USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=15 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 Set 1.1: A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 149 THR OG1 : rot 180:sc= 0 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 -24:sc= 0.581 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -1.83 K(o=-1.8,f=-5.1!) USER MOD Single : A 97 MET CE :methyl 179:sc= -2.62 (180deg=-2.62) USER MOD Single : A 98 SER OG : rot 180:sc= -0.546 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 30:sc= -0.71 USER MOD Single : A 142 ASN : amide:sc= -0.259 K(o=-0.26,f=-2) USER MOD Single : A 145 ASN : amide:sc= -0.0743 X(o=-0.074,f=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 179:sc= 0.0699 (180deg=0.0698) USER MOD Single : A 161 SER OG : rot -155:sc= 0.207 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.696 -7.183 4.514 1.00 0.00 N ATOM 32 CA ARG A 59 -0.300 -7.753 3.622 1.00 0.00 C ATOM 33 C ARG A 59 -1.000 -8.940 4.262 1.00 0.00 C ATOM 34 O ARG A 59 -0.394 -9.985 4.461 1.00 0.00 O ATOM 35 CB ARG A 59 0.373 -8.201 2.321 1.00 0.00 C ATOM 36 CG ARG A 59 -0.582 -9.072 1.496 1.00 0.00 C ATOM 37 CD ARG A 59 -1.854 -8.279 1.197 1.00 0.00 C ATOM 38 NE ARG A 59 -2.574 -8.904 0.096 1.00 0.00 N ATOM 39 CZ ARG A 59 -2.195 -8.715 -1.168 1.00 0.00 C ATOM 40 NH1 ARG A 59 -1.154 -7.970 -1.445 1.00 0.00 N ATOM 41 NH2 ARG A 59 -2.863 -9.281 -2.138 1.00 0.00 N ATOM 0 HA ARG A 59 -1.047 -6.987 3.413 1.00 0.00 H new ATOM 0 HB2 ARG A 59 0.673 -7.329 1.740 1.00 0.00 H new ATOM 0 HB3 ARG A 59 1.281 -8.760 2.548 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -0.103 -9.378 0.566 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -0.827 -9.983 2.043 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.487 -8.241 2.083 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -1.601 -7.250 0.941 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.381 -9.496 0.295 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -0.627 -7.530 -0.691 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.870 -7.830 -2.415 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -3.672 -9.865 -1.927 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.576 -9.138 -3.106 1.00 0.00 H new ATOM 55 N VAL A 60 -2.281 -8.777 4.572 1.00 0.00 N ATOM 56 CA VAL A 60 -3.049 -9.855 5.176 1.00 0.00 C ATOM 57 C VAL A 60 -4.272 -10.159 4.318 1.00 0.00 C ATOM 58 O VAL A 60 -4.962 -9.257 3.869 1.00 0.00 O ATOM 59 CB VAL A 60 -3.486 -9.461 6.581 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.204 -10.638 7.241 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.257 -9.074 7.403 1.00 0.00 C ATOM 0 H VAL A 60 -2.805 -7.916 4.416 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.424 -10.746 5.238 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.167 -8.611 6.529 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.517 -10.356 8.246 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.080 -10.907 6.651 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.528 -11.491 7.297 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.566 -8.791 8.409 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.574 -9.922 7.458 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.752 -8.232 6.929 1.00 0.00 H new ATOM 71 N VAL A 61 -4.527 -11.432 4.085 1.00 0.00 N ATOM 72 CA VAL A 61 -5.667 -11.835 3.265 1.00 0.00 C ATOM 73 C VAL A 61 -6.602 -12.755 4.049 1.00 0.00 C ATOM 74 O VAL A 61 -6.177 -13.779 4.583 1.00 0.00 O ATOM 75 CB VAL A 61 -5.175 -12.566 2.012 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.371 -13.007 1.165 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.289 -11.627 1.190 1.00 0.00 C ATOM 0 H VAL A 61 -3.968 -12.205 4.446 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.214 -10.937 2.978 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.602 -13.444 2.310 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.015 -13.526 0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -7.002 -13.677 1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.949 -12.132 0.868 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.938 -12.146 0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.864 -10.749 0.896 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.433 -11.317 1.789 1.00 0.00 H new ATOM 87 N VAL A 62 -7.878 -12.400 4.094 1.00 0.00 N ATOM 88 CA VAL A 62 -8.863 -13.217 4.799 1.00 0.00 C ATOM 89 C VAL A 62 -9.786 -13.904 3.791 1.00 0.00 C ATOM 90 O VAL A 62 -10.543 -13.245 3.091 1.00 0.00 O ATOM 91 CB VAL A 62 -9.695 -12.336 5.742 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.742 -13.192 6.449 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.771 -11.692 6.779 1.00 0.00 C ATOM 0 H VAL A 62 -8.256 -11.560 3.656 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.341 -13.975 5.383 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.196 -11.557 5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.332 -12.566 7.118 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.398 -13.650 5.709 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.245 -13.972 7.026 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.358 -11.066 7.450 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.271 -12.471 7.354 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.025 -11.080 6.272 1.00 0.00 H new ATOM 103 N TYR A 63 -9.734 -15.224 3.737 1.00 0.00 N ATOM 104 CA TYR A 63 -10.559 -16.000 2.834 1.00 0.00 C ATOM 105 C TYR A 63 -11.925 -16.251 3.460 1.00 0.00 C ATOM 106 O TYR A 63 -12.039 -16.588 4.636 1.00 0.00 O ATOM 107 CB TYR A 63 -9.878 -17.341 2.530 1.00 0.00 C ATOM 108 CG TYR A 63 -8.699 -17.111 1.616 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.548 -16.477 2.102 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.752 -17.538 0.286 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.455 -16.266 1.255 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.658 -17.329 -0.557 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.511 -16.691 -0.076 1.00 0.00 C ATOM 114 OH TYR A 63 -5.433 -16.480 -0.914 1.00 0.00 O ATOM 0 H TYR A 63 -9.116 -15.787 4.321 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.688 -15.442 1.907 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.547 -17.811 3.456 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.587 -18.023 2.061 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.505 -16.151 3.131 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.638 -18.029 -0.089 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.569 -15.775 1.629 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.698 -17.661 -1.584 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.636 -16.837 -1.804 1.00 0.00 H new ATOM 124 N ILE A 64 -12.951 -16.079 2.661 1.00 0.00 N ATOM 125 CA ILE A 64 -14.321 -16.276 3.124 1.00 0.00 C ATOM 126 C ILE A 64 -14.898 -17.553 2.537 1.00 0.00 C ATOM 127 O ILE A 64 -14.410 -18.038 1.518 1.00 0.00 O ATOM 128 CB ILE A 64 -15.190 -15.085 2.715 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.327 -13.827 2.604 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.270 -14.861 3.779 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.215 -12.611 2.327 1.00 0.00 C ATOM 0 H ILE A 64 -12.872 -15.802 1.682 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.311 -16.358 4.211 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.654 -15.291 1.750 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.767 -13.677 3.527 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.597 -13.945 1.803 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -16.892 -14.013 3.493 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -16.889 -15.754 3.862 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -15.797 -14.656 4.740 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.595 -11.718 2.249 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.755 -12.760 1.392 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.928 -12.488 3.142 1.00 0.00 H new ATOM 143 N ARG A 65 -15.930 -18.100 3.201 1.00 0.00 N ATOM 144 CA ARG A 65 -16.573 -19.329 2.740 1.00 0.00 C ATOM 145 C ARG A 65 -16.719 -19.310 1.233 1.00 0.00 C ATOM 146 O ARG A 65 -16.740 -18.230 0.641 1.00 0.00 O ATOM 147 CB ARG A 65 -17.952 -19.471 3.371 1.00 0.00 C ATOM 148 CG ARG A 65 -17.930 -20.581 4.413 1.00 0.00 C ATOM 149 CD ARG A 65 -17.327 -20.051 5.703 1.00 0.00 C ATOM 150 NE ARG A 65 -18.022 -20.605 6.858 1.00 0.00 N ATOM 151 CZ ARG A 65 -17.496 -20.539 8.080 1.00 0.00 C ATOM 152 NH1 ARG A 65 -16.330 -19.976 8.272 1.00 0.00 N ATOM 153 NH2 ARG A 65 -18.150 -21.036 9.096 1.00 0.00 N ATOM 0 H ARG A 65 -16.331 -17.709 4.053 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.949 -20.173 3.035 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.249 -18.530 3.835 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.692 -19.695 2.603 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -18.941 -20.945 4.594 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -17.348 -21.427 4.047 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -16.269 -20.309 5.750 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.390 -18.963 5.721 1.00 0.00 H new ATOM 0 HE ARG A 65 -18.929 -21.052 6.728 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -15.817 -19.584 7.483 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.934 -19.930 9.211 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -19.060 -21.473 8.952 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.750 -20.987 10.033 1.00 0.00 H new ATOM 517 N LYS A 89 -20.699 -7.085 6.007 1.00 0.00 N ATOM 518 CA LYS A 89 -20.553 -7.409 7.412 1.00 0.00 C ATOM 519 C LYS A 89 -19.100 -7.710 7.743 1.00 0.00 C ATOM 520 O LYS A 89 -18.572 -7.246 8.750 1.00 0.00 O ATOM 521 CB LYS A 89 -21.429 -8.618 7.752 1.00 0.00 C ATOM 522 CG LYS A 89 -21.384 -8.895 9.255 1.00 0.00 C ATOM 523 CD LYS A 89 -22.138 -7.786 9.996 1.00 0.00 C ATOM 524 CE LYS A 89 -22.305 -8.179 11.464 1.00 0.00 C ATOM 525 NZ LYS A 89 -23.035 -7.100 12.188 1.00 0.00 N ATOM 0 HA LYS A 89 -20.870 -6.552 8.006 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.456 -8.431 7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.083 -9.493 7.203 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.834 -9.864 9.472 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -20.350 -8.940 9.598 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -21.592 -6.846 9.920 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -23.114 -7.626 9.538 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -22.854 -9.118 11.540 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.329 -8.342 11.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -23.149 -7.367 13.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -22.495 -6.214 12.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -23.972 -6.965 11.757 1.00 0.00 H new ATOM 539 N VAL A 90 -18.459 -8.478 6.875 1.00 0.00 N ATOM 540 CA VAL A 90 -17.057 -8.837 7.067 1.00 0.00 C ATOM 541 C VAL A 90 -16.173 -7.613 6.850 1.00 0.00 C ATOM 542 O VAL A 90 -15.198 -7.395 7.564 1.00 0.00 O ATOM 543 CB VAL A 90 -16.651 -9.956 6.110 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.154 -10.235 6.260 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.443 -11.224 6.441 1.00 0.00 C ATOM 0 H VAL A 90 -18.883 -8.865 6.032 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.927 -9.195 8.088 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.864 -9.653 5.085 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.863 -11.033 5.578 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.590 -9.332 6.024 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.941 -10.538 7.285 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -17.153 -12.023 5.758 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.231 -11.528 7.466 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.509 -11.025 6.335 1.00 0.00 H new ATOM 555 N TYR A 91 -16.540 -6.805 5.868 1.00 0.00 N ATOM 556 CA TYR A 91 -15.797 -5.593 5.561 1.00 0.00 C ATOM 557 C TYR A 91 -15.840 -4.638 6.741 1.00 0.00 C ATOM 558 O TYR A 91 -14.829 -4.047 7.117 1.00 0.00 O ATOM 559 CB TYR A 91 -16.365 -4.910 4.310 1.00 0.00 C ATOM 560 CG TYR A 91 -15.671 -3.585 4.105 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.310 -3.547 3.776 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.393 -2.395 4.229 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.674 -2.316 3.575 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.754 -1.164 4.031 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.395 -1.125 3.704 1.00 0.00 C ATOM 566 OH TYR A 91 -13.765 0.087 3.510 1.00 0.00 O ATOM 0 H TYR A 91 -17.349 -6.967 5.269 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.761 -5.867 5.364 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.222 -5.547 3.437 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.439 -4.758 4.421 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.752 -4.466 3.677 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.444 -2.424 4.477 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.625 -2.286 3.320 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.311 -0.244 4.131 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.409 0.815 3.636 1.00 0.00 H new ATOM 576 N ASP A 92 -17.025 -4.493 7.319 1.00 0.00 N ATOM 577 CA ASP A 92 -17.205 -3.594 8.455 1.00 0.00 C ATOM 578 C ASP A 92 -16.419 -4.093 9.661 1.00 0.00 C ATOM 579 O ASP A 92 -15.820 -3.309 10.400 1.00 0.00 O ATOM 580 CB ASP A 92 -18.688 -3.483 8.816 1.00 0.00 C ATOM 581 CG ASP A 92 -18.886 -2.435 9.906 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.642 -1.269 9.637 1.00 0.00 O ATOM 583 OD2 ASP A 92 -19.281 -2.812 10.998 1.00 0.00 O ATOM 0 H ASP A 92 -17.871 -4.981 7.024 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.832 -2.609 8.173 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.266 -3.213 7.932 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -19.060 -4.449 9.158 1.00 0.00 H new ATOM 588 N SER A 93 -16.430 -5.407 9.851 1.00 0.00 N ATOM 589 CA SER A 93 -15.716 -6.014 10.975 1.00 0.00 C ATOM 590 C SER A 93 -14.209 -5.864 10.791 1.00 0.00 C ATOM 591 O SER A 93 -13.465 -5.666 11.754 1.00 0.00 O ATOM 592 CB SER A 93 -16.080 -7.492 11.098 1.00 0.00 C ATOM 593 OG SER A 93 -15.617 -8.183 9.952 1.00 0.00 O ATOM 0 H SER A 93 -16.919 -6.070 9.250 1.00 0.00 H new ATOM 0 HA SER A 93 -16.012 -5.500 11.889 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.633 -7.915 11.998 1.00 0.00 H new ATOM 0 HB3 SER A 93 -17.160 -7.606 11.195 1.00 0.00 H new ATOM 0 HG SER A 93 -15.529 -7.555 9.205 1.00 0.00 H new ATOM 599 N LEU A 94 -13.764 -5.963 9.549 1.00 0.00 N ATOM 600 CA LEU A 94 -12.344 -5.830 9.244 1.00 0.00 C ATOM 601 C LEU A 94 -11.931 -4.362 9.228 1.00 0.00 C ATOM 602 O LEU A 94 -10.745 -4.043 9.312 1.00 0.00 O ATOM 603 CB LEU A 94 -12.037 -6.462 7.882 1.00 0.00 C ATOM 604 CG LEU A 94 -12.226 -7.980 7.960 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.141 -8.580 6.559 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.126 -8.584 8.840 1.00 0.00 C ATOM 0 H LEU A 94 -14.359 -6.134 8.738 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.779 -6.346 10.020 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.694 -6.043 7.120 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.015 -6.228 7.585 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.203 -8.202 8.390 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.276 -9.660 6.617 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.921 -8.150 5.931 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.165 -8.359 6.127 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.258 -9.664 8.897 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.151 -8.360 8.408 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.186 -8.158 9.841 1.00 0.00 H new ATOM 618 N LYS A 95 -12.916 -3.475 9.115 1.00 0.00 N ATOM 619 CA LYS A 95 -12.645 -2.048 9.085 1.00 0.00 C ATOM 620 C LYS A 95 -12.561 -1.476 10.497 1.00 0.00 C ATOM 621 O LYS A 95 -11.757 -0.583 10.772 1.00 0.00 O ATOM 622 CB LYS A 95 -13.751 -1.320 8.320 1.00 0.00 C ATOM 623 CG LYS A 95 -13.197 -0.804 6.994 1.00 0.00 C ATOM 624 CD LYS A 95 -12.484 0.531 7.228 1.00 0.00 C ATOM 625 CE LYS A 95 -11.115 0.512 6.543 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.193 1.449 7.245 1.00 0.00 N ATOM 0 H LYS A 95 -13.903 -3.721 9.043 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.687 -1.901 8.586 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.588 -1.995 8.139 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.134 -0.490 8.914 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.504 -1.530 6.569 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.005 -0.676 6.274 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.087 1.350 6.835 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.364 0.708 8.297 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.704 -0.497 6.557 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.216 0.801 5.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.263 1.435 6.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.584 2.412 7.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.087 1.154 8.237 1.00 0.00 H new ATOM 640 N ASN A 96 -13.387 -2.007 11.391 1.00 0.00 N ATOM 641 CA ASN A 96 -13.400 -1.548 12.775 1.00 0.00 C ATOM 642 C ASN A 96 -12.370 -2.310 13.602 1.00 0.00 C ATOM 643 O ASN A 96 -12.318 -2.164 14.823 1.00 0.00 O ATOM 644 CB ASN A 96 -14.786 -1.740 13.389 1.00 0.00 C ATOM 645 CG ASN A 96 -14.925 -3.153 13.933 1.00 0.00 C ATOM 646 OD1 ASN A 96 -14.761 -4.122 13.200 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.212 -3.331 15.194 1.00 0.00 N ATOM 0 H ASN A 96 -14.053 -2.751 11.184 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.149 -0.487 12.781 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -14.941 -1.017 14.190 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.554 -1.554 12.638 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -15.300 -4.276 15.569 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -15.349 -2.525 15.805 1.00 0.00 H new ATOM 654 N MET A 97 -11.553 -3.132 12.935 1.00 0.00 N ATOM 655 CA MET A 97 -10.535 -3.907 13.622 1.00 0.00 C ATOM 656 C MET A 97 -9.693 -3.027 14.521 1.00 0.00 C ATOM 657 O MET A 97 -9.046 -3.546 15.432 1.00 0.00 O ATOM 658 CB MET A 97 -9.634 -4.605 12.603 1.00 0.00 C ATOM 659 CG MET A 97 -10.028 -6.078 12.498 1.00 0.00 C ATOM 660 SD MET A 97 -9.229 -6.812 11.052 1.00 0.00 S ATOM 661 CE MET A 97 -9.059 -8.484 11.717 1.00 0.00 C ATOM 0 H MET A 97 -11.583 -3.272 11.925 1.00 0.00 H new ATOM 0 HA MET A 97 -11.038 -4.652 14.239 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.726 -4.123 11.630 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.590 -4.517 12.905 1.00 0.00 H new ATOM 0 HG2 MET A 97 -9.730 -6.611 13.401 1.00 0.00 H new ATOM 0 HG3 MET A 97 -11.111 -6.171 12.415 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.595 -9.128 10.969 1.00 0.00 H new ATOM 0 HE2 MET A 97 -8.436 -8.458 12.611 1.00 0.00 H new ATOM 0 HE3 MET A 97 -10.044 -8.876 11.973 1.00 0.00 H new ATOM 671 N SER A 98 -9.694 -1.708 14.260 1.00 0.00 N ATOM 672 CA SER A 98 -8.927 -0.758 15.052 1.00 0.00 C ATOM 673 C SER A 98 -7.458 -0.804 14.656 1.00 0.00 C ATOM 674 O SER A 98 -6.870 0.220 14.315 1.00 0.00 O ATOM 675 CB SER A 98 -9.078 -1.061 16.540 1.00 0.00 C ATOM 676 OG SER A 98 -10.380 -1.588 16.779 1.00 0.00 O ATOM 0 H SER A 98 -10.224 -1.283 13.499 1.00 0.00 H new ATOM 0 HA SER A 98 -9.312 0.243 14.858 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.319 -1.776 16.857 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.926 -0.154 17.126 1.00 0.00 H new ATOM 0 HG SER A 98 -10.483 -1.786 17.733 1.00 0.00 H new ATOM 682 N THR A 99 -6.879 -1.999 14.686 1.00 0.00 N ATOM 683 CA THR A 99 -5.485 -2.169 14.308 1.00 0.00 C ATOM 684 C THR A 99 -5.355 -2.338 12.788 1.00 0.00 C ATOM 685 O THR A 99 -4.314 -2.750 12.277 1.00 0.00 O ATOM 686 CB THR A 99 -4.900 -3.397 15.019 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.147 -3.296 16.416 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.389 -3.481 14.771 1.00 0.00 C ATOM 0 H THR A 99 -7.352 -2.858 14.967 1.00 0.00 H new ATOM 0 HA THR A 99 -4.932 -1.279 14.608 1.00 0.00 H new ATOM 0 HB THR A 99 -5.374 -4.296 14.625 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.776 -4.080 16.871 1.00 0.00 H new ATOM 0 HG21 THR A 99 -2.985 -4.356 15.280 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.200 -3.564 13.701 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.907 -2.582 15.156 1.00 0.00 H new ATOM 696 N VAL A 100 -6.423 -2.033 12.067 1.00 0.00 N ATOM 697 CA VAL A 100 -6.414 -2.170 10.623 1.00 0.00 C ATOM 698 C VAL A 100 -6.146 -0.828 9.956 1.00 0.00 C ATOM 699 O VAL A 100 -6.542 0.221 10.462 1.00 0.00 O ATOM 700 CB VAL A 100 -7.759 -2.715 10.149 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.891 -1.838 10.695 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.802 -2.706 8.619 1.00 0.00 C ATOM 0 H VAL A 100 -7.301 -1.691 12.457 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.619 -2.862 10.347 1.00 0.00 H new ATOM 0 HB VAL A 100 -7.884 -3.735 10.512 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.850 -2.229 10.355 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.862 -1.843 11.785 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.767 -0.817 10.334 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.762 -3.095 8.280 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.676 -1.685 8.257 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -6.999 -3.331 8.229 1.00 0.00 H new ATOM 712 N LYS A 101 -5.477 -0.869 8.808 1.00 0.00 N ATOM 713 CA LYS A 101 -5.166 0.345 8.075 1.00 0.00 C ATOM 714 C LYS A 101 -6.113 0.505 6.885 1.00 0.00 C ATOM 715 O LYS A 101 -6.601 1.601 6.611 1.00 0.00 O ATOM 716 CB LYS A 101 -3.718 0.310 7.578 1.00 0.00 C ATOM 717 CG LYS A 101 -3.404 1.586 6.790 1.00 0.00 C ATOM 718 CD LYS A 101 -3.450 2.792 7.731 1.00 0.00 C ATOM 719 CE LYS A 101 -3.008 4.043 6.976 1.00 0.00 C ATOM 720 NZ LYS A 101 -3.013 5.212 7.905 1.00 0.00 N ATOM 0 H LYS A 101 -5.143 -1.727 8.370 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.292 1.194 8.747 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.037 0.218 8.424 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.562 -0.565 6.947 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.419 1.508 6.329 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.125 1.714 5.982 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -4.460 2.926 8.119 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.799 2.623 8.589 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.010 3.898 6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.677 4.229 6.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.712 6.065 7.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -3.973 5.354 8.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -2.358 5.033 8.692 1.00 0.00 H new ATOM 734 N SER A 102 -6.358 -0.593 6.181 1.00 0.00 N ATOM 735 CA SER A 102 -7.238 -0.570 5.018 1.00 0.00 C ATOM 736 C SER A 102 -7.741 -1.972 4.699 1.00 0.00 C ATOM 737 O SER A 102 -7.026 -2.955 4.894 1.00 0.00 O ATOM 738 CB SER A 102 -6.504 0.009 3.811 1.00 0.00 C ATOM 739 OG SER A 102 -7.344 -0.069 2.668 1.00 0.00 O ATOM 0 H SER A 102 -5.961 -1.508 6.394 1.00 0.00 H new ATOM 0 HA SER A 102 -8.095 0.063 5.248 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.227 1.046 4.003 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.579 -0.541 3.635 1.00 0.00 H new ATOM 0 HG SER A 102 -6.876 0.304 1.892 1.00 0.00 H new ATOM 745 N VAL A 103 -8.968 -2.054 4.200 1.00 0.00 N ATOM 746 CA VAL A 103 -9.547 -3.347 3.852 1.00 0.00 C ATOM 747 C VAL A 103 -10.102 -3.329 2.427 1.00 0.00 C ATOM 748 O VAL A 103 -10.906 -2.469 2.074 1.00 0.00 O ATOM 749 CB VAL A 103 -10.667 -3.698 4.829 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.237 -5.080 4.490 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.126 -3.694 6.257 1.00 0.00 C ATOM 0 H VAL A 103 -9.575 -1.253 4.029 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.760 -4.099 3.912 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.461 -2.956 4.747 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -12.036 -5.326 5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.634 -5.071 3.475 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.447 -5.827 4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.928 -3.945 6.951 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.327 -4.430 6.345 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.736 -2.704 6.496 1.00 0.00 H new ATOM 761 N THR A 104 -9.668 -4.284 1.612 1.00 0.00 N ATOM 762 CA THR A 104 -10.130 -4.373 0.235 1.00 0.00 C ATOM 763 C THR A 104 -10.722 -5.751 -0.040 1.00 0.00 C ATOM 764 O THR A 104 -10.100 -6.768 0.235 1.00 0.00 O ATOM 765 CB THR A 104 -8.973 -4.105 -0.729 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.480 -2.788 -0.523 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.456 -4.266 -2.169 1.00 0.00 C ATOM 0 H THR A 104 -8.999 -5.005 1.882 1.00 0.00 H new ATOM 0 HA THR A 104 -10.903 -3.620 0.082 1.00 0.00 H new ATOM 0 HB THR A 104 -8.171 -4.819 -0.544 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.738 -2.617 -1.139 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.630 -4.074 -2.854 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.823 -5.281 -2.318 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.261 -3.557 -2.364 1.00 0.00 H new ATOM 775 N PHE A 105 -11.926 -5.774 -0.586 1.00 0.00 N ATOM 776 CA PHE A 105 -12.587 -7.035 -0.886 1.00 0.00 C ATOM 777 C PHE A 105 -12.179 -7.543 -2.265 1.00 0.00 C ATOM 778 O PHE A 105 -12.469 -6.918 -3.283 1.00 0.00 O ATOM 779 CB PHE A 105 -14.109 -6.846 -0.855 1.00 0.00 C ATOM 780 CG PHE A 105 -14.789 -8.157 -1.176 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.786 -9.192 -0.239 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.428 -8.333 -2.410 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.421 -10.402 -0.528 1.00 0.00 C ATOM 784 CE2 PHE A 105 -16.061 -9.548 -2.703 1.00 0.00 C ATOM 785 CZ PHE A 105 -16.056 -10.583 -1.759 1.00 0.00 C ATOM 0 H PHE A 105 -12.463 -4.942 -0.829 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.287 -7.764 -0.134 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.422 -6.493 0.128 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.406 -6.085 -1.576 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -14.291 -9.057 0.712 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.433 -7.533 -3.135 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.421 -11.199 0.201 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.552 -9.686 -3.655 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.543 -11.521 -1.983 1.00 0.00 H new ATOM 795 N SER A 106 -11.529 -8.695 -2.287 1.00 0.00 N ATOM 796 CA SER A 106 -11.100 -9.301 -3.540 1.00 0.00 C ATOM 797 C SER A 106 -11.997 -10.494 -3.877 1.00 0.00 C ATOM 798 O SER A 106 -11.991 -11.506 -3.176 1.00 0.00 O ATOM 799 CB SER A 106 -9.647 -9.765 -3.436 1.00 0.00 C ATOM 800 OG SER A 106 -9.290 -10.453 -4.629 1.00 0.00 O ATOM 0 H SER A 106 -11.286 -9.230 -1.453 1.00 0.00 H new ATOM 0 HA SER A 106 -11.178 -8.555 -4.331 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.989 -8.909 -3.285 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.522 -10.419 -2.573 1.00 0.00 H new ATOM 0 HG SER A 106 -8.359 -10.751 -4.568 1.00 0.00 H new ATOM 806 N SER A 107 -12.759 -10.375 -4.959 1.00 0.00 N ATOM 807 CA SER A 107 -13.650 -11.449 -5.383 1.00 0.00 C ATOM 808 C SER A 107 -12.854 -12.686 -5.785 1.00 0.00 C ATOM 809 O SER A 107 -11.655 -12.614 -6.037 1.00 0.00 O ATOM 810 CB SER A 107 -14.519 -10.975 -6.548 1.00 0.00 C ATOM 811 OG SER A 107 -13.687 -10.551 -7.610 1.00 0.00 O ATOM 0 H SER A 107 -12.778 -9.549 -5.557 1.00 0.00 H new ATOM 0 HA SER A 107 -14.294 -11.717 -4.545 1.00 0.00 H new ATOM 0 HB2 SER A 107 -15.171 -11.782 -6.882 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.163 -10.157 -6.227 1.00 0.00 H new ATOM 0 HG SER A 107 -14.242 -10.248 -8.359 1.00 0.00 H new ATOM 817 N LYS A 108 -13.530 -13.825 -5.833 1.00 0.00 N ATOM 818 CA LYS A 108 -12.878 -15.079 -6.190 1.00 0.00 C ATOM 819 C LYS A 108 -12.388 -15.041 -7.628 1.00 0.00 C ATOM 820 O LYS A 108 -11.319 -15.556 -7.946 1.00 0.00 O ATOM 821 CB LYS A 108 -13.854 -16.246 -6.002 1.00 0.00 C ATOM 822 CG LYS A 108 -15.088 -16.032 -6.884 1.00 0.00 C ATOM 823 CD LYS A 108 -16.277 -16.787 -6.294 1.00 0.00 C ATOM 824 CE LYS A 108 -17.561 -16.004 -6.573 1.00 0.00 C ATOM 825 NZ LYS A 108 -18.740 -16.892 -6.362 1.00 0.00 N ATOM 0 H LYS A 108 -14.526 -13.908 -5.630 1.00 0.00 H new ATOM 0 HA LYS A 108 -12.017 -15.219 -5.536 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -13.367 -17.186 -6.262 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -14.151 -16.320 -4.956 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.318 -14.969 -6.953 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -14.889 -16.382 -7.897 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.343 -17.784 -6.731 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.143 -16.918 -5.220 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -17.622 -15.138 -5.914 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.555 -15.627 -7.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -19.613 -16.360 -6.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.682 -17.705 -7.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -18.748 -17.231 -5.379 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.911 -18.687 -3.018 1.00 0.00 N ATOM 1238 CA TYR A 134 -13.163 -18.006 -2.720 1.00 0.00 C ATOM 1239 C TYR A 134 -12.917 -16.516 -2.485 1.00 0.00 C ATOM 1240 O TYR A 134 -11.859 -15.989 -2.828 1.00 0.00 O ATOM 1241 CB TYR A 134 -13.809 -18.625 -1.479 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.008 -19.819 -1.030 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.148 -19.708 0.067 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -13.124 -21.034 -1.709 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -11.403 -20.816 0.483 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -12.381 -22.140 -1.294 1.00 0.00 C ATOM 1247 CZ TYR A 134 -11.517 -22.033 -0.197 1.00 0.00 C ATOM 1248 OH TYR A 134 -10.781 -23.126 0.213 1.00 0.00 O ATOM 0 HA TYR A 134 -13.834 -18.121 -3.572 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.860 -17.888 -0.678 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.833 -18.925 -1.702 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.059 -18.768 0.592 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -13.789 -21.118 -2.556 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -10.739 -20.732 1.330 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -12.472 -23.079 -1.819 1.00 0.00 H new ATOM 0 HH TYR A 134 -10.980 -23.890 -0.367 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.894 -15.846 -1.876 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.765 -14.425 -1.584 1.00 0.00 C ATOM 1260 C ASP A 135 -12.579 -14.180 -0.653 1.00 0.00 C ATOM 1261 O ASP A 135 -12.281 -14.992 0.214 1.00 0.00 O ATOM 1262 CB ASP A 135 -15.044 -13.916 -0.922 1.00 0.00 C ATOM 1263 CG ASP A 135 -16.173 -13.857 -1.942 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -15.886 -13.971 -3.122 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -17.312 -13.700 -1.530 1.00 0.00 O ATOM 0 H ASP A 135 -14.776 -16.263 -1.578 1.00 0.00 H new ATOM 0 HA ASP A 135 -13.599 -13.890 -2.519 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -15.322 -14.573 -0.098 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.874 -12.926 -0.498 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.894 -13.067 -0.855 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.732 -12.729 -0.043 1.00 0.00 C ATOM 1272 C ALA A 136 -10.814 -11.289 0.439 1.00 0.00 C ATOM 1273 O ALA A 136 -11.297 -10.416 -0.264 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.451 -12.921 -0.861 1.00 0.00 C ATOM 0 H ALA A 136 -12.121 -12.380 -1.574 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.715 -13.389 0.824 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.586 -12.667 -0.248 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.376 -13.960 -1.181 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.478 -12.273 -1.737 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.332 -11.046 1.643 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.349 -9.699 2.213 1.00 0.00 C ATOM 1282 C TYR A 137 -8.926 -9.224 2.496 1.00 0.00 C ATOM 1283 O TYR A 137 -8.277 -9.693 3.433 1.00 0.00 O ATOM 1284 CB TYR A 137 -11.161 -9.687 3.510 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.539 -9.142 3.256 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.659 -9.942 3.492 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.694 -7.845 2.772 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.939 -9.440 3.247 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.971 -7.338 2.529 1.00 0.00 C ATOM 1290 CZ TYR A 137 -15.097 -8.136 2.766 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.361 -7.636 2.514 1.00 0.00 O ATOM 0 H TYR A 137 -9.923 -11.757 2.249 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.812 -9.025 1.492 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.230 -10.697 3.913 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.654 -9.079 4.259 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.535 -10.948 3.864 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.825 -7.231 2.585 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.806 -10.058 3.429 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -14.091 -6.331 2.158 1.00 0.00 H new ATOM 0 HH TYR A 137 -17.006 -8.056 3.121 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.435 -8.306 1.673 1.00 0.00 N ATOM 1302 CA ILE A 138 -7.086 -7.789 1.833 1.00 0.00 C ATOM 1303 C ILE A 138 -7.058 -6.728 2.927 1.00 0.00 C ATOM 1304 O ILE A 138 -7.608 -5.649 2.766 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.614 -7.168 0.514 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.780 -8.181 -0.623 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -5.143 -6.777 0.633 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.473 -7.516 -1.963 1.00 0.00 C ATOM 0 H ILE A 138 -8.952 -7.906 0.890 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.424 -8.609 2.111 1.00 0.00 H new ATOM 0 HB ILE A 138 -7.212 -6.282 0.299 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -6.112 -9.028 -0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.797 -8.573 -0.627 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.807 -6.335 -0.305 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -5.023 -6.053 1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.547 -7.664 0.850 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.593 -8.243 -2.766 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -7.158 -6.683 -2.122 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.448 -7.146 -1.959 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.425 -7.049 4.041 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.336 -6.141 5.169 1.00 0.00 C ATOM 1322 C VAL A 139 -4.893 -5.714 5.408 1.00 0.00 C ATOM 1323 O VAL A 139 -3.979 -6.537 5.430 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.885 -6.822 6.428 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.682 -5.904 7.634 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.383 -7.098 6.248 1.00 0.00 C ATOM 0 H VAL A 139 -5.959 -7.944 4.189 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.928 -5.254 4.944 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.357 -7.762 6.591 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -7.072 -6.388 8.529 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.618 -5.704 7.764 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.210 -4.965 7.469 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.774 -7.582 7.143 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.909 -6.157 6.085 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.532 -7.751 5.388 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.710 -4.422 5.611 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.379 -3.880 5.870 1.00 0.00 C ATOM 1338 C GLU A 140 -3.183 -3.624 7.361 1.00 0.00 C ATOM 1339 O GLU A 140 -3.739 -2.682 7.915 1.00 0.00 O ATOM 1340 CB GLU A 140 -3.164 -2.582 5.092 1.00 0.00 C ATOM 1341 CG GLU A 140 -2.742 -2.905 3.657 1.00 0.00 C ATOM 1342 CD GLU A 140 -3.967 -3.087 2.768 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -5.057 -3.178 3.306 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -3.796 -3.127 1.563 1.00 0.00 O ATOM 0 H GLU A 140 -5.458 -3.728 5.603 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.647 -4.616 5.538 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -4.081 -1.993 5.088 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.399 -1.977 5.579 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.118 -2.102 3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.138 -3.813 3.645 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.373 -4.460 7.996 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.104 -4.307 9.427 1.00 0.00 C ATOM 1353 C ALA A 141 -1.287 -3.050 9.692 1.00 0.00 C ATOM 1354 O ALA A 141 -0.467 -2.651 8.876 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.353 -5.530 9.953 1.00 0.00 C ATOM 0 H ALA A 141 -1.894 -5.244 7.553 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.058 -4.218 9.946 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.158 -5.407 11.018 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.957 -6.423 9.796 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.408 -5.633 9.420 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.518 -2.423 10.837 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.794 -1.204 11.186 1.00 0.00 C ATOM 1363 C ASN A 142 0.707 -1.466 11.198 1.00 0.00 C ATOM 1364 O ASN A 142 1.497 -0.628 10.754 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.237 -0.712 12.565 1.00 0.00 C ATOM 1366 CG ASN A 142 -0.628 0.654 12.855 1.00 0.00 C ATOM 1367 OD1 ASN A 142 0.586 0.774 13.014 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -1.404 1.699 12.935 1.00 0.00 N ATOM 0 H ASN A 142 -2.194 -2.733 11.535 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.016 -0.441 10.440 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.324 -0.650 12.605 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -0.930 -1.425 13.330 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -1.005 2.617 13.130 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.410 1.598 12.803 1.00 0.00 H new ATOM 1375 N ALA A 143 1.100 -2.630 11.703 1.00 0.00 N ATOM 1376 CA ALA A 143 2.509 -2.985 11.763 1.00 0.00 C ATOM 1377 C ALA A 143 2.712 -4.441 11.339 1.00 0.00 C ATOM 1378 O ALA A 143 1.779 -5.242 11.371 1.00 0.00 O ATOM 1379 CB ALA A 143 3.045 -2.776 13.187 1.00 0.00 C ATOM 0 H ALA A 143 0.466 -3.338 12.074 1.00 0.00 H new ATOM 0 HA ALA A 143 3.058 -2.341 11.077 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.101 -3.045 13.221 1.00 0.00 H new ATOM 0 HB2 ALA A 143 2.927 -1.730 13.470 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.488 -3.405 13.881 1.00 0.00 H new ATOM 1385 N PRO A 144 3.912 -4.789 10.962 1.00 0.00 N ATOM 1386 CA PRO A 144 4.255 -6.181 10.534 1.00 0.00 C ATOM 1387 C PRO A 144 4.017 -7.196 11.642 1.00 0.00 C ATOM 1388 O PRO A 144 3.792 -8.374 11.375 1.00 0.00 O ATOM 1389 CB PRO A 144 5.742 -6.097 10.168 1.00 0.00 C ATOM 1390 CG PRO A 144 6.250 -4.872 10.852 1.00 0.00 C ATOM 1391 CD PRO A 144 5.081 -3.901 10.895 1.00 0.00 C ATOM 0 HA PRO A 144 3.632 -6.520 9.706 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.279 -6.985 10.502 1.00 0.00 H new ATOM 0 HB3 PRO A 144 5.878 -6.029 9.089 1.00 0.00 H new ATOM 0 HG2 PRO A 144 6.602 -5.104 11.857 1.00 0.00 H new ATOM 0 HG3 PRO A 144 7.093 -4.444 10.310 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.136 -3.242 11.761 1.00 0.00 H new ATOM 0 HD3 PRO A 144 5.053 -3.264 10.011 1.00 0.00 H new ATOM 1399 N ASN A 145 4.043 -6.729 12.884 1.00 0.00 N ATOM 1400 CA ASN A 145 3.804 -7.609 14.020 1.00 0.00 C ATOM 1401 C ASN A 145 2.306 -7.687 14.332 1.00 0.00 C ATOM 1402 O ASN A 145 1.884 -8.465 15.183 1.00 0.00 O ATOM 1403 CB ASN A 145 4.552 -7.092 15.248 1.00 0.00 C ATOM 1404 CG ASN A 145 6.053 -7.099 14.985 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.719 -6.079 15.155 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.625 -8.195 14.568 1.00 0.00 N ATOM 0 H ASN A 145 4.225 -5.756 13.129 1.00 0.00 H new ATOM 0 HA ASN A 145 4.166 -8.605 13.766 1.00 0.00 H new ATOM 0 HB2 ASN A 145 4.221 -6.081 15.487 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.323 -7.715 16.113 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.628 -8.208 14.382 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.069 -9.039 14.428 1.00 0.00 H new ATOM 1413 N ASP A 146 1.508 -6.878 13.639 1.00 0.00 N ATOM 1414 CA ASP A 146 0.076 -6.863 13.838 1.00 0.00 C ATOM 1415 C ASP A 146 -0.606 -7.802 12.851 1.00 0.00 C ATOM 1416 O ASP A 146 -1.731 -8.210 13.061 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.466 -5.438 13.647 1.00 0.00 C ATOM 1418 CG ASP A 146 0.013 -4.544 14.787 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.468 -5.081 15.783 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.079 -3.334 14.648 1.00 0.00 O ATOM 0 H ASP A 146 1.840 -6.223 12.931 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.136 -7.199 14.853 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.129 -5.036 12.692 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.556 -5.454 13.619 1.00 0.00 H new ATOM 1425 N VAL A 147 0.092 -8.144 11.774 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.459 -9.032 10.757 1.00 0.00 C ATOM 1427 C VAL A 147 -0.865 -10.347 11.397 1.00 0.00 C ATOM 1428 O VAL A 147 -1.807 -11.004 10.961 1.00 0.00 O ATOM 1429 CB VAL A 147 0.588 -9.284 9.668 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.149 -7.950 9.175 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.722 -10.145 10.236 1.00 0.00 C ATOM 0 H VAL A 147 1.040 -7.820 11.583 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.335 -8.566 10.307 1.00 0.00 H new ATOM 0 HB VAL A 147 0.122 -9.807 8.833 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.894 -8.133 8.400 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.341 -7.344 8.766 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.613 -7.421 10.007 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.467 -10.324 9.460 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.188 -9.626 11.074 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.319 -11.098 10.578 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.167 -10.708 12.467 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.490 -11.940 13.183 1.00 0.00 C ATOM 1443 C LYS A 148 -1.747 -11.737 14.032 1.00 0.00 C ATOM 1444 O LYS A 148 -2.587 -12.631 14.148 1.00 0.00 O ATOM 1445 CB LYS A 148 0.687 -12.356 14.081 1.00 0.00 C ATOM 1446 CG LYS A 148 0.182 -13.152 15.296 1.00 0.00 C ATOM 1447 CD LYS A 148 -0.093 -12.188 16.459 1.00 0.00 C ATOM 1448 CE LYS A 148 0.360 -12.828 17.763 1.00 0.00 C ATOM 1449 NZ LYS A 148 -0.249 -12.099 18.912 1.00 0.00 N ATOM 0 H LYS A 148 0.613 -10.177 12.854 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.675 -12.731 12.456 1.00 0.00 H new ATOM 0 HB2 LYS A 148 1.392 -12.961 13.510 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.226 -11.470 14.417 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -0.727 -13.695 15.037 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.923 -13.894 15.592 1.00 0.00 H new ATOM 0 HD2 LYS A 148 0.435 -11.248 16.300 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -1.156 -11.952 16.507 1.00 0.00 H new ATOM 0 HE2 LYS A 148 0.066 -13.877 17.787 1.00 0.00 H new ATOM 0 HE3 LYS A 148 1.447 -12.800 17.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 0.060 -12.536 19.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 0.053 -11.104 18.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -1.286 -12.148 18.844 1.00 0.00 H new ATOM 1463 N THR A 149 -1.867 -10.549 14.616 1.00 0.00 N ATOM 1464 CA THR A 149 -3.016 -10.230 15.455 1.00 0.00 C ATOM 1465 C THR A 149 -4.261 -10.050 14.591 1.00 0.00 C ATOM 1466 O THR A 149 -5.362 -10.400 14.978 1.00 0.00 O ATOM 1467 CB THR A 149 -2.746 -8.968 16.273 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.611 -9.185 17.109 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.966 -8.654 17.144 1.00 0.00 C ATOM 0 H THR A 149 -1.186 -9.795 14.524 1.00 0.00 H new ATOM 0 HA THR A 149 -3.186 -11.056 16.146 1.00 0.00 H new ATOM 0 HB THR A 149 -2.554 -8.131 15.602 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.433 -8.377 17.635 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.774 -7.754 17.728 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.836 -8.495 16.507 1.00 0.00 H new ATOM 0 HG23 THR A 149 -4.157 -9.489 17.818 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.075 -9.479 13.422 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.177 -9.242 12.510 1.00 0.00 C ATOM 1479 C ILE A 150 -5.714 -10.557 11.978 1.00 0.00 C ATOM 1480 O ILE A 150 -6.924 -10.728 11.826 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.719 -8.356 11.344 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.351 -6.961 11.868 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -5.840 -8.233 10.315 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.595 -6.238 12.412 1.00 0.00 C ATOM 0 H ILE A 150 -3.167 -9.168 13.077 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.972 -8.731 13.053 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.846 -8.809 10.874 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.602 -7.049 12.655 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.904 -6.373 11.067 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.509 -7.603 9.490 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.096 -9.222 9.936 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.717 -7.786 10.784 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.311 -5.251 12.778 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.331 -6.132 11.615 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.025 -6.818 13.228 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.807 -11.477 11.687 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.199 -12.771 11.164 1.00 0.00 C ATOM 1498 C ALA A 151 -5.944 -13.588 12.210 1.00 0.00 C ATOM 1499 O ALA A 151 -6.908 -14.294 11.906 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.966 -13.547 10.691 1.00 0.00 C ATOM 0 H ALA A 151 -3.802 -11.351 11.804 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.868 -12.599 10.320 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.274 -14.517 10.301 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.461 -12.984 9.906 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.285 -13.693 11.529 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.477 -13.496 13.445 1.00 0.00 N ATOM 1507 CA GLU A 152 -6.093 -14.253 14.535 1.00 0.00 C ATOM 1508 C GLU A 152 -7.462 -13.679 14.881 1.00 0.00 C ATOM 1509 O GLU A 152 -8.331 -14.382 15.398 1.00 0.00 O ATOM 1510 CB GLU A 152 -5.175 -14.238 15.770 1.00 0.00 C ATOM 1511 CG GLU A 152 -5.431 -12.980 16.598 1.00 0.00 C ATOM 1512 CD GLU A 152 -6.519 -13.236 17.637 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -6.637 -14.365 18.079 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -7.230 -12.301 17.963 1.00 0.00 O ATOM 0 H GLU A 152 -4.685 -12.915 13.720 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.229 -15.285 14.210 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.354 -15.125 16.377 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -4.131 -14.271 15.458 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -4.511 -12.671 17.095 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -5.730 -12.161 15.943 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.643 -12.391 14.599 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.899 -11.726 14.885 1.00 0.00 C ATOM 1523 C ASP A 153 -9.895 -11.999 13.762 1.00 0.00 C ATOM 1524 O ASP A 153 -11.079 -12.208 13.996 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.679 -10.219 15.030 1.00 0.00 C ATOM 1526 CG ASP A 153 -9.906 -9.572 15.666 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -9.981 -9.566 16.885 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -10.754 -9.104 14.928 1.00 0.00 O ATOM 0 H ASP A 153 -6.934 -11.793 14.174 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.298 -12.114 15.822 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.798 -10.029 15.643 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -8.489 -9.775 14.053 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.394 -12.011 12.537 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.242 -12.266 11.379 1.00 0.00 C ATOM 1535 C ALA A 154 -10.680 -13.726 11.345 1.00 0.00 C ATOM 1536 O ALA A 154 -11.687 -14.063 10.719 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.506 -11.912 10.086 1.00 0.00 C ATOM 0 H ALA A 154 -8.411 -11.849 12.317 1.00 0.00 H new ATOM 0 HA ALA A 154 -11.128 -11.637 11.463 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.155 -12.109 9.232 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -9.234 -10.857 10.099 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.604 -12.518 10.003 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.914 -14.584 12.009 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.221 -16.001 12.043 1.00 0.00 C ATOM 1545 C LYS A 155 -11.528 -16.258 12.787 1.00 0.00 C ATOM 1546 O LYS A 155 -12.123 -17.333 12.668 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.088 -16.769 12.718 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.076 -17.219 11.660 1.00 0.00 C ATOM 1549 CD LYS A 155 -6.927 -17.963 12.343 1.00 0.00 C ATOM 1550 CE LYS A 155 -6.980 -19.444 11.961 1.00 0.00 C ATOM 1551 NZ LYS A 155 -8.055 -20.127 12.745 1.00 0.00 N ATOM 0 H LYS A 155 -9.078 -14.319 12.529 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.331 -16.347 11.015 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.598 -16.138 13.460 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.486 -17.635 13.248 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.560 -17.867 10.929 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.693 -16.356 11.116 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -5.972 -17.533 12.043 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -7.000 -17.853 13.425 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.173 -19.548 10.893 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -6.017 -19.915 12.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -8.089 -21.133 12.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -7.852 -20.040 13.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -8.972 -19.684 12.536 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.969 -15.271 13.559 1.00 0.00 N ATOM 1566 CA LYS A 156 -13.209 -15.397 14.317 1.00 0.00 C ATOM 1567 C LYS A 156 -14.294 -14.480 13.749 1.00 0.00 C ATOM 1568 O LYS A 156 -15.377 -14.353 14.320 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.954 -15.054 15.785 1.00 0.00 C ATOM 1570 CG LYS A 156 -13.236 -13.570 16.023 1.00 0.00 C ATOM 1571 CD LYS A 156 -12.633 -13.143 17.357 1.00 0.00 C ATOM 1572 CE LYS A 156 -11.838 -11.855 17.167 1.00 0.00 C ATOM 1573 NZ LYS A 156 -12.763 -10.687 17.174 1.00 0.00 N ATOM 0 H LYS A 156 -11.489 -14.379 13.676 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.557 -16.427 14.239 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -13.591 -15.663 16.427 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -11.922 -15.285 16.049 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -12.813 -12.975 15.214 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -14.311 -13.389 16.024 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -13.423 -12.990 18.093 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -11.985 -13.929 17.744 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -11.100 -11.751 17.963 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -11.289 -11.891 16.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -12.216 -9.810 17.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -13.440 -10.776 16.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -13.280 -10.659 18.076 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.004 -13.852 12.613 1.00 0.00 N ATOM 1588 CA ILE A 157 -14.960 -12.965 11.986 1.00 0.00 C ATOM 1589 C ILE A 157 -15.886 -13.739 11.068 1.00 0.00 C ATOM 1590 O ILE A 157 -15.413 -14.454 10.178 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.230 -11.886 11.182 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.616 -10.854 12.141 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.198 -11.188 10.223 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -12.844 -9.784 11.349 1.00 0.00 C ATOM 0 H ILE A 157 -13.118 -13.944 12.116 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.553 -12.494 12.770 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.439 -12.357 10.599 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.402 -10.383 12.731 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -12.946 -11.352 12.842 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -14.663 -10.424 9.659 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -15.619 -11.920 9.534 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.002 -10.722 10.793 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -12.414 -9.059 12.040 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -12.046 -10.259 10.778 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.525 -9.275 10.666 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.194 -13.547 11.268 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.202 -14.201 10.438 1.00 0.00 C ATOM 1608 C GLU A 158 -17.759 -15.616 10.046 1.00 0.00 C ATOM 1609 O GLU A 158 -17.347 -16.394 10.904 1.00 0.00 O ATOM 1610 CB GLU A 158 -18.453 -13.359 9.184 1.00 0.00 C ATOM 1611 CG GLU A 158 -18.797 -11.930 9.569 1.00 0.00 C ATOM 1612 CD GLU A 158 -19.990 -11.923 10.516 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -20.929 -12.658 10.260 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -19.940 -11.191 11.490 1.00 0.00 O ATOM 0 H GLU A 158 -17.576 -12.944 11.997 1.00 0.00 H new ATOM 0 HA GLU A 158 -19.125 -14.286 11.011 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -17.568 -13.369 8.548 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -19.267 -13.793 8.603 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -17.939 -11.456 10.046 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -19.027 -11.348 8.676 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.819 -15.928 8.747 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.410 -17.220 8.269 1.00 0.00 C ATOM 1623 C GLY A 159 -16.081 -17.147 7.522 1.00 0.00 C ATOM 1624 O GLY A 159 -16.013 -17.368 6.309 1.00 0.00 O ATOM 0 H GLY A 159 -18.149 -15.292 8.021 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -17.318 -17.908 9.110 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.177 -17.624 7.609 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.021 -16.849 8.250 1.00 0.00 N ATOM 1629 CA VAL A 160 -13.691 -16.780 7.645 1.00 0.00 C ATOM 1630 C VAL A 160 -13.171 -18.192 7.352 1.00 0.00 C ATOM 1631 O VAL A 160 -12.811 -18.939 8.264 1.00 0.00 O ATOM 1632 CB VAL A 160 -12.724 -16.076 8.601 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -12.771 -16.748 9.999 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -11.299 -16.153 8.028 1.00 0.00 C ATOM 0 H VAL A 160 -15.047 -16.652 9.250 1.00 0.00 H new ATOM 0 HA VAL A 160 -13.759 -16.220 6.712 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.017 -15.032 8.707 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -12.079 -16.239 10.671 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -13.782 -16.682 10.401 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -12.484 -17.796 9.909 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -10.607 -15.653 8.705 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -11.007 -17.197 7.917 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -11.271 -15.663 7.055 1.00 0.00 H new ATOM 1644 N SER A 161 -13.142 -18.555 6.081 1.00 0.00 N ATOM 1645 CA SER A 161 -12.674 -19.876 5.684 1.00 0.00 C ATOM 1646 C SER A 161 -11.220 -20.082 6.097 1.00 0.00 C ATOM 1647 O SER A 161 -10.855 -21.139 6.613 1.00 0.00 O ATOM 1648 CB SER A 161 -12.803 -20.036 4.170 1.00 0.00 C ATOM 1649 OG SER A 161 -12.349 -21.330 3.794 1.00 0.00 O ATOM 0 H SER A 161 -13.435 -17.958 5.308 1.00 0.00 H new ATOM 0 HA SER A 161 -13.288 -20.624 6.186 1.00 0.00 H new ATOM 0 HB2 SER A 161 -13.841 -19.899 3.865 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.218 -19.270 3.661 1.00 0.00 H new ATOM 0 HG SER A 161 -12.051 -21.314 2.861 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.395 -19.070 5.854 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.970 -19.160 6.198 1.00 0.00 C ATOM 1657 C GLU A 162 -8.297 -17.808 6.067 1.00 0.00 C ATOM 1658 O GLU A 162 -8.783 -16.940 5.393 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.283 -20.173 5.277 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.871 -20.459 5.793 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.240 -21.590 4.994 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -6.976 -22.319 4.354 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.025 -21.703 5.029 1.00 0.00 O ATOM 0 H GLU A 162 -10.677 -18.188 5.427 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.883 -19.488 7.234 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.861 -21.096 5.239 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.238 -19.783 4.260 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.258 -19.561 5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.909 -20.727 6.849 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.170 -17.644 6.724 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.431 -16.383 6.661 1.00 0.00 C ATOM 1672 C VAL A 163 -4.968 -16.644 6.301 1.00 0.00 C ATOM 1673 O VAL A 163 -4.328 -17.526 6.872 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.514 -15.652 7.993 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -5.724 -14.344 7.906 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -7.978 -15.348 8.313 1.00 0.00 C ATOM 0 H VAL A 163 -6.739 -18.360 7.309 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.880 -15.759 5.889 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.093 -16.276 8.781 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -5.783 -13.819 8.860 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -4.681 -14.563 7.676 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.145 -13.716 7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.041 -14.824 9.267 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.400 -14.722 7.527 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -8.538 -16.281 8.374 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.444 -15.870 5.355 1.00 0.00 N ATOM 1687 CA GLN A 164 -3.059 -16.022 4.929 1.00 0.00 C ATOM 1688 C GLN A 164 -2.277 -14.736 5.167 1.00 0.00 C ATOM 1689 O GLN A 164 -2.653 -13.669 4.684 1.00 0.00 O ATOM 1690 CB GLN A 164 -3.011 -16.391 3.443 1.00 0.00 C ATOM 1691 CG GLN A 164 -1.741 -15.815 2.810 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.535 -16.404 1.421 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -0.962 -17.484 1.283 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -1.973 -15.754 0.377 1.00 0.00 N ATOM 0 H GLN A 164 -4.957 -15.133 4.871 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.602 -16.818 5.516 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -3.028 -17.475 3.327 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.892 -16.002 2.933 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -1.818 -14.730 2.745 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -0.879 -16.037 3.439 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -2.448 -14.859 0.496 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -1.841 -16.141 -0.557 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.183 -14.847 5.910 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.349 -13.687 6.200 1.00 0.00 C ATOM 1705 C ASP A 165 0.733 -13.519 5.135 1.00 0.00 C ATOM 1706 O ASP A 165 1.610 -14.369 4.985 1.00 0.00 O ATOM 1707 CB ASP A 165 0.310 -13.847 7.572 1.00 0.00 C ATOM 1708 CG ASP A 165 1.147 -15.123 7.610 1.00 0.00 C ATOM 1709 OD1 ASP A 165 0.622 -16.172 7.275 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.308 -15.031 7.970 1.00 0.00 O ATOM 0 H ASP A 165 -0.854 -15.721 6.320 1.00 0.00 H new ATOM 0 HA ASP A 165 -0.984 -12.801 6.200 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.941 -12.983 7.783 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.454 -13.881 8.349 1.00 0.00 H new ATOM 1715 N GLY A 166 0.663 -12.417 4.402 1.00 0.00 N ATOM 1716 CA GLY A 166 1.639 -12.139 3.356 1.00 0.00 C ATOM 1717 C GLY A 166 3.043 -12.010 3.935 1.00 0.00 C ATOM 1718 O GLY A 166 4.013 -12.496 3.354 1.00 0.00 O ATOM 0 H GLY A 166 -0.057 -11.702 4.511 1.00 0.00 H new ATOM 0 HA2 GLY A 166 1.620 -12.938 2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 166 1.370 -11.218 2.839 1.00 0.00 H new