USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 991 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 570 HIS : no HE2:sc= -4.5! C(o=-5.9!,f=-10!) USER MOD Set 1.2: A 574 GLN :FLIP amide:sc= -1.35 F(o=-7.7!,f=-5.9) USER MOD Set 2.1: A 535 HIS :FLIP no HE2:sc= -7.13! C(o=-11!,f=-8.8!) USER MOD Set 2.2: A 536 MET CE :methyl -160:sc= -1.37 (180deg=-0.507) USER MOD Set 2.3: A 554 CYS SG : rot -66:sc= 0.174 USER MOD Set 2.4: A 555 CYS SG : rot 34:sc= -0.499 USER MOD Set 3.1: A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 520 THR OG1 : rot -160:sc= 1.04 USER MOD Set 3.3: A 565 GLN : amide:sc= -0.502 K(o=0.54,f=-1.6!) USER MOD Set 4.1: A 508 THR OG1 : rot 77:sc= 0.099 USER MOD Set 4.2: A 579 MET CE :methyl -133:sc= -2.56! (180deg=-3.11!) USER MOD Set 5.1: A 478 SER OG : rot -173:sc= -0.451 USER MOD Set 5.2: A 481 SER OG : rot 180:sc= 0.591 USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 480 SER OG : rot 180:sc= 0 USER MOD Single : A 483 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 20:sc= 0.161 USER MOD Single : A 491 TYR OH : rot 180:sc= 0 USER MOD Single : A 495 TYR OH : rot 180:sc= -0.0925 USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN : amide:sc= -0.446 K(o=-0.45,f=-4.9!) USER MOD Single : A 499 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.188) USER MOD Single : A 500 LYS NZ :NH3+ -119:sc= 0 (180deg=-0.652) USER MOD Single : A 501 HIS : no HD1:sc= -0.495 X(o=-0.49,f=-0.038) USER MOD Single : A 503 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 504 THR OG1 : rot 150:sc= -0.276 USER MOD Single : A 505 GLN : amide:sc= 0.742 K(o=0.74,f=-0.48) USER MOD Single : A 506 GLN : amide:sc= -3.2 K(o=-3.2,f=-6.9!) USER MOD Single : A 511 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot 180:sc= -0.178 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -1.06 K(o=-1.1,f=-5.1!) USER MOD Single : A 537 MET CE :methyl -179:sc= -0.114 (180deg=-0.134) USER MOD Single : A 539 LYS NZ :NH3+ -118:sc= -0.174 (180deg=-2.06) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 GLN : amide:sc=-0.00736 X(o=-0.0074,f=0) USER MOD Single : A 556 ASN : amide:sc= -1.66! C(o=-1.7!,f=-5.5!) USER MOD Single : A 564 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 567 ASN : amide:sc= -0.143 X(o=-0.14,f=-0.14) USER MOD Single : A 569 MET CE :methyl 165:sc= -2.24! (180deg=-2.35!) USER MOD Single : A 575 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 SER OG : rot 180:sc= 0 USER MOD Single : A 591 LYS NZ :NH3+ -158:sc= -0.0587 (180deg=-0.385) USER MOD Single : A 592 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.079) USER MOD Single : A 593 SER OG : rot 180:sc= 0 USER MOD Single : A 594 SER OG : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 598 SER OG : rot -13:sc= 0.804 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 23.848 -13.691 -25.746 1.00 0.00 N ATOM 2 CA GLY A 476 24.133 -14.710 -24.753 1.00 0.00 C ATOM 3 C GLY A 476 23.959 -14.202 -23.335 1.00 0.00 C ATOM 4 O GLY A 476 23.318 -13.175 -23.111 1.00 0.00 O ATOM 0 HA2 GLY A 476 23.474 -15.564 -24.913 1.00 0.00 H new ATOM 0 HA3 GLY A 476 25.155 -15.066 -24.885 1.00 0.00 H new ATOM 8 N SER A 477 24.528 -14.924 -22.375 1.00 0.00 N ATOM 9 CA SER A 477 24.428 -14.544 -20.971 1.00 0.00 C ATOM 10 C SER A 477 25.381 -15.372 -20.115 1.00 0.00 C ATOM 11 O SER A 477 25.486 -16.587 -20.281 1.00 0.00 O ATOM 12 CB SER A 477 22.992 -14.722 -20.474 1.00 0.00 C ATOM 13 OG SER A 477 22.574 -16.071 -20.597 1.00 0.00 O ATOM 0 H SER A 477 25.063 -15.776 -22.544 1.00 0.00 H new ATOM 0 HA SER A 477 24.708 -13.494 -20.883 1.00 0.00 H new ATOM 0 HB2 SER A 477 22.923 -14.410 -19.432 1.00 0.00 H new ATOM 0 HB3 SER A 477 22.324 -14.077 -21.045 1.00 0.00 H new ATOM 0 HG SER A 477 21.654 -16.159 -20.271 1.00 0.00 H new ATOM 19 N SER A 478 26.074 -14.705 -19.197 1.00 0.00 N ATOM 20 CA SER A 478 27.022 -15.377 -18.316 1.00 0.00 C ATOM 21 C SER A 478 26.431 -16.674 -17.771 1.00 0.00 C ATOM 22 O SER A 478 26.985 -17.754 -17.971 1.00 0.00 O ATOM 23 CB SER A 478 27.416 -14.457 -17.159 1.00 0.00 C ATOM 24 OG SER A 478 26.275 -14.027 -16.438 1.00 0.00 O ATOM 0 H SER A 478 25.996 -13.699 -19.044 1.00 0.00 H new ATOM 0 HA SER A 478 27.912 -15.619 -18.897 1.00 0.00 H new ATOM 0 HB2 SER A 478 28.097 -14.982 -16.489 1.00 0.00 H new ATOM 0 HB3 SER A 478 27.953 -13.591 -17.546 1.00 0.00 H new ATOM 0 HG SER A 478 26.539 -13.350 -15.781 1.00 0.00 H new ATOM 30 N GLY A 479 25.301 -16.557 -17.080 1.00 0.00 N ATOM 31 CA GLY A 479 24.652 -17.727 -16.516 1.00 0.00 C ATOM 32 C GLY A 479 24.028 -17.447 -15.163 1.00 0.00 C ATOM 33 O GLY A 479 22.898 -17.856 -14.897 1.00 0.00 O ATOM 0 H GLY A 479 24.824 -15.674 -16.901 1.00 0.00 H new ATOM 0 HA2 GLY A 479 23.882 -18.078 -17.203 1.00 0.00 H new ATOM 0 HA3 GLY A 479 25.381 -18.531 -16.417 1.00 0.00 H new ATOM 37 N SER A 480 24.766 -16.750 -14.305 1.00 0.00 N ATOM 38 CA SER A 480 24.280 -16.422 -12.970 1.00 0.00 C ATOM 39 C SER A 480 23.767 -14.986 -12.917 1.00 0.00 C ATOM 40 O SER A 480 22.862 -14.667 -12.146 1.00 0.00 O ATOM 41 CB SER A 480 25.392 -16.616 -11.937 1.00 0.00 C ATOM 42 OG SER A 480 26.368 -15.594 -12.040 1.00 0.00 O ATOM 0 H SER A 480 25.702 -16.402 -14.510 1.00 0.00 H new ATOM 0 HA SER A 480 23.455 -17.094 -12.735 1.00 0.00 H new ATOM 0 HB2 SER A 480 24.965 -16.616 -10.934 1.00 0.00 H new ATOM 0 HB3 SER A 480 25.862 -17.588 -12.083 1.00 0.00 H new ATOM 0 HG SER A 480 27.066 -15.740 -11.368 1.00 0.00 H new ATOM 48 N SER A 481 24.352 -14.124 -13.742 1.00 0.00 N ATOM 49 CA SER A 481 23.958 -12.721 -13.788 1.00 0.00 C ATOM 50 C SER A 481 22.454 -12.586 -14.011 1.00 0.00 C ATOM 51 O SER A 481 21.802 -13.511 -14.494 1.00 0.00 O ATOM 52 CB SER A 481 24.717 -11.991 -14.897 1.00 0.00 C ATOM 53 OG SER A 481 26.095 -11.880 -14.584 1.00 0.00 O ATOM 0 H SER A 481 25.101 -14.373 -14.388 1.00 0.00 H new ATOM 0 HA SER A 481 24.208 -12.268 -12.829 1.00 0.00 H new ATOM 0 HB2 SER A 481 24.597 -12.527 -15.838 1.00 0.00 H new ATOM 0 HB3 SER A 481 24.292 -10.997 -15.040 1.00 0.00 H new ATOM 0 HG SER A 481 26.558 -11.411 -15.309 1.00 0.00 H new ATOM 59 N GLY A 482 21.911 -11.426 -13.656 1.00 0.00 N ATOM 60 CA GLY A 482 20.489 -11.190 -13.825 1.00 0.00 C ATOM 61 C GLY A 482 19.806 -10.811 -12.526 1.00 0.00 C ATOM 62 O GLY A 482 20.131 -11.345 -11.465 1.00 0.00 O ATOM 0 H GLY A 482 22.430 -10.645 -13.254 1.00 0.00 H new ATOM 0 HA2 GLY A 482 20.340 -10.395 -14.556 1.00 0.00 H new ATOM 0 HA3 GLY A 482 20.021 -12.087 -14.230 1.00 0.00 H new ATOM 66 N LYS A 483 18.858 -9.884 -12.607 1.00 0.00 N ATOM 67 CA LYS A 483 18.127 -9.432 -11.429 1.00 0.00 C ATOM 68 C LYS A 483 17.074 -10.456 -11.016 1.00 0.00 C ATOM 69 O LYS A 483 16.673 -11.319 -11.797 1.00 0.00 O ATOM 70 CB LYS A 483 17.460 -8.082 -11.704 1.00 0.00 C ATOM 71 CG LYS A 483 18.334 -6.890 -11.357 1.00 0.00 C ATOM 72 CD LYS A 483 19.466 -6.718 -12.357 1.00 0.00 C ATOM 73 CE LYS A 483 20.706 -7.490 -11.932 1.00 0.00 C ATOM 74 NZ LYS A 483 21.948 -6.905 -12.509 1.00 0.00 N ATOM 0 H LYS A 483 18.578 -9.431 -13.477 1.00 0.00 H new ATOM 0 HA LYS A 483 18.839 -9.319 -10.612 1.00 0.00 H new ATOM 0 HB2 LYS A 483 17.189 -8.028 -12.758 1.00 0.00 H new ATOM 0 HB3 LYS A 483 16.533 -8.021 -11.133 1.00 0.00 H new ATOM 0 HG2 LYS A 483 17.726 -5.986 -11.336 1.00 0.00 H new ATOM 0 HG3 LYS A 483 18.747 -7.020 -10.357 1.00 0.00 H new ATOM 0 HD2 LYS A 483 19.141 -7.061 -13.339 1.00 0.00 H new ATOM 0 HD3 LYS A 483 19.710 -5.660 -12.454 1.00 0.00 H new ATOM 0 HE2 LYS A 483 20.777 -7.493 -10.844 1.00 0.00 H new ATOM 0 HE3 LYS A 483 20.613 -8.529 -12.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 22.771 -7.459 -12.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 21.891 -6.925 -13.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 22.050 -5.921 -12.187 1.00 0.00 H new ATOM 88 N PRO A 484 16.614 -10.359 -9.759 1.00 0.00 N ATOM 89 CA PRO A 484 15.601 -11.268 -9.215 1.00 0.00 C ATOM 90 C PRO A 484 14.228 -11.045 -9.839 1.00 0.00 C ATOM 91 O PRO A 484 13.852 -9.913 -10.146 1.00 0.00 O ATOM 92 CB PRO A 484 15.575 -10.918 -7.725 1.00 0.00 C ATOM 93 CG PRO A 484 16.051 -9.508 -7.658 1.00 0.00 C ATOM 94 CD PRO A 484 17.048 -9.355 -8.773 1.00 0.00 C ATOM 0 HA PRO A 484 15.839 -12.312 -9.417 1.00 0.00 H new ATOM 0 HB2 PRO A 484 14.571 -11.017 -7.313 1.00 0.00 H new ATOM 0 HB3 PRO A 484 16.222 -11.582 -7.151 1.00 0.00 H new ATOM 0 HG2 PRO A 484 15.222 -8.810 -7.777 1.00 0.00 H new ATOM 0 HG3 PRO A 484 16.510 -9.296 -6.692 1.00 0.00 H new ATOM 0 HD2 PRO A 484 17.032 -8.348 -9.191 1.00 0.00 H new ATOM 0 HD3 PRO A 484 18.066 -9.542 -8.430 1.00 0.00 H new ATOM 102 N ILE A 485 13.483 -12.130 -10.023 1.00 0.00 N ATOM 103 CA ILE A 485 12.151 -12.051 -10.609 1.00 0.00 C ATOM 104 C ILE A 485 11.135 -11.531 -9.597 1.00 0.00 C ATOM 105 O ILE A 485 11.362 -11.588 -8.388 1.00 0.00 O ATOM 106 CB ILE A 485 11.683 -13.423 -11.130 1.00 0.00 C ATOM 107 CG1 ILE A 485 12.762 -14.051 -12.015 1.00 0.00 C ATOM 108 CG2 ILE A 485 10.377 -13.281 -11.897 1.00 0.00 C ATOM 109 CD1 ILE A 485 13.765 -14.883 -11.247 1.00 0.00 C ATOM 0 H ILE A 485 13.779 -13.074 -9.775 1.00 0.00 H new ATOM 0 HA ILE A 485 12.215 -11.356 -11.446 1.00 0.00 H new ATOM 0 HB ILE A 485 11.511 -14.080 -10.278 1.00 0.00 H new ATOM 0 HG12 ILE A 485 12.284 -14.677 -12.768 1.00 0.00 H new ATOM 0 HG13 ILE A 485 13.290 -13.260 -12.547 1.00 0.00 H new ATOM 0 HG21 ILE A 485 10.059 -14.259 -12.259 1.00 0.00 H new ATOM 0 HG22 ILE A 485 9.611 -12.871 -11.239 1.00 0.00 H new ATOM 0 HG23 ILE A 485 10.524 -12.611 -12.744 1.00 0.00 H new ATOM 0 HD11 ILE A 485 14.500 -15.297 -11.938 1.00 0.00 H new ATOM 0 HD12 ILE A 485 14.271 -14.257 -10.512 1.00 0.00 H new ATOM 0 HD13 ILE A 485 13.249 -15.696 -10.737 1.00 0.00 H new ATOM 121 N PHE A 486 10.013 -11.026 -10.099 1.00 0.00 N ATOM 122 CA PHE A 486 8.962 -10.496 -9.239 1.00 0.00 C ATOM 123 C PHE A 486 7.878 -11.543 -8.997 1.00 0.00 C ATOM 124 O PHE A 486 7.402 -11.713 -7.874 1.00 0.00 O ATOM 125 CB PHE A 486 8.345 -9.243 -9.864 1.00 0.00 C ATOM 126 CG PHE A 486 7.489 -8.458 -8.913 1.00 0.00 C ATOM 127 CD1 PHE A 486 6.267 -8.954 -8.487 1.00 0.00 C ATOM 128 CD2 PHE A 486 7.905 -7.222 -8.444 1.00 0.00 C ATOM 129 CE1 PHE A 486 5.477 -8.234 -7.611 1.00 0.00 C ATOM 130 CE2 PHE A 486 7.120 -6.497 -7.568 1.00 0.00 C ATOM 131 CZ PHE A 486 5.904 -7.003 -7.152 1.00 0.00 C ATOM 0 H PHE A 486 9.808 -10.973 -11.097 1.00 0.00 H new ATOM 0 HA PHE A 486 9.410 -10.233 -8.281 1.00 0.00 H new ATOM 0 HB2 PHE A 486 9.144 -8.601 -10.236 1.00 0.00 H new ATOM 0 HB3 PHE A 486 7.744 -9.535 -10.725 1.00 0.00 H new ATOM 0 HD1 PHE A 486 5.928 -9.915 -8.844 1.00 0.00 H new ATOM 0 HD2 PHE A 486 8.854 -6.821 -8.767 1.00 0.00 H new ATOM 0 HE1 PHE A 486 4.528 -8.633 -7.286 1.00 0.00 H new ATOM 0 HE2 PHE A 486 7.457 -5.536 -7.209 1.00 0.00 H new ATOM 0 HZ PHE A 486 5.288 -6.437 -6.469 1.00 0.00 H new ATOM 141 N THR A 487 7.493 -12.244 -10.059 1.00 0.00 N ATOM 142 CA THR A 487 6.465 -13.273 -9.964 1.00 0.00 C ATOM 143 C THR A 487 6.999 -14.521 -9.269 1.00 0.00 C ATOM 144 O THR A 487 6.237 -15.291 -8.684 1.00 0.00 O ATOM 145 CB THR A 487 5.931 -13.663 -11.355 1.00 0.00 C ATOM 146 OG1 THR A 487 4.959 -14.708 -11.231 1.00 0.00 O ATOM 147 CG2 THR A 487 7.063 -14.122 -12.261 1.00 0.00 C ATOM 0 H THR A 487 7.878 -12.118 -10.995 1.00 0.00 H new ATOM 0 HA THR A 487 5.650 -12.853 -9.375 1.00 0.00 H new ATOM 0 HB THR A 487 5.465 -12.784 -11.800 1.00 0.00 H new ATOM 0 HG1 THR A 487 4.623 -14.949 -12.119 1.00 0.00 H new ATOM 0 HG21 THR A 487 6.661 -14.392 -13.237 1.00 0.00 H new ATOM 0 HG22 THR A 487 7.786 -13.315 -12.377 1.00 0.00 H new ATOM 0 HG23 THR A 487 7.554 -14.989 -11.819 1.00 0.00 H new ATOM 155 N ASP A 488 8.312 -14.713 -9.336 1.00 0.00 N ATOM 156 CA ASP A 488 8.948 -15.867 -8.711 1.00 0.00 C ATOM 157 C ASP A 488 8.990 -15.709 -7.194 1.00 0.00 C ATOM 158 O ASP A 488 8.540 -16.586 -6.457 1.00 0.00 O ATOM 159 CB ASP A 488 10.365 -16.053 -9.256 1.00 0.00 C ATOM 160 CG ASP A 488 10.862 -17.477 -9.104 1.00 0.00 C ATOM 161 OD1 ASP A 488 10.039 -18.408 -9.222 1.00 0.00 O ATOM 162 OD2 ASP A 488 12.074 -17.660 -8.865 1.00 0.00 O ATOM 0 H ASP A 488 8.956 -14.085 -9.816 1.00 0.00 H new ATOM 0 HA ASP A 488 8.356 -16.751 -8.950 1.00 0.00 H new ATOM 0 HB2 ASP A 488 10.385 -15.775 -10.310 1.00 0.00 H new ATOM 0 HB3 ASP A 488 11.043 -15.377 -8.735 1.00 0.00 H new ATOM 167 N GLU A 489 9.536 -14.587 -6.736 1.00 0.00 N ATOM 168 CA GLU A 489 9.638 -14.316 -5.307 1.00 0.00 C ATOM 169 C GLU A 489 8.255 -14.171 -4.680 1.00 0.00 C ATOM 170 O GLU A 489 7.369 -13.530 -5.246 1.00 0.00 O ATOM 171 CB GLU A 489 10.456 -13.046 -5.063 1.00 0.00 C ATOM 172 CG GLU A 489 9.778 -11.781 -5.560 1.00 0.00 C ATOM 173 CD GLU A 489 10.642 -10.547 -5.383 1.00 0.00 C ATOM 174 OE1 GLU A 489 11.333 -10.452 -4.347 1.00 0.00 O ATOM 175 OE2 GLU A 489 10.627 -9.678 -6.279 1.00 0.00 O ATOM 0 H GLU A 489 9.914 -13.852 -7.333 1.00 0.00 H new ATOM 0 HA GLU A 489 10.143 -15.161 -4.839 1.00 0.00 H new ATOM 0 HB2 GLU A 489 10.650 -12.949 -3.995 1.00 0.00 H new ATOM 0 HB3 GLU A 489 11.423 -13.147 -5.555 1.00 0.00 H new ATOM 0 HG2 GLU A 489 9.529 -11.897 -6.615 1.00 0.00 H new ATOM 0 HG3 GLU A 489 8.839 -11.642 -5.024 1.00 0.00 H new ATOM 182 N SER A 490 8.077 -14.772 -3.508 1.00 0.00 N ATOM 183 CA SER A 490 6.800 -14.714 -2.805 1.00 0.00 C ATOM 184 C SER A 490 6.762 -13.529 -1.845 1.00 0.00 C ATOM 185 O SER A 490 7.691 -13.317 -1.066 1.00 0.00 O ATOM 186 CB SER A 490 6.557 -16.015 -2.037 1.00 0.00 C ATOM 187 OG SER A 490 7.515 -16.186 -1.007 1.00 0.00 O ATOM 0 H SER A 490 8.801 -15.305 -3.025 1.00 0.00 H new ATOM 0 HA SER A 490 6.011 -14.585 -3.546 1.00 0.00 H new ATOM 0 HB2 SER A 490 5.555 -16.006 -1.608 1.00 0.00 H new ATOM 0 HB3 SER A 490 6.602 -16.860 -2.724 1.00 0.00 H new ATOM 0 HG SER A 490 7.923 -15.321 -0.792 1.00 0.00 H new ATOM 193 N TYR A 491 5.680 -12.761 -1.907 1.00 0.00 N ATOM 194 CA TYR A 491 5.520 -11.595 -1.046 1.00 0.00 C ATOM 195 C TYR A 491 4.994 -12.001 0.327 1.00 0.00 C ATOM 196 O TYR A 491 4.179 -11.297 0.926 1.00 0.00 O ATOM 197 CB TYR A 491 4.570 -10.585 -1.691 1.00 0.00 C ATOM 198 CG TYR A 491 3.112 -10.844 -1.385 1.00 0.00 C ATOM 199 CD1 TYR A 491 2.553 -12.101 -1.583 1.00 0.00 C ATOM 200 CD2 TYR A 491 2.293 -9.833 -0.898 1.00 0.00 C ATOM 201 CE1 TYR A 491 1.221 -12.342 -1.306 1.00 0.00 C ATOM 202 CE2 TYR A 491 0.961 -10.065 -0.616 1.00 0.00 C ATOM 203 CZ TYR A 491 0.430 -11.321 -0.823 1.00 0.00 C ATOM 204 OH TYR A 491 -0.897 -11.558 -0.544 1.00 0.00 O ATOM 0 H TYR A 491 4.901 -12.925 -2.544 1.00 0.00 H new ATOM 0 HA TYR A 491 6.498 -11.132 -0.918 1.00 0.00 H new ATOM 0 HB2 TYR A 491 4.832 -9.583 -1.350 1.00 0.00 H new ATOM 0 HB3 TYR A 491 4.714 -10.602 -2.771 1.00 0.00 H new ATOM 0 HD1 TYR A 491 3.170 -12.903 -1.960 1.00 0.00 H new ATOM 0 HD2 TYR A 491 2.705 -8.848 -0.737 1.00 0.00 H new ATOM 0 HE1 TYR A 491 0.802 -13.324 -1.467 1.00 0.00 H new ATOM 0 HE2 TYR A 491 0.339 -9.268 -0.236 1.00 0.00 H new ATOM 0 HH TYR A 491 -1.313 -10.736 -0.211 1.00 0.00 H new ATOM 214 N LEU A 492 5.465 -13.140 0.821 1.00 0.00 N ATOM 215 CA LEU A 492 5.044 -13.641 2.125 1.00 0.00 C ATOM 216 C LEU A 492 6.006 -13.190 3.219 1.00 0.00 C ATOM 217 O LEU A 492 5.586 -12.836 4.320 1.00 0.00 O ATOM 218 CB LEU A 492 4.958 -15.168 2.103 1.00 0.00 C ATOM 219 CG LEU A 492 3.945 -15.798 3.059 1.00 0.00 C ATOM 220 CD1 LEU A 492 4.331 -15.522 4.504 1.00 0.00 C ATOM 221 CD2 LEU A 492 2.544 -15.277 2.771 1.00 0.00 C ATOM 0 H LEU A 492 6.139 -13.735 0.339 1.00 0.00 H new ATOM 0 HA LEU A 492 4.058 -13.231 2.343 1.00 0.00 H new ATOM 0 HB2 LEU A 492 4.715 -15.483 1.088 1.00 0.00 H new ATOM 0 HB3 LEU A 492 5.944 -15.571 2.334 1.00 0.00 H new ATOM 0 HG LEU A 492 3.950 -16.877 2.903 1.00 0.00 H new ATOM 0 HD11 LEU A 492 3.598 -15.978 5.170 1.00 0.00 H new ATOM 0 HD12 LEU A 492 5.316 -15.944 4.704 1.00 0.00 H new ATOM 0 HD13 LEU A 492 4.356 -14.446 4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 492 1.836 -15.736 3.461 1.00 0.00 H new ATOM 0 HD22 LEU A 492 2.525 -14.195 2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 492 2.266 -15.527 1.747 1.00 0.00 H new ATOM 233 N GLU A 493 7.298 -13.205 2.906 1.00 0.00 N ATOM 234 CA GLU A 493 8.319 -12.796 3.863 1.00 0.00 C ATOM 235 C GLU A 493 8.226 -11.301 4.153 1.00 0.00 C ATOM 236 O GLU A 493 8.121 -10.886 5.308 1.00 0.00 O ATOM 237 CB GLU A 493 9.713 -13.137 3.332 1.00 0.00 C ATOM 238 CG GLU A 493 10.051 -12.447 2.021 1.00 0.00 C ATOM 239 CD GLU A 493 11.138 -13.166 1.247 1.00 0.00 C ATOM 240 OE1 GLU A 493 11.938 -13.888 1.877 1.00 0.00 O ATOM 241 OE2 GLU A 493 11.189 -13.005 0.009 1.00 0.00 O ATOM 0 H GLU A 493 7.662 -13.496 1.998 1.00 0.00 H new ATOM 0 HA GLU A 493 8.148 -13.340 4.792 1.00 0.00 H new ATOM 0 HB2 GLU A 493 10.455 -12.860 4.080 1.00 0.00 H new ATOM 0 HB3 GLU A 493 9.786 -14.216 3.194 1.00 0.00 H new ATOM 0 HG2 GLU A 493 9.153 -12.384 1.406 1.00 0.00 H new ATOM 0 HG3 GLU A 493 10.370 -11.425 2.224 1.00 0.00 H new ATOM 248 N LEU A 494 8.265 -10.496 3.097 1.00 0.00 N ATOM 249 CA LEU A 494 8.185 -9.046 3.237 1.00 0.00 C ATOM 250 C LEU A 494 6.987 -8.647 4.093 1.00 0.00 C ATOM 251 O LEU A 494 7.073 -7.728 4.908 1.00 0.00 O ATOM 252 CB LEU A 494 8.085 -8.386 1.860 1.00 0.00 C ATOM 253 CG LEU A 494 6.677 -8.258 1.278 1.00 0.00 C ATOM 254 CD1 LEU A 494 5.986 -7.015 1.818 1.00 0.00 C ATOM 255 CD2 LEU A 494 6.729 -8.224 -0.242 1.00 0.00 C ATOM 0 H LEU A 494 8.352 -10.823 2.135 1.00 0.00 H new ATOM 0 HA LEU A 494 9.093 -8.703 3.733 1.00 0.00 H new ATOM 0 HB2 LEU A 494 8.522 -7.389 1.924 1.00 0.00 H new ATOM 0 HB3 LEU A 494 8.695 -8.957 1.160 1.00 0.00 H new ATOM 0 HG LEU A 494 6.099 -9.130 1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 494 4.985 -6.941 1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 494 5.915 -7.081 2.904 1.00 0.00 H new ATOM 0 HD13 LEU A 494 6.562 -6.131 1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 494 5.718 -8.133 -0.639 1.00 0.00 H new ATOM 0 HD22 LEU A 494 7.325 -7.371 -0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 494 7.182 -9.144 -0.611 1.00 0.00 H new ATOM 267 N TYR A 495 5.873 -9.344 3.904 1.00 0.00 N ATOM 268 CA TYR A 495 4.657 -9.062 4.659 1.00 0.00 C ATOM 269 C TYR A 495 4.854 -9.365 6.141 1.00 0.00 C ATOM 270 O TYR A 495 4.666 -8.498 6.994 1.00 0.00 O ATOM 271 CB TYR A 495 3.489 -9.882 4.109 1.00 0.00 C ATOM 272 CG TYR A 495 2.323 -9.991 5.066 1.00 0.00 C ATOM 273 CD1 TYR A 495 1.692 -8.854 5.555 1.00 0.00 C ATOM 274 CD2 TYR A 495 1.852 -11.231 5.479 1.00 0.00 C ATOM 275 CE1 TYR A 495 0.627 -8.949 6.430 1.00 0.00 C ATOM 276 CE2 TYR A 495 0.786 -11.336 6.352 1.00 0.00 C ATOM 277 CZ TYR A 495 0.178 -10.192 6.825 1.00 0.00 C ATOM 278 OH TYR A 495 -0.884 -10.291 7.695 1.00 0.00 O ATOM 0 H TYR A 495 5.786 -10.109 3.235 1.00 0.00 H new ATOM 0 HA TYR A 495 4.430 -8.001 4.551 1.00 0.00 H new ATOM 0 HB2 TYR A 495 3.144 -9.430 3.179 1.00 0.00 H new ATOM 0 HB3 TYR A 495 3.842 -10.884 3.864 1.00 0.00 H new ATOM 0 HD1 TYR A 495 2.040 -7.879 5.246 1.00 0.00 H new ATOM 0 HD2 TYR A 495 2.327 -12.128 5.111 1.00 0.00 H new ATOM 0 HE1 TYR A 495 0.149 -8.055 6.803 1.00 0.00 H new ATOM 0 HE2 TYR A 495 0.431 -12.308 6.662 1.00 0.00 H new ATOM 0 HH TYR A 495 -1.075 -11.236 7.871 1.00 0.00 H new ATOM 288 N ARG A 496 5.234 -10.603 6.439 1.00 0.00 N ATOM 289 CA ARG A 496 5.457 -11.023 7.818 1.00 0.00 C ATOM 290 C ARG A 496 6.875 -10.686 8.266 1.00 0.00 C ATOM 291 O ARG A 496 7.561 -11.514 8.868 1.00 0.00 O ATOM 292 CB ARG A 496 5.207 -12.525 7.962 1.00 0.00 C ATOM 293 CG ARG A 496 3.787 -12.943 7.618 1.00 0.00 C ATOM 294 CD ARG A 496 2.811 -12.559 8.719 1.00 0.00 C ATOM 295 NE ARG A 496 1.689 -13.490 8.805 1.00 0.00 N ATOM 296 CZ ARG A 496 0.970 -13.674 9.907 1.00 0.00 C ATOM 297 NH1 ARG A 496 1.254 -12.994 11.009 1.00 0.00 N ATOM 298 NH2 ARG A 496 -0.036 -14.539 9.907 1.00 0.00 N ATOM 0 H ARG A 496 5.394 -11.333 5.745 1.00 0.00 H new ATOM 0 HA ARG A 496 4.756 -10.483 8.455 1.00 0.00 H new ATOM 0 HB2 ARG A 496 5.901 -13.064 7.317 1.00 0.00 H new ATOM 0 HB3 ARG A 496 5.426 -12.824 8.987 1.00 0.00 H new ATOM 0 HG2 ARG A 496 3.485 -12.473 6.682 1.00 0.00 H new ATOM 0 HG3 ARG A 496 3.752 -14.021 7.459 1.00 0.00 H new ATOM 0 HD2 ARG A 496 3.335 -12.533 9.675 1.00 0.00 H new ATOM 0 HD3 ARG A 496 2.434 -11.553 8.535 1.00 0.00 H new ATOM 0 HE ARG A 496 1.444 -14.028 7.974 1.00 0.00 H new ATOM 0 HH11 ARG A 496 2.026 -12.328 11.012 1.00 0.00 H new ATOM 0 HH12 ARG A 496 0.700 -13.137 11.854 1.00 0.00 H new ATOM 0 HH21 ARG A 496 -0.258 -15.063 9.061 1.00 0.00 H new ATOM 0 HH22 ARG A 496 -0.588 -14.680 10.753 1.00 0.00 H new ATOM 312 N LYS A 497 7.311 -9.467 7.969 1.00 0.00 N ATOM 313 CA LYS A 497 8.647 -9.019 8.342 1.00 0.00 C ATOM 314 C LYS A 497 8.731 -8.744 9.840 1.00 0.00 C ATOM 315 O LYS A 497 8.607 -7.601 10.277 1.00 0.00 O ATOM 316 CB LYS A 497 9.022 -7.758 7.559 1.00 0.00 C ATOM 317 CG LYS A 497 9.431 -8.033 6.123 1.00 0.00 C ATOM 318 CD LYS A 497 10.905 -8.388 6.021 1.00 0.00 C ATOM 319 CE LYS A 497 11.125 -9.890 6.128 1.00 0.00 C ATOM 320 NZ LYS A 497 12.449 -10.297 5.581 1.00 0.00 N ATOM 0 H LYS A 497 6.757 -8.771 7.470 1.00 0.00 H new ATOM 0 HA LYS A 497 9.351 -9.814 8.097 1.00 0.00 H new ATOM 0 HB2 LYS A 497 8.174 -7.073 7.562 1.00 0.00 H new ATOM 0 HB3 LYS A 497 9.841 -7.253 8.071 1.00 0.00 H new ATOM 0 HG2 LYS A 497 8.831 -8.850 5.723 1.00 0.00 H new ATOM 0 HG3 LYS A 497 9.224 -7.156 5.510 1.00 0.00 H new ATOM 0 HD2 LYS A 497 11.302 -8.028 5.072 1.00 0.00 H new ATOM 0 HD3 LYS A 497 11.458 -7.881 6.812 1.00 0.00 H new ATOM 0 HE2 LYS A 497 11.055 -10.194 7.172 1.00 0.00 H new ATOM 0 HE3 LYS A 497 10.334 -10.412 5.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 12.561 -11.327 5.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 12.507 -10.030 4.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 13.205 -9.819 6.111 1.00 0.00 H new ATOM 334 N GLN A 498 8.944 -9.799 10.619 1.00 0.00 N ATOM 335 CA GLN A 498 9.045 -9.670 12.068 1.00 0.00 C ATOM 336 C GLN A 498 8.119 -8.572 12.583 1.00 0.00 C ATOM 337 O GLN A 498 8.489 -7.795 13.463 1.00 0.00 O ATOM 338 CB GLN A 498 10.489 -9.368 12.475 1.00 0.00 C ATOM 339 CG GLN A 498 11.324 -10.614 12.723 1.00 0.00 C ATOM 340 CD GLN A 498 11.879 -11.207 11.443 1.00 0.00 C ATOM 341 OE1 GLN A 498 11.470 -10.834 10.343 1.00 0.00 O ATOM 342 NE2 GLN A 498 12.817 -12.138 11.580 1.00 0.00 N ATOM 0 H GLN A 498 9.050 -10.752 10.272 1.00 0.00 H new ATOM 0 HA GLN A 498 8.739 -10.617 12.514 1.00 0.00 H new ATOM 0 HB2 GLN A 498 10.962 -8.774 11.693 1.00 0.00 H new ATOM 0 HB3 GLN A 498 10.483 -8.759 13.379 1.00 0.00 H new ATOM 0 HG2 GLN A 498 12.148 -10.367 13.392 1.00 0.00 H new ATOM 0 HG3 GLN A 498 10.714 -11.361 13.231 1.00 0.00 H new ATOM 0 HE21 GLN A 498 13.126 -12.417 12.511 1.00 0.00 H new ATOM 0 HE22 GLN A 498 13.228 -12.574 10.754 1.00 0.00 H new ATOM 351 N LYS A 499 6.914 -8.514 12.028 1.00 0.00 N ATOM 352 CA LYS A 499 5.933 -7.513 12.430 1.00 0.00 C ATOM 353 C LYS A 499 4.556 -8.142 12.613 1.00 0.00 C ATOM 354 O LYS A 499 4.320 -9.276 12.196 1.00 0.00 O ATOM 355 CB LYS A 499 5.860 -6.393 11.389 1.00 0.00 C ATOM 356 CG LYS A 499 6.901 -5.306 11.590 1.00 0.00 C ATOM 357 CD LYS A 499 6.460 -3.990 10.973 1.00 0.00 C ATOM 358 CE LYS A 499 6.852 -3.903 9.506 1.00 0.00 C ATOM 359 NZ LYS A 499 5.833 -4.531 8.621 1.00 0.00 N ATOM 0 H LYS A 499 6.593 -9.149 11.297 1.00 0.00 H new ATOM 0 HA LYS A 499 6.250 -7.093 13.385 1.00 0.00 H new ATOM 0 HB2 LYS A 499 5.984 -6.824 10.395 1.00 0.00 H new ATOM 0 HB3 LYS A 499 4.867 -5.944 11.420 1.00 0.00 H new ATOM 0 HG2 LYS A 499 7.081 -5.167 12.656 1.00 0.00 H new ATOM 0 HG3 LYS A 499 7.846 -5.619 11.145 1.00 0.00 H new ATOM 0 HD2 LYS A 499 5.379 -3.886 11.069 1.00 0.00 H new ATOM 0 HD3 LYS A 499 6.909 -3.162 11.521 1.00 0.00 H new ATOM 0 HE2 LYS A 499 6.981 -2.857 9.226 1.00 0.00 H new ATOM 0 HE3 LYS A 499 7.814 -4.394 9.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 5.945 -4.171 7.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 5.960 -5.563 8.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 4.881 -4.299 8.969 1.00 0.00 H new ATOM 373 N LYS A 500 3.649 -7.399 13.237 1.00 0.00 N ATOM 374 CA LYS A 500 2.293 -7.882 13.473 1.00 0.00 C ATOM 375 C LYS A 500 1.573 -8.147 12.154 1.00 0.00 C ATOM 376 O LYS A 500 1.993 -7.670 11.099 1.00 0.00 O ATOM 377 CB LYS A 500 1.504 -6.867 14.302 1.00 0.00 C ATOM 378 CG LYS A 500 2.172 -6.505 15.617 1.00 0.00 C ATOM 379 CD LYS A 500 1.420 -5.401 16.340 1.00 0.00 C ATOM 380 CE LYS A 500 0.324 -5.964 17.232 1.00 0.00 C ATOM 381 NZ LYS A 500 -0.967 -6.104 16.503 1.00 0.00 N ATOM 0 H LYS A 500 3.828 -6.459 13.589 1.00 0.00 H new ATOM 0 HA LYS A 500 2.359 -8.819 14.026 1.00 0.00 H new ATOM 0 HB2 LYS A 500 1.364 -5.960 13.714 1.00 0.00 H new ATOM 0 HB3 LYS A 500 0.512 -7.270 14.507 1.00 0.00 H new ATOM 0 HG2 LYS A 500 2.225 -7.388 16.254 1.00 0.00 H new ATOM 0 HG3 LYS A 500 3.197 -6.185 15.429 1.00 0.00 H new ATOM 0 HD2 LYS A 500 2.117 -4.819 16.942 1.00 0.00 H new ATOM 0 HD3 LYS A 500 0.982 -4.719 15.611 1.00 0.00 H new ATOM 0 HE2 LYS A 500 0.632 -6.937 17.616 1.00 0.00 H new ATOM 0 HE3 LYS A 500 0.186 -5.311 18.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 -1.690 -5.513 16.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 -0.844 -5.799 15.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 -1.270 -7.099 16.522 1.00 0.00 H new ATOM 395 N HIS A 501 0.486 -8.909 12.222 1.00 0.00 N ATOM 396 CA HIS A 501 -0.294 -9.235 11.033 1.00 0.00 C ATOM 397 C HIS A 501 -1.276 -8.115 10.703 1.00 0.00 C ATOM 398 O HIS A 501 -1.784 -7.437 11.598 1.00 0.00 O ATOM 399 CB HIS A 501 -1.050 -10.548 11.237 1.00 0.00 C ATOM 400 CG HIS A 501 -2.331 -10.390 11.996 1.00 0.00 C ATOM 401 ND1 HIS A 501 -3.525 -10.942 11.581 1.00 0.00 N ATOM 402 CD2 HIS A 501 -2.602 -9.738 13.151 1.00 0.00 C ATOM 403 CE1 HIS A 501 -4.474 -10.635 12.447 1.00 0.00 C ATOM 404 NE2 HIS A 501 -3.940 -9.905 13.410 1.00 0.00 N ATOM 0 H HIS A 501 0.125 -9.312 13.087 1.00 0.00 H new ATOM 0 HA HIS A 501 0.396 -9.348 10.196 1.00 0.00 H new ATOM 0 HB2 HIS A 501 -1.266 -10.988 10.264 1.00 0.00 H new ATOM 0 HB3 HIS A 501 -0.407 -11.249 11.768 1.00 0.00 H new ATOM 0 HD2 HIS A 501 -1.897 -9.188 13.756 1.00 0.00 H new ATOM 0 HE1 HIS A 501 -5.511 -10.931 12.379 1.00 0.00 H new ATOM 0 HE2 HIS A 501 -4.440 -9.527 14.215 1.00 0.00 H new ATOM 412 N LEU A 502 -1.539 -7.926 9.415 1.00 0.00 N ATOM 413 CA LEU A 502 -2.461 -6.887 8.967 1.00 0.00 C ATOM 414 C LEU A 502 -3.907 -7.356 9.081 1.00 0.00 C ATOM 415 O LEU A 502 -4.171 -8.523 9.367 1.00 0.00 O ATOM 416 CB LEU A 502 -2.153 -6.493 7.521 1.00 0.00 C ATOM 417 CG LEU A 502 -0.903 -5.638 7.310 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.583 -5.517 5.829 1.00 0.00 C ATOM 419 CD2 LEU A 502 -1.089 -4.261 7.932 1.00 0.00 C ATOM 0 H LEU A 502 -1.127 -8.478 8.662 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.329 -6.017 9.610 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -2.049 -7.404 6.932 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -3.011 -5.951 7.123 1.00 0.00 H new ATOM 0 HG LEU A 502 -0.063 -6.128 7.803 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.310 -4.905 5.698 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.407 -6.509 5.413 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.422 -5.050 5.313 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.190 -3.665 7.773 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -1.941 -3.764 7.468 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -1.270 -4.366 9.002 1.00 0.00 H new ATOM 431 N ASN A 503 -4.842 -6.438 8.854 1.00 0.00 N ATOM 432 CA ASN A 503 -6.262 -6.759 8.929 1.00 0.00 C ATOM 433 C ASN A 503 -6.798 -7.181 7.565 1.00 0.00 C ATOM 434 O ASN A 503 -6.143 -6.987 6.540 1.00 0.00 O ATOM 435 CB ASN A 503 -7.051 -5.555 9.449 1.00 0.00 C ATOM 436 CG ASN A 503 -6.845 -5.327 10.934 1.00 0.00 C ATOM 437 OD1 ASN A 503 -6.241 -6.150 11.622 1.00 0.00 O ATOM 438 ND2 ASN A 503 -7.348 -4.205 11.436 1.00 0.00 N ATOM 0 H ASN A 503 -4.641 -5.467 8.617 1.00 0.00 H new ATOM 0 HA ASN A 503 -6.384 -7.592 9.621 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -6.749 -4.662 8.902 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -8.112 -5.706 9.251 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -7.241 -3.997 12.429 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -7.842 -3.551 10.829 1.00 0.00 H new ATOM 445 N THR A 504 -7.995 -7.759 7.558 1.00 0.00 N ATOM 446 CA THR A 504 -8.620 -8.209 6.320 1.00 0.00 C ATOM 447 C THR A 504 -8.477 -7.163 5.220 1.00 0.00 C ATOM 448 O THR A 504 -7.911 -7.437 4.162 1.00 0.00 O ATOM 449 CB THR A 504 -10.115 -8.520 6.526 1.00 0.00 C ATOM 450 OG1 THR A 504 -10.294 -9.303 7.711 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.682 -9.266 5.328 1.00 0.00 C ATOM 0 H THR A 504 -8.551 -7.927 8.396 1.00 0.00 H new ATOM 0 HA THR A 504 -8.105 -9.121 6.019 1.00 0.00 H new ATOM 0 HB THR A 504 -10.649 -7.576 6.632 1.00 0.00 H new ATOM 0 HG1 THR A 504 -11.170 -9.107 8.104 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.739 -9.475 5.496 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.571 -8.654 4.433 1.00 0.00 H new ATOM 0 HG23 THR A 504 -10.143 -10.204 5.195 1.00 0.00 H new ATOM 459 N GLN A 505 -8.992 -5.965 5.478 1.00 0.00 N ATOM 460 CA GLN A 505 -8.920 -4.879 4.508 1.00 0.00 C ATOM 461 C GLN A 505 -7.473 -4.576 4.136 1.00 0.00 C ATOM 462 O GLN A 505 -7.086 -4.682 2.972 1.00 0.00 O ATOM 463 CB GLN A 505 -9.589 -3.622 5.068 1.00 0.00 C ATOM 464 CG GLN A 505 -11.098 -3.746 5.206 1.00 0.00 C ATOM 465 CD GLN A 505 -11.749 -2.459 5.670 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.157 -1.686 6.424 1.00 0.00 O ATOM 467 NE2 GLN A 505 -12.976 -2.220 5.221 1.00 0.00 N ATOM 0 H GLN A 505 -9.463 -5.722 6.350 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.449 -5.194 3.608 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.160 -3.397 6.045 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.360 -2.778 4.417 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.524 -4.039 4.246 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.330 -4.542 5.914 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.430 -2.888 4.598 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.464 -1.369 5.500 1.00 0.00 H new ATOM 476 N GLN A 506 -6.678 -4.198 5.132 1.00 0.00 N ATOM 477 CA GLN A 506 -5.273 -3.878 4.908 1.00 0.00 C ATOM 478 C GLN A 506 -4.632 -4.880 3.953 1.00 0.00 C ATOM 479 O GLN A 506 -3.937 -4.498 3.010 1.00 0.00 O ATOM 480 CB GLN A 506 -4.513 -3.863 6.235 1.00 0.00 C ATOM 481 CG GLN A 506 -5.008 -2.805 7.208 1.00 0.00 C ATOM 482 CD GLN A 506 -4.029 -2.545 8.336 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.543 -3.476 8.978 1.00 0.00 O ATOM 484 NE2 GLN A 506 -3.734 -1.274 8.582 1.00 0.00 N ATOM 0 H GLN A 506 -6.983 -4.106 6.101 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.220 -2.887 4.456 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.597 -4.844 6.704 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.455 -3.695 6.036 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -5.188 -1.876 6.667 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -5.963 -3.121 7.627 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -4.161 -0.534 8.024 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -3.081 -1.037 9.329 1.00 0.00 H new ATOM 493 N LEU A 507 -4.870 -6.163 4.202 1.00 0.00 N ATOM 494 CA LEU A 507 -4.316 -7.221 3.364 1.00 0.00 C ATOM 495 C LEU A 507 -4.767 -7.061 1.916 1.00 0.00 C ATOM 496 O LEU A 507 -3.945 -6.924 1.009 1.00 0.00 O ATOM 497 CB LEU A 507 -4.740 -8.592 3.894 1.00 0.00 C ATOM 498 CG LEU A 507 -4.048 -9.060 5.175 1.00 0.00 C ATOM 499 CD1 LEU A 507 -4.744 -10.288 5.740 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.578 -9.352 4.911 1.00 0.00 C ATOM 0 H LEU A 507 -5.443 -6.496 4.977 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.229 -7.146 3.397 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.815 -8.574 4.072 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.558 -9.333 3.115 1.00 0.00 H new ATOM 0 HG LEU A 507 -4.112 -8.260 5.913 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -4.237 -10.606 6.651 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -5.782 -10.045 5.968 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.712 -11.094 5.007 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -2.102 -9.684 5.834 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.492 -10.134 4.157 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -2.086 -8.448 4.553 1.00 0.00 H new ATOM 512 N THR A 508 -6.080 -7.077 1.705 1.00 0.00 N ATOM 513 CA THR A 508 -6.640 -6.933 0.367 1.00 0.00 C ATOM 514 C THR A 508 -5.972 -5.791 -0.389 1.00 0.00 C ATOM 515 O THR A 508 -5.500 -5.969 -1.511 1.00 0.00 O ATOM 516 CB THR A 508 -8.159 -6.681 0.419 1.00 0.00 C ATOM 517 OG1 THR A 508 -8.810 -7.749 1.117 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.736 -6.559 -0.983 1.00 0.00 C ATOM 0 H THR A 508 -6.775 -7.188 2.443 1.00 0.00 H new ATOM 0 HA THR A 508 -6.452 -7.870 -0.157 1.00 0.00 H new ATOM 0 HB THR A 508 -8.331 -5.744 0.948 1.00 0.00 H new ATOM 0 HG1 THR A 508 -8.677 -7.638 2.082 1.00 0.00 H new ATOM 0 HG21 THR A 508 -9.810 -6.381 -0.920 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.260 -5.726 -1.501 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.552 -7.482 -1.534 1.00 0.00 H new ATOM 526 N ALA A 509 -5.936 -4.617 0.234 1.00 0.00 N ATOM 527 CA ALA A 509 -5.323 -3.445 -0.380 1.00 0.00 C ATOM 528 C ALA A 509 -3.856 -3.701 -0.707 1.00 0.00 C ATOM 529 O ALA A 509 -3.384 -3.368 -1.794 1.00 0.00 O ATOM 530 CB ALA A 509 -5.459 -2.238 0.536 1.00 0.00 C ATOM 0 H ALA A 509 -6.324 -4.452 1.163 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.846 -3.239 -1.314 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.997 -1.370 0.065 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.515 -2.035 0.715 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.963 -2.443 1.485 1.00 0.00 H new ATOM 536 N PHE A 510 -3.138 -4.294 0.241 1.00 0.00 N ATOM 537 CA PHE A 510 -1.723 -4.593 0.054 1.00 0.00 C ATOM 538 C PHE A 510 -1.507 -5.442 -1.195 1.00 0.00 C ATOM 539 O PHE A 510 -0.637 -5.148 -2.014 1.00 0.00 O ATOM 540 CB PHE A 510 -1.167 -5.320 1.281 1.00 0.00 C ATOM 541 CG PHE A 510 0.333 -5.383 1.311 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.080 -4.266 1.649 1.00 0.00 C ATOM 543 CD2 PHE A 510 0.997 -6.560 1.003 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.461 -4.322 1.677 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.377 -6.621 1.029 1.00 0.00 C ATOM 546 CZ PHE A 510 3.110 -5.501 1.368 1.00 0.00 C ATOM 0 H PHE A 510 -3.513 -4.577 1.146 1.00 0.00 H new ATOM 0 HA PHE A 510 -1.192 -3.650 -0.073 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.520 -4.818 2.182 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.566 -6.334 1.304 1.00 0.00 H new ATOM 0 HD1 PHE A 510 0.578 -3.342 1.893 1.00 0.00 H new ATOM 0 HD2 PHE A 510 0.429 -7.440 0.740 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.032 -3.444 1.940 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.882 -7.544 0.784 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.189 -5.547 1.391 1.00 0.00 H new ATOM 556 N GLN A 511 -2.305 -6.496 -1.332 1.00 0.00 N ATOM 557 CA GLN A 511 -2.200 -7.389 -2.480 1.00 0.00 C ATOM 558 C GLN A 511 -2.382 -6.620 -3.785 1.00 0.00 C ATOM 559 O GLN A 511 -1.635 -6.819 -4.744 1.00 0.00 O ATOM 560 CB GLN A 511 -3.242 -8.505 -2.383 1.00 0.00 C ATOM 561 CG GLN A 511 -2.924 -9.711 -3.251 1.00 0.00 C ATOM 562 CD GLN A 511 -3.896 -10.855 -3.038 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.759 -10.797 -2.162 1.00 0.00 O ATOM 564 NE2 GLN A 511 -3.761 -11.904 -3.842 1.00 0.00 N ATOM 0 H GLN A 511 -3.031 -6.752 -0.663 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.204 -7.831 -2.475 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -3.322 -8.826 -1.345 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -4.216 -8.108 -2.670 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -2.942 -9.414 -4.300 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -1.912 -10.054 -3.034 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -3.031 -11.910 -4.555 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -4.387 -12.704 -3.746 1.00 0.00 H new ATOM 573 N LEU A 512 -3.378 -5.742 -3.815 1.00 0.00 N ATOM 574 CA LEU A 512 -3.659 -4.944 -5.003 1.00 0.00 C ATOM 575 C LEU A 512 -2.461 -4.073 -5.369 1.00 0.00 C ATOM 576 O LEU A 512 -2.010 -4.069 -6.516 1.00 0.00 O ATOM 577 CB LEU A 512 -4.890 -4.066 -4.773 1.00 0.00 C ATOM 578 CG LEU A 512 -6.176 -4.800 -4.393 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.206 -3.824 -3.846 1.00 0.00 C ATOM 580 CD2 LEU A 512 -6.735 -5.552 -5.592 1.00 0.00 C ATOM 0 H LEU A 512 -4.005 -5.565 -3.030 1.00 0.00 H new ATOM 0 HA LEU A 512 -3.856 -5.626 -5.830 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -4.658 -3.349 -3.985 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.077 -3.493 -5.681 1.00 0.00 H new ATOM 0 HG LEU A 512 -5.941 -5.524 -3.613 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.115 -4.365 -3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -6.806 -3.331 -2.960 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.437 -3.076 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.650 -6.069 -5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -6.954 -4.847 -6.394 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.002 -6.280 -5.939 1.00 0.00 H new ATOM 592 N LEU A 513 -1.948 -3.339 -4.388 1.00 0.00 N ATOM 593 CA LEU A 513 -0.799 -2.466 -4.606 1.00 0.00 C ATOM 594 C LEU A 513 0.396 -3.258 -5.128 1.00 0.00 C ATOM 595 O LEU A 513 1.060 -2.844 -6.078 1.00 0.00 O ATOM 596 CB LEU A 513 -0.424 -1.751 -3.307 1.00 0.00 C ATOM 597 CG LEU A 513 -1.365 -0.630 -2.862 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.041 -0.195 -1.441 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.276 0.551 -3.817 1.00 0.00 C ATOM 0 H LEU A 513 -2.309 -3.331 -3.434 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.074 -1.724 -5.356 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.372 -2.492 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.577 -1.334 -3.421 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.387 -1.010 -2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -1.720 0.603 -1.141 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.156 -1.043 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.014 0.167 -1.397 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -1.952 1.339 -3.485 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.255 0.931 -3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -1.558 0.230 -4.820 1.00 0.00 H new ATOM 611 N PHE A 514 0.661 -4.399 -4.502 1.00 0.00 N ATOM 612 CA PHE A 514 1.776 -5.250 -4.903 1.00 0.00 C ATOM 613 C PHE A 514 1.732 -5.532 -6.402 1.00 0.00 C ATOM 614 O PHE A 514 2.653 -5.179 -7.138 1.00 0.00 O ATOM 615 CB PHE A 514 1.746 -6.566 -4.124 1.00 0.00 C ATOM 616 CG PHE A 514 3.032 -7.338 -4.203 1.00 0.00 C ATOM 617 CD1 PHE A 514 4.179 -6.864 -3.584 1.00 0.00 C ATOM 618 CD2 PHE A 514 3.096 -8.537 -4.894 1.00 0.00 C ATOM 619 CE1 PHE A 514 5.364 -7.572 -3.656 1.00 0.00 C ATOM 620 CE2 PHE A 514 4.278 -9.250 -4.968 1.00 0.00 C ATOM 621 CZ PHE A 514 5.413 -8.767 -4.347 1.00 0.00 C ATOM 0 H PHE A 514 0.119 -4.756 -3.715 1.00 0.00 H new ATOM 0 HA PHE A 514 2.703 -4.723 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.522 -6.355 -3.078 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.935 -7.186 -4.505 1.00 0.00 H new ATOM 0 HD1 PHE A 514 4.146 -5.932 -3.040 1.00 0.00 H new ATOM 0 HD2 PHE A 514 2.211 -8.920 -5.381 1.00 0.00 H new ATOM 0 HE1 PHE A 514 6.251 -7.191 -3.172 1.00 0.00 H new ATOM 0 HE2 PHE A 514 4.314 -10.183 -5.511 1.00 0.00 H new ATOM 0 HZ PHE A 514 6.337 -9.323 -4.402 1.00 0.00 H new ATOM 631 N ALA A 515 0.655 -6.171 -6.847 1.00 0.00 N ATOM 632 CA ALA A 515 0.489 -6.499 -8.257 1.00 0.00 C ATOM 633 C ALA A 515 0.645 -5.259 -9.132 1.00 0.00 C ATOM 634 O ALA A 515 1.459 -5.238 -10.055 1.00 0.00 O ATOM 635 CB ALA A 515 -0.868 -7.146 -8.493 1.00 0.00 C ATOM 0 H ALA A 515 -0.116 -6.472 -6.251 1.00 0.00 H new ATOM 0 HA ALA A 515 1.270 -7.207 -8.533 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -0.978 -7.385 -9.551 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -0.942 -8.060 -7.904 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -1.657 -6.456 -8.193 1.00 0.00 H new ATOM 641 N TRP A 516 -0.140 -4.230 -8.836 1.00 0.00 N ATOM 642 CA TRP A 516 -0.089 -2.986 -9.596 1.00 0.00 C ATOM 643 C TRP A 516 1.347 -2.496 -9.742 1.00 0.00 C ATOM 644 O TRP A 516 1.797 -2.183 -10.844 1.00 0.00 O ATOM 645 CB TRP A 516 -0.941 -1.913 -8.916 1.00 0.00 C ATOM 646 CG TRP A 516 -0.698 -0.535 -9.451 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.340 0.063 -10.498 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.256 0.417 -8.967 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.842 1.329 -10.693 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.137 1.570 -9.766 1.00 0.00 C ATOM 651 CE3 TRP A 516 1.198 0.408 -7.934 1.00 0.00 C ATOM 652 CZ2 TRP A 516 0.925 2.700 -9.565 1.00 0.00 C ATOM 653 CZ3 TRP A 516 1.980 1.530 -7.736 1.00 0.00 C ATOM 654 CH2 TRP A 516 1.839 2.664 -8.547 1.00 0.00 C ATOM 0 H TRP A 516 -0.820 -4.232 -8.075 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.489 -3.181 -10.591 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.995 -2.163 -9.041 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.736 -1.921 -7.845 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.123 -0.392 -11.086 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.151 1.983 -11.412 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.312 -0.460 -7.302 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.819 3.574 -10.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.713 1.533 -6.942 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.464 3.526 -8.365 1.00 0.00 H new ATOM 665 N ARG A 517 2.063 -2.433 -8.624 1.00 0.00 N ATOM 666 CA ARG A 517 3.449 -1.980 -8.628 1.00 0.00 C ATOM 667 C ARG A 517 4.259 -2.720 -9.688 1.00 0.00 C ATOM 668 O ARG A 517 4.932 -2.101 -10.513 1.00 0.00 O ATOM 669 CB ARG A 517 4.080 -2.188 -7.251 1.00 0.00 C ATOM 670 CG ARG A 517 5.446 -1.537 -7.102 1.00 0.00 C ATOM 671 CD ARG A 517 6.004 -1.728 -5.700 1.00 0.00 C ATOM 672 NE ARG A 517 7.462 -1.649 -5.676 1.00 0.00 N ATOM 673 CZ ARG A 517 8.211 -2.186 -4.720 1.00 0.00 C ATOM 674 NH1 ARG A 517 7.643 -2.838 -3.715 1.00 0.00 N ATOM 675 NH2 ARG A 517 9.532 -2.072 -4.768 1.00 0.00 N ATOM 0 H ARG A 517 1.706 -2.690 -7.704 1.00 0.00 H new ATOM 0 HA ARG A 517 3.457 -0.916 -8.866 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.411 -1.787 -6.490 1.00 0.00 H new ATOM 0 HB3 ARG A 517 4.174 -3.257 -7.062 1.00 0.00 H new ATOM 0 HG2 ARG A 517 6.135 -1.964 -7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.369 -0.472 -7.322 1.00 0.00 H new ATOM 0 HD2 ARG A 517 5.589 -0.968 -5.038 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.687 -2.696 -5.312 1.00 0.00 H new ATOM 0 HE ARG A 517 7.931 -1.154 -6.435 1.00 0.00 H new ATOM 0 HH11 ARG A 517 6.628 -2.928 -3.675 1.00 0.00 H new ATOM 0 HH12 ARG A 517 8.221 -3.249 -2.982 1.00 0.00 H new ATOM 0 HH21 ARG A 517 9.973 -1.572 -5.540 1.00 0.00 H new ATOM 0 HH22 ARG A 517 10.107 -2.485 -4.033 1.00 0.00 H new ATOM 689 N ASP A 518 4.191 -4.046 -9.659 1.00 0.00 N ATOM 690 CA ASP A 518 4.918 -4.871 -10.617 1.00 0.00 C ATOM 691 C ASP A 518 4.472 -4.566 -12.044 1.00 0.00 C ATOM 692 O ASP A 518 5.299 -4.361 -12.933 1.00 0.00 O ATOM 693 CB ASP A 518 4.706 -6.354 -10.309 1.00 0.00 C ATOM 694 CG ASP A 518 5.193 -7.253 -11.429 1.00 0.00 C ATOM 695 OD1 ASP A 518 6.400 -7.203 -11.747 1.00 0.00 O ATOM 696 OD2 ASP A 518 4.368 -8.006 -11.986 1.00 0.00 O ATOM 0 H ASP A 518 3.639 -4.573 -8.982 1.00 0.00 H new ATOM 0 HA ASP A 518 5.979 -4.638 -10.529 1.00 0.00 H new ATOM 0 HB2 ASP A 518 5.230 -6.609 -9.388 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.646 -6.538 -10.134 1.00 0.00 H new ATOM 701 N LYS A 519 3.161 -4.540 -12.256 1.00 0.00 N ATOM 702 CA LYS A 519 2.604 -4.260 -13.574 1.00 0.00 C ATOM 703 C LYS A 519 3.237 -3.011 -14.179 1.00 0.00 C ATOM 704 O LYS A 519 3.852 -3.067 -15.245 1.00 0.00 O ATOM 705 CB LYS A 519 1.087 -4.083 -13.483 1.00 0.00 C ATOM 706 CG LYS A 519 0.409 -3.941 -14.834 1.00 0.00 C ATOM 707 CD LYS A 519 0.363 -2.490 -15.286 1.00 0.00 C ATOM 708 CE LYS A 519 -0.418 -1.626 -14.308 1.00 0.00 C ATOM 709 NZ LYS A 519 -0.960 -0.402 -14.960 1.00 0.00 N ATOM 0 H LYS A 519 2.464 -4.710 -11.531 1.00 0.00 H new ATOM 0 HA LYS A 519 2.826 -5.108 -14.222 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.661 -4.939 -12.960 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.868 -3.201 -12.882 1.00 0.00 H new ATOM 0 HG2 LYS A 519 0.943 -4.537 -15.574 1.00 0.00 H new ATOM 0 HG3 LYS A 519 -0.605 -4.337 -14.777 1.00 0.00 H new ATOM 0 HD2 LYS A 519 1.378 -2.105 -15.382 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -0.096 -2.430 -16.273 1.00 0.00 H new ATOM 0 HE2 LYS A 519 -1.238 -2.206 -13.886 1.00 0.00 H new ATOM 0 HE3 LYS A 519 0.229 -1.340 -13.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -1.486 0.160 -14.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -0.176 0.165 -15.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -1.598 -0.675 -15.735 1.00 0.00 H new ATOM 723 N THR A 520 3.085 -1.884 -13.491 1.00 0.00 N ATOM 724 CA THR A 520 3.642 -0.621 -13.960 1.00 0.00 C ATOM 725 C THR A 520 5.148 -0.729 -14.170 1.00 0.00 C ATOM 726 O THR A 520 5.652 -0.469 -15.262 1.00 0.00 O ATOM 727 CB THR A 520 3.355 0.522 -12.969 1.00 0.00 C ATOM 728 OG1 THR A 520 1.943 0.652 -12.766 1.00 0.00 O ATOM 729 CG2 THR A 520 3.921 1.838 -13.481 1.00 0.00 C ATOM 0 H THR A 520 2.581 -1.820 -12.607 1.00 0.00 H new ATOM 0 HA THR A 520 3.160 -0.397 -14.911 1.00 0.00 H new ATOM 0 HB THR A 520 3.838 0.281 -12.022 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.745 1.543 -12.408 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.706 2.630 -12.764 1.00 0.00 H new ATOM 0 HG22 THR A 520 5.000 1.746 -13.607 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.464 2.082 -14.440 1.00 0.00 H new ATOM 737 N ALA A 521 5.862 -1.115 -13.117 1.00 0.00 N ATOM 738 CA ALA A 521 7.311 -1.259 -13.188 1.00 0.00 C ATOM 739 C ALA A 521 7.720 -2.098 -14.394 1.00 0.00 C ATOM 740 O ALA A 521 8.810 -1.924 -14.941 1.00 0.00 O ATOM 741 CB ALA A 521 7.842 -1.882 -11.905 1.00 0.00 C ATOM 0 H ALA A 521 5.460 -1.333 -12.205 1.00 0.00 H new ATOM 0 HA ALA A 521 7.746 -0.266 -13.304 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.925 -1.984 -11.971 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.589 -1.244 -11.059 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.393 -2.865 -11.765 1.00 0.00 H new ATOM 747 N ARG A 522 6.841 -3.007 -14.803 1.00 0.00 N ATOM 748 CA ARG A 522 7.113 -3.873 -15.944 1.00 0.00 C ATOM 749 C ARG A 522 6.946 -3.113 -17.256 1.00 0.00 C ATOM 750 O ARG A 522 7.649 -3.377 -18.232 1.00 0.00 O ATOM 751 CB ARG A 522 6.181 -5.086 -15.923 1.00 0.00 C ATOM 752 CG ARG A 522 6.561 -6.128 -14.884 1.00 0.00 C ATOM 753 CD ARG A 522 7.782 -6.926 -15.316 1.00 0.00 C ATOM 754 NE ARG A 522 7.519 -7.727 -16.509 1.00 0.00 N ATOM 755 CZ ARG A 522 8.384 -8.600 -17.012 1.00 0.00 C ATOM 756 NH1 ARG A 522 9.561 -8.784 -16.430 1.00 0.00 N ATOM 757 NH2 ARG A 522 8.072 -9.292 -18.101 1.00 0.00 N ATOM 0 H ARG A 522 5.935 -3.163 -14.361 1.00 0.00 H new ATOM 0 HA ARG A 522 8.146 -4.214 -15.871 1.00 0.00 H new ATOM 0 HB2 ARG A 522 5.163 -4.748 -15.731 1.00 0.00 H new ATOM 0 HB3 ARG A 522 6.182 -5.551 -16.909 1.00 0.00 H new ATOM 0 HG2 ARG A 522 6.764 -5.637 -13.932 1.00 0.00 H new ATOM 0 HG3 ARG A 522 5.722 -6.804 -14.721 1.00 0.00 H new ATOM 0 HD2 ARG A 522 8.610 -6.244 -15.512 1.00 0.00 H new ATOM 0 HD3 ARG A 522 8.094 -7.580 -14.502 1.00 0.00 H new ATOM 0 HE ARG A 522 6.623 -7.609 -16.981 1.00 0.00 H new ATOM 0 HH11 ARG A 522 9.805 -8.254 -15.593 1.00 0.00 H new ATOM 0 HH12 ARG A 522 10.223 -9.455 -16.819 1.00 0.00 H new ATOM 0 HH21 ARG A 522 7.168 -9.153 -18.552 1.00 0.00 H new ATOM 0 HH22 ARG A 522 8.737 -9.962 -18.487 1.00 0.00 H new ATOM 771 N ARG A 523 6.012 -2.168 -17.272 1.00 0.00 N ATOM 772 CA ARG A 523 5.752 -1.370 -18.465 1.00 0.00 C ATOM 773 C ARG A 523 6.760 -0.231 -18.587 1.00 0.00 C ATOM 774 O ARG A 523 7.313 0.008 -19.660 1.00 0.00 O ATOM 775 CB ARG A 523 4.331 -0.806 -18.427 1.00 0.00 C ATOM 776 CG ARG A 523 3.779 -0.455 -19.799 1.00 0.00 C ATOM 777 CD ARG A 523 2.636 0.544 -19.700 1.00 0.00 C ATOM 778 NE ARG A 523 1.341 -0.118 -19.563 1.00 0.00 N ATOM 779 CZ ARG A 523 0.649 -0.600 -20.589 1.00 0.00 C ATOM 780 NH1 ARG A 523 1.126 -0.494 -21.822 1.00 0.00 N ATOM 781 NH2 ARG A 523 -0.522 -1.189 -20.384 1.00 0.00 N ATOM 0 H ARG A 523 5.422 -1.936 -16.473 1.00 0.00 H new ATOM 0 HA ARG A 523 5.855 -2.018 -19.335 1.00 0.00 H new ATOM 0 HB2 ARG A 523 3.672 -1.535 -17.955 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.320 0.086 -17.801 1.00 0.00 H new ATOM 0 HG2 ARG A 523 4.575 -0.039 -20.417 1.00 0.00 H new ATOM 0 HG3 ARG A 523 3.430 -1.361 -20.295 1.00 0.00 H new ATOM 0 HD2 ARG A 523 2.800 1.199 -18.845 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.628 1.175 -20.589 1.00 0.00 H new ATOM 0 HE ARG A 523 0.946 -0.215 -18.627 1.00 0.00 H new ATOM 0 HH11 ARG A 523 2.026 -0.042 -21.984 1.00 0.00 H new ATOM 0 HH12 ARG A 523 0.593 -0.865 -22.609 1.00 0.00 H new ATOM 0 HH21 ARG A 523 -0.892 -1.272 -19.437 1.00 0.00 H new ATOM 0 HH22 ARG A 523 -1.052 -1.559 -21.173 1.00 0.00 H new ATOM 795 N GLU A 524 6.991 0.469 -17.481 1.00 0.00 N ATOM 796 CA GLU A 524 7.931 1.584 -17.465 1.00 0.00 C ATOM 797 C GLU A 524 9.368 1.086 -17.585 1.00 0.00 C ATOM 798 O GLU A 524 10.243 1.795 -18.083 1.00 0.00 O ATOM 799 CB GLU A 524 7.768 2.400 -16.181 1.00 0.00 C ATOM 800 CG GLU A 524 6.581 3.349 -16.210 1.00 0.00 C ATOM 801 CD GLU A 524 5.421 2.808 -17.023 1.00 0.00 C ATOM 802 OE1 GLU A 524 4.783 1.834 -16.571 1.00 0.00 O ATOM 803 OE2 GLU A 524 5.152 3.357 -18.112 1.00 0.00 O ATOM 0 H GLU A 524 6.540 0.284 -16.585 1.00 0.00 H new ATOM 0 HA GLU A 524 7.713 2.221 -18.322 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.656 1.718 -15.338 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.678 2.975 -16.008 1.00 0.00 H new ATOM 0 HG2 GLU A 524 6.247 3.539 -15.190 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.896 4.306 -16.626 1.00 0.00 H new ATOM 810 N ASP A 525 9.604 -0.138 -17.125 1.00 0.00 N ATOM 811 CA ASP A 525 10.934 -0.732 -17.181 1.00 0.00 C ATOM 812 C ASP A 525 11.911 0.038 -16.297 1.00 0.00 C ATOM 813 O ASP A 525 13.034 0.331 -16.706 1.00 0.00 O ATOM 814 CB ASP A 525 11.445 -0.759 -18.622 1.00 0.00 C ATOM 815 CG ASP A 525 10.435 -1.355 -19.583 1.00 0.00 C ATOM 816 OD1 ASP A 525 9.724 -2.301 -19.184 1.00 0.00 O ATOM 817 OD2 ASP A 525 10.356 -0.877 -20.734 1.00 0.00 O ATOM 0 H ASP A 525 8.891 -0.738 -16.709 1.00 0.00 H new ATOM 0 HA ASP A 525 10.863 -1.754 -16.810 1.00 0.00 H new ATOM 0 HB2 ASP A 525 11.688 0.256 -18.938 1.00 0.00 H new ATOM 0 HB3 ASP A 525 12.369 -1.336 -18.666 1.00 0.00 H new ATOM 822 N GLU A 526 11.474 0.362 -15.084 1.00 0.00 N ATOM 823 CA GLU A 526 12.309 1.099 -14.144 1.00 0.00 C ATOM 824 C GLU A 526 12.460 0.333 -12.833 1.00 0.00 C ATOM 825 O GLU A 526 11.898 -0.749 -12.666 1.00 0.00 O ATOM 826 CB GLU A 526 11.713 2.482 -13.873 1.00 0.00 C ATOM 827 CG GLU A 526 12.064 3.514 -14.931 1.00 0.00 C ATOM 828 CD GLU A 526 13.460 4.079 -14.755 1.00 0.00 C ATOM 829 OE1 GLU A 526 14.434 3.315 -14.920 1.00 0.00 O ATOM 830 OE2 GLU A 526 13.579 5.285 -14.452 1.00 0.00 O ATOM 0 H GLU A 526 10.547 0.126 -14.730 1.00 0.00 H new ATOM 0 HA GLU A 526 13.296 1.218 -14.591 1.00 0.00 H new ATOM 0 HB2 GLU A 526 10.628 2.395 -13.809 1.00 0.00 H new ATOM 0 HB3 GLU A 526 12.063 2.835 -12.903 1.00 0.00 H new ATOM 0 HG2 GLU A 526 11.982 3.059 -15.918 1.00 0.00 H new ATOM 0 HG3 GLU A 526 11.340 4.328 -14.894 1.00 0.00 H new ATOM 837 N SER A 527 13.224 0.902 -11.906 1.00 0.00 N ATOM 838 CA SER A 527 13.453 0.271 -10.611 1.00 0.00 C ATOM 839 C SER A 527 12.137 0.061 -9.869 1.00 0.00 C ATOM 840 O SER A 527 11.276 0.940 -9.848 1.00 0.00 O ATOM 841 CB SER A 527 14.398 1.125 -9.764 1.00 0.00 C ATOM 842 OG SER A 527 14.865 0.405 -8.636 1.00 0.00 O ATOM 0 H SER A 527 13.695 1.799 -12.027 1.00 0.00 H new ATOM 0 HA SER A 527 13.912 -0.702 -10.785 1.00 0.00 H new ATOM 0 HB2 SER A 527 15.245 1.446 -10.370 1.00 0.00 H new ATOM 0 HB3 SER A 527 13.882 2.027 -9.435 1.00 0.00 H new ATOM 0 HG SER A 527 15.468 0.973 -8.112 1.00 0.00 H new ATOM 848 N TYR A 528 11.989 -1.111 -9.261 1.00 0.00 N ATOM 849 CA TYR A 528 10.777 -1.440 -8.520 1.00 0.00 C ATOM 850 C TYR A 528 10.548 -0.448 -7.383 1.00 0.00 C ATOM 851 O TYR A 528 9.515 0.216 -7.323 1.00 0.00 O ATOM 852 CB TYR A 528 10.866 -2.861 -7.961 1.00 0.00 C ATOM 853 CG TYR A 528 10.587 -3.935 -8.989 1.00 0.00 C ATOM 854 CD1 TYR A 528 9.366 -3.989 -9.651 1.00 0.00 C ATOM 855 CD2 TYR A 528 11.543 -4.894 -9.298 1.00 0.00 C ATOM 856 CE1 TYR A 528 9.106 -4.968 -10.590 1.00 0.00 C ATOM 857 CE2 TYR A 528 11.292 -5.876 -10.237 1.00 0.00 C ATOM 858 CZ TYR A 528 10.072 -5.909 -10.880 1.00 0.00 C ATOM 859 OH TYR A 528 9.818 -6.886 -11.815 1.00 0.00 O ATOM 0 H TYR A 528 12.693 -1.849 -9.267 1.00 0.00 H new ATOM 0 HA TYR A 528 9.933 -1.379 -9.207 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.862 -3.017 -7.546 1.00 0.00 H new ATOM 0 HB3 TYR A 528 10.158 -2.964 -7.139 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.608 -3.253 -9.427 1.00 0.00 H new ATOM 0 HD2 TYR A 528 12.499 -4.872 -8.796 1.00 0.00 H new ATOM 0 HE1 TYR A 528 8.151 -4.997 -11.094 1.00 0.00 H new ATOM 0 HE2 TYR A 528 12.047 -6.614 -10.466 1.00 0.00 H new ATOM 0 HH TYR A 528 10.602 -7.468 -11.901 1.00 0.00 H new ATOM 869 N GLY A 529 11.522 -0.354 -6.483 1.00 0.00 N ATOM 870 CA GLY A 529 11.409 0.558 -5.361 1.00 0.00 C ATOM 871 C GLY A 529 11.059 1.968 -5.793 1.00 0.00 C ATOM 872 O GLY A 529 10.231 2.630 -5.166 1.00 0.00 O ATOM 0 H GLY A 529 12.387 -0.893 -6.511 1.00 0.00 H new ATOM 0 HA2 GLY A 529 10.646 0.192 -4.674 1.00 0.00 H new ATOM 0 HA3 GLY A 529 12.351 0.573 -4.812 1.00 0.00 H new ATOM 876 N TYR A 530 11.691 2.431 -6.866 1.00 0.00 N ATOM 877 CA TYR A 530 11.445 3.773 -7.379 1.00 0.00 C ATOM 878 C TYR A 530 9.949 4.058 -7.464 1.00 0.00 C ATOM 879 O TYR A 530 9.483 5.122 -7.057 1.00 0.00 O ATOM 880 CB TYR A 530 12.087 3.941 -8.757 1.00 0.00 C ATOM 881 CG TYR A 530 11.396 4.967 -9.626 1.00 0.00 C ATOM 882 CD1 TYR A 530 11.546 6.327 -9.382 1.00 0.00 C ATOM 883 CD2 TYR A 530 10.592 4.577 -10.690 1.00 0.00 C ATOM 884 CE1 TYR A 530 10.915 7.268 -10.173 1.00 0.00 C ATOM 885 CE2 TYR A 530 9.959 5.511 -11.487 1.00 0.00 C ATOM 886 CZ TYR A 530 10.124 6.855 -11.225 1.00 0.00 C ATOM 887 OH TYR A 530 9.494 7.789 -12.015 1.00 0.00 O ATOM 0 H TYR A 530 12.378 1.896 -7.397 1.00 0.00 H new ATOM 0 HA TYR A 530 11.893 4.486 -6.688 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.131 4.229 -8.630 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.082 2.980 -9.271 1.00 0.00 H new ATOM 0 HD1 TYR A 530 12.166 6.654 -8.560 1.00 0.00 H new ATOM 0 HD2 TYR A 530 10.460 3.525 -10.898 1.00 0.00 H new ATOM 0 HE1 TYR A 530 11.040 8.321 -9.969 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.338 5.191 -12.311 1.00 0.00 H new ATOM 0 HH TYR A 530 8.977 7.333 -12.711 1.00 0.00 H new ATOM 897 N VAL A 531 9.200 3.098 -7.997 1.00 0.00 N ATOM 898 CA VAL A 531 7.755 3.242 -8.135 1.00 0.00 C ATOM 899 C VAL A 531 7.084 3.381 -6.773 1.00 0.00 C ATOM 900 O VAL A 531 6.506 4.421 -6.456 1.00 0.00 O ATOM 901 CB VAL A 531 7.140 2.043 -8.879 1.00 0.00 C ATOM 902 CG1 VAL A 531 5.625 2.169 -8.935 1.00 0.00 C ATOM 903 CG2 VAL A 531 7.725 1.926 -10.278 1.00 0.00 C ATOM 0 H VAL A 531 9.570 2.212 -8.341 1.00 0.00 H new ATOM 0 HA VAL A 531 7.581 4.148 -8.716 1.00 0.00 H new ATOM 0 HB VAL A 531 7.385 1.134 -8.331 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.208 1.312 -9.465 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.225 2.199 -7.922 1.00 0.00 H new ATOM 0 HG13 VAL A 531 5.355 3.086 -9.459 1.00 0.00 H new ATOM 0 HG21 VAL A 531 7.279 1.073 -10.789 1.00 0.00 H new ATOM 0 HG22 VAL A 531 7.513 2.836 -10.838 1.00 0.00 H new ATOM 0 HG23 VAL A 531 8.804 1.785 -10.211 1.00 0.00 H new ATOM 913 N LEU A 532 7.165 2.326 -5.970 1.00 0.00 N ATOM 914 CA LEU A 532 6.566 2.329 -4.640 1.00 0.00 C ATOM 915 C LEU A 532 7.266 1.330 -3.725 1.00 0.00 C ATOM 916 O LEU A 532 7.080 0.117 -3.829 1.00 0.00 O ATOM 917 CB LEU A 532 5.075 1.996 -4.730 1.00 0.00 C ATOM 918 CG LEU A 532 4.251 2.262 -3.470 1.00 0.00 C ATOM 919 CD1 LEU A 532 3.925 3.742 -3.347 1.00 0.00 C ATOM 920 CD2 LEU A 532 2.975 1.432 -3.482 1.00 0.00 C ATOM 0 H LEU A 532 7.640 1.457 -6.217 1.00 0.00 H new ATOM 0 HA LEU A 532 6.685 3.327 -4.217 1.00 0.00 H new ATOM 0 HB2 LEU A 532 4.644 2.570 -5.550 1.00 0.00 H new ATOM 0 HB3 LEU A 532 4.974 0.943 -4.991 1.00 0.00 H new ATOM 0 HG LEU A 532 4.844 1.969 -2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 532 3.338 3.911 -2.444 1.00 0.00 H new ATOM 0 HD12 LEU A 532 4.851 4.315 -3.291 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.352 4.062 -4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 532 2.401 1.634 -2.578 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.379 1.694 -4.356 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.230 0.373 -3.521 1.00 0.00 H new ATOM 932 N PRO A 533 8.091 1.849 -2.803 1.00 0.00 N ATOM 933 CA PRO A 533 8.835 1.021 -1.849 1.00 0.00 C ATOM 934 C PRO A 533 7.924 0.373 -0.811 1.00 0.00 C ATOM 935 O PRO A 533 6.819 0.851 -0.557 1.00 0.00 O ATOM 936 CB PRO A 533 9.785 2.016 -1.180 1.00 0.00 C ATOM 937 CG PRO A 533 9.109 3.337 -1.317 1.00 0.00 C ATOM 938 CD PRO A 533 8.361 3.285 -2.621 1.00 0.00 C ATOM 0 HA PRO A 533 9.343 0.191 -2.340 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.950 1.763 -0.133 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.761 2.019 -1.665 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.429 3.516 -0.484 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.836 4.149 -1.316 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.439 3.865 -2.579 1.00 0.00 H new ATOM 0 HD3 PRO A 533 8.955 3.689 -3.441 1.00 0.00 H new ATOM 946 N ASN A 534 8.396 -0.717 -0.215 1.00 0.00 N ATOM 947 CA ASN A 534 7.624 -1.430 0.796 1.00 0.00 C ATOM 948 C ASN A 534 7.126 -0.474 1.876 1.00 0.00 C ATOM 949 O ASN A 534 5.931 -0.413 2.165 1.00 0.00 O ATOM 950 CB ASN A 534 8.471 -2.536 1.429 1.00 0.00 C ATOM 951 CG ASN A 534 7.739 -3.257 2.545 1.00 0.00 C ATOM 952 OD1 ASN A 534 6.549 -3.035 2.767 1.00 0.00 O ATOM 953 ND2 ASN A 534 8.451 -4.127 3.253 1.00 0.00 N ATOM 0 H ASN A 534 9.309 -1.126 -0.415 1.00 0.00 H new ATOM 0 HA ASN A 534 6.759 -1.879 0.307 1.00 0.00 H new ATOM 0 HB2 ASN A 534 8.757 -3.255 0.662 1.00 0.00 H new ATOM 0 HB3 ASN A 534 9.392 -2.105 1.821 1.00 0.00 H new ATOM 0 HD21 ASN A 534 8.013 -4.643 4.016 1.00 0.00 H new ATOM 0 HD22 ASN A 534 9.435 -4.279 3.033 1.00 0.00 H new ATOM 960 N HIS A 535 8.052 0.273 2.469 1.00 0.00 N ATOM 961 CA HIS A 535 7.709 1.228 3.517 1.00 0.00 C ATOM 962 C HIS A 535 6.457 2.017 3.143 1.00 0.00 C ATOM 963 O HIS A 535 5.494 2.069 3.907 1.00 0.00 O ATOM 964 CB HIS A 535 8.874 2.185 3.766 1.00 0.00 C ATOM 965 CG HIS A 535 8.834 3.414 2.910 1.00 0.00 C ATOM 966 ND1 HIS A 535 8.060 4.522 2.987 1.00 0.00 N flip ATOM 967 CD2 HIS A 535 9.659 3.599 1.820 1.00 0.00 C flip ATOM 968 CE1 HIS A 535 8.429 5.348 1.954 1.00 0.00 C flip ATOM 969 NE2 HIS A 535 9.395 4.768 1.265 1.00 0.00 N flip ATOM 0 H HIS A 535 9.046 0.235 2.242 1.00 0.00 H new ATOM 0 HA HIS A 535 7.507 0.670 4.431 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.871 2.482 4.815 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.811 1.658 3.587 1.00 0.00 H new ATOM 0 HD1 HIS A 535 7.338 4.708 3.683 1.00 0.00 H new ATOM 0 HD2 HIS A 535 10.404 2.898 1.475 1.00 0.00 H new ATOM 0 HE1 HIS A 535 7.999 6.315 1.740 1.00 0.00 H new ATOM 977 N MET A 536 6.481 2.631 1.964 1.00 0.00 N ATOM 978 CA MET A 536 5.348 3.417 1.490 1.00 0.00 C ATOM 979 C MET A 536 4.123 2.533 1.280 1.00 0.00 C ATOM 980 O MET A 536 3.079 2.746 1.896 1.00 0.00 O ATOM 981 CB MET A 536 5.706 4.131 0.185 1.00 0.00 C ATOM 982 CG MET A 536 4.771 5.280 -0.155 1.00 0.00 C ATOM 983 SD MET A 536 5.138 6.775 0.784 1.00 0.00 S ATOM 984 CE MET A 536 6.592 7.368 -0.078 1.00 0.00 C ATOM 0 H MET A 536 7.272 2.599 1.320 1.00 0.00 H new ATOM 0 HA MET A 536 5.111 4.161 2.250 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.725 4.511 0.256 1.00 0.00 H new ATOM 0 HB3 MET A 536 5.692 3.408 -0.631 1.00 0.00 H new ATOM 0 HG2 MET A 536 4.842 5.498 -1.221 1.00 0.00 H new ATOM 0 HG3 MET A 536 3.742 4.976 0.040 1.00 0.00 H new ATOM 0 HE1 MET A 536 7.141 8.056 0.565 1.00 0.00 H new ATOM 0 HE2 MET A 536 7.231 6.524 -0.336 1.00 0.00 H new ATOM 0 HE3 MET A 536 6.289 7.886 -0.988 1.00 0.00 H new ATOM 994 N MET A 537 4.257 1.540 0.406 1.00 0.00 N ATOM 995 CA MET A 537 3.160 0.624 0.117 1.00 0.00 C ATOM 996 C MET A 537 2.389 0.280 1.387 1.00 0.00 C ATOM 997 O MET A 537 1.159 0.340 1.415 1.00 0.00 O ATOM 998 CB MET A 537 3.694 -0.655 -0.532 1.00 0.00 C ATOM 999 CG MET A 537 2.625 -1.463 -1.250 1.00 0.00 C ATOM 1000 SD MET A 537 3.280 -2.390 -2.651 1.00 0.00 S ATOM 1001 CE MET A 537 4.459 -3.459 -1.829 1.00 0.00 C ATOM 0 H MET A 537 5.114 1.350 -0.114 1.00 0.00 H new ATOM 0 HA MET A 537 2.480 1.119 -0.576 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.478 -0.392 -1.242 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.154 -1.277 0.235 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.163 -2.155 -0.545 1.00 0.00 H new ATOM 0 HG3 MET A 537 1.840 -0.792 -1.598 1.00 0.00 H new ATOM 0 HE1 MET A 537 4.961 -4.083 -2.568 1.00 0.00 H new ATOM 0 HE2 MET A 537 5.197 -2.852 -1.305 1.00 0.00 H new ATOM 0 HE3 MET A 537 3.937 -4.093 -1.113 1.00 0.00 H new ATOM 1011 N LEU A 538 3.119 -0.082 2.437 1.00 0.00 N ATOM 1012 CA LEU A 538 2.503 -0.436 3.711 1.00 0.00 C ATOM 1013 C LEU A 538 1.709 0.737 4.277 1.00 0.00 C ATOM 1014 O LEU A 538 0.527 0.604 4.595 1.00 0.00 O ATOM 1015 CB LEU A 538 3.574 -0.872 4.713 1.00 0.00 C ATOM 1016 CG LEU A 538 4.082 -2.307 4.570 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.261 -2.551 5.499 1.00 0.00 C ATOM 1018 CD2 LEU A 538 2.964 -3.300 4.853 1.00 0.00 C ATOM 0 H LEU A 538 4.137 -0.138 2.431 1.00 0.00 H new ATOM 0 HA LEU A 538 1.817 -1.265 3.537 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.424 -0.196 4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.174 -0.748 5.719 1.00 0.00 H new ATOM 0 HG LEU A 538 4.418 -2.452 3.543 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.609 -3.577 5.383 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.069 -1.864 5.249 1.00 0.00 H new ATOM 0 HD13 LEU A 538 4.951 -2.387 6.531 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.344 -4.316 4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.597 -3.155 5.869 1.00 0.00 H new ATOM 0 HD23 LEU A 538 2.149 -3.142 4.147 1.00 0.00 H new ATOM 1030 N LYS A 539 2.365 1.886 4.397 1.00 0.00 N ATOM 1031 CA LYS A 539 1.720 3.084 4.920 1.00 0.00 C ATOM 1032 C LYS A 539 0.394 3.342 4.213 1.00 0.00 C ATOM 1033 O LYS A 539 -0.606 3.673 4.851 1.00 0.00 O ATOM 1034 CB LYS A 539 2.641 4.296 4.758 1.00 0.00 C ATOM 1035 CG LYS A 539 2.135 5.543 5.461 1.00 0.00 C ATOM 1036 CD LYS A 539 1.113 6.285 4.616 1.00 0.00 C ATOM 1037 CE LYS A 539 0.768 7.639 5.218 1.00 0.00 C ATOM 1038 NZ LYS A 539 -0.240 8.369 4.401 1.00 0.00 N ATOM 0 H LYS A 539 3.344 2.013 4.139 1.00 0.00 H new ATOM 0 HA LYS A 539 1.521 2.925 5.980 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.628 4.046 5.146 1.00 0.00 H new ATOM 0 HB3 LYS A 539 2.761 4.511 3.696 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.687 5.267 6.416 1.00 0.00 H new ATOM 0 HG3 LYS A 539 2.974 6.203 5.681 1.00 0.00 H new ATOM 0 HD2 LYS A 539 1.504 6.423 3.608 1.00 0.00 H new ATOM 0 HD3 LYS A 539 0.208 5.684 4.527 1.00 0.00 H new ATOM 0 HE2 LYS A 539 0.384 7.500 6.229 1.00 0.00 H new ATOM 0 HE3 LYS A 539 1.673 8.241 5.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 0.174 9.256 4.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 -0.527 7.778 3.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 -1.072 8.584 4.987 1.00 0.00 H new ATOM 1052 N ILE A 540 0.392 3.186 2.894 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.813 3.399 2.101 1.00 0.00 C ATOM 1054 C ILE A 540 -1.835 2.295 2.348 1.00 0.00 C ATOM 1055 O ILE A 540 -2.962 2.560 2.767 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.493 3.460 0.596 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.549 4.546 0.317 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.761 3.718 -0.205 1.00 0.00 C ATOM 1059 CD1 ILE A 540 1.285 4.356 -0.990 1.00 0.00 C ATOM 0 H ILE A 540 1.211 2.913 2.351 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.232 4.355 2.414 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.081 2.499 0.288 1.00 0.00 H new ATOM 0 HG12 ILE A 540 0.056 5.518 0.309 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.272 4.562 1.133 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.519 3.758 -1.267 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.474 2.914 -0.026 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.199 4.667 0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 540 2.007 5.162 -1.121 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.807 3.399 -0.978 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.572 4.370 -1.814 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.434 1.055 2.086 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.314 -0.090 2.283 1.00 0.00 C ATOM 1073 C ALA A 541 -2.993 -0.032 3.647 1.00 0.00 C ATOM 1074 O ALA A 541 -4.197 -0.262 3.761 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.533 -1.387 2.135 1.00 0.00 C ATOM 0 H ALA A 541 -0.505 0.818 1.737 1.00 0.00 H new ATOM 0 HA ALA A 541 -3.090 -0.057 1.518 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -2.203 -2.234 2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -1.100 -1.439 1.136 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.736 -1.419 2.878 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.214 0.276 4.679 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.741 0.362 6.035 1.00 0.00 C ATOM 1083 C GLU A 542 -3.666 1.566 6.184 1.00 0.00 C ATOM 1084 O GLU A 542 -4.745 1.465 6.768 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.597 0.456 7.047 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.682 -0.757 7.045 1.00 0.00 C ATOM 1087 CD GLU A 542 0.412 -0.664 8.091 1.00 0.00 C ATOM 1088 OE1 GLU A 542 0.759 0.468 8.488 1.00 0.00 O ATOM 1089 OE2 GLU A 542 0.921 -1.724 8.513 1.00 0.00 O ATOM 0 H GLU A 542 -1.216 0.470 4.601 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.316 -0.543 6.231 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -1.006 1.347 6.833 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -2.016 0.583 8.045 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -1.274 -1.655 7.223 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -0.229 -0.864 6.059 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.236 2.705 5.651 1.00 0.00 N ATOM 1097 CA GLU A 543 -4.025 3.929 5.725 1.00 0.00 C ATOM 1098 C GLU A 543 -5.406 3.724 5.110 1.00 0.00 C ATOM 1099 O GLU A 543 -6.427 4.000 5.742 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.301 5.073 5.012 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.229 5.738 5.859 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.808 6.654 6.919 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.685 6.197 7.683 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -2.386 7.828 6.985 1.00 0.00 O ATOM 0 H GLU A 543 -2.346 2.806 5.163 1.00 0.00 H new ATOM 0 HA GLU A 543 -4.150 4.188 6.777 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.845 4.690 4.099 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -4.032 5.823 4.712 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.623 4.970 6.340 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.564 6.311 5.213 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.431 3.240 3.874 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.686 2.998 3.172 1.00 0.00 C ATOM 1113 C LEU A 544 -7.457 4.299 2.970 1.00 0.00 C ATOM 1114 O LEU A 544 -8.625 4.421 3.339 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.545 1.999 3.950 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.965 0.593 4.104 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -7.961 -0.322 4.799 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.572 0.026 2.748 1.00 0.00 C ATOM 0 H LEU A 544 -4.596 3.007 3.337 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.451 2.580 2.193 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.729 2.406 4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.513 1.919 3.455 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.069 0.656 4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.531 -1.318 4.900 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.192 0.075 5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.875 -0.380 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.161 -0.975 2.878 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.451 -0.023 2.105 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.822 0.669 2.288 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.790 5.294 2.367 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.393 6.603 2.099 1.00 0.00 C ATOM 1132 C PRO A 545 -8.467 6.537 1.018 1.00 0.00 C ATOM 1133 O PRO A 545 -8.174 6.262 -0.146 1.00 0.00 O ATOM 1134 CB PRO A 545 -6.209 7.449 1.625 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.236 6.465 1.074 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.395 5.218 1.900 1.00 0.00 C ATOM 0 HA PRO A 545 -7.898 7.006 2.977 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.516 8.169 0.867 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.774 8.017 2.447 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.437 6.264 0.022 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.217 6.847 1.136 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.217 4.319 1.309 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.693 5.196 2.733 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.711 6.789 1.410 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.829 6.760 0.475 1.00 0.00 C ATOM 1146 C LYS A 546 -10.566 7.676 -0.716 1.00 0.00 C ATOM 1147 O LYS A 546 -10.965 7.376 -1.841 1.00 0.00 O ATOM 1148 CB LYS A 546 -12.121 7.180 1.180 1.00 0.00 C ATOM 1149 CG LYS A 546 -12.085 8.599 1.721 1.00 0.00 C ATOM 1150 CD LYS A 546 -11.344 8.671 3.046 1.00 0.00 C ATOM 1151 CE LYS A 546 -11.868 9.803 3.916 1.00 0.00 C ATOM 1152 NZ LYS A 546 -10.835 10.294 4.870 1.00 0.00 N ATOM 0 H LYS A 546 -9.970 7.016 2.370 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.938 5.739 0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.953 7.087 0.482 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.317 6.492 2.002 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -11.601 9.254 0.996 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -13.103 8.966 1.852 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -11.450 7.724 3.576 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -10.279 8.815 2.862 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -12.197 10.626 3.282 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -12.741 9.460 4.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -11.231 11.065 5.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -10.539 9.515 5.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -10.012 10.645 4.340 1.00 0.00 H new ATOM 1166 N GLU A 547 -9.892 8.793 -0.461 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.576 9.751 -1.513 1.00 0.00 C ATOM 1168 C GLU A 547 -8.172 9.514 -2.062 1.00 0.00 C ATOM 1169 O GLU A 547 -7.333 8.868 -1.433 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.693 11.182 -0.983 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.082 11.777 -1.139 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.345 12.908 -0.164 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -10.887 12.813 0.994 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -12.008 13.890 -0.560 1.00 0.00 O ATOM 0 H GLU A 547 -9.555 9.056 0.465 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.292 9.611 -2.323 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.418 11.193 0.072 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -8.975 11.814 -1.506 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.203 12.145 -2.158 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.827 10.995 -0.992 1.00 0.00 H new ATOM 1181 N PRO A 548 -7.909 10.047 -3.264 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.608 9.907 -3.925 1.00 0.00 C ATOM 1183 C PRO A 548 -5.513 10.703 -3.223 1.00 0.00 C ATOM 1184 O PRO A 548 -4.336 10.348 -3.290 1.00 0.00 O ATOM 1185 CB PRO A 548 -6.860 10.466 -5.327 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.001 11.409 -5.160 1.00 0.00 C ATOM 1187 CD PRO A 548 -8.861 10.829 -4.071 1.00 0.00 C ATOM 0 HA PRO A 548 -6.257 8.875 -3.920 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -5.978 10.976 -5.714 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.103 9.671 -6.032 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -7.648 12.405 -4.890 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -8.563 11.510 -6.089 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.342 11.609 -3.481 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.654 10.201 -4.477 1.00 0.00 H new ATOM 1195 N GLN A 549 -5.908 11.779 -2.550 1.00 0.00 N ATOM 1196 CA GLN A 549 -4.958 12.624 -1.837 1.00 0.00 C ATOM 1197 C GLN A 549 -4.159 11.811 -0.824 1.00 0.00 C ATOM 1198 O GLN A 549 -2.941 11.950 -0.724 1.00 0.00 O ATOM 1199 CB GLN A 549 -5.691 13.764 -1.128 1.00 0.00 C ATOM 1200 CG GLN A 549 -4.778 14.905 -0.705 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.419 15.815 0.324 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -5.721 16.975 0.042 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -5.632 15.292 1.526 1.00 0.00 N ATOM 0 H GLN A 549 -6.879 12.086 -2.484 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.265 13.044 -2.566 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.464 14.155 -1.790 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.196 13.368 -0.247 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -3.855 14.494 -0.296 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.505 15.491 -1.583 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -5.366 14.326 1.716 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -6.062 15.856 2.259 1.00 0.00 H new ATOM 1212 N GLY A 550 -4.854 10.960 -0.075 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.192 10.137 0.921 1.00 0.00 C ATOM 1214 C GLY A 550 -3.020 9.365 0.348 1.00 0.00 C ATOM 1215 O GLY A 550 -2.006 9.173 1.021 1.00 0.00 O ATOM 0 H GLY A 550 -5.863 10.826 -0.140 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.842 10.770 1.737 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.911 9.437 1.346 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.157 8.920 -0.896 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.101 8.164 -1.558 1.00 0.00 C ATOM 1221 C ILE A 551 -0.970 9.081 -2.010 1.00 0.00 C ATOM 1222 O ILE A 551 0.166 8.640 -2.189 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.640 7.392 -2.777 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.663 6.345 -2.333 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.496 6.735 -3.535 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.077 6.877 -2.257 1.00 0.00 C ATOM 0 H ILE A 551 -3.989 9.070 -1.466 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.718 7.451 -0.828 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.136 8.096 -3.445 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.636 5.505 -3.027 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.375 5.959 -1.355 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -1.892 6.193 -4.394 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -0.800 7.500 -3.879 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -0.975 6.040 -2.876 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -5.749 6.081 -1.936 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.119 7.698 -1.541 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.384 7.236 -3.239 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.287 10.358 -2.192 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.297 11.338 -2.620 1.00 0.00 C ATOM 1240 C ILE A 552 0.498 11.872 -1.433 1.00 0.00 C ATOM 1241 O ILE A 552 1.714 12.040 -1.513 1.00 0.00 O ATOM 1242 CB ILE A 552 -0.956 12.520 -3.356 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.754 12.018 -4.561 1.00 0.00 C ATOM 1244 CG2 ILE A 552 0.099 13.525 -3.794 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.390 13.127 -5.369 1.00 0.00 C ATOM 0 H ILE A 552 -2.223 10.739 -2.050 1.00 0.00 H new ATOM 0 HA ILE A 552 0.378 10.825 -3.305 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.643 13.018 -2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.094 11.440 -5.208 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.533 11.340 -4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.382 14.354 -4.313 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.628 13.902 -2.919 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.808 13.039 -4.465 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -2.939 12.698 -6.207 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.076 13.691 -4.736 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.614 13.793 -5.747 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.199 12.135 -0.332 1.00 0.00 N ATOM 1258 CA ALA A 553 0.442 12.646 0.873 1.00 0.00 C ATOM 1259 C ALA A 553 1.571 11.726 1.327 1.00 0.00 C ATOM 1260 O ALA A 553 2.692 12.176 1.566 1.00 0.00 O ATOM 1261 CB ALA A 553 -0.583 12.814 1.985 1.00 0.00 C ATOM 0 H ALA A 553 -1.207 12.003 -0.250 1.00 0.00 H new ATOM 0 HA ALA A 553 0.873 13.620 0.640 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.091 13.196 2.879 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.353 13.516 1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.040 11.850 2.207 1.00 0.00 H new ATOM 1267 N CYS A 554 1.268 10.438 1.443 1.00 0.00 N ATOM 1268 CA CYS A 554 2.257 9.455 1.870 1.00 0.00 C ATOM 1269 C CYS A 554 3.609 9.726 1.216 1.00 0.00 C ATOM 1270 O CYS A 554 4.658 9.516 1.827 1.00 0.00 O ATOM 1271 CB CYS A 554 1.785 8.042 1.525 1.00 0.00 C ATOM 1272 SG CYS A 554 1.894 7.635 -0.233 1.00 0.00 S ATOM 0 H CYS A 554 0.345 10.050 1.247 1.00 0.00 H new ATOM 0 HA CYS A 554 2.372 9.538 2.951 1.00 0.00 H new ATOM 0 HB2 CYS A 554 2.379 7.324 2.090 1.00 0.00 H new ATOM 0 HB3 CYS A 554 0.751 7.927 1.850 1.00 0.00 H new ATOM 0 HG CYS A 554 1.068 8.382 -0.903 1.00 0.00 H new ATOM 1278 N CYS A 555 3.576 10.191 -0.028 1.00 0.00 N ATOM 1279 CA CYS A 555 4.799 10.488 -0.765 1.00 0.00 C ATOM 1280 C CYS A 555 5.189 11.953 -0.604 1.00 0.00 C ATOM 1281 O CYS A 555 4.348 12.845 -0.707 1.00 0.00 O ATOM 1282 CB CYS A 555 4.618 10.156 -2.247 1.00 0.00 C ATOM 1283 SG CYS A 555 4.098 8.454 -2.565 1.00 0.00 S ATOM 0 H CYS A 555 2.716 10.370 -0.547 1.00 0.00 H new ATOM 0 HA CYS A 555 5.599 9.871 -0.356 1.00 0.00 H new ATOM 0 HB2 CYS A 555 3.880 10.836 -2.673 1.00 0.00 H new ATOM 0 HB3 CYS A 555 5.558 10.340 -2.767 1.00 0.00 H new ATOM 0 HG CYS A 555 3.313 8.054 -1.609 1.00 0.00 H new ATOM 1289 N ASN A 556 6.471 12.194 -0.348 1.00 0.00 N ATOM 1290 CA ASN A 556 6.973 13.552 -0.169 1.00 0.00 C ATOM 1291 C ASN A 556 8.491 13.594 -0.312 1.00 0.00 C ATOM 1292 O ASN A 556 9.235 13.177 0.576 1.00 0.00 O ATOM 1293 CB ASN A 556 6.563 14.093 1.202 1.00 0.00 C ATOM 1294 CG ASN A 556 7.083 15.496 1.449 1.00 0.00 C ATOM 1295 OD1 ASN A 556 8.217 15.821 1.094 1.00 0.00 O ATOM 1296 ND2 ASN A 556 6.255 16.335 2.060 1.00 0.00 N ATOM 0 H ASN A 556 7.181 11.467 -0.260 1.00 0.00 H new ATOM 0 HA ASN A 556 6.535 14.180 -0.945 1.00 0.00 H new ATOM 0 HB2 ASN A 556 5.476 14.093 1.279 1.00 0.00 H new ATOM 0 HB3 ASN A 556 6.938 13.427 1.979 1.00 0.00 H new ATOM 0 HD21 ASN A 556 6.550 17.292 2.253 1.00 0.00 H new ATOM 0 HD22 ASN A 556 5.324 16.022 2.336 1.00 0.00 H new ATOM 1303 N PRO A 557 8.964 14.109 -1.457 1.00 0.00 N ATOM 1304 CA PRO A 557 8.088 14.607 -2.522 1.00 0.00 C ATOM 1305 C PRO A 557 7.334 13.484 -3.225 1.00 0.00 C ATOM 1306 O PRO A 557 7.592 12.304 -2.986 1.00 0.00 O ATOM 1307 CB PRO A 557 9.059 15.287 -3.490 1.00 0.00 C ATOM 1308 CG PRO A 557 10.364 14.605 -3.259 1.00 0.00 C ATOM 1309 CD PRO A 557 10.390 14.244 -1.800 1.00 0.00 C ATOM 0 HA PRO A 557 7.314 15.271 -2.136 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.731 15.175 -4.523 1.00 0.00 H new ATOM 0 HB3 PRO A 557 9.131 16.357 -3.293 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.455 13.716 -3.883 1.00 0.00 H new ATOM 0 HG3 PRO A 557 11.197 15.260 -3.514 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.935 13.316 -1.625 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.876 15.016 -1.203 1.00 0.00 H new ATOM 1317 N VAL A 558 6.399 13.858 -4.093 1.00 0.00 N ATOM 1318 CA VAL A 558 5.607 12.882 -4.832 1.00 0.00 C ATOM 1319 C VAL A 558 6.168 12.667 -6.233 1.00 0.00 C ATOM 1320 O VAL A 558 6.365 13.609 -7.001 1.00 0.00 O ATOM 1321 CB VAL A 558 4.135 13.320 -4.942 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.332 12.302 -5.737 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.535 13.521 -3.558 1.00 0.00 C ATOM 0 H VAL A 558 6.172 14.830 -4.302 1.00 0.00 H new ATOM 0 HA VAL A 558 5.659 11.946 -4.275 1.00 0.00 H new ATOM 0 HB VAL A 558 4.096 14.271 -5.472 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.294 12.629 -5.804 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.749 12.212 -6.740 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.376 11.334 -5.238 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.494 13.830 -3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.586 12.586 -3.000 1.00 0.00 H new ATOM 0 HG23 VAL A 558 4.095 14.291 -3.027 1.00 0.00 H new ATOM 1333 N PRO A 559 6.433 11.397 -6.576 1.00 0.00 N ATOM 1334 CA PRO A 559 6.974 11.028 -7.888 1.00 0.00 C ATOM 1335 C PRO A 559 5.960 11.223 -9.009 1.00 0.00 C ATOM 1336 O PRO A 559 4.764 11.399 -8.774 1.00 0.00 O ATOM 1337 CB PRO A 559 7.314 9.545 -7.726 1.00 0.00 C ATOM 1338 CG PRO A 559 6.406 9.063 -6.648 1.00 0.00 C ATOM 1339 CD PRO A 559 6.223 10.225 -5.711 1.00 0.00 C ATOM 0 HA PRO A 559 7.827 11.647 -8.166 1.00 0.00 H new ATOM 0 HB2 PRO A 559 7.151 8.998 -8.655 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.360 9.406 -7.454 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.450 8.739 -7.059 1.00 0.00 H new ATOM 0 HG3 PRO A 559 6.837 8.207 -6.129 1.00 0.00 H new ATOM 0 HD2 PRO A 559 5.229 10.228 -5.264 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.941 10.197 -4.891 1.00 0.00 H new ATOM 1347 N PRO A 560 6.445 11.192 -10.259 1.00 0.00 N ATOM 1348 CA PRO A 560 5.597 11.362 -11.442 1.00 0.00 C ATOM 1349 C PRO A 560 4.670 10.173 -11.667 1.00 0.00 C ATOM 1350 O PRO A 560 3.833 10.186 -12.571 1.00 0.00 O ATOM 1351 CB PRO A 560 6.605 11.479 -12.588 1.00 0.00 C ATOM 1352 CG PRO A 560 7.817 10.763 -12.100 1.00 0.00 C ATOM 1353 CD PRO A 560 7.860 10.986 -10.614 1.00 0.00 C ATOM 0 HA PRO A 560 4.936 12.223 -11.348 1.00 0.00 H new ATOM 0 HB2 PRO A 560 6.220 11.027 -13.502 1.00 0.00 H new ATOM 0 HB3 PRO A 560 6.826 12.522 -12.816 1.00 0.00 H new ATOM 0 HG2 PRO A 560 7.762 9.700 -12.334 1.00 0.00 H new ATOM 0 HG3 PRO A 560 8.717 11.149 -12.579 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.285 10.129 -10.091 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.469 11.852 -10.355 1.00 0.00 H new ATOM 1361 N LEU A 561 4.823 9.144 -10.840 1.00 0.00 N ATOM 1362 CA LEU A 561 3.999 7.946 -10.948 1.00 0.00 C ATOM 1363 C LEU A 561 2.777 8.041 -10.041 1.00 0.00 C ATOM 1364 O LEU A 561 1.661 8.272 -10.507 1.00 0.00 O ATOM 1365 CB LEU A 561 4.819 6.705 -10.590 1.00 0.00 C ATOM 1366 CG LEU A 561 5.850 6.259 -11.627 1.00 0.00 C ATOM 1367 CD1 LEU A 561 6.565 5.000 -11.162 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.184 6.029 -12.976 1.00 0.00 C ATOM 0 H LEU A 561 5.511 9.116 -10.087 1.00 0.00 H new ATOM 0 HA LEU A 561 3.657 7.863 -11.979 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.338 6.896 -9.650 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.131 5.878 -10.412 1.00 0.00 H new ATOM 0 HG LEU A 561 6.590 7.051 -11.740 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.295 4.698 -11.913 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.075 5.198 -10.219 1.00 0.00 H new ATOM 0 HD13 LEU A 561 5.838 4.200 -11.020 1.00 0.00 H new ATOM 0 HD21 LEU A 561 5.933 5.712 -13.702 1.00 0.00 H new ATOM 0 HD22 LEU A 561 4.423 5.255 -12.879 1.00 0.00 H new ATOM 0 HD23 LEU A 561 4.719 6.955 -13.315 1.00 0.00 H new ATOM 1380 N VAL A 562 2.995 7.865 -8.742 1.00 0.00 N ATOM 1381 CA VAL A 562 1.913 7.935 -7.767 1.00 0.00 C ATOM 1382 C VAL A 562 0.893 9.000 -8.154 1.00 0.00 C ATOM 1383 O VAL A 562 -0.311 8.814 -7.978 1.00 0.00 O ATOM 1384 CB VAL A 562 2.447 8.240 -6.355 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.299 8.368 -5.366 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.426 7.163 -5.912 1.00 0.00 C ATOM 0 H VAL A 562 3.912 7.673 -8.340 1.00 0.00 H new ATOM 0 HA VAL A 562 1.430 6.958 -7.760 1.00 0.00 H new ATOM 0 HB VAL A 562 2.978 9.192 -6.384 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.696 8.583 -4.374 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.640 9.178 -5.677 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.738 7.434 -5.337 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.794 7.394 -4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.922 6.197 -5.899 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.265 7.125 -6.607 1.00 0.00 H new ATOM 1396 N ARG A 563 1.384 10.116 -8.683 1.00 0.00 N ATOM 1397 CA ARG A 563 0.515 11.212 -9.095 1.00 0.00 C ATOM 1398 C ARG A 563 -0.176 10.892 -10.417 1.00 0.00 C ATOM 1399 O ARG A 563 -1.361 11.172 -10.592 1.00 0.00 O ATOM 1400 CB ARG A 563 1.320 12.506 -9.228 1.00 0.00 C ATOM 1401 CG ARG A 563 0.456 13.754 -9.325 1.00 0.00 C ATOM 1402 CD ARG A 563 0.158 14.332 -7.951 1.00 0.00 C ATOM 1403 NE ARG A 563 -0.237 15.736 -8.023 1.00 0.00 N ATOM 1404 CZ ARG A 563 0.627 16.738 -8.144 1.00 0.00 C ATOM 1405 NH1 ARG A 563 1.928 16.491 -8.207 1.00 0.00 N ATOM 1406 NH2 ARG A 563 0.190 17.990 -8.202 1.00 0.00 N ATOM 0 H ARG A 563 2.378 10.285 -8.836 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.249 11.344 -8.329 1.00 0.00 H new ATOM 0 HB2 ARG A 563 1.985 12.600 -8.369 1.00 0.00 H new ATOM 0 HB3 ARG A 563 1.951 12.442 -10.114 1.00 0.00 H new ATOM 0 HG2 ARG A 563 0.963 14.503 -9.934 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -0.479 13.512 -9.830 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.638 13.755 -7.480 1.00 0.00 H new ATOM 0 HD3 ARG A 563 1.040 14.235 -7.318 1.00 0.00 H new ATOM 0 HE ARG A 563 -1.231 15.960 -7.978 1.00 0.00 H new ATOM 0 HH11 ARG A 563 2.267 15.530 -8.163 1.00 0.00 H new ATOM 0 HH12 ARG A 563 2.590 17.262 -8.300 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -0.810 18.184 -8.154 1.00 0.00 H new ATOM 0 HH22 ARG A 563 0.854 18.758 -8.295 1.00 0.00 H new ATOM 1420 N GLN A 564 0.574 10.303 -11.343 1.00 0.00 N ATOM 1421 CA GLN A 564 0.034 9.945 -12.649 1.00 0.00 C ATOM 1422 C GLN A 564 -0.991 8.822 -12.526 1.00 0.00 C ATOM 1423 O GLN A 564 -2.127 8.954 -12.980 1.00 0.00 O ATOM 1424 CB GLN A 564 1.161 9.522 -13.592 1.00 0.00 C ATOM 1425 CG GLN A 564 0.675 9.093 -14.968 1.00 0.00 C ATOM 1426 CD GLN A 564 1.768 8.452 -15.799 1.00 0.00 C ATOM 1427 OE1 GLN A 564 2.747 9.102 -16.166 1.00 0.00 O ATOM 1428 NE2 GLN A 564 1.606 7.169 -16.101 1.00 0.00 N ATOM 0 H GLN A 564 1.557 10.064 -11.213 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.464 10.823 -13.061 1.00 0.00 H new ATOM 0 HB2 GLN A 564 1.859 10.351 -13.705 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.714 8.699 -13.138 1.00 0.00 H new ATOM 0 HG2 GLN A 564 -0.150 8.390 -14.855 1.00 0.00 H new ATOM 0 HG3 GLN A 564 0.283 9.961 -15.498 1.00 0.00 H new ATOM 0 HE21 GLN A 564 0.779 6.669 -15.776 1.00 0.00 H new ATOM 0 HE22 GLN A 564 2.309 6.684 -16.658 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.580 7.719 -11.909 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.463 6.572 -11.727 1.00 0.00 C ATOM 1439 C GLN A 565 -2.305 6.728 -10.465 1.00 0.00 C ATOM 1440 O GLN A 565 -2.855 5.754 -9.951 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.647 5.280 -11.654 1.00 0.00 C ATOM 1442 CG GLN A 565 0.339 5.118 -12.799 1.00 0.00 C ATOM 1443 CD GLN A 565 0.638 3.664 -13.110 1.00 0.00 C ATOM 1444 OE1 GLN A 565 1.296 2.974 -12.330 1.00 0.00 O ATOM 1445 NE2 GLN A 565 0.156 3.191 -14.253 1.00 0.00 N ATOM 0 H GLN A 565 0.358 7.595 -11.527 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.134 6.522 -12.585 1.00 0.00 H new ATOM 0 HB2 GLN A 565 -0.102 5.257 -10.710 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.329 4.429 -11.649 1.00 0.00 H new ATOM 0 HG2 GLN A 565 -0.062 5.601 -13.690 1.00 0.00 H new ATOM 0 HG3 GLN A 565 1.268 5.631 -12.549 1.00 0.00 H new ATOM 0 HE21 GLN A 565 -0.384 3.799 -14.869 1.00 0.00 H new ATOM 0 HE22 GLN A 565 0.326 2.220 -14.515 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.400 7.958 -9.972 1.00 0.00 N ATOM 1455 CA ILE A 566 -3.175 8.241 -8.770 1.00 0.00 C ATOM 1456 C ILE A 566 -4.579 7.652 -8.871 1.00 0.00 C ATOM 1457 O ILE A 566 -5.118 7.138 -7.892 1.00 0.00 O ATOM 1458 CB ILE A 566 -3.284 9.755 -8.513 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.802 10.019 -7.098 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -4.193 10.404 -9.546 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -3.083 9.221 -6.033 1.00 0.00 C ATOM 0 H ILE A 566 -1.950 8.774 -10.386 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.646 7.777 -7.937 1.00 0.00 H new ATOM 0 HB ILE A 566 -2.291 10.196 -8.604 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.701 11.081 -6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.866 9.785 -7.060 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -4.260 11.474 -9.351 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.784 10.242 -10.543 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -5.187 9.961 -9.485 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.502 9.459 -5.055 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -3.205 8.156 -6.231 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -2.022 9.472 -6.044 1.00 0.00 H new ATOM 1473 N ASN A 567 -5.163 7.731 -10.062 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.504 7.204 -10.291 1.00 0.00 C ATOM 1475 C ASN A 567 -6.565 5.713 -9.973 1.00 0.00 C ATOM 1476 O ASN A 567 -7.451 5.258 -9.251 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.928 7.446 -11.741 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.626 8.858 -12.204 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -5.846 9.065 -13.133 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -7.245 9.838 -11.555 1.00 0.00 N ATOM 0 H ASN A 567 -4.730 8.154 -10.883 1.00 0.00 H new ATOM 0 HA ASN A 567 -7.191 7.727 -9.626 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.415 6.736 -12.390 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.996 7.255 -11.841 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -7.081 10.809 -11.821 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -7.884 9.619 -10.790 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.615 4.958 -10.518 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.561 3.519 -10.293 1.00 0.00 C ATOM 1489 C GLU A 568 -5.389 3.206 -8.809 1.00 0.00 C ATOM 1490 O GLU A 568 -6.157 2.437 -8.233 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.415 2.897 -11.093 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.391 1.379 -11.043 1.00 0.00 C ATOM 1493 CD GLU A 568 -5.704 0.760 -11.479 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.441 1.413 -12.249 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -5.997 -0.376 -11.051 1.00 0.00 O ATOM 0 H GLU A 568 -4.873 5.320 -11.118 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.504 3.089 -10.630 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.493 3.217 -12.132 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.468 3.280 -10.712 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -3.590 1.011 -11.684 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.161 1.056 -10.028 1.00 0.00 H new ATOM 1502 N MET A 569 -4.374 3.809 -8.198 1.00 0.00 N ATOM 1503 CA MET A 569 -4.100 3.596 -6.781 1.00 0.00 C ATOM 1504 C MET A 569 -5.362 3.796 -5.948 1.00 0.00 C ATOM 1505 O MET A 569 -5.788 2.897 -5.223 1.00 0.00 O ATOM 1506 CB MET A 569 -3.003 4.548 -6.303 1.00 0.00 C ATOM 1507 CG MET A 569 -1.686 4.378 -7.043 1.00 0.00 C ATOM 1508 SD MET A 569 -0.892 2.797 -6.691 1.00 0.00 S ATOM 1509 CE MET A 569 0.348 3.299 -5.500 1.00 0.00 C ATOM 0 H MET A 569 -3.728 4.448 -8.661 1.00 0.00 H new ATOM 0 HA MET A 569 -3.760 2.568 -6.652 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.347 5.575 -6.422 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.835 4.390 -5.238 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.863 4.461 -8.115 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.011 5.189 -6.767 1.00 0.00 H new ATOM 0 HE1 MET A 569 0.740 2.419 -4.990 1.00 0.00 H new ATOM 0 HE2 MET A 569 1.160 3.812 -6.015 1.00 0.00 H new ATOM 0 HE3 MET A 569 -0.101 3.972 -4.769 1.00 0.00 H new ATOM 1519 N HIS A 570 -5.956 4.981 -6.056 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.169 5.299 -5.311 1.00 0.00 C ATOM 1521 C HIS A 570 -8.201 4.184 -5.453 1.00 0.00 C ATOM 1522 O HIS A 570 -8.805 3.753 -4.470 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.760 6.622 -5.799 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.163 6.860 -5.331 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -10.048 7.683 -5.994 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.832 6.376 -4.258 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.201 7.696 -5.349 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.096 6.911 -4.292 1.00 0.00 N ATOM 0 H HIS A 570 -5.617 5.736 -6.652 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.905 5.394 -4.258 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.128 7.441 -5.457 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.741 6.639 -6.889 1.00 0.00 H new ATOM 0 HD1 HIS A 570 -9.845 8.201 -6.849 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.444 5.696 -3.514 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.080 8.254 -5.637 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.399 3.721 -6.683 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.358 2.656 -6.954 1.00 0.00 C ATOM 1538 C LEU A 571 -9.072 1.431 -6.091 1.00 0.00 C ATOM 1539 O LEU A 571 -9.968 0.894 -5.439 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.318 2.271 -8.434 1.00 0.00 C ATOM 1541 CG LEU A 571 -9.945 3.273 -9.405 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.652 2.876 -10.843 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.445 3.374 -9.172 1.00 0.00 C ATOM 0 H LEU A 571 -7.908 4.066 -7.508 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.353 3.027 -6.707 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.278 2.119 -8.721 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -9.825 1.313 -8.554 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.503 4.253 -9.223 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.106 3.600 -11.520 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.574 2.856 -11.002 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.066 1.887 -11.039 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.874 4.091 -9.871 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -11.904 2.397 -9.326 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.633 3.706 -8.151 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.816 0.996 -6.088 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.410 -0.164 -5.303 1.00 0.00 C ATOM 1557 C LEU A 572 -7.836 -0.012 -3.846 1.00 0.00 C ATOM 1558 O LEU A 572 -8.420 -0.925 -3.262 1.00 0.00 O ATOM 1559 CB LEU A 572 -5.895 -0.355 -5.385 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.297 -0.379 -6.792 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.778 -0.428 -6.726 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -5.836 -1.564 -7.581 1.00 0.00 C ATOM 0 H LEU A 572 -7.062 1.430 -6.621 1.00 0.00 H new ATOM 0 HA LEU A 572 -7.904 -1.043 -5.717 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.417 0.447 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.639 -1.290 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.589 0.537 -7.305 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.370 -0.445 -7.737 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.408 0.452 -6.200 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.466 -1.327 -6.194 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.400 -1.565 -8.580 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.575 -2.491 -7.070 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -6.920 -1.486 -7.659 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.543 1.148 -3.267 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.900 1.420 -1.880 1.00 0.00 C ATOM 1576 C ILE A 573 -9.396 1.237 -1.651 1.00 0.00 C ATOM 1577 O ILE A 573 -9.814 0.681 -0.635 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.499 2.849 -1.467 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -6.008 3.078 -1.720 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.837 3.091 -0.003 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.115 2.087 -1.005 1.00 0.00 C ATOM 0 H ILE A 573 -7.060 1.914 -3.737 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.352 0.705 -1.266 1.00 0.00 H new ATOM 0 HB ILE A 573 -8.063 3.558 -2.073 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.816 3.020 -2.791 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.745 4.087 -1.403 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.548 4.105 0.274 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.909 2.965 0.149 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.296 2.377 0.618 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -4.072 2.309 -1.230 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.278 2.160 0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.351 1.077 -1.340 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.197 1.706 -2.602 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.647 1.592 -2.504 1.00 0.00 C ATOM 1595 C GLN A 574 -12.086 0.134 -2.594 1.00 0.00 C ATOM 1596 O GLN A 574 -13.113 -0.249 -2.033 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.320 2.409 -3.609 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.861 3.857 -3.660 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.690 4.764 -2.773 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -12.237 4.963 -1.541 1.00 0.00 O flip ATOM 1601 NE2 GLN A 574 -13.727 5.281 -3.191 1.00 0.00 N flip ATOM 0 H GLN A 574 -9.866 2.168 -3.449 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.952 1.985 -1.534 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.118 1.939 -4.571 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.400 2.384 -3.462 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.816 3.914 -3.355 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -11.913 4.215 -4.688 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -14.038 5.100 -4.145 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -14.275 5.890 -2.583 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.302 -0.672 -3.302 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.612 -2.088 -3.465 1.00 0.00 C ATOM 1612 C GLN A 575 -11.393 -2.847 -2.161 1.00 0.00 C ATOM 1613 O GLN A 575 -12.147 -3.760 -1.829 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.750 -2.695 -4.574 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.112 -2.201 -5.965 1.00 0.00 C ATOM 1616 CD GLN A 575 -10.655 -3.147 -7.058 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -11.469 -3.684 -7.810 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -9.348 -3.358 -7.150 1.00 0.00 N ATOM 0 H GLN A 575 -10.448 -0.370 -3.772 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.663 -2.175 -3.742 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.703 -2.464 -4.377 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -10.848 -3.780 -4.546 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.192 -2.071 -6.030 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.663 -1.221 -6.127 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -8.710 -2.892 -6.506 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -8.982 -3.986 -7.865 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.355 -2.462 -1.425 1.00 0.00 N ATOM 1628 CA ALA A 576 -10.037 -3.106 -0.157 1.00 0.00 C ATOM 1629 C ALA A 576 -10.826 -2.480 0.989 1.00 0.00 C ATOM 1630 O ALA A 576 -11.010 -3.097 2.038 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.544 -3.020 0.120 1.00 0.00 C ATOM 0 H ALA A 576 -9.720 -1.707 -1.686 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.321 -4.156 -0.230 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.322 -3.505 1.070 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -7.996 -3.519 -0.679 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.242 -1.974 0.168 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.290 -1.252 0.780 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.057 -0.542 1.796 1.00 0.00 C ATOM 1639 C ARG A 577 -13.545 -0.859 1.674 1.00 0.00 C ATOM 1640 O ARG A 577 -14.229 -1.065 2.676 1.00 0.00 O ATOM 1641 CB ARG A 577 -11.834 0.966 1.673 1.00 0.00 C ATOM 1642 CG ARG A 577 -12.590 1.780 2.711 1.00 0.00 C ATOM 1643 CD ARG A 577 -12.257 3.260 2.608 1.00 0.00 C ATOM 1644 NE ARG A 577 -13.133 4.077 3.444 1.00 0.00 N ATOM 1645 CZ ARG A 577 -12.946 4.260 4.746 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -11.919 3.686 5.359 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -13.787 5.018 5.439 1.00 0.00 N ATOM 0 H ARG A 577 -11.148 -0.728 -0.084 1.00 0.00 H new ATOM 0 HA ARG A 577 -11.711 -0.874 2.775 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -10.768 1.176 1.765 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -12.138 1.290 0.678 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -13.662 1.637 2.577 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -12.343 1.419 3.709 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -11.220 3.420 2.904 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -12.345 3.580 1.570 1.00 0.00 H new ATOM 0 HE ARG A 577 -13.932 4.532 3.003 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -11.271 3.103 4.830 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -11.778 3.828 6.359 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -14.578 5.461 4.972 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -13.642 5.158 6.439 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.037 -0.896 0.440 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.444 -1.186 0.188 1.00 0.00 C ATOM 1663 C GLU A 578 -15.853 -2.505 0.839 1.00 0.00 C ATOM 1664 O GLU A 578 -16.925 -2.609 1.434 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.714 -1.242 -1.317 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.117 -2.461 -1.998 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.240 -2.406 -3.508 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -15.117 -1.298 -4.072 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -15.461 -3.468 -4.126 1.00 0.00 O ATOM 0 H GLU A 578 -13.483 -0.729 -0.400 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.038 -0.385 0.627 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -16.791 -1.234 -1.485 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -15.312 -0.343 -1.783 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -14.065 -2.545 -1.726 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -15.614 -3.358 -1.629 1.00 0.00 H new ATOM 1676 N MET A 579 -14.990 -3.508 0.719 1.00 0.00 N ATOM 1677 CA MET A 579 -15.260 -4.820 1.296 1.00 0.00 C ATOM 1678 C MET A 579 -15.161 -4.776 2.818 1.00 0.00 C ATOM 1679 O MET A 579 -14.301 -4.105 3.389 1.00 0.00 O ATOM 1680 CB MET A 579 -14.282 -5.857 0.740 1.00 0.00 C ATOM 1681 CG MET A 579 -12.823 -5.514 0.992 1.00 0.00 C ATOM 1682 SD MET A 579 -12.257 -6.043 2.620 1.00 0.00 S ATOM 1683 CE MET A 579 -12.500 -7.814 2.504 1.00 0.00 C ATOM 0 H MET A 579 -14.099 -3.438 0.228 1.00 0.00 H new ATOM 0 HA MET A 579 -16.276 -5.106 1.024 1.00 0.00 H new ATOM 0 HB2 MET A 579 -14.501 -6.827 1.187 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.443 -5.957 -0.333 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.206 -5.984 0.226 1.00 0.00 H new ATOM 0 HG3 MET A 579 -12.685 -4.437 0.896 1.00 0.00 H new ATOM 0 HE1 MET A 579 -13.005 -8.172 3.401 1.00 0.00 H new ATOM 0 HE2 MET A 579 -13.110 -8.041 1.630 1.00 0.00 H new ATOM 0 HE3 MET A 579 -11.533 -8.309 2.410 1.00 0.00 H new ATOM 1693 N PRO A 580 -16.061 -5.507 3.492 1.00 0.00 N ATOM 1694 CA PRO A 580 -16.095 -5.568 4.956 1.00 0.00 C ATOM 1695 C PRO A 580 -14.904 -6.324 5.533 1.00 0.00 C ATOM 1696 O PRO A 580 -14.030 -6.783 4.795 1.00 0.00 O ATOM 1697 CB PRO A 580 -17.397 -6.317 5.250 1.00 0.00 C ATOM 1698 CG PRO A 580 -17.647 -7.135 4.030 1.00 0.00 C ATOM 1699 CD PRO A 580 -17.115 -6.331 2.876 1.00 0.00 C ATOM 0 HA PRO A 580 -16.047 -4.576 5.406 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -17.301 -6.946 6.135 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.218 -5.625 5.438 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -17.145 -8.100 4.098 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -18.711 -7.337 3.907 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -16.716 -6.972 2.090 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -17.892 -5.716 2.422 1.00 0.00 H new ATOM 1707 N LEU A 581 -14.873 -6.452 6.855 1.00 0.00 N ATOM 1708 CA LEU A 581 -13.788 -7.154 7.531 1.00 0.00 C ATOM 1709 C LEU A 581 -14.206 -8.573 7.903 1.00 0.00 C ATOM 1710 O LEU A 581 -14.902 -8.786 8.897 1.00 0.00 O ATOM 1711 CB LEU A 581 -13.363 -6.389 8.786 1.00 0.00 C ATOM 1712 CG LEU A 581 -12.708 -5.028 8.552 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -12.977 -4.098 9.725 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -11.211 -5.187 8.329 1.00 0.00 C ATOM 0 H LEU A 581 -15.587 -6.079 7.480 1.00 0.00 H new ATOM 0 HA LEU A 581 -12.943 -7.212 6.845 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -14.242 -6.244 9.414 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -12.668 -7.012 9.349 1.00 0.00 H new ATOM 0 HG LEU A 581 -13.144 -4.586 7.656 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -12.503 -3.134 9.541 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -14.052 -3.958 9.839 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -12.569 -4.535 10.637 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -10.762 -4.208 8.164 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -10.760 -5.650 9.206 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -11.038 -5.817 7.457 1.00 0.00 H new ATOM 1726 N LEU A 582 -13.776 -9.541 7.101 1.00 0.00 N ATOM 1727 CA LEU A 582 -14.104 -10.941 7.348 1.00 0.00 C ATOM 1728 C LEU A 582 -13.228 -11.518 8.455 1.00 0.00 C ATOM 1729 O LEU A 582 -13.716 -11.866 9.530 1.00 0.00 O ATOM 1730 CB LEU A 582 -13.931 -11.758 6.067 1.00 0.00 C ATOM 1731 CG LEU A 582 -14.753 -11.299 4.862 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -14.202 -11.902 3.579 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -16.217 -11.672 5.042 1.00 0.00 C ATOM 0 H LEU A 582 -13.200 -9.382 6.274 1.00 0.00 H new ATOM 0 HA LEU A 582 -15.144 -10.995 7.669 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -12.877 -11.743 5.790 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -14.189 -12.795 6.284 1.00 0.00 H new ATOM 0 HG LEU A 582 -14.681 -10.214 4.790 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -14.800 -11.564 2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -13.168 -11.585 3.443 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -14.243 -12.989 3.641 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -16.787 -11.338 4.175 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -16.307 -12.754 5.140 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -16.607 -11.192 5.940 1.00 0.00 H new ATOM 1745 N LYS A 583 -11.930 -11.616 8.186 1.00 0.00 N ATOM 1746 CA LYS A 583 -10.984 -12.147 9.159 1.00 0.00 C ATOM 1747 C LYS A 583 -10.614 -11.088 10.193 1.00 0.00 C ATOM 1748 O LYS A 583 -9.618 -10.381 10.042 1.00 0.00 O ATOM 1749 CB LYS A 583 -9.722 -12.649 8.454 1.00 0.00 C ATOM 1750 CG LYS A 583 -9.868 -14.042 7.865 1.00 0.00 C ATOM 1751 CD LYS A 583 -9.888 -15.106 8.950 1.00 0.00 C ATOM 1752 CE LYS A 583 -10.454 -16.419 8.431 1.00 0.00 C ATOM 1753 NZ LYS A 583 -10.447 -17.478 9.479 1.00 0.00 N ATOM 0 H LYS A 583 -11.509 -11.334 7.301 1.00 0.00 H new ATOM 0 HA LYS A 583 -11.461 -12.981 9.674 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -9.459 -11.953 7.658 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -8.895 -12.648 9.164 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -10.788 -14.097 7.283 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -9.044 -14.236 7.179 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -8.876 -15.266 9.323 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -10.486 -14.758 9.792 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -11.474 -16.262 8.080 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -9.870 -16.753 7.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -10.840 -18.357 9.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -9.471 -17.646 9.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -11.025 -17.171 10.287 1.00 0.00 H new ATOM 1767 N SER A 584 -11.422 -10.986 11.244 1.00 0.00 N ATOM 1768 CA SER A 584 -11.180 -10.011 12.301 1.00 0.00 C ATOM 1769 C SER A 584 -11.481 -10.611 13.672 1.00 0.00 C ATOM 1770 O SER A 584 -12.547 -11.187 13.887 1.00 0.00 O ATOM 1771 CB SER A 584 -12.036 -8.763 12.079 1.00 0.00 C ATOM 1772 OG SER A 584 -11.824 -7.810 13.106 1.00 0.00 O ATOM 0 H SER A 584 -12.249 -11.566 11.386 1.00 0.00 H new ATOM 0 HA SER A 584 -10.127 -9.731 12.269 1.00 0.00 H new ATOM 0 HB2 SER A 584 -11.795 -8.320 11.112 1.00 0.00 H new ATOM 0 HB3 SER A 584 -13.089 -9.041 12.049 1.00 0.00 H new ATOM 0 HG SER A 584 -12.381 -7.021 12.940 1.00 0.00 H new ATOM 1778 N GLU A 585 -10.534 -10.470 14.593 1.00 0.00 N ATOM 1779 CA GLU A 585 -10.698 -10.998 15.943 1.00 0.00 C ATOM 1780 C GLU A 585 -10.558 -9.889 16.982 1.00 0.00 C ATOM 1781 O GLU A 585 -9.500 -9.720 17.587 1.00 0.00 O ATOM 1782 CB GLU A 585 -9.668 -12.097 16.212 1.00 0.00 C ATOM 1783 CG GLU A 585 -9.874 -12.813 17.537 1.00 0.00 C ATOM 1784 CD GLU A 585 -9.134 -14.134 17.607 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -9.331 -14.973 16.703 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -8.358 -14.330 18.566 1.00 0.00 O ATOM 0 H GLU A 585 -9.646 -9.995 14.430 1.00 0.00 H new ATOM 0 HA GLU A 585 -11.700 -11.421 16.022 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -9.709 -12.827 15.404 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -8.670 -11.660 16.196 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -9.538 -12.169 18.350 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -10.939 -12.989 17.689 1.00 0.00 H new ATOM 1793 N VAL A 586 -11.635 -9.136 17.183 1.00 0.00 N ATOM 1794 CA VAL A 586 -11.634 -8.044 18.148 1.00 0.00 C ATOM 1795 C VAL A 586 -13.032 -7.457 18.315 1.00 0.00 C ATOM 1796 O VAL A 586 -13.773 -7.308 17.345 1.00 0.00 O ATOM 1797 CB VAL A 586 -10.666 -6.922 17.726 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -11.164 -6.234 16.465 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -10.488 -5.920 18.856 1.00 0.00 C ATOM 0 H VAL A 586 -12.519 -9.263 16.690 1.00 0.00 H new ATOM 0 HA VAL A 586 -11.302 -8.462 19.098 1.00 0.00 H new ATOM 0 HB VAL A 586 -9.694 -7.366 17.509 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -10.468 -5.445 16.182 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -11.235 -6.962 15.657 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -12.147 -5.801 16.651 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -9.801 -5.134 18.541 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -11.453 -5.479 19.107 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -10.082 -6.427 19.731 1.00 0.00 H new ATOM 1809 N ALA A 587 -13.384 -7.126 19.553 1.00 0.00 N ATOM 1810 CA ALA A 587 -14.692 -6.554 19.848 1.00 0.00 C ATOM 1811 C ALA A 587 -15.783 -7.618 19.791 1.00 0.00 C ATOM 1812 O ALA A 587 -16.869 -7.378 19.265 1.00 0.00 O ATOM 1813 CB ALA A 587 -15.003 -5.423 18.879 1.00 0.00 C ATOM 0 H ALA A 587 -12.782 -7.244 20.368 1.00 0.00 H new ATOM 0 HA ALA A 587 -14.666 -6.153 20.861 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -15.983 -5.005 19.110 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -14.245 -4.645 18.972 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -15.004 -5.808 17.859 1.00 0.00 H new ATOM 1819 N ALA A 588 -15.485 -8.793 20.334 1.00 0.00 N ATOM 1820 CA ALA A 588 -16.441 -9.893 20.346 1.00 0.00 C ATOM 1821 C ALA A 588 -17.863 -9.383 20.555 1.00 0.00 C ATOM 1822 O ALA A 588 -18.145 -8.686 21.529 1.00 0.00 O ATOM 1823 CB ALA A 588 -16.075 -10.900 21.427 1.00 0.00 C ATOM 0 H ALA A 588 -14.589 -9.008 20.772 1.00 0.00 H new ATOM 0 HA ALA A 588 -16.399 -10.388 19.376 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -16.798 -11.716 21.424 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -15.079 -11.297 21.232 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -16.086 -10.409 22.400 1.00 0.00 H new ATOM 1829 N GLY A 589 -18.755 -9.735 19.634 1.00 0.00 N ATOM 1830 CA GLY A 589 -20.137 -9.302 19.737 1.00 0.00 C ATOM 1831 C GLY A 589 -20.274 -7.793 19.721 1.00 0.00 C ATOM 1832 O GLY A 589 -20.245 -7.148 20.770 1.00 0.00 O ATOM 0 H GLY A 589 -18.546 -10.312 18.819 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -20.709 -9.725 18.911 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -20.570 -9.693 20.658 1.00 0.00 H new ATOM 1836 N VAL A 590 -20.423 -7.226 18.528 1.00 0.00 N ATOM 1837 CA VAL A 590 -20.565 -5.782 18.380 1.00 0.00 C ATOM 1838 C VAL A 590 -21.879 -5.427 17.693 1.00 0.00 C ATOM 1839 O VAL A 590 -22.362 -6.163 16.832 1.00 0.00 O ATOM 1840 CB VAL A 590 -19.399 -5.184 17.572 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -19.441 -5.670 16.132 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -19.435 -3.664 17.631 1.00 0.00 C ATOM 0 H VAL A 590 -20.449 -7.744 17.650 1.00 0.00 H new ATOM 0 HA VAL A 590 -20.557 -5.358 19.384 1.00 0.00 H new ATOM 0 HB VAL A 590 -18.462 -5.521 18.016 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -18.609 -5.236 15.577 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -19.363 -6.757 16.112 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -20.381 -5.366 15.673 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -18.604 -3.258 17.055 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -20.376 -3.306 17.213 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -19.351 -3.338 18.668 1.00 0.00 H new ATOM 1852 N LYS A 591 -22.455 -4.294 18.080 1.00 0.00 N ATOM 1853 CA LYS A 591 -23.713 -3.838 17.502 1.00 0.00 C ATOM 1854 C LYS A 591 -23.543 -2.478 16.832 1.00 0.00 C ATOM 1855 O LYS A 591 -24.454 -1.650 16.845 1.00 0.00 O ATOM 1856 CB LYS A 591 -24.795 -3.755 18.582 1.00 0.00 C ATOM 1857 CG LYS A 591 -24.395 -2.909 19.778 1.00 0.00 C ATOM 1858 CD LYS A 591 -24.780 -1.452 19.584 1.00 0.00 C ATOM 1859 CE LYS A 591 -24.765 -0.691 20.902 1.00 0.00 C ATOM 1860 NZ LYS A 591 -25.831 -1.166 21.828 1.00 0.00 N ATOM 0 H LYS A 591 -22.070 -3.674 18.793 1.00 0.00 H new ATOM 0 HA LYS A 591 -24.019 -4.561 16.745 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -25.704 -3.343 18.143 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -25.034 -4.762 18.923 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -24.876 -3.297 20.676 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -23.319 -2.984 19.934 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -24.089 -0.982 18.884 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -25.774 -1.393 19.140 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -23.791 -0.808 21.378 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -24.899 0.373 20.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -26.042 -0.423 22.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -26.691 -1.385 21.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -25.506 -2.022 22.321 1.00 0.00 H new ATOM 1874 N LYS A 592 -22.371 -2.254 16.247 1.00 0.00 N ATOM 1875 CA LYS A 592 -22.082 -0.996 15.569 1.00 0.00 C ATOM 1876 C LYS A 592 -22.905 -0.864 14.292 1.00 0.00 C ATOM 1877 O LYS A 592 -23.510 -1.831 13.829 1.00 0.00 O ATOM 1878 CB LYS A 592 -20.591 -0.902 15.240 1.00 0.00 C ATOM 1879 CG LYS A 592 -19.736 -0.446 16.410 1.00 0.00 C ATOM 1880 CD LYS A 592 -18.313 -0.138 15.975 1.00 0.00 C ATOM 1881 CE LYS A 592 -17.645 0.852 16.917 1.00 0.00 C ATOM 1882 NZ LYS A 592 -18.162 2.235 16.725 1.00 0.00 N ATOM 0 H LYS A 592 -21.606 -2.928 16.229 1.00 0.00 H new ATOM 0 HA LYS A 592 -22.352 -0.180 16.239 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -20.240 -1.877 14.903 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -20.454 -0.210 14.409 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -20.179 0.441 16.862 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -19.723 -1.221 17.176 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -17.733 -1.060 15.944 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -18.320 0.268 14.964 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -17.812 0.542 17.948 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -16.568 0.841 16.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -17.532 2.911 17.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -18.199 2.454 15.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -19.117 2.308 17.130 1.00 0.00 H new ATOM 1896 N SER A 593 -22.923 0.339 13.726 1.00 0.00 N ATOM 1897 CA SER A 593 -23.674 0.598 12.504 1.00 0.00 C ATOM 1898 C SER A 593 -22.760 1.143 11.410 1.00 0.00 C ATOM 1899 O SER A 593 -22.342 2.300 11.455 1.00 0.00 O ATOM 1900 CB SER A 593 -24.809 1.587 12.776 1.00 0.00 C ATOM 1901 OG SER A 593 -25.750 1.045 13.686 1.00 0.00 O ATOM 0 H SER A 593 -22.426 1.150 14.095 1.00 0.00 H new ATOM 0 HA SER A 593 -24.099 -0.346 12.162 1.00 0.00 H new ATOM 0 HB2 SER A 593 -24.400 2.513 13.180 1.00 0.00 H new ATOM 0 HB3 SER A 593 -25.307 1.840 11.840 1.00 0.00 H new ATOM 0 HG SER A 593 -26.464 1.697 13.845 1.00 0.00 H new ATOM 1907 N SER A 594 -22.455 0.301 10.428 1.00 0.00 N ATOM 1908 CA SER A 594 -21.587 0.696 9.325 1.00 0.00 C ATOM 1909 C SER A 594 -22.152 0.216 7.991 1.00 0.00 C ATOM 1910 O SER A 594 -22.981 -0.693 7.946 1.00 0.00 O ATOM 1911 CB SER A 594 -20.179 0.133 9.528 1.00 0.00 C ATOM 1912 OG SER A 594 -19.562 0.704 10.669 1.00 0.00 O ATOM 0 H SER A 594 -22.796 -0.659 10.374 1.00 0.00 H new ATOM 0 HA SER A 594 -21.535 1.785 9.308 1.00 0.00 H new ATOM 0 HB2 SER A 594 -20.230 -0.950 9.641 1.00 0.00 H new ATOM 0 HB3 SER A 594 -19.573 0.333 8.644 1.00 0.00 H new ATOM 0 HG SER A 594 -18.664 0.327 10.778 1.00 0.00 H new ATOM 1918 N GLY A 595 -21.696 0.833 6.905 1.00 0.00 N ATOM 1919 CA GLY A 595 -22.166 0.456 5.585 1.00 0.00 C ATOM 1920 C GLY A 595 -21.116 0.668 4.513 1.00 0.00 C ATOM 1921 O GLY A 595 -20.704 1.794 4.232 1.00 0.00 O ATOM 0 H GLY A 595 -21.009 1.587 6.916 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -22.464 -0.592 5.595 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -23.054 1.038 5.339 1.00 0.00 H new ATOM 1925 N PRO A 596 -20.664 -0.433 3.895 1.00 0.00 N ATOM 1926 CA PRO A 596 -19.648 -0.388 2.839 1.00 0.00 C ATOM 1927 C PRO A 596 -20.177 0.236 1.553 1.00 0.00 C ATOM 1928 O PRO A 596 -21.384 0.257 1.312 1.00 0.00 O ATOM 1929 CB PRO A 596 -19.303 -1.863 2.616 1.00 0.00 C ATOM 1930 CG PRO A 596 -20.519 -2.607 3.052 1.00 0.00 C ATOM 1931 CD PRO A 596 -21.111 -1.807 4.180 1.00 0.00 C ATOM 0 HA PRO A 596 -18.793 0.226 3.122 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -19.071 -2.062 1.570 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -18.429 -2.157 3.197 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -21.229 -2.709 2.231 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -20.263 -3.615 3.380 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -22.198 -1.880 4.197 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -20.753 -2.153 5.149 1.00 0.00 H new ATOM 1939 N SER A 597 -19.266 0.742 0.728 1.00 0.00 N ATOM 1940 CA SER A 597 -19.641 1.369 -0.534 1.00 0.00 C ATOM 1941 C SER A 597 -20.296 0.358 -1.470 1.00 0.00 C ATOM 1942 O SER A 597 -21.305 0.652 -2.112 1.00 0.00 O ATOM 1943 CB SER A 597 -18.413 1.984 -1.208 1.00 0.00 C ATOM 1944 OG SER A 597 -18.684 2.313 -2.559 1.00 0.00 O ATOM 0 H SER A 597 -18.263 0.730 0.911 1.00 0.00 H new ATOM 0 HA SER A 597 -20.361 2.158 -0.318 1.00 0.00 H new ATOM 0 HB2 SER A 597 -18.107 2.879 -0.667 1.00 0.00 H new ATOM 0 HB3 SER A 597 -17.579 1.283 -1.161 1.00 0.00 H new ATOM 0 HG SER A 597 -17.884 2.706 -2.967 1.00 0.00 H new ATOM 1950 N SER A 598 -19.715 -0.835 -1.542 1.00 0.00 N ATOM 1951 CA SER A 598 -20.239 -1.890 -2.402 1.00 0.00 C ATOM 1952 C SER A 598 -20.626 -1.334 -3.769 1.00 0.00 C ATOM 1953 O SER A 598 -21.666 -1.685 -4.323 1.00 0.00 O ATOM 1954 CB SER A 598 -21.451 -2.555 -1.748 1.00 0.00 C ATOM 1955 OG SER A 598 -22.591 -1.716 -1.813 1.00 0.00 O ATOM 0 H SER A 598 -18.881 -1.095 -1.015 1.00 0.00 H new ATOM 0 HA SER A 598 -19.455 -2.635 -2.540 1.00 0.00 H new ATOM 0 HB2 SER A 598 -21.663 -3.501 -2.246 1.00 0.00 H new ATOM 0 HB3 SER A 598 -21.225 -2.786 -0.707 1.00 0.00 H new ATOM 0 HG SER A 598 -22.316 -0.810 -2.066 1.00 0.00 H new ATOM 1961 N GLY A 599 -19.778 -0.462 -4.308 1.00 0.00 N ATOM 1962 CA GLY A 599 -20.048 0.129 -5.606 1.00 0.00 C ATOM 1963 C GLY A 599 -18.802 0.701 -6.253 1.00 0.00 C ATOM 1964 O GLY A 599 -18.882 1.633 -7.052 1.00 0.00 O ATOM 0 H GLY A 599 -18.910 -0.155 -3.869 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -20.481 -0.626 -6.263 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -20.791 0.919 -5.495 1.00 0.00 H new TER 1968 GLY A 599