USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 953 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 549 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 559 GLN : amide:sc= -1.24 K(o=-1.2,f=-2.8!) USER MOD Set 2.1: A 508 THR OG1 : rot -49:sc= 1.28 USER MOD Set 2.2: A 533 HIS :FLIP no HD1:sc= 0.892 F(o=-1.7,f=2.2) USER MOD Set 3.1: A 476 TYR OH : rot -30:sc= -2.14! USER MOD Set 3.2: A 497 TYR OH : rot -83:sc= -1.31 USER MOD Set 3.3: A 544 SER OG : rot -175:sc= -0.131 USER MOD Set 4.1: A 489 HIS : no HD1:sc= -0.111 X(o=-3.8,f=-3.8) USER MOD Set 4.2: A 493 MET CE :methyl -153:sc= -3.7! (180deg=-4.79!) USER MOD Single : A 464 MET CE :methyl -148:sc= -0.234 (180deg=-0.931) USER MOD Single : A 466 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 475 ASN :FLIP amide:sc= -1.89 F(o=-5.3!,f=-1.9) USER MOD Single : A 478 THR OG1 : rot 61:sc= 0.702 USER MOD Single : A 481 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 492 ASN :FLIP amide:sc= -0.0678 F(o=-0.74,f=-0.068) USER MOD Single : A 495 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 502 GLN : amide:sc= -0.0424 X(o=-0.042,f=0) USER MOD Single : A 503 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 506 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 507 HIS :FLIP no HD1:sc= -1.34 F(o=-4.8!,f=-1.3) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 514 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 517 MET CE :methyl -168:sc= 0 (180deg=-0.107) USER MOD Single : A 521 LYS NZ :NH3+ -159:sc= -1.59 (180deg=-2.72) USER MOD Single : A 522 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 525 GLN : amide:sc= -0.315 X(o=-0.32,f=0) USER MOD Single : A 528 SER OG : rot 180:sc= 0.00824 USER MOD Single : A 529 GLN : amide:sc= -0.0412 X(o=-0.041,f=0) USER MOD Single : A 531 MET CE :methyl 141:sc= -0.134 (180deg=-2.62!) USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 TYR OH : rot 180:sc= 0 USER MOD Single : A 541 MET CE :methyl -116:sc= -3.43 (180deg=-6!) USER MOD Single : A 542 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.01) USER MOD Single : A 543 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 546 SER OG : rot 180:sc= 0 USER MOD Single : A 550 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.2) USER MOD Single : A 567 GLN : amide:sc= -2.14 K(o=-2.1,f=-3.2!) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 460 -6.962 -0.693 -14.545 1.00 0.00 N ATOM 2 CA ARG A 460 -7.228 0.581 -13.827 1.00 0.00 C ATOM 3 C ARG A 460 -5.985 1.071 -13.092 1.00 0.00 C ATOM 4 O ARG A 460 -5.740 2.273 -12.999 1.00 0.00 O ATOM 5 CB ARG A 460 -8.371 0.351 -12.835 1.00 0.00 C ATOM 6 CG ARG A 460 -9.737 0.733 -13.382 1.00 0.00 C ATOM 7 CD ARG A 460 -10.735 0.979 -12.263 1.00 0.00 C ATOM 8 NE ARG A 460 -12.086 1.201 -12.773 1.00 0.00 N ATOM 9 CZ ARG A 460 -12.497 2.347 -13.307 1.00 0.00 C ATOM 10 NH1 ARG A 460 -11.668 3.379 -13.402 1.00 0.00 N ATOM 11 NH2 ARG A 460 -13.743 2.465 -13.748 1.00 0.00 N ATOM 0 HA ARG A 460 -7.505 1.348 -14.550 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -8.385 -0.700 -12.547 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -8.177 0.927 -11.930 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -9.647 1.630 -13.995 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -10.105 -0.061 -14.032 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -10.739 0.124 -11.586 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -10.420 1.845 -11.681 1.00 0.00 H new ATOM 0 HE ARG A 460 -12.753 0.431 -12.716 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -10.709 3.296 -13.064 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -11.990 4.255 -13.813 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -14.386 1.676 -13.677 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -14.058 3.344 -14.158 1.00 0.00 H new ATOM 27 N VAL A 461 -5.201 0.130 -12.572 1.00 0.00 N ATOM 28 CA VAL A 461 -3.982 0.467 -11.847 1.00 0.00 C ATOM 29 C VAL A 461 -3.017 1.251 -12.731 1.00 0.00 C ATOM 30 O VAL A 461 -2.427 2.239 -12.297 1.00 0.00 O ATOM 31 CB VAL A 461 -3.272 -0.796 -11.322 1.00 0.00 C ATOM 32 CG1 VAL A 461 -1.946 -0.437 -10.666 1.00 0.00 C ATOM 33 CG2 VAL A 461 -4.170 -1.547 -10.350 1.00 0.00 C ATOM 0 H VAL A 461 -5.389 -0.870 -12.640 1.00 0.00 H new ATOM 0 HA VAL A 461 -4.278 1.085 -10.999 1.00 0.00 H new ATOM 0 HB VAL A 461 -3.063 -1.449 -12.169 1.00 0.00 H new ATOM 0 HG11 VAL A 461 -1.462 -1.344 -10.303 1.00 0.00 H new ATOM 0 HG12 VAL A 461 -1.300 0.052 -11.395 1.00 0.00 H new ATOM 0 HG13 VAL A 461 -2.125 0.239 -9.830 1.00 0.00 H new ATOM 0 HG21 VAL A 461 -3.653 -2.436 -9.989 1.00 0.00 H new ATOM 0 HG22 VAL A 461 -4.413 -0.901 -9.506 1.00 0.00 H new ATOM 0 HG23 VAL A 461 -5.088 -1.842 -10.857 1.00 0.00 H new ATOM 43 N GLU A 462 -2.859 0.802 -13.972 1.00 0.00 N ATOM 44 CA GLU A 462 -1.960 1.463 -14.913 1.00 0.00 C ATOM 45 C GLU A 462 -2.256 2.955 -14.983 1.00 0.00 C ATOM 46 O GLU A 462 -1.347 3.785 -14.965 1.00 0.00 O ATOM 47 CB GLU A 462 -2.081 0.844 -16.310 1.00 0.00 C ATOM 48 CG GLU A 462 -3.481 0.360 -16.657 1.00 0.00 C ATOM 49 CD GLU A 462 -3.662 0.118 -18.143 1.00 0.00 C ATOM 50 OE1 GLU A 462 -3.740 1.107 -18.901 1.00 0.00 O ATOM 51 OE2 GLU A 462 -3.724 -1.062 -18.549 1.00 0.00 O ATOM 0 H GLU A 462 -3.340 -0.014 -14.349 1.00 0.00 H new ATOM 0 HA GLU A 462 -0.940 1.322 -14.554 1.00 0.00 H new ATOM 0 HB2 GLU A 462 -1.769 1.581 -17.050 1.00 0.00 H new ATOM 0 HB3 GLU A 462 -1.389 0.005 -16.385 1.00 0.00 H new ATOM 0 HG2 GLU A 462 -3.687 -0.563 -16.114 1.00 0.00 H new ATOM 0 HG3 GLU A 462 -4.210 1.097 -16.321 1.00 0.00 H new ATOM 58 N ALA A 463 -3.538 3.287 -15.055 1.00 0.00 N ATOM 59 CA ALA A 463 -3.966 4.679 -15.120 1.00 0.00 C ATOM 60 C ALA A 463 -3.601 5.419 -13.839 1.00 0.00 C ATOM 61 O ALA A 463 -3.329 6.619 -13.858 1.00 0.00 O ATOM 62 CB ALA A 463 -5.465 4.759 -15.371 1.00 0.00 C ATOM 0 H ALA A 463 -4.301 2.611 -15.070 1.00 0.00 H new ATOM 0 HA ALA A 463 -3.446 5.159 -15.949 1.00 0.00 H new ATOM 0 HB1 ALA A 463 -5.771 5.804 -15.417 1.00 0.00 H new ATOM 0 HB2 ALA A 463 -5.702 4.269 -16.315 1.00 0.00 H new ATOM 0 HB3 ALA A 463 -5.997 4.261 -14.560 1.00 0.00 H new ATOM 68 N MET A 464 -3.592 4.692 -12.725 1.00 0.00 N ATOM 69 CA MET A 464 -3.256 5.278 -11.433 1.00 0.00 C ATOM 70 C MET A 464 -1.800 5.728 -11.406 1.00 0.00 C ATOM 71 O MET A 464 -1.469 6.761 -10.824 1.00 0.00 O ATOM 72 CB MET A 464 -3.512 4.271 -10.309 1.00 0.00 C ATOM 73 CG MET A 464 -4.955 3.796 -10.235 1.00 0.00 C ATOM 74 SD MET A 464 -5.886 4.602 -8.917 1.00 0.00 S ATOM 75 CE MET A 464 -4.994 4.030 -7.473 1.00 0.00 C ATOM 0 H MET A 464 -3.814 3.697 -12.692 1.00 0.00 H new ATOM 0 HA MET A 464 -3.892 6.150 -11.280 1.00 0.00 H new ATOM 0 HB2 MET A 464 -2.861 3.408 -10.450 1.00 0.00 H new ATOM 0 HB3 MET A 464 -3.238 4.725 -9.356 1.00 0.00 H new ATOM 0 HG2 MET A 464 -5.445 3.987 -11.190 1.00 0.00 H new ATOM 0 HG3 MET A 464 -4.971 2.717 -10.078 1.00 0.00 H new ATOM 0 HE1 MET A 464 -5.684 3.931 -6.635 1.00 0.00 H new ATOM 0 HE2 MET A 464 -4.540 3.062 -7.685 1.00 0.00 H new ATOM 0 HE3 MET A 464 -4.214 4.748 -7.219 1.00 0.00 H new ATOM 85 N LEU A 465 -0.934 4.945 -12.043 1.00 0.00 N ATOM 86 CA LEU A 465 0.488 5.264 -12.097 1.00 0.00 C ATOM 87 C LEU A 465 0.723 6.551 -12.880 1.00 0.00 C ATOM 88 O LEU A 465 1.577 7.361 -12.520 1.00 0.00 O ATOM 89 CB LEU A 465 1.266 4.113 -12.737 1.00 0.00 C ATOM 90 CG LEU A 465 1.253 2.804 -11.946 1.00 0.00 C ATOM 91 CD1 LEU A 465 1.230 1.610 -12.888 1.00 0.00 C ATOM 92 CD2 LEU A 465 2.457 2.731 -11.020 1.00 0.00 C ATOM 0 H LEU A 465 -1.192 4.086 -12.528 1.00 0.00 H new ATOM 0 HA LEU A 465 0.844 5.409 -11.077 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.855 3.924 -13.729 1.00 0.00 H new ATOM 0 HB3 LEU A 465 2.301 4.426 -12.875 1.00 0.00 H new ATOM 0 HG LEU A 465 0.349 2.778 -11.338 1.00 0.00 H new ATOM 0 HD11 LEU A 465 1.221 0.688 -12.307 1.00 0.00 H new ATOM 0 HD12 LEU A 465 0.337 1.655 -13.511 1.00 0.00 H new ATOM 0 HD13 LEU A 465 2.116 1.630 -13.523 1.00 0.00 H new ATOM 0 HD21 LEU A 465 2.432 1.793 -10.465 1.00 0.00 H new ATOM 0 HD22 LEU A 465 3.373 2.780 -11.609 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.430 3.567 -10.321 1.00 0.00 H new ATOM 104 N ASN A 466 -0.041 6.733 -13.951 1.00 0.00 N ATOM 105 CA ASN A 466 0.081 7.923 -14.786 1.00 0.00 C ATOM 106 C ASN A 466 -0.270 9.177 -13.992 1.00 0.00 C ATOM 107 O ASN A 466 0.370 10.217 -14.142 1.00 0.00 O ATOM 108 CB ASN A 466 -0.827 7.809 -16.011 1.00 0.00 C ATOM 109 CG ASN A 466 -0.107 7.225 -17.211 1.00 0.00 C ATOM 110 OD1 ASN A 466 0.294 7.950 -18.122 1.00 0.00 O ATOM 111 ND2 ASN A 466 0.059 5.908 -17.219 1.00 0.00 N ATOM 0 H ASN A 466 -0.752 6.071 -14.262 1.00 0.00 H new ATOM 0 HA ASN A 466 1.116 8.001 -15.119 1.00 0.00 H new ATOM 0 HB2 ASN A 466 -1.686 7.184 -15.766 1.00 0.00 H new ATOM 0 HB3 ASN A 466 -1.213 8.796 -16.267 1.00 0.00 H new ATOM 0 HD21 ASN A 466 0.535 5.459 -18.001 1.00 0.00 H new ATOM 0 HD22 ASN A 466 -0.289 5.345 -16.443 1.00 0.00 H new ATOM 118 N ASP A 467 -1.289 9.069 -13.145 1.00 0.00 N ATOM 119 CA ASP A 467 -1.722 10.194 -12.325 1.00 0.00 C ATOM 120 C ASP A 467 -0.619 10.612 -11.359 1.00 0.00 C ATOM 121 O ASP A 467 -0.266 11.788 -11.275 1.00 0.00 O ATOM 122 CB ASP A 467 -2.988 9.830 -11.547 1.00 0.00 C ATOM 123 CG ASP A 467 -3.965 10.985 -11.460 1.00 0.00 C ATOM 124 OD1 ASP A 467 -4.446 11.437 -12.521 1.00 0.00 O ATOM 125 OD2 ASP A 467 -4.250 11.438 -10.332 1.00 0.00 O ATOM 0 H ASP A 467 -1.829 8.215 -13.009 1.00 0.00 H new ATOM 0 HA ASP A 467 -1.942 11.032 -12.986 1.00 0.00 H new ATOM 0 HB2 ASP A 467 -3.475 8.981 -12.027 1.00 0.00 H new ATOM 0 HB3 ASP A 467 -2.714 9.513 -10.541 1.00 0.00 H new ATOM 130 N ARG A 468 -0.074 9.639 -10.636 1.00 0.00 N ATOM 131 CA ARG A 468 0.994 9.902 -9.679 1.00 0.00 C ATOM 132 C ARG A 468 2.188 10.556 -10.369 1.00 0.00 C ATOM 133 O ARG A 468 2.931 11.321 -9.754 1.00 0.00 O ATOM 134 CB ARG A 468 1.431 8.603 -9.001 1.00 0.00 C ATOM 135 CG ARG A 468 0.345 7.966 -8.150 1.00 0.00 C ATOM 136 CD ARG A 468 0.634 6.497 -7.884 1.00 0.00 C ATOM 137 NE ARG A 468 0.108 6.059 -6.594 1.00 0.00 N ATOM 138 CZ ARG A 468 0.510 4.958 -5.964 1.00 0.00 C ATOM 139 NH1 ARG A 468 1.439 4.179 -6.505 1.00 0.00 N ATOM 140 NH2 ARG A 468 -0.019 4.634 -4.793 1.00 0.00 N ATOM 0 H ARG A 468 -0.355 8.660 -10.695 1.00 0.00 H new ATOM 0 HA ARG A 468 0.612 10.587 -8.922 1.00 0.00 H new ATOM 0 HB2 ARG A 468 1.746 7.892 -9.765 1.00 0.00 H new ATOM 0 HB3 ARG A 468 2.300 8.804 -8.375 1.00 0.00 H new ATOM 0 HG2 ARG A 468 0.264 8.499 -7.203 1.00 0.00 H new ATOM 0 HG3 ARG A 468 -0.617 8.063 -8.653 1.00 0.00 H new ATOM 0 HD2 ARG A 468 0.196 5.892 -8.678 1.00 0.00 H new ATOM 0 HD3 ARG A 468 1.711 6.329 -7.912 1.00 0.00 H new ATOM 0 HE ARG A 468 -0.610 6.631 -6.150 1.00 0.00 H new ATOM 0 HH11 ARG A 468 1.848 4.424 -7.407 1.00 0.00 H new ATOM 0 HH12 ARG A 468 1.744 3.336 -6.019 1.00 0.00 H new ATOM 0 HH21 ARG A 468 -0.734 5.229 -4.375 1.00 0.00 H new ATOM 0 HH22 ARG A 468 0.289 3.790 -4.310 1.00 0.00 H new ATOM 154 N ARG A 469 2.361 10.253 -11.650 1.00 0.00 N ATOM 155 CA ARG A 469 3.460 10.811 -12.428 1.00 0.00 C ATOM 156 C ARG A 469 3.068 12.157 -13.029 1.00 0.00 C ATOM 157 O ARG A 469 3.875 13.085 -13.075 1.00 0.00 O ATOM 158 CB ARG A 469 3.868 9.838 -13.537 1.00 0.00 C ATOM 159 CG ARG A 469 4.942 10.379 -14.466 1.00 0.00 C ATOM 160 CD ARG A 469 5.810 9.261 -15.024 1.00 0.00 C ATOM 161 NE ARG A 469 5.317 8.775 -16.311 1.00 0.00 N ATOM 162 CZ ARG A 469 5.353 7.498 -16.691 1.00 0.00 C ATOM 163 NH1 ARG A 469 5.870 6.570 -15.895 1.00 0.00 N ATOM 164 NH2 ARG A 469 4.875 7.149 -17.878 1.00 0.00 N ATOM 0 H ARG A 469 1.753 9.623 -12.173 1.00 0.00 H new ATOM 0 HA ARG A 469 4.308 10.966 -11.762 1.00 0.00 H new ATOM 0 HB2 ARG A 469 4.226 8.914 -13.083 1.00 0.00 H new ATOM 0 HB3 ARG A 469 2.987 9.583 -14.126 1.00 0.00 H new ATOM 0 HG2 ARG A 469 4.475 10.923 -15.287 1.00 0.00 H new ATOM 0 HG3 ARG A 469 5.566 11.091 -13.927 1.00 0.00 H new ATOM 0 HD2 ARG A 469 6.833 9.620 -15.140 1.00 0.00 H new ATOM 0 HD3 ARG A 469 5.840 8.436 -14.312 1.00 0.00 H new ATOM 0 HE ARG A 469 4.921 9.456 -16.959 1.00 0.00 H new ATOM 0 HH11 ARG A 469 6.245 6.831 -14.983 1.00 0.00 H new ATOM 0 HH12 ARG A 469 5.893 5.595 -16.195 1.00 0.00 H new ATOM 0 HH21 ARG A 469 4.481 7.857 -18.497 1.00 0.00 H new ATOM 0 HH22 ARG A 469 4.901 6.172 -18.171 1.00 0.00 H new ATOM 178 N ARG A 470 1.824 12.255 -13.483 1.00 0.00 N ATOM 179 CA ARG A 470 1.324 13.487 -14.076 1.00 0.00 C ATOM 180 C ARG A 470 1.267 14.594 -13.026 1.00 0.00 C ATOM 181 O ARG A 470 1.741 15.706 -13.256 1.00 0.00 O ATOM 182 CB ARG A 470 -0.058 13.244 -14.699 1.00 0.00 C ATOM 183 CG ARG A 470 -0.951 14.475 -14.752 1.00 0.00 C ATOM 184 CD ARG A 470 -1.876 14.534 -13.550 1.00 0.00 C ATOM 185 NE ARG A 470 -2.083 15.903 -13.083 1.00 0.00 N ATOM 186 CZ ARG A 470 -2.902 16.771 -13.672 1.00 0.00 C ATOM 187 NH1 ARG A 470 -3.593 16.417 -14.748 1.00 0.00 N ATOM 188 NH2 ARG A 470 -3.030 17.998 -13.184 1.00 0.00 N ATOM 0 H ARG A 470 1.144 11.495 -13.451 1.00 0.00 H new ATOM 0 HA ARG A 470 2.004 13.807 -14.865 1.00 0.00 H new ATOM 0 HB2 ARG A 470 0.076 12.864 -15.712 1.00 0.00 H new ATOM 0 HB3 ARG A 470 -0.567 12.465 -14.131 1.00 0.00 H new ATOM 0 HG2 ARG A 470 -0.335 15.373 -14.784 1.00 0.00 H new ATOM 0 HG3 ARG A 470 -1.541 14.460 -15.668 1.00 0.00 H new ATOM 0 HD2 ARG A 470 -2.837 14.091 -13.811 1.00 0.00 H new ATOM 0 HD3 ARG A 470 -1.458 13.935 -12.741 1.00 0.00 H new ATOM 0 HE ARG A 470 -1.570 16.211 -12.257 1.00 0.00 H new ATOM 0 HH11 ARG A 470 -3.498 15.475 -15.128 1.00 0.00 H new ATOM 0 HH12 ARG A 470 -4.219 17.087 -15.195 1.00 0.00 H new ATOM 0 HH21 ARG A 470 -2.501 18.276 -12.358 1.00 0.00 H new ATOM 0 HH22 ARG A 470 -3.658 18.663 -13.635 1.00 0.00 H new ATOM 202 N LEU A 471 0.690 14.280 -11.870 1.00 0.00 N ATOM 203 CA LEU A 471 0.584 15.248 -10.788 1.00 0.00 C ATOM 204 C LEU A 471 1.969 15.616 -10.266 1.00 0.00 C ATOM 205 O LEU A 471 2.245 16.782 -9.991 1.00 0.00 O ATOM 206 CB LEU A 471 -0.294 14.703 -9.654 1.00 0.00 C ATOM 207 CG LEU A 471 0.375 13.683 -8.729 1.00 0.00 C ATOM 208 CD1 LEU A 471 0.981 14.376 -7.519 1.00 0.00 C ATOM 209 CD2 LEU A 471 -0.627 12.625 -8.290 1.00 0.00 C ATOM 0 H LEU A 471 0.290 13.365 -11.661 1.00 0.00 H new ATOM 0 HA LEU A 471 0.111 16.149 -11.179 1.00 0.00 H new ATOM 0 HB2 LEU A 471 -0.638 15.543 -9.050 1.00 0.00 H new ATOM 0 HB3 LEU A 471 -1.179 14.242 -10.093 1.00 0.00 H new ATOM 0 HG LEU A 471 1.176 13.192 -9.281 1.00 0.00 H new ATOM 0 HD11 LEU A 471 1.452 13.635 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 471 1.729 15.097 -7.849 1.00 0.00 H new ATOM 0 HD13 LEU A 471 0.197 14.894 -6.966 1.00 0.00 H new ATOM 0 HD21 LEU A 471 -0.135 11.908 -7.633 1.00 0.00 H new ATOM 0 HD22 LEU A 471 -1.449 13.102 -7.756 1.00 0.00 H new ATOM 0 HD23 LEU A 471 -1.016 12.106 -9.166 1.00 0.00 H new ATOM 221 N ALA A 472 2.846 14.618 -10.152 1.00 0.00 N ATOM 222 CA ALA A 472 4.204 14.856 -9.683 1.00 0.00 C ATOM 223 C ALA A 472 4.940 15.751 -10.667 1.00 0.00 C ATOM 224 O ALA A 472 5.701 16.636 -10.277 1.00 0.00 O ATOM 225 CB ALA A 472 4.948 13.541 -9.495 1.00 0.00 C ATOM 0 H ALA A 472 2.639 13.645 -10.377 1.00 0.00 H new ATOM 0 HA ALA A 472 4.158 15.357 -8.716 1.00 0.00 H new ATOM 0 HB1 ALA A 472 5.960 13.743 -9.144 1.00 0.00 H new ATOM 0 HB2 ALA A 472 4.425 12.929 -8.761 1.00 0.00 H new ATOM 0 HB3 ALA A 472 4.992 13.009 -10.445 1.00 0.00 H new ATOM 231 N LEU A 473 4.685 15.524 -11.951 1.00 0.00 N ATOM 232 CA LEU A 473 5.295 16.317 -13.006 1.00 0.00 C ATOM 233 C LEU A 473 4.682 17.709 -13.011 1.00 0.00 C ATOM 234 O LEU A 473 5.385 18.715 -12.943 1.00 0.00 O ATOM 235 CB LEU A 473 5.079 15.634 -14.362 1.00 0.00 C ATOM 236 CG LEU A 473 6.025 16.063 -15.487 1.00 0.00 C ATOM 237 CD1 LEU A 473 5.956 17.565 -15.706 1.00 0.00 C ATOM 238 CD2 LEU A 473 7.449 15.625 -15.185 1.00 0.00 C ATOM 0 H LEU A 473 4.057 14.793 -12.285 1.00 0.00 H new ATOM 0 HA LEU A 473 6.367 16.401 -12.826 1.00 0.00 H new ATOM 0 HB2 LEU A 473 5.176 14.557 -14.224 1.00 0.00 H new ATOM 0 HB3 LEU A 473 4.055 15.824 -14.683 1.00 0.00 H new ATOM 0 HG LEU A 473 5.706 15.573 -16.407 1.00 0.00 H new ATOM 0 HD11 LEU A 473 6.636 17.847 -16.510 1.00 0.00 H new ATOM 0 HD12 LEU A 473 4.938 17.847 -15.976 1.00 0.00 H new ATOM 0 HD13 LEU A 473 6.244 18.080 -14.789 1.00 0.00 H new ATOM 0 HD21 LEU A 473 8.106 15.939 -15.996 1.00 0.00 H new ATOM 0 HD22 LEU A 473 7.780 16.082 -14.252 1.00 0.00 H new ATOM 0 HD23 LEU A 473 7.483 14.540 -15.090 1.00 0.00 H new ATOM 250 N GLU A 474 3.361 17.750 -13.073 1.00 0.00 N ATOM 251 CA GLU A 474 2.635 19.008 -13.068 1.00 0.00 C ATOM 252 C GLU A 474 2.898 19.778 -11.776 1.00 0.00 C ATOM 253 O GLU A 474 2.758 21.000 -11.731 1.00 0.00 O ATOM 254 CB GLU A 474 1.136 18.742 -13.225 1.00 0.00 C ATOM 255 CG GLU A 474 0.279 19.998 -13.159 1.00 0.00 C ATOM 256 CD GLU A 474 0.422 20.867 -14.393 1.00 0.00 C ATOM 257 OE1 GLU A 474 0.430 20.312 -15.512 1.00 0.00 O ATOM 258 OE2 GLU A 474 0.526 22.103 -14.240 1.00 0.00 O ATOM 0 H GLU A 474 2.768 16.922 -13.128 1.00 0.00 H new ATOM 0 HA GLU A 474 2.983 19.614 -13.905 1.00 0.00 H new ATOM 0 HB2 GLU A 474 0.963 18.245 -14.179 1.00 0.00 H new ATOM 0 HB3 GLU A 474 0.815 18.053 -12.444 1.00 0.00 H new ATOM 0 HG2 GLU A 474 -0.766 19.714 -13.038 1.00 0.00 H new ATOM 0 HG3 GLU A 474 0.556 20.576 -12.278 1.00 0.00 H new ATOM 265 N ASN A 475 3.277 19.054 -10.724 1.00 0.00 N ATOM 266 CA ASN A 475 3.554 19.674 -9.433 1.00 0.00 C ATOM 267 C ASN A 475 4.879 20.426 -9.452 1.00 0.00 C ATOM 268 O ASN A 475 4.948 21.577 -9.019 1.00 0.00 O ATOM 269 CB ASN A 475 3.567 18.620 -8.323 1.00 0.00 C ATOM 270 CG ASN A 475 2.231 18.511 -7.613 1.00 0.00 C ATOM 271 OD1 ASN A 475 1.690 17.299 -7.549 1.00 0.00 O flip ATOM 272 ND2 ASN A 475 1.692 19.505 -7.128 1.00 0.00 N flip ATOM 0 H ASN A 475 3.398 18.041 -10.742 1.00 0.00 H new ATOM 0 HA ASN A 475 2.758 20.391 -9.234 1.00 0.00 H new ATOM 0 HB2 ASN A 475 3.829 17.651 -8.749 1.00 0.00 H new ATOM 0 HB3 ASN A 475 4.341 18.870 -7.598 1.00 0.00 H new ATOM 0 HD21 ASN A 475 2.144 20.417 -7.201 1.00 0.00 H new ATOM 0 HD22 ASN A 475 0.793 19.417 -6.653 1.00 0.00 H new ATOM 279 N TYR A 476 5.932 19.783 -9.949 1.00 0.00 N ATOM 280 CA TYR A 476 7.236 20.429 -10.005 1.00 0.00 C ATOM 281 C TYR A 476 7.231 21.545 -11.044 1.00 0.00 C ATOM 282 O TYR A 476 7.947 22.537 -10.910 1.00 0.00 O ATOM 283 CB TYR A 476 8.340 19.396 -10.281 1.00 0.00 C ATOM 284 CG TYR A 476 8.849 19.365 -11.704 1.00 0.00 C ATOM 285 CD1 TYR A 476 8.226 18.584 -12.662 1.00 0.00 C ATOM 286 CD2 TYR A 476 9.963 20.103 -12.078 1.00 0.00 C ATOM 287 CE1 TYR A 476 8.697 18.538 -13.959 1.00 0.00 C ATOM 288 CE2 TYR A 476 10.440 20.065 -13.374 1.00 0.00 C ATOM 289 CZ TYR A 476 9.802 19.279 -14.309 1.00 0.00 C ATOM 290 OH TYR A 476 10.271 19.234 -15.600 1.00 0.00 O ATOM 0 H TYR A 476 5.908 18.830 -10.313 1.00 0.00 H new ATOM 0 HA TYR A 476 7.448 20.881 -9.036 1.00 0.00 H new ATOM 0 HB2 TYR A 476 9.179 19.598 -9.616 1.00 0.00 H new ATOM 0 HB3 TYR A 476 7.962 18.406 -10.025 1.00 0.00 H new ATOM 0 HD1 TYR A 476 7.358 18.002 -12.391 1.00 0.00 H new ATOM 0 HD2 TYR A 476 10.465 20.717 -11.345 1.00 0.00 H new ATOM 0 HE1 TYR A 476 8.200 17.923 -14.695 1.00 0.00 H new ATOM 0 HE2 TYR A 476 11.306 20.647 -13.652 1.00 0.00 H new ATOM 0 HH TYR A 476 10.073 18.357 -15.990 1.00 0.00 H new ATOM 300 N ILE A 477 6.398 21.387 -12.069 1.00 0.00 N ATOM 301 CA ILE A 477 6.277 22.392 -13.115 1.00 0.00 C ATOM 302 C ILE A 477 5.706 23.684 -12.540 1.00 0.00 C ATOM 303 O ILE A 477 6.060 24.780 -12.970 1.00 0.00 O ATOM 304 CB ILE A 477 5.376 21.897 -14.265 1.00 0.00 C ATOM 305 CG1 ILE A 477 6.109 20.832 -15.080 1.00 0.00 C ATOM 306 CG2 ILE A 477 4.948 23.052 -15.163 1.00 0.00 C ATOM 307 CD1 ILE A 477 7.428 21.308 -15.647 1.00 0.00 C ATOM 0 H ILE A 477 5.798 20.572 -12.195 1.00 0.00 H new ATOM 0 HA ILE A 477 7.274 22.579 -13.514 1.00 0.00 H new ATOM 0 HB ILE A 477 4.477 21.459 -13.832 1.00 0.00 H new ATOM 0 HG12 ILE A 477 6.287 19.961 -14.449 1.00 0.00 H new ATOM 0 HG13 ILE A 477 5.467 20.506 -15.899 1.00 0.00 H new ATOM 0 HG21 ILE A 477 4.314 22.674 -15.965 1.00 0.00 H new ATOM 0 HG22 ILE A 477 4.393 23.783 -14.576 1.00 0.00 H new ATOM 0 HG23 ILE A 477 5.831 23.526 -15.592 1.00 0.00 H new ATOM 0 HD11 ILE A 477 7.893 20.501 -16.213 1.00 0.00 H new ATOM 0 HD12 ILE A 477 7.255 22.160 -16.304 1.00 0.00 H new ATOM 0 HD13 ILE A 477 8.088 21.606 -14.832 1.00 0.00 H new ATOM 319 N THR A 478 4.824 23.544 -11.559 1.00 0.00 N ATOM 320 CA THR A 478 4.217 24.704 -10.920 1.00 0.00 C ATOM 321 C THR A 478 5.299 25.599 -10.330 1.00 0.00 C ATOM 322 O THR A 478 5.293 26.815 -10.529 1.00 0.00 O ATOM 323 CB THR A 478 3.239 24.262 -9.830 1.00 0.00 C ATOM 324 OG1 THR A 478 2.184 23.496 -10.382 1.00 0.00 O ATOM 325 CG2 THR A 478 2.620 25.419 -9.076 1.00 0.00 C ATOM 0 H THR A 478 4.514 22.645 -11.190 1.00 0.00 H new ATOM 0 HA THR A 478 3.664 25.269 -11.670 1.00 0.00 H new ATOM 0 HB THR A 478 3.833 23.671 -9.133 1.00 0.00 H new ATOM 0 HG1 THR A 478 2.550 22.689 -10.800 1.00 0.00 H new ATOM 0 HG21 THR A 478 1.937 25.036 -8.318 1.00 0.00 H new ATOM 0 HG22 THR A 478 3.406 26.002 -8.595 1.00 0.00 H new ATOM 0 HG23 THR A 478 2.071 26.054 -9.771 1.00 0.00 H new ATOM 333 N ALA A 479 6.239 24.986 -9.620 1.00 0.00 N ATOM 334 CA ALA A 479 7.342 25.722 -9.021 1.00 0.00 C ATOM 335 C ALA A 479 8.213 26.340 -10.107 1.00 0.00 C ATOM 336 O ALA A 479 8.790 27.412 -9.923 1.00 0.00 O ATOM 337 CB ALA A 479 8.169 24.808 -8.129 1.00 0.00 C ATOM 0 H ALA A 479 6.258 23.981 -9.446 1.00 0.00 H new ATOM 0 HA ALA A 479 6.933 26.523 -8.405 1.00 0.00 H new ATOM 0 HB1 ALA A 479 8.990 25.374 -7.689 1.00 0.00 H new ATOM 0 HB2 ALA A 479 7.539 24.406 -7.335 1.00 0.00 H new ATOM 0 HB3 ALA A 479 8.572 23.987 -8.723 1.00 0.00 H new ATOM 343 N LEU A 480 8.291 25.656 -11.246 1.00 0.00 N ATOM 344 CA LEU A 480 9.078 26.134 -12.377 1.00 0.00 C ATOM 345 C LEU A 480 8.567 27.495 -12.840 1.00 0.00 C ATOM 346 O LEU A 480 9.348 28.394 -13.152 1.00 0.00 O ATOM 347 CB LEU A 480 8.998 25.137 -13.539 1.00 0.00 C ATOM 348 CG LEU A 480 10.057 24.032 -13.545 1.00 0.00 C ATOM 349 CD1 LEU A 480 9.977 23.234 -14.838 1.00 0.00 C ATOM 350 CD2 LEU A 480 11.451 24.618 -13.363 1.00 0.00 C ATOM 0 H LEU A 480 7.817 24.767 -11.409 1.00 0.00 H new ATOM 0 HA LEU A 480 10.115 26.230 -12.057 1.00 0.00 H new ATOM 0 HB2 LEU A 480 8.013 24.670 -13.525 1.00 0.00 H new ATOM 0 HB3 LEU A 480 9.074 25.692 -14.474 1.00 0.00 H new ATOM 0 HG LEU A 480 9.860 23.361 -12.708 1.00 0.00 H new ATOM 0 HD11 LEU A 480 10.735 22.451 -14.830 1.00 0.00 H new ATOM 0 HD12 LEU A 480 8.989 22.781 -14.926 1.00 0.00 H new ATOM 0 HD13 LEU A 480 10.149 23.897 -15.686 1.00 0.00 H new ATOM 0 HD21 LEU A 480 12.187 23.814 -13.370 1.00 0.00 H new ATOM 0 HD22 LEU A 480 11.663 25.312 -14.176 1.00 0.00 H new ATOM 0 HD23 LEU A 480 11.502 25.148 -12.412 1.00 0.00 H new ATOM 362 N GLN A 481 7.244 27.633 -12.886 1.00 0.00 N ATOM 363 CA GLN A 481 6.611 28.876 -13.314 1.00 0.00 C ATOM 364 C GLN A 481 6.523 29.882 -12.170 1.00 0.00 C ATOM 365 O GLN A 481 6.242 31.059 -12.394 1.00 0.00 O ATOM 366 CB GLN A 481 5.211 28.590 -13.855 1.00 0.00 C ATOM 367 CG GLN A 481 5.189 27.574 -14.986 1.00 0.00 C ATOM 368 CD GLN A 481 6.122 27.945 -16.122 1.00 0.00 C ATOM 369 OE1 GLN A 481 5.931 28.960 -16.791 1.00 0.00 O ATOM 370 NE2 GLN A 481 7.140 27.121 -16.344 1.00 0.00 N ATOM 0 H GLN A 481 6.588 26.895 -12.631 1.00 0.00 H new ATOM 0 HA GLN A 481 7.228 29.310 -14.101 1.00 0.00 H new ATOM 0 HB2 GLN A 481 4.583 28.228 -13.041 1.00 0.00 H new ATOM 0 HB3 GLN A 481 4.770 29.522 -14.207 1.00 0.00 H new ATOM 0 HG2 GLN A 481 5.469 26.596 -14.596 1.00 0.00 H new ATOM 0 HG3 GLN A 481 4.173 27.485 -15.370 1.00 0.00 H new ATOM 0 HE21 GLN A 481 7.260 26.290 -15.764 1.00 0.00 H new ATOM 0 HE22 GLN A 481 7.802 27.319 -17.094 1.00 0.00 H new ATOM 379 N ALA A 482 6.755 29.410 -10.943 1.00 0.00 N ATOM 380 CA ALA A 482 6.698 30.261 -9.752 1.00 0.00 C ATOM 381 C ALA A 482 7.197 31.677 -10.038 1.00 0.00 C ATOM 382 O ALA A 482 6.493 32.653 -9.788 1.00 0.00 O ATOM 383 CB ALA A 482 7.508 29.636 -8.625 1.00 0.00 C ATOM 0 H ALA A 482 6.986 28.436 -10.748 1.00 0.00 H new ATOM 0 HA ALA A 482 5.653 30.337 -9.450 1.00 0.00 H new ATOM 0 HB1 ALA A 482 7.460 30.276 -7.744 1.00 0.00 H new ATOM 0 HB2 ALA A 482 7.099 28.655 -8.384 1.00 0.00 H new ATOM 0 HB3 ALA A 482 8.546 29.529 -8.939 1.00 0.00 H new ATOM 389 N VAL A 483 8.413 31.774 -10.571 1.00 0.00 N ATOM 390 CA VAL A 483 9.009 33.066 -10.904 1.00 0.00 C ATOM 391 C VAL A 483 8.826 34.087 -9.775 1.00 0.00 C ATOM 392 O VAL A 483 7.779 34.726 -9.675 1.00 0.00 O ATOM 393 CB VAL A 483 8.401 33.637 -12.199 1.00 0.00 C ATOM 394 CG1 VAL A 483 9.092 34.934 -12.593 1.00 0.00 C ATOM 395 CG2 VAL A 483 8.488 32.617 -13.323 1.00 0.00 C ATOM 0 H VAL A 483 9.006 30.971 -10.782 1.00 0.00 H new ATOM 0 HA VAL A 483 10.075 32.890 -11.047 1.00 0.00 H new ATOM 0 HB VAL A 483 7.349 33.857 -12.016 1.00 0.00 H new ATOM 0 HG11 VAL A 483 8.647 35.319 -13.510 1.00 0.00 H new ATOM 0 HG12 VAL A 483 8.972 35.667 -11.795 1.00 0.00 H new ATOM 0 HG13 VAL A 483 10.153 34.746 -12.756 1.00 0.00 H new ATOM 0 HG21 VAL A 483 8.054 33.037 -14.230 1.00 0.00 H new ATOM 0 HG22 VAL A 483 9.533 32.364 -13.504 1.00 0.00 H new ATOM 0 HG23 VAL A 483 7.940 31.718 -13.041 1.00 0.00 H new ATOM 405 N PRO A 484 9.842 34.258 -8.907 1.00 0.00 N ATOM 406 CA PRO A 484 11.110 33.522 -8.982 1.00 0.00 C ATOM 407 C PRO A 484 10.944 32.053 -8.601 1.00 0.00 C ATOM 408 O PRO A 484 10.287 31.734 -7.609 1.00 0.00 O ATOM 409 CB PRO A 484 12.015 34.237 -7.965 1.00 0.00 C ATOM 410 CG PRO A 484 11.289 35.483 -7.582 1.00 0.00 C ATOM 411 CD PRO A 484 9.831 35.190 -7.775 1.00 0.00 C ATOM 0 HA PRO A 484 11.514 33.518 -9.994 1.00 0.00 H new ATOM 0 HB2 PRO A 484 12.198 33.608 -7.094 1.00 0.00 H new ATOM 0 HB3 PRO A 484 12.987 34.469 -8.401 1.00 0.00 H new ATOM 0 HG2 PRO A 484 11.499 35.754 -6.547 1.00 0.00 H new ATOM 0 HG3 PRO A 484 11.603 36.323 -8.201 1.00 0.00 H new ATOM 0 HD2 PRO A 484 9.386 34.743 -6.886 1.00 0.00 H new ATOM 0 HD3 PRO A 484 9.262 36.092 -7.998 1.00 0.00 H new ATOM 419 N PRO A 485 11.537 31.132 -9.381 1.00 0.00 N ATOM 420 CA PRO A 485 11.447 29.700 -9.112 1.00 0.00 C ATOM 421 C PRO A 485 12.460 29.240 -8.070 1.00 0.00 C ATOM 422 O PRO A 485 13.505 29.864 -7.890 1.00 0.00 O ATOM 423 CB PRO A 485 11.757 29.083 -10.471 1.00 0.00 C ATOM 424 CG PRO A 485 12.702 30.043 -11.110 1.00 0.00 C ATOM 425 CD PRO A 485 12.343 31.412 -10.588 1.00 0.00 C ATOM 0 HA PRO A 485 10.478 29.414 -8.703 1.00 0.00 H new ATOM 0 HB2 PRO A 485 12.206 28.095 -10.365 1.00 0.00 H new ATOM 0 HB3 PRO A 485 10.853 28.960 -11.067 1.00 0.00 H new ATOM 0 HG2 PRO A 485 13.734 29.793 -10.864 1.00 0.00 H new ATOM 0 HG3 PRO A 485 12.615 30.007 -12.196 1.00 0.00 H new ATOM 0 HD2 PRO A 485 13.233 31.994 -10.348 1.00 0.00 H new ATOM 0 HD3 PRO A 485 11.777 31.984 -11.323 1.00 0.00 H new ATOM 433 N ARG A 486 12.144 28.145 -7.388 1.00 0.00 N ATOM 434 CA ARG A 486 13.028 27.598 -6.366 1.00 0.00 C ATOM 435 C ARG A 486 13.753 26.358 -6.884 1.00 0.00 C ATOM 436 O ARG A 486 13.377 25.231 -6.564 1.00 0.00 O ATOM 437 CB ARG A 486 12.229 27.248 -5.107 1.00 0.00 C ATOM 438 CG ARG A 486 12.249 28.340 -4.051 1.00 0.00 C ATOM 439 CD ARG A 486 13.242 28.027 -2.943 1.00 0.00 C ATOM 440 NE ARG A 486 13.008 28.840 -1.751 1.00 0.00 N ATOM 441 CZ ARG A 486 12.018 28.621 -0.887 1.00 0.00 C ATOM 442 NH1 ARG A 486 11.171 27.619 -1.079 1.00 0.00 N ATOM 443 NH2 ARG A 486 11.878 29.408 0.170 1.00 0.00 N ATOM 0 H ARG A 486 11.281 27.618 -7.525 1.00 0.00 H new ATOM 0 HA ARG A 486 13.772 28.355 -6.118 1.00 0.00 H new ATOM 0 HB2 ARG A 486 11.196 27.044 -5.388 1.00 0.00 H new ATOM 0 HB3 ARG A 486 12.629 26.330 -4.676 1.00 0.00 H new ATOM 0 HG2 ARG A 486 12.508 29.291 -4.515 1.00 0.00 H new ATOM 0 HG3 ARG A 486 11.252 28.454 -3.626 1.00 0.00 H new ATOM 0 HD2 ARG A 486 13.172 26.971 -2.681 1.00 0.00 H new ATOM 0 HD3 ARG A 486 14.255 28.199 -3.306 1.00 0.00 H new ATOM 0 HE ARG A 486 13.639 29.620 -1.570 1.00 0.00 H new ATOM 0 HH11 ARG A 486 11.276 27.011 -1.891 1.00 0.00 H new ATOM 0 HH12 ARG A 486 10.415 27.456 -0.414 1.00 0.00 H new ATOM 0 HH21 ARG A 486 12.528 30.180 0.321 1.00 0.00 H new ATOM 0 HH22 ARG A 486 11.121 29.242 0.833 1.00 0.00 H new ATOM 457 N PRO A 487 14.810 26.548 -7.694 1.00 0.00 N ATOM 458 CA PRO A 487 15.586 25.441 -8.259 1.00 0.00 C ATOM 459 C PRO A 487 15.997 24.414 -7.207 1.00 0.00 C ATOM 460 O PRO A 487 16.270 23.258 -7.531 1.00 0.00 O ATOM 461 CB PRO A 487 16.828 26.123 -8.859 1.00 0.00 C ATOM 462 CG PRO A 487 16.781 27.541 -8.390 1.00 0.00 C ATOM 463 CD PRO A 487 15.336 27.847 -8.125 1.00 0.00 C ATOM 0 HA PRO A 487 15.003 24.880 -8.989 1.00 0.00 H new ATOM 0 HB2 PRO A 487 17.743 25.632 -8.527 1.00 0.00 H new ATOM 0 HB3 PRO A 487 16.815 26.071 -9.948 1.00 0.00 H new ATOM 0 HG2 PRO A 487 17.378 27.673 -7.488 1.00 0.00 H new ATOM 0 HG3 PRO A 487 17.189 28.214 -9.144 1.00 0.00 H new ATOM 0 HD2 PRO A 487 15.217 28.609 -7.354 1.00 0.00 H new ATOM 0 HD3 PRO A 487 14.829 28.214 -9.017 1.00 0.00 H new ATOM 471 N ARG A 488 16.042 24.838 -5.948 1.00 0.00 N ATOM 472 CA ARG A 488 16.422 23.944 -4.862 1.00 0.00 C ATOM 473 C ARG A 488 15.211 23.216 -4.296 1.00 0.00 C ATOM 474 O ARG A 488 15.332 22.112 -3.767 1.00 0.00 O ATOM 475 CB ARG A 488 17.132 24.725 -3.757 1.00 0.00 C ATOM 476 CG ARG A 488 16.219 25.665 -2.985 1.00 0.00 C ATOM 477 CD ARG A 488 15.564 24.962 -1.807 1.00 0.00 C ATOM 478 NE ARG A 488 16.186 25.329 -0.536 1.00 0.00 N ATOM 479 CZ ARG A 488 16.065 24.615 0.582 1.00 0.00 C ATOM 480 NH1 ARG A 488 15.348 23.498 0.590 1.00 0.00 N ATOM 481 NH2 ARG A 488 16.663 25.019 1.693 1.00 0.00 N ATOM 0 H ARG A 488 15.821 25.790 -5.656 1.00 0.00 H new ATOM 0 HA ARG A 488 17.106 23.197 -5.266 1.00 0.00 H new ATOM 0 HB2 ARG A 488 17.585 24.020 -3.060 1.00 0.00 H new ATOM 0 HB3 ARG A 488 17.944 25.303 -4.198 1.00 0.00 H new ATOM 0 HG2 ARG A 488 16.793 26.519 -2.627 1.00 0.00 H new ATOM 0 HG3 ARG A 488 15.449 26.055 -3.651 1.00 0.00 H new ATOM 0 HD2 ARG A 488 14.504 25.214 -1.778 1.00 0.00 H new ATOM 0 HD3 ARG A 488 15.631 23.883 -1.946 1.00 0.00 H new ATOM 0 HE ARG A 488 16.745 26.181 -0.503 1.00 0.00 H new ATOM 0 HH11 ARG A 488 14.886 23.182 -0.263 1.00 0.00 H new ATOM 0 HH12 ARG A 488 15.259 22.955 1.449 1.00 0.00 H new ATOM 0 HH21 ARG A 488 17.216 25.876 1.692 1.00 0.00 H new ATOM 0 HH22 ARG A 488 16.571 24.473 2.549 1.00 0.00 H new ATOM 495 N HIS A 489 14.041 23.824 -4.425 1.00 0.00 N ATOM 496 CA HIS A 489 12.817 23.207 -3.942 1.00 0.00 C ATOM 497 C HIS A 489 12.261 22.300 -5.024 1.00 0.00 C ATOM 498 O HIS A 489 11.728 21.222 -4.751 1.00 0.00 O ATOM 499 CB HIS A 489 11.787 24.272 -3.560 1.00 0.00 C ATOM 500 CG HIS A 489 10.783 23.800 -2.555 1.00 0.00 C ATOM 501 ND1 HIS A 489 9.839 24.629 -1.987 1.00 0.00 N ATOM 502 CD2 HIS A 489 10.579 22.575 -2.015 1.00 0.00 C ATOM 503 CE1 HIS A 489 9.097 23.934 -1.142 1.00 0.00 C ATOM 504 NE2 HIS A 489 9.525 22.686 -1.141 1.00 0.00 N ATOM 0 H HIS A 489 13.915 24.739 -4.858 1.00 0.00 H new ATOM 0 HA HIS A 489 13.038 22.621 -3.050 1.00 0.00 H new ATOM 0 HB2 HIS A 489 12.307 25.142 -3.160 1.00 0.00 H new ATOM 0 HB3 HIS A 489 11.264 24.598 -4.459 1.00 0.00 H new ATOM 0 HD2 HIS A 489 11.140 21.678 -2.231 1.00 0.00 H new ATOM 0 HE1 HIS A 489 8.279 24.322 -0.553 1.00 0.00 H new ATOM 0 HE2 HIS A 489 9.136 21.927 -0.582 1.00 0.00 H new ATOM 513 N VAL A 490 12.416 22.745 -6.263 1.00 0.00 N ATOM 514 CA VAL A 490 11.958 21.990 -7.410 1.00 0.00 C ATOM 515 C VAL A 490 12.725 20.678 -7.522 1.00 0.00 C ATOM 516 O VAL A 490 12.139 19.631 -7.793 1.00 0.00 O ATOM 517 CB VAL A 490 12.110 22.805 -8.712 1.00 0.00 C ATOM 518 CG1 VAL A 490 11.537 24.204 -8.531 1.00 0.00 C ATOM 519 CG2 VAL A 490 13.568 22.878 -9.145 1.00 0.00 C ATOM 0 H VAL A 490 12.860 23.633 -6.496 1.00 0.00 H new ATOM 0 HA VAL A 490 10.900 21.773 -7.266 1.00 0.00 H new ATOM 0 HB VAL A 490 11.551 22.297 -9.497 1.00 0.00 H new ATOM 0 HG11 VAL A 490 11.651 24.767 -9.457 1.00 0.00 H new ATOM 0 HG12 VAL A 490 10.479 24.134 -8.277 1.00 0.00 H new ATOM 0 HG13 VAL A 490 12.070 24.714 -7.728 1.00 0.00 H new ATOM 0 HG21 VAL A 490 13.646 23.458 -10.065 1.00 0.00 H new ATOM 0 HG22 VAL A 490 14.156 23.358 -8.363 1.00 0.00 H new ATOM 0 HG23 VAL A 490 13.947 21.871 -9.318 1.00 0.00 H new ATOM 529 N PHE A 491 14.040 20.735 -7.293 1.00 0.00 N ATOM 530 CA PHE A 491 14.870 19.538 -7.359 1.00 0.00 C ATOM 531 C PHE A 491 14.292 18.445 -6.459 1.00 0.00 C ATOM 532 O PHE A 491 14.484 17.254 -6.707 1.00 0.00 O ATOM 533 CB PHE A 491 16.322 19.873 -6.973 1.00 0.00 C ATOM 534 CG PHE A 491 16.865 19.083 -5.812 1.00 0.00 C ATOM 535 CD1 PHE A 491 17.130 17.728 -5.939 1.00 0.00 C ATOM 536 CD2 PHE A 491 17.107 19.699 -4.596 1.00 0.00 C ATOM 537 CE1 PHE A 491 17.628 17.005 -4.871 1.00 0.00 C ATOM 538 CE2 PHE A 491 17.604 18.981 -3.526 1.00 0.00 C ATOM 539 CZ PHE A 491 17.865 17.632 -3.664 1.00 0.00 C ATOM 0 H PHE A 491 14.545 21.591 -7.063 1.00 0.00 H new ATOM 0 HA PHE A 491 14.875 19.163 -8.383 1.00 0.00 H new ATOM 0 HB2 PHE A 491 16.961 19.705 -7.840 1.00 0.00 H new ATOM 0 HB3 PHE A 491 16.384 20.934 -6.733 1.00 0.00 H new ATOM 0 HD1 PHE A 491 16.946 17.233 -6.881 1.00 0.00 H new ATOM 0 HD2 PHE A 491 16.905 20.754 -4.483 1.00 0.00 H new ATOM 0 HE1 PHE A 491 17.832 15.950 -4.981 1.00 0.00 H new ATOM 0 HE2 PHE A 491 17.788 19.474 -2.583 1.00 0.00 H new ATOM 0 HZ PHE A 491 18.254 17.068 -2.829 1.00 0.00 H new ATOM 549 N ASN A 492 13.571 18.864 -5.422 1.00 0.00 N ATOM 550 CA ASN A 492 12.952 17.928 -4.495 1.00 0.00 C ATOM 551 C ASN A 492 11.743 17.265 -5.143 1.00 0.00 C ATOM 552 O ASN A 492 11.544 16.057 -5.019 1.00 0.00 O ATOM 553 CB ASN A 492 12.530 18.648 -3.213 1.00 0.00 C ATOM 554 CG ASN A 492 12.048 17.689 -2.143 1.00 0.00 C ATOM 555 OD1 ASN A 492 10.828 17.188 -2.303 1.00 0.00 O flip ATOM 556 ND2 ASN A 492 12.763 17.399 -1.185 1.00 0.00 N flip ATOM 0 H ASN A 492 13.403 19.846 -5.205 1.00 0.00 H new ATOM 0 HA ASN A 492 13.682 17.159 -4.241 1.00 0.00 H new ATOM 0 HB2 ASN A 492 13.372 19.223 -2.829 1.00 0.00 H new ATOM 0 HB3 ASN A 492 11.737 19.359 -3.443 1.00 0.00 H new ATOM 0 HD21 ASN A 492 13.694 17.807 -1.101 1.00 0.00 H new ATOM 0 HD22 ASN A 492 12.425 16.750 -0.474 1.00 0.00 H new ATOM 563 N MET A 493 10.937 18.062 -5.838 1.00 0.00 N ATOM 564 CA MET A 493 9.750 17.537 -6.505 1.00 0.00 C ATOM 565 C MET A 493 10.134 16.553 -7.606 1.00 0.00 C ATOM 566 O MET A 493 9.374 15.638 -7.921 1.00 0.00 O ATOM 567 CB MET A 493 8.905 18.674 -7.082 1.00 0.00 C ATOM 568 CG MET A 493 7.593 18.887 -6.342 1.00 0.00 C ATOM 569 SD MET A 493 7.446 20.539 -5.633 1.00 0.00 S ATOM 570 CE MET A 493 9.079 20.752 -4.933 1.00 0.00 C ATOM 0 H MET A 493 11.082 19.065 -5.954 1.00 0.00 H new ATOM 0 HA MET A 493 9.156 17.006 -5.761 1.00 0.00 H new ATOM 0 HB2 MET A 493 9.484 19.597 -7.054 1.00 0.00 H new ATOM 0 HB3 MET A 493 8.692 18.463 -8.130 1.00 0.00 H new ATOM 0 HG2 MET A 493 6.763 18.717 -7.028 1.00 0.00 H new ATOM 0 HG3 MET A 493 7.506 18.147 -5.547 1.00 0.00 H new ATOM 0 HE1 MET A 493 9.027 21.443 -4.091 1.00 0.00 H new ATOM 0 HE2 MET A 493 9.456 19.789 -4.589 1.00 0.00 H new ATOM 0 HE3 MET A 493 9.750 21.155 -5.692 1.00 0.00 H new ATOM 580 N LEU A 494 11.315 16.736 -8.184 1.00 0.00 N ATOM 581 CA LEU A 494 11.784 15.848 -9.234 1.00 0.00 C ATOM 582 C LEU A 494 12.156 14.489 -8.650 1.00 0.00 C ATOM 583 O LEU A 494 11.796 13.445 -9.194 1.00 0.00 O ATOM 584 CB LEU A 494 12.996 16.454 -9.940 1.00 0.00 C ATOM 585 CG LEU A 494 12.674 17.505 -11.001 1.00 0.00 C ATOM 586 CD1 LEU A 494 11.560 17.024 -11.920 1.00 0.00 C ATOM 587 CD2 LEU A 494 12.301 18.825 -10.349 1.00 0.00 C ATOM 0 H LEU A 494 11.961 17.488 -7.943 1.00 0.00 H new ATOM 0 HA LEU A 494 10.980 15.717 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 494 13.645 16.906 -9.190 1.00 0.00 H new ATOM 0 HB3 LEU A 494 13.563 15.650 -10.409 1.00 0.00 H new ATOM 0 HG LEU A 494 13.567 17.662 -11.606 1.00 0.00 H new ATOM 0 HD11 LEU A 494 11.349 17.789 -12.667 1.00 0.00 H new ATOM 0 HD12 LEU A 494 11.871 16.106 -12.419 1.00 0.00 H new ATOM 0 HD13 LEU A 494 10.662 16.832 -11.333 1.00 0.00 H new ATOM 0 HD21 LEU A 494 12.075 19.561 -11.121 1.00 0.00 H new ATOM 0 HD22 LEU A 494 11.426 18.683 -9.715 1.00 0.00 H new ATOM 0 HD23 LEU A 494 13.134 19.179 -9.742 1.00 0.00 H new ATOM 599 N LYS A 495 12.882 14.516 -7.536 1.00 0.00 N ATOM 600 CA LYS A 495 13.312 13.293 -6.869 1.00 0.00 C ATOM 601 C LYS A 495 12.119 12.399 -6.535 1.00 0.00 C ATOM 602 O LYS A 495 12.235 11.174 -6.533 1.00 0.00 O ATOM 603 CB LYS A 495 14.117 13.626 -5.605 1.00 0.00 C ATOM 604 CG LYS A 495 13.276 14.064 -4.414 1.00 0.00 C ATOM 605 CD LYS A 495 13.677 13.328 -3.145 1.00 0.00 C ATOM 606 CE LYS A 495 13.545 11.819 -3.303 1.00 0.00 C ATOM 607 NZ LYS A 495 14.717 11.098 -2.734 1.00 0.00 N ATOM 0 H LYS A 495 13.185 15.374 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 495 13.957 12.742 -7.553 1.00 0.00 H new ATOM 0 HB2 LYS A 495 14.699 12.750 -5.319 1.00 0.00 H new ATOM 0 HB3 LYS A 495 14.828 14.417 -5.841 1.00 0.00 H new ATOM 0 HG2 LYS A 495 13.388 15.138 -4.264 1.00 0.00 H new ATOM 0 HG3 LYS A 495 12.222 13.880 -4.624 1.00 0.00 H new ATOM 0 HD2 LYS A 495 14.707 13.578 -2.889 1.00 0.00 H new ATOM 0 HD3 LYS A 495 13.052 13.663 -2.317 1.00 0.00 H new ATOM 0 HE2 LYS A 495 12.635 11.480 -2.808 1.00 0.00 H new ATOM 0 HE3 LYS A 495 13.444 11.572 -4.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 495 14.590 10.074 -2.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 495 15.583 11.402 -3.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 495 14.798 11.314 -1.720 1.00 0.00 H new ATOM 621 N LYS A 496 10.968 13.015 -6.269 1.00 0.00 N ATOM 622 CA LYS A 496 9.762 12.251 -5.955 1.00 0.00 C ATOM 623 C LYS A 496 9.054 11.833 -7.236 1.00 0.00 C ATOM 624 O LYS A 496 8.730 10.660 -7.422 1.00 0.00 O ATOM 625 CB LYS A 496 8.793 13.035 -5.054 1.00 0.00 C ATOM 626 CG LYS A 496 8.926 14.548 -5.129 1.00 0.00 C ATOM 627 CD LYS A 496 7.567 15.225 -5.234 1.00 0.00 C ATOM 628 CE LYS A 496 7.242 16.023 -3.981 1.00 0.00 C ATOM 629 NZ LYS A 496 5.796 16.370 -3.902 1.00 0.00 N ATOM 0 H LYS A 496 10.845 14.028 -6.264 1.00 0.00 H new ATOM 0 HA LYS A 496 10.078 11.365 -5.405 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.772 12.762 -5.320 1.00 0.00 H new ATOM 0 HB3 LYS A 496 8.948 12.723 -4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 496 9.447 14.912 -4.244 1.00 0.00 H new ATOM 0 HG3 LYS A 496 9.535 14.818 -5.991 1.00 0.00 H new ATOM 0 HD2 LYS A 496 7.555 15.886 -6.101 1.00 0.00 H new ATOM 0 HD3 LYS A 496 6.796 14.472 -5.397 1.00 0.00 H new ATOM 0 HE2 LYS A 496 7.526 15.447 -3.100 1.00 0.00 H new ATOM 0 HE3 LYS A 496 7.836 16.937 -3.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 5.616 16.914 -3.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 5.530 16.941 -4.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 5.230 15.498 -3.888 1.00 0.00 H new ATOM 643 N TYR A 497 8.831 12.796 -8.128 1.00 0.00 N ATOM 644 CA TYR A 497 8.178 12.516 -9.402 1.00 0.00 C ATOM 645 C TYR A 497 8.888 11.360 -10.103 1.00 0.00 C ATOM 646 O TYR A 497 8.252 10.440 -10.618 1.00 0.00 O ATOM 647 CB TYR A 497 8.179 13.774 -10.286 1.00 0.00 C ATOM 648 CG TYR A 497 8.737 13.562 -11.679 1.00 0.00 C ATOM 649 CD1 TYR A 497 7.936 13.074 -12.702 1.00 0.00 C ATOM 650 CD2 TYR A 497 10.066 13.846 -11.963 1.00 0.00 C ATOM 651 CE1 TYR A 497 8.444 12.876 -13.972 1.00 0.00 C ATOM 652 CE2 TYR A 497 10.581 13.652 -13.231 1.00 0.00 C ATOM 653 CZ TYR A 497 9.766 13.167 -14.231 1.00 0.00 C ATOM 654 OH TYR A 497 10.275 12.971 -15.494 1.00 0.00 O ATOM 0 H TYR A 497 9.092 13.773 -7.992 1.00 0.00 H new ATOM 0 HA TYR A 497 7.142 12.229 -9.220 1.00 0.00 H new ATOM 0 HB2 TYR A 497 7.157 14.145 -10.370 1.00 0.00 H new ATOM 0 HB3 TYR A 497 8.760 14.551 -9.790 1.00 0.00 H new ATOM 0 HD1 TYR A 497 6.899 12.845 -12.503 1.00 0.00 H new ATOM 0 HD2 TYR A 497 10.708 14.224 -11.181 1.00 0.00 H new ATOM 0 HE1 TYR A 497 7.808 12.495 -14.758 1.00 0.00 H new ATOM 0 HE2 TYR A 497 11.617 13.879 -13.437 1.00 0.00 H new ATOM 0 HH TYR A 497 10.524 12.029 -15.604 1.00 0.00 H new ATOM 664 N VAL A 498 10.215 11.417 -10.097 1.00 0.00 N ATOM 665 CA VAL A 498 11.031 10.381 -10.711 1.00 0.00 C ATOM 666 C VAL A 498 10.808 9.045 -10.011 1.00 0.00 C ATOM 667 O VAL A 498 10.679 8.005 -10.658 1.00 0.00 O ATOM 668 CB VAL A 498 12.531 10.749 -10.665 1.00 0.00 C ATOM 669 CG1 VAL A 498 13.398 9.556 -11.047 1.00 0.00 C ATOM 670 CG2 VAL A 498 12.817 11.932 -11.577 1.00 0.00 C ATOM 0 H VAL A 498 10.749 12.174 -9.671 1.00 0.00 H new ATOM 0 HA VAL A 498 10.729 10.296 -11.755 1.00 0.00 H new ATOM 0 HB VAL A 498 12.779 11.032 -9.642 1.00 0.00 H new ATOM 0 HG11 VAL A 498 14.449 9.842 -11.007 1.00 0.00 H new ATOM 0 HG12 VAL A 498 13.218 8.737 -10.350 1.00 0.00 H new ATOM 0 HG13 VAL A 498 13.148 9.234 -12.058 1.00 0.00 H new ATOM 0 HG21 VAL A 498 13.878 12.178 -11.532 1.00 0.00 H new ATOM 0 HG22 VAL A 498 12.547 11.675 -12.601 1.00 0.00 H new ATOM 0 HG23 VAL A 498 12.231 12.792 -11.252 1.00 0.00 H new ATOM 680 N ARG A 499 10.755 9.082 -8.682 1.00 0.00 N ATOM 681 CA ARG A 499 10.537 7.877 -7.891 1.00 0.00 C ATOM 682 C ARG A 499 9.247 7.182 -8.317 1.00 0.00 C ATOM 683 O ARG A 499 9.115 5.964 -8.196 1.00 0.00 O ATOM 684 CB ARG A 499 10.483 8.223 -6.401 1.00 0.00 C ATOM 685 CG ARG A 499 11.609 7.598 -5.590 1.00 0.00 C ATOM 686 CD ARG A 499 12.304 8.623 -4.705 1.00 0.00 C ATOM 687 NE ARG A 499 12.185 8.293 -3.287 1.00 0.00 N ATOM 688 CZ ARG A 499 12.903 7.349 -2.683 1.00 0.00 C ATOM 689 NH1 ARG A 499 13.794 6.642 -3.369 1.00 0.00 N ATOM 690 NH2 ARG A 499 12.733 7.113 -1.390 1.00 0.00 N ATOM 0 H ARG A 499 10.860 9.934 -8.131 1.00 0.00 H new ATOM 0 HA ARG A 499 11.370 7.196 -8.064 1.00 0.00 H new ATOM 0 HB2 ARG A 499 10.522 9.306 -6.286 1.00 0.00 H new ATOM 0 HB3 ARG A 499 9.527 7.893 -5.994 1.00 0.00 H new ATOM 0 HG2 ARG A 499 11.209 6.795 -4.971 1.00 0.00 H new ATOM 0 HG3 ARG A 499 12.337 7.148 -6.265 1.00 0.00 H new ATOM 0 HD2 ARG A 499 13.358 8.681 -4.976 1.00 0.00 H new ATOM 0 HD3 ARG A 499 11.874 9.608 -4.885 1.00 0.00 H new ATOM 0 HE ARG A 499 11.512 8.817 -2.727 1.00 0.00 H new ATOM 0 HH11 ARG A 499 13.931 6.821 -4.364 1.00 0.00 H new ATOM 0 HH12 ARG A 499 14.342 5.920 -2.901 1.00 0.00 H new ATOM 0 HH21 ARG A 499 12.052 7.655 -0.858 1.00 0.00 H new ATOM 0 HH22 ARG A 499 13.283 6.390 -0.927 1.00 0.00 H new ATOM 704 N ALA A 500 8.302 7.968 -8.824 1.00 0.00 N ATOM 705 CA ALA A 500 7.025 7.433 -9.278 1.00 0.00 C ATOM 706 C ALA A 500 7.198 6.673 -10.587 1.00 0.00 C ATOM 707 O ALA A 500 6.574 5.634 -10.802 1.00 0.00 O ATOM 708 CB ALA A 500 6.010 8.553 -9.444 1.00 0.00 C ATOM 0 H ALA A 500 8.398 8.978 -8.930 1.00 0.00 H new ATOM 0 HA ALA A 500 6.655 6.739 -8.524 1.00 0.00 H new ATOM 0 HB1 ALA A 500 5.061 8.137 -9.784 1.00 0.00 H new ATOM 0 HB2 ALA A 500 5.864 9.056 -8.488 1.00 0.00 H new ATOM 0 HB3 ALA A 500 6.376 9.270 -10.179 1.00 0.00 H new ATOM 714 N GLU A 501 8.058 7.196 -11.455 1.00 0.00 N ATOM 715 CA GLU A 501 8.324 6.564 -12.742 1.00 0.00 C ATOM 716 C GLU A 501 9.009 5.220 -12.536 1.00 0.00 C ATOM 717 O GLU A 501 8.692 4.240 -13.212 1.00 0.00 O ATOM 718 CB GLU A 501 9.200 7.469 -13.614 1.00 0.00 C ATOM 719 CG GLU A 501 8.863 8.946 -13.493 1.00 0.00 C ATOM 720 CD GLU A 501 9.468 9.774 -14.609 1.00 0.00 C ATOM 721 OE1 GLU A 501 8.971 9.687 -15.751 1.00 0.00 O ATOM 722 OE2 GLU A 501 10.442 10.511 -14.342 1.00 0.00 O ATOM 0 H GLU A 501 8.582 8.055 -11.291 1.00 0.00 H new ATOM 0 HA GLU A 501 7.373 6.404 -13.250 1.00 0.00 H new ATOM 0 HB2 GLU A 501 10.245 7.320 -13.341 1.00 0.00 H new ATOM 0 HB3 GLU A 501 9.096 7.166 -14.656 1.00 0.00 H new ATOM 0 HG2 GLU A 501 7.780 9.070 -13.500 1.00 0.00 H new ATOM 0 HG3 GLU A 501 9.221 9.319 -12.533 1.00 0.00 H new ATOM 729 N GLN A 502 9.945 5.182 -11.593 1.00 0.00 N ATOM 730 CA GLN A 502 10.673 3.957 -11.287 1.00 0.00 C ATOM 731 C GLN A 502 9.705 2.847 -10.890 1.00 0.00 C ATOM 732 O GLN A 502 9.873 1.692 -11.281 1.00 0.00 O ATOM 733 CB GLN A 502 11.678 4.202 -10.161 1.00 0.00 C ATOM 734 CG GLN A 502 13.065 4.578 -10.655 1.00 0.00 C ATOM 735 CD GLN A 502 13.916 5.220 -9.577 1.00 0.00 C ATOM 736 OE1 GLN A 502 14.126 4.643 -8.510 1.00 0.00 O ATOM 737 NE2 GLN A 502 14.411 6.422 -9.851 1.00 0.00 N ATOM 0 H GLN A 502 10.217 5.986 -11.028 1.00 0.00 H new ATOM 0 HA GLN A 502 11.215 3.647 -12.181 1.00 0.00 H new ATOM 0 HB2 GLN A 502 11.303 4.997 -9.517 1.00 0.00 H new ATOM 0 HB3 GLN A 502 11.751 3.303 -9.548 1.00 0.00 H new ATOM 0 HG2 GLN A 502 13.568 3.685 -11.026 1.00 0.00 H new ATOM 0 HG3 GLN A 502 12.973 5.265 -11.496 1.00 0.00 H new ATOM 0 HE21 GLN A 502 14.211 6.863 -10.749 1.00 0.00 H new ATOM 0 HE22 GLN A 502 14.991 6.904 -9.164 1.00 0.00 H new ATOM 746 N LYS A 503 8.686 3.210 -10.117 1.00 0.00 N ATOM 747 CA LYS A 503 7.683 2.251 -9.675 1.00 0.00 C ATOM 748 C LYS A 503 6.884 1.728 -10.862 1.00 0.00 C ATOM 749 O LYS A 503 6.545 0.547 -10.927 1.00 0.00 O ATOM 750 CB LYS A 503 6.744 2.893 -8.653 1.00 0.00 C ATOM 751 CG LYS A 503 7.292 2.888 -7.235 1.00 0.00 C ATOM 752 CD LYS A 503 6.912 4.155 -6.486 1.00 0.00 C ATOM 753 CE LYS A 503 5.515 4.053 -5.893 1.00 0.00 C ATOM 754 NZ LYS A 503 5.436 4.691 -4.549 1.00 0.00 N ATOM 0 H LYS A 503 8.534 4.162 -9.784 1.00 0.00 H new ATOM 0 HA LYS A 503 8.196 1.413 -9.203 1.00 0.00 H new ATOM 0 HB2 LYS A 503 6.544 3.922 -8.952 1.00 0.00 H new ATOM 0 HB3 LYS A 503 5.790 2.365 -8.667 1.00 0.00 H new ATOM 0 HG2 LYS A 503 6.910 2.019 -6.699 1.00 0.00 H new ATOM 0 HG3 LYS A 503 8.377 2.793 -7.264 1.00 0.00 H new ATOM 0 HD2 LYS A 503 7.634 4.339 -5.690 1.00 0.00 H new ATOM 0 HD3 LYS A 503 6.960 5.008 -7.163 1.00 0.00 H new ATOM 0 HE2 LYS A 503 4.800 4.529 -6.564 1.00 0.00 H new ATOM 0 HE3 LYS A 503 5.229 3.004 -5.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 503 4.469 4.601 -4.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 503 6.100 4.220 -3.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 503 5.684 5.698 -4.628 1.00 0.00 H new ATOM 768 N ASP A 504 6.593 2.619 -11.806 1.00 0.00 N ATOM 769 CA ASP A 504 5.841 2.249 -13.000 1.00 0.00 C ATOM 770 C ASP A 504 6.621 1.235 -13.827 1.00 0.00 C ATOM 771 O ASP A 504 6.048 0.302 -14.388 1.00 0.00 O ATOM 772 CB ASP A 504 5.535 3.489 -13.842 1.00 0.00 C ATOM 773 CG ASP A 504 4.336 3.290 -14.748 1.00 0.00 C ATOM 774 OD1 ASP A 504 3.329 2.717 -14.283 1.00 0.00 O ATOM 775 OD2 ASP A 504 4.404 3.707 -15.924 1.00 0.00 O ATOM 0 H ASP A 504 6.866 3.601 -11.767 1.00 0.00 H new ATOM 0 HA ASP A 504 4.900 1.796 -12.688 1.00 0.00 H new ATOM 0 HB2 ASP A 504 5.352 4.337 -13.182 1.00 0.00 H new ATOM 0 HB3 ASP A 504 6.407 3.738 -14.447 1.00 0.00 H new ATOM 780 N ARG A 505 7.936 1.421 -13.889 1.00 0.00 N ATOM 781 CA ARG A 505 8.803 0.520 -14.638 1.00 0.00 C ATOM 782 C ARG A 505 8.674 -0.903 -14.110 1.00 0.00 C ATOM 783 O ARG A 505 8.517 -1.854 -14.878 1.00 0.00 O ATOM 784 CB ARG A 505 10.258 0.981 -14.539 1.00 0.00 C ATOM 785 CG ARG A 505 11.144 0.448 -15.654 1.00 0.00 C ATOM 786 CD ARG A 505 12.613 0.466 -15.257 1.00 0.00 C ATOM 787 NE ARG A 505 13.164 -0.882 -15.140 1.00 0.00 N ATOM 788 CZ ARG A 505 14.277 -1.172 -14.472 1.00 0.00 C ATOM 789 NH1 ARG A 505 14.962 -0.213 -13.859 1.00 0.00 N ATOM 790 NH2 ARG A 505 14.708 -2.425 -14.414 1.00 0.00 N ATOM 0 H ARG A 505 8.424 2.189 -13.429 1.00 0.00 H new ATOM 0 HA ARG A 505 8.496 0.537 -15.684 1.00 0.00 H new ATOM 0 HB2 ARG A 505 10.287 2.071 -14.553 1.00 0.00 H new ATOM 0 HB3 ARG A 505 10.666 0.664 -13.579 1.00 0.00 H new ATOM 0 HG2 ARG A 505 10.846 -0.571 -15.902 1.00 0.00 H new ATOM 0 HG3 ARG A 505 11.001 1.049 -16.552 1.00 0.00 H new ATOM 0 HD2 ARG A 505 13.182 1.027 -15.998 1.00 0.00 H new ATOM 0 HD3 ARG A 505 12.725 0.988 -14.307 1.00 0.00 H new ATOM 0 HE ARG A 505 12.666 -1.646 -15.597 1.00 0.00 H new ATOM 0 HH11 ARG A 505 14.635 0.752 -13.899 1.00 0.00 H new ATOM 0 HH12 ARG A 505 15.815 -0.442 -13.348 1.00 0.00 H new ATOM 0 HH21 ARG A 505 14.186 -3.166 -14.882 1.00 0.00 H new ATOM 0 HH22 ARG A 505 15.562 -2.648 -13.902 1.00 0.00 H new ATOM 804 N GLN A 506 8.731 -1.040 -12.789 1.00 0.00 N ATOM 805 CA GLN A 506 8.613 -2.343 -12.150 1.00 0.00 C ATOM 806 C GLN A 506 7.236 -2.942 -12.414 1.00 0.00 C ATOM 807 O GLN A 506 7.085 -4.159 -12.514 1.00 0.00 O ATOM 808 CB GLN A 506 8.850 -2.221 -10.642 1.00 0.00 C ATOM 809 CG GLN A 506 10.317 -2.101 -10.265 1.00 0.00 C ATOM 810 CD GLN A 506 10.519 -1.838 -8.785 1.00 0.00 C ATOM 811 OE1 GLN A 506 11.034 -0.790 -8.394 1.00 0.00 O ATOM 812 NE2 GLN A 506 10.113 -2.790 -7.953 1.00 0.00 N ATOM 0 H GLN A 506 8.858 -0.263 -12.141 1.00 0.00 H new ATOM 0 HA GLN A 506 9.370 -3.003 -12.573 1.00 0.00 H new ATOM 0 HB2 GLN A 506 8.315 -1.348 -10.268 1.00 0.00 H new ATOM 0 HB3 GLN A 506 8.426 -3.093 -10.144 1.00 0.00 H new ATOM 0 HG2 GLN A 506 10.836 -3.019 -10.541 1.00 0.00 H new ATOM 0 HG3 GLN A 506 10.771 -1.293 -10.839 1.00 0.00 H new ATOM 0 HE21 GLN A 506 9.691 -3.643 -8.321 1.00 0.00 H new ATOM 0 HE22 GLN A 506 10.223 -2.668 -6.946 1.00 0.00 H new ATOM 821 N HIS A 507 6.236 -2.074 -12.530 1.00 0.00 N ATOM 822 CA HIS A 507 4.871 -2.513 -12.790 1.00 0.00 C ATOM 823 C HIS A 507 4.766 -3.141 -14.175 1.00 0.00 C ATOM 824 O HIS A 507 4.037 -4.113 -14.373 1.00 0.00 O ATOM 825 CB HIS A 507 3.901 -1.335 -12.667 1.00 0.00 C ATOM 826 CG HIS A 507 2.828 -1.547 -11.645 1.00 0.00 C ATOM 827 ND1 HIS A 507 2.349 -0.725 -10.681 1.00 0.00 N flip ATOM 828 CD2 HIS A 507 2.114 -2.722 -11.534 1.00 0.00 C flip ATOM 829 CE1 HIS A 507 1.364 -1.412 -10.014 1.00 0.00 C flip ATOM 830 NE2 HIS A 507 1.241 -2.613 -10.548 1.00 0.00 N flip ATOM 0 H HIS A 507 6.346 -1.063 -12.448 1.00 0.00 H new ATOM 0 HA HIS A 507 4.604 -3.265 -12.048 1.00 0.00 H new ATOM 0 HB2 HIS A 507 4.463 -0.437 -12.410 1.00 0.00 H new ATOM 0 HB3 HIS A 507 3.437 -1.154 -13.637 1.00 0.00 H new ATOM 0 HD2 HIS A 507 2.248 -3.595 -12.156 1.00 0.00 H new ATOM 0 HE1 HIS A 507 0.784 -1.031 -9.186 1.00 0.00 H new ATOM 0 HE2 HIS A 507 0.584 -3.334 -10.250 1.00 0.00 H new ATOM 839 N THR A 508 5.506 -2.585 -15.131 1.00 0.00 N ATOM 840 CA THR A 508 5.502 -3.101 -16.494 1.00 0.00 C ATOM 841 C THR A 508 5.930 -4.561 -16.503 1.00 0.00 C ATOM 842 O THR A 508 5.231 -5.423 -17.036 1.00 0.00 O ATOM 843 CB THR A 508 6.433 -2.271 -17.382 1.00 0.00 C ATOM 844 OG1 THR A 508 6.013 -0.919 -17.424 1.00 0.00 O ATOM 845 CG2 THR A 508 6.512 -2.773 -18.808 1.00 0.00 C ATOM 0 H THR A 508 6.114 -1.779 -14.986 1.00 0.00 H new ATOM 0 HA THR A 508 4.489 -3.029 -16.891 1.00 0.00 H new ATOM 0 HB THR A 508 7.420 -2.365 -16.929 1.00 0.00 H new ATOM 0 HG1 THR A 508 5.052 -0.881 -17.614 1.00 0.00 H new ATOM 0 HG21 THR A 508 7.189 -2.138 -19.380 1.00 0.00 H new ATOM 0 HG22 THR A 508 6.884 -3.798 -18.813 1.00 0.00 H new ATOM 0 HG23 THR A 508 5.520 -2.745 -19.259 1.00 0.00 H new ATOM 853 N LEU A 509 7.078 -4.835 -15.893 1.00 0.00 N ATOM 854 CA LEU A 509 7.595 -6.192 -15.810 1.00 0.00 C ATOM 855 C LEU A 509 6.577 -7.102 -15.139 1.00 0.00 C ATOM 856 O LEU A 509 6.214 -8.155 -15.667 1.00 0.00 O ATOM 857 CB LEU A 509 8.901 -6.199 -15.016 1.00 0.00 C ATOM 858 CG LEU A 509 10.132 -5.701 -15.776 1.00 0.00 C ATOM 859 CD1 LEU A 509 10.736 -6.830 -16.592 1.00 0.00 C ATOM 860 CD2 LEU A 509 9.782 -4.518 -16.670 1.00 0.00 C ATOM 0 H LEU A 509 7.668 -4.132 -15.448 1.00 0.00 H new ATOM 0 HA LEU A 509 7.785 -6.560 -16.818 1.00 0.00 H new ATOM 0 HB2 LEU A 509 8.770 -5.582 -14.127 1.00 0.00 H new ATOM 0 HB3 LEU A 509 9.093 -7.216 -14.673 1.00 0.00 H new ATOM 0 HG LEU A 509 10.870 -5.362 -15.049 1.00 0.00 H new ATOM 0 HD11 LEU A 509 11.611 -6.463 -17.128 1.00 0.00 H new ATOM 0 HD12 LEU A 509 11.031 -7.642 -15.927 1.00 0.00 H new ATOM 0 HD13 LEU A 509 9.999 -7.197 -17.307 1.00 0.00 H new ATOM 0 HD21 LEU A 509 10.675 -4.184 -17.198 1.00 0.00 H new ATOM 0 HD22 LEU A 509 9.024 -4.820 -17.393 1.00 0.00 H new ATOM 0 HD23 LEU A 509 9.396 -3.702 -16.059 1.00 0.00 H new ATOM 872 N LYS A 510 6.115 -6.677 -13.969 1.00 0.00 N ATOM 873 CA LYS A 510 5.130 -7.435 -13.211 1.00 0.00 C ATOM 874 C LYS A 510 3.863 -7.647 -14.033 1.00 0.00 C ATOM 875 O LYS A 510 3.289 -8.733 -14.029 1.00 0.00 O ATOM 876 CB LYS A 510 4.791 -6.711 -11.908 1.00 0.00 C ATOM 877 CG LYS A 510 5.987 -6.522 -10.989 1.00 0.00 C ATOM 878 CD LYS A 510 5.698 -5.501 -9.901 1.00 0.00 C ATOM 879 CE LYS A 510 6.432 -5.837 -8.613 1.00 0.00 C ATOM 880 NZ LYS A 510 6.108 -4.878 -7.521 1.00 0.00 N ATOM 0 H LYS A 510 6.409 -5.808 -13.524 1.00 0.00 H new ATOM 0 HA LYS A 510 5.558 -8.409 -12.975 1.00 0.00 H new ATOM 0 HB2 LYS A 510 4.367 -5.735 -12.144 1.00 0.00 H new ATOM 0 HB3 LYS A 510 4.022 -7.274 -11.379 1.00 0.00 H new ATOM 0 HG2 LYS A 510 6.251 -7.476 -10.533 1.00 0.00 H new ATOM 0 HG3 LYS A 510 6.849 -6.199 -11.573 1.00 0.00 H new ATOM 0 HD2 LYS A 510 5.996 -4.510 -10.243 1.00 0.00 H new ATOM 0 HD3 LYS A 510 4.625 -5.464 -9.711 1.00 0.00 H new ATOM 0 HE2 LYS A 510 6.169 -6.847 -8.299 1.00 0.00 H new ATOM 0 HE3 LYS A 510 7.507 -5.830 -8.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 6.629 -5.143 -6.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 6.382 -3.917 -7.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 5.086 -4.903 -7.329 1.00 0.00 H new ATOM 894 N HIS A 511 3.436 -6.604 -14.744 1.00 0.00 N ATOM 895 CA HIS A 511 2.237 -6.684 -15.575 1.00 0.00 C ATOM 896 C HIS A 511 2.319 -7.873 -16.528 1.00 0.00 C ATOM 897 O HIS A 511 1.329 -8.564 -16.765 1.00 0.00 O ATOM 898 CB HIS A 511 2.055 -5.386 -16.368 1.00 0.00 C ATOM 899 CG HIS A 511 0.845 -4.601 -15.963 1.00 0.00 C ATOM 900 ND1 HIS A 511 0.824 -3.760 -14.870 1.00 0.00 N ATOM 901 CD2 HIS A 511 -0.391 -4.531 -16.513 1.00 0.00 C ATOM 902 CE1 HIS A 511 -0.372 -3.208 -14.764 1.00 0.00 C ATOM 903 NE2 HIS A 511 -1.127 -3.658 -15.750 1.00 0.00 N ATOM 0 H HIS A 511 3.901 -5.697 -14.761 1.00 0.00 H new ATOM 0 HA HIS A 511 1.376 -6.824 -14.922 1.00 0.00 H new ATOM 0 HB2 HIS A 511 2.941 -4.764 -16.240 1.00 0.00 H new ATOM 0 HB3 HIS A 511 1.984 -5.625 -17.429 1.00 0.00 H new ATOM 0 HD2 HIS A 511 -0.734 -5.063 -17.388 1.00 0.00 H new ATOM 0 HE1 HIS A 511 -0.680 -2.508 -14.001 1.00 0.00 H new ATOM 0 HE2 HIS A 511 -2.099 -3.399 -15.918 1.00 0.00 H new ATOM 912 N PHE A 512 3.513 -8.104 -17.063 1.00 0.00 N ATOM 913 CA PHE A 512 3.741 -9.209 -17.985 1.00 0.00 C ATOM 914 C PHE A 512 3.424 -10.546 -17.317 1.00 0.00 C ATOM 915 O PHE A 512 2.689 -11.368 -17.864 1.00 0.00 O ATOM 916 CB PHE A 512 5.198 -9.200 -18.454 1.00 0.00 C ATOM 917 CG PHE A 512 5.383 -8.770 -19.881 1.00 0.00 C ATOM 918 CD1 PHE A 512 4.629 -9.331 -20.902 1.00 0.00 C ATOM 919 CD2 PHE A 512 6.325 -7.805 -20.202 1.00 0.00 C ATOM 920 CE1 PHE A 512 4.814 -8.935 -22.211 1.00 0.00 C ATOM 921 CE2 PHE A 512 6.513 -7.407 -21.510 1.00 0.00 C ATOM 922 CZ PHE A 512 5.757 -7.973 -22.516 1.00 0.00 C ATOM 0 H PHE A 512 4.340 -7.538 -16.873 1.00 0.00 H new ATOM 0 HA PHE A 512 3.080 -9.084 -18.843 1.00 0.00 H new ATOM 0 HB2 PHE A 512 5.772 -8.535 -17.809 1.00 0.00 H new ATOM 0 HB3 PHE A 512 5.614 -10.200 -18.331 1.00 0.00 H new ATOM 0 HD1 PHE A 512 3.891 -10.084 -20.670 1.00 0.00 H new ATOM 0 HD2 PHE A 512 6.919 -7.359 -19.418 1.00 0.00 H new ATOM 0 HE1 PHE A 512 4.221 -9.378 -22.998 1.00 0.00 H new ATOM 0 HE2 PHE A 512 7.250 -6.654 -21.746 1.00 0.00 H new ATOM 0 HZ PHE A 512 5.902 -7.664 -23.541 1.00 0.00 H new ATOM 932 N GLU A 513 3.999 -10.757 -16.136 1.00 0.00 N ATOM 933 CA GLU A 513 3.795 -11.997 -15.392 1.00 0.00 C ATOM 934 C GLU A 513 2.420 -12.039 -14.730 1.00 0.00 C ATOM 935 O GLU A 513 1.833 -13.109 -14.573 1.00 0.00 O ATOM 936 CB GLU A 513 4.886 -12.160 -14.332 1.00 0.00 C ATOM 937 CG GLU A 513 6.296 -12.122 -14.899 1.00 0.00 C ATOM 938 CD GLU A 513 7.347 -11.896 -13.829 1.00 0.00 C ATOM 939 OE1 GLU A 513 7.700 -12.868 -13.129 1.00 0.00 O ATOM 940 OE2 GLU A 513 7.817 -10.747 -13.693 1.00 0.00 O ATOM 0 H GLU A 513 4.611 -10.085 -15.673 1.00 0.00 H new ATOM 0 HA GLU A 513 3.850 -12.821 -16.103 1.00 0.00 H new ATOM 0 HB2 GLU A 513 4.781 -11.369 -13.589 1.00 0.00 H new ATOM 0 HB3 GLU A 513 4.738 -13.107 -13.813 1.00 0.00 H new ATOM 0 HG2 GLU A 513 6.502 -13.060 -15.414 1.00 0.00 H new ATOM 0 HG3 GLU A 513 6.363 -11.328 -15.643 1.00 0.00 H new ATOM 947 N HIS A 514 1.910 -10.875 -14.340 1.00 0.00 N ATOM 948 CA HIS A 514 0.605 -10.798 -13.695 1.00 0.00 C ATOM 949 C HIS A 514 -0.497 -11.209 -14.660 1.00 0.00 C ATOM 950 O HIS A 514 -1.222 -12.174 -14.419 1.00 0.00 O ATOM 951 CB HIS A 514 0.346 -9.380 -13.174 1.00 0.00 C ATOM 952 CG HIS A 514 -0.026 -9.334 -11.725 1.00 0.00 C ATOM 953 ND1 HIS A 514 0.901 -9.411 -10.707 1.00 0.00 N ATOM 954 CD2 HIS A 514 -1.233 -9.215 -11.123 1.00 0.00 C ATOM 955 CE1 HIS A 514 0.280 -9.344 -9.543 1.00 0.00 C ATOM 956 NE2 HIS A 514 -1.015 -9.223 -9.767 1.00 0.00 N ATOM 0 H HIS A 514 2.378 -9.977 -14.459 1.00 0.00 H new ATOM 0 HA HIS A 514 0.603 -11.488 -12.851 1.00 0.00 H new ATOM 0 HB2 HIS A 514 1.239 -8.775 -13.331 1.00 0.00 H new ATOM 0 HB3 HIS A 514 -0.453 -8.926 -13.760 1.00 0.00 H new ATOM 0 HD2 HIS A 514 -2.189 -9.130 -11.617 1.00 0.00 H new ATOM 0 HE1 HIS A 514 0.752 -9.382 -8.572 1.00 0.00 H new ATOM 0 HE2 HIS A 514 -1.736 -9.148 -9.050 1.00 0.00 H new ATOM 965 N VAL A 515 -0.614 -10.474 -15.759 1.00 0.00 N ATOM 966 CA VAL A 515 -1.624 -10.765 -16.766 1.00 0.00 C ATOM 967 C VAL A 515 -1.418 -12.156 -17.361 1.00 0.00 C ATOM 968 O VAL A 515 -2.353 -12.765 -17.877 1.00 0.00 O ATOM 969 CB VAL A 515 -1.609 -9.719 -17.898 1.00 0.00 C ATOM 970 CG1 VAL A 515 -0.330 -9.824 -18.716 1.00 0.00 C ATOM 971 CG2 VAL A 515 -2.833 -9.877 -18.787 1.00 0.00 C ATOM 0 H VAL A 515 -0.021 -9.672 -15.975 1.00 0.00 H new ATOM 0 HA VAL A 515 -2.592 -10.728 -16.267 1.00 0.00 H new ATOM 0 HB VAL A 515 -1.639 -8.727 -17.447 1.00 0.00 H new ATOM 0 HG11 VAL A 515 -0.343 -9.076 -19.509 1.00 0.00 H new ATOM 0 HG12 VAL A 515 0.531 -9.653 -18.069 1.00 0.00 H new ATOM 0 HG13 VAL A 515 -0.261 -10.818 -19.157 1.00 0.00 H new ATOM 0 HG21 VAL A 515 -2.805 -9.130 -19.580 1.00 0.00 H new ATOM 0 HG22 VAL A 515 -2.837 -10.874 -19.227 1.00 0.00 H new ATOM 0 HG23 VAL A 515 -3.735 -9.740 -18.191 1.00 0.00 H new ATOM 981 N ARG A 516 -0.187 -12.653 -17.282 1.00 0.00 N ATOM 982 CA ARG A 516 0.140 -13.971 -17.811 1.00 0.00 C ATOM 983 C ARG A 516 -0.344 -15.072 -16.871 1.00 0.00 C ATOM 984 O ARG A 516 -0.559 -16.210 -17.291 1.00 0.00 O ATOM 985 CB ARG A 516 1.650 -14.097 -18.026 1.00 0.00 C ATOM 986 CG ARG A 516 2.074 -15.437 -18.604 1.00 0.00 C ATOM 987 CD ARG A 516 3.536 -15.424 -19.023 1.00 0.00 C ATOM 988 NE ARG A 516 4.156 -16.739 -18.884 1.00 0.00 N ATOM 989 CZ ARG A 516 4.526 -17.264 -17.718 1.00 0.00 C ATOM 990 NH1 ARG A 516 4.338 -16.592 -16.589 1.00 0.00 N ATOM 991 NH2 ARG A 516 5.085 -18.467 -17.681 1.00 0.00 N ATOM 0 H ARG A 516 0.600 -12.162 -16.857 1.00 0.00 H new ATOM 0 HA ARG A 516 -0.368 -14.086 -18.768 1.00 0.00 H new ATOM 0 HB2 ARG A 516 1.981 -13.302 -18.694 1.00 0.00 H new ATOM 0 HB3 ARG A 516 2.158 -13.945 -17.074 1.00 0.00 H new ATOM 0 HG2 ARG A 516 1.913 -16.221 -17.864 1.00 0.00 H new ATOM 0 HG3 ARG A 516 1.450 -15.678 -19.464 1.00 0.00 H new ATOM 0 HD2 ARG A 516 3.613 -15.094 -20.059 1.00 0.00 H new ATOM 0 HD3 ARG A 516 4.081 -14.700 -18.417 1.00 0.00 H new ATOM 0 HE ARG A 516 4.315 -17.287 -19.730 1.00 0.00 H new ATOM 0 HH11 ARG A 516 3.908 -15.667 -16.611 1.00 0.00 H new ATOM 0 HH12 ARG A 516 4.624 -17.000 -15.699 1.00 0.00 H new ATOM 0 HH21 ARG A 516 5.231 -18.988 -18.545 1.00 0.00 H new ATOM 0 HH22 ARG A 516 5.369 -18.870 -16.788 1.00 0.00 H new ATOM 1005 N MET A 517 -0.512 -14.730 -15.596 1.00 0.00 N ATOM 1006 CA MET A 517 -0.968 -15.695 -14.600 1.00 0.00 C ATOM 1007 C MET A 517 -2.492 -15.735 -14.522 1.00 0.00 C ATOM 1008 O MET A 517 -3.069 -16.686 -13.996 1.00 0.00 O ATOM 1009 CB MET A 517 -0.386 -15.351 -13.227 1.00 0.00 C ATOM 1010 CG MET A 517 1.052 -15.806 -13.046 1.00 0.00 C ATOM 1011 SD MET A 517 1.491 -16.053 -11.314 1.00 0.00 S ATOM 1012 CE MET A 517 1.140 -14.431 -10.641 1.00 0.00 C ATOM 0 H MET A 517 -0.340 -13.794 -15.229 1.00 0.00 H new ATOM 0 HA MET A 517 -0.617 -16.681 -14.905 1.00 0.00 H new ATOM 0 HB2 MET A 517 -0.439 -14.272 -13.079 1.00 0.00 H new ATOM 0 HB3 MET A 517 -1.004 -15.809 -12.454 1.00 0.00 H new ATOM 0 HG2 MET A 517 1.206 -16.737 -13.592 1.00 0.00 H new ATOM 0 HG3 MET A 517 1.721 -15.065 -13.484 1.00 0.00 H new ATOM 0 HE1 MET A 517 1.556 -14.356 -9.636 1.00 0.00 H new ATOM 0 HE2 MET A 517 1.588 -13.668 -11.277 1.00 0.00 H new ATOM 0 HE3 MET A 517 0.061 -14.280 -10.599 1.00 0.00 H new ATOM 1022 N VAL A 518 -3.143 -14.698 -15.045 1.00 0.00 N ATOM 1023 CA VAL A 518 -4.599 -14.626 -15.027 1.00 0.00 C ATOM 1024 C VAL A 518 -5.174 -14.665 -16.438 1.00 0.00 C ATOM 1025 O VAL A 518 -6.148 -15.370 -16.702 1.00 0.00 O ATOM 1026 CB VAL A 518 -5.086 -13.345 -14.326 1.00 0.00 C ATOM 1027 CG1 VAL A 518 -4.800 -13.412 -12.833 1.00 0.00 C ATOM 1028 CG2 VAL A 518 -4.439 -12.116 -14.946 1.00 0.00 C ATOM 0 H VAL A 518 -2.685 -13.899 -15.485 1.00 0.00 H new ATOM 0 HA VAL A 518 -4.950 -15.496 -14.472 1.00 0.00 H new ATOM 0 HB VAL A 518 -6.164 -13.266 -14.463 1.00 0.00 H new ATOM 0 HG11 VAL A 518 -5.151 -12.498 -12.354 1.00 0.00 H new ATOM 0 HG12 VAL A 518 -5.317 -14.269 -12.402 1.00 0.00 H new ATOM 0 HG13 VAL A 518 -3.727 -13.517 -12.672 1.00 0.00 H new ATOM 0 HG21 VAL A 518 -4.796 -11.221 -14.437 1.00 0.00 H new ATOM 0 HG22 VAL A 518 -3.356 -12.184 -14.844 1.00 0.00 H new ATOM 0 HG23 VAL A 518 -4.701 -12.061 -16.003 1.00 0.00 H new ATOM 1038 N ASP A 519 -4.568 -13.901 -17.339 1.00 0.00 N ATOM 1039 CA ASP A 519 -5.023 -13.846 -18.724 1.00 0.00 C ATOM 1040 C ASP A 519 -3.878 -14.133 -19.696 1.00 0.00 C ATOM 1041 O ASP A 519 -3.377 -13.227 -20.361 1.00 0.00 O ATOM 1042 CB ASP A 519 -5.626 -12.472 -19.025 1.00 0.00 C ATOM 1043 CG ASP A 519 -6.769 -12.549 -20.018 1.00 0.00 C ATOM 1044 OD1 ASP A 519 -6.737 -13.441 -20.891 1.00 0.00 O ATOM 1045 OD2 ASP A 519 -7.695 -11.717 -19.922 1.00 0.00 O ATOM 0 H ASP A 519 -3.761 -13.311 -17.136 1.00 0.00 H new ATOM 0 HA ASP A 519 -5.785 -14.614 -18.858 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -5.983 -12.024 -18.098 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -4.850 -11.816 -19.418 1.00 0.00 H new ATOM 1050 N PRO A 520 -3.448 -15.403 -19.790 1.00 0.00 N ATOM 1051 CA PRO A 520 -2.358 -15.805 -20.687 1.00 0.00 C ATOM 1052 C PRO A 520 -2.688 -15.546 -22.154 1.00 0.00 C ATOM 1053 O PRO A 520 -1.799 -15.290 -22.967 1.00 0.00 O ATOM 1054 CB PRO A 520 -2.212 -17.312 -20.436 1.00 0.00 C ATOM 1055 CG PRO A 520 -2.870 -17.549 -19.121 1.00 0.00 C ATOM 1056 CD PRO A 520 -3.984 -16.547 -19.036 1.00 0.00 C ATOM 0 HA PRO A 520 -1.448 -15.238 -20.490 1.00 0.00 H new ATOM 0 HB2 PRO A 520 -2.689 -17.892 -21.226 1.00 0.00 H new ATOM 0 HB3 PRO A 520 -1.163 -17.608 -20.412 1.00 0.00 H new ATOM 0 HG2 PRO A 520 -3.254 -18.567 -19.053 1.00 0.00 H new ATOM 0 HG3 PRO A 520 -2.164 -17.419 -18.301 1.00 0.00 H new ATOM 0 HD2 PRO A 520 -4.905 -16.927 -19.478 1.00 0.00 H new ATOM 0 HD3 PRO A 520 -4.211 -16.281 -18.004 1.00 0.00 H new ATOM 1064 N LYS A 521 -3.974 -15.617 -22.485 1.00 0.00 N ATOM 1065 CA LYS A 521 -4.425 -15.394 -23.855 1.00 0.00 C ATOM 1066 C LYS A 521 -4.141 -13.964 -24.298 1.00 0.00 C ATOM 1067 O LYS A 521 -3.453 -13.738 -25.293 1.00 0.00 O ATOM 1068 CB LYS A 521 -5.922 -15.689 -23.973 1.00 0.00 C ATOM 1069 CG LYS A 521 -6.296 -17.107 -23.572 1.00 0.00 C ATOM 1070 CD LYS A 521 -7.561 -17.136 -22.730 1.00 0.00 C ATOM 1071 CE LYS A 521 -7.248 -17.015 -21.249 1.00 0.00 C ATOM 1072 NZ LYS A 521 -6.432 -18.160 -20.758 1.00 0.00 N ATOM 0 H LYS A 521 -4.722 -15.827 -21.824 1.00 0.00 H new ATOM 0 HA LYS A 521 -3.873 -16.071 -24.507 1.00 0.00 H new ATOM 0 HB2 LYS A 521 -6.473 -14.986 -23.348 1.00 0.00 H new ATOM 0 HB3 LYS A 521 -6.238 -15.516 -25.002 1.00 0.00 H new ATOM 0 HG2 LYS A 521 -6.440 -17.713 -24.467 1.00 0.00 H new ATOM 0 HG3 LYS A 521 -5.475 -17.556 -23.012 1.00 0.00 H new ATOM 0 HD2 LYS A 521 -8.219 -16.321 -23.032 1.00 0.00 H new ATOM 0 HD3 LYS A 521 -8.100 -18.065 -22.914 1.00 0.00 H new ATOM 0 HE2 LYS A 521 -6.713 -16.083 -21.066 1.00 0.00 H new ATOM 0 HE3 LYS A 521 -8.179 -16.964 -20.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 521 -6.534 -18.242 -19.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 521 -6.759 -19.038 -21.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 521 -5.432 -18.001 -20.995 1.00 0.00 H new ATOM 1086 N LYS A 522 -4.674 -13.002 -23.553 1.00 0.00 N ATOM 1087 CA LYS A 522 -4.474 -11.594 -23.873 1.00 0.00 C ATOM 1088 C LYS A 522 -3.075 -11.140 -23.466 1.00 0.00 C ATOM 1089 O LYS A 522 -2.513 -10.218 -24.061 1.00 0.00 O ATOM 1090 CB LYS A 522 -5.538 -10.731 -23.185 1.00 0.00 C ATOM 1091 CG LYS A 522 -5.267 -10.467 -21.712 1.00 0.00 C ATOM 1092 CD LYS A 522 -4.543 -9.146 -21.508 1.00 0.00 C ATOM 1093 CE LYS A 522 -5.140 -8.355 -20.355 1.00 0.00 C ATOM 1094 NZ LYS A 522 -6.443 -7.735 -20.723 1.00 0.00 N ATOM 0 H LYS A 522 -5.246 -13.171 -22.726 1.00 0.00 H new ATOM 0 HA LYS A 522 -4.573 -11.472 -24.952 1.00 0.00 H new ATOM 0 HB2 LYS A 522 -5.609 -9.777 -23.707 1.00 0.00 H new ATOM 0 HB3 LYS A 522 -6.507 -11.221 -23.283 1.00 0.00 H new ATOM 0 HG2 LYS A 522 -6.209 -10.455 -21.164 1.00 0.00 H new ATOM 0 HG3 LYS A 522 -4.668 -11.279 -21.300 1.00 0.00 H new ATOM 0 HD2 LYS A 522 -3.487 -9.335 -21.313 1.00 0.00 H new ATOM 0 HD3 LYS A 522 -4.597 -8.555 -22.422 1.00 0.00 H new ATOM 0 HE2 LYS A 522 -5.280 -9.013 -19.497 1.00 0.00 H new ATOM 0 HE3 LYS A 522 -4.441 -7.577 -20.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 522 -6.817 -7.205 -19.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 522 -6.305 -7.087 -21.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 522 -7.118 -8.479 -20.991 1.00 0.00 H new ATOM 1108 N ALA A 523 -2.515 -11.795 -22.453 1.00 0.00 N ATOM 1109 CA ALA A 523 -1.178 -11.461 -21.969 1.00 0.00 C ATOM 1110 C ALA A 523 -0.170 -11.453 -23.111 1.00 0.00 C ATOM 1111 O ALA A 523 0.694 -10.579 -23.187 1.00 0.00 O ATOM 1112 CB ALA A 523 -0.748 -12.444 -20.891 1.00 0.00 C ATOM 0 H ALA A 523 -2.966 -12.560 -21.951 1.00 0.00 H new ATOM 0 HA ALA A 523 -1.212 -10.459 -21.540 1.00 0.00 H new ATOM 0 HB1 ALA A 523 0.250 -12.184 -20.539 1.00 0.00 H new ATOM 0 HB2 ALA A 523 -1.450 -12.400 -20.058 1.00 0.00 H new ATOM 0 HB3 ALA A 523 -0.736 -13.453 -21.303 1.00 0.00 H new ATOM 1118 N ALA A 524 -0.290 -12.431 -24.002 1.00 0.00 N ATOM 1119 CA ALA A 524 0.606 -12.534 -25.147 1.00 0.00 C ATOM 1120 C ALA A 524 0.286 -11.462 -26.181 1.00 0.00 C ATOM 1121 O ALA A 524 1.164 -11.006 -26.912 1.00 0.00 O ATOM 1122 CB ALA A 524 0.502 -13.916 -25.772 1.00 0.00 C ATOM 0 H ALA A 524 -0.999 -13.163 -23.953 1.00 0.00 H new ATOM 0 HA ALA A 524 1.627 -12.380 -24.799 1.00 0.00 H new ATOM 0 HB1 ALA A 524 1.176 -13.981 -26.626 1.00 0.00 H new ATOM 0 HB2 ALA A 524 0.777 -14.670 -25.035 1.00 0.00 H new ATOM 0 HB3 ALA A 524 -0.522 -14.089 -26.104 1.00 0.00 H new ATOM 1128 N GLN A 525 -0.981 -11.063 -26.232 1.00 0.00 N ATOM 1129 CA GLN A 525 -1.426 -10.042 -27.172 1.00 0.00 C ATOM 1130 C GLN A 525 -0.985 -8.657 -26.713 1.00 0.00 C ATOM 1131 O GLN A 525 -0.720 -7.776 -27.530 1.00 0.00 O ATOM 1132 CB GLN A 525 -2.951 -10.068 -27.316 1.00 0.00 C ATOM 1133 CG GLN A 525 -3.542 -11.466 -27.391 1.00 0.00 C ATOM 1134 CD GLN A 525 -3.679 -11.965 -28.816 1.00 0.00 C ATOM 1135 OE1 GLN A 525 -4.783 -12.241 -29.285 1.00 0.00 O ATOM 1136 NE2 GLN A 525 -2.554 -12.083 -29.511 1.00 0.00 N ATOM 0 H GLN A 525 -1.718 -11.432 -25.632 1.00 0.00 H new ATOM 0 HA GLN A 525 -0.971 -10.259 -28.139 1.00 0.00 H new ATOM 0 HB2 GLN A 525 -3.394 -9.542 -26.470 1.00 0.00 H new ATOM 0 HB3 GLN A 525 -3.230 -9.518 -28.215 1.00 0.00 H new ATOM 0 HG2 GLN A 525 -2.911 -12.154 -26.828 1.00 0.00 H new ATOM 0 HG3 GLN A 525 -4.522 -11.468 -26.913 1.00 0.00 H new ATOM 0 HE21 GLN A 525 -1.661 -11.842 -29.081 1.00 0.00 H new ATOM 0 HE22 GLN A 525 -2.583 -12.414 -30.475 1.00 0.00 H new ATOM 1145 N ILE A 526 -0.914 -8.472 -25.399 1.00 0.00 N ATOM 1146 CA ILE A 526 -0.514 -7.192 -24.831 1.00 0.00 C ATOM 1147 C ILE A 526 1.007 -7.030 -24.813 1.00 0.00 C ATOM 1148 O ILE A 526 1.516 -5.949 -24.524 1.00 0.00 O ATOM 1149 CB ILE A 526 -1.070 -7.018 -23.405 1.00 0.00 C ATOM 1150 CG1 ILE A 526 -0.410 -8.006 -22.441 1.00 0.00 C ATOM 1151 CG2 ILE A 526 -2.580 -7.209 -23.408 1.00 0.00 C ATOM 1152 CD1 ILE A 526 -0.721 -7.729 -20.987 1.00 0.00 C ATOM 0 H ILE A 526 -1.128 -9.192 -24.709 1.00 0.00 H new ATOM 0 HA ILE A 526 -0.935 -6.418 -25.473 1.00 0.00 H new ATOM 0 HB ILE A 526 -0.842 -6.008 -23.065 1.00 0.00 H new ATOM 0 HG12 ILE A 526 -0.737 -9.016 -22.688 1.00 0.00 H new ATOM 0 HG13 ILE A 526 0.670 -7.976 -22.585 1.00 0.00 H new ATOM 0 HG21 ILE A 526 -2.965 -7.084 -22.396 1.00 0.00 H new ATOM 0 HG22 ILE A 526 -3.039 -6.470 -24.064 1.00 0.00 H new ATOM 0 HG23 ILE A 526 -2.819 -8.210 -23.766 1.00 0.00 H new ATOM 0 HD11 ILE A 526 -0.221 -8.468 -20.361 1.00 0.00 H new ATOM 0 HD12 ILE A 526 -0.369 -6.732 -20.723 1.00 0.00 H new ATOM 0 HD13 ILE A 526 -1.798 -7.788 -20.828 1.00 0.00 H new ATOM 1164 N ARG A 527 1.726 -8.110 -25.120 1.00 0.00 N ATOM 1165 CA ARG A 527 3.189 -8.090 -25.141 1.00 0.00 C ATOM 1166 C ARG A 527 3.724 -6.807 -25.775 1.00 0.00 C ATOM 1167 O ARG A 527 4.596 -6.145 -25.213 1.00 0.00 O ATOM 1168 CB ARG A 527 3.712 -9.305 -25.911 1.00 0.00 C ATOM 1169 CG ARG A 527 4.975 -9.910 -25.320 1.00 0.00 C ATOM 1170 CD ARG A 527 4.684 -11.216 -24.598 1.00 0.00 C ATOM 1171 NE ARG A 527 5.007 -12.380 -25.419 1.00 0.00 N ATOM 1172 CZ ARG A 527 5.144 -13.613 -24.936 1.00 0.00 C ATOM 1173 NH1 ARG A 527 4.986 -13.847 -23.638 1.00 0.00 N ATOM 1174 NH2 ARG A 527 5.438 -14.616 -25.751 1.00 0.00 N ATOM 0 H ARG A 527 1.317 -9.013 -25.359 1.00 0.00 H new ATOM 0 HA ARG A 527 3.540 -8.127 -24.110 1.00 0.00 H new ATOM 0 HB2 ARG A 527 2.934 -10.068 -25.939 1.00 0.00 H new ATOM 0 HB3 ARG A 527 3.909 -9.012 -26.942 1.00 0.00 H new ATOM 0 HG2 ARG A 527 5.701 -10.086 -26.114 1.00 0.00 H new ATOM 0 HG3 ARG A 527 5.428 -9.202 -24.625 1.00 0.00 H new ATOM 0 HD2 ARG A 527 5.259 -11.254 -23.673 1.00 0.00 H new ATOM 0 HD3 ARG A 527 3.631 -11.250 -24.320 1.00 0.00 H new ATOM 0 HE ARG A 527 5.135 -12.240 -26.421 1.00 0.00 H new ATOM 0 HH11 ARG A 527 4.758 -13.080 -23.005 1.00 0.00 H new ATOM 0 HH12 ARG A 527 5.092 -14.794 -23.274 1.00 0.00 H new ATOM 0 HH21 ARG A 527 5.559 -14.443 -26.749 1.00 0.00 H new ATOM 0 HH22 ARG A 527 5.543 -15.560 -25.380 1.00 0.00 H new ATOM 1188 N SER A 528 3.197 -6.462 -26.943 1.00 0.00 N ATOM 1189 CA SER A 528 3.624 -5.258 -27.646 1.00 0.00 C ATOM 1190 C SER A 528 3.279 -4.009 -26.843 1.00 0.00 C ATOM 1191 O SER A 528 4.005 -3.016 -26.877 1.00 0.00 O ATOM 1192 CB SER A 528 2.967 -5.187 -29.024 1.00 0.00 C ATOM 1193 OG SER A 528 2.952 -6.457 -29.651 1.00 0.00 O ATOM 0 H SER A 528 2.474 -6.998 -27.423 1.00 0.00 H new ATOM 0 HA SER A 528 4.706 -5.304 -27.768 1.00 0.00 H new ATOM 0 HB2 SER A 528 1.947 -4.816 -28.925 1.00 0.00 H new ATOM 0 HB3 SER A 528 3.506 -4.476 -29.650 1.00 0.00 H new ATOM 0 HG SER A 528 2.525 -6.383 -30.530 1.00 0.00 H new ATOM 1199 N GLN A 529 2.167 -4.068 -26.118 1.00 0.00 N ATOM 1200 CA GLN A 529 1.726 -2.946 -25.302 1.00 0.00 C ATOM 1201 C GLN A 529 2.569 -2.845 -24.033 1.00 0.00 C ATOM 1202 O GLN A 529 3.010 -1.761 -23.651 1.00 0.00 O ATOM 1203 CB GLN A 529 0.234 -3.098 -24.966 1.00 0.00 C ATOM 1204 CG GLN A 529 -0.133 -2.725 -23.537 1.00 0.00 C ATOM 1205 CD GLN A 529 -1.612 -2.437 -23.370 1.00 0.00 C ATOM 1206 OE1 GLN A 529 -2.091 -1.361 -23.725 1.00 0.00 O ATOM 1207 NE2 GLN A 529 -2.345 -3.403 -22.827 1.00 0.00 N ATOM 0 H GLN A 529 1.555 -4.883 -26.080 1.00 0.00 H new ATOM 0 HA GLN A 529 1.859 -2.022 -25.865 1.00 0.00 H new ATOM 0 HB2 GLN A 529 -0.344 -2.477 -25.650 1.00 0.00 H new ATOM 0 HB3 GLN A 529 -0.062 -4.131 -25.146 1.00 0.00 H new ATOM 0 HG2 GLN A 529 0.153 -3.537 -22.869 1.00 0.00 H new ATOM 0 HG3 GLN A 529 0.440 -1.848 -23.236 1.00 0.00 H new ATOM 0 HE21 GLN A 529 -1.906 -4.280 -22.547 1.00 0.00 H new ATOM 0 HE22 GLN A 529 -3.347 -3.267 -22.690 1.00 0.00 H new ATOM 1216 N VAL A 530 2.795 -3.984 -23.388 1.00 0.00 N ATOM 1217 CA VAL A 530 3.594 -4.021 -22.170 1.00 0.00 C ATOM 1218 C VAL A 530 5.017 -3.557 -22.451 1.00 0.00 C ATOM 1219 O VAL A 530 5.667 -2.956 -21.595 1.00 0.00 O ATOM 1220 CB VAL A 530 3.633 -5.439 -21.568 1.00 0.00 C ATOM 1221 CG1 VAL A 530 4.351 -5.435 -20.225 1.00 0.00 C ATOM 1222 CG2 VAL A 530 2.225 -5.997 -21.425 1.00 0.00 C ATOM 0 H VAL A 530 2.437 -4.891 -23.687 1.00 0.00 H new ATOM 0 HA VAL A 530 3.125 -3.348 -21.452 1.00 0.00 H new ATOM 0 HB VAL A 530 4.190 -6.085 -22.247 1.00 0.00 H new ATOM 0 HG11 VAL A 530 4.367 -6.446 -19.818 1.00 0.00 H new ATOM 0 HG12 VAL A 530 5.373 -5.082 -20.360 1.00 0.00 H new ATOM 0 HG13 VAL A 530 3.827 -4.774 -19.534 1.00 0.00 H new ATOM 0 HG21 VAL A 530 2.272 -6.999 -20.998 1.00 0.00 H new ATOM 0 HG22 VAL A 530 1.642 -5.350 -20.769 1.00 0.00 H new ATOM 0 HG23 VAL A 530 1.750 -6.042 -22.405 1.00 0.00 H new ATOM 1232 N MET A 531 5.492 -3.836 -23.661 1.00 0.00 N ATOM 1233 CA MET A 531 6.837 -3.442 -24.059 1.00 0.00 C ATOM 1234 C MET A 531 6.940 -1.927 -24.183 1.00 0.00 C ATOM 1235 O MET A 531 7.823 -1.308 -23.591 1.00 0.00 O ATOM 1236 CB MET A 531 7.217 -4.105 -25.384 1.00 0.00 C ATOM 1237 CG MET A 531 7.757 -5.518 -25.225 1.00 0.00 C ATOM 1238 SD MET A 531 9.448 -5.548 -24.602 1.00 0.00 S ATOM 1239 CE MET A 531 9.342 -6.869 -23.396 1.00 0.00 C ATOM 0 H MET A 531 4.966 -4.332 -24.381 1.00 0.00 H new ATOM 0 HA MET A 531 7.532 -3.774 -23.287 1.00 0.00 H new ATOM 0 HB2 MET A 531 6.341 -4.131 -26.032 1.00 0.00 H new ATOM 0 HB3 MET A 531 7.967 -3.493 -25.885 1.00 0.00 H new ATOM 0 HG2 MET A 531 7.113 -6.075 -24.544 1.00 0.00 H new ATOM 0 HG3 MET A 531 7.719 -6.028 -26.188 1.00 0.00 H new ATOM 0 HE1 MET A 531 10.253 -7.467 -23.430 1.00 0.00 H new ATOM 0 HE2 MET A 531 9.224 -6.443 -22.400 1.00 0.00 H new ATOM 0 HE3 MET A 531 8.484 -7.502 -23.624 1.00 0.00 H new ATOM 1249 N THR A 532 6.027 -1.332 -24.946 1.00 0.00 N ATOM 1250 CA THR A 532 6.022 0.113 -25.129 1.00 0.00 C ATOM 1251 C THR A 532 5.861 0.816 -23.785 1.00 0.00 C ATOM 1252 O THR A 532 6.371 1.918 -23.584 1.00 0.00 O ATOM 1253 CB THR A 532 4.902 0.534 -26.087 1.00 0.00 C ATOM 1254 OG1 THR A 532 5.047 1.893 -26.458 1.00 0.00 O ATOM 1255 CG2 THR A 532 3.514 0.363 -25.508 1.00 0.00 C ATOM 0 H THR A 532 5.286 -1.826 -25.444 1.00 0.00 H new ATOM 0 HA THR A 532 6.976 0.407 -25.566 1.00 0.00 H new ATOM 0 HB THR A 532 4.999 -0.127 -26.948 1.00 0.00 H new ATOM 0 HG1 THR A 532 4.324 2.144 -27.071 1.00 0.00 H new ATOM 0 HG21 THR A 532 2.772 0.680 -26.241 1.00 0.00 H new ATOM 0 HG22 THR A 532 3.351 -0.685 -25.257 1.00 0.00 H new ATOM 0 HG23 THR A 532 3.418 0.970 -24.608 1.00 0.00 H new ATOM 1263 N HIS A 533 5.156 0.161 -22.866 1.00 0.00 N ATOM 1264 CA HIS A 533 4.937 0.715 -21.536 1.00 0.00 C ATOM 1265 C HIS A 533 6.270 0.966 -20.844 1.00 0.00 C ATOM 1266 O HIS A 533 6.476 2.012 -20.230 1.00 0.00 O ATOM 1267 CB HIS A 533 4.081 -0.236 -20.697 1.00 0.00 C ATOM 1268 CG HIS A 533 3.499 0.405 -19.475 1.00 0.00 C ATOM 1269 ND1 HIS A 533 3.430 -0.030 -18.195 1.00 0.00 N flip ATOM 1270 CD2 HIS A 533 2.896 1.645 -19.490 1.00 0.00 C flip ATOM 1271 CE1 HIS A 533 2.791 0.945 -17.468 1.00 0.00 C flip ATOM 1272 NE2 HIS A 533 2.480 1.945 -18.271 1.00 0.00 N flip ATOM 0 H HIS A 533 4.728 -0.752 -23.019 1.00 0.00 H new ATOM 0 HA HIS A 533 4.409 1.663 -21.638 1.00 0.00 H new ATOM 0 HB2 HIS A 533 3.271 -0.624 -21.315 1.00 0.00 H new ATOM 0 HB3 HIS A 533 4.689 -1.089 -20.396 1.00 0.00 H new ATOM 0 HD2 HIS A 533 2.781 2.273 -20.361 1.00 0.00 H new ATOM 0 HE1 HIS A 533 2.578 0.900 -16.410 1.00 0.00 H new ATOM 0 HE2 HIS A 533 2.001 2.803 -17.998 1.00 0.00 H new ATOM 1281 N LEU A 534 7.180 0.003 -20.962 1.00 0.00 N ATOM 1282 CA LEU A 534 8.501 0.127 -20.359 1.00 0.00 C ATOM 1283 C LEU A 534 9.260 1.289 -20.991 1.00 0.00 C ATOM 1284 O LEU A 534 9.905 2.080 -20.299 1.00 0.00 O ATOM 1285 CB LEU A 534 9.287 -1.174 -20.531 1.00 0.00 C ATOM 1286 CG LEU A 534 10.463 -1.353 -19.570 1.00 0.00 C ATOM 1287 CD1 LEU A 534 11.575 -0.369 -19.899 1.00 0.00 C ATOM 1288 CD2 LEU A 534 10.003 -1.179 -18.130 1.00 0.00 C ATOM 0 H LEU A 534 7.026 -0.869 -21.468 1.00 0.00 H new ATOM 0 HA LEU A 534 8.382 0.324 -19.294 1.00 0.00 H new ATOM 0 HB2 LEU A 534 8.603 -2.013 -20.404 1.00 0.00 H new ATOM 0 HB3 LEU A 534 9.663 -1.221 -21.553 1.00 0.00 H new ATOM 0 HG LEU A 534 10.854 -2.364 -19.687 1.00 0.00 H new ATOM 0 HD11 LEU A 534 12.403 -0.511 -19.205 1.00 0.00 H new ATOM 0 HD12 LEU A 534 11.922 -0.540 -20.918 1.00 0.00 H new ATOM 0 HD13 LEU A 534 11.198 0.650 -19.810 1.00 0.00 H new ATOM 0 HD21 LEU A 534 10.852 -1.309 -17.459 1.00 0.00 H new ATOM 0 HD22 LEU A 534 9.587 -0.180 -17.999 1.00 0.00 H new ATOM 0 HD23 LEU A 534 9.240 -1.923 -17.899 1.00 0.00 H new ATOM 1300 N ARG A 535 9.167 1.392 -22.314 1.00 0.00 N ATOM 1301 CA ARG A 535 9.832 2.465 -23.041 1.00 0.00 C ATOM 1302 C ARG A 535 9.260 3.811 -22.621 1.00 0.00 C ATOM 1303 O ARG A 535 9.998 4.772 -22.416 1.00 0.00 O ATOM 1304 CB ARG A 535 9.676 2.281 -24.554 1.00 0.00 C ATOM 1305 CG ARG A 535 9.740 0.832 -25.012 1.00 0.00 C ATOM 1306 CD ARG A 535 10.952 0.111 -24.440 1.00 0.00 C ATOM 1307 NE ARG A 535 11.823 -0.413 -25.489 1.00 0.00 N ATOM 1308 CZ ARG A 535 11.493 -1.421 -26.293 1.00 0.00 C ATOM 1309 NH1 ARG A 535 10.312 -2.017 -26.171 1.00 0.00 N ATOM 1310 NH2 ARG A 535 12.345 -1.835 -27.221 1.00 0.00 N ATOM 0 H ARG A 535 8.639 0.747 -22.901 1.00 0.00 H new ATOM 0 HA ARG A 535 10.894 2.433 -22.799 1.00 0.00 H new ATOM 0 HB2 ARG A 535 8.722 2.708 -24.865 1.00 0.00 H new ATOM 0 HB3 ARG A 535 10.458 2.846 -25.061 1.00 0.00 H new ATOM 0 HG2 ARG A 535 8.831 0.314 -24.706 1.00 0.00 H new ATOM 0 HG3 ARG A 535 9.776 0.796 -26.101 1.00 0.00 H new ATOM 0 HD2 ARG A 535 11.517 0.797 -23.809 1.00 0.00 H new ATOM 0 HD3 ARG A 535 10.619 -0.708 -23.803 1.00 0.00 H new ATOM 0 HE ARG A 535 12.739 0.019 -25.613 1.00 0.00 H new ATOM 0 HH11 ARG A 535 9.653 -1.703 -25.459 1.00 0.00 H new ATOM 0 HH12 ARG A 535 10.064 -2.789 -26.790 1.00 0.00 H new ATOM 0 HH21 ARG A 535 13.253 -1.381 -27.319 1.00 0.00 H new ATOM 0 HH22 ARG A 535 12.092 -2.608 -27.837 1.00 0.00 H new ATOM 1324 N VAL A 536 7.938 3.869 -22.487 1.00 0.00 N ATOM 1325 CA VAL A 536 7.267 5.097 -22.078 1.00 0.00 C ATOM 1326 C VAL A 536 7.831 5.598 -20.751 1.00 0.00 C ATOM 1327 O VAL A 536 7.985 6.802 -20.547 1.00 0.00 O ATOM 1328 CB VAL A 536 5.738 4.887 -21.959 1.00 0.00 C ATOM 1329 CG1 VAL A 536 5.078 6.002 -21.157 1.00 0.00 C ATOM 1330 CG2 VAL A 536 5.114 4.795 -23.341 1.00 0.00 C ATOM 0 H VAL A 536 7.312 3.081 -22.655 1.00 0.00 H new ATOM 0 HA VAL A 536 7.450 5.848 -22.847 1.00 0.00 H new ATOM 0 HB VAL A 536 5.571 3.951 -21.425 1.00 0.00 H new ATOM 0 HG11 VAL A 536 4.005 5.820 -21.095 1.00 0.00 H new ATOM 0 HG12 VAL A 536 5.500 6.027 -20.152 1.00 0.00 H new ATOM 0 HG13 VAL A 536 5.256 6.958 -21.649 1.00 0.00 H new ATOM 0 HG21 VAL A 536 4.038 4.647 -23.245 1.00 0.00 H new ATOM 0 HG22 VAL A 536 5.306 5.717 -23.889 1.00 0.00 H new ATOM 0 HG23 VAL A 536 5.549 3.954 -23.881 1.00 0.00 H new ATOM 1340 N ILE A 537 8.146 4.666 -19.857 1.00 0.00 N ATOM 1341 CA ILE A 537 8.703 5.014 -18.556 1.00 0.00 C ATOM 1342 C ILE A 537 9.971 5.849 -18.725 1.00 0.00 C ATOM 1343 O ILE A 537 10.084 6.946 -18.179 1.00 0.00 O ATOM 1344 CB ILE A 537 9.015 3.742 -17.723 1.00 0.00 C ATOM 1345 CG1 ILE A 537 7.836 3.407 -16.804 1.00 0.00 C ATOM 1346 CG2 ILE A 537 10.293 3.908 -16.907 1.00 0.00 C ATOM 1347 CD1 ILE A 537 7.120 2.128 -17.184 1.00 0.00 C ATOM 0 H ILE A 537 8.025 3.665 -20.010 1.00 0.00 H new ATOM 0 HA ILE A 537 7.958 5.602 -18.020 1.00 0.00 H new ATOM 0 HB ILE A 537 9.169 2.917 -18.418 1.00 0.00 H new ATOM 0 HG12 ILE A 537 8.197 3.321 -15.779 1.00 0.00 H new ATOM 0 HG13 ILE A 537 7.124 4.232 -16.823 1.00 0.00 H new ATOM 0 HG21 ILE A 537 10.481 2.999 -16.336 1.00 0.00 H new ATOM 0 HG22 ILE A 537 11.131 4.095 -17.578 1.00 0.00 H new ATOM 0 HG23 ILE A 537 10.181 4.749 -16.223 1.00 0.00 H new ATOM 0 HD11 ILE A 537 6.297 1.952 -16.491 1.00 0.00 H new ATOM 0 HD12 ILE A 537 6.729 2.217 -18.197 1.00 0.00 H new ATOM 0 HD13 ILE A 537 7.818 1.292 -17.137 1.00 0.00 H new ATOM 1359 N TYR A 538 10.922 5.317 -19.488 1.00 0.00 N ATOM 1360 CA TYR A 538 12.182 6.010 -19.729 1.00 0.00 C ATOM 1361 C TYR A 538 11.996 7.154 -20.724 1.00 0.00 C ATOM 1362 O TYR A 538 12.540 8.244 -20.541 1.00 0.00 O ATOM 1363 CB TYR A 538 13.233 5.026 -20.247 1.00 0.00 C ATOM 1364 CG TYR A 538 14.532 5.066 -19.475 1.00 0.00 C ATOM 1365 CD1 TYR A 538 14.538 5.050 -18.085 1.00 0.00 C ATOM 1366 CD2 TYR A 538 15.754 5.119 -20.134 1.00 0.00 C ATOM 1367 CE1 TYR A 538 15.724 5.086 -17.375 1.00 0.00 C ATOM 1368 CE2 TYR A 538 16.944 5.156 -19.432 1.00 0.00 C ATOM 1369 CZ TYR A 538 16.922 5.139 -18.054 1.00 0.00 C ATOM 1370 OH TYR A 538 18.106 5.174 -17.351 1.00 0.00 O ATOM 0 H TYR A 538 10.844 4.410 -19.949 1.00 0.00 H new ATOM 0 HA TYR A 538 12.524 6.433 -18.785 1.00 0.00 H new ATOM 0 HB2 TYR A 538 12.825 4.016 -20.204 1.00 0.00 H new ATOM 0 HB3 TYR A 538 13.436 5.243 -21.296 1.00 0.00 H new ATOM 0 HD1 TYR A 538 13.600 5.009 -17.551 1.00 0.00 H new ATOM 0 HD2 TYR A 538 15.774 5.132 -21.214 1.00 0.00 H new ATOM 0 HE1 TYR A 538 15.712 5.073 -16.295 1.00 0.00 H new ATOM 0 HE2 TYR A 538 17.885 5.198 -19.960 1.00 0.00 H new ATOM 0 HH TYR A 538 18.858 5.209 -17.978 1.00 0.00 H new ATOM 1380 N GLU A 539 11.223 6.899 -21.775 1.00 0.00 N ATOM 1381 CA GLU A 539 10.965 7.907 -22.797 1.00 0.00 C ATOM 1382 C GLU A 539 10.301 9.137 -22.190 1.00 0.00 C ATOM 1383 O GLU A 539 10.741 10.265 -22.413 1.00 0.00 O ATOM 1384 CB GLU A 539 10.080 7.329 -23.903 1.00 0.00 C ATOM 1385 CG GLU A 539 10.856 6.586 -24.977 1.00 0.00 C ATOM 1386 CD GLU A 539 11.350 7.503 -26.079 1.00 0.00 C ATOM 1387 OE1 GLU A 539 10.584 7.749 -27.034 1.00 0.00 O ATOM 1388 OE2 GLU A 539 12.502 7.976 -25.986 1.00 0.00 O ATOM 0 H GLU A 539 10.765 6.003 -21.941 1.00 0.00 H new ATOM 0 HA GLU A 539 11.921 8.206 -23.227 1.00 0.00 H new ATOM 0 HB2 GLU A 539 9.352 6.651 -23.457 1.00 0.00 H new ATOM 0 HB3 GLU A 539 9.518 8.139 -24.368 1.00 0.00 H new ATOM 0 HG2 GLU A 539 11.707 6.081 -24.521 1.00 0.00 H new ATOM 0 HG3 GLU A 539 10.221 5.813 -25.410 1.00 0.00 H new ATOM 1395 N ARG A 540 9.242 8.913 -21.418 1.00 0.00 N ATOM 1396 CA ARG A 540 8.523 10.007 -20.777 1.00 0.00 C ATOM 1397 C ARG A 540 9.465 10.825 -19.901 1.00 0.00 C ATOM 1398 O ARG A 540 9.372 12.051 -19.848 1.00 0.00 O ATOM 1399 CB ARG A 540 7.363 9.471 -19.938 1.00 0.00 C ATOM 1400 CG ARG A 540 6.176 9.002 -20.767 1.00 0.00 C ATOM 1401 CD ARG A 540 5.220 10.146 -21.067 1.00 0.00 C ATOM 1402 NE ARG A 540 5.308 10.583 -22.459 1.00 0.00 N ATOM 1403 CZ ARG A 540 4.701 9.965 -23.470 1.00 0.00 C ATOM 1404 NH1 ARG A 540 3.965 8.883 -23.250 1.00 0.00 N ATOM 1405 NH2 ARG A 540 4.832 10.431 -24.704 1.00 0.00 N ATOM 0 H ARG A 540 8.864 7.986 -21.222 1.00 0.00 H new ATOM 0 HA ARG A 540 8.120 10.652 -21.558 1.00 0.00 H new ATOM 0 HB2 ARG A 540 7.720 8.641 -19.328 1.00 0.00 H new ATOM 0 HB3 ARG A 540 7.031 10.251 -19.252 1.00 0.00 H new ATOM 0 HG2 ARG A 540 6.532 8.569 -21.702 1.00 0.00 H new ATOM 0 HG3 ARG A 540 5.646 8.214 -20.232 1.00 0.00 H new ATOM 0 HD2 ARG A 540 4.199 9.832 -20.850 1.00 0.00 H new ATOM 0 HD3 ARG A 540 5.442 10.986 -20.409 1.00 0.00 H new ATOM 0 HE ARG A 540 5.867 11.410 -22.668 1.00 0.00 H new ATOM 0 HH11 ARG A 540 3.862 8.520 -22.302 1.00 0.00 H new ATOM 0 HH12 ARG A 540 3.502 8.414 -24.029 1.00 0.00 H new ATOM 0 HH21 ARG A 540 5.397 11.262 -24.878 1.00 0.00 H new ATOM 0 HH22 ARG A 540 4.368 9.959 -25.480 1.00 0.00 H new ATOM 1419 N MET A 541 10.380 10.138 -19.222 1.00 0.00 N ATOM 1420 CA MET A 541 11.348 10.803 -18.359 1.00 0.00 C ATOM 1421 C MET A 541 12.121 11.856 -19.144 1.00 0.00 C ATOM 1422 O MET A 541 12.469 12.914 -18.614 1.00 0.00 O ATOM 1423 CB MET A 541 12.316 9.783 -17.760 1.00 0.00 C ATOM 1424 CG MET A 541 12.992 10.261 -16.485 1.00 0.00 C ATOM 1425 SD MET A 541 13.644 8.903 -15.494 1.00 0.00 S ATOM 1426 CE MET A 541 12.148 7.973 -15.172 1.00 0.00 C ATOM 0 H MET A 541 10.470 9.122 -19.254 1.00 0.00 H new ATOM 0 HA MET A 541 10.808 11.293 -17.549 1.00 0.00 H new ATOM 0 HB2 MET A 541 11.775 8.860 -17.550 1.00 0.00 H new ATOM 0 HB3 MET A 541 13.081 9.543 -18.499 1.00 0.00 H new ATOM 0 HG2 MET A 541 13.804 10.941 -16.742 1.00 0.00 H new ATOM 0 HG3 MET A 541 12.277 10.829 -15.890 1.00 0.00 H new ATOM 0 HE1 MET A 541 11.941 7.976 -14.102 1.00 0.00 H new ATOM 0 HE2 MET A 541 11.314 8.430 -15.705 1.00 0.00 H new ATOM 0 HE3 MET A 541 12.278 6.946 -15.513 1.00 0.00 H new ATOM 1436 N ASN A 542 12.379 11.561 -20.414 1.00 0.00 N ATOM 1437 CA ASN A 542 13.103 12.482 -21.281 1.00 0.00 C ATOM 1438 C ASN A 542 12.227 13.674 -21.648 1.00 0.00 C ATOM 1439 O ASN A 542 12.724 14.780 -21.861 1.00 0.00 O ATOM 1440 CB ASN A 542 13.569 11.764 -22.549 1.00 0.00 C ATOM 1441 CG ASN A 542 14.708 10.799 -22.282 1.00 0.00 C ATOM 1442 OD1 ASN A 542 15.759 11.187 -21.769 1.00 0.00 O ATOM 1443 ND2 ASN A 542 14.506 9.534 -22.629 1.00 0.00 N ATOM 0 H ASN A 542 12.097 10.691 -20.865 1.00 0.00 H new ATOM 0 HA ASN A 542 13.977 12.846 -20.740 1.00 0.00 H new ATOM 0 HB2 ASN A 542 12.730 11.220 -22.984 1.00 0.00 H new ATOM 0 HB3 ASN A 542 13.887 12.502 -23.285 1.00 0.00 H new ATOM 0 HD21 ASN A 542 15.237 8.840 -22.473 1.00 0.00 H new ATOM 0 HD22 ASN A 542 13.620 9.256 -23.051 1.00 0.00 H new ATOM 1450 N GLN A 543 10.919 13.441 -21.717 1.00 0.00 N ATOM 1451 CA GLN A 543 9.974 14.498 -22.054 1.00 0.00 C ATOM 1452 C GLN A 543 9.885 15.518 -20.925 1.00 0.00 C ATOM 1453 O GLN A 543 9.744 16.717 -21.167 1.00 0.00 O ATOM 1454 CB GLN A 543 8.591 13.905 -22.335 1.00 0.00 C ATOM 1455 CG GLN A 543 8.436 13.365 -23.748 1.00 0.00 C ATOM 1456 CD GLN A 543 7.162 13.840 -24.420 1.00 0.00 C ATOM 1457 OE1 GLN A 543 6.061 13.432 -24.048 1.00 0.00 O ATOM 1458 NE2 GLN A 543 7.306 14.707 -25.415 1.00 0.00 N ATOM 0 H GLN A 543 10.491 12.531 -21.544 1.00 0.00 H new ATOM 0 HA GLN A 543 10.331 15.003 -22.952 1.00 0.00 H new ATOM 0 HB2 GLN A 543 8.398 13.101 -21.625 1.00 0.00 H new ATOM 0 HB3 GLN A 543 7.835 14.671 -22.163 1.00 0.00 H new ATOM 0 HG2 GLN A 543 9.294 13.673 -24.346 1.00 0.00 H new ATOM 0 HG3 GLN A 543 8.442 12.275 -23.719 1.00 0.00 H new ATOM 0 HE21 GLN A 543 8.238 15.018 -25.690 1.00 0.00 H new ATOM 0 HE22 GLN A 543 6.485 15.062 -25.905 1.00 0.00 H new ATOM 1467 N SER A 544 9.972 15.033 -19.690 1.00 0.00 N ATOM 1468 CA SER A 544 9.906 15.902 -18.522 1.00 0.00 C ATOM 1469 C SER A 544 11.099 16.851 -18.492 1.00 0.00 C ATOM 1470 O SER A 544 10.957 18.032 -18.174 1.00 0.00 O ATOM 1471 CB SER A 544 9.868 15.065 -17.240 1.00 0.00 C ATOM 1472 OG SER A 544 10.319 15.812 -16.123 1.00 0.00 O ATOM 0 H SER A 544 10.088 14.043 -19.473 1.00 0.00 H new ATOM 0 HA SER A 544 8.993 16.494 -18.585 1.00 0.00 H new ATOM 0 HB2 SER A 544 8.851 14.717 -17.061 1.00 0.00 H new ATOM 0 HB3 SER A 544 10.491 14.179 -17.363 1.00 0.00 H new ATOM 0 HG SER A 544 10.357 15.231 -15.335 1.00 0.00 H new ATOM 1478 N LEU A 545 12.274 16.328 -18.827 1.00 0.00 N ATOM 1479 CA LEU A 545 13.490 17.131 -18.839 1.00 0.00 C ATOM 1480 C LEU A 545 13.389 18.255 -19.865 1.00 0.00 C ATOM 1481 O LEU A 545 13.904 19.351 -19.651 1.00 0.00 O ATOM 1482 CB LEU A 545 14.706 16.253 -19.143 1.00 0.00 C ATOM 1483 CG LEU A 545 14.900 15.067 -18.197 1.00 0.00 C ATOM 1484 CD1 LEU A 545 15.987 14.141 -18.719 1.00 0.00 C ATOM 1485 CD2 LEU A 545 15.240 15.555 -16.797 1.00 0.00 C ATOM 0 H LEU A 545 12.409 15.353 -19.093 1.00 0.00 H new ATOM 0 HA LEU A 545 13.611 17.575 -17.851 1.00 0.00 H new ATOM 0 HB2 LEU A 545 14.617 15.875 -20.162 1.00 0.00 H new ATOM 0 HB3 LEU A 545 15.601 16.874 -19.111 1.00 0.00 H new ATOM 0 HG LEU A 545 13.966 14.507 -18.149 1.00 0.00 H new ATOM 0 HD11 LEU A 545 16.111 13.303 -18.033 1.00 0.00 H new ATOM 0 HD12 LEU A 545 15.704 13.766 -19.703 1.00 0.00 H new ATOM 0 HD13 LEU A 545 16.926 14.689 -18.796 1.00 0.00 H new ATOM 0 HD21 LEU A 545 15.375 14.699 -16.136 1.00 0.00 H new ATOM 0 HD22 LEU A 545 16.161 16.138 -16.828 1.00 0.00 H new ATOM 0 HD23 LEU A 545 14.428 16.179 -16.422 1.00 0.00 H new ATOM 1497 N SER A 546 12.721 17.978 -20.978 1.00 0.00 N ATOM 1498 CA SER A 546 12.552 18.973 -22.030 1.00 0.00 C ATOM 1499 C SER A 546 11.609 20.082 -21.575 1.00 0.00 C ATOM 1500 O SER A 546 11.833 21.262 -21.858 1.00 0.00 O ATOM 1501 CB SER A 546 12.010 18.315 -23.301 1.00 0.00 C ATOM 1502 OG SER A 546 13.065 17.933 -24.167 1.00 0.00 O ATOM 0 H SER A 546 12.289 17.076 -21.175 1.00 0.00 H new ATOM 0 HA SER A 546 13.526 19.411 -22.246 1.00 0.00 H new ATOM 0 HB2 SER A 546 11.417 17.439 -23.037 1.00 0.00 H new ATOM 0 HB3 SER A 546 11.344 19.007 -23.817 1.00 0.00 H new ATOM 0 HG SER A 546 12.693 17.514 -24.971 1.00 0.00 H new ATOM 1508 N LEU A 547 10.558 19.695 -20.861 1.00 0.00 N ATOM 1509 CA LEU A 547 9.579 20.649 -20.360 1.00 0.00 C ATOM 1510 C LEU A 547 10.228 21.625 -19.390 1.00 0.00 C ATOM 1511 O LEU A 547 9.907 22.812 -19.379 1.00 0.00 O ATOM 1512 CB LEU A 547 8.424 19.917 -19.673 1.00 0.00 C ATOM 1513 CG LEU A 547 7.626 18.979 -20.579 1.00 0.00 C ATOM 1514 CD1 LEU A 547 6.859 17.961 -19.751 1.00 0.00 C ATOM 1515 CD2 LEU A 547 6.677 19.775 -21.463 1.00 0.00 C ATOM 0 H LEU A 547 10.363 18.724 -20.616 1.00 0.00 H new ATOM 0 HA LEU A 547 9.186 21.211 -21.207 1.00 0.00 H new ATOM 0 HB2 LEU A 547 8.824 19.340 -18.839 1.00 0.00 H new ATOM 0 HB3 LEU A 547 7.744 20.657 -19.251 1.00 0.00 H new ATOM 0 HG LEU A 547 8.325 18.441 -21.220 1.00 0.00 H new ATOM 0 HD11 LEU A 547 6.297 17.302 -20.413 1.00 0.00 H new ATOM 0 HD12 LEU A 547 7.559 17.370 -19.161 1.00 0.00 H new ATOM 0 HD13 LEU A 547 6.170 18.479 -19.085 1.00 0.00 H new ATOM 0 HD21 LEU A 547 6.116 19.093 -22.102 1.00 0.00 H new ATOM 0 HD22 LEU A 547 5.984 20.339 -20.838 1.00 0.00 H new ATOM 0 HD23 LEU A 547 7.250 20.465 -22.083 1.00 0.00 H new ATOM 1527 N LEU A 548 11.150 21.116 -18.582 1.00 0.00 N ATOM 1528 CA LEU A 548 11.851 21.947 -17.615 1.00 0.00 C ATOM 1529 C LEU A 548 13.081 22.576 -18.261 1.00 0.00 C ATOM 1530 O LEU A 548 13.472 23.690 -17.916 1.00 0.00 O ATOM 1531 CB LEU A 548 12.203 21.113 -16.366 1.00 0.00 C ATOM 1532 CG LEU A 548 13.655 21.167 -15.869 1.00 0.00 C ATOM 1533 CD1 LEU A 548 14.597 20.557 -16.894 1.00 0.00 C ATOM 1534 CD2 LEU A 548 14.059 22.596 -15.531 1.00 0.00 C ATOM 0 H LEU A 548 11.428 20.135 -18.578 1.00 0.00 H new ATOM 0 HA LEU A 548 11.206 22.763 -17.290 1.00 0.00 H new ATOM 0 HB2 LEU A 548 11.555 21.436 -15.551 1.00 0.00 H new ATOM 0 HB3 LEU A 548 11.957 20.072 -16.575 1.00 0.00 H new ATOM 0 HG LEU A 548 13.726 20.576 -14.956 1.00 0.00 H new ATOM 0 HD11 LEU A 548 15.620 20.606 -16.522 1.00 0.00 H new ATOM 0 HD12 LEU A 548 14.323 19.516 -17.066 1.00 0.00 H new ATOM 0 HD13 LEU A 548 14.525 21.111 -17.830 1.00 0.00 H new ATOM 0 HD21 LEU A 548 15.091 22.609 -15.181 1.00 0.00 H new ATOM 0 HD22 LEU A 548 13.969 23.220 -16.421 1.00 0.00 H new ATOM 0 HD23 LEU A 548 13.406 22.983 -14.749 1.00 0.00 H new ATOM 1546 N TYR A 549 13.675 21.867 -19.218 1.00 0.00 N ATOM 1547 CA TYR A 549 14.845 22.379 -19.918 1.00 0.00 C ATOM 1548 C TYR A 549 14.531 23.729 -20.550 1.00 0.00 C ATOM 1549 O TYR A 549 15.432 24.526 -20.811 1.00 0.00 O ATOM 1550 CB TYR A 549 15.317 21.398 -20.992 1.00 0.00 C ATOM 1551 CG TYR A 549 16.368 20.421 -20.508 1.00 0.00 C ATOM 1552 CD1 TYR A 549 17.415 20.842 -19.695 1.00 0.00 C ATOM 1553 CD2 TYR A 549 16.315 19.080 -20.866 1.00 0.00 C ATOM 1554 CE1 TYR A 549 18.377 19.953 -19.254 1.00 0.00 C ATOM 1555 CE2 TYR A 549 17.274 18.185 -20.428 1.00 0.00 C ATOM 1556 CZ TYR A 549 18.302 18.626 -19.622 1.00 0.00 C ATOM 1557 OH TYR A 549 19.257 17.739 -19.184 1.00 0.00 O ATOM 0 H TYR A 549 13.367 20.944 -19.523 1.00 0.00 H new ATOM 0 HA TYR A 549 15.647 22.501 -19.190 1.00 0.00 H new ATOM 0 HB2 TYR A 549 14.458 20.839 -21.363 1.00 0.00 H new ATOM 0 HB3 TYR A 549 15.718 21.961 -21.834 1.00 0.00 H new ATOM 0 HD1 TYR A 549 17.477 21.880 -19.404 1.00 0.00 H new ATOM 0 HD2 TYR A 549 15.511 18.730 -21.497 1.00 0.00 H new ATOM 0 HE1 TYR A 549 19.184 20.296 -18.624 1.00 0.00 H new ATOM 0 HE2 TYR A 549 17.218 17.146 -20.716 1.00 0.00 H new ATOM 0 HH TYR A 549 19.057 16.845 -19.532 1.00 0.00 H new ATOM 1567 N ASN A 550 13.241 23.990 -20.781 1.00 0.00 N ATOM 1568 CA ASN A 550 12.814 25.258 -21.366 1.00 0.00 C ATOM 1569 C ASN A 550 13.492 26.422 -20.649 1.00 0.00 C ATOM 1570 O ASN A 550 13.745 27.471 -21.238 1.00 0.00 O ATOM 1571 CB ASN A 550 11.293 25.401 -21.279 1.00 0.00 C ATOM 1572 CG ASN A 550 10.566 24.376 -22.128 1.00 0.00 C ATOM 1573 OD1 ASN A 550 11.043 23.986 -23.194 1.00 0.00 O ATOM 1574 ND2 ASN A 550 9.405 23.934 -21.659 1.00 0.00 N ATOM 0 H ASN A 550 12.481 23.343 -20.572 1.00 0.00 H new ATOM 0 HA ASN A 550 13.105 25.272 -22.416 1.00 0.00 H new ATOM 0 HB2 ASN A 550 10.980 25.296 -20.240 1.00 0.00 H new ATOM 0 HB3 ASN A 550 11.006 26.403 -21.599 1.00 0.00 H new ATOM 0 HD21 ASN A 550 8.871 23.244 -22.187 1.00 0.00 H new ATOM 0 HD22 ASN A 550 9.047 24.285 -20.771 1.00 0.00 H new ATOM 1581 N VAL A 551 13.799 26.208 -19.371 1.00 0.00 N ATOM 1582 CA VAL A 551 14.470 27.212 -18.557 1.00 0.00 C ATOM 1583 C VAL A 551 15.930 26.823 -18.349 1.00 0.00 C ATOM 1584 O VAL A 551 16.301 26.323 -17.288 1.00 0.00 O ATOM 1585 CB VAL A 551 13.799 27.370 -17.178 1.00 0.00 C ATOM 1586 CG1 VAL A 551 14.220 28.677 -16.523 1.00 0.00 C ATOM 1587 CG2 VAL A 551 12.284 27.287 -17.296 1.00 0.00 C ATOM 0 H VAL A 551 13.591 25.341 -18.877 1.00 0.00 H new ATOM 0 HA VAL A 551 14.401 28.161 -19.089 1.00 0.00 H new ATOM 0 HB VAL A 551 14.131 26.548 -16.544 1.00 0.00 H new ATOM 0 HG11 VAL A 551 13.736 28.769 -15.551 1.00 0.00 H new ATOM 0 HG12 VAL A 551 15.302 28.686 -16.392 1.00 0.00 H new ATOM 0 HG13 VAL A 551 13.924 29.513 -17.157 1.00 0.00 H new ATOM 0 HG21 VAL A 551 11.835 27.401 -16.309 1.00 0.00 H new ATOM 0 HG22 VAL A 551 11.926 28.081 -17.952 1.00 0.00 H new ATOM 0 HG23 VAL A 551 12.004 26.319 -17.712 1.00 0.00 H new ATOM 1597 N PRO A 552 16.784 27.038 -19.365 1.00 0.00 N ATOM 1598 CA PRO A 552 18.204 26.695 -19.289 1.00 0.00 C ATOM 1599 C PRO A 552 18.841 27.148 -17.977 1.00 0.00 C ATOM 1600 O PRO A 552 19.776 26.518 -17.480 1.00 0.00 O ATOM 1601 CB PRO A 552 18.831 27.438 -20.482 1.00 0.00 C ATOM 1602 CG PRO A 552 17.735 28.263 -21.080 1.00 0.00 C ATOM 1603 CD PRO A 552 16.443 27.620 -20.665 1.00 0.00 C ATOM 0 HA PRO A 552 18.360 25.617 -19.323 1.00 0.00 H new ATOM 0 HB2 PRO A 552 19.660 28.067 -20.157 1.00 0.00 H new ATOM 0 HB3 PRO A 552 19.232 26.735 -21.212 1.00 0.00 H new ATOM 0 HG2 PRO A 552 17.787 29.293 -20.726 1.00 0.00 H new ATOM 0 HG3 PRO A 552 17.821 28.294 -22.166 1.00 0.00 H new ATOM 0 HD2 PRO A 552 15.635 28.347 -20.585 1.00 0.00 H new ATOM 0 HD3 PRO A 552 16.120 26.861 -21.378 1.00 0.00 H new ATOM 1611 N ALA A 553 18.328 28.240 -17.421 1.00 0.00 N ATOM 1612 CA ALA A 553 18.848 28.774 -16.167 1.00 0.00 C ATOM 1613 C ALA A 553 18.540 27.841 -15.002 1.00 0.00 C ATOM 1614 O ALA A 553 19.439 27.430 -14.272 1.00 0.00 O ATOM 1615 CB ALA A 553 18.269 30.156 -15.904 1.00 0.00 C ATOM 0 H ALA A 553 17.554 28.772 -17.818 1.00 0.00 H new ATOM 0 HA ALA A 553 19.931 28.855 -16.257 1.00 0.00 H new ATOM 0 HB1 ALA A 553 18.665 30.544 -14.965 1.00 0.00 H new ATOM 0 HB2 ALA A 553 18.544 30.827 -16.718 1.00 0.00 H new ATOM 0 HB3 ALA A 553 17.183 30.089 -15.840 1.00 0.00 H new ATOM 1621 N VAL A 554 17.263 27.504 -14.840 1.00 0.00 N ATOM 1622 CA VAL A 554 16.832 26.613 -13.769 1.00 0.00 C ATOM 1623 C VAL A 554 17.198 25.170 -14.090 1.00 0.00 C ATOM 1624 O VAL A 554 17.711 24.441 -13.241 1.00 0.00 O ATOM 1625 CB VAL A 554 15.308 26.704 -13.537 1.00 0.00 C ATOM 1626 CG1 VAL A 554 14.861 25.718 -12.467 1.00 0.00 C ATOM 1627 CG2 VAL A 554 14.905 28.120 -13.156 1.00 0.00 C ATOM 0 H VAL A 554 16.507 27.836 -15.439 1.00 0.00 H new ATOM 0 HA VAL A 554 17.347 26.930 -12.862 1.00 0.00 H new ATOM 0 HB VAL A 554 14.810 26.443 -14.471 1.00 0.00 H new ATOM 0 HG11 VAL A 554 13.784 25.802 -12.322 1.00 0.00 H new ATOM 0 HG12 VAL A 554 15.107 24.704 -12.781 1.00 0.00 H new ATOM 0 HG13 VAL A 554 15.371 25.942 -11.530 1.00 0.00 H new ATOM 0 HG21 VAL A 554 13.827 28.161 -12.997 1.00 0.00 H new ATOM 0 HG22 VAL A 554 15.418 28.410 -12.239 1.00 0.00 H new ATOM 0 HG23 VAL A 554 15.180 28.805 -13.958 1.00 0.00 H new ATOM 1637 N ALA A 555 16.925 24.766 -15.325 1.00 0.00 N ATOM 1638 CA ALA A 555 17.214 23.409 -15.777 1.00 0.00 C ATOM 1639 C ALA A 555 18.646 23.003 -15.451 1.00 0.00 C ATOM 1640 O ALA A 555 18.930 21.829 -15.225 1.00 0.00 O ATOM 1641 CB ALA A 555 16.968 23.294 -17.273 1.00 0.00 C ATOM 0 H ALA A 555 16.501 25.363 -16.036 1.00 0.00 H new ATOM 0 HA ALA A 555 16.545 22.731 -15.246 1.00 0.00 H new ATOM 0 HB1 ALA A 555 17.187 22.278 -17.601 1.00 0.00 H new ATOM 0 HB2 ALA A 555 15.926 23.529 -17.489 1.00 0.00 H new ATOM 0 HB3 ALA A 555 17.615 23.993 -17.803 1.00 0.00 H new ATOM 1647 N GLU A 556 19.546 23.978 -15.439 1.00 0.00 N ATOM 1648 CA GLU A 556 20.951 23.710 -15.152 1.00 0.00 C ATOM 1649 C GLU A 556 21.189 23.501 -13.661 1.00 0.00 C ATOM 1650 O GLU A 556 21.784 22.502 -13.257 1.00 0.00 O ATOM 1651 CB GLU A 556 21.827 24.854 -15.666 1.00 0.00 C ATOM 1652 CG GLU A 556 22.134 24.766 -17.151 1.00 0.00 C ATOM 1653 CD GLU A 556 23.014 23.580 -17.494 1.00 0.00 C ATOM 1654 OE1 GLU A 556 23.962 23.303 -16.730 1.00 0.00 O ATOM 1655 OE2 GLU A 556 22.756 22.929 -18.528 1.00 0.00 O ATOM 0 H GLU A 556 19.330 24.958 -15.624 1.00 0.00 H new ATOM 0 HA GLU A 556 21.223 22.789 -15.668 1.00 0.00 H new ATOM 0 HB2 GLU A 556 21.329 25.802 -15.462 1.00 0.00 H new ATOM 0 HB3 GLU A 556 22.764 24.861 -15.110 1.00 0.00 H new ATOM 0 HG2 GLU A 556 21.200 24.694 -17.708 1.00 0.00 H new ATOM 0 HG3 GLU A 556 22.626 25.684 -17.472 1.00 0.00 H new ATOM 1662 N GLU A 557 20.729 24.443 -12.844 1.00 0.00 N ATOM 1663 CA GLU A 557 20.909 24.338 -11.398 1.00 0.00 C ATOM 1664 C GLU A 557 20.212 23.096 -10.860 1.00 0.00 C ATOM 1665 O GLU A 557 20.745 22.387 -10.006 1.00 0.00 O ATOM 1666 CB GLU A 557 20.366 25.579 -10.683 1.00 0.00 C ATOM 1667 CG GLU A 557 20.601 26.879 -11.434 1.00 0.00 C ATOM 1668 CD GLU A 557 22.026 27.023 -11.932 1.00 0.00 C ATOM 1669 OE1 GLU A 557 22.308 26.576 -13.063 1.00 0.00 O ATOM 1670 OE2 GLU A 557 22.862 27.583 -11.190 1.00 0.00 O ATOM 0 H GLU A 557 20.234 25.280 -13.153 1.00 0.00 H new ATOM 0 HA GLU A 557 21.979 24.262 -11.204 1.00 0.00 H new ATOM 0 HB2 GLU A 557 19.295 25.453 -10.522 1.00 0.00 H new ATOM 0 HB3 GLU A 557 20.830 25.651 -9.699 1.00 0.00 H new ATOM 0 HG2 GLU A 557 19.918 26.932 -12.282 1.00 0.00 H new ATOM 0 HG3 GLU A 557 20.363 27.718 -10.781 1.00 0.00 H new ATOM 1677 N ILE A 558 19.011 22.844 -11.364 1.00 0.00 N ATOM 1678 CA ILE A 558 18.227 21.696 -10.933 1.00 0.00 C ATOM 1679 C ILE A 558 18.822 20.382 -11.433 1.00 0.00 C ATOM 1680 O ILE A 558 18.863 19.398 -10.698 1.00 0.00 O ATOM 1681 CB ILE A 558 16.765 21.801 -11.406 1.00 0.00 C ATOM 1682 CG1 ILE A 558 16.699 21.882 -12.931 1.00 0.00 C ATOM 1683 CG2 ILE A 558 16.092 23.012 -10.777 1.00 0.00 C ATOM 1684 CD1 ILE A 558 16.386 20.558 -13.594 1.00 0.00 C ATOM 0 H ILE A 558 18.559 23.421 -12.073 1.00 0.00 H new ATOM 0 HA ILE A 558 18.251 21.700 -9.843 1.00 0.00 H new ATOM 0 HB ILE A 558 16.233 20.905 -11.088 1.00 0.00 H new ATOM 0 HG12 ILE A 558 15.939 22.610 -13.215 1.00 0.00 H new ATOM 0 HG13 ILE A 558 17.652 22.252 -13.309 1.00 0.00 H new ATOM 0 HG21 ILE A 558 15.059 23.074 -11.120 1.00 0.00 H new ATOM 0 HG22 ILE A 558 16.108 22.914 -9.692 1.00 0.00 H new ATOM 0 HG23 ILE A 558 16.626 23.917 -11.068 1.00 0.00 H new ATOM 0 HD11 ILE A 558 16.355 20.691 -14.675 1.00 0.00 H new ATOM 0 HD12 ILE A 558 17.158 19.832 -13.340 1.00 0.00 H new ATOM 0 HD13 ILE A 558 15.419 20.196 -13.245 1.00 0.00 H new ATOM 1696 N GLN A 559 19.279 20.363 -12.684 1.00 0.00 N ATOM 1697 CA GLN A 559 19.857 19.151 -13.260 1.00 0.00 C ATOM 1698 C GLN A 559 21.122 18.736 -12.517 1.00 0.00 C ATOM 1699 O GLN A 559 21.381 17.547 -12.332 1.00 0.00 O ATOM 1700 CB GLN A 559 20.172 19.360 -14.741 1.00 0.00 C ATOM 1701 CG GLN A 559 18.977 19.136 -15.654 1.00 0.00 C ATOM 1702 CD GLN A 559 18.540 17.685 -15.698 1.00 0.00 C ATOM 1703 OE1 GLN A 559 17.385 17.363 -15.424 1.00 0.00 O ATOM 1704 NE2 GLN A 559 19.468 16.799 -16.044 1.00 0.00 N ATOM 0 H GLN A 559 19.261 21.166 -13.313 1.00 0.00 H new ATOM 0 HA GLN A 559 19.121 18.353 -13.160 1.00 0.00 H new ATOM 0 HB2 GLN A 559 20.544 20.374 -14.885 1.00 0.00 H new ATOM 0 HB3 GLN A 559 20.974 18.682 -15.033 1.00 0.00 H new ATOM 0 HG2 GLN A 559 18.144 19.752 -15.314 1.00 0.00 H new ATOM 0 HG3 GLN A 559 19.228 19.467 -16.662 1.00 0.00 H new ATOM 0 HE21 GLN A 559 20.414 17.111 -16.263 1.00 0.00 H new ATOM 0 HE22 GLN A 559 19.234 15.807 -16.090 1.00 0.00 H new ATOM 1713 N ASP A 560 21.909 19.719 -12.096 1.00 0.00 N ATOM 1714 CA ASP A 560 23.147 19.447 -11.379 1.00 0.00 C ATOM 1715 C ASP A 560 22.875 18.682 -10.088 1.00 0.00 C ATOM 1716 O ASP A 560 23.485 17.643 -9.829 1.00 0.00 O ATOM 1717 CB ASP A 560 23.876 20.755 -11.066 1.00 0.00 C ATOM 1718 CG ASP A 560 24.743 21.224 -12.217 1.00 0.00 C ATOM 1719 OD1 ASP A 560 24.232 21.292 -13.355 1.00 0.00 O ATOM 1720 OD2 ASP A 560 25.933 21.525 -11.982 1.00 0.00 O ATOM 0 H ASP A 560 21.712 20.709 -12.239 1.00 0.00 H new ATOM 0 HA ASP A 560 23.778 18.829 -12.018 1.00 0.00 H new ATOM 0 HB2 ASP A 560 23.145 21.527 -10.828 1.00 0.00 H new ATOM 0 HB3 ASP A 560 24.496 20.619 -10.180 1.00 0.00 H new ATOM 1725 N GLU A 561 21.961 19.204 -9.277 1.00 0.00 N ATOM 1726 CA GLU A 561 21.616 18.571 -8.009 1.00 0.00 C ATOM 1727 C GLU A 561 20.665 17.395 -8.210 1.00 0.00 C ATOM 1728 O GLU A 561 20.747 16.395 -7.497 1.00 0.00 O ATOM 1729 CB GLU A 561 20.985 19.592 -7.062 1.00 0.00 C ATOM 1730 CG GLU A 561 19.694 20.196 -7.591 1.00 0.00 C ATOM 1731 CD GLU A 561 19.493 21.630 -7.141 1.00 0.00 C ATOM 1732 OE1 GLU A 561 20.497 22.363 -7.032 1.00 0.00 O ATOM 1733 OE2 GLU A 561 18.332 22.018 -6.899 1.00 0.00 O ATOM 0 H GLU A 561 21.446 20.062 -9.475 1.00 0.00 H new ATOM 0 HA GLU A 561 22.537 18.190 -7.569 1.00 0.00 H new ATOM 0 HB2 GLU A 561 20.786 19.112 -6.104 1.00 0.00 H new ATOM 0 HB3 GLU A 561 21.701 20.392 -6.875 1.00 0.00 H new ATOM 0 HG2 GLU A 561 19.699 20.158 -8.680 1.00 0.00 H new ATOM 0 HG3 GLU A 561 18.851 19.592 -7.255 1.00 0.00 H new ATOM 1740 N VAL A 562 19.760 17.517 -9.177 1.00 0.00 N ATOM 1741 CA VAL A 562 18.798 16.458 -9.453 1.00 0.00 C ATOM 1742 C VAL A 562 19.508 15.167 -9.844 1.00 0.00 C ATOM 1743 O VAL A 562 19.265 14.111 -9.259 1.00 0.00 O ATOM 1744 CB VAL A 562 17.805 16.874 -10.564 1.00 0.00 C ATOM 1745 CG1 VAL A 562 17.137 15.661 -11.202 1.00 0.00 C ATOM 1746 CG2 VAL A 562 16.758 17.826 -10.002 1.00 0.00 C ATOM 0 H VAL A 562 19.674 18.335 -9.780 1.00 0.00 H new ATOM 0 HA VAL A 562 18.233 16.284 -8.537 1.00 0.00 H new ATOM 0 HB VAL A 562 18.369 17.386 -11.344 1.00 0.00 H new ATOM 0 HG11 VAL A 562 16.446 15.992 -11.978 1.00 0.00 H new ATOM 0 HG12 VAL A 562 17.898 15.017 -11.644 1.00 0.00 H new ATOM 0 HG13 VAL A 562 16.589 15.105 -10.441 1.00 0.00 H new ATOM 0 HG21 VAL A 562 16.065 18.112 -10.793 1.00 0.00 H new ATOM 0 HG22 VAL A 562 16.210 17.332 -9.200 1.00 0.00 H new ATOM 0 HG23 VAL A 562 17.249 18.717 -9.610 1.00 0.00 H new ATOM 1756 N ASP A 563 20.391 15.256 -10.831 1.00 0.00 N ATOM 1757 CA ASP A 563 21.134 14.090 -11.289 1.00 0.00 C ATOM 1758 C ASP A 563 21.986 13.520 -10.161 1.00 0.00 C ATOM 1759 O ASP A 563 22.093 12.305 -10.006 1.00 0.00 O ATOM 1760 CB ASP A 563 22.022 14.456 -12.482 1.00 0.00 C ATOM 1761 CG ASP A 563 21.353 14.158 -13.810 1.00 0.00 C ATOM 1762 OD1 ASP A 563 20.145 14.446 -13.945 1.00 0.00 O ATOM 1763 OD2 ASP A 563 22.039 13.638 -14.716 1.00 0.00 O ATOM 0 H ASP A 563 20.609 16.120 -11.328 1.00 0.00 H new ATOM 0 HA ASP A 563 20.417 13.331 -11.603 1.00 0.00 H new ATOM 0 HB2 ASP A 563 22.273 15.516 -12.434 1.00 0.00 H new ATOM 0 HB3 ASP A 563 22.959 13.903 -12.418 1.00 0.00 H new ATOM 1768 N GLU A 564 22.585 14.409 -9.373 1.00 0.00 N ATOM 1769 CA GLU A 564 23.428 13.996 -8.256 1.00 0.00 C ATOM 1770 C GLU A 564 22.599 13.354 -7.146 1.00 0.00 C ATOM 1771 O GLU A 564 23.109 12.553 -6.361 1.00 0.00 O ATOM 1772 CB GLU A 564 24.190 15.201 -7.699 1.00 0.00 C ATOM 1773 CG GLU A 564 25.559 15.400 -8.330 1.00 0.00 C ATOM 1774 CD GLU A 564 26.681 14.841 -7.476 1.00 0.00 C ATOM 1775 OE1 GLU A 564 26.561 13.683 -7.022 1.00 0.00 O ATOM 1776 OE2 GLU A 564 27.678 15.561 -7.261 1.00 0.00 O ATOM 0 H GLU A 564 22.502 15.419 -9.488 1.00 0.00 H new ATOM 0 HA GLU A 564 24.137 13.256 -8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 564 23.594 16.100 -7.853 1.00 0.00 H new ATOM 0 HB3 GLU A 564 24.310 15.079 -6.623 1.00 0.00 H new ATOM 0 HG2 GLU A 564 25.578 14.919 -9.308 1.00 0.00 H new ATOM 0 HG3 GLU A 564 25.728 16.464 -8.495 1.00 0.00 H new ATOM 1783 N LEU A 565 21.324 13.721 -7.078 1.00 0.00 N ATOM 1784 CA LEU A 565 20.425 13.196 -6.055 1.00 0.00 C ATOM 1785 C LEU A 565 19.995 11.762 -6.368 1.00 0.00 C ATOM 1786 O LEU A 565 19.794 10.955 -5.460 1.00 0.00 O ATOM 1787 CB LEU A 565 19.195 14.116 -5.923 1.00 0.00 C ATOM 1788 CG LEU A 565 17.824 13.478 -6.208 1.00 0.00 C ATOM 1789 CD1 LEU A 565 17.106 13.142 -4.911 1.00 0.00 C ATOM 1790 CD2 LEU A 565 16.970 14.403 -7.063 1.00 0.00 C ATOM 0 H LEU A 565 20.888 14.382 -7.721 1.00 0.00 H new ATOM 0 HA LEU A 565 20.961 13.174 -5.106 1.00 0.00 H new ATOM 0 HB2 LEU A 565 19.179 14.520 -4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 565 19.326 14.959 -6.601 1.00 0.00 H new ATOM 0 HG LEU A 565 17.989 12.552 -6.759 1.00 0.00 H new ATOM 0 HD11 LEU A 565 16.139 12.692 -5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 565 17.707 12.440 -4.334 1.00 0.00 H new ATOM 0 HD13 LEU A 565 16.956 14.053 -4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 565 16.005 13.934 -7.254 1.00 0.00 H new ATOM 0 HD22 LEU A 565 16.818 15.346 -6.538 1.00 0.00 H new ATOM 0 HD23 LEU A 565 17.475 14.592 -8.010 1.00 0.00 H new ATOM 1802 N LEU A 566 19.822 11.464 -7.649 1.00 0.00 N ATOM 1803 CA LEU A 566 19.376 10.141 -8.072 1.00 0.00 C ATOM 1804 C LEU A 566 20.526 9.140 -8.184 1.00 0.00 C ATOM 1805 O LEU A 566 20.293 7.932 -8.233 1.00 0.00 O ATOM 1806 CB LEU A 566 18.634 10.251 -9.403 1.00 0.00 C ATOM 1807 CG LEU A 566 17.435 11.208 -9.382 1.00 0.00 C ATOM 1808 CD1 LEU A 566 17.544 12.242 -10.495 1.00 0.00 C ATOM 1809 CD2 LEU A 566 16.126 10.435 -9.490 1.00 0.00 C ATOM 0 H LEU A 566 19.983 12.119 -8.414 1.00 0.00 H new ATOM 0 HA LEU A 566 18.704 9.760 -7.303 1.00 0.00 H new ATOM 0 HB2 LEU A 566 19.335 10.582 -10.170 1.00 0.00 H new ATOM 0 HB3 LEU A 566 18.287 9.260 -9.695 1.00 0.00 H new ATOM 0 HG LEU A 566 17.442 11.737 -8.429 1.00 0.00 H new ATOM 0 HD11 LEU A 566 16.682 12.908 -10.458 1.00 0.00 H new ATOM 0 HD12 LEU A 566 18.457 12.823 -10.364 1.00 0.00 H new ATOM 0 HD13 LEU A 566 17.571 11.736 -11.460 1.00 0.00 H new ATOM 0 HD21 LEU A 566 15.289 11.133 -9.473 1.00 0.00 H new ATOM 0 HD22 LEU A 566 16.111 9.873 -10.424 1.00 0.00 H new ATOM 0 HD23 LEU A 566 16.040 9.745 -8.650 1.00 0.00 H new ATOM 1821 N GLN A 567 21.762 9.628 -8.219 1.00 0.00 N ATOM 1822 CA GLN A 567 22.920 8.740 -8.319 1.00 0.00 C ATOM 1823 C GLN A 567 22.928 7.733 -7.173 1.00 0.00 C ATOM 1824 O GLN A 567 23.093 6.532 -7.386 1.00 0.00 O ATOM 1825 CB GLN A 567 24.224 9.537 -8.308 1.00 0.00 C ATOM 1826 CG GLN A 567 24.171 10.806 -9.135 1.00 0.00 C ATOM 1827 CD GLN A 567 25.546 11.379 -9.415 1.00 0.00 C ATOM 1828 OE1 GLN A 567 26.301 11.692 -8.494 1.00 0.00 O ATOM 1829 NE2 GLN A 567 25.879 11.520 -10.693 1.00 0.00 N ATOM 0 H GLN A 567 21.989 10.622 -8.180 1.00 0.00 H new ATOM 0 HA GLN A 567 22.844 8.204 -9.265 1.00 0.00 H new ATOM 0 HB2 GLN A 567 24.473 9.795 -7.279 1.00 0.00 H new ATOM 0 HB3 GLN A 567 25.029 8.904 -8.681 1.00 0.00 H new ATOM 0 HG2 GLN A 567 23.669 10.598 -10.080 1.00 0.00 H new ATOM 0 HG3 GLN A 567 23.571 11.551 -8.612 1.00 0.00 H new ATOM 0 HE21 GLN A 567 25.222 11.248 -11.424 1.00 0.00 H new ATOM 0 HE22 GLN A 567 26.792 11.901 -10.943 1.00 0.00 H new ATOM 1838 N LYS A 568 22.751 8.236 -5.956 1.00 0.00 N ATOM 1839 CA LYS A 568 22.739 7.386 -4.770 1.00 0.00 C ATOM 1840 C LYS A 568 21.620 6.353 -4.847 1.00 0.00 C ATOM 1841 O LYS A 568 21.738 5.255 -4.303 1.00 0.00 O ATOM 1842 CB LYS A 568 22.576 8.238 -3.510 1.00 0.00 C ATOM 1843 CG LYS A 568 23.711 9.226 -3.292 1.00 0.00 C ATOM 1844 CD LYS A 568 25.005 8.516 -2.926 1.00 0.00 C ATOM 1845 CE LYS A 568 25.233 8.509 -1.422 1.00 0.00 C ATOM 1846 NZ LYS A 568 25.362 7.125 -0.887 1.00 0.00 N ATOM 0 H LYS A 568 22.614 9.228 -5.764 1.00 0.00 H new ATOM 0 HA LYS A 568 23.691 6.857 -4.725 1.00 0.00 H new ATOM 0 HB2 LYS A 568 21.636 8.786 -3.571 1.00 0.00 H new ATOM 0 HB3 LYS A 568 22.506 7.580 -2.643 1.00 0.00 H new ATOM 0 HG2 LYS A 568 23.861 9.815 -4.197 1.00 0.00 H new ATOM 0 HG3 LYS A 568 23.441 9.923 -2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 568 24.975 7.491 -3.295 1.00 0.00 H new ATOM 0 HD3 LYS A 568 25.843 9.008 -3.419 1.00 0.00 H new ATOM 0 HE2 LYS A 568 26.135 9.074 -1.189 1.00 0.00 H new ATOM 0 HE3 LYS A 568 24.404 9.014 -0.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 25.516 7.163 0.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 24.491 6.593 -1.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 26.169 6.651 -1.341 1.00 0.00 H new ATOM 1860 N GLU A 569 20.534 6.710 -5.526 1.00 0.00 N ATOM 1861 CA GLU A 569 19.395 5.810 -5.671 1.00 0.00 C ATOM 1862 C GLU A 569 19.810 4.510 -6.353 1.00 0.00 C ATOM 1863 O GLU A 569 19.288 3.445 -5.964 1.00 0.00 O ATOM 1864 CB GLU A 569 18.280 6.487 -6.472 1.00 0.00 C ATOM 1865 CG GLU A 569 17.837 7.820 -5.892 1.00 0.00 C ATOM 1866 CD GLU A 569 16.832 7.661 -4.767 1.00 0.00 C ATOM 1867 OE1 GLU A 569 15.704 7.198 -5.039 1.00 0.00 O ATOM 1868 OE2 GLU A 569 17.173 7.999 -3.614 1.00 0.00 O ATOM 1869 OXT GLU A 569 20.654 4.569 -7.273 1.00 0.00 O ATOM 0 H GLU A 569 20.419 7.614 -5.984 1.00 0.00 H new ATOM 0 HA GLU A 569 19.024 5.573 -4.674 1.00 0.00 H new ATOM 0 HB2 GLU A 569 18.622 6.641 -7.496 1.00 0.00 H new ATOM 0 HB3 GLU A 569 17.421 5.818 -6.520 1.00 0.00 H new ATOM 0 HG2 GLU A 569 18.709 8.359 -5.522 1.00 0.00 H new ATOM 0 HG3 GLU A 569 17.398 8.428 -6.683 1.00 0.00 H new TER 1876 GLU A 569