USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 475 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot -18:sc= -0.832 USER MOD Single : A 95 LYS NZ :NH3+ -153:sc= -0.0611 (180deg=-0.486) USER MOD Single : A 96 ASN : amide:sc= -1.7 X(o=-1.7,f=-2!) USER MOD Single : A 97 MET CE :methyl -166:sc= -1.97 (180deg=-2.45) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -158:sc= -0.0483 (180deg=-0.47) USER MOD Single : A 102 SER OG : rot 180:sc=-0.00586 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -157:sc= -0.131 (180deg=-0.743) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 30:sc= -0.998 USER MOD Single : A 142 ASN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ -145:sc= -0.0378 (180deg=-0.554) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 100:sc= -0.756 USER MOD Single : A 164 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.826 -7.018 4.525 1.00 0.00 N ATOM 32 CA ARG A 59 -0.414 -7.343 3.858 1.00 0.00 C ATOM 33 C ARG A 59 -0.955 -8.681 4.334 1.00 0.00 C ATOM 34 O ARG A 59 -0.233 -9.675 4.406 1.00 0.00 O ATOM 35 CB ARG A 59 -0.178 -7.373 2.349 1.00 0.00 C ATOM 36 CG ARG A 59 -1.510 -7.574 1.633 1.00 0.00 C ATOM 37 CD ARG A 59 -1.561 -8.982 1.047 1.00 0.00 C ATOM 38 NE ARG A 59 -0.660 -9.094 -0.095 1.00 0.00 N ATOM 39 CZ ARG A 59 -0.500 -10.248 -0.746 1.00 0.00 C ATOM 40 NH1 ARG A 59 -1.151 -11.323 -0.372 1.00 0.00 N ATOM 41 NH2 ARG A 59 0.311 -10.308 -1.766 1.00 0.00 N ATOM 0 HA ARG A 59 -1.155 -6.581 4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 59 0.286 -6.442 2.024 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.510 -8.178 2.093 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -2.336 -7.427 2.329 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -1.626 -6.834 0.841 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.283 -9.710 1.809 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.580 -9.217 0.738 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.141 -8.272 -0.403 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.788 -11.283 0.424 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.021 -12.200 -0.877 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.820 -9.475 -2.063 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.437 -11.188 -2.267 1.00 0.00 H new ATOM 55 N VAL A 60 -2.236 -8.685 4.654 1.00 0.00 N ATOM 56 CA VAL A 60 -2.901 -9.888 5.125 1.00 0.00 C ATOM 57 C VAL A 60 -4.140 -10.168 4.280 1.00 0.00 C ATOM 58 O VAL A 60 -4.863 -9.250 3.899 1.00 0.00 O ATOM 59 CB VAL A 60 -3.297 -9.742 6.590 1.00 0.00 C ATOM 60 CG1 VAL A 60 -3.982 -11.025 7.058 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.045 -9.491 7.430 1.00 0.00 C ATOM 0 H VAL A 60 -2.840 -7.865 4.596 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.208 -10.724 5.031 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.983 -8.903 6.704 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.267 -10.924 8.105 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.873 -11.203 6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.296 -11.865 6.948 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.325 -9.386 8.478 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.359 -10.331 7.320 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.557 -8.577 7.092 1.00 0.00 H new ATOM 71 N VAL A 61 -4.370 -11.438 3.983 1.00 0.00 N ATOM 72 CA VAL A 61 -5.515 -11.835 3.172 1.00 0.00 C ATOM 73 C VAL A 61 -6.421 -12.787 3.953 1.00 0.00 C ATOM 74 O VAL A 61 -5.967 -13.809 4.468 1.00 0.00 O ATOM 75 CB VAL A 61 -5.035 -12.524 1.895 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.244 -12.953 1.059 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.177 -11.549 1.086 1.00 0.00 C ATOM 0 H VAL A 61 -3.781 -12.212 4.290 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.081 -10.940 2.913 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.445 -13.403 2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.901 -13.444 0.148 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.858 -13.645 1.635 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.835 -12.075 0.797 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.833 -12.037 0.174 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.770 -10.672 0.826 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.316 -11.242 1.680 1.00 0.00 H new ATOM 87 N VAL A 62 -7.702 -12.446 4.036 1.00 0.00 N ATOM 88 CA VAL A 62 -8.658 -13.280 4.760 1.00 0.00 C ATOM 89 C VAL A 62 -9.635 -13.933 3.782 1.00 0.00 C ATOM 90 O VAL A 62 -10.299 -13.253 3.008 1.00 0.00 O ATOM 91 CB VAL A 62 -9.439 -12.432 5.773 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.390 -13.327 6.564 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.455 -11.745 6.725 1.00 0.00 C ATOM 0 H VAL A 62 -8.101 -11.607 3.616 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.107 -14.057 5.290 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.019 -11.674 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.944 -12.724 7.283 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.089 -13.809 5.880 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -9.817 -14.088 7.094 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.007 -11.142 7.446 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.873 -12.500 7.254 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.784 -11.104 6.154 1.00 0.00 H new ATOM 103 N TYR A 63 -9.724 -15.253 3.834 1.00 0.00 N ATOM 104 CA TYR A 63 -10.620 -15.986 2.965 1.00 0.00 C ATOM 105 C TYR A 63 -11.963 -16.183 3.646 1.00 0.00 C ATOM 106 O TYR A 63 -12.034 -16.532 4.826 1.00 0.00 O ATOM 107 CB TYR A 63 -10.011 -17.347 2.617 1.00 0.00 C ATOM 108 CG TYR A 63 -8.889 -17.160 1.624 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.645 -16.676 2.053 1.00 0.00 C ATOM 110 CD2 TYR A 63 -9.089 -17.478 0.275 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.604 -16.507 1.133 1.00 0.00 C ATOM 112 CE2 TYR A 63 -8.047 -17.308 -0.645 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.805 -16.823 -0.217 1.00 0.00 C ATOM 114 OH TYR A 63 -5.778 -16.655 -1.123 1.00 0.00 O ATOM 0 H TYR A 63 -9.183 -15.837 4.472 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.768 -15.415 2.049 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.635 -17.830 3.519 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.775 -18.003 2.199 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.490 -16.433 3.094 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -10.046 -17.854 -0.056 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.646 -16.133 1.464 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -8.201 -17.551 -1.686 1.00 0.00 H new ATOM 0 HH TYR A 63 -6.082 -16.921 -2.016 1.00 0.00 H new ATOM 124 N ILE A 64 -13.017 -15.968 2.879 1.00 0.00 N ATOM 125 CA ILE A 64 -14.387 -16.119 3.382 1.00 0.00 C ATOM 126 C ILE A 64 -15.079 -17.333 2.767 1.00 0.00 C ATOM 127 O ILE A 64 -14.874 -17.654 1.596 1.00 0.00 O ATOM 128 CB ILE A 64 -15.209 -14.867 3.075 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.641 -13.682 3.856 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.670 -15.092 3.493 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.281 -12.379 3.366 1.00 0.00 C ATOM 0 H ILE A 64 -12.958 -15.687 1.900 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.322 -16.263 4.460 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.164 -14.660 2.006 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.831 -13.813 4.921 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.559 -13.636 3.729 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.253 -14.198 3.273 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.080 -15.938 2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.715 -15.300 4.562 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.871 -11.539 3.927 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.068 -12.245 2.305 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.360 -12.424 3.516 1.00 0.00 H new ATOM 143 N ARG A 65 -15.902 -18.000 3.571 1.00 0.00 N ATOM 144 CA ARG A 65 -16.631 -19.175 3.105 1.00 0.00 C ATOM 145 C ARG A 65 -17.498 -18.820 1.899 1.00 0.00 C ATOM 146 O ARG A 65 -17.844 -17.658 1.691 1.00 0.00 O ATOM 147 CB ARG A 65 -17.516 -19.722 4.229 1.00 0.00 C ATOM 148 CG ARG A 65 -16.654 -20.462 5.252 1.00 0.00 C ATOM 149 CD ARG A 65 -16.363 -21.873 4.749 1.00 0.00 C ATOM 150 NE ARG A 65 -17.604 -22.627 4.606 1.00 0.00 N ATOM 151 CZ ARG A 65 -17.606 -23.898 4.197 1.00 0.00 C ATOM 152 NH1 ARG A 65 -16.484 -24.513 3.916 1.00 0.00 N ATOM 153 NH2 ARG A 65 -18.738 -24.537 4.076 1.00 0.00 N ATOM 0 H ARG A 65 -16.080 -17.749 4.543 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.909 -19.936 2.810 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.051 -18.905 4.713 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.268 -20.396 3.818 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -15.721 -19.923 5.414 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -17.168 -20.506 6.212 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -15.846 -21.825 3.790 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -15.697 -22.384 5.445 1.00 0.00 H new ATOM 0 HE ARG A 65 -18.491 -22.172 4.824 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -15.595 -24.021 4.009 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -16.499 -25.484 3.605 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -19.616 -24.065 4.294 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.745 -25.508 3.764 1.00 0.00 H new ATOM 517 N LYS A 89 -20.568 -6.769 6.272 1.00 0.00 N ATOM 518 CA LYS A 89 -20.388 -7.441 7.547 1.00 0.00 C ATOM 519 C LYS A 89 -18.912 -7.671 7.832 1.00 0.00 C ATOM 520 O LYS A 89 -18.345 -7.086 8.755 1.00 0.00 O ATOM 521 CB LYS A 89 -21.133 -8.792 7.547 1.00 0.00 C ATOM 522 CG LYS A 89 -22.157 -8.846 6.405 1.00 0.00 C ATOM 523 CD LYS A 89 -21.481 -9.374 5.140 1.00 0.00 C ATOM 524 CE LYS A 89 -21.969 -8.579 3.927 1.00 0.00 C ATOM 525 NZ LYS A 89 -21.928 -9.438 2.705 1.00 0.00 N ATOM 0 HA LYS A 89 -20.800 -6.802 8.328 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.418 -9.608 7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.638 -8.935 8.502 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -22.992 -9.491 6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.568 -7.853 6.223 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -20.398 -9.289 5.232 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -21.708 -10.432 5.009 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -22.985 -8.224 4.099 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.344 -7.698 3.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -22.261 -8.891 1.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -20.952 -9.756 2.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -22.543 -10.266 2.842 1.00 0.00 H new ATOM 539 N VAL A 90 -18.297 -8.521 7.028 1.00 0.00 N ATOM 540 CA VAL A 90 -16.891 -8.827 7.191 1.00 0.00 C ATOM 541 C VAL A 90 -16.077 -7.572 6.924 1.00 0.00 C ATOM 542 O VAL A 90 -15.056 -7.329 7.567 1.00 0.00 O ATOM 543 CB VAL A 90 -16.463 -9.957 6.245 1.00 0.00 C ATOM 544 CG1 VAL A 90 -14.956 -10.217 6.409 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.254 -11.225 6.588 1.00 0.00 C ATOM 0 H VAL A 90 -18.751 -9.010 6.257 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.715 -9.166 8.212 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.665 -9.674 5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.650 -11.019 5.738 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.402 -9.310 6.167 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.747 -10.506 7.439 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -16.955 -12.032 5.920 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.050 -11.513 7.619 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.320 -11.032 6.469 1.00 0.00 H new ATOM 555 N TYR A 91 -16.547 -6.777 5.972 1.00 0.00 N ATOM 556 CA TYR A 91 -15.868 -5.543 5.622 1.00 0.00 C ATOM 557 C TYR A 91 -15.901 -4.573 6.785 1.00 0.00 C ATOM 558 O TYR A 91 -14.916 -3.893 7.065 1.00 0.00 O ATOM 559 CB TYR A 91 -16.511 -4.896 4.389 1.00 0.00 C ATOM 560 CG TYR A 91 -15.711 -3.684 3.970 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.390 -3.832 3.532 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.297 -2.415 4.003 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.657 -2.711 3.127 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.563 -1.292 3.601 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.244 -1.443 3.162 1.00 0.00 C ATOM 566 OH TYR A 91 -13.517 -0.337 2.766 1.00 0.00 O ATOM 0 H TYR A 91 -17.392 -6.966 5.432 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.831 -5.785 5.388 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.554 -5.615 3.571 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.537 -4.606 4.613 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.936 -4.812 3.507 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.317 -2.301 4.339 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.638 -2.825 2.788 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.015 -0.311 3.630 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.072 0.466 2.850 1.00 0.00 H new ATOM 576 N ASP A 92 -17.043 -4.503 7.448 1.00 0.00 N ATOM 577 CA ASP A 92 -17.190 -3.592 8.576 1.00 0.00 C ATOM 578 C ASP A 92 -16.354 -4.060 9.755 1.00 0.00 C ATOM 579 O ASP A 92 -15.743 -3.257 10.458 1.00 0.00 O ATOM 580 CB ASP A 92 -18.662 -3.500 8.985 1.00 0.00 C ATOM 581 CG ASP A 92 -18.856 -2.400 10.026 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.746 -1.242 9.663 1.00 0.00 O ATOM 583 OD2 ASP A 92 -19.110 -2.735 11.172 1.00 0.00 O ATOM 0 H ASP A 92 -17.872 -5.056 7.231 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.839 -2.606 8.272 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.277 -3.294 8.109 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.994 -4.456 9.390 1.00 0.00 H new ATOM 588 N SER A 93 -16.334 -5.366 9.966 1.00 0.00 N ATOM 589 CA SER A 93 -15.572 -5.933 11.068 1.00 0.00 C ATOM 590 C SER A 93 -14.078 -5.767 10.836 1.00 0.00 C ATOM 591 O SER A 93 -13.325 -5.464 11.762 1.00 0.00 O ATOM 592 CB SER A 93 -15.910 -7.419 11.214 1.00 0.00 C ATOM 593 OG SER A 93 -15.584 -8.091 10.005 1.00 0.00 O ATOM 0 H SER A 93 -16.832 -6.049 9.395 1.00 0.00 H new ATOM 0 HA SER A 93 -15.839 -5.403 11.983 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.354 -7.851 12.046 1.00 0.00 H new ATOM 0 HB3 SER A 93 -16.969 -7.543 11.440 1.00 0.00 H new ATOM 0 HG SER A 93 -15.504 -7.438 9.279 1.00 0.00 H new ATOM 599 N LEU A 94 -13.658 -5.964 9.594 1.00 0.00 N ATOM 600 CA LEU A 94 -12.245 -5.828 9.249 1.00 0.00 C ATOM 601 C LEU A 94 -11.832 -4.360 9.202 1.00 0.00 C ATOM 602 O LEU A 94 -10.739 -3.990 9.631 1.00 0.00 O ATOM 603 CB LEU A 94 -11.966 -6.492 7.900 1.00 0.00 C ATOM 604 CG LEU A 94 -12.149 -8.012 8.017 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.067 -8.645 6.631 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.052 -8.599 8.913 1.00 0.00 C ATOM 0 H LEU A 94 -14.266 -6.216 8.814 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.658 -6.324 10.022 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.640 -6.093 7.142 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.951 -6.263 7.575 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.124 -8.223 8.456 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.197 -9.724 6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.852 -8.234 5.996 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.094 -8.430 6.190 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.186 -9.678 8.993 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.075 -8.386 8.479 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.114 -8.151 9.905 1.00 0.00 H new ATOM 618 N LYS A 95 -12.718 -3.536 8.661 1.00 0.00 N ATOM 619 CA LYS A 95 -12.465 -2.107 8.531 1.00 0.00 C ATOM 620 C LYS A 95 -12.475 -1.408 9.886 1.00 0.00 C ATOM 621 O LYS A 95 -11.697 -0.483 10.125 1.00 0.00 O ATOM 622 CB LYS A 95 -13.511 -1.471 7.622 1.00 0.00 C ATOM 623 CG LYS A 95 -13.203 0.025 7.464 1.00 0.00 C ATOM 624 CD LYS A 95 -12.936 0.359 5.997 1.00 0.00 C ATOM 625 CE LYS A 95 -11.424 0.364 5.746 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.800 1.556 6.400 1.00 0.00 N ATOM 0 H LYS A 95 -13.625 -3.835 8.302 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.474 -1.987 8.094 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.508 -1.960 6.648 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.507 -1.607 8.044 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -14.041 0.617 7.832 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -12.336 0.291 8.068 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.421 -0.373 5.351 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -13.360 1.332 5.751 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.979 -0.551 6.138 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.225 0.381 4.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.933 1.819 5.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.469 2.352 6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.564 1.327 7.387 1.00 0.00 H new ATOM 640 N ASN A 96 -13.370 -1.842 10.758 1.00 0.00 N ATOM 641 CA ASN A 96 -13.496 -1.239 12.078 1.00 0.00 C ATOM 642 C ASN A 96 -12.707 -2.026 13.117 1.00 0.00 C ATOM 643 O ASN A 96 -12.792 -1.750 14.314 1.00 0.00 O ATOM 644 CB ASN A 96 -14.971 -1.182 12.481 1.00 0.00 C ATOM 645 CG ASN A 96 -15.741 -0.309 11.494 1.00 0.00 C ATOM 646 OD1 ASN A 96 -16.479 -0.825 10.654 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.613 0.988 11.547 1.00 0.00 N ATOM 0 H ASN A 96 -14.019 -2.608 10.578 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.089 -0.229 12.034 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.392 -2.187 12.498 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.067 -0.779 13.489 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.125 1.578 10.891 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -15.001 1.412 12.244 1.00 0.00 H new ATOM 654 N MET A 97 -11.942 -3.013 12.659 1.00 0.00 N ATOM 655 CA MET A 97 -11.150 -3.828 13.559 1.00 0.00 C ATOM 656 C MET A 97 -10.209 -2.968 14.389 1.00 0.00 C ATOM 657 O MET A 97 -9.685 -3.448 15.397 1.00 0.00 O ATOM 658 CB MET A 97 -10.335 -4.851 12.780 1.00 0.00 C ATOM 659 CG MET A 97 -10.150 -6.101 13.644 1.00 0.00 C ATOM 660 SD MET A 97 -8.670 -6.999 13.120 1.00 0.00 S ATOM 661 CE MET A 97 -9.384 -7.833 11.682 1.00 0.00 C ATOM 0 H MET A 97 -11.857 -3.263 11.674 1.00 0.00 H new ATOM 0 HA MET A 97 -11.840 -4.345 14.226 1.00 0.00 H new ATOM 0 HB2 MET A 97 -10.842 -5.108 11.850 1.00 0.00 H new ATOM 0 HB3 MET A 97 -9.365 -4.433 12.509 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.062 -5.819 14.693 1.00 0.00 H new ATOM 0 HG3 MET A 97 -11.025 -6.745 13.559 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.716 -8.629 11.354 1.00 0.00 H new ATOM 0 HE2 MET A 97 -10.351 -8.259 11.951 1.00 0.00 H new ATOM 0 HE3 MET A 97 -9.516 -7.114 10.873 1.00 0.00 H new ATOM 671 N SER A 98 -9.980 -1.711 13.944 1.00 0.00 N ATOM 672 CA SER A 98 -9.087 -0.774 14.639 1.00 0.00 C ATOM 673 C SER A 98 -7.642 -0.991 14.215 1.00 0.00 C ATOM 674 O SER A 98 -7.006 -0.095 13.656 1.00 0.00 O ATOM 675 CB SER A 98 -9.218 -0.929 16.149 1.00 0.00 C ATOM 676 OG SER A 98 -8.986 0.323 16.779 1.00 0.00 O ATOM 0 H SER A 98 -10.407 -1.327 13.101 1.00 0.00 H new ATOM 0 HA SER A 98 -9.381 0.239 14.364 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.213 -1.296 16.402 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.504 -1.668 16.512 1.00 0.00 H new ATOM 0 HG SER A 98 -9.072 0.222 17.750 1.00 0.00 H new ATOM 682 N THR A 99 -7.129 -2.184 14.476 1.00 0.00 N ATOM 683 CA THR A 99 -5.759 -2.512 14.112 1.00 0.00 C ATOM 684 C THR A 99 -5.597 -2.586 12.589 1.00 0.00 C ATOM 685 O THR A 99 -4.483 -2.730 12.084 1.00 0.00 O ATOM 686 CB THR A 99 -5.359 -3.847 14.744 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.611 -3.796 16.141 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.868 -4.105 14.502 1.00 0.00 C ATOM 0 H THR A 99 -7.638 -2.938 14.937 1.00 0.00 H new ATOM 0 HA THR A 99 -5.107 -1.723 14.487 1.00 0.00 H new ATOM 0 HB THR A 99 -5.940 -4.652 14.295 1.00 0.00 H new ATOM 0 HG1 THR A 99 -5.358 -4.650 16.550 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.585 -5.056 14.953 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.674 -4.140 13.430 1.00 0.00 H new ATOM 0 HG23 THR A 99 -3.282 -3.303 14.951 1.00 0.00 H new ATOM 696 N VAL A 100 -6.712 -2.501 11.864 1.00 0.00 N ATOM 697 CA VAL A 100 -6.673 -2.569 10.409 1.00 0.00 C ATOM 698 C VAL A 100 -6.672 -1.171 9.802 1.00 0.00 C ATOM 699 O VAL A 100 -7.613 -0.399 9.991 1.00 0.00 O ATOM 700 CB VAL A 100 -7.891 -3.339 9.899 1.00 0.00 C ATOM 701 CG1 VAL A 100 -7.879 -3.373 8.371 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.867 -4.764 10.448 1.00 0.00 C ATOM 0 H VAL A 100 -7.645 -2.386 12.259 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.758 -3.081 10.112 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.799 -2.840 10.238 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.749 -3.923 8.012 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.909 -2.354 7.984 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.970 -3.866 8.025 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.737 -5.310 10.082 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -6.958 -5.266 10.117 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.889 -4.735 11.537 1.00 0.00 H new ATOM 712 N LYS A 101 -5.611 -0.857 9.071 1.00 0.00 N ATOM 713 CA LYS A 101 -5.496 0.448 8.436 1.00 0.00 C ATOM 714 C LYS A 101 -6.503 0.587 7.294 1.00 0.00 C ATOM 715 O LYS A 101 -7.150 1.624 7.146 1.00 0.00 O ATOM 716 CB LYS A 101 -4.077 0.644 7.896 1.00 0.00 C ATOM 717 CG LYS A 101 -3.936 2.043 7.292 1.00 0.00 C ATOM 718 CD LYS A 101 -3.978 3.087 8.411 1.00 0.00 C ATOM 719 CE LYS A 101 -3.617 4.458 7.839 1.00 0.00 C ATOM 720 NZ LYS A 101 -2.173 4.486 7.458 1.00 0.00 N ATOM 0 H LYS A 101 -4.823 -1.483 8.904 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.709 1.212 9.184 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.352 0.511 8.699 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.859 -0.111 7.141 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.998 2.121 6.742 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.740 2.226 6.579 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -4.972 3.117 8.858 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.280 2.816 9.203 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -4.236 4.673 6.968 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.823 5.235 8.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.841 5.471 7.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.619 3.954 8.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -2.053 4.052 6.520 1.00 0.00 H new ATOM 734 N SER A 102 -6.625 -0.464 6.487 1.00 0.00 N ATOM 735 CA SER A 102 -7.545 -0.452 5.357 1.00 0.00 C ATOM 736 C SER A 102 -7.946 -1.868 4.989 1.00 0.00 C ATOM 737 O SER A 102 -7.255 -2.828 5.328 1.00 0.00 O ATOM 738 CB SER A 102 -6.878 0.217 4.152 1.00 0.00 C ATOM 739 OG SER A 102 -5.816 -0.605 3.686 1.00 0.00 O ATOM 0 H SER A 102 -6.099 -1.331 6.595 1.00 0.00 H new ATOM 0 HA SER A 102 -8.436 0.108 5.639 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.608 0.373 3.358 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.497 1.199 4.432 1.00 0.00 H new ATOM 0 HG SER A 102 -5.388 -0.180 2.914 1.00 0.00 H new ATOM 745 N VAL A 103 -9.067 -1.985 4.299 1.00 0.00 N ATOM 746 CA VAL A 103 -9.569 -3.291 3.877 1.00 0.00 C ATOM 747 C VAL A 103 -9.997 -3.282 2.410 1.00 0.00 C ATOM 748 O VAL A 103 -10.755 -2.415 1.982 1.00 0.00 O ATOM 749 CB VAL A 103 -10.766 -3.692 4.742 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.338 -5.029 4.254 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.321 -3.829 6.194 1.00 0.00 C ATOM 0 H VAL A 103 -9.649 -1.196 4.017 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.758 -4.010 3.996 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.536 -2.924 4.666 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -12.190 -5.308 4.874 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.661 -4.930 3.218 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.571 -5.800 4.323 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.173 -4.115 6.810 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.548 -4.594 6.267 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.923 -2.876 6.544 1.00 0.00 H new ATOM 761 N THR A 104 -9.518 -4.257 1.642 1.00 0.00 N ATOM 762 CA THR A 104 -9.882 -4.354 0.239 1.00 0.00 C ATOM 763 C THR A 104 -10.501 -5.720 -0.033 1.00 0.00 C ATOM 764 O THR A 104 -9.895 -6.751 0.241 1.00 0.00 O ATOM 765 CB THR A 104 -8.646 -4.148 -0.641 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.124 -2.844 -0.429 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.018 -4.333 -2.114 1.00 0.00 C ATOM 0 H THR A 104 -8.882 -4.984 1.968 1.00 0.00 H new ATOM 0 HA THR A 104 -10.610 -3.578 0.002 1.00 0.00 H new ATOM 0 HB THR A 104 -7.887 -4.884 -0.376 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.332 -2.713 -0.991 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.134 -4.185 -2.734 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.405 -5.340 -2.268 1.00 0.00 H new ATOM 0 HG23 THR A 104 -9.781 -3.605 -2.391 1.00 0.00 H new ATOM 775 N PHE A 105 -11.710 -5.725 -0.572 1.00 0.00 N ATOM 776 CA PHE A 105 -12.394 -6.975 -0.862 1.00 0.00 C ATOM 777 C PHE A 105 -12.003 -7.491 -2.242 1.00 0.00 C ATOM 778 O PHE A 105 -12.336 -6.888 -3.263 1.00 0.00 O ATOM 779 CB PHE A 105 -13.908 -6.754 -0.816 1.00 0.00 C ATOM 780 CG PHE A 105 -14.622 -8.041 -1.147 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.508 -9.144 -0.298 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.412 -8.128 -2.302 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.176 -10.330 -0.600 1.00 0.00 C ATOM 784 CE2 PHE A 105 -16.081 -9.319 -2.605 1.00 0.00 C ATOM 785 CZ PHE A 105 -15.963 -10.420 -1.752 1.00 0.00 C ATOM 0 H PHE A 105 -12.234 -4.885 -0.816 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.104 -7.712 -0.113 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.204 -6.407 0.174 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.193 -5.976 -1.525 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -13.902 -9.078 0.593 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.504 -7.275 -2.958 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.085 -11.182 0.058 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.687 -9.387 -3.496 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.480 -11.340 -1.983 1.00 0.00 H new ATOM 795 N SER A 106 -11.314 -8.621 -2.258 1.00 0.00 N ATOM 796 CA SER A 106 -10.896 -9.237 -3.506 1.00 0.00 C ATOM 797 C SER A 106 -11.840 -10.382 -3.858 1.00 0.00 C ATOM 798 O SER A 106 -11.785 -11.454 -3.252 1.00 0.00 O ATOM 799 CB SER A 106 -9.466 -9.769 -3.378 1.00 0.00 C ATOM 800 OG SER A 106 -9.095 -10.414 -4.589 1.00 0.00 O ATOM 0 H SER A 106 -11.033 -9.130 -1.420 1.00 0.00 H new ATOM 0 HA SER A 106 -10.926 -8.488 -4.297 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.779 -8.950 -3.163 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.399 -10.468 -2.545 1.00 0.00 H new ATOM 0 HG SER A 106 -8.179 -10.754 -4.511 1.00 0.00 H new ATOM 806 N SER A 107 -12.704 -10.154 -4.840 1.00 0.00 N ATOM 807 CA SER A 107 -13.658 -11.173 -5.261 1.00 0.00 C ATOM 808 C SER A 107 -12.920 -12.367 -5.859 1.00 0.00 C ATOM 809 O SER A 107 -11.745 -12.275 -6.203 1.00 0.00 O ATOM 810 CB SER A 107 -14.623 -10.591 -6.295 1.00 0.00 C ATOM 811 OG SER A 107 -13.916 -10.325 -7.498 1.00 0.00 O ATOM 0 H SER A 107 -12.764 -9.277 -5.358 1.00 0.00 H new ATOM 0 HA SER A 107 -14.224 -11.505 -4.391 1.00 0.00 H new ATOM 0 HB2 SER A 107 -15.437 -11.291 -6.485 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.073 -9.675 -5.914 1.00 0.00 H new ATOM 0 HG SER A 107 -14.532 -9.953 -8.164 1.00 0.00 H new ATOM 817 N LYS A 108 -13.620 -13.484 -5.969 1.00 0.00 N ATOM 818 CA LYS A 108 -13.034 -14.699 -6.515 1.00 0.00 C ATOM 819 C LYS A 108 -12.612 -14.474 -7.957 1.00 0.00 C ATOM 820 O LYS A 108 -11.623 -15.037 -8.421 1.00 0.00 O ATOM 821 CB LYS A 108 -14.051 -15.847 -6.434 1.00 0.00 C ATOM 822 CG LYS A 108 -15.402 -15.408 -7.018 1.00 0.00 C ATOM 823 CD LYS A 108 -16.485 -15.508 -5.943 1.00 0.00 C ATOM 824 CE LYS A 108 -17.816 -15.022 -6.521 1.00 0.00 C ATOM 825 NZ LYS A 108 -17.689 -13.593 -6.929 1.00 0.00 N ATOM 0 H LYS A 108 -14.596 -13.576 -5.687 1.00 0.00 H new ATOM 0 HA LYS A 108 -12.152 -14.963 -5.931 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -13.676 -16.713 -6.980 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -14.179 -16.155 -5.396 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.335 -14.384 -7.386 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.662 -16.036 -7.870 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.579 -16.538 -5.599 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.210 -14.907 -5.076 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -18.097 -15.633 -7.379 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.608 -15.131 -5.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.631 -13.153 -6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -17.085 -13.090 -6.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -17.262 -13.539 -7.876 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.939 -18.743 -3.416 1.00 0.00 N ATOM 1238 CA TYR A 134 -12.819 -18.139 -2.420 1.00 0.00 C ATOM 1239 C TYR A 134 -12.545 -16.642 -2.285 1.00 0.00 C ATOM 1240 O TYR A 134 -11.452 -16.170 -2.595 1.00 0.00 O ATOM 1241 CB TYR A 134 -12.614 -18.822 -1.066 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.493 -20.050 -0.975 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -13.609 -20.913 -2.069 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -14.194 -20.318 0.205 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -14.426 -22.046 -1.985 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -15.012 -21.450 0.292 1.00 0.00 C ATOM 1247 CZ TYR A 134 -15.129 -22.315 -0.805 1.00 0.00 C ATOM 1248 OH TYR A 134 -15.939 -23.429 -0.725 1.00 0.00 O ATOM 0 HA TYR A 134 -13.850 -18.274 -2.747 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.568 -19.102 -0.944 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.855 -18.130 -0.259 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -13.067 -20.705 -2.980 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.104 -19.651 1.050 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -14.514 -22.712 -2.830 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -15.553 -21.657 1.204 1.00 0.00 H new ATOM 0 HH TYR A 134 -16.353 -23.469 0.162 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.542 -15.904 -1.805 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.396 -14.466 -1.612 1.00 0.00 C ATOM 1260 C ASP A 135 -12.236 -14.184 -0.666 1.00 0.00 C ATOM 1261 O ASP A 135 -12.031 -14.911 0.299 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.683 -13.896 -1.024 1.00 0.00 C ATOM 1263 CG ASP A 135 -15.836 -14.120 -1.993 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -15.769 -13.599 -3.094 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -16.759 -14.825 -1.630 1.00 0.00 O ATOM 0 H ASP A 135 -14.455 -16.276 -1.544 1.00 0.00 H new ATOM 0 HA ASP A 135 -13.195 -13.995 -2.575 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.900 -14.374 -0.069 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.563 -12.831 -0.827 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.474 -13.138 -0.967 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.320 -12.771 -0.156 1.00 0.00 C ATOM 1272 C ALA A 136 -10.443 -11.328 0.328 1.00 0.00 C ATOM 1273 O ALA A 136 -10.921 -10.462 -0.390 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.031 -12.939 -0.980 1.00 0.00 C ATOM 0 H ALA A 136 -11.636 -12.528 -1.769 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.281 -13.427 0.714 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.171 -12.664 -0.370 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -8.934 -13.978 -1.296 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.074 -12.295 -1.858 1.00 0.00 H new ATOM 1280 N TYR A 137 -9.995 -11.084 1.545 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.037 -9.742 2.119 1.00 0.00 C ATOM 1282 C TYR A 137 -8.617 -9.259 2.393 1.00 0.00 C ATOM 1283 O TYR A 137 -7.959 -9.750 3.304 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.830 -9.756 3.431 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.183 -9.148 3.216 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.326 -9.901 3.473 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.292 -7.842 2.744 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.582 -9.348 3.249 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.549 -7.285 2.528 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.695 -8.041 2.777 1.00 0.00 C ATOM 1291 OH TYR A 137 -15.937 -7.502 2.549 1.00 0.00 O ATOM 0 H TYR A 137 -9.597 -11.794 2.159 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.524 -9.070 1.413 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -10.935 -10.779 3.792 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.290 -9.201 4.198 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.237 -10.911 3.845 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.402 -7.263 2.546 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.470 -9.931 3.441 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.637 -6.270 2.169 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.586 -7.903 3.165 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.152 -8.308 1.596 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.804 -7.789 1.754 1.00 0.00 C ATOM 1303 C ILE A 138 -6.818 -6.619 2.736 1.00 0.00 C ATOM 1304 O ILE A 138 -7.344 -5.556 2.430 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.284 -7.304 0.394 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.498 -8.387 -0.670 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.799 -6.977 0.499 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.118 -7.856 -2.059 1.00 0.00 C ATOM 0 H ILE A 138 -8.686 -7.883 0.838 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.154 -8.576 2.136 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.834 -6.408 0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -5.896 -9.264 -0.432 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.540 -8.706 -0.668 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.433 -6.633 -0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.651 -6.194 1.243 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.250 -7.870 0.798 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.276 -8.637 -2.803 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.739 -6.994 -2.301 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.069 -7.560 -2.061 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.241 -6.821 3.909 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.214 -5.782 4.922 1.00 0.00 C ATOM 1322 C VAL A 139 -4.780 -5.419 5.258 1.00 0.00 C ATOM 1323 O VAL A 139 -3.877 -6.249 5.171 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.914 -6.279 6.186 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -8.322 -6.777 5.838 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -6.093 -7.410 6.804 1.00 0.00 C ATOM 0 H VAL A 139 -5.787 -7.693 4.182 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.729 -4.902 4.537 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.999 -5.463 6.903 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.817 -7.130 6.743 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.899 -5.961 5.404 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -8.252 -7.594 5.120 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.588 -7.768 7.706 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -6.005 -8.228 6.089 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -5.099 -7.041 7.058 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.587 -4.174 5.650 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.256 -3.709 6.010 1.00 0.00 C ATOM 1338 C GLU A 140 -3.118 -3.634 7.524 1.00 0.00 C ATOM 1339 O GLU A 140 -3.684 -2.749 8.167 1.00 0.00 O ATOM 1340 CB GLU A 140 -2.995 -2.325 5.401 1.00 0.00 C ATOM 1341 CG GLU A 140 -3.046 -2.415 3.875 1.00 0.00 C ATOM 1342 CD GLU A 140 -2.800 -1.042 3.257 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -2.664 -0.091 4.010 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -2.755 -0.961 2.041 1.00 0.00 O ATOM 0 H GLU A 140 -5.323 -3.472 5.728 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.524 -4.416 5.618 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.740 -1.614 5.758 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.021 -1.954 5.721 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.296 -3.121 3.520 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.017 -2.796 3.558 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.368 -4.571 8.092 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.177 -4.600 9.534 1.00 0.00 C ATOM 1353 C ALA A 141 -1.257 -3.471 9.982 1.00 0.00 C ATOM 1354 O ALA A 141 -0.307 -3.114 9.285 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.584 -5.946 9.955 1.00 0.00 C ATOM 0 H ALA A 141 -1.888 -5.312 7.582 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.148 -4.466 10.010 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.444 -5.960 11.036 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.263 -6.749 9.667 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.622 -6.090 9.463 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.532 -2.923 11.159 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.706 -1.848 11.695 1.00 0.00 C ATOM 1363 C ASN A 142 0.665 -2.366 12.083 1.00 0.00 C ATOM 1364 O ASN A 142 0.893 -2.691 13.242 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.358 -1.239 12.934 1.00 0.00 C ATOM 1366 CG ASN A 142 -2.068 0.053 12.574 1.00 0.00 C ATOM 1367 OD1 ASN A 142 -1.422 1.078 12.361 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -3.363 0.067 12.505 1.00 0.00 N ATOM 0 H ASN A 142 -2.312 -3.201 11.755 1.00 0.00 H new ATOM 0 HA ASN A 142 -0.607 -1.091 10.917 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.069 -1.945 13.364 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -0.601 -1.046 13.694 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -3.852 0.932 12.273 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -3.892 -0.787 12.683 1.00 0.00 H new ATOM 1375 N ALA A 143 1.550 -2.447 11.095 1.00 0.00 N ATOM 1376 CA ALA A 143 2.919 -2.929 11.289 1.00 0.00 C ATOM 1377 C ALA A 143 2.992 -4.439 11.071 1.00 0.00 C ATOM 1378 O ALA A 143 1.984 -5.135 11.176 1.00 0.00 O ATOM 1379 CB ALA A 143 3.444 -2.588 12.688 1.00 0.00 C ATOM 0 H ALA A 143 1.340 -2.180 10.133 1.00 0.00 H new ATOM 0 HA ALA A 143 3.547 -2.425 10.554 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.462 -2.961 12.795 1.00 0.00 H new ATOM 0 HB2 ALA A 143 3.437 -1.507 12.826 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.806 -3.053 13.439 1.00 0.00 H new ATOM 1385 N PRO A 144 4.156 -4.954 10.761 1.00 0.00 N ATOM 1386 CA PRO A 144 4.357 -6.415 10.517 1.00 0.00 C ATOM 1387 C PRO A 144 3.993 -7.265 11.726 1.00 0.00 C ATOM 1388 O PRO A 144 3.690 -8.448 11.593 1.00 0.00 O ATOM 1389 CB PRO A 144 5.846 -6.540 10.191 1.00 0.00 C ATOM 1390 CG PRO A 144 6.283 -5.170 9.805 1.00 0.00 C ATOM 1391 CD PRO A 144 5.418 -4.212 10.609 1.00 0.00 C ATOM 0 HA PRO A 144 3.712 -6.778 9.717 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.407 -6.903 11.052 1.00 0.00 H new ATOM 0 HB3 PRO A 144 6.012 -7.249 9.380 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.340 -5.021 10.026 1.00 0.00 H new ATOM 0 HG3 PRO A 144 6.155 -5.007 8.735 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.866 -3.976 11.574 1.00 0.00 H new ATOM 0 HD3 PRO A 144 5.270 -3.267 10.087 1.00 0.00 H new ATOM 1399 N ASN A 145 4.045 -6.664 12.906 1.00 0.00 N ATOM 1400 CA ASN A 145 3.732 -7.384 14.133 1.00 0.00 C ATOM 1401 C ASN A 145 2.221 -7.493 14.342 1.00 0.00 C ATOM 1402 O ASN A 145 1.763 -8.213 15.230 1.00 0.00 O ATOM 1403 CB ASN A 145 4.359 -6.660 15.318 1.00 0.00 C ATOM 1404 CG ASN A 145 5.879 -6.710 15.213 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.520 -5.683 14.987 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.499 -7.847 15.373 1.00 0.00 N ATOM 0 H ASN A 145 4.299 -5.685 13.040 1.00 0.00 H new ATOM 0 HA ASN A 145 4.138 -8.392 14.052 1.00 0.00 H new ATOM 0 HB2 ASN A 145 4.022 -5.624 15.342 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.035 -7.122 16.250 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.516 -7.886 15.311 1.00 0.00 H new ATOM 0 HD22 ASN A 145 5.966 -8.696 15.560 1.00 0.00 H new ATOM 1413 N ASP A 146 1.445 -6.770 13.536 1.00 0.00 N ATOM 1414 CA ASP A 146 -0.006 -6.798 13.660 1.00 0.00 C ATOM 1415 C ASP A 146 -0.624 -7.761 12.656 1.00 0.00 C ATOM 1416 O ASP A 146 -1.754 -8.200 12.828 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.571 -5.398 13.418 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.450 -4.563 14.693 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.088 -5.074 15.660 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.926 -3.440 14.695 1.00 0.00 O ATOM 0 H ASP A 146 1.796 -6.162 12.796 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.252 -7.135 14.667 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.032 -4.914 12.603 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.616 -5.465 13.114 1.00 0.00 H new ATOM 1425 N VAL A 147 0.118 -8.086 11.611 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.379 -8.991 10.582 1.00 0.00 C ATOM 1427 C VAL A 147 -0.857 -10.278 11.224 1.00 0.00 C ATOM 1428 O VAL A 147 -1.800 -10.913 10.751 1.00 0.00 O ATOM 1429 CB VAL A 147 0.743 -9.294 9.576 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.346 -7.979 9.069 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.836 -10.149 10.248 1.00 0.00 C ATOM 0 H VAL A 147 1.064 -7.739 11.451 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.212 -8.522 10.058 1.00 0.00 H new ATOM 0 HB VAL A 147 0.330 -9.849 8.734 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.142 -8.195 8.356 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.571 -7.388 8.581 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.755 -7.418 9.910 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.627 -10.359 9.528 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.252 -9.606 11.097 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.402 -11.087 10.595 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.209 -10.647 12.315 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.589 -11.865 13.029 1.00 0.00 C ATOM 1443 C LYS A 148 -1.856 -11.643 13.843 1.00 0.00 C ATOM 1444 O LYS A 148 -2.675 -12.548 14.005 1.00 0.00 O ATOM 1445 CB LYS A 148 0.545 -12.311 13.954 1.00 0.00 C ATOM 1446 CG LYS A 148 0.694 -11.313 15.100 1.00 0.00 C ATOM 1447 CD LYS A 148 1.973 -11.614 15.879 1.00 0.00 C ATOM 1448 CE LYS A 148 1.826 -12.947 16.618 1.00 0.00 C ATOM 1449 NZ LYS A 148 3.030 -13.180 17.465 1.00 0.00 N ATOM 0 H LYS A 148 0.571 -10.134 12.725 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.780 -12.644 12.291 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.336 -13.305 14.349 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.478 -12.380 13.395 1.00 0.00 H new ATOM 0 HG2 LYS A 148 0.726 -10.296 14.708 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -0.170 -11.373 15.762 1.00 0.00 H new ATOM 0 HD2 LYS A 148 2.823 -11.656 15.198 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.174 -10.813 16.590 1.00 0.00 H new ATOM 0 HE2 LYS A 148 0.929 -12.935 17.237 1.00 0.00 H new ATOM 0 HE3 LYS A 148 1.708 -13.761 15.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 2.931 -14.085 17.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 3.878 -13.209 16.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 3.123 -12.409 18.156 1.00 0.00 H new ATOM 1463 N THR A 149 -2.011 -10.426 14.336 1.00 0.00 N ATOM 1464 CA THR A 149 -3.182 -10.061 15.125 1.00 0.00 C ATOM 1465 C THR A 149 -4.410 -9.937 14.232 1.00 0.00 C ATOM 1466 O THR A 149 -5.523 -10.279 14.619 1.00 0.00 O ATOM 1467 CB THR A 149 -2.932 -8.748 15.875 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.800 -8.899 16.723 1.00 0.00 O ATOM 1469 CG2 THR A 149 -4.155 -8.404 16.726 1.00 0.00 C ATOM 0 H THR A 149 -1.340 -9.669 14.205 1.00 0.00 H new ATOM 0 HA THR A 149 -3.365 -10.849 15.856 1.00 0.00 H new ATOM 0 HB THR A 149 -2.751 -7.949 15.156 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.636 -8.060 17.203 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.976 -7.470 17.259 1.00 0.00 H new ATOM 0 HG22 THR A 149 -5.027 -8.293 16.082 1.00 0.00 H new ATOM 0 HG23 THR A 149 -4.335 -9.203 17.445 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.206 -9.408 13.045 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.302 -9.226 12.117 1.00 0.00 C ATOM 1479 C ILE A 150 -5.764 -10.569 11.576 1.00 0.00 C ATOM 1480 O ILE A 150 -6.961 -10.807 11.420 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.868 -8.321 10.965 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.404 -6.967 11.519 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -6.036 -8.112 10.006 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.516 -6.292 12.322 1.00 0.00 C ATOM 0 H ILE A 150 -3.297 -9.098 12.701 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.132 -8.756 12.645 1.00 0.00 H new ATOM 0 HB ILE A 150 -4.044 -8.792 10.429 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.529 -7.110 12.153 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -4.100 -6.319 10.697 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.722 -7.466 9.186 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.356 -9.075 9.608 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.865 -7.646 10.538 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.160 -5.335 12.703 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.381 -6.128 11.679 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.801 -6.931 13.157 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.812 -11.440 11.288 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.138 -12.755 10.759 1.00 0.00 C ATOM 1498 C ALA A 151 -5.837 -13.604 11.810 1.00 0.00 C ATOM 1499 O ALA A 151 -6.783 -14.335 11.509 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.866 -13.460 10.292 1.00 0.00 C ATOM 0 H ALA A 151 -3.815 -11.264 11.410 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.813 -12.624 9.913 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.119 -14.444 9.897 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.388 -12.868 9.512 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.182 -13.572 11.133 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.361 -13.508 13.043 1.00 0.00 N ATOM 1507 CA GLU A 152 -5.944 -14.294 14.125 1.00 0.00 C ATOM 1508 C GLU A 152 -7.286 -13.711 14.553 1.00 0.00 C ATOM 1509 O GLU A 152 -8.184 -14.437 14.983 1.00 0.00 O ATOM 1510 CB GLU A 152 -4.973 -14.354 15.316 1.00 0.00 C ATOM 1511 CG GLU A 152 -4.976 -13.016 16.050 1.00 0.00 C ATOM 1512 CD GLU A 152 -6.047 -12.997 17.140 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -6.295 -14.038 17.725 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -6.610 -11.938 17.366 1.00 0.00 O ATOM 0 H GLU A 152 -4.586 -12.905 13.318 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.117 -15.308 13.765 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.266 -15.154 15.996 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -3.967 -14.586 14.966 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -3.996 -12.837 16.493 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -5.158 -12.208 15.341 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.414 -12.397 14.431 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.648 -11.718 14.797 1.00 0.00 C ATOM 1523 C ASP A 153 -9.695 -11.895 13.705 1.00 0.00 C ATOM 1524 O ASP A 153 -10.885 -12.045 13.980 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.375 -10.232 15.036 1.00 0.00 C ATOM 1526 CG ASP A 153 -9.620 -9.562 15.604 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -10.626 -10.240 15.738 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -9.553 -8.378 15.892 1.00 0.00 O ATOM 0 H ASP A 153 -6.679 -11.781 14.082 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.032 -12.158 15.717 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.540 -10.113 15.726 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -8.087 -9.751 14.101 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.234 -11.873 12.459 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.123 -12.028 11.319 1.00 0.00 C ATOM 1535 C ALA A 154 -10.731 -13.420 11.289 1.00 0.00 C ATOM 1536 O ALA A 154 -11.882 -13.596 10.893 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.373 -11.760 10.016 1.00 0.00 C ATOM 0 H ALA A 154 -8.251 -11.749 12.216 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.929 -11.301 11.421 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.054 -11.880 9.173 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -8.982 -10.743 10.024 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.548 -12.465 9.920 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.943 -14.409 11.689 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.412 -15.789 11.682 1.00 0.00 C ATOM 1545 C LYS A 155 -11.594 -15.963 12.630 1.00 0.00 C ATOM 1546 O LYS A 155 -12.315 -16.959 12.562 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.281 -16.726 12.095 1.00 0.00 C ATOM 1548 CG LYS A 155 -9.374 -17.023 13.593 1.00 0.00 C ATOM 1549 CD LYS A 155 -8.088 -17.698 14.069 1.00 0.00 C ATOM 1550 CE LYS A 155 -7.824 -18.956 13.235 1.00 0.00 C ATOM 1551 NZ LYS A 155 -9.021 -19.849 13.287 1.00 0.00 N ATOM 0 H LYS A 155 -8.986 -14.285 12.019 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.737 -16.035 10.671 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -9.340 -17.654 11.527 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -8.318 -16.272 11.864 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -9.536 -16.098 14.147 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -10.229 -17.668 13.792 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -7.249 -17.008 13.979 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.173 -17.961 15.123 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.606 -18.682 12.203 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -6.948 -19.481 13.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -8.714 -20.842 13.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -9.558 -19.659 14.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -9.626 -19.667 12.461 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.791 -14.990 13.509 1.00 0.00 N ATOM 1566 CA LYS A 156 -12.895 -15.039 14.461 1.00 0.00 C ATOM 1567 C LYS A 156 -14.096 -14.235 13.954 1.00 0.00 C ATOM 1568 O LYS A 156 -15.083 -14.067 14.670 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.445 -14.491 15.812 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.451 -15.463 16.451 1.00 0.00 C ATOM 1571 CD LYS A 156 -11.114 -14.991 17.864 1.00 0.00 C ATOM 1572 CE LYS A 156 -10.261 -13.723 17.792 1.00 0.00 C ATOM 1573 NZ LYS A 156 -9.893 -13.293 19.169 1.00 0.00 N ATOM 0 H LYS A 156 -11.204 -14.159 13.584 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.199 -16.080 14.572 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -11.982 -13.513 15.684 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.306 -14.353 16.466 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -11.876 -16.466 16.483 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -10.544 -15.520 15.849 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -12.030 -14.794 18.421 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -10.577 -15.773 18.401 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -9.362 -13.910 17.205 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -10.812 -12.930 17.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -9.313 -12.431 19.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -10.757 -13.099 19.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -9.352 -14.048 19.636 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.006 -13.740 12.722 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.086 -12.959 12.138 1.00 0.00 C ATOM 1589 C ILE A 157 -16.022 -13.853 11.339 1.00 0.00 C ATOM 1590 O ILE A 157 -15.578 -14.629 10.489 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.511 -11.877 11.225 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.797 -10.822 12.074 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.637 -11.227 10.421 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -13.025 -9.861 11.165 1.00 0.00 C ATOM 0 H ILE A 157 -13.198 -13.867 12.113 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.650 -12.493 12.946 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.797 -12.325 10.534 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.523 -10.269 12.670 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -13.113 -11.305 12.772 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.222 -10.456 9.771 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.135 -11.984 9.814 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.358 -10.777 11.103 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -12.519 -9.112 11.774 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -12.287 -10.419 10.588 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.719 -9.367 10.485 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.318 -13.724 11.610 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.329 -14.508 10.909 1.00 0.00 C ATOM 1608 C GLU A 158 -17.903 -15.980 10.781 1.00 0.00 C ATOM 1609 O GLU A 158 -17.661 -16.647 11.786 1.00 0.00 O ATOM 1610 CB GLU A 158 -18.586 -13.905 9.527 1.00 0.00 C ATOM 1611 CG GLU A 158 -18.988 -12.441 9.653 1.00 0.00 C ATOM 1612 CD GLU A 158 -19.931 -12.080 8.514 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -19.686 -12.524 7.404 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -20.897 -11.382 8.770 1.00 0.00 O ATOM 0 H GLU A 158 -17.692 -13.084 12.310 1.00 0.00 H new ATOM 0 HA GLU A 158 -19.250 -14.479 11.491 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -17.689 -13.991 8.913 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -19.374 -14.463 9.021 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -19.474 -12.267 10.613 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.103 -11.805 9.624 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.803 -16.477 9.545 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.402 -17.852 9.318 1.00 0.00 C ATOM 1623 C GLY A 159 -16.228 -17.920 8.356 1.00 0.00 C ATOM 1624 O GLY A 159 -16.299 -18.603 7.338 1.00 0.00 O ATOM 0 H GLY A 159 -17.995 -15.945 8.696 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -17.129 -18.317 10.265 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.241 -18.419 8.915 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.150 -17.201 8.683 1.00 0.00 N ATOM 1629 CA VAL A 160 -13.960 -17.192 7.835 1.00 0.00 C ATOM 1630 C VAL A 160 -13.618 -18.611 7.403 1.00 0.00 C ATOM 1631 O VAL A 160 -13.821 -19.561 8.160 1.00 0.00 O ATOM 1632 CB VAL A 160 -12.777 -16.579 8.601 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -11.510 -17.423 8.395 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -12.522 -15.162 8.082 1.00 0.00 C ATOM 0 H VAL A 160 -15.079 -16.624 9.521 1.00 0.00 H new ATOM 0 HA VAL A 160 -14.161 -16.590 6.949 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.019 -16.555 9.663 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -10.681 -16.975 8.944 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -11.683 -18.435 8.761 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -11.265 -17.458 7.333 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -11.684 -14.722 8.622 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -12.288 -15.201 7.018 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -13.412 -14.552 8.236 1.00 0.00 H new ATOM 1644 N SER A 161 -13.087 -18.755 6.194 1.00 0.00 N ATOM 1645 CA SER A 161 -12.714 -20.067 5.696 1.00 0.00 C ATOM 1646 C SER A 161 -11.224 -20.316 5.915 1.00 0.00 C ATOM 1647 O SER A 161 -10.811 -21.445 6.185 1.00 0.00 O ATOM 1648 CB SER A 161 -13.023 -20.157 4.203 1.00 0.00 C ATOM 1649 OG SER A 161 -12.160 -19.281 3.484 1.00 0.00 O ATOM 0 H SER A 161 -12.908 -17.986 5.549 1.00 0.00 H new ATOM 0 HA SER A 161 -13.285 -20.820 6.239 1.00 0.00 H new ATOM 0 HB2 SER A 161 -12.891 -21.181 3.855 1.00 0.00 H new ATOM 0 HB3 SER A 161 -14.064 -19.890 4.020 1.00 0.00 H new ATOM 0 HG SER A 161 -11.421 -19.795 3.097 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.415 -19.261 5.790 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.971 -19.401 5.967 1.00 0.00 C ATOM 1657 C GLU A 162 -8.308 -18.034 6.017 1.00 0.00 C ATOM 1658 O GLU A 162 -8.868 -17.051 5.557 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.386 -20.221 4.815 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.979 -20.685 5.188 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.470 -21.702 4.171 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -7.222 -22.038 3.271 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.336 -22.132 4.308 1.00 0.00 O ATOM 0 H GLU A 162 -10.730 -18.316 5.571 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.781 -19.915 6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.022 -21.082 4.607 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.354 -19.621 3.906 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.305 -19.829 5.226 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.987 -21.129 6.184 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.116 -17.978 6.589 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.381 -16.723 6.696 1.00 0.00 C ATOM 1672 C VAL A 163 -4.939 -16.904 6.241 1.00 0.00 C ATOM 1673 O VAL A 163 -4.332 -17.949 6.476 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.405 -16.232 8.143 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -7.632 -15.349 8.366 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -6.465 -17.431 9.093 1.00 0.00 C ATOM 0 H VAL A 163 -6.635 -18.785 6.987 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.860 -15.985 6.052 1.00 0.00 H new ATOM 0 HB VAL A 163 -5.501 -15.656 8.340 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -7.647 -15.000 9.399 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -7.590 -14.492 7.694 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -8.536 -15.924 8.165 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -6.482 -17.078 10.124 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -7.367 -18.009 8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -5.589 -18.061 8.940 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.396 -15.881 5.589 1.00 0.00 N ATOM 1687 CA GLN A 164 -3.024 -15.940 5.105 1.00 0.00 C ATOM 1688 C GLN A 164 -2.327 -14.599 5.309 1.00 0.00 C ATOM 1689 O GLN A 164 -2.870 -13.552 4.969 1.00 0.00 O ATOM 1690 CB GLN A 164 -3.012 -16.310 3.620 1.00 0.00 C ATOM 1691 CG GLN A 164 -1.709 -15.825 2.986 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.515 -16.476 1.621 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -2.482 -16.916 0.998 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -0.314 -16.567 1.116 1.00 0.00 N ATOM 0 H GLN A 164 -4.882 -15.008 5.385 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.488 -16.702 5.671 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -3.107 -17.389 3.502 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.865 -15.858 3.114 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -1.729 -14.740 2.880 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -0.868 -16.067 3.635 1.00 0.00 H new ATOM 0 HE21 GLN A 164 0.486 -16.202 1.633 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -0.176 -17.003 0.204 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.121 -14.636 5.861 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.362 -13.411 6.096 1.00 0.00 C ATOM 1705 C ASP A 165 0.946 -13.432 5.312 1.00 0.00 C ATOM 1706 O ASP A 165 1.742 -14.362 5.441 1.00 0.00 O ATOM 1707 CB ASP A 165 -0.065 -13.262 7.587 1.00 0.00 C ATOM 1708 CG ASP A 165 -0.445 -14.541 8.324 1.00 0.00 C ATOM 1709 OD1 ASP A 165 0.208 -15.547 8.097 1.00 0.00 O ATOM 1710 OD2 ASP A 165 -1.383 -14.497 9.102 1.00 0.00 O ATOM 0 H ASP A 165 -0.649 -15.492 6.153 1.00 0.00 H new ATOM 0 HA ASP A 165 -0.959 -12.564 5.758 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.993 -13.047 7.736 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.622 -12.418 7.995 1.00 0.00 H new ATOM 1715 N GLY A 166 1.164 -12.401 4.499 1.00 0.00 N ATOM 1716 CA GLY A 166 2.382 -12.319 3.700 1.00 0.00 C ATOM 1717 C GLY A 166 3.617 -12.266 4.590 1.00 0.00 C ATOM 1718 O GLY A 166 4.620 -12.927 4.317 1.00 0.00 O ATOM 0 H GLY A 166 0.520 -11.619 4.377 1.00 0.00 H new ATOM 0 HA2 GLY A 166 2.444 -13.181 3.036 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.347 -11.432 3.067 1.00 0.00 H new