USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 909 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 600 THR OG1 : rot -63:sc= -0.98! USER MOD Set 1.2: A 605 GLN : amide:sc= -4.84! C(o=-5.8!,f=-4.7!) USER MOD Single : A 521 THR OG1 : rot 180:sc= 0.0401 USER MOD Single : A 530 GLN : amide:sc= -3.26! K(o=-3.3!,f=-0.43) USER MOD Single : A 531 HIS : no HD1:sc= -1.7 K(o=-1.7,f=-0.83) USER MOD Single : A 540 LYS NZ :NH3+ -171:sc= 0.199 (180deg=0.176) USER MOD Single : A 541 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0543) USER MOD Single : A 543 SER OG : rot 180:sc= 0 USER MOD Single : A 544 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 547 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 550 THR OG1 : rot 106:sc= 0.881 USER MOD Single : A 552 TYR OH : rot 180:sc= -0.223 USER MOD Single : A 553 TYR OH : rot 22:sc= 1.32 USER MOD Single : A 556 CYS SG : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 560 MET CE :methyl 154:sc= -0.429 (180deg=-1.51!) USER MOD Single : A 561 LYS NZ :NH3+ -169:sc= 1.04 (180deg=0.937) USER MOD Single : A 562 GLN : amide:sc= -1.57 K(o=-1.6,f=-3!) USER MOD Single : A 568 LYS NZ :NH3+ 141:sc= 1.27 (180deg=0.964) USER MOD Single : A 569 TYR OH : rot 130:sc= 0 USER MOD Single : A 571 SER OG : rot 180:sc= 0 USER MOD Single : A 573 ASN : amide:sc= 0.342 X(o=0.34,f=0) USER MOD Single : A 576 HIS : no HD1:sc= -0.0545 X(o=-0.054,f=-0.078) USER MOD Single : A 577 SER OG : rot 180:sc= 0 USER MOD Single : A 582 HIS : no HD1:sc= -0.365 K(o=-0.36,f=-9.7!) USER MOD Single : A 584 SER OG : rot 180:sc= 0 USER MOD Single : A 586 SER OG : rot 180:sc= 0 USER MOD Single : A 589 MET CE :methyl 166:sc= -0.028 (180deg=-0.286) USER MOD Single : A 608 GLN : amide:sc= 0.0157 X(o=0.016,f=-0.22) USER MOD Single : A 610 SER OG : rot 75:sc= 0.99 USER MOD Single : A 616 SER OG : rot 180:sc= 0.00266 USER MOD Single : A 619 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.71) USER MOD Single : A 622 THR OG1 : rot 180:sc= 0 USER MOD Single : A 624 SER OG : rot 49:sc= 0.333 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 516 -10.324 18.274 -7.902 1.00 0.00 N ATOM 2 CA ARG A 516 -9.852 18.565 -6.529 1.00 0.00 C ATOM 3 C ARG A 516 -9.219 17.317 -5.929 1.00 0.00 C ATOM 4 O ARG A 516 -9.738 16.213 -6.099 1.00 0.00 O ATOM 5 CB ARG A 516 -11.018 19.013 -5.641 1.00 0.00 C ATOM 6 CG ARG A 516 -11.862 20.129 -6.235 1.00 0.00 C ATOM 7 CD ARG A 516 -13.031 20.477 -5.329 1.00 0.00 C ATOM 8 NE ARG A 516 -13.971 21.400 -5.965 1.00 0.00 N ATOM 9 CZ ARG A 516 -15.201 21.638 -5.509 1.00 0.00 C ATOM 10 NH1 ARG A 516 -15.627 21.049 -4.398 1.00 0.00 N ATOM 11 NH2 ARG A 516 -16.005 22.470 -6.158 1.00 0.00 N ATOM 0 HA ARG A 516 -9.116 19.367 -6.580 1.00 0.00 H new ATOM 0 HB2 ARG A 516 -11.659 18.154 -5.442 1.00 0.00 H new ATOM 0 HB3 ARG A 516 -10.622 19.344 -4.681 1.00 0.00 H new ATOM 0 HG2 ARG A 516 -11.243 21.013 -6.390 1.00 0.00 H new ATOM 0 HG3 ARG A 516 -12.235 19.825 -7.213 1.00 0.00 H new ATOM 0 HD2 ARG A 516 -13.555 19.563 -5.049 1.00 0.00 H new ATOM 0 HD3 ARG A 516 -12.654 20.923 -4.408 1.00 0.00 H new ATOM 0 HE ARG A 516 -13.668 21.890 -6.807 1.00 0.00 H new ATOM 0 HH11 ARG A 516 -15.013 20.412 -3.891 1.00 0.00 H new ATOM 0 HH12 ARG A 516 -16.569 21.233 -4.052 1.00 0.00 H new ATOM 0 HH21 ARG A 516 -15.683 22.930 -7.009 1.00 0.00 H new ATOM 0 HH22 ARG A 516 -16.945 22.649 -5.806 1.00 0.00 H new ATOM 27 N ARG A 517 -8.098 17.484 -5.241 1.00 0.00 N ATOM 28 CA ARG A 517 -7.442 16.365 -4.584 1.00 0.00 C ATOM 29 C ARG A 517 -8.117 16.062 -3.259 1.00 0.00 C ATOM 30 O ARG A 517 -8.246 16.936 -2.400 1.00 0.00 O ATOM 31 CB ARG A 517 -5.959 16.648 -4.351 1.00 0.00 C ATOM 32 CG ARG A 517 -5.127 16.640 -5.617 1.00 0.00 C ATOM 33 CD ARG A 517 -3.652 16.796 -5.301 1.00 0.00 C ATOM 34 NE ARG A 517 -2.824 16.760 -6.503 1.00 0.00 N ATOM 35 CZ ARG A 517 -1.495 16.808 -6.488 1.00 0.00 C ATOM 36 NH1 ARG A 517 -0.847 16.890 -5.335 1.00 0.00 N ATOM 37 NH2 ARG A 517 -0.814 16.771 -7.626 1.00 0.00 N ATOM 0 H ARG A 517 -7.626 18.381 -5.124 1.00 0.00 H new ATOM 0 HA ARG A 517 -7.528 15.500 -5.241 1.00 0.00 H new ATOM 0 HB2 ARG A 517 -5.856 17.619 -3.866 1.00 0.00 H new ATOM 0 HB3 ARG A 517 -5.561 15.904 -3.661 1.00 0.00 H new ATOM 0 HG2 ARG A 517 -5.290 15.707 -6.157 1.00 0.00 H new ATOM 0 HG3 ARG A 517 -5.449 17.449 -6.273 1.00 0.00 H new ATOM 0 HD2 ARG A 517 -3.492 17.740 -4.779 1.00 0.00 H new ATOM 0 HD3 ARG A 517 -3.341 16.001 -4.624 1.00 0.00 H new ATOM 0 HE ARG A 517 -3.292 16.694 -7.407 1.00 0.00 H new ATOM 0 HH11 ARG A 517 -1.368 16.916 -4.458 1.00 0.00 H new ATOM 0 HH12 ARG A 517 0.172 16.927 -5.324 1.00 0.00 H new ATOM 0 HH21 ARG A 517 -1.310 16.706 -8.515 1.00 0.00 H new ATOM 0 HH22 ARG A 517 0.205 16.808 -7.612 1.00 0.00 H new ATOM 51 N ARG A 518 -8.550 14.829 -3.101 1.00 0.00 N ATOM 52 CA ARG A 518 -9.222 14.409 -1.886 1.00 0.00 C ATOM 53 C ARG A 518 -8.337 13.421 -1.155 1.00 0.00 C ATOM 54 O ARG A 518 -8.056 12.334 -1.656 1.00 0.00 O ATOM 55 CB ARG A 518 -10.587 13.795 -2.222 1.00 0.00 C ATOM 56 CG ARG A 518 -11.550 13.696 -1.045 1.00 0.00 C ATOM 57 CD ARG A 518 -11.249 12.514 -0.133 1.00 0.00 C ATOM 58 NE ARG A 518 -12.359 12.249 0.783 1.00 0.00 N ATOM 59 CZ ARG A 518 -12.304 11.402 1.811 1.00 0.00 C ATOM 60 NH1 ARG A 518 -11.160 10.815 2.139 1.00 0.00 N ATOM 61 NH2 ARG A 518 -13.391 11.170 2.533 1.00 0.00 N ATOM 0 H ARG A 518 -8.449 14.095 -3.802 1.00 0.00 H new ATOM 0 HA ARG A 518 -9.400 15.268 -1.240 1.00 0.00 H new ATOM 0 HB2 ARG A 518 -11.054 14.390 -3.007 1.00 0.00 H new ATOM 0 HB3 ARG A 518 -10.430 12.797 -2.630 1.00 0.00 H new ATOM 0 HG2 ARG A 518 -11.503 14.618 -0.465 1.00 0.00 H new ATOM 0 HG3 ARG A 518 -12.569 13.608 -1.422 1.00 0.00 H new ATOM 0 HD2 ARG A 518 -11.054 11.628 -0.736 1.00 0.00 H new ATOM 0 HD3 ARG A 518 -10.343 12.716 0.439 1.00 0.00 H new ATOM 0 HE ARG A 518 -13.235 12.747 0.624 1.00 0.00 H new ATOM 0 HH11 ARG A 518 -10.314 11.011 1.603 1.00 0.00 H new ATOM 0 HH12 ARG A 518 -11.126 10.168 2.927 1.00 0.00 H new ATOM 0 HH21 ARG A 518 -14.267 11.639 2.302 1.00 0.00 H new ATOM 0 HH22 ARG A 518 -13.352 10.522 3.320 1.00 0.00 H new ATOM 75 N ILE A 519 -7.891 13.807 0.023 1.00 0.00 N ATOM 76 CA ILE A 519 -6.913 13.024 0.752 1.00 0.00 C ATOM 77 C ILE A 519 -7.596 12.051 1.700 1.00 0.00 C ATOM 78 O ILE A 519 -8.667 12.334 2.236 1.00 0.00 O ATOM 79 CB ILE A 519 -5.960 13.932 1.556 1.00 0.00 C ATOM 80 CG1 ILE A 519 -5.586 15.167 0.727 1.00 0.00 C ATOM 81 CG2 ILE A 519 -4.709 13.164 1.969 1.00 0.00 C ATOM 82 CD1 ILE A 519 -4.551 16.062 1.381 1.00 0.00 C ATOM 0 H ILE A 519 -8.190 14.659 0.497 1.00 0.00 H new ATOM 0 HA ILE A 519 -6.334 12.464 0.017 1.00 0.00 H new ATOM 0 HB ILE A 519 -6.471 14.261 2.461 1.00 0.00 H new ATOM 0 HG12 ILE A 519 -5.208 14.840 -0.242 1.00 0.00 H new ATOM 0 HG13 ILE A 519 -6.487 15.750 0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 519 -4.049 13.821 2.535 1.00 0.00 H new ATOM 0 HG22 ILE A 519 -4.992 12.313 2.589 1.00 0.00 H new ATOM 0 HG23 ILE A 519 -4.190 12.808 1.079 1.00 0.00 H new ATOM 0 HD11 ILE A 519 -4.342 16.912 0.731 1.00 0.00 H new ATOM 0 HD12 ILE A 519 -4.932 16.421 2.337 1.00 0.00 H new ATOM 0 HD13 ILE A 519 -3.634 15.497 1.546 1.00 0.00 H new ATOM 94 N ALA A 520 -6.984 10.899 1.875 1.00 0.00 N ATOM 95 CA ALA A 520 -7.445 9.919 2.834 1.00 0.00 C ATOM 96 C ALA A 520 -6.628 10.039 4.108 1.00 0.00 C ATOM 97 O ALA A 520 -5.471 10.456 4.068 1.00 0.00 O ATOM 98 CB ALA A 520 -7.338 8.517 2.258 1.00 0.00 C ATOM 0 H ALA A 520 -6.153 10.616 1.356 1.00 0.00 H new ATOM 0 HA ALA A 520 -8.494 10.107 3.063 1.00 0.00 H new ATOM 0 HB1 ALA A 520 -7.689 7.794 2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -7.949 8.446 1.358 1.00 0.00 H new ATOM 0 HB3 ALA A 520 -6.299 8.305 2.008 1.00 0.00 H new ATOM 104 N THR A 521 -7.219 9.688 5.230 1.00 0.00 N ATOM 105 CA THR A 521 -6.528 9.735 6.500 1.00 0.00 C ATOM 106 C THR A 521 -6.028 8.352 6.879 1.00 0.00 C ATOM 107 O THR A 521 -6.668 7.354 6.554 1.00 0.00 O ATOM 108 CB THR A 521 -7.458 10.283 7.594 1.00 0.00 C ATOM 109 OG1 THR A 521 -8.824 10.062 7.216 1.00 0.00 O ATOM 110 CG2 THR A 521 -7.217 11.769 7.818 1.00 0.00 C ATOM 0 H THR A 521 -8.185 9.364 5.288 1.00 0.00 H new ATOM 0 HA THR A 521 -5.671 10.402 6.405 1.00 0.00 H new ATOM 0 HB THR A 521 -7.246 9.759 8.526 1.00 0.00 H new ATOM 0 HG1 THR A 521 -9.417 10.410 7.914 1.00 0.00 H new ATOM 0 HG21 THR A 521 -7.887 12.133 8.597 1.00 0.00 H new ATOM 0 HG22 THR A 521 -6.183 11.928 8.126 1.00 0.00 H new ATOM 0 HG23 THR A 521 -7.408 12.312 6.892 1.00 0.00 H new ATOM 118 N PRO A 522 -4.872 8.270 7.556 1.00 0.00 N ATOM 119 CA PRO A 522 -4.270 6.993 7.943 1.00 0.00 C ATOM 120 C PRO A 522 -5.249 6.095 8.692 1.00 0.00 C ATOM 121 O PRO A 522 -5.301 4.888 8.464 1.00 0.00 O ATOM 122 CB PRO A 522 -3.097 7.393 8.853 1.00 0.00 C ATOM 123 CG PRO A 522 -3.280 8.845 9.143 1.00 0.00 C ATOM 124 CD PRO A 522 -4.053 9.410 7.989 1.00 0.00 C ATOM 0 HA PRO A 522 -3.961 6.415 7.072 1.00 0.00 H new ATOM 0 HB2 PRO A 522 -3.099 6.808 9.773 1.00 0.00 H new ATOM 0 HB3 PRO A 522 -2.141 7.210 8.361 1.00 0.00 H new ATOM 0 HG2 PRO A 522 -3.818 8.990 10.080 1.00 0.00 H new ATOM 0 HG3 PRO A 522 -2.317 9.345 9.248 1.00 0.00 H new ATOM 0 HD2 PRO A 522 -4.668 10.258 8.291 1.00 0.00 H new ATOM 0 HD3 PRO A 522 -3.395 9.760 7.194 1.00 0.00 H new ATOM 132 N GLU A 523 -6.011 6.700 9.592 1.00 0.00 N ATOM 133 CA GLU A 523 -7.015 5.967 10.355 1.00 0.00 C ATOM 134 C GLU A 523 -8.034 5.306 9.411 1.00 0.00 C ATOM 135 O GLU A 523 -8.473 4.182 9.645 1.00 0.00 O ATOM 136 CB GLU A 523 -7.720 6.880 11.357 1.00 0.00 C ATOM 137 CG GLU A 523 -8.564 7.973 10.722 1.00 0.00 C ATOM 138 CD GLU A 523 -9.192 8.885 11.751 1.00 0.00 C ATOM 139 OE1 GLU A 523 -8.488 9.788 12.254 1.00 0.00 O ATOM 140 OE2 GLU A 523 -10.385 8.701 12.068 1.00 0.00 O ATOM 0 H GLU A 523 -5.955 7.694 9.813 1.00 0.00 H new ATOM 0 HA GLU A 523 -6.506 5.184 10.917 1.00 0.00 H new ATOM 0 HB2 GLU A 523 -8.357 6.272 11.999 1.00 0.00 H new ATOM 0 HB3 GLU A 523 -6.970 7.343 11.999 1.00 0.00 H new ATOM 0 HG2 GLU A 523 -7.943 8.563 10.048 1.00 0.00 H new ATOM 0 HG3 GLU A 523 -9.348 7.518 10.117 1.00 0.00 H new ATOM 147 N GLU A 524 -8.406 6.011 8.347 1.00 0.00 N ATOM 148 CA GLU A 524 -9.294 5.466 7.328 1.00 0.00 C ATOM 149 C GLU A 524 -8.580 4.421 6.473 1.00 0.00 C ATOM 150 O GLU A 524 -9.192 3.468 6.012 1.00 0.00 O ATOM 151 CB GLU A 524 -9.841 6.588 6.448 1.00 0.00 C ATOM 152 CG GLU A 524 -10.755 7.546 7.191 1.00 0.00 C ATOM 153 CD GLU A 524 -12.046 6.897 7.643 1.00 0.00 C ATOM 154 OE1 GLU A 524 -12.038 6.178 8.660 1.00 0.00 O ATOM 155 OE2 GLU A 524 -13.085 7.118 6.987 1.00 0.00 O ATOM 0 H GLU A 524 -8.103 6.968 8.168 1.00 0.00 H new ATOM 0 HA GLU A 524 -10.126 4.975 7.833 1.00 0.00 H new ATOM 0 HB2 GLU A 524 -9.007 7.148 6.025 1.00 0.00 H new ATOM 0 HB3 GLU A 524 -10.387 6.151 5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 524 -10.229 7.941 8.060 1.00 0.00 H new ATOM 0 HG3 GLU A 524 -10.987 8.393 6.546 1.00 0.00 H new ATOM 162 N VAL A 525 -7.283 4.611 6.263 1.00 0.00 N ATOM 163 CA VAL A 525 -6.489 3.683 5.460 1.00 0.00 C ATOM 164 C VAL A 525 -6.245 2.370 6.213 1.00 0.00 C ATOM 165 O VAL A 525 -6.131 1.303 5.607 1.00 0.00 O ATOM 166 CB VAL A 525 -5.135 4.310 5.050 1.00 0.00 C ATOM 167 CG1 VAL A 525 -4.303 3.334 4.229 1.00 0.00 C ATOM 168 CG2 VAL A 525 -5.352 5.603 4.276 1.00 0.00 C ATOM 0 H VAL A 525 -6.756 5.400 6.637 1.00 0.00 H new ATOM 0 HA VAL A 525 -7.061 3.469 4.557 1.00 0.00 H new ATOM 0 HB VAL A 525 -4.585 4.540 5.963 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -3.358 3.802 3.955 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -4.107 2.438 4.818 1.00 0.00 H new ATOM 0 HG13 VAL A 525 -4.848 3.062 3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -4.387 6.027 3.998 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -5.930 5.395 3.376 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -5.894 6.314 4.900 1.00 0.00 H new ATOM 178 N ARG A 526 -6.153 2.452 7.536 1.00 0.00 N ATOM 179 CA ARG A 526 -6.016 1.256 8.367 1.00 0.00 C ATOM 180 C ARG A 526 -7.372 0.596 8.590 1.00 0.00 C ATOM 181 O ARG A 526 -7.443 -0.551 9.019 1.00 0.00 O ATOM 182 CB ARG A 526 -5.371 1.581 9.722 1.00 0.00 C ATOM 183 CG ARG A 526 -6.205 2.503 10.583 1.00 0.00 C ATOM 184 CD ARG A 526 -5.526 2.820 11.903 1.00 0.00 C ATOM 185 NE ARG A 526 -6.405 3.568 12.803 1.00 0.00 N ATOM 186 CZ ARG A 526 -6.000 4.147 13.933 1.00 0.00 C ATOM 187 NH1 ARG A 526 -4.735 4.039 14.327 1.00 0.00 N ATOM 188 NH2 ARG A 526 -6.867 4.822 14.680 1.00 0.00 N ATOM 0 H ARG A 526 -6.170 3.329 8.056 1.00 0.00 H new ATOM 0 HA ARG A 526 -5.364 0.565 7.833 1.00 0.00 H new ATOM 0 HB2 ARG A 526 -5.195 0.652 10.264 1.00 0.00 H new ATOM 0 HB3 ARG A 526 -4.397 2.039 9.551 1.00 0.00 H new ATOM 0 HG2 ARG A 526 -6.396 3.430 10.042 1.00 0.00 H new ATOM 0 HG3 ARG A 526 -7.173 2.041 10.776 1.00 0.00 H new ATOM 0 HD2 ARG A 526 -5.218 1.892 12.385 1.00 0.00 H new ATOM 0 HD3 ARG A 526 -4.621 3.398 11.716 1.00 0.00 H new ATOM 0 HE ARG A 526 -7.389 3.651 12.549 1.00 0.00 H new ATOM 0 HH11 ARG A 526 -4.069 3.511 13.764 1.00 0.00 H new ATOM 0 HH12 ARG A 526 -4.431 4.484 15.193 1.00 0.00 H new ATOM 0 HH21 ARG A 526 -7.842 4.897 14.388 1.00 0.00 H new ATOM 0 HH22 ARG A 526 -6.558 5.265 15.545 1.00 0.00 H new ATOM 202 N LEU A 527 -8.445 1.332 8.314 1.00 0.00 N ATOM 203 CA LEU A 527 -9.809 0.826 8.467 1.00 0.00 C ATOM 204 C LEU A 527 -9.987 -0.523 7.746 1.00 0.00 C ATOM 205 O LEU A 527 -10.496 -1.471 8.343 1.00 0.00 O ATOM 206 CB LEU A 527 -10.802 1.877 7.929 1.00 0.00 C ATOM 207 CG LEU A 527 -12.039 2.173 8.782 1.00 0.00 C ATOM 208 CD1 LEU A 527 -12.971 0.979 8.816 1.00 0.00 C ATOM 209 CD2 LEU A 527 -11.640 2.584 10.188 1.00 0.00 C ATOM 0 H LEU A 527 -8.396 2.294 7.979 1.00 0.00 H new ATOM 0 HA LEU A 527 -10.008 0.653 9.525 1.00 0.00 H new ATOM 0 HB2 LEU A 527 -10.260 2.811 7.785 1.00 0.00 H new ATOM 0 HB3 LEU A 527 -11.140 1.550 6.946 1.00 0.00 H new ATOM 0 HG LEU A 527 -12.572 3.006 8.323 1.00 0.00 H new ATOM 0 HD11 LEU A 527 -13.842 1.214 9.428 1.00 0.00 H new ATOM 0 HD12 LEU A 527 -13.294 0.740 7.803 1.00 0.00 H new ATOM 0 HD13 LEU A 527 -12.449 0.122 9.242 1.00 0.00 H new ATOM 0 HD21 LEU A 527 -12.535 2.789 10.775 1.00 0.00 H new ATOM 0 HD22 LEU A 527 -11.076 1.778 10.656 1.00 0.00 H new ATOM 0 HD23 LEU A 527 -11.022 3.481 10.143 1.00 0.00 H new ATOM 221 N PRO A 528 -9.568 -0.644 6.463 1.00 0.00 N ATOM 222 CA PRO A 528 -9.593 -1.927 5.748 1.00 0.00 C ATOM 223 C PRO A 528 -8.825 -3.011 6.494 1.00 0.00 C ATOM 224 O PRO A 528 -9.259 -4.163 6.556 1.00 0.00 O ATOM 225 CB PRO A 528 -8.910 -1.614 4.414 1.00 0.00 C ATOM 226 CG PRO A 528 -9.086 -0.150 4.227 1.00 0.00 C ATOM 227 CD PRO A 528 -9.076 0.447 5.598 1.00 0.00 C ATOM 0 HA PRO A 528 -10.607 -2.311 5.638 1.00 0.00 H new ATOM 0 HB2 PRO A 528 -7.854 -1.885 4.438 1.00 0.00 H new ATOM 0 HB3 PRO A 528 -9.365 -2.174 3.597 1.00 0.00 H new ATOM 0 HG2 PRO A 528 -8.284 0.264 3.616 1.00 0.00 H new ATOM 0 HG3 PRO A 528 -10.023 0.068 3.714 1.00 0.00 H new ATOM 0 HD2 PRO A 528 -8.075 0.766 5.888 1.00 0.00 H new ATOM 0 HD3 PRO A 528 -9.720 1.325 5.656 1.00 0.00 H new ATOM 235 N LEU A 529 -7.703 -2.623 7.089 1.00 0.00 N ATOM 236 CA LEU A 529 -6.851 -3.550 7.826 1.00 0.00 C ATOM 237 C LEU A 529 -7.577 -4.063 9.064 1.00 0.00 C ATOM 238 O LEU A 529 -7.256 -5.126 9.593 1.00 0.00 O ATOM 239 CB LEU A 529 -5.548 -2.861 8.252 1.00 0.00 C ATOM 240 CG LEU A 529 -4.830 -2.066 7.159 1.00 0.00 C ATOM 241 CD1 LEU A 529 -3.547 -1.450 7.699 1.00 0.00 C ATOM 242 CD2 LEU A 529 -4.533 -2.950 5.964 1.00 0.00 C ATOM 0 H LEU A 529 -7.359 -1.663 7.075 1.00 0.00 H new ATOM 0 HA LEU A 529 -6.614 -4.388 7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 529 -5.769 -2.187 9.080 1.00 0.00 H new ATOM 0 HB3 LEU A 529 -4.864 -3.620 8.632 1.00 0.00 H new ATOM 0 HG LEU A 529 -5.488 -1.260 6.835 1.00 0.00 H new ATOM 0 HD11 LEU A 529 -3.051 -0.889 6.907 1.00 0.00 H new ATOM 0 HD12 LEU A 529 -3.785 -0.779 8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 529 -2.885 -2.240 8.053 1.00 0.00 H new ATOM 0 HD21 LEU A 529 -4.022 -2.367 5.198 1.00 0.00 H new ATOM 0 HD22 LEU A 529 -3.896 -3.779 6.274 1.00 0.00 H new ATOM 0 HD23 LEU A 529 -5.467 -3.341 5.560 1.00 0.00 H new ATOM 254 N GLN A 530 -8.557 -3.295 9.523 1.00 0.00 N ATOM 255 CA GLN A 530 -9.315 -3.650 10.712 1.00 0.00 C ATOM 256 C GLN A 530 -10.495 -4.548 10.352 1.00 0.00 C ATOM 257 O GLN A 530 -11.147 -5.112 11.229 1.00 0.00 O ATOM 258 CB GLN A 530 -9.817 -2.388 11.430 1.00 0.00 C ATOM 259 CG GLN A 530 -8.731 -1.350 11.671 1.00 0.00 C ATOM 260 CD GLN A 530 -9.113 -0.313 12.708 1.00 0.00 C ATOM 261 OE1 GLN A 530 -8.897 -0.501 13.905 1.00 0.00 O ATOM 262 NE2 GLN A 530 -9.657 0.801 12.254 1.00 0.00 N ATOM 0 H GLN A 530 -8.845 -2.419 9.087 1.00 0.00 H new ATOM 0 HA GLN A 530 -8.652 -4.196 11.383 1.00 0.00 H new ATOM 0 HB2 GLN A 530 -10.614 -1.937 10.839 1.00 0.00 H new ATOM 0 HB3 GLN A 530 -10.253 -2.674 12.387 1.00 0.00 H new ATOM 0 HG2 GLN A 530 -7.820 -1.855 11.991 1.00 0.00 H new ATOM 0 HG3 GLN A 530 -8.504 -0.847 10.731 1.00 0.00 H new ATOM 0 HE21 GLN A 530 -9.820 0.918 11.254 1.00 0.00 H new ATOM 0 HE22 GLN A 530 -9.914 1.544 12.903 1.00 0.00 H new ATOM 271 N HIS A 531 -10.764 -4.689 9.058 1.00 0.00 N ATOM 272 CA HIS A 531 -11.901 -5.484 8.604 1.00 0.00 C ATOM 273 C HIS A 531 -11.469 -6.793 7.950 1.00 0.00 C ATOM 274 O HIS A 531 -12.223 -7.765 7.949 1.00 0.00 O ATOM 275 CB HIS A 531 -12.779 -4.680 7.644 1.00 0.00 C ATOM 276 CG HIS A 531 -13.674 -3.705 8.342 1.00 0.00 C ATOM 277 ND1 HIS A 531 -14.870 -4.100 8.890 1.00 0.00 N ATOM 278 CD2 HIS A 531 -13.499 -2.383 8.569 1.00 0.00 C ATOM 279 CE1 HIS A 531 -15.392 -3.016 9.440 1.00 0.00 C ATOM 280 NE2 HIS A 531 -14.598 -1.951 9.270 1.00 0.00 N ATOM 0 H HIS A 531 -10.215 -4.267 8.309 1.00 0.00 H new ATOM 0 HA HIS A 531 -12.482 -5.737 9.491 1.00 0.00 H new ATOM 0 HB2 HIS A 531 -12.141 -4.141 6.943 1.00 0.00 H new ATOM 0 HB3 HIS A 531 -13.388 -5.367 7.057 1.00 0.00 H new ATOM 0 HD2 HIS A 531 -12.657 -1.783 8.259 1.00 0.00 H new ATOM 0 HE1 HIS A 531 -16.338 -2.993 9.960 1.00 0.00 H new ATOM 0 HE2 HIS A 531 -14.775 -1.002 9.598 1.00 0.00 H new ATOM 288 N GLY A 532 -10.263 -6.830 7.400 1.00 0.00 N ATOM 289 CA GLY A 532 -9.789 -8.054 6.779 1.00 0.00 C ATOM 290 C GLY A 532 -8.840 -7.804 5.629 1.00 0.00 C ATOM 291 O GLY A 532 -8.053 -8.679 5.266 1.00 0.00 O ATOM 0 H GLY A 532 -9.611 -6.046 7.371 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -9.288 -8.665 7.530 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -10.644 -8.627 6.420 1.00 0.00 H new ATOM 295 N TRP A 533 -8.923 -6.619 5.043 1.00 0.00 N ATOM 296 CA TRP A 533 -8.017 -6.232 3.969 1.00 0.00 C ATOM 297 C TRP A 533 -6.598 -6.085 4.501 1.00 0.00 C ATOM 298 O TRP A 533 -6.392 -5.937 5.705 1.00 0.00 O ATOM 299 CB TRP A 533 -8.455 -4.904 3.354 1.00 0.00 C ATOM 300 CG TRP A 533 -9.795 -4.949 2.691 1.00 0.00 C ATOM 301 CD1 TRP A 533 -11.012 -5.078 3.296 1.00 0.00 C ATOM 302 CD2 TRP A 533 -10.051 -4.831 1.291 1.00 0.00 C ATOM 303 NE1 TRP A 533 -12.007 -5.080 2.352 1.00 0.00 N ATOM 304 CE2 TRP A 533 -11.443 -4.917 1.112 1.00 0.00 C ATOM 305 CE3 TRP A 533 -9.233 -4.665 0.170 1.00 0.00 C ATOM 306 CZ2 TRP A 533 -12.036 -4.840 -0.145 1.00 0.00 C ATOM 307 CZ3 TRP A 533 -9.821 -4.585 -1.074 1.00 0.00 C ATOM 308 CH2 TRP A 533 -11.209 -4.671 -1.225 1.00 0.00 C ATOM 0 H TRP A 533 -9.609 -5.907 5.293 1.00 0.00 H new ATOM 0 HA TRP A 533 -8.043 -7.012 3.208 1.00 0.00 H new ATOM 0 HB2 TRP A 533 -8.473 -4.143 4.134 1.00 0.00 H new ATOM 0 HB3 TRP A 533 -7.710 -4.592 2.622 1.00 0.00 H new ATOM 0 HD1 TRP A 533 -11.168 -5.166 4.361 1.00 0.00 H new ATOM 0 HE1 TRP A 533 -13.004 -5.185 2.541 1.00 0.00 H new ATOM 0 HE3 TRP A 533 -8.160 -4.601 0.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 533 -13.107 -4.911 -0.265 1.00 0.00 H new ATOM 0 HZ3 TRP A 533 -9.199 -4.454 -1.947 1.00 0.00 H new ATOM 0 HH2 TRP A 533 -11.638 -4.603 -2.214 1.00 0.00 H new ATOM 319 N ARG A 534 -5.624 -6.114 3.607 1.00 0.00 N ATOM 320 CA ARG A 534 -4.241 -5.867 3.976 1.00 0.00 C ATOM 321 C ARG A 534 -3.684 -4.771 3.083 1.00 0.00 C ATOM 322 O ARG A 534 -4.228 -4.517 2.005 1.00 0.00 O ATOM 323 CB ARG A 534 -3.386 -7.128 3.817 1.00 0.00 C ATOM 324 CG ARG A 534 -3.638 -8.203 4.860 1.00 0.00 C ATOM 325 CD ARG A 534 -2.701 -9.383 4.652 1.00 0.00 C ATOM 326 NE ARG A 534 -2.780 -10.365 5.734 1.00 0.00 N ATOM 327 CZ ARG A 534 -2.227 -11.579 5.679 1.00 0.00 C ATOM 328 NH1 ARG A 534 -1.590 -11.975 4.584 1.00 0.00 N ATOM 329 NH2 ARG A 534 -2.312 -12.399 6.720 1.00 0.00 N ATOM 0 H ARG A 534 -5.767 -6.307 2.616 1.00 0.00 H new ATOM 0 HA ARG A 534 -4.211 -5.566 5.023 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -3.567 -7.551 2.829 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -2.334 -6.844 3.855 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -3.494 -7.789 5.858 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -4.673 -8.539 4.800 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -2.941 -9.870 3.707 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -1.677 -9.019 4.572 1.00 0.00 H new ATOM 0 HE ARG A 534 -3.288 -10.107 6.580 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -1.521 -11.351 3.780 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -1.169 -12.903 4.546 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -2.801 -12.102 7.565 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -1.889 -13.326 6.675 1.00 0.00 H new ATOM 343 N ARG A 535 -2.605 -4.137 3.512 1.00 0.00 N ATOM 344 CA ARG A 535 -1.962 -3.143 2.676 1.00 0.00 C ATOM 345 C ARG A 535 -0.461 -3.146 2.906 1.00 0.00 C ATOM 346 O ARG A 535 0.017 -2.870 4.009 1.00 0.00 O ATOM 347 CB ARG A 535 -2.530 -1.762 2.997 1.00 0.00 C ATOM 348 CG ARG A 535 -2.090 -0.672 2.039 1.00 0.00 C ATOM 349 CD ARG A 535 -1.538 0.525 2.786 1.00 0.00 C ATOM 350 NE ARG A 535 -1.625 1.760 2.005 1.00 0.00 N ATOM 351 CZ ARG A 535 -0.793 2.792 2.140 1.00 0.00 C ATOM 352 NH1 ARG A 535 0.186 2.745 3.034 1.00 0.00 N ATOM 353 NH2 ARG A 535 -0.938 3.863 1.369 1.00 0.00 N ATOM 0 H ARG A 535 -2.164 -4.290 4.419 1.00 0.00 H new ATOM 0 HA ARG A 535 -2.155 -3.384 1.631 1.00 0.00 H new ATOM 0 HB2 ARG A 535 -3.619 -1.819 2.990 1.00 0.00 H new ATOM 0 HB3 ARG A 535 -2.231 -1.484 4.008 1.00 0.00 H new ATOM 0 HG2 ARG A 535 -1.330 -1.064 1.363 1.00 0.00 H new ATOM 0 HG3 ARG A 535 -2.935 -0.362 1.424 1.00 0.00 H new ATOM 0 HD2 ARG A 535 -2.085 0.650 3.720 1.00 0.00 H new ATOM 0 HD3 ARG A 535 -0.497 0.337 3.049 1.00 0.00 H new ATOM 0 HE ARG A 535 -2.370 1.835 1.313 1.00 0.00 H new ATOM 0 HH11 ARG A 535 0.303 1.918 3.619 1.00 0.00 H new ATOM 0 HH12 ARG A 535 0.822 3.536 3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 535 -1.685 3.895 0.675 1.00 0.00 H new ATOM 0 HH22 ARG A 535 -0.302 4.654 1.470 1.00 0.00 H new ATOM 367 N GLU A 536 0.274 -3.429 1.855 1.00 0.00 N ATOM 368 CA GLU A 536 1.720 -3.488 1.919 1.00 0.00 C ATOM 369 C GLU A 536 2.300 -2.363 1.089 1.00 0.00 C ATOM 370 O GLU A 536 1.758 -2.025 0.045 1.00 0.00 O ATOM 371 CB GLU A 536 2.242 -4.809 1.353 1.00 0.00 C ATOM 372 CG GLU A 536 1.828 -6.044 2.129 1.00 0.00 C ATOM 373 CD GLU A 536 2.491 -7.298 1.590 1.00 0.00 C ATOM 374 OE1 GLU A 536 2.798 -7.346 0.377 1.00 0.00 O ATOM 375 OE2 GLU A 536 2.732 -8.237 2.375 1.00 0.00 O ATOM 0 H GLU A 536 -0.111 -3.625 0.931 1.00 0.00 H new ATOM 0 HA GLU A 536 2.017 -3.401 2.964 1.00 0.00 H new ATOM 0 HB2 GLU A 536 1.894 -4.910 0.325 1.00 0.00 H new ATOM 0 HB3 GLU A 536 3.331 -4.768 1.318 1.00 0.00 H new ATOM 0 HG2 GLU A 536 2.090 -5.918 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 536 0.745 -6.157 2.082 1.00 0.00 H new ATOM 382 N VAL A 537 3.378 -1.768 1.544 1.00 0.00 N ATOM 383 CA VAL A 537 4.055 -0.765 0.750 1.00 0.00 C ATOM 384 C VAL A 537 5.451 -1.252 0.418 1.00 0.00 C ATOM 385 O VAL A 537 6.279 -1.467 1.303 1.00 0.00 O ATOM 386 CB VAL A 537 4.130 0.599 1.465 1.00 0.00 C ATOM 387 CG1 VAL A 537 4.817 1.636 0.584 1.00 0.00 C ATOM 388 CG2 VAL A 537 2.739 1.073 1.852 1.00 0.00 C ATOM 0 H VAL A 537 3.803 -1.957 2.451 1.00 0.00 H new ATOM 0 HA VAL A 537 3.477 -0.616 -0.162 1.00 0.00 H new ATOM 0 HB VAL A 537 4.722 0.475 2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 537 4.858 2.590 1.110 1.00 0.00 H new ATOM 0 HG12 VAL A 537 5.830 1.304 0.354 1.00 0.00 H new ATOM 0 HG13 VAL A 537 4.255 1.756 -0.342 1.00 0.00 H new ATOM 0 HG21 VAL A 537 2.810 2.037 2.356 1.00 0.00 H new ATOM 0 HG22 VAL A 537 2.127 1.176 0.956 1.00 0.00 H new ATOM 0 HG23 VAL A 537 2.280 0.346 2.523 1.00 0.00 H new ATOM 398 N ARG A 538 5.688 -1.444 -0.858 1.00 0.00 N ATOM 399 CA ARG A 538 6.942 -2.002 -1.319 1.00 0.00 C ATOM 400 C ARG A 538 7.806 -0.907 -1.918 1.00 0.00 C ATOM 401 O ARG A 538 7.423 -0.268 -2.900 1.00 0.00 O ATOM 402 CB ARG A 538 6.678 -3.120 -2.329 1.00 0.00 C ATOM 403 CG ARG A 538 5.825 -4.240 -1.752 1.00 0.00 C ATOM 404 CD ARG A 538 5.590 -5.360 -2.750 1.00 0.00 C ATOM 405 NE ARG A 538 4.762 -6.423 -2.176 1.00 0.00 N ATOM 406 CZ ARG A 538 4.876 -7.715 -2.485 1.00 0.00 C ATOM 407 NH1 ARG A 538 5.769 -8.113 -3.382 1.00 0.00 N ATOM 408 NH2 ARG A 538 4.096 -8.608 -1.890 1.00 0.00 N ATOM 0 H ARG A 538 5.026 -1.221 -1.601 1.00 0.00 H new ATOM 0 HA ARG A 538 7.480 -2.433 -0.475 1.00 0.00 H new ATOM 0 HB2 ARG A 538 6.180 -2.703 -3.205 1.00 0.00 H new ATOM 0 HB3 ARG A 538 7.629 -3.530 -2.668 1.00 0.00 H new ATOM 0 HG2 ARG A 538 6.312 -4.644 -0.864 1.00 0.00 H new ATOM 0 HG3 ARG A 538 4.865 -3.834 -1.432 1.00 0.00 H new ATOM 0 HD2 ARG A 538 5.105 -4.960 -3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 538 6.547 -5.774 -3.067 1.00 0.00 H new ATOM 0 HE ARG A 538 4.051 -6.157 -1.495 1.00 0.00 H new ATOM 0 HH11 ARG A 538 6.373 -7.429 -3.839 1.00 0.00 H new ATOM 0 HH12 ARG A 538 5.852 -9.103 -3.615 1.00 0.00 H new ATOM 0 HH21 ARG A 538 3.411 -8.306 -1.198 1.00 0.00 H new ATOM 0 HH22 ARG A 538 4.182 -9.597 -2.125 1.00 0.00 H new ATOM 422 N ILE A 539 8.967 -0.685 -1.318 1.00 0.00 N ATOM 423 CA ILE A 539 9.851 0.374 -1.758 1.00 0.00 C ATOM 424 C ILE A 539 11.122 -0.208 -2.367 1.00 0.00 C ATOM 425 O ILE A 539 11.848 -0.975 -1.730 1.00 0.00 O ATOM 426 CB ILE A 539 10.223 1.289 -0.581 1.00 0.00 C ATOM 427 CG1 ILE A 539 8.952 1.763 0.131 1.00 0.00 C ATOM 428 CG2 ILE A 539 11.044 2.474 -1.065 1.00 0.00 C ATOM 429 CD1 ILE A 539 9.205 2.663 1.319 1.00 0.00 C ATOM 0 H ILE A 539 9.315 -1.226 -0.526 1.00 0.00 H new ATOM 0 HA ILE A 539 9.326 0.958 -2.514 1.00 0.00 H new ATOM 0 HB ILE A 539 10.831 0.725 0.127 1.00 0.00 H new ATOM 0 HG12 ILE A 539 8.324 2.294 -0.585 1.00 0.00 H new ATOM 0 HG13 ILE A 539 8.389 0.891 0.464 1.00 0.00 H new ATOM 0 HG21 ILE A 539 11.298 3.111 -0.218 1.00 0.00 H new ATOM 0 HG22 ILE A 539 11.959 2.115 -1.536 1.00 0.00 H new ATOM 0 HG23 ILE A 539 10.464 3.047 -1.789 1.00 0.00 H new ATOM 0 HD11 ILE A 539 8.254 2.953 1.765 1.00 0.00 H new ATOM 0 HD12 ILE A 539 9.805 2.131 2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 539 9.739 3.555 0.992 1.00 0.00 H new ATOM 441 N LYS A 540 11.376 0.172 -3.602 1.00 0.00 N ATOM 442 CA LYS A 540 12.543 -0.312 -4.316 1.00 0.00 C ATOM 443 C LYS A 540 13.343 0.825 -4.925 1.00 0.00 C ATOM 444 O LYS A 540 12.798 1.872 -5.283 1.00 0.00 O ATOM 445 CB LYS A 540 12.128 -1.299 -5.408 1.00 0.00 C ATOM 446 CG LYS A 540 11.336 -0.668 -6.543 1.00 0.00 C ATOM 447 CD LYS A 540 10.922 -1.694 -7.583 1.00 0.00 C ATOM 448 CE LYS A 540 12.100 -2.533 -8.056 1.00 0.00 C ATOM 449 NZ LYS A 540 13.171 -1.712 -8.685 1.00 0.00 N ATOM 0 H LYS A 540 10.790 0.815 -4.134 1.00 0.00 H new ATOM 0 HA LYS A 540 13.180 -0.820 -3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 540 13.022 -1.767 -5.819 1.00 0.00 H new ATOM 0 HB3 LYS A 540 11.530 -2.092 -4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 540 10.448 -0.181 -6.139 1.00 0.00 H new ATOM 0 HG3 LYS A 540 11.937 0.108 -7.017 1.00 0.00 H new ATOM 0 HD2 LYS A 540 10.157 -2.347 -7.163 1.00 0.00 H new ATOM 0 HD3 LYS A 540 10.474 -1.185 -8.436 1.00 0.00 H new ATOM 0 HE2 LYS A 540 12.516 -3.079 -7.209 1.00 0.00 H new ATOM 0 HE3 LYS A 540 11.748 -3.275 -8.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 540 13.876 -2.338 -9.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 540 12.754 -1.096 -9.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 540 13.632 -1.128 -7.959 1.00 0.00 H new ATOM 463 N LYS A 541 14.643 0.616 -5.024 1.00 0.00 N ATOM 464 CA LYS A 541 15.474 1.569 -5.724 1.00 0.00 C ATOM 465 C LYS A 541 15.208 1.435 -7.217 1.00 0.00 C ATOM 466 O LYS A 541 15.213 0.328 -7.760 1.00 0.00 O ATOM 467 CB LYS A 541 16.956 1.324 -5.424 1.00 0.00 C ATOM 468 CG LYS A 541 17.887 2.294 -6.133 1.00 0.00 C ATOM 469 CD LYS A 541 17.631 3.723 -5.694 1.00 0.00 C ATOM 470 CE LYS A 541 18.468 4.715 -6.479 1.00 0.00 C ATOM 471 NZ LYS A 541 19.921 4.531 -6.238 1.00 0.00 N ATOM 0 H LYS A 541 15.135 -0.189 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 541 15.232 2.578 -5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 541 17.118 1.398 -4.349 1.00 0.00 H new ATOM 0 HB3 LYS A 541 17.214 0.306 -5.716 1.00 0.00 H new ATOM 0 HG2 LYS A 541 18.923 2.027 -5.923 1.00 0.00 H new ATOM 0 HG3 LYS A 541 17.749 2.212 -7.211 1.00 0.00 H new ATOM 0 HD2 LYS A 541 16.574 3.958 -5.822 1.00 0.00 H new ATOM 0 HD3 LYS A 541 17.853 3.822 -4.631 1.00 0.00 H new ATOM 0 HE2 LYS A 541 18.260 4.603 -7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 541 18.181 5.730 -6.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 541 20.450 5.291 -6.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 541 20.110 4.562 -5.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 541 20.222 3.611 -6.618 1.00 0.00 H new ATOM 485 N GLY A 542 14.940 2.547 -7.869 1.00 0.00 N ATOM 486 CA GLY A 542 14.665 2.514 -9.285 1.00 0.00 C ATOM 487 C GLY A 542 15.875 2.899 -10.099 1.00 0.00 C ATOM 488 O GLY A 542 16.863 3.401 -9.558 1.00 0.00 O ATOM 0 H GLY A 542 14.907 3.474 -7.445 1.00 0.00 H new ATOM 0 HA2 GLY A 542 14.339 1.513 -9.569 1.00 0.00 H new ATOM 0 HA3 GLY A 542 13.843 3.193 -9.512 1.00 0.00 H new ATOM 492 N SER A 543 15.802 2.662 -11.397 1.00 0.00 N ATOM 493 CA SER A 543 16.878 3.017 -12.303 1.00 0.00 C ATOM 494 C SER A 543 16.938 4.530 -12.484 1.00 0.00 C ATOM 495 O SER A 543 17.930 5.073 -12.974 1.00 0.00 O ATOM 496 CB SER A 543 16.661 2.328 -13.650 1.00 0.00 C ATOM 497 OG SER A 543 16.437 0.938 -13.471 1.00 0.00 O ATOM 0 H SER A 543 15.001 2.221 -11.849 1.00 0.00 H new ATOM 0 HA SER A 543 17.826 2.684 -11.881 1.00 0.00 H new ATOM 0 HB2 SER A 543 15.809 2.776 -14.160 1.00 0.00 H new ATOM 0 HB3 SER A 543 17.531 2.482 -14.288 1.00 0.00 H new ATOM 0 HG SER A 543 16.298 0.514 -14.344 1.00 0.00 H new ATOM 503 N HIS A 544 15.865 5.202 -12.089 1.00 0.00 N ATOM 504 CA HIS A 544 15.789 6.650 -12.196 1.00 0.00 C ATOM 505 C HIS A 544 15.861 7.299 -10.816 1.00 0.00 C ATOM 506 O HIS A 544 16.735 8.126 -10.557 1.00 0.00 O ATOM 507 CB HIS A 544 14.499 7.069 -12.907 1.00 0.00 C ATOM 508 CG HIS A 544 14.321 6.436 -14.255 1.00 0.00 C ATOM 509 ND1 HIS A 544 13.137 5.844 -14.617 1.00 0.00 N ATOM 510 CD2 HIS A 544 15.199 6.330 -15.282 1.00 0.00 C ATOM 511 CE1 HIS A 544 13.316 5.395 -15.846 1.00 0.00 C ATOM 512 NE2 HIS A 544 14.550 5.666 -16.292 1.00 0.00 N ATOM 0 H HIS A 544 15.034 4.765 -11.691 1.00 0.00 H new ATOM 0 HA HIS A 544 16.641 6.991 -12.784 1.00 0.00 H new ATOM 0 HB2 HIS A 544 13.647 6.810 -12.278 1.00 0.00 H new ATOM 0 HB3 HIS A 544 14.493 8.153 -13.021 1.00 0.00 H new ATOM 0 HD2 HIS A 544 16.214 6.698 -15.302 1.00 0.00 H new ATOM 0 HE1 HIS A 544 12.563 4.875 -16.419 1.00 0.00 H new ATOM 0 HE2 HIS A 544 14.933 5.425 -17.206 1.00 0.00 H new ATOM 520 N ARG A 545 14.941 6.917 -9.934 1.00 0.00 N ATOM 521 CA ARG A 545 14.863 7.491 -8.591 1.00 0.00 C ATOM 522 C ARG A 545 14.444 6.436 -7.572 1.00 0.00 C ATOM 523 O ARG A 545 14.408 5.245 -7.869 1.00 0.00 O ATOM 524 CB ARG A 545 13.843 8.637 -8.556 1.00 0.00 C ATOM 525 CG ARG A 545 14.225 9.861 -9.369 1.00 0.00 C ATOM 526 CD ARG A 545 13.189 10.956 -9.193 1.00 0.00 C ATOM 527 NE ARG A 545 13.541 12.186 -9.895 1.00 0.00 N ATOM 528 CZ ARG A 545 13.154 13.397 -9.496 1.00 0.00 C ATOM 529 NH1 ARG A 545 12.411 13.532 -8.405 1.00 0.00 N ATOM 530 NH2 ARG A 545 13.508 14.472 -10.185 1.00 0.00 N ATOM 0 H ARG A 545 14.234 6.207 -10.126 1.00 0.00 H new ATOM 0 HA ARG A 545 15.854 7.868 -8.337 1.00 0.00 H new ATOM 0 HB2 ARG A 545 12.886 8.263 -8.919 1.00 0.00 H new ATOM 0 HB3 ARG A 545 13.695 8.940 -7.519 1.00 0.00 H new ATOM 0 HG2 ARG A 545 15.204 10.223 -9.055 1.00 0.00 H new ATOM 0 HG3 ARG A 545 14.307 9.595 -10.423 1.00 0.00 H new ATOM 0 HD2 ARG A 545 12.225 10.599 -9.556 1.00 0.00 H new ATOM 0 HD3 ARG A 545 13.071 11.170 -8.131 1.00 0.00 H new ATOM 0 HE ARG A 545 14.114 12.115 -10.736 1.00 0.00 H new ATOM 0 HH11 ARG A 545 12.135 12.708 -7.871 1.00 0.00 H new ATOM 0 HH12 ARG A 545 12.116 14.460 -8.101 1.00 0.00 H new ATOM 0 HH21 ARG A 545 14.079 14.374 -11.025 1.00 0.00 H new ATOM 0 HH22 ARG A 545 13.209 15.397 -9.876 1.00 0.00 H new ATOM 544 N TRP A 546 14.138 6.895 -6.369 1.00 0.00 N ATOM 545 CA TRP A 546 13.579 6.016 -5.353 1.00 0.00 C ATOM 546 C TRP A 546 12.074 5.957 -5.511 1.00 0.00 C ATOM 547 O TRP A 546 11.400 6.985 -5.492 1.00 0.00 O ATOM 548 CB TRP A 546 13.943 6.485 -3.947 1.00 0.00 C ATOM 549 CG TRP A 546 15.284 6.004 -3.511 1.00 0.00 C ATOM 550 CD1 TRP A 546 16.487 6.588 -3.768 1.00 0.00 C ATOM 551 CD2 TRP A 546 15.558 4.822 -2.752 1.00 0.00 C ATOM 552 NE1 TRP A 546 17.497 5.843 -3.211 1.00 0.00 N ATOM 553 CE2 TRP A 546 16.951 4.754 -2.580 1.00 0.00 C ATOM 554 CE3 TRP A 546 14.760 3.815 -2.197 1.00 0.00 C ATOM 555 CZ2 TRP A 546 17.565 3.720 -1.881 1.00 0.00 C ATOM 556 CZ3 TRP A 546 15.371 2.789 -1.502 1.00 0.00 C ATOM 557 CH2 TRP A 546 16.762 2.748 -1.349 1.00 0.00 C ATOM 0 H TRP A 546 14.266 7.863 -6.073 1.00 0.00 H new ATOM 0 HA TRP A 546 14.002 5.021 -5.488 1.00 0.00 H new ATOM 0 HB2 TRP A 546 13.924 7.574 -3.915 1.00 0.00 H new ATOM 0 HB3 TRP A 546 13.188 6.132 -3.244 1.00 0.00 H new ATOM 0 HD1 TRP A 546 16.626 7.502 -4.327 1.00 0.00 H new ATOM 0 HE1 TRP A 546 18.492 6.063 -3.259 1.00 0.00 H new ATOM 0 HE3 TRP A 546 13.686 3.839 -2.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 546 18.638 3.685 -1.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 546 14.766 2.006 -1.070 1.00 0.00 H new ATOM 0 HH2 TRP A 546 17.210 1.933 -0.800 1.00 0.00 H new ATOM 568 N GLN A 547 11.546 4.757 -5.667 1.00 0.00 N ATOM 569 CA GLN A 547 10.122 4.592 -5.888 1.00 0.00 C ATOM 570 C GLN A 547 9.499 3.623 -4.899 1.00 0.00 C ATOM 571 O GLN A 547 10.147 2.703 -4.400 1.00 0.00 O ATOM 572 CB GLN A 547 9.870 4.119 -7.318 1.00 0.00 C ATOM 573 CG GLN A 547 10.510 2.780 -7.633 1.00 0.00 C ATOM 574 CD GLN A 547 10.409 2.416 -9.097 1.00 0.00 C ATOM 575 OE1 GLN A 547 11.286 2.751 -9.894 1.00 0.00 O ATOM 576 NE2 GLN A 547 9.342 1.726 -9.461 1.00 0.00 N ATOM 0 H GLN A 547 12.078 3.887 -5.645 1.00 0.00 H new ATOM 0 HA GLN A 547 9.649 5.562 -5.734 1.00 0.00 H new ATOM 0 HB2 GLN A 547 8.795 4.047 -7.485 1.00 0.00 H new ATOM 0 HB3 GLN A 547 10.251 4.868 -8.013 1.00 0.00 H new ATOM 0 HG2 GLN A 547 11.560 2.806 -7.341 1.00 0.00 H new ATOM 0 HG3 GLN A 547 10.032 2.004 -7.036 1.00 0.00 H new ATOM 0 HE21 GLN A 547 8.640 1.469 -8.767 1.00 0.00 H new ATOM 0 HE22 GLN A 547 9.221 1.450 -10.436 1.00 0.00 H new ATOM 585 N GLY A 548 8.233 3.853 -4.628 1.00 0.00 N ATOM 586 CA GLY A 548 7.483 2.995 -3.744 1.00 0.00 C ATOM 587 C GLY A 548 6.094 2.758 -4.276 1.00 0.00 C ATOM 588 O GLY A 548 5.546 3.606 -4.980 1.00 0.00 O ATOM 0 H GLY A 548 7.700 4.634 -5.012 1.00 0.00 H new ATOM 0 HA2 GLY A 548 8.000 2.042 -3.630 1.00 0.00 H new ATOM 0 HA3 GLY A 548 7.425 3.447 -2.754 1.00 0.00 H new ATOM 592 N GLU A 549 5.521 1.617 -3.955 1.00 0.00 N ATOM 593 CA GLU A 549 4.188 1.295 -4.422 1.00 0.00 C ATOM 594 C GLU A 549 3.383 0.658 -3.308 1.00 0.00 C ATOM 595 O GLU A 549 3.924 -0.029 -2.440 1.00 0.00 O ATOM 596 CB GLU A 549 4.245 0.366 -5.635 1.00 0.00 C ATOM 597 CG GLU A 549 4.692 -1.040 -5.294 1.00 0.00 C ATOM 598 CD GLU A 549 5.138 -1.823 -6.507 1.00 0.00 C ATOM 599 OE1 GLU A 549 4.280 -2.432 -7.179 1.00 0.00 O ATOM 600 OE2 GLU A 549 6.354 -1.832 -6.793 1.00 0.00 O ATOM 0 H GLU A 549 5.955 0.899 -3.375 1.00 0.00 H new ATOM 0 HA GLU A 549 3.699 2.220 -4.726 1.00 0.00 H new ATOM 0 HB2 GLU A 549 3.259 0.324 -6.098 1.00 0.00 H new ATOM 0 HB3 GLU A 549 4.926 0.787 -6.374 1.00 0.00 H new ATOM 0 HG2 GLU A 549 5.511 -0.992 -4.577 1.00 0.00 H new ATOM 0 HG3 GLU A 549 3.873 -1.569 -4.807 1.00 0.00 H new ATOM 607 N THR A 550 2.099 0.907 -3.341 1.00 0.00 N ATOM 608 CA THR A 550 1.206 0.396 -2.328 1.00 0.00 C ATOM 609 C THR A 550 0.371 -0.753 -2.873 1.00 0.00 C ATOM 610 O THR A 550 -0.252 -0.641 -3.927 1.00 0.00 O ATOM 611 CB THR A 550 0.284 1.496 -1.801 1.00 0.00 C ATOM 612 OG1 THR A 550 1.051 2.504 -1.128 1.00 0.00 O ATOM 613 CG2 THR A 550 -0.753 0.916 -0.863 1.00 0.00 C ATOM 0 H THR A 550 1.644 1.465 -4.064 1.00 0.00 H new ATOM 0 HA THR A 550 1.820 0.030 -1.505 1.00 0.00 H new ATOM 0 HB THR A 550 -0.231 1.951 -2.647 1.00 0.00 H new ATOM 0 HG1 THR A 550 1.102 3.306 -1.689 1.00 0.00 H new ATOM 0 HG21 THR A 550 -1.400 1.714 -0.498 1.00 0.00 H new ATOM 0 HG22 THR A 550 -1.352 0.177 -1.395 1.00 0.00 H new ATOM 0 HG23 THR A 550 -0.254 0.439 -0.019 1.00 0.00 H new ATOM 621 N TRP A 551 0.424 -1.872 -2.182 1.00 0.00 N ATOM 622 CA TRP A 551 -0.328 -3.039 -2.577 1.00 0.00 C ATOM 623 C TRP A 551 -1.482 -3.276 -1.611 1.00 0.00 C ATOM 624 O TRP A 551 -1.387 -3.008 -0.412 1.00 0.00 O ATOM 625 CB TRP A 551 0.566 -4.278 -2.620 1.00 0.00 C ATOM 626 CG TRP A 551 1.283 -4.443 -3.918 1.00 0.00 C ATOM 627 CD1 TRP A 551 2.189 -3.589 -4.463 1.00 0.00 C ATOM 628 CD2 TRP A 551 1.151 -5.534 -4.835 1.00 0.00 C ATOM 629 NE1 TRP A 551 2.626 -4.075 -5.670 1.00 0.00 N ATOM 630 CE2 TRP A 551 2.006 -5.271 -5.918 1.00 0.00 C ATOM 631 CE3 TRP A 551 0.391 -6.709 -4.846 1.00 0.00 C ATOM 632 CZ2 TRP A 551 2.124 -6.135 -7.000 1.00 0.00 C ATOM 633 CZ3 TRP A 551 0.511 -7.567 -5.921 1.00 0.00 C ATOM 634 CH2 TRP A 551 1.372 -7.277 -6.986 1.00 0.00 C ATOM 0 H TRP A 551 0.985 -1.996 -1.339 1.00 0.00 H new ATOM 0 HA TRP A 551 -0.724 -2.860 -3.577 1.00 0.00 H new ATOM 0 HB2 TRP A 551 1.297 -4.218 -1.814 1.00 0.00 H new ATOM 0 HB3 TRP A 551 -0.042 -5.163 -2.434 1.00 0.00 H new ATOM 0 HD1 TRP A 551 2.517 -2.664 -4.013 1.00 0.00 H new ATOM 0 HE1 TRP A 551 3.302 -3.620 -6.283 1.00 0.00 H new ATOM 0 HE3 TRP A 551 -0.277 -6.940 -4.029 1.00 0.00 H new ATOM 0 HZ2 TRP A 551 2.787 -5.912 -7.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 551 -0.069 -8.478 -5.941 1.00 0.00 H new ATOM 0 HH2 TRP A 551 1.444 -7.969 -7.812 1.00 0.00 H new ATOM 645 N TYR A 552 -2.560 -3.782 -2.167 1.00 0.00 N ATOM 646 CA TYR A 552 -3.734 -4.143 -1.385 1.00 0.00 C ATOM 647 C TYR A 552 -4.169 -5.556 -1.716 1.00 0.00 C ATOM 648 O TYR A 552 -3.964 -6.034 -2.830 1.00 0.00 O ATOM 649 CB TYR A 552 -4.894 -3.177 -1.647 1.00 0.00 C ATOM 650 CG TYR A 552 -4.934 -1.956 -0.746 1.00 0.00 C ATOM 651 CD1 TYR A 552 -4.252 -0.792 -1.076 1.00 0.00 C ATOM 652 CD2 TYR A 552 -5.688 -1.960 0.421 1.00 0.00 C ATOM 653 CE1 TYR A 552 -4.318 0.327 -0.270 1.00 0.00 C ATOM 654 CE2 TYR A 552 -5.763 -0.841 1.229 1.00 0.00 C ATOM 655 CZ TYR A 552 -5.078 0.299 0.877 1.00 0.00 C ATOM 656 OH TYR A 552 -5.146 1.417 1.676 1.00 0.00 O ATOM 0 H TYR A 552 -2.653 -3.956 -3.168 1.00 0.00 H new ATOM 0 HA TYR A 552 -3.463 -4.081 -0.331 1.00 0.00 H new ATOM 0 HB2 TYR A 552 -4.840 -2.843 -2.683 1.00 0.00 H new ATOM 0 HB3 TYR A 552 -5.832 -3.722 -1.536 1.00 0.00 H new ATOM 0 HD1 TYR A 552 -3.660 -0.762 -1.979 1.00 0.00 H new ATOM 0 HD2 TYR A 552 -6.225 -2.854 0.702 1.00 0.00 H new ATOM 0 HE1 TYR A 552 -3.775 1.221 -0.539 1.00 0.00 H new ATOM 0 HE2 TYR A 552 -6.356 -0.861 2.131 1.00 0.00 H new ATOM 0 HH TYR A 552 -5.724 1.234 2.446 1.00 0.00 H new ATOM 666 N TYR A 553 -4.760 -6.236 -0.753 1.00 0.00 N ATOM 667 CA TYR A 553 -5.204 -7.601 -0.954 1.00 0.00 C ATOM 668 C TYR A 553 -6.608 -7.776 -0.402 1.00 0.00 C ATOM 669 O TYR A 553 -6.895 -7.342 0.717 1.00 0.00 O ATOM 670 CB TYR A 553 -4.249 -8.577 -0.253 1.00 0.00 C ATOM 671 CG TYR A 553 -2.790 -8.381 -0.613 1.00 0.00 C ATOM 672 CD1 TYR A 553 -2.016 -7.422 0.031 1.00 0.00 C ATOM 673 CD2 TYR A 553 -2.189 -9.147 -1.602 1.00 0.00 C ATOM 674 CE1 TYR A 553 -0.689 -7.235 -0.303 1.00 0.00 C ATOM 675 CE2 TYR A 553 -0.864 -8.966 -1.940 1.00 0.00 C ATOM 676 CZ TYR A 553 -0.119 -8.008 -1.289 1.00 0.00 C ATOM 677 OH TYR A 553 1.200 -7.820 -1.625 1.00 0.00 O ATOM 0 H TYR A 553 -4.944 -5.864 0.179 1.00 0.00 H new ATOM 0 HA TYR A 553 -5.209 -7.814 -2.023 1.00 0.00 H new ATOM 0 HB2 TYR A 553 -4.364 -8.469 0.826 1.00 0.00 H new ATOM 0 HB3 TYR A 553 -4.540 -9.597 -0.504 1.00 0.00 H new ATOM 0 HD1 TYR A 553 -2.460 -6.813 0.805 1.00 0.00 H new ATOM 0 HD2 TYR A 553 -2.769 -9.899 -2.116 1.00 0.00 H new ATOM 0 HE1 TYR A 553 -0.101 -6.486 0.207 1.00 0.00 H new ATOM 0 HE2 TYR A 553 -0.413 -9.573 -2.711 1.00 0.00 H new ATOM 0 HH TYR A 553 1.669 -7.387 -0.881 1.00 0.00 H new ATOM 687 N GLY A 554 -7.480 -8.388 -1.192 1.00 0.00 N ATOM 688 CA GLY A 554 -8.812 -8.695 -0.722 1.00 0.00 C ATOM 689 C GLY A 554 -8.778 -9.692 0.413 1.00 0.00 C ATOM 690 O GLY A 554 -7.964 -10.619 0.395 1.00 0.00 O ATOM 0 H GLY A 554 -7.286 -8.677 -2.151 1.00 0.00 H new ATOM 0 HA2 GLY A 554 -9.303 -7.780 -0.390 1.00 0.00 H new ATOM 0 HA3 GLY A 554 -9.406 -9.096 -1.543 1.00 0.00 H new ATOM 694 N PRO A 555 -9.645 -9.513 1.419 1.00 0.00 N ATOM 695 CA PRO A 555 -9.661 -10.350 2.620 1.00 0.00 C ATOM 696 C PRO A 555 -9.725 -11.848 2.320 1.00 0.00 C ATOM 697 O PRO A 555 -9.211 -12.662 3.087 1.00 0.00 O ATOM 698 CB PRO A 555 -10.906 -9.890 3.390 1.00 0.00 C ATOM 699 CG PRO A 555 -11.625 -8.915 2.513 1.00 0.00 C ATOM 700 CD PRO A 555 -10.650 -8.445 1.475 1.00 0.00 C ATOM 0 HA PRO A 555 -8.736 -10.231 3.185 1.00 0.00 H new ATOM 0 HB2 PRO A 555 -11.547 -10.739 3.630 1.00 0.00 H new ATOM 0 HB3 PRO A 555 -10.625 -9.425 4.335 1.00 0.00 H new ATOM 0 HG2 PRO A 555 -12.489 -9.385 2.044 1.00 0.00 H new ATOM 0 HG3 PRO A 555 -11.998 -8.074 3.098 1.00 0.00 H new ATOM 0 HD2 PRO A 555 -11.134 -8.302 0.509 1.00 0.00 H new ATOM 0 HD3 PRO A 555 -10.202 -7.490 1.752 1.00 0.00 H new ATOM 708 N CYS A 556 -10.342 -12.211 1.212 1.00 0.00 N ATOM 709 CA CYS A 556 -10.323 -13.596 0.760 1.00 0.00 C ATOM 710 C CYS A 556 -10.186 -13.684 -0.761 1.00 0.00 C ATOM 711 O CYS A 556 -9.736 -14.702 -1.294 1.00 0.00 O ATOM 712 CB CYS A 556 -11.584 -14.329 1.233 1.00 0.00 C ATOM 713 SG CYS A 556 -13.135 -13.516 0.782 1.00 0.00 S ATOM 0 H CYS A 556 -10.861 -11.573 0.609 1.00 0.00 H new ATOM 0 HA CYS A 556 -9.451 -14.081 1.199 1.00 0.00 H new ATOM 0 HB2 CYS A 556 -11.582 -15.336 0.817 1.00 0.00 H new ATOM 0 HB3 CYS A 556 -11.544 -14.432 2.317 1.00 0.00 H new ATOM 0 HG CYS A 556 -14.137 -14.216 1.226 1.00 0.00 H new ATOM 719 N GLY A 557 -10.568 -12.616 -1.456 1.00 0.00 N ATOM 720 CA GLY A 557 -10.535 -12.622 -2.910 1.00 0.00 C ATOM 721 C GLY A 557 -9.165 -12.305 -3.493 1.00 0.00 C ATOM 722 O GLY A 557 -8.134 -12.640 -2.906 1.00 0.00 O ATOM 0 H GLY A 557 -10.900 -11.746 -1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 557 -10.854 -13.601 -3.268 1.00 0.00 H new ATOM 0 HA3 GLY A 557 -11.256 -11.895 -3.284 1.00 0.00 H new ATOM 726 N LYS A 558 -9.163 -11.655 -4.655 1.00 0.00 N ATOM 727 CA LYS A 558 -7.919 -11.336 -5.358 1.00 0.00 C ATOM 728 C LYS A 558 -7.238 -10.110 -4.757 1.00 0.00 C ATOM 729 O LYS A 558 -7.732 -9.520 -3.795 1.00 0.00 O ATOM 730 CB LYS A 558 -8.159 -11.115 -6.859 1.00 0.00 C ATOM 731 CG LYS A 558 -9.080 -9.948 -7.199 1.00 0.00 C ATOM 732 CD LYS A 558 -10.519 -10.404 -7.368 1.00 0.00 C ATOM 733 CE LYS A 558 -11.375 -9.320 -7.996 1.00 0.00 C ATOM 734 NZ LYS A 558 -12.738 -9.809 -8.327 1.00 0.00 N ATOM 0 H LYS A 558 -10.008 -11.338 -5.131 1.00 0.00 H new ATOM 0 HA LYS A 558 -7.260 -12.195 -5.237 1.00 0.00 H new ATOM 0 HB2 LYS A 558 -7.197 -10.953 -7.345 1.00 0.00 H new ATOM 0 HB3 LYS A 558 -8.581 -12.027 -7.282 1.00 0.00 H new ATOM 0 HG2 LYS A 558 -9.025 -9.198 -6.410 1.00 0.00 H new ATOM 0 HG3 LYS A 558 -8.739 -9.470 -8.117 1.00 0.00 H new ATOM 0 HD2 LYS A 558 -10.548 -11.298 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 558 -10.931 -10.678 -6.397 1.00 0.00 H new ATOM 0 HE2 LYS A 558 -11.449 -8.475 -7.312 1.00 0.00 H new ATOM 0 HE3 LYS A 558 -10.891 -8.955 -8.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 -13.290 -9.037 -8.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 -12.669 -10.599 -9.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 -13.211 -10.134 -7.459 1.00 0.00 H new ATOM 748 N ARG A 559 -6.101 -9.728 -5.332 1.00 0.00 N ATOM 749 CA ARG A 559 -5.340 -8.594 -4.825 1.00 0.00 C ATOM 750 C ARG A 559 -5.258 -7.487 -5.868 1.00 0.00 C ATOM 751 O ARG A 559 -5.115 -7.743 -7.066 1.00 0.00 O ATOM 752 CB ARG A 559 -3.929 -9.006 -4.379 1.00 0.00 C ATOM 753 CG ARG A 559 -2.938 -9.268 -5.509 1.00 0.00 C ATOM 754 CD ARG A 559 -3.186 -10.604 -6.189 1.00 0.00 C ATOM 755 NE ARG A 559 -3.188 -11.705 -5.231 1.00 0.00 N ATOM 756 CZ ARG A 559 -3.978 -12.773 -5.320 1.00 0.00 C ATOM 757 NH1 ARG A 559 -4.774 -12.936 -6.370 1.00 0.00 N ATOM 758 NH2 ARG A 559 -3.952 -13.692 -4.365 1.00 0.00 N ATOM 0 H ARG A 559 -5.689 -10.186 -6.145 1.00 0.00 H new ATOM 0 HA ARG A 559 -5.870 -8.217 -3.950 1.00 0.00 H new ATOM 0 HB2 ARG A 559 -3.525 -8.222 -3.738 1.00 0.00 H new ATOM 0 HB3 ARG A 559 -4.007 -9.907 -3.770 1.00 0.00 H new ATOM 0 HG2 ARG A 559 -3.009 -8.468 -6.246 1.00 0.00 H new ATOM 0 HG3 ARG A 559 -1.923 -9.246 -5.113 1.00 0.00 H new ATOM 0 HD2 ARG A 559 -4.142 -10.574 -6.711 1.00 0.00 H new ATOM 0 HD3 ARG A 559 -2.417 -10.778 -6.941 1.00 0.00 H new ATOM 0 HE ARG A 559 -2.543 -11.653 -4.443 1.00 0.00 H new ATOM 0 HH11 ARG A 559 -4.783 -12.240 -7.116 1.00 0.00 H new ATOM 0 HH12 ARG A 559 -5.376 -13.757 -6.431 1.00 0.00 H new ATOM 0 HH21 ARG A 559 -3.328 -13.579 -3.566 1.00 0.00 H new ATOM 0 HH22 ARG A 559 -4.556 -14.512 -4.429 1.00 0.00 H new ATOM 772 N MET A 560 -5.373 -6.261 -5.396 1.00 0.00 N ATOM 773 CA MET A 560 -5.342 -5.102 -6.267 1.00 0.00 C ATOM 774 C MET A 560 -4.292 -4.111 -5.795 1.00 0.00 C ATOM 775 O MET A 560 -4.073 -3.952 -4.601 1.00 0.00 O ATOM 776 CB MET A 560 -6.717 -4.424 -6.328 1.00 0.00 C ATOM 777 CG MET A 560 -7.839 -5.319 -6.853 1.00 0.00 C ATOM 778 SD MET A 560 -8.359 -6.586 -5.674 1.00 0.00 S ATOM 779 CE MET A 560 -8.723 -5.586 -4.233 1.00 0.00 C ATOM 0 H MET A 560 -5.490 -6.041 -4.407 1.00 0.00 H new ATOM 0 HA MET A 560 -5.082 -5.441 -7.270 1.00 0.00 H new ATOM 0 HB2 MET A 560 -6.982 -4.077 -5.329 1.00 0.00 H new ATOM 0 HB3 MET A 560 -6.645 -3.541 -6.963 1.00 0.00 H new ATOM 0 HG2 MET A 560 -8.698 -4.699 -7.111 1.00 0.00 H new ATOM 0 HG3 MET A 560 -7.508 -5.803 -7.772 1.00 0.00 H new ATOM 0 HE1 MET A 560 -9.457 -6.098 -3.611 1.00 0.00 H new ATOM 0 HE2 MET A 560 -7.809 -5.427 -3.660 1.00 0.00 H new ATOM 0 HE3 MET A 560 -9.124 -4.623 -4.550 1.00 0.00 H new ATOM 789 N LYS A 561 -3.649 -3.436 -6.730 1.00 0.00 N ATOM 790 CA LYS A 561 -2.636 -2.454 -6.381 1.00 0.00 C ATOM 791 C LYS A 561 -2.788 -1.217 -7.254 1.00 0.00 C ATOM 792 O LYS A 561 -1.911 -0.357 -7.314 1.00 0.00 O ATOM 793 CB LYS A 561 -1.229 -3.045 -6.488 1.00 0.00 C ATOM 794 CG LYS A 561 -0.879 -3.640 -7.847 1.00 0.00 C ATOM 795 CD LYS A 561 -0.021 -2.702 -8.683 1.00 0.00 C ATOM 796 CE LYS A 561 1.349 -2.497 -8.057 1.00 0.00 C ATOM 797 NZ LYS A 561 2.285 -1.771 -8.954 1.00 0.00 N ATOM 0 H LYS A 561 -3.808 -3.548 -7.731 1.00 0.00 H new ATOM 0 HA LYS A 561 -2.781 -2.161 -5.341 1.00 0.00 H new ATOM 0 HB2 LYS A 561 -0.505 -2.265 -6.253 1.00 0.00 H new ATOM 0 HB3 LYS A 561 -1.119 -3.820 -5.730 1.00 0.00 H new ATOM 0 HG2 LYS A 561 -0.350 -4.582 -7.704 1.00 0.00 H new ATOM 0 HG3 LYS A 561 -1.797 -3.869 -8.388 1.00 0.00 H new ATOM 0 HD2 LYS A 561 0.094 -3.110 -9.687 1.00 0.00 H new ATOM 0 HD3 LYS A 561 -0.524 -1.740 -8.785 1.00 0.00 H new ATOM 0 HE2 LYS A 561 1.239 -1.941 -7.126 1.00 0.00 H new ATOM 0 HE3 LYS A 561 1.776 -3.467 -7.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 561 3.248 -1.820 -8.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 561 2.271 -2.208 -9.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 561 1.992 -0.776 -9.029 1.00 0.00 H new ATOM 811 N GLN A 562 -3.926 -1.148 -7.922 1.00 0.00 N ATOM 812 CA GLN A 562 -4.284 0.004 -8.727 1.00 0.00 C ATOM 813 C GLN A 562 -5.617 0.555 -8.261 1.00 0.00 C ATOM 814 O GLN A 562 -6.501 -0.204 -7.859 1.00 0.00 O ATOM 815 CB GLN A 562 -4.380 -0.386 -10.198 1.00 0.00 C ATOM 816 CG GLN A 562 -3.110 -0.993 -10.760 1.00 0.00 C ATOM 817 CD GLN A 562 -1.948 -0.018 -10.799 1.00 0.00 C ATOM 818 OE1 GLN A 562 -0.792 -0.409 -10.653 1.00 0.00 O ATOM 819 NE2 GLN A 562 -2.236 1.252 -11.023 1.00 0.00 N ATOM 0 H GLN A 562 -4.627 -1.889 -7.921 1.00 0.00 H new ATOM 0 HA GLN A 562 -3.513 0.766 -8.614 1.00 0.00 H new ATOM 0 HB2 GLN A 562 -5.196 -1.098 -10.322 1.00 0.00 H new ATOM 0 HB3 GLN A 562 -4.637 0.498 -10.781 1.00 0.00 H new ATOM 0 HG2 GLN A 562 -2.831 -1.857 -10.158 1.00 0.00 H new ATOM 0 HG3 GLN A 562 -3.304 -1.357 -11.769 1.00 0.00 H new ATOM 0 HE21 GLN A 562 -3.207 1.542 -11.139 1.00 0.00 H new ATOM 0 HE22 GLN A 562 -1.487 1.942 -11.079 1.00 0.00 H new ATOM 828 N PHE A 563 -5.758 1.866 -8.327 1.00 0.00 N ATOM 829 CA PHE A 563 -6.995 2.532 -7.943 1.00 0.00 C ATOM 830 C PHE A 563 -8.196 1.997 -8.741 1.00 0.00 C ATOM 831 O PHE A 563 -9.203 1.611 -8.146 1.00 0.00 O ATOM 832 CB PHE A 563 -6.851 4.047 -8.124 1.00 0.00 C ATOM 833 CG PHE A 563 -8.019 4.843 -7.612 1.00 0.00 C ATOM 834 CD1 PHE A 563 -8.644 4.503 -6.421 1.00 0.00 C ATOM 835 CD2 PHE A 563 -8.481 5.944 -8.315 1.00 0.00 C ATOM 836 CE1 PHE A 563 -9.707 5.245 -5.946 1.00 0.00 C ATOM 837 CE2 PHE A 563 -9.547 6.687 -7.845 1.00 0.00 C ATOM 838 CZ PHE A 563 -10.159 6.338 -6.658 1.00 0.00 C ATOM 0 H PHE A 563 -5.024 2.499 -8.646 1.00 0.00 H new ATOM 0 HA PHE A 563 -7.185 2.318 -6.891 1.00 0.00 H new ATOM 0 HB2 PHE A 563 -5.948 4.378 -7.612 1.00 0.00 H new ATOM 0 HB3 PHE A 563 -6.715 4.264 -9.184 1.00 0.00 H new ATOM 0 HD1 PHE A 563 -8.295 3.649 -5.859 1.00 0.00 H new ATOM 0 HD2 PHE A 563 -8.002 6.225 -9.241 1.00 0.00 H new ATOM 0 HE1 PHE A 563 -10.185 4.970 -5.017 1.00 0.00 H new ATOM 0 HE2 PHE A 563 -9.901 7.540 -8.406 1.00 0.00 H new ATOM 0 HZ PHE A 563 -10.990 6.919 -6.287 1.00 0.00 H new ATOM 848 N PRO A 564 -8.107 1.931 -10.092 1.00 0.00 N ATOM 849 CA PRO A 564 -9.220 1.457 -10.930 1.00 0.00 C ATOM 850 C PRO A 564 -9.557 -0.014 -10.690 1.00 0.00 C ATOM 851 O PRO A 564 -10.629 -0.480 -11.068 1.00 0.00 O ATOM 852 CB PRO A 564 -8.711 1.665 -12.358 1.00 0.00 C ATOM 853 CG PRO A 564 -7.230 1.666 -12.232 1.00 0.00 C ATOM 854 CD PRO A 564 -6.940 2.311 -10.913 1.00 0.00 C ATOM 0 HA PRO A 564 -10.143 1.993 -10.710 1.00 0.00 H new ATOM 0 HB2 PRO A 564 -9.052 0.869 -13.020 1.00 0.00 H new ATOM 0 HB3 PRO A 564 -9.074 2.604 -12.775 1.00 0.00 H new ATOM 0 HG2 PRO A 564 -6.833 0.652 -12.268 1.00 0.00 H new ATOM 0 HG3 PRO A 564 -6.767 2.219 -13.049 1.00 0.00 H new ATOM 0 HD2 PRO A 564 -6.008 1.946 -10.482 1.00 0.00 H new ATOM 0 HD3 PRO A 564 -6.847 3.393 -11.005 1.00 0.00 H new ATOM 862 N GLU A 565 -8.657 -0.737 -10.033 1.00 0.00 N ATOM 863 CA GLU A 565 -8.885 -2.140 -9.705 1.00 0.00 C ATOM 864 C GLU A 565 -9.659 -2.279 -8.396 1.00 0.00 C ATOM 865 O GLU A 565 -10.344 -3.272 -8.164 1.00 0.00 O ATOM 866 CB GLU A 565 -7.556 -2.892 -9.627 1.00 0.00 C ATOM 867 CG GLU A 565 -6.762 -2.859 -10.923 1.00 0.00 C ATOM 868 CD GLU A 565 -7.453 -3.565 -12.069 1.00 0.00 C ATOM 869 OE1 GLU A 565 -7.396 -4.808 -12.131 1.00 0.00 O ATOM 870 OE2 GLU A 565 -8.039 -2.874 -12.927 1.00 0.00 O ATOM 0 H GLU A 565 -7.759 -0.373 -9.716 1.00 0.00 H new ATOM 0 HA GLU A 565 -9.488 -2.580 -10.499 1.00 0.00 H new ATOM 0 HB2 GLU A 565 -6.951 -2.462 -8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 565 -7.750 -3.930 -9.356 1.00 0.00 H new ATOM 0 HG2 GLU A 565 -6.580 -1.821 -11.202 1.00 0.00 H new ATOM 0 HG3 GLU A 565 -5.789 -3.320 -10.756 1.00 0.00 H new ATOM 877 N VAL A 566 -9.528 -1.289 -7.531 1.00 0.00 N ATOM 878 CA VAL A 566 -10.251 -1.305 -6.268 1.00 0.00 C ATOM 879 C VAL A 566 -11.710 -0.888 -6.479 1.00 0.00 C ATOM 880 O VAL A 566 -12.625 -1.500 -5.927 1.00 0.00 O ATOM 881 CB VAL A 566 -9.570 -0.418 -5.200 1.00 0.00 C ATOM 882 CG1 VAL A 566 -10.472 -0.233 -3.986 1.00 0.00 C ATOM 883 CG2 VAL A 566 -8.235 -1.032 -4.778 1.00 0.00 C ATOM 0 H VAL A 566 -8.935 -0.472 -7.675 1.00 0.00 H new ATOM 0 HA VAL A 566 -10.233 -2.328 -5.892 1.00 0.00 H new ATOM 0 HB VAL A 566 -9.387 0.563 -5.639 1.00 0.00 H new ATOM 0 HG11 VAL A 566 -9.968 0.395 -3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 566 -11.403 0.244 -4.294 1.00 0.00 H new ATOM 0 HG13 VAL A 566 -10.691 -1.205 -3.544 1.00 0.00 H new ATOM 0 HG21 VAL A 566 -7.765 -0.399 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL A 566 -8.407 -2.024 -4.361 1.00 0.00 H new ATOM 0 HG23 VAL A 566 -7.580 -1.111 -5.646 1.00 0.00 H new ATOM 893 N ILE A 567 -11.921 0.138 -7.304 1.00 0.00 N ATOM 894 CA ILE A 567 -13.273 0.649 -7.584 1.00 0.00 C ATOM 895 C ILE A 567 -14.161 -0.431 -8.192 1.00 0.00 C ATOM 896 O ILE A 567 -15.361 -0.494 -7.923 1.00 0.00 O ATOM 897 CB ILE A 567 -13.244 1.851 -8.547 1.00 0.00 C ATOM 898 CG1 ILE A 567 -12.091 2.780 -8.192 1.00 0.00 C ATOM 899 CG2 ILE A 567 -14.566 2.606 -8.494 1.00 0.00 C ATOM 900 CD1 ILE A 567 -12.126 3.259 -6.759 1.00 0.00 C ATOM 0 H ILE A 567 -11.176 0.635 -7.793 1.00 0.00 H new ATOM 0 HA ILE A 567 -13.681 0.966 -6.624 1.00 0.00 H new ATOM 0 HB ILE A 567 -13.097 1.481 -9.562 1.00 0.00 H new ATOM 0 HG12 ILE A 567 -11.149 2.262 -8.371 1.00 0.00 H new ATOM 0 HG13 ILE A 567 -12.112 3.644 -8.857 1.00 0.00 H new ATOM 0 HG21 ILE A 567 -14.529 3.452 -9.180 1.00 0.00 H new ATOM 0 HG22 ILE A 567 -15.378 1.939 -8.784 1.00 0.00 H new ATOM 0 HG23 ILE A 567 -14.738 2.968 -7.480 1.00 0.00 H new ATOM 0 HD11 ILE A 567 -11.276 3.916 -6.574 1.00 0.00 H new ATOM 0 HD12 ILE A 567 -13.053 3.804 -6.580 1.00 0.00 H new ATOM 0 HD13 ILE A 567 -12.074 2.402 -6.088 1.00 0.00 H new ATOM 912 N LYS A 568 -13.549 -1.304 -8.975 1.00 0.00 N ATOM 913 CA LYS A 568 -14.302 -2.382 -9.594 1.00 0.00 C ATOM 914 C LYS A 568 -14.651 -3.437 -8.562 1.00 0.00 C ATOM 915 O LYS A 568 -15.745 -3.983 -8.571 1.00 0.00 O ATOM 916 CB LYS A 568 -13.554 -2.994 -10.780 1.00 0.00 C ATOM 917 CG LYS A 568 -12.182 -3.522 -10.431 1.00 0.00 C ATOM 918 CD LYS A 568 -11.454 -4.068 -11.651 1.00 0.00 C ATOM 919 CE LYS A 568 -11.299 -3.012 -12.733 1.00 0.00 C ATOM 920 NZ LYS A 568 -10.467 -3.491 -13.866 1.00 0.00 N ATOM 0 H LYS A 568 -12.553 -1.290 -9.194 1.00 0.00 H new ATOM 0 HA LYS A 568 -15.227 -1.961 -9.988 1.00 0.00 H new ATOM 0 HB2 LYS A 568 -14.151 -3.807 -11.193 1.00 0.00 H new ATOM 0 HB3 LYS A 568 -13.455 -2.241 -11.562 1.00 0.00 H new ATOM 0 HG2 LYS A 568 -11.590 -2.724 -9.982 1.00 0.00 H new ATOM 0 HG3 LYS A 568 -12.276 -4.309 -9.683 1.00 0.00 H new ATOM 0 HD2 LYS A 568 -10.470 -4.432 -11.355 1.00 0.00 H new ATOM 0 HD3 LYS A 568 -12.003 -4.921 -12.051 1.00 0.00 H new ATOM 0 HE2 LYS A 568 -12.283 -2.725 -13.103 1.00 0.00 H new ATOM 0 HE3 LYS A 568 -10.847 -2.118 -12.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 -10.868 -3.146 -14.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 -9.497 -3.132 -13.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 -10.453 -4.531 -13.871 1.00 0.00 H new ATOM 934 N TYR A 569 -13.730 -3.684 -7.641 1.00 0.00 N ATOM 935 CA TYR A 569 -13.900 -4.697 -6.618 1.00 0.00 C ATOM 936 C TYR A 569 -15.092 -4.351 -5.742 1.00 0.00 C ATOM 937 O TYR A 569 -15.933 -5.201 -5.447 1.00 0.00 O ATOM 938 CB TYR A 569 -12.625 -4.770 -5.777 1.00 0.00 C ATOM 939 CG TYR A 569 -12.546 -5.955 -4.847 1.00 0.00 C ATOM 940 CD1 TYR A 569 -13.242 -5.978 -3.645 1.00 0.00 C ATOM 941 CD2 TYR A 569 -11.751 -7.045 -5.166 1.00 0.00 C ATOM 942 CE1 TYR A 569 -13.144 -7.058 -2.789 1.00 0.00 C ATOM 943 CE2 TYR A 569 -11.651 -8.127 -4.319 1.00 0.00 C ATOM 944 CZ TYR A 569 -12.347 -8.128 -3.134 1.00 0.00 C ATOM 945 OH TYR A 569 -12.236 -9.200 -2.287 1.00 0.00 O ATOM 0 H TYR A 569 -12.843 -3.184 -7.585 1.00 0.00 H new ATOM 0 HA TYR A 569 -14.084 -5.666 -7.082 1.00 0.00 H new ATOM 0 HB2 TYR A 569 -11.766 -4.794 -6.447 1.00 0.00 H new ATOM 0 HB3 TYR A 569 -12.543 -3.857 -5.187 1.00 0.00 H new ATOM 0 HD1 TYR A 569 -13.868 -5.140 -3.376 1.00 0.00 H new ATOM 0 HD2 TYR A 569 -11.200 -7.046 -6.095 1.00 0.00 H new ATOM 0 HE1 TYR A 569 -13.688 -7.064 -1.856 1.00 0.00 H new ATOM 0 HE2 TYR A 569 -11.029 -8.969 -4.585 1.00 0.00 H new ATOM 0 HH TYR A 569 -12.394 -10.029 -2.786 1.00 0.00 H new ATOM 955 N LEU A 570 -15.161 -3.085 -5.355 1.00 0.00 N ATOM 956 CA LEU A 570 -16.223 -2.591 -4.492 1.00 0.00 C ATOM 957 C LEU A 570 -17.556 -2.584 -5.231 1.00 0.00 C ATOM 958 O LEU A 570 -18.613 -2.758 -4.633 1.00 0.00 O ATOM 959 CB LEU A 570 -15.885 -1.182 -4.011 1.00 0.00 C ATOM 960 CG LEU A 570 -14.455 -0.999 -3.497 1.00 0.00 C ATOM 961 CD1 LEU A 570 -14.255 0.410 -2.978 1.00 0.00 C ATOM 962 CD2 LEU A 570 -14.129 -2.020 -2.422 1.00 0.00 C ATOM 0 H LEU A 570 -14.484 -2.373 -5.630 1.00 0.00 H new ATOM 0 HA LEU A 570 -16.310 -3.254 -3.631 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -16.052 -0.484 -4.832 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -16.579 -0.910 -3.215 1.00 0.00 H new ATOM 0 HG LEU A 570 -13.771 -1.160 -4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -13.233 0.523 -2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -14.436 1.123 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -14.952 0.599 -2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -13.107 -1.868 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 570 -14.819 -1.901 -1.586 1.00 0.00 H new ATOM 0 HD23 LEU A 570 -14.227 -3.025 -2.833 1.00 0.00 H new ATOM 974 N SER A 571 -17.496 -2.346 -6.532 1.00 0.00 N ATOM 975 CA SER A 571 -18.688 -2.330 -7.366 1.00 0.00 C ATOM 976 C SER A 571 -19.216 -3.748 -7.591 1.00 0.00 C ATOM 977 O SER A 571 -20.424 -3.966 -7.670 1.00 0.00 O ATOM 978 CB SER A 571 -18.376 -1.657 -8.707 1.00 0.00 C ATOM 979 OG SER A 571 -19.555 -1.419 -9.460 1.00 0.00 O ATOM 0 H SER A 571 -16.629 -2.160 -7.036 1.00 0.00 H new ATOM 0 HA SER A 571 -19.463 -1.760 -6.853 1.00 0.00 H new ATOM 0 HB2 SER A 571 -17.860 -0.713 -8.530 1.00 0.00 H new ATOM 0 HB3 SER A 571 -17.698 -2.288 -9.282 1.00 0.00 H new ATOM 0 HG SER A 571 -19.320 -0.988 -10.308 1.00 0.00 H new ATOM 985 N ARG A 572 -18.303 -4.707 -7.682 1.00 0.00 N ATOM 986 CA ARG A 572 -18.663 -6.091 -7.978 1.00 0.00 C ATOM 987 C ARG A 572 -19.084 -6.842 -6.718 1.00 0.00 C ATOM 988 O ARG A 572 -20.019 -7.641 -6.742 1.00 0.00 O ATOM 989 CB ARG A 572 -17.485 -6.802 -8.645 1.00 0.00 C ATOM 990 CG ARG A 572 -17.070 -6.158 -9.956 1.00 0.00 C ATOM 991 CD ARG A 572 -15.802 -6.775 -10.523 1.00 0.00 C ATOM 992 NE ARG A 572 -15.965 -8.200 -10.811 1.00 0.00 N ATOM 993 CZ ARG A 572 -15.405 -8.825 -11.845 1.00 0.00 C ATOM 994 NH1 ARG A 572 -14.664 -8.154 -12.719 1.00 0.00 N ATOM 995 NH2 ARG A 572 -15.589 -10.127 -12.007 1.00 0.00 N ATOM 0 H ARG A 572 -17.303 -4.552 -7.555 1.00 0.00 H new ATOM 0 HA ARG A 572 -19.514 -6.080 -8.658 1.00 0.00 H new ATOM 0 HB2 ARG A 572 -16.635 -6.804 -7.962 1.00 0.00 H new ATOM 0 HB3 ARG A 572 -17.751 -7.843 -8.826 1.00 0.00 H new ATOM 0 HG2 ARG A 572 -17.878 -6.261 -10.681 1.00 0.00 H new ATOM 0 HG3 ARG A 572 -16.915 -5.090 -9.801 1.00 0.00 H new ATOM 0 HD2 ARG A 572 -15.521 -6.251 -11.436 1.00 0.00 H new ATOM 0 HD3 ARG A 572 -14.985 -6.640 -9.814 1.00 0.00 H new ATOM 0 HE ARG A 572 -16.545 -8.751 -10.179 1.00 0.00 H new ATOM 0 HH11 ARG A 572 -14.520 -7.151 -12.601 1.00 0.00 H new ATOM 0 HH12 ARG A 572 -14.239 -8.641 -13.508 1.00 0.00 H new ATOM 0 HH21 ARG A 572 -16.159 -10.648 -11.341 1.00 0.00 H new ATOM 0 HH22 ARG A 572 -15.161 -10.608 -12.798 1.00 0.00 H new ATOM 1009 N ASN A 573 -18.392 -6.580 -5.622 1.00 0.00 N ATOM 1010 CA ASN A 573 -18.668 -7.258 -4.361 1.00 0.00 C ATOM 1011 C ASN A 573 -19.384 -6.313 -3.414 1.00 0.00 C ATOM 1012 O ASN A 573 -19.461 -5.117 -3.677 1.00 0.00 O ATOM 1013 CB ASN A 573 -17.366 -7.745 -3.721 1.00 0.00 C ATOM 1014 CG ASN A 573 -16.634 -8.756 -4.579 1.00 0.00 C ATOM 1015 OD1 ASN A 573 -16.832 -9.964 -4.442 1.00 0.00 O ATOM 1016 ND2 ASN A 573 -15.793 -8.271 -5.482 1.00 0.00 N ATOM 0 H ASN A 573 -17.632 -5.901 -5.577 1.00 0.00 H new ATOM 0 HA ASN A 573 -19.305 -8.120 -4.560 1.00 0.00 H new ATOM 0 HB2 ASN A 573 -16.714 -6.891 -3.538 1.00 0.00 H new ATOM 0 HB3 ASN A 573 -17.587 -8.190 -2.751 1.00 0.00 H new ATOM 0 HD21 ASN A 573 -15.282 -8.906 -6.095 1.00 0.00 H new ATOM 0 HD22 ASN A 573 -15.657 -7.263 -5.563 1.00 0.00 H new ATOM 1023 N VAL A 574 -19.912 -6.833 -2.319 1.00 0.00 N ATOM 1024 CA VAL A 574 -20.575 -5.980 -1.347 1.00 0.00 C ATOM 1025 C VAL A 574 -19.587 -5.547 -0.275 1.00 0.00 C ATOM 1026 O VAL A 574 -19.071 -6.374 0.485 1.00 0.00 O ATOM 1027 CB VAL A 574 -21.770 -6.694 -0.684 1.00 0.00 C ATOM 1028 CG1 VAL A 574 -22.513 -5.749 0.249 1.00 0.00 C ATOM 1029 CG2 VAL A 574 -22.708 -7.254 -1.741 1.00 0.00 C ATOM 0 H VAL A 574 -19.896 -7.825 -2.083 1.00 0.00 H new ATOM 0 HA VAL A 574 -20.953 -5.107 -1.879 1.00 0.00 H new ATOM 0 HB VAL A 574 -21.387 -7.524 -0.090 1.00 0.00 H new ATOM 0 HG11 VAL A 574 -23.352 -6.274 0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 574 -21.836 -5.400 1.028 1.00 0.00 H new ATOM 0 HG13 VAL A 574 -22.884 -4.895 -0.318 1.00 0.00 H new ATOM 0 HG21 VAL A 574 -23.546 -7.755 -1.256 1.00 0.00 H new ATOM 0 HG22 VAL A 574 -23.082 -6.441 -2.363 1.00 0.00 H new ATOM 0 HG23 VAL A 574 -22.170 -7.969 -2.363 1.00 0.00 H new ATOM 1039 N VAL A 575 -19.332 -4.249 -0.214 1.00 0.00 N ATOM 1040 CA VAL A 575 -18.395 -3.694 0.751 1.00 0.00 C ATOM 1041 C VAL A 575 -18.860 -2.310 1.185 1.00 0.00 C ATOM 1042 O VAL A 575 -18.730 -1.342 0.438 1.00 0.00 O ATOM 1043 CB VAL A 575 -16.959 -3.574 0.179 1.00 0.00 C ATOM 1044 CG1 VAL A 575 -15.994 -3.155 1.267 1.00 0.00 C ATOM 1045 CG2 VAL A 575 -16.486 -4.871 -0.457 1.00 0.00 C ATOM 0 H VAL A 575 -19.764 -3.556 -0.826 1.00 0.00 H new ATOM 0 HA VAL A 575 -18.369 -4.379 1.598 1.00 0.00 H new ATOM 0 HB VAL A 575 -16.985 -2.813 -0.601 1.00 0.00 H new ATOM 0 HG11 VAL A 575 -14.990 -3.075 0.851 1.00 0.00 H new ATOM 0 HG12 VAL A 575 -16.298 -2.189 1.671 1.00 0.00 H new ATOM 0 HG13 VAL A 575 -15.999 -3.899 2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 575 -15.475 -4.739 -0.844 1.00 0.00 H new ATOM 0 HG22 VAL A 575 -16.488 -5.665 0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 575 -17.155 -5.141 -1.274 1.00 0.00 H new ATOM 1055 N HIS A 576 -19.404 -2.217 2.386 1.00 0.00 N ATOM 1056 CA HIS A 576 -19.920 -0.948 2.891 1.00 0.00 C ATOM 1057 C HIS A 576 -19.107 -0.449 4.079 1.00 0.00 C ATOM 1058 O HIS A 576 -19.143 0.737 4.411 1.00 0.00 O ATOM 1059 CB HIS A 576 -21.405 -1.069 3.263 1.00 0.00 C ATOM 1060 CG HIS A 576 -21.772 -2.367 3.919 1.00 0.00 C ATOM 1061 ND1 HIS A 576 -22.376 -3.375 3.210 1.00 0.00 N ATOM 1062 CD2 HIS A 576 -21.605 -2.767 5.202 1.00 0.00 C ATOM 1063 CE1 HIS A 576 -22.562 -4.361 4.068 1.00 0.00 C ATOM 1064 NE2 HIS A 576 -22.112 -4.039 5.289 1.00 0.00 N ATOM 0 H HIS A 576 -19.502 -3.001 3.031 1.00 0.00 H new ATOM 0 HA HIS A 576 -19.825 -0.214 2.091 1.00 0.00 H new ATOM 0 HB2 HIS A 576 -21.668 -0.250 3.932 1.00 0.00 H new ATOM 0 HB3 HIS A 576 -22.005 -0.949 2.361 1.00 0.00 H new ATOM 0 HD2 HIS A 576 -21.159 -2.195 6.002 1.00 0.00 H new ATOM 0 HE1 HIS A 576 -23.019 -5.307 3.818 1.00 0.00 H new ATOM 0 HE2 HIS A 576 -22.141 -4.626 6.122 1.00 0.00 H new ATOM 1072 N SER A 577 -18.368 -1.350 4.709 1.00 0.00 N ATOM 1073 CA SER A 577 -17.513 -0.978 5.826 1.00 0.00 C ATOM 1074 C SER A 577 -16.344 -0.127 5.335 1.00 0.00 C ATOM 1075 O SER A 577 -15.970 0.864 5.962 1.00 0.00 O ATOM 1076 CB SER A 577 -17.009 -2.237 6.526 1.00 0.00 C ATOM 1077 OG SER A 577 -18.095 -3.071 6.902 1.00 0.00 O ATOM 0 H SER A 577 -18.343 -2.341 4.467 1.00 0.00 H new ATOM 0 HA SER A 577 -18.087 -0.386 6.539 1.00 0.00 H new ATOM 0 HB2 SER A 577 -16.337 -2.783 5.864 1.00 0.00 H new ATOM 0 HB3 SER A 577 -16.432 -1.962 7.409 1.00 0.00 H new ATOM 0 HG SER A 577 -17.752 -3.874 7.348 1.00 0.00 H new ATOM 1083 N VAL A 578 -15.777 -0.522 4.206 1.00 0.00 N ATOM 1084 CA VAL A 578 -14.729 0.262 3.574 1.00 0.00 C ATOM 1085 C VAL A 578 -15.109 0.663 2.152 1.00 0.00 C ATOM 1086 O VAL A 578 -15.641 -0.136 1.386 1.00 0.00 O ATOM 1087 CB VAL A 578 -13.366 -0.473 3.590 1.00 0.00 C ATOM 1088 CG1 VAL A 578 -12.799 -0.499 4.998 1.00 0.00 C ATOM 1089 CG2 VAL A 578 -13.488 -1.892 3.063 1.00 0.00 C ATOM 0 H VAL A 578 -16.024 -1.378 3.710 1.00 0.00 H new ATOM 0 HA VAL A 578 -14.620 1.172 4.164 1.00 0.00 H new ATOM 0 HB VAL A 578 -12.690 0.076 2.934 1.00 0.00 H new ATOM 0 HG11 VAL A 578 -11.841 -1.019 4.995 1.00 0.00 H new ATOM 0 HG12 VAL A 578 -12.657 0.522 5.352 1.00 0.00 H new ATOM 0 HG13 VAL A 578 -13.492 -1.019 5.660 1.00 0.00 H new ATOM 0 HG21 VAL A 578 -12.511 -2.375 3.090 1.00 0.00 H new ATOM 0 HG22 VAL A 578 -14.187 -2.452 3.684 1.00 0.00 H new ATOM 0 HG23 VAL A 578 -13.853 -1.869 2.036 1.00 0.00 H new ATOM 1099 N ARG A 579 -14.871 1.924 1.825 1.00 0.00 N ATOM 1100 CA ARG A 579 -15.143 2.450 0.497 1.00 0.00 C ATOM 1101 C ARG A 579 -13.814 2.807 -0.146 1.00 0.00 C ATOM 1102 O ARG A 579 -12.780 2.704 0.509 1.00 0.00 O ATOM 1103 CB ARG A 579 -16.038 3.690 0.574 1.00 0.00 C ATOM 1104 CG ARG A 579 -17.218 3.539 1.522 1.00 0.00 C ATOM 1105 CD ARG A 579 -18.209 2.493 1.032 1.00 0.00 C ATOM 1106 NE ARG A 579 -18.941 2.947 -0.154 1.00 0.00 N ATOM 1107 CZ ARG A 579 -19.414 2.143 -1.109 1.00 0.00 C ATOM 1108 NH1 ARG A 579 -19.226 0.833 -1.042 1.00 0.00 N ATOM 1109 NH2 ARG A 579 -20.086 2.653 -2.134 1.00 0.00 N ATOM 0 H ARG A 579 -14.484 2.611 2.473 1.00 0.00 H new ATOM 0 HA ARG A 579 -15.667 1.700 -0.096 1.00 0.00 H new ATOM 0 HB2 ARG A 579 -15.436 4.542 0.891 1.00 0.00 H new ATOM 0 HB3 ARG A 579 -16.413 3.918 -0.424 1.00 0.00 H new ATOM 0 HG2 ARG A 579 -16.855 3.260 2.511 1.00 0.00 H new ATOM 0 HG3 ARG A 579 -17.725 4.498 1.627 1.00 0.00 H new ATOM 0 HD2 ARG A 579 -17.678 1.570 0.799 1.00 0.00 H new ATOM 0 HD3 ARG A 579 -18.916 2.262 1.829 1.00 0.00 H new ATOM 0 HE ARG A 579 -19.100 3.949 -0.257 1.00 0.00 H new ATOM 0 HH11 ARG A 579 -18.716 0.431 -0.256 1.00 0.00 H new ATOM 0 HH12 ARG A 579 -19.591 0.227 -1.777 1.00 0.00 H new ATOM 0 HH21 ARG A 579 -20.241 3.659 -2.192 1.00 0.00 H new ATOM 0 HH22 ARG A 579 -20.447 2.038 -2.863 1.00 0.00 H new ATOM 1123 N ARG A 580 -13.826 3.226 -1.408 1.00 0.00 N ATOM 1124 CA ARG A 580 -12.592 3.534 -2.130 1.00 0.00 C ATOM 1125 C ARG A 580 -11.712 4.529 -1.372 1.00 0.00 C ATOM 1126 O ARG A 580 -10.489 4.476 -1.487 1.00 0.00 O ATOM 1127 CB ARG A 580 -12.869 4.059 -3.541 1.00 0.00 C ATOM 1128 CG ARG A 580 -13.731 5.303 -3.600 1.00 0.00 C ATOM 1129 CD ARG A 580 -15.194 4.947 -3.780 1.00 0.00 C ATOM 1130 NE ARG A 580 -16.028 6.113 -4.064 1.00 0.00 N ATOM 1131 CZ ARG A 580 -17.360 6.066 -4.150 1.00 0.00 C ATOM 1132 NH1 ARG A 580 -18.000 4.919 -3.962 1.00 0.00 N ATOM 1133 NH2 ARG A 580 -18.052 7.162 -4.427 1.00 0.00 N ATOM 0 H ARG A 580 -14.677 3.361 -1.954 1.00 0.00 H new ATOM 0 HA ARG A 580 -12.051 2.591 -2.211 1.00 0.00 H new ATOM 0 HB2 ARG A 580 -11.917 4.271 -4.028 1.00 0.00 H new ATOM 0 HB3 ARG A 580 -13.353 3.271 -4.118 1.00 0.00 H new ATOM 0 HG2 ARG A 580 -13.604 5.880 -2.684 1.00 0.00 H new ATOM 0 HG3 ARG A 580 -13.404 5.937 -4.424 1.00 0.00 H new ATOM 0 HD2 ARG A 580 -15.291 4.229 -4.594 1.00 0.00 H new ATOM 0 HD3 ARG A 580 -15.558 4.456 -2.877 1.00 0.00 H new ATOM 0 HE ARG A 580 -15.567 7.012 -4.204 1.00 0.00 H new ATOM 0 HH11 ARG A 580 -17.475 4.070 -3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 580 -19.017 4.886 -4.028 1.00 0.00 H new ATOM 0 HH21 ARG A 580 -17.567 8.047 -4.576 1.00 0.00 H new ATOM 0 HH22 ARG A 580 -19.069 7.120 -4.491 1.00 0.00 H new ATOM 1147 N GLU A 581 -12.322 5.445 -0.614 1.00 0.00 N ATOM 1148 CA GLU A 581 -11.578 6.418 0.183 1.00 0.00 C ATOM 1149 C GLU A 581 -10.698 5.770 1.256 1.00 0.00 C ATOM 1150 O GLU A 581 -9.664 6.321 1.627 1.00 0.00 O ATOM 1151 CB GLU A 581 -12.551 7.403 0.835 1.00 0.00 C ATOM 1152 CG GLU A 581 -13.527 6.748 1.800 1.00 0.00 C ATOM 1153 CD GLU A 581 -14.651 7.673 2.210 1.00 0.00 C ATOM 1154 OE1 GLU A 581 -15.676 7.719 1.499 1.00 0.00 O ATOM 1155 OE2 GLU A 581 -14.516 8.361 3.242 1.00 0.00 O ATOM 0 H GLU A 581 -13.335 5.531 -0.537 1.00 0.00 H new ATOM 0 HA GLU A 581 -10.908 6.941 -0.500 1.00 0.00 H new ATOM 0 HB2 GLU A 581 -11.981 8.164 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 581 -13.114 7.915 0.054 1.00 0.00 H new ATOM 0 HG2 GLU A 581 -13.947 5.856 1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 581 -12.988 6.421 2.689 1.00 0.00 H new ATOM 1162 N HIS A 582 -11.112 4.608 1.746 1.00 0.00 N ATOM 1163 CA HIS A 582 -10.383 3.905 2.802 1.00 0.00 C ATOM 1164 C HIS A 582 -9.114 3.270 2.251 1.00 0.00 C ATOM 1165 O HIS A 582 -8.247 2.817 2.995 1.00 0.00 O ATOM 1166 CB HIS A 582 -11.272 2.847 3.460 1.00 0.00 C ATOM 1167 CG HIS A 582 -12.379 3.426 4.288 1.00 0.00 C ATOM 1168 ND1 HIS A 582 -13.695 3.300 3.920 1.00 0.00 N ATOM 1169 CD2 HIS A 582 -12.313 4.109 5.455 1.00 0.00 C ATOM 1170 CE1 HIS A 582 -14.396 3.900 4.864 1.00 0.00 C ATOM 1171 NE2 HIS A 582 -13.602 4.409 5.817 1.00 0.00 N ATOM 0 H HIS A 582 -11.954 4.128 1.428 1.00 0.00 H new ATOM 0 HA HIS A 582 -10.098 4.634 3.561 1.00 0.00 H new ATOM 0 HB2 HIS A 582 -11.702 2.213 2.685 1.00 0.00 H new ATOM 0 HB3 HIS A 582 -10.655 2.206 4.090 1.00 0.00 H new ATOM 0 HD2 HIS A 582 -11.416 4.368 5.998 1.00 0.00 H new ATOM 0 HE1 HIS A 582 -15.474 3.972 4.868 1.00 0.00 H new ATOM 0 HE2 HIS A 582 -13.898 4.920 6.649 1.00 0.00 H new ATOM 1179 N PHE A 583 -9.020 3.246 0.937 1.00 0.00 N ATOM 1180 CA PHE A 583 -7.877 2.666 0.263 1.00 0.00 C ATOM 1181 C PHE A 583 -7.011 3.778 -0.300 1.00 0.00 C ATOM 1182 O PHE A 583 -7.500 4.650 -1.018 1.00 0.00 O ATOM 1183 CB PHE A 583 -8.325 1.721 -0.854 1.00 0.00 C ATOM 1184 CG PHE A 583 -9.287 0.663 -0.392 1.00 0.00 C ATOM 1185 CD1 PHE A 583 -8.845 -0.430 0.327 1.00 0.00 C ATOM 1186 CD2 PHE A 583 -10.632 0.767 -0.679 1.00 0.00 C ATOM 1187 CE1 PHE A 583 -9.729 -1.399 0.752 1.00 0.00 C ATOM 1188 CE2 PHE A 583 -11.525 -0.199 -0.259 1.00 0.00 C ATOM 1189 CZ PHE A 583 -11.072 -1.284 0.459 1.00 0.00 C ATOM 0 H PHE A 583 -9.729 3.626 0.310 1.00 0.00 H new ATOM 0 HA PHE A 583 -7.299 2.084 0.981 1.00 0.00 H new ATOM 0 HB2 PHE A 583 -8.792 2.304 -1.648 1.00 0.00 H new ATOM 0 HB3 PHE A 583 -7.448 1.240 -1.286 1.00 0.00 H new ATOM 0 HD1 PHE A 583 -7.795 -0.527 0.559 1.00 0.00 H new ATOM 0 HD2 PHE A 583 -10.992 1.616 -1.240 1.00 0.00 H new ATOM 0 HE1 PHE A 583 -9.370 -2.248 1.314 1.00 0.00 H new ATOM 0 HE2 PHE A 583 -12.575 -0.104 -0.493 1.00 0.00 H new ATOM 0 HZ PHE A 583 -11.766 -2.042 0.791 1.00 0.00 H new ATOM 1199 N SER A 584 -5.733 3.757 0.022 1.00 0.00 N ATOM 1200 CA SER A 584 -4.822 4.790 -0.424 1.00 0.00 C ATOM 1201 C SER A 584 -3.549 4.138 -0.929 1.00 0.00 C ATOM 1202 O SER A 584 -2.995 3.255 -0.272 1.00 0.00 O ATOM 1203 CB SER A 584 -4.508 5.762 0.718 1.00 0.00 C ATOM 1204 OG SER A 584 -3.611 6.779 0.299 1.00 0.00 O ATOM 0 H SER A 584 -5.301 3.031 0.594 1.00 0.00 H new ATOM 0 HA SER A 584 -5.286 5.359 -1.230 1.00 0.00 H new ATOM 0 HB2 SER A 584 -5.432 6.215 1.077 1.00 0.00 H new ATOM 0 HB3 SER A 584 -4.075 5.215 1.555 1.00 0.00 H new ATOM 0 HG SER A 584 -3.431 7.385 1.048 1.00 0.00 H new ATOM 1210 N PHE A 585 -3.085 4.562 -2.090 1.00 0.00 N ATOM 1211 CA PHE A 585 -1.915 3.956 -2.700 1.00 0.00 C ATOM 1212 C PHE A 585 -0.691 4.849 -2.573 1.00 0.00 C ATOM 1213 O PHE A 585 0.410 4.469 -2.975 1.00 0.00 O ATOM 1214 CB PHE A 585 -2.188 3.622 -4.163 1.00 0.00 C ATOM 1215 CG PHE A 585 -3.055 2.411 -4.334 1.00 0.00 C ATOM 1216 CD1 PHE A 585 -2.553 1.162 -4.038 1.00 0.00 C ATOM 1217 CD2 PHE A 585 -4.359 2.514 -4.787 1.00 0.00 C ATOM 1218 CE1 PHE A 585 -3.322 0.033 -4.188 1.00 0.00 C ATOM 1219 CE2 PHE A 585 -5.140 1.382 -4.940 1.00 0.00 C ATOM 1220 CZ PHE A 585 -4.615 0.139 -4.640 1.00 0.00 C ATOM 0 H PHE A 585 -3.499 5.322 -2.629 1.00 0.00 H new ATOM 0 HA PHE A 585 -1.703 3.031 -2.164 1.00 0.00 H new ATOM 0 HB2 PHE A 585 -2.667 4.476 -4.642 1.00 0.00 H new ATOM 0 HB3 PHE A 585 -1.240 3.459 -4.676 1.00 0.00 H new ATOM 0 HD1 PHE A 585 -1.538 1.069 -3.682 1.00 0.00 H new ATOM 0 HD2 PHE A 585 -4.770 3.485 -5.023 1.00 0.00 H new ATOM 0 HE1 PHE A 585 -2.910 -0.937 -3.951 1.00 0.00 H new ATOM 0 HE2 PHE A 585 -6.157 1.469 -5.293 1.00 0.00 H new ATOM 0 HZ PHE A 585 -5.220 -0.747 -4.761 1.00 0.00 H new ATOM 1230 N SER A 586 -0.888 6.040 -2.036 1.00 0.00 N ATOM 1231 CA SER A 586 0.221 6.933 -1.739 1.00 0.00 C ATOM 1232 C SER A 586 1.165 6.303 -0.713 1.00 0.00 C ATOM 1233 O SER A 586 0.768 6.036 0.427 1.00 0.00 O ATOM 1234 CB SER A 586 -0.317 8.259 -1.207 1.00 0.00 C ATOM 1235 OG SER A 586 -1.190 8.870 -2.144 1.00 0.00 O ATOM 0 H SER A 586 -1.807 6.413 -1.796 1.00 0.00 H new ATOM 0 HA SER A 586 0.782 7.110 -2.657 1.00 0.00 H new ATOM 0 HB2 SER A 586 -0.846 8.090 -0.269 1.00 0.00 H new ATOM 0 HB3 SER A 586 0.513 8.930 -0.988 1.00 0.00 H new ATOM 0 HG SER A 586 -1.522 9.716 -1.778 1.00 0.00 H new ATOM 1241 N PRO A 587 2.433 6.053 -1.097 1.00 0.00 N ATOM 1242 CA PRO A 587 3.430 5.463 -0.198 1.00 0.00 C ATOM 1243 C PRO A 587 3.949 6.461 0.833 1.00 0.00 C ATOM 1244 O PRO A 587 4.920 6.192 1.533 1.00 0.00 O ATOM 1245 CB PRO A 587 4.550 5.043 -1.143 1.00 0.00 C ATOM 1246 CG PRO A 587 4.469 6.022 -2.258 1.00 0.00 C ATOM 1247 CD PRO A 587 3.000 6.306 -2.440 1.00 0.00 C ATOM 0 HA PRO A 587 3.015 4.643 0.388 1.00 0.00 H new ATOM 0 HB2 PRO A 587 5.522 5.079 -0.651 1.00 0.00 H new ATOM 0 HB3 PRO A 587 4.410 4.022 -1.498 1.00 0.00 H new ATOM 0 HG2 PRO A 587 5.018 6.933 -2.021 1.00 0.00 H new ATOM 0 HG3 PRO A 587 4.906 5.615 -3.170 1.00 0.00 H new ATOM 0 HD2 PRO A 587 2.826 7.333 -2.763 1.00 0.00 H new ATOM 0 HD3 PRO A 587 2.555 5.655 -3.193 1.00 0.00 H new ATOM 1255 N ARG A 588 3.289 7.610 0.934 1.00 0.00 N ATOM 1256 CA ARG A 588 3.610 8.600 1.945 1.00 0.00 C ATOM 1257 C ARG A 588 2.687 8.405 3.139 1.00 0.00 C ATOM 1258 O ARG A 588 2.758 9.131 4.132 1.00 0.00 O ATOM 1259 CB ARG A 588 3.457 10.016 1.378 1.00 0.00 C ATOM 1260 CG ARG A 588 4.351 10.290 0.177 1.00 0.00 C ATOM 1261 CD ARG A 588 4.254 11.736 -0.285 1.00 0.00 C ATOM 1262 NE ARG A 588 2.927 12.074 -0.803 1.00 0.00 N ATOM 1263 CZ ARG A 588 2.568 13.298 -1.201 1.00 0.00 C ATOM 1264 NH1 ARG A 588 3.426 14.310 -1.136 1.00 0.00 N ATOM 1265 NH2 ARG A 588 1.343 13.506 -1.662 1.00 0.00 N ATOM 0 H ARG A 588 2.521 7.876 0.318 1.00 0.00 H new ATOM 0 HA ARG A 588 4.646 8.474 2.260 1.00 0.00 H new ATOM 0 HB2 ARG A 588 2.417 10.173 1.090 1.00 0.00 H new ATOM 0 HB3 ARG A 588 3.683 10.739 2.162 1.00 0.00 H new ATOM 0 HG2 ARG A 588 5.385 10.060 0.434 1.00 0.00 H new ATOM 0 HG3 ARG A 588 4.071 9.628 -0.642 1.00 0.00 H new ATOM 0 HD2 ARG A 588 4.494 12.397 0.548 1.00 0.00 H new ATOM 0 HD3 ARG A 588 4.999 11.917 -1.060 1.00 0.00 H new ATOM 0 HE ARG A 588 2.233 11.329 -0.864 1.00 0.00 H new ATOM 0 HH11 ARG A 588 4.369 14.157 -0.780 1.00 0.00 H new ATOM 0 HH12 ARG A 588 3.141 15.240 -1.443 1.00 0.00 H new ATOM 0 HH21 ARG A 588 0.679 12.733 -1.712 1.00 0.00 H new ATOM 0 HH22 ARG A 588 1.064 14.439 -1.967 1.00 0.00 H new ATOM 1279 N MET A 589 1.811 7.417 3.011 1.00 0.00 N ATOM 1280 CA MET A 589 0.885 7.057 4.071 1.00 0.00 C ATOM 1281 C MET A 589 1.429 5.879 4.872 1.00 0.00 C ATOM 1282 O MET A 589 1.391 4.737 4.409 1.00 0.00 O ATOM 1283 CB MET A 589 -0.481 6.694 3.482 1.00 0.00 C ATOM 1284 CG MET A 589 -1.548 6.474 4.527 1.00 0.00 C ATOM 1285 SD MET A 589 -1.857 7.933 5.536 1.00 0.00 S ATOM 1286 CE MET A 589 -2.597 9.034 4.332 1.00 0.00 C ATOM 0 H MET A 589 1.724 6.845 2.171 1.00 0.00 H new ATOM 0 HA MET A 589 0.770 7.915 4.734 1.00 0.00 H new ATOM 0 HB2 MET A 589 -0.801 7.490 2.809 1.00 0.00 H new ATOM 0 HB3 MET A 589 -0.380 5.790 2.881 1.00 0.00 H new ATOM 0 HG2 MET A 589 -2.474 6.176 4.035 1.00 0.00 H new ATOM 0 HG3 MET A 589 -1.251 5.648 5.174 1.00 0.00 H new ATOM 0 HE1 MET A 589 -3.066 9.873 4.846 1.00 0.00 H new ATOM 0 HE2 MET A 589 -1.826 9.407 3.658 1.00 0.00 H new ATOM 0 HE3 MET A 589 -3.350 8.493 3.759 1.00 0.00 H new ATOM 1296 N PRO A 590 1.945 6.140 6.080 1.00 0.00 N ATOM 1297 CA PRO A 590 2.545 5.110 6.927 1.00 0.00 C ATOM 1298 C PRO A 590 1.505 4.322 7.715 1.00 0.00 C ATOM 1299 O PRO A 590 1.378 4.479 8.928 1.00 0.00 O ATOM 1300 CB PRO A 590 3.428 5.926 7.867 1.00 0.00 C ATOM 1301 CG PRO A 590 2.716 7.227 8.018 1.00 0.00 C ATOM 1302 CD PRO A 590 1.983 7.469 6.722 1.00 0.00 C ATOM 0 HA PRO A 590 3.081 4.357 6.350 1.00 0.00 H new ATOM 0 HB2 PRO A 590 3.550 5.427 8.828 1.00 0.00 H new ATOM 0 HB3 PRO A 590 4.426 6.066 7.451 1.00 0.00 H new ATOM 0 HG2 PRO A 590 2.020 7.193 8.856 1.00 0.00 H new ATOM 0 HG3 PRO A 590 3.421 8.033 8.221 1.00 0.00 H new ATOM 0 HD2 PRO A 590 0.979 7.856 6.897 1.00 0.00 H new ATOM 0 HD3 PRO A 590 2.502 8.198 6.100 1.00 0.00 H new ATOM 1310 N VAL A 591 0.748 3.485 7.023 1.00 0.00 N ATOM 1311 CA VAL A 591 -0.338 2.768 7.671 1.00 0.00 C ATOM 1312 C VAL A 591 -0.057 1.282 7.888 1.00 0.00 C ATOM 1313 O VAL A 591 0.179 0.879 9.028 1.00 0.00 O ATOM 1314 CB VAL A 591 -1.666 2.989 6.930 1.00 0.00 C ATOM 1315 CG1 VAL A 591 -2.760 2.103 7.494 1.00 0.00 C ATOM 1316 CG2 VAL A 591 -2.057 4.443 7.064 1.00 0.00 C ATOM 0 H VAL A 591 0.862 3.288 6.029 1.00 0.00 H new ATOM 0 HA VAL A 591 -0.423 3.195 8.670 1.00 0.00 H new ATOM 0 HB VAL A 591 -1.537 2.728 5.880 1.00 0.00 H new ATOM 0 HG11 VAL A 591 -3.688 2.281 6.951 1.00 0.00 H new ATOM 0 HG12 VAL A 591 -2.472 1.057 7.388 1.00 0.00 H new ATOM 0 HG13 VAL A 591 -2.907 2.334 8.549 1.00 0.00 H new ATOM 0 HG21 VAL A 591 -2.999 4.616 6.543 1.00 0.00 H new ATOM 0 HG22 VAL A 591 -2.175 4.692 8.119 1.00 0.00 H new ATOM 0 HG23 VAL A 591 -1.280 5.070 6.627 1.00 0.00 H new ATOM 1326 N GLY A 592 -0.062 0.451 6.841 1.00 0.00 N ATOM 1327 CA GLY A 592 -0.004 -0.981 7.059 1.00 0.00 C ATOM 1328 C GLY A 592 1.402 -1.491 7.227 1.00 0.00 C ATOM 1329 O GLY A 592 2.004 -1.351 8.294 1.00 0.00 O ATOM 0 H GLY A 592 -0.105 0.742 5.864 1.00 0.00 H new ATOM 0 HA2 GLY A 592 -0.585 -1.232 7.947 1.00 0.00 H new ATOM 0 HA3 GLY A 592 -0.472 -1.491 6.217 1.00 0.00 H new ATOM 1333 N ASP A 593 1.933 -2.080 6.176 1.00 0.00 N ATOM 1334 CA ASP A 593 3.250 -2.659 6.229 1.00 0.00 C ATOM 1335 C ASP A 593 4.156 -1.991 5.212 1.00 0.00 C ATOM 1336 O ASP A 593 3.743 -1.686 4.103 1.00 0.00 O ATOM 1337 CB ASP A 593 3.183 -4.170 5.981 1.00 0.00 C ATOM 1338 CG ASP A 593 2.349 -4.901 7.018 1.00 0.00 C ATOM 1339 OD1 ASP A 593 1.122 -5.036 6.820 1.00 0.00 O ATOM 1340 OD2 ASP A 593 2.910 -5.347 8.042 1.00 0.00 O ATOM 0 H ASP A 593 1.467 -2.168 5.273 1.00 0.00 H new ATOM 0 HA ASP A 593 3.664 -2.495 7.224 1.00 0.00 H new ATOM 0 HB2 ASP A 593 2.765 -4.353 4.991 1.00 0.00 H new ATOM 0 HB3 ASP A 593 4.194 -4.579 5.981 1.00 0.00 H new ATOM 1345 N PHE A 594 5.376 -1.747 5.624 1.00 0.00 N ATOM 1346 CA PHE A 594 6.376 -1.127 4.757 1.00 0.00 C ATOM 1347 C PHE A 594 7.592 -2.016 4.599 1.00 0.00 C ATOM 1348 O PHE A 594 8.115 -2.543 5.579 1.00 0.00 O ATOM 1349 CB PHE A 594 6.800 0.237 5.298 1.00 0.00 C ATOM 1350 CG PHE A 594 5.901 1.364 4.880 1.00 0.00 C ATOM 1351 CD1 PHE A 594 4.603 1.456 5.356 1.00 0.00 C ATOM 1352 CD2 PHE A 594 6.362 2.336 4.006 1.00 0.00 C ATOM 1353 CE1 PHE A 594 3.783 2.497 4.969 1.00 0.00 C ATOM 1354 CE2 PHE A 594 5.546 3.380 3.617 1.00 0.00 C ATOM 1355 CZ PHE A 594 4.255 3.461 4.099 1.00 0.00 C ATOM 0 H PHE A 594 5.713 -1.967 6.561 1.00 0.00 H new ATOM 0 HA PHE A 594 5.916 -0.990 3.778 1.00 0.00 H new ATOM 0 HB2 PHE A 594 6.828 0.192 6.387 1.00 0.00 H new ATOM 0 HB3 PHE A 594 7.815 0.451 4.962 1.00 0.00 H new ATOM 0 HD1 PHE A 594 4.229 0.706 6.037 1.00 0.00 H new ATOM 0 HD2 PHE A 594 7.371 2.276 3.625 1.00 0.00 H new ATOM 0 HE1 PHE A 594 2.773 2.558 5.346 1.00 0.00 H new ATOM 0 HE2 PHE A 594 5.917 4.132 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 594 3.615 4.277 3.797 1.00 0.00 H new ATOM 1365 N PHE A 595 8.028 -2.197 3.361 1.00 0.00 N ATOM 1366 CA PHE A 595 9.199 -3.006 3.077 1.00 0.00 C ATOM 1367 C PHE A 595 10.152 -2.258 2.156 1.00 0.00 C ATOM 1368 O PHE A 595 9.737 -1.403 1.372 1.00 0.00 O ATOM 1369 CB PHE A 595 8.787 -4.327 2.417 1.00 0.00 C ATOM 1370 CG PHE A 595 7.602 -4.976 3.066 1.00 0.00 C ATOM 1371 CD1 PHE A 595 6.322 -4.675 2.637 1.00 0.00 C ATOM 1372 CD2 PHE A 595 7.762 -5.870 4.112 1.00 0.00 C ATOM 1373 CE1 PHE A 595 5.225 -5.252 3.234 1.00 0.00 C ATOM 1374 CE2 PHE A 595 6.662 -6.450 4.716 1.00 0.00 C ATOM 1375 CZ PHE A 595 5.392 -6.137 4.273 1.00 0.00 C ATOM 0 H PHE A 595 7.585 -1.792 2.536 1.00 0.00 H new ATOM 0 HA PHE A 595 9.703 -3.216 4.020 1.00 0.00 H new ATOM 0 HB2 PHE A 595 8.561 -4.144 1.367 1.00 0.00 H new ATOM 0 HB3 PHE A 595 9.630 -5.017 2.446 1.00 0.00 H new ATOM 0 HD1 PHE A 595 6.182 -3.979 1.824 1.00 0.00 H new ATOM 0 HD2 PHE A 595 8.755 -6.116 4.459 1.00 0.00 H new ATOM 0 HE1 PHE A 595 4.232 -5.010 2.886 1.00 0.00 H new ATOM 0 HE2 PHE A 595 6.795 -7.145 5.531 1.00 0.00 H new ATOM 0 HZ PHE A 595 4.530 -6.587 4.743 1.00 0.00 H new ATOM 1385 N GLU A 596 11.418 -2.604 2.249 1.00 0.00 N ATOM 1386 CA GLU A 596 12.438 -2.013 1.404 1.00 0.00 C ATOM 1387 C GLU A 596 13.289 -3.121 0.809 1.00 0.00 C ATOM 1388 O GLU A 596 13.792 -3.975 1.546 1.00 0.00 O ATOM 1389 CB GLU A 596 13.320 -1.072 2.226 1.00 0.00 C ATOM 1390 CG GLU A 596 14.376 -0.352 1.398 1.00 0.00 C ATOM 1391 CD GLU A 596 15.540 0.146 2.228 1.00 0.00 C ATOM 1392 OE1 GLU A 596 15.418 1.213 2.857 1.00 0.00 O ATOM 1393 OE2 GLU A 596 16.589 -0.533 2.250 1.00 0.00 O ATOM 0 H GLU A 596 11.770 -3.299 2.908 1.00 0.00 H new ATOM 0 HA GLU A 596 11.963 -1.442 0.607 1.00 0.00 H new ATOM 0 HB2 GLU A 596 12.689 -0.332 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 596 13.813 -1.643 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 596 14.749 -1.027 0.628 1.00 0.00 H new ATOM 0 HG3 GLU A 596 13.915 0.492 0.886 1.00 0.00 H new ATOM 1400 N GLU A 597 13.447 -3.137 -0.507 1.00 0.00 N ATOM 1401 CA GLU A 597 14.215 -4.175 -1.168 1.00 0.00 C ATOM 1402 C GLU A 597 15.701 -3.937 -0.933 1.00 0.00 C ATOM 1403 O GLU A 597 16.226 -2.856 -1.211 1.00 0.00 O ATOM 1404 CB GLU A 597 13.911 -4.191 -2.671 1.00 0.00 C ATOM 1405 CG GLU A 597 14.751 -5.187 -3.455 1.00 0.00 C ATOM 1406 CD GLU A 597 14.380 -5.245 -4.923 1.00 0.00 C ATOM 1407 OE1 GLU A 597 13.357 -5.870 -5.258 1.00 0.00 O ATOM 1408 OE2 GLU A 597 15.119 -4.670 -5.751 1.00 0.00 O ATOM 0 H GLU A 597 13.051 -2.439 -1.137 1.00 0.00 H new ATOM 0 HA GLU A 597 13.936 -5.143 -0.752 1.00 0.00 H new ATOM 0 HB2 GLU A 597 12.856 -4.425 -2.817 1.00 0.00 H new ATOM 0 HB3 GLU A 597 14.075 -3.193 -3.076 1.00 0.00 H new ATOM 0 HG2 GLU A 597 15.804 -4.920 -3.362 1.00 0.00 H new ATOM 0 HG3 GLU A 597 14.634 -6.178 -3.016 1.00 0.00 H new ATOM 1415 N ARG A 598 16.359 -4.944 -0.393 1.00 0.00 N ATOM 1416 CA ARG A 598 17.759 -4.844 -0.025 1.00 0.00 C ATOM 1417 C ARG A 598 18.525 -6.069 -0.514 1.00 0.00 C ATOM 1418 O ARG A 598 17.930 -7.126 -0.747 1.00 0.00 O ATOM 1419 CB ARG A 598 17.865 -4.696 1.501 1.00 0.00 C ATOM 1420 CG ARG A 598 19.261 -4.900 2.068 1.00 0.00 C ATOM 1421 CD ARG A 598 19.305 -4.648 3.564 1.00 0.00 C ATOM 1422 NE ARG A 598 20.585 -5.051 4.146 1.00 0.00 N ATOM 1423 CZ ARG A 598 20.829 -5.093 5.455 1.00 0.00 C ATOM 1424 NH1 ARG A 598 19.910 -4.681 6.319 1.00 0.00 N ATOM 1425 NH2 ARG A 598 22.001 -5.534 5.898 1.00 0.00 N ATOM 0 H ARG A 598 15.940 -5.853 -0.197 1.00 0.00 H new ATOM 0 HA ARG A 598 18.203 -3.968 -0.498 1.00 0.00 H new ATOM 0 HB2 ARG A 598 17.517 -3.701 1.780 1.00 0.00 H new ATOM 0 HB3 ARG A 598 17.190 -5.413 1.969 1.00 0.00 H new ATOM 0 HG2 ARG A 598 19.592 -5.918 1.861 1.00 0.00 H new ATOM 0 HG3 ARG A 598 19.959 -4.230 1.566 1.00 0.00 H new ATOM 0 HD2 ARG A 598 19.134 -3.589 3.759 1.00 0.00 H new ATOM 0 HD3 ARG A 598 18.497 -5.196 4.049 1.00 0.00 H new ATOM 0 HE ARG A 598 21.337 -5.316 3.510 1.00 0.00 H new ATOM 0 HH11 ARG A 598 19.013 -4.331 5.982 1.00 0.00 H new ATOM 0 HH12 ARG A 598 20.100 -4.715 7.321 1.00 0.00 H new ATOM 0 HH21 ARG A 598 22.714 -5.840 5.236 1.00 0.00 H new ATOM 0 HH22 ARG A 598 22.188 -5.566 6.900 1.00 0.00 H new ATOM 1439 N ASP A 599 19.839 -5.934 -0.663 1.00 0.00 N ATOM 1440 CA ASP A 599 20.690 -7.048 -1.038 1.00 0.00 C ATOM 1441 C ASP A 599 21.380 -7.637 0.175 1.00 0.00 C ATOM 1442 O ASP A 599 21.846 -6.920 1.061 1.00 0.00 O ATOM 1443 CB ASP A 599 21.734 -6.618 -2.078 1.00 0.00 C ATOM 1444 CG ASP A 599 22.735 -5.602 -1.550 1.00 0.00 C ATOM 1445 OD1 ASP A 599 22.471 -4.385 -1.657 1.00 0.00 O ATOM 1446 OD2 ASP A 599 23.798 -6.016 -1.040 1.00 0.00 O ATOM 0 H ASP A 599 20.337 -5.054 -0.527 1.00 0.00 H new ATOM 0 HA ASP A 599 20.052 -7.813 -1.481 1.00 0.00 H new ATOM 0 HB2 ASP A 599 22.273 -7.499 -2.426 1.00 0.00 H new ATOM 0 HB3 ASP A 599 21.221 -6.196 -2.942 1.00 0.00 H new ATOM 1451 N THR A 600 21.402 -8.951 0.217 1.00 0.00 N ATOM 1452 CA THR A 600 22.047 -9.686 1.287 1.00 0.00 C ATOM 1453 C THR A 600 22.942 -10.757 0.691 1.00 0.00 C ATOM 1454 O THR A 600 22.829 -11.069 -0.496 1.00 0.00 O ATOM 1455 CB THR A 600 20.997 -10.350 2.198 1.00 0.00 C ATOM 1456 OG1 THR A 600 20.422 -11.476 1.535 1.00 0.00 O ATOM 1457 CG2 THR A 600 19.899 -9.369 2.540 1.00 0.00 C ATOM 0 H THR A 600 20.972 -9.544 -0.493 1.00 0.00 H new ATOM 0 HA THR A 600 22.639 -8.991 1.882 1.00 0.00 H new ATOM 0 HB THR A 600 21.492 -10.672 3.115 1.00 0.00 H new ATOM 0 HG1 THR A 600 19.944 -11.175 0.734 1.00 0.00 H new ATOM 0 HG21 THR A 600 19.165 -9.854 3.184 1.00 0.00 H new ATOM 0 HG22 THR A 600 20.326 -8.511 3.059 1.00 0.00 H new ATOM 0 HG23 THR A 600 19.412 -9.034 1.624 1.00 0.00 H new ATOM 1465 N PRO A 601 23.850 -11.321 1.494 1.00 0.00 N ATOM 1466 CA PRO A 601 24.715 -12.422 1.063 1.00 0.00 C ATOM 1467 C PRO A 601 23.928 -13.676 0.673 1.00 0.00 C ATOM 1468 O PRO A 601 24.484 -14.611 0.095 1.00 0.00 O ATOM 1469 CB PRO A 601 25.598 -12.688 2.286 1.00 0.00 C ATOM 1470 CG PRO A 601 24.862 -12.094 3.434 1.00 0.00 C ATOM 1471 CD PRO A 601 24.139 -10.909 2.876 1.00 0.00 C ATOM 0 HA PRO A 601 25.280 -12.164 0.167 1.00 0.00 H new ATOM 0 HB2 PRO A 601 25.758 -13.756 2.431 1.00 0.00 H new ATOM 0 HB3 PRO A 601 26.581 -12.231 2.169 1.00 0.00 H new ATOM 0 HG2 PRO A 601 24.164 -12.811 3.866 1.00 0.00 H new ATOM 0 HG3 PRO A 601 25.547 -11.797 4.228 1.00 0.00 H new ATOM 0 HD2 PRO A 601 23.227 -10.694 3.432 1.00 0.00 H new ATOM 0 HD3 PRO A 601 24.753 -10.009 2.909 1.00 0.00 H new ATOM 1479 N GLU A 602 22.633 -13.695 0.983 1.00 0.00 N ATOM 1480 CA GLU A 602 21.781 -14.804 0.578 1.00 0.00 C ATOM 1481 C GLU A 602 20.935 -14.408 -0.632 1.00 0.00 C ATOM 1482 O GLU A 602 20.373 -15.261 -1.318 1.00 0.00 O ATOM 1483 CB GLU A 602 20.895 -15.266 1.742 1.00 0.00 C ATOM 1484 CG GLU A 602 19.716 -14.360 2.038 1.00 0.00 C ATOM 1485 CD GLU A 602 18.899 -14.843 3.219 1.00 0.00 C ATOM 1486 OE1 GLU A 602 18.126 -15.813 3.061 1.00 0.00 O ATOM 1487 OE2 GLU A 602 19.022 -14.256 4.313 1.00 0.00 O ATOM 0 H GLU A 602 22.157 -12.961 1.508 1.00 0.00 H new ATOM 0 HA GLU A 602 22.417 -15.642 0.292 1.00 0.00 H new ATOM 0 HB2 GLU A 602 20.521 -16.266 1.522 1.00 0.00 H new ATOM 0 HB3 GLU A 602 21.509 -15.346 2.639 1.00 0.00 H new ATOM 0 HG2 GLU A 602 20.078 -13.351 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 602 19.077 -14.301 1.157 1.00 0.00 H new ATOM 1494 N GLY A 603 20.844 -13.107 -0.878 1.00 0.00 N ATOM 1495 CA GLY A 603 20.119 -12.641 -2.033 1.00 0.00 C ATOM 1496 C GLY A 603 19.286 -11.414 -1.770 1.00 0.00 C ATOM 1497 O GLY A 603 19.448 -10.737 -0.757 1.00 0.00 O ATOM 0 H GLY A 603 21.257 -12.375 -0.300 1.00 0.00 H new ATOM 0 HA2 GLY A 603 20.827 -12.424 -2.833 1.00 0.00 H new ATOM 0 HA3 GLY A 603 19.470 -13.440 -2.391 1.00 0.00 H new ATOM 1501 N LEU A 604 18.401 -11.128 -2.701 1.00 0.00 N ATOM 1502 CA LEU A 604 17.498 -10.001 -2.584 1.00 0.00 C ATOM 1503 C LEU A 604 16.278 -10.385 -1.779 1.00 0.00 C ATOM 1504 O LEU A 604 15.514 -11.273 -2.159 1.00 0.00 O ATOM 1505 CB LEU A 604 17.076 -9.498 -3.962 1.00 0.00 C ATOM 1506 CG LEU A 604 18.169 -8.770 -4.736 1.00 0.00 C ATOM 1507 CD1 LEU A 604 17.762 -8.584 -6.188 1.00 0.00 C ATOM 1508 CD2 LEU A 604 18.468 -7.424 -4.095 1.00 0.00 C ATOM 0 H LEU A 604 18.287 -11.668 -3.559 1.00 0.00 H new ATOM 0 HA LEU A 604 18.025 -9.198 -2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 604 16.734 -10.346 -4.554 1.00 0.00 H new ATOM 0 HB3 LEU A 604 16.225 -8.827 -3.844 1.00 0.00 H new ATOM 0 HG LEU A 604 19.073 -9.378 -4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 604 18.555 -8.063 -6.724 1.00 0.00 H new ATOM 0 HD12 LEU A 604 17.594 -9.559 -6.646 1.00 0.00 H new ATOM 0 HD13 LEU A 604 16.845 -7.997 -6.236 1.00 0.00 H new ATOM 0 HD21 LEU A 604 19.251 -6.918 -4.660 1.00 0.00 H new ATOM 0 HD22 LEU A 604 17.566 -6.812 -4.096 1.00 0.00 H new ATOM 0 HD23 LEU A 604 18.802 -7.576 -3.069 1.00 0.00 H new ATOM 1520 N GLN A 605 16.096 -9.695 -0.679 1.00 0.00 N ATOM 1521 CA GLN A 605 14.986 -9.967 0.217 1.00 0.00 C ATOM 1522 C GLN A 605 14.331 -8.652 0.596 1.00 0.00 C ATOM 1523 O GLN A 605 15.005 -7.618 0.665 1.00 0.00 O ATOM 1524 CB GLN A 605 15.458 -10.716 1.457 1.00 0.00 C ATOM 1525 CG GLN A 605 16.335 -9.885 2.375 1.00 0.00 C ATOM 1526 CD GLN A 605 17.102 -10.726 3.369 1.00 0.00 C ATOM 1527 OE1 GLN A 605 17.334 -10.312 4.506 1.00 0.00 O ATOM 1528 NE2 GLN A 605 17.564 -11.884 2.930 1.00 0.00 N ATOM 0 H GLN A 605 16.705 -8.934 -0.377 1.00 0.00 H new ATOM 0 HA GLN A 605 14.259 -10.603 -0.288 1.00 0.00 H new ATOM 0 HB2 GLN A 605 14.588 -11.061 2.015 1.00 0.00 H new ATOM 0 HB3 GLN A 605 16.010 -11.603 1.147 1.00 0.00 H new ATOM 0 HG2 GLN A 605 17.038 -9.308 1.774 1.00 0.00 H new ATOM 0 HG3 GLN A 605 15.714 -9.169 2.914 1.00 0.00 H new ATOM 0 HE21 GLN A 605 17.350 -12.192 1.982 1.00 0.00 H new ATOM 0 HE22 GLN A 605 18.135 -12.470 3.540 1.00 0.00 H new ATOM 1537 N TRP A 606 13.027 -8.665 0.801 1.00 0.00 N ATOM 1538 CA TRP A 606 12.306 -7.457 1.139 1.00 0.00 C ATOM 1539 C TRP A 606 12.299 -7.293 2.647 1.00 0.00 C ATOM 1540 O TRP A 606 11.643 -8.054 3.358 1.00 0.00 O ATOM 1541 CB TRP A 606 10.873 -7.519 0.607 1.00 0.00 C ATOM 1542 CG TRP A 606 10.770 -7.205 -0.850 1.00 0.00 C ATOM 1543 CD1 TRP A 606 10.846 -8.076 -1.897 1.00 0.00 C ATOM 1544 CD2 TRP A 606 10.577 -5.911 -1.415 1.00 0.00 C ATOM 1545 NE1 TRP A 606 10.706 -7.395 -3.083 1.00 0.00 N ATOM 1546 CE2 TRP A 606 10.541 -6.061 -2.811 1.00 0.00 C ATOM 1547 CE3 TRP A 606 10.430 -4.639 -0.868 1.00 0.00 C ATOM 1548 CZ2 TRP A 606 10.363 -4.977 -3.669 1.00 0.00 C ATOM 1549 CZ3 TRP A 606 10.256 -3.570 -1.715 1.00 0.00 C ATOM 1550 CH2 TRP A 606 10.223 -3.739 -3.100 1.00 0.00 C ATOM 0 H TRP A 606 12.447 -9.501 0.739 1.00 0.00 H new ATOM 0 HA TRP A 606 12.800 -6.601 0.679 1.00 0.00 H new ATOM 0 HB2 TRP A 606 10.469 -8.515 0.786 1.00 0.00 H new ATOM 0 HB3 TRP A 606 10.254 -6.818 1.167 1.00 0.00 H new ATOM 0 HD1 TRP A 606 10.994 -9.142 -1.808 1.00 0.00 H new ATOM 0 HE1 TRP A 606 10.722 -7.813 -4.013 1.00 0.00 H new ATOM 0 HE3 TRP A 606 10.452 -4.495 0.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 606 10.337 -5.108 -4.741 1.00 0.00 H new ATOM 0 HZ3 TRP A 606 10.143 -2.579 -1.300 1.00 0.00 H new ATOM 0 HH2 TRP A 606 10.084 -2.877 -3.735 1.00 0.00 H new ATOM 1561 N VAL A 607 13.023 -6.303 3.136 1.00 0.00 N ATOM 1562 CA VAL A 607 13.144 -6.104 4.567 1.00 0.00 C ATOM 1563 C VAL A 607 12.084 -5.132 5.055 1.00 0.00 C ATOM 1564 O VAL A 607 11.927 -4.039 4.514 1.00 0.00 O ATOM 1565 CB VAL A 607 14.543 -5.564 4.943 1.00 0.00 C ATOM 1566 CG1 VAL A 607 14.713 -5.499 6.455 1.00 0.00 C ATOM 1567 CG2 VAL A 607 15.641 -6.414 4.312 1.00 0.00 C ATOM 0 H VAL A 607 13.533 -5.628 2.566 1.00 0.00 H new ATOM 0 HA VAL A 607 13.004 -7.072 5.047 1.00 0.00 H new ATOM 0 HB VAL A 607 14.629 -4.551 4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 607 15.705 -5.116 6.693 1.00 0.00 H new ATOM 0 HG12 VAL A 607 13.957 -4.837 6.878 1.00 0.00 H new ATOM 0 HG13 VAL A 607 14.598 -6.497 6.877 1.00 0.00 H new ATOM 0 HG21 VAL A 607 16.616 -6.014 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 607 15.555 -7.441 4.666 1.00 0.00 H new ATOM 0 HG23 VAL A 607 15.538 -6.395 3.227 1.00 0.00 H new ATOM 1577 N GLN A 608 11.351 -5.559 6.066 1.00 0.00 N ATOM 1578 CA GLN A 608 10.266 -4.769 6.612 1.00 0.00 C ATOM 1579 C GLN A 608 10.827 -3.612 7.422 1.00 0.00 C ATOM 1580 O GLN A 608 11.748 -3.783 8.221 1.00 0.00 O ATOM 1581 CB GLN A 608 9.336 -5.622 7.475 1.00 0.00 C ATOM 1582 CG GLN A 608 8.218 -4.812 8.111 1.00 0.00 C ATOM 1583 CD GLN A 608 7.070 -5.663 8.607 1.00 0.00 C ATOM 1584 OE1 GLN A 608 7.249 -6.815 9.002 1.00 0.00 O ATOM 1585 NE2 GLN A 608 5.880 -5.095 8.587 1.00 0.00 N ATOM 0 H GLN A 608 11.490 -6.457 6.529 1.00 0.00 H new ATOM 0 HA GLN A 608 9.679 -4.375 5.782 1.00 0.00 H new ATOM 0 HB2 GLN A 608 8.903 -6.413 6.863 1.00 0.00 H new ATOM 0 HB3 GLN A 608 9.918 -6.108 8.258 1.00 0.00 H new ATOM 0 HG2 GLN A 608 8.623 -4.239 8.945 1.00 0.00 H new ATOM 0 HG3 GLN A 608 7.841 -4.093 7.384 1.00 0.00 H new ATOM 0 HE21 GLN A 608 5.778 -4.137 8.251 1.00 0.00 H new ATOM 0 HE22 GLN A 608 5.062 -5.613 8.907 1.00 0.00 H new ATOM 1594 N LEU A 609 10.264 -2.439 7.204 1.00 0.00 N ATOM 1595 CA LEU A 609 10.719 -1.223 7.848 1.00 0.00 C ATOM 1596 C LEU A 609 9.860 -0.972 9.072 1.00 0.00 C ATOM 1597 O LEU A 609 8.653 -1.223 9.032 1.00 0.00 O ATOM 1598 CB LEU A 609 10.569 -0.048 6.881 1.00 0.00 C ATOM 1599 CG LEU A 609 11.353 -0.169 5.577 1.00 0.00 C ATOM 1600 CD1 LEU A 609 10.810 0.806 4.543 1.00 0.00 C ATOM 1601 CD2 LEU A 609 12.829 0.087 5.833 1.00 0.00 C ATOM 0 H LEU A 609 9.475 -2.303 6.572 1.00 0.00 H new ATOM 0 HA LEU A 609 11.765 -1.324 8.136 1.00 0.00 H new ATOM 0 HB2 LEU A 609 9.512 0.070 6.640 1.00 0.00 H new ATOM 0 HB3 LEU A 609 10.883 0.863 7.391 1.00 0.00 H new ATOM 0 HG LEU A 609 11.238 -1.180 5.187 1.00 0.00 H new ATOM 0 HD11 LEU A 609 11.378 0.709 3.618 1.00 0.00 H new ATOM 0 HD12 LEU A 609 9.761 0.584 4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 609 10.902 1.825 4.920 1.00 0.00 H new ATOM 0 HD21 LEU A 609 13.381 -0.001 4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 609 12.959 1.091 6.238 1.00 0.00 H new ATOM 0 HD23 LEU A 609 13.207 -0.644 6.548 1.00 0.00 H new ATOM 1613 N SER A 610 10.442 -0.489 10.156 1.00 0.00 N ATOM 1614 CA SER A 610 9.695 -0.130 11.336 1.00 0.00 C ATOM 1615 C SER A 610 9.027 1.212 11.109 1.00 0.00 C ATOM 1616 O SER A 610 9.375 1.923 10.163 1.00 0.00 O ATOM 1617 CB SER A 610 10.636 -0.057 12.536 1.00 0.00 C ATOM 1618 OG SER A 610 11.497 -1.185 12.576 1.00 0.00 O ATOM 0 H SER A 610 11.447 -0.337 10.237 1.00 0.00 H new ATOM 0 HA SER A 610 8.932 -0.882 11.536 1.00 0.00 H new ATOM 0 HB2 SER A 610 11.229 0.856 12.483 1.00 0.00 H new ATOM 0 HB3 SER A 610 10.054 -0.006 13.456 1.00 0.00 H new ATOM 0 HG SER A 610 12.193 -1.090 11.892 1.00 0.00 H new ATOM 1624 N ALA A 611 8.078 1.561 11.963 1.00 0.00 N ATOM 1625 CA ALA A 611 7.363 2.821 11.849 1.00 0.00 C ATOM 1626 C ALA A 611 8.324 4.002 11.753 1.00 0.00 C ATOM 1627 O ALA A 611 8.043 4.977 11.063 1.00 0.00 O ATOM 1628 CB ALA A 611 6.421 2.999 13.029 1.00 0.00 C ATOM 0 H ALA A 611 7.783 0.983 12.750 1.00 0.00 H new ATOM 0 HA ALA A 611 6.779 2.793 10.929 1.00 0.00 H new ATOM 0 HB1 ALA A 611 5.891 3.947 12.932 1.00 0.00 H new ATOM 0 HB2 ALA A 611 5.701 2.181 13.046 1.00 0.00 H new ATOM 0 HB3 ALA A 611 6.995 2.997 13.956 1.00 0.00 H new ATOM 1634 N GLU A 612 9.451 3.912 12.452 1.00 0.00 N ATOM 1635 CA GLU A 612 10.431 4.997 12.455 1.00 0.00 C ATOM 1636 C GLU A 612 11.227 5.035 11.148 1.00 0.00 C ATOM 1637 O GLU A 612 11.681 6.093 10.721 1.00 0.00 O ATOM 1638 CB GLU A 612 11.397 4.861 13.630 1.00 0.00 C ATOM 1639 CG GLU A 612 10.735 4.986 14.989 1.00 0.00 C ATOM 1640 CD GLU A 612 11.746 5.083 16.108 1.00 0.00 C ATOM 1641 OE1 GLU A 612 12.485 4.104 16.334 1.00 0.00 O ATOM 1642 OE2 GLU A 612 11.823 6.151 16.753 1.00 0.00 O ATOM 0 H GLU A 612 9.709 3.105 13.021 1.00 0.00 H new ATOM 0 HA GLU A 612 9.874 5.929 12.555 1.00 0.00 H new ATOM 0 HB2 GLU A 612 11.895 3.894 13.567 1.00 0.00 H new ATOM 0 HB3 GLU A 612 12.170 5.624 13.542 1.00 0.00 H new ATOM 0 HG2 GLU A 612 10.096 5.869 15.001 1.00 0.00 H new ATOM 0 HG3 GLU A 612 10.090 4.124 15.158 1.00 0.00 H new ATOM 1649 N GLU A 613 11.389 3.879 10.513 1.00 0.00 N ATOM 1650 CA GLU A 613 12.161 3.786 9.278 1.00 0.00 C ATOM 1651 C GLU A 613 11.315 4.205 8.089 1.00 0.00 C ATOM 1652 O GLU A 613 11.833 4.693 7.082 1.00 0.00 O ATOM 1653 CB GLU A 613 12.653 2.358 9.064 1.00 0.00 C ATOM 1654 CG GLU A 613 13.477 1.817 10.219 1.00 0.00 C ATOM 1655 CD GLU A 613 13.887 0.375 10.016 1.00 0.00 C ATOM 1656 OE1 GLU A 613 13.112 -0.528 10.395 1.00 0.00 O ATOM 1657 OE2 GLU A 613 14.989 0.136 9.482 1.00 0.00 O ATOM 0 H GLU A 613 10.996 2.993 10.833 1.00 0.00 H new ATOM 0 HA GLU A 613 13.017 4.455 9.365 1.00 0.00 H new ATOM 0 HB2 GLU A 613 11.793 1.707 8.906 1.00 0.00 H new ATOM 0 HB3 GLU A 613 13.252 2.322 8.154 1.00 0.00 H new ATOM 0 HG2 GLU A 613 14.369 2.431 10.343 1.00 0.00 H new ATOM 0 HG3 GLU A 613 12.902 1.901 11.141 1.00 0.00 H new ATOM 1664 N ILE A 614 10.012 3.990 8.221 1.00 0.00 N ATOM 1665 CA ILE A 614 9.045 4.309 7.177 1.00 0.00 C ATOM 1666 C ILE A 614 9.232 5.724 6.598 1.00 0.00 C ATOM 1667 O ILE A 614 9.479 5.865 5.400 1.00 0.00 O ATOM 1668 CB ILE A 614 7.605 4.153 7.718 1.00 0.00 C ATOM 1669 CG1 ILE A 614 7.266 2.676 7.927 1.00 0.00 C ATOM 1670 CG2 ILE A 614 6.604 4.822 6.797 1.00 0.00 C ATOM 1671 CD1 ILE A 614 5.870 2.440 8.465 1.00 0.00 C ATOM 0 H ILE A 614 9.594 3.587 9.060 1.00 0.00 H new ATOM 0 HA ILE A 614 9.218 3.603 6.364 1.00 0.00 H new ATOM 0 HB ILE A 614 7.547 4.652 8.685 1.00 0.00 H new ATOM 0 HG12 ILE A 614 7.373 2.150 6.978 1.00 0.00 H new ATOM 0 HG13 ILE A 614 7.989 2.241 8.616 1.00 0.00 H new ATOM 0 HG21 ILE A 614 5.599 4.698 7.200 1.00 0.00 H new ATOM 0 HG22 ILE A 614 6.835 5.884 6.719 1.00 0.00 H new ATOM 0 HG23 ILE A 614 6.657 4.366 5.809 1.00 0.00 H new ATOM 0 HD11 ILE A 614 5.703 1.370 8.587 1.00 0.00 H new ATOM 0 HD12 ILE A 614 5.763 2.936 9.430 1.00 0.00 H new ATOM 0 HD13 ILE A 614 5.138 2.844 7.766 1.00 0.00 H new ATOM 1683 N PRO A 615 9.156 6.786 7.430 1.00 0.00 N ATOM 1684 CA PRO A 615 9.255 8.170 6.951 1.00 0.00 C ATOM 1685 C PRO A 615 10.594 8.467 6.295 1.00 0.00 C ATOM 1686 O PRO A 615 10.674 9.295 5.390 1.00 0.00 O ATOM 1687 CB PRO A 615 9.085 9.012 8.217 1.00 0.00 C ATOM 1688 CG PRO A 615 9.412 8.087 9.331 1.00 0.00 C ATOM 1689 CD PRO A 615 8.954 6.739 8.884 1.00 0.00 C ATOM 0 HA PRO A 615 8.509 8.379 6.184 1.00 0.00 H new ATOM 0 HB2 PRO A 615 9.750 9.875 8.211 1.00 0.00 H new ATOM 0 HB3 PRO A 615 8.068 9.394 8.305 1.00 0.00 H new ATOM 0 HG2 PRO A 615 10.482 8.088 9.539 1.00 0.00 H new ATOM 0 HG3 PRO A 615 8.908 8.387 10.250 1.00 0.00 H new ATOM 0 HD2 PRO A 615 9.535 5.941 9.347 1.00 0.00 H new ATOM 0 HD3 PRO A 615 7.910 6.562 9.141 1.00 0.00 H new ATOM 1697 N SER A 616 11.639 7.770 6.725 1.00 0.00 N ATOM 1698 CA SER A 616 12.967 7.975 6.169 1.00 0.00 C ATOM 1699 C SER A 616 12.989 7.532 4.708 1.00 0.00 C ATOM 1700 O SER A 616 13.587 8.183 3.851 1.00 0.00 O ATOM 1701 CB SER A 616 13.992 7.183 6.980 1.00 0.00 C ATOM 1702 OG SER A 616 13.744 7.315 8.371 1.00 0.00 O ATOM 0 H SER A 616 11.591 7.060 7.456 1.00 0.00 H new ATOM 0 HA SER A 616 13.221 9.034 6.218 1.00 0.00 H new ATOM 0 HB2 SER A 616 13.952 6.131 6.697 1.00 0.00 H new ATOM 0 HB3 SER A 616 14.997 7.537 6.750 1.00 0.00 H new ATOM 0 HG SER A 616 14.410 6.799 8.872 1.00 0.00 H new ATOM 1708 N ARG A 617 12.307 6.425 4.433 1.00 0.00 N ATOM 1709 CA ARG A 617 12.163 5.915 3.074 1.00 0.00 C ATOM 1710 C ARG A 617 11.187 6.765 2.276 1.00 0.00 C ATOM 1711 O ARG A 617 11.403 7.026 1.090 1.00 0.00 O ATOM 1712 CB ARG A 617 11.719 4.450 3.077 1.00 0.00 C ATOM 1713 CG ARG A 617 12.859 3.464 3.283 1.00 0.00 C ATOM 1714 CD ARG A 617 13.521 3.637 4.639 1.00 0.00 C ATOM 1715 NE ARG A 617 14.676 2.763 4.796 1.00 0.00 N ATOM 1716 CZ ARG A 617 15.484 2.767 5.853 1.00 0.00 C ATOM 1717 NH1 ARG A 617 15.277 3.615 6.853 1.00 0.00 N ATOM 1718 NH2 ARG A 617 16.504 1.922 5.906 1.00 0.00 N ATOM 0 H ARG A 617 11.841 5.859 5.142 1.00 0.00 H new ATOM 0 HA ARG A 617 13.140 5.972 2.595 1.00 0.00 H new ATOM 0 HB2 ARG A 617 10.979 4.306 3.865 1.00 0.00 H new ATOM 0 HB3 ARG A 617 11.225 4.228 2.131 1.00 0.00 H new ATOM 0 HG2 ARG A 617 12.479 2.446 3.192 1.00 0.00 H new ATOM 0 HG3 ARG A 617 13.602 3.599 2.497 1.00 0.00 H new ATOM 0 HD2 ARG A 617 13.832 4.675 4.761 1.00 0.00 H new ATOM 0 HD3 ARG A 617 12.797 3.426 5.426 1.00 0.00 H new ATOM 0 HE ARG A 617 14.879 2.103 4.045 1.00 0.00 H new ATOM 0 HH11 ARG A 617 14.495 4.269 6.814 1.00 0.00 H new ATOM 0 HH12 ARG A 617 15.900 3.613 7.661 1.00 0.00 H new ATOM 0 HH21 ARG A 617 16.668 1.271 5.138 1.00 0.00 H new ATOM 0 HH22 ARG A 617 17.125 1.923 6.715 1.00 0.00 H new ATOM 1732 N ILE A 618 10.115 7.196 2.938 1.00 0.00 N ATOM 1733 CA ILE A 618 9.116 8.052 2.310 1.00 0.00 C ATOM 1734 C ILE A 618 9.764 9.314 1.759 1.00 0.00 C ATOM 1735 O ILE A 618 9.405 9.784 0.694 1.00 0.00 O ATOM 1736 CB ILE A 618 7.993 8.451 3.294 1.00 0.00 C ATOM 1737 CG1 ILE A 618 7.217 7.215 3.753 1.00 0.00 C ATOM 1738 CG2 ILE A 618 7.051 9.461 2.652 1.00 0.00 C ATOM 1739 CD1 ILE A 618 6.065 7.530 4.684 1.00 0.00 C ATOM 0 H ILE A 618 9.918 6.965 3.912 1.00 0.00 H new ATOM 0 HA ILE A 618 8.673 7.476 1.498 1.00 0.00 H new ATOM 0 HB ILE A 618 8.452 8.915 4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 618 6.832 6.693 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 618 7.902 6.533 4.256 1.00 0.00 H new ATOM 0 HG21 ILE A 618 6.267 9.729 3.361 1.00 0.00 H new ATOM 0 HG22 ILE A 618 7.610 10.354 2.374 1.00 0.00 H new ATOM 0 HG23 ILE A 618 6.600 9.023 1.761 1.00 0.00 H new ATOM 0 HD11 ILE A 618 5.562 6.605 4.967 1.00 0.00 H new ATOM 0 HD12 ILE A 618 6.445 8.025 5.578 1.00 0.00 H new ATOM 0 HD13 ILE A 618 5.358 8.187 4.178 1.00 0.00 H new ATOM 1751 N GLN A 619 10.731 9.841 2.488 1.00 0.00 N ATOM 1752 CA GLN A 619 11.435 11.050 2.082 1.00 0.00 C ATOM 1753 C GLN A 619 12.173 10.875 0.764 1.00 0.00 C ATOM 1754 O GLN A 619 12.291 11.817 -0.016 1.00 0.00 O ATOM 1755 CB GLN A 619 12.369 11.504 3.190 1.00 0.00 C ATOM 1756 CG GLN A 619 11.585 12.023 4.371 1.00 0.00 C ATOM 1757 CD GLN A 619 10.798 13.269 4.007 1.00 0.00 C ATOM 1758 OE1 GLN A 619 11.286 14.129 3.277 1.00 0.00 O ATOM 1759 NE2 GLN A 619 9.547 13.334 4.424 1.00 0.00 N ATOM 0 H GLN A 619 11.051 9.448 3.373 1.00 0.00 H new ATOM 0 HA GLN A 619 10.691 11.828 1.911 1.00 0.00 H new ATOM 0 HB2 GLN A 619 13.000 10.673 3.504 1.00 0.00 H new ATOM 0 HB3 GLN A 619 13.032 12.284 2.816 1.00 0.00 H new ATOM 0 HG2 GLN A 619 10.903 11.250 4.725 1.00 0.00 H new ATOM 0 HG3 GLN A 619 12.266 12.248 5.192 1.00 0.00 H new ATOM 0 HE21 GLN A 619 9.173 12.603 5.029 1.00 0.00 H new ATOM 0 HE22 GLN A 619 8.955 14.115 4.141 1.00 0.00 H new ATOM 1768 N ALA A 620 12.684 9.685 0.513 1.00 0.00 N ATOM 1769 CA ALA A 620 13.349 9.409 -0.749 1.00 0.00 C ATOM 1770 C ALA A 620 12.334 9.278 -1.884 1.00 0.00 C ATOM 1771 O ALA A 620 12.514 9.844 -2.962 1.00 0.00 O ATOM 1772 CB ALA A 620 14.184 8.144 -0.629 1.00 0.00 C ATOM 0 H ALA A 620 12.653 8.897 1.161 1.00 0.00 H new ATOM 0 HA ALA A 620 14.007 10.245 -0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 620 14.679 7.944 -1.579 1.00 0.00 H new ATOM 0 HB2 ALA A 620 14.934 8.276 0.151 1.00 0.00 H new ATOM 0 HB3 ALA A 620 13.538 7.304 -0.373 1.00 0.00 H new ATOM 1778 N ILE A 621 11.259 8.546 -1.621 1.00 0.00 N ATOM 1779 CA ILE A 621 10.238 8.286 -2.638 1.00 0.00 C ATOM 1780 C ILE A 621 9.216 9.418 -2.739 1.00 0.00 C ATOM 1781 O ILE A 621 8.346 9.398 -3.613 1.00 0.00 O ATOM 1782 CB ILE A 621 9.476 6.976 -2.352 1.00 0.00 C ATOM 1783 CG1 ILE A 621 8.778 7.046 -0.993 1.00 0.00 C ATOM 1784 CG2 ILE A 621 10.419 5.788 -2.399 1.00 0.00 C ATOM 1785 CD1 ILE A 621 7.922 5.838 -0.691 1.00 0.00 C ATOM 0 H ILE A 621 11.068 8.120 -0.714 1.00 0.00 H new ATOM 0 HA ILE A 621 10.778 8.206 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 621 8.718 6.847 -3.125 1.00 0.00 H new ATOM 0 HG12 ILE A 621 9.531 7.152 -0.212 1.00 0.00 H new ATOM 0 HG13 ILE A 621 8.155 7.940 -0.959 1.00 0.00 H new ATOM 0 HG21 ILE A 621 9.862 4.873 -2.195 1.00 0.00 H new ATOM 0 HG22 ILE A 621 10.873 5.723 -3.388 1.00 0.00 H new ATOM 0 HG23 ILE A 621 11.199 5.913 -1.648 1.00 0.00 H new ATOM 0 HD11 ILE A 621 7.458 5.956 0.288 1.00 0.00 H new ATOM 0 HD12 ILE A 621 7.146 5.743 -1.451 1.00 0.00 H new ATOM 0 HD13 ILE A 621 8.543 4.942 -0.692 1.00 0.00 H new ATOM 1797 N THR A 622 9.317 10.392 -1.847 1.00 0.00 N ATOM 1798 CA THR A 622 8.326 11.454 -1.764 1.00 0.00 C ATOM 1799 C THR A 622 8.404 12.361 -2.990 1.00 0.00 C ATOM 1800 O THR A 622 9.461 12.497 -3.617 1.00 0.00 O ATOM 1801 CB THR A 622 8.478 12.299 -0.468 1.00 0.00 C ATOM 1802 OG1 THR A 622 7.263 13.010 -0.200 1.00 0.00 O ATOM 1803 CG2 THR A 622 9.620 13.294 -0.587 1.00 0.00 C ATOM 0 H THR A 622 10.076 10.469 -1.170 1.00 0.00 H new ATOM 0 HA THR A 622 7.348 10.974 -1.733 1.00 0.00 H new ATOM 0 HB THR A 622 8.697 11.613 0.350 1.00 0.00 H new ATOM 0 HG1 THR A 622 7.367 13.538 0.619 1.00 0.00 H new ATOM 0 HG21 THR A 622 9.699 13.869 0.336 1.00 0.00 H new ATOM 0 HG22 THR A 622 10.553 12.758 -0.762 1.00 0.00 H new ATOM 0 HG23 THR A 622 9.428 13.970 -1.420 1.00 0.00 H new ATOM 1811 N GLY A 623 7.278 12.959 -3.336 1.00 0.00 N ATOM 1812 CA GLY A 623 7.219 13.833 -4.483 1.00 0.00 C ATOM 1813 C GLY A 623 6.011 14.737 -4.431 1.00 0.00 C ATOM 1814 O GLY A 623 4.877 14.277 -4.578 1.00 0.00 O ATOM 0 H GLY A 623 6.395 12.852 -2.836 1.00 0.00 H new ATOM 0 HA2 GLY A 623 8.125 14.437 -4.528 1.00 0.00 H new ATOM 0 HA3 GLY A 623 7.189 13.236 -5.395 1.00 0.00 H new ATOM 1818 N SER A 624 6.249 16.014 -4.193 1.00 0.00 N ATOM 1819 CA SER A 624 5.176 16.986 -4.110 1.00 0.00 C ATOM 1820 C SER A 624 4.825 17.524 -5.496 1.00 0.00 C ATOM 1821 O SER A 624 5.439 18.521 -5.925 1.00 0.00 O ATOM 1822 CB SER A 624 5.591 18.121 -3.172 1.00 0.00 C ATOM 1823 OG SER A 624 6.875 18.613 -3.514 1.00 0.00 O ATOM 1824 OXT SER A 624 3.944 16.939 -6.159 1.00 0.00 O ATOM 0 H SER A 624 7.182 16.403 -4.053 1.00 0.00 H new ATOM 0 HA SER A 624 4.285 16.503 -3.709 1.00 0.00 H new ATOM 0 HB2 SER A 624 4.861 18.929 -3.226 1.00 0.00 H new ATOM 0 HB3 SER A 624 5.596 17.764 -2.142 1.00 0.00 H new ATOM 0 HG SER A 624 6.914 18.783 -4.478 1.00 0.00 H new TER 1830 SER A 624