USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 797 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 516 TYR OH : rot -140:sc= -0.674! USER MOD Set 1.2: A 554 MET CE :methyl -116:sc= -0.972 (180deg=-1.03) USER MOD Set 2.1: A 538 GLN : amide:sc= -1.3 K(o=-0.71,f=0.58) USER MOD Set 2.2: A 551 HIS : no HD1:sc= 0.592 K(o=-0.71,f=-5.5!) USER MOD Set 3.1: A 483 THR OG1 : rot -29:sc= 1.45 USER MOD Set 3.2: A 556 LYS NZ :NH3+ 179:sc= 0.942 (180deg=-0.196) USER MOD Single : A 477 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 480 GLN : amide:sc= -0.688! K(o=-0.69!,f=0) USER MOD Single : A 497 LYS NZ :NH3+ 150:sc= 1.63 (180deg=1.24) USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 LYS NZ :NH3+ -172:sc=-0.00913 (180deg=-0.111) USER MOD Single : A 511 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 515 LYS NZ :NH3+ 168:sc= -0.0322 (180deg=-0.231) USER MOD Single : A 517 LYS NZ :NH3+ 171:sc= -0.0037 (180deg=-0.0808) USER MOD Single : A 519 ASN : amide:sc= -0.0499 K(o=-0.05,f=-1.4!) USER MOD Single : A 525 SER OG : rot 180:sc= 0 USER MOD Single : A 540 MET CE :methyl 158:sc= -0.0605 (180deg=-0.361) USER MOD Single : A 543 SER OG : rot 80:sc= 0.612 USER MOD Single : A 545 TYR OH : rot 180:sc= 0 USER MOD Single : A 547 CYS SG : rot 180:sc= 0.116 USER MOD Single : A 552 LYS NZ :NH3+ -171:sc= -0.0128 (180deg=-0.127) USER MOD Single : A 553 THR OG1 : rot 180:sc= 0 USER MOD Single : A 559 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000777) USER MOD Single : A 563 SER OG : rot 180:sc= 0 USER MOD Single : A 566 LYS NZ :NH3+ 165:sc= 0.388 (180deg=0.279) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 571 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 475 0.665 14.893 11.201 1.00 9.50 N ATOM 2 CA GLY A 475 1.502 15.697 10.277 1.00 8.97 C ATOM 3 C GLY A 475 1.616 15.055 8.913 1.00 8.18 C ATOM 4 O GLY A 475 0.850 14.146 8.590 1.00 8.54 O ATOM 0 HA2 GLY A 475 1.073 16.694 10.174 1.00 8.97 H new ATOM 0 HA3 GLY A 475 2.497 15.821 10.704 1.00 8.97 H new ATOM 10 N ALA A 476 2.574 15.532 8.116 1.00 7.34 N ATOM 11 CA ALA A 476 2.829 15.000 6.778 1.00 6.74 C ATOM 12 C ALA A 476 1.617 15.166 5.863 1.00 7.12 C ATOM 13 O ALA A 476 1.289 14.276 5.075 1.00 7.28 O ATOM 14 CB ALA A 476 3.257 13.540 6.847 1.00 5.93 C ATOM 0 H ALA A 476 3.194 16.297 8.381 1.00 7.34 H new ATOM 0 HA ALA A 476 3.646 15.579 6.348 1.00 6.74 H new ATOM 0 HB1 ALA A 476 3.441 13.167 5.840 1.00 5.93 H new ATOM 0 HB2 ALA A 476 4.169 13.456 7.437 1.00 5.93 H new ATOM 0 HB3 ALA A 476 2.467 12.951 7.314 1.00 5.93 H new ATOM 20 N MET A 477 0.961 16.315 5.972 1.00 7.56 N ATOM 21 CA MET A 477 -0.178 16.639 5.124 1.00 8.10 C ATOM 22 C MET A 477 0.294 16.864 3.691 1.00 7.49 C ATOM 23 O MET A 477 -0.406 16.548 2.727 1.00 7.91 O ATOM 24 CB MET A 477 -0.885 17.889 5.655 1.00 8.92 C ATOM 25 CG MET A 477 -2.137 18.271 4.882 1.00 9.65 C ATOM 26 SD MET A 477 -2.955 19.719 5.578 1.00 10.43 S ATOM 27 CE MET A 477 -4.375 19.862 4.495 1.00 10.95 C ATOM 0 H MET A 477 1.201 17.043 6.645 1.00 7.56 H new ATOM 0 HA MET A 477 -0.884 15.808 5.136 1.00 8.10 H new ATOM 0 HB2 MET A 477 -1.152 17.726 6.699 1.00 8.92 H new ATOM 0 HB3 MET A 477 -0.187 18.726 5.631 1.00 8.92 H new ATOM 0 HG2 MET A 477 -1.874 18.469 3.843 1.00 9.65 H new ATOM 0 HG3 MET A 477 -2.831 17.430 4.880 1.00 9.65 H new ATOM 0 HE1 MET A 477 -4.980 20.716 4.800 1.00 10.95 H new ATOM 0 HE2 MET A 477 -4.037 20.005 3.469 1.00 10.95 H new ATOM 0 HE3 MET A 477 -4.973 18.953 4.557 1.00 10.95 H new ATOM 37 N ASP A 478 1.491 17.414 3.567 1.00 6.78 N ATOM 38 CA ASP A 478 2.128 17.578 2.272 1.00 6.45 C ATOM 39 C ASP A 478 3.257 16.566 2.134 1.00 5.85 C ATOM 40 O ASP A 478 3.957 16.274 3.106 1.00 5.45 O ATOM 41 CB ASP A 478 2.649 19.012 2.090 1.00 6.52 C ATOM 42 CG ASP A 478 3.737 19.391 3.073 1.00 6.15 C ATOM 43 OD1 ASP A 478 3.409 19.754 4.225 1.00 6.19 O ATOM 44 OD2 ASP A 478 4.921 19.355 2.696 1.00 6.08 O ATOM 0 H ASP A 478 2.043 17.756 4.353 1.00 6.78 H new ATOM 0 HA ASP A 478 1.391 17.399 1.489 1.00 6.45 H new ATOM 0 HB2 ASP A 478 3.032 19.125 1.076 1.00 6.52 H new ATOM 0 HB3 ASP A 478 1.817 19.708 2.196 1.00 6.52 H new ATOM 49 N PRO A 479 3.383 15.964 0.940 1.00 6.15 N ATOM 50 CA PRO A 479 4.448 14.993 0.612 1.00 6.09 C ATOM 51 C PRO A 479 5.871 15.561 0.710 1.00 5.56 C ATOM 52 O PRO A 479 6.636 15.505 -0.253 1.00 5.93 O ATOM 53 CB PRO A 479 4.146 14.619 -0.845 1.00 7.00 C ATOM 54 CG PRO A 479 2.711 14.940 -1.039 1.00 7.45 C ATOM 55 CD PRO A 479 2.447 16.140 -0.181 1.00 6.96 C ATOM 0 HA PRO A 479 4.438 14.162 1.317 1.00 6.09 H new ATOM 0 HB2 PRO A 479 4.773 15.184 -1.535 1.00 7.00 H new ATOM 0 HB3 PRO A 479 4.342 13.563 -1.029 1.00 7.00 H new ATOM 0 HG2 PRO A 479 2.495 15.152 -2.086 1.00 7.45 H new ATOM 0 HG3 PRO A 479 2.079 14.102 -0.746 1.00 7.45 H new ATOM 0 HD2 PRO A 479 2.634 17.069 -0.720 1.00 6.96 H new ATOM 0 HD3 PRO A 479 1.412 16.172 0.160 1.00 6.96 H new ATOM 63 N GLN A 480 6.227 16.096 1.868 1.00 5.08 N ATOM 64 CA GLN A 480 7.582 16.567 2.107 1.00 4.93 C ATOM 65 C GLN A 480 8.453 15.428 2.617 1.00 4.26 C ATOM 66 O GLN A 480 9.585 15.247 2.167 1.00 4.58 O ATOM 67 CB GLN A 480 7.588 17.726 3.112 1.00 5.47 C ATOM 68 CG GLN A 480 6.840 17.429 4.402 1.00 5.99 C ATOM 69 CD GLN A 480 6.959 18.544 5.420 1.00 6.80 C ATOM 70 OE1 GLN A 480 7.853 18.540 6.262 1.00 7.23 O ATOM 71 NE2 GLN A 480 6.065 19.513 5.343 1.00 7.34 N ATOM 0 H GLN A 480 5.594 16.215 2.659 1.00 5.08 H new ATOM 0 HA GLN A 480 7.988 16.929 1.163 1.00 4.93 H new ATOM 0 HB2 GLN A 480 8.620 17.979 3.353 1.00 5.47 H new ATOM 0 HB3 GLN A 480 7.146 18.604 2.641 1.00 5.47 H new ATOM 0 HG2 GLN A 480 5.787 17.261 4.176 1.00 5.99 H new ATOM 0 HG3 GLN A 480 7.224 16.505 4.835 1.00 5.99 H new ATOM 0 HE21 GLN A 480 5.337 19.480 4.629 1.00 7.34 H new ATOM 0 HE22 GLN A 480 6.102 20.294 5.998 1.00 7.34 H new ATOM 80 N GLU A 481 7.906 14.653 3.544 1.00 3.73 N ATOM 81 CA GLU A 481 8.617 13.540 4.152 1.00 3.42 C ATOM 82 C GLU A 481 7.678 12.811 5.100 1.00 2.91 C ATOM 83 O GLU A 481 7.139 13.415 6.031 1.00 3.35 O ATOM 84 CB GLU A 481 9.842 14.038 4.925 1.00 4.12 C ATOM 85 CG GLU A 481 10.834 12.940 5.274 1.00 4.77 C ATOM 86 CD GLU A 481 11.578 12.421 4.060 1.00 5.51 C ATOM 87 OE1 GLU A 481 12.619 13.000 3.699 1.00 6.03 O ATOM 88 OE2 GLU A 481 11.119 11.426 3.456 1.00 5.86 O ATOM 0 H GLU A 481 6.957 14.780 3.895 1.00 3.73 H new ATOM 0 HA GLU A 481 8.956 12.864 3.367 1.00 3.42 H new ATOM 0 HB2 GLU A 481 10.350 14.799 4.332 1.00 4.12 H new ATOM 0 HB3 GLU A 481 9.509 14.520 5.844 1.00 4.12 H new ATOM 0 HG2 GLU A 481 11.552 13.321 6.000 1.00 4.77 H new ATOM 0 HG3 GLU A 481 10.305 12.115 5.751 1.00 4.77 H new ATOM 95 N GLU A 482 7.463 11.530 4.857 1.00 2.67 N ATOM 96 CA GLU A 482 6.565 10.747 5.690 1.00 2.85 C ATOM 97 C GLU A 482 6.970 9.277 5.692 1.00 2.19 C ATOM 98 O GLU A 482 7.223 8.696 6.748 1.00 2.63 O ATOM 99 CB GLU A 482 5.116 10.915 5.211 1.00 3.76 C ATOM 100 CG GLU A 482 4.881 10.515 3.762 1.00 4.21 C ATOM 101 CD GLU A 482 3.488 10.842 3.282 1.00 5.22 C ATOM 102 OE1 GLU A 482 2.531 10.145 3.686 1.00 5.55 O ATOM 103 OE2 GLU A 482 3.341 11.796 2.490 1.00 5.92 O ATOM 0 H GLU A 482 7.896 11.011 4.093 1.00 2.67 H new ATOM 0 HA GLU A 482 6.635 11.113 6.714 1.00 2.85 H new ATOM 0 HB2 GLU A 482 4.464 10.319 5.850 1.00 3.76 H new ATOM 0 HB3 GLU A 482 4.823 11.957 5.339 1.00 3.76 H new ATOM 0 HG2 GLU A 482 5.607 11.023 3.128 1.00 4.21 H new ATOM 0 HG3 GLU A 482 5.056 9.445 3.653 1.00 4.21 H new ATOM 110 N THR A 483 7.029 8.686 4.511 1.00 1.57 N ATOM 111 CA THR A 483 7.380 7.292 4.340 1.00 0.95 C ATOM 112 C THR A 483 7.773 7.071 2.881 1.00 0.88 C ATOM 113 O THR A 483 7.123 7.603 1.982 1.00 1.70 O ATOM 114 CB THR A 483 6.202 6.363 4.709 1.00 0.84 C ATOM 115 OG1 THR A 483 5.627 6.759 5.960 1.00 1.40 O ATOM 116 CG2 THR A 483 6.670 4.928 4.819 1.00 1.04 C ATOM 0 H THR A 483 6.832 9.169 3.635 1.00 1.57 H new ATOM 0 HA THR A 483 8.210 7.051 5.004 1.00 0.95 H new ATOM 0 HB THR A 483 5.454 6.442 3.920 1.00 0.84 H new ATOM 0 HG1 THR A 483 6.314 7.182 6.516 1.00 1.40 H new ATOM 0 HG21 THR A 483 5.826 4.289 5.080 1.00 1.04 H new ATOM 0 HG22 THR A 483 7.087 4.607 3.864 1.00 1.04 H new ATOM 0 HG23 THR A 483 7.434 4.853 5.592 1.00 1.04 H new ATOM 124 N GLY A 484 8.831 6.301 2.644 1.00 0.58 N ATOM 125 CA GLY A 484 9.337 6.132 1.290 1.00 0.41 C ATOM 126 C GLY A 484 8.525 5.162 0.452 1.00 0.35 C ATOM 127 O GLY A 484 9.080 4.408 -0.346 1.00 0.36 O ATOM 0 H GLY A 484 9.347 5.792 3.362 1.00 0.58 H new ATOM 0 HA2 GLY A 484 9.353 7.102 0.794 1.00 0.41 H new ATOM 0 HA3 GLY A 484 10.368 5.782 1.338 1.00 0.41 H new ATOM 131 N VAL A 485 7.213 5.211 0.613 1.00 0.31 N ATOM 132 CA VAL A 485 6.289 4.391 -0.153 1.00 0.27 C ATOM 133 C VAL A 485 4.947 5.085 -0.255 1.00 0.26 C ATOM 134 O VAL A 485 4.613 5.936 0.572 1.00 0.31 O ATOM 135 CB VAL A 485 6.052 3.017 0.483 1.00 0.26 C ATOM 136 CG1 VAL A 485 7.049 1.992 -0.008 1.00 0.36 C ATOM 137 CG2 VAL A 485 6.104 3.131 1.988 1.00 0.29 C ATOM 0 H VAL A 485 6.755 5.827 1.285 1.00 0.31 H new ATOM 0 HA VAL A 485 6.743 4.250 -1.134 1.00 0.27 H new ATOM 0 HB VAL A 485 5.062 2.674 0.183 1.00 0.26 H new ATOM 0 HG11 VAL A 485 6.847 1.032 0.466 1.00 0.36 H new ATOM 0 HG12 VAL A 485 6.961 1.888 -1.089 1.00 0.36 H new ATOM 0 HG13 VAL A 485 8.059 2.316 0.245 1.00 0.36 H new ATOM 0 HG21 VAL A 485 5.935 2.151 2.433 1.00 0.29 H new ATOM 0 HG22 VAL A 485 7.083 3.503 2.291 1.00 0.29 H new ATOM 0 HG23 VAL A 485 5.332 3.822 2.327 1.00 0.29 H new ATOM 147 N ARG A 486 4.184 4.708 -1.256 1.00 0.24 N ATOM 148 CA ARG A 486 2.872 5.278 -1.474 1.00 0.26 C ATOM 149 C ARG A 486 2.020 4.324 -2.291 1.00 0.20 C ATOM 150 O ARG A 486 2.468 3.772 -3.291 1.00 0.28 O ATOM 151 CB ARG A 486 3.000 6.630 -2.173 1.00 0.37 C ATOM 152 CG ARG A 486 1.680 7.275 -2.554 1.00 0.38 C ATOM 153 CD ARG A 486 0.768 7.437 -1.351 1.00 0.73 C ATOM 154 NE ARG A 486 -0.416 8.230 -1.671 1.00 1.51 N ATOM 155 CZ ARG A 486 -1.245 8.730 -0.761 1.00 2.01 C ATOM 156 NH1 ARG A 486 -1.043 8.489 0.527 1.00 2.01 N ATOM 157 NH2 ARG A 486 -2.278 9.473 -1.141 1.00 2.96 N ATOM 0 H ARG A 486 4.453 4.001 -1.940 1.00 0.24 H new ATOM 0 HA ARG A 486 2.384 5.434 -0.512 1.00 0.26 H new ATOM 0 HB2 ARG A 486 3.546 7.311 -1.520 1.00 0.37 H new ATOM 0 HB3 ARG A 486 3.600 6.502 -3.074 1.00 0.37 H new ATOM 0 HG2 ARG A 486 1.867 8.250 -3.003 1.00 0.38 H new ATOM 0 HG3 ARG A 486 1.182 6.667 -3.309 1.00 0.38 H new ATOM 0 HD2 ARG A 486 0.461 6.454 -0.992 1.00 0.73 H new ATOM 0 HD3 ARG A 486 1.317 7.915 -0.540 1.00 0.73 H new ATOM 0 HE ARG A 486 -0.619 8.411 -2.654 1.00 1.51 H new ATOM 0 HH11 ARG A 486 -0.250 7.919 0.821 1.00 2.01 H new ATOM 0 HH12 ARG A 486 -1.681 8.874 1.224 1.00 2.01 H new ATOM 0 HH21 ARG A 486 -2.435 9.660 -2.131 1.00 2.96 H new ATOM 0 HH22 ARG A 486 -2.914 9.857 -0.442 1.00 2.96 H new ATOM 171 N VAL A 487 0.794 4.129 -1.854 1.00 0.19 N ATOM 172 CA VAL A 487 -0.093 3.187 -2.509 1.00 0.16 C ATOM 173 C VAL A 487 -1.245 3.904 -3.191 1.00 0.19 C ATOM 174 O VAL A 487 -1.848 4.820 -2.628 1.00 0.23 O ATOM 175 CB VAL A 487 -0.630 2.148 -1.510 1.00 0.18 C ATOM 176 CG1 VAL A 487 -1.574 1.171 -2.185 1.00 0.22 C ATOM 177 CG2 VAL A 487 0.530 1.414 -0.877 1.00 0.21 C ATOM 0 H VAL A 487 0.388 4.608 -1.050 1.00 0.19 H new ATOM 0 HA VAL A 487 0.487 2.666 -3.271 1.00 0.16 H new ATOM 0 HB VAL A 487 -1.196 2.668 -0.737 1.00 0.18 H new ATOM 0 HG11 VAL A 487 -1.936 0.450 -1.452 1.00 0.22 H new ATOM 0 HG12 VAL A 487 -2.419 1.715 -2.607 1.00 0.22 H new ATOM 0 HG13 VAL A 487 -1.046 0.646 -2.981 1.00 0.22 H new ATOM 0 HG21 VAL A 487 0.151 0.677 -0.169 1.00 0.21 H new ATOM 0 HG22 VAL A 487 1.107 0.909 -1.652 1.00 0.21 H new ATOM 0 HG23 VAL A 487 1.169 2.125 -0.354 1.00 0.21 H new ATOM 187 N GLU A 488 -1.531 3.484 -4.413 1.00 0.20 N ATOM 188 CA GLU A 488 -2.573 4.097 -5.219 1.00 0.24 C ATOM 189 C GLU A 488 -3.465 3.031 -5.839 1.00 0.19 C ATOM 190 O GLU A 488 -3.098 1.857 -5.892 1.00 0.18 O ATOM 191 CB GLU A 488 -1.943 4.962 -6.313 1.00 0.32 C ATOM 192 CG GLU A 488 -1.057 6.073 -5.772 1.00 0.42 C ATOM 193 CD GLU A 488 -0.589 7.017 -6.854 1.00 1.13 C ATOM 194 OE1 GLU A 488 -1.432 7.724 -7.448 1.00 1.19 O ATOM 195 OE2 GLU A 488 0.627 7.041 -7.129 1.00 2.01 O ATOM 0 H GLU A 488 -1.049 2.711 -4.872 1.00 0.20 H new ATOM 0 HA GLU A 488 -3.187 4.728 -4.576 1.00 0.24 H new ATOM 0 HB2 GLU A 488 -1.353 4.326 -6.973 1.00 0.32 H new ATOM 0 HB3 GLU A 488 -2.735 5.402 -6.919 1.00 0.32 H new ATOM 0 HG2 GLU A 488 -1.605 6.635 -5.016 1.00 0.42 H new ATOM 0 HG3 GLU A 488 -0.191 5.634 -5.277 1.00 0.42 H new ATOM 202 N LEU A 489 -4.634 3.451 -6.298 1.00 0.22 N ATOM 203 CA LEU A 489 -5.612 2.541 -6.877 1.00 0.20 C ATOM 204 C LEU A 489 -5.273 2.238 -8.327 1.00 0.21 C ATOM 205 O LEU A 489 -4.934 3.136 -9.097 1.00 0.30 O ATOM 206 CB LEU A 489 -7.010 3.156 -6.829 1.00 0.24 C ATOM 207 CG LEU A 489 -7.552 3.499 -5.443 1.00 0.26 C ATOM 208 CD1 LEU A 489 -8.846 4.281 -5.579 1.00 0.37 C ATOM 209 CD2 LEU A 489 -7.802 2.243 -4.629 1.00 0.22 C ATOM 0 H LEU A 489 -4.931 4.427 -6.280 1.00 0.22 H new ATOM 0 HA LEU A 489 -5.590 1.621 -6.293 1.00 0.20 H new ATOM 0 HB2 LEU A 489 -7.004 4.066 -7.429 1.00 0.24 H new ATOM 0 HB3 LEU A 489 -7.704 2.464 -7.306 1.00 0.24 H new ATOM 0 HG LEU A 489 -6.807 4.103 -4.925 1.00 0.26 H new ATOM 0 HD11 LEU A 489 -9.230 4.524 -4.588 1.00 0.37 H new ATOM 0 HD12 LEU A 489 -8.658 5.202 -6.131 1.00 0.37 H new ATOM 0 HD13 LEU A 489 -9.580 3.679 -6.115 1.00 0.37 H new ATOM 0 HD21 LEU A 489 -8.187 2.517 -3.647 1.00 0.22 H new ATOM 0 HD22 LEU A 489 -8.530 1.615 -5.143 1.00 0.22 H new ATOM 0 HD23 LEU A 489 -6.868 1.693 -4.512 1.00 0.22 H new ATOM 221 N ALA A 490 -5.366 0.969 -8.690 1.00 0.19 N ATOM 222 CA ALA A 490 -5.247 0.564 -10.083 1.00 0.21 C ATOM 223 C ALA A 490 -6.550 0.862 -10.805 1.00 0.28 C ATOM 224 O ALA A 490 -6.588 1.048 -12.022 1.00 0.43 O ATOM 225 CB ALA A 490 -4.925 -0.917 -10.181 1.00 0.20 C ATOM 0 H ALA A 490 -5.524 0.200 -8.039 1.00 0.19 H new ATOM 0 HA ALA A 490 -4.435 1.123 -10.549 1.00 0.21 H new ATOM 0 HB1 ALA A 490 -4.840 -1.202 -11.230 1.00 0.20 H new ATOM 0 HB2 ALA A 490 -3.982 -1.119 -9.672 1.00 0.20 H new ATOM 0 HB3 ALA A 490 -5.722 -1.494 -9.712 1.00 0.20 H new ATOM 231 N GLU A 491 -7.615 0.914 -10.023 1.00 0.28 N ATOM 232 CA GLU A 491 -8.943 1.184 -10.533 1.00 0.37 C ATOM 233 C GLU A 491 -9.649 2.139 -9.588 1.00 0.45 C ATOM 234 O GLU A 491 -9.327 2.202 -8.403 1.00 0.69 O ATOM 235 CB GLU A 491 -9.740 -0.113 -10.660 1.00 0.46 C ATOM 236 CG GLU A 491 -9.932 -0.830 -9.339 1.00 0.64 C ATOM 237 CD GLU A 491 -10.712 -2.117 -9.479 1.00 1.35 C ATOM 238 OE1 GLU A 491 -10.087 -3.165 -9.747 1.00 2.02 O ATOM 239 OE2 GLU A 491 -11.952 -2.090 -9.325 1.00 1.60 O ATOM 0 H GLU A 491 -7.580 0.769 -9.014 1.00 0.28 H new ATOM 0 HA GLU A 491 -8.866 1.635 -11.522 1.00 0.37 H new ATOM 0 HB2 GLU A 491 -10.717 0.109 -11.090 1.00 0.46 H new ATOM 0 HB3 GLU A 491 -9.229 -0.779 -11.356 1.00 0.46 H new ATOM 0 HG2 GLU A 491 -8.957 -1.047 -8.904 1.00 0.64 H new ATOM 0 HG3 GLU A 491 -10.451 -0.170 -8.644 1.00 0.64 H new ATOM 246 N GLU A 492 -10.613 2.862 -10.112 1.00 0.49 N ATOM 247 CA GLU A 492 -11.300 3.888 -9.351 1.00 0.59 C ATOM 248 C GLU A 492 -12.269 3.259 -8.363 1.00 0.57 C ATOM 249 O GLU A 492 -13.109 2.437 -8.739 1.00 0.83 O ATOM 250 CB GLU A 492 -12.045 4.833 -10.293 1.00 0.82 C ATOM 251 CG GLU A 492 -11.145 5.488 -11.326 1.00 1.23 C ATOM 252 CD GLU A 492 -11.899 6.409 -12.256 1.00 1.71 C ATOM 253 OE1 GLU A 492 -12.479 5.915 -13.248 1.00 2.06 O ATOM 254 OE2 GLU A 492 -11.928 7.630 -11.995 1.00 2.36 O ATOM 0 H GLU A 492 -10.943 2.759 -11.071 1.00 0.49 H new ATOM 0 HA GLU A 492 -10.559 4.460 -8.792 1.00 0.59 H new ATOM 0 HB2 GLU A 492 -12.830 4.278 -10.806 1.00 0.82 H new ATOM 0 HB3 GLU A 492 -12.535 5.609 -9.705 1.00 0.82 H new ATOM 0 HG2 GLU A 492 -10.365 6.053 -10.816 1.00 1.23 H new ATOM 0 HG3 GLU A 492 -10.648 4.715 -11.911 1.00 1.23 H new ATOM 261 N ASP A 493 -12.134 3.627 -7.102 1.00 0.49 N ATOM 262 CA ASP A 493 -13.007 3.098 -6.066 1.00 0.52 C ATOM 263 C ASP A 493 -14.233 3.981 -5.893 1.00 0.71 C ATOM 264 O ASP A 493 -14.117 5.175 -5.601 1.00 0.97 O ATOM 265 CB ASP A 493 -12.277 2.963 -4.729 1.00 0.69 C ATOM 266 CG ASP A 493 -13.162 2.326 -3.678 1.00 1.00 C ATOM 267 OD1 ASP A 493 -13.535 1.139 -3.829 1.00 1.37 O ATOM 268 OD2 ASP A 493 -13.485 3.010 -2.691 1.00 1.13 O ATOM 0 H ASP A 493 -11.431 4.288 -6.770 1.00 0.49 H new ATOM 0 HA ASP A 493 -13.322 2.105 -6.386 1.00 0.52 H new ATOM 0 HB2 ASP A 493 -11.378 2.362 -4.863 1.00 0.69 H new ATOM 0 HB3 ASP A 493 -11.955 3.947 -4.388 1.00 0.69 H new ATOM 273 N ASP A 494 -15.405 3.397 -6.089 1.00 0.91 N ATOM 274 CA ASP A 494 -16.654 4.132 -5.956 1.00 1.30 C ATOM 275 C ASP A 494 -17.781 3.196 -5.543 1.00 1.49 C ATOM 276 O ASP A 494 -18.458 2.610 -6.390 1.00 2.20 O ATOM 277 CB ASP A 494 -17.013 4.824 -7.275 1.00 1.80 C ATOM 278 CG ASP A 494 -18.193 5.768 -7.140 1.00 2.52 C ATOM 279 OD1 ASP A 494 -17.983 6.957 -6.819 1.00 2.75 O ATOM 280 OD2 ASP A 494 -19.341 5.320 -7.343 1.00 3.38 O ATOM 0 H ASP A 494 -15.518 2.415 -6.341 1.00 0.91 H new ATOM 0 HA ASP A 494 -16.522 4.890 -5.184 1.00 1.30 H new ATOM 0 HB2 ASP A 494 -16.148 5.380 -7.636 1.00 1.80 H new ATOM 0 HB3 ASP A 494 -17.242 4.068 -8.026 1.00 1.80 H new ATOM 285 N GLY A 495 -17.948 3.016 -4.243 1.00 1.42 N ATOM 286 CA GLY A 495 -19.051 2.232 -3.749 1.00 1.85 C ATOM 287 C GLY A 495 -18.711 1.481 -2.490 1.00 1.67 C ATOM 288 O GLY A 495 -18.691 2.048 -1.397 1.00 2.45 O ATOM 0 H GLY A 495 -17.337 3.401 -3.523 1.00 1.42 H new ATOM 0 HA2 GLY A 495 -19.901 2.887 -3.558 1.00 1.85 H new ATOM 0 HA3 GLY A 495 -19.361 1.524 -4.517 1.00 1.85 H new ATOM 292 N GLU A 496 -18.418 0.206 -2.654 1.00 1.21 N ATOM 293 CA GLU A 496 -18.238 -0.688 -1.525 1.00 1.33 C ATOM 294 C GLU A 496 -17.574 -1.991 -1.958 1.00 1.13 C ATOM 295 O GLU A 496 -17.970 -3.079 -1.534 1.00 1.17 O ATOM 296 CB GLU A 496 -19.594 -0.959 -0.878 1.00 1.72 C ATOM 297 CG GLU A 496 -20.636 -1.495 -1.847 1.00 2.44 C ATOM 298 CD GLU A 496 -22.003 -1.604 -1.217 1.00 2.90 C ATOM 299 OE1 GLU A 496 -22.688 -0.568 -1.091 1.00 3.35 O ATOM 300 OE2 GLU A 496 -22.399 -2.724 -0.836 1.00 3.22 O ATOM 0 H GLU A 496 -18.299 -0.237 -3.565 1.00 1.21 H new ATOM 0 HA GLU A 496 -17.580 -0.214 -0.797 1.00 1.33 H new ATOM 0 HB2 GLU A 496 -19.463 -1.675 -0.066 1.00 1.72 H new ATOM 0 HB3 GLU A 496 -19.965 -0.036 -0.433 1.00 1.72 H new ATOM 0 HG2 GLU A 496 -20.691 -0.840 -2.717 1.00 2.44 H new ATOM 0 HG3 GLU A 496 -20.325 -2.476 -2.206 1.00 2.44 H new ATOM 307 N LYS A 497 -16.565 -1.871 -2.810 1.00 1.03 N ATOM 308 CA LYS A 497 -15.785 -3.010 -3.243 1.00 0.93 C ATOM 309 C LYS A 497 -15.067 -3.625 -2.054 1.00 0.74 C ATOM 310 O LYS A 497 -14.403 -2.926 -1.290 1.00 0.84 O ATOM 311 CB LYS A 497 -14.770 -2.562 -4.288 1.00 1.08 C ATOM 312 CG LYS A 497 -15.404 -1.975 -5.536 1.00 0.89 C ATOM 313 CD LYS A 497 -14.355 -1.454 -6.505 1.00 1.02 C ATOM 314 CE LYS A 497 -14.995 -0.957 -7.790 1.00 1.22 C ATOM 315 NZ LYS A 497 -13.987 -0.470 -8.769 1.00 1.75 N ATOM 0 H LYS A 497 -16.269 -0.983 -3.216 1.00 1.03 H new ATOM 0 HA LYS A 497 -16.447 -3.757 -3.681 1.00 0.93 H new ATOM 0 HB2 LYS A 497 -14.107 -1.820 -3.844 1.00 1.08 H new ATOM 0 HB3 LYS A 497 -14.151 -3.414 -4.571 1.00 1.08 H new ATOM 0 HG2 LYS A 497 -16.010 -2.735 -6.029 1.00 0.89 H new ATOM 0 HG3 LYS A 497 -16.076 -1.164 -5.256 1.00 0.89 H new ATOM 0 HD2 LYS A 497 -13.794 -0.644 -6.038 1.00 1.02 H new ATOM 0 HD3 LYS A 497 -13.641 -2.246 -6.733 1.00 1.02 H new ATOM 0 HE2 LYS A 497 -15.576 -1.762 -8.240 1.00 1.22 H new ATOM 0 HE3 LYS A 497 -15.692 -0.152 -7.559 1.00 1.22 H new ATOM 0 HZ1 LYS A 497 -14.341 -0.620 -9.735 1.00 1.75 H new ATOM 0 HZ2 LYS A 497 -13.817 0.545 -8.617 1.00 1.75 H new ATOM 0 HZ3 LYS A 497 -13.097 -0.993 -8.641 1.00 1.75 H new ATOM 329 N ILE A 498 -15.206 -4.925 -1.896 1.00 0.62 N ATOM 330 CA ILE A 498 -14.606 -5.622 -0.775 1.00 0.52 C ATOM 331 C ILE A 498 -13.153 -5.921 -1.079 1.00 0.45 C ATOM 332 O ILE A 498 -12.316 -5.994 -0.188 1.00 0.50 O ATOM 333 CB ILE A 498 -15.376 -6.918 -0.451 1.00 0.61 C ATOM 334 CG1 ILE A 498 -16.757 -6.570 0.096 1.00 0.68 C ATOM 335 CG2 ILE A 498 -14.615 -7.791 0.542 1.00 0.65 C ATOM 336 CD1 ILE A 498 -16.722 -5.788 1.390 1.00 0.65 C ATOM 0 H ILE A 498 -15.732 -5.524 -2.533 1.00 0.62 H new ATOM 0 HA ILE A 498 -14.659 -4.980 0.104 1.00 0.52 H new ATOM 0 HB ILE A 498 -15.483 -7.490 -1.372 1.00 0.61 H new ATOM 0 HG12 ILE A 498 -17.299 -5.992 -0.652 1.00 0.68 H new ATOM 0 HG13 ILE A 498 -17.318 -7.491 0.254 1.00 0.68 H new ATOM 0 HG21 ILE A 498 -15.189 -8.695 0.746 1.00 0.65 H new ATOM 0 HG22 ILE A 498 -13.647 -8.063 0.120 1.00 0.65 H new ATOM 0 HG23 ILE A 498 -14.464 -7.240 1.470 1.00 0.65 H new ATOM 0 HD11 ILE A 498 -17.741 -5.578 1.716 1.00 0.65 H new ATOM 0 HD12 ILE A 498 -16.209 -6.372 2.154 1.00 0.65 H new ATOM 0 HD13 ILE A 498 -16.191 -4.849 1.234 1.00 0.65 H new ATOM 348 N ALA A 499 -12.857 -6.047 -2.354 1.00 0.45 N ATOM 349 CA ALA A 499 -11.514 -6.338 -2.788 1.00 0.40 C ATOM 350 C ALA A 499 -11.115 -5.433 -3.937 1.00 0.36 C ATOM 351 O ALA A 499 -11.758 -5.419 -4.989 1.00 0.43 O ATOM 352 CB ALA A 499 -11.416 -7.792 -3.175 1.00 0.45 C ATOM 0 H ALA A 499 -13.535 -5.951 -3.110 1.00 0.45 H new ATOM 0 HA ALA A 499 -10.821 -6.148 -1.969 1.00 0.40 H new ATOM 0 HB1 ALA A 499 -10.401 -8.013 -3.504 1.00 0.45 H new ATOM 0 HB2 ALA A 499 -11.663 -8.415 -2.315 1.00 0.45 H new ATOM 0 HB3 ALA A 499 -12.113 -8.000 -3.986 1.00 0.45 H new ATOM 358 N ILE A 500 -10.062 -4.670 -3.715 1.00 0.28 N ATOM 359 CA ILE A 500 -9.612 -3.684 -4.675 1.00 0.25 C ATOM 360 C ILE A 500 -8.234 -4.038 -5.199 1.00 0.21 C ATOM 361 O ILE A 500 -7.654 -5.049 -4.811 1.00 0.24 O ATOM 362 CB ILE A 500 -9.565 -2.284 -4.037 1.00 0.25 C ATOM 363 CG1 ILE A 500 -8.417 -2.171 -3.029 1.00 0.22 C ATOM 364 CG2 ILE A 500 -10.883 -1.992 -3.355 1.00 0.31 C ATOM 365 CD1 ILE A 500 -8.380 -0.849 -2.299 1.00 0.26 C ATOM 0 H ILE A 500 -9.497 -4.717 -2.867 1.00 0.28 H new ATOM 0 HA ILE A 500 -10.322 -3.678 -5.502 1.00 0.25 H new ATOM 0 HB ILE A 500 -9.391 -1.553 -4.827 1.00 0.25 H new ATOM 0 HG12 ILE A 500 -8.504 -2.977 -2.300 1.00 0.22 H new ATOM 0 HG13 ILE A 500 -7.471 -2.315 -3.551 1.00 0.22 H new ATOM 0 HG21 ILE A 500 -10.847 -1.000 -2.904 1.00 0.31 H new ATOM 0 HG22 ILE A 500 -11.688 -2.028 -4.089 1.00 0.31 H new ATOM 0 HG23 ILE A 500 -11.065 -2.737 -2.580 1.00 0.31 H new ATOM 0 HD11 ILE A 500 -7.542 -0.841 -1.602 1.00 0.26 H new ATOM 0 HD12 ILE A 500 -8.261 -0.039 -3.019 1.00 0.26 H new ATOM 0 HD13 ILE A 500 -9.311 -0.711 -1.748 1.00 0.26 H new ATOM 377 N LYS A 501 -7.709 -3.191 -6.063 1.00 0.21 N ATOM 378 CA LYS A 501 -6.394 -3.410 -6.635 1.00 0.20 C ATOM 379 C LYS A 501 -5.531 -2.171 -6.439 1.00 0.15 C ATOM 380 O LYS A 501 -5.865 -1.087 -6.918 1.00 0.16 O ATOM 381 CB LYS A 501 -6.512 -3.759 -8.119 1.00 0.27 C ATOM 382 CG LYS A 501 -5.208 -4.243 -8.738 1.00 0.33 C ATOM 383 CD LYS A 501 -5.385 -4.611 -10.204 1.00 1.08 C ATOM 384 CE LYS A 501 -6.342 -5.780 -10.381 1.00 1.52 C ATOM 385 NZ LYS A 501 -6.573 -6.096 -11.813 1.00 1.81 N ATOM 0 H LYS A 501 -8.174 -2.342 -6.385 1.00 0.21 H new ATOM 0 HA LYS A 501 -5.919 -4.249 -6.125 1.00 0.20 H new ATOM 0 HB2 LYS A 501 -7.271 -4.531 -8.243 1.00 0.27 H new ATOM 0 HB3 LYS A 501 -6.859 -2.881 -8.664 1.00 0.27 H new ATOM 0 HG2 LYS A 501 -4.451 -3.464 -8.647 1.00 0.33 H new ATOM 0 HG3 LYS A 501 -4.843 -5.109 -8.187 1.00 0.33 H new ATOM 0 HD2 LYS A 501 -5.761 -3.747 -10.753 1.00 1.08 H new ATOM 0 HD3 LYS A 501 -4.416 -4.866 -10.634 1.00 1.08 H new ATOM 0 HE2 LYS A 501 -5.939 -6.658 -9.876 1.00 1.52 H new ATOM 0 HE3 LYS A 501 -7.293 -5.546 -9.903 1.00 1.52 H new ATOM 0 HZ1 LYS A 501 -7.231 -6.898 -11.890 1.00 1.81 H new ATOM 0 HZ2 LYS A 501 -6.981 -5.267 -12.290 1.00 1.81 H new ATOM 0 HZ3 LYS A 501 -5.669 -6.345 -12.264 1.00 1.81 H new ATOM 399 N LEU A 502 -4.438 -2.342 -5.716 1.00 0.16 N ATOM 400 CA LEU A 502 -3.543 -1.245 -5.385 1.00 0.13 C ATOM 401 C LEU A 502 -2.156 -1.493 -5.964 1.00 0.14 C ATOM 402 O LEU A 502 -1.780 -2.634 -6.212 1.00 0.20 O ATOM 403 CB LEU A 502 -3.433 -1.118 -3.866 1.00 0.18 C ATOM 404 CG LEU A 502 -4.736 -0.815 -3.130 1.00 0.21 C ATOM 405 CD1 LEU A 502 -4.595 -1.144 -1.656 1.00 0.60 C ATOM 406 CD2 LEU A 502 -5.116 0.644 -3.304 1.00 0.55 C ATOM 0 H LEU A 502 -4.145 -3.245 -5.342 1.00 0.16 H new ATOM 0 HA LEU A 502 -3.947 -0.326 -5.810 1.00 0.13 H new ATOM 0 HB2 LEU A 502 -3.022 -2.047 -3.471 1.00 0.18 H new ATOM 0 HB3 LEU A 502 -2.716 -0.330 -3.637 1.00 0.18 H new ATOM 0 HG LEU A 502 -5.526 -1.434 -3.556 1.00 0.21 H new ATOM 0 HD11 LEU A 502 -5.531 -0.923 -1.143 1.00 0.60 H new ATOM 0 HD12 LEU A 502 -4.358 -2.202 -1.540 1.00 0.60 H new ATOM 0 HD13 LEU A 502 -3.794 -0.544 -1.224 1.00 0.60 H new ATOM 0 HD21 LEU A 502 -6.047 0.843 -2.773 1.00 0.55 H new ATOM 0 HD22 LEU A 502 -4.326 1.277 -2.900 1.00 0.55 H new ATOM 0 HD23 LEU A 502 -5.249 0.861 -4.364 1.00 0.55 H new ATOM 418 N TRP A 503 -1.406 -0.429 -6.189 1.00 0.12 N ATOM 419 CA TRP A 503 -0.008 -0.555 -6.574 1.00 0.14 C ATOM 420 C TRP A 503 0.879 0.107 -5.530 1.00 0.15 C ATOM 421 O TRP A 503 0.727 1.295 -5.234 1.00 0.17 O ATOM 422 CB TRP A 503 0.261 0.070 -7.944 1.00 0.19 C ATOM 423 CG TRP A 503 -0.313 -0.695 -9.103 1.00 0.20 C ATOM 424 CD1 TRP A 503 -1.628 -0.907 -9.366 1.00 0.20 C ATOM 425 CD2 TRP A 503 0.410 -1.344 -10.159 1.00 0.25 C ATOM 426 NE1 TRP A 503 -1.775 -1.613 -10.534 1.00 0.25 N ATOM 427 CE2 TRP A 503 -0.539 -1.896 -11.037 1.00 0.27 C ATOM 428 CE3 TRP A 503 1.765 -1.506 -10.454 1.00 0.28 C ATOM 429 CZ2 TRP A 503 -0.178 -2.592 -12.186 1.00 0.32 C ATOM 430 CZ3 TRP A 503 2.121 -2.203 -11.592 1.00 0.33 C ATOM 431 CH2 TRP A 503 1.153 -2.734 -12.448 1.00 0.34 C ATOM 0 H TRP A 503 -1.739 0.532 -6.112 1.00 0.12 H new ATOM 0 HA TRP A 503 0.223 -1.618 -6.637 1.00 0.14 H new ATOM 0 HB2 TRP A 503 -0.147 1.081 -7.954 1.00 0.19 H new ATOM 0 HB3 TRP A 503 1.338 0.160 -8.083 1.00 0.19 H new ATOM 0 HD1 TRP A 503 -2.443 -0.568 -8.744 1.00 0.20 H new ATOM 0 HE1 TRP A 503 -2.663 -1.882 -10.957 1.00 0.25 H new ATOM 0 HE3 TRP A 503 2.522 -1.093 -9.803 1.00 0.28 H new ATOM 0 HZ2 TRP A 503 -0.925 -3.005 -12.847 1.00 0.32 H new ATOM 0 HZ3 TRP A 503 3.167 -2.340 -11.824 1.00 0.33 H new ATOM 0 HH2 TRP A 503 1.465 -3.267 -13.334 1.00 0.34 H new ATOM 442 N LEU A 504 1.781 -0.673 -4.959 1.00 0.17 N ATOM 443 CA LEU A 504 2.735 -0.162 -3.991 1.00 0.18 C ATOM 444 C LEU A 504 3.873 0.547 -4.702 1.00 0.18 C ATOM 445 O LEU A 504 4.840 -0.079 -5.132 1.00 0.21 O ATOM 446 CB LEU A 504 3.282 -1.300 -3.136 1.00 0.20 C ATOM 447 CG LEU A 504 4.357 -0.909 -2.118 1.00 0.21 C ATOM 448 CD1 LEU A 504 3.784 0.008 -1.053 1.00 0.29 C ATOM 449 CD2 LEU A 504 4.961 -2.152 -1.486 1.00 0.26 C ATOM 0 H LEU A 504 1.872 -1.670 -5.152 1.00 0.17 H new ATOM 0 HA LEU A 504 2.225 0.550 -3.342 1.00 0.18 H new ATOM 0 HB2 LEU A 504 2.451 -1.759 -2.601 1.00 0.20 H new ATOM 0 HB3 LEU A 504 3.695 -2.061 -3.798 1.00 0.20 H new ATOM 0 HG LEU A 504 5.145 -0.367 -2.641 1.00 0.21 H new ATOM 0 HD11 LEU A 504 4.566 0.272 -0.341 1.00 0.29 H new ATOM 0 HD12 LEU A 504 3.399 0.914 -1.522 1.00 0.29 H new ATOM 0 HD13 LEU A 504 2.975 -0.502 -0.530 1.00 0.29 H new ATOM 0 HD21 LEU A 504 5.724 -1.859 -0.764 1.00 0.26 H new ATOM 0 HD22 LEU A 504 4.180 -2.718 -0.979 1.00 0.26 H new ATOM 0 HD23 LEU A 504 5.413 -2.771 -2.261 1.00 0.26 H new ATOM 461 N ARG A 505 3.735 1.847 -4.834 1.00 0.21 N ATOM 462 CA ARG A 505 4.740 2.661 -5.491 1.00 0.23 C ATOM 463 C ARG A 505 5.801 3.106 -4.495 1.00 0.22 C ATOM 464 O ARG A 505 5.504 3.772 -3.505 1.00 0.30 O ATOM 465 CB ARG A 505 4.089 3.859 -6.176 1.00 0.33 C ATOM 466 CG ARG A 505 3.515 3.516 -7.535 1.00 0.64 C ATOM 467 CD ARG A 505 2.855 4.711 -8.188 1.00 0.72 C ATOM 468 NE ARG A 505 2.419 4.404 -9.552 1.00 1.68 N ATOM 469 CZ ARG A 505 1.452 5.052 -10.203 1.00 2.25 C ATOM 470 NH1 ARG A 505 0.776 6.028 -9.609 1.00 2.19 N ATOM 471 NH2 ARG A 505 1.155 4.711 -11.451 1.00 3.33 N ATOM 0 H ARG A 505 2.929 2.370 -4.492 1.00 0.21 H new ATOM 0 HA ARG A 505 5.231 2.060 -6.257 1.00 0.23 H new ATOM 0 HB2 ARG A 505 3.295 4.249 -5.539 1.00 0.33 H new ATOM 0 HB3 ARG A 505 4.827 4.653 -6.288 1.00 0.33 H new ATOM 0 HG2 ARG A 505 4.310 3.143 -8.181 1.00 0.64 H new ATOM 0 HG3 ARG A 505 2.786 2.712 -7.429 1.00 0.64 H new ATOM 0 HD2 ARG A 505 1.998 5.025 -7.593 1.00 0.72 H new ATOM 0 HD3 ARG A 505 3.553 5.548 -8.208 1.00 0.72 H new ATOM 0 HE ARG A 505 2.888 3.640 -10.039 1.00 1.68 H new ATOM 0 HH11 ARG A 505 0.995 6.288 -8.647 1.00 2.19 H new ATOM 0 HH12 ARG A 505 0.038 6.518 -10.114 1.00 2.19 H new ATOM 0 HH21 ARG A 505 1.666 3.956 -11.909 1.00 3.33 H new ATOM 0 HH22 ARG A 505 0.416 5.204 -11.952 1.00 3.33 H new ATOM 485 N ILE A 506 7.035 2.702 -4.751 1.00 0.27 N ATOM 486 CA ILE A 506 8.149 3.052 -3.885 1.00 0.33 C ATOM 487 C ILE A 506 8.531 4.516 -4.083 1.00 0.39 C ATOM 488 O ILE A 506 8.882 4.929 -5.190 1.00 0.45 O ATOM 489 CB ILE A 506 9.383 2.169 -4.166 1.00 0.42 C ATOM 490 CG1 ILE A 506 9.019 0.677 -4.123 1.00 0.40 C ATOM 491 CG2 ILE A 506 10.490 2.480 -3.173 1.00 0.51 C ATOM 492 CD1 ILE A 506 8.489 0.202 -2.787 1.00 0.35 C ATOM 0 H ILE A 506 7.291 2.129 -5.555 1.00 0.27 H new ATOM 0 HA ILE A 506 7.828 2.886 -2.857 1.00 0.33 H new ATOM 0 HB ILE A 506 9.741 2.395 -5.170 1.00 0.42 H new ATOM 0 HG12 ILE A 506 8.271 0.476 -4.890 1.00 0.40 H new ATOM 0 HG13 ILE A 506 9.903 0.092 -4.379 1.00 0.40 H new ATOM 0 HG21 ILE A 506 11.354 1.850 -3.383 1.00 0.51 H new ATOM 0 HG22 ILE A 506 10.775 3.528 -3.262 1.00 0.51 H new ATOM 0 HG23 ILE A 506 10.136 2.285 -2.161 1.00 0.51 H new ATOM 0 HD11 ILE A 506 8.257 -0.862 -2.845 1.00 0.35 H new ATOM 0 HD12 ILE A 506 9.242 0.368 -2.017 1.00 0.35 H new ATOM 0 HD13 ILE A 506 7.585 0.757 -2.536 1.00 0.35 H new ATOM 504 N GLU A 507 8.457 5.287 -3.011 1.00 0.40 N ATOM 505 CA GLU A 507 8.725 6.713 -3.062 1.00 0.46 C ATOM 506 C GLU A 507 10.208 7.011 -2.870 1.00 0.48 C ATOM 507 O GLU A 507 10.782 7.840 -3.578 1.00 0.61 O ATOM 508 CB GLU A 507 7.923 7.412 -1.971 1.00 0.47 C ATOM 509 CG GLU A 507 6.432 7.467 -2.239 1.00 0.73 C ATOM 510 CD GLU A 507 6.069 8.464 -3.318 1.00 1.05 C ATOM 511 OE1 GLU A 507 5.914 9.663 -3.007 1.00 1.42 O ATOM 512 OE2 GLU A 507 5.941 8.053 -4.490 1.00 1.52 O ATOM 0 H GLU A 507 8.210 4.942 -2.083 1.00 0.40 H new ATOM 0 HA GLU A 507 8.432 7.081 -4.045 1.00 0.46 H new ATOM 0 HB2 GLU A 507 8.093 6.899 -1.025 1.00 0.47 H new ATOM 0 HB3 GLU A 507 8.298 8.429 -1.854 1.00 0.47 H new ATOM 0 HG2 GLU A 507 6.083 6.477 -2.533 1.00 0.73 H new ATOM 0 HG3 GLU A 507 5.911 7.729 -1.318 1.00 0.73 H new ATOM 519 N ASP A 508 10.824 6.339 -1.908 1.00 0.40 N ATOM 520 CA ASP A 508 12.209 6.620 -1.553 1.00 0.41 C ATOM 521 C ASP A 508 12.898 5.364 -1.046 1.00 0.39 C ATOM 522 O ASP A 508 12.626 4.894 0.061 1.00 0.40 O ATOM 523 CB ASP A 508 12.270 7.714 -0.486 1.00 0.44 C ATOM 524 CG ASP A 508 13.685 8.171 -0.204 1.00 0.47 C ATOM 525 OD1 ASP A 508 14.369 7.532 0.616 1.00 0.57 O ATOM 526 OD2 ASP A 508 14.117 9.179 -0.801 1.00 0.71 O ATOM 0 H ASP A 508 10.389 5.597 -1.360 1.00 0.40 H new ATOM 0 HA ASP A 508 12.728 6.965 -2.447 1.00 0.41 H new ATOM 0 HB2 ASP A 508 11.674 8.567 -0.811 1.00 0.44 H new ATOM 0 HB3 ASP A 508 11.821 7.344 0.436 1.00 0.44 H new ATOM 531 N ILE A 509 13.781 4.816 -1.866 1.00 0.40 N ATOM 532 CA ILE A 509 14.469 3.579 -1.536 1.00 0.44 C ATOM 533 C ILE A 509 15.578 3.774 -0.507 1.00 0.48 C ATOM 534 O ILE A 509 16.117 2.800 0.015 1.00 0.56 O ATOM 535 CB ILE A 509 15.038 2.908 -2.780 1.00 0.51 C ATOM 536 CG1 ILE A 509 15.924 3.867 -3.550 1.00 0.59 C ATOM 537 CG2 ILE A 509 13.911 2.406 -3.662 1.00 0.53 C ATOM 538 CD1 ILE A 509 16.582 3.201 -4.718 1.00 0.71 C ATOM 0 H ILE A 509 14.039 5.212 -2.770 1.00 0.40 H new ATOM 0 HA ILE A 509 13.714 2.931 -1.092 1.00 0.44 H new ATOM 0 HB ILE A 509 15.646 2.059 -2.468 1.00 0.51 H new ATOM 0 HG12 ILE A 509 15.329 4.710 -3.901 1.00 0.59 H new ATOM 0 HG13 ILE A 509 16.687 4.271 -2.885 1.00 0.59 H new ATOM 0 HG21 ILE A 509 14.328 1.928 -4.548 1.00 0.53 H new ATOM 0 HG22 ILE A 509 13.310 1.684 -3.109 1.00 0.53 H new ATOM 0 HG23 ILE A 509 13.284 3.245 -3.963 1.00 0.53 H new ATOM 0 HD11 ILE A 509 17.208 3.923 -5.243 1.00 0.71 H new ATOM 0 HD12 ILE A 509 17.199 2.374 -4.365 1.00 0.71 H new ATOM 0 HD13 ILE A 509 15.819 2.821 -5.397 1.00 0.71 H new ATOM 550 N LYS A 510 15.918 5.024 -0.216 1.00 0.47 N ATOM 551 CA LYS A 510 16.936 5.319 0.782 1.00 0.55 C ATOM 552 C LYS A 510 16.383 5.056 2.176 1.00 0.57 C ATOM 553 O LYS A 510 17.127 4.783 3.117 1.00 0.70 O ATOM 554 CB LYS A 510 17.391 6.772 0.663 1.00 0.62 C ATOM 555 CG LYS A 510 17.974 7.134 -0.693 1.00 0.77 C ATOM 556 CD LYS A 510 19.173 6.268 -1.043 1.00 1.51 C ATOM 557 CE LYS A 510 19.871 6.770 -2.295 1.00 2.36 C ATOM 558 NZ LYS A 510 18.957 6.815 -3.468 1.00 3.15 N ATOM 0 H LYS A 510 15.505 5.846 -0.656 1.00 0.47 H new ATOM 0 HA LYS A 510 17.796 4.671 0.611 1.00 0.55 H new ATOM 0 HB2 LYS A 510 16.542 7.425 0.867 1.00 0.62 H new ATOM 0 HB3 LYS A 510 18.138 6.971 1.432 1.00 0.62 H new ATOM 0 HG2 LYS A 510 17.208 7.020 -1.460 1.00 0.77 H new ATOM 0 HG3 LYS A 510 18.271 8.183 -0.692 1.00 0.77 H new ATOM 0 HD2 LYS A 510 19.876 6.263 -0.210 1.00 1.51 H new ATOM 0 HD3 LYS A 510 18.849 5.238 -1.193 1.00 1.51 H new ATOM 0 HE2 LYS A 510 20.272 7.767 -2.111 1.00 2.36 H new ATOM 0 HE3 LYS A 510 20.718 6.122 -2.521 1.00 2.36 H new ATOM 0 HZ1 LYS A 510 19.504 7.032 -4.326 1.00 3.15 H new ATOM 0 HZ2 LYS A 510 18.489 5.893 -3.579 1.00 3.15 H new ATOM 0 HZ3 LYS A 510 18.238 7.552 -3.320 1.00 3.15 H new ATOM 572 N LYS A 511 15.066 5.136 2.285 1.00 0.53 N ATOM 573 CA LYS A 511 14.362 4.850 3.503 1.00 0.61 C ATOM 574 C LYS A 511 14.280 3.340 3.716 1.00 0.57 C ATOM 575 O LYS A 511 14.219 2.850 4.846 1.00 0.69 O ATOM 576 CB LYS A 511 12.968 5.465 3.387 1.00 0.69 C ATOM 577 CG LYS A 511 11.972 4.854 4.326 1.00 1.41 C ATOM 578 CD LYS A 511 12.190 5.317 5.751 1.00 1.84 C ATOM 579 CE LYS A 511 11.154 4.733 6.699 1.00 2.59 C ATOM 580 NZ LYS A 511 11.355 5.203 8.094 1.00 3.19 N ATOM 0 H LYS A 511 14.457 5.406 1.513 1.00 0.53 H new ATOM 0 HA LYS A 511 14.882 5.274 4.362 1.00 0.61 H new ATOM 0 HB2 LYS A 511 13.033 6.535 3.583 1.00 0.69 H new ATOM 0 HB3 LYS A 511 12.611 5.349 2.364 1.00 0.69 H new ATOM 0 HG2 LYS A 511 10.963 5.117 4.008 1.00 1.41 H new ATOM 0 HG3 LYS A 511 12.048 3.768 4.281 1.00 1.41 H new ATOM 0 HD2 LYS A 511 13.188 5.026 6.079 1.00 1.84 H new ATOM 0 HD3 LYS A 511 12.146 6.405 5.790 1.00 1.84 H new ATOM 0 HE2 LYS A 511 10.155 5.011 6.362 1.00 2.59 H new ATOM 0 HE3 LYS A 511 11.208 3.645 6.671 1.00 2.59 H new ATOM 0 HZ1 LYS A 511 10.630 4.783 8.710 1.00 3.19 H new ATOM 0 HZ2 LYS A 511 12.298 4.916 8.425 1.00 3.19 H new ATOM 0 HZ3 LYS A 511 11.278 6.240 8.126 1.00 3.19 H new ATOM 594 N LEU A 512 14.301 2.611 2.615 1.00 0.44 N ATOM 595 CA LEU A 512 14.124 1.171 2.639 1.00 0.42 C ATOM 596 C LEU A 512 15.463 0.456 2.766 1.00 0.49 C ATOM 597 O LEU A 512 16.510 0.993 2.395 1.00 0.58 O ATOM 598 CB LEU A 512 13.410 0.732 1.365 1.00 0.35 C ATOM 599 CG LEU A 512 12.129 1.506 1.052 1.00 0.32 C ATOM 600 CD1 LEU A 512 11.541 1.043 -0.261 1.00 0.31 C ATOM 601 CD2 LEU A 512 11.115 1.349 2.173 1.00 0.38 C ATOM 0 H LEU A 512 14.441 2.999 1.682 1.00 0.44 H new ATOM 0 HA LEU A 512 13.522 0.905 3.508 1.00 0.42 H new ATOM 0 HB2 LEU A 512 14.097 0.838 0.525 1.00 0.35 H new ATOM 0 HB3 LEU A 512 13.167 -0.327 1.447 1.00 0.35 H new ATOM 0 HG LEU A 512 12.381 2.563 0.967 1.00 0.32 H new ATOM 0 HD11 LEU A 512 10.630 1.604 -0.469 1.00 0.31 H new ATOM 0 HD12 LEU A 512 12.261 1.211 -1.062 1.00 0.31 H new ATOM 0 HD13 LEU A 512 11.307 -0.020 -0.200 1.00 0.31 H new ATOM 0 HD21 LEU A 512 10.212 1.908 1.928 1.00 0.38 H new ATOM 0 HD22 LEU A 512 10.867 0.295 2.294 1.00 0.38 H new ATOM 0 HD23 LEU A 512 11.538 1.731 3.102 1.00 0.38 H new ATOM 613 N LYS A 513 15.414 -0.755 3.299 1.00 0.51 N ATOM 614 CA LYS A 513 16.604 -1.560 3.508 1.00 0.61 C ATOM 615 C LYS A 513 16.777 -2.534 2.352 1.00 0.64 C ATOM 616 O LYS A 513 17.898 -2.841 1.940 1.00 1.21 O ATOM 617 CB LYS A 513 16.495 -2.327 4.832 1.00 0.71 C ATOM 618 CG LYS A 513 17.756 -3.089 5.204 1.00 1.54 C ATOM 619 CD LYS A 513 18.945 -2.153 5.310 1.00 1.77 C ATOM 620 CE LYS A 513 20.199 -2.888 5.739 1.00 2.87 C ATOM 621 NZ LYS A 513 21.364 -1.974 5.835 1.00 3.30 N ATOM 0 H LYS A 513 14.549 -1.205 3.598 1.00 0.51 H new ATOM 0 HA LYS A 513 17.474 -0.904 3.553 1.00 0.61 H new ATOM 0 HB2 LYS A 513 16.258 -1.624 5.630 1.00 0.71 H new ATOM 0 HB3 LYS A 513 15.663 -3.029 4.768 1.00 0.71 H new ATOM 0 HG2 LYS A 513 17.608 -3.603 6.154 1.00 1.54 H new ATOM 0 HG3 LYS A 513 17.957 -3.855 4.455 1.00 1.54 H new ATOM 0 HD2 LYS A 513 19.116 -1.672 4.347 1.00 1.77 H new ATOM 0 HD3 LYS A 513 18.723 -1.362 6.027 1.00 1.77 H new ATOM 0 HE2 LYS A 513 20.029 -3.364 6.705 1.00 2.87 H new ATOM 0 HE3 LYS A 513 20.417 -3.683 5.026 1.00 2.87 H new ATOM 0 HZ1 LYS A 513 22.204 -2.512 6.131 1.00 3.30 H new ATOM 0 HZ2 LYS A 513 21.541 -1.538 4.907 1.00 3.30 H new ATOM 0 HZ3 LYS A 513 21.165 -1.230 6.534 1.00 3.30 H new ATOM 635 N GLY A 514 15.652 -3.013 1.834 1.00 0.67 N ATOM 636 CA GLY A 514 15.676 -3.925 0.711 1.00 0.63 C ATOM 637 C GLY A 514 16.100 -3.250 -0.579 1.00 0.73 C ATOM 638 O GLY A 514 16.362 -2.047 -0.608 1.00 0.96 O ATOM 0 H GLY A 514 14.719 -2.783 2.176 1.00 0.67 H new ATOM 0 HA2 GLY A 514 16.359 -4.746 0.929 1.00 0.63 H new ATOM 0 HA3 GLY A 514 14.685 -4.361 0.580 1.00 0.63 H new ATOM 642 N LYS A 515 16.152 -4.024 -1.650 1.00 0.73 N ATOM 643 CA LYS A 515 16.594 -3.521 -2.941 1.00 0.86 C ATOM 644 C LYS A 515 15.393 -3.237 -3.835 1.00 0.71 C ATOM 645 O LYS A 515 14.650 -4.153 -4.193 1.00 0.77 O ATOM 646 CB LYS A 515 17.522 -4.529 -3.632 1.00 1.10 C ATOM 647 CG LYS A 515 18.809 -4.842 -2.872 1.00 1.71 C ATOM 648 CD LYS A 515 18.578 -5.757 -1.675 1.00 2.22 C ATOM 649 CE LYS A 515 18.127 -7.150 -2.095 1.00 3.03 C ATOM 650 NZ LYS A 515 19.137 -7.841 -2.942 1.00 3.53 N ATOM 0 H LYS A 515 15.892 -5.010 -1.651 1.00 0.73 H new ATOM 0 HA LYS A 515 17.146 -2.596 -2.772 1.00 0.86 H new ATOM 0 HB2 LYS A 515 16.974 -5.458 -3.788 1.00 1.10 H new ATOM 0 HB3 LYS A 515 17.783 -4.144 -4.618 1.00 1.10 H new ATOM 0 HG2 LYS A 515 19.522 -5.311 -3.550 1.00 1.71 H new ATOM 0 HG3 LYS A 515 19.260 -3.910 -2.530 1.00 1.71 H new ATOM 0 HD2 LYS A 515 19.498 -5.834 -1.096 1.00 2.22 H new ATOM 0 HD3 LYS A 515 17.826 -5.315 -1.022 1.00 2.22 H new ATOM 0 HE2 LYS A 515 17.931 -7.749 -1.206 1.00 3.03 H new ATOM 0 HE3 LYS A 515 17.187 -7.075 -2.642 1.00 3.03 H new ATOM 0 HZ1 LYS A 515 18.884 -8.846 -3.034 1.00 3.53 H new ATOM 0 HZ2 LYS A 515 19.159 -7.402 -3.885 1.00 3.53 H new ATOM 0 HZ3 LYS A 515 20.075 -7.759 -2.500 1.00 3.53 H new ATOM 664 N TYR A 516 15.195 -1.971 -4.180 1.00 0.62 N ATOM 665 CA TYR A 516 14.051 -1.571 -4.991 1.00 0.52 C ATOM 666 C TYR A 516 14.455 -0.526 -6.016 1.00 0.55 C ATOM 667 O TYR A 516 15.507 0.103 -5.900 1.00 0.73 O ATOM 668 CB TYR A 516 12.937 -0.999 -4.109 1.00 0.48 C ATOM 669 CG TYR A 516 12.543 -1.905 -2.978 1.00 0.46 C ATOM 670 CD1 TYR A 516 11.682 -2.970 -3.183 1.00 0.50 C ATOM 671 CD2 TYR A 516 13.057 -1.706 -1.707 1.00 0.51 C ATOM 672 CE1 TYR A 516 11.351 -3.816 -2.150 1.00 0.55 C ATOM 673 CE2 TYR A 516 12.724 -2.542 -0.669 1.00 0.51 C ATOM 674 CZ TYR A 516 11.873 -3.597 -0.896 1.00 0.51 C ATOM 675 OH TYR A 516 11.558 -4.448 0.127 1.00 0.57 O ATOM 0 H TYR A 516 15.811 -1.204 -3.911 1.00 0.62 H new ATOM 0 HA TYR A 516 13.686 -2.459 -5.507 1.00 0.52 H new ATOM 0 HB2 TYR A 516 13.263 -0.042 -3.701 1.00 0.48 H new ATOM 0 HB3 TYR A 516 12.061 -0.800 -4.727 1.00 0.48 H new ATOM 0 HD1 TYR A 516 11.266 -3.138 -4.165 1.00 0.50 H new ATOM 0 HD2 TYR A 516 13.730 -0.880 -1.529 1.00 0.51 H new ATOM 0 HE1 TYR A 516 10.685 -4.648 -2.323 1.00 0.55 H new ATOM 0 HE2 TYR A 516 13.128 -2.371 0.318 1.00 0.51 H new ATOM 0 HH TYR A 516 11.417 -3.933 0.949 1.00 0.57 H new ATOM 685 N LYS A 517 13.612 -0.358 -7.018 1.00 0.51 N ATOM 686 CA LYS A 517 13.791 0.684 -8.014 1.00 0.55 C ATOM 687 C LYS A 517 13.144 1.974 -7.521 1.00 0.51 C ATOM 688 O LYS A 517 12.141 1.929 -6.805 1.00 0.47 O ATOM 689 CB LYS A 517 13.153 0.252 -9.336 1.00 0.64 C ATOM 690 CG LYS A 517 13.729 -1.038 -9.900 1.00 1.06 C ATOM 691 CD LYS A 517 12.920 -1.546 -11.082 1.00 1.18 C ATOM 692 CE LYS A 517 12.884 -0.541 -12.223 1.00 1.33 C ATOM 693 NZ LYS A 517 14.236 -0.280 -12.784 1.00 1.98 N ATOM 0 H LYS A 517 12.786 -0.938 -7.165 1.00 0.51 H new ATOM 0 HA LYS A 517 14.856 0.854 -8.174 1.00 0.55 H new ATOM 0 HB2 LYS A 517 12.080 0.126 -9.188 1.00 0.64 H new ATOM 0 HB3 LYS A 517 13.282 1.048 -10.069 1.00 0.64 H new ATOM 0 HG2 LYS A 517 14.760 -0.871 -10.210 1.00 1.06 H new ATOM 0 HG3 LYS A 517 13.750 -1.799 -9.120 1.00 1.06 H new ATOM 0 HD2 LYS A 517 13.348 -2.483 -11.438 1.00 1.18 H new ATOM 0 HD3 LYS A 517 11.902 -1.763 -10.758 1.00 1.18 H new ATOM 0 HE2 LYS A 517 12.231 -0.913 -13.012 1.00 1.33 H new ATOM 0 HE3 LYS A 517 12.453 0.395 -11.867 1.00 1.33 H new ATOM 0 HZ1 LYS A 517 14.148 0.288 -13.651 1.00 1.98 H new ATOM 0 HZ2 LYS A 517 14.807 0.238 -12.086 1.00 1.98 H new ATOM 0 HZ3 LYS A 517 14.699 -1.184 -13.008 1.00 1.98 H new ATOM 707 N ASP A 518 13.693 3.118 -7.922 1.00 0.60 N ATOM 708 CA ASP A 518 13.173 4.418 -7.480 1.00 0.67 C ATOM 709 C ASP A 518 11.954 4.821 -8.303 1.00 0.71 C ATOM 710 O ASP A 518 11.650 6.000 -8.478 1.00 0.87 O ATOM 711 CB ASP A 518 14.259 5.503 -7.550 1.00 0.83 C ATOM 712 CG ASP A 518 14.623 5.899 -8.970 1.00 1.48 C ATOM 713 OD1 ASP A 518 15.126 5.041 -9.725 1.00 2.29 O ATOM 714 OD2 ASP A 518 14.426 7.081 -9.333 1.00 1.91 O ATOM 0 H ASP A 518 14.495 3.176 -8.550 1.00 0.60 H new ATOM 0 HA ASP A 518 12.866 4.318 -6.439 1.00 0.67 H new ATOM 0 HB2 ASP A 518 13.916 6.386 -7.011 1.00 0.83 H new ATOM 0 HB3 ASP A 518 15.153 5.145 -7.040 1.00 0.83 H new ATOM 719 N ASN A 519 11.261 3.808 -8.778 1.00 0.62 N ATOM 720 CA ASN A 519 10.036 3.957 -9.544 1.00 0.75 C ATOM 721 C ASN A 519 9.377 2.588 -9.640 1.00 0.68 C ATOM 722 O ASN A 519 8.889 2.173 -10.689 1.00 0.89 O ATOM 723 CB ASN A 519 10.312 4.522 -10.945 1.00 0.96 C ATOM 724 CG ASN A 519 9.067 5.095 -11.607 1.00 1.85 C ATOM 725 OD1 ASN A 519 7.943 4.677 -11.329 1.00 2.56 O ATOM 726 ND2 ASN A 519 9.261 6.059 -12.493 1.00 2.48 N ATOM 0 H ASN A 519 11.537 2.836 -8.641 1.00 0.62 H new ATOM 0 HA ASN A 519 9.376 4.666 -9.043 1.00 0.75 H new ATOM 0 HB2 ASN A 519 11.071 5.301 -10.874 1.00 0.96 H new ATOM 0 HB3 ASN A 519 10.722 3.733 -11.575 1.00 0.96 H new ATOM 0 HD21 ASN A 519 8.464 6.481 -12.971 1.00 2.48 H new ATOM 0 HD22 ASN A 519 10.207 6.380 -12.698 1.00 2.48 H new ATOM 733 N GLU A 520 9.413 1.873 -8.528 1.00 0.50 N ATOM 734 CA GLU A 520 8.847 0.544 -8.451 1.00 0.52 C ATOM 735 C GLU A 520 7.402 0.631 -7.986 1.00 0.38 C ATOM 736 O GLU A 520 7.041 1.534 -7.232 1.00 0.40 O ATOM 737 CB GLU A 520 9.669 -0.321 -7.486 1.00 0.74 C ATOM 738 CG GLU A 520 9.129 -1.730 -7.298 1.00 0.81 C ATOM 739 CD GLU A 520 9.123 -2.531 -8.582 1.00 0.99 C ATOM 740 OE1 GLU A 520 8.219 -2.322 -9.413 1.00 1.52 O ATOM 741 OE2 GLU A 520 10.031 -3.368 -8.770 1.00 1.37 O ATOM 0 H GLU A 520 9.835 2.199 -7.658 1.00 0.50 H new ATOM 0 HA GLU A 520 8.873 0.082 -9.438 1.00 0.52 H new ATOM 0 HB2 GLU A 520 10.693 -0.383 -7.854 1.00 0.74 H new ATOM 0 HB3 GLU A 520 9.708 0.174 -6.516 1.00 0.74 H new ATOM 0 HG2 GLU A 520 9.733 -2.249 -6.554 1.00 0.81 H new ATOM 0 HG3 GLU A 520 8.114 -1.676 -6.904 1.00 0.81 H new ATOM 748 N ALA A 521 6.590 -0.293 -8.455 1.00 0.38 N ATOM 749 CA ALA A 521 5.197 -0.367 -8.056 1.00 0.32 C ATOM 750 C ALA A 521 4.718 -1.799 -8.071 1.00 0.31 C ATOM 751 O ALA A 521 4.645 -2.443 -9.118 1.00 0.43 O ATOM 752 CB ALA A 521 4.324 0.500 -8.944 1.00 0.39 C ATOM 0 H ALA A 521 6.874 -1.012 -9.121 1.00 0.38 H new ATOM 0 HA ALA A 521 5.118 0.014 -7.038 1.00 0.32 H new ATOM 0 HB1 ALA A 521 3.286 0.423 -8.620 1.00 0.39 H new ATOM 0 HB2 ALA A 521 4.651 1.538 -8.874 1.00 0.39 H new ATOM 0 HB3 ALA A 521 4.407 0.163 -9.977 1.00 0.39 H new ATOM 758 N ILE A 522 4.414 -2.293 -6.893 1.00 0.25 N ATOM 759 CA ILE A 522 3.959 -3.653 -6.726 1.00 0.25 C ATOM 760 C ILE A 522 2.436 -3.701 -6.669 1.00 0.21 C ATOM 761 O ILE A 522 1.828 -3.296 -5.678 1.00 0.19 O ATOM 762 CB ILE A 522 4.557 -4.261 -5.444 1.00 0.28 C ATOM 763 CG1 ILE A 522 6.080 -4.337 -5.555 1.00 0.33 C ATOM 764 CG2 ILE A 522 3.983 -5.643 -5.185 1.00 0.31 C ATOM 765 CD1 ILE A 522 6.769 -4.733 -4.267 1.00 0.39 C ATOM 0 H ILE A 522 4.475 -1.763 -6.024 1.00 0.25 H new ATOM 0 HA ILE A 522 4.294 -4.238 -7.582 1.00 0.25 H new ATOM 0 HB ILE A 522 4.295 -3.616 -4.605 1.00 0.28 H new ATOM 0 HG12 ILE A 522 6.343 -5.055 -6.332 1.00 0.33 H new ATOM 0 HG13 ILE A 522 6.460 -3.367 -5.876 1.00 0.33 H new ATOM 0 HG21 ILE A 522 4.420 -6.054 -4.274 1.00 0.31 H new ATOM 0 HG22 ILE A 522 2.902 -5.572 -5.069 1.00 0.31 H new ATOM 0 HG23 ILE A 522 4.215 -6.297 -6.026 1.00 0.31 H new ATOM 0 HD11 ILE A 522 7.847 -4.765 -4.426 1.00 0.39 H new ATOM 0 HD12 ILE A 522 6.538 -4.003 -3.491 1.00 0.39 H new ATOM 0 HD13 ILE A 522 6.419 -5.717 -3.955 1.00 0.39 H new ATOM 777 N GLU A 523 1.832 -4.162 -7.751 1.00 0.23 N ATOM 778 CA GLU A 523 0.385 -4.311 -7.834 1.00 0.21 C ATOM 779 C GLU A 523 -0.087 -5.466 -6.949 1.00 0.22 C ATOM 780 O GLU A 523 0.399 -6.593 -7.072 1.00 0.26 O ATOM 781 CB GLU A 523 -0.017 -4.560 -9.286 1.00 0.25 C ATOM 782 CG GLU A 523 -1.446 -5.050 -9.453 1.00 0.27 C ATOM 783 CD GLU A 523 -1.684 -5.719 -10.790 1.00 0.36 C ATOM 784 OE1 GLU A 523 -1.329 -6.908 -10.933 1.00 0.60 O ATOM 785 OE2 GLU A 523 -2.232 -5.068 -11.704 1.00 0.50 O ATOM 0 H GLU A 523 2.328 -4.444 -8.597 1.00 0.23 H new ATOM 0 HA GLU A 523 -0.088 -3.395 -7.480 1.00 0.21 H new ATOM 0 HB2 GLU A 523 0.109 -3.636 -9.851 1.00 0.25 H new ATOM 0 HB3 GLU A 523 0.662 -5.294 -9.720 1.00 0.25 H new ATOM 0 HG2 GLU A 523 -1.680 -5.753 -8.653 1.00 0.27 H new ATOM 0 HG3 GLU A 523 -2.129 -4.207 -9.347 1.00 0.27 H new ATOM 792 N PHE A 524 -1.025 -5.178 -6.061 1.00 0.20 N ATOM 793 CA PHE A 524 -1.591 -6.183 -5.178 1.00 0.22 C ATOM 794 C PHE A 524 -3.080 -5.929 -4.986 1.00 0.20 C ATOM 795 O PHE A 524 -3.536 -4.786 -5.022 1.00 0.17 O ATOM 796 CB PHE A 524 -0.877 -6.185 -3.815 1.00 0.24 C ATOM 797 CG PHE A 524 -0.993 -4.896 -3.044 1.00 0.20 C ATOM 798 CD1 PHE A 524 -0.165 -3.825 -3.340 1.00 0.19 C ATOM 799 CD2 PHE A 524 -1.936 -4.748 -2.038 1.00 0.22 C ATOM 800 CE1 PHE A 524 -0.273 -2.636 -2.649 1.00 0.18 C ATOM 801 CE2 PHE A 524 -2.049 -3.559 -1.346 1.00 0.22 C ATOM 802 CZ PHE A 524 -1.199 -2.534 -1.595 1.00 0.18 C ATOM 0 H PHE A 524 -1.414 -4.244 -5.933 1.00 0.20 H new ATOM 0 HA PHE A 524 -1.449 -7.161 -5.639 1.00 0.22 H new ATOM 0 HB2 PHE A 524 -1.283 -6.994 -3.208 1.00 0.24 H new ATOM 0 HB3 PHE A 524 0.179 -6.405 -3.973 1.00 0.24 H new ATOM 0 HD1 PHE A 524 0.574 -3.922 -4.121 1.00 0.19 H new ATOM 0 HD2 PHE A 524 -2.589 -5.572 -1.793 1.00 0.22 H new ATOM 0 HE1 PHE A 524 0.347 -1.792 -2.914 1.00 0.18 H new ATOM 0 HE2 PHE A 524 -2.821 -3.445 -0.600 1.00 0.22 H new ATOM 0 HZ PHE A 524 -1.232 -1.642 -0.987 1.00 0.18 H new ATOM 812 N SER A 525 -3.837 -6.993 -4.796 1.00 0.25 N ATOM 813 CA SER A 525 -5.255 -6.870 -4.517 1.00 0.25 C ATOM 814 C SER A 525 -5.464 -6.773 -3.015 1.00 0.25 C ATOM 815 O SER A 525 -4.811 -7.482 -2.250 1.00 0.33 O ATOM 816 CB SER A 525 -6.011 -8.067 -5.092 1.00 0.32 C ATOM 817 OG SER A 525 -5.804 -8.164 -6.492 1.00 1.24 O ATOM 0 H SER A 525 -3.493 -7.953 -4.830 1.00 0.25 H new ATOM 0 HA SER A 525 -5.643 -5.967 -4.988 1.00 0.25 H new ATOM 0 HB2 SER A 525 -5.676 -8.983 -4.605 1.00 0.32 H new ATOM 0 HB3 SER A 525 -7.076 -7.966 -4.883 1.00 0.32 H new ATOM 0 HG SER A 525 -6.294 -8.937 -6.842 1.00 1.24 H new ATOM 823 N PHE A 526 -6.355 -5.895 -2.582 1.00 0.22 N ATOM 824 CA PHE A 526 -6.559 -5.700 -1.163 1.00 0.22 C ATOM 825 C PHE A 526 -8.001 -5.951 -0.799 1.00 0.26 C ATOM 826 O PHE A 526 -8.893 -5.192 -1.185 1.00 0.27 O ATOM 827 CB PHE A 526 -6.163 -4.285 -0.742 1.00 0.19 C ATOM 828 CG PHE A 526 -5.981 -4.134 0.742 1.00 0.19 C ATOM 829 CD1 PHE A 526 -4.774 -4.458 1.335 1.00 0.20 C ATOM 830 CD2 PHE A 526 -7.008 -3.666 1.539 1.00 0.22 C ATOM 831 CE1 PHE A 526 -4.596 -4.319 2.699 1.00 0.22 C ATOM 832 CE2 PHE A 526 -6.836 -3.522 2.904 1.00 0.22 C ATOM 833 CZ PHE A 526 -5.627 -3.848 3.485 1.00 0.21 C ATOM 0 H PHE A 526 -6.939 -5.316 -3.186 1.00 0.22 H new ATOM 0 HA PHE A 526 -5.925 -6.412 -0.634 1.00 0.22 H new ATOM 0 HB2 PHE A 526 -5.235 -4.010 -1.244 1.00 0.19 H new ATOM 0 HB3 PHE A 526 -6.928 -3.586 -1.080 1.00 0.19 H new ATOM 0 HD1 PHE A 526 -3.961 -4.824 0.725 1.00 0.20 H new ATOM 0 HD2 PHE A 526 -7.957 -3.409 1.091 1.00 0.22 H new ATOM 0 HE1 PHE A 526 -3.649 -4.579 3.149 1.00 0.22 H new ATOM 0 HE2 PHE A 526 -7.647 -3.155 3.515 1.00 0.22 H new ATOM 0 HZ PHE A 526 -5.489 -3.735 4.550 1.00 0.21 H new ATOM 843 N ASP A 527 -8.228 -7.028 -0.078 1.00 0.30 N ATOM 844 CA ASP A 527 -9.538 -7.296 0.467 1.00 0.35 C ATOM 845 C ASP A 527 -9.688 -6.536 1.772 1.00 0.35 C ATOM 846 O ASP A 527 -8.957 -6.778 2.730 1.00 0.36 O ATOM 847 CB ASP A 527 -9.735 -8.787 0.692 1.00 0.42 C ATOM 848 CG ASP A 527 -11.192 -9.148 0.885 1.00 0.49 C ATOM 849 OD1 ASP A 527 -11.766 -8.771 1.925 1.00 0.48 O ATOM 850 OD2 ASP A 527 -11.771 -9.799 -0.008 1.00 0.58 O ATOM 0 H ASP A 527 -7.522 -7.730 0.143 1.00 0.30 H new ATOM 0 HA ASP A 527 -10.299 -6.966 -0.240 1.00 0.35 H new ATOM 0 HB2 ASP A 527 -9.336 -9.337 -0.160 1.00 0.42 H new ATOM 0 HB3 ASP A 527 -9.166 -9.099 1.568 1.00 0.42 H new ATOM 855 N LEU A 528 -10.630 -5.619 1.797 1.00 0.37 N ATOM 856 CA LEU A 528 -10.792 -4.705 2.912 1.00 0.39 C ATOM 857 C LEU A 528 -11.370 -5.406 4.139 1.00 0.43 C ATOM 858 O LEU A 528 -11.426 -4.828 5.227 1.00 0.51 O ATOM 859 CB LEU A 528 -11.689 -3.550 2.476 1.00 0.40 C ATOM 860 CG LEU A 528 -11.138 -2.713 1.317 1.00 0.37 C ATOM 861 CD1 LEU A 528 -12.209 -1.786 0.782 1.00 0.41 C ATOM 862 CD2 LEU A 528 -9.930 -1.908 1.759 1.00 0.32 C ATOM 0 H LEU A 528 -11.307 -5.484 1.046 1.00 0.37 H new ATOM 0 HA LEU A 528 -9.812 -4.324 3.199 1.00 0.39 H new ATOM 0 HB2 LEU A 528 -12.660 -3.951 2.187 1.00 0.40 H new ATOM 0 HB3 LEU A 528 -11.857 -2.895 3.331 1.00 0.40 H new ATOM 0 HG LEU A 528 -10.829 -3.394 0.524 1.00 0.37 H new ATOM 0 HD11 LEU A 528 -11.803 -1.198 -0.041 1.00 0.41 H new ATOM 0 HD12 LEU A 528 -13.054 -2.374 0.425 1.00 0.41 H new ATOM 0 HD13 LEU A 528 -12.542 -1.118 1.576 1.00 0.41 H new ATOM 0 HD21 LEU A 528 -9.556 -1.322 0.919 1.00 0.32 H new ATOM 0 HD22 LEU A 528 -10.216 -1.238 2.570 1.00 0.32 H new ATOM 0 HD23 LEU A 528 -9.149 -2.585 2.105 1.00 0.32 H new ATOM 874 N GLU A 529 -11.790 -6.650 3.959 1.00 0.44 N ATOM 875 CA GLU A 529 -12.343 -7.439 5.047 1.00 0.50 C ATOM 876 C GLU A 529 -11.420 -8.605 5.390 1.00 0.50 C ATOM 877 O GLU A 529 -11.134 -8.864 6.559 1.00 0.59 O ATOM 878 CB GLU A 529 -13.731 -7.951 4.661 1.00 0.56 C ATOM 879 CG GLU A 529 -14.768 -6.849 4.532 1.00 0.81 C ATOM 880 CD GLU A 529 -15.153 -6.251 5.867 1.00 1.54 C ATOM 881 OE1 GLU A 529 -14.362 -5.457 6.411 1.00 2.18 O ATOM 882 OE2 GLU A 529 -16.246 -6.563 6.382 1.00 2.09 O ATOM 0 H GLU A 529 -11.757 -7.136 3.063 1.00 0.44 H new ATOM 0 HA GLU A 529 -12.431 -6.806 5.930 1.00 0.50 H new ATOM 0 HB2 GLU A 529 -13.662 -8.487 3.714 1.00 0.56 H new ATOM 0 HB3 GLU A 529 -14.066 -8.669 5.410 1.00 0.56 H new ATOM 0 HG2 GLU A 529 -14.378 -6.063 3.885 1.00 0.81 H new ATOM 0 HG3 GLU A 529 -15.659 -7.249 4.047 1.00 0.81 H new ATOM 889 N ARG A 530 -10.945 -9.290 4.362 1.00 0.46 N ATOM 890 CA ARG A 530 -10.090 -10.454 4.524 1.00 0.49 C ATOM 891 C ARG A 530 -8.627 -10.061 4.735 1.00 0.44 C ATOM 892 O ARG A 530 -7.979 -10.527 5.674 1.00 0.49 O ATOM 893 CB ARG A 530 -10.215 -11.348 3.290 1.00 0.53 C ATOM 894 CG ARG A 530 -8.946 -12.103 2.967 1.00 0.97 C ATOM 895 CD ARG A 530 -9.036 -12.825 1.634 1.00 1.44 C ATOM 896 NE ARG A 530 -7.712 -13.174 1.127 1.00 2.29 N ATOM 897 CZ ARG A 530 -7.491 -13.974 0.086 1.00 3.07 C ATOM 898 NH1 ARG A 530 -8.507 -14.551 -0.543 1.00 3.22 N ATOM 899 NH2 ARG A 530 -6.248 -14.208 -0.316 1.00 4.10 N ATOM 0 H ARG A 530 -11.142 -9.053 3.390 1.00 0.46 H new ATOM 0 HA ARG A 530 -10.416 -10.993 5.413 1.00 0.49 H new ATOM 0 HB2 ARG A 530 -11.024 -12.062 3.447 1.00 0.53 H new ATOM 0 HB3 ARG A 530 -10.493 -10.735 2.433 1.00 0.53 H new ATOM 0 HG2 ARG A 530 -8.106 -11.408 2.947 1.00 0.97 H new ATOM 0 HG3 ARG A 530 -8.743 -12.826 3.757 1.00 0.97 H new ATOM 0 HD2 ARG A 530 -9.634 -13.729 1.748 1.00 1.44 H new ATOM 0 HD3 ARG A 530 -9.550 -12.193 0.910 1.00 1.44 H new ATOM 0 HE ARG A 530 -6.901 -12.778 1.603 1.00 2.29 H new ATOM 0 HH11 ARG A 530 -9.463 -14.382 -0.229 1.00 3.22 H new ATOM 0 HH12 ARG A 530 -8.332 -15.163 -1.340 1.00 3.22 H new ATOM 0 HH21 ARG A 530 -5.464 -13.775 0.172 1.00 4.10 H new ATOM 0 HH22 ARG A 530 -6.077 -14.821 -1.113 1.00 4.10 H new ATOM 913 N ASP A 531 -8.112 -9.202 3.869 1.00 0.36 N ATOM 914 CA ASP A 531 -6.686 -8.908 3.858 1.00 0.32 C ATOM 915 C ASP A 531 -6.336 -7.822 4.855 1.00 0.25 C ATOM 916 O ASP A 531 -7.094 -6.874 5.062 1.00 0.27 O ATOM 917 CB ASP A 531 -6.204 -8.505 2.463 1.00 0.34 C ATOM 918 CG ASP A 531 -6.080 -9.685 1.521 1.00 0.39 C ATOM 919 OD1 ASP A 531 -5.428 -10.684 1.896 1.00 0.61 O ATOM 920 OD2 ASP A 531 -6.609 -9.610 0.394 1.00 0.39 O ATOM 0 H ASP A 531 -8.656 -8.698 3.168 1.00 0.36 H new ATOM 0 HA ASP A 531 -6.175 -9.826 4.148 1.00 0.32 H new ATOM 0 HB2 ASP A 531 -6.898 -7.779 2.039 1.00 0.34 H new ATOM 0 HB3 ASP A 531 -5.237 -8.010 2.547 1.00 0.34 H new ATOM 925 N VAL A 532 -5.184 -7.981 5.473 1.00 0.23 N ATOM 926 CA VAL A 532 -4.674 -7.015 6.426 1.00 0.19 C ATOM 927 C VAL A 532 -3.419 -6.361 5.859 1.00 0.17 C ATOM 928 O VAL A 532 -2.615 -7.044 5.231 1.00 0.19 O ATOM 929 CB VAL A 532 -4.371 -7.693 7.786 1.00 0.25 C ATOM 930 CG1 VAL A 532 -3.605 -6.772 8.727 1.00 0.28 C ATOM 931 CG2 VAL A 532 -5.669 -8.141 8.433 1.00 0.28 C ATOM 0 H VAL A 532 -4.573 -8.785 5.329 1.00 0.23 H new ATOM 0 HA VAL A 532 -5.431 -6.249 6.598 1.00 0.19 H new ATOM 0 HB VAL A 532 -3.737 -8.558 7.593 1.00 0.25 H new ATOM 0 HG11 VAL A 532 -3.415 -7.289 9.667 1.00 0.28 H new ATOM 0 HG12 VAL A 532 -2.657 -6.491 8.269 1.00 0.28 H new ATOM 0 HG13 VAL A 532 -4.195 -5.876 8.919 1.00 0.28 H new ATOM 0 HG21 VAL A 532 -5.453 -8.618 9.389 1.00 0.28 H new ATOM 0 HG22 VAL A 532 -6.312 -7.276 8.595 1.00 0.28 H new ATOM 0 HG23 VAL A 532 -6.175 -8.852 7.779 1.00 0.28 H new ATOM 941 N PRO A 533 -3.253 -5.039 6.022 1.00 0.17 N ATOM 942 CA PRO A 533 -2.110 -4.314 5.453 1.00 0.18 C ATOM 943 C PRO A 533 -0.776 -5.016 5.714 1.00 0.14 C ATOM 944 O PRO A 533 -0.001 -5.262 4.785 1.00 0.18 O ATOM 945 CB PRO A 533 -2.162 -2.956 6.156 1.00 0.23 C ATOM 946 CG PRO A 533 -3.583 -2.778 6.565 1.00 0.24 C ATOM 947 CD PRO A 533 -4.165 -4.150 6.764 1.00 0.18 C ATOM 0 HA PRO A 533 -2.174 -4.245 4.367 1.00 0.18 H new ATOM 0 HB2 PRO A 533 -1.499 -2.935 7.021 1.00 0.23 H new ATOM 0 HB3 PRO A 533 -1.842 -2.156 5.489 1.00 0.23 H new ATOM 0 HG2 PRO A 533 -3.648 -2.196 7.484 1.00 0.24 H new ATOM 0 HG3 PRO A 533 -4.137 -2.232 5.802 1.00 0.24 H new ATOM 0 HD2 PRO A 533 -4.208 -4.415 7.820 1.00 0.18 H new ATOM 0 HD3 PRO A 533 -5.183 -4.211 6.378 1.00 0.18 H new ATOM 955 N GLU A 534 -0.527 -5.367 6.974 1.00 0.17 N ATOM 956 CA GLU A 534 0.699 -6.059 7.343 1.00 0.17 C ATOM 957 C GLU A 534 0.749 -7.464 6.754 1.00 0.16 C ATOM 958 O GLU A 534 1.828 -7.985 6.476 1.00 0.20 O ATOM 959 CB GLU A 534 0.847 -6.118 8.861 1.00 0.22 C ATOM 960 CG GLU A 534 1.151 -4.770 9.490 1.00 0.37 C ATOM 961 CD GLU A 534 1.510 -4.872 10.956 1.00 1.23 C ATOM 962 OE1 GLU A 534 0.592 -4.973 11.793 1.00 1.11 O ATOM 963 OE2 GLU A 534 2.715 -4.838 11.276 1.00 2.34 O ATOM 0 H GLU A 534 -1.159 -5.182 7.753 1.00 0.17 H new ATOM 0 HA GLU A 534 1.532 -5.492 6.928 1.00 0.17 H new ATOM 0 HB2 GLU A 534 -0.072 -6.513 9.293 1.00 0.22 H new ATOM 0 HB3 GLU A 534 1.644 -6.817 9.114 1.00 0.22 H new ATOM 0 HG2 GLU A 534 1.974 -4.301 8.951 1.00 0.37 H new ATOM 0 HG3 GLU A 534 0.284 -4.119 9.378 1.00 0.37 H new ATOM 970 N ASP A 535 -0.414 -8.060 6.539 1.00 0.19 N ATOM 971 CA ASP A 535 -0.491 -9.407 5.986 1.00 0.21 C ATOM 972 C ASP A 535 -0.073 -9.396 4.526 1.00 0.19 C ATOM 973 O ASP A 535 0.669 -10.261 4.071 1.00 0.21 O ATOM 974 CB ASP A 535 -1.907 -9.962 6.111 1.00 0.26 C ATOM 975 CG ASP A 535 -2.005 -11.403 5.654 1.00 0.70 C ATOM 976 OD1 ASP A 535 -1.641 -12.308 6.433 1.00 1.00 O ATOM 977 OD2 ASP A 535 -2.430 -11.632 4.503 1.00 1.09 O ATOM 0 H ASP A 535 -1.319 -7.633 6.739 1.00 0.19 H new ATOM 0 HA ASP A 535 0.186 -10.048 6.551 1.00 0.21 H new ATOM 0 HB2 ASP A 535 -2.232 -9.890 7.149 1.00 0.26 H new ATOM 0 HB3 ASP A 535 -2.588 -9.349 5.520 1.00 0.26 H new ATOM 982 N VAL A 536 -0.546 -8.390 3.803 1.00 0.18 N ATOM 983 CA VAL A 536 -0.179 -8.214 2.408 1.00 0.18 C ATOM 984 C VAL A 536 1.319 -7.984 2.280 1.00 0.15 C ATOM 985 O VAL A 536 1.972 -8.546 1.401 1.00 0.17 O ATOM 986 CB VAL A 536 -0.935 -7.035 1.766 1.00 0.21 C ATOM 987 CG1 VAL A 536 -0.455 -6.803 0.340 1.00 0.26 C ATOM 988 CG2 VAL A 536 -2.431 -7.290 1.788 1.00 0.28 C ATOM 0 H VAL A 536 -1.187 -7.682 4.163 1.00 0.18 H new ATOM 0 HA VAL A 536 -0.456 -9.127 1.881 1.00 0.18 H new ATOM 0 HB VAL A 536 -0.728 -6.137 2.348 1.00 0.21 H new ATOM 0 HG11 VAL A 536 -1.001 -5.966 -0.096 1.00 0.26 H new ATOM 0 HG12 VAL A 536 0.611 -6.576 0.347 1.00 0.26 H new ATOM 0 HG13 VAL A 536 -0.631 -7.700 -0.254 1.00 0.26 H new ATOM 0 HG21 VAL A 536 -2.950 -6.448 1.331 1.00 0.28 H new ATOM 0 HG22 VAL A 536 -2.653 -8.200 1.230 1.00 0.28 H new ATOM 0 HG23 VAL A 536 -2.765 -7.406 2.819 1.00 0.28 H new ATOM 998 N ALA A 537 1.865 -7.173 3.176 1.00 0.14 N ATOM 999 CA ALA A 537 3.293 -6.915 3.183 1.00 0.12 C ATOM 1000 C ALA A 537 4.068 -8.193 3.500 1.00 0.12 C ATOM 1001 O ALA A 537 5.197 -8.363 3.057 1.00 0.17 O ATOM 1002 CB ALA A 537 3.640 -5.809 4.165 1.00 0.13 C ATOM 0 H ALA A 537 1.341 -6.686 3.903 1.00 0.14 H new ATOM 0 HA ALA A 537 3.584 -6.579 2.188 1.00 0.12 H new ATOM 0 HB1 ALA A 537 4.716 -5.635 4.151 1.00 0.13 H new ATOM 0 HB2 ALA A 537 3.121 -4.894 3.881 1.00 0.13 H new ATOM 0 HB3 ALA A 537 3.333 -6.104 5.168 1.00 0.13 H new ATOM 1008 N GLN A 538 3.451 -9.093 4.266 1.00 0.13 N ATOM 1009 CA GLN A 538 4.042 -10.403 4.528 1.00 0.16 C ATOM 1010 C GLN A 538 4.132 -11.200 3.238 1.00 0.15 C ATOM 1011 O GLN A 538 5.165 -11.794 2.937 1.00 0.17 O ATOM 1012 CB GLN A 538 3.229 -11.184 5.561 1.00 0.22 C ATOM 1013 CG GLN A 538 3.396 -10.671 6.976 1.00 0.48 C ATOM 1014 CD GLN A 538 4.808 -10.848 7.500 1.00 0.59 C ATOM 1015 OE1 GLN A 538 5.289 -10.041 8.289 1.00 1.08 O ATOM 1016 NE2 GLN A 538 5.475 -11.912 7.079 1.00 0.47 N ATOM 0 H GLN A 538 2.547 -8.939 4.713 1.00 0.13 H new ATOM 0 HA GLN A 538 5.042 -10.245 4.931 1.00 0.16 H new ATOM 0 HB2 GLN A 538 2.174 -11.140 5.290 1.00 0.22 H new ATOM 0 HB3 GLN A 538 3.524 -12.233 5.526 1.00 0.22 H new ATOM 0 HG2 GLN A 538 3.131 -9.614 7.009 1.00 0.48 H new ATOM 0 HG3 GLN A 538 2.701 -11.195 7.632 1.00 0.48 H new ATOM 0 HE21 GLN A 538 5.040 -12.560 6.422 1.00 0.47 H new ATOM 0 HE22 GLN A 538 6.424 -12.084 7.412 1.00 0.47 H new ATOM 1025 N GLU A 539 3.043 -11.194 2.476 1.00 0.16 N ATOM 1026 CA GLU A 539 3.019 -11.838 1.168 1.00 0.20 C ATOM 1027 C GLU A 539 4.114 -11.243 0.298 1.00 0.19 C ATOM 1028 O GLU A 539 4.865 -11.961 -0.358 1.00 0.25 O ATOM 1029 CB GLU A 539 1.661 -11.629 0.487 1.00 0.29 C ATOM 1030 CG GLU A 539 0.458 -11.946 1.363 1.00 0.65 C ATOM 1031 CD GLU A 539 0.233 -13.429 1.554 1.00 1.45 C ATOM 1032 OE1 GLU A 539 0.899 -14.034 2.417 1.00 2.07 O ATOM 1033 OE2 GLU A 539 -0.631 -13.995 0.850 1.00 1.88 O ATOM 0 H GLU A 539 2.164 -10.750 2.743 1.00 0.16 H new ATOM 0 HA GLU A 539 3.183 -12.908 1.300 1.00 0.20 H new ATOM 0 HB2 GLU A 539 1.591 -10.593 0.157 1.00 0.29 H new ATOM 0 HB3 GLU A 539 1.618 -12.252 -0.406 1.00 0.29 H new ATOM 0 HG2 GLU A 539 0.593 -11.477 2.338 1.00 0.65 H new ATOM 0 HG3 GLU A 539 -0.434 -11.504 0.918 1.00 0.65 H new ATOM 1040 N MET A 540 4.204 -9.919 0.331 1.00 0.16 N ATOM 1041 CA MET A 540 5.227 -9.187 -0.399 1.00 0.16 C ATOM 1042 C MET A 540 6.622 -9.684 -0.040 1.00 0.16 C ATOM 1043 O MET A 540 7.460 -9.906 -0.917 1.00 0.19 O ATOM 1044 CB MET A 540 5.118 -7.704 -0.098 1.00 0.14 C ATOM 1045 CG MET A 540 3.898 -7.071 -0.715 1.00 0.18 C ATOM 1046 SD MET A 540 3.753 -5.324 -0.338 1.00 0.19 S ATOM 1047 CE MET A 540 2.454 -4.912 -1.485 1.00 0.25 C ATOM 0 H MET A 540 3.570 -9.325 0.865 1.00 0.16 H new ATOM 0 HA MET A 540 5.067 -9.355 -1.464 1.00 0.16 H new ATOM 0 HB2 MET A 540 5.091 -7.558 0.982 1.00 0.14 H new ATOM 0 HB3 MET A 540 6.010 -7.197 -0.466 1.00 0.14 H new ATOM 0 HG2 MET A 540 3.934 -7.202 -1.796 1.00 0.18 H new ATOM 0 HG3 MET A 540 3.007 -7.589 -0.360 1.00 0.18 H new ATOM 0 HE1 MET A 540 1.952 -4.002 -1.155 1.00 0.25 H new ATOM 0 HE2 MET A 540 2.880 -4.752 -2.475 1.00 0.25 H new ATOM 0 HE3 MET A 540 1.733 -5.729 -1.527 1.00 0.25 H new ATOM 1057 N VAL A 541 6.861 -9.856 1.253 1.00 0.14 N ATOM 1058 CA VAL A 541 8.141 -10.354 1.738 1.00 0.16 C ATOM 1059 C VAL A 541 8.382 -11.784 1.266 1.00 0.20 C ATOM 1060 O VAL A 541 9.426 -12.084 0.691 1.00 0.24 O ATOM 1061 CB VAL A 541 8.225 -10.297 3.283 1.00 0.18 C ATOM 1062 CG1 VAL A 541 9.540 -10.879 3.788 1.00 0.23 C ATOM 1063 CG2 VAL A 541 8.062 -8.868 3.770 1.00 0.16 C ATOM 0 H VAL A 541 6.182 -9.657 1.988 1.00 0.14 H new ATOM 0 HA VAL A 541 8.914 -9.706 1.326 1.00 0.16 H new ATOM 0 HB VAL A 541 7.412 -10.903 3.684 1.00 0.18 H new ATOM 0 HG11 VAL A 541 9.568 -10.824 4.876 1.00 0.23 H new ATOM 0 HG12 VAL A 541 9.621 -11.920 3.475 1.00 0.23 H new ATOM 0 HG13 VAL A 541 10.372 -10.310 3.375 1.00 0.23 H new ATOM 0 HG21 VAL A 541 8.123 -8.845 4.858 1.00 0.16 H new ATOM 0 HG22 VAL A 541 8.853 -8.248 3.349 1.00 0.16 H new ATOM 0 HG23 VAL A 541 7.092 -8.484 3.453 1.00 0.16 H new ATOM 1073 N GLU A 542 7.399 -12.650 1.475 1.00 0.20 N ATOM 1074 CA GLU A 542 7.558 -14.067 1.175 1.00 0.26 C ATOM 1075 C GLU A 542 7.714 -14.318 -0.320 1.00 0.28 C ATOM 1076 O GLU A 542 8.488 -15.180 -0.730 1.00 0.36 O ATOM 1077 CB GLU A 542 6.372 -14.860 1.716 1.00 0.31 C ATOM 1078 CG GLU A 542 6.235 -14.775 3.228 1.00 0.34 C ATOM 1079 CD GLU A 542 5.223 -15.753 3.782 1.00 0.51 C ATOM 1080 OE1 GLU A 542 5.567 -16.940 3.947 1.00 0.77 O ATOM 1081 OE2 GLU A 542 4.078 -15.340 4.064 1.00 0.77 O ATOM 0 H GLU A 542 6.485 -12.397 1.850 1.00 0.20 H new ATOM 0 HA GLU A 542 8.472 -14.403 1.665 1.00 0.26 H new ATOM 0 HB2 GLU A 542 5.456 -14.493 1.253 1.00 0.31 H new ATOM 0 HB3 GLU A 542 6.479 -15.905 1.425 1.00 0.31 H new ATOM 0 HG2 GLU A 542 7.205 -14.964 3.687 1.00 0.34 H new ATOM 0 HG3 GLU A 542 5.944 -13.762 3.505 1.00 0.34 H new ATOM 1088 N SER A 543 6.995 -13.552 -1.130 1.00 0.27 N ATOM 1089 CA SER A 543 7.024 -13.740 -2.574 1.00 0.32 C ATOM 1090 C SER A 543 8.328 -13.225 -3.192 1.00 0.32 C ATOM 1091 O SER A 543 8.619 -13.497 -4.357 1.00 0.43 O ATOM 1092 CB SER A 543 5.822 -13.051 -3.219 1.00 0.37 C ATOM 1093 OG SER A 543 4.604 -13.574 -2.713 1.00 1.22 O ATOM 0 H SER A 543 6.387 -12.797 -0.813 1.00 0.27 H new ATOM 0 HA SER A 543 6.972 -14.811 -2.768 1.00 0.32 H new ATOM 0 HB2 SER A 543 5.868 -11.979 -3.029 1.00 0.37 H new ATOM 0 HB3 SER A 543 5.858 -13.185 -4.300 1.00 0.37 H new ATOM 0 HG SER A 543 4.414 -13.173 -1.839 1.00 1.22 H new ATOM 1099 N GLY A 544 9.107 -12.480 -2.417 1.00 0.27 N ATOM 1100 CA GLY A 544 10.390 -12.007 -2.904 1.00 0.30 C ATOM 1101 C GLY A 544 10.345 -10.588 -3.437 1.00 0.32 C ATOM 1102 O GLY A 544 11.251 -10.155 -4.150 1.00 0.54 O ATOM 0 H GLY A 544 8.876 -12.196 -1.465 1.00 0.27 H new ATOM 0 HA2 GLY A 544 11.119 -12.061 -2.096 1.00 0.30 H new ATOM 0 HA3 GLY A 544 10.739 -12.673 -3.693 1.00 0.30 H new ATOM 1106 N TYR A 545 9.291 -9.859 -3.098 1.00 0.21 N ATOM 1107 CA TYR A 545 9.165 -8.469 -3.511 1.00 0.21 C ATOM 1108 C TYR A 545 9.757 -7.544 -2.458 1.00 0.19 C ATOM 1109 O TYR A 545 10.611 -6.710 -2.754 1.00 0.27 O ATOM 1110 CB TYR A 545 7.699 -8.101 -3.736 1.00 0.23 C ATOM 1111 CG TYR A 545 7.068 -8.754 -4.944 1.00 0.29 C ATOM 1112 CD1 TYR A 545 7.440 -8.386 -6.231 1.00 0.35 C ATOM 1113 CD2 TYR A 545 6.090 -9.727 -4.798 1.00 0.36 C ATOM 1114 CE1 TYR A 545 6.856 -8.974 -7.338 1.00 0.43 C ATOM 1115 CE2 TYR A 545 5.500 -10.318 -5.898 1.00 0.44 C ATOM 1116 CZ TYR A 545 5.886 -9.937 -7.166 1.00 0.47 C ATOM 1117 OH TYR A 545 5.296 -10.520 -8.267 1.00 0.56 O ATOM 0 H TYR A 545 8.512 -10.207 -2.539 1.00 0.21 H new ATOM 0 HA TYR A 545 9.711 -8.349 -4.447 1.00 0.21 H new ATOM 0 HB2 TYR A 545 7.128 -8.377 -2.850 1.00 0.23 H new ATOM 0 HB3 TYR A 545 7.621 -7.019 -3.841 1.00 0.23 H new ATOM 0 HD1 TYR A 545 8.197 -7.629 -6.369 1.00 0.35 H new ATOM 0 HD2 TYR A 545 5.785 -10.028 -3.807 1.00 0.36 H new ATOM 0 HE1 TYR A 545 7.159 -8.680 -8.332 1.00 0.43 H new ATOM 0 HE2 TYR A 545 4.740 -11.074 -5.766 1.00 0.44 H new ATOM 0 HH TYR A 545 4.634 -11.179 -7.972 1.00 0.56 H new ATOM 1127 N VAL A 546 9.301 -7.713 -1.227 1.00 0.17 N ATOM 1128 CA VAL A 546 9.686 -6.837 -0.132 1.00 0.15 C ATOM 1129 C VAL A 546 10.632 -7.553 0.832 1.00 0.16 C ATOM 1130 O VAL A 546 10.612 -8.778 0.943 1.00 0.17 O ATOM 1131 CB VAL A 546 8.430 -6.322 0.618 1.00 0.14 C ATOM 1132 CG1 VAL A 546 8.791 -5.580 1.896 1.00 0.16 C ATOM 1133 CG2 VAL A 546 7.617 -5.418 -0.297 1.00 0.14 C ATOM 0 H VAL A 546 8.657 -8.457 -0.960 1.00 0.17 H new ATOM 0 HA VAL A 546 10.214 -5.981 -0.551 1.00 0.15 H new ATOM 0 HB VAL A 546 7.836 -7.191 0.902 1.00 0.14 H new ATOM 0 HG11 VAL A 546 7.880 -5.238 2.388 1.00 0.16 H new ATOM 0 HG12 VAL A 546 9.334 -6.249 2.564 1.00 0.16 H new ATOM 0 HG13 VAL A 546 9.417 -4.721 1.654 1.00 0.16 H new ATOM 0 HG21 VAL A 546 6.736 -5.059 0.235 1.00 0.14 H new ATOM 0 HG22 VAL A 546 8.227 -4.568 -0.604 1.00 0.14 H new ATOM 0 HG23 VAL A 546 7.305 -5.978 -1.179 1.00 0.14 H new ATOM 1143 N CYS A 547 11.480 -6.779 1.496 1.00 0.19 N ATOM 1144 CA CYS A 547 12.391 -7.300 2.497 1.00 0.22 C ATOM 1145 C CYS A 547 11.720 -7.233 3.860 1.00 0.20 C ATOM 1146 O CYS A 547 10.984 -6.289 4.155 1.00 0.21 O ATOM 1147 CB CYS A 547 13.684 -6.482 2.504 1.00 0.30 C ATOM 1148 SG CYS A 547 14.894 -7.014 3.739 1.00 0.43 S ATOM 0 H CYS A 547 11.553 -5.772 1.353 1.00 0.19 H new ATOM 0 HA CYS A 547 12.639 -8.336 2.264 1.00 0.22 H new ATOM 0 HB2 CYS A 547 14.141 -6.539 1.516 1.00 0.30 H new ATOM 0 HB3 CYS A 547 13.437 -5.435 2.681 1.00 0.30 H new ATOM 0 HG CYS A 547 15.952 -6.262 3.663 1.00 0.43 H new ATOM 1154 N GLU A 548 11.977 -8.238 4.687 1.00 0.22 N ATOM 1155 CA GLU A 548 11.326 -8.355 5.986 1.00 0.24 C ATOM 1156 C GLU A 548 11.657 -7.180 6.910 1.00 0.26 C ATOM 1157 O GLU A 548 10.973 -6.960 7.908 1.00 0.37 O ATOM 1158 CB GLU A 548 11.677 -9.702 6.642 1.00 0.31 C ATOM 1159 CG GLU A 548 13.170 -10.027 6.716 1.00 1.43 C ATOM 1160 CD GLU A 548 13.944 -9.143 7.675 1.00 2.08 C ATOM 1161 OE1 GLU A 548 13.644 -9.171 8.887 1.00 2.51 O ATOM 1162 OE2 GLU A 548 14.853 -8.419 7.218 1.00 2.72 O ATOM 0 H GLU A 548 12.636 -8.988 4.480 1.00 0.22 H new ATOM 0 HA GLU A 548 10.249 -8.322 5.818 1.00 0.24 H new ATOM 0 HB2 GLU A 548 11.270 -9.711 7.653 1.00 0.31 H new ATOM 0 HB3 GLU A 548 11.176 -10.497 6.090 1.00 0.31 H new ATOM 0 HG2 GLU A 548 13.291 -11.067 7.018 1.00 1.43 H new ATOM 0 HG3 GLU A 548 13.602 -9.932 5.720 1.00 1.43 H new ATOM 1169 N GLY A 549 12.697 -6.427 6.569 1.00 0.23 N ATOM 1170 CA GLY A 549 13.076 -5.277 7.369 1.00 0.27 C ATOM 1171 C GLY A 549 12.251 -4.045 7.049 1.00 0.23 C ATOM 1172 O GLY A 549 12.249 -3.076 7.812 1.00 0.32 O ATOM 0 H GLY A 549 13.285 -6.593 5.752 1.00 0.23 H new ATOM 0 HA2 GLY A 549 12.963 -5.521 8.425 1.00 0.27 H new ATOM 0 HA3 GLY A 549 14.131 -5.056 7.204 1.00 0.27 H new ATOM 1176 N ASP A 550 11.541 -4.079 5.928 1.00 0.17 N ATOM 1177 CA ASP A 550 10.726 -2.948 5.504 1.00 0.22 C ATOM 1178 C ASP A 550 9.246 -3.307 5.544 1.00 0.16 C ATOM 1179 O ASP A 550 8.411 -2.602 4.978 1.00 0.20 O ATOM 1180 CB ASP A 550 11.112 -2.502 4.092 1.00 0.35 C ATOM 1181 CG ASP A 550 12.517 -1.941 4.011 1.00 0.77 C ATOM 1182 OD1 ASP A 550 12.786 -0.886 4.628 1.00 0.79 O ATOM 1183 OD2 ASP A 550 13.361 -2.540 3.314 1.00 1.23 O ATOM 0 H ASP A 550 11.513 -4.879 5.296 1.00 0.17 H new ATOM 0 HA ASP A 550 10.909 -2.125 6.195 1.00 0.22 H new ATOM 0 HB2 ASP A 550 11.026 -3.350 3.413 1.00 0.35 H new ATOM 0 HB3 ASP A 550 10.405 -1.746 3.750 1.00 0.35 H new ATOM 1188 N HIS A 551 8.930 -4.401 6.228 1.00 0.15 N ATOM 1189 CA HIS A 551 7.556 -4.894 6.325 1.00 0.16 C ATOM 1190 C HIS A 551 6.616 -3.820 6.874 1.00 0.17 C ATOM 1191 O HIS A 551 5.551 -3.575 6.308 1.00 0.21 O ATOM 1192 CB HIS A 551 7.510 -6.147 7.216 1.00 0.17 C ATOM 1193 CG HIS A 551 6.129 -6.543 7.657 1.00 0.18 C ATOM 1194 ND1 HIS A 551 5.604 -6.199 8.886 1.00 0.22 N ATOM 1195 CD2 HIS A 551 5.158 -7.235 7.020 1.00 0.21 C ATOM 1196 CE1 HIS A 551 4.373 -6.657 8.981 1.00 0.24 C ATOM 1197 NE2 HIS A 551 4.077 -7.290 7.864 1.00 0.23 N ATOM 0 H HIS A 551 9.612 -4.970 6.729 1.00 0.15 H new ATOM 0 HA HIS A 551 7.217 -5.153 5.322 1.00 0.16 H new ATOM 0 HB2 HIS A 551 7.958 -6.980 6.675 1.00 0.17 H new ATOM 0 HB3 HIS A 551 8.125 -5.973 8.099 1.00 0.17 H new ATOM 0 HD2 HIS A 551 5.221 -7.665 6.031 1.00 0.21 H new ATOM 0 HE1 HIS A 551 3.717 -6.535 9.830 1.00 0.24 H new ATOM 0 HE2 HIS A 551 3.188 -7.747 7.660 1.00 0.23 H new ATOM 1206 N LYS A 552 7.013 -3.187 7.973 1.00 0.20 N ATOM 1207 CA LYS A 552 6.175 -2.175 8.616 1.00 0.27 C ATOM 1208 C LYS A 552 5.980 -0.977 7.697 1.00 0.22 C ATOM 1209 O LYS A 552 4.891 -0.415 7.616 1.00 0.23 O ATOM 1210 CB LYS A 552 6.794 -1.716 9.937 1.00 0.41 C ATOM 1211 CG LYS A 552 6.982 -2.836 10.948 1.00 1.40 C ATOM 1212 CD LYS A 552 7.525 -2.317 12.272 1.00 1.75 C ATOM 1213 CE LYS A 552 8.870 -1.621 12.108 1.00 2.03 C ATOM 1214 NZ LYS A 552 9.897 -2.516 11.515 1.00 2.90 N ATOM 0 H LYS A 552 7.906 -3.354 8.437 1.00 0.20 H new ATOM 0 HA LYS A 552 5.204 -2.627 8.821 1.00 0.27 H new ATOM 0 HB2 LYS A 552 7.761 -1.256 9.734 1.00 0.41 H new ATOM 0 HB3 LYS A 552 6.161 -0.945 10.376 1.00 0.41 H new ATOM 0 HG2 LYS A 552 6.029 -3.337 11.117 1.00 1.40 H new ATOM 0 HG3 LYS A 552 7.666 -3.581 10.542 1.00 1.40 H new ATOM 0 HD2 LYS A 552 6.809 -1.621 12.709 1.00 1.75 H new ATOM 0 HD3 LYS A 552 7.630 -3.147 12.970 1.00 1.75 H new ATOM 0 HE2 LYS A 552 8.747 -0.742 11.475 1.00 2.03 H new ATOM 0 HE3 LYS A 552 9.215 -1.268 13.080 1.00 2.03 H new ATOM 0 HZ1 LYS A 552 10.828 -2.055 11.562 1.00 2.90 H new ATOM 0 HZ2 LYS A 552 9.926 -3.410 12.045 1.00 2.90 H new ATOM 0 HZ3 LYS A 552 9.657 -2.710 10.522 1.00 2.90 H new ATOM 1228 N THR A 553 7.044 -0.607 7.004 1.00 0.21 N ATOM 1229 CA THR A 553 7.016 0.499 6.061 1.00 0.21 C ATOM 1230 C THR A 553 6.020 0.238 4.933 1.00 0.16 C ATOM 1231 O THR A 553 5.170 1.080 4.633 1.00 0.17 O ATOM 1232 CB THR A 553 8.420 0.717 5.471 1.00 0.26 C ATOM 1233 OG1 THR A 553 9.351 0.953 6.533 1.00 0.35 O ATOM 1234 CG2 THR A 553 8.444 1.884 4.498 1.00 0.26 C ATOM 0 H THR A 553 7.952 -1.065 7.079 1.00 0.21 H new ATOM 0 HA THR A 553 6.699 1.394 6.597 1.00 0.21 H new ATOM 0 HB THR A 553 8.700 -0.181 4.920 1.00 0.26 H new ATOM 0 HG1 THR A 553 10.246 1.090 6.159 1.00 0.35 H new ATOM 0 HG21 THR A 553 9.452 2.007 4.102 1.00 0.26 H new ATOM 0 HG22 THR A 553 7.753 1.688 3.678 1.00 0.26 H new ATOM 0 HG23 THR A 553 8.144 2.795 5.015 1.00 0.26 H new ATOM 1242 N MET A 554 6.117 -0.939 4.332 1.00 0.12 N ATOM 1243 CA MET A 554 5.254 -1.307 3.220 1.00 0.12 C ATOM 1244 C MET A 554 3.807 -1.380 3.667 1.00 0.12 C ATOM 1245 O MET A 554 2.914 -0.840 3.016 1.00 0.14 O ATOM 1246 CB MET A 554 5.685 -2.650 2.644 1.00 0.13 C ATOM 1247 CG MET A 554 7.097 -2.641 2.105 1.00 0.12 C ATOM 1248 SD MET A 554 7.354 -1.376 0.852 1.00 0.13 S ATOM 1249 CE MET A 554 9.110 -1.550 0.574 1.00 0.14 C ATOM 0 H MET A 554 6.789 -1.659 4.598 1.00 0.12 H new ATOM 0 HA MET A 554 5.343 -0.541 2.449 1.00 0.12 H new ATOM 0 HB2 MET A 554 5.603 -3.413 3.418 1.00 0.13 H new ATOM 0 HB3 MET A 554 5.000 -2.932 1.845 1.00 0.13 H new ATOM 0 HG2 MET A 554 7.794 -2.479 2.927 1.00 0.12 H new ATOM 0 HG3 MET A 554 7.326 -3.619 1.681 1.00 0.12 H new ATOM 0 HE1 MET A 554 9.618 -0.633 0.873 1.00 0.14 H new ATOM 0 HE2 MET A 554 9.491 -2.385 1.162 1.00 0.14 H new ATOM 0 HE3 MET A 554 9.294 -1.738 -0.484 1.00 0.14 H new ATOM 1259 N ALA A 555 3.588 -2.040 4.793 1.00 0.12 N ATOM 1260 CA ALA A 555 2.251 -2.208 5.340 1.00 0.14 C ATOM 1261 C ALA A 555 1.625 -0.869 5.682 1.00 0.13 C ATOM 1262 O ALA A 555 0.428 -0.668 5.480 1.00 0.15 O ATOM 1263 CB ALA A 555 2.304 -3.083 6.577 1.00 0.17 C ATOM 0 H ALA A 555 4.326 -2.471 5.350 1.00 0.12 H new ATOM 0 HA ALA A 555 1.633 -2.688 4.581 1.00 0.14 H new ATOM 0 HB1 ALA A 555 1.299 -3.204 6.981 1.00 0.17 H new ATOM 0 HB2 ALA A 555 2.710 -4.060 6.314 1.00 0.17 H new ATOM 0 HB3 ALA A 555 2.942 -2.615 7.327 1.00 0.17 H new ATOM 1269 N LYS A 556 2.438 0.045 6.195 1.00 0.13 N ATOM 1270 CA LYS A 556 1.962 1.369 6.548 1.00 0.15 C ATOM 1271 C LYS A 556 1.507 2.088 5.287 1.00 0.16 C ATOM 1272 O LYS A 556 0.481 2.759 5.284 1.00 0.20 O ATOM 1273 CB LYS A 556 3.064 2.164 7.258 1.00 0.20 C ATOM 1274 CG LYS A 556 2.548 3.205 8.252 1.00 0.40 C ATOM 1275 CD LYS A 556 1.715 4.295 7.587 1.00 0.87 C ATOM 1276 CE LYS A 556 2.551 5.178 6.672 1.00 1.31 C ATOM 1277 NZ LYS A 556 3.562 5.961 7.428 1.00 1.83 N ATOM 0 H LYS A 556 3.430 -0.110 6.375 1.00 0.13 H new ATOM 0 HA LYS A 556 1.120 1.281 7.234 1.00 0.15 H new ATOM 0 HB2 LYS A 556 3.716 1.468 7.785 1.00 0.20 H new ATOM 0 HB3 LYS A 556 3.674 2.666 6.508 1.00 0.20 H new ATOM 0 HG2 LYS A 556 1.946 2.707 9.013 1.00 0.40 H new ATOM 0 HG3 LYS A 556 3.394 3.663 8.764 1.00 0.40 H new ATOM 0 HD2 LYS A 556 0.911 3.836 7.011 1.00 0.87 H new ATOM 0 HD3 LYS A 556 1.246 4.911 8.354 1.00 0.87 H new ATOM 0 HE2 LYS A 556 3.053 4.558 5.929 1.00 1.31 H new ATOM 0 HE3 LYS A 556 1.897 5.859 6.128 1.00 1.31 H new ATOM 0 HZ1 LYS A 556 4.121 6.536 6.766 1.00 1.83 H new ATOM 0 HZ2 LYS A 556 3.081 6.584 8.108 1.00 1.83 H new ATOM 0 HZ3 LYS A 556 4.192 5.311 7.940 1.00 1.83 H new ATOM 1291 N ALA A 557 2.269 1.923 4.212 1.00 0.15 N ATOM 1292 CA ALA A 557 1.901 2.489 2.921 1.00 0.16 C ATOM 1293 C ALA A 557 0.545 1.963 2.488 1.00 0.15 C ATOM 1294 O ALA A 557 -0.327 2.721 2.057 1.00 0.17 O ATOM 1295 CB ALA A 557 2.953 2.147 1.873 1.00 0.18 C ATOM 0 H ALA A 557 3.146 1.402 4.209 1.00 0.15 H new ATOM 0 HA ALA A 557 1.845 3.573 3.019 1.00 0.16 H new ATOM 0 HB1 ALA A 557 2.664 2.577 0.914 1.00 0.18 H new ATOM 0 HB2 ALA A 557 3.917 2.555 2.178 1.00 0.18 H new ATOM 0 HB3 ALA A 557 3.032 1.064 1.776 1.00 0.18 H new ATOM 1301 N ILE A 558 0.381 0.655 2.618 1.00 0.14 N ATOM 1302 CA ILE A 558 -0.864 -0.012 2.289 1.00 0.14 C ATOM 1303 C ILE A 558 -1.998 0.535 3.148 1.00 0.14 C ATOM 1304 O ILE A 558 -3.037 0.960 2.640 1.00 0.16 O ATOM 1305 CB ILE A 558 -0.733 -1.531 2.517 1.00 0.14 C ATOM 1306 CG1 ILE A 558 0.458 -2.081 1.734 1.00 0.17 C ATOM 1307 CG2 ILE A 558 -2.005 -2.246 2.115 1.00 0.18 C ATOM 1308 CD1 ILE A 558 0.727 -3.549 1.967 1.00 0.18 C ATOM 0 H ILE A 558 1.111 0.027 2.956 1.00 0.14 H new ATOM 0 HA ILE A 558 -1.087 0.174 1.239 1.00 0.14 H new ATOM 0 HB ILE A 558 -0.566 -1.707 3.580 1.00 0.14 H new ATOM 0 HG12 ILE A 558 0.285 -1.919 0.670 1.00 0.17 H new ATOM 0 HG13 ILE A 558 1.349 -1.513 2.002 1.00 0.17 H new ATOM 0 HG21 ILE A 558 -1.890 -3.317 2.284 1.00 0.18 H new ATOM 0 HG22 ILE A 558 -2.837 -1.872 2.712 1.00 0.18 H new ATOM 0 HG23 ILE A 558 -2.206 -2.065 1.059 1.00 0.18 H new ATOM 0 HD11 ILE A 558 1.588 -3.860 1.375 1.00 0.18 H new ATOM 0 HD12 ILE A 558 0.934 -3.718 3.024 1.00 0.18 H new ATOM 0 HD13 ILE A 558 -0.146 -4.130 1.671 1.00 0.18 H new ATOM 1320 N LYS A 559 -1.758 0.551 4.449 1.00 0.14 N ATOM 1321 CA LYS A 559 -2.742 0.991 5.422 1.00 0.17 C ATOM 1322 C LYS A 559 -3.122 2.447 5.179 1.00 0.18 C ATOM 1323 O LYS A 559 -4.301 2.789 5.161 1.00 0.23 O ATOM 1324 CB LYS A 559 -2.169 0.827 6.831 1.00 0.21 C ATOM 1325 CG LYS A 559 -3.201 0.518 7.900 1.00 0.34 C ATOM 1326 CD LYS A 559 -4.296 1.564 7.992 1.00 0.93 C ATOM 1327 CE LYS A 559 -5.487 1.029 8.764 1.00 1.61 C ATOM 1328 NZ LYS A 559 -5.165 0.782 10.196 1.00 2.20 N ATOM 0 H LYS A 559 -0.872 0.258 4.860 1.00 0.14 H new ATOM 0 HA LYS A 559 -3.640 0.382 5.320 1.00 0.17 H new ATOM 0 HB2 LYS A 559 -1.429 0.027 6.817 1.00 0.21 H new ATOM 0 HB3 LYS A 559 -1.644 1.742 7.105 1.00 0.21 H new ATOM 0 HG2 LYS A 559 -3.651 -0.453 7.692 1.00 0.34 H new ATOM 0 HG3 LYS A 559 -2.702 0.438 8.866 1.00 0.34 H new ATOM 0 HD2 LYS A 559 -3.911 2.458 8.482 1.00 0.93 H new ATOM 0 HD3 LYS A 559 -4.609 1.859 6.990 1.00 0.93 H new ATOM 0 HE2 LYS A 559 -6.311 1.740 8.696 1.00 1.61 H new ATOM 0 HE3 LYS A 559 -5.828 0.101 8.305 1.00 1.61 H new ATOM 0 HZ1 LYS A 559 -6.013 0.433 10.687 1.00 2.20 H new ATOM 0 HZ2 LYS A 559 -4.409 0.072 10.264 1.00 2.20 H new ATOM 0 HZ3 LYS A 559 -4.848 1.668 10.639 1.00 2.20 H new ATOM 1342 N ASP A 560 -2.115 3.289 4.982 1.00 0.20 N ATOM 1343 CA ASP A 560 -2.326 4.719 4.773 1.00 0.25 C ATOM 1344 C ASP A 560 -3.315 4.976 3.639 1.00 0.20 C ATOM 1345 O ASP A 560 -4.176 5.852 3.743 1.00 0.22 O ATOM 1346 CB ASP A 560 -0.998 5.410 4.480 1.00 0.34 C ATOM 1347 CG ASP A 560 -1.143 6.908 4.326 1.00 0.60 C ATOM 1348 OD1 ASP A 560 -1.344 7.598 5.345 1.00 0.75 O ATOM 1349 OD2 ASP A 560 -1.069 7.403 3.181 1.00 1.03 O ATOM 0 H ASP A 560 -1.136 3.004 4.962 1.00 0.20 H new ATOM 0 HA ASP A 560 -2.750 5.132 5.688 1.00 0.25 H new ATOM 0 HB2 ASP A 560 -0.296 5.198 5.287 1.00 0.34 H new ATOM 0 HB3 ASP A 560 -0.570 4.994 3.568 1.00 0.34 H new ATOM 1354 N ARG A 561 -3.208 4.194 2.569 1.00 0.20 N ATOM 1355 CA ARG A 561 -4.119 4.325 1.444 1.00 0.19 C ATOM 1356 C ARG A 561 -5.494 3.785 1.809 1.00 0.18 C ATOM 1357 O ARG A 561 -6.507 4.441 1.589 1.00 0.20 O ATOM 1358 CB ARG A 561 -3.582 3.588 0.217 1.00 0.19 C ATOM 1359 CG ARG A 561 -4.470 3.727 -1.012 1.00 0.21 C ATOM 1360 CD ARG A 561 -4.815 5.183 -1.285 1.00 0.25 C ATOM 1361 NE ARG A 561 -5.613 5.369 -2.501 1.00 0.64 N ATOM 1362 CZ ARG A 561 -5.220 6.100 -3.549 1.00 0.85 C ATOM 1363 NH1 ARG A 561 -3.992 6.601 -3.599 1.00 1.57 N ATOM 1364 NH2 ARG A 561 -6.056 6.312 -4.558 1.00 1.32 N ATOM 0 H ARG A 561 -2.501 3.467 2.460 1.00 0.20 H new ATOM 0 HA ARG A 561 -4.204 5.385 1.203 1.00 0.19 H new ATOM 0 HB2 ARG A 561 -2.588 3.967 -0.018 1.00 0.19 H new ATOM 0 HB3 ARG A 561 -3.471 2.531 0.458 1.00 0.19 H new ATOM 0 HG2 ARG A 561 -3.963 3.303 -1.879 1.00 0.21 H new ATOM 0 HG3 ARG A 561 -5.387 3.155 -0.867 1.00 0.21 H new ATOM 0 HD2 ARG A 561 -5.363 5.586 -0.433 1.00 0.25 H new ATOM 0 HD3 ARG A 561 -3.893 5.758 -1.372 1.00 0.25 H new ATOM 0 HE ARG A 561 -6.524 4.913 -2.550 1.00 0.64 H new ATOM 0 HH11 ARG A 561 -3.340 6.429 -2.834 1.00 1.57 H new ATOM 0 HH12 ARG A 561 -3.701 7.158 -4.403 1.00 1.57 H new ATOM 0 HH21 ARG A 561 -6.996 5.917 -4.533 1.00 1.32 H new ATOM 0 HH22 ARG A 561 -5.758 6.869 -5.359 1.00 1.32 H new ATOM 1378 N VAL A 562 -5.518 2.590 2.377 1.00 0.16 N ATOM 1379 CA VAL A 562 -6.760 1.943 2.757 1.00 0.18 C ATOM 1380 C VAL A 562 -7.538 2.794 3.757 1.00 0.21 C ATOM 1381 O VAL A 562 -8.770 2.843 3.722 1.00 0.24 O ATOM 1382 CB VAL A 562 -6.477 0.549 3.346 1.00 0.18 C ATOM 1383 CG1 VAL A 562 -7.756 -0.097 3.843 1.00 0.22 C ATOM 1384 CG2 VAL A 562 -5.803 -0.327 2.303 1.00 0.18 C ATOM 0 H VAL A 562 -4.681 2.045 2.586 1.00 0.16 H new ATOM 0 HA VAL A 562 -7.372 1.830 1.862 1.00 0.18 H new ATOM 0 HB VAL A 562 -5.806 0.660 4.198 1.00 0.18 H new ATOM 0 HG11 VAL A 562 -7.531 -1.081 4.255 1.00 0.22 H new ATOM 0 HG12 VAL A 562 -8.202 0.527 4.618 1.00 0.22 H new ATOM 0 HG13 VAL A 562 -8.456 -0.202 3.014 1.00 0.22 H new ATOM 0 HG21 VAL A 562 -5.606 -1.312 2.727 1.00 0.18 H new ATOM 0 HG22 VAL A 562 -6.456 -0.429 1.437 1.00 0.18 H new ATOM 0 HG23 VAL A 562 -4.863 0.131 1.996 1.00 0.18 H new ATOM 1394 N SER A 563 -6.811 3.477 4.627 1.00 0.23 N ATOM 1395 CA SER A 563 -7.413 4.357 5.611 1.00 0.28 C ATOM 1396 C SER A 563 -8.208 5.468 4.924 1.00 0.32 C ATOM 1397 O SER A 563 -9.360 5.719 5.279 1.00 0.35 O ATOM 1398 CB SER A 563 -6.328 4.955 6.511 1.00 0.34 C ATOM 1399 OG SER A 563 -6.893 5.674 7.596 1.00 0.84 O ATOM 0 H SER A 563 -5.793 3.436 4.670 1.00 0.23 H new ATOM 0 HA SER A 563 -8.100 3.776 6.226 1.00 0.28 H new ATOM 0 HB2 SER A 563 -5.690 4.158 6.894 1.00 0.34 H new ATOM 0 HB3 SER A 563 -5.692 5.618 5.925 1.00 0.34 H new ATOM 0 HG SER A 563 -6.176 6.042 8.153 1.00 0.84 H new ATOM 1405 N LEU A 564 -7.601 6.109 3.924 1.00 0.35 N ATOM 1406 CA LEU A 564 -8.261 7.204 3.218 1.00 0.42 C ATOM 1407 C LEU A 564 -9.359 6.666 2.305 1.00 0.43 C ATOM 1408 O LEU A 564 -10.412 7.284 2.149 1.00 0.51 O ATOM 1409 CB LEU A 564 -7.238 8.053 2.444 1.00 0.53 C ATOM 1410 CG LEU A 564 -6.498 7.368 1.303 1.00 0.98 C ATOM 1411 CD1 LEU A 564 -7.245 7.551 -0.009 1.00 1.65 C ATOM 1412 CD2 LEU A 564 -5.078 7.908 1.191 1.00 1.70 C ATOM 0 H LEU A 564 -6.663 5.891 3.588 1.00 0.35 H new ATOM 0 HA LEU A 564 -8.733 7.857 3.952 1.00 0.42 H new ATOM 0 HB2 LEU A 564 -7.756 8.923 2.039 1.00 0.53 H new ATOM 0 HB3 LEU A 564 -6.499 8.424 3.154 1.00 0.53 H new ATOM 0 HG LEU A 564 -6.446 6.301 1.519 1.00 0.98 H new ATOM 0 HD11 LEU A 564 -6.699 7.054 -0.811 1.00 1.65 H new ATOM 0 HD12 LEU A 564 -8.241 7.116 0.076 1.00 1.65 H new ATOM 0 HD13 LEU A 564 -7.331 8.614 -0.233 1.00 1.65 H new ATOM 0 HD21 LEU A 564 -4.562 7.408 0.371 1.00 1.70 H new ATOM 0 HD22 LEU A 564 -5.111 8.981 0.999 1.00 1.70 H new ATOM 0 HD23 LEU A 564 -4.543 7.722 2.123 1.00 1.70 H new ATOM 1424 N ILE A 565 -9.100 5.506 1.716 1.00 0.39 N ATOM 1425 CA ILE A 565 -10.094 4.793 0.918 1.00 0.41 C ATOM 1426 C ILE A 565 -11.375 4.563 1.714 1.00 0.47 C ATOM 1427 O ILE A 565 -12.467 4.942 1.281 1.00 0.58 O ATOM 1428 CB ILE A 565 -9.528 3.444 0.436 1.00 0.35 C ATOM 1429 CG1 ILE A 565 -8.496 3.694 -0.651 1.00 0.30 C ATOM 1430 CG2 ILE A 565 -10.630 2.514 -0.063 1.00 0.38 C ATOM 1431 CD1 ILE A 565 -7.751 2.457 -1.069 1.00 0.24 C ATOM 0 H ILE A 565 -8.199 5.032 1.776 1.00 0.39 H new ATOM 0 HA ILE A 565 -10.333 5.410 0.052 1.00 0.41 H new ATOM 0 HB ILE A 565 -9.053 2.945 1.281 1.00 0.35 H new ATOM 0 HG12 ILE A 565 -8.994 4.120 -1.522 1.00 0.30 H new ATOM 0 HG13 ILE A 565 -7.781 4.437 -0.298 1.00 0.30 H new ATOM 0 HG21 ILE A 565 -10.190 1.573 -0.394 1.00 0.38 H new ATOM 0 HG22 ILE A 565 -11.336 2.320 0.745 1.00 0.38 H new ATOM 0 HG23 ILE A 565 -11.152 2.983 -0.897 1.00 0.38 H new ATOM 0 HD11 ILE A 565 -7.032 2.711 -1.847 1.00 0.24 H new ATOM 0 HD12 ILE A 565 -7.224 2.042 -0.210 1.00 0.24 H new ATOM 0 HD13 ILE A 565 -8.456 1.720 -1.453 1.00 0.24 H new ATOM 1443 N LYS A 566 -11.232 3.954 2.881 1.00 0.42 N ATOM 1444 CA LYS A 566 -12.376 3.681 3.746 1.00 0.49 C ATOM 1445 C LYS A 566 -12.953 4.975 4.316 1.00 0.56 C ATOM 1446 O LYS A 566 -14.158 5.081 4.524 1.00 0.68 O ATOM 1447 CB LYS A 566 -11.994 2.728 4.881 1.00 0.45 C ATOM 1448 CG LYS A 566 -11.729 1.302 4.423 1.00 0.46 C ATOM 1449 CD LYS A 566 -11.402 0.392 5.598 1.00 0.49 C ATOM 1450 CE LYS A 566 -11.218 -1.051 5.154 1.00 0.54 C ATOM 1451 NZ LYS A 566 -10.943 -1.963 6.298 1.00 0.88 N ATOM 0 H LYS A 566 -10.336 3.638 3.253 1.00 0.42 H new ATOM 0 HA LYS A 566 -13.141 3.200 3.136 1.00 0.49 H new ATOM 0 HB2 LYS A 566 -11.104 3.111 5.380 1.00 0.45 H new ATOM 0 HB3 LYS A 566 -12.795 2.719 5.620 1.00 0.45 H new ATOM 0 HG2 LYS A 566 -12.603 0.919 3.897 1.00 0.46 H new ATOM 0 HG3 LYS A 566 -10.901 1.294 3.714 1.00 0.46 H new ATOM 0 HD2 LYS A 566 -10.493 0.741 6.088 1.00 0.49 H new ATOM 0 HD3 LYS A 566 -12.203 0.447 6.336 1.00 0.49 H new ATOM 0 HE2 LYS A 566 -12.115 -1.386 4.633 1.00 0.54 H new ATOM 0 HE3 LYS A 566 -10.395 -1.107 4.441 1.00 0.54 H new ATOM 0 HZ1 LYS A 566 -11.076 -2.949 5.995 1.00 0.88 H new ATOM 0 HZ2 LYS A 566 -9.964 -1.829 6.621 1.00 0.88 H new ATOM 0 HZ3 LYS A 566 -11.597 -1.749 7.078 1.00 0.88 H new ATOM 1465 N ARG A 567 -12.086 5.955 4.549 1.00 0.55 N ATOM 1466 CA ARG A 567 -12.492 7.254 5.079 1.00 0.68 C ATOM 1467 C ARG A 567 -13.544 7.902 4.181 1.00 0.85 C ATOM 1468 O ARG A 567 -14.573 8.382 4.657 1.00 0.96 O ATOM 1469 CB ARG A 567 -11.270 8.167 5.188 1.00 0.73 C ATOM 1470 CG ARG A 567 -11.070 8.787 6.559 1.00 1.10 C ATOM 1471 CD ARG A 567 -12.195 9.737 6.918 1.00 1.32 C ATOM 1472 NE ARG A 567 -11.904 10.471 8.149 1.00 1.82 N ATOM 1473 CZ ARG A 567 -12.089 11.780 8.303 1.00 2.40 C ATOM 1474 NH1 ARG A 567 -12.657 12.500 7.345 1.00 2.76 N ATOM 1475 NH2 ARG A 567 -11.731 12.368 9.435 1.00 3.00 N ATOM 0 H ARG A 567 -11.084 5.873 4.377 1.00 0.55 H new ATOM 0 HA ARG A 567 -12.928 7.106 6.067 1.00 0.68 H new ATOM 0 HB2 ARG A 567 -10.380 7.594 4.928 1.00 0.73 H new ATOM 0 HB3 ARG A 567 -11.361 8.965 4.452 1.00 0.73 H new ATOM 0 HG2 ARG A 567 -11.007 7.998 7.309 1.00 1.10 H new ATOM 0 HG3 ARG A 567 -10.121 9.323 6.580 1.00 1.10 H new ATOM 0 HD2 ARG A 567 -12.352 10.442 6.101 1.00 1.32 H new ATOM 0 HD3 ARG A 567 -13.122 9.176 7.038 1.00 1.32 H new ATOM 0 HE ARG A 567 -11.535 9.945 8.941 1.00 1.82 H new ATOM 0 HH11 ARG A 567 -12.957 12.051 6.480 1.00 2.76 H new ATOM 0 HH12 ARG A 567 -12.794 13.503 7.474 1.00 2.76 H new ATOM 0 HH21 ARG A 567 -11.315 11.818 10.186 1.00 3.00 H new ATOM 0 HH22 ARG A 567 -11.872 13.371 9.555 1.00 3.00 H new ATOM 1489 N LYS A 568 -13.282 7.895 2.877 1.00 0.95 N ATOM 1490 CA LYS A 568 -14.207 8.468 1.905 1.00 1.18 C ATOM 1491 C LYS A 568 -15.495 7.656 1.851 1.00 1.27 C ATOM 1492 O LYS A 568 -16.579 8.200 1.637 1.00 1.48 O ATOM 1493 CB LYS A 568 -13.560 8.517 0.521 1.00 1.28 C ATOM 1494 CG LYS A 568 -12.275 9.324 0.483 1.00 1.84 C ATOM 1495 CD LYS A 568 -11.675 9.348 -0.910 1.00 2.17 C ATOM 1496 CE LYS A 568 -10.353 10.095 -0.933 1.00 2.77 C ATOM 1497 NZ LYS A 568 -9.793 10.190 -2.307 1.00 3.47 N ATOM 0 H LYS A 568 -12.436 7.498 2.469 1.00 0.95 H new ATOM 0 HA LYS A 568 -14.448 9.484 2.217 1.00 1.18 H new ATOM 0 HB2 LYS A 568 -13.351 7.500 0.190 1.00 1.28 H new ATOM 0 HB3 LYS A 568 -14.269 8.944 -0.188 1.00 1.28 H new ATOM 0 HG2 LYS A 568 -12.475 10.344 0.812 1.00 1.84 H new ATOM 0 HG3 LYS A 568 -11.556 8.898 1.183 1.00 1.84 H new ATOM 0 HD2 LYS A 568 -11.523 8.327 -1.260 1.00 2.17 H new ATOM 0 HD3 LYS A 568 -12.374 9.821 -1.600 1.00 2.17 H new ATOM 0 HE2 LYS A 568 -10.495 11.097 -0.529 1.00 2.77 H new ATOM 0 HE3 LYS A 568 -9.639 9.588 -0.284 1.00 2.77 H new ATOM 0 HZ1 LYS A 568 -8.891 10.707 -2.279 1.00 3.47 H new ATOM 0 HZ2 LYS A 568 -9.633 9.234 -2.683 1.00 3.47 H new ATOM 0 HZ3 LYS A 568 -10.463 10.696 -2.921 1.00 3.47 H new ATOM 1511 N ARG A 569 -15.369 6.351 2.064 1.00 1.16 N ATOM 1512 CA ARG A 569 -16.520 5.456 2.075 1.00 1.30 C ATOM 1513 C ARG A 569 -17.408 5.712 3.285 1.00 1.33 C ATOM 1514 O ARG A 569 -18.598 5.402 3.270 1.00 1.49 O ATOM 1515 CB ARG A 569 -16.073 4.006 2.083 1.00 1.22 C ATOM 1516 CG ARG A 569 -15.453 3.546 0.782 1.00 1.34 C ATOM 1517 CD ARG A 569 -15.434 2.041 0.738 1.00 1.18 C ATOM 1518 NE ARG A 569 -14.799 1.504 -0.460 1.00 1.70 N ATOM 1519 CZ ARG A 569 -14.668 0.203 -0.683 1.00 2.26 C ATOM 1520 NH1 ARG A 569 -15.149 -0.673 0.191 1.00 2.66 N ATOM 1521 NH2 ARG A 569 -14.070 -0.232 -1.776 1.00 3.05 N ATOM 0 H ARG A 569 -14.476 5.887 2.232 1.00 1.16 H new ATOM 0 HA ARG A 569 -17.093 5.655 1.169 1.00 1.30 H new ATOM 0 HB2 ARG A 569 -15.352 3.863 2.888 1.00 1.22 H new ATOM 0 HB3 ARG A 569 -16.931 3.373 2.308 1.00 1.22 H new ATOM 0 HG2 ARG A 569 -16.021 3.938 -0.062 1.00 1.34 H new ATOM 0 HG3 ARG A 569 -14.439 3.936 0.692 1.00 1.34 H new ATOM 0 HD2 ARG A 569 -14.910 1.666 1.617 1.00 1.18 H new ATOM 0 HD3 ARG A 569 -16.457 1.670 0.795 1.00 1.18 H new ATOM 0 HE ARG A 569 -14.440 2.157 -1.157 1.00 1.70 H new ATOM 0 HH11 ARG A 569 -15.620 -0.346 1.035 1.00 2.66 H new ATOM 0 HH12 ARG A 569 -15.048 -1.673 0.019 1.00 2.66 H new ATOM 0 HH21 ARG A 569 -13.704 0.434 -2.457 1.00 3.05 H new ATOM 0 HH22 ARG A 569 -13.973 -1.234 -1.940 1.00 3.05 H new ATOM 1535 N GLU A 570 -16.823 6.274 4.334 1.00 1.25 N ATOM 1536 CA GLU A 570 -17.562 6.583 5.551 1.00 1.34 C ATOM 1537 C GLU A 570 -18.386 7.854 5.380 1.00 1.54 C ATOM 1538 O GLU A 570 -19.056 8.300 6.314 1.00 1.74 O ATOM 1539 CB GLU A 570 -16.600 6.757 6.727 1.00 1.23 C ATOM 1540 CG GLU A 570 -15.803 5.511 7.062 1.00 1.17 C ATOM 1541 CD GLU A 570 -16.653 4.409 7.650 1.00 1.69 C ATOM 1542 OE1 GLU A 570 -17.084 4.537 8.818 1.00 2.16 O ATOM 1543 OE2 GLU A 570 -16.906 3.411 6.947 1.00 2.15 O ATOM 0 H GLU A 570 -15.835 6.526 4.367 1.00 1.25 H new ATOM 0 HA GLU A 570 -18.236 5.751 5.753 1.00 1.34 H new ATOM 0 HB2 GLU A 570 -15.908 7.568 6.500 1.00 1.23 H new ATOM 0 HB3 GLU A 570 -17.169 7.059 7.606 1.00 1.23 H new ATOM 0 HG2 GLU A 570 -15.315 5.144 6.159 1.00 1.17 H new ATOM 0 HG3 GLU A 570 -15.014 5.770 7.768 1.00 1.17 H new ATOM 1550 N GLN A 571 -18.318 8.434 4.176 1.00 1.83 N ATOM 1551 CA GLN A 571 -18.968 9.708 3.877 1.00 2.15 C ATOM 1552 C GLN A 571 -18.466 10.768 4.844 1.00 2.64 C ATOM 1553 O GLN A 571 -19.219 11.630 5.304 1.00 3.40 O ATOM 1554 CB GLN A 571 -20.492 9.580 3.960 1.00 3.00 C ATOM 1555 CG GLN A 571 -21.076 8.580 2.976 1.00 3.64 C ATOM 1556 CD GLN A 571 -22.579 8.447 3.105 1.00 4.52 C ATOM 1557 OE1 GLN A 571 -23.141 8.628 4.187 1.00 4.82 O ATOM 1558 NE2 GLN A 571 -23.242 8.130 2.005 1.00 5.28 N ATOM 0 H GLN A 571 -17.812 8.032 3.387 1.00 1.83 H new ATOM 0 HA GLN A 571 -18.718 10.002 2.858 1.00 2.15 H new ATOM 0 HB2 GLN A 571 -20.768 9.284 4.972 1.00 3.00 H new ATOM 0 HB3 GLN A 571 -20.940 10.557 3.780 1.00 3.00 H new ATOM 0 HG2 GLN A 571 -20.828 8.888 1.960 1.00 3.64 H new ATOM 0 HG3 GLN A 571 -20.614 7.606 3.136 1.00 3.64 H new ATOM 0 HE21 GLN A 571 -22.739 7.989 1.129 1.00 5.28 H new ATOM 0 HE22 GLN A 571 -24.256 8.027 2.033 1.00 5.28 H new ATOM 1567 N ARG A 572 -17.179 10.692 5.138 1.00 2.88 N ATOM 1568 CA ARG A 572 -16.577 11.501 6.171 1.00 3.87 C ATOM 1569 C ARG A 572 -15.468 12.363 5.582 1.00 4.61 C ATOM 1570 O ARG A 572 -15.728 13.549 5.297 1.00 5.14 O ATOM 1571 CB ARG A 572 -16.028 10.577 7.256 1.00 4.32 C ATOM 1572 CG ARG A 572 -15.654 11.278 8.542 1.00 4.96 C ATOM 1573 CD ARG A 572 -15.208 10.273 9.590 1.00 5.75 C ATOM 1574 NE ARG A 572 -14.885 10.907 10.861 1.00 6.35 N ATOM 1575 CZ ARG A 572 -14.403 10.254 11.915 1.00 7.28 C ATOM 1576 NH1 ARG A 572 -14.192 8.947 11.849 1.00 7.72 N ATOM 1577 NH2 ARG A 572 -14.134 10.911 13.036 1.00 8.03 N ATOM 1578 OXT ARG A 572 -14.350 11.842 5.385 1.00 5.05 O ATOM 0 H ARG A 572 -16.527 10.067 4.665 1.00 2.88 H new ATOM 0 HA ARG A 572 -17.322 12.167 6.606 1.00 3.87 H new ATOM 0 HB2 ARG A 572 -16.773 9.813 7.476 1.00 4.32 H new ATOM 0 HB3 ARG A 572 -15.149 10.063 6.868 1.00 4.32 H new ATOM 0 HG2 ARG A 572 -14.854 11.993 8.353 1.00 4.96 H new ATOM 0 HG3 ARG A 572 -16.507 11.845 8.914 1.00 4.96 H new ATOM 0 HD2 ARG A 572 -15.997 9.537 9.744 1.00 5.75 H new ATOM 0 HD3 ARG A 572 -14.335 9.733 9.224 1.00 5.75 H new ATOM 0 HE ARG A 572 -15.038 11.912 10.948 1.00 6.35 H new ATOM 0 HH11 ARG A 572 -14.399 8.440 10.989 1.00 7.72 H new ATOM 0 HH12 ARG A 572 -13.822 8.449 12.659 1.00 7.72 H new ATOM 0 HH21 ARG A 572 -14.297 11.917 13.089 1.00 8.03 H new ATOM 0 HH22 ARG A 572 -13.764 10.411 13.844 1.00 8.03 H new TER 1592 ARG A 572