016 -0.473 1.00 45.50 C ATOM 439 O ILE A 328 21.670 13.400 -0.102 1.00 54.24 O ATOM 440 CB ILE A 328 23.629 15.151 1.532 1.00 73.10 C ATOM 441 CG1 ILE A 328 24.944 14.378 1.425 1.00 53.12 C ATOM 442 CG2 ILE A 328 22.644 14.411 2.425 1.00 53.22 C ATOM 443 CD1 ILE A 328 25.766 14.406 2.695 1.00 32.34 C ATOM 0 H ILE A 328 21.045 15.833 0.652 1.00 11.01 H new ATOM 0 HA ILE A 328 23.758 15.867 -0.499 1.00 13.42 H new ATOM 0 HB ILE A 328 23.836 16.123 1.979 1.00 73.10 H new ATOM 0 HG12 ILE A 328 24.727 13.342 1.165 1.00 53.12 H new ATOM 0 HG13 ILE A 328 25.536 14.794 0.610 1.00 53.12 H new ATOM 0 HG21 ILE A 328 23.086 14.263 3.410 1.00 53.22 H new ATOM 0 HG22 ILE A 328 21.730 14.997 2.522 1.00 53.22 H new ATOM 0 HG23 ILE A 328 22.409 13.442 1.984 1.00 53.22 H new ATOM 0 HD11 ILE A 328 26.684 13.838 2.547 1.00 32.34 H new ATOM 0 HD12 ILE A 328 26.014 15.438 2.945 1.00 32.34 H new ATOM 0 HD13 ILE A 328 25.193 13.963 3.509 1.00 32.34 H new ATOM 455 N GLY A 329 23.494 13.558 -1.408 1.00 64.24 N ATOM 456 CA GLY A 329 23.253 12.279 -2.050 1.00 61.42 C ATOM 457 C GLY A 329 24.537 11.548 -2.387 1.00 63.14 C ATOM 458 O GLY A 329 25.580 11.799 -1.785 1.00 70.23 O ATOM 0 H GLY A 329 24.326 14.050 -1.733 1.00 64.24 H new ATOM 0 HA2 GLY A 329 22.645 11.656 -1.394 1.00 61.42 H new ATOM 0 HA3 GLY A 329 22.678 12.437 -2.963 1.00 61.42 H new ATOM 462 N GLY A 330 24.462 10.637 -3.354 1.00 41.31 N ATOM 463 CA GLY A 330 25.634 9.880 -3.752 1.00 14.33 C ATOM 464 C GLY A 330 25.768 9.769 -5.258 1.00 35.30 C ATOM 465 O GLY A 330 25.515 10.732 -5.982 1.00 4.31 O ATOM 0 H GLY A 330 23.611 10.411 -3.868 1.00 41.31 H new ATOM 0 HA2 GLY A 330 26.526 10.356 -3.345 1.00 14.33 H new ATOM 0 HA3 GLY A 330 25.581 8.881 -3.320 1.00 14.33 H new ATOM 469 N GLU A 331 26.169 8.594 -5.731 1.00 55.42 N ATOM 470 CA GLU A 331 26.339 8.364 -7.161 1.00 45.23 C ATOM 471 C GLU A 331 25.133 7.631 -7.741 1.00 61.10 C ATOM 472 O GLU A 331 24.534 6.779 -7.083 1.00 71.34 O ATOM 473 CB GLU A 331 27.613 7.557 -7.423 1.00 71.41 C ATOM 474 CG GLU A 331 28.814 8.042 -6.626 1.00 21.35 C ATOM 475 CD GLU A 331 30.128 7.540 -7.190 1.00 1.11 C ATOM 476 OE1 GLU A 331 30.338 6.309 -7.201 1.00 13.10 O ATOM 477 OE2 GLU A 331 30.947 8.379 -7.621 1.00 15.51 O1- ATOM 0 H GLU A 331 26.382 7.787 -5.145 1.00 55.42 H new ATOM 0 HA GLU A 331 26.424 9.334 -7.651 1.00 45.23 H new ATOM 0 HB2 GLU A 331 27.426 6.510 -7.183 1.00 71.41 H new ATOM 0 HB3 GLU A 331 27.850 7.603 -8.486 1.00 71.41 H new ATOM 0 HG2 GLU A 331 28.821 9.132 -6.613 1.00 21.35 H new ATOM 0 HG3 GLU A 331 28.717 7.712 -5.592 1.00 21.35 H new ATOM 484 N ASP A 332 24.782 7.967 -8.977 1.00 34.22 N ATOM 485 CA ASP A 332 23.648 7.342 -9.647 1.00 54.55 C ATOM 486 C ASP A 332 22.399 7.401 -8.772 1.00 20.51 C ATOM 487 O ASP A 332 21.536 6.527 -8.846 1.00 45.45 O ATOM 488 CB ASP A 332 23.972 5.889 -9.997 1.00 30.44 C ATOM 489 CG ASP A 332 25.219 5.764 -10.851 1.00 42.20 C ATOM 490 OD1 ASP A 332 26.089 4.934 -10.513 1.00 25.10 O ATOM 491 OD2 ASP A 332 25.324 6.495 -11.858 1.00 12.24 O1- ATOM 0 H ASP A 332 25.267 8.669 -9.536 1.00 34.22 H new ATOM 0 HA ASP A 332 23.452 7.894 -10.566 1.00 54.55 H new ATOM 0 HB2 ASP A 332 24.106 5.318 -9.078 1.00 30.44 H new ATOM 0 HB3 ASP A 332 23.127 5.449 -10.526 1.00 30.44 H new ATOM 496 N GLY A 333 22.312 8.437 -7.945 1.00 50.11 N ATOM 497 CA GLY A 333 21.166 8.589 -7.066 1.00 62.04 C ATOM 498 C GLY A 333 21.002 7.418 -6.118 1.00 1.24 C ATOM 499 O GLY A 333 19.885 6.974 -5.859 1.00 52.13 O ATOM 0 H GLY A 333 23.013 9.174 -7.867 1.00 50.11 H new ATOM 0 HA2 GLY A 333 21.274 9.507 -6.489 1.00 62.04 H new ATOM 0 HA3 GLY A 333 20.263 8.695 -7.667 1.00 62.04 H new ATOM 503 N GLU A 334 22.120 6.916 -5.601 1.00 21.13 N ATOM 504 CA GLU A 334 22.093 5.787 -4.678 1.00 54.34 C ATOM 505 C GLU A 334 21.185 6.079 -3.488 1.00 71.03 C ATOM 506 O GLU A 334 20.589 5.170 -2.911 1.00 62.04 O ATOM 507 CB GLU A 334 23.507 5.468 -4.190 1.00 4.41 C ATOM 508 CG GLU A 334 23.716 4.001 -3.848 1.00 70.23 C ATOM 509 CD GLU A 334 23.037 3.600 -2.553 1.00 13.12 C ATOM 510 OE1 GLU A 334 23.262 4.281 -1.531 1.00 51.52 O ATOM 511 OE2 GLU A 334 22.280 2.608 -2.562 1.00 64.51 O1- ATOM 0 H GLU A 334 23.054 7.273 -5.805 1.00 21.13 H new ATOM 0 HA GLU A 334 21.696 4.923 -5.211 1.00 54.34 H new ATOM 0 HB2 GLU A 334 24.222 5.759 -4.959 1.00 4.41 H new ATOM 0 HB3 GLU A 334 23.723 6.072 -3.309 1.00 4.41 H new ATOM 0 HG2 GLU A 334 23.332 3.384 -4.661 1.00 70.23 H new ATOM 0 HG3 GLU A 334 24.784 3.799 -3.771 1.00 70.23 H new ATOM 518 N GLY A 335 21.083 7.354 -3.126 1.00 12.05 N ATOM 519 CA GLY A 335 20.247 7.743 -2.006 1.00 74.04 C ATOM 520 C GLY A 335 20.428 9.199 -1.624 1.00 72.20 C ATOM 521 O GLY A 335 21.377 9.548 -0.922 1.00 1.50 O ATOM 0 H GLY A 335 21.565 8.125 -3.589 1.00 12.05 H new ATOM 0 HA2 GLY A 335 19.202 7.564 -2.258 1.00 74.04 H new ATOM 0 HA3 GLY A 335 20.480 7.114 -1.147 1.00 74.04 H new ATOM 525 N ILE A 336 19.520 10.049 -2.090 1.00 11.34 N ATOM 526 CA ILE A 336 19.585 11.474 -1.793 1.00 53.22 C ATOM 527 C ILE A 336 18.599 11.853 -0.694 1.00 70.03 C ATOM 528 O ILE A 336 17.402 11.585 -0.800 1.00 51.25 O ATOM 529 CB ILE A 336 19.293 12.323 -3.044 1.00 51.54 C ATOM 530 CG1 ILE A 336 19.440 13.813 -2.723 1.00 73.13 C ATOM 531 CG2 ILE A 336 17.898 12.026 -3.573 1.00 21.51 C ATOM 532 CD1 ILE A 336 20.651 14.452 -3.365 1.00 2.51 C ATOM 0 H ILE A 336 18.730 9.776 -2.675 1.00 11.34 H new ATOM 0 HA ILE A 336 20.600 11.679 -1.453 1.00 53.22 H new ATOM 0 HB ILE A 336 20.017 12.063 -3.817 1.00 51.54 H new ATOM 0 HG12 ILE A 336 18.544 14.338 -3.054 1.00 73.13 H new ATOM 0 HG13 ILE A 336 19.503 13.939 -1.642 1.00 73.13 H new ATOM 0 HG21 ILE A 336 17.707 12.634 -4.457 1.00 21.51 H new ATOM 0 HG22 ILE A 336 17.826 10.971 -3.836 1.00 21.51 H new ATOM 0 HG23 ILE A 336 17.160 12.260 -2.805 1.00 21.51 H new ATOM 0 HD11 ILE A 336 20.692 15.507 -3.095 1.00 2.51 H new ATOM 0 HD12 ILE A 336 21.554 13.953 -3.015 1.00 2.51 H new ATOM 0 HD13 ILE A 336 20.581 14.357 -4.449 1.00 2.51 H new ATOM 544 N PHE A 337 19.109 12.480 0.361 1.00 13.53 N ATOM 545 CA PHE A 337 18.274 12.896 1.481 1.00 44.42 C ATOM 546 C PHE A 337 18.612 14.321 1.911 1.00 3.11 C ATOM 547 O PHE A 337 19.626 14.882 1.495 1.00 23.23 O ATOM 548 CB PHE A 337 18.450 11.940 2.662 1.00 22.41 C ATOM 549 CG PHE A 337 18.562 10.498 2.253 1.00 1.43 C ATOM 550 CD1 PHE A 337 17.552 9.891 1.526 1.00 52.41 C ATOM 551 CD2 PHE A 337 19.678 9.752 2.599 1.00 30.51 C ATOM 552 CE1 PHE A 337 17.652 8.565 1.148 1.00 11.01 C ATOM 553 CE2 PHE A 337 19.783 8.426 2.224 1.00 51.44 C ATOM 554 CZ PHE A 337 18.768 7.831 1.498 1.00 72.43 C ATOM 0 H PHE A 337 20.097 12.711 0.463 1.00 13.53 H new ATOM 0 HA PHE A 337 17.234 12.869 1.155 1.00 44.42 H new ATOM 0 HB2 PHE A 337 19.344 12.222 3.218 1.00 22.41 H new ATOM 0 HB3 PHE A 337 17.604 12.053 3.340 1.00 22.41 H new ATOM 0 HD1 PHE A 337 16.676 10.460 1.251 1.00 52.41 H new ATOM 0 HD2 PHE A 337 20.473 10.212 3.167 1.00 30.51 H new ATOM 0 HE1 PHE A 337 16.858 8.104 0.580 1.00 11.01 H new ATOM 0 HE2 PHE A 337 20.658 7.855 2.498 1.00 51.44 H new ATOM 0 HZ PHE A 337 18.848 6.794 1.205 1.00 72.43 H new ATOM 564 N ILE A 338 17.754 14.900 2.745 1.00 10.45 N ATOM 565 CA ILE A 338 17.961 16.258 3.232 1.00 20.14 C ATOM 566 C ILE A 338 19.180 16.335 4.145 1.00 32.21 C ATOM 567 O ILE A 338 19.441 15.419 4.925 1.00 61.42 O ATOM 568 CB ILE A 338 16.729 16.778 3.994 1.00 33.41 C ATOM 569 CG1 ILE A 338 15.500 16.774 3.084 1.00 41.54 C ATOM 570 CG2 ILE A 338 16.989 18.176 4.534 1.00 13.13 C ATOM 571 CD1 ILE A 338 14.246 17.285 3.758 1.00 35.32 C ATOM 0 H ILE A 338 16.909 14.450 3.097 1.00 10.45 H new ATOM 0 HA ILE A 338 18.126 16.885 2.356 1.00 20.14 H new ATOM 0 HB ILE A 338 16.537 16.114 4.837 1.00 33.41 H new ATOM 0 HG12 ILE A 338 15.706 17.387 2.206 1.00 41.54 H new ATOM 0 HG13 ILE A 338 15.324 15.758 2.730 1.00 41.54 H new ATOM 0 HG21 ILE A 338 16.108 18.529 5.070 1.00 13.13 H new ATOM 0 HG22 ILE A 338 17.841 18.151 5.213 1.00 13.13 H new ATOM 0 HG23 ILE A 338 17.205 18.852 3.706 1.00 13.13 H new ATOM 0 HD11 ILE A 338 13.415 17.253 3.053 1.00 35.32 H new ATOM 0 HD12 ILE A 338 14.015 16.658 4.619 1.00 35.32 H new ATOM 0 HD13 ILE A 338 14.403 18.312 4.088 1.00 35.32 H new ATOM 583 N SER A 339 19.921 17.434 4.043 1.00 53.21 N ATOM 584 CA SER A 339 21.114 17.629 4.859 1.00 21.04 C ATOM 585 C SER A 339 20.817 18.540 6.046 1.00 3.23 C ATOM 586 O SER A 339 20.836 18.105 7.197 1.00 14.32 O ATOM 587 CB SER A 339 22.243 18.223 4.015 1.00 72.42 C ATOM 588 OG SER A 339 23.013 19.144 4.769 1.00 60.13 O ATOM 0 H SER A 339 19.716 18.202 3.404 1.00 53.21 H new ATOM 0 HA SER A 339 21.427 16.657 5.239 1.00 21.04 H new ATOM 0 HB2 SER A 339 22.885 17.423 3.646 1.00 72.42 H new ATOM 0 HB3 SER A 339 21.824 18.723 3.142 1.00 72.42 H new ATOM 0 HG SER A 339 23.729 19.508 4.208 1.00 60.13 H new ATOM 594 N PHE A 340 20.543 19.808 5.757 1.00 10.12 N ATOM 595 CA PHE A 340 20.243 20.782 6.799 1.00 0.00 C ATOM 596 C PHE A 340 19.499 21.984 6.222 1.00 71.25 C ATOM 597 O PHE A 340 19.423 22.167 5.004 1.00 73.44 O ATOM 598 CB PHE A 340 21.532 21.245 7.481 1.00 62.34 C ATOM 599 CG PHE A 340 21.339 21.654 8.913 1.00 14.15 C ATOM 600 CD1 PHE A 340 20.809 20.766 9.835 1.00 54.53 C ATOM 601 CD2 PHE A 340 21.686 22.927 9.337 1.00 10.52 C ATOM 602 CE1 PHE A 340 20.631 21.139 11.154 1.00 33.00 C ATOM 603 CE2 PHE A 340 21.510 23.305 10.654 1.00 34.23 C ATOM 604 CZ PHE A 340 20.980 22.411 11.564 1.00 34.54 C ATOM 0 H PHE A 340 20.523 20.185 4.809 1.00 10.12 H new ATOM 0 HA PHE A 340 19.602 20.301 7.538 1.00 0.00 H new ATOM 0 HB2 PHE A 340 22.266 20.440 7.437 1.00 62.34 H new ATOM 0 HB3 PHE A 340 21.947 22.085 6.924 1.00 62.34 H new ATOM 0 HD1 PHE A 340 20.532 19.771 9.520 1.00 54.53 H new ATOM 0 HD2 PHE A 340 22.099 23.631 8.630 1.00 10.52 H new ATOM 0 HE1 PHE A 340 20.219 20.436 11.863 1.00 33.00 H new ATOM 0 HE2 PHE A 340 21.787 24.299 10.972 1.00 34.23 H new ATOM 0 HZ PHE A 340 20.839 22.706 12.593 1.00 34.54 H new HETATM 614 N AZH A 341 18.943 22.815 7.111 1.00 62.40 N HETATM 615 CA AZH A 341 18.201 24.003 6.712 1.00 10.20 C HETATM 616 CB AZH A 341 16.952 24.158 7.584 1.00 71.21 C HETATM 617 CG AZH A 341 16.014 22.978 7.527 1.00 40.14 C HETATM 618 ND AZH A 341 15.577 22.624 8.892 1.00 51.24 N HETATM 619 NE AZH A 341 15.015 23.522 9.646 1.00 51.40 N HETATM 620 NZ AZH A 341 14.473 24.392 10.447 1.00 30.12 N HETATM 621 C AZH A 341 19.041 25.276 6.786 1.00 25.33 C HETATM 622 O AZH A 341 19.479 25.471 7.921 1.00 11.24 O HETATM 0 HG2C AZH A 341 15.149 23.218 6.909 1.00 40.14 H new HETATM 0 HG1C AZH A 341 16.512 22.127 7.062 1.00 40.14 H new HETATM 0 HB2C AZH A 341 17.260 24.315 8.618 1.00 71.21 H new HETATM 0 HB1C AZH A 341 16.413 25.053 7.273 1.00 71.21 H new HETATM 0 HZ AZH A 341 13.988 25.103 9.900 1.00 30.12 H new HETATM 0 HN1 AZH A 341 18.600 22.232 7.874 1.00 62.40 H new HETATM 0 HA AZH A 341 17.916 23.864 5.669 1.00 10.20 H new ATOM 629 N LEU A 342 19.128 26.176 5.813 1.00 34.54 N ATOM 630 CA LEU A 342 19.757 27.475 6.027 1.00 12.21 C ATOM 631 C LEU A 342 18.777 28.458 6.657 1.00 50.14 C ATOM 632 O LEU A 342 17.600 28.493 6.297 1.00 42.41 O ATOM 633 CB LEU A 342 20.277 28.035 4.701 1.00 15.42 C ATOM 634 CG LEU A 342 21.619 27.481 4.220 1.00 70.31 C ATOM 635 CD1 LEU A 342 21.972 28.049 2.854 1.00 73.42 C ATOM 636 CD2 LEU A 342 22.717 27.790 5.229 1.00 2.52 C ATOM 0 H LEU A 342 18.771 26.031 4.869 1.00 34.54 H new ATOM 0 HA LEU A 342 20.594 27.338 6.711 1.00 12.21 H new ATOM 0 HB2 LEU A 342 19.530 27.843 3.931 1.00 15.42 H new ATOM 0 HB3 LEU A 342 20.366 29.117 4.796 1.00 15.42 H new ATOM 0 HG LEU A 342 21.532 26.398 4.129 1.00 70.31 H new ATOM 0 HD11 LEU A 342 22.930 27.644 2.528 1.00 73.42 H new ATOM 0 HD12 LEU A 342 21.199 27.776 2.136 1.00 73.42 H new ATOM 0 HD13 LEU A 342 22.040 29.135 2.918 1.00 73.42 H new ATOM 0 HD21 LEU A 342 23.665 27.388 4.870 1.00 2.52 H new ATOM 0 HD22 LEU A 342 22.804 28.869 5.353 1.00 2.52 H new ATOM 0 HD23 LEU A 342 22.469 27.334 6.187 1.00 2.52 H new ATOM 648 N ALA A 343 19.270 29.257 7.598 1.00 70.31 N ATOM 649 CA ALA A 343 18.439 30.244 8.275 1.00 42.20 C ATOM 650 C ALA A 343 18.200 31.462 7.389 1.00 72.12 C ATOM 651 O ALA A 343 19.045 31.821 6.569 1.00 64.03 O ATOM 652 CB ALA A 343 19.081 30.663 9.589 1.00 12.23 C ATOM 0 H ALA A 343 20.241 29.240 7.909 1.00 70.31 H new ATOM 0 HA ALA A 343 17.473 29.785 8.485 1.00 42.20 H new ATOM 0 HB1 ALA A 343 18.449 31.401 10.084 1.00 12.23 H new ATOM 0 HB2 ALA A 343 19.194 29.791 10.233 1.00 12.23 H new ATOM 0 HB3 ALA A 343 20.061 31.098 9.393 1.00 12.23 H new ATOM 658 N GLY A 344 17.042 32.094 7.558 1.00 73.32 N ATOM 659 CA GLY A 344 16.713 33.264 6.765 1.00 22.32 C ATOM 660 C GLY A 344 16.153 32.903 5.404 1.00 65.20 C ATOM 661 O GLY A 344 16.059 33.753 4.518 1.00 32.14 O ATOM 0 H GLY A 344 16.326 31.816 8.230 1.00 73.32 H new ATOM 0 HA2 GLY A 344 15.986 33.872 7.304 1.00 22.32 H new ATOM 0 HA3 GLY A 344 17.606 33.875 6.636 1.00 22.32 H new ATOM 665 N GLY A 345 15.781 31.638 5.234 1.00 23.12 N ATOM 666 CA GLY A 345 15.235 31.189 3.967 1.00 52.00 C ATOM 667 C GLY A 345 13.780 30.780 4.076 1.00 22.43 C ATOM 668 O GLY A 345 13.159 30.892 5.133 1.00 40.45 O ATOM 0 H GLY A 345 15.848 30.916 5.951 1.00 23.12 H new ATOM 0 HA2 GLY A 345 15.331 31.987 3.230 1.00 52.00 H new ATOM 0 HA3 GLY A 345 15.820 30.345 3.601 1.00 52.00 H new ATOM 672 N PRO A 346 13.211 30.297 2.962 1.00 53.14 N ATOM 673 CA PRO A 346 11.812 29.862 2.910 1.00 44.02 C ATOM 674 C PRO A 346 11.574 28.583 3.704 1.00 14.04 C ATOM 675 O PRO A 346 10.526 28.416 4.330 1.00 51.45 O ATOM 676 CB PRO A 346 11.571 29.618 1.418 1.00 2.12 C ATOM 677 CG PRO A 346 12.919 29.318 0.861 1.00 64.40 C ATOM 678 CD PRO A 346 13.891 30.137 1.665 1.00 75.50 C ATOM 0 HA PRO A 346 11.139 30.599 3.349 1.00 44.02 H new ATOM 0 HB2 PRO A 346 10.883 28.788 1.259 1.00 2.12 H new ATOM 0 HB3 PRO A 346 11.131 30.493 0.940 1.00 2.12 H new ATOM 0 HG2 PRO A 346 13.146 28.255 0.940 1.00 64.40 H new ATOM 0 HG3 PRO A 346 12.971 29.578 -0.196 1.00 64.40 H new ATOM 0 HD2 PRO A 346 14.850 29.630 1.774 1.00 75.50 H new ATOM 0 HD3 PRO A 346 14.091 31.100 1.195 1.00 75.50 H new ATOM 686 N ALA A 347 12.550 27.683 3.676 1.00 35.54 N ATOM 687 CA ALA A 347 12.446 26.420 4.395 1.00 74.21 C ATOM 688 C ALA A 347 12.289 26.653 5.894 1.00 62.43 C ATOM 689 O ALA A 347 11.579 25.913 6.575 1.00 51.24 O ATOM 690 CB ALA A 347 13.667 25.553 4.119 1.00 24.45 C ATOM 0 H ALA A 347 13.423 27.805 3.163 1.00 35.54 H new ATOM 0 HA ALA A 347 11.557 25.900 4.039 1.00 74.21 H new ATOM 0 HB1 ALA A 347 13.576 24.613 4.663 1.00 24.45 H new ATOM 0 HB2 ALA A 347 13.735 25.349 3.050 1.00 24.45 H new ATOM 0 HB3 ALA A 347 14.566 26.076 4.446 1.00 24.45 H new ATOM 696 N ASP A 348 12.957 27.684 6.401 1.00 14.33 N ATOM 697 CA ASP A 348 12.890 28.015 7.819 1.00 52.14 C ATOM 698 C ASP A 348 11.450 28.279 8.249 1.00 64.31 C ATOM 699 O ASP A 348 10.970 27.712 9.231 1.00 51.35 O ATOM 700 CB ASP A 348 13.758 29.237 8.120 1.00 40.52 C ATOM 701 CG ASP A 348 14.050 29.388 9.601 1.00 22.44 C ATOM 702 OD1 ASP A 348 13.895 30.513 10.123 1.00 2.53 O ATOM 703 OD2 ASP A 348 14.434 28.385 10.236 1.00 10.20 O1- ATOM 0 H ASP A 348 13.551 28.304 5.851 1.00 14.33 H new ATOM 0 HA ASP A 348 13.267 27.163 8.384 1.00 52.14 H new ATOM 0 HB2 ASP A 348 14.698 29.155 7.574 1.00 40.52 H new ATOM 0 HB3 ASP A 348 13.256 30.134 7.758 1.00 40.52 H new ATOM 708 N LEU A 349 10.767 29.144 7.508 1.00 71.31 N ATOM 709 CA LEU A 349 9.382 29.486 7.813 1.00 51.53 C ATOM 710 C LEU A 349 8.495 28.245 7.779 1.00 12.02 C ATOM 711 O LEU A 349 7.565 28.113 8.575 1.00 70.14 O ATOM 712 CB LEU A 349 8.861 30.526 6.818 1.00 24.32 C ATOM 713 CG LEU A 349 9.473 31.923 6.927 1.00 5.13 C ATOM 714 CD1 LEU A 349 10.600 32.092 5.920 1.00 0.23 C ATOM 715 CD2 LEU A 349 8.407 32.989 6.720 1.00 55.22 C ATOM 0 H LEU A 349 11.149 29.621 6.692 1.00 71.31 H new ATOM 0 HA LEU A 349 9.350 29.906 8.818 1.00 51.53 H new ATOM 0 HB2 LEU A 349 9.034 30.153 5.809 1.00 24.32 H new ATOM 0 HB3 LEU A 349 7.782 30.613 6.945 1.00 24.32 H new ATOM 0 HG LEU A 349 9.887 32.040 7.928 1.00 5.13 H new ATOM 0 HD11 LEU A 349 11.023 33.092 6.012 1.00 0.23 H new ATOM 0 HD12 LEU A 349 11.375 31.351 6.114 1.00 0.23 H new ATOM 0 HD13 LEU A 349 10.210 31.955 4.911 1.00 0.23 H new ATOM 0 HD21 LEU A 349 8.860 33.977 6.801 1.00 55.22 H new ATOM 0 HD22 LEU A 349 7.964 32.873 5.731 1.00 55.22 H new ATOM 0 HD23 LEU A 349 7.633 32.882 7.480 1.00 55.22 H new ATOM 727 N SER A 350 8.791 27.337 6.854 1.00 73.34 N ATOM 728 CA SER A 350 8.020 26.107 6.715 1.00 32.33 C ATOM 729 C SER A 350 7.970 25.346 8.037 1.00 42.41 C ATOM 730 O SER A 350 6.947 24.763 8.392 1.00 22.13 O ATOM 731 CB SER A 350 8.626 25.221 5.626 1.00 35.25 C ATOM 732 OG SER A 350 9.308 25.998 4.657 1.00 54.44 O ATOM 0 H SER A 350 9.559 27.430 6.190 1.00 73.34 H new ATOM 0 HA SER A 350 7.002 26.375 6.431 1.00 32.33 H new ATOM 0 HB2 SER A 350 9.316 24.507 6.076 1.00 35.25 H new ATOM 0 HB3 SER A 350 7.838 24.642 5.144 1.00 35.25 H new ATOM 0 HG SER A 350 9.408 25.478 3.832 1.00 54.44 H new ATOM 738 N GLY A 351 9.085 25.356 8.761 1.00 33.35 N ATOM 739 CA GLY A 351 9.149 24.663 10.034 1.00 12.41 C ATOM 740 C GLY A 351 8.735 23.209 9.925 1.00 22.05 C ATOM 741 O GLY A 351 8.160 22.649 10.858 1.00 70.33 O ATOM 0 H GLY A 351 9.945 25.832 8.488 1.00 33.35 H new ATOM 0 HA2 GLY A 351 10.165 24.720 10.424 1.00 12.41 H new ATOM 0 HA3 GLY A 351 8.503 25.168 10.752 1.00 12.41 H new ATOM 745 N GLU A 352 9.026 22.597 8.782 1.00 5.11 N ATOM 746 CA GLU A 352 8.678 21.200 8.553 1.00 73.30 C ATOM 747 C GLU A 352 9.890 20.407 8.073 1.00 52.43 C ATOM 748 O GLU A 352 10.242 19.377 8.650 1.00 30.44 O ATOM 749 CB GLU A 352 7.546 21.093 7.528 1.00 65.40 C ATOM 750 CG GLU A 352 6.576 19.957 7.807 1.00 74.50 C ATOM 751 CD GLU A 352 5.978 20.031 9.198 1.00 64.11 C ATOM 752 OE1 GLU A 352 6.302 19.158 10.031 1.00 63.12 O ATOM 753 OE2 GLU A 352 5.184 20.961 9.455 1.00 61.14 O1- ATOM 0 H GLU A 352 9.502 23.047 8.000 1.00 5.11 H new ATOM 0 HA GLU A 352 8.342 20.778 9.500 1.00 73.30 H new ATOM 0 HB2 GLU A 352 6.995 22.033 7.509 1.00 65.40 H new ATOM 0 HB3 GLU A 352 7.977 20.956 6.536 1.00 65.40 H new ATOM 0 HG2 GLU A 352 5.774 19.979 7.069 1.00 74.50 H new ATOM 0 HG3 GLU A 352 7.093 19.005 7.688 1.00 74.50 H new ATOM 760 N LEU A 353 10.525 20.895 7.012 1.00 71.34 N ATOM 761 CA LEU A 353 11.697 20.234 6.451 1.00 3.31 C ATOM 762 C LEU A 353 12.895 20.362 7.389 1.00 44.20 C ATOM 763 O LEU A 353 13.265 21.465 7.790 1.00 31.23 O ATOM 764 CB LEU A 353 12.040 20.829 5.085 1.00 32.25 C ATOM 765 CG LEU A 353 11.039 20.550 3.962 1.00 32.11 C ATOM 766 CD1 LEU A 353 11.364 21.390 2.737 1.00 53.54 C ATOM 767 CD2 LEU A 353 11.033 19.070 3.609 1.00 3.24 C ATOM 0 H LEU A 353 10.247 21.746 6.524 1.00 71.34 H new ATOM 0 HA LEU A 353 11.463 19.176 6.330 1.00 3.31 H new ATOM 0 HB2 LEU A 353 12.140 21.909 5.196 1.00 32.25 H new ATOM 0 HB3 LEU A 353 13.014 20.448 4.779 1.00 32.25 H new ATOM 0 HG LEU A 353 10.044 20.824 4.312 1.00 32.11 H new ATOM 0 HD11 LEU A 353 10.642 21.178 1.949 1.00 53.54 H new ATOM 0 HD12 LEU A 353 11.317 22.447 2.998 1.00 53.54 H new ATOM 0 HD13 LEU A 353 12.367 21.147 2.385 1.00 53.54 H new ATOM 0 HD21 LEU A 353 10.315 18.890 2.809 1.00 3.24 H new ATOM 0 HD22 LEU A 353 12.028 18.771 3.279 1.00 3.24 H new ATOM 0 HD23 LEU A 353 10.752 18.488 4.486 1.00 3.24 H new ATOM 779 N ARG A 354 13.496 19.227 7.731 1.00 42.35 N ATOM 780 CA ARG A 354 14.652 19.213 8.620 1.00 70.32 C ATOM 781 C ARG A 354 15.584 18.054 8.281 1.00 34.00 C ATOM 782 O ARG A 354 15.256 17.199 7.457 1.00 74.12 O ATOM 783 CB ARG A 354 14.199 19.108 10.077 1.00 52.13 C ATOM 784 CG ARG A 354 15.128 19.808 11.055 1.00 45.24 C ATOM 785 CD ARG A 354 14.428 20.106 12.373 1.00 4.20 C ATOM 786 NE ARG A 354 15.377 20.421 13.437 1.00 4.34 N ATOM 787 CZ ARG A 354 15.030 20.985 14.589 1.00 3.31 C ATOM 788 NH1 ARG A 354 13.762 21.295 14.822 1.00 70.32 N1+ ATOM 789 NH2 ARG A 354 15.951 21.240 15.509 1.00 4.21 N ATOM 0 H ARG A 354 13.202 18.306 7.406 1.00 42.35 H new ATOM 0 HA ARG A 354 15.197 20.147 8.482 1.00 70.32 H new ATOM 0 HB2 ARG A 354 13.200 19.534 10.170 1.00 52.13 H new ATOM 0 HB3 ARG A 354 14.124 18.056 10.350 1.00 52.13 H new ATOM 0 HG2 ARG A 354 16.002 19.183 11.239 1.00 45.24 H new ATOM 0 HG3 ARG A 354 15.488 20.738 10.615 1.00 45.24 H new ATOM 0 HD2 ARG A 354 13.743 20.943 12.239 1.00 4.20 H new ATOM 0 HD3 ARG A 354 13.826 19.246 12.667 1.00 4.20 H new ATOM 0 HE ARG A 354 16.361 20.196 13.288 1.00 4.34 H new ATOM 0 HH11 ARG A 354 13.052 21.101 14.116 1.00 70.32 H new ATOM 0 HH12 ARG A 354 13.497 21.728 15.707 1.00 70.32 H new ATOM 0 HH21 ARG A 354 16.927 21.003 15.333 1.00 4.21 H new ATOM 0 HH22 ARG A 354 15.683 21.673 16.393 1.00 4.21 H new ATOM 803 N LYS A 355 16.749 18.032 8.919 1.00 33.30 N ATOM 804 CA LYS A 355 17.731 16.979 8.687 1.00 21.22 C ATOM 805 C LYS A 355 17.153 15.611 9.037 1.00 34.13 C ATOM 806 O LYS A 355 16.452 15.459 10.036 1.00 60.32 O ATOM 807 CB LYS A 355 18.992 17.238 9.513 1.00 63.32 C ATOM 808 CG LYS A 355 19.938 16.051 9.566 1.00 32.14 C ATOM 809 CD LYS A 355 19.737 15.235 10.833 1.00 71.43 C ATOM 810 CE LYS A 355 21.061 14.733 11.388 1.00 20.31 C ATOM 811 NZ LYS A 355 21.096 14.790 12.876 1.00 41.04 N1+ ATOM 0 H LYS A 355 17.037 18.733 9.602 1.00 33.30 H new ATOM 0 HA LYS A 355 17.991 16.985 7.628 1.00 21.22 H new ATOM 0 HB2 LYS A 355 19.520 18.095 9.095 1.00 63.32 H new ATOM 0 HB3 LYS A 355 18.702 17.507 10.529 1.00 63.32 H new ATOM 0 HG2 LYS A 355 19.777 15.417 8.694 1.00 32.14 H new ATOM 0 HG3 LYS A 355 20.968 16.403 9.518 1.00 32.14 H new ATOM 0 HD2 LYS A 355 19.234 15.845 11.584 1.00 71.43 H new ATOM 0 HD3 LYS A 355 19.085 14.387 10.622 1.00 71.43 H new ATOM 0 HE2 LYS A 355 21.227 13.707 11.060 1.00 20.31 H new ATOM 0 HE3 LYS A 355 21.876 15.333 10.982 1.00 20.31 H new ATOM 0 HZ1 LYS A 355 22.015 14.440 13.215 1.00 41.04 H new ATOM 0 HZ2 LYS A 355 20.963 15.773 13.189 1.00 41.04 H new ATOM 0 HZ3 LYS A 355 20.335 14.197 13.264 1.00 41.04 H new ATOM 825 N GLY A 356 17.454 14.616 8.207 1.00 41.20 N ATOM 826 CA GLY A 356 16.958 13.274 8.447 1.00 2.44 C ATOM 827 C GLY A 356 15.912 12.853 7.434 1.00 13.01 C ATOM 828 O GLY A 356 15.771 11.667 7.134 1.00 31.51 O ATOM 0 H GLY A 356 18.033 14.716 7.373 1.00 41.20 H new ATOM 0 HA2 GLY A 356 17.791 12.571 8.418 1.00 2.44 H new ATOM 0 HA3 GLY A 356 16.531 13.221 9.449 1.00 2.44 H new ATOM 832 N ASP A 357 15.177 13.825 6.907 1.00 2.03 N ATOM 833 CA ASP A 357 14.137 13.548 5.922 1.00 31.34 C ATOM 834 C ASP A 357 14.748 13.076 4.606 1.00 35.53 C ATOM 835 O ASP A 357 15.855 13.476 4.246 1.00 32.25 O ATOM 836 CB ASP A 357 13.285 14.796 5.684 1.00 54.11 C ATOM 837 CG ASP A 357 12.156 14.925 6.689 1.00 42.24 C ATOM 838 OD1 ASP A 357 11.736 13.889 7.245 1.00 42.23 O ATOM 839 OD2 ASP A 357 11.694 16.063 6.917 1.00 21.32 O1- ATOM 0 H ASP A 357 15.281 14.811 7.145 1.00 2.03 H new ATOM 0 HA ASP A 357 13.502 12.753 6.313 1.00 31.34 H new ATOM 0 HB2 ASP A 357 13.919 15.681 5.738 1.00 54.11 H new ATOM 0 HB3 ASP A 357 12.869 14.762 4.677 1.00 54.11 H new ATOM 844 N GLN A 358 14.018 12.224 3.893 1.00 31.32 N ATOM 845 CA GLN A 358 14.489 11.697 2.618 1.00 14.41 C ATOM 846 C GLN A 358 13.611 12.183 1.469 1.00 33.14 C ATOM 847 O GLN A 358 12.395 12.305 1.614 1.00 13.50 O ATOM 848 CB GLN A 358 14.506 10.168 2.649 1.00 63.45 C ATOM 849 CG GLN A 358 13.147 9.550 2.937 1.00 21.21 C ATOM 850 CD GLN A 358 12.962 8.206 2.261 1.00 43.34 C ATOM 851 OE1 GLN A 358 11.730 7.709 2.256 1.00 0.51 O flip ATOM 852 NE2 GLN A 358 13.916 7.618 1.749 1.00 15.43 N flip ATOM 0 H GLN A 358 13.099 11.884 4.177 1.00 31.32 H new ATOM 0 HA GLN A 358 15.503 12.062 2.456 1.00 14.41 H new ATOM 0 HB2 GLN A 358 14.868 9.797 1.690 1.00 63.45 H new ATOM 0 HB3 GLN A 358 15.215 9.836 3.408 1.00 63.45 H new ATOM 0 HG2 GLN A 358 13.027 9.430 4.014 1.00 21.21 H new ATOM 0 HG3 GLN A 358 12.364 10.231 2.603 1.00 21.21 H new ATOM 0 HE21 GLN A 358 14.846 8.036 1.775 1.00 15.43 H new ATOM 0 HE22 GLN A 358 13.776 6.714 1.299 1.00 15.43 H new ATOM 861 N ILE A 359 14.236 12.462 0.331 1.00 3.42 N ATOM 862 CA ILE A 359 13.511 12.935 -0.842 1.00 53.21 C ATOM 863 C ILE A 359 12.908 11.772 -1.621 1.00 34.53 C ATOM 864 O ILE A 359 13.607 10.825 -1.986 1.00 54.41 O ATOM 865 CB ILE A 359 14.425 13.748 -1.779 1.00 64.42 C ATOM 866 CG1 ILE A 359 15.233 14.771 -0.977 1.00 65.31 C ATOM 867 CG2 ILE A 359 13.600 14.440 -2.853 1.00 45.52 C ATOM 868 CD1 ILE A 359 14.375 15.797 -0.270 1.00 15.24 C ATOM 0 H ILE A 359 15.243 12.369 0.196 1.00 3.42 H new ATOM 0 HA ILE A 359 12.711 13.580 -0.480 1.00 53.21 H new ATOM 0 HB ILE A 359 15.121 13.066 -2.267 1.00 64.42 H new ATOM 0 HG12 ILE A 359 15.839 14.246 -0.239 1.00 65.31 H new ATOM 0 HG13 ILE A 359 15.922 15.285 -1.648 1.00 65.31 H new ATOM 0 HG21 ILE A 359 14.259 15.010 -3.507 1.00 45.52 H new ATOM 0 HG22 ILE A 359 13.065 13.693 -3.439 1.00 45.52 H new ATOM 0 HG23 ILE A 359 12.883 15.114 -2.384 1.00 45.52 H new ATOM 0 HD11 ILE A 359 15.014 16.490 0.278 1.00 15.24 H new ATOM 0 HD12 ILE A 359 13.788 16.349 -1.004 1.00 15.24 H new ATOM 0 HD13 ILE A 359 13.704 15.293 0.426 1.00 15.24 H new ATOM 880 N LEU A 360 11.607 11.850 -1.877 1.00 42.11 N ATOM 881 CA LEU A 360 10.908 10.804 -2.616 1.00 24.30 C ATOM 882 C LEU A 360 10.520 11.289 -4.009 1.00 30.12 C ATOM 883 O LEU A 360 10.752 10.601 -5.004 1.00 64.33 O ATOM 884 CB LEU A 360 9.660 10.359 -1.853 1.00 10.42 C ATOM 885 CG LEU A 360 9.842 9.180 -0.897 1.00 64.12 C ATOM 886 CD1 LEU A 360 10.202 9.671 0.497 1.00 41.24 C ATOM 887 CD2 LEU A 360 8.582 8.327 -0.854 1.00 13.33 C ATOM 0 H LEU A 360 11.014 12.627 -1.584 1.00 42.11 H new ATOM 0 HA LEU A 360 11.583 9.955 -2.721 1.00 24.30 H new ATOM 0 HB2 LEU A 360 9.285 11.209 -1.282 1.00 10.42 H new ATOM 0 HB3 LEU A 360 8.889 10.097 -2.578 1.00 10.42 H new ATOM 0 HG LEU A 360 10.662 8.564 -1.266 1.00 64.12 H new ATOM 0 HD11 LEU A 360 10.327 8.817 1.163 1.00 41.24 H new ATOM 0 HD12 LEU A 360 11.132 10.237 0.454 1.00 41.24 H new ATOM 0 HD13 LEU A 360 9.405 10.311 0.874 1.00 41.24 H new ATOM 0 HD21 LEU A 360 8.731 7.493 -0.168 1.00 13.33 H new ATOM 0 HD22 LEU A 360 7.744 8.933 -0.511 1.00 13.33 H new ATOM 0 HD23 LEU A 360 8.368 7.943 -1.852 1.00 13.33 H new ATOM 899 N SER A 361 9.929 12.478 -4.074 1.00 73.14 N ATOM 900 CA SER A 361 9.507 13.054 -5.345 1.00 44.34 C ATOM 901 C SER A 361 9.504 14.578 -5.276 1.00 14.03 C ATOM 902 O SER A 361 9.149 15.164 -4.254 1.00 33.25 O ATOM 903 CB SER A 361 8.114 12.546 -5.721 1.00 63.41 C ATOM 904 OG SER A 361 7.569 11.741 -4.691 1.00 41.10 O ATOM 0 H SER A 361 9.732 13.061 -3.261 1.00 73.14 H new ATOM 0 HA SER A 361 10.218 12.744 -6.111 1.00 44.34 H new ATOM 0 HB2 SER A 361 7.454 13.392 -5.913 1.00 63.41 H new ATOM 0 HB3 SER A 361 8.171 11.971 -6.645 1.00 63.41 H new ATOM 0 HG SER A 361 6.699 11.391 -4.975 1.00 41.10 H new ATOM 910 N VAL A 362 9.903 15.215 -6.373 1.00 44.44 N ATOM 911 CA VAL A 362 9.945 16.670 -6.439 1.00 13.10 C ATOM 912 C VAL A 362 9.232 17.185 -7.685 1.00 35.44 C ATOM 913 O VAL A 362 9.562 16.797 -8.805 1.00 52.21 O ATOM 914 CB VAL A 362 11.395 17.190 -6.440 1.00 42.40 C ATOM 915 CG1 VAL A 362 11.421 18.703 -6.282 1.00 40.30 C ATOM 916 CG2 VAL A 362 12.201 16.518 -5.338 1.00 70.40 C ATOM 0 H VAL A 362 10.202 14.745 -7.228 1.00 44.44 H new ATOM 0 HA VAL A 362 9.433 17.042 -5.551 1.00 13.10 H new ATOM 0 HB VAL A 362 11.851 16.941 -7.398 1.00 42.40 H new ATOM 0 HG11 VAL A 362 12.454 19.051 -6.285 1.00 40.30 H new ATOM 0 HG12 VAL A 362 10.880 19.164 -7.108 1.00 40.30 H new ATOM 0 HG13 VAL A 362 10.948 18.979 -5.340 1.00 40.30 H new ATOM 0 HG21 VAL A 362 13.223 16.896 -5.352 1.00 70.40 H new ATOM 0 HG22 VAL A 362 11.747 16.735 -4.371 1.00 70.40 H new ATOM 0 HG23 VAL A 362 12.211 15.440 -5.500 1.00 70.40 H new ATOM 926 N ASN A 363 8.254 18.062 -7.480 1.00 72.14 N ATOM 927 CA ASN A 363 7.494 18.630 -8.587 1.00 0.44 C ATOM 928 C ASN A 363 7.124 17.553 -9.603 1.00 33.34 C ATOM 929 O ASN A 363 7.093 17.804 -10.807 1.00 75.01 O ATOM 930 CB ASN A 363 8.299 19.737 -9.271 1.00 61.50 C ATOM 931 CG ASN A 363 9.600 19.225 -9.861 1.00 70.41 C ATOM 932 OD1 ASN A 363 10.614 19.133 -9.169 1.00 34.34 O ATOM 933 ND2 ASN A 363 9.575 18.890 -11.146 1.00 52.13 N ATOM 0 H ASN A 363 7.970 18.394 -6.558 1.00 72.14 H new ATOM 0 HA ASN A 363 6.575 19.055 -8.183 1.00 0.44 H new ATOM 0 HB2 ASN A 363 7.697 20.186 -10.061 1.00 61.50 H new ATOM 0 HB3 ASN A 363 8.515 20.524 -8.549 1.00 61.50 H new ATOM 0 HD21 ASN A 363 10.420 18.540 -11.598 1.00 52.13 H new ATOM 0 HD22 ASN A 363 8.711 18.983 -11.681 1.00 52.13 H new ATOM 940 N GLY A 364 6.843 16.352 -9.107 1.00 23.21 N ATOM 941 CA GLY A 364 6.479 15.254 -9.985 1.00 2.53 C ATOM 942 C GLY A 364 7.584 14.226 -10.117 1.00 24.34 C ATOM 943 O GLY A 364 7.464 13.107 -9.619 1.00 32.33 O ATOM 0 H GLY A 364 6.861 16.119 -8.114 1.00 23.21 H new ATOM 0 HA2 GLY A 364 5.580 14.770 -9.603 1.00 2.53 H new ATOM 0 HA3 GLY A 364 6.234 15.648 -10.971 1.00 2.53 H new ATOM 947 N VAL A 365 8.665 14.604 -10.792 1.00 54.34 N ATOM 948 CA VAL A 365 9.797 13.706 -10.990 1.00 44.21 C ATOM 949 C VAL A 365 10.221 13.061 -9.676 1.00 0.31 C ATOM 950 O VAL A 365 10.282 13.720 -8.639 1.00 64.42 O ATOM 951 CB VAL A 365 11.002 14.449 -11.598 1.00 22.21 C ATOM 952 CG1 VAL A 365 10.705 14.867 -13.030 1.00 2.33 C ATOM 953 CG2 VAL A 365 11.369 15.654 -10.746 1.00 41.10 C ATOM 0 H VAL A 365 8.781 15.527 -11.211 1.00 54.34 H new ATOM 0 HA VAL A 365 9.471 12.931 -11.683 1.00 44.21 H new ATOM 0 HB VAL A 365 11.855 13.771 -11.614 1.00 22.21 H new ATOM 0 HG11 VAL A 365 11.568 15.390 -13.443 1.00 2.33 H new ATOM 0 HG12 VAL A 365 10.496 13.982 -13.631 1.00 2.33 H new ATOM 0 HG13 VAL A 365 9.839 15.528 -13.044 1.00 2.33 H new ATOM 0 HG21 VAL A 365 12.222 16.167 -11.190 1.00 41.10 H new ATOM 0 HG22 VAL A 365 10.521 16.336 -10.696 1.00 41.10 H new ATOM 0 HG23 VAL A 365 11.628 15.323 -9.740 1.00 41.10 H new ATOM 963 N ASP A 366 10.514 11.766 -9.728 1.00 45.41 N ATOM 964 CA ASP A 366 10.935 11.029 -8.542 1.00 55.34 C ATOM 965 C ASP A 366 12.410 11.278 -8.243 1.00 23.21 C ATOM 966 O ASP A 366 13.214 11.478 -9.154 1.00 43.44 O ATOM 967 CB ASP A 366 10.685 9.532 -8.730 1.00 11.51 C ATOM 968 CG ASP A 366 9.244 9.148 -8.462 1.00 42.00 C ATOM 969 OD1 ASP A 366 8.492 9.993 -7.933 1.00 64.02 O ATOM 970 OD2 ASP A 366 8.867 8.000 -8.782 1.00 61.22 O1- ATOM 0 H ASP A 366 10.468 11.205 -10.579 1.00 45.41 H new ATOM 0 HA ASP A 366 10.346 11.384 -7.696 1.00 55.34 H new ATOM 0 HB2 ASP A 366 10.951 9.247 -9.748 1.00 11.51 H new ATOM 0 HB3 ASP A 366 11.338 8.971 -8.062 1.00 11.51 H new ATOM 975 N LEU A 367 12.759 11.265 -6.961 1.00 23.41 N ATOM 976 CA LEU A 367 14.137 11.490 -6.541 1.00 3.23 C ATOM 977 C LEU A 367 14.691 10.268 -5.815 1.00 43.21 C ATOM 978 O LEU A 367 15.608 10.381 -5.000 1.00 4.41 O ATOM 979 CB LEU A 367 14.221 12.719 -5.632 1.00 71.32 C ATOM 980 CG LEU A 367 14.336 14.069 -6.340 1.00 54.14 C ATOM 981 CD1 LEU A 367 15.729 14.250 -6.921 1.00 61.24 C ATOM 982 CD2 LEU A 367 13.281 14.193 -7.429 1.00 25.52 C ATOM 0 H LEU A 367 12.106 11.101 -6.195 1.00 23.41 H new ATOM 0 HA LEU A 367 14.739 11.664 -7.433 1.00 3.23 H new ATOM 0 HB2 LEU A 367 13.335 12.738 -4.997 1.00 71.32 H new ATOM 0 HB3 LEU A 367 15.082 12.602 -4.974 1.00 71.32 H new ATOM 0 HG LEU A 367 14.165 14.857 -5.607 1.00 54.14 H new ATOM 0 HD11 LEU A 367 15.792 15.216 -7.421 1.00 61.24 H new ATOM 0 HD12 LEU A 367 16.466 14.208 -6.119 1.00 61.24 H new ATOM 0 HD13 LEU A 367 15.929 13.456 -7.640 1.00 61.24 H new ATOM 0 HD21 LEU A 367 13.379 15.160 -7.922 1.00 25.52 H new ATOM 0 HD22 LEU A 367 13.419 13.397 -8.161 1.00 25.52 H new ATOM 0 HD23 LEU A 367 12.289 14.110 -6.985 1.00 25.52 H new ATOM 994 N ARG A 368 14.132 9.102 -6.119 1.00 1.50 N ATOM 995 CA ARG A 368 14.572 7.859 -5.496 1.00 24.01 C ATOM 996 C ARG A 368 15.930 7.427 -6.043 1.00 51.02 C ATOM 997 O ARG A 368 16.785 6.946 -5.301 1.00 12.14 O ATOM 998 CB ARG A 368 13.540 6.754 -5.730 1.00 72.51 C ATOM 999 CG ARG A 368 13.312 6.437 -7.200 1.00 14.40 C ATOM 1000 CD ARG A 368 12.228 5.384 -7.380 1.00 25.41 C ATOM 1001 NE ARG A 368 12.048 5.020 -8.783 1.00 72.33 N ATOM 1002 CZ ARG A 368 11.482 3.885 -9.180 1.00 42.12 C ATOM 1003 NH1 ARG A 368 11.044 3.010 -8.285 1.00 61.33 N1+ ATOM 1004 NH2 ARG A 368 11.354 3.625 -10.475 1.00 65.51 N ATOM 0 H ARG A 368 13.374 8.991 -6.792 1.00 1.50 H new ATOM 0 HA ARG A 368 14.671 8.034 -4.425 1.00 24.01 H new ATOM 0 HB2 ARG A 368 13.866 5.849 -5.218 1.00 72.51 H new ATOM 0 HB3 ARG A 368 12.593 7.051 -5.280 1.00 72.51 H new ATOM 0 HG2 ARG A 368 13.029 7.346 -7.730 1.00 14.40 H new ATOM 0 HG3 ARG A 368 14.242 6.084 -7.646 1.00 14.40 H new ATOM 0 HD2 ARG A 368 12.487 4.495 -6.805 1.00 25.41 H new ATOM 0 HD3 ARG A 368 11.287 5.760 -6.979 1.00 25.41 H new ATOM 0 HE ARG A 368 12.374 5.672 -9.496 1.00 72.33 H new ATOM 0 HH11 ARG A 368 11.141 3.207 -7.289 1.00 61.33 H new ATOM 0 HH12 ARG A 368 10.610 2.140 -8.593 1.00 61.33 H new ATOM 0 HH21 ARG A 368 11.690 4.296 -11.166 1.00 65.51 H new ATOM 0 HH22 ARG A 368 10.920 2.754 -10.780 1.00 65.51 H new ATOM 1018 N ASN A 369 16.119 7.602 -7.346 1.00 74.53 N ATOM 1019 CA ASN A 369 17.372 7.230 -7.993 1.00 42.03 C ATOM 1020 C ASN A 369 18.000 8.430 -8.695 1.00 1.52 C ATOM 1021 O ASN A 369 18.715 8.279 -9.685 1.00 2.15 O ATOM 1022 CB ASN A 369 17.135 6.103 -8.999 1.00 63.03 C ATOM 1023 CG ASN A 369 17.118 4.735 -8.342 1.00 51.31 C ATOM 1024 OD1 ASN A 369 17.791 4.509 -7.337 1.00 4.11 O ATOM 1025 ND2 ASN A 369 16.345 3.816 -8.910 1.00 23.10 N ATOM 0 H ASN A 369 15.421 7.999 -7.975 1.00 74.53 H new ATOM 0 HA ASN A 369 18.060 6.882 -7.223 1.00 42.03 H new ATOM 0 HB2 ASN A 369 16.187 6.269 -9.510 1.00 63.03 H new ATOM 0 HB3 ASN A 369 17.916 6.128 -9.759 1.00 63.03 H new ATOM 0 HD21 ASN A 369 16.292 2.878 -8.513 1.00 23.10 H new ATOM 0 HD22 ASN A 369 15.804 4.049 -9.743 1.00 23.10 H new ATOM 1032 N ALA A 370 17.726 9.623 -8.176 1.00 31.21 N ATOM 1033 CA ALA A 370 18.266 10.849 -8.752 1.00 64.50 C ATOM 1034 C ALA A 370 19.639 11.169 -8.173 1.00 70.32 C ATOM 1035 O ALA A 370 19.820 11.194 -6.955 1.00 51.14 O ATOM 1036 CB ALA A 370 17.308 12.007 -8.517 1.00 32.21 C ATOM 0 H ALA A 370 17.134 9.766 -7.358 1.00 31.21 H new ATOM 0 HA ALA A 370 18.381 10.698 -9.825 1.00 64.50 H new ATOM 0 HB1 ALA A 370 17.723 12.916 -8.952 1.00 32.21 H new ATOM 0 HB2 ALA A 370 16.349 11.786 -8.985 1.00 32.21 H new ATOM 0 HB3 ALA A 370 17.165 12.149 -7.446 1.00 32.21 H new ATOM 1042 N SER A 371 20.606 11.414 -9.052 1.00 31.44 N ATOM 1043 CA SER A 371 21.964 11.727 -8.628 1.00 64.13 C ATOM 1044 C SER A 371 21.982 12.965 -7.734 1.00 2.51 C ATOM 1045 O SER A 371 20.961 13.629 -7.554 1.00 64.12 O ATOM 1046 CB SER A 371 22.863 11.951 -9.845 1.00 43.24 C ATOM 1047 OG SER A 371 22.849 13.310 -10.247 1.00 14.45 O ATOM 0 H SER A 371 20.473 11.401 -10.063 1.00 31.44 H new ATOM 0 HA SER A 371 22.344 10.880 -8.056 1.00 64.13 H new ATOM 0 HB2 SER A 371 23.883 11.649 -9.608 1.00 43.24 H new ATOM 0 HB3 SER A 371 22.528 11.321 -10.669 1.00 43.24 H new ATOM 0 HG SER A 371 23.433 13.427 -11.026 1.00 14.45 H new ATOM 1053 N HIS A 372 23.150 13.268 -7.176 1.00 13.42 N ATOM 1054 CA HIS A 372 23.303 14.425 -6.302 1.00 72.30 C ATOM 1055 C HIS A 372 22.969 15.716 -7.046 1.00 51.12 C ATOM 1056 O HIS A 372 22.128 16.498 -6.603 1.00 25.34 O ATOM 1057 CB HIS A 372 24.729 14.493 -5.755 1.00 62.22 C ATOM 1058 CG HIS A 372 24.892 15.469 -4.630 1.00 12.23 C ATOM 1059 ND1 HIS A 372 26.122 15.930 -4.207 1.00 21.24 N ATOM 1060 CD2 HIS A 372 23.974 16.074 -3.842 1.00 43.11 C ATOM 1061 CE1 HIS A 372 25.952 16.774 -3.206 1.00 65.31 C ATOM 1062 NE2 HIS A 372 24.657 16.880 -2.965 1.00 11.35 N ATOM 0 H HIS A 372 24.004 12.728 -7.314 1.00 13.42 H new ATOM 0 HA HIS A 372 22.608 14.315 -5.470 1.00 72.30 H new ATOM 0 HB2 HIS A 372 25.025 13.502 -5.411 1.00 62.22 H new ATOM 0 HB3 HIS A 372 25.407 14.766 -6.563 1.00 62.22 H new ATOM 0 HD2 HIS A 372 22.903 15.947 -3.893 1.00 43.11 H new ATOM 0 HE1 HIS A 372 26.738 17.290 -2.674 1.00 65.31 H new ATOM 0 HE2 HIS A 372 24.234 17.465 -2.245 1.00 11.35 H new ATOM 1070 N GLU A 373 23.634 15.931 -8.176 1.00 22.51 N ATOM 1071 CA GLU A 373 23.409 17.127 -8.978 1.00 2.13 C ATOM 1072 C GLU A 373 22.067 17.051 -9.702 1.00 53.21 C ATOM 1073 O GLU A 373 21.399 18.067 -9.900 1.00 42.43 O ATOM 1074 CB GLU A 373 24.539 17.307 -9.994 1.00 65.41 C ATOM 1075 CG GLU A 373 24.797 16.074 -10.843 1.00 44.41 C ATOM 1076 CD GLU A 373 25.707 16.358 -12.022 1.00 74.21 C ATOM 1077 OE1 GLU A 373 25.219 16.312 -13.171 1.00 34.15 O ATOM 1078 OE2 GLU A 373 26.905 16.626 -11.797 1.00 3.22 O1- ATOM 0 H GLU A 373 24.333 15.293 -8.557 1.00 22.51 H new ATOM 0 HA GLU A 373 23.393 17.986 -8.307 1.00 2.13 H new ATOM 0 HB2 GLU A 373 24.297 18.144 -10.649 1.00 65.41 H new ATOM 0 HB3 GLU A 373 25.454 17.571 -9.464 1.00 65.41 H new ATOM 0 HG2 GLU A 373 25.244 15.297 -10.223 1.00 44.41 H new ATOM 0 HG3 GLU A 373 23.847 15.683 -11.208 1.00 44.41 H new ATOM 1085 N GLN A 374 21.680 15.842 -10.094 1.00 71.21 N ATOM 1086 CA GLN A 374 20.419 15.634 -10.797 1.00 65.41 C ATOM 1087 C GLN A 374 19.250 16.194 -9.995 1.00 42.21 C ATOM 1088 O GLN A 374 18.339 16.807 -10.551 1.00 30.25 O ATOM 1089 CB GLN A 374 20.201 14.144 -11.067 1.00 11.04 C ATOM 1090 CG GLN A 374 18.753 13.784 -11.357 1.00 24.33 C ATOM 1091 CD GLN A 374 18.126 14.687 -12.402 1.00 24.55 C ATOM 1092 OE1 GLN A 374 18.745 15.004 -13.418 1.00 13.43 O ATOM 1093 NE2 GLN A 374 16.890 15.107 -12.156 1.00 72.25 N ATOM 0 H GLN A 374 22.221 14.992 -9.937 1.00 71.21 H new ATOM 0 HA GLN A 374 20.470 16.164 -11.748 1.00 65.41 H new ATOM 0 HB2 GLN A 374 20.818 13.842 -11.913 1.00 11.04 H new ATOM 0 HB3 GLN A 374 20.543 13.573 -10.204 1.00 11.04 H new ATOM 0 HG2 GLN A 374 18.701 12.750 -11.697 1.00 24.33 H new ATOM 0 HG3 GLN A 374 18.175 13.846 -10.435 1.00 24.33 H new ATOM 0 HE21 GLN A 374 16.414 14.819 -11.301 1.00 72.25 H new ATOM 0 HE22 GLN A 374 16.417 15.717 -12.822 1.00 72.25 H new ATOM 1102 N ALA A 375 19.282 15.980 -8.683 1.00 54.24 N ATOM 1103 CA ALA A 375 18.226 16.466 -7.804 1.00 42.42 C ATOM 1104 C ALA A 375 18.083 17.981 -7.902 1.00 35.42 C ATOM 1105 O ALA A 375 16.973 18.513 -7.866 1.00 11.04 O ATOM 1106 CB ALA A 375 18.504 16.052 -6.366 1.00 54.24 C ATOM 0 H ALA A 375 20.028 15.473 -8.206 1.00 54.24 H new ATOM 0 HA ALA A 375 17.286 16.017 -8.125 1.00 42.42 H new ATOM 0 HB1 ALA A 375 17.707 16.422 -5.720 1.00 54.24 H new ATOM 0 HB2 ALA A 375 18.548 14.965 -6.302 1.00 54.24 H new ATOM 0 HB3 ALA A 375 19.457 16.473 -6.044 1.00 54.24 H new ATOM 1112 N ALA A 376 19.212 18.671 -8.024 1.00 12.04 N ATOM 1113 CA ALA A 376 19.213 20.124 -8.128 1.00 21.41 C ATOM 1114 C ALA A 376 18.558 20.582 -9.427 1.00 60.15 C ATOM 1115 O ALA A 376 17.891 21.616 -9.466 1.00 2.42 O ATOM 1116 CB ALA A 376 20.634 20.661 -8.033 1.00 73.42 C ATOM 0 H ALA A 376 20.139 18.246 -8.053 1.00 12.04 H new ATOM 0 HA ALA A 376 18.630 20.522 -7.297 1.00 21.41 H new ATOM 0 HB1 ALA A 376 20.618 21.748 -8.112 1.00 73.42 H new ATOM 0 HB2 ALA A 376 21.068 20.373 -7.076 1.00 73.42 H new ATOM 0 HB3 ALA A 376 21.234 20.247 -8.843 1.00 73.42 H new ATOM 1122 N ILE A 377 18.753 19.805 -10.487 1.00 13.30 N ATOM 1123 CA ILE A 377 18.181 20.132 -11.788 1.00 53.01 C ATOM 1124 C ILE A 377 16.660 20.209 -11.715 1.00 53.41 C ATOM 1125 O ILE A 377 16.056 21.181 -12.168 1.00 0.34 O ATOM 1126 CB ILE A 377 18.580 19.095 -12.855 1.00 1.12 C ATOM 1127 CG1 ILE A 377 20.100 18.916 -12.879 1.00 51.02 C ATOM 1128 CG2 ILE A 377 18.070 19.519 -14.223 1.00 35.03 C ATOM 1129 CD1 ILE A 377 20.575 17.924 -13.918 1.00 10.32 C ATOM 0 H ILE A 377 19.302 18.946 -10.471 1.00 13.30 H new ATOM 0 HA ILE A 377 18.579 21.106 -12.072 1.00 53.01 H new ATOM 0 HB ILE A 377 18.124 18.139 -12.600 1.00 1.12 H new ATOM 0 HG12 ILE A 377 20.569 19.882 -13.069 1.00 51.02 H new ATOM 0 HG13 ILE A 377 20.435 18.588 -11.895 1.00 51.02 H new ATOM 0 HG21 ILE A 377 18.360 18.776 -14.966 1.00 35.03 H new ATOM 0 HG22 ILE A 377 16.983 19.601 -14.197 1.00 35.03 H new ATOM 0 HG23 ILE A 377 18.500 20.485 -14.489 1.00 35.03 H new ATOM 0 HD11 ILE A 377 21.662 17.848 -13.878 1.00 10.32 H new ATOM 0 HD12 ILE A 377 20.135 16.947 -13.716 1.00 10.32 H new ATOM 0 HD13 ILE A 377 20.271 18.261 -14.909 1.00 10.32 H new ATOM 1141 N ALA A 378 16.047 19.179 -11.142 1.00 23.43 N ATOM 1142 CA ALA A 378 14.596 19.132 -11.005 1.00 51.44 C ATOM 1143 C ALA A 378 14.093 20.251 -10.099 1.00 52.25 C ATOM 1144 O ALA A 378 13.090 20.901 -10.397 1.00 11.13 O ATOM 1145 CB ALA A 378 14.160 17.777 -10.468 1.00 31.34 C ATOM 0 H ALA A 378 16.533 18.365 -10.765 1.00 23.43 H new ATOM 0 HA ALA A 378 14.158 19.276 -11.992 1.00 51.44 H new ATOM 0 HB1 ALA A 378 13.075 17.756 -10.371 1.00 31.34 H new ATOM 0 HB2 ALA A 378 14.478 16.994 -11.156 1.00 31.34 H new ATOM 0 HB3 ALA A 378 14.615 17.609 -9.492 1.00 31.34 H new ATOM 1151 N LEU A 379 14.795 20.470 -8.994 1.00 14.45 N ATOM 1152 CA LEU A 379 14.419 21.510 -8.042 1.00 25.33 C ATOM 1153 C LEU A 379 14.367 22.875 -8.721 1.00 24.21 C ATOM 1154 O LEU A 379 13.514 23.705 -8.405 1.00 40.23 O ATOM 1155 CB LEU A 379 15.409 21.545 -6.877 1.00 74.04 C ATOM 1156 CG LEU A 379 14.821 21.887 -5.507 1.00 71.11 C ATOM 1157 CD1 LEU A 379 14.400 20.622 -4.776 1.00 65.34 C ATOM 1158 CD2 LEU A 379 15.825 22.675 -4.678 1.00 64.42 C ATOM 0 H LEU A 379 15.628 19.942 -8.734 1.00 14.45 H new ATOM 0 HA LEU A 379 13.426 21.276 -7.659 1.00 25.33 H new ATOM 0 HB2 LEU A 379 15.894 20.571 -6.809 1.00 74.04 H new ATOM 0 HB3 LEU A 379 16.186 22.273 -7.109 1.00 74.04 H new ATOM 0 HG LEU A 379 13.937 22.507 -5.657 1.00 71.11 H new ATOM 0 HD11 LEU A 379 13.984 20.885 -3.803 1.00 65.34 H new ATOM 0 HD12 LEU A 379 13.647 20.096 -5.363 1.00 65.34 H new ATOM 0 HD13 LEU A 379 15.267 19.976 -4.637 1.00 65.34 H new ATOM 0 HD21 LEU A 379 15.390 22.910 -3.707 1.00 64.42 H new ATOM 0 HD22 LEU A 379 16.727 22.080 -4.537 1.00 64.42 H new ATOM 0 HD23 LEU A 379 16.078 23.600 -5.196 1.00 64.42 H new ATOM 1170 N LYS A 380 15.282 23.100 -9.657 1.00 52.32 N ATOM 1171 CA LYS A 380 15.339 24.362 -10.384 1.00 51.01 C ATOM 1172 C LYS A 380 14.218 24.448 -11.416 1.00 22.42 C ATOM 1173 O LYS A 380 13.678 25.524 -11.671 1.00 72.12 O ATOM 1174 CB LYS A 380 16.695 24.515 -11.077 1.00 71.44 C ATOM 1175 CG LYS A 380 16.755 25.680 -12.049 1.00 11.03 C ATOM 1176 CD LYS A 380 16.497 27.004 -11.350 1.00 42.12 C ATOM 1177 CE LYS A 380 16.330 28.139 -12.348 1.00 13.01 C ATOM 1178 NZ LYS A 380 17.613 28.854 -12.596 1.00 32.14 N1+ ATOM 0 H LYS A 380 15.995 22.424 -9.930 1.00 52.32 H new ATOM 0 HA LYS A 380 15.211 25.171 -9.665 1.00 51.01 H new ATOM 0 HB2 LYS A 380 17.468 24.645 -10.319 1.00 71.44 H new ATOM 0 HB3 LYS A 380 16.925 23.594 -11.613 1.00 71.44 H new ATOM 0 HG2 LYS A 380 17.734 25.705 -12.528 1.00 11.03 H new ATOM 0 HG3 LYS A 380 16.018 25.535 -12.838 1.00 11.03 H new ATOM 0 HD2 LYS A 380 15.600 26.923 -10.736 1.00 42.12 H new ATOM 0 HD3 LYS A 380 17.325 27.229 -10.677 1.00 42.12 H new ATOM 0 HE2 LYS A 380 15.948 27.742 -13.289 1.00 13.01 H new ATOM 0 HE3 LYS A 380 15.588 28.844 -11.975 1.00 13.01 H new ATOM 0 HZ1 LYS A 380 17.457 29.620 -13.282 1.00 32.14 H new ATOM 0 HZ2 LYS A 380 17.965 29.255 -11.703 1.00 32.14 H new ATOM 0 HZ3 LYS A 380 18.314 28.187 -12.976 1.00 32.14 H new ATOM 1192 N ASN A 381 13.872 23.307 -12.003 1.00 71.53 N ATOM 1193 CA ASN A 381 12.814 23.253 -13.004 1.00 61.53 C ATOM 1194 C ASN A 381 11.473 22.910 -12.363 1.00 53.30 C ATOM 1195 O ASN A 381 10.535 22.496 -13.043 1.00 24.44 O ATOM 1196 CB ASN A 381 13.155 22.222 -14.082 1.00 43.53 C ATOM 1197 CG ASN A 381 13.754 22.858 -15.322 1.00 21.05 C ATOM 1198 OD1 ASN A 381 13.125 23.695 -15.969 1.00 71.43 O ATOM 1199 ND2 ASN A 381 14.976 22.462 -15.658 1.00 43.54 N ATOM 0 H ASN A 381 14.309 22.408 -11.802 1.00 71.53 H new ATOM 0 HA ASN A 381 12.734 24.238 -13.464 1.00 61.53 H new ATOM 0 HB2 ASN A 381 13.857 21.494 -13.675 1.00 43.53 H new ATOM 0 HB3 ASN A 381 12.253 21.676 -14.357 1.00 43.53 H new ATOM 0 HD21 ASN A 381 15.431 22.855 -16.482 1.00 43.54 H new ATOM 0 HD22 ASN A 381 15.460 21.765 -15.092 1.00 43.54 H new ATOM 1206 N ALA A 382 11.390 23.086 -11.048 1.00 14.22 N ATOM 1207 CA ALA A 382 10.165 22.798 -10.314 1.00 5.40 C ATOM 1208 C ALA A 382 9.060 23.782 -10.682 1.00 61.32 C ATOM 1209 O ALA A 382 7.962 23.382 -11.067 1.00 52.51 O ATOM 1210 CB ALA A 382 10.427 22.832 -8.815 1.00 75.24 C ATOM 0 H ALA A 382 12.158 23.427 -10.469 1.00 14.22 H new ATOM 0 HA ALA A 382 9.832 21.798 -10.591 1.00 5.40 H new ATOM 0 HB1 ALA A 382 9.503 22.615 -8.279 1.00 75.24 H new ATOM 0 HB2 ALA A 382 11.178 22.085 -8.560 1.00 75.24 H new ATOM 0 HB3 ALA A 382 10.788 23.821 -8.531 1.00 75.24 H new ATOM 1216 N GLY A 383 9.358 25.072 -10.562 1.00 51.03 N ATOM 1217 CA GLY A 383 8.379 26.094 -10.884 1.00 61.22 C ATOM 1218 C GLY A 383 8.271 27.155 -9.808 1.00 61.51 C ATOM 1219 O GLY A 383 9.267 27.514 -9.181 1.00 44.22 O ATOM 0 H GLY A 383 10.261 25.428 -10.247 1.00 51.03 H new ATOM 0 HA2 GLY A 383 8.649 26.566 -11.829 1.00 61.22 H new ATOM 0 HA3 GLY A 383 7.405 25.627 -11.028 1.00 61.22 H new ATOM 1223 N GLN A 384 7.059 27.659 -9.595 1.00 54.13 N ATOM 1224 CA GLN A 384 6.827 28.688 -8.589 1.00 12.05 C ATOM 1225 C GLN A 384 6.418 28.065 -7.258 1.00 51.43 C ATOM 1226 O GLN A 384 5.957 28.758 -6.350 1.00 12.44 O ATOM 1227 CB GLN A 384 5.746 29.661 -9.064 1.00 0.14 C ATOM 1228 CG GLN A 384 4.377 29.018 -9.226 1.00 50.22 C ATOM 1229 CD GLN A 384 3.463 29.814 -10.136 1.00 33.10 C ATOM 1230 OE1 GLN A 384 2.834 29.262 -11.040 1.00 1.44 O ATOM 1231 NE2 GLN A 384 3.384 31.118 -9.903 1.00 74.34 N ATOM 0 H GLN A 384 6.224 27.371 -10.105 1.00 54.13 H new ATOM 0 HA GLN A 384 7.759 29.235 -8.443 1.00 12.05 H new ATOM 0 HB2 GLN A 384 5.670 30.483 -8.352 1.00 0.14 H new ATOM 0 HB3 GLN A 384 6.051 30.092 -10.017 1.00 0.14 H new ATOM 0 HG2 GLN A 384 4.498 28.012 -9.628 1.00 50.22 H new ATOM 0 HG3 GLN A 384 3.909 28.916 -8.247 1.00 50.22 H new ATOM 0 HE21 GLN A 384 3.923 31.534 -9.143 1.00 74.34 H new ATOM 0 HE22 GLN A 384 2.785 31.704 -10.484 1.00 74.34 H new ATOM 1240 N THR A 385 6.589 26.750 -7.148 1.00 2.34 N ATOM 1241 CA THR A 385 6.236 26.033 -5.930 1.00 2.15 C ATOM 1242 C THR A 385 6.905 24.665 -5.884 1.00 62.43 C ATOM 1243 O THR A 385 6.399 23.696 -6.452 1.00 3.14 O ATOM 1244 CB THR A 385 4.711 25.851 -5.805 1.00 3.33 C ATOM 1245 OG1 THR A 385 4.069 27.129 -5.748 1.00 13.00 O ATOM 1246 CG2 THR A 385 4.362 25.046 -4.563 1.00 52.23 C ATOM 0 H THR A 385 6.970 26.161 -7.889 1.00 2.34 H new ATOM 0 HA THR A 385 6.591 26.637 -5.095 1.00 2.15 H new ATOM 0 HB THR A 385 4.359 25.307 -6.681 1.00 3.33 H new ATOM 0 HG1 THR A 385 4.739 27.824 -5.581 1.00 13.00 H new ATOM 0 HG21 THR A 385 3.280 24.931 -4.496 1.00 52.23 H new ATOM 0 HG22 THR A 385 4.829 24.063 -4.624 1.00 52.23 H new ATOM 0 HG23 THR A 385 4.727 25.567 -3.678 1.00 52.23 H new ATOM 1254 N VAL A 386 8.044 24.591 -5.204 1.00 15.40 N ATOM 1255 CA VAL A 386 8.783 23.339 -5.082 1.00 22.21 C ATOM 1256 C VAL A 386 8.139 22.420 -4.050 1.00 3.40 C ATOM 1257 O VAL A 386 8.147 22.709 -2.854 1.00 54.32 O ATOM 1258 CB VAL A 386 10.250 23.588 -4.689 1.00 1.11 C ATOM 1259 CG1 VAL A 386 11.016 24.211 -5.846 1.00 31.41 C ATOM 1260 CG2 VAL A 386 10.327 24.471 -3.452 1.00 71.42 C ATOM 0 H VAL A 386 8.476 25.383 -4.729 1.00 15.40 H new ATOM 0 HA VAL A 386 8.755 22.858 -6.060 1.00 22.21 H new ATOM 0 HB VAL A 386 10.712 22.629 -4.454 1.00 1.11 H new ATOM 0 HG11 VAL A 386 12.051 24.379 -5.548 1.00 31.41 H new ATOM 0 HG12 VAL A 386 10.990 23.539 -6.704 1.00 31.41 H new ATOM 0 HG13 VAL A 386 10.557 25.162 -6.116 1.00 31.41 H new ATOM 0 HG21 VAL A 386 11.371 24.637 -3.188 1.00 71.42 H new ATOM 0 HG22 VAL A 386 9.848 25.428 -3.658 1.00 71.42 H new ATOM 0 HG23 VAL A 386 9.817 23.981 -2.623 1.00 71.42 H new ATOM 1270 N THR A 387 7.583 21.307 -4.521 1.00 33.22 N ATOM 1271 CA THR A 387 6.934 20.346 -3.639 1.00 41.44 C ATOM 1272 C THR A 387 7.778 19.085 -3.486 1.00 42.03 C ATOM 1273 O THR A 387 7.835 18.251 -4.389 1.00 22.24 O ATOM 1274 CB THR A 387 5.539 19.955 -4.163 1.00 55.24 C ATOM 1275 OG1 THR A 387 5.631 19.525 -5.526 1.00 41.04 O ATOM 1276 CG2 THR A 387 4.574 21.126 -4.060 1.00 53.15 C ATOM 0 H THR A 387 7.570 21.050 -5.508 1.00 33.22 H new ATOM 0 HA THR A 387 6.827 20.830 -2.668 1.00 41.44 H new ATOM 0 HB THR A 387 5.160 19.138 -3.549 1.00 55.24 H new ATOM 0 HG1 THR A 387 6.341 18.855 -5.610 1.00 41.04 H new ATOM 0 HG21 THR A 387 3.596 20.826 -4.436 1.00 53.15 H new ATOM 0 HG22 THR A 387 4.484 21.433 -3.018 1.00 53.15 H new ATOM 0 HG23 THR A 387 4.950 21.960 -4.652 1.00 53.15 H new ATOM 1284 N ILE A 388 8.431 18.953 -2.336 1.00 62.03 N ATOM 1285 CA ILE A 388 9.270 17.793 -2.064 1.00 34.34 C ATOM 1286 C ILE A 388 8.675 16.932 -0.955 1.00 20.33 C ATOM 1287 O ILE A 388 8.265 17.442 0.088 1.00 65.41 O ATOM 1288 CB ILE A 388 10.697 18.212 -1.663 1.00 21.21 C ATOM 1289 CG1 ILE A 388 11.388 18.925 -2.828 1.00 72.43 C ATOM 1290 CG2 ILE A 388 11.502 16.997 -1.226 1.00 21.25 C ATOM 1291 CD1 ILE A 388 11.367 20.433 -2.711 1.00 51.22 C ATOM 0 H ILE A 388 8.395 19.635 -1.578 1.00 62.03 H new ATOM 0 HA ILE A 388 9.316 17.213 -2.986 1.00 34.34 H new ATOM 0 HB ILE A 388 10.635 18.904 -0.823 1.00 21.21 H new ATOM 0 HG12 ILE A 388 12.423 18.588 -2.888 1.00 72.43 H new ATOM 0 HG13 ILE A 388 10.904 18.634 -3.760 1.00 72.43 H new ATOM 0 HG21 ILE A 388 12.508 17.309 -0.946 1.00 21.25 H new ATOM 0 HG22 ILE A 388 11.016 16.527 -0.371 1.00 21.25 H new ATOM 0 HG23 ILE A 388 11.559 16.284 -2.048 1.00 21.25 H new ATOM 0 HD11 ILE A 388 11.874 20.872 -3.570 1.00 51.22 H new ATOM 0 HD12 ILE A 388 10.335 20.781 -2.682 1.00 51.22 H new ATOM 0 HD13 ILE A 388 11.877 20.734 -1.796 1.00 51.22 H new ATOM 1303 N ILE A 389 8.633 15.624 -1.187 1.00 72.12 N ATOM 1304 CA ILE A 389 8.090 14.692 -0.206 1.00 73.10 C ATOM 1305 C ILE A 389 9.173 14.215 0.756 1.00 74.25 C ATOM 1306 O ILE A 389 10.150 13.589 0.346 1.00 21.12 O ATOM 1307 CB ILE A 389 7.449 13.468 -0.887 1.00 64.04 C ATOM 1308 CG1 ILE A 389 6.477 13.916 -1.981 1.00 14.22 C ATOM 1309 CG2 ILE A 389 6.736 12.604 0.141 1.00 24.01 C ATOM 1310 CD1 ILE A 389 5.771 12.769 -2.670 1.00 73.34 C ATOM 0 H ILE A 389 8.968 15.186 -2.045 1.00 72.12 H new ATOM 0 HA ILE A 389 7.323 15.231 0.351 1.00 73.10 H new ATOM 0 HB ILE A 389 8.237 12.873 -1.349 1.00 64.04 H new ATOM 0 HG12 ILE A 389 5.732 14.580 -1.544 1.00 14.22 H new ATOM 0 HG13 ILE A 389 7.023 14.496 -2.725 1.00 14.22 H new ATOM 0 HG21 ILE A 389 6.288 11.743 -0.355 1.00 24.01 H new ATOM 0 HG22 ILE A 389 7.452 12.261 0.887 1.00 24.01 H new ATOM 0 HG23 ILE A 389 5.956 13.188 0.629 1.00 24.01 H new ATOM 0 HD11 ILE A 389 5.098 13.161 -3.433 1.00 73.34 H new ATOM 0 HD12 ILE A 389 6.508 12.116 -3.137 1.00 73.34 H new ATOM 0 HD13 ILE A 389 5.197 12.202 -1.937 1.00 73.34 H new ATOM 1322 N ALA A 390 8.990 14.513 2.038 1.00 44.01 N ATOM 1323 CA ALA A 390 9.950 14.112 3.060 1.00 3.23 C ATOM 1324 C ALA A 390 9.322 13.136 4.049 1.00 33.33 C ATOM 1325 O ALA A 390 8.242 13.388 4.581 1.00 24.21 O ATOM 1326 CB ALA A 390 10.486 15.334 3.789 1.00 22.20 C ATOM 0 H ALA A 390 8.186 15.030 2.394 1.00 44.01 H new ATOM 0 HA ALA A 390 10.779 13.605 2.566 1.00 3.23 H new ATOM 0 HB1 ALA A 390 11.201 15.020 4.549 1.00 22.20 H new ATOM 0 HB2 ALA A 390 10.980 15.995 3.077 1.00 22.20 H new ATOM 0 HB3 ALA A 390 9.661 15.865 4.265 1.00 22.20 H new ATOM 1332 N GLN A 391 10.005 12.021 4.288 1.00 24.04 N ATOM 1333 CA GLN A 391 9.512 11.007 5.212 1.00 51.04 C ATOM 1334 C GLN A 391 10.545 10.708 6.295 1.00 24.21 C ATOM 1335 O GLN A 391 11.748 10.701 6.034 1.00 14.23 O ATOM 1336 CB GLN A 391 9.163 9.724 4.457 1.00 75.00 C ATOM 1337 CG GLN A 391 8.711 8.589 5.362 1.00 12.34 C ATOM 1338 CD GLN A 391 8.588 7.270 4.624 1.00 71.13 C ATOM 1339 OE1 GLN A 391 9.181 6.266 5.020 1.00 12.24 O ATOM 1340 NE2 GLN A 391 7.813 7.264 3.546 1.00 32.13 N ATOM 0 H GLN A 391 10.901 11.797 3.855 1.00 24.04 H new ATOM 0 HA GLN A 391 8.612 11.395 5.690 1.00 51.04 H new ATOM 0 HB2 GLN A 391 8.374 9.939 3.737 1.00 75.00 H new ATOM 0 HB3 GLN A 391 10.034 9.399 3.888 1.00 75.00 H new ATOM 0 HG2 GLN A 391 9.421 8.478 6.182 1.00 12.34 H new ATOM 0 HG3 GLN A 391 7.749 8.844 5.806 1.00 12.34 H new ATOM 0 HE21 GLN A 391 7.340 8.119 3.253 1.00 32.13 H new ATOM 0 HE22 GLN A 391 7.691 6.404 3.011 1.00 32.13 H new ATOM 1349 N TYR A 392 10.067 10.464 7.510 1.00 2.00 N ATOM 1350 CA TYR A 392 10.950 10.169 8.633 1.00 4.12 C ATOM 1351 C TYR A 392 11.883 9.008 8.302 1.00 31.32 C ATOM 1352 O TYR A 392 11.448 7.863 8.170 1.00 41.02 O ATOM 1353 CB TYR A 392 10.128 9.836 9.880 1.00 2.34 C ATOM 1354 CG TYR A 392 10.932 9.869 11.160 1.00 20.34 C ATOM 1355 CD1 TYR A 392 11.842 10.889 11.407 1.00 14.34 C ATOM 1356 CD2 TYR A 392 10.780 8.879 12.123 1.00 52.40 C ATOM 1357 CE1 TYR A 392 12.578 10.922 12.575 1.00 64.44 C ATOM 1358 CE2 TYR A 392 11.512 8.905 13.295 1.00 12.22 C ATOM 1359 CZ TYR A 392 12.411 9.927 13.516 1.00 44.04 C ATOM 1360 OH TYR A 392 13.142 9.957 14.682 1.00 14.22 O ATOM 0 H TYR A 392 9.074 10.465 7.743 1.00 2.00 H new ATOM 0 HA TYR A 392 11.555 11.054 8.829 1.00 4.12 H new ATOM 0 HB2 TYR A 392 9.303 10.543 9.961 1.00 2.34 H new ATOM 0 HB3 TYR A 392 9.689 8.845 9.762 1.00 2.34 H new ATOM 0 HD1 TYR A 392 11.976 11.670 10.673 1.00 14.34 H new ATOM 0 HD2 TYR A 392 10.078 8.076 11.953 1.00 52.40 H new ATOM 0 HE1 TYR A 392 13.281 11.723 12.751 1.00 64.44 H new ATOM 0 HE2 TYR A 392 11.381 8.129 14.034 1.00 12.22 H new ATOM 0 HH TYR A 392 12.904 9.185 15.237 1.00 14.22 H new ATOM 1370 N LYS A 393 13.169 9.312 8.167 1.00 43.50 N ATOM 1371 CA LYS A 393 14.167 8.296 7.853 1.00 75.02 C ATOM 1372 C LYS A 393 15.523 8.663 8.449 1.00 21.04 C ATOM 1373 O LYS A 393 16.474 8.982 7.737 1.00 23.45 O ATOM 1374 CB LYS A 393 14.293 8.128 6.337 1.00 53.43 C ATOM 1375 CG LYS A 393 13.093 7.450 5.698 1.00 34.22 C ATOM 1376 CD LYS A 393 12.928 6.024 6.195 1.00 11.43 C ATOM 1377 CE LYS A 393 12.294 5.135 5.136 1.00 61.24 C ATOM 1378 NZ LYS A 393 13.214 4.896 3.989 1.00 24.44 N1+ ATOM 0 H LYS A 393 13.545 10.254 8.270 1.00 43.50 H new ATOM 0 HA LYS A 393 13.840 7.353 8.291 1.00 75.02 H new ATOM 0 HB2 LYS A 393 14.431 9.109 5.881 1.00 53.43 H new ATOM 0 HB3 LYS A 393 15.188 7.546 6.118 1.00 53.43 H new ATOM 0 HG2 LYS A 393 12.191 8.020 5.920 1.00 34.22 H new ATOM 0 HG3 LYS A 393 13.210 7.447 4.614 1.00 34.22 H new ATOM 0 HD2 LYS A 393 13.901 5.620 6.476 1.00 11.43 H new ATOM 0 HD3 LYS A 393 12.310 6.020 7.093 1.00 11.43 H new ATOM 0 HE2 LYS A 393 12.015 4.181 5.583 1.00 61.24 H new ATOM 0 HE3 LYS A 393 11.376 5.599 4.775 1.00 61.24 H new ATOM 0 HZ1 LYS A 393 12.679 4.494 3.193 1.00 24.44 H new ATOM 0 HZ2 LYS A 393 13.646 5.796 3.697 1.00 24.44 H new ATOM 0 HZ3 LYS A 393 13.960 4.231 4.275 1.00 24.44 H new ATOM 1392 N PRO A 394 15.615 8.613 9.786 1.00 42.31 N ATOM 1393 CA PRO A 394 16.850 8.936 10.507 1.00 61.10 C ATOM 1394 C PRO A 394 17.934 7.884 10.296 1.00 41.21 C ATOM 1395 O PRO A 394 19.124 8.197 10.307 1.00 42.30 O ATOM 1396 CB PRO A 394 16.409 8.963 11.972 1.00 52.41 C ATOM 1397 CG PRO A 394 15.210 8.079 12.023 1.00 73.53 C ATOM 1398 CD PRO A 394 14.520 8.241 10.698 1.00 35.43 C ATOM 0 HA PRO A 394 17.290 9.872 10.164 1.00 61.10 H new ATOM 0 HB2 PRO A 394 17.198 8.598 12.630 1.00 52.41 H new ATOM 0 HB3 PRO A 394 16.168 9.976 12.294 1.00 52.41 H new ATOM 0 HG2 PRO A 394 15.497 7.041 12.189 1.00 73.53 H new ATOM 0 HG3 PRO A 394 14.551 8.362 12.844 1.00 73.53 H new ATOM 0 HD2 PRO A 394 14.031 7.319 10.384 1.00 35.43 H new ATOM 0 HD3 PRO A 394 13.750 9.012 10.737 1.00 35.43 H new ATOM 1406 N GLU A 395 17.514 6.638 10.104 1.00 14.25 N ATOM 1407 CA GLU A 395 18.452 5.541 9.892 1.00 61.24 C ATOM 1408 C GLU A 395 19.022 5.579 8.476 1.00 13.51 C ATOM 1409 O GLU A 395 20.190 5.259 8.259 1.00 53.42 O ATOM 1410 CB GLU A 395 17.763 4.197 10.140 1.00 45.31 C ATOM 1411 CG GLU A 395 17.342 3.986 11.585 1.00 42.34 C ATOM 1412 CD GLU A 395 18.442 4.335 12.569 1.00 3.54 C ATOM 1413 OE1 GLU A 395 19.300 3.466 12.832 1.00 45.14 O ATOM 1414 OE2 GLU A 395 18.443 5.476 13.076 1.00 11.43 O1- ATOM 0 H GLU A 395 16.532 6.363 10.091 1.00 14.25 H new ATOM 0 HA GLU A 395 19.273 5.657 10.599 1.00 61.24 H new ATOM 0 HB2 GLU A 395 16.884 4.126 9.500 1.00 45.31 H new ATOM 0 HB3 GLU A 395 18.437 3.393 9.846 1.00 45.31 H new ATOM 0 HG2 GLU A 395 16.463 4.596 11.796 1.00 42.34 H new ATOM 0 HG3 GLU A 395 17.050 2.945 11.726 1.00 42.34 H new ATOM 1421 N GLU A 396 18.187 5.972 7.520 1.00 2.44 N ATOM 1422 CA GLU A 396 18.609 6.051 6.125 1.00 54.14 C ATOM 1423 C GLU A 396 19.629 7.168 5.928 1.00 52.41 C ATOM 1424 O GLU A 396 20.672 6.967 5.303 1.00 11.52 O ATOM 1425 CB GLU A 396 17.399 6.283 5.216 1.00 12.42 C ATOM 1426 CG GLU A 396 16.276 5.283 5.432 1.00 33.21 C ATOM 1427 CD GLU A 396 16.576 3.928 4.821 1.00 11.11 C ATOM 1428 OE1 GLU A 396 16.827 2.975 5.589 1.00 41.00 O ATOM 1429 OE2 GLU A 396 16.561 3.821 3.577 1.00 41.42 O1- ATOM 0 H GLU A 396 17.217 6.240 7.684 1.00 2.44 H new ATOM 0 HA GLU A 396 19.078 5.104 5.859 1.00 54.14 H new ATOM 0 HB2 GLU A 396 17.016 7.289 5.385 1.00 12.42 H new ATOM 0 HB3 GLU A 396 17.722 6.235 4.176 1.00 12.42 H new ATOM 0 HG2 GLU A 396 16.101 5.164 6.501 1.00 33.21 H new ATOM 0 HG3 GLU A 396 15.356 5.677 5.000 1.00 33.21 H new ATOM 1436 N TYR A 397 19.322 8.344 6.463 1.00 20.30 N ATOM 1437 CA TYR A 397 20.210 9.493 6.343 1.00 75.01 C ATOM 1438 C TYR A 397 21.478 9.290 7.168 1.00 10.42 C ATOM 1439 O TYR A 397 22.550 9.781 6.810 1.00 41.34 O ATOM 1440 CB TYR A 397 19.493 10.767 6.794 1.00 75.24 C ATOM 1441 CG TYR A 397 20.414 11.956 6.954 1.00 45.10 C ATOM 1442 CD1 TYR A 397 20.764 12.740 5.861 1.00 44.40 C ATOM 1443 CD2 TYR A 397 20.935 12.295 8.197 1.00 32.42 C ATOM 1444 CE1 TYR A 397 21.606 13.827 6.002 1.00 13.04 C ATOM 1445 CE2 TYR A 397 21.777 13.380 8.346 1.00 21.33 C ATOM 1446 CZ TYR A 397 22.108 14.144 7.246 1.00 53.25 C ATOM 1447 OH TYR A 397 22.947 15.225 7.392 1.00 53.31 O ATOM 0 H TYR A 397 18.464 8.526 6.984 1.00 20.30 H new ATOM 0 HA TYR A 397 20.492 9.594 5.295 1.00 75.01 H new ATOM 0 HB2 TYR A 397 18.718 11.014 6.069 1.00 75.24 H new ATOM 0 HB3 TYR A 397 18.992 10.576 7.743 1.00 75.24 H new ATOM 0 HD1 TYR A 397 20.371 12.496 4.885 1.00 44.40 H new ATOM 0 HD2 TYR A 397 20.677 11.700 9.061 1.00 32.42 H new ATOM 0 HE1 TYR A 397 21.869 14.425 5.142 1.00 13.04 H new ATOM 0 HE2 TYR A 397 22.174 13.629 9.319 1.00 21.33 H new ATOM 0 HH TYR A 397 23.210 15.310 8.332 1.00 53.31 H new ATOM 1457 N SER A 398 21.347 8.565 8.273 1.00 61.04 N ATOM 1458 CA SER A 398 22.481 8.298 9.151 1.00 1.35 C ATOM 1459 C SER A 398 23.641 7.687 8.371 1.00 32.04 C ATOM 1460 O SER A 398 24.800 7.799 8.772 1.00 50.11 O ATOM 1461 CB SER A 398 22.064 7.361 10.287 1.00 14.33 C ATOM 1462 OG SER A 398 23.198 6.843 10.962 1.00 1.04 O ATOM 0 H SER A 398 20.467 8.152 8.582 1.00 61.04 H new ATOM 0 HA SER A 398 22.812 9.246 9.575 1.00 1.35 H new ATOM 0 HB2 SER A 398 21.431 7.899 10.993 1.00 14.33 H new ATOM 0 HB3 SER A 398 21.469 6.540 9.886 1.00 14.33 H new ATOM 0 HG SER A 398 22.906 6.249 11.684 1.00 1.04 H new ATOM 1468 N ARG A 399 23.319 7.040 7.255 1.00 63.33 N ATOM 1469 CA ARG A 399 24.334 6.410 6.419 1.00 24.30 C ATOM 1470 C ARG A 399 25.348 7.437 5.926 1.00 72.24 C ATOM 1471 O ARG A 399 26.528 7.130 5.759 1.00 44.15 O ATOM 1472 CB ARG A 399 23.678 5.710 5.227 1.00 24.15 C ATOM 1473 CG ARG A 399 23.303 6.655 4.097 1.00 54.32 C ATOM 1474 CD ARG A 399 22.440 5.962 3.055 1.00 34.13 C ATOM 1475 NE ARG A 399 22.685 6.478 1.710 1.00 61.24 N ATOM 1476 CZ ARG A 399 23.820 6.290 1.046 1.00 41.35 C ATOM 1477 NH1 ARG A 399 24.808 5.600 1.599 1.00 11.31 N1+ ATOM 1478 NH2 ARG A 399 23.967 6.791 -0.174 1.00 3.10 N ATOM 0 H ARG A 399 22.365 6.939 6.910 1.00 63.33 H new ATOM 0 HA ARG A 399 24.859 5.670 7.023 1.00 24.30 H new ATOM 0 HB2 ARG A 399 24.359 4.950 4.843 1.00 24.15 H new ATOM 0 HB3 ARG A 399 22.782 5.192 5.569 1.00 24.15 H new ATOM 0 HG2 ARG A 399 22.767 7.514 4.502 1.00 54.32 H new ATOM 0 HG3 ARG A 399 24.208 7.037 3.625 1.00 54.32 H new ATOM 0 HD2 ARG A 399 22.639 4.890 3.074 1.00 34.13 H new ATOM 0 HD3 ARG A 399 21.388 6.095 3.308 1.00 34.13 H new ATOM 0 HE ARG A 399 21.944 7.012 1.256 1.00 61.24 H new ATOM 0 HH11 ARG A 399 24.697 5.212 2.536 1.00 11.31 H new ATOM 0 HH12 ARG A 399 25.679 5.457 1.087 1.00 11.31 H new ATOM 0 HH21 ARG A 399 23.208 7.321 -0.603 1.00 3.10 H new ATOM 0 HH22 ARG A 399 24.839 6.646 -0.683 1.00 3.10 H new ATOM 1492 N PHE A 400 24.878 8.658 5.693 1.00 45.45 N ATOM 1493 CA PHE A 400 25.743 9.732 5.216 1.00 3.02 C ATOM 1494 C PHE A 400 26.623 10.262 6.345 1.00 32.14 C ATOM 1495 O PHE A 400 27.832 10.420 6.180 1.00 44.42 O ATOM 1496 CB PHE A 400 24.905 10.870 4.631 1.00 62.21 C ATOM 1497 CG PHE A 400 24.530 10.659 3.192 1.00 24.03 C ATOM 1498 CD1 PHE A 400 23.201 10.550 2.817 1.00 2.32 C ATOM 1499 CD2 PHE A 400 25.508 10.570 2.214 1.00 3.43 C ATOM 1500 CE1 PHE A 400 22.854 10.356 1.493 1.00 75.53 C ATOM 1501 CE2 PHE A 400 25.166 10.376 0.889 1.00 13.35 C ATOM 1502 CZ PHE A 400 23.838 10.269 0.528 1.00 64.05 C ATOM 0 H PHE A 400 23.904 8.929 5.826 1.00 45.45 H new ATOM 0 HA PHE A 400 26.387 9.327 4.435 1.00 3.02 H new ATOM 0 HB2 PHE A 400 23.996 10.983 5.222 1.00 62.21 H new ATOM 0 HB3 PHE A 400 25.461 11.803 4.720 1.00 62.21 H new ATOM 0 HD1 PHE A 400 22.427 10.617 3.567 1.00 2.32 H new ATOM 0 HD2 PHE A 400 26.549 10.653 2.490 1.00 3.43 H new ATOM 0 HE1 PHE A 400 21.814 10.273 1.214 1.00 75.53 H new ATOM 0 HE2 PHE A 400 25.938 10.308 0.136 1.00 13.35 H new ATOM 0 HZ PHE A 400 23.569 10.118 -0.507 1.00 64.05 H new ATOM 1512 N GLU A 401 26.006 10.535 7.491 1.00 2.42 N ATOM 1513 CA GLU A 401 26.733 11.049 8.645 1.00 63.41 C ATOM 1514 C GLU A 401 27.304 9.907 9.480 1.00 54.33 C ATOM 1515 O GLU A 401 26.575 9.226 10.202 1.00 13.24 O ATOM 1516 CB GLU A 401 25.815 11.917 9.508 1.00 30.12 C ATOM 1517 CG GLU A 401 26.543 13.033 10.239 1.00 73.34 C ATOM 1518 CD GLU A 401 26.641 14.303 9.417 1.00 22.14 C ATOM 1519 OE1 GLU A 401 26.270 15.376 9.935 1.00 44.41 O ATOM 1520 OE2 GLU A 401 27.088 14.223 8.254 1.00 43.43 O1- ATOM 0 H GLU A 401 25.006 10.409 7.644 1.00 2.42 H new ATOM 0 HA GLU A 401 27.560 11.658 8.280 1.00 63.41 H new ATOM 0 HB2 GLU A 401 25.041 12.352 8.876 1.00 30.12 H new ATOM 0 HB3 GLU A 401 25.311 11.284 10.238 1.00 30.12 H new ATOM 0 HG2 GLU A 401 26.025 13.249 11.173 1.00 73.34 H new ATOM 0 HG3 GLU A 401 27.546 12.696 10.501 1.00 73.34 H new ATOM 1527 N ALA A 402 28.613 9.704 9.377 1.00 74.34 N ATOM 1528 CA ALA A 402 29.283 8.646 10.124 1.00 11.33 C ATOM 1529 C ALA A 402 30.416 9.208 10.976 1.00 52.51 C ATOM 1530 O ALA A 402 31.222 8.458 11.526 1.00 24.04 O ATOM 1531 CB ALA A 402 29.814 7.583 9.172 1.00 70.13 C ATOM 0 H ALA A 402 29.231 10.258 8.784 1.00 74.34 H new ATOM 0 HA ALA A 402 28.553 8.189 10.792 1.00 11.33 H new ATOM 0 HB1 ALA A 402 30.312 6.799 9.743 1.00 70.13 H new ATOM 0 HB2 ALA A 402 28.986 7.152 8.610 1.00 70.13 H new ATOM 0 HB3 ALA A 402 30.525 8.036 8.481 1.00 70.13 H new TER 1537 ALA A 402