USER MOD reduce.3.24.130724 H: found=0, std=0, add=397, rem=0, adj=2 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 108 GLN : amide:sc= -0.0206 K(o=-0.021,f=-1.3) 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 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 88 12.058 10.915 -2.704 1.00 0.00 N ATOM 2 CA ILE A 88 13.263 10.095 -2.689 1.00 0.00 C ATOM 3 C ILE A 88 13.242 9.108 -1.527 1.00 0.00 C ATOM 4 O ILE A 88 14.259 8.886 -0.869 1.00 0.00 O ATOM 5 CB ILE A 88 14.532 10.962 -2.587 1.00 0.00 C ATOM 6 CG1 ILE A 88 14.452 11.882 -1.367 1.00 0.00 C ATOM 7 CG2 ILE A 88 14.721 11.776 -3.859 1.00 0.00 C ATOM 8 CD1 ILE A 88 15.804 12.325 -0.855 1.00 0.00 C ATOM 0 HA ILE A 88 13.282 9.545 -3.630 1.00 0.00 H new ATOM 0 HB ILE A 88 15.394 10.305 -2.467 1.00 0.00 H new ATOM 0 HG12 ILE A 88 13.863 12.763 -1.624 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.921 11.366 -0.567 1.00 0.00 H new ATOM 0 HG21 ILE A 88 15.622 12.384 -3.772 1.00 0.00 H new ATOM 0 HG22 ILE A 88 14.818 11.103 -4.711 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.858 12.426 -4.007 1.00 0.00 H new ATOM 0 HD11 ILE A 88 15.670 12.974 0.010 1.00 0.00 H new ATOM 0 HD12 ILE A 88 16.388 11.451 -0.566 1.00 0.00 H new ATOM 0 HD13 ILE A 88 16.330 12.869 -1.640 1.00 0.00 H new ATOM 20 N ASP A 89 12.078 8.517 -1.282 1.00 0.00 N ATOM 21 CA ASP A 89 11.924 7.550 -0.200 1.00 0.00 C ATOM 22 C ASP A 89 11.412 6.216 -0.734 1.00 0.00 C ATOM 23 O ASP A 89 10.267 5.836 -0.489 1.00 0.00 O ATOM 24 CB ASP A 89 10.966 8.090 0.862 1.00 0.00 C ATOM 25 CG ASP A 89 9.631 8.510 0.280 1.00 0.00 C ATOM 26 OD1 ASP A 89 9.563 9.602 -0.321 1.00 0.00 O ATOM 27 OD2 ASP A 89 8.654 7.746 0.424 1.00 0.00 O ATOM 0 H ASP A 89 11.227 8.690 -1.817 1.00 0.00 H new ATOM 0 HA ASP A 89 12.902 7.389 0.253 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.803 7.326 1.622 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.426 8.943 1.361 1.00 0.00 H new ATOM 32 N VAL A 90 12.268 5.509 -1.464 1.00 0.00 N ATOM 33 CA VAL A 90 11.902 4.217 -2.033 1.00 0.00 C ATOM 34 C VAL A 90 11.702 3.173 -0.940 1.00 0.00 C ATOM 35 O VAL A 90 10.855 2.286 -1.061 1.00 0.00 O ATOM 36 CB VAL A 90 12.974 3.713 -3.017 1.00 0.00 C ATOM 37 CG1 VAL A 90 12.568 2.372 -3.608 1.00 0.00 C ATOM 38 CG2 VAL A 90 13.211 4.739 -4.116 1.00 0.00 C ATOM 0 H VAL A 90 13.220 5.809 -1.676 1.00 0.00 H new ATOM 0 HA VAL A 90 10.965 4.362 -2.571 1.00 0.00 H new ATOM 0 HB VAL A 90 13.908 3.575 -2.472 1.00 0.00 H new ATOM 0 HG11 VAL A 90 13.338 2.032 -4.301 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.452 1.642 -2.807 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.623 2.480 -4.140 1.00 0.00 H new ATOM 0 HG21 VAL A 90 13.971 4.367 -4.803 1.00 0.00 H new ATOM 0 HG22 VAL A 90 12.282 4.910 -4.661 1.00 0.00 H new ATOM 0 HG23 VAL A 90 13.549 5.676 -3.673 1.00 0.00 H new ATOM 48 N LEU A 91 12.485 3.284 0.127 1.00 0.00 N ATOM 49 CA LEU A 91 12.393 2.350 1.243 1.00 0.00 C ATOM 50 C LEU A 91 10.994 2.361 1.850 1.00 0.00 C ATOM 51 O LEU A 91 10.401 1.309 2.088 1.00 0.00 O ATOM 52 CB LEU A 91 13.428 2.700 2.313 1.00 0.00 C ATOM 53 CG LEU A 91 14.518 1.656 2.561 1.00 0.00 C ATOM 54 CD1 LEU A 91 13.904 0.339 3.008 1.00 0.00 C ATOM 55 CD2 LEU A 91 15.359 1.456 1.307 1.00 0.00 C ATOM 0 H LEU A 91 13.191 4.011 0.243 1.00 0.00 H new ATOM 0 HA LEU A 91 12.596 1.349 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 91 13.908 3.637 2.032 1.00 0.00 H new ATOM 0 HB3 LEU A 91 12.904 2.879 3.252 1.00 0.00 H new ATOM 0 HG LEU A 91 15.168 2.019 3.357 1.00 0.00 H new ATOM 0 HD11 LEU A 91 14.695 -0.391 3.180 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.345 0.493 3.931 1.00 0.00 H new ATOM 0 HD13 LEU A 91 13.231 -0.030 2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 91 16.130 0.710 1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 91 14.721 1.115 0.492 1.00 0.00 H new ATOM 0 HD23 LEU A 91 15.829 2.400 1.030 1.00 0.00 H new ATOM 67 N ARG A 92 10.471 3.558 2.095 1.00 0.00 N ATOM 68 CA ARG A 92 9.141 3.707 2.673 1.00 0.00 C ATOM 69 C ARG A 92 8.070 3.203 1.710 1.00 0.00 C ATOM 70 O ARG A 92 7.126 2.526 2.114 1.00 0.00 O ATOM 71 CB ARG A 92 8.876 5.172 3.026 1.00 0.00 C ATOM 72 CG ARG A 92 7.910 5.354 4.186 1.00 0.00 C ATOM 73 CD ARG A 92 6.467 5.394 3.707 1.00 0.00 C ATOM 74 NE ARG A 92 5.754 6.563 4.216 1.00 0.00 N ATOM 75 CZ ARG A 92 4.489 6.838 3.920 1.00 0.00 C ATOM 76 NH1 ARG A 92 3.800 6.032 3.123 1.00 0.00 N ATOM 77 NH2 ARG A 92 3.909 7.920 4.423 1.00 0.00 N ATOM 0 H ARG A 92 10.948 4.439 1.902 1.00 0.00 H new ATOM 0 HA ARG A 92 9.098 3.108 3.583 1.00 0.00 H new ATOM 0 HB2 ARG A 92 9.822 5.654 3.273 1.00 0.00 H new ATOM 0 HB3 ARG A 92 8.477 5.682 2.149 1.00 0.00 H new ATOM 0 HG2 ARG A 92 8.036 4.538 4.898 1.00 0.00 H new ATOM 0 HG3 ARG A 92 8.145 6.278 4.715 1.00 0.00 H new ATOM 0 HD2 ARG A 92 6.447 5.403 2.617 1.00 0.00 H new ATOM 0 HD3 ARG A 92 5.953 4.488 4.028 1.00 0.00 H new ATOM 0 HE ARG A 92 6.255 7.203 4.832 1.00 0.00 H new ATOM 0 HH11 ARG A 92 4.242 5.198 2.736 1.00 0.00 H new ATOM 0 HH12 ARG A 92 2.829 6.246 2.898 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.435 8.541 5.038 1.00 0.00 H new ATOM 0 HH22 ARG A 92 2.937 8.130 4.195 1.00 0.00 H new ATOM 91 N ALA A 93 8.224 3.539 0.433 1.00 0.00 N ATOM 92 CA ALA A 93 7.272 3.120 -0.587 1.00 0.00 C ATOM 93 C ALA A 93 7.176 1.600 -0.656 1.00 0.00 C ATOM 94 O ALA A 93 6.082 1.035 -0.652 1.00 0.00 O ATOM 95 CB ALA A 93 7.667 3.688 -1.941 1.00 0.00 C ATOM 0 H ALA A 93 8.999 4.100 0.081 1.00 0.00 H new ATOM 0 HA ALA A 93 6.290 3.508 -0.315 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.947 3.367 -2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.678 4.777 -1.890 1.00 0.00 H new ATOM 0 HB3 ALA A 93 8.660 3.328 -2.211 1.00 0.00 H new ATOM 101 N LYS A 94 8.329 0.941 -0.721 1.00 0.00 N ATOM 102 CA LYS A 94 8.376 -0.515 -0.791 1.00 0.00 C ATOM 103 C LYS A 94 7.772 -1.140 0.462 1.00 0.00 C ATOM 104 O LYS A 94 7.069 -2.147 0.387 1.00 0.00 O ATOM 105 CB LYS A 94 9.819 -0.991 -0.967 1.00 0.00 C ATOM 106 CG LYS A 94 9.960 -2.169 -1.915 1.00 0.00 C ATOM 107 CD LYS A 94 10.096 -1.710 -3.357 1.00 0.00 C ATOM 108 CE LYS A 94 9.416 -2.677 -4.315 1.00 0.00 C ATOM 109 NZ LYS A 94 9.027 -2.012 -5.590 1.00 0.00 N ATOM 0 H LYS A 94 9.243 1.393 -0.727 1.00 0.00 H new ATOM 0 HA LYS A 94 7.788 -0.832 -1.652 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.423 -0.163 -1.338 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.222 -1.269 0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.833 -2.759 -1.636 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.091 -2.820 -1.820 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.658 -0.718 -3.467 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.152 -1.623 -3.614 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.087 -3.509 -4.529 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.530 -3.097 -3.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.567 -2.704 -6.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.367 -1.234 -5.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.876 -1.633 -6.057 1.00 0.00 H new ATOM 123 N ALA A 95 8.050 -0.534 1.612 1.00 0.00 N ATOM 124 CA ALA A 95 7.531 -1.030 2.881 1.00 0.00 C ATOM 125 C ALA A 95 6.024 -0.819 2.977 1.00 0.00 C ATOM 126 O ALA A 95 5.314 -1.618 3.587 1.00 0.00 O ATOM 127 CB ALA A 95 8.236 -0.346 4.042 1.00 0.00 C ATOM 0 H ALA A 95 8.631 0.300 1.691 1.00 0.00 H new ATOM 0 HA ALA A 95 7.726 -2.101 2.932 1.00 0.00 H new ATOM 0 HB1 ALA A 95 7.839 -0.726 4.983 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.305 -0.551 3.990 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.070 0.730 3.986 1.00 0.00 H new ATOM 133 N ALA A 96 5.542 0.261 2.371 1.00 0.00 N ATOM 134 CA ALA A 96 4.118 0.575 2.388 1.00 0.00 C ATOM 135 C ALA A 96 3.331 -0.400 1.520 1.00 0.00 C ATOM 136 O ALA A 96 2.320 -0.955 1.952 1.00 0.00 O ATOM 137 CB ALA A 96 3.888 2.005 1.921 1.00 0.00 C ATOM 0 H ALA A 96 6.116 0.933 1.862 1.00 0.00 H new ATOM 0 HA ALA A 96 3.761 0.477 3.413 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.821 2.226 1.938 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.412 2.693 2.584 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.266 2.121 0.905 1.00 0.00 H new ATOM 143 N LYS A 97 3.799 -0.604 0.293 1.00 0.00 N ATOM 144 CA LYS A 97 3.139 -1.512 -0.636 1.00 0.00 C ATOM 145 C LYS A 97 3.184 -2.947 -0.119 1.00 0.00 C ATOM 146 O LYS A 97 2.197 -3.677 -0.203 1.00 0.00 O ATOM 147 CB LYS A 97 3.800 -1.434 -2.014 1.00 0.00 C ATOM 148 CG LYS A 97 3.012 -0.614 -3.021 1.00 0.00 C ATOM 149 CD LYS A 97 3.422 -0.940 -4.447 1.00 0.00 C ATOM 150 CE LYS A 97 2.250 -0.807 -5.408 1.00 0.00 C ATOM 151 NZ LYS A 97 2.657 -1.057 -6.819 1.00 0.00 N ATOM 0 H LYS A 97 4.634 -0.152 -0.081 1.00 0.00 H new ATOM 0 HA LYS A 97 2.096 -1.208 -0.723 1.00 0.00 H new ATOM 0 HB2 LYS A 97 4.795 -1.003 -1.906 1.00 0.00 H new ATOM 0 HB3 LYS A 97 3.930 -2.444 -2.403 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.947 -0.807 -2.895 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.169 0.448 -2.830 1.00 0.00 H new ATOM 0 HD2 LYS A 97 4.226 -0.272 -4.757 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.816 -1.955 -4.490 1.00 0.00 H new ATOM 0 HE2 LYS A 97 1.467 -1.511 -5.126 1.00 0.00 H new ATOM 0 HE3 LYS A 97 1.824 0.193 -5.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 1.830 -0.957 -7.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 3.386 -0.369 -7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 3.040 -2.020 -6.904 1.00 0.00 H new ATOM 165 N GLU A 98 4.335 -3.343 0.415 1.00 0.00 N ATOM 166 CA GLU A 98 4.507 -4.690 0.945 1.00 0.00 C ATOM 167 C GLU A 98 3.584 -4.928 2.136 1.00 0.00 C ATOM 168 O GLU A 98 2.964 -5.985 2.253 1.00 0.00 O ATOM 169 CB GLU A 98 5.962 -4.917 1.360 1.00 0.00 C ATOM 170 CG GLU A 98 6.835 -5.464 0.243 1.00 0.00 C ATOM 171 CD GLU A 98 8.304 -5.504 0.618 1.00 0.00 C ATOM 172 OE1 GLU A 98 8.742 -6.521 1.195 1.00 0.00 O ATOM 173 OE2 GLU A 98 9.015 -4.518 0.332 1.00 0.00 O ATOM 0 H GLU A 98 5.162 -2.750 0.492 1.00 0.00 H new ATOM 0 HA GLU A 98 4.247 -5.398 0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.383 -3.974 1.710 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.987 -5.609 2.202 1.00 0.00 H new ATOM 0 HG2 GLU A 98 6.502 -6.469 -0.014 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.708 -4.848 -0.647 1.00 0.00 H new ATOM 180 N ARG A 99 3.499 -3.937 3.018 1.00 0.00 N ATOM 181 CA ARG A 99 2.653 -4.038 4.202 1.00 0.00 C ATOM 182 C ARG A 99 1.209 -4.343 3.814 1.00 0.00 C ATOM 183 O ARG A 99 0.568 -5.211 4.405 1.00 0.00 O ATOM 184 CB ARG A 99 2.712 -2.740 5.009 1.00 0.00 C ATOM 185 CG ARG A 99 1.955 -2.807 6.324 1.00 0.00 C ATOM 186 CD ARG A 99 2.491 -1.797 7.328 1.00 0.00 C ATOM 187 NE ARG A 99 1.724 -0.554 7.317 1.00 0.00 N ATOM 188 CZ ARG A 99 2.051 0.517 8.030 1.00 0.00 C ATOM 189 NH1 ARG A 99 3.125 0.498 8.807 1.00 0.00 N ATOM 190 NH2 ARG A 99 1.303 1.611 7.967 1.00 0.00 N ATOM 0 H ARG A 99 4.005 -3.055 2.935 1.00 0.00 H new ATOM 0 HA ARG A 99 3.027 -4.857 4.816 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.755 -2.495 5.212 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.305 -1.928 4.406 1.00 0.00 H new ATOM 0 HG2 ARG A 99 0.896 -2.618 6.146 1.00 0.00 H new ATOM 0 HG3 ARG A 99 2.034 -3.812 6.740 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.464 -2.231 8.328 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.535 -1.581 7.102 1.00 0.00 H new ATOM 0 HE ARG A 99 0.892 -0.506 6.729 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.703 -0.341 8.858 1.00 0.00 H new ATOM 0 HH12 ARG A 99 3.374 1.322 9.354 1.00 0.00 H new ATOM 0 HH21 ARG A 99 0.476 1.630 7.370 1.00 0.00 H new ATOM 0 HH22 ARG A 99 1.555 2.433 8.515 1.00 0.00 H new ATOM 204 N ALA A 100 0.705 -3.624 2.817 1.00 0.00 N ATOM 205 CA ALA A 100 -0.661 -3.819 2.348 1.00 0.00 C ATOM 206 C ALA A 100 -0.850 -5.218 1.772 1.00 0.00 C ATOM 207 O ALA A 100 -1.898 -5.836 1.953 1.00 0.00 O ATOM 208 CB ALA A 100 -1.019 -2.765 1.311 1.00 0.00 C ATOM 0 H ALA A 100 1.223 -2.901 2.318 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.330 -3.714 3.202 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -2.042 -2.923 0.970 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.934 -1.773 1.756 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.338 -2.842 0.464 1.00 0.00 H new ATOM 214 N GLU A 101 0.170 -5.709 1.077 1.00 0.00 N ATOM 215 CA GLU A 101 0.114 -7.035 0.473 1.00 0.00 C ATOM 216 C GLU A 101 -0.169 -8.102 1.527 1.00 0.00 C ATOM 217 O GLU A 101 -1.018 -8.972 1.333 1.00 0.00 O ATOM 218 CB GLU A 101 1.429 -7.349 -0.244 1.00 0.00 C ATOM 219 CG GLU A 101 1.290 -7.440 -1.754 1.00 0.00 C ATOM 220 CD GLU A 101 2.630 -7.523 -2.459 1.00 0.00 C ATOM 221 OE1 GLU A 101 3.305 -6.479 -2.576 1.00 0.00 O ATOM 222 OE2 GLU A 101 3.004 -8.633 -2.893 1.00 0.00 O ATOM 0 H GLU A 101 1.045 -5.209 0.918 1.00 0.00 H new ATOM 0 HA GLU A 101 -0.699 -7.041 -0.253 1.00 0.00 H new ATOM 0 HB2 GLU A 101 2.160 -6.578 -0.000 1.00 0.00 H new ATOM 0 HB3 GLU A 101 1.823 -8.292 0.134 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.695 -8.317 -2.008 1.00 0.00 H new ATOM 0 HG3 GLU A 101 0.745 -6.569 -2.118 1.00 0.00 H new ATOM 229 N ARG A 102 0.548 -8.027 2.643 1.00 0.00 N ATOM 230 CA ARG A 102 0.376 -8.986 3.728 1.00 0.00 C ATOM 231 C ARG A 102 -1.018 -8.874 4.336 1.00 0.00 C ATOM 232 O ARG A 102 -1.675 -9.882 4.600 1.00 0.00 O ATOM 233 CB ARG A 102 1.436 -8.762 4.809 1.00 0.00 C ATOM 234 CG ARG A 102 2.306 -9.981 5.070 1.00 0.00 C ATOM 235 CD ARG A 102 2.898 -9.952 6.470 1.00 0.00 C ATOM 236 NE ARG A 102 4.268 -10.456 6.495 1.00 0.00 N ATOM 237 CZ ARG A 102 5.052 -10.401 7.566 1.00 0.00 C ATOM 238 NH1 ARG A 102 4.603 -9.867 8.694 1.00 0.00 N ATOM 239 NH2 ARG A 102 6.288 -10.881 7.511 1.00 0.00 N ATOM 0 H ARG A 102 1.254 -7.312 2.820 1.00 0.00 H new ATOM 0 HA ARG A 102 0.494 -9.988 3.316 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.073 -7.928 4.514 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.942 -8.473 5.737 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.713 -10.887 4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 102 3.110 -10.020 4.335 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.881 -8.931 6.850 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.279 -10.551 7.138 1.00 0.00 H new ATOM 0 HE ARG A 102 4.644 -10.873 5.643 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.654 -9.497 8.741 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.207 -9.826 9.515 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.637 -11.293 6.646 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.889 -10.838 8.334 1.00 0.00 H new ATOM 253 N ARG A 103 -1.464 -7.642 4.558 1.00 0.00 N ATOM 254 CA ARG A 103 -2.780 -7.398 5.138 1.00 0.00 C ATOM 255 C ARG A 103 -3.878 -7.999 4.265 1.00 0.00 C ATOM 256 O ARG A 103 -4.824 -8.606 4.769 1.00 0.00 O ATOM 257 CB ARG A 103 -3.015 -5.896 5.308 1.00 0.00 C ATOM 258 CG ARG A 103 -3.036 -5.444 6.759 1.00 0.00 C ATOM 259 CD ARG A 103 -3.020 -3.927 6.870 1.00 0.00 C ATOM 260 NE ARG A 103 -2.195 -3.469 7.985 1.00 0.00 N ATOM 261 CZ ARG A 103 -1.974 -2.188 8.257 1.00 0.00 C ATOM 262 NH1 ARG A 103 -2.515 -1.243 7.502 1.00 0.00 N ATOM 263 NH2 ARG A 103 -1.211 -1.850 9.290 1.00 0.00 N ATOM 0 H ARG A 103 -0.934 -6.797 4.345 1.00 0.00 H new ATOM 0 HA ARG A 103 -2.813 -7.877 6.116 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -2.233 -5.352 4.778 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -3.962 -5.630 4.839 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.926 -5.837 7.251 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -2.174 -5.857 7.283 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -2.644 -3.499 5.941 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -4.039 -3.562 6.999 1.00 0.00 H new ATOM 0 HE ARG A 103 -1.765 -4.171 8.587 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -3.103 -1.498 6.709 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.343 -0.260 7.714 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -0.794 -2.574 9.875 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -1.042 -0.866 9.498 1.00 0.00 H new ATOM 277 N LEU A 104 -3.747 -7.826 2.955 1.00 0.00 N ATOM 278 CA LEU A 104 -4.728 -8.351 2.011 1.00 0.00 C ATOM 279 C LEU A 104 -4.821 -9.870 2.112 1.00 0.00 C ATOM 280 O LEU A 104 -5.884 -10.452 1.895 1.00 0.00 O ATOM 281 CB LEU A 104 -4.360 -7.945 0.584 1.00 0.00 C ATOM 282 CG LEU A 104 -5.368 -7.051 -0.139 1.00 0.00 C ATOM 283 CD1 LEU A 104 -4.934 -5.595 -0.073 1.00 0.00 C ATOM 284 CD2 LEU A 104 -5.532 -7.495 -1.585 1.00 0.00 C ATOM 0 H LEU A 104 -2.971 -7.326 2.522 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.701 -7.928 2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.400 -7.429 0.610 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.219 -8.851 -0.006 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.332 -7.144 0.361 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.664 -4.974 -0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.868 -5.282 0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.959 -5.484 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.253 -6.848 -2.085 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.572 -7.431 -2.096 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.889 -8.524 -1.611 1.00 0.00 H new ATOM 296 N GLN A 105 -3.702 -10.506 2.445 1.00 0.00 N ATOM 297 CA GLN A 105 -3.659 -11.957 2.575 1.00 0.00 C ATOM 298 C GLN A 105 -4.729 -12.449 3.544 1.00 0.00 C ATOM 299 O GLN A 105 -5.351 -13.488 3.322 1.00 0.00 O ATOM 300 CB GLN A 105 -2.277 -12.406 3.053 1.00 0.00 C ATOM 301 CG GLN A 105 -1.850 -13.756 2.498 1.00 0.00 C ATOM 302 CD GLN A 105 -0.669 -14.346 3.244 1.00 0.00 C ATOM 303 OE1 GLN A 105 0.080 -13.631 3.909 1.00 0.00 O ATOM 304 NE2 GLN A 105 -0.498 -15.659 3.136 1.00 0.00 N ATOM 0 H GLN A 105 -2.814 -10.039 2.629 1.00 0.00 H new ATOM 0 HA GLN A 105 -3.856 -12.390 1.594 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -1.541 -11.655 2.766 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -2.276 -12.453 4.142 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.690 -14.448 2.550 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -1.592 -13.646 1.445 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -1.144 -16.213 2.574 1.00 0.00 H new ATOM 0 HE22 GLN A 105 0.279 -16.113 3.616 1.00 0.00 H new ATOM 313 N SER A 106 -4.939 -11.695 4.618 1.00 0.00 N ATOM 314 CA SER A 106 -5.932 -12.057 5.624 1.00 0.00 C ATOM 315 C SER A 106 -7.288 -12.320 4.977 1.00 0.00 C ATOM 316 O SER A 106 -7.629 -11.718 3.960 1.00 0.00 O ATOM 317 CB SER A 106 -6.059 -10.946 6.668 1.00 0.00 C ATOM 318 OG SER A 106 -6.691 -11.421 7.844 1.00 0.00 O ATOM 0 H SER A 106 -4.435 -10.830 4.814 1.00 0.00 H new ATOM 0 HA SER A 106 -5.600 -12.971 6.116 1.00 0.00 H new ATOM 0 HB2 SER A 106 -5.070 -10.559 6.914 1.00 0.00 H new ATOM 0 HB3 SER A 106 -6.632 -10.117 6.253 1.00 0.00 H new ATOM 0 HG SER A 106 -6.759 -10.693 8.496 1.00 0.00 H new ATOM 324 N GLN A 107 -8.057 -13.224 5.576 1.00 0.00 N ATOM 325 CA GLN A 107 -9.376 -13.568 5.060 1.00 0.00 C ATOM 326 C GLN A 107 -10.433 -12.596 5.573 1.00 0.00 C ATOM 327 O GLN A 107 -11.459 -12.384 4.929 1.00 0.00 O ATOM 328 CB GLN A 107 -9.745 -14.998 5.456 1.00 0.00 C ATOM 329 CG GLN A 107 -10.921 -15.562 4.674 1.00 0.00 C ATOM 330 CD GLN A 107 -11.043 -17.067 4.809 1.00 0.00 C ATOM 331 OE1 GLN A 107 -10.476 -17.669 5.721 1.00 0.00 O ATOM 332 NE2 GLN A 107 -11.787 -17.685 3.898 1.00 0.00 N ATOM 0 H GLN A 107 -7.789 -13.731 6.419 1.00 0.00 H new ATOM 0 HA GLN A 107 -9.342 -13.497 3.973 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.878 -15.642 5.308 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -9.982 -15.022 6.520 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -11.842 -15.094 5.022 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -10.810 -15.303 3.621 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -12.239 -17.147 3.159 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -11.906 -18.697 3.938 1.00 0.00 H new ATOM 341 N GLN A 108 -10.174 -12.009 6.738 1.00 0.00 N ATOM 342 CA GLN A 108 -11.104 -11.060 7.337 1.00 0.00 C ATOM 343 C GLN A 108 -10.726 -9.627 6.980 1.00 0.00 C ATOM 344 O GLN A 108 -10.590 -8.773 7.857 1.00 0.00 O ATOM 345 CB GLN A 108 -11.128 -11.230 8.858 1.00 0.00 C ATOM 346 CG GLN A 108 -11.710 -12.559 9.312 1.00 0.00 C ATOM 347 CD GLN A 108 -13.226 -12.570 9.291 1.00 0.00 C ATOM 348 OE1 GLN A 108 -13.861 -11.573 8.947 1.00 0.00 O ATOM 349 NE2 GLN A 108 -13.815 -13.701 9.661 1.00 0.00 N ATOM 0 H GLN A 108 -9.329 -12.174 7.284 1.00 0.00 H new ATOM 0 HA GLN A 108 -12.098 -11.263 6.939 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -10.112 -11.138 9.242 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -11.709 -10.419 9.297 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -11.336 -13.354 8.667 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -11.363 -12.777 10.322 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -13.250 -14.503 9.939 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -14.833 -13.768 9.668 1.00 0.00 H new ATOM 358 N ASP A 109 -10.558 -9.370 5.687 1.00 0.00 N ATOM 359 CA ASP A 109 -10.196 -8.039 5.213 1.00 0.00 C ATOM 360 C ASP A 109 -11.439 -7.245 4.822 1.00 0.00 C ATOM 361 O ASP A 109 -11.538 -6.740 3.704 1.00 0.00 O ATOM 362 CB ASP A 109 -9.244 -8.140 4.021 1.00 0.00 C ATOM 363 CG ASP A 109 -9.827 -8.952 2.882 1.00 0.00 C ATOM 364 OD1 ASP A 109 -9.700 -10.194 2.913 1.00 0.00 O ATOM 365 OD2 ASP A 109 -10.410 -8.346 1.958 1.00 0.00 O ATOM 0 H ASP A 109 -10.667 -10.066 4.949 1.00 0.00 H new ATOM 0 HA ASP A 109 -9.693 -7.515 6.026 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.006 -7.138 3.664 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -8.308 -8.594 4.345 1.00 0.00 H new ATOM 370 N ASP A 110 -12.385 -7.141 5.749 1.00 0.00 N ATOM 371 CA ASP A 110 -13.621 -6.409 5.501 1.00 0.00 C ATOM 372 C ASP A 110 -13.375 -4.904 5.522 1.00 0.00 C ATOM 373 O ASP A 110 -13.621 -4.211 4.534 1.00 0.00 O ATOM 374 CB ASP A 110 -14.677 -6.781 6.542 1.00 0.00 C ATOM 375 CG ASP A 110 -15.930 -7.361 5.916 1.00 0.00 C ATOM 376 OD1 ASP A 110 -15.858 -8.486 5.379 1.00 0.00 O ATOM 377 OD2 ASP A 110 -16.982 -6.690 5.963 1.00 0.00 O ATOM 0 H ASP A 110 -12.319 -7.555 6.679 1.00 0.00 H new ATOM 0 HA ASP A 110 -13.985 -6.685 4.512 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.255 -7.504 7.240 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -14.940 -5.895 7.120 1.00 0.00 H new ATOM 382 N ILE A 111 -12.891 -4.405 6.654 1.00 0.00 N ATOM 383 CA ILE A 111 -12.612 -2.982 6.804 1.00 0.00 C ATOM 384 C ILE A 111 -11.157 -2.669 6.471 1.00 0.00 C ATOM 385 O ILE A 111 -10.832 -1.561 6.043 1.00 0.00 O ATOM 386 CB ILE A 111 -12.916 -2.496 8.234 1.00 0.00 C ATOM 387 CG1 ILE A 111 -12.061 -3.259 9.248 1.00 0.00 C ATOM 388 CG2 ILE A 111 -14.395 -2.665 8.546 1.00 0.00 C ATOM 389 CD1 ILE A 111 -12.266 -2.802 10.674 1.00 0.00 C ATOM 0 H ILE A 111 -12.684 -4.965 7.481 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.263 -2.457 6.105 1.00 0.00 H new ATOM 0 HB ILE A 111 -12.668 -1.437 8.303 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -12.291 -4.322 9.179 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -11.010 -3.143 8.985 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -14.595 -2.318 9.560 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.985 -2.081 7.839 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.666 -3.717 8.463 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -11.629 -3.386 11.338 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -12.008 -1.746 10.758 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -13.310 -2.944 10.955 1.00 0.00 H new ATOM 401 N ASP A 112 -10.286 -3.652 6.668 1.00 0.00 N ATOM 402 CA ASP A 112 -8.866 -3.483 6.387 1.00 0.00 C ATOM 403 C ASP A 112 -8.639 -3.156 4.913 1.00 0.00 C ATOM 404 O ASP A 112 -7.714 -2.422 4.565 1.00 0.00 O ATOM 405 CB ASP A 112 -8.094 -4.748 6.765 1.00 0.00 C ATOM 406 CG ASP A 112 -7.986 -4.933 8.266 1.00 0.00 C ATOM 407 OD1 ASP A 112 -9.040 -5.053 8.928 1.00 0.00 O ATOM 408 OD2 ASP A 112 -6.849 -4.957 8.781 1.00 0.00 O ATOM 0 H ASP A 112 -10.539 -4.575 7.021 1.00 0.00 H new ATOM 0 HA ASP A 112 -8.499 -2.650 6.987 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -8.589 -5.616 6.329 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -7.094 -4.702 6.335 1.00 0.00 H new ATOM 413 N PHE A 113 -9.488 -3.707 4.053 1.00 0.00 N ATOM 414 CA PHE A 113 -9.380 -3.476 2.618 1.00 0.00 C ATOM 415 C PHE A 113 -9.489 -1.988 2.296 1.00 0.00 C ATOM 416 O PHE A 113 -8.901 -1.505 1.328 1.00 0.00 O ATOM 417 CB PHE A 113 -10.467 -4.252 1.870 1.00 0.00 C ATOM 418 CG PHE A 113 -10.424 -4.061 0.382 1.00 0.00 C ATOM 419 CD1 PHE A 113 -9.241 -4.232 -0.317 1.00 0.00 C ATOM 420 CD2 PHE A 113 -11.568 -3.710 -0.318 1.00 0.00 C ATOM 421 CE1 PHE A 113 -9.199 -4.055 -1.688 1.00 0.00 C ATOM 422 CE2 PHE A 113 -11.532 -3.533 -1.687 1.00 0.00 C ATOM 423 CZ PHE A 113 -10.346 -3.707 -2.374 1.00 0.00 C ATOM 0 H PHE A 113 -10.259 -4.317 4.325 1.00 0.00 H new ATOM 0 HA PHE A 113 -8.402 -3.830 2.292 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -10.364 -5.314 2.095 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -11.444 -3.941 2.240 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -8.342 -4.507 0.214 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -12.498 -3.573 0.214 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -8.270 -4.189 -2.222 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -12.430 -3.259 -2.220 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.316 -3.571 -3.445 1.00 0.00 H new ATOM 433 N LYS A 114 -10.246 -1.266 3.116 1.00 0.00 N ATOM 434 CA LYS A 114 -10.433 0.166 2.921 1.00 0.00 C ATOM 435 C LYS A 114 -9.113 0.914 3.080 1.00 0.00 C ATOM 436 O LYS A 114 -8.700 1.659 2.191 1.00 0.00 O ATOM 437 CB LYS A 114 -11.461 0.707 3.918 1.00 0.00 C ATOM 438 CG LYS A 114 -12.579 1.503 3.268 1.00 0.00 C ATOM 439 CD LYS A 114 -13.886 1.351 4.027 1.00 0.00 C ATOM 440 CE LYS A 114 -15.046 1.984 3.273 1.00 0.00 C ATOM 441 NZ LYS A 114 -15.049 3.467 3.404 1.00 0.00 N ATOM 0 H LYS A 114 -10.740 -1.650 3.922 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.800 0.324 1.907 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -11.894 -0.128 4.469 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -10.951 1.339 4.645 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -12.301 2.556 3.228 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -12.714 1.169 2.239 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -14.092 0.293 4.191 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.793 1.814 5.009 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -14.985 1.713 2.219 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -15.987 1.584 3.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.854 3.860 2.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.132 3.727 4.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -14.162 3.851 3.020 1.00 0.00 H new ATOM 455 N ARG A 115 -8.455 0.710 4.216 1.00 0.00 N ATOM 456 CA ARG A 115 -7.182 1.365 4.490 1.00 0.00 C ATOM 457 C ARG A 115 -6.123 0.939 3.478 1.00 0.00 C ATOM 458 O ARG A 115 -5.312 1.751 3.034 1.00 0.00 O ATOM 459 CB ARG A 115 -6.710 1.037 5.907 1.00 0.00 C ATOM 460 CG ARG A 115 -7.722 1.393 6.985 1.00 0.00 C ATOM 461 CD ARG A 115 -7.182 1.099 8.375 1.00 0.00 C ATOM 462 NE ARG A 115 -8.239 0.695 9.298 1.00 0.00 N ATOM 463 CZ ARG A 115 -8.008 0.179 10.500 1.00 0.00 C ATOM 464 NH1 ARG A 115 -6.763 0.006 10.923 1.00 0.00 N ATOM 465 NH2 ARG A 115 -9.023 -0.164 11.283 1.00 0.00 N ATOM 0 H ARG A 115 -8.783 0.096 4.962 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.330 2.442 4.404 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -6.486 -0.028 5.969 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -5.780 1.570 6.103 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -7.979 2.450 6.909 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -8.641 0.829 6.824 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -6.433 0.309 8.314 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.680 1.985 8.764 1.00 0.00 H new ATOM 0 HE ARG A 115 -9.208 0.816 9.003 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -5.980 0.269 10.325 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.589 -0.390 11.846 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -9.982 -0.032 10.962 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -8.844 -0.560 12.206 1.00 0.00 H new ATOM 479 N ALA A 116 -6.136 -0.341 3.119 1.00 0.00 N ATOM 480 CA ALA A 116 -5.178 -0.875 2.158 1.00 0.00 C ATOM 481 C ALA A 116 -5.339 -0.211 0.795 1.00 0.00 C ATOM 482 O ALA A 116 -4.384 -0.112 0.028 1.00 0.00 O ATOM 483 CB ALA A 116 -5.338 -2.383 2.037 1.00 0.00 C ATOM 0 H ALA A 116 -6.799 -1.027 3.479 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.174 -0.656 2.522 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -4.617 -2.769 1.316 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -5.164 -2.846 3.008 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.348 -2.616 1.700 1.00 0.00 H new ATOM 489 N GLU A 117 -6.555 0.240 0.502 1.00 0.00 N ATOM 490 CA GLU A 117 -6.840 0.893 -0.769 1.00 0.00 C ATOM 491 C GLU A 117 -6.285 2.314 -0.789 1.00 0.00 C ATOM 492 O GLU A 117 -5.563 2.699 -1.709 1.00 0.00 O ATOM 493 CB GLU A 117 -8.348 0.919 -1.027 1.00 0.00 C ATOM 494 CG GLU A 117 -8.712 1.066 -2.496 1.00 0.00 C ATOM 495 CD GLU A 117 -10.172 0.761 -2.768 1.00 0.00 C ATOM 496 OE1 GLU A 117 -10.759 -0.048 -2.020 1.00 0.00 O ATOM 497 OE2 GLU A 117 -10.727 1.333 -3.730 1.00 0.00 O ATOM 0 H GLU A 117 -7.357 0.165 1.127 1.00 0.00 H new ATOM 0 HA GLU A 117 -6.353 0.321 -1.559 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.790 -0.000 -0.642 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -8.790 1.744 -0.468 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.490 2.082 -2.822 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.088 0.398 -3.090 1.00 0.00 H new ATOM 504 N LEU A 118 -6.628 3.090 0.234 1.00 0.00 N ATOM 505 CA LEU A 118 -6.165 4.470 0.335 1.00 0.00 C ATOM 506 C LEU A 118 -4.645 4.528 0.448 1.00 0.00 C ATOM 507 O LEU A 118 -3.998 5.371 -0.171 1.00 0.00 O ATOM 508 CB LEU A 118 -6.804 5.155 1.543 1.00 0.00 C ATOM 509 CG LEU A 118 -6.978 6.671 1.442 1.00 0.00 C ATOM 510 CD1 LEU A 118 -8.325 7.013 0.824 1.00 0.00 C ATOM 511 CD2 LEU A 118 -6.838 7.317 2.812 1.00 0.00 C ATOM 0 H LEU A 118 -7.224 2.787 1.004 1.00 0.00 H new ATOM 0 HA LEU A 118 -6.463 4.995 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -7.783 4.708 1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.197 4.937 2.422 1.00 0.00 H new ATOM 0 HG LEU A 118 -6.194 7.065 0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -8.432 8.096 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -8.387 6.583 -0.176 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -9.124 6.606 1.444 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -6.965 8.396 2.720 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -7.599 6.918 3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -5.849 7.101 3.217 1.00 0.00 H new ATOM 523 N ALA A 119 -4.081 3.623 1.242 1.00 0.00 N ATOM 524 CA ALA A 119 -2.638 3.568 1.433 1.00 0.00 C ATOM 525 C ALA A 119 -1.920 3.280 0.119 1.00 0.00 C ATOM 526 O ALA A 119 -1.020 4.018 -0.283 1.00 0.00 O ATOM 527 CB ALA A 119 -2.282 2.514 2.471 1.00 0.00 C ATOM 0 H ALA A 119 -4.603 2.918 1.763 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.308 4.543 1.792 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.200 2.484 2.603 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -2.757 2.763 3.420 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.633 1.539 2.134 1.00 0.00 H new ATOM 533 N LEU A 120 -2.323 2.203 -0.546 1.00 0.00 N ATOM 534 CA LEU A 120 -1.718 1.817 -1.817 1.00 0.00 C ATOM 535 C LEU A 120 -1.886 2.920 -2.857 1.00 0.00 C ATOM 536 O LEU A 120 -1.009 3.138 -3.694 1.00 0.00 O ATOM 537 CB LEU A 120 -2.344 0.519 -2.328 1.00 0.00 C ATOM 538 CG LEU A 120 -1.608 -0.174 -3.476 1.00 0.00 C ATOM 539 CD1 LEU A 120 -1.650 -1.684 -3.301 1.00 0.00 C ATOM 540 CD2 LEU A 120 -2.210 0.227 -4.814 1.00 0.00 C ATOM 0 H LEU A 120 -3.066 1.581 -0.227 1.00 0.00 H new ATOM 0 HA LEU A 120 -0.652 1.659 -1.651 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.415 -0.180 -1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.362 0.733 -2.652 1.00 0.00 H new ATOM 0 HG LEU A 120 -0.566 0.144 -3.460 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.122 -2.161 -4.127 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.172 -1.955 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.687 -2.020 -3.291 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.674 -0.275 -5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.261 -0.062 -4.842 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -2.127 1.306 -4.941 1.00 0.00 H new ATOM 552 N LYS A 121 -3.017 3.615 -2.797 1.00 0.00 N ATOM 553 CA LYS A 121 -3.299 4.699 -3.732 1.00 0.00 C ATOM 554 C LYS A 121 -2.290 5.831 -3.572 1.00 0.00 C ATOM 555 O LYS A 121 -1.779 6.363 -4.557 1.00 0.00 O ATOM 556 CB LYS A 121 -4.718 5.230 -3.514 1.00 0.00 C ATOM 557 CG LYS A 121 -5.758 4.569 -4.401 1.00 0.00 C ATOM 558 CD LYS A 121 -5.674 5.076 -5.831 1.00 0.00 C ATOM 559 CE LYS A 121 -6.566 6.289 -6.046 1.00 0.00 C ATOM 560 NZ LYS A 121 -6.874 6.503 -7.487 1.00 0.00 N ATOM 0 H LYS A 121 -3.753 3.447 -2.111 1.00 0.00 H new ATOM 0 HA LYS A 121 -3.217 4.304 -4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.996 5.082 -2.470 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -4.727 6.305 -3.697 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.615 3.489 -4.388 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -6.754 4.764 -4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.642 5.336 -6.066 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -5.967 4.282 -6.518 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -7.495 6.159 -5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -6.076 7.176 -5.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -7.484 7.339 -7.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -5.989 6.652 -8.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -7.364 5.667 -7.865 1.00 0.00 H new ATOM 574 N ARG A 122 -2.008 6.195 -2.325 1.00 0.00 N ATOM 575 CA ARG A 122 -1.060 7.264 -2.037 1.00 0.00 C ATOM 576 C ARG A 122 0.352 6.869 -2.463 1.00 0.00 C ATOM 577 O ARG A 122 1.090 7.676 -3.026 1.00 0.00 O ATOM 578 CB ARG A 122 -1.078 7.604 -0.546 1.00 0.00 C ATOM 579 CG ARG A 122 -2.079 8.688 -0.181 1.00 0.00 C ATOM 580 CD ARG A 122 -1.941 9.107 1.274 1.00 0.00 C ATOM 581 NE ARG A 122 -2.506 8.115 2.185 1.00 0.00 N ATOM 582 CZ ARG A 122 -2.536 8.263 3.504 1.00 0.00 C ATOM 583 NH1 ARG A 122 -2.036 9.355 4.064 1.00 0.00 N ATOM 584 NH2 ARG A 122 -3.068 7.316 4.267 1.00 0.00 N ATOM 0 H ARG A 122 -2.423 5.765 -1.498 1.00 0.00 H new ATOM 0 HA ARG A 122 -1.360 8.144 -2.606 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -1.309 6.702 0.021 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -0.081 7.925 -0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -1.930 9.554 -0.826 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -3.091 8.326 -0.362 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -0.887 9.257 1.510 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -2.441 10.064 1.425 1.00 0.00 H new ATOM 0 HE ARG A 122 -2.899 7.262 1.786 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -1.626 10.085 3.481 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -2.061 9.465 5.078 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -3.454 6.474 3.840 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -3.091 7.430 5.280 1.00 0.00 H new ATOM 598 N ALA A 123 0.719 5.622 -2.187 1.00 0.00 N ATOM 599 CA ALA A 123 2.040 5.118 -2.542 1.00 0.00 C ATOM 600 C ALA A 123 2.303 5.271 -4.036 1.00 0.00 C ATOM 601 O ALA A 123 3.413 5.602 -4.450 1.00 0.00 O ATOM 602 CB ALA A 123 2.180 3.662 -2.126 1.00 0.00 C ATOM 0 H ALA A 123 0.120 4.942 -1.719 1.00 0.00 H new ATOM 0 HA ALA A 123 2.782 5.710 -2.006 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.171 3.300 -2.398 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.046 3.577 -1.048 1.00 0.00 H new ATOM 0 HB3 ALA A 123 1.423 3.064 -2.634 1.00 0.00 H new ATOM 608 N MET A 124 1.274 5.027 -4.841 1.00 0.00 N ATOM 609 CA MET A 124 1.394 5.138 -6.290 1.00 0.00 C ATOM 610 C MET A 124 1.635 6.585 -6.706 1.00 0.00 C ATOM 611 O MET A 124 2.574 6.881 -7.444 1.00 0.00 O ATOM 612 CB MET A 124 0.133 4.602 -6.971 1.00 0.00 C ATOM 613 CG MET A 124 0.235 3.140 -7.375 1.00 0.00 C ATOM 614 SD MET A 124 -1.355 2.441 -7.859 1.00 0.00 S ATOM 615 CE MET A 124 -0.873 1.450 -9.271 1.00 0.00 C ATOM 0 H MET A 124 0.348 4.751 -4.514 1.00 0.00 H new ATOM 0 HA MET A 124 2.249 4.541 -6.605 1.00 0.00 H new ATOM 0 HB2 MET A 124 -0.715 4.726 -6.297 1.00 0.00 H new ATOM 0 HB3 MET A 124 -0.074 5.202 -7.857 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.937 3.044 -8.203 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.642 2.565 -6.544 1.00 0.00 H new ATOM 0 HE1 MET A 124 -1.751 0.952 -9.683 1.00 0.00 H new ATOM 0 HE2 MET A 124 -0.429 2.092 -10.032 1.00 0.00 H new ATOM 0 HE3 MET A 124 -0.145 0.701 -8.959 1.00 0.00 H new ATOM 625 N ASN A 125 0.780 7.484 -6.228 1.00 0.00 N ATOM 626 CA ASN A 125 0.900 8.901 -6.552 1.00 0.00 C ATOM 627 C ASN A 125 2.284 9.427 -6.186 1.00 0.00 C ATOM 628 O ASN A 125 2.895 10.177 -6.948 1.00 0.00 O ATOM 629 CB ASN A 125 -0.174 9.706 -5.818 1.00 0.00 C ATOM 630 CG ASN A 125 -0.923 10.647 -6.741 1.00 0.00 C ATOM 631 OD1 ASN A 125 -0.546 11.808 -6.902 1.00 0.00 O ATOM 632 ND2 ASN A 125 -1.992 10.150 -7.353 1.00 0.00 N ATOM 0 H ASN A 125 -0.003 7.256 -5.615 1.00 0.00 H new ATOM 0 HA ASN A 125 0.760 9.016 -7.627 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -0.881 9.021 -5.350 1.00 0.00 H new ATOM 0 HB3 ASN A 125 0.291 10.281 -5.017 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -2.536 10.737 -7.986 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -2.269 9.182 -7.190 1.00 0.00 H new ATOM 639 N ARG A 126 2.773 9.028 -5.016 1.00 0.00 N ATOM 640 CA ARG A 126 4.085 9.460 -4.550 1.00 0.00 C ATOM 641 C ARG A 126 5.180 9.005 -5.509 1.00 0.00 C ATOM 642 O ARG A 126 6.061 9.784 -5.878 1.00 0.00 O ATOM 643 CB ARG A 126 4.358 8.909 -3.149 1.00 0.00 C ATOM 644 CG ARG A 126 4.651 9.986 -2.118 1.00 0.00 C ATOM 645 CD ARG A 126 5.173 9.387 -0.820 1.00 0.00 C ATOM 646 NE ARG A 126 5.876 10.375 -0.006 1.00 0.00 N ATOM 647 CZ ARG A 126 6.315 10.134 1.224 1.00 0.00 C ATOM 648 NH1 ARG A 126 6.125 8.945 1.778 1.00 0.00 N ATOM 649 NH2 ARG A 126 6.947 11.084 1.902 1.00 0.00 N ATOM 0 H ARG A 126 2.281 8.407 -4.374 1.00 0.00 H new ATOM 0 HA ARG A 126 4.089 10.549 -4.513 1.00 0.00 H new ATOM 0 HB2 ARG A 126 3.495 8.329 -2.821 1.00 0.00 H new ATOM 0 HB3 ARG A 126 5.204 8.223 -3.196 1.00 0.00 H new ATOM 0 HG2 ARG A 126 5.385 10.685 -2.519 1.00 0.00 H new ATOM 0 HG3 ARG A 126 3.744 10.556 -1.918 1.00 0.00 H new ATOM 0 HD2 ARG A 126 4.340 8.974 -0.250 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.845 8.560 -1.047 1.00 0.00 H new ATOM 0 HE ARG A 126 6.039 11.300 -0.404 1.00 0.00 H new ATOM 0 HH11 ARG A 126 5.641 8.212 1.259 1.00 0.00 H new ATOM 0 HH12 ARG A 126 6.463 8.763 2.723 1.00 0.00 H new ATOM 0 HH21 ARG A 126 7.096 12.000 1.478 1.00 0.00 H new ATOM 0 HH22 ARG A 126 7.284 10.898 2.847 1.00 0.00 H new ATOM 663 N LEU A 127 5.120 7.740 -5.910 1.00 0.00 N ATOM 664 CA LEU A 127 6.108 7.180 -6.827 1.00 0.00 C ATOM 665 C LEU A 127 6.019 7.846 -8.196 1.00 0.00 C ATOM 666 O LEU A 127 7.012 7.940 -8.917 1.00 0.00 O ATOM 667 CB LEU A 127 5.904 5.670 -6.967 1.00 0.00 C ATOM 668 CG LEU A 127 7.164 4.810 -6.865 1.00 0.00 C ATOM 669 CD1 LEU A 127 7.652 4.747 -5.426 1.00 0.00 C ATOM 670 CD2 LEU A 127 6.900 3.412 -7.404 1.00 0.00 C ATOM 0 H LEU A 127 4.398 7.082 -5.615 1.00 0.00 H new ATOM 0 HA LEU A 127 7.099 7.370 -6.415 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.204 5.345 -6.198 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.432 5.475 -7.930 1.00 0.00 H new ATOM 0 HG LEU A 127 7.945 5.269 -7.471 1.00 0.00 H new ATOM 0 HD11 LEU A 127 8.549 4.131 -5.373 1.00 0.00 H new ATOM 0 HD12 LEU A 127 7.881 5.753 -5.075 1.00 0.00 H new ATOM 0 HD13 LEU A 127 6.875 4.312 -4.797 1.00 0.00 H new ATOM 0 HD21 LEU A 127 7.808 2.814 -7.324 1.00 0.00 H new ATOM 0 HD22 LEU A 127 6.104 2.943 -6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.599 3.476 -8.450 1.00 0.00 H new ATOM 682 N SER A 128 4.823 8.310 -8.546 1.00 0.00 N ATOM 683 CA SER A 128 4.604 8.967 -9.830 1.00 0.00 C ATOM 684 C SER A 128 5.329 10.308 -9.884 1.00 0.00 C ATOM 685 O SER A 128 6.033 10.608 -10.848 1.00 0.00 O ATOM 686 CB SER A 128 3.108 9.173 -10.073 1.00 0.00 C ATOM 687 OG SER A 128 2.662 8.414 -11.183 1.00 0.00 O ATOM 0 H SER A 128 3.992 8.243 -7.959 1.00 0.00 H new ATOM 0 HA SER A 128 5.006 8.324 -10.613 1.00 0.00 H new ATOM 0 HB2 SER A 128 2.549 8.884 -9.183 1.00 0.00 H new ATOM 0 HB3 SER A 128 2.907 10.230 -10.247 1.00 0.00 H new ATOM 0 HG SER A 128 1.702 8.562 -11.316 1.00 0.00 H new ATOM 693 N VAL A 129 5.151 11.113 -8.841 1.00 0.00 N ATOM 694 CA VAL A 129 5.788 12.422 -8.768 1.00 0.00 C ATOM 695 C VAL A 129 7.300 12.290 -8.622 1.00 0.00 C ATOM 696 O VAL A 129 8.058 13.103 -9.151 1.00 0.00 O ATOM 697 CB VAL A 129 5.240 13.248 -7.590 1.00 0.00 C ATOM 698 CG1 VAL A 129 5.891 14.622 -7.551 1.00 0.00 C ATOM 699 CG2 VAL A 129 3.726 13.370 -7.683 1.00 0.00 C ATOM 0 H VAL A 129 4.571 10.881 -8.035 1.00 0.00 H new ATOM 0 HA VAL A 129 5.559 12.938 -9.701 1.00 0.00 H new ATOM 0 HB VAL A 129 5.484 12.730 -6.663 1.00 0.00 H new ATOM 0 HG11 VAL A 129 5.491 15.191 -6.712 1.00 0.00 H new ATOM 0 HG12 VAL A 129 6.969 14.511 -7.433 1.00 0.00 H new ATOM 0 HG13 VAL A 129 5.681 15.151 -8.481 1.00 0.00 H new ATOM 0 HG21 VAL A 129 3.356 13.957 -6.842 1.00 0.00 H new ATOM 0 HG22 VAL A 129 3.457 13.864 -8.617 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.279 12.376 -7.657 1.00 0.00 H new ATOM 709 N ALA A 130 7.732 11.261 -7.901 1.00 0.00 N ATOM 710 CA ALA A 130 9.153 11.021 -7.688 1.00 0.00 C ATOM 711 C ALA A 130 9.890 10.869 -9.013 1.00 0.00 C ATOM 712 O ALA A 130 10.863 11.575 -9.278 1.00 0.00 O ATOM 713 CB ALA A 130 9.356 9.783 -6.825 1.00 0.00 C ATOM 0 H ALA A 130 7.118 10.580 -7.454 1.00 0.00 H new ATOM 0 HA ALA A 130 9.567 11.885 -7.169 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.422 9.616 -6.674 1.00 0.00 H new ATOM 0 HB2 ALA A 130 8.871 9.929 -5.860 1.00 0.00 H new ATOM 0 HB3 ALA A 130 8.920 8.917 -7.323 1.00 0.00 H new ATOM 719 N GLU A 131 9.420 9.944 -9.845 1.00 0.00 N ATOM 720 CA GLU A 131 10.037 9.700 -11.144 1.00 0.00 C ATOM 721 C GLU A 131 10.188 11.001 -11.926 1.00 0.00 C ATOM 722 O GLU A 131 11.301 11.420 -12.244 1.00 0.00 O ATOM 723 CB GLU A 131 9.203 8.702 -11.950 1.00 0.00 C ATOM 724 CG GLU A 131 9.971 8.042 -13.082 1.00 0.00 C ATOM 725 CD GLU A 131 9.123 7.063 -13.870 1.00 0.00 C ATOM 726 OE1 GLU A 131 8.183 7.511 -14.558 1.00 0.00 O ATOM 727 OE2 GLU A 131 9.399 5.847 -13.797 1.00 0.00 O ATOM 0 H GLU A 131 8.615 9.352 -9.643 1.00 0.00 H new ATOM 0 HA GLU A 131 11.029 9.280 -10.974 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.827 7.930 -11.279 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.335 9.216 -12.362 1.00 0.00 H new ATOM 0 HG2 GLU A 131 10.351 8.811 -13.755 1.00 0.00 H new ATOM 0 HG3 GLU A 131 10.836 7.520 -12.673 1.00 0.00 H new ATOM 734 N MET A 132 9.061 11.635 -12.234 1.00 0.00 N ATOM 735 CA MET A 132 9.069 12.889 -12.979 1.00 0.00 C ATOM 736 C MET A 132 9.092 14.084 -12.031 1.00 0.00 C ATOM 737 O MET A 132 8.389 15.072 -12.244 1.00 0.00 O ATOM 738 CB MET A 132 7.845 12.971 -13.893 1.00 0.00 C ATOM 739 CG MET A 132 7.812 11.891 -14.962 1.00 0.00 C ATOM 740 SD MET A 132 6.271 11.889 -15.899 1.00 0.00 S ATOM 741 CE MET A 132 6.507 10.447 -16.936 1.00 0.00 C ATOM 0 H MET A 132 8.131 11.301 -11.979 1.00 0.00 H new ATOM 0 HA MET A 132 9.972 12.915 -13.590 1.00 0.00 H new ATOM 0 HB2 MET A 132 6.943 12.898 -13.286 1.00 0.00 H new ATOM 0 HB3 MET A 132 7.826 13.949 -14.375 1.00 0.00 H new ATOM 0 HG2 MET A 132 8.648 12.036 -15.646 1.00 0.00 H new ATOM 0 HG3 MET A 132 7.949 10.917 -14.493 1.00 0.00 H new ATOM 0 HE1 MET A 132 5.635 10.312 -17.576 1.00 0.00 H new ATOM 0 HE2 MET A 132 7.393 10.585 -17.555 1.00 0.00 H new ATOM 0 HE3 MET A 132 6.637 9.565 -16.309 1.00 0.00 H new ATOM 751 N LYS A 133 9.904 13.988 -10.985 1.00 0.00 N ATOM 752 CA LYS A 133 10.019 15.061 -10.004 1.00 0.00 C ATOM 753 C LYS A 133 10.336 16.389 -10.685 1.00 0.00 C ATOM 754 O LYS A 133 9.847 17.441 -10.273 1.00 0.00 O ATOM 755 CB LYS A 133 11.107 14.729 -8.980 1.00 0.00 C ATOM 756 CG LYS A 133 10.570 14.474 -7.583 1.00 0.00 C ATOM 757 CD LYS A 133 10.898 15.619 -6.641 1.00 0.00 C ATOM 758 CE LYS A 133 12.193 15.365 -5.883 1.00 0.00 C ATOM 759 NZ LYS A 133 12.461 16.423 -4.871 1.00 0.00 N ATOM 0 H LYS A 133 10.493 13.178 -10.794 1.00 0.00 H new ATOM 0 HA LYS A 133 9.062 15.155 -9.491 1.00 0.00 H new ATOM 0 HB2 LYS A 133 11.654 13.848 -9.316 1.00 0.00 H new ATOM 0 HB3 LYS A 133 11.821 15.552 -8.941 1.00 0.00 H new ATOM 0 HG2 LYS A 133 9.490 14.336 -7.627 1.00 0.00 H new ATOM 0 HG3 LYS A 133 10.993 13.548 -7.193 1.00 0.00 H new ATOM 0 HD2 LYS A 133 10.983 16.545 -7.209 1.00 0.00 H new ATOM 0 HD3 LYS A 133 10.081 15.754 -5.932 1.00 0.00 H new ATOM 0 HE2 LYS A 133 12.140 14.395 -5.389 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.023 15.318 -6.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 13.352 16.213 -4.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 12.537 17.346 -5.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 11.682 16.451 -4.183 1.00 0.00 H new TER 773 LYS A 133