USER MOD reduce.3.24.130724 H: found=0, std=0, add=397, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 398 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 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0358) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot -92:sc=0.000905 USER MOD Single : A 107 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 169:sc= 0 (180deg=-0.246) USER MOD Single : A 125 ASN : amide:sc= -0.227 K(o=-0.23,f=-1.7!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0196) USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 88 7.643 9.380 1.403 1.00 0.00 N ATOM 2 CA ILE A 88 8.784 10.286 1.402 1.00 0.00 C ATOM 3 C ILE A 88 9.963 9.685 0.646 1.00 0.00 C ATOM 4 O ILE A 88 10.384 10.209 -0.386 1.00 0.00 O ATOM 5 CB ILE A 88 9.231 10.630 2.835 1.00 0.00 C ATOM 6 CG1 ILE A 88 8.077 11.265 3.613 1.00 0.00 C ATOM 7 CG2 ILE A 88 10.433 11.562 2.806 1.00 0.00 C ATOM 8 CD1 ILE A 88 7.760 10.554 4.910 1.00 0.00 C ATOM 0 HA ILE A 88 8.461 11.199 0.901 1.00 0.00 H new ATOM 0 HB ILE A 88 9.522 9.709 3.340 1.00 0.00 H new ATOM 0 HG12 ILE A 88 8.323 12.305 3.829 1.00 0.00 H new ATOM 0 HG13 ILE A 88 7.186 11.272 2.985 1.00 0.00 H new ATOM 0 HG21 ILE A 88 10.737 11.796 3.826 1.00 0.00 H new ATOM 0 HG22 ILE A 88 11.258 11.076 2.284 1.00 0.00 H new ATOM 0 HG23 ILE A 88 10.167 12.483 2.287 1.00 0.00 H new ATOM 0 HD11 ILE A 88 6.932 11.058 5.408 1.00 0.00 H new ATOM 0 HD12 ILE A 88 7.482 9.521 4.700 1.00 0.00 H new ATOM 0 HD13 ILE A 88 8.637 10.570 5.557 1.00 0.00 H new ATOM 20 N ASP A 89 10.490 8.581 1.162 1.00 0.00 N ATOM 21 CA ASP A 89 11.619 7.905 0.534 1.00 0.00 C ATOM 22 C ASP A 89 11.154 6.677 -0.242 1.00 0.00 C ATOM 23 O ASP A 89 10.208 5.998 0.159 1.00 0.00 O ATOM 24 CB ASP A 89 12.648 7.496 1.588 1.00 0.00 C ATOM 25 CG ASP A 89 13.931 8.298 1.488 1.00 0.00 C ATOM 26 OD1 ASP A 89 14.506 8.360 0.382 1.00 0.00 O ATOM 27 OD2 ASP A 89 14.360 8.864 2.515 1.00 0.00 O ATOM 0 H ASP A 89 10.153 8.134 2.015 1.00 0.00 H new ATOM 0 HA ASP A 89 12.083 8.601 -0.165 1.00 0.00 H new ATOM 0 HB2 ASP A 89 12.218 7.627 2.581 1.00 0.00 H new ATOM 0 HB3 ASP A 89 12.876 6.436 1.476 1.00 0.00 H new ATOM 32 N VAL A 90 11.824 6.399 -1.356 1.00 0.00 N ATOM 33 CA VAL A 90 11.479 5.253 -2.189 1.00 0.00 C ATOM 34 C VAL A 90 11.450 3.967 -1.371 1.00 0.00 C ATOM 35 O VAL A 90 10.486 3.202 -1.430 1.00 0.00 O ATOM 36 CB VAL A 90 12.474 5.085 -3.353 1.00 0.00 C ATOM 37 CG1 VAL A 90 12.082 3.903 -4.225 1.00 0.00 C ATOM 38 CG2 VAL A 90 12.552 6.363 -4.175 1.00 0.00 C ATOM 0 H VAL A 90 12.608 6.951 -1.702 1.00 0.00 H new ATOM 0 HA VAL A 90 10.486 5.445 -2.594 1.00 0.00 H new ATOM 0 HB VAL A 90 13.462 4.886 -2.938 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.797 3.801 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.083 2.993 -3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.085 4.067 -4.634 1.00 0.00 H new ATOM 0 HG21 VAL A 90 13.259 6.227 -4.993 1.00 0.00 H new ATOM 0 HG22 VAL A 90 11.568 6.595 -4.581 1.00 0.00 H new ATOM 0 HG23 VAL A 90 12.885 7.184 -3.540 1.00 0.00 H new ATOM 48 N LEU A 91 12.511 3.735 -0.606 1.00 0.00 N ATOM 49 CA LEU A 91 12.607 2.541 0.227 1.00 0.00 C ATOM 50 C LEU A 91 11.371 2.390 1.107 1.00 0.00 C ATOM 51 O LEU A 91 10.805 1.302 1.217 1.00 0.00 O ATOM 52 CB LEU A 91 13.863 2.603 1.096 1.00 0.00 C ATOM 53 CG LEU A 91 15.176 2.226 0.410 1.00 0.00 C ATOM 54 CD1 LEU A 91 16.363 2.764 1.193 1.00 0.00 C ATOM 55 CD2 LEU A 91 15.281 0.716 0.249 1.00 0.00 C ATOM 0 H LEU A 91 13.317 4.358 -0.545 1.00 0.00 H new ATOM 0 HA LEU A 91 12.670 1.673 -0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 91 13.959 3.616 1.488 1.00 0.00 H new ATOM 0 HB3 LEU A 91 13.721 1.942 1.951 1.00 0.00 H new ATOM 0 HG LEU A 91 15.187 2.678 -0.582 1.00 0.00 H new ATOM 0 HD11 LEU A 91 17.288 2.485 0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 91 16.296 3.850 1.254 1.00 0.00 H new ATOM 0 HD13 LEU A 91 16.357 2.343 2.198 1.00 0.00 H new ATOM 0 HD21 LEU A 91 16.222 0.467 -0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 91 15.246 0.242 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 91 14.450 0.356 -0.357 1.00 0.00 H new ATOM 67 N ARG A 92 10.957 3.488 1.730 1.00 0.00 N ATOM 68 CA ARG A 92 9.787 3.478 2.599 1.00 0.00 C ATOM 69 C ARG A 92 8.546 3.022 1.836 1.00 0.00 C ATOM 70 O ARG A 92 7.750 2.232 2.343 1.00 0.00 O ATOM 71 CB ARG A 92 9.553 4.869 3.191 1.00 0.00 C ATOM 72 CG ARG A 92 8.500 4.895 4.286 1.00 0.00 C ATOM 73 CD ARG A 92 9.120 5.163 5.649 1.00 0.00 C ATOM 74 NE ARG A 92 8.167 5.770 6.574 1.00 0.00 N ATOM 75 CZ ARG A 92 8.377 5.875 7.882 1.00 0.00 C ATOM 76 NH1 ARG A 92 9.501 5.416 8.414 1.00 0.00 N ATOM 77 NH2 ARG A 92 7.462 6.440 8.659 1.00 0.00 N ATOM 0 H ARG A 92 11.415 4.396 1.649 1.00 0.00 H new ATOM 0 HA ARG A 92 9.973 2.773 3.409 1.00 0.00 H new ATOM 0 HB2 ARG A 92 10.493 5.246 3.594 1.00 0.00 H new ATOM 0 HB3 ARG A 92 9.252 5.548 2.393 1.00 0.00 H new ATOM 0 HG2 ARG A 92 7.761 5.665 4.063 1.00 0.00 H new ATOM 0 HG3 ARG A 92 7.971 3.942 4.307 1.00 0.00 H new ATOM 0 HD2 ARG A 92 9.488 4.227 6.070 1.00 0.00 H new ATOM 0 HD3 ARG A 92 9.981 5.821 5.532 1.00 0.00 H new ATOM 0 HE ARG A 92 7.292 6.133 6.195 1.00 0.00 H new ATOM 0 HH11 ARG A 92 10.206 4.981 7.819 1.00 0.00 H new ATOM 0 HH12 ARG A 92 9.660 5.497 9.418 1.00 0.00 H new ATOM 0 HH21 ARG A 92 6.596 6.794 8.253 1.00 0.00 H new ATOM 0 HH22 ARG A 92 7.624 6.520 9.663 1.00 0.00 H new ATOM 91 N ALA A 93 8.390 3.526 0.618 1.00 0.00 N ATOM 92 CA ALA A 93 7.248 3.170 -0.215 1.00 0.00 C ATOM 93 C ALA A 93 7.169 1.661 -0.423 1.00 0.00 C ATOM 94 O ALA A 93 6.115 1.052 -0.238 1.00 0.00 O ATOM 95 CB ALA A 93 7.328 3.886 -1.555 1.00 0.00 C ATOM 0 H ALA A 93 9.040 4.182 0.185 1.00 0.00 H new ATOM 0 HA ALA A 93 6.341 3.487 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.469 3.611 -2.167 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.327 4.964 -1.392 1.00 0.00 H new ATOM 0 HB3 ALA A 93 8.246 3.597 -2.068 1.00 0.00 H new ATOM 101 N LYS A 94 8.290 1.063 -0.810 1.00 0.00 N ATOM 102 CA LYS A 94 8.350 -0.375 -1.043 1.00 0.00 C ATOM 103 C LYS A 94 7.934 -1.147 0.206 1.00 0.00 C ATOM 104 O LYS A 94 7.183 -2.118 0.126 1.00 0.00 O ATOM 105 CB LYS A 94 9.763 -0.787 -1.463 1.00 0.00 C ATOM 106 CG LYS A 94 10.212 -0.167 -2.774 1.00 0.00 C ATOM 107 CD LYS A 94 9.905 -1.073 -3.954 1.00 0.00 C ATOM 108 CE LYS A 94 11.157 -1.379 -4.763 1.00 0.00 C ATOM 109 NZ LYS A 94 12.028 -2.376 -4.080 1.00 0.00 N ATOM 0 H LYS A 94 9.171 1.553 -0.969 1.00 0.00 H new ATOM 0 HA LYS A 94 7.654 -0.616 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.464 -0.503 -0.678 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.805 -1.873 -1.551 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.715 0.793 -2.912 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.283 0.031 -2.736 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.466 -2.004 -3.595 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.163 -0.598 -4.596 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.872 -1.758 -5.745 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.718 -0.459 -4.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.870 -2.558 -4.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.321 -2.004 -3.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.502 -3.263 -3.946 1.00 0.00 H new ATOM 123 N ALA A 95 8.427 -0.706 1.358 1.00 0.00 N ATOM 124 CA ALA A 95 8.104 -1.353 2.624 1.00 0.00 C ATOM 125 C ALA A 95 6.612 -1.258 2.923 1.00 0.00 C ATOM 126 O ALA A 95 6.020 -2.184 3.477 1.00 0.00 O ATOM 127 CB ALA A 95 8.912 -0.734 3.754 1.00 0.00 C ATOM 0 H ALA A 95 9.051 0.096 1.441 1.00 0.00 H new ATOM 0 HA ALA A 95 8.365 -2.408 2.542 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.661 -1.227 4.693 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.976 -0.859 3.552 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.679 0.328 3.828 1.00 0.00 H new ATOM 133 N ALA A 96 6.010 -0.132 2.554 1.00 0.00 N ATOM 134 CA ALA A 96 4.586 0.082 2.784 1.00 0.00 C ATOM 135 C ALA A 96 3.744 -0.807 1.875 1.00 0.00 C ATOM 136 O ALA A 96 2.717 -1.343 2.292 1.00 0.00 O ATOM 137 CB ALA A 96 4.232 1.546 2.567 1.00 0.00 C ATOM 0 H ALA A 96 6.485 0.645 2.095 1.00 0.00 H new ATOM 0 HA ALA A 96 4.365 -0.186 3.817 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.166 1.692 2.742 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.802 2.165 3.260 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.474 1.831 1.543 1.00 0.00 H new ATOM 143 N LYS A 97 4.184 -0.960 0.631 1.00 0.00 N ATOM 144 CA LYS A 97 3.472 -1.785 -0.337 1.00 0.00 C ATOM 145 C LYS A 97 3.365 -3.226 0.151 1.00 0.00 C ATOM 146 O LYS A 97 2.305 -3.845 0.058 1.00 0.00 O ATOM 147 CB LYS A 97 4.181 -1.745 -1.691 1.00 0.00 C ATOM 148 CG LYS A 97 3.452 -0.918 -2.736 1.00 0.00 C ATOM 149 CD LYS A 97 3.798 0.557 -2.620 1.00 0.00 C ATOM 150 CE LYS A 97 3.644 1.272 -3.953 1.00 0.00 C ATOM 151 NZ LYS A 97 4.766 0.963 -4.882 1.00 0.00 N ATOM 0 H LYS A 97 5.032 -0.523 0.269 1.00 0.00 H new ATOM 0 HA LYS A 97 2.465 -1.382 -0.449 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.184 -1.340 -1.555 1.00 0.00 H new ATOM 0 HB3 LYS A 97 4.296 -2.764 -2.062 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.713 -1.277 -3.732 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.376 -1.051 -2.621 1.00 0.00 H new ATOM 0 HD2 LYS A 97 3.152 1.026 -1.878 1.00 0.00 H new ATOM 0 HD3 LYS A 97 4.823 0.665 -2.264 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.700 0.981 -4.414 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.598 2.348 -3.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.727 1.605 -5.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.672 1.088 -4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.684 -0.020 -5.210 1.00 0.00 H new ATOM 165 N GLU A 98 4.468 -3.754 0.672 1.00 0.00 N ATOM 166 CA GLU A 98 4.496 -5.122 1.174 1.00 0.00 C ATOM 167 C GLU A 98 3.599 -5.270 2.400 1.00 0.00 C ATOM 168 O GLU A 98 2.884 -6.262 2.543 1.00 0.00 O ATOM 169 CB GLU A 98 5.929 -5.531 1.525 1.00 0.00 C ATOM 170 CG GLU A 98 6.607 -6.358 0.446 1.00 0.00 C ATOM 171 CD GLU A 98 8.004 -6.797 0.840 1.00 0.00 C ATOM 172 OE1 GLU A 98 8.915 -5.943 0.844 1.00 0.00 O ATOM 173 OE2 GLU A 98 8.186 -7.995 1.143 1.00 0.00 O ATOM 0 H GLU A 98 5.354 -3.255 0.757 1.00 0.00 H new ATOM 0 HA GLU A 98 4.120 -5.778 0.389 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.520 -4.633 1.708 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.918 -6.100 2.454 1.00 0.00 H new ATOM 0 HG2 GLU A 98 6.000 -7.238 0.233 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.659 -5.776 -0.474 1.00 0.00 H new ATOM 180 N ARG A 99 3.643 -4.277 3.282 1.00 0.00 N ATOM 181 CA ARG A 99 2.836 -4.296 4.496 1.00 0.00 C ATOM 182 C ARG A 99 1.357 -4.468 4.162 1.00 0.00 C ATOM 183 O ARG A 99 0.677 -5.320 4.733 1.00 0.00 O ATOM 184 CB ARG A 99 3.044 -3.007 5.292 1.00 0.00 C ATOM 185 CG ARG A 99 2.279 -2.973 6.606 1.00 0.00 C ATOM 186 CD ARG A 99 2.373 -1.608 7.270 1.00 0.00 C ATOM 187 NE ARG A 99 2.868 -1.700 8.641 1.00 0.00 N ATOM 188 CZ ARG A 99 3.274 -0.651 9.347 1.00 0.00 C ATOM 189 NH1 ARG A 99 3.246 0.562 8.815 1.00 0.00 N ATOM 190 NH2 ARG A 99 3.711 -0.815 10.590 1.00 0.00 N ATOM 0 H ARG A 99 4.229 -3.449 3.178 1.00 0.00 H new ATOM 0 HA ARG A 99 3.155 -5.144 5.102 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.107 -2.884 5.497 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.737 -2.159 4.680 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.233 -3.220 6.426 1.00 0.00 H new ATOM 0 HG3 ARG A 99 2.675 -3.734 7.279 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.035 -0.966 6.688 1.00 0.00 H new ATOM 0 HD3 ARG A 99 1.390 -1.136 7.270 1.00 0.00 H new ATOM 0 HE ARG A 99 2.904 -2.620 9.080 1.00 0.00 H new ATOM 0 HH11 ARG A 99 2.912 0.693 7.860 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.559 1.365 9.360 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.735 -1.747 11.003 1.00 0.00 H new ATOM 0 HH22 ARG A 99 4.023 -0.009 11.132 1.00 0.00 H new ATOM 204 N ALA A 100 0.866 -3.653 3.235 1.00 0.00 N ATOM 205 CA ALA A 100 -0.532 -3.716 2.825 1.00 0.00 C ATOM 206 C ALA A 100 -0.863 -5.071 2.209 1.00 0.00 C ATOM 207 O ALA A 100 -1.855 -5.702 2.574 1.00 0.00 O ATOM 208 CB ALA A 100 -0.844 -2.597 1.842 1.00 0.00 C ATOM 0 H ALA A 100 1.415 -2.941 2.753 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.152 -3.589 3.713 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -1.891 -2.656 1.544 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.655 -1.634 2.315 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.210 -2.699 0.961 1.00 0.00 H new ATOM 214 N GLU A 101 -0.026 -5.512 1.276 1.00 0.00 N ATOM 215 CA GLU A 101 -0.232 -6.793 0.609 1.00 0.00 C ATOM 216 C GLU A 101 -0.355 -7.923 1.627 1.00 0.00 C ATOM 217 O GLU A 101 -1.099 -8.881 1.421 1.00 0.00 O ATOM 218 CB GLU A 101 0.920 -7.083 -0.354 1.00 0.00 C ATOM 219 CG GLU A 101 0.473 -7.309 -1.788 1.00 0.00 C ATOM 220 CD GLU A 101 0.109 -8.755 -2.065 1.00 0.00 C ATOM 221 OE1 GLU A 101 0.774 -9.651 -1.503 1.00 0.00 O ATOM 222 OE2 GLU A 101 -0.839 -8.990 -2.843 1.00 0.00 O ATOM 0 H GLU A 101 0.801 -5.002 0.965 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.162 -6.733 0.044 1.00 0.00 H new ATOM 0 HB2 GLU A 101 1.622 -6.250 -0.328 1.00 0.00 H new ATOM 0 HB3 GLU A 101 1.459 -7.965 -0.007 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -0.387 -6.675 -2.001 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.270 -7.003 -2.466 1.00 0.00 H new ATOM 229 N ARG A 102 0.381 -7.802 2.728 1.00 0.00 N ATOM 230 CA ARG A 102 0.356 -8.813 3.779 1.00 0.00 C ATOM 231 C ARG A 102 -0.987 -8.811 4.503 1.00 0.00 C ATOM 232 O ARG A 102 -1.531 -9.868 4.824 1.00 0.00 O ATOM 233 CB ARG A 102 1.488 -8.568 4.778 1.00 0.00 C ATOM 234 CG ARG A 102 1.805 -9.775 5.646 1.00 0.00 C ATOM 235 CD ARG A 102 3.103 -10.443 5.219 1.00 0.00 C ATOM 236 NE ARG A 102 4.269 -9.823 5.844 1.00 0.00 N ATOM 237 CZ ARG A 102 4.653 -10.072 7.091 1.00 0.00 C ATOM 238 NH1 ARG A 102 3.967 -10.922 7.843 1.00 0.00 N ATOM 239 NH2 ARG A 102 5.725 -9.469 7.588 1.00 0.00 N ATOM 0 H ARG A 102 1.001 -7.014 2.915 1.00 0.00 H new ATOM 0 HA ARG A 102 0.496 -9.789 3.314 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.386 -8.277 4.233 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.219 -7.729 5.420 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.880 -9.465 6.688 1.00 0.00 H new ATOM 0 HG3 ARG A 102 0.988 -10.493 5.585 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.070 -11.500 5.482 1.00 0.00 H new ATOM 0 HD3 ARG A 102 3.200 -10.387 4.135 1.00 0.00 H new ATOM 0 HE ARG A 102 4.818 -9.163 5.293 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.142 -11.387 7.464 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.265 -11.111 8.800 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.254 -8.814 7.013 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.020 -9.660 8.546 1.00 0.00 H new ATOM 253 N ARG A 103 -1.514 -7.618 4.759 1.00 0.00 N ATOM 254 CA ARG A 103 -2.791 -7.479 5.448 1.00 0.00 C ATOM 255 C ARG A 103 -3.913 -8.137 4.649 1.00 0.00 C ATOM 256 O ARG A 103 -4.730 -8.877 5.200 1.00 0.00 O ATOM 257 CB ARG A 103 -3.113 -6.001 5.677 1.00 0.00 C ATOM 258 CG ARG A 103 -2.758 -5.511 7.072 1.00 0.00 C ATOM 259 CD ARG A 103 -1.340 -4.966 7.126 1.00 0.00 C ATOM 260 NE ARG A 103 -1.229 -3.818 8.023 1.00 0.00 N ATOM 261 CZ ARG A 103 -1.188 -3.922 9.347 1.00 0.00 C ATOM 262 NH1 ARG A 103 -1.247 -5.114 9.924 1.00 0.00 N ATOM 263 NH2 ARG A 103 -1.086 -2.831 10.096 1.00 0.00 N ATOM 0 H ARG A 103 -1.076 -6.734 4.500 1.00 0.00 H new ATOM 0 HA ARG A 103 -2.712 -7.980 6.413 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -2.575 -5.402 4.942 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.177 -5.838 5.503 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.460 -4.734 7.375 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -2.862 -6.330 7.784 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -0.662 -5.752 7.458 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.025 -4.675 6.124 1.00 0.00 H new ATOM 0 HE ARG A 103 -1.180 -2.886 7.611 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -1.324 -5.955 9.351 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -1.215 -5.191 10.941 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -1.039 -1.912 9.655 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -1.055 -2.911 11.112 1.00 0.00 H new ATOM 277 N LEU A 104 -3.948 -7.862 3.350 1.00 0.00 N ATOM 278 CA LEU A 104 -4.970 -8.426 2.475 1.00 0.00 C ATOM 279 C LEU A 104 -4.894 -9.950 2.462 1.00 0.00 C ATOM 280 O LEU A 104 -5.891 -10.628 2.215 1.00 0.00 O ATOM 281 CB LEU A 104 -4.810 -7.883 1.054 1.00 0.00 C ATOM 282 CG LEU A 104 -5.602 -6.617 0.728 1.00 0.00 C ATOM 283 CD1 LEU A 104 -4.696 -5.567 0.104 1.00 0.00 C ATOM 284 CD2 LEU A 104 -6.765 -6.940 -0.198 1.00 0.00 C ATOM 0 H LEU A 104 -3.280 -7.252 2.879 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.946 -8.132 2.861 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.753 -7.681 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.105 -8.663 0.353 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.005 -6.213 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.277 -4.673 -0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.897 -5.315 0.802 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.263 -5.960 -0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.318 -6.027 -0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.384 -7.368 -1.125 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.428 -7.657 0.287 1.00 0.00 H new ATOM 296 N GLN A 105 -3.705 -10.480 2.729 1.00 0.00 N ATOM 297 CA GLN A 105 -3.500 -11.924 2.748 1.00 0.00 C ATOM 298 C GLN A 105 -4.443 -12.594 3.741 1.00 0.00 C ATOM 299 O GLN A 105 -4.796 -13.764 3.586 1.00 0.00 O ATOM 300 CB GLN A 105 -2.049 -12.249 3.105 1.00 0.00 C ATOM 301 CG GLN A 105 -1.537 -13.529 2.463 1.00 0.00 C ATOM 302 CD GLN A 105 -0.384 -14.146 3.230 1.00 0.00 C ATOM 303 OE1 GLN A 105 -0.587 -14.822 4.239 1.00 0.00 O ATOM 304 NE2 GLN A 105 0.834 -13.917 2.755 1.00 0.00 N ATOM 0 H GLN A 105 -2.870 -9.932 2.935 1.00 0.00 H new ATOM 0 HA GLN A 105 -3.717 -12.310 1.752 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -1.413 -11.419 2.798 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -1.960 -12.335 4.188 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.352 -14.250 2.398 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -1.217 -13.317 1.443 1.00 0.00 H new ATOM 0 HE21 GLN A 105 0.956 -13.351 1.915 1.00 0.00 H new ATOM 0 HE22 GLN A 105 1.648 -14.307 3.230 1.00 0.00 H new ATOM 313 N SER A 106 -4.848 -11.847 4.763 1.00 0.00 N ATOM 314 CA SER A 106 -5.747 -12.370 5.785 1.00 0.00 C ATOM 315 C SER A 106 -7.107 -12.717 5.186 1.00 0.00 C ATOM 316 O SER A 106 -7.366 -12.449 4.013 1.00 0.00 O ATOM 317 CB SER A 106 -5.919 -11.352 6.913 1.00 0.00 C ATOM 318 OG SER A 106 -7.031 -10.506 6.672 1.00 0.00 O ATOM 0 H SER A 106 -4.567 -10.877 4.905 1.00 0.00 H new ATOM 0 HA SER A 106 -5.305 -13.280 6.191 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.054 -11.874 7.860 1.00 0.00 H new ATOM 0 HB3 SER A 106 -5.014 -10.751 7.006 1.00 0.00 H new ATOM 0 HG SER A 106 -6.734 -9.703 6.195 1.00 0.00 H new ATOM 324 N GLN A 107 -7.970 -13.315 6.000 1.00 0.00 N ATOM 325 CA GLN A 107 -9.303 -13.699 5.551 1.00 0.00 C ATOM 326 C GLN A 107 -10.309 -12.583 5.813 1.00 0.00 C ATOM 327 O GLN A 107 -11.253 -12.394 5.046 1.00 0.00 O ATOM 328 CB GLN A 107 -9.751 -14.981 6.255 1.00 0.00 C ATOM 329 CG GLN A 107 -10.958 -15.640 5.608 1.00 0.00 C ATOM 330 CD GLN A 107 -12.199 -15.567 6.477 1.00 0.00 C ATOM 331 OE1 GLN A 107 -12.600 -14.490 6.918 1.00 0.00 O ATOM 332 NE2 GLN A 107 -12.815 -16.717 6.727 1.00 0.00 N ATOM 0 H GLN A 107 -7.770 -13.544 6.974 1.00 0.00 H new ATOM 0 HA GLN A 107 -9.259 -13.878 4.477 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.922 -15.689 6.264 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -9.986 -14.752 7.294 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -11.160 -15.159 4.651 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -10.728 -16.684 5.397 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -12.448 -17.587 6.341 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -13.655 -16.730 7.305 1.00 0.00 H new ATOM 341 N GLN A 108 -10.099 -11.847 6.900 1.00 0.00 N ATOM 342 CA GLN A 108 -10.989 -10.750 7.262 1.00 0.00 C ATOM 343 C GLN A 108 -10.566 -9.456 6.573 1.00 0.00 C ATOM 344 O GLN A 108 -10.383 -8.427 7.223 1.00 0.00 O ATOM 345 CB GLN A 108 -11.000 -10.554 8.779 1.00 0.00 C ATOM 346 CG GLN A 108 -12.105 -9.631 9.265 1.00 0.00 C ATOM 347 CD GLN A 108 -12.806 -10.161 10.500 1.00 0.00 C ATOM 348 OE1 GLN A 108 -12.422 -9.848 11.628 1.00 0.00 O ATOM 349 NE2 GLN A 108 -13.840 -10.968 10.295 1.00 0.00 N ATOM 0 H GLN A 108 -9.321 -11.990 7.544 1.00 0.00 H new ATOM 0 HA GLN A 108 -11.995 -11.006 6.929 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.111 -11.525 9.262 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.037 -10.150 9.092 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -11.684 -8.650 9.484 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -12.836 -9.494 8.468 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -14.124 -11.201 9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -14.350 -11.355 11.089 1.00 0.00 H new ATOM 358 N ASP A 109 -10.414 -9.517 5.255 1.00 0.00 N ATOM 359 CA ASP A 109 -10.014 -8.350 4.477 1.00 0.00 C ATOM 360 C ASP A 109 -11.224 -7.693 3.821 1.00 0.00 C ATOM 361 O ASP A 109 -11.194 -7.357 2.636 1.00 0.00 O ATOM 362 CB ASP A 109 -8.991 -8.747 3.411 1.00 0.00 C ATOM 363 CG ASP A 109 -9.450 -9.930 2.582 1.00 0.00 C ATOM 364 OD1 ASP A 109 -9.531 -11.047 3.134 1.00 0.00 O ATOM 365 OD2 ASP A 109 -9.729 -9.738 1.380 1.00 0.00 O ATOM 0 H ASP A 109 -10.562 -10.362 4.703 1.00 0.00 H new ATOM 0 HA ASP A 109 -9.557 -7.630 5.156 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.806 -7.897 2.755 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -8.044 -8.990 3.893 1.00 0.00 H new ATOM 370 N ASP A 110 -12.287 -7.515 4.596 1.00 0.00 N ATOM 371 CA ASP A 110 -13.508 -6.899 4.089 1.00 0.00 C ATOM 372 C ASP A 110 -13.523 -5.402 4.381 1.00 0.00 C ATOM 373 O ASP A 110 -13.720 -4.587 3.480 1.00 0.00 O ATOM 374 CB ASP A 110 -14.737 -7.564 4.713 1.00 0.00 C ATOM 375 CG ASP A 110 -15.294 -8.677 3.847 1.00 0.00 C ATOM 376 OD1 ASP A 110 -14.572 -9.142 2.940 1.00 0.00 O ATOM 377 OD2 ASP A 110 -16.452 -9.083 4.077 1.00 0.00 O ATOM 0 H ASP A 110 -12.329 -7.788 5.578 1.00 0.00 H new ATOM 0 HA ASP A 110 -13.536 -7.041 3.009 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.472 -7.966 5.691 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -15.510 -6.813 4.876 1.00 0.00 H new ATOM 382 N ILE A 111 -13.314 -5.048 5.645 1.00 0.00 N ATOM 383 CA ILE A 111 -13.303 -3.649 6.054 1.00 0.00 C ATOM 384 C ILE A 111 -11.904 -3.053 5.937 1.00 0.00 C ATOM 385 O ILE A 111 -11.745 -1.844 5.769 1.00 0.00 O ATOM 386 CB ILE A 111 -13.801 -3.482 7.501 1.00 0.00 C ATOM 387 CG1 ILE A 111 -15.171 -4.142 7.671 1.00 0.00 C ATOM 388 CG2 ILE A 111 -13.867 -2.008 7.872 1.00 0.00 C ATOM 389 CD1 ILE A 111 -16.224 -3.598 6.732 1.00 0.00 C ATOM 0 H ILE A 111 -13.150 -5.711 6.403 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.978 -3.118 5.383 1.00 0.00 H new ATOM 0 HB ILE A 111 -13.096 -3.974 8.171 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -15.071 -5.215 7.509 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -15.506 -4.005 8.699 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -14.221 -1.907 8.898 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -12.874 -1.566 7.785 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.553 -1.494 7.199 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -17.169 -4.112 6.908 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -16.353 -2.530 6.909 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -15.910 -3.760 5.701 1.00 0.00 H new ATOM 401 N ASP A 112 -10.893 -3.910 6.027 1.00 0.00 N ATOM 402 CA ASP A 112 -9.506 -3.469 5.929 1.00 0.00 C ATOM 403 C ASP A 112 -9.155 -3.095 4.492 1.00 0.00 C ATOM 404 O ASP A 112 -8.277 -2.266 4.252 1.00 0.00 O ATOM 405 CB ASP A 112 -8.563 -4.566 6.428 1.00 0.00 C ATOM 406 CG ASP A 112 -7.159 -4.053 6.676 1.00 0.00 C ATOM 407 OD1 ASP A 112 -6.995 -2.826 6.842 1.00 0.00 O ATOM 408 OD2 ASP A 112 -6.222 -4.879 6.704 1.00 0.00 O ATOM 0 H ASP A 112 -11.008 -4.914 6.168 1.00 0.00 H new ATOM 0 HA ASP A 112 -9.387 -2.585 6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -8.960 -4.990 7.350 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -8.528 -5.372 5.695 1.00 0.00 H new ATOM 413 N PHE A 113 -9.847 -3.711 3.540 1.00 0.00 N ATOM 414 CA PHE A 113 -9.608 -3.444 2.126 1.00 0.00 C ATOM 415 C PHE A 113 -9.669 -1.946 1.838 1.00 0.00 C ATOM 416 O PHE A 113 -8.972 -1.443 0.956 1.00 0.00 O ATOM 417 CB PHE A 113 -10.634 -4.182 1.264 1.00 0.00 C ATOM 418 CG PHE A 113 -10.237 -4.290 -0.179 1.00 0.00 C ATOM 419 CD1 PHE A 113 -10.422 -3.222 -1.044 1.00 0.00 C ATOM 420 CD2 PHE A 113 -9.680 -5.458 -0.674 1.00 0.00 C ATOM 421 CE1 PHE A 113 -10.057 -3.318 -2.373 1.00 0.00 C ATOM 422 CE2 PHE A 113 -9.314 -5.560 -2.003 1.00 0.00 C ATOM 423 CZ PHE A 113 -9.504 -4.488 -2.853 1.00 0.00 C ATOM 0 H PHE A 113 -10.578 -4.399 3.721 1.00 0.00 H new ATOM 0 HA PHE A 113 -8.610 -3.805 1.878 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -10.782 -5.184 1.668 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -11.592 -3.666 1.331 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -10.856 -2.305 -0.675 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -9.530 -6.299 -0.013 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -10.204 -2.478 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -8.880 -6.476 -2.376 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.220 -4.565 -3.892 1.00 0.00 H new ATOM 433 N LYS A 114 -10.507 -1.239 2.588 1.00 0.00 N ATOM 434 CA LYS A 114 -10.660 0.201 2.415 1.00 0.00 C ATOM 435 C LYS A 114 -9.395 0.938 2.843 1.00 0.00 C ATOM 436 O LYS A 114 -8.833 1.721 2.079 1.00 0.00 O ATOM 437 CB LYS A 114 -11.857 0.707 3.224 1.00 0.00 C ATOM 438 CG LYS A 114 -12.431 2.014 2.706 1.00 0.00 C ATOM 439 CD LYS A 114 -13.297 1.795 1.476 1.00 0.00 C ATOM 440 CE LYS A 114 -12.520 2.057 0.195 1.00 0.00 C ATOM 441 NZ LYS A 114 -13.318 2.844 -0.785 1.00 0.00 N ATOM 0 H LYS A 114 -11.091 -1.640 3.322 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.834 0.399 1.357 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -12.639 -0.053 3.215 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.553 0.839 4.262 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -13.023 2.488 3.489 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -11.618 2.698 2.463 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -13.673 0.772 1.472 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -14.164 2.454 1.518 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -11.601 2.594 0.431 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -12.228 1.107 -0.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -12.754 3.002 -1.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.182 2.320 -1.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.575 3.761 -0.367 1.00 0.00 H new ATOM 455 N ARG A 115 -8.953 0.681 4.071 1.00 0.00 N ATOM 456 CA ARG A 115 -7.755 1.320 4.599 1.00 0.00 C ATOM 457 C ARG A 115 -6.545 1.019 3.720 1.00 0.00 C ATOM 458 O ARG A 115 -5.699 1.884 3.495 1.00 0.00 O ATOM 459 CB ARG A 115 -7.489 0.848 6.031 1.00 0.00 C ATOM 460 CG ARG A 115 -8.412 1.476 7.061 1.00 0.00 C ATOM 461 CD ARG A 115 -7.747 1.563 8.426 1.00 0.00 C ATOM 462 NE ARG A 115 -6.665 2.544 8.446 1.00 0.00 N ATOM 463 CZ ARG A 115 -5.922 2.797 9.518 1.00 0.00 C ATOM 464 NH1 ARG A 115 -6.143 2.144 10.650 1.00 0.00 N ATOM 465 NH2 ARG A 115 -4.955 3.703 9.457 1.00 0.00 N ATOM 0 H ARG A 115 -9.407 0.035 4.717 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.920 2.397 4.603 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -7.596 -0.236 6.073 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -6.456 1.077 6.294 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -8.701 2.474 6.732 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -9.327 0.888 7.138 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -8.492 1.830 9.176 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -7.354 0.584 8.701 1.00 0.00 H new ATOM 0 HE ARG A 115 -6.469 3.063 7.590 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -6.885 1.446 10.699 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -5.571 2.340 11.472 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -4.781 4.206 8.587 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -4.385 3.897 10.280 1.00 0.00 H new ATOM 479 N ALA A 116 -6.470 -0.212 3.226 1.00 0.00 N ATOM 480 CA ALA A 116 -5.365 -0.626 2.371 1.00 0.00 C ATOM 481 C ALA A 116 -5.409 0.096 1.028 1.00 0.00 C ATOM 482 O ALA A 116 -4.385 0.259 0.368 1.00 0.00 O ATOM 483 CB ALA A 116 -5.394 -2.133 2.163 1.00 0.00 C ATOM 0 H ALA A 116 -7.162 -0.940 3.403 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.433 -0.357 2.868 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -4.563 -2.428 1.522 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -5.305 -2.635 3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.334 -2.417 1.691 1.00 0.00 H new ATOM 489 N GLU A 117 -6.604 0.525 0.632 1.00 0.00 N ATOM 490 CA GLU A 117 -6.780 1.228 -0.632 1.00 0.00 C ATOM 491 C GLU A 117 -6.266 2.662 -0.534 1.00 0.00 C ATOM 492 O GLU A 117 -5.679 3.189 -1.480 1.00 0.00 O ATOM 493 CB GLU A 117 -8.256 1.231 -1.038 1.00 0.00 C ATOM 494 CG GLU A 117 -8.476 1.404 -2.532 1.00 0.00 C ATOM 495 CD GLU A 117 -9.887 1.049 -2.958 1.00 0.00 C ATOM 496 OE1 GLU A 117 -10.299 -0.109 -2.739 1.00 0.00 O ATOM 497 OE2 GLU A 117 -10.579 1.929 -3.511 1.00 0.00 O ATOM 0 H GLU A 117 -7.462 0.398 1.168 1.00 0.00 H new ATOM 0 HA GLU A 117 -6.202 0.704 -1.393 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.714 0.295 -0.718 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -8.768 2.034 -0.508 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.266 2.437 -2.809 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.768 0.778 -3.075 1.00 0.00 H new ATOM 504 N LEU A 118 -6.491 3.287 0.615 1.00 0.00 N ATOM 505 CA LEU A 118 -6.052 4.660 0.838 1.00 0.00 C ATOM 506 C LEU A 118 -4.531 4.738 0.927 1.00 0.00 C ATOM 507 O LEU A 118 -3.908 5.617 0.334 1.00 0.00 O ATOM 508 CB LEU A 118 -6.678 5.216 2.119 1.00 0.00 C ATOM 509 CG LEU A 118 -7.287 6.615 2.016 1.00 0.00 C ATOM 510 CD1 LEU A 118 -6.255 7.609 1.505 1.00 0.00 C ATOM 511 CD2 LEU A 118 -8.509 6.599 1.110 1.00 0.00 C ATOM 0 H LEU A 118 -6.975 2.865 1.408 1.00 0.00 H new ATOM 0 HA LEU A 118 -6.380 5.262 -0.010 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -7.455 4.527 2.449 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -5.914 5.230 2.896 1.00 0.00 H new ATOM 0 HG LEU A 118 -7.602 6.928 3.011 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -6.706 8.599 1.438 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -5.409 7.641 2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.910 7.300 0.518 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -8.929 7.603 1.048 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -8.219 6.265 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -9.255 5.917 1.518 1.00 0.00 H new ATOM 523 N ALA A 119 -3.939 3.810 1.673 1.00 0.00 N ATOM 524 CA ALA A 119 -2.491 3.771 1.837 1.00 0.00 C ATOM 525 C ALA A 119 -1.794 3.553 0.498 1.00 0.00 C ATOM 526 O ALA A 119 -0.829 4.246 0.170 1.00 0.00 O ATOM 527 CB ALA A 119 -2.101 2.679 2.821 1.00 0.00 C ATOM 0 H ALA A 119 -4.440 3.076 2.173 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.168 4.734 2.233 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.017 2.661 2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -2.563 2.878 3.788 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.443 1.714 2.448 1.00 0.00 H new ATOM 533 N LEU A 120 -2.285 2.588 -0.269 1.00 0.00 N ATOM 534 CA LEU A 120 -1.708 2.278 -1.573 1.00 0.00 C ATOM 535 C LEU A 120 -1.822 3.472 -2.516 1.00 0.00 C ATOM 536 O LEU A 120 -0.948 3.703 -3.351 1.00 0.00 O ATOM 537 CB LEU A 120 -2.404 1.062 -2.185 1.00 0.00 C ATOM 538 CG LEU A 120 -1.498 0.058 -2.898 1.00 0.00 C ATOM 539 CD1 LEU A 120 -0.824 0.706 -4.098 1.00 0.00 C ATOM 540 CD2 LEU A 120 -0.458 -0.499 -1.936 1.00 0.00 C ATOM 0 H LEU A 120 -3.082 2.006 -0.011 1.00 0.00 H new ATOM 0 HA LEU A 120 -0.652 2.050 -1.431 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.940 0.539 -1.393 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.151 1.416 -2.896 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.113 -0.768 -3.255 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.183 -0.023 -4.593 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.584 1.055 -4.797 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.222 1.551 -3.765 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.178 -1.212 -2.461 1.00 0.00 H new ATOM 0 HD22 LEU A 120 0.153 0.316 -1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -0.960 -1.001 -1.109 1.00 0.00 H new ATOM 552 N LYS A 121 -2.905 4.229 -2.375 1.00 0.00 N ATOM 553 CA LYS A 121 -3.133 5.402 -3.212 1.00 0.00 C ATOM 554 C LYS A 121 -2.137 6.508 -2.879 1.00 0.00 C ATOM 555 O LYS A 121 -1.708 7.254 -3.760 1.00 0.00 O ATOM 556 CB LYS A 121 -4.563 5.915 -3.026 1.00 0.00 C ATOM 557 CG LYS A 121 -5.361 5.971 -4.317 1.00 0.00 C ATOM 558 CD LYS A 121 -5.176 7.300 -5.030 1.00 0.00 C ATOM 559 CE LYS A 121 -6.444 7.726 -5.753 1.00 0.00 C ATOM 560 NZ LYS A 121 -6.709 9.183 -5.598 1.00 0.00 N ATOM 0 H LYS A 121 -3.639 4.051 -1.689 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.991 5.110 -4.252 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -5.082 5.271 -2.316 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -4.528 6.912 -2.586 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.050 5.158 -4.974 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -6.418 5.818 -4.099 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.893 8.065 -4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.358 7.219 -5.745 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -6.357 7.484 -6.812 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -7.291 7.160 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -7.582 9.433 -6.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -6.818 9.411 -4.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -5.913 9.724 -5.991 1.00 0.00 H new ATOM 574 N ARG A 122 -1.772 6.608 -1.605 1.00 0.00 N ATOM 575 CA ARG A 122 -0.827 7.624 -1.159 1.00 0.00 C ATOM 576 C ARG A 122 0.567 7.351 -1.716 1.00 0.00 C ATOM 577 O ARG A 122 1.222 8.249 -2.243 1.00 0.00 O ATOM 578 CB ARG A 122 -0.777 7.668 0.369 1.00 0.00 C ATOM 579 CG ARG A 122 -0.819 9.076 0.939 1.00 0.00 C ATOM 580 CD ARG A 122 -2.008 9.266 1.867 1.00 0.00 C ATOM 581 NE ARG A 122 -1.968 8.350 3.003 1.00 0.00 N ATOM 582 CZ ARG A 122 -1.228 8.556 4.087 1.00 0.00 C ATOM 583 NH1 ARG A 122 -0.471 9.640 4.181 1.00 0.00 N ATOM 584 NH2 ARG A 122 -1.245 7.676 5.080 1.00 0.00 N ATOM 0 H ARG A 122 -2.116 5.998 -0.864 1.00 0.00 H new ATOM 0 HA ARG A 122 -1.167 8.590 -1.533 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -1.616 7.098 0.768 1.00 0.00 H new ATOM 0 HB3 ARG A 122 0.134 7.175 0.709 1.00 0.00 H new ATOM 0 HG2 ARG A 122 0.104 9.277 1.483 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -0.873 9.798 0.124 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -2.023 10.294 2.230 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -2.932 9.111 1.309 1.00 0.00 H new ATOM 0 HE ARG A 122 -2.539 7.506 2.962 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.456 10.319 3.420 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.096 9.795 5.015 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.826 6.841 5.011 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -0.677 7.835 5.912 1.00 0.00 H new ATOM 598 N ALA A 123 1.015 6.105 -1.594 1.00 0.00 N ATOM 599 CA ALA A 123 2.329 5.714 -2.087 1.00 0.00 C ATOM 600 C ALA A 123 2.395 5.803 -3.608 1.00 0.00 C ATOM 601 O ALA A 123 3.412 6.203 -4.172 1.00 0.00 O ATOM 602 CB ALA A 123 2.669 4.305 -1.623 1.00 0.00 C ATOM 0 H ALA A 123 0.486 5.350 -1.158 1.00 0.00 H new ATOM 0 HA ALA A 123 3.064 6.407 -1.677 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.653 4.026 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.674 4.272 -0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 123 1.924 3.607 -2.004 1.00 0.00 H new ATOM 608 N MET A 124 1.303 5.426 -4.265 1.00 0.00 N ATOM 609 CA MET A 124 1.237 5.465 -5.722 1.00 0.00 C ATOM 610 C MET A 124 1.447 6.884 -6.239 1.00 0.00 C ATOM 611 O MET A 124 2.156 7.099 -7.221 1.00 0.00 O ATOM 612 CB MET A 124 -0.110 4.927 -6.208 1.00 0.00 C ATOM 613 CG MET A 124 -0.210 3.410 -6.165 1.00 0.00 C ATOM 614 SD MET A 124 0.061 2.652 -7.779 1.00 0.00 S ATOM 615 CE MET A 124 -0.959 1.187 -7.640 1.00 0.00 C ATOM 0 H MET A 124 0.453 5.090 -3.813 1.00 0.00 H new ATOM 0 HA MET A 124 2.035 4.833 -6.113 1.00 0.00 H new ATOM 0 HB2 MET A 124 -0.905 5.353 -5.595 1.00 0.00 H new ATOM 0 HB3 MET A 124 -0.280 5.265 -7.230 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.522 3.021 -5.457 1.00 0.00 H new ATOM 0 HG3 MET A 124 -1.194 3.125 -5.794 1.00 0.00 H new ATOM 0 HE1 MET A 124 -1.054 0.716 -8.618 1.00 0.00 H new ATOM 0 HE2 MET A 124 -0.498 0.487 -6.943 1.00 0.00 H new ATOM 0 HE3 MET A 124 -1.947 1.465 -7.274 1.00 0.00 H new ATOM 625 N ASN A 125 0.825 7.850 -5.570 1.00 0.00 N ATOM 626 CA ASN A 125 0.943 9.250 -5.963 1.00 0.00 C ATOM 627 C ASN A 125 2.399 9.704 -5.926 1.00 0.00 C ATOM 628 O ASN A 125 2.898 10.303 -6.879 1.00 0.00 O ATOM 629 CB ASN A 125 0.098 10.133 -5.043 1.00 0.00 C ATOM 630 CG ASN A 125 -0.107 11.526 -5.606 1.00 0.00 C ATOM 631 OD1 ASN A 125 0.852 12.207 -5.971 1.00 0.00 O ATOM 632 ND2 ASN A 125 -1.361 11.955 -5.679 1.00 0.00 N ATOM 0 H ASN A 125 0.235 7.689 -4.754 1.00 0.00 H new ATOM 0 HA ASN A 125 0.576 9.347 -6.985 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -0.872 9.662 -4.883 1.00 0.00 H new ATOM 0 HB3 ASN A 125 0.582 10.205 -4.069 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.561 12.884 -6.050 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -2.124 11.356 -5.365 1.00 0.00 H new ATOM 639 N ARG A 126 3.076 9.415 -4.819 1.00 0.00 N ATOM 640 CA ARG A 126 4.474 9.794 -4.656 1.00 0.00 C ATOM 641 C ARG A 126 5.363 9.019 -5.625 1.00 0.00 C ATOM 642 O ARG A 126 6.438 9.485 -6.006 1.00 0.00 O ATOM 643 CB ARG A 126 4.929 9.543 -3.218 1.00 0.00 C ATOM 644 CG ARG A 126 5.237 10.816 -2.446 1.00 0.00 C ATOM 645 CD ARG A 126 4.962 10.647 -0.959 1.00 0.00 C ATOM 646 NE ARG A 126 3.890 11.525 -0.499 1.00 0.00 N ATOM 647 CZ ARG A 126 4.055 12.819 -0.250 1.00 0.00 C ATOM 648 NH1 ARG A 126 5.243 13.383 -0.419 1.00 0.00 N ATOM 649 NH2 ARG A 126 3.031 13.552 0.167 1.00 0.00 N ATOM 0 H ARG A 126 2.678 8.919 -4.021 1.00 0.00 H new ATOM 0 HA ARG A 126 4.564 10.857 -4.877 1.00 0.00 H new ATOM 0 HB2 ARG A 126 4.152 8.988 -2.692 1.00 0.00 H new ATOM 0 HB3 ARG A 126 5.818 8.912 -3.232 1.00 0.00 H new ATOM 0 HG2 ARG A 126 6.282 11.089 -2.595 1.00 0.00 H new ATOM 0 HG3 ARG A 126 4.634 11.635 -2.838 1.00 0.00 H new ATOM 0 HD2 ARG A 126 4.694 9.610 -0.755 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.871 10.858 -0.396 1.00 0.00 H new ATOM 0 HE ARG A 126 2.963 11.122 -0.361 1.00 0.00 H new ATOM 0 HH11 ARG A 126 6.032 12.823 -0.741 1.00 0.00 H new ATOM 0 HH12 ARG A 126 5.368 14.377 -0.227 1.00 0.00 H new ATOM 0 HH21 ARG A 126 2.115 13.122 0.297 1.00 0.00 H new ATOM 0 HH22 ARG A 126 3.159 14.546 0.358 1.00 0.00 H new ATOM 663 N LEU A 127 4.909 7.834 -6.017 1.00 0.00 N ATOM 664 CA LEU A 127 5.663 6.994 -6.942 1.00 0.00 C ATOM 665 C LEU A 127 5.662 7.590 -8.345 1.00 0.00 C ATOM 666 O LEU A 127 6.691 7.615 -9.020 1.00 0.00 O ATOM 667 CB LEU A 127 5.073 5.582 -6.974 1.00 0.00 C ATOM 668 CG LEU A 127 6.080 4.438 -7.096 1.00 0.00 C ATOM 669 CD1 LEU A 127 7.007 4.665 -8.280 1.00 0.00 C ATOM 670 CD2 LEU A 127 6.880 4.292 -5.810 1.00 0.00 C ATOM 0 H LEU A 127 4.023 7.433 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 127 6.694 6.944 -6.591 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.491 5.432 -6.065 1.00 0.00 H new ATOM 0 HB3 LEU A 127 4.378 5.519 -7.811 1.00 0.00 H new ATOM 0 HG LEU A 127 5.530 3.513 -7.265 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.716 3.840 -8.350 1.00 0.00 H new ATOM 0 HD12 LEU A 127 6.420 4.718 -9.197 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.550 5.600 -8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 127 7.592 3.473 -5.915 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.419 5.218 -5.610 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.203 4.080 -4.982 1.00 0.00 H new ATOM 682 N SER A 128 4.501 8.072 -8.777 1.00 0.00 N ATOM 683 CA SER A 128 4.366 8.667 -10.102 1.00 0.00 C ATOM 684 C SER A 128 5.223 9.924 -10.222 1.00 0.00 C ATOM 685 O SER A 128 6.000 10.072 -11.165 1.00 0.00 O ATOM 686 CB SER A 128 2.901 9.006 -10.385 1.00 0.00 C ATOM 687 OG SER A 128 2.792 9.998 -11.391 1.00 0.00 O ATOM 0 H SER A 128 3.641 8.062 -8.229 1.00 0.00 H new ATOM 0 HA SER A 128 4.712 7.940 -10.837 1.00 0.00 H new ATOM 0 HB2 SER A 128 2.370 8.107 -10.698 1.00 0.00 H new ATOM 0 HB3 SER A 128 2.423 9.357 -9.471 1.00 0.00 H new ATOM 0 HG SER A 128 1.846 10.196 -11.554 1.00 0.00 H new ATOM 693 N VAL A 129 5.074 10.828 -9.259 1.00 0.00 N ATOM 694 CA VAL A 129 5.834 12.073 -9.254 1.00 0.00 C ATOM 695 C VAL A 129 7.334 11.801 -9.208 1.00 0.00 C ATOM 696 O VAL A 129 8.126 12.531 -9.803 1.00 0.00 O ATOM 697 CB VAL A 129 5.448 12.962 -8.059 1.00 0.00 C ATOM 698 CG1 VAL A 129 5.713 12.239 -6.746 1.00 0.00 C ATOM 699 CG2 VAL A 129 6.203 14.282 -8.111 1.00 0.00 C ATOM 0 H VAL A 129 4.434 10.722 -8.472 1.00 0.00 H new ATOM 0 HA VAL A 129 5.590 12.596 -10.179 1.00 0.00 H new ATOM 0 HB VAL A 129 4.381 13.177 -8.119 1.00 0.00 H new ATOM 0 HG11 VAL A 129 5.434 12.884 -5.913 1.00 0.00 H new ATOM 0 HG12 VAL A 129 5.123 11.323 -6.710 1.00 0.00 H new ATOM 0 HG13 VAL A 129 6.772 11.992 -6.674 1.00 0.00 H new ATOM 0 HG21 VAL A 129 5.918 14.898 -7.258 1.00 0.00 H new ATOM 0 HG22 VAL A 129 7.275 14.089 -8.077 1.00 0.00 H new ATOM 0 HG23 VAL A 129 5.958 14.805 -9.035 1.00 0.00 H new ATOM 709 N ALA A 130 7.716 10.744 -8.499 1.00 0.00 N ATOM 710 CA ALA A 130 9.121 10.374 -8.376 1.00 0.00 C ATOM 711 C ALA A 130 9.747 10.137 -9.747 1.00 0.00 C ATOM 712 O ALA A 130 10.761 10.744 -10.089 1.00 0.00 O ATOM 713 CB ALA A 130 9.266 9.135 -7.506 1.00 0.00 C ATOM 0 H ALA A 130 7.073 10.129 -8.001 1.00 0.00 H new ATOM 0 HA ALA A 130 9.650 11.201 -7.902 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.320 8.870 -7.423 1.00 0.00 H new ATOM 0 HB2 ALA A 130 8.863 9.338 -6.514 1.00 0.00 H new ATOM 0 HB3 ALA A 130 8.718 8.307 -7.957 1.00 0.00 H new ATOM 719 N GLU A 131 9.136 9.249 -10.526 1.00 0.00 N ATOM 720 CA GLU A 131 9.636 8.931 -11.858 1.00 0.00 C ATOM 721 C GLU A 131 9.854 10.202 -12.675 1.00 0.00 C ATOM 722 O GLU A 131 10.976 10.509 -13.075 1.00 0.00 O ATOM 723 CB GLU A 131 8.659 8.005 -12.586 1.00 0.00 C ATOM 724 CG GLU A 131 9.324 7.109 -13.618 1.00 0.00 C ATOM 725 CD GLU A 131 9.618 5.722 -13.081 1.00 0.00 C ATOM 726 OE1 GLU A 131 10.638 5.561 -12.379 1.00 0.00 O ATOM 727 OE2 GLU A 131 8.829 4.796 -13.364 1.00 0.00 O ATOM 0 H GLU A 131 8.295 8.738 -10.258 1.00 0.00 H new ATOM 0 HA GLU A 131 10.594 8.422 -11.747 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.147 7.382 -11.853 1.00 0.00 H new ATOM 0 HB3 GLU A 131 7.897 8.609 -13.079 1.00 0.00 H new ATOM 0 HG2 GLU A 131 8.679 7.027 -14.493 1.00 0.00 H new ATOM 0 HG3 GLU A 131 10.254 7.571 -13.950 1.00 0.00 H new ATOM 734 N MET A 132 8.773 10.935 -12.917 1.00 0.00 N ATOM 735 CA MET A 132 8.846 12.172 -13.686 1.00 0.00 C ATOM 736 C MET A 132 9.045 13.373 -12.765 1.00 0.00 C ATOM 737 O MET A 132 8.425 14.420 -12.950 1.00 0.00 O ATOM 738 CB MET A 132 7.574 12.358 -14.517 1.00 0.00 C ATOM 739 CG MET A 132 7.521 11.473 -15.751 1.00 0.00 C ATOM 740 SD MET A 132 7.835 12.385 -17.274 1.00 0.00 S ATOM 741 CE MET A 132 6.164 12.762 -17.795 1.00 0.00 C ATOM 0 H MET A 132 7.836 10.694 -12.592 1.00 0.00 H new ATOM 0 HA MET A 132 9.703 12.103 -14.357 1.00 0.00 H new ATOM 0 HB2 MET A 132 6.707 12.147 -13.891 1.00 0.00 H new ATOM 0 HB3 MET A 132 7.500 13.401 -14.824 1.00 0.00 H new ATOM 0 HG2 MET A 132 8.256 10.674 -15.652 1.00 0.00 H new ATOM 0 HG3 MET A 132 6.541 10.999 -15.811 1.00 0.00 H new ATOM 0 HE1 MET A 132 6.192 13.326 -18.727 1.00 0.00 H new ATOM 0 HE2 MET A 132 5.613 11.834 -17.949 1.00 0.00 H new ATOM 0 HE3 MET A 132 5.668 13.355 -17.027 1.00 0.00 H new ATOM 751 N LYS A 133 9.915 13.214 -11.774 1.00 0.00 N ATOM 752 CA LYS A 133 10.198 14.284 -10.825 1.00 0.00 C ATOM 753 C LYS A 133 10.639 15.551 -11.550 1.00 0.00 C ATOM 754 O LYS A 133 10.040 16.614 -11.383 1.00 0.00 O ATOM 755 CB LYS A 133 11.282 13.845 -9.837 1.00 0.00 C ATOM 756 CG LYS A 133 10.784 13.711 -8.408 1.00 0.00 C ATOM 757 CD LYS A 133 11.811 13.025 -7.523 1.00 0.00 C ATOM 758 CE LYS A 133 11.246 12.729 -6.141 1.00 0.00 C ATOM 759 NZ LYS A 133 10.950 13.977 -5.385 1.00 0.00 N ATOM 0 H LYS A 133 10.437 12.354 -11.607 1.00 0.00 H new ATOM 0 HA LYS A 133 9.282 14.501 -10.276 1.00 0.00 H new ATOM 0 HB2 LYS A 133 11.692 12.888 -10.161 1.00 0.00 H new ATOM 0 HB3 LYS A 133 12.099 14.567 -9.862 1.00 0.00 H new ATOM 0 HG2 LYS A 133 10.558 14.699 -8.006 1.00 0.00 H new ATOM 0 HG3 LYS A 133 9.855 13.142 -8.397 1.00 0.00 H new ATOM 0 HD2 LYS A 133 12.134 12.096 -7.992 1.00 0.00 H new ATOM 0 HD3 LYS A 133 12.693 13.658 -7.429 1.00 0.00 H new ATOM 0 HE2 LYS A 133 10.335 12.139 -6.240 1.00 0.00 H new ATOM 0 HE3 LYS A 133 11.958 12.124 -5.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 10.631 13.734 -4.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 11.809 14.560 -5.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 10.202 14.510 -5.874 1.00 0.00 H new TER 773 LYS A 133