USER MOD reduce.3.24.130724 H: found=0, std=0, add=1217, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1215 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 Single : A 501 HIS : no HD1:sc= -0.0412 X(o=-0.041,f=-0.0072) USER MOD Single : A 506 THR OG1 : rot 35:sc= 0.31 USER MOD Single : A 512 THR OG1 : rot 79:sc= 1.08 USER MOD Single : A 513 HIS : no HE2:sc= -1.13! C(o=-1.1!,f=-6.5!) USER MOD Single : A 515 SER OG : rot 180:sc= 0 USER MOD Single : A 517 SER OG : rot -58:sc= 1.25 USER MOD Single : A 521 MET CE :methyl 141:sc= -3.87! (180deg=-4.89!) USER MOD Single : A 524 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0288) USER MOD Single : A 528 THR OG1 : rot -136:sc= -0.926! USER MOD Single : A 529 SER OG : rot -31:sc= 0.00553 USER MOD Single : A 534 ASN : amide:sc= -2.82! C(o=-2.8!,f=-2!) USER MOD Single : A 539 TYR OH : rot 180:sc= 0 USER MOD Single : A 540 LYS NZ :NH3+ 168:sc=-0.00014 (180deg=-0.135) USER MOD Single : A 541 THR OG1 : rot 43:sc= 0.693 USER MOD Single : A 545 THR OG1 : rot -35:sc= 0.252 USER MOD Single : A 556 THR OG1 : rot 69:sc= 0.679 USER MOD Single : A 557 CYS SG : rot 30:sc= 0.0441 USER MOD Single : A 563 GLN : amide:sc= -0.718 K(o=-0.72,f=0) USER MOD Single : A 564 ASN : amide:sc= 0.583 K(o=0.58,f=-7.5!) USER MOD Single : A 569 LYS NZ :NH3+ 142:sc= 1.25 (180deg=1.11) USER MOD Single : A 570 THR OG1 : rot 180:sc= 0 USER MOD Single : A 572 SER OG : rot 47:sc= 0.0834 USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 581 TYR OH : rot 180:sc= 0 USER MOD Single : A 583 LYS NZ :NH3+ 155:sc= 2.28 (180deg=1.52) USER MOD Single : A 584 ASN : amide:sc= 1.06 K(o=1.1,f=-1.9!) USER MOD Single : A 585 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.14) USER MOD Single : A 586 THR OG1 : rot 23:sc= 0.987 USER MOD Single : A 599 MET CE :methyl -134:sc= -0.278 (180deg=-2.09!) USER MOD Single : A 600 SER OG : rot 180:sc= 0 USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 603 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 607 THR OG1 : rot 38:sc= 0.164 USER MOD Single : A 609 THR OG1 : rot 109:sc= 1.14 USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 615 LYS NZ :NH3+ -150:sc= 0.928 (180deg=-0.223) USER MOD Single : A 616 GLN : amide:sc= 0.381 X(o=0.38,f=-0.013) USER MOD Single : A 619 THR OG1 : rot -79:sc= 0.49 USER MOD Single : A 620 SER OG : rot -29:sc= -1.15! USER MOD Single : A 621 LYS NZ :NH3+ 166:sc= -0.0176 (180deg=-0.2) USER MOD Single : A 631 MET CE :methyl -153:sc= -0.335 (180deg=-1.12) USER MOD Single : A 639 HIS : no HD1:sc= -0.19 X(o=-0.19,f=0) USER MOD Single : A 640 THR OG1 : rot 48:sc= 0.161 USER MOD Single : A 641 LYS NZ :NH3+ -176:sc= 1.19 (180deg=0.962) USER MOD Single : A 649 SER OG : rot 180:sc= 0 USER MOD Single : A 650 TYR OH : rot -111:sc= 0.332 USER MOD Single : A 653 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 654 SER OG : rot 180:sc= 0 USER MOD Single : A 655 THR OG1 : rot 180:sc= -0.0128 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 501 -5.503 -18.405 -1.191 1.00 65.11 N ATOM 2 CA HIS A 501 -5.217 -18.696 -2.602 1.00 72.24 C ATOM 3 C HIS A 501 -4.366 -17.589 -3.201 1.00 73.11 C ATOM 4 O HIS A 501 -3.498 -17.822 -4.031 1.00 32.25 O ATOM 5 CB HIS A 501 -6.533 -18.889 -3.420 1.00 74.32 C ATOM 6 CG HIS A 501 -7.446 -17.668 -3.585 1.00 72.32 C ATOM 7 ND1 HIS A 501 -8.141 -17.395 -4.747 1.00 13.01 N ATOM 8 CD2 HIS A 501 -7.813 -16.692 -2.702 1.00 23.13 C ATOM 9 CE1 HIS A 501 -8.885 -16.306 -4.547 1.00 12.11 C ATOM 10 NE2 HIS A 501 -8.726 -15.838 -3.315 1.00 44.23 N ATOM 0 HA HIS A 501 -4.661 -19.632 -2.652 1.00 72.24 H new ATOM 0 HB2 HIS A 501 -6.263 -19.244 -4.414 1.00 74.32 H new ATOM 0 HB3 HIS A 501 -7.112 -19.681 -2.945 1.00 74.32 H new ATOM 0 HD2 HIS A 501 -7.452 -16.598 -1.689 1.00 23.13 H new ATOM 0 HE1 HIS A 501 -9.532 -15.863 -5.290 1.00 12.11 H new ATOM 0 HE2 HIS A 501 -9.179 -15.022 -2.903 1.00 44.23 H new ATOM 18 N ALA A 502 -4.612 -16.410 -2.709 1.00 30.13 N ATOM 19 CA ALA A 502 -3.998 -15.183 -3.122 1.00 35.20 C ATOM 20 C ALA A 502 -4.596 -14.138 -2.230 1.00 33.32 C ATOM 21 O ALA A 502 -5.293 -14.494 -1.261 1.00 14.31 O ATOM 22 CB ALA A 502 -4.316 -14.866 -4.590 1.00 42.22 C ATOM 0 H ALA A 502 -5.291 -16.272 -1.960 1.00 30.13 H new ATOM 0 HA ALA A 502 -2.912 -15.233 -3.046 1.00 35.20 H new ATOM 0 HB1 ALA A 502 -3.836 -13.929 -4.872 1.00 42.22 H new ATOM 0 HB2 ALA A 502 -3.944 -15.670 -5.225 1.00 42.22 H new ATOM 0 HB3 ALA A 502 -5.395 -14.773 -4.717 1.00 42.22 H new ATOM 28 N GLY A 503 -4.385 -12.889 -2.508 1.00 0.52 N ATOM 29 CA GLY A 503 -4.959 -11.919 -1.667 1.00 65.43 C ATOM 30 C GLY A 503 -4.981 -10.560 -2.261 1.00 74.12 C ATOM 31 O GLY A 503 -3.980 -10.096 -2.782 1.00 1.11 O ATOM 0 H GLY A 503 -3.834 -12.536 -3.290 1.00 0.52 H new ATOM 0 HA2 GLY A 503 -5.979 -12.217 -1.424 1.00 65.43 H new ATOM 0 HA3 GLY A 503 -4.404 -11.888 -0.729 1.00 65.43 H new ATOM 35 N ILE A 504 -6.127 -9.938 -2.209 1.00 64.20 N ATOM 36 CA ILE A 504 -6.274 -8.573 -2.634 1.00 12.32 C ATOM 37 C ILE A 504 -5.818 -7.686 -1.487 1.00 51.45 C ATOM 38 O ILE A 504 -6.510 -7.555 -0.483 1.00 63.24 O ATOM 39 CB ILE A 504 -7.757 -8.197 -3.029 1.00 43.33 C ATOM 40 CG1 ILE A 504 -8.255 -8.946 -4.292 1.00 10.35 C ATOM 41 CG2 ILE A 504 -7.919 -6.688 -3.228 1.00 34.41 C ATOM 42 CD1 ILE A 504 -8.519 -10.428 -4.116 1.00 11.42 C ATOM 0 H ILE A 504 -6.989 -10.365 -1.869 1.00 64.20 H new ATOM 0 HA ILE A 504 -5.673 -8.429 -3.532 1.00 12.32 H new ATOM 0 HB ILE A 504 -8.375 -8.517 -2.190 1.00 43.33 H new ATOM 0 HG12 ILE A 504 -9.174 -8.470 -4.635 1.00 10.35 H new ATOM 0 HG13 ILE A 504 -7.515 -8.819 -5.083 1.00 10.35 H new ATOM 0 HG21 ILE A 504 -8.951 -6.465 -3.499 1.00 34.41 H new ATOM 0 HG22 ILE A 504 -7.667 -6.170 -2.303 1.00 34.41 H new ATOM 0 HG23 ILE A 504 -7.255 -6.353 -4.024 1.00 34.41 H new ATOM 0 HD11 ILE A 504 -8.862 -10.851 -5.060 1.00 11.42 H new ATOM 0 HD12 ILE A 504 -7.600 -10.927 -3.808 1.00 11.42 H new ATOM 0 HD13 ILE A 504 -9.284 -10.573 -3.354 1.00 11.42 H new ATOM 54 N PHE A 505 -4.632 -7.166 -1.596 1.00 14.33 N ATOM 55 CA PHE A 505 -4.102 -6.291 -0.588 1.00 1.55 C ATOM 56 C PHE A 505 -3.911 -4.920 -1.209 1.00 13.41 C ATOM 57 O PHE A 505 -3.248 -4.782 -2.243 1.00 34.32 O ATOM 58 CB PHE A 505 -2.779 -6.840 -0.047 1.00 73.14 C ATOM 59 CG PHE A 505 -2.892 -8.246 0.502 1.00 73.30 C ATOM 60 CD1 PHE A 505 -3.756 -8.530 1.549 1.00 54.31 C ATOM 61 CD2 PHE A 505 -2.154 -9.282 -0.048 1.00 10.03 C ATOM 62 CE1 PHE A 505 -3.876 -9.815 2.040 1.00 30.32 C ATOM 63 CE2 PHE A 505 -2.271 -10.571 0.439 1.00 35.31 C ATOM 64 CZ PHE A 505 -3.133 -10.837 1.483 1.00 11.05 C ATOM 0 H PHE A 505 -4.005 -7.334 -2.383 1.00 14.33 H new ATOM 0 HA PHE A 505 -4.791 -6.220 0.253 1.00 1.55 H new ATOM 0 HB2 PHE A 505 -2.036 -6.828 -0.844 1.00 73.14 H new ATOM 0 HB3 PHE A 505 -2.414 -6.179 0.739 1.00 73.14 H new ATOM 0 HD1 PHE A 505 -4.343 -7.736 1.986 1.00 54.31 H new ATOM 0 HD2 PHE A 505 -1.479 -9.080 -0.867 1.00 10.03 H new ATOM 0 HE1 PHE A 505 -4.550 -10.020 2.858 1.00 30.32 H new ATOM 0 HE2 PHE A 505 -1.688 -11.369 0.003 1.00 35.31 H new ATOM 0 HZ PHE A 505 -3.226 -11.843 1.864 1.00 11.05 H new ATOM 74 N THR A 506 -4.505 -3.928 -0.623 1.00 74.33 N ATOM 75 CA THR A 506 -4.489 -2.606 -1.173 1.00 14.14 C ATOM 76 C THR A 506 -4.705 -1.615 -0.042 1.00 64.32 C ATOM 77 O THR A 506 -5.034 -2.025 1.080 1.00 23.21 O ATOM 78 CB THR A 506 -5.634 -2.481 -2.247 1.00 32.11 C ATOM 79 OG1 THR A 506 -5.600 -1.214 -2.921 1.00 1.15 O ATOM 80 CG2 THR A 506 -7.017 -2.693 -1.630 1.00 13.20 C ATOM 0 H THR A 506 -5.018 -4.011 0.255 1.00 74.33 H new ATOM 0 HA THR A 506 -3.535 -2.398 -1.657 1.00 14.14 H new ATOM 0 HB THR A 506 -5.452 -3.269 -2.978 1.00 32.11 H new ATOM 0 HG1 THR A 506 -4.670 -0.925 -3.028 1.00 1.15 H new ATOM 0 HG21 THR A 506 -7.779 -2.599 -2.404 1.00 13.20 H new ATOM 0 HG22 THR A 506 -7.070 -3.688 -1.188 1.00 13.20 H new ATOM 0 HG23 THR A 506 -7.190 -1.944 -0.858 1.00 13.20 H new ATOM 88 N PHE A 507 -4.496 -0.351 -0.316 1.00 3.24 N ATOM 89 CA PHE A 507 -4.759 0.684 0.654 1.00 71.22 C ATOM 90 C PHE A 507 -6.193 1.080 0.516 1.00 42.10 C ATOM 91 O PHE A 507 -6.774 0.923 -0.563 1.00 1.14 O ATOM 92 CB PHE A 507 -3.877 1.908 0.418 1.00 72.14 C ATOM 93 CG PHE A 507 -2.407 1.645 0.488 1.00 33.00 C ATOM 94 CD1 PHE A 507 -1.786 1.437 1.703 1.00 34.13 C ATOM 95 CD2 PHE A 507 -1.642 1.635 -0.661 1.00 33.21 C ATOM 96 CE1 PHE A 507 -0.429 1.223 1.771 1.00 44.14 C ATOM 97 CE2 PHE A 507 -0.286 1.418 -0.603 1.00 20.25 C ATOM 98 CZ PHE A 507 0.322 1.212 0.616 1.00 1.30 C ATOM 0 H PHE A 507 -4.142 -0.012 -1.210 1.00 3.24 H new ATOM 0 HA PHE A 507 -4.542 0.305 1.653 1.00 71.22 H new ATOM 0 HB2 PHE A 507 -4.111 2.323 -0.562 1.00 72.14 H new ATOM 0 HB3 PHE A 507 -4.131 2.669 1.156 1.00 72.14 H new ATOM 0 HD1 PHE A 507 -2.372 1.442 2.610 1.00 34.13 H new ATOM 0 HD2 PHE A 507 -2.115 1.800 -1.618 1.00 33.21 H new ATOM 0 HE1 PHE A 507 0.047 1.064 2.727 1.00 44.14 H new ATOM 0 HE2 PHE A 507 0.301 1.409 -1.510 1.00 20.25 H new ATOM 0 HZ PHE A 507 1.387 1.042 0.666 1.00 1.30 H new ATOM 108 N GLU A 508 -6.782 1.533 1.594 1.00 35.50 N ATOM 109 CA GLU A 508 -8.153 1.963 1.553 1.00 53.45 C ATOM 110 C GLU A 508 -8.211 3.433 1.138 1.00 72.43 C ATOM 111 O GLU A 508 -9.073 3.843 0.357 1.00 4.33 O ATOM 112 CB GLU A 508 -8.825 1.742 2.908 1.00 64.50 C ATOM 113 CG GLU A 508 -10.329 1.682 2.809 1.00 13.25 C ATOM 114 CD GLU A 508 -11.006 1.385 4.120 1.00 60.44 C ATOM 115 OE1 GLU A 508 -11.184 0.202 4.452 1.00 11.12 O ATOM 116 OE2 GLU A 508 -11.408 2.333 4.835 1.00 3.44 O ATOM 0 H GLU A 508 -6.334 1.613 2.507 1.00 35.50 H new ATOM 0 HA GLU A 508 -8.697 1.371 0.817 1.00 53.45 H new ATOM 0 HB2 GLU A 508 -8.456 0.814 3.345 1.00 64.50 H new ATOM 0 HB3 GLU A 508 -8.541 2.548 3.585 1.00 64.50 H new ATOM 0 HG2 GLU A 508 -10.698 2.633 2.426 1.00 13.25 H new ATOM 0 HG3 GLU A 508 -10.607 0.917 2.084 1.00 13.25 H new ATOM 123 N GLU A 509 -7.276 4.211 1.647 1.00 20.43 N ATOM 124 CA GLU A 509 -7.167 5.599 1.290 1.00 40.41 C ATOM 125 C GLU A 509 -5.909 5.784 0.449 1.00 73.33 C ATOM 126 O GLU A 509 -4.844 5.288 0.810 1.00 62.41 O ATOM 127 CB GLU A 509 -7.164 6.512 2.550 1.00 15.24 C ATOM 128 CG GLU A 509 -5.996 6.324 3.510 1.00 15.12 C ATOM 129 CD GLU A 509 -6.180 7.086 4.808 1.00 53.03 C ATOM 130 OE1 GLU A 509 -5.838 8.275 4.898 1.00 30.23 O ATOM 131 OE2 GLU A 509 -6.678 6.497 5.783 1.00 45.15 O ATOM 0 H GLU A 509 -6.576 3.894 2.317 1.00 20.43 H new ATOM 0 HA GLU A 509 -8.036 5.897 0.704 1.00 40.41 H new ATOM 0 HB2 GLU A 509 -7.174 7.551 2.221 1.00 15.24 H new ATOM 0 HB3 GLU A 509 -8.090 6.342 3.099 1.00 15.24 H new ATOM 0 HG2 GLU A 509 -5.878 5.263 3.729 1.00 15.12 H new ATOM 0 HG3 GLU A 509 -5.076 6.654 3.027 1.00 15.12 H new ATOM 138 N PRO A 510 -6.022 6.421 -0.719 1.00 54.14 N ATOM 139 CA PRO A 510 -4.869 6.659 -1.584 1.00 31.23 C ATOM 140 C PRO A 510 -4.024 7.851 -1.116 1.00 43.23 C ATOM 141 O PRO A 510 -2.887 8.029 -1.548 1.00 14.24 O ATOM 142 CB PRO A 510 -5.510 6.951 -2.943 1.00 43.22 C ATOM 143 CG PRO A 510 -6.840 7.552 -2.615 1.00 64.34 C ATOM 144 CD PRO A 510 -7.287 6.916 -1.322 1.00 0.53 C ATOM 0 HA PRO A 510 -4.180 5.815 -1.594 1.00 31.23 H new ATOM 0 HB2 PRO A 510 -4.899 7.637 -3.529 1.00 43.22 H new ATOM 0 HB3 PRO A 510 -5.621 6.041 -3.532 1.00 43.22 H new ATOM 0 HG2 PRO A 510 -6.762 8.634 -2.509 1.00 64.34 H new ATOM 0 HG3 PRO A 510 -7.560 7.361 -3.411 1.00 64.34 H new ATOM 0 HD2 PRO A 510 -7.786 7.636 -0.673 1.00 0.53 H new ATOM 0 HD3 PRO A 510 -7.992 6.103 -1.498 1.00 0.53 H new ATOM 152 N VAL A 511 -4.583 8.652 -0.232 1.00 62.13 N ATOM 153 CA VAL A 511 -3.927 9.841 0.295 1.00 23.15 C ATOM 154 C VAL A 511 -4.205 9.933 1.769 1.00 42.25 C ATOM 155 O VAL A 511 -5.335 9.708 2.204 1.00 63.44 O ATOM 156 CB VAL A 511 -4.439 11.156 -0.403 1.00 22.20 C ATOM 157 CG1 VAL A 511 -3.864 12.389 0.249 1.00 60.50 C ATOM 158 CG2 VAL A 511 -4.094 11.173 -1.871 1.00 15.53 C ATOM 0 H VAL A 511 -5.517 8.498 0.148 1.00 62.13 H new ATOM 0 HA VAL A 511 -2.858 9.752 0.100 1.00 23.15 H new ATOM 0 HB VAL A 511 -5.523 11.164 -0.290 1.00 22.20 H new ATOM 0 HG11 VAL A 511 -4.239 13.278 -0.259 1.00 60.50 H new ATOM 0 HG12 VAL A 511 -4.160 12.418 1.298 1.00 60.50 H new ATOM 0 HG13 VAL A 511 -2.776 12.364 0.180 1.00 60.50 H new ATOM 0 HG21 VAL A 511 -4.463 12.095 -2.321 1.00 15.53 H new ATOM 0 HG22 VAL A 511 -3.012 11.118 -1.991 1.00 15.53 H new ATOM 0 HG23 VAL A 511 -4.558 10.318 -2.364 1.00 15.53 H new ATOM 168 N THR A 512 -3.196 10.233 2.525 1.00 25.12 N ATOM 169 CA THR A 512 -3.351 10.406 3.914 1.00 0.32 C ATOM 170 C THR A 512 -2.518 11.643 4.333 1.00 63.43 C ATOM 171 O THR A 512 -1.427 11.880 3.792 1.00 43.55 O ATOM 172 CB THR A 512 -2.929 9.099 4.682 1.00 65.41 C ATOM 173 OG1 THR A 512 -3.494 9.079 5.988 1.00 60.31 O ATOM 174 CG2 THR A 512 -1.421 8.943 4.779 1.00 73.11 C ATOM 0 H THR A 512 -2.243 10.363 2.184 1.00 25.12 H new ATOM 0 HA THR A 512 -4.395 10.583 4.174 1.00 0.32 H new ATOM 0 HB THR A 512 -3.314 8.260 4.102 1.00 65.41 H new ATOM 0 HG1 THR A 512 -4.432 8.801 5.934 1.00 60.31 H new ATOM 0 HG21 THR A 512 -1.184 8.026 5.318 1.00 73.11 H new ATOM 0 HG22 THR A 512 -0.995 8.896 3.777 1.00 73.11 H new ATOM 0 HG23 THR A 512 -1.001 9.796 5.312 1.00 73.11 H new ATOM 182 N HIS A 513 -3.062 12.463 5.198 1.00 10.12 N ATOM 183 CA HIS A 513 -2.360 13.642 5.689 1.00 34.52 C ATOM 184 C HIS A 513 -1.976 13.402 7.120 1.00 71.04 C ATOM 185 O HIS A 513 -2.833 13.100 7.948 1.00 1.21 O ATOM 186 CB HIS A 513 -3.218 14.916 5.559 1.00 33.25 C ATOM 187 CG HIS A 513 -3.418 15.391 4.146 1.00 53.25 C ATOM 188 ND1 HIS A 513 -2.977 16.608 3.677 1.00 50.22 N ATOM 189 CD2 HIS A 513 -4.029 14.792 3.096 1.00 44.51 C ATOM 190 CE1 HIS A 513 -3.313 16.708 2.396 1.00 33.31 C ATOM 191 NE2 HIS A 513 -3.962 15.632 1.983 1.00 61.24 N ATOM 0 H HIS A 513 -3.998 12.341 5.585 1.00 10.12 H new ATOM 0 HA HIS A 513 -1.469 13.804 5.083 1.00 34.52 H new ATOM 0 HB2 HIS A 513 -4.194 14.729 6.008 1.00 33.25 H new ATOM 0 HB3 HIS A 513 -2.750 15.715 6.135 1.00 33.25 H new ATOM 0 HD1 HIS A 513 -2.478 17.312 4.220 1.00 50.22 H new ATOM 0 HD2 HIS A 513 -4.495 13.818 3.117 1.00 44.51 H new ATOM 0 HE1 HIS A 513 -3.085 17.559 1.771 1.00 33.31 H new ATOM 199 N VAL A 514 -0.714 13.527 7.425 1.00 62.42 N ATOM 200 CA VAL A 514 -0.226 13.184 8.748 1.00 61.01 C ATOM 201 C VAL A 514 0.469 14.331 9.395 1.00 20.53 C ATOM 202 O VAL A 514 0.899 15.283 8.731 1.00 32.32 O ATOM 203 CB VAL A 514 0.699 11.926 8.761 1.00 23.34 C ATOM 204 CG1 VAL A 514 -0.026 10.698 8.225 1.00 52.20 C ATOM 205 CG2 VAL A 514 1.987 12.172 7.991 1.00 32.33 C ATOM 0 H VAL A 514 0.002 13.863 6.781 1.00 62.42 H new ATOM 0 HA VAL A 514 -1.117 12.936 9.326 1.00 61.01 H new ATOM 0 HB VAL A 514 0.964 11.732 9.800 1.00 23.34 H new ATOM 0 HG11 VAL A 514 0.646 9.840 8.248 1.00 52.20 H new ATOM 0 HG12 VAL A 514 -0.899 10.492 8.844 1.00 52.20 H new ATOM 0 HG13 VAL A 514 -0.344 10.882 7.199 1.00 52.20 H new ATOM 0 HG21 VAL A 514 2.606 11.275 8.021 1.00 32.33 H new ATOM 0 HG22 VAL A 514 1.751 12.415 6.955 1.00 32.33 H new ATOM 0 HG23 VAL A 514 2.529 13.002 8.444 1.00 32.33 H new ATOM 215 N SER A 515 0.550 14.239 10.680 1.00 35.31 N ATOM 216 CA SER A 515 1.149 15.208 11.492 1.00 12.01 C ATOM 217 C SER A 515 2.677 15.113 11.381 1.00 71.41 C ATOM 218 O SER A 515 3.209 14.063 11.061 1.00 40.42 O ATOM 219 CB SER A 515 0.684 14.931 12.903 1.00 10.02 C ATOM 220 OG SER A 515 -0.742 14.949 12.986 1.00 43.30 O ATOM 0 H SER A 515 0.180 13.445 11.202 1.00 35.31 H new ATOM 0 HA SER A 515 0.870 16.217 11.190 1.00 12.01 H new ATOM 0 HB2 SER A 515 1.058 13.961 13.229 1.00 10.02 H new ATOM 0 HB3 SER A 515 1.100 15.677 13.580 1.00 10.02 H new ATOM 0 HG SER A 515 -1.018 14.766 13.908 1.00 43.30 H new ATOM 226 N GLU A 516 3.343 16.215 11.592 1.00 62.21 N ATOM 227 CA GLU A 516 4.791 16.276 11.544 1.00 53.40 C ATOM 228 C GLU A 516 5.426 15.721 12.815 1.00 34.43 C ATOM 229 O GLU A 516 6.304 14.874 12.770 1.00 45.04 O ATOM 230 CB GLU A 516 5.222 17.719 11.396 1.00 11.23 C ATOM 231 CG GLU A 516 6.712 17.898 11.480 1.00 61.42 C ATOM 232 CD GLU A 516 7.094 19.306 11.744 1.00 45.33 C ATOM 233 OE1 GLU A 516 7.108 19.732 12.878 1.00 11.34 O ATOM 234 OE2 GLU A 516 7.383 20.012 10.806 1.00 42.44 O ATOM 0 H GLU A 516 2.898 17.108 11.805 1.00 62.21 H new ATOM 0 HA GLU A 516 5.119 15.673 10.697 1.00 53.40 H new ATOM 0 HB2 GLU A 516 4.869 18.102 10.438 1.00 11.23 H new ATOM 0 HB3 GLU A 516 4.745 18.316 12.173 1.00 11.23 H new ATOM 0 HG2 GLU A 516 7.108 17.262 12.271 1.00 61.42 H new ATOM 0 HG3 GLU A 516 7.169 17.568 10.547 1.00 61.42 H new ATOM 241 N SER A 517 4.932 16.165 13.944 1.00 62.03 N ATOM 242 CA SER A 517 5.553 15.879 15.224 1.00 63.42 C ATOM 243 C SER A 517 4.981 14.597 15.808 1.00 53.04 C ATOM 244 O SER A 517 4.810 14.447 17.020 1.00 31.13 O ATOM 245 CB SER A 517 5.333 17.071 16.152 1.00 40.20 C ATOM 246 OG SER A 517 5.830 18.274 15.557 1.00 22.20 O ATOM 0 H SER A 517 4.089 16.735 14.007 1.00 62.03 H new ATOM 0 HA SER A 517 6.625 15.727 15.100 1.00 63.42 H new ATOM 0 HB2 SER A 517 4.270 17.179 16.368 1.00 40.20 H new ATOM 0 HB3 SER A 517 5.836 16.895 17.103 1.00 40.20 H new ATOM 0 HG SER A 517 6.782 18.168 15.352 1.00 22.20 H new ATOM 252 N ILE A 518 4.758 13.671 14.938 1.00 41.21 N ATOM 253 CA ILE A 518 4.235 12.404 15.270 1.00 22.13 C ATOM 254 C ILE A 518 5.396 11.439 15.172 1.00 1.13 C ATOM 255 O ILE A 518 6.381 11.743 14.493 1.00 4.43 O ATOM 256 CB ILE A 518 3.115 12.030 14.265 1.00 42.10 C ATOM 257 CG1 ILE A 518 2.287 10.867 14.758 1.00 42.01 C ATOM 258 CG2 ILE A 518 3.681 11.713 12.885 1.00 65.02 C ATOM 259 CD1 ILE A 518 1.089 10.640 13.903 1.00 20.05 C ATOM 0 H ILE A 518 4.944 13.787 13.942 1.00 41.21 H new ATOM 0 HA ILE A 518 3.797 12.384 16.268 1.00 22.13 H new ATOM 0 HB ILE A 518 2.468 12.904 14.183 1.00 42.10 H new ATOM 0 HG12 ILE A 518 2.899 9.965 14.773 1.00 42.01 H new ATOM 0 HG13 ILE A 518 1.971 11.055 15.784 1.00 42.01 H new ATOM 0 HG21 ILE A 518 2.866 11.455 12.208 1.00 65.02 H new ATOM 0 HG22 ILE A 518 4.211 12.584 12.500 1.00 65.02 H new ATOM 0 HG23 ILE A 518 4.371 10.872 12.959 1.00 65.02 H new ATOM 0 HD11 ILE A 518 0.520 9.795 14.291 1.00 20.05 H new ATOM 0 HD12 ILE A 518 0.463 11.532 13.909 1.00 20.05 H new ATOM 0 HD13 ILE A 518 1.406 10.426 12.882 1.00 20.05 H new ATOM 271 N GLY A 519 5.336 10.347 15.854 1.00 14.43 N ATOM 272 CA GLY A 519 6.407 9.411 15.760 1.00 73.44 C ATOM 273 C GLY A 519 6.170 8.427 14.658 1.00 50.51 C ATOM 274 O GLY A 519 6.957 8.312 13.720 1.00 75.22 O ATOM 0 H GLY A 519 4.571 10.081 16.474 1.00 14.43 H new ATOM 0 HA2 GLY A 519 7.343 9.941 15.583 1.00 73.44 H new ATOM 0 HA3 GLY A 519 6.515 8.882 16.707 1.00 73.44 H new ATOM 278 N ILE A 520 5.063 7.753 14.745 1.00 51.43 N ATOM 279 CA ILE A 520 4.715 6.716 13.817 1.00 54.04 C ATOM 280 C ILE A 520 3.340 6.989 13.230 1.00 62.34 C ATOM 281 O ILE A 520 2.426 7.425 13.947 1.00 71.12 O ATOM 282 CB ILE A 520 4.706 5.316 14.540 1.00 23.51 C ATOM 283 CG1 ILE A 520 6.114 4.899 15.007 1.00 44.13 C ATOM 284 CG2 ILE A 520 4.093 4.222 13.672 1.00 12.50 C ATOM 285 CD1 ILE A 520 7.105 4.684 13.879 1.00 61.34 C ATOM 0 H ILE A 520 4.365 7.909 15.472 1.00 51.43 H new ATOM 0 HA ILE A 520 5.456 6.700 13.018 1.00 54.04 H new ATOM 0 HB ILE A 520 4.077 5.437 15.422 1.00 23.51 H new ATOM 0 HG12 ILE A 520 6.504 5.665 15.677 1.00 44.13 H new ATOM 0 HG13 ILE A 520 6.035 3.979 15.586 1.00 44.13 H new ATOM 0 HG21 ILE A 520 4.109 3.276 14.213 1.00 12.50 H new ATOM 0 HG22 ILE A 520 3.063 4.484 13.430 1.00 12.50 H new ATOM 0 HG23 ILE A 520 4.668 4.123 12.751 1.00 12.50 H new ATOM 0 HD11 ILE A 520 8.070 4.393 14.293 1.00 61.34 H new ATOM 0 HD12 ILE A 520 6.741 3.896 13.220 1.00 61.34 H new ATOM 0 HD13 ILE A 520 7.217 5.608 13.312 1.00 61.34 H new ATOM 297 N MET A 521 3.215 6.808 11.943 1.00 71.32 N ATOM 298 CA MET A 521 1.923 6.829 11.302 1.00 3.10 C ATOM 299 C MET A 521 1.682 5.434 10.783 1.00 61.11 C ATOM 300 O MET A 521 2.601 4.820 10.225 1.00 51.21 O ATOM 301 CB MET A 521 1.793 7.955 10.210 1.00 65.23 C ATOM 302 CG MET A 521 2.674 7.862 8.948 1.00 40.50 C ATOM 303 SD MET A 521 2.077 6.659 7.735 1.00 45.54 S ATOM 304 CE MET A 521 3.142 6.996 6.328 1.00 12.33 C ATOM 0 H MET A 521 3.998 6.643 11.311 1.00 71.32 H new ATOM 0 HA MET A 521 1.141 7.097 12.012 1.00 3.10 H new ATOM 0 HB2 MET A 521 0.753 7.984 9.886 1.00 65.23 H new ATOM 0 HB3 MET A 521 2.004 8.910 10.692 1.00 65.23 H new ATOM 0 HG2 MET A 521 2.726 8.844 8.478 1.00 40.50 H new ATOM 0 HG3 MET A 521 3.689 7.595 9.242 1.00 40.50 H new ATOM 0 HE1 MET A 521 3.417 6.057 5.846 1.00 12.33 H new ATOM 0 HE2 MET A 521 2.613 7.629 5.615 1.00 12.33 H new ATOM 0 HE3 MET A 521 4.043 7.507 6.668 1.00 12.33 H new ATOM 314 N GLU A 522 0.523 4.891 11.074 1.00 61.53 N ATOM 315 CA GLU A 522 0.208 3.538 10.700 1.00 72.42 C ATOM 316 C GLU A 522 -0.887 3.524 9.669 1.00 54.15 C ATOM 317 O GLU A 522 -1.978 4.051 9.902 1.00 3.22 O ATOM 318 CB GLU A 522 -0.245 2.696 11.902 1.00 51.32 C ATOM 319 CG GLU A 522 0.684 2.689 13.103 1.00 43.50 C ATOM 320 CD GLU A 522 0.333 3.760 14.110 1.00 1.50 C ATOM 321 OE1 GLU A 522 0.718 4.917 13.939 1.00 12.42 O ATOM 322 OE2 GLU A 522 -0.351 3.442 15.106 1.00 33.20 O ATOM 0 H GLU A 522 -0.223 5.374 11.574 1.00 61.53 H new ATOM 0 HA GLU A 522 1.121 3.103 10.294 1.00 72.42 H new ATOM 0 HB2 GLU A 522 -1.221 3.058 12.226 1.00 51.32 H new ATOM 0 HB3 GLU A 522 -0.381 1.667 11.568 1.00 51.32 H new ATOM 0 HG2 GLU A 522 0.642 1.713 13.586 1.00 43.50 H new ATOM 0 HG3 GLU A 522 1.710 2.834 12.766 1.00 43.50 H new ATOM 329 N VAL A 523 -0.613 2.929 8.549 1.00 11.55 N ATOM 330 CA VAL A 523 -1.587 2.842 7.482 1.00 43.45 C ATOM 331 C VAL A 523 -2.193 1.452 7.427 1.00 13.32 C ATOM 332 O VAL A 523 -1.464 0.460 7.376 1.00 42.42 O ATOM 333 CB VAL A 523 -0.948 3.167 6.133 1.00 12.05 C ATOM 334 CG1 VAL A 523 -1.999 3.173 5.024 1.00 4.21 C ATOM 335 CG2 VAL A 523 -0.242 4.499 6.217 1.00 42.54 C ATOM 0 H VAL A 523 0.284 2.490 8.340 1.00 11.55 H new ATOM 0 HA VAL A 523 -2.371 3.571 7.688 1.00 43.45 H new ATOM 0 HB VAL A 523 -0.217 2.396 5.889 1.00 12.05 H new ATOM 0 HG11 VAL A 523 -1.522 3.407 4.072 1.00 4.21 H new ATOM 0 HG12 VAL A 523 -2.469 2.192 4.963 1.00 4.21 H new ATOM 0 HG13 VAL A 523 -2.756 3.925 5.245 1.00 4.21 H new ATOM 0 HG21 VAL A 523 0.214 4.731 5.254 1.00 42.54 H new ATOM 0 HG22 VAL A 523 -0.961 5.276 6.474 1.00 42.54 H new ATOM 0 HG23 VAL A 523 0.532 4.453 6.983 1.00 42.54 H new ATOM 345 N LYS A 524 -3.508 1.395 7.458 1.00 61.12 N ATOM 346 CA LYS A 524 -4.252 0.147 7.390 1.00 53.31 C ATOM 347 C LYS A 524 -4.330 -0.387 5.969 1.00 2.10 C ATOM 348 O LYS A 524 -4.584 0.361 5.016 1.00 10.20 O ATOM 349 CB LYS A 524 -5.653 0.339 7.978 1.00 32.12 C ATOM 350 CG LYS A 524 -5.653 0.482 9.488 1.00 35.13 C ATOM 351 CD LYS A 524 -5.442 -0.868 10.154 1.00 41.32 C ATOM 352 CE LYS A 524 -5.230 -0.755 11.650 1.00 15.25 C ATOM 353 NZ LYS A 524 -6.337 -0.081 12.341 1.00 73.51 N ATOM 0 H LYS A 524 -4.101 2.222 7.532 1.00 61.12 H new ATOM 0 HA LYS A 524 -3.718 -0.596 7.982 1.00 53.31 H new ATOM 0 HB2 LYS A 524 -6.107 1.226 7.536 1.00 32.12 H new ATOM 0 HB3 LYS A 524 -6.276 -0.511 7.700 1.00 32.12 H new ATOM 0 HG2 LYS A 524 -4.866 1.171 9.793 1.00 35.13 H new ATOM 0 HG3 LYS A 524 -6.599 0.912 9.818 1.00 35.13 H new ATOM 0 HD2 LYS A 524 -6.307 -1.503 9.961 1.00 41.32 H new ATOM 0 HD3 LYS A 524 -4.579 -1.359 9.705 1.00 41.32 H new ATOM 0 HE2 LYS A 524 -5.102 -1.753 12.069 1.00 15.25 H new ATOM 0 HE3 LYS A 524 -4.306 -0.209 11.839 1.00 15.25 H new ATOM 0 HZ1 LYS A 524 -6.166 -0.095 13.367 1.00 73.51 H new ATOM 0 HZ2 LYS A 524 -6.402 0.904 12.014 1.00 73.51 H new ATOM 0 HZ3 LYS A 524 -7.228 -0.575 12.132 1.00 73.51 H new ATOM 367 N VAL A 525 -4.094 -1.667 5.838 1.00 53.55 N ATOM 368 CA VAL A 525 -4.127 -2.336 4.545 1.00 1.53 C ATOM 369 C VAL A 525 -5.270 -3.338 4.545 1.00 24.23 C ATOM 370 O VAL A 525 -5.532 -3.969 5.573 1.00 44.14 O ATOM 371 CB VAL A 525 -2.793 -3.084 4.262 1.00 24.45 C ATOM 372 CG1 VAL A 525 -2.736 -3.619 2.838 1.00 45.10 C ATOM 373 CG2 VAL A 525 -1.613 -2.191 4.534 1.00 25.14 C ATOM 0 H VAL A 525 -3.872 -2.283 6.620 1.00 53.55 H new ATOM 0 HA VAL A 525 -4.268 -1.586 3.767 1.00 1.53 H new ATOM 0 HB VAL A 525 -2.751 -3.938 4.938 1.00 24.45 H new ATOM 0 HG11 VAL A 525 -1.789 -4.135 2.681 1.00 45.10 H new ATOM 0 HG12 VAL A 525 -3.559 -4.315 2.678 1.00 45.10 H new ATOM 0 HG13 VAL A 525 -2.819 -2.791 2.134 1.00 45.10 H new ATOM 0 HG21 VAL A 525 -0.691 -2.735 4.329 1.00 25.14 H new ATOM 0 HG22 VAL A 525 -1.666 -1.312 3.892 1.00 25.14 H new ATOM 0 HG23 VAL A 525 -1.626 -1.879 5.578 1.00 25.14 H new ATOM 383 N LEU A 526 -5.951 -3.464 3.419 1.00 23.30 N ATOM 384 CA LEU A 526 -7.087 -4.370 3.297 1.00 34.23 C ATOM 385 C LEU A 526 -6.696 -5.838 3.331 1.00 73.14 C ATOM 386 O LEU A 526 -5.520 -6.214 3.208 1.00 11.52 O ATOM 387 CB LEU A 526 -7.968 -4.076 2.061 1.00 21.45 C ATOM 388 CG LEU A 526 -8.843 -2.808 2.095 1.00 55.41 C ATOM 389 CD1 LEU A 526 -9.755 -2.795 3.305 1.00 13.21 C ATOM 390 CD2 LEU A 526 -8.016 -1.561 2.055 1.00 2.54 C ATOM 0 H LEU A 526 -5.736 -2.946 2.567 1.00 23.30 H new ATOM 0 HA LEU A 526 -7.685 -4.172 4.186 1.00 34.23 H new ATOM 0 HB2 LEU A 526 -7.315 -4.011 1.191 1.00 21.45 H new ATOM 0 HB3 LEU A 526 -8.623 -4.933 1.904 1.00 21.45 H new ATOM 0 HG LEU A 526 -9.463 -2.830 1.199 1.00 55.41 H new ATOM 0 HD11 LEU A 526 -10.357 -1.887 3.297 1.00 13.21 H new ATOM 0 HD12 LEU A 526 -10.410 -3.665 3.276 1.00 13.21 H new ATOM 0 HD13 LEU A 526 -9.154 -2.824 4.214 1.00 13.21 H new ATOM 0 HD21 LEU A 526 -8.670 -0.690 2.081 1.00 2.54 H new ATOM 0 HD22 LEU A 526 -7.349 -1.539 2.917 1.00 2.54 H new ATOM 0 HD23 LEU A 526 -7.426 -1.545 1.139 1.00 2.54 H new ATOM 402 N ARG A 527 -7.699 -6.649 3.482 1.00 12.12 N ATOM 403 CA ARG A 527 -7.566 -8.061 3.627 1.00 64.01 C ATOM 404 C ARG A 527 -8.019 -8.752 2.343 1.00 23.12 C ATOM 405 O ARG A 527 -8.767 -8.189 1.558 1.00 70.13 O ATOM 406 CB ARG A 527 -8.474 -8.486 4.784 1.00 11.12 C ATOM 407 CG ARG A 527 -8.464 -9.955 5.197 1.00 73.43 C ATOM 408 CD ARG A 527 -7.309 -10.317 6.109 1.00 2.42 C ATOM 409 NE ARG A 527 -6.039 -10.659 5.442 1.00 51.04 N ATOM 410 CZ ARG A 527 -5.293 -11.744 5.806 1.00 5.11 C ATOM 411 NH1 ARG A 527 -5.786 -12.650 6.656 1.00 41.21 N ATOM 412 NH2 ARG A 527 -4.087 -11.947 5.290 1.00 42.44 N ATOM 0 H ARG A 527 -8.667 -6.330 3.508 1.00 12.12 H new ATOM 0 HA ARG A 527 -6.530 -8.335 3.824 1.00 64.01 H new ATOM 0 HB2 ARG A 527 -8.204 -7.891 5.657 1.00 11.12 H new ATOM 0 HB3 ARG A 527 -9.498 -8.220 4.521 1.00 11.12 H new ATOM 0 HG2 ARG A 527 -9.402 -10.189 5.701 1.00 73.43 H new ATOM 0 HG3 ARG A 527 -8.419 -10.576 4.302 1.00 73.43 H new ATOM 0 HD2 ARG A 527 -7.128 -9.479 6.783 1.00 2.42 H new ATOM 0 HD3 ARG A 527 -7.611 -11.163 6.726 1.00 2.42 H new ATOM 0 HE ARG A 527 -5.706 -10.065 4.683 1.00 51.04 H new ATOM 0 HH11 ARG A 527 -6.725 -12.534 7.037 1.00 41.21 H new ATOM 0 HH12 ARG A 527 -5.223 -13.458 6.923 1.00 41.21 H new ATOM 0 HH21 ARG A 527 -3.705 -11.288 4.612 1.00 42.44 H new ATOM 0 HH22 ARG A 527 -3.542 -12.762 5.572 1.00 42.44 H new ATOM 426 N THR A 528 -7.562 -9.963 2.168 1.00 34.12 N ATOM 427 CA THR A 528 -7.926 -10.805 1.069 1.00 41.24 C ATOM 428 C THR A 528 -9.372 -11.320 1.247 1.00 41.14 C ATOM 429 O THR A 528 -9.915 -11.308 2.370 1.00 42.52 O ATOM 430 CB THR A 528 -6.916 -11.999 0.983 1.00 50.44 C ATOM 431 OG1 THR A 528 -7.312 -12.969 0.009 1.00 22.23 O ATOM 432 CG2 THR A 528 -6.722 -12.673 2.331 1.00 13.04 C ATOM 0 H THR A 528 -6.903 -10.402 2.811 1.00 34.12 H new ATOM 0 HA THR A 528 -7.885 -10.236 0.140 1.00 41.24 H new ATOM 0 HB THR A 528 -5.965 -11.569 0.670 1.00 50.44 H new ATOM 0 HG1 THR A 528 -7.197 -13.869 0.378 1.00 22.23 H new ATOM 0 HG21 THR A 528 -6.014 -13.496 2.228 1.00 13.04 H new ATOM 0 HG22 THR A 528 -6.335 -11.949 3.048 1.00 13.04 H new ATOM 0 HG23 THR A 528 -7.678 -13.059 2.686 1.00 13.04 H new ATOM 440 N SER A 529 -9.975 -11.763 0.159 1.00 14.10 N ATOM 441 CA SER A 529 -11.313 -12.298 0.174 1.00 43.34 C ATOM 442 C SER A 529 -11.240 -13.796 0.546 1.00 61.34 C ATOM 443 O SER A 529 -12.258 -14.436 0.846 1.00 5.12 O ATOM 444 CB SER A 529 -11.957 -12.089 -1.217 1.00 5.13 C ATOM 445 OG SER A 529 -13.349 -12.426 -1.245 1.00 62.52 O ATOM 0 H SER A 529 -9.542 -11.759 -0.764 1.00 14.10 H new ATOM 0 HA SER A 529 -11.931 -11.787 0.912 1.00 43.34 H new ATOM 0 HB2 SER A 529 -11.835 -11.048 -1.515 1.00 5.13 H new ATOM 0 HB3 SER A 529 -11.427 -12.695 -1.952 1.00 5.13 H new ATOM 0 HG SER A 529 -13.523 -13.150 -0.608 1.00 62.52 H new ATOM 451 N GLY A 530 -10.027 -14.325 0.530 1.00 12.14 N ATOM 452 CA GLY A 530 -9.783 -15.692 0.904 1.00 34.14 C ATOM 453 C GLY A 530 -8.439 -15.810 1.568 1.00 21.33 C ATOM 454 O GLY A 530 -7.402 -15.789 0.894 1.00 72.03 O ATOM 0 H GLY A 530 -9.189 -13.811 0.256 1.00 12.14 H new ATOM 0 HA2 GLY A 530 -10.564 -16.038 1.581 1.00 34.14 H new ATOM 0 HA3 GLY A 530 -9.820 -16.331 0.022 1.00 34.14 H new ATOM 458 N ALA A 531 -8.430 -15.878 2.877 1.00 60.00 N ATOM 459 CA ALA A 531 -7.193 -15.927 3.622 1.00 32.44 C ATOM 460 C ALA A 531 -6.733 -17.338 3.844 1.00 2.32 C ATOM 461 O ALA A 531 -7.115 -17.980 4.804 1.00 44.34 O ATOM 462 CB ALA A 531 -7.303 -15.190 4.944 1.00 1.15 C ATOM 0 H ALA A 531 -9.271 -15.901 3.453 1.00 60.00 H new ATOM 0 HA ALA A 531 -6.443 -15.420 3.015 1.00 32.44 H new ATOM 0 HB1 ALA A 531 -6.353 -15.250 5.474 1.00 1.15 H new ATOM 0 HB2 ALA A 531 -7.550 -14.145 4.758 1.00 1.15 H new ATOM 0 HB3 ALA A 531 -8.086 -15.645 5.550 1.00 1.15 H new ATOM 468 N ARG A 532 -5.983 -17.833 2.914 1.00 44.01 N ATOM 469 CA ARG A 532 -5.365 -19.119 3.005 1.00 71.13 C ATOM 470 C ARG A 532 -3.963 -19.006 2.493 1.00 72.43 C ATOM 471 O ARG A 532 -3.746 -18.932 1.280 1.00 12.10 O ATOM 472 CB ARG A 532 -6.127 -20.193 2.207 1.00 4.41 C ATOM 473 CG ARG A 532 -7.470 -20.609 2.791 1.00 71.23 C ATOM 474 CD ARG A 532 -7.295 -21.107 4.210 1.00 55.51 C ATOM 475 NE ARG A 532 -8.488 -21.786 4.726 1.00 14.41 N ATOM 476 CZ ARG A 532 -8.648 -22.194 5.990 1.00 20.14 C ATOM 477 NH1 ARG A 532 -7.821 -21.768 6.941 1.00 70.03 N ATOM 478 NH2 ARG A 532 -9.678 -22.966 6.311 1.00 74.43 N ATOM 0 H ARG A 532 -5.776 -17.341 2.045 1.00 44.01 H new ATOM 0 HA ARG A 532 -5.376 -19.433 4.049 1.00 71.13 H new ATOM 0 HB2 ARG A 532 -6.289 -19.823 1.195 1.00 4.41 H new ATOM 0 HB3 ARG A 532 -5.495 -21.078 2.126 1.00 4.41 H new ATOM 0 HG2 ARG A 532 -8.158 -19.763 2.777 1.00 71.23 H new ATOM 0 HG3 ARG A 532 -7.915 -21.391 2.176 1.00 71.23 H new ATOM 0 HD2 ARG A 532 -6.448 -21.792 4.248 1.00 55.51 H new ATOM 0 HD3 ARG A 532 -7.053 -20.265 4.858 1.00 55.51 H new ATOM 0 HE ARG A 532 -9.252 -21.960 4.073 1.00 14.41 H new ATOM 0 HH11 ARG A 532 -7.062 -21.128 6.708 1.00 70.03 H new ATOM 0 HH12 ARG A 532 -7.946 -22.081 7.904 1.00 70.03 H new ATOM 0 HH21 ARG A 532 -10.347 -23.248 5.594 1.00 74.43 H new ATOM 0 HH22 ARG A 532 -9.801 -23.278 7.274 1.00 74.43 H new ATOM 492 N GLY A 533 -3.026 -18.913 3.397 1.00 71.43 N ATOM 493 CA GLY A 533 -1.655 -18.835 3.003 1.00 12.33 C ATOM 494 C GLY A 533 -0.979 -17.611 3.534 1.00 51.11 C ATOM 495 O GLY A 533 -1.639 -16.608 3.852 1.00 35.42 O ATOM 0 H GLY A 533 -3.190 -18.890 4.404 1.00 71.43 H new ATOM 0 HA2 GLY A 533 -1.127 -19.721 3.356 1.00 12.33 H new ATOM 0 HA3 GLY A 533 -1.591 -18.839 1.915 1.00 12.33 H new ATOM 499 N ASN A 534 0.315 -17.694 3.678 1.00 44.12 N ATOM 500 CA ASN A 534 1.097 -16.575 4.109 1.00 74.32 C ATOM 501 C ASN A 534 1.724 -15.902 2.907 1.00 41.10 C ATOM 502 O ASN A 534 2.465 -16.526 2.130 1.00 22.14 O ATOM 503 CB ASN A 534 2.154 -16.992 5.143 1.00 14.12 C ATOM 504 CG ASN A 534 3.006 -15.831 5.666 1.00 34.23 C ATOM 505 OD1 ASN A 534 4.159 -16.018 6.021 1.00 22.02 O ATOM 506 ND2 ASN A 534 2.458 -14.639 5.740 1.00 62.21 N ATOM 0 H ASN A 534 0.855 -18.541 3.499 1.00 44.12 H new ATOM 0 HA ASN A 534 0.443 -15.859 4.606 1.00 74.32 H new ATOM 0 HB2 ASN A 534 1.654 -17.471 5.985 1.00 14.12 H new ATOM 0 HB3 ASN A 534 2.811 -17.738 4.696 1.00 14.12 H new ATOM 0 HD21 ASN A 534 2.997 -13.851 6.099 1.00 62.21 H new ATOM 0 HD22 ASN A 534 1.493 -14.502 5.439 1.00 62.21 H new ATOM 513 N VAL A 535 1.389 -14.654 2.734 1.00 42.10 N ATOM 514 CA VAL A 535 1.862 -13.851 1.649 1.00 51.44 C ATOM 515 C VAL A 535 2.563 -12.634 2.201 1.00 4.01 C ATOM 516 O VAL A 535 2.091 -12.009 3.154 1.00 31.11 O ATOM 517 CB VAL A 535 0.693 -13.411 0.723 1.00 31.31 C ATOM 518 CG1 VAL A 535 1.178 -12.498 -0.394 1.00 64.11 C ATOM 519 CG2 VAL A 535 0.027 -14.629 0.138 1.00 20.34 C ATOM 0 H VAL A 535 0.761 -14.156 3.364 1.00 42.10 H new ATOM 0 HA VAL A 535 2.557 -14.445 1.055 1.00 51.44 H new ATOM 0 HB VAL A 535 -0.023 -12.850 1.324 1.00 31.31 H new ATOM 0 HG11 VAL A 535 0.334 -12.211 -1.021 1.00 64.11 H new ATOM 0 HG12 VAL A 535 1.631 -11.605 0.037 1.00 64.11 H new ATOM 0 HG13 VAL A 535 1.917 -13.024 -0.999 1.00 64.11 H new ATOM 0 HG21 VAL A 535 -0.792 -14.319 -0.511 1.00 20.34 H new ATOM 0 HG22 VAL A 535 0.754 -15.198 -0.442 1.00 20.34 H new ATOM 0 HG23 VAL A 535 -0.363 -15.252 0.943 1.00 20.34 H new ATOM 529 N ILE A 536 3.682 -12.330 1.639 1.00 2.31 N ATOM 530 CA ILE A 536 4.438 -11.191 2.036 1.00 74.32 C ATOM 531 C ILE A 536 4.238 -10.094 1.024 1.00 53.31 C ATOM 532 O ILE A 536 4.273 -10.344 -0.185 1.00 63.43 O ATOM 533 CB ILE A 536 5.945 -11.526 2.167 1.00 14.44 C ATOM 534 CG1 ILE A 536 6.171 -12.610 3.211 1.00 70.04 C ATOM 535 CG2 ILE A 536 6.744 -10.300 2.511 1.00 65.42 C ATOM 536 CD1 ILE A 536 5.604 -12.270 4.562 1.00 23.43 C ATOM 0 H ILE A 536 4.103 -12.870 0.883 1.00 2.31 H new ATOM 0 HA ILE A 536 4.089 -10.865 3.016 1.00 74.32 H new ATOM 0 HB ILE A 536 6.286 -11.898 1.201 1.00 14.44 H new ATOM 0 HG12 ILE A 536 5.722 -13.540 2.861 1.00 70.04 H new ATOM 0 HG13 ILE A 536 7.241 -12.790 3.310 1.00 70.04 H new ATOM 0 HG21 ILE A 536 7.798 -10.565 2.597 1.00 65.42 H new ATOM 0 HG22 ILE A 536 6.620 -9.553 1.727 1.00 65.42 H new ATOM 0 HG23 ILE A 536 6.394 -9.892 3.459 1.00 65.42 H new ATOM 0 HD11 ILE A 536 5.802 -13.087 5.256 1.00 23.43 H new ATOM 0 HD12 ILE A 536 6.071 -11.358 4.933 1.00 23.43 H new ATOM 0 HD13 ILE A 536 4.528 -12.119 4.477 1.00 23.43 H new ATOM 548 N VAL A 537 3.985 -8.914 1.500 1.00 0.34 N ATOM 549 CA VAL A 537 3.800 -7.777 0.635 1.00 74.12 C ATOM 550 C VAL A 537 4.859 -6.709 0.947 1.00 0.34 C ATOM 551 O VAL A 537 4.851 -6.124 2.030 1.00 5.42 O ATOM 552 CB VAL A 537 2.366 -7.167 0.751 1.00 63.44 C ATOM 553 CG1 VAL A 537 2.208 -5.966 -0.176 1.00 13.33 C ATOM 554 CG2 VAL A 537 1.304 -8.212 0.425 1.00 43.43 C ATOM 0 H VAL A 537 3.900 -8.706 2.495 1.00 0.34 H new ATOM 0 HA VAL A 537 3.917 -8.124 -0.392 1.00 74.12 H new ATOM 0 HB VAL A 537 2.231 -6.836 1.781 1.00 63.44 H new ATOM 0 HG11 VAL A 537 1.201 -5.560 -0.077 1.00 13.33 H new ATOM 0 HG12 VAL A 537 2.936 -5.201 0.092 1.00 13.33 H new ATOM 0 HG13 VAL A 537 2.373 -6.278 -1.207 1.00 13.33 H new ATOM 0 HG21 VAL A 537 0.314 -7.764 0.512 1.00 43.43 H new ATOM 0 HG22 VAL A 537 1.450 -8.574 -0.593 1.00 43.43 H new ATOM 0 HG23 VAL A 537 1.388 -9.046 1.122 1.00 43.43 H new ATOM 564 N PRO A 538 5.811 -6.491 0.034 1.00 11.25 N ATOM 565 CA PRO A 538 6.854 -5.482 0.208 1.00 74.23 C ATOM 566 C PRO A 538 6.316 -4.066 0.013 1.00 44.03 C ATOM 567 O PRO A 538 5.334 -3.852 -0.713 1.00 43.34 O ATOM 568 CB PRO A 538 7.873 -5.825 -0.879 1.00 62.12 C ATOM 569 CG PRO A 538 7.080 -6.495 -1.939 1.00 42.13 C ATOM 570 CD PRO A 538 5.953 -7.210 -1.242 1.00 15.44 C ATOM 0 HA PRO A 538 7.274 -5.495 1.214 1.00 74.23 H new ATOM 0 HB2 PRO A 538 8.364 -4.929 -1.258 1.00 62.12 H new ATOM 0 HB3 PRO A 538 8.656 -6.480 -0.496 1.00 62.12 H new ATOM 0 HG2 PRO A 538 6.695 -5.768 -2.654 1.00 42.13 H new ATOM 0 HG3 PRO A 538 7.697 -7.197 -2.500 1.00 42.13 H new ATOM 0 HD2 PRO A 538 5.034 -7.171 -1.826 1.00 15.44 H new ATOM 0 HD3 PRO A 538 6.186 -8.263 -1.083 1.00 15.44 H new ATOM 578 N TYR A 539 6.950 -3.120 0.652 1.00 43.22 N ATOM 579 CA TYR A 539 6.549 -1.733 0.593 1.00 1.41 C ATOM 580 C TYR A 539 7.762 -0.870 0.823 1.00 60.21 C ATOM 581 O TYR A 539 8.751 -1.335 1.415 1.00 71.22 O ATOM 582 CB TYR A 539 5.486 -1.427 1.671 1.00 43.44 C ATOM 583 CG TYR A 539 5.961 -1.670 3.088 1.00 5.04 C ATOM 584 CD1 TYR A 539 5.836 -2.916 3.669 1.00 63.01 C ATOM 585 CD2 TYR A 539 6.556 -0.658 3.828 1.00 42.52 C ATOM 586 CE1 TYR A 539 6.286 -3.152 4.942 1.00 20.30 C ATOM 587 CE2 TYR A 539 7.019 -0.889 5.098 1.00 52.31 C ATOM 588 CZ TYR A 539 6.879 -2.146 5.655 1.00 54.44 C ATOM 589 OH TYR A 539 7.354 -2.406 6.918 1.00 31.13 O ATOM 0 H TYR A 539 7.769 -3.289 1.236 1.00 43.22 H new ATOM 0 HA TYR A 539 6.116 -1.526 -0.386 1.00 1.41 H new ATOM 0 HB2 TYR A 539 5.175 -0.387 1.576 1.00 43.44 H new ATOM 0 HB3 TYR A 539 4.605 -2.041 1.483 1.00 43.44 H new ATOM 0 HD1 TYR A 539 5.376 -3.718 3.111 1.00 63.01 H new ATOM 0 HD2 TYR A 539 6.656 0.327 3.397 1.00 42.52 H new ATOM 0 HE1 TYR A 539 6.173 -4.132 5.382 1.00 20.30 H new ATOM 0 HE2 TYR A 539 7.489 -0.095 5.659 1.00 52.31 H new ATOM 0 HH TYR A 539 7.748 -1.591 7.294 1.00 31.13 H new ATOM 599 N LYS A 540 7.684 0.368 0.404 1.00 52.04 N ATOM 600 CA LYS A 540 8.767 1.301 0.582 1.00 70.41 C ATOM 601 C LYS A 540 8.264 2.720 0.437 1.00 21.24 C ATOM 602 O LYS A 540 7.245 2.972 -0.232 1.00 25.34 O ATOM 603 CB LYS A 540 9.944 1.045 -0.410 1.00 3.21 C ATOM 604 CG LYS A 540 9.728 1.469 -1.874 1.00 53.33 C ATOM 605 CD LYS A 540 8.520 0.812 -2.515 1.00 1.52 C ATOM 606 CE LYS A 540 8.399 1.172 -3.979 1.00 62.11 C ATOM 607 NZ LYS A 540 9.463 0.550 -4.791 1.00 60.42 N ATOM 0 H LYS A 540 6.869 0.757 -0.070 1.00 52.04 H new ATOM 0 HA LYS A 540 9.156 1.152 1.589 1.00 70.41 H new ATOM 0 HB2 LYS A 540 10.824 1.565 -0.033 1.00 3.21 H new ATOM 0 HB3 LYS A 540 10.173 -0.021 -0.396 1.00 3.21 H new ATOM 0 HG2 LYS A 540 9.611 2.552 -1.918 1.00 53.33 H new ATOM 0 HG3 LYS A 540 10.618 1.221 -2.452 1.00 53.33 H new ATOM 0 HD2 LYS A 540 8.597 -0.270 -2.411 1.00 1.52 H new ATOM 0 HD3 LYS A 540 7.616 1.119 -1.989 1.00 1.52 H new ATOM 0 HE2 LYS A 540 7.425 0.853 -4.351 1.00 62.11 H new ATOM 0 HE3 LYS A 540 8.444 2.255 -4.091 1.00 62.11 H new ATOM 0 HZ1 LYS A 540 9.233 0.650 -5.800 1.00 60.42 H new ATOM 0 HZ2 LYS A 540 10.370 1.020 -4.594 1.00 60.42 H new ATOM 0 HZ3 LYS A 540 9.537 -0.459 -4.551 1.00 60.42 H new ATOM 621 N THR A 541 8.921 3.604 1.114 1.00 74.23 N ATOM 622 CA THR A 541 8.687 5.010 1.004 1.00 33.52 C ATOM 623 C THR A 541 9.420 5.591 -0.206 1.00 33.13 C ATOM 624 O THR A 541 10.638 5.427 -0.341 1.00 12.51 O ATOM 625 CB THR A 541 9.186 5.725 2.278 1.00 13.14 C ATOM 626 OG1 THR A 541 10.472 5.185 2.669 1.00 44.24 O ATOM 627 CG2 THR A 541 8.200 5.588 3.421 1.00 23.41 C ATOM 0 H THR A 541 9.657 3.363 1.778 1.00 74.23 H new ATOM 0 HA THR A 541 7.615 5.166 0.881 1.00 33.52 H new ATOM 0 HB THR A 541 9.284 6.786 2.050 1.00 13.14 H new ATOM 0 HG1 THR A 541 11.032 5.064 1.874 1.00 44.24 H new ATOM 0 HG21 THR A 541 8.587 6.104 4.299 1.00 23.41 H new ATOM 0 HG22 THR A 541 7.245 6.028 3.133 1.00 23.41 H new ATOM 0 HG23 THR A 541 8.057 4.533 3.654 1.00 23.41 H new ATOM 635 N ILE A 542 8.685 6.195 -1.095 1.00 44.21 N ATOM 636 CA ILE A 542 9.268 6.940 -2.182 1.00 33.00 C ATOM 637 C ILE A 542 9.350 8.366 -1.688 1.00 64.34 C ATOM 638 O ILE A 542 8.313 8.945 -1.357 1.00 12.33 O ATOM 639 CB ILE A 542 8.415 6.923 -3.506 1.00 61.41 C ATOM 640 CG1 ILE A 542 8.225 5.513 -4.101 1.00 71.11 C ATOM 641 CG2 ILE A 542 9.012 7.852 -4.559 1.00 53.22 C ATOM 642 CD1 ILE A 542 7.239 4.638 -3.368 1.00 65.40 C ATOM 0 H ILE A 542 7.665 6.187 -1.090 1.00 44.21 H new ATOM 0 HA ILE A 542 10.228 6.493 -2.441 1.00 33.00 H new ATOM 0 HB ILE A 542 7.427 7.283 -3.219 1.00 61.41 H new ATOM 0 HG12 ILE A 542 7.899 5.613 -5.136 1.00 71.11 H new ATOM 0 HG13 ILE A 542 9.192 5.009 -4.118 1.00 71.11 H new ATOM 0 HG21 ILE A 542 8.402 7.819 -5.461 1.00 53.22 H new ATOM 0 HG22 ILE A 542 9.035 8.871 -4.174 1.00 53.22 H new ATOM 0 HG23 ILE A 542 10.026 7.530 -4.795 1.00 53.22 H new ATOM 0 HD11 ILE A 542 7.175 3.669 -3.862 1.00 65.40 H new ATOM 0 HD12 ILE A 542 7.570 4.500 -2.339 1.00 65.40 H new ATOM 0 HD13 ILE A 542 6.258 5.113 -3.373 1.00 65.40 H new ATOM 654 N GLU A 543 10.556 8.894 -1.605 1.00 73.22 N ATOM 655 CA GLU A 543 10.842 10.228 -1.050 1.00 70.11 C ATOM 656 C GLU A 543 9.917 11.305 -1.616 1.00 12.10 C ATOM 657 O GLU A 543 9.255 12.016 -0.866 1.00 2.44 O ATOM 658 CB GLU A 543 12.306 10.652 -1.296 1.00 72.40 C ATOM 659 CG GLU A 543 13.366 9.599 -0.991 1.00 14.14 C ATOM 660 CD GLU A 543 13.515 8.596 -2.099 1.00 51.55 C ATOM 661 OE1 GLU A 543 14.269 8.865 -3.046 1.00 22.44 O ATOM 662 OE2 GLU A 543 12.857 7.544 -2.065 1.00 12.23 O ATOM 0 H GLU A 543 11.392 8.406 -1.926 1.00 73.22 H new ATOM 0 HA GLU A 543 10.666 10.141 0.022 1.00 70.11 H new ATOM 0 HB2 GLU A 543 12.407 10.949 -2.340 1.00 72.40 H new ATOM 0 HB3 GLU A 543 12.514 11.535 -0.692 1.00 72.40 H new ATOM 0 HG2 GLU A 543 14.323 10.091 -0.819 1.00 14.14 H new ATOM 0 HG3 GLU A 543 13.104 9.081 -0.069 1.00 14.14 H new ATOM 669 N GLY A 544 9.885 11.420 -2.932 1.00 0.12 N ATOM 670 CA GLY A 544 9.048 12.405 -3.571 1.00 13.03 C ATOM 671 C GLY A 544 9.608 13.787 -3.374 1.00 41.33 C ATOM 672 O GLY A 544 10.579 14.171 -4.034 1.00 54.45 O ATOM 0 H GLY A 544 10.429 10.843 -3.573 1.00 0.12 H new ATOM 0 HA2 GLY A 544 8.970 12.187 -4.636 1.00 13.03 H new ATOM 0 HA3 GLY A 544 8.040 12.354 -3.161 1.00 13.03 H new ATOM 676 N THR A 545 9.028 14.523 -2.467 1.00 1.12 N ATOM 677 CA THR A 545 9.510 15.851 -2.139 1.00 2.45 C ATOM 678 C THR A 545 9.937 15.889 -0.652 1.00 31.45 C ATOM 679 O THR A 545 10.392 16.911 -0.119 1.00 73.04 O ATOM 680 CB THR A 545 8.455 16.958 -2.491 1.00 5.42 C ATOM 681 OG1 THR A 545 8.984 18.277 -2.267 1.00 52.22 O ATOM 682 CG2 THR A 545 7.181 16.790 -1.688 1.00 42.54 C ATOM 0 H THR A 545 8.211 14.228 -1.932 1.00 1.12 H new ATOM 0 HA THR A 545 10.384 16.074 -2.751 1.00 2.45 H new ATOM 0 HB THR A 545 8.223 16.841 -3.550 1.00 5.42 H new ATOM 0 HG1 THR A 545 9.577 18.263 -1.487 1.00 52.22 H new ATOM 0 HG21 THR A 545 6.474 17.574 -1.959 1.00 42.54 H new ATOM 0 HG22 THR A 545 6.742 15.816 -1.902 1.00 42.54 H new ATOM 0 HG23 THR A 545 7.410 16.859 -0.624 1.00 42.54 H new ATOM 690 N ALA A 546 9.783 14.759 0.014 1.00 4.24 N ATOM 691 CA ALA A 546 10.252 14.609 1.350 1.00 61.11 C ATOM 692 C ALA A 546 11.690 14.125 1.300 1.00 20.15 C ATOM 693 O ALA A 546 12.071 13.375 0.393 1.00 35.04 O ATOM 694 CB ALA A 546 9.386 13.619 2.097 1.00 51.52 C ATOM 0 H ALA A 546 9.328 13.930 -0.369 1.00 4.24 H new ATOM 0 HA ALA A 546 10.202 15.563 1.875 1.00 61.11 H new ATOM 0 HB1 ALA A 546 9.753 13.512 3.118 1.00 51.52 H new ATOM 0 HB2 ALA A 546 8.357 13.979 2.118 1.00 51.52 H new ATOM 0 HB3 ALA A 546 9.422 12.652 1.595 1.00 51.52 H new ATOM 700 N ARG A 547 12.493 14.583 2.206 1.00 53.15 N ATOM 701 CA ARG A 547 13.869 14.170 2.257 1.00 1.00 C ATOM 702 C ARG A 547 13.981 12.933 3.154 1.00 65.00 C ATOM 703 O ARG A 547 13.633 12.977 4.344 1.00 34.31 O ATOM 704 CB ARG A 547 14.736 15.320 2.779 1.00 21.03 C ATOM 705 CG ARG A 547 16.228 15.059 2.739 1.00 54.10 C ATOM 706 CD ARG A 547 16.752 14.889 1.334 1.00 4.44 C ATOM 707 NE ARG A 547 18.219 14.699 1.329 1.00 71.02 N ATOM 708 CZ ARG A 547 18.913 14.003 0.413 1.00 51.31 C ATOM 709 NH1 ARG A 547 18.286 13.390 -0.573 1.00 75.25 N ATOM 710 NH2 ARG A 547 20.237 13.913 0.500 1.00 54.33 N ATOM 0 H ARG A 547 12.222 15.249 2.929 1.00 53.15 H new ATOM 0 HA ARG A 547 14.225 13.912 1.260 1.00 1.00 H new ATOM 0 HB2 ARG A 547 14.522 16.213 2.192 1.00 21.03 H new ATOM 0 HB3 ARG A 547 14.447 15.537 3.807 1.00 21.03 H new ATOM 0 HG2 ARG A 547 16.750 15.886 3.220 1.00 54.10 H new ATOM 0 HG3 ARG A 547 16.451 14.162 3.317 1.00 54.10 H new ATOM 0 HD2 ARG A 547 16.270 14.031 0.865 1.00 4.44 H new ATOM 0 HD3 ARG A 547 16.494 15.765 0.739 1.00 4.44 H new ATOM 0 HE ARG A 547 18.749 15.133 2.085 1.00 71.02 H new ATOM 0 HH11 ARG A 547 17.270 13.443 -0.642 1.00 75.25 H new ATOM 0 HH12 ARG A 547 18.818 12.863 -1.266 1.00 75.25 H new ATOM 0 HH21 ARG A 547 20.730 14.374 1.265 1.00 54.33 H new ATOM 0 HH22 ARG A 547 20.759 13.383 -0.198 1.00 54.33 H new ATOM 724 N GLY A 548 14.434 11.844 2.594 1.00 71.12 N ATOM 725 CA GLY A 548 14.501 10.613 3.338 1.00 65.41 C ATOM 726 C GLY A 548 15.769 10.467 4.122 1.00 2.04 C ATOM 727 O GLY A 548 16.664 11.307 4.034 1.00 42.54 O ATOM 0 H GLY A 548 14.761 11.782 1.630 1.00 71.12 H new ATOM 0 HA2 GLY A 548 13.652 10.561 4.019 1.00 65.41 H new ATOM 0 HA3 GLY A 548 14.409 9.774 2.649 1.00 65.41 H new ATOM 731 N GLY A 549 15.835 9.420 4.910 1.00 33.54 N ATOM 732 CA GLY A 549 17.031 9.126 5.662 1.00 45.34 C ATOM 733 C GLY A 549 17.097 9.843 6.988 1.00 20.20 C ATOM 734 O GLY A 549 18.160 10.281 7.397 1.00 75.54 O ATOM 0 H GLY A 549 15.073 8.756 5.047 1.00 33.54 H new ATOM 0 HA2 GLY A 549 17.087 8.051 5.835 1.00 45.34 H new ATOM 0 HA3 GLY A 549 17.902 9.399 5.066 1.00 45.34 H new ATOM 738 N GLY A 550 15.962 10.001 7.644 1.00 14.44 N ATOM 739 CA GLY A 550 15.957 10.608 8.950 1.00 25.44 C ATOM 740 C GLY A 550 15.844 12.112 8.896 1.00 1.32 C ATOM 741 O GLY A 550 16.034 12.778 9.903 1.00 42.45 O ATOM 0 H GLY A 550 15.046 9.720 7.295 1.00 14.44 H new ATOM 0 HA2 GLY A 550 15.125 10.206 9.529 1.00 25.44 H new ATOM 0 HA3 GLY A 550 16.872 10.336 9.476 1.00 25.44 H new ATOM 745 N GLU A 551 15.547 12.653 7.727 1.00 71.00 N ATOM 746 CA GLU A 551 15.399 14.090 7.593 1.00 62.11 C ATOM 747 C GLU A 551 13.947 14.465 7.780 1.00 74.31 C ATOM 748 O GLU A 551 13.574 14.987 8.809 1.00 31.32 O ATOM 749 CB GLU A 551 15.861 14.536 6.219 1.00 4.21 C ATOM 750 CG GLU A 551 17.279 14.154 5.882 1.00 53.32 C ATOM 751 CD GLU A 551 18.288 14.836 6.744 1.00 14.12 C ATOM 752 OE1 GLU A 551 18.558 14.361 7.857 1.00 62.32 O ATOM 753 OE2 GLU A 551 18.860 15.854 6.312 1.00 50.41 O ATOM 0 H GLU A 551 15.405 12.125 6.866 1.00 71.00 H new ATOM 0 HA GLU A 551 16.008 14.583 8.351 1.00 62.11 H new ATOM 0 HB2 GLU A 551 15.195 14.109 5.469 1.00 4.21 H new ATOM 0 HB3 GLU A 551 15.764 15.620 6.151 1.00 4.21 H new ATOM 0 HG2 GLU A 551 17.393 13.075 5.984 1.00 53.32 H new ATOM 0 HG3 GLU A 551 17.477 14.398 4.838 1.00 53.32 H new ATOM 760 N ASP A 552 13.126 14.131 6.794 1.00 3.33 N ATOM 761 CA ASP A 552 11.682 14.366 6.872 1.00 74.22 C ATOM 762 C ASP A 552 11.016 13.102 7.303 1.00 3.31 C ATOM 763 O ASP A 552 9.971 13.112 7.953 1.00 71.51 O ATOM 764 CB ASP A 552 11.059 14.833 5.528 1.00 63.42 C ATOM 765 CG ASP A 552 11.371 16.267 5.146 1.00 54.20 C ATOM 766 OD1 ASP A 552 11.294 17.161 6.026 1.00 55.24 O ATOM 767 OD2 ASP A 552 11.663 16.545 3.952 1.00 41.15 O ATOM 0 H ASP A 552 13.433 13.694 5.925 1.00 3.33 H new ATOM 0 HA ASP A 552 11.524 15.171 7.590 1.00 74.22 H new ATOM 0 HB2 ASP A 552 11.411 14.175 4.733 1.00 63.42 H new ATOM 0 HB3 ASP A 552 9.977 14.714 5.585 1.00 63.42 H new ATOM 772 N PHE A 553 11.622 11.996 6.939 1.00 34.33 N ATOM 773 CA PHE A 553 11.115 10.724 7.312 1.00 54.34 C ATOM 774 C PHE A 553 12.230 9.747 7.452 1.00 24.41 C ATOM 775 O PHE A 553 13.313 9.908 6.849 1.00 63.52 O ATOM 776 CB PHE A 553 10.085 10.187 6.314 1.00 44.34 C ATOM 777 CG PHE A 553 10.608 9.827 4.944 1.00 51.33 C ATOM 778 CD1 PHE A 553 10.736 10.780 3.956 1.00 53.32 C ATOM 779 CD2 PHE A 553 10.941 8.521 4.648 1.00 65.14 C ATOM 780 CE1 PHE A 553 11.189 10.439 2.700 1.00 24.55 C ATOM 781 CE2 PHE A 553 11.392 8.173 3.399 1.00 34.10 C ATOM 782 CZ PHE A 553 11.515 9.129 2.423 1.00 23.04 C ATOM 0 H PHE A 553 12.474 11.967 6.379 1.00 34.33 H new ATOM 0 HA PHE A 553 10.609 10.853 8.269 1.00 54.34 H new ATOM 0 HB2 PHE A 553 9.619 9.302 6.746 1.00 44.34 H new ATOM 0 HB3 PHE A 553 9.301 10.935 6.196 1.00 44.34 H new ATOM 0 HD1 PHE A 553 10.478 11.807 4.169 1.00 53.32 H new ATOM 0 HD2 PHE A 553 10.845 7.762 5.410 1.00 65.14 H new ATOM 0 HE1 PHE A 553 11.288 11.196 1.936 1.00 24.55 H new ATOM 0 HE2 PHE A 553 11.650 7.146 3.185 1.00 34.10 H new ATOM 0 HZ PHE A 553 11.867 8.856 1.439 1.00 23.04 H new ATOM 792 N GLU A 554 11.979 8.767 8.230 1.00 1.41 N ATOM 793 CA GLU A 554 12.859 7.673 8.427 1.00 23.15 C ATOM 794 C GLU A 554 12.580 6.742 7.250 1.00 33.41 C ATOM 795 O GLU A 554 11.419 6.382 7.025 1.00 12.12 O ATOM 796 CB GLU A 554 12.445 7.046 9.754 1.00 74.44 C ATOM 797 CG GLU A 554 13.400 6.081 10.413 1.00 12.44 C ATOM 798 CD GLU A 554 13.694 4.834 9.635 1.00 53.13 C ATOM 799 OE1 GLU A 554 12.871 3.903 9.646 1.00 50.22 O ATOM 800 OE2 GLU A 554 14.785 4.747 9.061 1.00 63.55 O ATOM 0 H GLU A 554 11.118 8.698 8.773 1.00 1.41 H new ATOM 0 HA GLU A 554 13.920 7.919 8.466 1.00 23.15 H new ATOM 0 HB2 GLU A 554 12.249 7.855 10.458 1.00 74.44 H new ATOM 0 HB3 GLU A 554 11.501 6.525 9.596 1.00 74.44 H new ATOM 0 HG2 GLU A 554 14.340 6.600 10.604 1.00 12.44 H new ATOM 0 HG3 GLU A 554 12.991 5.796 11.382 1.00 12.44 H new ATOM 807 N ASP A 555 13.603 6.413 6.464 1.00 53.01 N ATOM 808 CA ASP A 555 13.391 5.598 5.266 1.00 3.32 C ATOM 809 C ASP A 555 12.828 4.263 5.605 1.00 12.30 C ATOM 810 O ASP A 555 13.403 3.481 6.361 1.00 2.03 O ATOM 811 CB ASP A 555 14.606 5.471 4.342 1.00 5.15 C ATOM 812 CG ASP A 555 15.818 4.765 4.934 1.00 45.51 C ATOM 813 OD1 ASP A 555 16.603 5.411 5.661 1.00 60.32 O ATOM 814 OD2 ASP A 555 16.031 3.565 4.641 1.00 11.11 O ATOM 0 H ASP A 555 14.570 6.691 6.629 1.00 53.01 H new ATOM 0 HA ASP A 555 12.656 6.154 4.685 1.00 3.32 H new ATOM 0 HB2 ASP A 555 14.301 4.936 3.443 1.00 5.15 H new ATOM 0 HB3 ASP A 555 14.908 6.471 4.030 1.00 5.15 H new ATOM 819 N THR A 556 11.703 4.008 5.057 1.00 4.12 N ATOM 820 CA THR A 556 10.968 2.883 5.404 1.00 51.04 C ATOM 821 C THR A 556 10.732 1.964 4.201 1.00 24.13 C ATOM 822 O THR A 556 10.049 2.324 3.252 1.00 40.22 O ATOM 823 CB THR A 556 9.652 3.345 6.024 1.00 34.12 C ATOM 824 OG1 THR A 556 9.909 4.118 7.208 1.00 1.12 O ATOM 825 CG2 THR A 556 8.803 2.189 6.356 1.00 12.23 C ATOM 0 H THR A 556 11.269 4.593 4.343 1.00 4.12 H new ATOM 0 HA THR A 556 11.528 2.292 6.128 1.00 51.04 H new ATOM 0 HB THR A 556 9.128 3.966 5.298 1.00 34.12 H new ATOM 0 HG1 THR A 556 10.323 4.971 6.959 1.00 1.12 H new ATOM 0 HG21 THR A 556 7.869 2.538 6.797 1.00 12.23 H new ATOM 0 HG22 THR A 556 8.587 1.624 5.449 1.00 12.23 H new ATOM 0 HG23 THR A 556 9.323 1.548 7.068 1.00 12.23 H new ATOM 833 N CYS A 557 11.331 0.810 4.244 1.00 54.22 N ATOM 834 CA CYS A 557 11.150 -0.196 3.237 1.00 55.24 C ATOM 835 C CYS A 557 11.214 -1.538 3.910 1.00 73.54 C ATOM 836 O CYS A 557 12.143 -1.802 4.675 1.00 33.10 O ATOM 837 CB CYS A 557 12.213 -0.068 2.133 1.00 3.01 C ATOM 838 SG CYS A 557 13.918 -0.101 2.725 1.00 24.23 S ATOM 0 H CYS A 557 11.969 0.536 4.991 1.00 54.22 H new ATOM 0 HA CYS A 557 10.182 -0.074 2.751 1.00 55.24 H new ATOM 0 HB2 CYS A 557 12.075 -0.879 1.418 1.00 3.01 H new ATOM 0 HB3 CYS A 557 12.047 0.865 1.594 1.00 3.01 H new ATOM 0 HG CYS A 557 13.987 -0.816 3.809 1.00 24.23 H new ATOM 844 N GLY A 558 10.244 -2.369 3.669 1.00 53.24 N ATOM 845 CA GLY A 558 10.192 -3.627 4.329 1.00 21.23 C ATOM 846 C GLY A 558 9.218 -4.538 3.671 1.00 61.33 C ATOM 847 O GLY A 558 8.891 -4.351 2.489 1.00 31.15 O ATOM 0 H GLY A 558 9.479 -2.192 3.018 1.00 53.24 H new ATOM 0 HA2 GLY A 558 11.182 -4.084 4.325 1.00 21.23 H new ATOM 0 HA3 GLY A 558 9.912 -3.482 5.372 1.00 21.23 H new ATOM 851 N GLU A 559 8.721 -5.481 4.418 1.00 53.05 N ATOM 852 CA GLU A 559 7.821 -6.484 3.919 1.00 3.24 C ATOM 853 C GLU A 559 6.765 -6.818 4.971 1.00 65.42 C ATOM 854 O GLU A 559 7.100 -7.137 6.113 1.00 0.31 O ATOM 855 CB GLU A 559 8.610 -7.734 3.539 1.00 10.34 C ATOM 856 CG GLU A 559 9.473 -7.606 2.289 1.00 21.02 C ATOM 857 CD GLU A 559 10.280 -8.851 2.020 1.00 20.15 C ATOM 858 OE1 GLU A 559 9.793 -9.765 1.321 1.00 12.52 O ATOM 859 OE2 GLU A 559 11.420 -8.943 2.518 1.00 61.21 O ATOM 0 H GLU A 559 8.933 -5.577 5.411 1.00 53.05 H new ATOM 0 HA GLU A 559 7.313 -6.102 3.034 1.00 3.24 H new ATOM 0 HB2 GLU A 559 9.252 -8.007 4.377 1.00 10.34 H new ATOM 0 HB3 GLU A 559 7.909 -8.556 3.394 1.00 10.34 H new ATOM 0 HG2 GLU A 559 8.835 -7.396 1.430 1.00 21.02 H new ATOM 0 HG3 GLU A 559 10.147 -6.756 2.401 1.00 21.02 H new ATOM 866 N LEU A 560 5.509 -6.716 4.593 1.00 75.14 N ATOM 867 CA LEU A 560 4.396 -7.013 5.478 1.00 23.21 C ATOM 868 C LEU A 560 4.027 -8.469 5.401 1.00 72.12 C ATOM 869 O LEU A 560 3.930 -9.039 4.308 1.00 21.30 O ATOM 870 CB LEU A 560 3.160 -6.180 5.132 1.00 73.44 C ATOM 871 CG LEU A 560 3.230 -4.682 5.393 1.00 62.33 C ATOM 872 CD1 LEU A 560 1.962 -4.020 4.911 1.00 73.23 C ATOM 873 CD2 LEU A 560 3.440 -4.396 6.877 1.00 61.42 C ATOM 0 H LEU A 560 5.226 -6.423 3.658 1.00 75.14 H new ATOM 0 HA LEU A 560 4.723 -6.763 6.487 1.00 23.21 H new ATOM 0 HB2 LEU A 560 2.939 -6.328 4.075 1.00 73.44 H new ATOM 0 HB3 LEU A 560 2.316 -6.581 5.693 1.00 73.44 H new ATOM 0 HG LEU A 560 4.080 -4.275 4.846 1.00 62.33 H new ATOM 0 HD11 LEU A 560 2.017 -2.948 5.100 1.00 73.23 H new ATOM 0 HD12 LEU A 560 1.844 -4.194 3.841 1.00 73.23 H new ATOM 0 HD13 LEU A 560 1.108 -4.439 5.443 1.00 73.23 H new ATOM 0 HD21 LEU A 560 3.487 -3.319 7.037 1.00 61.42 H new ATOM 0 HD22 LEU A 560 2.611 -4.812 7.449 1.00 61.42 H new ATOM 0 HD23 LEU A 560 4.373 -4.852 7.207 1.00 61.42 H new ATOM 885 N GLU A 561 3.804 -9.052 6.539 1.00 64.45 N ATOM 886 CA GLU A 561 3.427 -10.426 6.636 1.00 71.12 C ATOM 887 C GLU A 561 1.909 -10.560 6.752 1.00 42.13 C ATOM 888 O GLU A 561 1.321 -10.178 7.743 1.00 13.24 O ATOM 889 CB GLU A 561 4.132 -11.085 7.838 1.00 73.32 C ATOM 890 CG GLU A 561 3.830 -12.566 8.015 1.00 41.02 C ATOM 891 CD GLU A 561 4.566 -13.176 9.179 1.00 51.23 C ATOM 892 OE1 GLU A 561 4.217 -12.898 10.329 1.00 1.31 O ATOM 893 OE2 GLU A 561 5.528 -13.935 8.963 1.00 44.34 O ATOM 0 H GLU A 561 3.880 -8.578 7.439 1.00 64.45 H new ATOM 0 HA GLU A 561 3.740 -10.941 5.728 1.00 71.12 H new ATOM 0 HB2 GLU A 561 5.209 -10.958 7.725 1.00 73.32 H new ATOM 0 HB3 GLU A 561 3.842 -10.557 8.747 1.00 73.32 H new ATOM 0 HG2 GLU A 561 2.758 -12.699 8.159 1.00 41.02 H new ATOM 0 HG3 GLU A 561 4.098 -13.098 7.102 1.00 41.02 H new ATOM 900 N PHE A 562 1.287 -11.036 5.712 1.00 33.11 N ATOM 901 CA PHE A 562 -0.127 -11.333 5.742 1.00 23.32 C ATOM 902 C PHE A 562 -0.319 -12.818 5.753 1.00 34.03 C ATOM 903 O PHE A 562 0.064 -13.496 4.812 1.00 64.44 O ATOM 904 CB PHE A 562 -0.859 -10.768 4.532 1.00 61.03 C ATOM 905 CG PHE A 562 -1.429 -9.393 4.695 1.00 23.12 C ATOM 906 CD1 PHE A 562 -2.485 -9.183 5.571 1.00 62.33 C ATOM 907 CD2 PHE A 562 -0.955 -8.330 3.950 1.00 74.42 C ATOM 908 CE1 PHE A 562 -3.057 -7.939 5.699 1.00 31.22 C ATOM 909 CE2 PHE A 562 -1.530 -7.079 4.068 1.00 55.43 C ATOM 910 CZ PHE A 562 -2.583 -6.884 4.946 1.00 4.21 C ATOM 0 H PHE A 562 1.739 -11.231 4.819 1.00 33.11 H new ATOM 0 HA PHE A 562 -0.538 -10.872 6.640 1.00 23.32 H new ATOM 0 HB2 PHE A 562 -0.170 -10.757 3.688 1.00 61.03 H new ATOM 0 HB3 PHE A 562 -1.670 -11.448 4.272 1.00 61.03 H new ATOM 0 HD1 PHE A 562 -2.862 -10.007 6.159 1.00 62.33 H new ATOM 0 HD2 PHE A 562 -0.129 -8.478 3.270 1.00 74.42 H new ATOM 0 HE1 PHE A 562 -3.875 -7.788 6.387 1.00 31.22 H new ATOM 0 HE2 PHE A 562 -1.159 -6.255 3.477 1.00 55.43 H new ATOM 0 HZ PHE A 562 -3.033 -5.907 5.041 1.00 4.21 H new ATOM 920 N GLN A 563 -0.888 -13.343 6.785 1.00 55.50 N ATOM 921 CA GLN A 563 -1.090 -14.777 6.824 1.00 63.45 C ATOM 922 C GLN A 563 -2.555 -15.141 6.932 1.00 51.31 C ATOM 923 O GLN A 563 -3.427 -14.263 6.822 1.00 73.12 O ATOM 924 CB GLN A 563 -0.230 -15.444 7.908 1.00 63.02 C ATOM 925 CG GLN A 563 -0.329 -14.799 9.267 1.00 13.45 C ATOM 926 CD GLN A 563 0.431 -15.542 10.350 1.00 21.45 C ATOM 927 OE1 GLN A 563 0.049 -15.498 11.511 1.00 43.55 O ATOM 928 NE2 GLN A 563 1.489 -16.230 9.990 1.00 33.25 N ATOM 0 H GLN A 563 -1.219 -12.828 7.601 1.00 55.50 H new ATOM 0 HA GLN A 563 -0.748 -15.178 5.870 1.00 63.45 H new ATOM 0 HB2 GLN A 563 -0.523 -16.490 7.994 1.00 63.02 H new ATOM 0 HB3 GLN A 563 0.812 -15.430 7.588 1.00 63.02 H new ATOM 0 HG2 GLN A 563 0.050 -13.779 9.204 1.00 13.45 H new ATOM 0 HG3 GLN A 563 -1.379 -14.732 9.552 1.00 13.45 H new ATOM 0 HE21 GLN A 563 1.779 -16.245 9.012 1.00 33.25 H new ATOM 0 HE22 GLN A 563 2.021 -16.750 10.688 1.00 33.25 H new ATOM 937 N ASN A 564 -2.819 -16.425 7.071 1.00 43.25 N ATOM 938 CA ASN A 564 -4.169 -16.954 7.235 1.00 62.22 C ATOM 939 C ASN A 564 -4.807 -16.349 8.467 1.00 1.41 C ATOM 940 O ASN A 564 -5.923 -15.838 8.416 1.00 43.34 O ATOM 941 CB ASN A 564 -4.097 -18.494 7.349 1.00 42.23 C ATOM 942 CG ASN A 564 -5.391 -19.180 7.777 1.00 62.24 C ATOM 943 OD1 ASN A 564 -6.216 -19.542 6.951 1.00 63.55 O ATOM 944 ND2 ASN A 564 -5.542 -19.421 9.056 1.00 75.21 N ATOM 0 H ASN A 564 -2.096 -17.144 7.074 1.00 43.25 H new ATOM 0 HA ASN A 564 -4.782 -16.694 6.372 1.00 62.22 H new ATOM 0 HB2 ASN A 564 -3.793 -18.899 6.384 1.00 42.23 H new ATOM 0 HB3 ASN A 564 -3.315 -18.752 8.063 1.00 42.23 H new ATOM 0 HD21 ASN A 564 -6.366 -19.924 9.386 1.00 75.21 H new ATOM 0 HD22 ASN A 564 -4.836 -19.106 9.721 1.00 75.21 H new ATOM 951 N ASP A 565 -4.063 -16.358 9.543 1.00 32.44 N ATOM 952 CA ASP A 565 -4.541 -15.844 10.818 1.00 10.32 C ATOM 953 C ASP A 565 -4.501 -14.322 10.849 1.00 63.03 C ATOM 954 O ASP A 565 -5.552 -13.674 10.886 1.00 54.15 O ATOM 955 CB ASP A 565 -3.715 -16.404 11.973 1.00 41.22 C ATOM 956 CG ASP A 565 -4.275 -16.023 13.323 1.00 51.33 C ATOM 957 OD1 ASP A 565 -3.972 -14.929 13.843 1.00 25.23 O ATOM 958 OD2 ASP A 565 -5.024 -16.825 13.907 1.00 42.24 O ATOM 0 H ASP A 565 -3.109 -16.719 9.569 1.00 32.44 H new ATOM 0 HA ASP A 565 -5.576 -16.167 10.932 1.00 10.32 H new ATOM 0 HB2 ASP A 565 -3.675 -17.490 11.893 1.00 41.22 H new ATOM 0 HB3 ASP A 565 -2.691 -16.040 11.892 1.00 41.22 H new ATOM 963 N GLU A 566 -3.285 -13.766 10.828 1.00 72.21 N ATOM 964 CA GLU A 566 -3.064 -12.321 10.887 1.00 34.22 C ATOM 965 C GLU A 566 -3.785 -11.578 9.789 1.00 25.31 C ATOM 966 O GLU A 566 -3.484 -11.738 8.590 1.00 21.12 O ATOM 967 CB GLU A 566 -1.562 -11.968 10.858 1.00 21.24 C ATOM 968 CG GLU A 566 -1.285 -10.466 10.903 1.00 13.41 C ATOM 969 CD GLU A 566 0.073 -10.111 11.471 1.00 24.14 C ATOM 970 OE1 GLU A 566 0.197 -10.019 12.701 1.00 42.01 O ATOM 971 OE2 GLU A 566 1.027 -9.880 10.719 1.00 51.55 O ATOM 0 H GLU A 566 -2.424 -14.310 10.769 1.00 72.21 H new ATOM 0 HA GLU A 566 -3.482 -11.998 11.841 1.00 34.22 H new ATOM 0 HB2 GLU A 566 -1.069 -12.445 11.705 1.00 21.24 H new ATOM 0 HB3 GLU A 566 -1.117 -12.384 9.954 1.00 21.24 H new ATOM 0 HG2 GLU A 566 -1.363 -10.061 9.894 1.00 13.41 H new ATOM 0 HG3 GLU A 566 -2.057 -9.982 11.501 1.00 13.41 H new ATOM 978 N ILE A 567 -4.744 -10.783 10.190 1.00 34.42 N ATOM 979 CA ILE A 567 -5.417 -9.934 9.292 1.00 33.20 C ATOM 980 C ILE A 567 -4.854 -8.557 9.498 1.00 71.41 C ATOM 981 O ILE A 567 -4.162 -8.343 10.480 1.00 64.13 O ATOM 982 CB ILE A 567 -6.953 -9.867 9.537 1.00 64.15 C ATOM 983 CG1 ILE A 567 -7.274 -9.145 10.848 1.00 65.44 C ATOM 984 CG2 ILE A 567 -7.540 -11.269 9.574 1.00 31.11 C ATOM 985 CD1 ILE A 567 -8.654 -8.560 10.871 1.00 24.14 C ATOM 0 H ILE A 567 -5.067 -10.720 11.155 1.00 34.42 H new ATOM 0 HA ILE A 567 -5.273 -10.320 8.283 1.00 33.20 H new ATOM 0 HB ILE A 567 -7.397 -9.306 8.715 1.00 64.15 H new ATOM 0 HG12 ILE A 567 -7.168 -9.845 11.677 1.00 65.44 H new ATOM 0 HG13 ILE A 567 -6.545 -8.350 11.006 1.00 65.44 H new ATOM 0 HG21 ILE A 567 -8.615 -11.209 9.746 1.00 31.11 H new ATOM 0 HG22 ILE A 567 -7.352 -11.767 8.623 1.00 31.11 H new ATOM 0 HG23 ILE A 567 -7.075 -11.837 10.380 1.00 31.11 H new ATOM 0 HD11 ILE A 567 -8.822 -8.062 11.826 1.00 24.14 H new ATOM 0 HD12 ILE A 567 -8.756 -7.837 10.061 1.00 24.14 H new ATOM 0 HD13 ILE A 567 -9.388 -9.355 10.743 1.00 24.14 H new ATOM 997 N VAL A 568 -5.197 -7.661 8.597 1.00 0.21 N ATOM 998 CA VAL A 568 -4.838 -6.232 8.584 1.00 45.22 C ATOM 999 C VAL A 568 -3.380 -5.874 9.004 1.00 44.02 C ATOM 1000 O VAL A 568 -2.885 -6.172 10.093 1.00 2.51 O ATOM 1001 CB VAL A 568 -5.881 -5.358 9.327 1.00 24.21 C ATOM 1002 CG1 VAL A 568 -5.663 -5.307 10.825 1.00 54.33 C ATOM 1003 CG2 VAL A 568 -5.969 -3.980 8.728 1.00 4.22 C ATOM 0 H VAL A 568 -5.773 -7.914 7.794 1.00 0.21 H new ATOM 0 HA VAL A 568 -4.864 -5.985 7.523 1.00 45.22 H new ATOM 0 HB VAL A 568 -6.844 -5.848 9.185 1.00 24.21 H new ATOM 0 HG11 VAL A 568 -6.427 -4.679 11.283 1.00 54.33 H new ATOM 0 HG12 VAL A 568 -5.727 -6.314 11.236 1.00 54.33 H new ATOM 0 HG13 VAL A 568 -4.678 -4.891 11.035 1.00 54.33 H new ATOM 0 HG21 VAL A 568 -6.709 -3.393 9.272 1.00 4.22 H new ATOM 0 HG22 VAL A 568 -4.997 -3.491 8.796 1.00 4.22 H new ATOM 0 HG23 VAL A 568 -6.265 -4.056 7.682 1.00 4.22 H new ATOM 1013 N LYS A 569 -2.728 -5.207 8.150 1.00 71.12 N ATOM 1014 CA LYS A 569 -1.394 -4.792 8.416 1.00 64.13 C ATOM 1015 C LYS A 569 -1.316 -3.320 8.445 1.00 44.42 C ATOM 1016 O LYS A 569 -2.185 -2.629 7.904 1.00 32.01 O ATOM 1017 CB LYS A 569 -0.398 -5.375 7.423 1.00 14.31 C ATOM 1018 CG LYS A 569 -0.268 -6.882 7.510 1.00 10.11 C ATOM 1019 CD LYS A 569 0.209 -7.334 8.876 1.00 11.14 C ATOM 1020 CE LYS A 569 1.634 -6.946 9.128 1.00 23.33 C ATOM 1021 NZ LYS A 569 2.120 -7.451 10.433 1.00 23.12 N ATOM 0 H LYS A 569 -3.091 -4.925 7.240 1.00 71.12 H new ATOM 0 HA LYS A 569 -1.118 -5.179 9.397 1.00 64.13 H new ATOM 0 HB2 LYS A 569 -0.703 -5.103 6.413 1.00 14.31 H new ATOM 0 HB3 LYS A 569 0.579 -4.924 7.594 1.00 14.31 H new ATOM 0 HG2 LYS A 569 -1.232 -7.342 7.292 1.00 10.11 H new ATOM 0 HG3 LYS A 569 0.430 -7.230 6.749 1.00 10.11 H new ATOM 0 HD2 LYS A 569 -0.427 -6.897 9.645 1.00 11.14 H new ATOM 0 HD3 LYS A 569 0.108 -8.416 8.956 1.00 11.14 H new ATOM 0 HE2 LYS A 569 2.264 -7.338 8.329 1.00 23.33 H new ATOM 0 HE3 LYS A 569 1.725 -5.860 9.102 1.00 23.33 H new ATOM 0 HZ1 LYS A 569 3.110 -7.757 10.340 1.00 23.12 H new ATOM 0 HZ2 LYS A 569 2.057 -6.694 11.143 1.00 23.12 H new ATOM 0 HZ3 LYS A 569 1.535 -8.257 10.733 1.00 23.12 H new ATOM 1035 N THR A 570 -0.324 -2.849 9.098 1.00 11.13 N ATOM 1036 CA THR A 570 -0.084 -1.451 9.212 1.00 44.05 C ATOM 1037 C THR A 570 1.332 -1.112 8.864 1.00 30.32 C ATOM 1038 O THR A 570 2.267 -1.692 9.417 1.00 1.51 O ATOM 1039 CB THR A 570 -0.390 -0.946 10.626 1.00 3.34 C ATOM 1040 OG1 THR A 570 0.011 -1.928 11.601 1.00 33.55 O ATOM 1041 CG2 THR A 570 -1.849 -0.599 10.793 1.00 2.40 C ATOM 0 H THR A 570 0.362 -3.430 9.580 1.00 11.13 H new ATOM 0 HA THR A 570 -0.752 -0.958 8.506 1.00 44.05 H new ATOM 0 HB THR A 570 0.182 -0.032 10.784 1.00 3.34 H new ATOM 0 HG1 THR A 570 -0.187 -1.595 12.501 1.00 33.55 H new ATOM 0 HG21 THR A 570 -2.025 -0.245 11.809 1.00 2.40 H new ATOM 0 HG22 THR A 570 -2.120 0.183 10.084 1.00 2.40 H new ATOM 0 HG23 THR A 570 -2.457 -1.484 10.607 1.00 2.40 H new ATOM 1049 N ILE A 571 1.501 -0.211 7.936 1.00 61.11 N ATOM 1050 CA ILE A 571 2.818 0.272 7.630 1.00 44.41 C ATOM 1051 C ILE A 571 3.104 1.368 8.616 1.00 71.14 C ATOM 1052 O ILE A 571 2.429 2.396 8.606 1.00 2.24 O ATOM 1053 CB ILE A 571 3.006 0.846 6.176 1.00 11.42 C ATOM 1054 CG1 ILE A 571 2.754 -0.193 5.081 1.00 44.22 C ATOM 1055 CG2 ILE A 571 4.403 1.402 6.008 1.00 22.20 C ATOM 1056 CD1 ILE A 571 1.315 -0.516 4.848 1.00 3.55 C ATOM 0 H ILE A 571 0.750 0.201 7.383 1.00 61.11 H new ATOM 0 HA ILE A 571 3.499 -0.577 7.690 1.00 44.41 H new ATOM 0 HB ILE A 571 2.261 1.634 6.063 1.00 11.42 H new ATOM 0 HG12 ILE A 571 3.187 0.169 4.149 1.00 44.22 H new ATOM 0 HG13 ILE A 571 3.281 -1.111 5.342 1.00 44.22 H new ATOM 0 HG21 ILE A 571 4.519 1.795 4.998 1.00 22.20 H new ATOM 0 HG22 ILE A 571 4.565 2.202 6.730 1.00 22.20 H new ATOM 0 HG23 ILE A 571 5.133 0.609 6.175 1.00 22.20 H new ATOM 0 HD11 ILE A 571 1.233 -1.260 4.056 1.00 3.55 H new ATOM 0 HD12 ILE A 571 0.878 -0.912 5.765 1.00 3.55 H new ATOM 0 HD13 ILE A 571 0.782 0.388 4.553 1.00 3.55 H new ATOM 1068 N SER A 572 4.011 1.113 9.495 1.00 12.22 N ATOM 1069 CA SER A 572 4.404 2.053 10.480 1.00 31.01 C ATOM 1070 C SER A 572 5.644 2.815 10.008 1.00 50.24 C ATOM 1071 O SER A 572 6.727 2.247 9.899 1.00 71.24 O ATOM 1072 CB SER A 572 4.647 1.282 11.772 1.00 73.40 C ATOM 1073 OG SER A 572 5.299 0.036 11.492 1.00 10.44 O ATOM 0 H SER A 572 4.509 0.225 9.548 1.00 12.22 H new ATOM 0 HA SER A 572 3.631 2.802 10.654 1.00 31.01 H new ATOM 0 HB2 SER A 572 5.260 1.877 12.449 1.00 73.40 H new ATOM 0 HB3 SER A 572 3.699 1.099 12.278 1.00 73.40 H new ATOM 0 HG SER A 572 6.046 0.189 10.876 1.00 10.44 H new ATOM 1079 N VAL A 573 5.478 4.066 9.691 1.00 13.13 N ATOM 1080 CA VAL A 573 6.586 4.873 9.200 1.00 61.15 C ATOM 1081 C VAL A 573 6.926 5.911 10.230 1.00 64.14 C ATOM 1082 O VAL A 573 6.013 6.553 10.784 1.00 30.44 O ATOM 1083 CB VAL A 573 6.240 5.596 7.860 1.00 52.30 C ATOM 1084 CG1 VAL A 573 7.419 6.421 7.339 1.00 54.32 C ATOM 1085 CG2 VAL A 573 5.783 4.606 6.808 1.00 24.51 C ATOM 0 H VAL A 573 4.589 4.561 9.760 1.00 13.13 H new ATOM 0 HA VAL A 573 7.428 4.205 9.016 1.00 61.15 H new ATOM 0 HB VAL A 573 5.420 6.282 8.070 1.00 52.30 H new ATOM 0 HG11 VAL A 573 7.138 6.908 6.405 1.00 54.32 H new ATOM 0 HG12 VAL A 573 7.688 7.177 8.076 1.00 54.32 H new ATOM 0 HG13 VAL A 573 8.272 5.766 7.164 1.00 54.32 H new ATOM 0 HG21 VAL A 573 5.549 5.137 5.886 1.00 24.51 H new ATOM 0 HG22 VAL A 573 6.577 3.884 6.619 1.00 24.51 H new ATOM 0 HG23 VAL A 573 4.894 4.084 7.162 1.00 24.51 H new ATOM 1095 N LYS A 574 8.201 6.068 10.518 1.00 12.23 N ATOM 1096 CA LYS A 574 8.617 7.065 11.450 1.00 61.41 C ATOM 1097 C LYS A 574 8.767 8.399 10.739 1.00 13.10 C ATOM 1098 O LYS A 574 9.574 8.549 9.804 1.00 24.03 O ATOM 1099 CB LYS A 574 9.908 6.659 12.161 1.00 75.31 C ATOM 1100 CG LYS A 574 10.402 7.675 13.181 1.00 54.50 C ATOM 1101 CD LYS A 574 11.741 7.272 13.784 1.00 73.02 C ATOM 1102 CE LYS A 574 11.655 5.979 14.584 1.00 12.02 C ATOM 1103 NZ LYS A 574 12.947 5.640 15.218 1.00 72.40 N ATOM 0 H LYS A 574 8.957 5.514 10.115 1.00 12.23 H new ATOM 0 HA LYS A 574 7.852 7.166 12.220 1.00 61.41 H new ATOM 0 HB2 LYS A 574 9.749 5.704 12.663 1.00 75.31 H new ATOM 0 HB3 LYS A 574 10.687 6.501 11.415 1.00 75.31 H new ATOM 0 HG2 LYS A 574 10.498 8.650 12.704 1.00 54.50 H new ATOM 0 HG3 LYS A 574 9.663 7.780 13.976 1.00 54.50 H new ATOM 0 HD2 LYS A 574 12.474 7.154 12.986 1.00 73.02 H new ATOM 0 HD3 LYS A 574 12.100 8.072 14.431 1.00 73.02 H new ATOM 0 HE2 LYS A 574 10.888 6.077 15.352 1.00 12.02 H new ATOM 0 HE3 LYS A 574 11.347 5.165 13.928 1.00 12.02 H new ATOM 0 HZ1 LYS A 574 12.849 4.754 15.754 1.00 72.40 H new ATOM 0 HZ2 LYS A 574 13.674 5.522 14.483 1.00 72.40 H new ATOM 0 HZ3 LYS A 574 13.228 6.405 15.864 1.00 72.40 H new ATOM 1117 N VAL A 575 7.971 9.330 11.150 1.00 24.50 N ATOM 1118 CA VAL A 575 7.978 10.658 10.603 1.00 10.24 C ATOM 1119 C VAL A 575 8.970 11.467 11.412 1.00 14.33 C ATOM 1120 O VAL A 575 9.114 11.237 12.616 1.00 23.44 O ATOM 1121 CB VAL A 575 6.560 11.291 10.693 1.00 64.21 C ATOM 1122 CG1 VAL A 575 6.540 12.698 10.114 1.00 71.11 C ATOM 1123 CG2 VAL A 575 5.540 10.413 9.972 1.00 11.34 C ATOM 0 H VAL A 575 7.282 9.192 11.889 1.00 24.50 H new ATOM 0 HA VAL A 575 8.261 10.640 9.550 1.00 10.24 H new ATOM 0 HB VAL A 575 6.293 11.357 11.748 1.00 64.21 H new ATOM 0 HG11 VAL A 575 5.534 13.110 10.193 1.00 71.11 H new ATOM 0 HG12 VAL A 575 7.235 13.329 10.668 1.00 71.11 H new ATOM 0 HG13 VAL A 575 6.837 12.664 9.066 1.00 71.11 H new ATOM 0 HG21 VAL A 575 4.552 10.869 10.044 1.00 11.34 H new ATOM 0 HG22 VAL A 575 5.820 10.316 8.923 1.00 11.34 H new ATOM 0 HG23 VAL A 575 5.518 9.426 10.434 1.00 11.34 H new ATOM 1133 N ILE A 576 9.683 12.358 10.784 1.00 50.04 N ATOM 1134 CA ILE A 576 10.669 13.115 11.494 1.00 72.55 C ATOM 1135 C ILE A 576 10.224 14.567 11.572 1.00 41.10 C ATOM 1136 O ILE A 576 9.774 15.144 10.577 1.00 25.11 O ATOM 1137 CB ILE A 576 12.074 13.024 10.825 1.00 12.54 C ATOM 1138 CG1 ILE A 576 12.448 11.557 10.493 1.00 11.01 C ATOM 1139 CG2 ILE A 576 13.139 13.649 11.725 1.00 64.02 C ATOM 1140 CD1 ILE A 576 12.523 10.620 11.670 1.00 1.52 C ATOM 0 H ILE A 576 9.600 12.576 9.791 1.00 50.04 H new ATOM 0 HA ILE A 576 10.761 12.694 12.495 1.00 72.55 H new ATOM 0 HB ILE A 576 12.031 13.582 9.889 1.00 12.54 H new ATOM 0 HG12 ILE A 576 11.716 11.166 9.787 1.00 11.01 H new ATOM 0 HG13 ILE A 576 13.413 11.553 9.987 1.00 11.01 H new ATOM 0 HG21 ILE A 576 14.113 13.576 11.241 1.00 64.02 H new ATOM 0 HG22 ILE A 576 12.898 14.698 11.899 1.00 64.02 H new ATOM 0 HG23 ILE A 576 13.167 13.120 12.678 1.00 64.02 H new ATOM 0 HD11 ILE A 576 12.792 9.622 11.324 1.00 1.52 H new ATOM 0 HD12 ILE A 576 13.278 10.976 12.371 1.00 1.52 H new ATOM 0 HD13 ILE A 576 11.554 10.583 12.168 1.00 1.52 H new ATOM 1152 N ASP A 577 10.309 15.118 12.764 1.00 43.00 N ATOM 1153 CA ASP A 577 9.963 16.521 13.033 1.00 73.03 C ATOM 1154 C ASP A 577 10.857 17.425 12.177 1.00 43.30 C ATOM 1155 O ASP A 577 12.067 17.166 12.070 1.00 40.52 O ATOM 1156 CB ASP A 577 10.173 16.812 14.527 1.00 23.30 C ATOM 1157 CG ASP A 577 9.664 18.166 14.976 1.00 24.22 C ATOM 1158 OD1 ASP A 577 8.490 18.261 15.392 1.00 32.33 O ATOM 1159 OD2 ASP A 577 10.441 19.152 14.986 1.00 20.43 O ATOM 0 H ASP A 577 10.622 14.609 13.591 1.00 43.00 H new ATOM 0 HA ASP A 577 8.920 16.712 12.781 1.00 73.03 H new ATOM 0 HB2 ASP A 577 9.674 16.038 15.110 1.00 23.30 H new ATOM 0 HB3 ASP A 577 11.237 16.744 14.752 1.00 23.30 H new ATOM 1164 N ASP A 578 10.282 18.477 11.578 1.00 24.11 N ATOM 1165 CA ASP A 578 11.018 19.294 10.603 1.00 43.04 C ATOM 1166 C ASP A 578 12.267 19.957 11.076 1.00 61.31 C ATOM 1167 O ASP A 578 12.287 20.815 11.965 1.00 70.23 O ATOM 1168 CB ASP A 578 10.195 20.186 9.696 1.00 31.40 C ATOM 1169 CG ASP A 578 9.571 19.425 8.548 1.00 12.44 C ATOM 1170 OD1 ASP A 578 10.329 18.868 7.690 1.00 54.32 O ATOM 1171 OD2 ASP A 578 8.285 19.385 8.449 1.00 2.42 O ATOM 0 H ASP A 578 9.323 18.780 11.748 1.00 24.11 H new ATOM 0 HA ASP A 578 11.367 18.488 9.958 1.00 43.04 H new ATOM 0 HB2 ASP A 578 9.409 20.666 10.279 1.00 31.40 H new ATOM 0 HB3 ASP A 578 10.828 20.980 9.300 1.00 31.40 H new ATOM 1176 N GLU A 579 13.270 19.556 10.397 1.00 60.31 N ATOM 1177 CA GLU A 579 14.634 19.807 10.597 1.00 44.45 C ATOM 1178 C GLU A 579 15.167 20.968 9.727 1.00 62.43 C ATOM 1179 O GLU A 579 16.263 21.478 9.973 1.00 60.13 O ATOM 1180 CB GLU A 579 15.356 18.482 10.225 1.00 32.55 C ATOM 1181 CG GLU A 579 15.366 18.052 8.697 1.00 53.33 C ATOM 1182 CD GLU A 579 14.006 17.883 7.941 1.00 53.21 C ATOM 1183 OE1 GLU A 579 12.907 17.920 8.486 1.00 43.13 O ATOM 1184 OE2 GLU A 579 13.983 17.820 6.743 1.00 12.41 O ATOM 0 H GLU A 579 13.128 18.964 9.578 1.00 60.31 H new ATOM 0 HA GLU A 579 14.813 20.113 11.628 1.00 44.45 H new ATOM 0 HB2 GLU A 579 16.391 18.559 10.559 1.00 32.55 H new ATOM 0 HB3 GLU A 579 14.895 17.677 10.797 1.00 32.55 H new ATOM 0 HG2 GLU A 579 15.954 18.791 8.152 1.00 53.33 H new ATOM 0 HG3 GLU A 579 15.900 17.104 8.627 1.00 53.33 H new ATOM 1191 N GLU A 580 14.406 21.373 8.739 1.00 61.42 N ATOM 1192 CA GLU A 580 14.835 22.364 7.768 1.00 3.34 C ATOM 1193 C GLU A 580 13.781 23.481 7.654 1.00 3.03 C ATOM 1194 O GLU A 580 12.914 23.601 8.526 1.00 54.35 O ATOM 1195 CB GLU A 580 15.031 21.674 6.376 1.00 2.15 C ATOM 1196 CG GLU A 580 13.740 21.356 5.552 1.00 32.41 C ATOM 1197 CD GLU A 580 12.748 20.372 6.166 1.00 12.25 C ATOM 1198 OE1 GLU A 580 12.504 20.334 7.335 1.00 71.33 O ATOM 1199 OE2 GLU A 580 12.183 19.547 5.487 1.00 24.33 O ATOM 0 H GLU A 580 13.461 21.023 8.580 1.00 61.42 H new ATOM 0 HA GLU A 580 15.778 22.803 8.093 1.00 3.34 H new ATOM 0 HB2 GLU A 580 15.672 22.313 5.768 1.00 2.15 H new ATOM 0 HB3 GLU A 580 15.570 20.740 6.534 1.00 2.15 H new ATOM 0 HG2 GLU A 580 13.216 22.294 5.368 1.00 32.41 H new ATOM 0 HG3 GLU A 580 14.046 20.966 4.581 1.00 32.41 H new ATOM 1206 N TYR A 581 13.905 24.322 6.618 1.00 31.22 N ATOM 1207 CA TYR A 581 12.880 25.309 6.239 1.00 12.23 C ATOM 1208 C TYR A 581 11.580 24.546 5.955 1.00 33.25 C ATOM 1209 O TYR A 581 11.617 23.380 5.563 1.00 4.13 O ATOM 1210 CB TYR A 581 13.306 26.065 4.955 1.00 61.03 C ATOM 1211 CG TYR A 581 13.375 25.181 3.722 1.00 71.44 C ATOM 1212 CD1 TYR A 581 14.528 24.485 3.399 1.00 54.14 C ATOM 1213 CD2 TYR A 581 12.262 25.014 2.907 1.00 71.24 C ATOM 1214 CE1 TYR A 581 14.569 23.657 2.302 1.00 41.54 C ATOM 1215 CE2 TYR A 581 12.294 24.190 1.824 1.00 44.44 C ATOM 1216 CZ TYR A 581 13.451 23.511 1.518 1.00 41.24 C ATOM 1217 OH TYR A 581 13.490 22.677 0.424 1.00 13.11 O ATOM 0 H TYR A 581 14.726 24.338 6.013 1.00 31.22 H new ATOM 0 HA TYR A 581 12.749 26.032 7.044 1.00 12.23 H new ATOM 0 HB2 TYR A 581 12.602 26.876 4.771 1.00 61.03 H new ATOM 0 HB3 TYR A 581 14.282 26.521 5.119 1.00 61.03 H new ATOM 0 HD1 TYR A 581 15.407 24.594 4.017 1.00 54.14 H new ATOM 0 HD2 TYR A 581 11.353 25.549 3.138 1.00 71.24 H new ATOM 0 HE1 TYR A 581 15.476 23.124 2.058 1.00 41.54 H new ATOM 0 HE2 TYR A 581 11.415 24.070 1.208 1.00 44.44 H new ATOM 0 HH TYR A 581 12.618 22.684 -0.024 1.00 13.11 H new ATOM 1227 N GLU A 582 10.462 25.139 6.107 1.00 62.53 N ATOM 1228 CA GLU A 582 9.290 24.353 5.912 1.00 31.43 C ATOM 1229 C GLU A 582 8.747 24.425 4.501 1.00 21.12 C ATOM 1230 O GLU A 582 8.655 25.494 3.896 1.00 14.42 O ATOM 1231 CB GLU A 582 8.208 24.651 6.930 1.00 50.40 C ATOM 1232 CG GLU A 582 7.092 23.632 6.906 1.00 21.31 C ATOM 1233 CD GLU A 582 7.606 22.261 7.247 1.00 60.30 C ATOM 1234 OE1 GLU A 582 7.800 21.983 8.441 1.00 65.13 O ATOM 1235 OE2 GLU A 582 7.816 21.419 6.360 1.00 24.10 O ATOM 0 H GLU A 582 10.323 26.119 6.354 1.00 62.53 H new ATOM 0 HA GLU A 582 9.613 23.324 6.072 1.00 31.43 H new ATOM 0 HB2 GLU A 582 8.649 24.678 7.926 1.00 50.40 H new ATOM 0 HB3 GLU A 582 7.795 25.641 6.737 1.00 50.40 H new ATOM 0 HG2 GLU A 582 6.316 23.920 7.616 1.00 21.31 H new ATOM 0 HG3 GLU A 582 6.631 23.616 5.919 1.00 21.31 H new ATOM 1242 N LYS A 583 8.420 23.259 3.998 1.00 22.13 N ATOM 1243 CA LYS A 583 7.732 23.084 2.777 1.00 70.14 C ATOM 1244 C LYS A 583 6.866 21.861 2.999 1.00 32.04 C ATOM 1245 O LYS A 583 7.355 20.855 3.549 1.00 43.22 O ATOM 1246 CB LYS A 583 8.676 22.899 1.542 1.00 70.33 C ATOM 1247 CG LYS A 583 9.283 21.505 1.336 1.00 11.32 C ATOM 1248 CD LYS A 583 10.341 21.113 2.356 1.00 14.22 C ATOM 1249 CE LYS A 583 10.687 19.640 2.167 1.00 3.12 C ATOM 1250 NZ LYS A 583 11.870 19.171 2.940 1.00 54.03 N ATOM 0 H LYS A 583 8.644 22.379 4.462 1.00 22.13 H new ATOM 0 HA LYS A 583 7.155 23.975 2.530 1.00 70.14 H new ATOM 0 HB2 LYS A 583 8.116 23.161 0.644 1.00 70.33 H new ATOM 0 HB3 LYS A 583 9.493 23.615 1.629 1.00 70.33 H new ATOM 0 HG2 LYS A 583 8.481 20.767 1.363 1.00 11.32 H new ATOM 0 HG3 LYS A 583 9.724 21.460 0.340 1.00 11.32 H new ATOM 0 HD2 LYS A 583 11.232 21.729 2.231 1.00 14.22 H new ATOM 0 HD3 LYS A 583 9.973 21.287 3.367 1.00 14.22 H new ATOM 0 HE2 LYS A 583 9.823 19.039 2.452 1.00 3.12 H new ATOM 0 HE3 LYS A 583 10.867 19.457 1.108 1.00 3.12 H new ATOM 0 HZ1 LYS A 583 11.794 18.147 3.103 1.00 54.03 H new ATOM 0 HZ2 LYS A 583 12.738 19.373 2.403 1.00 54.03 H new ATOM 0 HZ3 LYS A 583 11.905 19.665 3.854 1.00 54.03 H new ATOM 1264 N ASN A 584 5.602 21.944 2.676 1.00 21.32 N ATOM 1265 CA ASN A 584 4.721 20.804 2.854 1.00 72.13 C ATOM 1266 C ASN A 584 5.169 19.745 1.910 1.00 50.54 C ATOM 1267 O ASN A 584 5.288 19.975 0.701 1.00 0.31 O ATOM 1268 CB ASN A 584 3.210 21.124 2.689 1.00 71.13 C ATOM 1269 CG ASN A 584 2.676 22.117 3.727 1.00 1.11 C ATOM 1270 OD1 ASN A 584 3.374 23.042 4.144 1.00 13.23 O ATOM 1271 ND2 ASN A 584 1.468 21.899 4.215 1.00 44.42 N ATOM 0 H ASN A 584 5.156 22.777 2.292 1.00 21.32 H new ATOM 0 HA ASN A 584 4.799 20.469 3.888 1.00 72.13 H new ATOM 0 HB2 ASN A 584 3.040 21.528 1.691 1.00 71.13 H new ATOM 0 HB3 ASN A 584 2.641 20.197 2.759 1.00 71.13 H new ATOM 0 HD21 ASN A 584 1.098 22.502 4.950 1.00 44.42 H new ATOM 0 HD22 ASN A 584 0.905 21.128 3.857 1.00 44.42 H new ATOM 1278 N LYS A 585 5.458 18.612 2.443 1.00 34.30 N ATOM 1279 CA LYS A 585 6.122 17.609 1.688 1.00 44.54 C ATOM 1280 C LYS A 585 5.375 16.307 1.797 1.00 71.14 C ATOM 1281 O LYS A 585 4.493 16.169 2.654 1.00 31.33 O ATOM 1282 CB LYS A 585 7.627 17.529 2.120 1.00 60.12 C ATOM 1283 CG LYS A 585 8.024 16.681 3.360 1.00 3.43 C ATOM 1284 CD LYS A 585 7.160 16.860 4.607 1.00 33.44 C ATOM 1285 CE LYS A 585 7.103 18.299 5.175 1.00 0.12 C ATOM 1286 NZ LYS A 585 8.410 18.841 5.633 1.00 71.03 N ATOM 0 H LYS A 585 5.244 18.354 3.406 1.00 34.30 H new ATOM 0 HA LYS A 585 6.127 17.862 0.628 1.00 44.54 H new ATOM 0 HB2 LYS A 585 8.191 17.147 1.269 1.00 60.12 H new ATOM 0 HB3 LYS A 585 7.970 18.548 2.298 1.00 60.12 H new ATOM 0 HG2 LYS A 585 8.002 15.629 3.076 1.00 3.43 H new ATOM 0 HG3 LYS A 585 9.055 16.919 3.621 1.00 3.43 H new ATOM 0 HD2 LYS A 585 6.145 16.539 4.374 1.00 33.44 H new ATOM 0 HD3 LYS A 585 7.534 16.195 5.386 1.00 33.44 H new ATOM 0 HE2 LYS A 585 6.699 18.961 4.409 1.00 0.12 H new ATOM 0 HE3 LYS A 585 6.405 18.317 6.012 1.00 0.12 H new ATOM 0 HZ1 LYS A 585 8.269 19.786 6.043 1.00 71.03 H new ATOM 0 HZ2 LYS A 585 8.815 18.208 6.352 1.00 71.03 H new ATOM 0 HZ3 LYS A 585 9.061 18.908 4.824 1.00 71.03 H new ATOM 1300 N THR A 586 5.701 15.373 0.961 1.00 24.35 N ATOM 1301 CA THR A 586 4.968 14.160 0.885 1.00 25.54 C ATOM 1302 C THR A 586 5.815 13.058 0.317 1.00 60.33 C ATOM 1303 O THR A 586 6.711 13.305 -0.509 1.00 22.32 O ATOM 1304 CB THR A 586 3.655 14.381 0.051 1.00 12.22 C ATOM 1305 OG1 THR A 586 2.906 13.179 -0.095 1.00 61.52 O ATOM 1306 CG2 THR A 586 3.934 14.956 -1.323 1.00 45.42 C ATOM 0 H THR A 586 6.486 15.435 0.312 1.00 24.35 H new ATOM 0 HA THR A 586 4.680 13.853 1.890 1.00 25.54 H new ATOM 0 HB THR A 586 3.068 15.101 0.620 1.00 12.22 H new ATOM 0 HG1 THR A 586 3.142 12.557 0.625 1.00 61.52 H new ATOM 0 HG21 THR A 586 2.994 15.090 -1.859 1.00 45.42 H new ATOM 0 HG22 THR A 586 4.433 15.919 -1.220 1.00 45.42 H new ATOM 0 HG23 THR A 586 4.575 14.273 -1.880 1.00 45.42 H new ATOM 1314 N PHE A 587 5.566 11.877 0.827 1.00 13.34 N ATOM 1315 CA PHE A 587 6.191 10.677 0.397 1.00 64.32 C ATOM 1316 C PHE A 587 5.142 9.668 0.019 1.00 41.04 C ATOM 1317 O PHE A 587 4.037 9.656 0.585 1.00 13.14 O ATOM 1318 CB PHE A 587 7.190 10.115 1.433 1.00 24.22 C ATOM 1319 CG PHE A 587 6.811 10.223 2.903 1.00 41.21 C ATOM 1320 CD1 PHE A 587 5.863 9.402 3.503 1.00 60.12 C ATOM 1321 CD2 PHE A 587 7.471 11.128 3.691 1.00 44.21 C ATOM 1322 CE1 PHE A 587 5.610 9.510 4.867 1.00 64.24 C ATOM 1323 CE2 PHE A 587 7.211 11.236 5.036 1.00 51.30 C ATOM 1324 CZ PHE A 587 6.284 10.423 5.624 1.00 4.50 C ATOM 0 H PHE A 587 4.895 11.733 1.581 1.00 13.34 H new ATOM 0 HA PHE A 587 6.790 10.908 -0.484 1.00 64.32 H new ATOM 0 HB2 PHE A 587 7.355 9.062 1.204 1.00 24.22 H new ATOM 0 HB3 PHE A 587 8.143 10.625 1.293 1.00 24.22 H new ATOM 0 HD1 PHE A 587 5.322 8.680 2.910 1.00 60.12 H new ATOM 0 HD2 PHE A 587 8.214 11.772 3.245 1.00 44.21 H new ATOM 0 HE1 PHE A 587 4.876 8.867 5.329 1.00 64.24 H new ATOM 0 HE2 PHE A 587 7.741 11.966 5.630 1.00 51.30 H new ATOM 0 HZ PHE A 587 6.086 10.503 6.683 1.00 4.50 H new ATOM 1334 N PHE A 588 5.457 8.853 -0.934 1.00 21.02 N ATOM 1335 CA PHE A 588 4.525 7.891 -1.439 1.00 13.01 C ATOM 1336 C PHE A 588 4.852 6.552 -0.837 1.00 5.01 C ATOM 1337 O PHE A 588 5.997 6.128 -0.852 1.00 63.45 O ATOM 1338 CB PHE A 588 4.628 7.813 -2.971 1.00 63.45 C ATOM 1339 CG PHE A 588 4.696 9.165 -3.639 1.00 21.55 C ATOM 1340 CD1 PHE A 588 3.649 10.059 -3.539 1.00 34.10 C ATOM 1341 CD2 PHE A 588 5.828 9.546 -4.333 1.00 14.00 C ATOM 1342 CE1 PHE A 588 3.727 11.304 -4.127 1.00 54.25 C ATOM 1343 CE2 PHE A 588 5.914 10.791 -4.920 1.00 3.11 C ATOM 1344 CZ PHE A 588 4.861 11.672 -4.817 1.00 0.05 C ATOM 0 H PHE A 588 6.370 8.833 -1.388 1.00 21.02 H new ATOM 0 HA PHE A 588 3.509 8.183 -1.175 1.00 13.01 H new ATOM 0 HB2 PHE A 588 5.515 7.239 -3.239 1.00 63.45 H new ATOM 0 HB3 PHE A 588 3.767 7.268 -3.358 1.00 63.45 H new ATOM 0 HD1 PHE A 588 2.759 9.780 -2.994 1.00 34.10 H new ATOM 0 HD2 PHE A 588 6.657 8.859 -4.417 1.00 14.00 H new ATOM 0 HE1 PHE A 588 2.898 11.991 -4.046 1.00 54.25 H new ATOM 0 HE2 PHE A 588 6.806 11.074 -5.459 1.00 3.11 H new ATOM 0 HZ PHE A 588 4.924 12.648 -5.275 1.00 0.05 H new ATOM 1354 N LEU A 589 3.889 5.926 -0.260 1.00 11.31 N ATOM 1355 CA LEU A 589 4.074 4.610 0.262 1.00 2.32 C ATOM 1356 C LEU A 589 3.467 3.695 -0.770 1.00 31.21 C ATOM 1357 O LEU A 589 2.277 3.800 -1.083 1.00 43.33 O ATOM 1358 CB LEU A 589 3.360 4.452 1.622 1.00 34.34 C ATOM 1359 CG LEU A 589 3.881 3.365 2.595 1.00 3.22 C ATOM 1360 CD1 LEU A 589 3.851 1.970 2.004 1.00 62.12 C ATOM 1361 CD2 LEU A 589 5.261 3.715 3.082 1.00 43.52 C ATOM 0 H LEU A 589 2.951 6.306 -0.134 1.00 11.31 H new ATOM 0 HA LEU A 589 5.125 4.386 0.441 1.00 2.32 H new ATOM 0 HB2 LEU A 589 3.407 5.411 2.137 1.00 34.34 H new ATOM 0 HB3 LEU A 589 2.308 4.247 1.425 1.00 34.34 H new ATOM 0 HG LEU A 589 3.196 3.348 3.443 1.00 3.22 H new ATOM 0 HD11 LEU A 589 4.229 1.256 2.736 1.00 62.12 H new ATOM 0 HD12 LEU A 589 2.827 1.709 1.738 1.00 62.12 H new ATOM 0 HD13 LEU A 589 4.476 1.939 1.112 1.00 62.12 H new ATOM 0 HD21 LEU A 589 5.613 2.942 3.765 1.00 43.52 H new ATOM 0 HD22 LEU A 589 5.940 3.785 2.232 1.00 43.52 H new ATOM 0 HD23 LEU A 589 5.231 4.672 3.603 1.00 43.52 H new ATOM 1373 N GLU A 590 4.262 2.870 -1.344 1.00 64.21 N ATOM 1374 CA GLU A 590 3.781 2.005 -2.367 1.00 4.42 C ATOM 1375 C GLU A 590 4.122 0.577 -2.027 1.00 32.23 C ATOM 1376 O GLU A 590 5.277 0.264 -1.708 1.00 32.03 O ATOM 1377 CB GLU A 590 4.383 2.420 -3.717 1.00 10.20 C ATOM 1378 CG GLU A 590 3.852 1.667 -4.924 1.00 72.43 C ATOM 1379 CD GLU A 590 4.477 2.147 -6.214 1.00 32.15 C ATOM 1380 OE1 GLU A 590 3.993 3.132 -6.796 1.00 70.31 O ATOM 1381 OE2 GLU A 590 5.464 1.535 -6.685 1.00 31.10 O ATOM 0 H GLU A 590 5.253 2.772 -1.125 1.00 64.21 H new ATOM 0 HA GLU A 590 2.696 2.084 -2.441 1.00 4.42 H new ATOM 0 HB2 GLU A 590 4.202 3.485 -3.865 1.00 10.20 H new ATOM 0 HB3 GLU A 590 5.464 2.284 -3.671 1.00 10.20 H new ATOM 0 HG2 GLU A 590 4.048 0.602 -4.801 1.00 72.43 H new ATOM 0 HG3 GLU A 590 2.770 1.788 -4.979 1.00 72.43 H new ATOM 1388 N ILE A 591 3.112 -0.255 -2.020 1.00 52.22 N ATOM 1389 CA ILE A 591 3.286 -1.673 -1.843 1.00 1.42 C ATOM 1390 C ILE A 591 3.530 -2.284 -3.207 1.00 21.34 C ATOM 1391 O ILE A 591 2.899 -1.878 -4.202 1.00 1.23 O ATOM 1392 CB ILE A 591 2.071 -2.350 -1.133 1.00 5.45 C ATOM 1393 CG1 ILE A 591 0.745 -1.958 -1.792 1.00 15.10 C ATOM 1394 CG2 ILE A 591 2.060 -2.037 0.358 1.00 2.11 C ATOM 1395 CD1 ILE A 591 -0.480 -2.591 -1.161 1.00 0.51 C ATOM 0 H ILE A 591 2.141 0.034 -2.138 1.00 52.22 H new ATOM 0 HA ILE A 591 4.138 -1.844 -1.186 1.00 1.42 H new ATOM 0 HB ILE A 591 2.185 -3.428 -1.246 1.00 5.45 H new ATOM 0 HG12 ILE A 591 0.640 -0.874 -1.752 1.00 15.10 H new ATOM 0 HG13 ILE A 591 0.781 -2.236 -2.845 1.00 15.10 H new ATOM 0 HG21 ILE A 591 1.203 -2.522 0.825 1.00 2.11 H new ATOM 0 HG22 ILE A 591 2.979 -2.406 0.814 1.00 2.11 H new ATOM 0 HG23 ILE A 591 1.991 -0.959 0.503 1.00 2.11 H new ATOM 0 HD11 ILE A 591 -1.374 -2.259 -1.689 1.00 0.51 H new ATOM 0 HD12 ILE A 591 -0.402 -3.676 -1.225 1.00 0.51 H new ATOM 0 HD13 ILE A 591 -0.545 -2.293 -0.115 1.00 0.51 H new ATOM 1407 N GLY A 592 4.442 -3.201 -3.272 1.00 51.02 N ATOM 1408 CA GLY A 592 4.835 -3.741 -4.535 1.00 64.24 C ATOM 1409 C GLY A 592 4.188 -5.056 -4.866 1.00 62.13 C ATOM 1410 O GLY A 592 2.994 -5.263 -4.642 1.00 31.12 O ATOM 0 H GLY A 592 4.929 -3.592 -2.465 1.00 51.02 H new ATOM 0 HA2 GLY A 592 4.593 -3.022 -5.317 1.00 64.24 H new ATOM 0 HA3 GLY A 592 5.918 -3.868 -4.543 1.00 64.24 H new ATOM 1414 N GLU A 593 4.995 -5.929 -5.376 1.00 14.14 N ATOM 1415 CA GLU A 593 4.600 -7.227 -5.844 1.00 13.13 C ATOM 1416 C GLU A 593 4.565 -8.218 -4.680 1.00 10.33 C ATOM 1417 O GLU A 593 5.604 -8.482 -4.053 1.00 61.14 O ATOM 1418 CB GLU A 593 5.635 -7.662 -6.850 1.00 23.24 C ATOM 1419 CG GLU A 593 5.452 -9.022 -7.447 1.00 24.13 C ATOM 1420 CD GLU A 593 6.742 -9.472 -8.055 1.00 44.43 C ATOM 1421 OE1 GLU A 593 7.237 -8.808 -8.990 1.00 33.02 O ATOM 1422 OE2 GLU A 593 7.353 -10.434 -7.516 1.00 55.22 O ATOM 0 H GLU A 593 5.994 -5.753 -5.485 1.00 14.14 H new ATOM 0 HA GLU A 593 3.605 -7.193 -6.289 1.00 13.13 H new ATOM 0 HB2 GLU A 593 5.652 -6.933 -7.660 1.00 23.24 H new ATOM 0 HB3 GLU A 593 6.613 -7.628 -6.370 1.00 23.24 H new ATOM 0 HG2 GLU A 593 5.132 -9.728 -6.681 1.00 24.13 H new ATOM 0 HG3 GLU A 593 4.669 -8.997 -8.205 1.00 24.13 H new ATOM 1429 N PRO A 594 3.399 -8.788 -4.382 1.00 41.14 N ATOM 1430 CA PRO A 594 3.253 -9.738 -3.288 1.00 44.14 C ATOM 1431 C PRO A 594 3.968 -11.058 -3.592 1.00 44.05 C ATOM 1432 O PRO A 594 4.100 -11.461 -4.745 1.00 20.45 O ATOM 1433 CB PRO A 594 1.744 -9.949 -3.187 1.00 72.30 C ATOM 1434 CG PRO A 594 1.224 -9.640 -4.542 1.00 55.22 C ATOM 1435 CD PRO A 594 2.132 -8.579 -5.111 1.00 54.02 C ATOM 0 HA PRO A 594 3.695 -9.373 -2.361 1.00 44.14 H new ATOM 0 HB2 PRO A 594 1.507 -10.972 -2.897 1.00 72.30 H new ATOM 0 HB3 PRO A 594 1.303 -9.294 -2.436 1.00 72.30 H new ATOM 0 HG2 PRO A 594 1.224 -10.530 -5.171 1.00 55.22 H new ATOM 0 HG3 PRO A 594 0.195 -9.285 -4.492 1.00 55.22 H new ATOM 0 HD2 PRO A 594 2.263 -8.697 -6.187 1.00 54.02 H new ATOM 0 HD3 PRO A 594 1.734 -7.578 -4.946 1.00 54.02 H new ATOM 1443 N ARG A 595 4.415 -11.722 -2.573 1.00 42.03 N ATOM 1444 CA ARG A 595 5.155 -12.941 -2.737 1.00 72.40 C ATOM 1445 C ARG A 595 4.603 -13.996 -1.799 1.00 53.12 C ATOM 1446 O ARG A 595 4.339 -13.723 -0.627 1.00 72.34 O ATOM 1447 CB ARG A 595 6.664 -12.679 -2.518 1.00 24.01 C ATOM 1448 CG ARG A 595 7.012 -12.128 -1.144 1.00 43.42 C ATOM 1449 CD ARG A 595 8.436 -11.590 -1.068 1.00 34.51 C ATOM 1450 NE ARG A 595 9.463 -12.600 -1.352 1.00 72.12 N ATOM 1451 CZ ARG A 595 10.754 -12.482 -0.995 1.00 13.32 C ATOM 1452 NH1 ARG A 595 11.150 -11.473 -0.221 1.00 43.14 N ATOM 1453 NH2 ARG A 595 11.639 -13.393 -1.373 1.00 40.11 N ATOM 0 H ARG A 595 4.279 -11.438 -1.603 1.00 42.03 H new ATOM 0 HA ARG A 595 5.044 -13.316 -3.754 1.00 72.40 H new ATOM 0 HB2 ARG A 595 7.208 -13.611 -2.671 1.00 24.01 H new ATOM 0 HB3 ARG A 595 7.013 -11.978 -3.276 1.00 24.01 H new ATOM 0 HG2 ARG A 595 6.313 -11.331 -0.889 1.00 43.42 H new ATOM 0 HG3 ARG A 595 6.885 -12.914 -0.399 1.00 43.42 H new ATOM 0 HD2 ARG A 595 8.543 -10.767 -1.775 1.00 34.51 H new ATOM 0 HD3 ARG A 595 8.608 -11.180 -0.073 1.00 34.51 H new ATOM 0 HE ARG A 595 9.180 -13.443 -1.851 1.00 72.12 H new ATOM 0 HH11 ARG A 595 10.472 -10.784 0.105 1.00 43.14 H new ATOM 0 HH12 ARG A 595 12.131 -11.390 0.046 1.00 43.14 H new ATOM 0 HH21 ARG A 595 11.342 -14.189 -1.938 1.00 40.11 H new ATOM 0 HH22 ARG A 595 12.617 -13.298 -1.099 1.00 40.11 H new ATOM 1467 N LEU A 596 4.365 -15.167 -2.321 1.00 54.31 N ATOM 1468 CA LEU A 596 3.811 -16.243 -1.536 1.00 42.03 C ATOM 1469 C LEU A 596 4.953 -16.857 -0.738 1.00 54.42 C ATOM 1470 O LEU A 596 6.048 -17.054 -1.277 1.00 54.24 O ATOM 1471 CB LEU A 596 3.205 -17.312 -2.469 1.00 55.32 C ATOM 1472 CG LEU A 596 1.850 -17.950 -2.060 1.00 51.30 C ATOM 1473 CD1 LEU A 596 1.777 -18.306 -0.587 1.00 74.43 C ATOM 1474 CD2 LEU A 596 0.690 -17.074 -2.468 1.00 1.03 C ATOM 0 H LEU A 596 4.547 -15.405 -3.296 1.00 54.31 H new ATOM 0 HA LEU A 596 3.027 -15.873 -0.875 1.00 42.03 H new ATOM 0 HB2 LEU A 596 3.079 -16.863 -3.454 1.00 55.32 H new ATOM 0 HB3 LEU A 596 3.934 -18.115 -2.575 1.00 55.32 H new ATOM 0 HG LEU A 596 1.780 -18.892 -2.604 1.00 51.30 H new ATOM 0 HD11 LEU A 596 0.805 -18.747 -0.367 1.00 74.43 H new ATOM 0 HD12 LEU A 596 2.563 -19.021 -0.346 1.00 74.43 H new ATOM 0 HD13 LEU A 596 1.910 -17.405 0.012 1.00 74.43 H new ATOM 0 HD21 LEU A 596 -0.246 -17.546 -2.169 1.00 1.03 H new ATOM 0 HD22 LEU A 596 0.778 -16.103 -1.981 1.00 1.03 H new ATOM 0 HD23 LEU A 596 0.699 -16.939 -3.550 1.00 1.03 H new ATOM 1486 N VAL A 597 4.736 -17.105 0.523 1.00 22.41 N ATOM 1487 CA VAL A 597 5.770 -17.731 1.339 1.00 13.55 C ATOM 1488 C VAL A 597 5.739 -19.223 1.116 1.00 65.53 C ATOM 1489 O VAL A 597 6.757 -19.861 0.837 1.00 43.24 O ATOM 1490 CB VAL A 597 5.567 -17.447 2.843 1.00 33.13 C ATOM 1491 CG1 VAL A 597 6.662 -18.092 3.681 1.00 24.03 C ATOM 1492 CG2 VAL A 597 5.521 -15.967 3.094 1.00 0.54 C ATOM 0 H VAL A 597 3.868 -16.891 1.015 1.00 22.41 H new ATOM 0 HA VAL A 597 6.731 -17.312 1.041 1.00 13.55 H new ATOM 0 HB VAL A 597 4.615 -17.886 3.141 1.00 33.13 H new ATOM 0 HG11 VAL A 597 6.490 -17.873 4.735 1.00 24.03 H new ATOM 0 HG12 VAL A 597 6.650 -19.171 3.528 1.00 24.03 H new ATOM 0 HG13 VAL A 597 7.632 -17.694 3.381 1.00 24.03 H new ATOM 0 HG21 VAL A 597 5.377 -15.783 4.159 1.00 0.54 H new ATOM 0 HG22 VAL A 597 6.458 -15.514 2.770 1.00 0.54 H new ATOM 0 HG23 VAL A 597 4.694 -15.529 2.535 1.00 0.54 H new ATOM 1502 N GLU A 598 4.563 -19.758 1.208 1.00 33.32 N ATOM 1503 CA GLU A 598 4.337 -21.164 1.074 1.00 60.23 C ATOM 1504 C GLU A 598 4.091 -21.479 -0.387 1.00 54.01 C ATOM 1505 O GLU A 598 2.995 -21.246 -0.910 1.00 3.43 O ATOM 1506 CB GLU A 598 3.126 -21.532 1.895 1.00 33.11 C ATOM 1507 CG GLU A 598 3.194 -21.003 3.316 1.00 42.40 C ATOM 1508 CD GLU A 598 1.898 -21.147 4.028 1.00 22.32 C ATOM 1509 OE1 GLU A 598 0.946 -20.423 3.687 1.00 52.34 O ATOM 1510 OE2 GLU A 598 1.797 -21.971 4.931 1.00 40.24 O ATOM 0 H GLU A 598 3.715 -19.219 1.382 1.00 33.32 H new ATOM 0 HA GLU A 598 5.200 -21.732 1.423 1.00 60.23 H new ATOM 0 HB2 GLU A 598 2.232 -21.141 1.410 1.00 33.11 H new ATOM 0 HB3 GLU A 598 3.027 -22.617 1.921 1.00 33.11 H new ATOM 0 HG2 GLU A 598 3.970 -21.537 3.865 1.00 42.40 H new ATOM 0 HG3 GLU A 598 3.482 -19.952 3.298 1.00 42.40 H new ATOM 1517 N MET A 599 5.100 -21.954 -1.050 1.00 70.20 N ATOM 1518 CA MET A 599 5.005 -22.243 -2.461 1.00 63.43 C ATOM 1519 C MET A 599 4.342 -23.595 -2.667 1.00 51.45 C ATOM 1520 O MET A 599 5.001 -24.627 -2.695 1.00 23.25 O ATOM 1521 CB MET A 599 6.393 -22.204 -3.124 1.00 10.45 C ATOM 1522 CG MET A 599 6.441 -22.425 -4.652 1.00 1.44 C ATOM 1523 SD MET A 599 5.698 -21.084 -5.648 1.00 63.12 S ATOM 1524 CE MET A 599 3.938 -21.466 -5.602 1.00 20.33 C ATOM 0 H MET A 599 6.011 -22.154 -0.638 1.00 70.20 H new ATOM 0 HA MET A 599 4.392 -21.477 -2.935 1.00 63.43 H new ATOM 0 HB2 MET A 599 6.847 -21.237 -2.906 1.00 10.45 H new ATOM 0 HB3 MET A 599 7.017 -22.963 -2.651 1.00 10.45 H new ATOM 0 HG2 MET A 599 7.481 -22.548 -4.954 1.00 1.44 H new ATOM 0 HG3 MET A 599 5.928 -23.358 -4.886 1.00 1.44 H new ATOM 0 HE1 MET A 599 3.521 -21.382 -6.606 1.00 20.33 H new ATOM 0 HE2 MET A 599 3.796 -22.482 -5.234 1.00 20.33 H new ATOM 0 HE3 MET A 599 3.431 -20.765 -4.939 1.00 20.33 H new ATOM 1534 N SER A 600 3.042 -23.594 -2.703 1.00 74.53 N ATOM 1535 CA SER A 600 2.280 -24.790 -2.921 1.00 4.41 C ATOM 1536 C SER A 600 1.086 -24.458 -3.804 1.00 51.12 C ATOM 1537 O SER A 600 0.685 -23.292 -3.886 1.00 1.42 O ATOM 1538 CB SER A 600 1.829 -25.376 -1.575 1.00 75.42 C ATOM 1539 OG SER A 600 2.952 -25.608 -0.728 1.00 61.02 O ATOM 0 H SER A 600 2.475 -22.755 -2.581 1.00 74.53 H new ATOM 0 HA SER A 600 2.892 -25.540 -3.422 1.00 4.41 H new ATOM 0 HB2 SER A 600 1.135 -24.691 -1.088 1.00 75.42 H new ATOM 0 HB3 SER A 600 1.292 -26.310 -1.740 1.00 75.42 H new ATOM 0 HG SER A 600 2.647 -25.980 0.126 1.00 61.02 H new ATOM 1545 N GLU A 601 0.556 -25.440 -4.489 1.00 25.30 N ATOM 1546 CA GLU A 601 -0.585 -25.224 -5.345 1.00 2.41 C ATOM 1547 C GLU A 601 -1.845 -25.779 -4.694 1.00 31.12 C ATOM 1548 O GLU A 601 -1.803 -26.807 -4.000 1.00 51.13 O ATOM 1549 CB GLU A 601 -0.351 -25.839 -6.732 1.00 32.11 C ATOM 1550 CG GLU A 601 -0.058 -27.327 -6.713 1.00 34.05 C ATOM 1551 CD GLU A 601 0.266 -27.872 -8.072 1.00 70.15 C ATOM 1552 OE1 GLU A 601 1.457 -27.898 -8.448 1.00 1.44 O ATOM 1553 OE2 GLU A 601 -0.648 -28.319 -8.779 1.00 0.42 O ATOM 0 H GLU A 601 0.898 -26.401 -4.471 1.00 25.30 H new ATOM 0 HA GLU A 601 -0.721 -24.151 -5.483 1.00 2.41 H new ATOM 0 HB2 GLU A 601 -1.232 -25.662 -7.349 1.00 32.11 H new ATOM 0 HB3 GLU A 601 0.481 -25.323 -7.210 1.00 32.11 H new ATOM 0 HG2 GLU A 601 0.778 -27.520 -6.040 1.00 34.05 H new ATOM 0 HG3 GLU A 601 -0.921 -27.858 -6.310 1.00 34.05 H new ATOM 1560 N LYS A 602 -2.933 -25.085 -4.874 1.00 53.43 N ATOM 1561 CA LYS A 602 -4.210 -25.473 -4.333 1.00 43.31 C ATOM 1562 C LYS A 602 -5.249 -25.161 -5.389 1.00 65.20 C ATOM 1563 O LYS A 602 -5.253 -24.052 -5.912 1.00 52.14 O ATOM 1564 CB LYS A 602 -4.487 -24.661 -3.051 1.00 74.13 C ATOM 1565 CG LYS A 602 -5.757 -25.031 -2.296 1.00 42.53 C ATOM 1566 CD LYS A 602 -5.685 -26.432 -1.728 1.00 11.04 C ATOM 1567 CE LYS A 602 -6.943 -26.776 -0.960 1.00 43.21 C ATOM 1568 NZ LYS A 602 -6.924 -28.151 -0.424 1.00 72.41 N ATOM 0 H LYS A 602 -2.960 -24.218 -5.410 1.00 53.43 H new ATOM 0 HA LYS A 602 -4.232 -26.532 -4.077 1.00 43.31 H new ATOM 0 HB2 LYS A 602 -3.638 -24.780 -2.377 1.00 74.13 H new ATOM 0 HB3 LYS A 602 -4.538 -23.605 -3.316 1.00 74.13 H new ATOM 0 HG2 LYS A 602 -5.920 -24.319 -1.487 1.00 42.53 H new ATOM 0 HG3 LYS A 602 -6.614 -24.954 -2.966 1.00 42.53 H new ATOM 0 HD2 LYS A 602 -5.542 -27.148 -2.537 1.00 11.04 H new ATOM 0 HD3 LYS A 602 -4.820 -26.517 -1.071 1.00 11.04 H new ATOM 0 HE2 LYS A 602 -7.066 -26.071 -0.138 1.00 43.21 H new ATOM 0 HE3 LYS A 602 -7.807 -26.657 -1.614 1.00 43.21 H new ATOM 0 HZ1 LYS A 602 -7.808 -28.335 0.092 1.00 72.41 H new ATOM 0 HZ2 LYS A 602 -6.834 -28.828 -1.208 1.00 72.41 H new ATOM 0 HZ3 LYS A 602 -6.116 -28.261 0.222 1.00 72.41 H new ATOM 1582 N LYS A 603 -6.081 -26.152 -5.748 1.00 71.43 N ATOM 1583 CA LYS A 603 -7.131 -25.982 -6.793 1.00 22.44 C ATOM 1584 C LYS A 603 -6.520 -25.717 -8.158 1.00 33.41 C ATOM 1585 O LYS A 603 -7.183 -25.200 -9.053 1.00 32.05 O ATOM 1586 CB LYS A 603 -8.122 -24.845 -6.439 1.00 61.30 C ATOM 1587 CG LYS A 603 -9.153 -25.174 -5.371 1.00 2.52 C ATOM 1588 CD LYS A 603 -10.438 -25.796 -5.956 1.00 61.21 C ATOM 1589 CE LYS A 603 -10.211 -27.113 -6.690 1.00 2.14 C ATOM 1590 NZ LYS A 603 -11.455 -27.647 -7.266 1.00 55.42 N ATOM 0 H LYS A 603 -6.055 -27.084 -5.335 1.00 71.43 H new ATOM 0 HA LYS A 603 -7.683 -26.921 -6.829 1.00 22.44 H new ATOM 0 HB2 LYS A 603 -7.549 -23.979 -6.109 1.00 61.30 H new ATOM 0 HB3 LYS A 603 -8.648 -24.552 -7.347 1.00 61.30 H new ATOM 0 HG2 LYS A 603 -8.716 -25.865 -4.650 1.00 2.52 H new ATOM 0 HG3 LYS A 603 -9.409 -24.265 -4.827 1.00 2.52 H new ATOM 0 HD2 LYS A 603 -11.150 -25.961 -5.148 1.00 61.21 H new ATOM 0 HD3 LYS A 603 -10.894 -25.083 -6.643 1.00 61.21 H new ATOM 0 HE2 LYS A 603 -9.479 -26.964 -7.484 1.00 2.14 H new ATOM 0 HE3 LYS A 603 -9.788 -27.844 -6.000 1.00 2.14 H new ATOM 0 HZ1 LYS A 603 -11.255 -28.542 -7.755 1.00 55.42 H new ATOM 0 HZ2 LYS A 603 -12.145 -27.815 -6.506 1.00 55.42 H new ATOM 0 HZ3 LYS A 603 -11.846 -26.962 -7.944 1.00 55.42 H new ATOM 1604 N GLY A 604 -5.297 -26.128 -8.324 1.00 73.13 N ATOM 1605 CA GLY A 604 -4.602 -25.872 -9.536 1.00 44.20 C ATOM 1606 C GLY A 604 -4.560 -27.084 -10.410 1.00 73.45 C ATOM 1607 O GLY A 604 -5.598 -27.714 -10.675 1.00 43.40 O ATOM 0 H GLY A 604 -4.763 -26.645 -7.625 1.00 73.13 H new ATOM 0 HA2 GLY A 604 -5.087 -25.054 -10.069 1.00 44.20 H new ATOM 0 HA3 GLY A 604 -3.586 -25.548 -9.312 1.00 44.20 H new ATOM 1611 N GLY A 605 -3.385 -27.435 -10.814 1.00 71.12 N ATOM 1612 CA GLY A 605 -3.180 -28.519 -11.701 1.00 1.05 C ATOM 1613 C GLY A 605 -1.972 -28.220 -12.512 1.00 4.32 C ATOM 1614 O GLY A 605 -0.983 -27.716 -11.967 1.00 54.43 O ATOM 0 H GLY A 605 -2.527 -26.964 -10.528 1.00 71.12 H new ATOM 0 HA2 GLY A 605 -3.047 -29.447 -11.145 1.00 1.05 H new ATOM 0 HA3 GLY A 605 -4.049 -28.655 -12.345 1.00 1.05 H new ATOM 1618 N PHE A 606 -2.023 -28.475 -13.781 1.00 64.04 N ATOM 1619 CA PHE A 606 -0.922 -28.138 -14.632 1.00 72.33 C ATOM 1620 C PHE A 606 -1.400 -27.805 -16.013 1.00 61.23 C ATOM 1621 O PHE A 606 -1.848 -28.681 -16.757 1.00 51.43 O ATOM 1622 CB PHE A 606 0.113 -29.262 -14.713 1.00 42.33 C ATOM 1623 CG PHE A 606 1.330 -28.891 -15.532 1.00 12.14 C ATOM 1624 CD1 PHE A 606 2.265 -27.997 -15.038 1.00 43.03 C ATOM 1625 CD2 PHE A 606 1.520 -29.416 -16.802 1.00 61.33 C ATOM 1626 CE1 PHE A 606 3.366 -27.641 -15.791 1.00 75.04 C ATOM 1627 CE2 PHE A 606 2.617 -29.060 -17.559 1.00 1.13 C ATOM 1628 CZ PHE A 606 3.541 -28.170 -17.053 1.00 43.43 C ATOM 0 H PHE A 606 -2.813 -28.915 -14.252 1.00 64.04 H new ATOM 0 HA PHE A 606 -0.442 -27.266 -14.189 1.00 72.33 H new ATOM 0 HB2 PHE A 606 0.429 -29.530 -13.705 1.00 42.33 H new ATOM 0 HB3 PHE A 606 -0.353 -30.147 -15.147 1.00 42.33 H new ATOM 0 HD1 PHE A 606 2.132 -27.574 -14.053 1.00 43.03 H new ATOM 0 HD2 PHE A 606 0.799 -30.113 -17.204 1.00 61.33 H new ATOM 0 HE1 PHE A 606 4.091 -26.947 -15.392 1.00 75.04 H new ATOM 0 HE2 PHE A 606 2.752 -29.477 -18.546 1.00 1.13 H new ATOM 0 HZ PHE A 606 4.400 -27.888 -17.644 1.00 43.43 H new ATOM 1638 N THR A 607 -1.355 -26.563 -16.343 1.00 72.14 N ATOM 1639 CA THR A 607 -1.608 -26.167 -17.680 1.00 72.13 C ATOM 1640 C THR A 607 -0.303 -26.299 -18.436 1.00 74.34 C ATOM 1641 O THR A 607 0.729 -25.786 -17.975 1.00 61.43 O ATOM 1642 CB THR A 607 -2.115 -24.719 -17.742 1.00 54.20 C ATOM 1643 OG1 THR A 607 -1.242 -23.877 -16.955 1.00 50.10 O ATOM 1644 CG2 THR A 607 -3.538 -24.618 -17.226 1.00 23.41 C ATOM 0 H THR A 607 -1.144 -25.800 -15.700 1.00 72.14 H new ATOM 0 HA THR A 607 -2.382 -26.795 -18.120 1.00 72.13 H new ATOM 0 HB THR A 607 -2.110 -24.389 -18.781 1.00 54.20 H new ATOM 0 HG1 THR A 607 -0.314 -24.170 -17.070 1.00 50.10 H new ATOM 0 HG21 THR A 607 -3.872 -23.582 -17.281 1.00 23.41 H new ATOM 0 HG22 THR A 607 -4.191 -25.243 -17.835 1.00 23.41 H new ATOM 0 HG23 THR A 607 -3.574 -24.956 -16.191 1.00 23.41 H new ATOM 1652 N ILE A 608 -0.316 -27.001 -19.540 1.00 51.04 N ATOM 1653 CA ILE A 608 0.895 -27.219 -20.297 1.00 0.33 C ATOM 1654 C ILE A 608 1.267 -25.938 -21.014 1.00 13.55 C ATOM 1655 O ILE A 608 0.691 -25.591 -22.056 1.00 72.04 O ATOM 1656 CB ILE A 608 0.745 -28.359 -21.320 1.00 50.32 C ATOM 1657 CG1 ILE A 608 0.180 -29.619 -20.641 1.00 1.02 C ATOM 1658 CG2 ILE A 608 2.106 -28.662 -21.967 1.00 74.11 C ATOM 1659 CD1 ILE A 608 -0.055 -30.787 -21.578 1.00 5.31 C ATOM 0 H ILE A 608 -1.151 -27.433 -19.937 1.00 51.04 H new ATOM 0 HA ILE A 608 1.680 -27.510 -19.599 1.00 0.33 H new ATOM 0 HB ILE A 608 0.047 -28.047 -22.097 1.00 50.32 H new ATOM 0 HG12 ILE A 608 0.868 -29.932 -19.856 1.00 1.02 H new ATOM 0 HG13 ILE A 608 -0.762 -29.363 -20.156 1.00 1.02 H new ATOM 0 HG21 ILE A 608 1.993 -29.470 -22.690 1.00 74.11 H new ATOM 0 HG22 ILE A 608 2.475 -27.770 -22.474 1.00 74.11 H new ATOM 0 HG23 ILE A 608 2.817 -28.961 -21.197 1.00 74.11 H new ATOM 0 HD11 ILE A 608 -0.453 -31.631 -21.015 1.00 5.31 H new ATOM 0 HD12 ILE A 608 -0.768 -30.497 -22.350 1.00 5.31 H new ATOM 0 HD13 ILE A 608 0.887 -31.075 -22.044 1.00 5.31 H new ATOM 1671 N THR A 609 2.175 -25.234 -20.432 1.00 3.25 N ATOM 1672 CA THR A 609 2.597 -23.971 -20.919 1.00 34.42 C ATOM 1673 C THR A 609 4.095 -23.825 -20.674 1.00 74.20 C ATOM 1674 O THR A 609 4.685 -24.628 -19.930 1.00 0.51 O ATOM 1675 CB THR A 609 1.789 -22.841 -20.215 1.00 25.43 C ATOM 1676 OG1 THR A 609 2.140 -21.564 -20.734 1.00 53.34 O ATOM 1677 CG2 THR A 609 2.008 -22.845 -18.705 1.00 13.05 C ATOM 0 H THR A 609 2.656 -25.530 -19.583 1.00 3.25 H new ATOM 0 HA THR A 609 2.411 -23.893 -21.990 1.00 34.42 H new ATOM 0 HB THR A 609 0.736 -23.037 -20.415 1.00 25.43 H new ATOM 0 HG1 THR A 609 1.395 -21.210 -21.264 1.00 53.34 H new ATOM 0 HG21 THR A 609 1.427 -22.042 -18.251 1.00 13.05 H new ATOM 0 HG22 THR A 609 1.688 -23.802 -18.293 1.00 13.05 H new ATOM 0 HG23 THR A 609 3.066 -22.694 -18.490 1.00 13.05 H new ATOM 1685 N GLU A 610 4.705 -22.825 -21.275 1.00 41.21 N ATOM 1686 CA GLU A 610 6.138 -22.621 -21.157 1.00 0.30 C ATOM 1687 C GLU A 610 6.430 -21.596 -20.084 1.00 51.24 C ATOM 1688 O GLU A 610 7.587 -21.202 -19.875 1.00 41.41 O ATOM 1689 CB GLU A 610 6.719 -22.134 -22.478 1.00 22.05 C ATOM 1690 CG GLU A 610 6.394 -23.013 -23.663 1.00 71.33 C ATOM 1691 CD GLU A 610 7.144 -22.596 -24.893 1.00 42.05 C ATOM 1692 OE1 GLU A 610 6.829 -21.537 -25.476 1.00 20.52 O ATOM 1693 OE2 GLU A 610 8.100 -23.304 -25.278 1.00 65.22 O ATOM 0 H GLU A 610 4.228 -22.134 -21.855 1.00 41.21 H new ATOM 0 HA GLU A 610 6.596 -23.574 -20.891 1.00 0.30 H new ATOM 0 HB2 GLU A 610 6.349 -21.128 -22.675 1.00 22.05 H new ATOM 0 HB3 GLU A 610 7.802 -22.062 -22.380 1.00 22.05 H new ATOM 0 HG2 GLU A 610 6.636 -24.048 -23.424 1.00 71.33 H new ATOM 0 HG3 GLU A 610 5.323 -22.974 -23.861 1.00 71.33 H new ATOM 1700 N GLU A 611 5.387 -21.166 -19.410 1.00 20.11 N ATOM 1701 CA GLU A 611 5.488 -20.151 -18.393 1.00 21.43 C ATOM 1702 C GLU A 611 6.199 -20.620 -17.129 1.00 53.32 C ATOM 1703 O GLU A 611 5.577 -21.090 -16.170 1.00 12.02 O ATOM 1704 CB GLU A 611 4.122 -19.546 -18.071 1.00 54.22 C ATOM 1705 CG GLU A 611 3.492 -18.822 -19.246 1.00 43.13 C ATOM 1706 CD GLU A 611 4.345 -17.679 -19.731 1.00 13.45 C ATOM 1707 OE1 GLU A 611 4.224 -16.569 -19.192 1.00 45.14 O ATOM 1708 OE2 GLU A 611 5.155 -17.868 -20.648 1.00 62.03 O ATOM 0 H GLU A 611 4.440 -21.515 -19.555 1.00 20.11 H new ATOM 0 HA GLU A 611 6.119 -19.369 -18.816 1.00 21.43 H new ATOM 0 HB2 GLU A 611 3.451 -20.338 -17.740 1.00 54.22 H new ATOM 0 HB3 GLU A 611 4.228 -18.850 -17.239 1.00 54.22 H new ATOM 0 HG2 GLU A 611 3.333 -19.527 -20.062 1.00 43.13 H new ATOM 0 HG3 GLU A 611 2.512 -18.444 -18.955 1.00 43.13 H new ATOM 1715 N TYR A 612 7.501 -20.556 -17.177 1.00 22.24 N ATOM 1716 CA TYR A 612 8.345 -20.784 -16.045 1.00 34.03 C ATOM 1717 C TYR A 612 8.834 -19.473 -15.579 1.00 1.14 C ATOM 1718 O TYR A 612 9.885 -18.985 -16.000 1.00 1.33 O ATOM 1719 CB TYR A 612 9.495 -21.747 -16.349 1.00 35.55 C ATOM 1720 CG TYR A 612 9.073 -23.188 -16.346 1.00 55.21 C ATOM 1721 CD1 TYR A 612 8.469 -23.773 -17.449 1.00 22.14 C ATOM 1722 CD2 TYR A 612 9.266 -23.961 -15.217 1.00 12.33 C ATOM 1723 CE1 TYR A 612 8.068 -25.091 -17.417 1.00 34.40 C ATOM 1724 CE2 TYR A 612 8.877 -25.271 -15.177 1.00 4.14 C ATOM 1725 CZ TYR A 612 8.278 -25.834 -16.274 1.00 74.21 C ATOM 1726 OH TYR A 612 7.871 -27.142 -16.220 1.00 2.22 O ATOM 0 H TYR A 612 8.015 -20.337 -18.030 1.00 22.24 H new ATOM 0 HA TYR A 612 7.770 -21.273 -15.259 1.00 34.03 H new ATOM 0 HB2 TYR A 612 9.919 -21.501 -17.322 1.00 35.55 H new ATOM 0 HB3 TYR A 612 10.285 -21.604 -15.612 1.00 35.55 H new ATOM 0 HD1 TYR A 612 8.311 -23.189 -18.343 1.00 22.14 H new ATOM 0 HD2 TYR A 612 9.734 -23.521 -14.348 1.00 12.33 H new ATOM 0 HE1 TYR A 612 7.594 -25.538 -18.278 1.00 34.40 H new ATOM 0 HE2 TYR A 612 9.041 -25.859 -14.286 1.00 4.14 H new ATOM 0 HH TYR A 612 8.096 -27.519 -15.344 1.00 2.22 H new ATOM 1736 N ASP A 613 8.029 -18.860 -14.779 1.00 52.32 N ATOM 1737 CA ASP A 613 8.318 -17.555 -14.299 1.00 44.35 C ATOM 1738 C ASP A 613 9.256 -17.651 -13.165 1.00 12.51 C ATOM 1739 O ASP A 613 8.896 -18.135 -12.098 1.00 72.40 O ATOM 1740 CB ASP A 613 7.063 -16.859 -13.827 1.00 15.24 C ATOM 1741 CG ASP A 613 7.315 -15.421 -13.446 1.00 24.10 C ATOM 1742 OD1 ASP A 613 7.836 -15.146 -12.346 1.00 12.34 O ATOM 1743 OD2 ASP A 613 6.973 -14.555 -14.237 1.00 22.21 O ATOM 0 H ASP A 613 7.151 -19.252 -14.440 1.00 52.32 H new ATOM 0 HA ASP A 613 8.755 -16.980 -15.115 1.00 44.35 H new ATOM 0 HB2 ASP A 613 6.311 -16.897 -14.615 1.00 15.24 H new ATOM 0 HB3 ASP A 613 6.654 -17.394 -12.970 1.00 15.24 H new ATOM 1748 N ASP A 614 10.454 -17.254 -13.378 1.00 65.01 N ATOM 1749 CA ASP A 614 11.380 -17.224 -12.304 1.00 51.15 C ATOM 1750 C ASP A 614 11.445 -15.853 -11.750 1.00 63.11 C ATOM 1751 O ASP A 614 12.157 -14.991 -12.282 1.00 50.31 O ATOM 1752 CB ASP A 614 12.745 -17.696 -12.700 1.00 3.14 C ATOM 1753 CG ASP A 614 13.737 -17.602 -11.542 1.00 1.31 C ATOM 1754 OD1 ASP A 614 13.593 -18.344 -10.553 1.00 32.33 O ATOM 1755 OD2 ASP A 614 14.682 -16.778 -11.605 1.00 41.32 O ATOM 0 H ASP A 614 10.818 -16.946 -14.280 1.00 65.01 H new ATOM 0 HA ASP A 614 11.024 -17.918 -11.543 1.00 51.15 H new ATOM 0 HB2 ASP A 614 12.686 -18.728 -13.045 1.00 3.14 H new ATOM 0 HB3 ASP A 614 13.107 -17.100 -13.538 1.00 3.14 H new ATOM 1760 N LYS A 615 10.621 -15.646 -10.741 1.00 44.30 N ATOM 1761 CA LYS A 615 10.511 -14.405 -9.976 1.00 21.34 C ATOM 1762 C LYS A 615 10.548 -13.129 -10.831 1.00 45.52 C ATOM 1763 O LYS A 615 11.288 -12.183 -10.535 1.00 30.41 O ATOM 1764 CB LYS A 615 11.502 -14.374 -8.779 1.00 71.41 C ATOM 1765 CG LYS A 615 12.951 -14.678 -9.132 1.00 43.11 C ATOM 1766 CD LYS A 615 13.830 -14.726 -7.904 1.00 11.34 C ATOM 1767 CE LYS A 615 15.250 -15.146 -8.257 1.00 31.13 C ATOM 1768 NZ LYS A 615 15.321 -16.517 -8.837 1.00 11.12 N ATOM 0 H LYS A 615 9.978 -16.367 -10.412 1.00 44.30 H new ATOM 0 HA LYS A 615 9.506 -14.407 -9.554 1.00 21.34 H new ATOM 0 HB2 LYS A 615 11.456 -13.389 -8.315 1.00 71.41 H new ATOM 0 HB3 LYS A 615 11.168 -15.094 -8.032 1.00 71.41 H new ATOM 0 HG2 LYS A 615 13.005 -15.633 -9.655 1.00 43.11 H new ATOM 0 HG3 LYS A 615 13.325 -13.918 -9.817 1.00 43.11 H new ATOM 0 HD2 LYS A 615 13.846 -13.746 -7.427 1.00 11.34 H new ATOM 0 HD3 LYS A 615 13.411 -15.426 -7.181 1.00 11.34 H new ATOM 0 HE2 LYS A 615 15.668 -14.434 -8.968 1.00 31.13 H new ATOM 0 HE3 LYS A 615 15.870 -15.103 -7.361 1.00 31.13 H new ATOM 0 HZ1 LYS A 615 16.236 -16.949 -8.597 1.00 11.12 H new ATOM 0 HZ2 LYS A 615 14.551 -17.099 -8.448 1.00 11.12 H new ATOM 0 HZ3 LYS A 615 15.225 -16.462 -9.871 1.00 11.12 H new ATOM 1782 N GLN A 616 9.760 -13.113 -11.895 1.00 3.43 N ATOM 1783 CA GLN A 616 9.660 -11.926 -12.733 1.00 5.03 C ATOM 1784 C GLN A 616 8.742 -10.918 -12.048 1.00 24.12 C ATOM 1785 O GLN A 616 8.021 -11.295 -11.123 1.00 74.23 O ATOM 1786 CB GLN A 616 9.108 -12.254 -14.129 1.00 21.35 C ATOM 1787 CG GLN A 616 9.945 -13.207 -14.949 1.00 53.55 C ATOM 1788 CD GLN A 616 9.407 -13.361 -16.358 1.00 15.44 C ATOM 1789 OE1 GLN A 616 9.802 -12.634 -17.266 1.00 33.21 O ATOM 1790 NE2 GLN A 616 8.472 -14.246 -16.541 1.00 21.13 N ATOM 0 H GLN A 616 9.185 -13.900 -12.197 1.00 3.43 H new ATOM 0 HA GLN A 616 10.661 -11.514 -12.863 1.00 5.03 H new ATOM 0 HB2 GLN A 616 8.110 -12.678 -14.016 1.00 21.35 H new ATOM 0 HB3 GLN A 616 8.998 -11.323 -14.685 1.00 21.35 H new ATOM 0 HG2 GLN A 616 10.972 -12.845 -14.990 1.00 53.55 H new ATOM 0 HG3 GLN A 616 9.969 -14.181 -14.461 1.00 53.55 H new ATOM 0 HE21 GLN A 616 8.167 -14.834 -15.765 1.00 21.13 H new ATOM 0 HE22 GLN A 616 8.043 -14.352 -17.460 1.00 21.13 H new ATOM 1799 N PRO A 617 8.773 -9.622 -12.453 1.00 20.54 N ATOM 1800 CA PRO A 617 7.870 -8.595 -11.905 1.00 55.21 C ATOM 1801 C PRO A 617 6.391 -8.880 -12.215 1.00 21.44 C ATOM 1802 O PRO A 617 6.025 -9.999 -12.634 1.00 24.54 O ATOM 1803 CB PRO A 617 8.315 -7.309 -12.625 1.00 4.04 C ATOM 1804 CG PRO A 617 9.697 -7.590 -13.075 1.00 62.53 C ATOM 1805 CD PRO A 617 9.713 -9.041 -13.422 1.00 2.00 C ATOM 0 HA PRO A 617 7.932 -8.546 -10.818 1.00 55.21 H new ATOM 0 HB2 PRO A 617 7.663 -7.081 -13.468 1.00 4.04 H new ATOM 0 HB3 PRO A 617 8.283 -6.449 -11.956 1.00 4.04 H new ATOM 0 HG2 PRO A 617 9.962 -6.977 -13.936 1.00 62.53 H new ATOM 0 HG3 PRO A 617 10.419 -7.366 -12.290 1.00 62.53 H new ATOM 0 HD2 PRO A 617 9.392 -9.214 -14.449 1.00 2.00 H new ATOM 0 HD3 PRO A 617 10.711 -9.469 -13.323 1.00 2.00 H new ATOM 1813 N LEU A 618 5.542 -7.862 -12.031 1.00 72.21 N ATOM 1814 CA LEU A 618 4.123 -7.999 -12.294 1.00 24.24 C ATOM 1815 C LEU A 618 3.906 -8.469 -13.716 1.00 23.32 C ATOM 1816 O LEU A 618 4.307 -7.814 -14.688 1.00 13.35 O ATOM 1817 CB LEU A 618 3.332 -6.703 -11.994 1.00 31.03 C ATOM 1818 CG LEU A 618 3.140 -6.304 -10.504 1.00 42.10 C ATOM 1819 CD1 LEU A 618 2.520 -7.432 -9.700 1.00 4.01 C ATOM 1820 CD2 LEU A 618 4.429 -5.825 -9.851 1.00 21.55 C ATOM 0 H LEU A 618 5.823 -6.939 -11.701 1.00 72.21 H new ATOM 0 HA LEU A 618 3.730 -8.752 -11.610 1.00 24.24 H new ATOM 0 HB2 LEU A 618 3.834 -5.879 -12.500 1.00 31.03 H new ATOM 0 HB3 LEU A 618 2.345 -6.800 -12.445 1.00 31.03 H new ATOM 0 HG LEU A 618 2.449 -5.461 -10.504 1.00 42.10 H new ATOM 0 HD11 LEU A 618 2.401 -7.117 -8.663 1.00 4.01 H new ATOM 0 HD12 LEU A 618 1.545 -7.683 -10.117 1.00 4.01 H new ATOM 0 HD13 LEU A 618 3.168 -8.307 -9.741 1.00 4.01 H new ATOM 0 HD21 LEU A 618 4.234 -5.560 -8.812 1.00 21.55 H new ATOM 0 HD22 LEU A 618 5.174 -6.620 -9.889 1.00 21.55 H new ATOM 0 HD23 LEU A 618 4.804 -4.951 -10.384 1.00 21.55 H new ATOM 1832 N THR A 619 3.354 -9.627 -13.823 1.00 23.35 N ATOM 1833 CA THR A 619 3.168 -10.289 -15.070 1.00 73.30 C ATOM 1834 C THR A 619 1.728 -10.743 -15.199 1.00 11.01 C ATOM 1835 O THR A 619 0.886 -10.363 -14.368 1.00 50.12 O ATOM 1836 CB THR A 619 4.137 -11.503 -15.143 1.00 55.20 C ATOM 1837 OG1 THR A 619 4.281 -12.078 -13.829 1.00 24.20 O ATOM 1838 CG2 THR A 619 5.503 -11.098 -15.670 1.00 62.44 C ATOM 0 H THR A 619 3.009 -10.157 -13.023 1.00 23.35 H new ATOM 0 HA THR A 619 3.385 -9.608 -15.893 1.00 73.30 H new ATOM 0 HB THR A 619 3.713 -12.234 -15.832 1.00 55.20 H new ATOM 0 HG1 THR A 619 4.901 -11.534 -13.300 1.00 24.20 H new ATOM 0 HG21 THR A 619 6.153 -11.972 -15.707 1.00 62.44 H new ATOM 0 HG22 THR A 619 5.398 -10.682 -16.672 1.00 62.44 H new ATOM 0 HG23 THR A 619 5.940 -10.349 -15.010 1.00 62.44 H new ATOM 1846 N SER A 620 1.437 -11.488 -16.258 1.00 41.23 N ATOM 1847 CA SER A 620 0.138 -12.100 -16.469 1.00 5.13 C ATOM 1848 C SER A 620 -0.948 -11.072 -16.847 1.00 15.13 C ATOM 1849 O SER A 620 -2.150 -11.336 -16.690 1.00 45.51 O ATOM 1850 CB SER A 620 -0.264 -12.923 -15.224 1.00 74.23 C ATOM 1851 OG SER A 620 -1.462 -13.619 -15.433 1.00 21.03 O ATOM 0 H SER A 620 2.107 -11.685 -17.002 1.00 41.23 H new ATOM 0 HA SER A 620 0.222 -12.772 -17.323 1.00 5.13 H new ATOM 0 HB2 SER A 620 0.530 -13.629 -14.981 1.00 74.23 H new ATOM 0 HB3 SER A 620 -0.373 -12.258 -14.367 1.00 74.23 H new ATOM 0 HG SER A 620 -2.023 -13.122 -16.065 1.00 21.03 H new ATOM 1857 N LYS A 621 -0.548 -9.944 -17.410 1.00 23.12 N ATOM 1858 CA LYS A 621 -1.527 -8.941 -17.818 1.00 14.53 C ATOM 1859 C LYS A 621 -2.059 -9.241 -19.218 1.00 2.12 C ATOM 1860 O LYS A 621 -3.002 -8.610 -19.679 1.00 2.41 O ATOM 1861 CB LYS A 621 -0.990 -7.482 -17.760 1.00 43.35 C ATOM 1862 CG LYS A 621 -0.704 -6.911 -16.354 1.00 23.22 C ATOM 1863 CD LYS A 621 0.628 -7.368 -15.766 1.00 13.12 C ATOM 1864 CE LYS A 621 1.826 -6.747 -16.493 1.00 64.43 C ATOM 1865 NZ LYS A 621 1.880 -5.274 -16.349 1.00 71.30 N ATOM 0 H LYS A 621 0.425 -9.699 -17.594 1.00 23.12 H new ATOM 0 HA LYS A 621 -2.336 -9.007 -17.091 1.00 14.53 H new ATOM 0 HB2 LYS A 621 -0.070 -7.433 -18.342 1.00 43.35 H new ATOM 0 HB3 LYS A 621 -1.713 -6.832 -18.252 1.00 43.35 H new ATOM 0 HG2 LYS A 621 -0.714 -5.822 -16.405 1.00 23.22 H new ATOM 0 HG3 LYS A 621 -1.509 -7.206 -15.681 1.00 23.22 H new ATOM 0 HD2 LYS A 621 0.668 -7.101 -14.710 1.00 13.12 H new ATOM 0 HD3 LYS A 621 0.694 -8.455 -15.823 1.00 13.12 H new ATOM 0 HE2 LYS A 621 2.747 -7.180 -16.103 1.00 64.43 H new ATOM 0 HE3 LYS A 621 1.776 -7.003 -17.551 1.00 64.43 H new ATOM 0 HZ1 LYS A 621 2.815 -4.930 -16.647 1.00 71.30 H new ATOM 0 HZ2 LYS A 621 1.146 -4.840 -16.944 1.00 71.30 H new ATOM 0 HZ3 LYS A 621 1.717 -5.016 -15.355 1.00 71.30 H new ATOM 1879 N GLU A 622 -1.461 -10.209 -19.882 1.00 65.12 N ATOM 1880 CA GLU A 622 -1.869 -10.565 -21.227 1.00 71.33 C ATOM 1881 C GLU A 622 -2.435 -11.987 -21.267 1.00 31.05 C ATOM 1882 O GLU A 622 -3.600 -12.206 -21.634 1.00 21.43 O ATOM 1883 CB GLU A 622 -0.670 -10.436 -22.177 1.00 23.43 C ATOM 1884 CG GLU A 622 -0.969 -10.741 -23.635 1.00 34.24 C ATOM 1885 CD GLU A 622 -2.017 -9.833 -24.201 1.00 42.14 C ATOM 1886 OE1 GLU A 622 -1.726 -8.645 -24.446 1.00 21.43 O ATOM 1887 OE2 GLU A 622 -3.160 -10.275 -24.400 1.00 44.15 O ATOM 0 H GLU A 622 -0.690 -10.764 -19.512 1.00 65.12 H new ATOM 0 HA GLU A 622 -2.657 -9.884 -21.548 1.00 71.33 H new ATOM 0 HB2 GLU A 622 -0.278 -9.421 -22.107 1.00 23.43 H new ATOM 0 HB3 GLU A 622 0.118 -11.107 -21.836 1.00 23.43 H new ATOM 0 HG2 GLU A 622 -0.054 -10.645 -24.219 1.00 34.24 H new ATOM 0 HG3 GLU A 622 -1.299 -11.776 -23.727 1.00 34.24 H new ATOM 1894 N GLU A 623 -1.616 -12.939 -20.877 1.00 23.13 N ATOM 1895 CA GLU A 623 -1.983 -14.334 -20.927 1.00 32.42 C ATOM 1896 C GLU A 623 -2.977 -14.689 -19.829 1.00 24.50 C ATOM 1897 O GLU A 623 -2.729 -14.472 -18.644 1.00 30.32 O ATOM 1898 CB GLU A 623 -0.736 -15.218 -20.832 1.00 3.24 C ATOM 1899 CG GLU A 623 0.214 -15.102 -22.009 1.00 25.41 C ATOM 1900 CD GLU A 623 -0.360 -15.655 -23.288 1.00 72.31 C ATOM 1901 OE1 GLU A 623 -1.126 -14.967 -23.958 1.00 73.44 O ATOM 1902 OE2 GLU A 623 -0.014 -16.803 -23.664 1.00 74.44 O ATOM 0 H GLU A 623 -0.678 -12.766 -20.517 1.00 23.13 H new ATOM 0 HA GLU A 623 -2.470 -14.517 -21.885 1.00 32.42 H new ATOM 0 HB2 GLU A 623 -0.196 -14.964 -19.920 1.00 3.24 H new ATOM 0 HB3 GLU A 623 -1.050 -16.257 -20.737 1.00 3.24 H new ATOM 0 HG2 GLU A 623 0.473 -14.054 -22.157 1.00 25.41 H new ATOM 0 HG3 GLU A 623 1.139 -15.629 -21.775 1.00 25.41 H new ATOM 1909 N GLU A 624 -4.083 -15.248 -20.232 1.00 52.33 N ATOM 1910 CA GLU A 624 -5.126 -15.685 -19.324 1.00 22.31 C ATOM 1911 C GLU A 624 -4.693 -16.976 -18.662 1.00 24.43 C ATOM 1912 O GLU A 624 -4.993 -17.223 -17.495 1.00 74.42 O ATOM 1913 CB GLU A 624 -6.418 -15.913 -20.080 1.00 32.54 C ATOM 1914 CG GLU A 624 -6.900 -14.706 -20.849 1.00 3.43 C ATOM 1915 CD GLU A 624 -8.128 -15.014 -21.642 1.00 12.25 C ATOM 1916 OE1 GLU A 624 -8.003 -15.542 -22.757 1.00 72.43 O ATOM 1917 OE2 GLU A 624 -9.248 -14.732 -21.166 1.00 22.31 O ATOM 0 H GLU A 624 -4.296 -15.419 -21.215 1.00 52.33 H new ATOM 0 HA GLU A 624 -5.292 -14.916 -18.570 1.00 22.31 H new ATOM 0 HB2 GLU A 624 -6.280 -16.742 -20.774 1.00 32.54 H new ATOM 0 HB3 GLU A 624 -7.192 -16.214 -19.374 1.00 32.54 H new ATOM 0 HG2 GLU A 624 -7.109 -13.891 -20.155 1.00 3.43 H new ATOM 0 HG3 GLU A 624 -6.111 -14.361 -21.518 1.00 3.43 H new ATOM 1924 N GLU A 625 -3.953 -17.787 -19.412 1.00 40.43 N ATOM 1925 CA GLU A 625 -3.404 -19.037 -18.901 1.00 54.32 C ATOM 1926 C GLU A 625 -2.362 -18.758 -17.826 1.00 4.44 C ATOM 1927 O GLU A 625 -2.102 -19.585 -16.954 1.00 14.55 O ATOM 1928 CB GLU A 625 -2.812 -19.878 -20.031 1.00 32.15 C ATOM 1929 CG GLU A 625 -1.728 -19.180 -20.842 1.00 21.01 C ATOM 1930 CD GLU A 625 -1.171 -20.059 -21.925 1.00 32.51 C ATOM 1931 OE1 GLU A 625 -1.848 -20.263 -22.958 1.00 13.51 O ATOM 1932 OE2 GLU A 625 -0.044 -20.546 -21.791 1.00 24.40 O ATOM 0 H GLU A 625 -3.718 -17.597 -20.386 1.00 40.43 H new ATOM 0 HA GLU A 625 -4.216 -19.610 -18.452 1.00 54.32 H new ATOM 0 HB2 GLU A 625 -2.397 -20.792 -19.606 1.00 32.15 H new ATOM 0 HB3 GLU A 625 -3.616 -20.175 -20.704 1.00 32.15 H new ATOM 0 HG2 GLU A 625 -2.138 -18.274 -21.288 1.00 21.01 H new ATOM 0 HG3 GLU A 625 -0.922 -18.872 -20.177 1.00 21.01 H new ATOM 1939 N ARG A 626 -1.798 -17.574 -17.885 1.00 11.11 N ATOM 1940 CA ARG A 626 -0.847 -17.128 -16.902 1.00 32.55 C ATOM 1941 C ARG A 626 -1.541 -16.960 -15.575 1.00 24.42 C ATOM 1942 O ARG A 626 -1.038 -17.388 -14.567 1.00 61.54 O ATOM 1943 CB ARG A 626 -0.255 -15.811 -17.320 1.00 13.13 C ATOM 1944 CG ARG A 626 1.205 -15.834 -17.668 1.00 75.44 C ATOM 1945 CD ARG A 626 2.062 -16.146 -16.460 1.00 60.34 C ATOM 1946 NE ARG A 626 3.453 -15.905 -16.762 1.00 63.32 N ATOM 1947 CZ ARG A 626 4.328 -15.374 -15.929 1.00 50.34 C ATOM 1948 NH1 ARG A 626 4.093 -15.334 -14.627 1.00 13.43 N ATOM 1949 NH2 ARG A 626 5.486 -14.959 -16.378 1.00 13.35 N ATOM 0 H ARG A 626 -1.989 -16.893 -18.620 1.00 11.11 H new ATOM 0 HA ARG A 626 -0.052 -17.868 -16.814 1.00 32.55 H new ATOM 0 HB2 ARG A 626 -0.809 -15.442 -18.183 1.00 13.13 H new ATOM 0 HB3 ARG A 626 -0.406 -15.093 -16.513 1.00 13.13 H new ATOM 0 HG2 ARG A 626 1.383 -16.579 -18.443 1.00 75.44 H new ATOM 0 HG3 ARG A 626 1.496 -14.868 -18.082 1.00 75.44 H new ATOM 0 HD2 ARG A 626 1.753 -15.529 -15.616 1.00 60.34 H new ATOM 0 HD3 ARG A 626 1.921 -17.185 -16.163 1.00 60.34 H new ATOM 0 HE ARG A 626 3.785 -16.165 -17.691 1.00 63.32 H new ATOM 0 HH11 ARG A 626 3.225 -15.717 -14.253 1.00 13.43 H new ATOM 0 HH12 ARG A 626 4.780 -14.920 -13.997 1.00 13.43 H new ATOM 0 HH21 ARG A 626 5.710 -15.047 -17.369 1.00 13.35 H new ATOM 0 HH22 ARG A 626 6.164 -14.548 -15.736 1.00 13.35 H new ATOM 1963 N ARG A 627 -2.749 -16.407 -15.614 1.00 22.32 N ATOM 1964 CA ARG A 627 -3.541 -16.140 -14.408 1.00 13.41 C ATOM 1965 C ARG A 627 -3.870 -17.425 -13.659 1.00 62.12 C ATOM 1966 O ARG A 627 -4.093 -17.414 -12.460 1.00 61.03 O ATOM 1967 CB ARG A 627 -4.813 -15.349 -14.756 1.00 4.01 C ATOM 1968 CG ARG A 627 -4.520 -13.941 -15.245 1.00 2.42 C ATOM 1969 CD ARG A 627 -5.758 -13.192 -15.706 1.00 21.12 C ATOM 1970 NE ARG A 627 -5.420 -11.804 -16.065 1.00 14.33 N ATOM 1971 CZ ARG A 627 -5.952 -11.092 -17.070 1.00 65.21 C ATOM 1972 NH1 ARG A 627 -6.912 -11.619 -17.843 1.00 34.31 N ATOM 1973 NH2 ARG A 627 -5.534 -9.836 -17.286 1.00 41.05 N ATOM 0 H ARG A 627 -3.211 -16.130 -16.480 1.00 22.32 H new ATOM 0 HA ARG A 627 -2.937 -15.526 -13.740 1.00 13.41 H new ATOM 0 HB2 ARG A 627 -5.370 -15.886 -15.524 1.00 4.01 H new ATOM 0 HB3 ARG A 627 -5.454 -15.296 -13.876 1.00 4.01 H new ATOM 0 HG2 ARG A 627 -4.042 -13.378 -14.443 1.00 2.42 H new ATOM 0 HG3 ARG A 627 -3.807 -13.991 -16.068 1.00 2.42 H new ATOM 0 HD2 ARG A 627 -6.198 -13.699 -16.565 1.00 21.12 H new ATOM 0 HD3 ARG A 627 -6.508 -13.197 -14.915 1.00 21.12 H new ATOM 0 HE ARG A 627 -4.713 -11.339 -15.495 1.00 14.33 H new ATOM 0 HH11 ARG A 627 -7.243 -12.568 -17.669 1.00 34.31 H new ATOM 0 HH12 ARG A 627 -7.311 -11.071 -18.605 1.00 34.31 H new ATOM 0 HH21 ARG A 627 -4.816 -9.428 -16.688 1.00 41.05 H new ATOM 0 HH22 ARG A 627 -5.934 -9.289 -18.048 1.00 41.05 H new ATOM 1987 N ILE A 628 -3.866 -18.529 -14.378 1.00 64.11 N ATOM 1988 CA ILE A 628 -4.083 -19.836 -13.794 1.00 55.13 C ATOM 1989 C ILE A 628 -2.865 -20.226 -12.961 1.00 75.44 C ATOM 1990 O ILE A 628 -2.980 -20.701 -11.835 1.00 55.31 O ATOM 1991 CB ILE A 628 -4.278 -20.883 -14.897 1.00 12.42 C ATOM 1992 CG1 ILE A 628 -5.442 -20.482 -15.795 1.00 12.51 C ATOM 1993 CG2 ILE A 628 -4.502 -22.260 -14.288 1.00 41.54 C ATOM 1994 CD1 ILE A 628 -5.601 -21.362 -16.998 1.00 44.52 C ATOM 0 H ILE A 628 -3.712 -18.545 -15.386 1.00 64.11 H new ATOM 0 HA ILE A 628 -4.974 -19.797 -13.168 1.00 55.13 H new ATOM 0 HB ILE A 628 -3.376 -20.931 -15.507 1.00 12.42 H new ATOM 0 HG12 ILE A 628 -6.364 -20.505 -15.214 1.00 12.51 H new ATOM 0 HG13 ILE A 628 -5.299 -19.453 -16.124 1.00 12.51 H new ATOM 0 HG21 ILE A 628 -4.639 -22.992 -15.084 1.00 41.54 H new ATOM 0 HG22 ILE A 628 -3.637 -22.536 -13.685 1.00 41.54 H new ATOM 0 HG23 ILE A 628 -5.391 -22.239 -13.658 1.00 41.54 H new ATOM 0 HD11 ILE A 628 -6.448 -21.018 -17.591 1.00 44.52 H new ATOM 0 HD12 ILE A 628 -4.694 -21.320 -17.602 1.00 44.52 H new ATOM 0 HD13 ILE A 628 -5.776 -22.389 -16.677 1.00 44.52 H new ATOM 2006 N ALA A 629 -1.703 -19.981 -13.516 1.00 10.22 N ATOM 2007 CA ALA A 629 -0.452 -20.290 -12.855 1.00 11.03 C ATOM 2008 C ALA A 629 -0.226 -19.316 -11.710 1.00 61.54 C ATOM 2009 O ALA A 629 0.203 -19.702 -10.619 1.00 20.44 O ATOM 2010 CB ALA A 629 0.704 -20.240 -13.847 1.00 52.40 C ATOM 0 H ALA A 629 -1.595 -19.561 -14.439 1.00 10.22 H new ATOM 0 HA ALA A 629 -0.501 -21.301 -12.451 1.00 11.03 H new ATOM 0 HB1 ALA A 629 1.636 -20.475 -13.332 1.00 52.40 H new ATOM 0 HB2 ALA A 629 0.534 -20.968 -14.640 1.00 52.40 H new ATOM 0 HB3 ALA A 629 0.770 -19.241 -14.279 1.00 52.40 H new ATOM 2016 N GLU A 630 -0.596 -18.063 -11.941 1.00 11.01 N ATOM 2017 CA GLU A 630 -0.443 -17.011 -10.946 1.00 44.23 C ATOM 2018 C GLU A 630 -1.488 -17.146 -9.844 1.00 25.32 C ATOM 2019 O GLU A 630 -1.475 -16.406 -8.886 1.00 45.52 O ATOM 2020 CB GLU A 630 -0.544 -15.612 -11.565 1.00 20.54 C ATOM 2021 CG GLU A 630 0.398 -15.345 -12.728 1.00 64.43 C ATOM 2022 CD GLU A 630 1.845 -15.628 -12.431 1.00 23.21 C ATOM 2023 OE1 GLU A 630 2.487 -14.846 -11.708 1.00 24.31 O ATOM 2024 OE2 GLU A 630 2.383 -16.623 -12.961 1.00 21.51 O ATOM 0 H GLU A 630 -1.009 -17.749 -12.819 1.00 11.01 H new ATOM 0 HA GLU A 630 0.554 -17.129 -10.522 1.00 44.23 H new ATOM 0 HB2 GLU A 630 -1.568 -15.457 -11.905 1.00 20.54 H new ATOM 0 HB3 GLU A 630 -0.352 -14.874 -10.786 1.00 20.54 H new ATOM 0 HG2 GLU A 630 0.088 -15.953 -13.578 1.00 64.43 H new ATOM 0 HG3 GLU A 630 0.298 -14.302 -13.029 1.00 64.43 H new ATOM 2031 N MET A 631 -2.391 -18.099 -9.991 1.00 30.01 N ATOM 2032 CA MET A 631 -3.381 -18.368 -9.006 1.00 72.21 C ATOM 2033 C MET A 631 -2.760 -19.241 -7.908 1.00 50.03 C ATOM 2034 O MET A 631 -3.334 -19.447 -6.842 1.00 52.41 O ATOM 2035 CB MET A 631 -4.553 -19.041 -9.683 1.00 34.43 C ATOM 2036 CG MET A 631 -5.757 -19.188 -8.824 1.00 63.23 C ATOM 2037 SD MET A 631 -7.184 -19.825 -9.735 1.00 53.54 S ATOM 2038 CE MET A 631 -7.377 -18.544 -10.996 1.00 31.04 C ATOM 0 H MET A 631 -2.444 -18.704 -10.810 1.00 30.01 H new ATOM 0 HA MET A 631 -3.742 -17.453 -8.535 1.00 72.21 H new ATOM 0 HB2 MET A 631 -4.822 -18.468 -10.570 1.00 34.43 H new ATOM 0 HB3 MET A 631 -4.242 -20.029 -10.024 1.00 34.43 H new ATOM 0 HG2 MET A 631 -5.529 -19.860 -7.996 1.00 63.23 H new ATOM 0 HG3 MET A 631 -6.010 -18.221 -8.389 1.00 63.23 H new ATOM 0 HE1 MET A 631 -8.418 -18.501 -11.315 1.00 31.04 H new ATOM 0 HE2 MET A 631 -7.084 -17.579 -10.582 1.00 31.04 H new ATOM 0 HE3 MET A 631 -6.745 -18.778 -11.852 1.00 31.04 H new ATOM 2048 N GLY A 632 -1.566 -19.748 -8.196 1.00 14.51 N ATOM 2049 CA GLY A 632 -0.779 -20.452 -7.208 1.00 10.10 C ATOM 2050 C GLY A 632 0.174 -19.470 -6.552 1.00 52.51 C ATOM 2051 O GLY A 632 1.021 -19.826 -5.733 1.00 62.12 O ATOM 0 H GLY A 632 -1.126 -19.680 -9.114 1.00 14.51 H new ATOM 0 HA2 GLY A 632 -1.430 -20.904 -6.459 1.00 10.10 H new ATOM 0 HA3 GLY A 632 -0.222 -21.263 -7.677 1.00 10.10 H new ATOM 2055 N ARG A 633 0.004 -18.232 -6.926 1.00 21.24 N ATOM 2056 CA ARG A 633 0.759 -17.112 -6.463 1.00 74.30 C ATOM 2057 C ARG A 633 -0.219 -16.078 -5.921 1.00 60.42 C ATOM 2058 O ARG A 633 -1.421 -16.282 -6.001 1.00 3.05 O ATOM 2059 CB ARG A 633 1.524 -16.502 -7.633 1.00 11.23 C ATOM 2060 CG ARG A 633 2.763 -17.232 -8.055 1.00 3.23 C ATOM 2061 CD ARG A 633 3.378 -16.500 -9.210 1.00 60.25 C ATOM 2062 NE ARG A 633 4.762 -16.873 -9.445 1.00 70.11 N ATOM 2063 CZ ARG A 633 5.574 -16.209 -10.258 1.00 1.22 C ATOM 2064 NH1 ARG A 633 5.084 -15.288 -11.089 1.00 73.34 N ATOM 2065 NH2 ARG A 633 6.865 -16.499 -10.293 1.00 65.01 N ATOM 0 H ARG A 633 -0.711 -17.967 -7.604 1.00 21.24 H new ATOM 0 HA ARG A 633 1.462 -17.422 -5.690 1.00 74.30 H new ATOM 0 HB2 ARG A 633 0.852 -16.441 -8.489 1.00 11.23 H new ATOM 0 HB3 ARG A 633 1.799 -15.481 -7.370 1.00 11.23 H new ATOM 0 HG2 ARG A 633 3.468 -17.292 -7.226 1.00 3.23 H new ATOM 0 HG3 ARG A 633 2.520 -18.255 -8.341 1.00 3.23 H new ATOM 0 HD2 ARG A 633 2.796 -16.698 -10.110 1.00 60.25 H new ATOM 0 HD3 ARG A 633 3.323 -15.427 -9.024 1.00 60.25 H new ATOM 0 HE ARG A 633 5.130 -17.690 -8.958 1.00 70.11 H new ATOM 0 HH11 ARG A 633 4.083 -15.093 -11.101 1.00 73.34 H new ATOM 0 HH12 ARG A 633 5.710 -14.779 -11.713 1.00 73.34 H new ATOM 0 HH21 ARG A 633 7.239 -17.235 -9.694 1.00 65.01 H new ATOM 0 HH22 ARG A 633 7.486 -15.987 -10.919 1.00 65.01 H new ATOM 2079 N PRO A 634 0.254 -14.987 -5.322 1.00 64.33 N ATOM 2080 CA PRO A 634 -0.610 -13.925 -4.915 1.00 3.31 C ATOM 2081 C PRO A 634 -0.686 -12.846 -5.990 1.00 72.34 C ATOM 2082 O PRO A 634 0.257 -12.643 -6.761 1.00 74.05 O ATOM 2083 CB PRO A 634 0.069 -13.396 -3.672 1.00 33.33 C ATOM 2084 CG PRO A 634 1.529 -13.685 -3.871 1.00 14.13 C ATOM 2085 CD PRO A 634 1.650 -14.704 -4.960 1.00 63.23 C ATOM 0 HA PRO A 634 -1.637 -14.246 -4.743 1.00 3.31 H new ATOM 0 HB2 PRO A 634 -0.108 -12.327 -3.550 1.00 33.33 H new ATOM 0 HB3 PRO A 634 -0.311 -13.886 -2.776 1.00 33.33 H new ATOM 0 HG2 PRO A 634 2.065 -12.775 -4.139 1.00 14.13 H new ATOM 0 HG3 PRO A 634 1.974 -14.058 -2.948 1.00 14.13 H new ATOM 0 HD2 PRO A 634 2.215 -14.319 -5.809 1.00 63.23 H new ATOM 0 HD3 PRO A 634 2.165 -15.601 -4.615 1.00 63.23 H new ATOM 2093 N ILE A 635 -1.778 -12.168 -6.043 1.00 10.13 N ATOM 2094 CA ILE A 635 -1.962 -11.150 -7.025 1.00 2.03 C ATOM 2095 C ILE A 635 -2.029 -9.784 -6.396 1.00 21.51 C ATOM 2096 O ILE A 635 -2.039 -9.669 -5.169 1.00 41.31 O ATOM 2097 CB ILE A 635 -3.164 -11.444 -7.964 1.00 14.53 C ATOM 2098 CG1 ILE A 635 -4.443 -11.908 -7.201 1.00 52.15 C ATOM 2099 CG2 ILE A 635 -2.753 -12.486 -8.991 1.00 3.34 C ATOM 2100 CD1 ILE A 635 -5.106 -10.874 -6.311 1.00 63.15 C ATOM 0 H ILE A 635 -2.568 -12.300 -5.411 1.00 10.13 H new ATOM 0 HA ILE A 635 -1.081 -11.156 -7.667 1.00 2.03 H new ATOM 0 HB ILE A 635 -3.428 -10.508 -8.456 1.00 14.53 H new ATOM 0 HG12 ILE A 635 -5.174 -12.248 -7.934 1.00 52.15 H new ATOM 0 HG13 ILE A 635 -4.182 -12.770 -6.588 1.00 52.15 H new ATOM 0 HG21 ILE A 635 -3.593 -12.696 -9.653 1.00 3.34 H new ATOM 0 HG22 ILE A 635 -1.915 -12.108 -9.577 1.00 3.34 H new ATOM 0 HG23 ILE A 635 -2.455 -13.402 -8.481 1.00 3.34 H new ATOM 0 HD11 ILE A 635 -5.983 -11.313 -5.835 1.00 63.15 H new ATOM 0 HD12 ILE A 635 -4.402 -10.548 -5.545 1.00 63.15 H new ATOM 0 HD13 ILE A 635 -5.410 -10.017 -6.913 1.00 63.15 H new ATOM 2112 N LEU A 636 -2.062 -8.763 -7.210 1.00 50.20 N ATOM 2113 CA LEU A 636 -2.071 -7.420 -6.710 1.00 11.42 C ATOM 2114 C LEU A 636 -3.472 -7.037 -6.235 1.00 50.31 C ATOM 2115 O LEU A 636 -4.461 -7.640 -6.655 1.00 52.15 O ATOM 2116 CB LEU A 636 -1.607 -6.460 -7.777 1.00 73.34 C ATOM 2117 CG LEU A 636 -1.163 -5.110 -7.256 1.00 64.22 C ATOM 2118 CD1 LEU A 636 0.152 -5.228 -6.501 1.00 0.42 C ATOM 2119 CD2 LEU A 636 -1.058 -4.135 -8.367 1.00 2.10 C ATOM 0 H LEU A 636 -2.083 -8.840 -8.227 1.00 50.20 H new ATOM 0 HA LEU A 636 -1.386 -7.363 -5.864 1.00 11.42 H new ATOM 0 HB2 LEU A 636 -0.780 -6.915 -8.323 1.00 73.34 H new ATOM 0 HB3 LEU A 636 -2.417 -6.311 -8.491 1.00 73.34 H new ATOM 0 HG LEU A 636 -1.915 -4.745 -6.556 1.00 64.22 H new ATOM 0 HD11 LEU A 636 0.451 -4.246 -6.136 1.00 0.42 H new ATOM 0 HD12 LEU A 636 0.027 -5.906 -5.657 1.00 0.42 H new ATOM 0 HD13 LEU A 636 0.921 -5.617 -7.168 1.00 0.42 H new ATOM 0 HD21 LEU A 636 -0.738 -3.170 -7.975 1.00 2.10 H new ATOM 0 HD22 LEU A 636 -0.329 -4.491 -9.096 1.00 2.10 H new ATOM 0 HD23 LEU A 636 -2.030 -4.027 -8.849 1.00 2.10 H new ATOM 2131 N GLY A 637 -3.544 -6.040 -5.371 1.00 25.14 N ATOM 2132 CA GLY A 637 -4.792 -5.618 -4.803 1.00 2.45 C ATOM 2133 C GLY A 637 -5.673 -4.794 -5.727 1.00 14.41 C ATOM 2134 O GLY A 637 -6.271 -5.315 -6.663 1.00 22.34 O ATOM 0 H GLY A 637 -2.735 -5.507 -5.050 1.00 25.14 H new ATOM 0 HA2 GLY A 637 -5.348 -6.501 -4.488 1.00 2.45 H new ATOM 0 HA3 GLY A 637 -4.587 -5.034 -3.906 1.00 2.45 H new ATOM 2138 N GLU A 638 -5.755 -3.514 -5.453 1.00 53.21 N ATOM 2139 CA GLU A 638 -6.630 -2.626 -6.189 1.00 34.42 C ATOM 2140 C GLU A 638 -5.824 -1.438 -6.689 1.00 65.54 C ATOM 2141 O GLU A 638 -5.519 -1.331 -7.878 1.00 65.24 O ATOM 2142 CB GLU A 638 -7.772 -2.157 -5.264 1.00 21.12 C ATOM 2143 CG GLU A 638 -8.844 -1.307 -5.922 1.00 41.33 C ATOM 2144 CD GLU A 638 -9.630 -2.070 -6.937 1.00 51.51 C ATOM 2145 OE1 GLU A 638 -10.463 -2.906 -6.548 1.00 61.41 O ATOM 2146 OE2 GLU A 638 -9.436 -1.857 -8.149 1.00 43.40 O ATOM 0 H GLU A 638 -5.219 -3.057 -4.715 1.00 53.21 H new ATOM 0 HA GLU A 638 -7.063 -3.144 -7.044 1.00 34.42 H new ATOM 0 HB2 GLU A 638 -8.247 -3.036 -4.829 1.00 21.12 H new ATOM 0 HB3 GLU A 638 -7.338 -1.589 -4.441 1.00 21.12 H new ATOM 0 HG2 GLU A 638 -9.519 -0.922 -5.158 1.00 41.33 H new ATOM 0 HG3 GLU A 638 -8.378 -0.445 -6.400 1.00 41.33 H new ATOM 2153 N HIS A 639 -5.431 -0.590 -5.773 1.00 10.24 N ATOM 2154 CA HIS A 639 -4.652 0.575 -6.086 1.00 22.14 C ATOM 2155 C HIS A 639 -3.496 0.668 -5.122 1.00 62.13 C ATOM 2156 O HIS A 639 -3.678 0.810 -3.906 1.00 15.30 O ATOM 2157 CB HIS A 639 -5.511 1.880 -6.103 1.00 75.30 C ATOM 2158 CG HIS A 639 -6.291 2.183 -4.839 1.00 60.40 C ATOM 2159 ND1 HIS A 639 -5.893 3.090 -3.876 1.00 73.31 N ATOM 2160 CD2 HIS A 639 -7.483 1.696 -4.412 1.00 10.23 C ATOM 2161 CE1 HIS A 639 -6.832 3.122 -2.926 1.00 12.12 C ATOM 2162 NE2 HIS A 639 -7.819 2.291 -3.205 1.00 21.11 N ATOM 0 H HIS A 639 -5.646 -0.692 -4.781 1.00 10.24 H new ATOM 0 HA HIS A 639 -4.262 0.473 -7.099 1.00 22.14 H new ATOM 0 HB2 HIS A 639 -4.851 2.722 -6.309 1.00 75.30 H new ATOM 0 HB3 HIS A 639 -6.215 1.817 -6.933 1.00 75.30 H new ATOM 0 HD2 HIS A 639 -8.078 0.959 -4.931 1.00 10.23 H new ATOM 0 HE1 HIS A 639 -6.789 3.746 -2.045 1.00 12.12 H new ATOM 0 HE2 HIS A 639 -8.656 2.121 -2.648 1.00 21.11 H new ATOM 2170 N THR A 640 -2.322 0.538 -5.629 1.00 44.12 N ATOM 2171 CA THR A 640 -1.184 0.571 -4.803 1.00 41.42 C ATOM 2172 C THR A 640 -0.557 1.965 -4.837 1.00 3.00 C ATOM 2173 O THR A 640 0.255 2.285 -5.701 1.00 61.04 O ATOM 2174 CB THR A 640 -0.188 -0.539 -5.226 1.00 32.24 C ATOM 2175 OG1 THR A 640 0.069 -0.465 -6.646 1.00 65.01 O ATOM 2176 CG2 THR A 640 -0.778 -1.904 -4.920 1.00 52.41 C ATOM 0 H THR A 640 -2.131 0.407 -6.622 1.00 44.12 H new ATOM 0 HA THR A 640 -1.469 0.369 -3.770 1.00 41.42 H new ATOM 0 HB THR A 640 0.740 -0.396 -4.673 1.00 32.24 H new ATOM 0 HG1 THR A 640 0.262 0.463 -6.896 1.00 65.01 H new ATOM 0 HG21 THR A 640 -0.074 -2.680 -5.219 1.00 52.41 H new ATOM 0 HG22 THR A 640 -0.974 -1.984 -3.851 1.00 52.41 H new ATOM 0 HG23 THR A 640 -1.711 -2.029 -5.470 1.00 52.41 H new ATOM 2184 N LYS A 641 -0.982 2.797 -3.915 1.00 2.33 N ATOM 2185 CA LYS A 641 -0.519 4.162 -3.803 1.00 73.12 C ATOM 2186 C LYS A 641 -1.032 4.756 -2.527 1.00 75.23 C ATOM 2187 O LYS A 641 -2.215 4.642 -2.217 1.00 53.00 O ATOM 2188 CB LYS A 641 -1.023 5.030 -4.983 1.00 74.25 C ATOM 2189 CG LYS A 641 -0.712 6.532 -4.852 1.00 11.11 C ATOM 2190 CD LYS A 641 0.773 6.840 -4.927 1.00 70.21 C ATOM 2191 CE LYS A 641 1.028 8.328 -4.722 1.00 65.10 C ATOM 2192 NZ LYS A 641 0.375 9.182 -5.743 1.00 70.12 N ATOM 0 H LYS A 641 -1.672 2.540 -3.209 1.00 2.33 H new ATOM 0 HA LYS A 641 0.571 4.148 -3.817 1.00 73.12 H new ATOM 0 HB2 LYS A 641 -0.577 4.659 -5.906 1.00 74.25 H new ATOM 0 HB3 LYS A 641 -2.101 4.902 -5.076 1.00 74.25 H new ATOM 0 HG2 LYS A 641 -1.230 7.075 -5.642 1.00 11.11 H new ATOM 0 HG3 LYS A 641 -1.106 6.897 -3.903 1.00 11.11 H new ATOM 0 HD2 LYS A 641 1.307 6.267 -4.169 1.00 70.21 H new ATOM 0 HD3 LYS A 641 1.165 6.529 -5.895 1.00 70.21 H new ATOM 0 HE2 LYS A 641 0.671 8.618 -3.734 1.00 65.10 H new ATOM 0 HE3 LYS A 641 2.102 8.511 -4.739 1.00 65.10 H new ATOM 0 HZ1 LYS A 641 0.642 10.175 -5.587 1.00 70.12 H new ATOM 0 HZ2 LYS A 641 0.682 8.885 -6.691 1.00 70.12 H new ATOM 0 HZ3 LYS A 641 -0.658 9.085 -5.667 1.00 70.12 H new ATOM 2206 N LEU A 642 -0.151 5.334 -1.792 1.00 0.24 N ATOM 2207 CA LEU A 642 -0.495 6.076 -0.636 1.00 62.14 C ATOM 2208 C LEU A 642 0.332 7.330 -0.643 1.00 45.53 C ATOM 2209 O LEU A 642 1.548 7.279 -0.506 1.00 13.51 O ATOM 2210 CB LEU A 642 -0.204 5.295 0.615 1.00 64.31 C ATOM 2211 CG LEU A 642 -0.480 6.028 1.912 1.00 5.12 C ATOM 2212 CD1 LEU A 642 -1.966 6.155 2.197 1.00 41.15 C ATOM 2213 CD2 LEU A 642 0.249 5.388 3.043 1.00 51.13 C ATOM 0 H LEU A 642 0.851 5.303 -1.983 1.00 0.24 H new ATOM 0 HA LEU A 642 -1.561 6.302 -0.648 1.00 62.14 H new ATOM 0 HB2 LEU A 642 -0.797 4.381 0.600 1.00 64.31 H new ATOM 0 HB3 LEU A 642 0.844 4.995 0.602 1.00 64.31 H new ATOM 0 HG LEU A 642 -0.103 7.045 1.801 1.00 5.12 H new ATOM 0 HD11 LEU A 642 -2.112 6.687 3.137 1.00 41.15 H new ATOM 0 HD12 LEU A 642 -2.446 6.707 1.389 1.00 41.15 H new ATOM 0 HD13 LEU A 642 -2.409 5.162 2.270 1.00 41.15 H new ATOM 0 HD21 LEU A 642 0.037 5.929 3.965 1.00 51.13 H new ATOM 0 HD22 LEU A 642 -0.077 4.353 3.147 1.00 51.13 H new ATOM 0 HD23 LEU A 642 1.321 5.413 2.846 1.00 51.13 H new ATOM 2225 N GLU A 643 -0.297 8.414 -0.866 1.00 62.31 N ATOM 2226 CA GLU A 643 0.354 9.676 -0.893 1.00 33.01 C ATOM 2227 C GLU A 643 0.224 10.277 0.499 1.00 54.12 C ATOM 2228 O GLU A 643 -0.864 10.669 0.918 1.00 4.33 O ATOM 2229 CB GLU A 643 -0.322 10.521 -1.963 1.00 2.02 C ATOM 2230 CG GLU A 643 0.414 11.759 -2.410 1.00 30.34 C ATOM 2231 CD GLU A 643 -0.098 12.220 -3.758 1.00 70.32 C ATOM 2232 OE1 GLU A 643 0.412 11.725 -4.789 1.00 20.00 O ATOM 2233 OE2 GLU A 643 -1.039 13.035 -3.826 1.00 31.12 O ATOM 0 H GLU A 643 -1.301 8.459 -1.040 1.00 62.31 H new ATOM 0 HA GLU A 643 1.414 9.610 -1.140 1.00 33.01 H new ATOM 0 HB2 GLU A 643 -0.493 9.892 -2.837 1.00 2.02 H new ATOM 0 HB3 GLU A 643 -1.301 10.822 -1.591 1.00 2.02 H new ATOM 0 HG2 GLU A 643 0.284 12.552 -1.674 1.00 30.34 H new ATOM 0 HG3 GLU A 643 1.482 11.552 -2.471 1.00 30.34 H new ATOM 2240 N VAL A 644 1.300 10.238 1.248 1.00 71.41 N ATOM 2241 CA VAL A 644 1.297 10.727 2.602 1.00 72.14 C ATOM 2242 C VAL A 644 1.793 12.136 2.626 1.00 44.34 C ATOM 2243 O VAL A 644 2.979 12.370 2.411 1.00 74.41 O ATOM 2244 CB VAL A 644 2.237 9.904 3.490 1.00 51.31 C ATOM 2245 CG1 VAL A 644 2.101 10.322 4.945 1.00 51.42 C ATOM 2246 CG2 VAL A 644 2.003 8.420 3.307 1.00 10.51 C ATOM 0 H VAL A 644 2.198 9.868 0.936 1.00 71.41 H new ATOM 0 HA VAL A 644 0.275 10.655 2.974 1.00 72.14 H new ATOM 0 HB VAL A 644 3.263 10.106 3.182 1.00 51.31 H new ATOM 0 HG11 VAL A 644 2.776 9.726 5.559 1.00 51.42 H new ATOM 0 HG12 VAL A 644 2.355 11.377 5.046 1.00 51.42 H new ATOM 0 HG13 VAL A 644 1.074 10.163 5.275 1.00 51.42 H new ATOM 0 HG21 VAL A 644 2.684 7.862 3.950 1.00 10.51 H new ATOM 0 HG22 VAL A 644 0.974 8.178 3.573 1.00 10.51 H new ATOM 0 HG23 VAL A 644 2.182 8.149 2.267 1.00 10.51 H new ATOM 2256 N ILE A 645 0.923 13.062 2.855 1.00 52.11 N ATOM 2257 CA ILE A 645 1.315 14.439 2.940 1.00 24.33 C ATOM 2258 C ILE A 645 1.538 14.755 4.415 1.00 14.13 C ATOM 2259 O ILE A 645 0.667 14.513 5.243 1.00 31.33 O ATOM 2260 CB ILE A 645 0.276 15.438 2.303 1.00 31.41 C ATOM 2261 CG1 ILE A 645 0.005 15.149 0.797 1.00 10.34 C ATOM 2262 CG2 ILE A 645 0.771 16.865 2.447 1.00 12.02 C ATOM 2263 CD1 ILE A 645 -0.868 13.941 0.502 1.00 15.53 C ATOM 0 H ILE A 645 -0.074 12.893 2.988 1.00 52.11 H new ATOM 0 HA ILE A 645 2.225 14.577 2.357 1.00 24.33 H new ATOM 0 HB ILE A 645 -0.660 15.298 2.843 1.00 31.41 H new ATOM 0 HG12 ILE A 645 -0.464 16.029 0.356 1.00 10.34 H new ATOM 0 HG13 ILE A 645 0.963 15.013 0.295 1.00 10.34 H new ATOM 0 HG21 ILE A 645 0.046 17.548 2.004 1.00 12.02 H new ATOM 0 HG22 ILE A 645 0.894 17.102 3.504 1.00 12.02 H new ATOM 0 HG23 ILE A 645 1.729 16.971 1.937 1.00 12.02 H new ATOM 0 HD11 ILE A 645 -0.990 13.835 -0.576 1.00 15.53 H new ATOM 0 HD12 ILE A 645 -0.396 13.044 0.904 1.00 15.53 H new ATOM 0 HD13 ILE A 645 -1.845 14.076 0.966 1.00 15.53 H new ATOM 2275 N ILE A 646 2.702 15.246 4.738 1.00 74.12 N ATOM 2276 CA ILE A 646 3.084 15.474 6.118 1.00 12.21 C ATOM 2277 C ILE A 646 2.997 16.937 6.373 1.00 75.43 C ATOM 2278 O ILE A 646 3.735 17.733 5.751 1.00 60.52 O ATOM 2279 CB ILE A 646 4.546 14.998 6.447 1.00 62.24 C ATOM 2280 CG1 ILE A 646 4.822 13.586 5.920 1.00 21.13 C ATOM 2281 CG2 ILE A 646 4.809 15.042 7.947 1.00 21.43 C ATOM 2282 CD1 ILE A 646 5.093 13.531 4.435 1.00 2.03 C ATOM 0 H ILE A 646 3.418 15.502 4.058 1.00 74.12 H new ATOM 0 HA ILE A 646 2.411 14.895 6.750 1.00 12.21 H new ATOM 0 HB ILE A 646 5.221 15.689 5.942 1.00 62.24 H new ATOM 0 HG12 ILE A 646 5.678 13.171 6.452 1.00 21.13 H new ATOM 0 HG13 ILE A 646 3.967 12.950 6.147 1.00 21.13 H new ATOM 0 HG21 ILE A 646 5.827 14.708 8.148 1.00 21.43 H new ATOM 0 HG22 ILE A 646 4.684 16.063 8.309 1.00 21.43 H new ATOM 0 HG23 ILE A 646 4.104 14.387 8.459 1.00 21.43 H new ATOM 0 HD11 ILE A 646 5.279 12.499 4.137 1.00 2.03 H new ATOM 0 HD12 ILE A 646 4.229 13.915 3.893 1.00 2.03 H new ATOM 0 HD13 ILE A 646 5.967 14.139 4.202 1.00 2.03 H new ATOM 2294 N GLU A 647 2.114 17.309 7.240 1.00 55.45 N ATOM 2295 CA GLU A 647 1.868 18.684 7.489 1.00 45.33 C ATOM 2296 C GLU A 647 2.122 18.988 8.947 1.00 14.22 C ATOM 2297 O GLU A 647 2.292 18.076 9.757 1.00 24.14 O ATOM 2298 CB GLU A 647 0.454 19.058 7.033 1.00 23.55 C ATOM 2299 CG GLU A 647 0.130 18.434 5.678 1.00 55.33 C ATOM 2300 CD GLU A 647 -0.908 19.151 4.889 1.00 52.41 C ATOM 2301 OE1 GLU A 647 -0.554 20.080 4.126 1.00 0.43 O ATOM 2302 OE2 GLU A 647 -2.080 18.774 4.962 1.00 54.11 O ATOM 0 H GLU A 647 1.546 16.667 7.793 1.00 55.45 H new ATOM 0 HA GLU A 647 2.554 19.302 6.909 1.00 45.33 H new ATOM 0 HB2 GLU A 647 -0.271 18.722 7.774 1.00 23.55 H new ATOM 0 HB3 GLU A 647 0.364 20.142 6.968 1.00 23.55 H new ATOM 0 HG2 GLU A 647 1.045 18.387 5.088 1.00 55.33 H new ATOM 0 HG3 GLU A 647 -0.200 17.407 5.837 1.00 55.33 H new ATOM 2309 N GLU A 648 2.154 20.239 9.276 1.00 43.04 N ATOM 2310 CA GLU A 648 2.535 20.681 10.602 1.00 41.14 C ATOM 2311 C GLU A 648 1.502 20.336 11.654 1.00 63.12 C ATOM 2312 O GLU A 648 0.335 20.112 11.340 1.00 3.10 O ATOM 2313 CB GLU A 648 2.771 22.177 10.584 1.00 65.43 C ATOM 2314 CG GLU A 648 3.812 22.597 9.575 1.00 2.44 C ATOM 2315 CD GLU A 648 5.139 21.939 9.816 1.00 10.31 C ATOM 2316 OE1 GLU A 648 5.919 22.429 10.636 1.00 34.24 O ATOM 2317 OE2 GLU A 648 5.471 20.901 9.156 1.00 51.02 O ATOM 0 H GLU A 648 1.917 20.997 8.636 1.00 43.04 H new ATOM 0 HA GLU A 648 3.450 20.154 10.871 1.00 41.14 H new ATOM 0 HB2 GLU A 648 1.832 22.685 10.362 1.00 65.43 H new ATOM 0 HB3 GLU A 648 3.083 22.502 11.577 1.00 65.43 H new ATOM 0 HG2 GLU A 648 3.463 22.349 8.572 1.00 2.44 H new ATOM 0 HG3 GLU A 648 3.934 23.680 9.612 1.00 2.44 H new ATOM 2324 N SER A 649 1.943 20.283 12.899 1.00 3.12 N ATOM 2325 CA SER A 649 1.066 20.065 14.019 1.00 2.55 C ATOM 2326 C SER A 649 0.332 21.389 14.264 1.00 31.31 C ATOM 2327 O SER A 649 0.795 22.260 15.011 1.00 64.02 O ATOM 2328 CB SER A 649 1.886 19.611 15.257 1.00 33.40 C ATOM 2329 OG SER A 649 1.073 19.188 16.349 1.00 33.45 O ATOM 0 H SER A 649 2.925 20.391 13.155 1.00 3.12 H new ATOM 0 HA SER A 649 0.344 19.273 13.823 1.00 2.55 H new ATOM 0 HB2 SER A 649 2.546 18.794 14.967 1.00 33.40 H new ATOM 0 HB3 SER A 649 2.522 20.434 15.584 1.00 33.40 H new ATOM 0 HG SER A 649 1.645 18.914 17.096 1.00 33.45 H new ATOM 2335 N TYR A 650 -0.740 21.554 13.536 1.00 22.23 N ATOM 2336 CA TYR A 650 -1.526 22.751 13.491 1.00 54.23 C ATOM 2337 C TYR A 650 -2.880 22.406 12.874 1.00 60.13 C ATOM 2338 O TYR A 650 -3.913 22.396 13.564 1.00 74.42 O ATOM 2339 CB TYR A 650 -0.758 23.829 12.659 1.00 42.12 C ATOM 2340 CG TYR A 650 -1.597 24.977 12.141 1.00 43.53 C ATOM 2341 CD1 TYR A 650 -2.016 26.009 12.965 1.00 44.21 C ATOM 2342 CD2 TYR A 650 -1.990 24.995 10.813 1.00 5.23 C ATOM 2343 CE1 TYR A 650 -2.804 27.027 12.467 1.00 71.13 C ATOM 2344 CE2 TYR A 650 -2.775 25.989 10.316 1.00 42.45 C ATOM 2345 CZ TYR A 650 -3.183 27.005 11.140 1.00 61.45 C ATOM 2346 OH TYR A 650 -3.995 27.985 10.642 1.00 43.12 O ATOM 0 H TYR A 650 -1.104 20.819 12.930 1.00 22.23 H new ATOM 0 HA TYR A 650 -1.695 23.160 14.487 1.00 54.23 H new ATOM 0 HB2 TYR A 650 0.042 24.237 13.277 1.00 42.12 H new ATOM 0 HB3 TYR A 650 -0.284 23.337 11.810 1.00 42.12 H new ATOM 0 HD1 TYR A 650 -1.724 26.017 14.005 1.00 44.21 H new ATOM 0 HD2 TYR A 650 -1.666 24.201 10.156 1.00 5.23 H new ATOM 0 HE1 TYR A 650 -3.121 27.834 13.110 1.00 71.13 H new ATOM 0 HE2 TYR A 650 -3.075 25.977 9.278 1.00 42.45 H new ATOM 0 HH TYR A 650 -4.874 27.606 10.432 1.00 43.12 H new ATOM 2356 N GLU A 651 -2.851 22.057 11.606 1.00 43.43 N ATOM 2357 CA GLU A 651 -4.007 21.674 10.816 1.00 31.44 C ATOM 2358 C GLU A 651 -3.479 20.946 9.620 1.00 52.44 C ATOM 2359 O GLU A 651 -2.269 20.720 9.520 1.00 44.23 O ATOM 2360 CB GLU A 651 -4.838 22.875 10.305 1.00 70.10 C ATOM 2361 CG GLU A 651 -5.575 23.695 11.344 1.00 11.11 C ATOM 2362 CD GLU A 651 -6.464 24.722 10.705 1.00 53.12 C ATOM 2363 OE1 GLU A 651 -6.006 25.855 10.452 1.00 64.31 O ATOM 2364 OE2 GLU A 651 -7.631 24.406 10.421 1.00 74.34 O ATOM 0 H GLU A 651 -1.983 22.031 11.071 1.00 43.43 H new ATOM 0 HA GLU A 651 -4.666 21.078 11.447 1.00 31.44 H new ATOM 0 HB2 GLU A 651 -4.170 23.541 9.760 1.00 70.10 H new ATOM 0 HB3 GLU A 651 -5.569 22.500 9.589 1.00 70.10 H new ATOM 0 HG2 GLU A 651 -6.173 23.035 11.973 1.00 11.11 H new ATOM 0 HG3 GLU A 651 -4.855 24.190 11.996 1.00 11.11 H new ATOM 2371 N PHE A 652 -4.347 20.617 8.718 1.00 33.44 N ATOM 2372 CA PHE A 652 -3.994 19.966 7.533 1.00 50.35 C ATOM 2373 C PHE A 652 -4.541 20.756 6.386 1.00 12.00 C ATOM 2374 O PHE A 652 -5.521 21.503 6.535 1.00 44.52 O ATOM 2375 CB PHE A 652 -4.566 18.560 7.507 1.00 5.14 C ATOM 2376 CG PHE A 652 -4.006 17.650 8.553 1.00 11.24 C ATOM 2377 CD1 PHE A 652 -2.708 17.193 8.460 1.00 54.40 C ATOM 2378 CD2 PHE A 652 -4.771 17.263 9.637 1.00 40.54 C ATOM 2379 CE1 PHE A 652 -2.185 16.366 9.421 1.00 42.04 C ATOM 2380 CE2 PHE A 652 -4.250 16.434 10.605 1.00 12.20 C ATOM 2381 CZ PHE A 652 -2.954 15.983 10.496 1.00 13.14 C ATOM 0 H PHE A 652 -5.346 20.807 8.804 1.00 33.44 H new ATOM 0 HA PHE A 652 -2.909 19.892 7.463 1.00 50.35 H new ATOM 0 HB2 PHE A 652 -5.647 18.618 7.633 1.00 5.14 H new ATOM 0 HB3 PHE A 652 -4.382 18.123 6.525 1.00 5.14 H new ATOM 0 HD1 PHE A 652 -2.096 17.490 7.621 1.00 54.40 H new ATOM 0 HD2 PHE A 652 -5.788 17.615 9.726 1.00 40.54 H new ATOM 0 HE1 PHE A 652 -1.167 16.015 9.334 1.00 42.04 H new ATOM 0 HE2 PHE A 652 -4.857 16.138 11.448 1.00 12.20 H new ATOM 0 HZ PHE A 652 -2.542 15.331 11.252 1.00 13.14 H new ATOM 2391 N LYS A 653 -3.925 20.621 5.282 1.00 14.31 N ATOM 2392 CA LYS A 653 -4.339 21.251 4.084 1.00 32.11 C ATOM 2393 C LYS A 653 -4.723 20.140 3.150 1.00 72.33 C ATOM 2394 O LYS A 653 -4.001 19.830 2.197 1.00 52.11 O ATOM 2395 CB LYS A 653 -3.200 22.091 3.488 1.00 24.10 C ATOM 2396 CG LYS A 653 -2.651 23.173 4.409 1.00 21.31 C ATOM 2397 CD LYS A 653 -3.637 24.307 4.628 1.00 63.53 C ATOM 2398 CE LYS A 653 -3.023 25.378 5.512 1.00 60.14 C ATOM 2399 NZ LYS A 653 -3.921 26.533 5.708 1.00 53.13 N ATOM 0 H LYS A 653 -3.087 20.049 5.176 1.00 14.31 H new ATOM 0 HA LYS A 653 -5.171 21.933 4.259 1.00 32.11 H new ATOM 0 HB2 LYS A 653 -2.384 21.424 3.208 1.00 24.10 H new ATOM 0 HB3 LYS A 653 -3.556 22.561 2.571 1.00 24.10 H new ATOM 0 HG2 LYS A 653 -2.393 22.730 5.371 1.00 21.31 H new ATOM 0 HG3 LYS A 653 -1.730 23.574 3.985 1.00 21.31 H new ATOM 0 HD2 LYS A 653 -3.924 24.738 3.669 1.00 63.53 H new ATOM 0 HD3 LYS A 653 -4.547 23.923 5.090 1.00 63.53 H new ATOM 0 HE2 LYS A 653 -2.775 24.946 6.482 1.00 60.14 H new ATOM 0 HE3 LYS A 653 -2.089 25.720 5.067 1.00 60.14 H new ATOM 0 HZ1 LYS A 653 -3.456 27.235 6.318 1.00 53.13 H new ATOM 0 HZ2 LYS A 653 -4.138 26.964 4.787 1.00 53.13 H new ATOM 0 HZ3 LYS A 653 -4.803 26.215 6.157 1.00 53.13 H new ATOM 2413 N SER A 654 -5.798 19.459 3.508 1.00 2.42 N ATOM 2414 CA SER A 654 -6.289 18.330 2.762 1.00 15.32 C ATOM 2415 C SER A 654 -6.680 18.754 1.362 1.00 72.22 C ATOM 2416 O SER A 654 -7.765 19.259 1.134 1.00 24.14 O ATOM 2417 CB SER A 654 -7.462 17.690 3.499 1.00 75.24 C ATOM 2418 OG SER A 654 -7.073 17.305 4.817 1.00 41.32 O ATOM 0 H SER A 654 -6.354 19.682 4.333 1.00 2.42 H new ATOM 0 HA SER A 654 -5.498 17.586 2.674 1.00 15.32 H new ATOM 0 HB2 SER A 654 -8.294 18.392 3.549 1.00 75.24 H new ATOM 0 HB3 SER A 654 -7.814 16.818 2.948 1.00 75.24 H new ATOM 0 HG SER A 654 -7.836 16.898 5.278 1.00 41.32 H new ATOM 2424 N THR A 655 -5.762 18.599 0.452 1.00 40.11 N ATOM 2425 CA THR A 655 -5.965 19.003 -0.878 1.00 42.23 C ATOM 2426 C THR A 655 -6.451 17.860 -1.745 1.00 21.14 C ATOM 2427 O THR A 655 -5.678 17.188 -2.435 1.00 1.14 O ATOM 2428 CB THR A 655 -4.717 19.748 -1.482 1.00 32.54 C ATOM 2429 OG1 THR A 655 -4.904 20.035 -2.879 1.00 34.12 O ATOM 2430 CG2 THR A 655 -3.423 18.955 -1.281 1.00 21.21 C ATOM 0 H THR A 655 -4.848 18.183 0.631 1.00 40.11 H new ATOM 0 HA THR A 655 -6.766 19.742 -0.866 1.00 42.23 H new ATOM 0 HB THR A 655 -4.625 20.689 -0.940 1.00 32.54 H new ATOM 0 HG1 THR A 655 -4.114 20.499 -3.226 1.00 34.12 H new ATOM 0 HG21 THR A 655 -2.588 19.506 -1.713 1.00 21.21 H new ATOM 0 HG22 THR A 655 -3.248 18.808 -0.215 1.00 21.21 H new ATOM 0 HG23 THR A 655 -3.510 17.986 -1.771 1.00 21.21 H new ATOM 2438 N VAL A 656 -7.724 17.591 -1.656 1.00 4.42 N ATOM 2439 CA VAL A 656 -8.331 16.651 -2.526 1.00 51.24 C ATOM 2440 C VAL A 656 -8.822 17.434 -3.726 1.00 12.32 C ATOM 2441 O VAL A 656 -9.964 17.909 -3.813 1.00 42.42 O ATOM 2442 CB VAL A 656 -9.417 15.772 -1.833 1.00 2.32 C ATOM 2443 CG1 VAL A 656 -10.490 16.595 -1.132 1.00 21.34 C ATOM 2444 CG2 VAL A 656 -10.026 14.774 -2.806 1.00 24.45 C ATOM 0 H VAL A 656 -8.357 18.019 -0.980 1.00 4.42 H new ATOM 0 HA VAL A 656 -7.610 15.900 -2.850 1.00 51.24 H new ATOM 0 HB VAL A 656 -8.905 15.211 -1.051 1.00 2.32 H new ATOM 0 HG11 VAL A 656 -11.216 15.927 -0.669 1.00 21.34 H new ATOM 0 HG12 VAL A 656 -10.028 17.217 -0.365 1.00 21.34 H new ATOM 0 HG13 VAL A 656 -10.994 17.231 -1.860 1.00 21.34 H new ATOM 0 HG21 VAL A 656 -10.779 14.177 -2.291 1.00 24.45 H new ATOM 0 HG22 VAL A 656 -10.491 15.310 -3.633 1.00 24.45 H new ATOM 0 HG23 VAL A 656 -9.245 14.119 -3.192 1.00 24.45 H new ATOM 2454 N ASP A 657 -7.893 17.653 -4.592 1.00 22.02 N ATOM 2455 CA ASP A 657 -8.059 18.562 -5.710 1.00 73.21 C ATOM 2456 C ASP A 657 -8.025 17.787 -7.013 1.00 4.43 C ATOM 2457 O ASP A 657 -7.732 16.571 -6.999 1.00 31.32 O ATOM 2458 CB ASP A 657 -6.907 19.575 -5.666 1.00 32.53 C ATOM 2459 CG ASP A 657 -7.143 20.820 -6.481 1.00 32.13 C ATOM 2460 OD1 ASP A 657 -6.981 20.792 -7.715 1.00 51.00 O ATOM 2461 OD2 ASP A 657 -7.449 21.871 -5.876 1.00 55.14 O ATOM 0 H ASP A 657 -6.977 17.206 -4.556 1.00 22.02 H new ATOM 0 HA ASP A 657 -9.017 19.078 -5.645 1.00 73.21 H new ATOM 0 HB2 ASP A 657 -6.731 19.862 -4.629 1.00 32.53 H new ATOM 0 HB3 ASP A 657 -5.998 19.089 -6.021 1.00 32.53 H new TER 2466 ASP A 657 HETATM 2467 CA CA A 800 7.185 20.558 9.194 1.00 14.05 CA HETATM 2468 CA CA A 850 11.968 18.444 7.031 1.00 53.32 CA