USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 825 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 527 ASN : amide:sc= -0.86 K(o=-0.68,f=-5.8!) USER MOD Set 1.2: A 529 ASN : amide:sc= 0.183 X(o=-0.68,f=-1) USER MOD Set 2.1: A 472 SER OG : rot -126:sc= 0.0199 USER MOD Set 2.2: A 522 THR OG1 : rot -39:sc= -0.211 USER MOD Set 3.1: A 514 ASN : amide:sc= -1.12 K(o=-1.1,f=-3.1!) USER MOD Set 3.2: A 534 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 441 THR OG1 : rot 119:sc= 0.376 USER MOD Set 4.2: A 530 ASN : amide:sc= -2.92! C(o=-2.5!,f=-3.4!) USER MOD Single : A 445 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.032) USER MOD Single : A 453 ASN :FLIP amide:sc= -1.11 F(o=-2.3!,f=-1.1) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -151:sc= 0.535 USER MOD Single : A 461 HIS : no HE2:sc= 0.641 K(o=0.64,f=-2.7!) USER MOD Single : A 463 LYS NZ :NH3+ 160:sc= 1.25 (180deg=1.18) USER MOD Single : A 464 ASN : amide:sc= -0.525 K(o=-0.53,f=-10!) USER MOD Single : A 473 THR OG1 : rot 93:sc= 0.309 USER MOD Single : A 474 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00883) USER MOD Single : A 478 TYR OH : rot -136:sc= 0.227 USER MOD Single : A 480 ASN : amide:sc= 0.835 K(o=0.84,f=-6.1!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 180:sc= 0.786 USER MOD Single : A 485 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0623) USER MOD Single : A 486 ASN : amide:sc= -1.67! C(o=-1.7!,f=-4.5!) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0.0604 K(o=0.06,f=-5.7!) USER MOD Single : A 510 MET CE :methyl -149:sc= -0.723 (180deg=-2.6!) USER MOD Single : A 511 TYR OH : rot 37:sc= 0.5 USER MOD Single : A 516 THR OG1 : rot -100:sc= 0 USER MOD Single : A 521 ASN : amide:sc= -0.155 X(o=-0.15,f=-0.29) USER MOD Single : A 531 ASN : amide:sc= -0.911! X(o=-0.91!,f=-0.84) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 35 N PHE A 437 -7.600 13.415 15.890 1.00 62.53 N ATOM 36 CA PHE A 437 -7.088 13.278 14.525 1.00 71.31 C ATOM 37 C PHE A 437 -6.609 11.842 14.261 1.00 53.25 C ATOM 38 O PHE A 437 -6.089 11.176 15.161 1.00 64.13 O ATOM 39 CB PHE A 437 -5.947 14.276 14.284 1.00 44.41 C ATOM 40 CG PHE A 437 -6.386 15.717 14.380 1.00 33.42 C ATOM 41 CD1 PHE A 437 -7.022 16.335 13.311 1.00 70.11 C ATOM 42 CD2 PHE A 437 -6.171 16.451 15.539 1.00 44.34 C ATOM 43 CE1 PHE A 437 -7.430 17.651 13.396 1.00 25.40 C ATOM 44 CE2 PHE A 437 -6.578 17.768 15.628 1.00 71.25 C ATOM 45 CZ PHE A 437 -7.210 18.369 14.556 1.00 42.23 C ATOM 0 HA PHE A 437 -7.899 13.497 13.831 1.00 71.31 H new ATOM 0 HB2 PHE A 437 -5.155 14.095 15.011 1.00 44.41 H new ATOM 0 HB3 PHE A 437 -5.520 14.098 13.297 1.00 44.41 H new ATOM 0 HD1 PHE A 437 -7.199 15.779 12.402 1.00 70.11 H new ATOM 0 HD2 PHE A 437 -5.680 15.986 16.381 1.00 44.34 H new ATOM 0 HE1 PHE A 437 -7.921 18.119 12.556 1.00 25.40 H new ATOM 0 HE2 PHE A 437 -6.402 18.328 16.535 1.00 71.25 H new ATOM 0 HZ PHE A 437 -7.531 19.398 14.625 1.00 42.23 H new ATOM 55 N PRO A 438 -6.803 11.337 13.032 1.00 60.23 N ATOM 56 CA PRO A 438 -6.392 9.982 12.651 1.00 23.13 C ATOM 57 C PRO A 438 -4.880 9.833 12.440 1.00 44.12 C ATOM 58 O PRO A 438 -4.122 10.800 12.508 1.00 45.43 O ATOM 59 CB PRO A 438 -7.135 9.721 11.329 1.00 53.51 C ATOM 60 CG PRO A 438 -8.036 10.896 11.125 1.00 33.31 C ATOM 61 CD PRO A 438 -7.450 12.030 11.914 1.00 55.23 C ATOM 0 HA PRO A 438 -6.632 9.274 13.444 1.00 23.13 H new ATOM 0 HB2 PRO A 438 -6.434 9.618 10.501 1.00 53.51 H new ATOM 0 HB3 PRO A 438 -7.707 8.795 11.379 1.00 53.51 H new ATOM 0 HG2 PRO A 438 -8.103 11.154 10.068 1.00 33.31 H new ATOM 0 HG3 PRO A 438 -9.048 10.671 11.463 1.00 33.31 H new ATOM 0 HD2 PRO A 438 -6.736 12.607 11.326 1.00 55.23 H new ATOM 0 HD3 PRO A 438 -8.217 12.725 12.256 1.00 55.23 H new ATOM 69 N ASP A 439 -4.459 8.596 12.208 1.00 3.52 N ATOM 70 CA ASP A 439 -3.065 8.284 11.908 1.00 33.43 C ATOM 71 C ASP A 439 -3.007 6.976 11.102 1.00 75.15 C ATOM 72 O ASP A 439 -2.825 5.891 11.656 1.00 42.32 O ATOM 73 CB ASP A 439 -2.258 8.180 13.210 1.00 14.42 C ATOM 74 CG ASP A 439 -0.758 8.222 12.981 1.00 12.43 C ATOM 75 OD1 ASP A 439 -0.212 9.330 12.813 1.00 33.23 O ATOM 76 OD2 ASP A 439 -0.111 7.154 12.995 1.00 24.24 O ATOM 0 H ASP A 439 -5.072 7.781 12.222 1.00 3.52 H new ATOM 0 HA ASP A 439 -2.622 9.080 11.310 1.00 33.43 H new ATOM 0 HB2 ASP A 439 -2.542 8.997 13.874 1.00 14.42 H new ATOM 0 HB3 ASP A 439 -2.517 7.251 13.719 1.00 14.42 H new ATOM 81 N LEU A 440 -3.237 7.088 9.799 1.00 71.45 N ATOM 82 CA LEU A 440 -3.357 5.923 8.917 1.00 62.42 C ATOM 83 C LEU A 440 -1.991 5.461 8.394 1.00 33.11 C ATOM 84 O LEU A 440 -1.224 6.249 7.840 1.00 32.25 O ATOM 85 CB LEU A 440 -4.278 6.259 7.733 1.00 53.44 C ATOM 86 CG LEU A 440 -5.685 6.760 8.110 1.00 43.13 C ATOM 87 CD1 LEU A 440 -6.464 7.174 6.864 1.00 43.23 C ATOM 88 CD2 LEU A 440 -6.451 5.696 8.893 1.00 73.22 C ATOM 0 H LEU A 440 -3.346 7.983 9.321 1.00 71.45 H new ATOM 0 HA LEU A 440 -3.784 5.108 9.501 1.00 62.42 H new ATOM 0 HB2 LEU A 440 -3.792 7.019 7.121 1.00 53.44 H new ATOM 0 HB3 LEU A 440 -4.382 5.369 7.112 1.00 53.44 H new ATOM 0 HG LEU A 440 -5.570 7.635 8.749 1.00 43.13 H new ATOM 0 HD11 LEU A 440 -7.455 7.524 7.154 1.00 43.23 H new ATOM 0 HD12 LEU A 440 -5.931 7.975 6.351 1.00 43.23 H new ATOM 0 HD13 LEU A 440 -6.563 6.319 6.196 1.00 43.23 H new ATOM 0 HD21 LEU A 440 -7.441 6.074 9.147 1.00 73.22 H new ATOM 0 HD22 LEU A 440 -6.551 4.798 8.284 1.00 73.22 H new ATOM 0 HD23 LEU A 440 -5.908 5.456 9.807 1.00 73.22 H new ATOM 100 N THR A 441 -1.694 4.175 8.556 1.00 52.22 N ATOM 101 CA THR A 441 -0.427 3.613 8.071 1.00 55.45 C ATOM 102 C THR A 441 -0.648 2.338 7.252 1.00 64.43 C ATOM 103 O THR A 441 -1.664 1.652 7.403 1.00 73.43 O ATOM 104 CB THR A 441 0.552 3.306 9.225 1.00 53.51 C ATOM 105 OG1 THR A 441 1.809 2.854 8.698 1.00 11.54 O ATOM 106 CG2 THR A 441 -0.014 2.259 10.177 1.00 24.24 C ATOM 0 H THR A 441 -2.306 3.501 9.016 1.00 52.22 H new ATOM 0 HA THR A 441 0.013 4.378 7.431 1.00 55.45 H new ATOM 0 HB THR A 441 0.701 4.228 9.787 1.00 53.51 H new ATOM 0 HG1 THR A 441 2.520 3.470 8.973 1.00 11.54 H new ATOM 0 HG21 THR A 441 0.702 2.069 10.976 1.00 24.24 H new ATOM 0 HG22 THR A 441 -0.947 2.624 10.606 1.00 24.24 H new ATOM 0 HG23 THR A 441 -0.202 1.335 9.631 1.00 24.24 H new ATOM 114 N VAL A 442 0.313 2.029 6.383 1.00 63.00 N ATOM 115 CA VAL A 442 0.219 0.871 5.489 1.00 35.13 C ATOM 116 C VAL A 442 1.519 0.043 5.495 1.00 33.22 C ATOM 117 O VAL A 442 2.615 0.582 5.661 1.00 31.02 O ATOM 118 CB VAL A 442 -0.099 1.318 4.036 1.00 73.11 C ATOM 119 CG1 VAL A 442 -1.462 2.007 3.961 1.00 74.43 C ATOM 120 CG2 VAL A 442 0.993 2.242 3.504 1.00 13.33 C ATOM 0 H VAL A 442 1.173 2.568 6.277 1.00 63.00 H new ATOM 0 HA VAL A 442 -0.593 0.246 5.861 1.00 35.13 H new ATOM 0 HB VAL A 442 -0.133 0.426 3.411 1.00 73.11 H new ATOM 0 HG11 VAL A 442 -1.660 2.310 2.933 1.00 74.43 H new ATOM 0 HG12 VAL A 442 -2.238 1.316 4.292 1.00 74.43 H new ATOM 0 HG13 VAL A 442 -1.461 2.887 4.605 1.00 74.43 H new ATOM 0 HG21 VAL A 442 0.750 2.543 2.485 1.00 13.33 H new ATOM 0 HG22 VAL A 442 1.061 3.127 4.137 1.00 13.33 H new ATOM 0 HG23 VAL A 442 1.948 1.717 3.509 1.00 13.33 H new ATOM 130 N GLU A 443 1.387 -1.271 5.313 1.00 74.52 N ATOM 131 CA GLU A 443 2.544 -2.182 5.291 1.00 24.23 C ATOM 132 C GLU A 443 2.466 -3.150 4.097 1.00 73.10 C ATOM 133 O GLU A 443 1.391 -3.656 3.773 1.00 33.03 O ATOM 134 CB GLU A 443 2.610 -2.986 6.601 1.00 30.31 C ATOM 135 CG GLU A 443 2.682 -2.130 7.864 1.00 1.44 C ATOM 136 CD GLU A 443 2.746 -2.965 9.133 1.00 11.04 C ATOM 137 OE1 GLU A 443 1.856 -3.814 9.334 1.00 61.23 O ATOM 138 OE2 GLU A 443 3.700 -2.793 9.926 1.00 51.20 O ATOM 0 H GLU A 443 0.489 -1.735 5.178 1.00 74.52 H new ATOM 0 HA GLU A 443 3.445 -1.577 5.188 1.00 24.23 H new ATOM 0 HB2 GLU A 443 1.732 -3.630 6.663 1.00 30.31 H new ATOM 0 HB3 GLU A 443 3.482 -3.639 6.569 1.00 30.31 H new ATOM 0 HG2 GLU A 443 3.560 -1.486 7.813 1.00 1.44 H new ATOM 0 HG3 GLU A 443 1.810 -1.477 7.906 1.00 1.44 H new ATOM 145 N ILE A 444 3.606 -3.407 3.451 1.00 11.40 N ATOM 146 CA ILE A 444 3.657 -4.317 2.293 1.00 62.45 C ATOM 147 C ILE A 444 4.376 -5.634 2.642 1.00 23.23 C ATOM 148 O ILE A 444 5.487 -5.628 3.176 1.00 74.00 O ATOM 149 CB ILE A 444 4.371 -3.656 1.082 1.00 15.20 C ATOM 150 CG1 ILE A 444 3.709 -2.310 0.737 1.00 10.13 C ATOM 151 CG2 ILE A 444 4.350 -4.590 -0.131 1.00 33.21 C ATOM 152 CD1 ILE A 444 4.398 -1.559 -0.388 1.00 33.54 C ATOM 0 H ILE A 444 4.507 -3.001 3.706 1.00 11.40 H new ATOM 0 HA ILE A 444 2.624 -4.535 2.023 1.00 62.45 H new ATOM 0 HB ILE A 444 5.410 -3.471 1.354 1.00 15.20 H new ATOM 0 HG12 ILE A 444 2.670 -2.487 0.460 1.00 10.13 H new ATOM 0 HG13 ILE A 444 3.699 -1.682 1.628 1.00 10.13 H new ATOM 0 HG21 ILE A 444 4.855 -4.109 -0.969 1.00 33.21 H new ATOM 0 HG22 ILE A 444 4.863 -5.520 0.117 1.00 33.21 H new ATOM 0 HG23 ILE A 444 3.318 -4.807 -0.405 1.00 33.21 H new ATOM 0 HD11 ILE A 444 3.874 -0.621 -0.574 1.00 33.54 H new ATOM 0 HD12 ILE A 444 5.430 -1.349 -0.107 1.00 33.54 H new ATOM 0 HD13 ILE A 444 4.385 -2.167 -1.293 1.00 33.54 H new ATOM 164 N LYS A 445 3.738 -6.760 2.330 1.00 4.14 N ATOM 165 CA LYS A 445 4.308 -8.090 2.599 1.00 64.45 C ATOM 166 C LYS A 445 4.223 -8.998 1.357 1.00 14.31 C ATOM 167 O LYS A 445 3.166 -9.119 0.740 1.00 14.34 O ATOM 168 CB LYS A 445 3.552 -8.730 3.777 1.00 53.23 C ATOM 169 CG LYS A 445 4.014 -10.138 4.150 1.00 32.12 C ATOM 170 CD LYS A 445 5.471 -10.166 4.607 1.00 21.55 C ATOM 171 CE LYS A 445 5.848 -11.521 5.199 1.00 55.43 C ATOM 172 NZ LYS A 445 5.641 -12.634 4.235 1.00 42.13 N ATOM 0 H LYS A 445 2.819 -6.783 1.887 1.00 4.14 H new ATOM 0 HA LYS A 445 5.362 -7.975 2.851 1.00 64.45 H new ATOM 0 HB2 LYS A 445 3.657 -8.086 4.650 1.00 53.23 H new ATOM 0 HB3 LYS A 445 2.490 -8.765 3.532 1.00 53.23 H new ATOM 0 HG2 LYS A 445 3.378 -10.528 4.945 1.00 32.12 H new ATOM 0 HG3 LYS A 445 3.892 -10.798 3.291 1.00 32.12 H new ATOM 0 HD2 LYS A 445 6.122 -9.944 3.762 1.00 21.55 H new ATOM 0 HD3 LYS A 445 5.635 -9.385 5.350 1.00 21.55 H new ATOM 0 HE2 LYS A 445 6.893 -11.502 5.510 1.00 55.43 H new ATOM 0 HE3 LYS A 445 5.253 -11.703 6.094 1.00 55.43 H new ATOM 0 HZ1 LYS A 445 6.004 -13.519 4.643 1.00 42.13 H new ATOM 0 HZ2 LYS A 445 4.625 -12.736 4.036 1.00 42.13 H new ATOM 0 HZ3 LYS A 445 6.148 -12.427 3.351 1.00 42.13 H new ATOM 186 N GLY A 446 5.333 -9.642 0.997 1.00 12.15 N ATOM 187 CA GLY A 446 5.329 -10.539 -0.159 1.00 22.33 C ATOM 188 C GLY A 446 6.724 -10.952 -0.626 1.00 74.34 C ATOM 189 O GLY A 446 7.710 -10.720 0.074 1.00 20.02 O ATOM 0 H GLY A 446 6.229 -9.563 1.477 1.00 12.15 H new ATOM 0 HA2 GLY A 446 4.760 -11.435 0.090 1.00 22.33 H new ATOM 0 HA3 GLY A 446 4.810 -10.051 -0.984 1.00 22.33 H new ATOM 193 N PRO A 447 6.830 -11.578 -1.816 1.00 23.13 N ATOM 194 CA PRO A 447 8.120 -12.036 -2.366 1.00 54.32 C ATOM 195 C PRO A 447 8.991 -10.887 -2.905 1.00 3.02 C ATOM 196 O PRO A 447 8.573 -10.132 -3.789 1.00 14.43 O ATOM 197 CB PRO A 447 7.695 -12.972 -3.504 1.00 21.11 C ATOM 198 CG PRO A 447 6.375 -12.437 -3.955 1.00 21.52 C ATOM 199 CD PRO A 447 5.703 -11.898 -2.717 1.00 41.33 C ATOM 0 HA PRO A 447 8.740 -12.509 -1.604 1.00 54.32 H new ATOM 0 HB2 PRO A 447 8.423 -12.967 -4.315 1.00 21.11 H new ATOM 0 HB3 PRO A 447 7.609 -14.002 -3.159 1.00 21.11 H new ATOM 0 HG2 PRO A 447 6.505 -11.653 -4.701 1.00 21.52 H new ATOM 0 HG3 PRO A 447 5.773 -13.220 -4.417 1.00 21.52 H new ATOM 0 HD2 PRO A 447 5.105 -11.014 -2.939 1.00 41.33 H new ATOM 0 HD3 PRO A 447 5.032 -12.634 -2.273 1.00 41.33 H new ATOM 207 N ASP A 448 10.205 -10.769 -2.372 1.00 53.33 N ATOM 208 CA ASP A 448 11.150 -9.733 -2.802 1.00 55.12 C ATOM 209 C ASP A 448 11.689 -10.013 -4.216 1.00 14.13 C ATOM 210 O ASP A 448 11.973 -9.088 -4.978 1.00 75.22 O ATOM 211 CB ASP A 448 12.313 -9.648 -1.809 1.00 43.14 C ATOM 212 CG ASP A 448 11.835 -9.396 -0.390 1.00 24.43 C ATOM 213 OD1 ASP A 448 11.550 -10.376 0.331 1.00 65.12 O ATOM 214 OD2 ASP A 448 11.739 -8.219 0.012 1.00 64.31 O ATOM 0 H ASP A 448 10.562 -11.380 -1.637 1.00 53.33 H new ATOM 0 HA ASP A 448 10.619 -8.782 -2.828 1.00 55.12 H new ATOM 0 HB2 ASP A 448 12.884 -10.576 -1.839 1.00 43.14 H new ATOM 0 HB3 ASP A 448 12.989 -8.848 -2.111 1.00 43.14 H new ATOM 219 N VAL A 449 11.837 -11.292 -4.554 1.00 0.34 N ATOM 220 CA VAL A 449 12.335 -11.698 -5.874 1.00 52.40 C ATOM 221 C VAL A 449 11.311 -12.578 -6.610 1.00 34.22 C ATOM 222 O VAL A 449 10.775 -13.531 -6.042 1.00 20.32 O ATOM 223 CB VAL A 449 13.677 -12.467 -5.757 1.00 25.13 C ATOM 224 CG1 VAL A 449 14.214 -12.847 -7.138 1.00 3.54 C ATOM 225 CG2 VAL A 449 14.706 -11.643 -4.980 1.00 24.11 C ATOM 0 H VAL A 449 11.619 -12.071 -3.932 1.00 0.34 H new ATOM 0 HA VAL A 449 12.497 -10.785 -6.446 1.00 52.40 H new ATOM 0 HB VAL A 449 13.491 -13.389 -5.205 1.00 25.13 H new ATOM 0 HG11 VAL A 449 15.155 -13.385 -7.027 1.00 3.54 H new ATOM 0 HG12 VAL A 449 13.490 -13.483 -7.647 1.00 3.54 H new ATOM 0 HG13 VAL A 449 14.379 -11.944 -7.725 1.00 3.54 H new ATOM 0 HG21 VAL A 449 15.640 -12.200 -4.909 1.00 24.11 H new ATOM 0 HG22 VAL A 449 14.884 -10.701 -5.498 1.00 24.11 H new ATOM 0 HG23 VAL A 449 14.328 -11.440 -3.978 1.00 24.11 H new ATOM 235 N VAL A 450 11.047 -12.256 -7.876 1.00 21.44 N ATOM 236 CA VAL A 450 10.085 -13.012 -8.691 1.00 32.23 C ATOM 237 C VAL A 450 10.658 -13.353 -10.078 1.00 55.34 C ATOM 238 O VAL A 450 11.645 -12.763 -10.522 1.00 3.53 O ATOM 239 CB VAL A 450 8.752 -12.237 -8.873 1.00 41.41 C ATOM 240 CG1 VAL A 450 8.069 -11.998 -7.525 1.00 35.04 C ATOM 241 CG2 VAL A 450 8.988 -10.915 -9.604 1.00 51.42 C ATOM 0 H VAL A 450 11.485 -11.475 -8.364 1.00 21.44 H new ATOM 0 HA VAL A 450 9.889 -13.937 -8.149 1.00 32.23 H new ATOM 0 HB VAL A 450 8.088 -12.849 -9.483 1.00 41.41 H new ATOM 0 HG11 VAL A 450 7.138 -11.453 -7.680 1.00 35.04 H new ATOM 0 HG12 VAL A 450 7.854 -12.956 -7.051 1.00 35.04 H new ATOM 0 HG13 VAL A 450 8.728 -11.414 -6.882 1.00 35.04 H new ATOM 0 HG21 VAL A 450 8.040 -10.389 -9.720 1.00 51.42 H new ATOM 0 HG22 VAL A 450 9.677 -10.298 -9.027 1.00 51.42 H new ATOM 0 HG23 VAL A 450 9.415 -11.114 -10.587 1.00 51.42 H new ATOM 251 N GLY A 451 10.029 -14.310 -10.758 1.00 31.22 N ATOM 252 CA GLY A 451 10.476 -14.712 -12.089 1.00 13.50 C ATOM 253 C GLY A 451 9.729 -13.991 -13.208 1.00 71.54 C ATOM 254 O GLY A 451 8.562 -13.630 -13.055 1.00 63.54 O ATOM 0 H GLY A 451 9.215 -14.818 -10.412 1.00 31.22 H new ATOM 0 HA2 GLY A 451 11.543 -14.513 -12.184 1.00 13.50 H new ATOM 0 HA3 GLY A 451 10.341 -15.788 -12.203 1.00 13.50 H new ATOM 258 N VAL A 452 10.405 -13.781 -14.335 1.00 12.32 N ATOM 259 CA VAL A 452 9.802 -13.096 -15.484 1.00 1.13 C ATOM 260 C VAL A 452 8.606 -13.885 -16.060 1.00 4.04 C ATOM 261 O VAL A 452 8.657 -15.110 -16.185 1.00 24.15 O ATOM 262 CB VAL A 452 10.857 -12.847 -16.596 1.00 33.41 C ATOM 263 CG1 VAL A 452 11.336 -14.160 -17.216 1.00 30.14 C ATOM 264 CG2 VAL A 452 10.315 -11.898 -17.664 1.00 42.34 C ATOM 0 H VAL A 452 11.371 -14.074 -14.481 1.00 12.32 H new ATOM 0 HA VAL A 452 9.431 -12.136 -15.125 1.00 1.13 H new ATOM 0 HB VAL A 452 11.720 -12.370 -16.131 1.00 33.41 H new ATOM 0 HG11 VAL A 452 12.073 -13.949 -17.990 1.00 30.14 H new ATOM 0 HG12 VAL A 452 11.788 -14.783 -16.444 1.00 30.14 H new ATOM 0 HG13 VAL A 452 10.488 -14.685 -17.656 1.00 30.14 H new ATOM 0 HG21 VAL A 452 11.074 -11.741 -18.430 1.00 42.34 H new ATOM 0 HG22 VAL A 452 9.425 -12.332 -18.119 1.00 42.34 H new ATOM 0 HG23 VAL A 452 10.059 -10.943 -17.206 1.00 42.34 H new ATOM 274 N ASN A 453 7.531 -13.166 -16.394 1.00 15.44 N ATOM 275 CA ASN A 453 6.295 -13.769 -16.923 1.00 44.13 C ATOM 276 C ASN A 453 5.635 -14.735 -15.917 1.00 53.41 C ATOM 277 O ASN A 453 4.893 -15.638 -16.307 1.00 64.41 O ATOM 278 CB ASN A 453 6.558 -14.485 -18.259 1.00 12.42 C ATOM 279 CG ASN A 453 6.850 -13.512 -19.386 1.00 32.32 C ATOM 280 OD1 ASN A 453 8.115 -13.252 -19.645 1.00 14.01 O flip ATOM 281 ND2 ASN A 453 5.941 -13.000 -20.028 1.00 10.10 N flip ATOM 0 H ASN A 453 7.488 -12.151 -16.307 1.00 15.44 H new ATOM 0 HA ASN A 453 5.596 -12.950 -17.094 1.00 44.13 H new ATOM 0 HB2 ASN A 453 7.400 -15.167 -18.143 1.00 12.42 H new ATOM 0 HB3 ASN A 453 5.691 -15.091 -18.521 1.00 12.42 H new ATOM 0 HD21 ASN A 453 4.971 -13.221 -19.804 1.00 10.10 H new ATOM 0 HD22 ASN A 453 6.154 -12.353 -20.787 1.00 10.10 H new ATOM 288 N LYS A 454 5.893 -14.531 -14.625 1.00 61.42 N ATOM 289 CA LYS A 454 5.256 -15.335 -13.571 1.00 12.03 C ATOM 290 C LYS A 454 4.275 -14.497 -12.736 1.00 72.15 C ATOM 291 O LYS A 454 4.320 -13.266 -12.752 1.00 2.02 O ATOM 292 CB LYS A 454 6.319 -15.967 -12.659 1.00 63.31 C ATOM 293 CG LYS A 454 7.178 -17.021 -13.354 1.00 12.02 C ATOM 294 CD LYS A 454 6.334 -18.174 -13.907 1.00 31.42 C ATOM 295 CE LYS A 454 5.583 -18.919 -12.804 1.00 54.55 C ATOM 296 NZ LYS A 454 4.752 -20.028 -13.346 1.00 42.21 N ATOM 0 H LYS A 454 6.536 -13.819 -14.279 1.00 61.42 H new ATOM 0 HA LYS A 454 4.690 -16.127 -14.060 1.00 12.03 H new ATOM 0 HB2 LYS A 454 6.967 -15.180 -12.273 1.00 63.31 H new ATOM 0 HB3 LYS A 454 5.824 -16.423 -11.801 1.00 63.31 H new ATOM 0 HG2 LYS A 454 7.735 -16.556 -14.168 1.00 12.02 H new ATOM 0 HG3 LYS A 454 7.911 -17.414 -12.649 1.00 12.02 H new ATOM 0 HD2 LYS A 454 5.619 -17.784 -14.632 1.00 31.42 H new ATOM 0 HD3 LYS A 454 6.980 -18.872 -14.440 1.00 31.42 H new ATOM 0 HE2 LYS A 454 6.298 -19.320 -12.086 1.00 54.55 H new ATOM 0 HE3 LYS A 454 4.946 -18.219 -12.263 1.00 54.55 H new ATOM 0 HZ1 LYS A 454 4.260 -20.507 -12.565 1.00 42.21 H new ATOM 0 HZ2 LYS A 454 4.052 -19.644 -14.012 1.00 42.21 H new ATOM 0 HZ3 LYS A 454 5.362 -20.710 -13.840 1.00 42.21 H new ATOM 310 N LEU A 455 3.387 -15.173 -12.007 1.00 13.54 N ATOM 311 CA LEU A 455 2.385 -14.494 -11.179 1.00 64.05 C ATOM 312 C LEU A 455 2.904 -14.247 -9.750 1.00 33.12 C ATOM 313 O LEU A 455 3.379 -15.168 -9.082 1.00 73.31 O ATOM 314 CB LEU A 455 1.091 -15.323 -11.126 1.00 50.23 C ATOM 315 CG LEU A 455 -0.080 -14.665 -10.375 1.00 1.22 C ATOM 316 CD1 LEU A 455 -0.506 -13.368 -11.061 1.00 32.15 C ATOM 317 CD2 LEU A 455 -1.258 -15.632 -10.258 1.00 4.21 C ATOM 0 H LEU A 455 3.340 -16.191 -11.972 1.00 13.54 H new ATOM 0 HA LEU A 455 2.180 -13.526 -11.636 1.00 64.05 H new ATOM 0 HB2 LEU A 455 0.773 -15.536 -12.147 1.00 50.23 H new ATOM 0 HB3 LEU A 455 1.311 -16.281 -10.655 1.00 50.23 H new ATOM 0 HG LEU A 455 0.258 -14.418 -9.368 1.00 1.22 H new ATOM 0 HD11 LEU A 455 -1.335 -12.921 -10.512 1.00 32.15 H new ATOM 0 HD12 LEU A 455 0.334 -12.673 -11.079 1.00 32.15 H new ATOM 0 HD13 LEU A 455 -0.821 -13.583 -12.082 1.00 32.15 H new ATOM 0 HD21 LEU A 455 -2.075 -15.147 -9.724 1.00 4.21 H new ATOM 0 HD22 LEU A 455 -1.595 -15.917 -11.255 1.00 4.21 H new ATOM 0 HD23 LEU A 455 -0.945 -16.522 -9.712 1.00 4.21 H new ATOM 329 N ALA A 456 2.809 -13.000 -9.290 1.00 14.41 N ATOM 330 CA ALA A 456 3.214 -12.635 -7.926 1.00 13.14 C ATOM 331 C ALA A 456 2.044 -12.022 -7.139 1.00 12.11 C ATOM 332 O ALA A 456 1.227 -11.291 -7.694 1.00 62.24 O ATOM 333 CB ALA A 456 4.386 -11.658 -7.969 1.00 72.33 C ATOM 0 H ALA A 456 2.454 -12.220 -9.842 1.00 14.41 H new ATOM 0 HA ALA A 456 3.524 -13.546 -7.413 1.00 13.14 H new ATOM 0 HB1 ALA A 456 4.678 -11.395 -6.952 1.00 72.33 H new ATOM 0 HB2 ALA A 456 5.229 -12.124 -8.479 1.00 72.33 H new ATOM 0 HB3 ALA A 456 4.089 -10.757 -8.506 1.00 72.33 H new ATOM 339 N GLU A 457 1.967 -12.329 -5.847 1.00 14.51 N ATOM 340 CA GLU A 457 0.931 -11.766 -4.966 1.00 23.53 C ATOM 341 C GLU A 457 1.549 -11.027 -3.773 1.00 25.24 C ATOM 342 O GLU A 457 2.588 -11.431 -3.246 1.00 3.14 O ATOM 343 CB GLU A 457 -0.009 -12.871 -4.459 1.00 40.23 C ATOM 344 CG GLU A 457 -1.145 -13.207 -5.415 1.00 35.43 C ATOM 345 CD GLU A 457 -1.937 -14.428 -4.978 1.00 11.12 C ATOM 346 OE1 GLU A 457 -2.696 -14.326 -3.992 1.00 2.24 O ATOM 347 OE2 GLU A 457 -1.811 -15.492 -5.621 1.00 44.14 O ATOM 0 H GLU A 457 2.610 -12.967 -5.379 1.00 14.51 H new ATOM 0 HA GLU A 457 0.358 -11.050 -5.555 1.00 23.53 H new ATOM 0 HB2 GLU A 457 0.574 -13.773 -4.274 1.00 40.23 H new ATOM 0 HB3 GLU A 457 -0.432 -12.563 -3.503 1.00 40.23 H new ATOM 0 HG2 GLU A 457 -1.816 -12.351 -5.490 1.00 35.43 H new ATOM 0 HG3 GLU A 457 -0.737 -13.381 -6.411 1.00 35.43 H new ATOM 354 N TYR A 458 0.905 -9.941 -3.354 1.00 23.31 N ATOM 355 CA TYR A 458 1.367 -9.161 -2.202 1.00 55.31 C ATOM 356 C TYR A 458 0.214 -8.861 -1.233 1.00 4.11 C ATOM 357 O TYR A 458 -0.959 -8.870 -1.618 1.00 24.32 O ATOM 358 CB TYR A 458 2.035 -7.855 -2.668 1.00 24.44 C ATOM 359 CG TYR A 458 3.300 -8.081 -3.481 1.00 23.45 C ATOM 360 CD1 TYR A 458 3.245 -8.261 -4.862 1.00 33.45 C ATOM 361 CD2 TYR A 458 4.545 -8.129 -2.865 1.00 44.24 C ATOM 362 CE1 TYR A 458 4.395 -8.483 -5.600 1.00 21.21 C ATOM 363 CE2 TYR A 458 5.697 -8.348 -3.597 1.00 10.10 C ATOM 364 CZ TYR A 458 5.617 -8.526 -4.962 1.00 22.53 C ATOM 365 OH TYR A 458 6.763 -8.744 -5.691 1.00 51.01 O ATOM 0 H TYR A 458 0.059 -9.578 -3.794 1.00 23.31 H new ATOM 0 HA TYR A 458 2.105 -9.759 -1.667 1.00 55.31 H new ATOM 0 HB2 TYR A 458 1.324 -7.285 -3.267 1.00 24.44 H new ATOM 0 HB3 TYR A 458 2.276 -7.247 -1.796 1.00 24.44 H new ATOM 0 HD1 TYR A 458 2.290 -8.227 -5.365 1.00 33.45 H new ATOM 0 HD2 TYR A 458 4.614 -7.993 -1.796 1.00 44.24 H new ATOM 0 HE1 TYR A 458 4.336 -8.622 -6.669 1.00 21.21 H new ATOM 0 HE2 TYR A 458 6.656 -8.380 -3.102 1.00 10.10 H new ATOM 0 HH TYR A 458 7.429 -9.192 -5.128 1.00 51.01 H new ATOM 375 N GLU A 459 0.566 -8.587 0.021 1.00 4.22 N ATOM 376 CA GLU A 459 -0.411 -8.337 1.086 1.00 4.24 C ATOM 377 C GLU A 459 -0.213 -6.939 1.688 1.00 35.21 C ATOM 378 O GLU A 459 0.892 -6.578 2.098 1.00 13.32 O ATOM 379 CB GLU A 459 -0.261 -9.395 2.193 1.00 32.44 C ATOM 380 CG GLU A 459 -0.560 -10.824 1.742 1.00 24.12 C ATOM 381 CD GLU A 459 -0.209 -11.859 2.801 1.00 75.12 C ATOM 382 OE1 GLU A 459 -0.912 -11.930 3.830 1.00 41.12 O ATOM 383 OE2 GLU A 459 0.781 -12.600 2.614 1.00 32.21 O ATOM 0 H GLU A 459 1.536 -8.531 0.331 1.00 4.22 H new ATOM 0 HA GLU A 459 -1.410 -8.396 0.654 1.00 4.24 H new ATOM 0 HB2 GLU A 459 0.756 -9.355 2.582 1.00 32.44 H new ATOM 0 HB3 GLU A 459 -0.928 -9.139 3.016 1.00 32.44 H new ATOM 0 HG2 GLU A 459 -1.618 -10.909 1.494 1.00 24.12 H new ATOM 0 HG3 GLU A 459 -0.001 -11.038 0.831 1.00 24.12 H new ATOM 390 N VAL A 460 -1.288 -6.164 1.744 1.00 13.24 N ATOM 391 CA VAL A 460 -1.243 -4.800 2.274 1.00 13.40 C ATOM 392 C VAL A 460 -1.978 -4.699 3.620 1.00 14.12 C ATOM 393 O VAL A 460 -3.189 -4.924 3.698 1.00 54.05 O ATOM 394 CB VAL A 460 -1.874 -3.787 1.284 1.00 64.21 C ATOM 395 CG1 VAL A 460 -1.695 -2.353 1.784 1.00 1.23 C ATOM 396 CG2 VAL A 460 -1.284 -3.952 -0.116 1.00 45.41 C ATOM 0 H VAL A 460 -2.212 -6.457 1.427 1.00 13.24 H new ATOM 0 HA VAL A 460 -0.190 -4.556 2.417 1.00 13.40 H new ATOM 0 HB VAL A 460 -2.943 -3.994 1.226 1.00 64.21 H new ATOM 0 HG11 VAL A 460 -2.146 -1.661 1.073 1.00 1.23 H new ATOM 0 HG12 VAL A 460 -2.179 -2.243 2.754 1.00 1.23 H new ATOM 0 HG13 VAL A 460 -0.632 -2.132 1.882 1.00 1.23 H new ATOM 0 HG21 VAL A 460 -1.743 -3.230 -0.792 1.00 45.41 H new ATOM 0 HG22 VAL A 460 -0.208 -3.782 -0.080 1.00 45.41 H new ATOM 0 HG23 VAL A 460 -1.480 -4.962 -0.477 1.00 45.41 H new ATOM 406 N HIS A 461 -1.237 -4.379 4.675 1.00 54.33 N ATOM 407 CA HIS A 461 -1.824 -4.144 6.000 1.00 63.23 C ATOM 408 C HIS A 461 -2.120 -2.652 6.204 1.00 24.41 C ATOM 409 O HIS A 461 -1.205 -1.834 6.249 1.00 53.12 O ATOM 410 CB HIS A 461 -0.880 -4.645 7.102 1.00 13.13 C ATOM 411 CG HIS A 461 -0.848 -6.136 7.240 1.00 54.20 C ATOM 412 ND1 HIS A 461 -1.361 -6.798 8.335 1.00 45.05 N ATOM 413 CD2 HIS A 461 -0.350 -7.097 6.426 1.00 42.44 C ATOM 414 CE1 HIS A 461 -1.183 -8.093 8.191 1.00 32.41 C ATOM 415 NE2 HIS A 461 -0.573 -8.303 7.043 1.00 34.32 N ATOM 0 H HIS A 461 -0.223 -4.275 4.643 1.00 54.33 H new ATOM 0 HA HIS A 461 -2.761 -4.698 6.059 1.00 63.23 H new ATOM 0 HB2 HIS A 461 0.128 -4.287 6.894 1.00 13.13 H new ATOM 0 HB3 HIS A 461 -1.183 -4.208 8.053 1.00 13.13 H new ATOM 0 HD1 HIS A 461 -1.810 -6.352 9.135 1.00 45.05 H new ATOM 0 HD2 HIS A 461 0.132 -6.944 5.472 1.00 42.44 H new ATOM 0 HE1 HIS A 461 -1.486 -8.855 8.894 1.00 32.41 H new ATOM 424 N VAL A 462 -3.400 -2.304 6.310 1.00 52.12 N ATOM 425 CA VAL A 462 -3.805 -0.908 6.510 1.00 40.41 C ATOM 426 C VAL A 462 -4.502 -0.732 7.871 1.00 22.34 C ATOM 427 O VAL A 462 -5.505 -1.386 8.154 1.00 23.14 O ATOM 428 CB VAL A 462 -4.739 -0.425 5.361 1.00 21.21 C ATOM 429 CG1 VAL A 462 -4.066 -0.634 4.008 1.00 41.33 C ATOM 430 CG2 VAL A 462 -6.093 -1.137 5.392 1.00 21.52 C ATOM 0 H VAL A 462 -4.176 -2.965 6.261 1.00 52.12 H new ATOM 0 HA VAL A 462 -2.903 -0.296 6.498 1.00 40.41 H new ATOM 0 HB VAL A 462 -4.921 0.639 5.511 1.00 21.21 H new ATOM 0 HG11 VAL A 462 -4.730 -0.292 3.214 1.00 41.33 H new ATOM 0 HG12 VAL A 462 -3.136 -0.066 3.973 1.00 41.33 H new ATOM 0 HG13 VAL A 462 -3.850 -1.693 3.869 1.00 41.33 H new ATOM 0 HG21 VAL A 462 -6.715 -0.772 4.575 1.00 21.52 H new ATOM 0 HG22 VAL A 462 -5.942 -2.211 5.281 1.00 21.52 H new ATOM 0 HG23 VAL A 462 -6.588 -0.936 6.342 1.00 21.52 H new ATOM 440 N LYS A 463 -3.974 0.151 8.717 1.00 50.31 N ATOM 441 CA LYS A 463 -4.530 0.334 10.064 1.00 74.01 C ATOM 442 C LYS A 463 -4.573 1.804 10.502 1.00 11.12 C ATOM 443 O LYS A 463 -3.794 2.638 10.036 1.00 11.31 O ATOM 444 CB LYS A 463 -3.749 -0.489 11.098 1.00 2.01 C ATOM 445 CG LYS A 463 -2.236 -0.285 11.059 1.00 63.53 C ATOM 446 CD LYS A 463 -1.622 -0.343 12.457 1.00 64.22 C ATOM 447 CE LYS A 463 -1.971 -1.631 13.201 1.00 13.22 C ATOM 448 NZ LYS A 463 -1.411 -2.835 12.541 1.00 62.15 N ATOM 0 H LYS A 463 -3.173 0.745 8.502 1.00 50.31 H new ATOM 0 HA LYS A 463 -5.559 -0.022 10.014 1.00 74.01 H new ATOM 0 HB2 LYS A 463 -4.111 -0.235 12.094 1.00 2.01 H new ATOM 0 HB3 LYS A 463 -3.964 -1.546 10.940 1.00 2.01 H new ATOM 0 HG2 LYS A 463 -1.782 -1.050 10.430 1.00 63.53 H new ATOM 0 HG3 LYS A 463 -2.010 0.678 10.602 1.00 63.53 H new ATOM 0 HD2 LYS A 463 -0.538 -0.256 12.377 1.00 64.22 H new ATOM 0 HD3 LYS A 463 -1.968 0.512 13.037 1.00 64.22 H new ATOM 0 HE2 LYS A 463 -1.594 -1.571 14.222 1.00 13.22 H new ATOM 0 HE3 LYS A 463 -3.055 -1.727 13.267 1.00 13.22 H new ATOM 0 HZ1 LYS A 463 -1.372 -3.619 13.224 1.00 62.15 H new ATOM 0 HZ2 LYS A 463 -2.016 -3.105 11.739 1.00 62.15 H new ATOM 0 HZ3 LYS A 463 -0.452 -2.628 12.196 1.00 62.15 H new ATOM 462 N ASN A 464 -5.501 2.096 11.414 1.00 70.23 N ATOM 463 CA ASN A 464 -5.678 3.443 11.971 1.00 15.04 C ATOM 464 C ASN A 464 -5.075 3.522 13.385 1.00 25.31 C ATOM 465 O ASN A 464 -5.393 2.705 14.245 1.00 12.43 O ATOM 466 CB ASN A 464 -7.181 3.757 12.015 1.00 4.14 C ATOM 467 CG ASN A 464 -7.508 5.187 12.415 1.00 32.43 C ATOM 468 OD1 ASN A 464 -6.772 5.838 13.148 1.00 4.41 O ATOM 469 ND2 ASN A 464 -8.635 5.678 11.949 1.00 21.13 N ATOM 0 H ASN A 464 -6.153 1.407 11.789 1.00 70.23 H new ATOM 0 HA ASN A 464 -5.164 4.172 11.345 1.00 15.04 H new ATOM 0 HB2 ASN A 464 -7.611 3.559 11.033 1.00 4.14 H new ATOM 0 HB3 ASN A 464 -7.663 3.076 12.717 1.00 4.14 H new ATOM 0 HD21 ASN A 464 -8.919 6.626 12.195 1.00 21.13 H new ATOM 0 HD22 ASN A 464 -9.226 5.111 11.341 1.00 21.13 H new ATOM 476 N LEU A 465 -4.226 4.519 13.629 1.00 4.13 N ATOM 477 CA LEU A 465 -3.567 4.676 14.936 1.00 33.30 C ATOM 478 C LEU A 465 -3.999 5.969 15.650 1.00 71.20 C ATOM 479 O LEU A 465 -3.484 6.301 16.719 1.00 21.41 O ATOM 480 CB LEU A 465 -2.044 4.661 14.748 1.00 41.25 C ATOM 481 CG LEU A 465 -1.472 3.364 14.149 1.00 23.24 C ATOM 482 CD1 LEU A 465 0.017 3.515 13.851 1.00 73.00 C ATOM 483 CD2 LEU A 465 -1.723 2.184 15.087 1.00 33.40 C ATOM 0 H LEU A 465 -3.975 5.232 12.944 1.00 4.13 H new ATOM 0 HA LEU A 465 -3.872 3.841 15.567 1.00 33.30 H new ATOM 0 HB2 LEU A 465 -1.765 5.494 14.103 1.00 41.25 H new ATOM 0 HB3 LEU A 465 -1.573 4.835 15.715 1.00 41.25 H new ATOM 0 HG LEU A 465 -1.985 3.166 13.208 1.00 23.24 H new ATOM 0 HD11 LEU A 465 0.400 2.586 13.428 1.00 73.00 H new ATOM 0 HD12 LEU A 465 0.165 4.326 13.138 1.00 73.00 H new ATOM 0 HD13 LEU A 465 0.552 3.741 14.774 1.00 73.00 H new ATOM 0 HD21 LEU A 465 -1.312 1.276 14.647 1.00 33.40 H new ATOM 0 HD22 LEU A 465 -1.241 2.373 16.046 1.00 33.40 H new ATOM 0 HD23 LEU A 465 -2.795 2.061 15.238 1.00 33.40 H new ATOM 495 N GLY A 466 -4.951 6.687 15.056 1.00 71.21 N ATOM 496 CA GLY A 466 -5.434 7.935 15.640 1.00 44.21 C ATOM 497 C GLY A 466 -6.545 7.734 16.670 1.00 25.01 C ATOM 498 O GLY A 466 -6.759 8.581 17.536 1.00 11.25 O ATOM 0 H GLY A 466 -5.400 6.428 14.177 1.00 71.21 H new ATOM 0 HA2 GLY A 466 -4.600 8.453 16.113 1.00 44.21 H new ATOM 0 HA3 GLY A 466 -5.800 8.582 14.843 1.00 44.21 H new ATOM 502 N GLY A 467 -7.263 6.614 16.570 1.00 12.12 N ATOM 503 CA GLY A 467 -8.336 6.319 17.523 1.00 12.51 C ATOM 504 C GLY A 467 -9.690 6.910 17.126 1.00 33.54 C ATOM 505 O GLY A 467 -10.596 7.025 17.953 1.00 75.31 O ATOM 0 H GLY A 467 -7.125 5.905 15.850 1.00 12.12 H new ATOM 0 HA2 GLY A 467 -8.436 5.238 17.621 1.00 12.51 H new ATOM 0 HA3 GLY A 467 -8.055 6.703 18.504 1.00 12.51 H new ATOM 509 N ILE A 468 -9.828 7.276 15.856 1.00 4.35 N ATOM 510 CA ILE A 468 -11.078 7.837 15.326 1.00 50.02 C ATOM 511 C ILE A 468 -11.401 7.234 13.948 1.00 32.50 C ATOM 512 O ILE A 468 -10.496 6.999 13.149 1.00 15.21 O ATOM 513 CB ILE A 468 -10.995 9.387 15.219 1.00 62.14 C ATOM 514 CG1 ILE A 468 -12.307 9.972 14.660 1.00 53.55 C ATOM 515 CG2 ILE A 468 -9.802 9.810 14.361 1.00 72.50 C ATOM 516 CD1 ILE A 468 -12.325 11.486 14.585 1.00 23.40 C ATOM 0 H ILE A 468 -9.084 7.195 15.163 1.00 4.35 H new ATOM 0 HA ILE A 468 -11.878 7.581 16.021 1.00 50.02 H new ATOM 0 HB ILE A 468 -10.849 9.786 16.223 1.00 62.14 H new ATOM 0 HG12 ILE A 468 -12.477 9.567 13.662 1.00 53.55 H new ATOM 0 HG13 ILE A 468 -13.136 9.640 15.285 1.00 53.55 H new ATOM 0 HG21 ILE A 468 -9.765 10.898 14.301 1.00 72.50 H new ATOM 0 HG22 ILE A 468 -8.881 9.440 14.811 1.00 72.50 H new ATOM 0 HG23 ILE A 468 -9.909 9.395 13.359 1.00 72.50 H new ATOM 0 HD11 ILE A 468 -13.281 11.819 14.182 1.00 23.40 H new ATOM 0 HD12 ILE A 468 -12.188 11.901 15.583 1.00 23.40 H new ATOM 0 HD13 ILE A 468 -11.519 11.828 13.936 1.00 23.40 H new ATOM 528 N GLY A 469 -12.680 6.973 13.680 1.00 31.42 N ATOM 529 CA GLY A 469 -13.078 6.360 12.411 1.00 3.30 C ATOM 530 C GLY A 469 -12.820 7.248 11.195 1.00 64.00 C ATOM 531 O GLY A 469 -13.109 8.446 11.221 1.00 12.34 O ATOM 0 H GLY A 469 -13.452 7.173 14.316 1.00 31.42 H new ATOM 0 HA2 GLY A 469 -12.539 5.421 12.286 1.00 3.30 H new ATOM 0 HA3 GLY A 469 -14.139 6.115 12.453 1.00 3.30 H new ATOM 535 N VAL A 470 -12.286 6.661 10.122 1.00 40.02 N ATOM 536 CA VAL A 470 -11.926 7.428 8.920 1.00 31.15 C ATOM 537 C VAL A 470 -12.490 6.803 7.631 1.00 55.31 C ATOM 538 O VAL A 470 -12.069 5.716 7.220 1.00 41.23 O ATOM 539 CB VAL A 470 -10.386 7.544 8.771 1.00 2.42 C ATOM 540 CG1 VAL A 470 -10.017 8.452 7.598 1.00 62.43 C ATOM 541 CG2 VAL A 470 -9.756 8.042 10.064 1.00 5.34 C ATOM 0 H VAL A 470 -12.093 5.662 10.057 1.00 40.02 H new ATOM 0 HA VAL A 470 -12.368 8.415 9.054 1.00 31.15 H new ATOM 0 HB VAL A 470 -9.990 6.550 8.562 1.00 2.42 H new ATOM 0 HG11 VAL A 470 -8.932 8.517 7.515 1.00 62.43 H new ATOM 0 HG12 VAL A 470 -10.427 8.040 6.676 1.00 62.43 H new ATOM 0 HG13 VAL A 470 -10.428 9.448 7.765 1.00 62.43 H new ATOM 0 HG21 VAL A 470 -8.676 8.116 9.938 1.00 5.34 H new ATOM 0 HG22 VAL A 470 -10.161 9.023 10.311 1.00 5.34 H new ATOM 0 HG23 VAL A 470 -9.980 7.344 10.870 1.00 5.34 H new ATOM 551 N PRO A 471 -13.440 7.494 6.968 1.00 4.05 N ATOM 552 CA PRO A 471 -13.948 7.100 5.638 1.00 31.21 C ATOM 553 C PRO A 471 -13.011 7.547 4.501 1.00 54.35 C ATOM 554 O PRO A 471 -13.144 7.119 3.356 1.00 63.43 O ATOM 555 CB PRO A 471 -15.281 7.845 5.555 1.00 50.02 C ATOM 556 CG PRO A 471 -15.058 9.087 6.352 1.00 13.31 C ATOM 557 CD PRO A 471 -14.130 8.702 7.478 1.00 53.23 C ATOM 0 HA PRO A 471 -14.032 6.019 5.527 1.00 31.21 H new ATOM 0 HB2 PRO A 471 -15.544 8.076 4.523 1.00 50.02 H new ATOM 0 HB3 PRO A 471 -16.096 7.249 5.966 1.00 50.02 H new ATOM 0 HG2 PRO A 471 -14.618 9.871 5.736 1.00 13.31 H new ATOM 0 HG3 PRO A 471 -16.000 9.476 6.739 1.00 13.31 H new ATOM 0 HD2 PRO A 471 -13.424 9.500 7.705 1.00 53.23 H new ATOM 0 HD3 PRO A 471 -14.680 8.492 8.396 1.00 53.23 H new ATOM 565 N SER A 472 -12.051 8.396 4.847 1.00 54.42 N ATOM 566 CA SER A 472 -11.104 8.987 3.887 1.00 54.34 C ATOM 567 C SER A 472 -9.961 8.023 3.532 1.00 73.34 C ATOM 568 O SER A 472 -8.989 8.414 2.887 1.00 60.14 O ATOM 569 CB SER A 472 -10.525 10.292 4.450 1.00 21.01 C ATOM 570 OG SER A 472 -11.540 11.267 4.648 1.00 43.34 O ATOM 0 H SER A 472 -11.900 8.701 5.808 1.00 54.42 H new ATOM 0 HA SER A 472 -11.659 9.194 2.972 1.00 54.34 H new ATOM 0 HB2 SER A 472 -10.022 10.091 5.396 1.00 21.01 H new ATOM 0 HB3 SER A 472 -9.772 10.683 3.766 1.00 21.01 H new ATOM 0 HG SER A 472 -11.295 12.094 4.183 1.00 43.34 H new ATOM 576 N THR A 473 -10.092 6.757 3.918 1.00 34.01 N ATOM 577 CA THR A 473 -8.975 5.813 3.825 1.00 1.00 C ATOM 578 C THR A 473 -8.944 5.129 2.453 1.00 1.43 C ATOM 579 O THR A 473 -9.582 4.100 2.225 1.00 71.13 O ATOM 580 CB THR A 473 -9.070 4.717 4.920 1.00 22.44 C ATOM 581 OG1 THR A 473 -9.195 5.318 6.219 1.00 33.44 O ATOM 582 CG2 THR A 473 -7.846 3.803 4.902 1.00 14.43 C ATOM 0 H THR A 473 -10.952 6.360 4.296 1.00 34.01 H new ATOM 0 HA THR A 473 -8.062 6.391 3.968 1.00 1.00 H new ATOM 0 HB THR A 473 -9.955 4.117 4.707 1.00 22.44 H new ATOM 0 HG1 THR A 473 -10.144 5.405 6.449 1.00 33.44 H new ATOM 0 HG21 THR A 473 -7.945 3.047 5.681 1.00 14.43 H new ATOM 0 HG22 THR A 473 -7.771 3.315 3.930 1.00 14.43 H new ATOM 0 HG23 THR A 473 -6.948 4.394 5.082 1.00 14.43 H new ATOM 590 N LYS A 474 -8.212 5.745 1.530 1.00 41.03 N ATOM 591 CA LYS A 474 -8.020 5.200 0.185 1.00 61.11 C ATOM 592 C LYS A 474 -6.599 4.633 0.038 1.00 44.15 C ATOM 593 O LYS A 474 -5.617 5.346 0.245 1.00 13.52 O ATOM 594 CB LYS A 474 -8.260 6.300 -0.864 1.00 25.30 C ATOM 595 CG LYS A 474 -9.581 7.054 -0.686 1.00 23.24 C ATOM 596 CD LYS A 474 -9.740 8.167 -1.721 1.00 40.21 C ATOM 597 CE LYS A 474 -10.947 9.057 -1.431 1.00 60.40 C ATOM 598 NZ LYS A 474 -12.230 8.304 -1.460 1.00 1.13 N ATOM 0 H LYS A 474 -7.736 6.633 1.690 1.00 41.03 H new ATOM 0 HA LYS A 474 -8.736 4.393 0.026 1.00 61.11 H new ATOM 0 HB2 LYS A 474 -7.438 7.014 -0.821 1.00 25.30 H new ATOM 0 HB3 LYS A 474 -8.241 5.851 -1.857 1.00 25.30 H new ATOM 0 HG2 LYS A 474 -10.413 6.355 -0.772 1.00 23.24 H new ATOM 0 HG3 LYS A 474 -9.625 7.480 0.316 1.00 23.24 H new ATOM 0 HD2 LYS A 474 -8.837 8.777 -1.738 1.00 40.21 H new ATOM 0 HD3 LYS A 474 -9.846 7.726 -2.712 1.00 40.21 H new ATOM 0 HE2 LYS A 474 -10.825 9.522 -0.453 1.00 60.40 H new ATOM 0 HE3 LYS A 474 -10.985 9.862 -2.165 1.00 60.40 H new ATOM 0 HZ1 LYS A 474 -13.022 8.961 -1.308 1.00 1.13 H new ATOM 0 HZ2 LYS A 474 -12.339 7.839 -2.384 1.00 1.13 H new ATOM 0 HZ3 LYS A 474 -12.228 7.585 -0.709 1.00 1.13 H new ATOM 612 N VAL A 475 -6.497 3.356 -0.319 1.00 63.23 N ATOM 613 CA VAL A 475 -5.197 2.672 -0.435 1.00 20.11 C ATOM 614 C VAL A 475 -4.792 2.512 -1.906 1.00 1.40 C ATOM 615 O VAL A 475 -5.503 1.891 -2.690 1.00 41.42 O ATOM 616 CB VAL A 475 -5.244 1.275 0.236 1.00 70.34 C ATOM 617 CG1 VAL A 475 -3.866 0.615 0.231 1.00 3.22 C ATOM 618 CG2 VAL A 475 -5.796 1.382 1.657 1.00 21.43 C ATOM 0 H VAL A 475 -7.299 2.765 -0.536 1.00 63.23 H new ATOM 0 HA VAL A 475 -4.457 3.289 0.075 1.00 20.11 H new ATOM 0 HB VAL A 475 -5.915 0.642 -0.344 1.00 70.34 H new ATOM 0 HG11 VAL A 475 -3.929 -0.363 0.708 1.00 3.22 H new ATOM 0 HG12 VAL A 475 -3.523 0.496 -0.797 1.00 3.22 H new ATOM 0 HG13 VAL A 475 -3.161 1.241 0.778 1.00 3.22 H new ATOM 0 HG21 VAL A 475 -5.822 0.392 2.113 1.00 21.43 H new ATOM 0 HG22 VAL A 475 -5.156 2.037 2.248 1.00 21.43 H new ATOM 0 HG23 VAL A 475 -6.805 1.793 1.625 1.00 21.43 H new ATOM 628 N ARG A 476 -3.645 3.067 -2.274 1.00 25.12 N ATOM 629 CA ARG A 476 -3.211 3.095 -3.674 1.00 74.30 C ATOM 630 C ARG A 476 -1.772 2.567 -3.834 1.00 44.41 C ATOM 631 O ARG A 476 -0.928 2.772 -2.964 1.00 53.12 O ATOM 632 CB ARG A 476 -3.345 4.536 -4.193 1.00 2.13 C ATOM 633 CG ARG A 476 -2.992 4.729 -5.664 1.00 55.32 C ATOM 634 CD ARG A 476 -3.613 6.009 -6.224 1.00 61.33 C ATOM 635 NE ARG A 476 -5.065 5.891 -6.359 1.00 75.31 N ATOM 636 CZ ARG A 476 -5.934 6.716 -5.837 1.00 23.13 C ATOM 637 NH1 ARG A 476 -5.543 7.764 -5.189 1.00 5.02 N ATOM 638 NH2 ARG A 476 -7.200 6.506 -5.994 1.00 32.11 N ATOM 0 H ARG A 476 -2.993 3.506 -1.624 1.00 25.12 H new ATOM 0 HA ARG A 476 -3.844 2.433 -4.265 1.00 74.30 H new ATOM 0 HB2 ARG A 476 -4.371 4.869 -4.035 1.00 2.13 H new ATOM 0 HB3 ARG A 476 -2.704 5.183 -3.594 1.00 2.13 H new ATOM 0 HG2 ARG A 476 -1.909 4.769 -5.777 1.00 55.32 H new ATOM 0 HG3 ARG A 476 -3.342 3.872 -6.239 1.00 55.32 H new ATOM 0 HD2 ARG A 476 -3.375 6.846 -5.568 1.00 61.33 H new ATOM 0 HD3 ARG A 476 -3.174 6.231 -7.196 1.00 61.33 H new ATOM 0 HE ARG A 476 -5.426 5.106 -6.901 1.00 75.31 H new ATOM 0 HH11 ARG A 476 -4.547 7.954 -5.081 1.00 5.02 H new ATOM 0 HH12 ARG A 476 -6.231 8.401 -4.786 1.00 5.02 H new ATOM 0 HH21 ARG A 476 -7.521 5.696 -6.525 1.00 32.11 H new ATOM 0 HH22 ARG A 476 -7.878 7.150 -5.587 1.00 32.11 H new ATOM 652 N VAL A 477 -1.500 1.877 -4.950 1.00 2.21 N ATOM 653 CA VAL A 477 -0.184 1.269 -5.188 1.00 11.53 C ATOM 654 C VAL A 477 0.473 1.816 -6.467 1.00 54.34 C ATOM 655 O VAL A 477 -0.148 1.859 -7.535 1.00 41.13 O ATOM 656 CB VAL A 477 -0.294 -0.276 -5.304 1.00 40.25 C ATOM 657 CG1 VAL A 477 1.075 -0.908 -5.560 1.00 71.20 C ATOM 658 CG2 VAL A 477 -0.944 -0.869 -4.053 1.00 0.13 C ATOM 0 H VAL A 477 -2.173 1.726 -5.701 1.00 2.21 H new ATOM 0 HA VAL A 477 0.437 1.528 -4.331 1.00 11.53 H new ATOM 0 HB VAL A 477 -0.931 -0.504 -6.158 1.00 40.25 H new ATOM 0 HG11 VAL A 477 0.968 -1.990 -5.637 1.00 71.20 H new ATOM 0 HG12 VAL A 477 1.488 -0.517 -6.490 1.00 71.20 H new ATOM 0 HG13 VAL A 477 1.747 -0.668 -4.736 1.00 71.20 H new ATOM 0 HG21 VAL A 477 -1.011 -1.952 -4.156 1.00 0.13 H new ATOM 0 HG22 VAL A 477 -0.341 -0.624 -3.179 1.00 0.13 H new ATOM 0 HG23 VAL A 477 -1.944 -0.454 -3.931 1.00 0.13 H new ATOM 668 N TYR A 478 1.734 2.234 -6.343 1.00 20.13 N ATOM 669 CA TYR A 478 2.515 2.734 -7.484 1.00 51.12 C ATOM 670 C TYR A 478 3.769 1.875 -7.718 1.00 33.14 C ATOM 671 O TYR A 478 4.471 1.517 -6.770 1.00 4.02 O ATOM 672 CB TYR A 478 2.959 4.186 -7.248 1.00 12.54 C ATOM 673 CG TYR A 478 1.830 5.169 -7.001 1.00 64.33 C ATOM 674 CD1 TYR A 478 1.166 5.786 -8.060 1.00 65.21 C ATOM 675 CD2 TYR A 478 1.445 5.500 -5.707 1.00 21.32 C ATOM 676 CE1 TYR A 478 0.156 6.701 -7.830 1.00 34.34 C ATOM 677 CE2 TYR A 478 0.433 6.410 -5.473 1.00 24.11 C ATOM 678 CZ TYR A 478 -0.206 7.008 -6.536 1.00 74.40 C ATOM 679 OH TYR A 478 -1.209 7.923 -6.306 1.00 5.44 O ATOM 0 H TYR A 478 2.242 2.237 -5.459 1.00 20.13 H new ATOM 0 HA TYR A 478 1.869 2.682 -8.360 1.00 51.12 H new ATOM 0 HB2 TYR A 478 3.635 4.209 -6.393 1.00 12.54 H new ATOM 0 HB3 TYR A 478 3.530 4.521 -8.114 1.00 12.54 H new ATOM 0 HD1 TYR A 478 1.445 5.545 -9.075 1.00 65.21 H new ATOM 0 HD2 TYR A 478 1.946 5.037 -4.870 1.00 21.32 H new ATOM 0 HE1 TYR A 478 -0.347 7.173 -8.661 1.00 34.34 H new ATOM 0 HE2 TYR A 478 0.144 6.652 -4.461 1.00 24.11 H new ATOM 0 HH TYR A 478 -0.940 8.529 -5.585 1.00 5.44 H new ATOM 689 N ILE A 479 4.059 1.565 -8.980 1.00 42.42 N ATOM 690 CA ILE A 479 5.291 0.853 -9.349 1.00 61.22 C ATOM 691 C ILE A 479 6.227 1.781 -10.144 1.00 43.44 C ATOM 692 O ILE A 479 5.951 2.115 -11.298 1.00 13.22 O ATOM 693 CB ILE A 479 4.986 -0.419 -10.184 1.00 25.43 C ATOM 694 CG1 ILE A 479 4.032 -1.349 -9.409 1.00 52.22 C ATOM 695 CG2 ILE A 479 6.282 -1.153 -10.547 1.00 41.14 C ATOM 696 CD1 ILE A 479 3.654 -2.612 -10.159 1.00 10.44 C ATOM 0 H ILE A 479 3.457 1.795 -9.771 1.00 42.42 H new ATOM 0 HA ILE A 479 5.781 0.545 -8.425 1.00 61.22 H new ATOM 0 HB ILE A 479 4.498 -0.116 -11.111 1.00 25.43 H new ATOM 0 HG12 ILE A 479 4.500 -1.626 -8.464 1.00 52.22 H new ATOM 0 HG13 ILE A 479 3.123 -0.798 -9.165 1.00 52.22 H new ATOM 0 HG21 ILE A 479 6.045 -2.042 -11.132 1.00 41.14 H new ATOM 0 HG22 ILE A 479 6.922 -0.493 -11.132 1.00 41.14 H new ATOM 0 HG23 ILE A 479 6.801 -1.447 -9.635 1.00 41.14 H new ATOM 0 HD11 ILE A 479 2.981 -3.212 -9.546 1.00 10.44 H new ATOM 0 HD12 ILE A 479 3.156 -2.346 -11.091 1.00 10.44 H new ATOM 0 HD13 ILE A 479 4.553 -3.187 -10.380 1.00 10.44 H new ATOM 708 N ASN A 480 7.322 2.213 -9.512 1.00 12.51 N ATOM 709 CA ASN A 480 8.259 3.178 -10.116 1.00 11.33 C ATOM 710 C ASN A 480 7.541 4.485 -10.510 1.00 3.23 C ATOM 711 O ASN A 480 7.892 5.127 -11.505 1.00 14.01 O ATOM 712 CB ASN A 480 8.959 2.568 -11.345 1.00 24.31 C ATOM 713 CG ASN A 480 9.829 1.374 -10.997 1.00 10.24 C ATOM 714 OD1 ASN A 480 10.324 1.253 -9.882 1.00 44.31 O ATOM 715 ND2 ASN A 480 10.043 0.495 -11.958 1.00 52.14 N ATOM 0 H ASN A 480 7.587 1.910 -8.575 1.00 12.51 H new ATOM 0 HA ASN A 480 9.013 3.415 -9.365 1.00 11.33 H new ATOM 0 HB2 ASN A 480 8.206 2.263 -12.072 1.00 24.31 H new ATOM 0 HB3 ASN A 480 9.573 3.331 -11.823 1.00 24.31 H new ATOM 0 HD21 ASN A 480 10.636 -0.316 -11.784 1.00 52.14 H new ATOM 0 HD22 ASN A 480 9.615 0.627 -12.874 1.00 52.14 H new ATOM 722 N GLY A 481 6.551 4.882 -9.711 1.00 25.22 N ATOM 723 CA GLY A 481 5.774 6.088 -10.003 1.00 12.25 C ATOM 724 C GLY A 481 4.570 5.830 -10.911 1.00 25.10 C ATOM 725 O GLY A 481 3.800 6.746 -11.212 1.00 22.24 O ATOM 0 H GLY A 481 6.269 4.391 -8.863 1.00 25.22 H new ATOM 0 HA2 GLY A 481 5.426 6.523 -9.066 1.00 12.25 H new ATOM 0 HA3 GLY A 481 6.424 6.825 -10.475 1.00 12.25 H new ATOM 729 N THR A 482 4.408 4.584 -11.349 1.00 34.12 N ATOM 730 CA THR A 482 3.296 4.204 -12.236 1.00 5.13 C ATOM 731 C THR A 482 2.067 3.758 -11.433 1.00 45.32 C ATOM 732 O THR A 482 2.154 2.833 -10.624 1.00 5.11 O ATOM 733 CB THR A 482 3.706 3.050 -13.186 1.00 54.33 C ATOM 734 OG1 THR A 482 4.868 3.420 -13.946 1.00 44.11 O ATOM 735 CG2 THR A 482 2.568 2.681 -14.136 1.00 2.41 C ATOM 0 H THR A 482 5.031 3.814 -11.107 1.00 34.12 H new ATOM 0 HA THR A 482 3.047 5.090 -12.820 1.00 5.13 H new ATOM 0 HB THR A 482 3.936 2.180 -12.571 1.00 54.33 H new ATOM 0 HG1 THR A 482 5.118 2.683 -14.541 1.00 44.11 H new ATOM 0 HG21 THR A 482 2.888 1.869 -14.789 1.00 2.41 H new ATOM 0 HG22 THR A 482 1.701 2.362 -13.558 1.00 2.41 H new ATOM 0 HG23 THR A 482 2.302 3.549 -14.740 1.00 2.41 H new ATOM 743 N LEU A 483 0.925 4.407 -11.657 1.00 74.14 N ATOM 744 CA LEU A 483 -0.320 4.022 -10.981 1.00 53.12 C ATOM 745 C LEU A 483 -0.752 2.605 -11.388 1.00 1.22 C ATOM 746 O LEU A 483 -1.078 2.350 -12.549 1.00 23.33 O ATOM 747 CB LEU A 483 -1.445 5.022 -11.292 1.00 53.10 C ATOM 748 CG LEU A 483 -2.828 4.642 -10.732 1.00 4.35 C ATOM 749 CD1 LEU A 483 -2.762 4.442 -9.221 1.00 45.20 C ATOM 750 CD2 LEU A 483 -3.872 5.695 -11.090 1.00 2.44 C ATOM 0 H LEU A 483 0.833 5.197 -12.296 1.00 74.14 H new ATOM 0 HA LEU A 483 -0.129 4.033 -9.908 1.00 53.12 H new ATOM 0 HB2 LEU A 483 -1.164 5.997 -10.894 1.00 53.10 H new ATOM 0 HB3 LEU A 483 -1.525 5.131 -12.374 1.00 53.10 H new ATOM 0 HG LEU A 483 -3.129 3.700 -11.190 1.00 4.35 H new ATOM 0 HD11 LEU A 483 -3.750 4.174 -8.846 1.00 45.20 H new ATOM 0 HD12 LEU A 483 -2.057 3.643 -8.990 1.00 45.20 H new ATOM 0 HD13 LEU A 483 -2.432 5.366 -8.746 1.00 45.20 H new ATOM 0 HD21 LEU A 483 -4.839 5.402 -10.682 1.00 2.44 H new ATOM 0 HD22 LEU A 483 -3.578 6.657 -10.670 1.00 2.44 H new ATOM 0 HD23 LEU A 483 -3.946 5.780 -12.174 1.00 2.44 H new ATOM 762 N TYR A 484 -0.752 1.685 -10.428 1.00 30.43 N ATOM 763 CA TYR A 484 -1.055 0.281 -10.721 1.00 43.35 C ATOM 764 C TYR A 484 -2.461 -0.143 -10.258 1.00 32.10 C ATOM 765 O TYR A 484 -3.183 -0.819 -10.996 1.00 65.01 O ATOM 766 CB TYR A 484 -0.001 -0.621 -10.068 1.00 61.34 C ATOM 767 CG TYR A 484 -0.227 -2.094 -10.335 1.00 72.00 C ATOM 768 CD1 TYR A 484 -0.009 -2.626 -11.601 1.00 34.31 C ATOM 769 CD2 TYR A 484 -0.673 -2.947 -9.329 1.00 15.04 C ATOM 770 CE1 TYR A 484 -0.227 -3.963 -11.858 1.00 34.25 C ATOM 771 CE2 TYR A 484 -0.894 -4.289 -9.583 1.00 23.01 C ATOM 772 CZ TYR A 484 -0.669 -4.790 -10.849 1.00 20.43 C ATOM 773 OH TYR A 484 -0.889 -6.122 -11.112 1.00 23.44 O ATOM 0 H TYR A 484 -0.548 1.880 -9.448 1.00 30.43 H new ATOM 0 HA TYR A 484 -1.033 0.171 -11.805 1.00 43.35 H new ATOM 0 HB2 TYR A 484 0.986 -0.339 -10.435 1.00 61.34 H new ATOM 0 HB3 TYR A 484 -0.002 -0.449 -8.992 1.00 61.34 H new ATOM 0 HD1 TYR A 484 0.337 -1.982 -12.396 1.00 34.31 H new ATOM 0 HD2 TYR A 484 -0.849 -2.556 -8.338 1.00 15.04 H new ATOM 0 HE1 TYR A 484 -0.052 -4.360 -12.847 1.00 34.25 H new ATOM 0 HE2 TYR A 484 -1.241 -4.941 -8.795 1.00 23.01 H new ATOM 0 HH TYR A 484 -1.197 -6.570 -10.297 1.00 23.44 H new ATOM 783 N LYS A 485 -2.856 0.254 -9.049 1.00 2.21 N ATOM 784 CA LYS A 485 -4.111 -0.238 -8.455 1.00 65.22 C ATOM 785 C LYS A 485 -4.521 0.612 -7.238 1.00 4.22 C ATOM 786 O LYS A 485 -3.694 1.326 -6.670 1.00 10.10 O ATOM 787 CB LYS A 485 -3.919 -1.707 -8.040 1.00 53.34 C ATOM 788 CG LYS A 485 -5.211 -2.508 -7.892 1.00 4.43 C ATOM 789 CD LYS A 485 -4.913 -3.965 -7.542 1.00 62.05 C ATOM 790 CE LYS A 485 -6.163 -4.841 -7.546 1.00 41.50 C ATOM 791 NZ LYS A 485 -6.710 -5.028 -8.912 1.00 70.12 N ATOM 0 H LYS A 485 -2.336 0.907 -8.463 1.00 2.21 H new ATOM 0 HA LYS A 485 -4.909 -0.161 -9.193 1.00 65.22 H new ATOM 0 HB2 LYS A 485 -3.287 -2.198 -8.779 1.00 53.34 H new ATOM 0 HB3 LYS A 485 -3.381 -1.734 -7.092 1.00 53.34 H new ATOM 0 HG2 LYS A 485 -5.832 -2.063 -7.115 1.00 4.43 H new ATOM 0 HG3 LYS A 485 -5.780 -2.462 -8.820 1.00 4.43 H new ATOM 0 HD2 LYS A 485 -4.192 -4.365 -8.255 1.00 62.05 H new ATOM 0 HD3 LYS A 485 -4.447 -4.010 -6.558 1.00 62.05 H new ATOM 0 HE2 LYS A 485 -5.925 -5.814 -7.115 1.00 41.50 H new ATOM 0 HE3 LYS A 485 -6.924 -4.389 -6.910 1.00 41.50 H new ATOM 0 HZ1 LYS A 485 -7.484 -5.722 -8.884 1.00 70.12 H new ATOM 0 HZ2 LYS A 485 -7.071 -4.120 -9.269 1.00 70.12 H new ATOM 0 HZ3 LYS A 485 -5.958 -5.373 -9.543 1.00 70.12 H new ATOM 805 N ASN A 486 -5.799 0.544 -6.840 1.00 12.44 N ATOM 806 CA ASN A 486 -6.274 1.280 -5.655 1.00 31.31 C ATOM 807 C ASN A 486 -7.603 0.727 -5.100 1.00 74.02 C ATOM 808 O ASN A 486 -8.401 0.133 -5.829 1.00 40.30 O ATOM 809 CB ASN A 486 -6.422 2.782 -5.955 1.00 63.10 C ATOM 810 CG ASN A 486 -7.473 3.100 -7.007 1.00 23.40 C ATOM 811 OD1 ASN A 486 -8.233 4.050 -6.866 1.00 33.20 O ATOM 812 ND2 ASN A 486 -7.499 2.350 -8.089 1.00 32.13 N ATOM 0 H ASN A 486 -6.516 -0.005 -7.313 1.00 12.44 H new ATOM 0 HA ASN A 486 -5.512 1.138 -4.888 1.00 31.31 H new ATOM 0 HB2 ASN A 486 -6.676 3.303 -5.032 1.00 63.10 H new ATOM 0 HB3 ASN A 486 -5.460 3.173 -6.287 1.00 63.10 H new ATOM 0 HD21 ASN A 486 -8.163 2.554 -8.835 1.00 32.13 H new ATOM 0 HD22 ASN A 486 -6.855 1.565 -8.181 1.00 32.13 H new ATOM 819 N TRP A 487 -7.819 0.947 -3.799 1.00 62.41 N ATOM 820 CA TRP A 487 -9.037 0.519 -3.089 1.00 4.32 C ATOM 821 C TRP A 487 -9.547 1.644 -2.170 1.00 3.32 C ATOM 822 O TRP A 487 -8.758 2.442 -1.663 1.00 21.12 O ATOM 823 CB TRP A 487 -8.760 -0.716 -2.217 1.00 72.40 C ATOM 824 CG TRP A 487 -8.145 -1.878 -2.940 1.00 11.33 C ATOM 825 CD1 TRP A 487 -8.799 -2.872 -3.605 1.00 71.12 C ATOM 826 CD2 TRP A 487 -6.748 -2.173 -3.049 1.00 71.52 C ATOM 827 NE1 TRP A 487 -7.895 -3.767 -4.122 1.00 72.23 N ATOM 828 CE2 TRP A 487 -6.629 -3.360 -3.792 1.00 0.03 C ATOM 829 CE3 TRP A 487 -5.588 -1.546 -2.587 1.00 21.03 C ATOM 830 CZ2 TRP A 487 -5.394 -3.933 -4.085 1.00 51.13 C ATOM 831 CZ3 TRP A 487 -4.362 -2.114 -2.878 1.00 71.45 C ATOM 832 CH2 TRP A 487 -4.274 -3.298 -3.620 1.00 44.22 C ATOM 0 H TRP A 487 -7.150 1.431 -3.201 1.00 62.41 H new ATOM 0 HA TRP A 487 -9.785 0.278 -3.844 1.00 4.32 H new ATOM 0 HB2 TRP A 487 -8.099 -0.425 -1.400 1.00 72.40 H new ATOM 0 HB3 TRP A 487 -9.698 -1.042 -1.767 1.00 72.40 H new ATOM 0 HD1 TRP A 487 -9.871 -2.945 -3.710 1.00 71.12 H new ATOM 0 HE1 TRP A 487 -8.128 -4.599 -4.664 1.00 72.23 H new ATOM 0 HE3 TRP A 487 -5.648 -0.633 -2.013 1.00 21.03 H new ATOM 0 HZ2 TRP A 487 -5.322 -4.845 -4.658 1.00 51.13 H new ATOM 0 HZ3 TRP A 487 -3.458 -1.637 -2.528 1.00 71.45 H new ATOM 0 HH2 TRP A 487 -3.302 -3.719 -3.830 1.00 44.22 H new ATOM 843 N THR A 488 -10.858 1.707 -1.952 1.00 24.34 N ATOM 844 CA THR A 488 -11.433 2.662 -0.989 1.00 33.14 C ATOM 845 C THR A 488 -12.092 1.932 0.192 1.00 41.22 C ATOM 846 O THR A 488 -13.044 1.168 0.013 1.00 63.14 O ATOM 847 CB THR A 488 -12.477 3.593 -1.654 1.00 14.32 C ATOM 848 OG1 THR A 488 -11.861 4.360 -2.703 1.00 74.45 O ATOM 849 CG2 THR A 488 -13.099 4.542 -0.634 1.00 55.41 C ATOM 0 H THR A 488 -11.544 1.116 -2.422 1.00 24.34 H new ATOM 0 HA THR A 488 -10.605 3.269 -0.623 1.00 33.14 H new ATOM 0 HB THR A 488 -13.264 2.965 -2.071 1.00 14.32 H new ATOM 0 HG1 THR A 488 -12.530 4.944 -3.118 1.00 74.45 H new ATOM 0 HG21 THR A 488 -13.828 5.183 -1.130 1.00 55.41 H new ATOM 0 HG22 THR A 488 -13.596 3.964 0.145 1.00 55.41 H new ATOM 0 HG23 THR A 488 -12.319 5.158 -0.187 1.00 55.41 H new ATOM 857 N VAL A 489 -11.592 2.188 1.401 1.00 44.21 N ATOM 858 CA VAL A 489 -12.077 1.511 2.613 1.00 71.13 C ATOM 859 C VAL A 489 -12.233 2.492 3.789 1.00 60.34 C ATOM 860 O VAL A 489 -11.872 3.666 3.692 1.00 1.12 O ATOM 861 CB VAL A 489 -11.127 0.355 3.040 1.00 73.22 C ATOM 862 CG1 VAL A 489 -11.071 -0.741 1.974 1.00 23.42 C ATOM 863 CG2 VAL A 489 -9.725 0.889 3.340 1.00 23.24 C ATOM 0 H VAL A 489 -10.847 2.863 1.572 1.00 44.21 H new ATOM 0 HA VAL A 489 -13.054 1.098 2.364 1.00 71.13 H new ATOM 0 HB VAL A 489 -11.530 -0.087 3.952 1.00 73.22 H new ATOM 0 HG11 VAL A 489 -10.399 -1.534 2.302 1.00 23.42 H new ATOM 0 HG12 VAL A 489 -12.069 -1.151 1.821 1.00 23.42 H new ATOM 0 HG13 VAL A 489 -10.705 -0.320 1.038 1.00 23.42 H new ATOM 0 HG21 VAL A 489 -9.077 0.064 3.637 1.00 23.24 H new ATOM 0 HG22 VAL A 489 -9.319 1.367 2.448 1.00 23.24 H new ATOM 0 HG23 VAL A 489 -9.779 1.617 4.149 1.00 23.24 H new ATOM 873 N SER A 490 -12.792 2.007 4.896 1.00 11.04 N ATOM 874 CA SER A 490 -12.929 2.820 6.115 1.00 75.25 C ATOM 875 C SER A 490 -12.300 2.109 7.320 1.00 32.24 C ATOM 876 O SER A 490 -12.506 0.911 7.526 1.00 61.24 O ATOM 877 CB SER A 490 -14.407 3.127 6.408 1.00 63.21 C ATOM 878 OG SER A 490 -15.135 1.952 6.739 1.00 73.43 O ATOM 0 H SER A 490 -13.158 1.059 4.980 1.00 11.04 H new ATOM 0 HA SER A 490 -12.402 3.759 5.945 1.00 75.25 H new ATOM 0 HB2 SER A 490 -14.474 3.840 7.230 1.00 63.21 H new ATOM 0 HB3 SER A 490 -14.859 3.601 5.537 1.00 63.21 H new ATOM 0 HG SER A 490 -16.069 2.186 6.920 1.00 73.43 H new ATOM 884 N LEU A 491 -11.537 2.854 8.116 1.00 32.24 N ATOM 885 CA LEU A 491 -10.877 2.297 9.305 1.00 34.13 C ATOM 886 C LEU A 491 -11.379 2.971 10.585 1.00 43.01 C ATOM 887 O LEU A 491 -11.230 4.181 10.755 1.00 30.13 O ATOM 888 CB LEU A 491 -9.355 2.477 9.199 1.00 15.54 C ATOM 889 CG LEU A 491 -8.672 1.677 8.080 1.00 62.11 C ATOM 890 CD1 LEU A 491 -7.185 2.015 7.999 1.00 52.32 C ATOM 891 CD2 LEU A 491 -8.869 0.178 8.296 1.00 75.31 C ATOM 0 H LEU A 491 -11.357 3.846 7.963 1.00 32.24 H new ATOM 0 HA LEU A 491 -11.119 1.235 9.353 1.00 34.13 H new ATOM 0 HB2 LEU A 491 -9.141 3.535 9.048 1.00 15.54 H new ATOM 0 HB3 LEU A 491 -8.906 2.194 10.151 1.00 15.54 H new ATOM 0 HG LEU A 491 -9.136 1.954 7.133 1.00 62.11 H new ATOM 0 HD11 LEU A 491 -6.723 1.436 7.199 1.00 52.32 H new ATOM 0 HD12 LEU A 491 -7.064 3.079 7.793 1.00 52.32 H new ATOM 0 HD13 LEU A 491 -6.705 1.772 8.947 1.00 52.32 H new ATOM 0 HD21 LEU A 491 -8.378 -0.373 7.494 1.00 75.31 H new ATOM 0 HD22 LEU A 491 -8.435 -0.112 9.253 1.00 75.31 H new ATOM 0 HD23 LEU A 491 -9.934 -0.053 8.296 1.00 75.31 H new ATOM 903 N GLY A 492 -11.953 2.180 11.486 1.00 14.45 N ATOM 904 CA GLY A 492 -12.458 2.712 12.747 1.00 4.40 C ATOM 905 C GLY A 492 -11.359 2.982 13.771 1.00 24.44 C ATOM 906 O GLY A 492 -10.167 2.921 13.447 1.00 21.10 O ATOM 0 H GLY A 492 -12.080 1.175 11.368 1.00 14.45 H new ATOM 0 HA2 GLY A 492 -12.999 3.638 12.552 1.00 4.40 H new ATOM 0 HA3 GLY A 492 -13.174 2.007 13.170 1.00 4.40 H new ATOM 910 N PRO A 493 -11.726 3.279 15.030 1.00 63.24 N ATOM 911 CA PRO A 493 -10.747 3.552 16.090 1.00 24.12 C ATOM 912 C PRO A 493 -9.813 2.357 16.349 1.00 50.21 C ATOM 913 O PRO A 493 -10.169 1.417 17.060 1.00 34.54 O ATOM 914 CB PRO A 493 -11.616 3.856 17.322 1.00 45.13 C ATOM 915 CG PRO A 493 -12.945 3.245 17.013 1.00 74.45 C ATOM 916 CD PRO A 493 -13.113 3.368 15.521 1.00 73.22 C ATOM 0 HA PRO A 493 -10.078 4.371 15.825 1.00 24.12 H new ATOM 0 HB2 PRO A 493 -11.184 3.427 18.226 1.00 45.13 H new ATOM 0 HB3 PRO A 493 -11.704 4.930 17.489 1.00 45.13 H new ATOM 0 HG2 PRO A 493 -12.978 2.201 17.326 1.00 74.45 H new ATOM 0 HG3 PRO A 493 -13.746 3.762 17.541 1.00 74.45 H new ATOM 0 HD2 PRO A 493 -13.737 2.571 15.117 1.00 73.22 H new ATOM 0 HD3 PRO A 493 -13.581 4.312 15.243 1.00 73.22 H new ATOM 924 N LYS A 494 -8.628 2.403 15.738 1.00 22.10 N ATOM 925 CA LYS A 494 -7.616 1.347 15.878 1.00 45.04 C ATOM 926 C LYS A 494 -8.084 0.017 15.247 1.00 73.31 C ATOM 927 O LYS A 494 -8.195 -1.015 15.912 1.00 72.34 O ATOM 928 CB LYS A 494 -7.222 1.183 17.357 1.00 32.11 C ATOM 929 CG LYS A 494 -6.598 2.448 17.949 1.00 11.33 C ATOM 930 CD LYS A 494 -6.294 2.309 19.440 1.00 21.02 C ATOM 931 CE LYS A 494 -5.679 3.589 20.004 1.00 4.01 C ATOM 932 NZ LYS A 494 -5.367 3.481 21.454 1.00 74.55 N ATOM 0 H LYS A 494 -8.340 3.171 15.132 1.00 22.10 H new ATOM 0 HA LYS A 494 -6.726 1.648 15.325 1.00 45.04 H new ATOM 0 HB2 LYS A 494 -8.106 0.914 17.936 1.00 32.11 H new ATOM 0 HB3 LYS A 494 -6.516 0.357 17.451 1.00 32.11 H new ATOM 0 HG2 LYS A 494 -5.677 2.679 17.414 1.00 11.33 H new ATOM 0 HG3 LYS A 494 -7.275 3.289 17.797 1.00 11.33 H new ATOM 0 HD2 LYS A 494 -7.212 2.076 19.980 1.00 21.02 H new ATOM 0 HD3 LYS A 494 -5.610 1.475 19.598 1.00 21.02 H new ATOM 0 HE2 LYS A 494 -4.766 3.822 19.456 1.00 4.01 H new ATOM 0 HE3 LYS A 494 -6.367 4.419 19.845 1.00 4.01 H new ATOM 0 HZ1 LYS A 494 -4.952 4.375 21.787 1.00 74.55 H new ATOM 0 HZ2 LYS A 494 -6.241 3.286 21.983 1.00 74.55 H new ATOM 0 HZ3 LYS A 494 -4.690 2.707 21.607 1.00 74.55 H new ATOM 946 N GLU A 495 -8.361 0.077 13.943 1.00 61.10 N ATOM 947 CA GLU A 495 -8.778 -1.089 13.143 1.00 31.30 C ATOM 948 C GLU A 495 -7.791 -1.334 11.983 1.00 53.24 C ATOM 949 O GLU A 495 -7.143 -0.396 11.513 1.00 13.34 O ATOM 950 CB GLU A 495 -10.194 -0.841 12.584 1.00 74.31 C ATOM 951 CG GLU A 495 -10.682 -1.887 11.580 1.00 71.20 C ATOM 952 CD GLU A 495 -10.947 -3.251 12.204 1.00 43.21 C ATOM 953 OE1 GLU A 495 -9.993 -4.041 12.361 1.00 31.23 O ATOM 954 OE2 GLU A 495 -12.116 -3.542 12.530 1.00 11.43 O ATOM 0 H GLU A 495 -8.303 0.940 13.403 1.00 61.10 H new ATOM 0 HA GLU A 495 -8.783 -1.973 13.781 1.00 31.30 H new ATOM 0 HB2 GLU A 495 -10.896 -0.803 13.417 1.00 74.31 H new ATOM 0 HB3 GLU A 495 -10.214 0.138 12.105 1.00 74.31 H new ATOM 0 HG2 GLU A 495 -11.597 -1.528 11.109 1.00 71.20 H new ATOM 0 HG3 GLU A 495 -9.939 -1.996 10.790 1.00 71.20 H new ATOM 961 N GLU A 496 -7.680 -2.588 11.526 1.00 43.25 N ATOM 962 CA GLU A 496 -6.818 -2.926 10.380 1.00 54.31 C ATOM 963 C GLU A 496 -7.525 -3.856 9.386 1.00 22.42 C ATOM 964 O GLU A 496 -8.192 -4.816 9.780 1.00 33.32 O ATOM 965 CB GLU A 496 -5.513 -3.595 10.839 1.00 64.22 C ATOM 966 CG GLU A 496 -4.612 -4.007 9.673 1.00 54.44 C ATOM 967 CD GLU A 496 -3.304 -4.642 10.110 1.00 62.14 C ATOM 968 OE1 GLU A 496 -3.259 -5.878 10.272 1.00 52.44 O ATOM 969 OE2 GLU A 496 -2.305 -3.911 10.269 1.00 63.33 O ATOM 0 H GLU A 496 -8.173 -3.385 11.929 1.00 43.25 H new ATOM 0 HA GLU A 496 -6.590 -1.983 9.883 1.00 54.31 H new ATOM 0 HB2 GLU A 496 -4.968 -2.909 11.488 1.00 64.22 H new ATOM 0 HB3 GLU A 496 -5.752 -4.476 11.435 1.00 64.22 H new ATOM 0 HG2 GLU A 496 -5.152 -4.709 9.038 1.00 54.44 H new ATOM 0 HG3 GLU A 496 -4.395 -3.129 9.065 1.00 54.44 H new ATOM 976 N LYS A 497 -7.362 -3.570 8.094 1.00 3.45 N ATOM 977 CA LYS A 497 -7.882 -4.434 7.026 1.00 60.23 C ATOM 978 C LYS A 497 -6.722 -4.996 6.183 1.00 75.45 C ATOM 979 O LYS A 497 -5.676 -4.355 6.044 1.00 53.40 O ATOM 980 CB LYS A 497 -8.853 -3.655 6.119 1.00 21.32 C ATOM 981 CG LYS A 497 -9.879 -2.807 6.869 1.00 45.52 C ATOM 982 CD LYS A 497 -10.733 -3.622 7.839 1.00 3.14 C ATOM 983 CE LYS A 497 -11.661 -4.593 7.120 1.00 42.24 C ATOM 984 NZ LYS A 497 -12.498 -5.361 8.076 1.00 4.30 N ATOM 0 H LYS A 497 -6.871 -2.742 7.757 1.00 3.45 H new ATOM 0 HA LYS A 497 -8.422 -5.260 7.489 1.00 60.23 H new ATOM 0 HB2 LYS A 497 -8.274 -3.006 5.462 1.00 21.32 H new ATOM 0 HB3 LYS A 497 -9.382 -4.363 5.482 1.00 21.32 H new ATOM 0 HG2 LYS A 497 -9.360 -2.023 7.421 1.00 45.52 H new ATOM 0 HG3 LYS A 497 -10.530 -2.312 6.148 1.00 45.52 H new ATOM 0 HD2 LYS A 497 -10.082 -4.178 8.513 1.00 3.14 H new ATOM 0 HD3 LYS A 497 -11.326 -2.945 8.454 1.00 3.14 H new ATOM 0 HE2 LYS A 497 -12.304 -4.042 6.434 1.00 42.24 H new ATOM 0 HE3 LYS A 497 -11.070 -5.283 6.518 1.00 42.24 H new ATOM 0 HZ1 LYS A 497 -13.117 -6.011 7.551 1.00 4.30 H new ATOM 0 HZ2 LYS A 497 -11.884 -5.906 8.714 1.00 4.30 H new ATOM 0 HZ3 LYS A 497 -13.080 -4.704 8.633 1.00 4.30 H new ATOM 998 N VAL A 498 -6.906 -6.190 5.619 1.00 72.14 N ATOM 999 CA VAL A 498 -5.859 -6.831 4.806 1.00 54.40 C ATOM 1000 C VAL A 498 -6.288 -6.963 3.333 1.00 30.43 C ATOM 1001 O VAL A 498 -7.213 -7.710 3.007 1.00 20.35 O ATOM 1002 CB VAL A 498 -5.493 -8.232 5.365 1.00 41.14 C ATOM 1003 CG1 VAL A 498 -4.384 -8.884 4.535 1.00 14.32 C ATOM 1004 CG2 VAL A 498 -5.084 -8.137 6.837 1.00 12.12 C ATOM 0 H VAL A 498 -7.764 -6.735 5.706 1.00 72.14 H new ATOM 0 HA VAL A 498 -4.981 -6.187 4.858 1.00 54.40 H new ATOM 0 HB VAL A 498 -6.379 -8.863 5.295 1.00 41.14 H new ATOM 0 HG11 VAL A 498 -4.148 -9.864 4.949 1.00 14.32 H new ATOM 0 HG12 VAL A 498 -4.720 -8.997 3.504 1.00 14.32 H new ATOM 0 HG13 VAL A 498 -3.494 -8.256 4.560 1.00 14.32 H new ATOM 0 HG21 VAL A 498 -4.832 -9.130 7.209 1.00 12.12 H new ATOM 0 HG22 VAL A 498 -4.218 -7.483 6.932 1.00 12.12 H new ATOM 0 HG23 VAL A 498 -5.911 -7.731 7.419 1.00 12.12 H new ATOM 1014 N LEU A 499 -5.599 -6.238 2.451 1.00 52.34 N ATOM 1015 CA LEU A 499 -5.910 -6.246 1.013 1.00 52.23 C ATOM 1016 C LEU A 499 -4.805 -6.948 0.206 1.00 23.43 C ATOM 1017 O LEU A 499 -3.623 -6.723 0.440 1.00 12.02 O ATOM 1018 CB LEU A 499 -6.077 -4.803 0.511 1.00 42.22 C ATOM 1019 CG LEU A 499 -7.165 -3.980 1.225 1.00 4.14 C ATOM 1020 CD1 LEU A 499 -7.152 -2.528 0.748 1.00 11.15 C ATOM 1021 CD2 LEU A 499 -8.546 -4.603 1.011 1.00 74.51 C ATOM 0 H LEU A 499 -4.817 -5.634 2.705 1.00 52.34 H new ATOM 0 HA LEU A 499 -6.839 -6.798 0.870 1.00 52.23 H new ATOM 0 HB2 LEU A 499 -5.124 -4.286 0.619 1.00 42.22 H new ATOM 0 HB3 LEU A 499 -6.306 -4.831 -0.554 1.00 42.22 H new ATOM 0 HG LEU A 499 -6.946 -3.990 2.293 1.00 4.14 H new ATOM 0 HD11 LEU A 499 -7.930 -1.968 1.267 1.00 11.15 H new ATOM 0 HD12 LEU A 499 -6.180 -2.083 0.962 1.00 11.15 H new ATOM 0 HD13 LEU A 499 -7.337 -2.496 -0.326 1.00 11.15 H new ATOM 0 HD21 LEU A 499 -9.299 -4.005 1.524 1.00 74.51 H new ATOM 0 HD22 LEU A 499 -8.771 -4.632 -0.055 1.00 74.51 H new ATOM 0 HD23 LEU A 499 -8.554 -5.617 1.411 1.00 74.51 H new ATOM 1033 N THR A 500 -5.191 -7.797 -0.746 1.00 23.23 N ATOM 1034 CA THR A 500 -4.216 -8.497 -1.603 1.00 2.31 C ATOM 1035 C THR A 500 -4.382 -8.126 -3.080 1.00 24.51 C ATOM 1036 O THR A 500 -5.483 -7.813 -3.538 1.00 31.23 O ATOM 1037 CB THR A 500 -4.325 -10.037 -1.481 1.00 12.41 C ATOM 1038 OG1 THR A 500 -5.672 -10.462 -1.735 1.00 62.42 O ATOM 1039 CG2 THR A 500 -3.882 -10.523 -0.106 1.00 50.04 C ATOM 0 H THR A 500 -6.166 -8.020 -0.948 1.00 23.23 H new ATOM 0 HA THR A 500 -3.237 -8.174 -1.248 1.00 2.31 H new ATOM 0 HB THR A 500 -3.660 -10.474 -2.226 1.00 12.41 H new ATOM 0 HG1 THR A 500 -5.728 -11.437 -1.657 1.00 62.42 H new ATOM 0 HG21 THR A 500 -3.972 -11.608 -0.057 1.00 50.04 H new ATOM 0 HG22 THR A 500 -2.844 -10.237 0.064 1.00 50.04 H new ATOM 0 HG23 THR A 500 -4.513 -10.072 0.660 1.00 50.04 H new ATOM 1047 N PHE A 501 -3.282 -8.175 -3.826 1.00 63.04 N ATOM 1048 CA PHE A 501 -3.313 -7.926 -5.271 1.00 31.42 C ATOM 1049 C PHE A 501 -2.282 -8.797 -6.002 1.00 72.52 C ATOM 1050 O PHE A 501 -1.255 -9.177 -5.433 1.00 2.11 O ATOM 1051 CB PHE A 501 -3.071 -6.437 -5.576 1.00 74.42 C ATOM 1052 CG PHE A 501 -1.710 -5.923 -5.169 1.00 4.22 C ATOM 1053 CD1 PHE A 501 -1.452 -5.563 -3.854 1.00 44.12 C ATOM 1054 CD2 PHE A 501 -0.693 -5.789 -6.106 1.00 42.12 C ATOM 1055 CE1 PHE A 501 -0.213 -5.077 -3.483 1.00 22.41 C ATOM 1056 CE2 PHE A 501 0.549 -5.307 -5.739 1.00 42.24 C ATOM 1057 CZ PHE A 501 0.789 -4.950 -4.427 1.00 2.32 C ATOM 0 H PHE A 501 -2.355 -8.385 -3.457 1.00 63.04 H new ATOM 0 HA PHE A 501 -4.305 -8.195 -5.634 1.00 31.42 H new ATOM 0 HB2 PHE A 501 -3.201 -6.273 -6.646 1.00 74.42 H new ATOM 0 HB3 PHE A 501 -3.834 -5.847 -5.068 1.00 74.42 H new ATOM 0 HD1 PHE A 501 -2.229 -5.664 -3.111 1.00 44.12 H new ATOM 0 HD2 PHE A 501 -0.875 -6.065 -7.134 1.00 42.12 H new ATOM 0 HE1 PHE A 501 -0.027 -4.797 -2.457 1.00 22.41 H new ATOM 0 HE2 PHE A 501 1.331 -5.210 -6.478 1.00 42.24 H new ATOM 0 HZ PHE A 501 1.759 -4.572 -4.138 1.00 2.32 H new ATOM 1067 N SER A 502 -2.570 -9.120 -7.261 1.00 21.21 N ATOM 1068 CA SER A 502 -1.680 -9.955 -8.079 1.00 51.41 C ATOM 1069 C SER A 502 -1.047 -9.145 -9.218 1.00 22.51 C ATOM 1070 O SER A 502 -1.702 -8.292 -9.822 1.00 4.32 O ATOM 1071 CB SER A 502 -2.452 -11.147 -8.654 1.00 53.43 C ATOM 1072 OG SER A 502 -3.557 -10.717 -9.433 1.00 24.14 O ATOM 0 H SER A 502 -3.416 -8.816 -7.743 1.00 21.21 H new ATOM 0 HA SER A 502 -0.880 -10.320 -7.435 1.00 51.41 H new ATOM 0 HB2 SER A 502 -1.785 -11.753 -9.268 1.00 53.43 H new ATOM 0 HB3 SER A 502 -2.803 -11.783 -7.841 1.00 53.43 H new ATOM 0 HG SER A 502 -4.030 -11.498 -9.789 1.00 24.14 H new ATOM 1078 N TRP A 503 0.224 -9.420 -9.501 1.00 1.54 N ATOM 1079 CA TRP A 503 0.975 -8.708 -10.542 1.00 63.32 C ATOM 1080 C TRP A 503 1.859 -9.676 -11.347 1.00 54.14 C ATOM 1081 O TRP A 503 2.490 -10.572 -10.781 1.00 21.32 O ATOM 1082 CB TRP A 503 1.834 -7.604 -9.902 1.00 41.32 C ATOM 1083 CG TRP A 503 2.718 -6.872 -10.873 1.00 11.54 C ATOM 1084 CD1 TRP A 503 2.342 -6.287 -12.048 1.00 74.35 C ATOM 1085 CD2 TRP A 503 4.124 -6.637 -10.740 1.00 23.53 C ATOM 1086 NE1 TRP A 503 3.429 -5.714 -12.659 1.00 70.42 N ATOM 1087 CE2 TRP A 503 4.535 -5.912 -11.875 1.00 42.33 C ATOM 1088 CE3 TRP A 503 5.076 -6.970 -9.772 1.00 20.14 C ATOM 1089 CZ2 TRP A 503 5.855 -5.514 -12.067 1.00 30.43 C ATOM 1090 CZ3 TRP A 503 6.388 -6.577 -9.964 1.00 52.11 C ATOM 1091 CH2 TRP A 503 6.766 -5.854 -11.103 1.00 31.32 C ATOM 0 H TRP A 503 0.764 -10.139 -9.020 1.00 1.54 H new ATOM 0 HA TRP A 503 0.263 -8.254 -11.231 1.00 63.32 H new ATOM 0 HB2 TRP A 503 1.177 -6.885 -9.413 1.00 41.32 H new ATOM 0 HB3 TRP A 503 2.456 -8.048 -9.125 1.00 41.32 H new ATOM 0 HD1 TRP A 503 1.336 -6.277 -12.440 1.00 74.35 H new ATOM 0 HE1 TRP A 503 3.416 -5.221 -13.552 1.00 70.42 H new ATOM 0 HE3 TRP A 503 4.792 -7.524 -8.890 1.00 20.14 H new ATOM 0 HZ2 TRP A 503 6.150 -4.957 -12.944 1.00 30.43 H new ATOM 0 HZ3 TRP A 503 7.133 -6.831 -9.224 1.00 52.11 H new ATOM 0 HH2 TRP A 503 7.798 -5.559 -11.223 1.00 31.32 H new ATOM 1102 N THR A 504 1.886 -9.504 -12.668 1.00 61.15 N ATOM 1103 CA THR A 504 2.708 -10.349 -13.547 1.00 13.21 C ATOM 1104 C THR A 504 3.762 -9.517 -14.294 1.00 44.23 C ATOM 1105 O THR A 504 3.455 -8.857 -15.289 1.00 22.42 O ATOM 1106 CB THR A 504 1.836 -11.109 -14.580 1.00 1.44 C ATOM 1107 OG1 THR A 504 0.859 -11.916 -13.901 1.00 74.14 O ATOM 1108 CG2 THR A 504 2.690 -12.002 -15.479 1.00 53.43 C ATOM 0 H THR A 504 1.349 -8.788 -13.158 1.00 61.15 H new ATOM 0 HA THR A 504 3.211 -11.073 -12.906 1.00 13.21 H new ATOM 0 HB THR A 504 1.336 -10.367 -15.203 1.00 1.44 H new ATOM 0 HG1 THR A 504 0.312 -12.391 -14.561 1.00 74.14 H new ATOM 0 HG21 THR A 504 2.049 -12.521 -16.192 1.00 53.43 H new ATOM 0 HG22 THR A 504 3.412 -11.390 -16.019 1.00 53.43 H new ATOM 0 HG23 THR A 504 3.219 -12.733 -14.868 1.00 53.43 H new ATOM 1116 N PRO A 505 5.024 -9.528 -13.822 1.00 71.00 N ATOM 1117 CA PRO A 505 6.121 -8.803 -14.481 1.00 42.45 C ATOM 1118 C PRO A 505 6.657 -9.533 -15.725 1.00 64.13 C ATOM 1119 O PRO A 505 7.399 -10.507 -15.618 1.00 45.55 O ATOM 1120 CB PRO A 505 7.189 -8.732 -13.385 1.00 70.45 C ATOM 1121 CG PRO A 505 6.965 -9.960 -12.564 1.00 13.32 C ATOM 1122 CD PRO A 505 5.478 -10.227 -12.599 1.00 60.04 C ATOM 0 HA PRO A 505 5.804 -7.830 -14.856 1.00 42.45 H new ATOM 0 HB2 PRO A 505 8.193 -8.716 -13.809 1.00 70.45 H new ATOM 0 HB3 PRO A 505 7.082 -7.828 -12.785 1.00 70.45 H new ATOM 0 HG2 PRO A 505 7.522 -10.805 -12.969 1.00 13.32 H new ATOM 0 HG3 PRO A 505 7.310 -9.812 -11.541 1.00 13.32 H new ATOM 0 HD2 PRO A 505 5.264 -11.295 -12.645 1.00 60.04 H new ATOM 0 HD3 PRO A 505 4.981 -9.841 -11.709 1.00 60.04 H new ATOM 1130 N THR A 506 6.276 -9.061 -16.909 1.00 74.55 N ATOM 1131 CA THR A 506 6.703 -9.691 -18.170 1.00 31.25 C ATOM 1132 C THR A 506 8.115 -9.247 -18.592 1.00 2.22 C ATOM 1133 O THR A 506 8.643 -9.708 -19.606 1.00 23.42 O ATOM 1134 CB THR A 506 5.716 -9.380 -19.320 1.00 74.11 C ATOM 1135 OG1 THR A 506 5.659 -7.962 -19.550 1.00 53.51 O ATOM 1136 CG2 THR A 506 4.316 -9.906 -19.001 1.00 3.31 C ATOM 0 H THR A 506 5.674 -8.247 -17.029 1.00 74.55 H new ATOM 0 HA THR A 506 6.715 -10.764 -17.981 1.00 31.25 H new ATOM 0 HB THR A 506 6.076 -9.881 -20.219 1.00 74.11 H new ATOM 0 HG1 THR A 506 5.033 -7.774 -20.281 1.00 53.51 H new ATOM 0 HG21 THR A 506 3.643 -9.673 -19.826 1.00 3.31 H new ATOM 0 HG22 THR A 506 4.357 -10.986 -18.859 1.00 3.31 H new ATOM 0 HG23 THR A 506 3.949 -9.434 -18.090 1.00 3.31 H new ATOM 1144 N GLN A 507 8.731 -8.364 -17.803 1.00 0.35 N ATOM 1145 CA GLN A 507 10.088 -7.877 -18.093 1.00 31.12 C ATOM 1146 C GLN A 507 10.947 -7.818 -16.815 1.00 50.35 C ATOM 1147 O GLN A 507 10.441 -7.526 -15.729 1.00 50.25 O ATOM 1148 CB GLN A 507 10.027 -6.491 -18.759 1.00 34.41 C ATOM 1149 CG GLN A 507 11.378 -5.989 -19.259 1.00 74.30 C ATOM 1150 CD GLN A 507 12.010 -6.923 -20.280 1.00 15.10 C ATOM 1151 OE1 GLN A 507 12.738 -7.847 -19.929 1.00 61.23 O ATOM 1152 NE2 GLN A 507 11.719 -6.708 -21.548 1.00 71.51 N ATOM 0 H GLN A 507 8.315 -7.970 -16.959 1.00 0.35 H new ATOM 0 HA GLN A 507 10.557 -8.581 -18.781 1.00 31.12 H new ATOM 0 HB2 GLN A 507 9.332 -6.531 -19.597 1.00 34.41 H new ATOM 0 HB3 GLN A 507 9.624 -5.772 -18.045 1.00 34.41 H new ATOM 0 HG2 GLN A 507 11.252 -5.002 -19.704 1.00 74.30 H new ATOM 0 HG3 GLN A 507 12.054 -5.873 -18.412 1.00 74.30 H new ATOM 0 HE21 GLN A 507 11.111 -5.931 -21.807 1.00 71.51 H new ATOM 0 HE22 GLN A 507 12.102 -7.318 -22.270 1.00 71.51 H new ATOM 1161 N GLU A 508 12.247 -8.091 -16.957 1.00 52.13 N ATOM 1162 CA GLU A 508 13.177 -8.125 -15.816 1.00 11.22 C ATOM 1163 C GLU A 508 13.692 -6.725 -15.433 1.00 52.32 C ATOM 1164 O GLU A 508 13.744 -5.820 -16.264 1.00 34.51 O ATOM 1165 CB GLU A 508 14.351 -9.083 -16.110 1.00 22.23 C ATOM 1166 CG GLU A 508 15.110 -8.814 -17.416 1.00 32.21 C ATOM 1167 CD GLU A 508 16.163 -7.718 -17.309 1.00 3.00 C ATOM 1168 OE1 GLU A 508 17.175 -7.927 -16.602 1.00 24.23 O ATOM 1169 OE2 GLU A 508 16.005 -6.663 -17.956 1.00 15.31 O ATOM 0 H GLU A 508 12.685 -8.293 -17.856 1.00 52.13 H new ATOM 0 HA GLU A 508 12.621 -8.499 -14.956 1.00 11.22 H new ATOM 0 HB2 GLU A 508 15.057 -9.029 -15.282 1.00 22.23 H new ATOM 0 HB3 GLU A 508 13.967 -10.103 -16.136 1.00 22.23 H new ATOM 0 HG2 GLU A 508 15.592 -9.736 -17.740 1.00 32.21 H new ATOM 0 HG3 GLU A 508 14.393 -8.540 -18.190 1.00 32.21 H new ATOM 1176 N GLY A 509 14.036 -6.545 -14.155 1.00 53.22 N ATOM 1177 CA GLY A 509 14.571 -5.265 -13.691 1.00 50.11 C ATOM 1178 C GLY A 509 14.278 -4.974 -12.219 1.00 33.33 C ATOM 1179 O GLY A 509 13.708 -5.808 -11.509 1.00 21.41 O ATOM 0 H GLY A 509 13.955 -7.260 -13.432 1.00 53.22 H new ATOM 0 HA2 GLY A 509 15.650 -5.254 -13.847 1.00 50.11 H new ATOM 0 HA3 GLY A 509 14.153 -4.464 -14.301 1.00 50.11 H new ATOM 1183 N MET A 510 14.677 -3.786 -11.763 1.00 13.22 N ATOM 1184 CA MET A 510 14.429 -3.345 -10.383 1.00 31.22 C ATOM 1185 C MET A 510 13.114 -2.548 -10.295 1.00 72.43 C ATOM 1186 O MET A 510 13.041 -1.397 -10.740 1.00 34.34 O ATOM 1187 CB MET A 510 15.607 -2.480 -9.898 1.00 25.13 C ATOM 1188 CG MET A 510 15.476 -1.935 -8.474 1.00 22.24 C ATOM 1189 SD MET A 510 16.097 -3.059 -7.197 1.00 1.33 S ATOM 1190 CE MET A 510 14.839 -4.332 -7.160 1.00 21.11 C ATOM 0 H MET A 510 15.178 -3.104 -12.332 1.00 13.22 H new ATOM 0 HA MET A 510 14.339 -4.223 -9.744 1.00 31.22 H new ATOM 0 HB2 MET A 510 16.520 -3.072 -9.960 1.00 25.13 H new ATOM 0 HB3 MET A 510 15.725 -1.639 -10.582 1.00 25.13 H new ATOM 0 HG2 MET A 510 16.016 -0.990 -8.406 1.00 22.24 H new ATOM 0 HG3 MET A 510 14.427 -1.718 -8.274 1.00 22.24 H new ATOM 0 HE1 MET A 510 14.764 -4.740 -6.152 1.00 21.11 H new ATOM 0 HE2 MET A 510 13.880 -3.904 -7.451 1.00 21.11 H new ATOM 0 HE3 MET A 510 15.106 -5.128 -7.855 1.00 21.11 H new ATOM 1200 N TYR A 511 12.075 -3.161 -9.727 1.00 71.02 N ATOM 1201 CA TYR A 511 10.757 -2.523 -9.622 1.00 3.34 C ATOM 1202 C TYR A 511 10.440 -2.104 -8.180 1.00 13.02 C ATOM 1203 O TYR A 511 10.433 -2.925 -7.266 1.00 63.13 O ATOM 1204 CB TYR A 511 9.669 -3.469 -10.142 1.00 3.03 C ATOM 1205 CG TYR A 511 9.784 -3.767 -11.628 1.00 41.43 C ATOM 1206 CD1 TYR A 511 10.626 -4.772 -12.095 1.00 2.31 C ATOM 1207 CD2 TYR A 511 9.051 -3.043 -12.562 1.00 61.41 C ATOM 1208 CE1 TYR A 511 10.732 -5.043 -13.445 1.00 44.34 C ATOM 1209 CE2 TYR A 511 9.153 -3.310 -13.914 1.00 14.41 C ATOM 1210 CZ TYR A 511 9.994 -4.310 -14.349 1.00 72.32 C ATOM 1211 OH TYR A 511 10.098 -4.578 -15.694 1.00 31.31 O ATOM 0 H TYR A 511 12.118 -4.100 -9.331 1.00 71.02 H new ATOM 0 HA TYR A 511 10.779 -1.621 -10.234 1.00 3.34 H new ATOM 0 HB2 TYR A 511 9.718 -4.406 -9.587 1.00 3.03 H new ATOM 0 HB3 TYR A 511 8.691 -3.030 -9.942 1.00 3.03 H new ATOM 0 HD1 TYR A 511 11.206 -5.349 -11.390 1.00 2.31 H new ATOM 0 HD2 TYR A 511 8.390 -2.258 -12.225 1.00 61.41 H new ATOM 0 HE1 TYR A 511 11.390 -5.826 -13.791 1.00 44.34 H new ATOM 0 HE2 TYR A 511 8.576 -2.738 -14.626 1.00 14.41 H new ATOM 0 HH TYR A 511 10.202 -5.543 -15.828 1.00 31.31 H new ATOM 1221 N ARG A 512 10.186 -0.817 -7.987 1.00 41.15 N ATOM 1222 CA ARG A 512 9.825 -0.276 -6.675 1.00 15.35 C ATOM 1223 C ARG A 512 8.299 -0.201 -6.496 1.00 3.35 C ATOM 1224 O ARG A 512 7.621 0.574 -7.173 1.00 62.54 O ATOM 1225 CB ARG A 512 10.455 1.116 -6.501 1.00 74.14 C ATOM 1226 CG ARG A 512 9.933 1.903 -5.300 1.00 33.12 C ATOM 1227 CD ARG A 512 10.183 1.189 -3.975 1.00 34.35 C ATOM 1228 NE ARG A 512 11.607 0.995 -3.708 1.00 63.11 N ATOM 1229 CZ ARG A 512 12.411 1.934 -3.290 1.00 41.33 C ATOM 1230 NH1 ARG A 512 11.986 3.143 -3.101 1.00 43.41 N ATOM 1231 NH2 ARG A 512 13.648 1.656 -3.064 1.00 11.34 N ATOM 0 H ARG A 512 10.223 -0.118 -8.729 1.00 41.15 H new ATOM 0 HA ARG A 512 10.211 -0.948 -5.909 1.00 15.35 H new ATOM 0 HB2 ARG A 512 11.535 1.002 -6.403 1.00 74.14 H new ATOM 0 HB3 ARG A 512 10.276 1.697 -7.406 1.00 74.14 H new ATOM 0 HG2 ARG A 512 10.412 2.882 -5.276 1.00 33.12 H new ATOM 0 HG3 ARG A 512 8.863 2.074 -5.420 1.00 33.12 H new ATOM 0 HD2 ARG A 512 9.739 1.767 -3.164 1.00 34.35 H new ATOM 0 HD3 ARG A 512 9.683 0.221 -3.987 1.00 34.35 H new ATOM 0 HE ARG A 512 11.998 0.065 -3.858 1.00 63.11 H new ATOM 0 HH11 ARG A 512 11.009 3.374 -3.279 1.00 43.41 H new ATOM 0 HH12 ARG A 512 12.629 3.864 -2.774 1.00 43.41 H new ATOM 0 HH21 ARG A 512 13.993 0.708 -3.212 1.00 11.34 H new ATOM 0 HH22 ARG A 512 14.283 2.384 -2.737 1.00 11.34 H new ATOM 1245 N ILE A 513 7.768 -1.014 -5.586 1.00 34.34 N ATOM 1246 CA ILE A 513 6.341 -0.981 -5.256 1.00 74.30 C ATOM 1247 C ILE A 513 6.094 -0.166 -3.978 1.00 61.54 C ATOM 1248 O ILE A 513 6.718 -0.403 -2.942 1.00 43.52 O ATOM 1249 CB ILE A 513 5.753 -2.409 -5.080 1.00 11.12 C ATOM 1250 CG1 ILE A 513 5.838 -3.186 -6.405 1.00 54.42 C ATOM 1251 CG2 ILE A 513 4.306 -2.342 -4.583 1.00 33.32 C ATOM 1252 CD1 ILE A 513 5.186 -4.554 -6.361 1.00 53.42 C ATOM 0 H ILE A 513 8.304 -1.706 -5.062 1.00 34.34 H new ATOM 0 HA ILE A 513 5.835 -0.503 -6.095 1.00 74.30 H new ATOM 0 HB ILE A 513 6.343 -2.937 -4.330 1.00 11.12 H new ATOM 0 HG12 ILE A 513 5.367 -2.596 -7.191 1.00 54.42 H new ATOM 0 HG13 ILE A 513 6.886 -3.303 -6.679 1.00 54.42 H new ATOM 0 HG21 ILE A 513 3.914 -3.352 -4.467 1.00 33.32 H new ATOM 0 HG22 ILE A 513 4.275 -1.828 -3.622 1.00 33.32 H new ATOM 0 HG23 ILE A 513 3.698 -1.798 -5.306 1.00 33.32 H new ATOM 0 HD11 ILE A 513 5.289 -5.037 -7.333 1.00 53.42 H new ATOM 0 HD12 ILE A 513 5.671 -5.164 -5.599 1.00 53.42 H new ATOM 0 HD13 ILE A 513 4.129 -4.446 -6.120 1.00 53.42 H new ATOM 1264 N ASN A 514 5.190 0.804 -4.063 1.00 3.10 N ATOM 1265 CA ASN A 514 4.830 1.636 -2.912 1.00 61.31 C ATOM 1266 C ASN A 514 3.326 1.593 -2.636 1.00 72.30 C ATOM 1267 O ASN A 514 2.515 1.647 -3.561 1.00 53.33 O ATOM 1268 CB ASN A 514 5.251 3.090 -3.144 1.00 1.24 C ATOM 1269 CG ASN A 514 6.753 3.255 -3.230 1.00 3.52 C ATOM 1270 OD1 ASN A 514 7.335 3.217 -4.308 1.00 72.30 O ATOM 1271 ND2 ASN A 514 7.392 3.422 -2.093 1.00 2.32 N ATOM 0 H ASN A 514 4.689 1.037 -4.920 1.00 3.10 H new ATOM 0 HA ASN A 514 5.358 1.232 -2.048 1.00 61.31 H new ATOM 0 HB2 ASN A 514 4.796 3.453 -4.065 1.00 1.24 H new ATOM 0 HB3 ASN A 514 4.867 3.709 -2.333 1.00 1.24 H new ATOM 0 HD21 ASN A 514 8.407 3.525 -2.089 1.00 2.32 H new ATOM 0 HD22 ASN A 514 6.873 3.448 -1.215 1.00 2.32 H new ATOM 1278 N ALA A 515 2.965 1.506 -1.361 1.00 4.10 N ATOM 1279 CA ALA A 515 1.565 1.602 -0.945 1.00 75.15 C ATOM 1280 C ALA A 515 1.345 2.895 -0.158 1.00 12.04 C ATOM 1281 O ALA A 515 2.123 3.227 0.739 1.00 32.30 O ATOM 1282 CB ALA A 515 1.165 0.393 -0.106 1.00 33.34 C ATOM 0 H ALA A 515 3.622 1.369 -0.593 1.00 4.10 H new ATOM 0 HA ALA A 515 0.937 1.617 -1.836 1.00 75.15 H new ATOM 0 HB1 ALA A 515 0.121 0.486 0.192 1.00 33.34 H new ATOM 0 HB2 ALA A 515 1.295 -0.516 -0.693 1.00 33.34 H new ATOM 0 HB3 ALA A 515 1.793 0.344 0.784 1.00 33.34 H new ATOM 1288 N THR A 516 0.297 3.622 -0.505 1.00 1.20 N ATOM 1289 CA THR A 516 -0.007 4.906 0.137 1.00 75.51 C ATOM 1290 C THR A 516 -1.481 5.001 0.529 1.00 40.40 C ATOM 1291 O THR A 516 -2.360 4.544 -0.202 1.00 40.22 O ATOM 1292 CB THR A 516 0.331 6.090 -0.803 1.00 41.03 C ATOM 1293 OG1 THR A 516 -0.316 5.914 -2.072 1.00 73.11 O ATOM 1294 CG2 THR A 516 1.836 6.221 -1.018 1.00 32.25 C ATOM 0 H THR A 516 -0.366 3.350 -1.231 1.00 1.20 H new ATOM 0 HA THR A 516 0.608 4.961 1.035 1.00 75.51 H new ATOM 0 HB THR A 516 -0.030 7.002 -0.327 1.00 41.03 H new ATOM 0 HG1 THR A 516 0.328 5.561 -2.721 1.00 73.11 H new ATOM 0 HG21 THR A 516 2.037 7.061 -1.682 1.00 32.25 H new ATOM 0 HG22 THR A 516 2.327 6.390 -0.060 1.00 32.25 H new ATOM 0 HG23 THR A 516 2.221 5.305 -1.466 1.00 32.25 H new ATOM 1302 N VAL A 517 -1.752 5.590 1.691 1.00 51.54 N ATOM 1303 CA VAL A 517 -3.132 5.822 2.128 1.00 3.41 C ATOM 1304 C VAL A 517 -3.470 7.324 2.110 1.00 55.50 C ATOM 1305 O VAL A 517 -2.646 8.160 2.485 1.00 72.24 O ATOM 1306 CB VAL A 517 -3.392 5.227 3.537 1.00 21.51 C ATOM 1307 CG1 VAL A 517 -2.413 5.790 4.563 1.00 64.32 C ATOM 1308 CG2 VAL A 517 -4.838 5.459 3.969 1.00 71.44 C ATOM 0 H VAL A 517 -1.041 5.915 2.346 1.00 51.54 H new ATOM 0 HA VAL A 517 -3.786 5.310 1.422 1.00 3.41 H new ATOM 0 HB VAL A 517 -3.228 4.151 3.481 1.00 21.51 H new ATOM 0 HG11 VAL A 517 -2.620 5.355 5.541 1.00 64.32 H new ATOM 0 HG12 VAL A 517 -1.393 5.545 4.265 1.00 64.32 H new ATOM 0 HG13 VAL A 517 -2.525 6.873 4.617 1.00 64.32 H new ATOM 0 HG21 VAL A 517 -4.995 5.033 4.960 1.00 71.44 H new ATOM 0 HG22 VAL A 517 -5.042 6.529 3.998 1.00 71.44 H new ATOM 0 HG23 VAL A 517 -5.511 4.981 3.258 1.00 71.44 H new ATOM 1318 N ASP A 518 -4.692 7.643 1.671 1.00 62.11 N ATOM 1319 CA ASP A 518 -5.143 9.031 1.477 1.00 12.22 C ATOM 1320 C ASP A 518 -4.065 9.886 0.779 1.00 52.11 C ATOM 1321 O ASP A 518 -3.468 10.786 1.377 1.00 22.52 O ATOM 1322 CB ASP A 518 -5.582 9.679 2.806 1.00 22.03 C ATOM 1323 CG ASP A 518 -6.390 10.960 2.593 1.00 23.35 C ATOM 1324 OD1 ASP A 518 -6.538 11.398 1.429 1.00 43.14 O ATOM 1325 OD2 ASP A 518 -6.883 11.536 3.583 1.00 21.01 O ATOM 0 H ASP A 518 -5.400 6.947 1.439 1.00 62.11 H new ATOM 0 HA ASP A 518 -6.014 8.993 0.823 1.00 12.22 H new ATOM 0 HB2 ASP A 518 -6.180 8.966 3.374 1.00 22.03 H new ATOM 0 HB3 ASP A 518 -4.700 9.905 3.405 1.00 22.03 H new ATOM 1330 N GLU A 519 -3.809 9.574 -0.488 1.00 32.21 N ATOM 1331 CA GLU A 519 -2.867 10.340 -1.317 1.00 61.21 C ATOM 1332 C GLU A 519 -3.227 11.831 -1.379 1.00 33.33 C ATOM 1333 O GLU A 519 -2.354 12.689 -1.517 1.00 70.12 O ATOM 1334 CB GLU A 519 -2.818 9.752 -2.734 1.00 15.02 C ATOM 1335 CG GLU A 519 -1.867 8.574 -2.880 1.00 71.34 C ATOM 1336 CD GLU A 519 -0.412 9.013 -2.844 1.00 72.05 C ATOM 1337 OE1 GLU A 519 0.160 9.123 -1.743 1.00 43.13 O ATOM 1338 OE2 GLU A 519 0.157 9.272 -3.924 1.00 52.41 O ATOM 0 H GLU A 519 -4.243 8.788 -0.973 1.00 32.21 H new ATOM 0 HA GLU A 519 -1.885 10.262 -0.851 1.00 61.21 H new ATOM 0 HB2 GLU A 519 -3.821 9.434 -3.020 1.00 15.02 H new ATOM 0 HB3 GLU A 519 -2.521 10.535 -3.432 1.00 15.02 H new ATOM 0 HG2 GLU A 519 -2.050 7.858 -2.079 1.00 71.34 H new ATOM 0 HG3 GLU A 519 -2.068 8.059 -3.820 1.00 71.34 H new ATOM 1345 N GLU A 520 -4.518 12.127 -1.305 1.00 11.14 N ATOM 1346 CA GLU A 520 -5.005 13.505 -1.390 1.00 22.01 C ATOM 1347 C GLU A 520 -4.809 14.255 -0.063 1.00 33.44 C ATOM 1348 O GLU A 520 -4.827 15.490 -0.030 1.00 21.32 O ATOM 1349 CB GLU A 520 -6.489 13.502 -1.774 1.00 14.42 C ATOM 1350 CG GLU A 520 -6.834 12.537 -2.905 1.00 61.25 C ATOM 1351 CD GLU A 520 -6.029 12.786 -4.172 1.00 72.24 C ATOM 1352 OE1 GLU A 520 -6.365 13.731 -4.914 1.00 33.40 O ATOM 1353 OE2 GLU A 520 -5.064 12.035 -4.436 1.00 31.12 O ATOM 0 H GLU A 520 -5.253 11.430 -1.186 1.00 11.14 H new ATOM 0 HA GLU A 520 -4.426 14.024 -2.154 1.00 22.01 H new ATOM 0 HB2 GLU A 520 -7.081 13.243 -0.896 1.00 14.42 H new ATOM 0 HB3 GLU A 520 -6.780 14.510 -2.069 1.00 14.42 H new ATOM 0 HG2 GLU A 520 -6.661 11.515 -2.567 1.00 61.25 H new ATOM 0 HG3 GLU A 520 -7.896 12.621 -3.135 1.00 61.25 H new ATOM 1360 N ASN A 521 -4.630 13.499 1.024 1.00 22.51 N ATOM 1361 CA ASN A 521 -4.467 14.069 2.368 1.00 50.04 C ATOM 1362 C ASN A 521 -5.735 14.847 2.768 1.00 73.15 C ATOM 1363 O ASN A 521 -5.675 15.973 3.264 1.00 51.13 O ATOM 1364 CB ASN A 521 -3.210 14.963 2.415 1.00 53.14 C ATOM 1365 CG ASN A 521 -2.783 15.328 3.828 1.00 2.23 C ATOM 1366 OD1 ASN A 521 -3.174 16.355 4.365 1.00 22.44 O ATOM 1367 ND2 ASN A 521 -1.974 14.488 4.442 1.00 53.00 N ATOM 0 H ASN A 521 -4.594 12.480 1.000 1.00 22.51 H new ATOM 0 HA ASN A 521 -4.329 13.264 3.090 1.00 50.04 H new ATOM 0 HB2 ASN A 521 -2.388 14.449 1.916 1.00 53.14 H new ATOM 0 HB3 ASN A 521 -3.402 15.877 1.853 1.00 53.14 H new ATOM 0 HD21 ASN A 521 -1.657 14.687 5.391 1.00 53.00 H new ATOM 0 HD22 ASN A 521 -1.665 13.639 3.968 1.00 53.00 H new ATOM 1374 N THR A 522 -6.888 14.220 2.540 1.00 73.35 N ATOM 1375 CA THR A 522 -8.191 14.846 2.814 1.00 54.22 C ATOM 1376 C THR A 522 -8.415 15.047 4.316 1.00 72.53 C ATOM 1377 O THR A 522 -8.985 16.052 4.745 1.00 60.30 O ATOM 1378 CB THR A 522 -9.362 14.005 2.247 1.00 42.41 C ATOM 1379 OG1 THR A 522 -9.452 12.744 2.930 1.00 1.24 O ATOM 1380 CG2 THR A 522 -9.189 13.758 0.753 1.00 33.22 C ATOM 0 H THR A 522 -6.951 13.274 2.164 1.00 73.35 H new ATOM 0 HA THR A 522 -8.172 15.816 2.318 1.00 54.22 H new ATOM 0 HB THR A 522 -10.280 14.570 2.405 1.00 42.41 H new ATOM 0 HG1 THR A 522 -8.551 12.397 3.097 1.00 1.24 H new ATOM 0 HG21 THR A 522 -10.026 13.165 0.383 1.00 33.22 H new ATOM 0 HG22 THR A 522 -9.160 14.712 0.227 1.00 33.22 H new ATOM 0 HG23 THR A 522 -8.258 13.219 0.579 1.00 33.22 H new ATOM 1388 N VAL A 523 -7.966 14.082 5.107 1.00 54.12 N ATOM 1389 CA VAL A 523 -8.096 14.146 6.564 1.00 32.24 C ATOM 1390 C VAL A 523 -6.759 14.545 7.221 1.00 74.45 C ATOM 1391 O VAL A 523 -5.684 14.182 6.741 1.00 51.05 O ATOM 1392 CB VAL A 523 -8.604 12.799 7.141 1.00 51.41 C ATOM 1393 CG1 VAL A 523 -7.567 11.688 6.973 1.00 44.45 C ATOM 1394 CG2 VAL A 523 -9.017 12.960 8.600 1.00 63.11 C ATOM 0 H VAL A 523 -7.505 13.239 4.765 1.00 54.12 H new ATOM 0 HA VAL A 523 -8.834 14.914 6.796 1.00 32.24 H new ATOM 0 HB VAL A 523 -9.485 12.502 6.572 1.00 51.41 H new ATOM 0 HG11 VAL A 523 -7.958 10.759 7.389 1.00 44.45 H new ATOM 0 HG12 VAL A 523 -7.351 11.549 5.914 1.00 44.45 H new ATOM 0 HG13 VAL A 523 -6.651 11.963 7.497 1.00 44.45 H new ATOM 0 HG21 VAL A 523 -9.370 12.004 8.986 1.00 63.11 H new ATOM 0 HG22 VAL A 523 -8.161 13.294 9.186 1.00 63.11 H new ATOM 0 HG23 VAL A 523 -9.816 13.698 8.673 1.00 63.11 H new ATOM 1404 N VAL A 524 -6.828 15.326 8.299 1.00 74.13 N ATOM 1405 CA VAL A 524 -5.617 15.809 8.974 1.00 61.41 C ATOM 1406 C VAL A 524 -5.051 14.743 9.926 1.00 62.44 C ATOM 1407 O VAL A 524 -5.680 14.383 10.919 1.00 72.02 O ATOM 1408 CB VAL A 524 -5.896 17.111 9.769 1.00 30.34 C ATOM 1409 CG1 VAL A 524 -4.624 17.617 10.450 1.00 64.14 C ATOM 1410 CG2 VAL A 524 -6.494 18.187 8.861 1.00 63.53 C ATOM 0 H VAL A 524 -7.702 15.638 8.723 1.00 74.13 H new ATOM 0 HA VAL A 524 -4.882 16.020 8.198 1.00 61.41 H new ATOM 0 HB VAL A 524 -6.626 16.882 10.546 1.00 30.34 H new ATOM 0 HG11 VAL A 524 -4.845 18.531 11.001 1.00 64.14 H new ATOM 0 HG12 VAL A 524 -4.254 16.858 11.139 1.00 64.14 H new ATOM 0 HG13 VAL A 524 -3.865 17.823 9.696 1.00 64.14 H new ATOM 0 HG21 VAL A 524 -6.681 19.090 9.442 1.00 63.53 H new ATOM 0 HG22 VAL A 524 -5.796 18.412 8.055 1.00 63.53 H new ATOM 0 HG23 VAL A 524 -7.432 17.827 8.439 1.00 63.53 H new ATOM 1420 N GLU A 525 -3.848 14.266 9.615 1.00 63.42 N ATOM 1421 CA GLU A 525 -3.224 13.154 10.344 1.00 70.42 C ATOM 1422 C GLU A 525 -2.343 13.639 11.505 1.00 43.51 C ATOM 1423 O GLU A 525 -1.840 14.768 11.493 1.00 73.01 O ATOM 1424 CB GLU A 525 -2.361 12.343 9.367 1.00 20.33 C ATOM 1425 CG GLU A 525 -3.127 11.797 8.164 1.00 73.22 C ATOM 1426 CD GLU A 525 -4.004 10.606 8.513 1.00 21.31 C ATOM 1427 OE1 GLU A 525 -5.110 10.809 9.058 1.00 72.23 O ATOM 1428 OE2 GLU A 525 -3.578 9.463 8.250 1.00 1.32 O ATOM 0 H GLU A 525 -3.277 14.635 8.855 1.00 63.42 H new ATOM 0 HA GLU A 525 -4.022 12.543 10.767 1.00 70.42 H new ATOM 0 HB2 GLU A 525 -1.546 12.973 9.010 1.00 20.33 H new ATOM 0 HB3 GLU A 525 -1.908 11.510 9.904 1.00 20.33 H new ATOM 0 HG2 GLU A 525 -3.748 12.589 7.745 1.00 73.22 H new ATOM 0 HG3 GLU A 525 -2.417 11.505 7.390 1.00 73.22 H new ATOM 1435 N LEU A 526 -2.142 12.772 12.500 1.00 11.44 N ATOM 1436 CA LEU A 526 -1.211 13.054 13.599 1.00 62.42 C ATOM 1437 C LEU A 526 0.239 13.039 13.092 1.00 65.14 C ATOM 1438 O LEU A 526 1.063 13.863 13.493 1.00 73.53 O ATOM 1439 CB LEU A 526 -1.383 12.021 14.729 1.00 53.54 C ATOM 1440 CG LEU A 526 -2.747 12.037 15.440 1.00 4.22 C ATOM 1441 CD1 LEU A 526 -2.844 10.892 16.449 1.00 21.33 C ATOM 1442 CD2 LEU A 526 -2.982 13.382 16.130 1.00 44.03 C ATOM 0 H LEU A 526 -2.611 11.869 12.569 1.00 11.44 H new ATOM 0 HA LEU A 526 -1.436 14.046 13.992 1.00 62.42 H new ATOM 0 HB2 LEU A 526 -1.220 11.026 14.315 1.00 53.54 H new ATOM 0 HB3 LEU A 526 -0.604 12.189 15.472 1.00 53.54 H new ATOM 0 HG LEU A 526 -3.524 11.898 14.688 1.00 4.22 H new ATOM 0 HD11 LEU A 526 -3.816 10.922 16.941 1.00 21.33 H new ATOM 0 HD12 LEU A 526 -2.728 9.940 15.931 1.00 21.33 H new ATOM 0 HD13 LEU A 526 -2.057 10.997 17.195 1.00 21.33 H new ATOM 0 HD21 LEU A 526 -3.952 13.372 16.627 1.00 44.03 H new ATOM 0 HD22 LEU A 526 -2.199 13.554 16.868 1.00 44.03 H new ATOM 0 HD23 LEU A 526 -2.963 14.180 15.388 1.00 44.03 H new ATOM 1454 N ASN A 527 0.532 12.095 12.201 1.00 23.41 N ATOM 1455 CA ASN A 527 1.832 12.016 11.529 1.00 42.12 C ATOM 1456 C ASN A 527 1.645 11.787 10.020 1.00 71.20 C ATOM 1457 O ASN A 527 1.198 10.726 9.591 1.00 73.30 O ATOM 1458 CB ASN A 527 2.674 10.892 12.144 1.00 62.32 C ATOM 1459 CG ASN A 527 3.979 10.652 11.405 1.00 3.44 C ATOM 1460 OD1 ASN A 527 4.528 11.545 10.764 1.00 55.31 O ATOM 1461 ND2 ASN A 527 4.489 9.441 11.492 1.00 33.32 N ATOM 0 H ASN A 527 -0.122 11.363 11.923 1.00 23.41 H new ATOM 0 HA ASN A 527 2.356 12.961 11.668 1.00 42.12 H new ATOM 0 HB2 ASN A 527 2.892 11.137 13.184 1.00 62.32 H new ATOM 0 HB3 ASN A 527 2.091 9.971 12.149 1.00 62.32 H new ATOM 0 HD21 ASN A 527 5.366 9.222 11.019 1.00 33.32 H new ATOM 0 HD22 ASN A 527 4.007 8.722 12.033 1.00 33.32 H new ATOM 1468 N GLU A 528 2.023 12.778 9.219 1.00 60.42 N ATOM 1469 CA GLU A 528 1.800 12.734 7.771 1.00 43.45 C ATOM 1470 C GLU A 528 2.910 11.937 7.055 1.00 72.34 C ATOM 1471 O GLU A 528 2.866 11.726 5.843 1.00 25.34 O ATOM 1472 CB GLU A 528 1.727 14.170 7.228 1.00 2.23 C ATOM 1473 CG GLU A 528 1.237 14.278 5.787 1.00 74.12 C ATOM 1474 CD GLU A 528 1.188 15.716 5.299 1.00 2.45 C ATOM 1475 OE1 GLU A 528 0.272 16.457 5.713 1.00 45.43 O ATOM 1476 OE2 GLU A 528 2.073 16.113 4.512 1.00 15.22 O ATOM 0 H GLU A 528 2.487 13.626 9.546 1.00 60.42 H new ATOM 0 HA GLU A 528 0.858 12.222 7.576 1.00 43.45 H new ATOM 0 HB2 GLU A 528 1.065 14.754 7.868 1.00 2.23 H new ATOM 0 HB3 GLU A 528 2.717 14.622 7.297 1.00 2.23 H new ATOM 0 HG2 GLU A 528 1.894 13.699 5.138 1.00 74.12 H new ATOM 0 HG3 GLU A 528 0.243 13.837 5.710 1.00 74.12 H new ATOM 1483 N ASN A 529 3.905 11.488 7.819 1.00 75.43 N ATOM 1484 CA ASN A 529 5.000 10.674 7.276 1.00 23.23 C ATOM 1485 C ASN A 529 4.695 9.171 7.402 1.00 12.11 C ATOM 1486 O ASN A 529 5.475 8.327 6.961 1.00 22.33 O ATOM 1487 CB ASN A 529 6.307 11.004 8.010 1.00 31.34 C ATOM 1488 CG ASN A 529 6.696 12.466 7.874 1.00 25.43 C ATOM 1489 OD1 ASN A 529 7.410 12.848 6.953 1.00 54.41 O ATOM 1490 ND2 ASN A 529 6.232 13.295 8.786 1.00 52.54 N ATOM 0 H ASN A 529 3.978 11.673 8.819 1.00 75.43 H new ATOM 0 HA ASN A 529 5.105 10.910 6.217 1.00 23.23 H new ATOM 0 HB2 ASN A 529 6.200 10.756 9.066 1.00 31.34 H new ATOM 0 HB3 ASN A 529 7.109 10.380 7.616 1.00 31.34 H new ATOM 0 HD21 ASN A 529 6.464 14.287 8.739 1.00 52.54 H new ATOM 0 HD22 ASN A 529 5.640 12.945 9.540 1.00 52.54 H new ATOM 1497 N ASN A 530 3.547 8.849 7.992 1.00 24.21 N ATOM 1498 CA ASN A 530 3.186 7.456 8.295 1.00 4.32 C ATOM 1499 C ASN A 530 2.294 6.836 7.194 1.00 20.23 C ATOM 1500 O ASN A 530 2.025 5.635 7.202 1.00 70.34 O ATOM 1501 CB ASN A 530 2.472 7.417 9.659 1.00 44.53 C ATOM 1502 CG ASN A 530 2.343 6.018 10.231 1.00 61.31 C ATOM 1503 OD1 ASN A 530 3.160 5.142 9.963 1.00 25.21 O ATOM 1504 ND2 ASN A 530 1.326 5.800 11.043 1.00 20.20 N ATOM 0 H ASN A 530 2.844 9.533 8.273 1.00 24.21 H new ATOM 0 HA ASN A 530 4.097 6.859 8.332 1.00 4.32 H new ATOM 0 HB2 ASN A 530 3.019 8.041 10.365 1.00 44.53 H new ATOM 0 HB3 ASN A 530 1.478 7.851 9.553 1.00 44.53 H new ATOM 0 HD21 ASN A 530 1.201 4.882 11.469 1.00 20.20 H new ATOM 0 HD22 ASN A 530 0.665 6.550 11.245 1.00 20.20 H new ATOM 1511 N ASN A 531 1.874 7.659 6.231 1.00 61.54 N ATOM 1512 CA ASN A 531 0.904 7.241 5.202 1.00 71.21 C ATOM 1513 C ASN A 531 1.550 6.498 4.010 1.00 21.34 C ATOM 1514 O ASN A 531 0.858 6.152 3.048 1.00 4.40 O ATOM 1515 CB ASN A 531 0.159 8.476 4.677 1.00 3.13 C ATOM 1516 CG ASN A 531 -0.468 9.295 5.791 1.00 33.11 C ATOM 1517 OD1 ASN A 531 0.163 10.184 6.349 1.00 24.21 O ATOM 1518 ND2 ASN A 531 -1.712 9.008 6.117 1.00 51.25 N ATOM 0 H ASN A 531 2.189 8.625 6.137 1.00 61.54 H new ATOM 0 HA ASN A 531 0.222 6.539 5.682 1.00 71.21 H new ATOM 0 HB2 ASN A 531 0.852 9.103 4.116 1.00 3.13 H new ATOM 0 HB3 ASN A 531 -0.618 8.159 3.982 1.00 3.13 H new ATOM 0 HD21 ASN A 531 -2.180 9.533 6.856 1.00 51.25 H new ATOM 0 HD22 ASN A 531 -2.207 8.261 5.631 1.00 51.25 H new ATOM 1525 N VAL A 532 2.862 6.244 4.066 1.00 1.41 N ATOM 1526 CA VAL A 532 3.585 5.659 2.917 1.00 41.24 C ATOM 1527 C VAL A 532 4.385 4.393 3.295 1.00 2.31 C ATOM 1528 O VAL A 532 4.978 4.312 4.369 1.00 34.11 O ATOM 1529 CB VAL A 532 4.555 6.697 2.284 1.00 60.33 C ATOM 1530 CG1 VAL A 532 5.268 6.117 1.058 1.00 70.12 C ATOM 1531 CG2 VAL A 532 3.812 7.985 1.919 1.00 31.34 C ATOM 0 H VAL A 532 3.445 6.430 4.882 1.00 1.41 H new ATOM 0 HA VAL A 532 2.820 5.373 2.196 1.00 41.24 H new ATOM 0 HB VAL A 532 5.314 6.938 3.028 1.00 60.33 H new ATOM 0 HG11 VAL A 532 5.939 6.867 0.639 1.00 70.12 H new ATOM 0 HG12 VAL A 532 5.844 5.240 1.353 1.00 70.12 H new ATOM 0 HG13 VAL A 532 4.529 5.831 0.309 1.00 70.12 H new ATOM 0 HG21 VAL A 532 4.511 8.696 1.478 1.00 31.34 H new ATOM 0 HG22 VAL A 532 3.023 7.759 1.201 1.00 31.34 H new ATOM 0 HG23 VAL A 532 3.372 8.418 2.817 1.00 31.34 H new ATOM 1541 N ALA A 533 4.401 3.412 2.384 1.00 61.44 N ATOM 1542 CA ALA A 533 5.186 2.178 2.556 1.00 51.55 C ATOM 1543 C ALA A 533 6.064 1.899 1.322 1.00 52.11 C ATOM 1544 O ALA A 533 5.662 2.170 0.188 1.00 71.41 O ATOM 1545 CB ALA A 533 4.270 0.991 2.828 1.00 13.42 C ATOM 0 H ALA A 533 3.874 3.448 1.511 1.00 61.44 H new ATOM 0 HA ALA A 533 5.841 2.320 3.415 1.00 51.55 H new ATOM 0 HB1 ALA A 533 4.870 0.089 2.952 1.00 13.42 H new ATOM 0 HB2 ALA A 533 3.698 1.174 3.737 1.00 13.42 H new ATOM 0 HB3 ALA A 533 3.586 0.859 1.989 1.00 13.42 H new ATOM 1551 N THR A 534 7.263 1.364 1.549 1.00 32.13 N ATOM 1552 CA THR A 534 8.224 1.092 0.461 1.00 70.00 C ATOM 1553 C THR A 534 8.599 -0.400 0.384 1.00 32.41 C ATOM 1554 O THR A 534 8.883 -1.029 1.403 1.00 72.01 O ATOM 1555 CB THR A 534 9.516 1.929 0.648 1.00 32.53 C ATOM 1556 OG1 THR A 534 9.217 3.333 0.547 1.00 44.24 O ATOM 1557 CG2 THR A 534 10.576 1.562 -0.386 1.00 5.21 C ATOM 0 H THR A 534 7.600 1.107 2.477 1.00 32.13 H new ATOM 0 HA THR A 534 7.733 1.374 -0.470 1.00 70.00 H new ATOM 0 HB THR A 534 9.911 1.706 1.639 1.00 32.53 H new ATOM 0 HG1 THR A 534 10.039 3.852 0.668 1.00 44.24 H new ATOM 0 HG21 THR A 534 11.467 2.168 -0.224 1.00 5.21 H new ATOM 0 HG22 THR A 534 10.832 0.507 -0.286 1.00 5.21 H new ATOM 0 HG23 THR A 534 10.187 1.748 -1.387 1.00 5.21 H new ATOM 1565 N PHE A 535 8.596 -0.960 -0.833 1.00 54.41 N ATOM 1566 CA PHE A 535 8.992 -2.362 -1.055 1.00 2.44 C ATOM 1567 C PHE A 535 9.776 -2.515 -2.378 1.00 40.34 C ATOM 1568 O PHE A 535 9.401 -1.938 -3.404 1.00 44.25 O ATOM 1569 CB PHE A 535 7.743 -3.259 -1.074 1.00 71.41 C ATOM 1570 CG PHE A 535 8.040 -4.742 -1.069 1.00 34.13 C ATOM 1571 CD1 PHE A 535 8.212 -5.440 -2.257 1.00 63.11 C ATOM 1572 CD2 PHE A 535 8.141 -5.437 0.128 1.00 74.31 C ATOM 1573 CE1 PHE A 535 8.481 -6.797 -2.249 1.00 42.25 C ATOM 1574 CE2 PHE A 535 8.409 -6.793 0.140 1.00 44.43 C ATOM 1575 CZ PHE A 535 8.577 -7.474 -1.049 1.00 63.03 C ATOM 0 H PHE A 535 8.324 -0.465 -1.682 1.00 54.41 H new ATOM 0 HA PHE A 535 9.645 -2.668 -0.238 1.00 2.44 H new ATOM 0 HB2 PHE A 535 7.126 -3.021 -0.207 1.00 71.41 H new ATOM 0 HB3 PHE A 535 7.153 -3.022 -1.959 1.00 71.41 H new ATOM 0 HD1 PHE A 535 8.135 -4.917 -3.199 1.00 63.11 H new ATOM 0 HD2 PHE A 535 8.008 -4.912 1.062 1.00 74.31 H new ATOM 0 HE1 PHE A 535 8.616 -7.327 -3.181 1.00 42.25 H new ATOM 0 HE2 PHE A 535 8.487 -7.320 1.080 1.00 44.43 H new ATOM 0 HZ PHE A 535 8.783 -8.534 -1.041 1.00 63.03 H new ATOM 1585 N ASP A 536 10.860 -3.293 -2.353 1.00 12.23 N ATOM 1586 CA ASP A 536 11.693 -3.509 -3.548 1.00 55.14 C ATOM 1587 C ASP A 536 11.461 -4.903 -4.159 1.00 44.15 C ATOM 1588 O ASP A 536 11.598 -5.919 -3.476 1.00 5.30 O ATOM 1589 CB ASP A 536 13.175 -3.347 -3.192 1.00 34.10 C ATOM 1590 CG ASP A 536 13.491 -1.973 -2.630 1.00 14.52 C ATOM 1591 OD1 ASP A 536 13.703 -1.034 -3.426 1.00 23.45 O ATOM 1592 OD2 ASP A 536 13.530 -1.826 -1.391 1.00 55.33 O ATOM 0 H ASP A 536 11.185 -3.786 -1.521 1.00 12.23 H new ATOM 0 HA ASP A 536 11.406 -2.762 -4.288 1.00 55.14 H new ATOM 0 HB2 ASP A 536 13.455 -4.107 -2.463 1.00 34.10 H new ATOM 0 HB3 ASP A 536 13.780 -3.520 -4.082 1.00 34.10 H new ATOM 1597 N VAL A 537 11.117 -4.944 -5.448 1.00 5.45 N ATOM 1598 CA VAL A 537 10.900 -6.212 -6.162 1.00 12.25 C ATOM 1599 C VAL A 537 11.955 -6.421 -7.262 1.00 4.52 C ATOM 1600 O VAL A 537 12.177 -5.543 -8.099 1.00 4.14 O ATOM 1601 CB VAL A 537 9.494 -6.252 -6.809 1.00 53.23 C ATOM 1602 CG1 VAL A 537 9.258 -7.584 -7.521 1.00 62.35 C ATOM 1603 CG2 VAL A 537 8.411 -5.993 -5.767 1.00 10.41 C ATOM 0 H VAL A 537 10.981 -4.113 -6.024 1.00 5.45 H new ATOM 0 HA VAL A 537 10.985 -7.010 -5.424 1.00 12.25 H new ATOM 0 HB VAL A 537 9.443 -5.459 -7.555 1.00 53.23 H new ATOM 0 HG11 VAL A 537 8.263 -7.587 -7.967 1.00 62.35 H new ATOM 0 HG12 VAL A 537 10.006 -7.717 -8.302 1.00 62.35 H new ATOM 0 HG13 VAL A 537 9.336 -8.400 -6.802 1.00 62.35 H new ATOM 0 HG21 VAL A 537 7.432 -6.026 -6.244 1.00 10.41 H new ATOM 0 HG22 VAL A 537 8.462 -6.757 -4.991 1.00 10.41 H new ATOM 0 HG23 VAL A 537 8.564 -5.011 -5.320 1.00 10.41 H new ATOM 1613 N SER A 538 12.597 -7.588 -7.263 1.00 14.25 N ATOM 1614 CA SER A 538 13.612 -7.921 -8.276 1.00 41.45 C ATOM 1615 C SER A 538 13.129 -9.058 -9.186 1.00 10.54 C ATOM 1616 O SER A 538 12.815 -10.150 -8.713 1.00 62.13 O ATOM 1617 CB SER A 538 14.933 -8.329 -7.609 1.00 40.51 C ATOM 1618 OG SER A 538 15.952 -8.544 -8.576 1.00 65.23 O ATOM 0 H SER A 538 12.436 -8.324 -6.575 1.00 14.25 H new ATOM 0 HA SER A 538 13.776 -7.029 -8.881 1.00 41.45 H new ATOM 0 HB2 SER A 538 15.247 -7.552 -6.913 1.00 40.51 H new ATOM 0 HB3 SER A 538 14.784 -9.238 -7.026 1.00 40.51 H new ATOM 0 HG SER A 538 16.783 -8.801 -8.124 1.00 65.23 H new ATOM 1624 N VAL A 539 13.068 -8.797 -10.490 1.00 30.13 N ATOM 1625 CA VAL A 539 12.618 -9.802 -11.464 1.00 51.14 C ATOM 1626 C VAL A 539 13.810 -10.488 -12.152 1.00 2.34 C ATOM 1627 O VAL A 539 14.732 -9.821 -12.626 1.00 31.00 O ATOM 1628 CB VAL A 539 11.703 -9.170 -12.545 1.00 54.43 C ATOM 1629 CG1 VAL A 539 11.152 -10.238 -13.490 1.00 14.33 C ATOM 1630 CG2 VAL A 539 10.568 -8.382 -11.894 1.00 3.12 C ATOM 0 H VAL A 539 13.324 -7.899 -10.901 1.00 30.13 H new ATOM 0 HA VAL A 539 12.050 -10.547 -10.907 1.00 51.14 H new ATOM 0 HB VAL A 539 12.304 -8.479 -13.136 1.00 54.43 H new ATOM 0 HG11 VAL A 539 10.514 -9.768 -14.238 1.00 14.33 H new ATOM 0 HG12 VAL A 539 11.979 -10.746 -13.986 1.00 14.33 H new ATOM 0 HG13 VAL A 539 10.570 -10.963 -12.920 1.00 14.33 H new ATOM 0 HG21 VAL A 539 9.937 -7.946 -12.668 1.00 3.12 H new ATOM 0 HG22 VAL A 539 9.971 -9.050 -11.273 1.00 3.12 H new ATOM 0 HG23 VAL A 539 10.985 -7.587 -11.276 1.00 3.12 H new ATOM 1640 N VAL A 540 13.785 -11.821 -12.203 1.00 10.53 N ATOM 1641 CA VAL A 540 14.872 -12.603 -12.811 1.00 32.23 C ATOM 1642 C VAL A 540 14.420 -13.332 -14.092 1.00 53.41 C ATOM 1643 O VAL A 540 13.234 -13.602 -14.282 1.00 21.22 O ATOM 1644 CB VAL A 540 15.437 -13.645 -11.811 1.00 11.10 C ATOM 1645 CG1 VAL A 540 16.065 -12.951 -10.602 1.00 74.21 C ATOM 1646 CG2 VAL A 540 14.349 -14.626 -11.367 1.00 32.14 C ATOM 0 H VAL A 540 13.022 -12.387 -11.830 1.00 10.53 H new ATOM 0 HA VAL A 540 15.651 -11.888 -13.076 1.00 32.23 H new ATOM 0 HB VAL A 540 16.215 -14.213 -12.321 1.00 11.10 H new ATOM 0 HG11 VAL A 540 16.455 -13.701 -9.914 1.00 74.21 H new ATOM 0 HG12 VAL A 540 16.878 -12.306 -10.935 1.00 74.21 H new ATOM 0 HG13 VAL A 540 15.310 -12.350 -10.095 1.00 74.21 H new ATOM 0 HG21 VAL A 540 14.772 -15.346 -10.666 1.00 32.14 H new ATOM 0 HG22 VAL A 540 13.541 -14.078 -10.881 1.00 32.14 H new ATOM 0 HG23 VAL A 540 13.958 -15.154 -12.237 1.00 32.14 H new ATOM 1656 N LEU A 541 15.381 -13.648 -14.964 1.00 30.23 N ATOM 1657 CA LEU A 541 15.104 -14.384 -16.211 1.00 50.01 C ATOM 1658 C LEU A 541 15.344 -15.894 -16.044 1.00 13.13 C ATOM 1659 O LEU A 541 14.947 -16.692 -16.893 1.00 63.51 O ATOM 1660 CB LEU A 541 15.993 -13.855 -17.350 1.00 43.32 C ATOM 1661 CG LEU A 541 15.730 -12.404 -17.785 1.00 74.30 C ATOM 1662 CD1 LEU A 541 16.731 -11.974 -18.854 1.00 52.15 C ATOM 1663 CD2 LEU A 541 14.299 -12.247 -18.295 1.00 13.13 C ATOM 0 H LEU A 541 16.363 -13.407 -14.833 1.00 30.23 H new ATOM 0 HA LEU A 541 14.054 -14.226 -16.455 1.00 50.01 H new ATOM 0 HB2 LEU A 541 17.035 -13.939 -17.041 1.00 43.32 H new ATOM 0 HB3 LEU A 541 15.865 -14.503 -18.217 1.00 43.32 H new ATOM 0 HG LEU A 541 15.857 -11.758 -16.917 1.00 74.30 H new ATOM 0 HD11 LEU A 541 16.529 -10.944 -19.149 1.00 52.15 H new ATOM 0 HD12 LEU A 541 17.743 -12.045 -18.455 1.00 52.15 H new ATOM 0 HD13 LEU A 541 16.638 -12.625 -19.723 1.00 52.15 H new ATOM 0 HD21 LEU A 541 14.132 -11.213 -18.598 1.00 13.13 H new ATOM 0 HD22 LEU A 541 14.143 -12.905 -19.150 1.00 13.13 H new ATOM 0 HD23 LEU A 541 13.599 -12.510 -17.502 1.00 13.13 H new ATOM 1675 N GLU A 542 16.003 -16.269 -14.955 1.00 61.21 N ATOM 1676 CA GLU A 542 16.367 -17.671 -14.698 1.00 55.14 C ATOM 1677 C GLU A 542 15.151 -18.528 -14.263 1.00 31.14 C ATOM 1678 O GLU A 542 14.725 -18.442 -13.092 1.00 37.34 O ATOM 1679 CB GLU A 542 17.499 -17.721 -13.656 1.00 4.42 C ATOM 1680 CG GLU A 542 17.210 -16.949 -12.372 1.00 31.33 C ATOM 1681 CD GLU A 542 18.454 -16.720 -11.535 1.00 22.42 C ATOM 1682 OE1 GLU A 542 18.871 -17.645 -10.809 1.00 51.54 O ATOM 1683 OE2 GLU A 542 19.032 -15.613 -11.617 1.00 54.25 O ATOM 0 H GLU A 542 16.302 -15.622 -14.226 1.00 61.21 H new ATOM 0 HA GLU A 542 16.721 -18.109 -15.631 1.00 55.14 H new ATOM 0 HB2 GLU A 542 17.697 -18.762 -13.402 1.00 4.42 H new ATOM 0 HB3 GLU A 542 18.409 -17.324 -14.107 1.00 4.42 H new ATOM 0 HG2 GLU A 542 16.764 -15.987 -12.624 1.00 31.33 H new ATOM 0 HG3 GLU A 542 16.475 -17.496 -11.781 1.00 31.33 H new