USER MOD reduce.3.24.130724 H: found=0, std=0, add=559, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 561 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 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -118:sc= 0.05 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.242) USER MOD Single : A 65 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0204) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ARG A 3 -6.399 -10.680 -3.783 1.00 0.00 N ATOM 20 CA ARG A 3 -5.732 -9.886 -2.764 1.00 0.00 C ATOM 21 C ARG A 3 -4.946 -8.744 -3.410 1.00 0.00 C ATOM 22 O ARG A 3 -5.175 -7.576 -3.103 1.00 0.00 O ATOM 23 CB ARG A 3 -4.778 -10.748 -1.933 1.00 0.00 C ATOM 24 CG ARG A 3 -5.332 -10.977 -0.526 1.00 0.00 C ATOM 25 CD ARG A 3 -5.735 -12.439 -0.328 1.00 0.00 C ATOM 26 NE ARG A 3 -7.202 -12.583 -0.460 1.00 0.00 N ATOM 27 CZ ARG A 3 -7.824 -13.743 -0.705 1.00 0.00 C ATOM 28 NH1 ARG A 3 -7.111 -14.869 -0.845 1.00 0.00 N ATOM 29 NH2 ARG A 3 -9.159 -13.779 -0.808 1.00 0.00 N ATOM 0 HA ARG A 3 -6.499 -9.476 -2.107 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -4.624 -11.707 -2.428 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -3.804 -10.262 -1.870 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -4.581 -10.699 0.214 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -6.195 -10.332 -0.362 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -5.232 -13.066 -1.064 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -5.415 -12.783 0.656 1.00 0.00 H new ATOM 0 HE ARG A 3 -7.775 -11.746 -0.358 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -6.095 -14.842 -0.765 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -7.585 -15.753 -1.032 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -9.702 -12.922 -0.700 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -9.632 -14.663 -0.995 1.00 0.00 H new ATOM 43 N VAL A 4 -4.036 -9.122 -4.296 1.00 0.00 N ATOM 44 CA VAL A 4 -3.214 -8.144 -4.989 1.00 0.00 C ATOM 45 C VAL A 4 -4.119 -7.114 -5.668 1.00 0.00 C ATOM 46 O VAL A 4 -4.108 -5.939 -5.305 1.00 0.00 O ATOM 47 CB VAL A 4 -2.273 -8.850 -5.966 1.00 0.00 C ATOM 48 CG1 VAL A 4 -1.243 -7.873 -6.538 1.00 0.00 C ATOM 49 CG2 VAL A 4 -1.585 -10.045 -5.301 1.00 0.00 C ATOM 0 H VAL A 4 -3.850 -10.092 -4.550 1.00 0.00 H new ATOM 0 HA VAL A 4 -2.582 -7.606 -4.282 1.00 0.00 H new ATOM 0 HB VAL A 4 -2.873 -9.228 -6.794 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -0.586 -8.400 -7.230 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.757 -7.070 -7.067 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -0.651 -7.452 -5.726 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -0.922 -10.528 -6.018 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -1.005 -9.701 -4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -2.338 -10.758 -4.965 1.00 0.00 H new ATOM 59 N LYS A 5 -4.879 -7.593 -6.641 1.00 0.00 N ATOM 60 CA LYS A 5 -5.788 -6.728 -7.375 1.00 0.00 C ATOM 61 C LYS A 5 -6.568 -5.859 -6.386 1.00 0.00 C ATOM 62 O LYS A 5 -6.499 -4.632 -6.445 1.00 0.00 O ATOM 63 CB LYS A 5 -6.681 -7.554 -8.304 1.00 0.00 C ATOM 64 CG LYS A 5 -7.736 -6.674 -8.976 1.00 0.00 C ATOM 65 CD LYS A 5 -7.307 -6.291 -10.394 1.00 0.00 C ATOM 66 CE LYS A 5 -8.225 -6.932 -11.436 1.00 0.00 C ATOM 67 NZ LYS A 5 -8.644 -5.933 -12.443 1.00 0.00 N ATOM 0 H LYS A 5 -4.885 -8.569 -6.939 1.00 0.00 H new ATOM 0 HA LYS A 5 -5.230 -6.052 -8.024 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.070 -8.040 -9.064 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.170 -8.345 -7.735 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -8.688 -7.203 -9.011 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -7.894 -5.773 -8.384 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -7.328 -5.207 -10.504 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.279 -6.609 -10.565 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -7.708 -7.757 -11.927 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -9.103 -7.353 -10.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -9.267 -6.385 -13.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -9.156 -5.160 -11.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -7.804 -5.551 -12.923 1.00 0.00 H new ATOM 81 N ALA A 6 -7.291 -6.528 -5.501 1.00 0.00 N ATOM 82 CA ALA A 6 -8.082 -5.832 -4.501 1.00 0.00 C ATOM 83 C ALA A 6 -7.210 -4.784 -3.805 1.00 0.00 C ATOM 84 O ALA A 6 -7.723 -3.810 -3.258 1.00 0.00 O ATOM 85 CB ALA A 6 -8.670 -6.847 -3.517 1.00 0.00 C ATOM 0 H ALA A 6 -7.346 -7.546 -5.455 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.916 -5.309 -4.968 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.263 -6.325 -2.767 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -9.304 -7.551 -4.056 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -7.861 -7.389 -3.027 1.00 0.00 H new ATOM 91 N LEU A 7 -5.907 -5.021 -3.850 1.00 0.00 N ATOM 92 CA LEU A 7 -4.960 -4.110 -3.232 1.00 0.00 C ATOM 93 C LEU A 7 -4.608 -2.997 -4.222 1.00 0.00 C ATOM 94 O LEU A 7 -4.782 -1.817 -3.923 1.00 0.00 O ATOM 95 CB LEU A 7 -3.742 -4.876 -2.710 1.00 0.00 C ATOM 96 CG LEU A 7 -3.589 -4.935 -1.189 1.00 0.00 C ATOM 97 CD1 LEU A 7 -3.651 -3.535 -0.576 1.00 0.00 C ATOM 98 CD2 LEU A 7 -4.624 -5.878 -0.570 1.00 0.00 C ATOM 0 H LEU A 7 -5.485 -5.831 -4.305 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.406 -3.632 -2.360 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.789 -5.896 -3.091 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.844 -4.421 -3.128 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.604 -5.342 -0.961 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -3.540 -3.606 0.506 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.846 -2.923 -0.984 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.611 -3.076 -0.812 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.493 -5.902 0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.627 -5.523 -0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.489 -6.881 -0.974 1.00 0.00 H new ATOM 110 N GLU A 8 -4.120 -3.413 -5.381 1.00 0.00 N ATOM 111 CA GLU A 8 -3.743 -2.467 -6.417 1.00 0.00 C ATOM 112 C GLU A 8 -4.725 -1.294 -6.448 1.00 0.00 C ATOM 113 O GLU A 8 -4.342 -0.167 -6.760 1.00 0.00 O ATOM 114 CB GLU A 8 -3.664 -3.151 -7.783 1.00 0.00 C ATOM 115 CG GLU A 8 -3.062 -2.214 -8.832 1.00 0.00 C ATOM 116 CD GLU A 8 -3.876 -2.245 -10.127 1.00 0.00 C ATOM 117 OE1 GLU A 8 -3.869 -3.312 -10.777 1.00 0.00 O ATOM 118 OE2 GLU A 8 -4.488 -1.200 -10.437 1.00 0.00 O ATOM 0 H GLU A 8 -3.977 -4.393 -5.626 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.751 -2.080 -6.183 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -3.059 -4.054 -7.707 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.661 -3.461 -8.097 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -3.032 -1.197 -8.442 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -2.033 -2.507 -9.038 1.00 0.00 H new ATOM 125 N GLU A 9 -5.971 -1.598 -6.119 1.00 0.00 N ATOM 126 CA GLU A 9 -7.011 -0.583 -6.103 1.00 0.00 C ATOM 127 C GLU A 9 -6.594 0.591 -5.216 1.00 0.00 C ATOM 128 O GLU A 9 -6.535 1.730 -5.675 1.00 0.00 O ATOM 129 CB GLU A 9 -8.346 -1.172 -5.643 1.00 0.00 C ATOM 130 CG GLU A 9 -9.488 -0.723 -6.556 1.00 0.00 C ATOM 131 CD GLU A 9 -10.798 -1.415 -6.177 1.00 0.00 C ATOM 132 OE1 GLU A 9 -11.069 -1.491 -4.959 1.00 0.00 O ATOM 133 OE2 GLU A 9 -11.500 -1.854 -7.113 1.00 0.00 O ATOM 0 H GLU A 9 -6.285 -2.534 -5.861 1.00 0.00 H new ATOM 0 HA GLU A 9 -7.146 -0.214 -7.120 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.285 -2.260 -5.639 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.551 -0.861 -4.619 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.610 0.358 -6.486 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.240 -0.950 -7.593 1.00 0.00 H new ATOM 140 N LYS A 10 -6.316 0.273 -3.961 1.00 0.00 N ATOM 141 CA LYS A 10 -5.906 1.288 -3.005 1.00 0.00 C ATOM 142 C LYS A 10 -4.511 1.796 -3.374 1.00 0.00 C ATOM 143 O LYS A 10 -4.308 2.999 -3.540 1.00 0.00 O ATOM 144 CB LYS A 10 -6.005 0.749 -1.576 1.00 0.00 C ATOM 145 CG LYS A 10 -6.330 1.871 -0.589 1.00 0.00 C ATOM 146 CD LYS A 10 -7.841 2.060 -0.450 1.00 0.00 C ATOM 147 CE LYS A 10 -8.276 1.953 1.013 1.00 0.00 C ATOM 148 NZ LYS A 10 -8.984 0.676 1.252 1.00 0.00 N ATOM 0 H LYS A 10 -6.366 -0.673 -3.583 1.00 0.00 H new ATOM 0 HA LYS A 10 -6.579 2.144 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.777 -0.019 -1.526 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -5.064 0.275 -1.296 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -5.898 1.640 0.385 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.873 2.801 -0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -8.127 3.034 -0.848 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.361 1.308 -1.043 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -7.404 2.019 1.663 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -8.927 2.789 1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -9.272 0.620 2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -9.827 0.628 0.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -8.351 -0.119 1.029 1.00 0.00 H new ATOM 162 N VAL A 11 -3.585 0.856 -3.492 1.00 0.00 N ATOM 163 CA VAL A 11 -2.216 1.195 -3.839 1.00 0.00 C ATOM 164 C VAL A 11 -2.219 2.208 -4.986 1.00 0.00 C ATOM 165 O VAL A 11 -1.653 3.293 -4.862 1.00 0.00 O ATOM 166 CB VAL A 11 -1.429 -0.077 -4.168 1.00 0.00 C ATOM 167 CG1 VAL A 11 0.068 0.217 -4.278 1.00 0.00 C ATOM 168 CG2 VAL A 11 -1.699 -1.171 -3.133 1.00 0.00 C ATOM 0 H VAL A 11 -3.756 -0.140 -3.353 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.714 1.664 -2.993 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.770 -0.441 -5.137 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.603 -0.703 -4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.238 0.947 -5.069 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.431 0.617 -3.331 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -1.128 -2.063 -3.390 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.399 -0.820 -2.146 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.762 -1.410 -3.125 1.00 0.00 H new ATOM 178 N LYS A 12 -2.864 1.818 -6.076 1.00 0.00 N ATOM 179 CA LYS A 12 -2.949 2.678 -7.243 1.00 0.00 C ATOM 180 C LYS A 12 -3.405 4.073 -6.811 1.00 0.00 C ATOM 181 O LYS A 12 -2.786 5.073 -7.173 1.00 0.00 O ATOM 182 CB LYS A 12 -3.840 2.044 -8.313 1.00 0.00 C ATOM 183 CG LYS A 12 -4.114 3.027 -9.453 1.00 0.00 C ATOM 184 CD LYS A 12 -3.363 2.616 -10.722 1.00 0.00 C ATOM 185 CE LYS A 12 -4.325 2.463 -11.901 1.00 0.00 C ATOM 186 NZ LYS A 12 -3.642 2.790 -13.173 1.00 0.00 N ATOM 0 H LYS A 12 -3.333 0.917 -6.175 1.00 0.00 H new ATOM 0 HA LYS A 12 -1.968 2.791 -7.704 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -3.359 1.149 -8.708 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.783 1.729 -7.866 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -5.184 3.066 -9.656 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -3.810 4.030 -9.154 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -2.606 3.364 -10.960 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -2.839 1.676 -10.551 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -4.705 1.442 -11.938 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.185 3.119 -11.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.309 2.681 -13.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.300 3.772 -13.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.836 2.147 -13.309 1.00 0.00 H new ATOM 200 N ALA A 13 -4.484 4.097 -6.043 1.00 0.00 N ATOM 201 CA ALA A 13 -5.031 5.352 -5.558 1.00 0.00 C ATOM 202 C ALA A 13 -3.995 6.046 -4.672 1.00 0.00 C ATOM 203 O ALA A 13 -3.880 7.270 -4.685 1.00 0.00 O ATOM 204 CB ALA A 13 -6.345 5.088 -4.820 1.00 0.00 C ATOM 0 H ALA A 13 -4.995 3.266 -5.744 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.254 6.019 -6.391 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.754 6.031 -4.457 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -7.057 4.622 -5.501 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.161 4.423 -3.976 1.00 0.00 H new ATOM 210 N LEU A 14 -3.266 5.232 -3.921 1.00 0.00 N ATOM 211 CA LEU A 14 -2.242 5.752 -3.031 1.00 0.00 C ATOM 212 C LEU A 14 -1.177 6.479 -3.853 1.00 0.00 C ATOM 213 O LEU A 14 -0.672 7.522 -3.439 1.00 0.00 O ATOM 214 CB LEU A 14 -1.682 4.634 -2.148 1.00 0.00 C ATOM 215 CG LEU A 14 -2.654 4.027 -1.135 1.00 0.00 C ATOM 216 CD1 LEU A 14 -1.902 3.325 -0.003 1.00 0.00 C ATOM 217 CD2 LEU A 14 -3.627 5.084 -0.607 1.00 0.00 C ATOM 0 H LEU A 14 -3.365 4.217 -3.911 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.669 6.484 -2.346 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.317 3.836 -2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.820 5.024 -1.606 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.247 3.268 -1.645 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.618 2.903 0.702 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.286 2.527 -0.416 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.266 4.045 0.512 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.307 4.626 0.111 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.068 5.882 -0.119 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.200 5.497 -1.437 1.00 0.00 H new ATOM 229 N GLU A 15 -0.865 5.899 -5.003 1.00 0.00 N ATOM 230 CA GLU A 15 0.132 6.478 -5.886 1.00 0.00 C ATOM 231 C GLU A 15 -0.245 7.919 -6.240 1.00 0.00 C ATOM 232 O GLU A 15 0.602 8.810 -6.211 1.00 0.00 O ATOM 233 CB GLU A 15 0.303 5.631 -7.149 1.00 0.00 C ATOM 234 CG GLU A 15 1.538 6.069 -7.941 1.00 0.00 C ATOM 235 CD GLU A 15 1.202 7.228 -8.883 1.00 0.00 C ATOM 236 OE1 GLU A 15 0.553 6.949 -9.915 1.00 0.00 O ATOM 237 OE2 GLU A 15 1.601 8.365 -8.551 1.00 0.00 O ATOM 0 H GLU A 15 -1.285 5.034 -5.343 1.00 0.00 H new ATOM 0 HA GLU A 15 1.089 6.491 -5.363 1.00 0.00 H new ATOM 0 HB2 GLU A 15 0.396 4.580 -6.876 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.585 5.721 -7.774 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.327 6.372 -7.253 1.00 0.00 H new ATOM 0 HG3 GLU A 15 1.923 5.227 -8.517 1.00 0.00 H new ATOM 244 N GLU A 16 -1.517 8.101 -6.565 1.00 0.00 N ATOM 245 CA GLU A 16 -2.016 9.418 -6.922 1.00 0.00 C ATOM 246 C GLU A 16 -2.108 10.306 -5.681 1.00 0.00 C ATOM 247 O GLU A 16 -1.629 11.439 -5.686 1.00 0.00 O ATOM 248 CB GLU A 16 -3.370 9.317 -7.628 1.00 0.00 C ATOM 249 CG GLU A 16 -3.224 9.556 -9.131 1.00 0.00 C ATOM 250 CD GLU A 16 -4.353 8.874 -9.908 1.00 0.00 C ATOM 251 OE1 GLU A 16 -4.228 7.650 -10.131 1.00 0.00 O ATOM 252 OE2 GLU A 16 -5.314 9.590 -10.259 1.00 0.00 O ATOM 0 H GLU A 16 -2.216 7.359 -6.588 1.00 0.00 H new ATOM 0 HA GLU A 16 -1.313 9.875 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.803 8.332 -7.453 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.060 10.048 -7.205 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.233 10.627 -9.335 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.261 9.174 -9.472 1.00 0.00 H new ATOM 259 N LYS A 17 -2.729 9.758 -4.645 1.00 0.00 N ATOM 260 CA LYS A 17 -2.890 10.487 -3.399 1.00 0.00 C ATOM 261 C LYS A 17 -1.513 10.859 -2.847 1.00 0.00 C ATOM 262 O LYS A 17 -1.193 12.038 -2.709 1.00 0.00 O ATOM 263 CB LYS A 17 -3.749 9.686 -2.418 1.00 0.00 C ATOM 264 CG LYS A 17 -5.131 10.322 -2.253 1.00 0.00 C ATOM 265 CD LYS A 17 -6.189 9.260 -1.941 1.00 0.00 C ATOM 266 CE LYS A 17 -6.760 9.455 -0.535 1.00 0.00 C ATOM 267 NZ LYS A 17 -6.853 8.157 0.170 1.00 0.00 N ATOM 0 H LYS A 17 -3.126 8.818 -4.644 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.427 11.420 -3.571 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.856 8.662 -2.776 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -3.250 9.635 -1.450 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.103 11.059 -1.451 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.402 10.854 -3.165 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.993 9.315 -2.675 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.748 8.266 -2.024 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.126 10.138 0.030 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.747 9.914 -0.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.242 8.307 1.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.476 7.517 -0.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -5.906 7.734 0.246 1.00 0.00 H new ATOM 281 N VAL A 18 -0.733 9.830 -2.548 1.00 0.00 N ATOM 282 CA VAL A 18 0.604 10.035 -2.016 1.00 0.00 C ATOM 283 C VAL A 18 1.310 11.125 -2.825 1.00 0.00 C ATOM 284 O VAL A 18 1.994 11.977 -2.260 1.00 0.00 O ATOM 285 CB VAL A 18 1.369 8.710 -2.002 1.00 0.00 C ATOM 286 CG1 VAL A 18 2.844 8.933 -1.658 1.00 0.00 C ATOM 287 CG2 VAL A 18 0.725 7.714 -1.035 1.00 0.00 C ATOM 0 H VAL A 18 -1.001 8.853 -2.664 1.00 0.00 H new ATOM 0 HA VAL A 18 0.556 10.379 -0.983 1.00 0.00 H new ATOM 0 HB VAL A 18 1.319 8.283 -3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 18 3.366 7.976 -1.655 1.00 0.00 H new ATOM 0 HG12 VAL A 18 3.296 9.590 -2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 18 2.922 9.392 -0.673 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.289 6.781 -1.045 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.730 8.130 -0.028 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.303 7.520 -1.343 1.00 0.00 H new ATOM 297 N LYS A 19 1.118 11.062 -4.135 1.00 0.00 N ATOM 298 CA LYS A 19 1.728 12.034 -5.026 1.00 0.00 C ATOM 299 C LYS A 19 1.021 13.381 -4.867 1.00 0.00 C ATOM 300 O LYS A 19 1.667 14.427 -4.845 1.00 0.00 O ATOM 301 CB LYS A 19 1.736 11.510 -6.465 1.00 0.00 C ATOM 302 CG LYS A 19 2.703 12.314 -7.335 1.00 0.00 C ATOM 303 CD LYS A 19 1.968 13.421 -8.093 1.00 0.00 C ATOM 304 CE LYS A 19 1.394 12.895 -9.411 1.00 0.00 C ATOM 305 NZ LYS A 19 2.404 12.985 -10.488 1.00 0.00 N ATOM 0 H LYS A 19 0.550 10.354 -4.600 1.00 0.00 H new ATOM 0 HA LYS A 19 2.774 12.190 -4.761 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.023 10.459 -6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.731 11.568 -6.883 1.00 0.00 H new ATOM 0 HG2 LYS A 19 3.482 12.751 -6.710 1.00 0.00 H new ATOM 0 HG3 LYS A 19 3.198 11.650 -8.044 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.163 13.818 -7.474 1.00 0.00 H new ATOM 0 HD3 LYS A 19 2.652 14.246 -8.293 1.00 0.00 H new ATOM 0 HE2 LYS A 19 1.076 11.860 -9.288 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.510 13.470 -9.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 1.999 12.624 -11.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 2.688 13.977 -10.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 3.236 12.417 -10.232 1.00 0.00 H new ATOM 319 N ALA A 20 -0.298 13.312 -4.758 1.00 0.00 N ATOM 320 CA ALA A 20 -1.099 14.513 -4.601 1.00 0.00 C ATOM 321 C ALA A 20 -0.587 15.309 -3.399 1.00 0.00 C ATOM 322 O ALA A 20 -0.552 16.538 -3.434 1.00 0.00 O ATOM 323 CB ALA A 20 -2.573 14.128 -4.460 1.00 0.00 C ATOM 0 H ALA A 20 -0.831 12.443 -4.775 1.00 0.00 H new ATOM 0 HA ALA A 20 -1.011 15.151 -5.480 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -3.175 15.029 -4.342 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -2.896 13.590 -5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -2.700 13.490 -3.586 1.00 0.00 H new ATOM 329 N LEU A 21 -0.202 14.576 -2.365 1.00 0.00 N ATOM 330 CA LEU A 21 0.307 15.199 -1.155 1.00 0.00 C ATOM 331 C LEU A 21 1.403 16.202 -1.524 1.00 0.00 C ATOM 332 O LEU A 21 2.274 15.903 -2.339 1.00 0.00 O ATOM 333 CB LEU A 21 0.760 14.135 -0.154 1.00 0.00 C ATOM 334 CG LEU A 21 -0.070 12.849 -0.120 1.00 0.00 C ATOM 335 CD1 LEU A 21 0.299 11.990 1.090 1.00 0.00 C ATOM 336 CD2 LEU A 21 -1.567 13.162 -0.167 1.00 0.00 C ATOM 0 H LEU A 21 -0.232 13.557 -2.340 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.483 15.759 -0.655 1.00 0.00 H new ATOM 0 HB2 LEU A 21 1.794 13.871 -0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.752 14.576 0.843 1.00 0.00 H new ATOM 0 HG LEU A 21 0.165 12.267 -1.011 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.305 11.083 1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 21 1.355 11.723 1.038 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.111 12.551 2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.134 12.232 -0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -1.838 13.775 0.692 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.797 13.702 -1.085 1.00 0.00 H new ATOM 348 N GLY A 22 1.323 17.371 -0.907 1.00 0.00 N ATOM 349 CA GLY A 22 2.297 18.419 -1.160 1.00 0.00 C ATOM 350 C GLY A 22 3.724 17.877 -1.065 1.00 0.00 C ATOM 351 O GLY A 22 4.650 18.448 -1.638 1.00 0.00 O ATOM 0 H GLY A 22 0.599 17.616 -0.232 1.00 0.00 H new ATOM 0 HA2 GLY A 22 2.131 18.843 -2.150 1.00 0.00 H new ATOM 0 HA3 GLY A 22 2.162 19.227 -0.440 1.00 0.00 H new ATOM 355 N GLY A 23 3.857 16.779 -0.334 1.00 0.00 N ATOM 356 CA GLY A 23 5.157 16.152 -0.156 1.00 0.00 C ATOM 357 C GLY A 23 6.180 17.154 0.381 1.00 0.00 C ATOM 358 O GLY A 23 5.935 18.361 0.375 1.00 0.00 O ATOM 0 H GLY A 23 3.087 16.308 0.141 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.068 15.312 0.534 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.503 15.748 -1.107 1.00 0.00 H new ATOM 362 N GLY A 24 7.304 16.619 0.833 1.00 0.00 N ATOM 363 CA GLY A 24 8.365 17.452 1.373 1.00 0.00 C ATOM 364 C GLY A 24 8.672 17.077 2.824 1.00 0.00 C ATOM 365 O GLY A 24 8.724 17.945 3.695 1.00 0.00 O ATOM 0 H GLY A 24 7.503 15.619 0.837 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.264 17.340 0.767 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.072 18.501 1.319 1.00 0.00 H new ATOM 369 N GLY A 25 8.867 15.785 3.039 1.00 0.00 N ATOM 370 CA GLY A 25 9.167 15.285 4.371 1.00 0.00 C ATOM 371 C GLY A 25 8.142 14.235 4.805 1.00 0.00 C ATOM 372 O GLY A 25 8.511 13.174 5.306 1.00 0.00 O ATOM 0 H GLY A 25 8.823 15.069 2.314 1.00 0.00 H new ATOM 0 HA2 GLY A 25 10.166 14.850 4.384 1.00 0.00 H new ATOM 0 HA3 GLY A 25 9.170 16.111 5.082 1.00 0.00 H new ATOM 376 N ARG A 26 6.877 14.568 4.599 1.00 0.00 N ATOM 377 CA ARG A 26 5.797 13.667 4.963 1.00 0.00 C ATOM 378 C ARG A 26 5.900 12.365 4.166 1.00 0.00 C ATOM 379 O ARG A 26 6.467 11.384 4.643 1.00 0.00 O ATOM 380 CB ARG A 26 4.433 14.309 4.704 1.00 0.00 C ATOM 381 CG ARG A 26 3.932 15.053 5.944 1.00 0.00 C ATOM 382 CD ARG A 26 3.896 14.127 7.161 1.00 0.00 C ATOM 383 NE ARG A 26 5.062 14.392 8.034 1.00 0.00 N ATOM 384 CZ ARG A 26 5.318 13.725 9.167 1.00 0.00 C ATOM 385 NH1 ARG A 26 4.492 12.752 9.574 1.00 0.00 N ATOM 386 NH2 ARG A 26 6.400 14.033 9.895 1.00 0.00 N ATOM 0 H ARG A 26 6.575 15.450 4.184 1.00 0.00 H new ATOM 0 HA ARG A 26 5.889 13.453 6.028 1.00 0.00 H new ATOM 0 HB2 ARG A 26 4.506 15.001 3.865 1.00 0.00 H new ATOM 0 HB3 ARG A 26 3.713 13.541 4.421 1.00 0.00 H new ATOM 0 HG2 ARG A 26 4.581 15.904 6.149 1.00 0.00 H new ATOM 0 HG3 ARG A 26 2.935 15.451 5.756 1.00 0.00 H new ATOM 0 HD2 ARG A 26 2.972 14.281 7.718 1.00 0.00 H new ATOM 0 HD3 ARG A 26 3.903 13.086 6.837 1.00 0.00 H new ATOM 0 HE ARG A 26 5.711 15.128 7.755 1.00 0.00 H new ATOM 0 HH11 ARG A 26 3.667 12.519 9.021 1.00 0.00 H new ATOM 0 HH12 ARG A 26 4.688 12.245 10.437 1.00 0.00 H new ATOM 0 HH21 ARG A 26 7.028 14.775 9.586 1.00 0.00 H new ATOM 0 HH22 ARG A 26 6.595 13.525 10.758 1.00 0.00 H new ATOM 400 N ILE A 27 5.342 12.399 2.964 1.00 0.00 N ATOM 401 CA ILE A 27 5.364 11.233 2.096 1.00 0.00 C ATOM 402 C ILE A 27 6.786 10.674 2.036 1.00 0.00 C ATOM 403 O ILE A 27 6.980 9.483 1.798 1.00 0.00 O ATOM 404 CB ILE A 27 4.779 11.576 0.724 1.00 0.00 C ATOM 405 CG1 ILE A 27 5.530 12.745 0.085 1.00 0.00 C ATOM 406 CG2 ILE A 27 3.276 11.845 0.822 1.00 0.00 C ATOM 407 CD1 ILE A 27 4.708 13.376 -1.041 1.00 0.00 C ATOM 0 H ILE A 27 4.872 13.215 2.571 1.00 0.00 H new ATOM 0 HA ILE A 27 4.729 10.445 2.500 1.00 0.00 H new ATOM 0 HB ILE A 27 4.910 10.714 0.070 1.00 0.00 H new ATOM 0 HG12 ILE A 27 5.752 13.496 0.843 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.485 12.397 -0.308 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.884 12.086 -0.166 1.00 0.00 H new ATOM 0 HG22 ILE A 27 2.772 10.958 1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 27 3.100 12.683 1.497 1.00 0.00 H new ATOM 0 HD11 ILE A 27 5.265 14.205 -1.478 1.00 0.00 H new ATOM 0 HD12 ILE A 27 4.508 12.628 -1.809 1.00 0.00 H new ATOM 0 HD13 ILE A 27 3.764 13.745 -0.640 1.00 0.00 H new ATOM 419 N GLU A 28 7.746 11.562 2.256 1.00 0.00 N ATOM 420 CA GLU A 28 9.146 11.172 2.229 1.00 0.00 C ATOM 421 C GLU A 28 9.343 9.849 2.972 1.00 0.00 C ATOM 422 O GLU A 28 10.297 9.120 2.709 1.00 0.00 O ATOM 423 CB GLU A 28 10.032 12.269 2.819 1.00 0.00 C ATOM 424 CG GLU A 28 11.488 12.092 2.383 1.00 0.00 C ATOM 425 CD GLU A 28 12.337 11.530 3.526 1.00 0.00 C ATOM 426 OE1 GLU A 28 12.161 12.023 4.660 1.00 0.00 O ATOM 427 OE2 GLU A 28 13.143 10.618 3.238 1.00 0.00 O ATOM 0 H GLU A 28 7.582 12.549 2.453 1.00 0.00 H new ATOM 0 HA GLU A 28 9.443 11.030 1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.669 13.246 2.499 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.969 12.246 3.907 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.536 11.421 1.525 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.894 13.051 2.061 1.00 0.00 H new ATOM 434 N GLU A 29 8.424 9.579 3.889 1.00 0.00 N ATOM 435 CA GLU A 29 8.484 8.358 4.673 1.00 0.00 C ATOM 436 C GLU A 29 7.499 7.325 4.122 1.00 0.00 C ATOM 437 O GLU A 29 7.872 6.182 3.864 1.00 0.00 O ATOM 438 CB GLU A 29 8.213 8.642 6.152 1.00 0.00 C ATOM 439 CG GLU A 29 9.284 8.003 7.038 1.00 0.00 C ATOM 440 CD GLU A 29 8.649 7.173 8.155 1.00 0.00 C ATOM 441 OE1 GLU A 29 8.298 6.009 7.867 1.00 0.00 O ATOM 442 OE2 GLU A 29 8.530 7.722 9.273 1.00 0.00 O ATOM 0 H GLU A 29 7.634 10.186 4.106 1.00 0.00 H new ATOM 0 HA GLU A 29 9.491 7.948 4.595 1.00 0.00 H new ATOM 0 HB2 GLU A 29 8.191 9.719 6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.231 8.256 6.426 1.00 0.00 H new ATOM 0 HG2 GLU A 29 9.931 7.369 6.432 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.914 8.780 7.471 1.00 0.00 H new ATOM 449 N LEU A 30 6.260 7.764 3.960 1.00 0.00 N ATOM 450 CA LEU A 30 5.217 6.892 3.445 1.00 0.00 C ATOM 451 C LEU A 30 5.675 6.286 2.117 1.00 0.00 C ATOM 452 O LEU A 30 5.636 5.070 1.938 1.00 0.00 O ATOM 453 CB LEU A 30 3.887 7.643 3.354 1.00 0.00 C ATOM 454 CG LEU A 30 3.527 8.203 1.977 1.00 0.00 C ATOM 455 CD1 LEU A 30 3.339 7.076 0.958 1.00 0.00 C ATOM 456 CD2 LEU A 30 2.299 9.113 2.059 1.00 0.00 C ATOM 0 H LEU A 30 5.954 8.713 4.176 1.00 0.00 H new ATOM 0 HA LEU A 30 5.041 6.062 4.130 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.090 6.970 3.671 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.909 8.468 4.066 1.00 0.00 H new ATOM 0 HG LEU A 30 4.359 8.815 1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.084 7.502 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.264 6.505 0.872 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.536 6.417 1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.064 9.498 1.067 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.450 8.545 2.438 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.507 9.946 2.731 1.00 0.00 H new ATOM 468 N LYS A 31 6.098 7.164 1.219 1.00 0.00 N ATOM 469 CA LYS A 31 6.562 6.731 -0.089 1.00 0.00 C ATOM 470 C LYS A 31 7.562 5.586 0.083 1.00 0.00 C ATOM 471 O LYS A 31 7.711 4.748 -0.805 1.00 0.00 O ATOM 472 CB LYS A 31 7.117 7.918 -0.880 1.00 0.00 C ATOM 473 CG LYS A 31 6.092 8.425 -1.897 1.00 0.00 C ATOM 474 CD LYS A 31 6.754 8.716 -3.245 1.00 0.00 C ATOM 475 CE LYS A 31 6.716 7.483 -4.151 1.00 0.00 C ATOM 476 NZ LYS A 31 7.816 7.533 -5.140 1.00 0.00 N ATOM 0 H LYS A 31 6.129 8.172 1.371 1.00 0.00 H new ATOM 0 HA LYS A 31 5.731 6.344 -0.679 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.385 8.723 -0.195 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.030 7.621 -1.396 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.305 7.682 -2.027 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.616 9.330 -1.519 1.00 0.00 H new ATOM 0 HD2 LYS A 31 6.244 9.546 -3.733 1.00 0.00 H new ATOM 0 HD3 LYS A 31 7.787 9.025 -3.088 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.802 6.579 -3.548 1.00 0.00 H new ATOM 0 HE3 LYS A 31 5.757 7.433 -4.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.418 7.565 -6.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 8.392 8.383 -4.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 8.411 6.686 -5.040 1.00 0.00 H new ATOM 490 N LYS A 32 8.222 5.587 1.233 1.00 0.00 N ATOM 491 CA LYS A 32 9.204 4.558 1.533 1.00 0.00 C ATOM 492 C LYS A 32 8.483 3.235 1.804 1.00 0.00 C ATOM 493 O LYS A 32 8.683 2.257 1.087 1.00 0.00 O ATOM 494 CB LYS A 32 10.118 5.007 2.675 1.00 0.00 C ATOM 495 CG LYS A 32 10.453 6.495 2.557 1.00 0.00 C ATOM 496 CD LYS A 32 11.642 6.861 3.447 1.00 0.00 C ATOM 497 CE LYS A 32 12.906 7.078 2.613 1.00 0.00 C ATOM 498 NZ LYS A 32 14.091 6.543 3.319 1.00 0.00 N ATOM 0 H LYS A 32 8.096 6.284 1.967 1.00 0.00 H new ATOM 0 HA LYS A 32 9.859 4.394 0.677 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.632 4.815 3.631 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.037 4.421 2.661 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.682 6.739 1.520 1.00 0.00 H new ATOM 0 HG3 LYS A 32 9.585 7.090 2.840 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.414 7.766 4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 32 11.814 6.068 4.174 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.799 6.587 1.646 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.041 8.142 2.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 14.940 6.699 2.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.201 7.030 4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.966 5.524 3.484 1.00 0.00 H new ATOM 512 N LYS A 33 7.661 3.250 2.843 1.00 0.00 N ATOM 513 CA LYS A 33 6.910 2.063 3.218 1.00 0.00 C ATOM 514 C LYS A 33 6.030 1.630 2.044 1.00 0.00 C ATOM 515 O LYS A 33 5.903 0.438 1.766 1.00 0.00 O ATOM 516 CB LYS A 33 6.131 2.309 4.512 1.00 0.00 C ATOM 517 CG LYS A 33 7.080 2.610 5.674 1.00 0.00 C ATOM 518 CD LYS A 33 6.789 1.700 6.869 1.00 0.00 C ATOM 519 CE LYS A 33 8.085 1.238 7.536 1.00 0.00 C ATOM 520 NZ LYS A 33 7.877 -0.044 8.245 1.00 0.00 N ATOM 0 H LYS A 33 7.498 4.064 3.436 1.00 0.00 H new ATOM 0 HA LYS A 33 7.587 1.236 3.432 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.443 3.143 4.374 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.526 1.434 4.749 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.112 2.473 5.351 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.976 3.653 5.973 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.173 2.232 7.594 1.00 0.00 H new ATOM 0 HD3 LYS A 33 6.217 0.833 6.539 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.866 1.122 6.784 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.429 1.997 8.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.768 -0.342 8.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.147 0.078 8.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 7.570 -0.770 7.567 1.00 0.00 H new ATOM 534 N TRP A 34 5.445 2.619 1.387 1.00 0.00 N ATOM 535 CA TRP A 34 4.580 2.355 0.249 1.00 0.00 C ATOM 536 C TRP A 34 5.403 1.616 -0.808 1.00 0.00 C ATOM 537 O TRP A 34 4.856 0.857 -1.606 1.00 0.00 O ATOM 538 CB TRP A 34 3.954 3.648 -0.277 1.00 0.00 C ATOM 539 CG TRP A 34 4.009 3.792 -1.798 1.00 0.00 C ATOM 540 CD1 TRP A 34 5.032 4.219 -2.551 1.00 0.00 C ATOM 541 CD2 TRP A 34 2.948 3.490 -2.730 1.00 0.00 C ATOM 542 NE1 TRP A 34 4.709 4.214 -3.893 1.00 0.00 N ATOM 543 CE2 TRP A 34 3.402 3.756 -4.005 1.00 0.00 C ATOM 544 CE3 TRP A 34 1.647 3.007 -2.501 1.00 0.00 C ATOM 545 CZ2 TRP A 34 2.620 3.570 -5.152 1.00 0.00 C ATOM 546 CZ3 TRP A 34 0.878 2.826 -3.657 1.00 0.00 C ATOM 547 CH2 TRP A 34 1.321 3.090 -4.948 1.00 0.00 C ATOM 0 H TRP A 34 5.553 3.606 1.621 1.00 0.00 H new ATOM 0 HA TRP A 34 3.740 1.724 0.541 1.00 0.00 H new ATOM 0 HB2 TRP A 34 2.913 3.693 0.044 1.00 0.00 H new ATOM 0 HB3 TRP A 34 4.465 4.497 0.177 1.00 0.00 H new ATOM 0 HD1 TRP A 34 5.989 4.528 -2.157 1.00 0.00 H new ATOM 0 HE1 TRP A 34 5.318 4.495 -4.661 1.00 0.00 H new ATOM 0 HE3 TRP A 34 1.271 2.793 -1.512 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 2.999 3.785 -6.140 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -0.129 2.456 -3.537 1.00 0.00 H new ATOM 0 HH2 TRP A 34 0.665 2.925 -5.790 1.00 0.00 H new ATOM 558 N GLU A 35 6.704 1.865 -0.779 1.00 0.00 N ATOM 559 CA GLU A 35 7.608 1.233 -1.726 1.00 0.00 C ATOM 560 C GLU A 35 7.903 -0.206 -1.297 1.00 0.00 C ATOM 561 O GLU A 35 8.064 -1.088 -2.139 1.00 0.00 O ATOM 562 CB GLU A 35 8.900 2.039 -1.870 1.00 0.00 C ATOM 563 CG GLU A 35 9.056 2.573 -3.296 1.00 0.00 C ATOM 564 CD GLU A 35 9.573 4.013 -3.287 1.00 0.00 C ATOM 565 OE1 GLU A 35 10.252 4.366 -2.300 1.00 0.00 O ATOM 566 OE2 GLU A 35 9.279 4.728 -4.270 1.00 0.00 O ATOM 0 H GLU A 35 7.154 2.495 -0.115 1.00 0.00 H new ATOM 0 HA GLU A 35 7.124 1.208 -2.702 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.895 2.870 -1.165 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.755 1.412 -1.617 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.746 1.938 -3.853 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.097 2.530 -3.812 1.00 0.00 H new ATOM 573 N GLU A 36 7.967 -0.398 0.013 1.00 0.00 N ATOM 574 CA GLU A 36 8.241 -1.715 0.563 1.00 0.00 C ATOM 575 C GLU A 36 6.946 -2.520 0.681 1.00 0.00 C ATOM 576 O GLU A 36 6.981 -3.743 0.807 1.00 0.00 O ATOM 577 CB GLU A 36 8.946 -1.607 1.917 1.00 0.00 C ATOM 578 CG GLU A 36 9.761 -0.316 2.010 1.00 0.00 C ATOM 579 CD GLU A 36 11.048 -0.535 2.808 1.00 0.00 C ATOM 580 OE1 GLU A 36 11.025 -1.423 3.687 1.00 0.00 O ATOM 581 OE2 GLU A 36 12.025 0.189 2.520 1.00 0.00 O ATOM 0 H GLU A 36 7.834 0.336 0.709 1.00 0.00 H new ATOM 0 HA GLU A 36 8.911 -2.240 -0.117 1.00 0.00 H new ATOM 0 HB2 GLU A 36 8.208 -1.634 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 36 9.602 -2.466 2.059 1.00 0.00 H new ATOM 0 HG2 GLU A 36 10.006 0.036 1.008 1.00 0.00 H new ATOM 0 HG3 GLU A 36 9.163 0.462 2.484 1.00 0.00 H new ATOM 588 N LEU A 37 5.834 -1.802 0.639 1.00 0.00 N ATOM 589 CA LEU A 37 4.529 -2.435 0.740 1.00 0.00 C ATOM 590 C LEU A 37 4.130 -2.992 -0.628 1.00 0.00 C ATOM 591 O LEU A 37 3.817 -4.175 -0.754 1.00 0.00 O ATOM 592 CB LEU A 37 3.507 -1.462 1.330 1.00 0.00 C ATOM 593 CG LEU A 37 2.174 -1.357 0.586 1.00 0.00 C ATOM 594 CD1 LEU A 37 1.394 -2.671 0.669 1.00 0.00 C ATOM 595 CD2 LEU A 37 1.354 -0.171 1.096 1.00 0.00 C ATOM 0 H LEU A 37 5.809 -0.787 0.536 1.00 0.00 H new ATOM 0 HA LEU A 37 4.566 -3.279 1.429 1.00 0.00 H new ATOM 0 HB2 LEU A 37 3.304 -1.759 2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.958 -0.471 1.368 1.00 0.00 H new ATOM 0 HG LEU A 37 2.385 -1.174 -0.468 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.451 -2.569 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.982 -3.472 0.221 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.193 -2.909 1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.412 -0.119 0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.151 -0.299 2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.914 0.752 0.942 1.00 0.00 H new ATOM 607 N LYS A 38 4.155 -2.112 -1.619 1.00 0.00 N ATOM 608 CA LYS A 38 3.799 -2.502 -2.973 1.00 0.00 C ATOM 609 C LYS A 38 4.631 -3.719 -3.385 1.00 0.00 C ATOM 610 O LYS A 38 4.159 -4.572 -4.134 1.00 0.00 O ATOM 611 CB LYS A 38 3.937 -1.313 -3.926 1.00 0.00 C ATOM 612 CG LYS A 38 3.759 -1.752 -5.381 1.00 0.00 C ATOM 613 CD LYS A 38 4.722 -1.001 -6.302 1.00 0.00 C ATOM 614 CE LYS A 38 4.339 0.476 -6.408 1.00 0.00 C ATOM 615 NZ LYS A 38 3.384 0.686 -7.518 1.00 0.00 N ATOM 0 H LYS A 38 4.416 -1.132 -1.511 1.00 0.00 H new ATOM 0 HA LYS A 38 2.752 -2.800 -3.020 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.194 -0.555 -3.678 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.917 -0.852 -3.799 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.932 -2.825 -5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.732 -1.570 -5.697 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.739 -1.090 -5.921 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.712 -1.455 -7.293 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.895 0.811 -5.470 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.233 1.079 -6.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.135 1.694 -7.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.820 0.386 -8.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.524 0.126 -7.347 1.00 0.00 H new ATOM 629 N LYS A 39 5.854 -3.759 -2.876 1.00 0.00 N ATOM 630 CA LYS A 39 6.755 -4.857 -3.182 1.00 0.00 C ATOM 631 C LYS A 39 6.204 -6.147 -2.572 1.00 0.00 C ATOM 632 O LYS A 39 6.509 -7.241 -3.045 1.00 0.00 O ATOM 633 CB LYS A 39 8.178 -4.522 -2.731 1.00 0.00 C ATOM 634 CG LYS A 39 9.212 -5.241 -3.601 1.00 0.00 C ATOM 635 CD LYS A 39 10.622 -4.717 -3.323 1.00 0.00 C ATOM 636 CE LYS A 39 11.567 -5.046 -4.480 1.00 0.00 C ATOM 637 NZ LYS A 39 12.971 -4.782 -4.095 1.00 0.00 N ATOM 0 H LYS A 39 6.242 -3.049 -2.254 1.00 0.00 H new ATOM 0 HA LYS A 39 6.815 -5.013 -4.259 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.337 -3.445 -2.786 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.311 -4.811 -1.688 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.174 -6.313 -3.407 1.00 0.00 H new ATOM 0 HG3 LYS A 39 8.968 -5.099 -4.654 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.589 -3.638 -3.171 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.002 -5.158 -2.401 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.452 -6.092 -4.764 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.305 -4.448 -5.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.598 -5.011 -4.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.080 -3.778 -3.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.223 -5.371 -3.276 1.00 0.00 H new ATOM 651 N LYS A 40 5.403 -5.977 -1.530 1.00 0.00 N ATOM 652 CA LYS A 40 4.808 -7.116 -0.851 1.00 0.00 C ATOM 653 C LYS A 40 3.577 -7.581 -1.630 1.00 0.00 C ATOM 654 O LYS A 40 3.365 -8.781 -1.803 1.00 0.00 O ATOM 655 CB LYS A 40 4.517 -6.773 0.612 1.00 0.00 C ATOM 656 CG LYS A 40 5.595 -7.347 1.534 1.00 0.00 C ATOM 657 CD LYS A 40 5.890 -6.393 2.693 1.00 0.00 C ATOM 658 CE LYS A 40 6.672 -7.101 3.800 1.00 0.00 C ATOM 659 NZ LYS A 40 7.687 -6.192 4.381 1.00 0.00 N ATOM 0 H LYS A 40 5.152 -5.069 -1.140 1.00 0.00 H new ATOM 0 HA LYS A 40 5.505 -7.954 -0.826 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.468 -5.691 0.733 1.00 0.00 H new ATOM 0 HB3 LYS A 40 3.542 -7.170 0.895 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.268 -8.310 1.925 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.507 -7.527 0.965 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.461 -5.539 2.329 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.955 -6.004 3.095 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.988 -7.437 4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.159 -7.990 3.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.209 -6.689 5.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 8.350 -5.892 3.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.216 -5.356 4.782 1.00 0.00 H new ATOM 673 N ILE A 41 2.796 -6.609 -2.079 1.00 0.00 N ATOM 674 CA ILE A 41 1.592 -6.904 -2.836 1.00 0.00 C ATOM 675 C ILE A 41 1.974 -7.600 -4.144 1.00 0.00 C ATOM 676 O ILE A 41 1.139 -8.242 -4.777 1.00 0.00 O ATOM 677 CB ILE A 41 0.759 -5.637 -3.034 1.00 0.00 C ATOM 678 CG1 ILE A 41 0.772 -4.770 -1.774 1.00 0.00 C ATOM 679 CG2 ILE A 41 -0.664 -5.981 -3.478 1.00 0.00 C ATOM 680 CD1 ILE A 41 -0.400 -3.788 -1.771 1.00 0.00 C ATOM 0 H ILE A 41 2.974 -5.615 -1.933 1.00 0.00 H new ATOM 0 HA ILE A 41 0.954 -7.593 -2.283 1.00 0.00 H new ATOM 0 HB ILE A 41 1.213 -5.051 -3.833 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.720 -5.406 -0.890 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.711 -4.220 -1.716 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.235 -5.063 -3.612 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.629 -6.527 -4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.143 -6.599 -2.718 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.366 -3.184 -0.864 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.332 -3.137 -2.643 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.338 -4.341 -1.804 1.00 0.00 H new ATOM 692 N GLU A 42 3.238 -7.447 -4.510 1.00 0.00 N ATOM 693 CA GLU A 42 3.743 -8.052 -5.732 1.00 0.00 C ATOM 694 C GLU A 42 3.990 -9.547 -5.521 1.00 0.00 C ATOM 695 O GLU A 42 3.473 -10.377 -6.269 1.00 0.00 O ATOM 696 CB GLU A 42 5.014 -7.348 -6.208 1.00 0.00 C ATOM 697 CG GLU A 42 4.728 -6.463 -7.423 1.00 0.00 C ATOM 698 CD GLU A 42 5.078 -7.185 -8.724 1.00 0.00 C ATOM 699 OE1 GLU A 42 6.231 -7.660 -8.816 1.00 0.00 O ATOM 700 OE2 GLU A 42 4.187 -7.248 -9.598 1.00 0.00 O ATOM 0 H GLU A 42 3.928 -6.913 -3.982 1.00 0.00 H new ATOM 0 HA GLU A 42 2.989 -7.934 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.422 -6.741 -5.400 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.771 -8.090 -6.464 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.675 -6.181 -7.432 1.00 0.00 H new ATOM 0 HG3 GLU A 42 5.304 -5.541 -7.349 1.00 0.00 H new ATOM 707 N GLU A 43 4.779 -9.845 -4.500 1.00 0.00 N ATOM 708 CA GLU A 43 5.101 -11.226 -4.182 1.00 0.00 C ATOM 709 C GLU A 43 3.916 -11.902 -3.490 1.00 0.00 C ATOM 710 O GLU A 43 3.933 -13.110 -3.259 1.00 0.00 O ATOM 711 CB GLU A 43 6.361 -11.310 -3.316 1.00 0.00 C ATOM 712 CG GLU A 43 7.365 -12.303 -3.904 1.00 0.00 C ATOM 713 CD GLU A 43 7.819 -13.313 -2.848 1.00 0.00 C ATOM 714 OE1 GLU A 43 6.943 -14.063 -2.366 1.00 0.00 O ATOM 715 OE2 GLU A 43 9.033 -13.312 -2.546 1.00 0.00 O ATOM 0 H GLU A 43 5.205 -9.154 -3.882 1.00 0.00 H new ATOM 0 HA GLU A 43 5.303 -11.755 -5.114 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.821 -10.325 -3.240 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.092 -11.615 -2.305 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.912 -12.829 -4.745 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.229 -11.765 -4.293 1.00 0.00 H new ATOM 722 N LEU A 44 2.914 -11.093 -3.180 1.00 0.00 N ATOM 723 CA LEU A 44 1.721 -11.598 -2.520 1.00 0.00 C ATOM 724 C LEU A 44 1.325 -12.937 -3.146 1.00 0.00 C ATOM 725 O LEU A 44 0.759 -12.972 -4.238 1.00 0.00 O ATOM 726 CB LEU A 44 0.607 -10.550 -2.552 1.00 0.00 C ATOM 727 CG LEU A 44 0.366 -9.787 -1.247 1.00 0.00 C ATOM 728 CD1 LEU A 44 -0.822 -8.832 -1.382 1.00 0.00 C ATOM 729 CD2 LEU A 44 0.196 -10.751 -0.072 1.00 0.00 C ATOM 0 H LEU A 44 2.903 -10.092 -3.373 1.00 0.00 H new ATOM 0 HA LEU A 44 1.920 -11.786 -1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.837 -9.827 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.322 -11.044 -2.838 1.00 0.00 H new ATOM 0 HG LEU A 44 1.246 -9.179 -1.039 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.972 -8.302 -0.441 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.622 -8.112 -2.176 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.720 -9.400 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.026 -10.183 0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.657 -11.404 -0.257 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.097 -11.354 0.037 1.00 0.00 H new ATOM 769 N GLU A 49 0.102 -14.039 3.742 1.00 0.00 N ATOM 770 CA GLU A 49 0.478 -13.105 4.790 1.00 0.00 C ATOM 771 C GLU A 49 0.120 -11.675 4.379 1.00 0.00 C ATOM 772 O GLU A 49 0.833 -10.732 4.719 1.00 0.00 O ATOM 773 CB GLU A 49 1.965 -13.225 5.123 1.00 0.00 C ATOM 774 CG GLU A 49 2.196 -14.239 6.244 1.00 0.00 C ATOM 775 CD GLU A 49 3.691 -14.442 6.501 1.00 0.00 C ATOM 776 OE1 GLU A 49 4.349 -15.013 5.604 1.00 0.00 O ATOM 777 OE2 GLU A 49 4.142 -14.023 7.589 1.00 0.00 O ATOM 0 HA GLU A 49 -0.083 -13.354 5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 49 2.517 -13.529 4.234 1.00 0.00 H new ATOM 0 HB3 GLU A 49 2.354 -12.252 5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 49 1.710 -13.894 7.157 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.737 -15.191 5.978 1.00 0.00 H new ATOM 784 N VAL A 50 -0.983 -11.559 3.655 1.00 0.00 N ATOM 785 CA VAL A 50 -1.443 -10.260 3.195 1.00 0.00 C ATOM 786 C VAL A 50 -1.678 -9.350 4.402 1.00 0.00 C ATOM 787 O VAL A 50 -1.472 -8.139 4.321 1.00 0.00 O ATOM 788 CB VAL A 50 -2.687 -10.425 2.319 1.00 0.00 C ATOM 789 CG1 VAL A 50 -3.084 -9.095 1.673 1.00 0.00 C ATOM 790 CG2 VAL A 50 -2.471 -11.506 1.259 1.00 0.00 C ATOM 0 H VAL A 50 -1.572 -12.344 3.375 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.685 -9.785 2.573 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.508 -10.744 2.961 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.971 -9.241 1.056 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -3.300 -8.363 2.451 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.265 -8.734 1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.370 -11.603 0.650 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.630 -11.229 0.623 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.259 -12.457 1.747 1.00 0.00 H new ATOM 800 N LYS A 51 -2.107 -9.967 5.493 1.00 0.00 N ATOM 801 CA LYS A 51 -2.372 -9.228 6.716 1.00 0.00 C ATOM 802 C LYS A 51 -1.327 -8.123 6.876 1.00 0.00 C ATOM 803 O LYS A 51 -1.617 -7.063 7.430 1.00 0.00 O ATOM 804 CB LYS A 51 -2.449 -10.179 7.911 1.00 0.00 C ATOM 805 CG LYS A 51 -3.815 -10.090 8.596 1.00 0.00 C ATOM 806 CD LYS A 51 -3.889 -11.035 9.797 1.00 0.00 C ATOM 807 CE LYS A 51 -5.218 -11.794 9.816 1.00 0.00 C ATOM 808 NZ LYS A 51 -6.126 -11.225 10.836 1.00 0.00 N ATOM 0 H LYS A 51 -2.278 -10.971 5.556 1.00 0.00 H new ATOM 0 HA LYS A 51 -3.346 -8.741 6.663 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.271 -11.202 7.578 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.663 -9.935 8.626 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.996 -9.066 8.923 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.600 -10.340 7.883 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.062 -11.744 9.758 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.778 -10.466 10.720 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.687 -11.742 8.834 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.038 -12.848 10.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.023 -11.752 10.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.683 -11.297 11.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.312 -10.225 10.617 1.00 0.00 H new ATOM 822 N LYS A 52 -0.130 -8.408 6.381 1.00 0.00 N ATOM 823 CA LYS A 52 0.961 -7.451 6.462 1.00 0.00 C ATOM 824 C LYS A 52 0.699 -6.301 5.489 1.00 0.00 C ATOM 825 O LYS A 52 0.614 -5.144 5.898 1.00 0.00 O ATOM 826 CB LYS A 52 2.303 -8.151 6.241 1.00 0.00 C ATOM 827 CG LYS A 52 3.031 -8.374 7.569 1.00 0.00 C ATOM 828 CD LYS A 52 2.344 -9.465 8.393 1.00 0.00 C ATOM 829 CE LYS A 52 3.086 -9.705 9.711 1.00 0.00 C ATOM 830 NZ LYS A 52 2.125 -9.956 10.807 1.00 0.00 N ATOM 0 H LYS A 52 0.108 -9.288 5.923 1.00 0.00 H new ATOM 0 HA LYS A 52 1.014 -7.017 7.460 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.141 -9.108 5.746 1.00 0.00 H new ATOM 0 HB3 LYS A 52 2.925 -7.551 5.577 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.067 -8.655 7.378 1.00 0.00 H new ATOM 0 HG3 LYS A 52 3.053 -7.444 8.137 1.00 0.00 H new ATOM 0 HD2 LYS A 52 1.313 -9.176 8.599 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.307 -10.391 7.819 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.759 -10.556 9.607 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.703 -8.839 9.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 2.644 -10.117 11.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.500 -9.132 10.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.554 -10.796 10.583 1.00 0.00 H new ATOM 844 N VAL A 53 0.577 -6.659 4.219 1.00 0.00 N ATOM 845 CA VAL A 53 0.326 -5.671 3.183 1.00 0.00 C ATOM 846 C VAL A 53 -0.744 -4.691 3.668 1.00 0.00 C ATOM 847 O VAL A 53 -0.457 -3.519 3.902 1.00 0.00 O ATOM 848 CB VAL A 53 -0.049 -6.369 1.875 1.00 0.00 C ATOM 849 CG1 VAL A 53 -0.943 -5.473 1.013 1.00 0.00 C ATOM 850 CG2 VAL A 53 1.200 -6.800 1.104 1.00 0.00 C ATOM 0 H VAL A 53 0.647 -7.620 3.884 1.00 0.00 H new ATOM 0 HA VAL A 53 1.227 -5.092 2.979 1.00 0.00 H new ATOM 0 HB VAL A 53 -0.614 -7.267 2.125 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.196 -5.992 0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.857 -5.238 1.559 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.414 -4.550 0.777 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.904 -7.294 0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.804 -5.923 0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.783 -7.491 1.713 1.00 0.00 H new ATOM 860 N GLU A 54 -1.956 -5.209 3.804 1.00 0.00 N ATOM 861 CA GLU A 54 -3.071 -4.395 4.256 1.00 0.00 C ATOM 862 C GLU A 54 -2.618 -3.442 5.363 1.00 0.00 C ATOM 863 O GLU A 54 -2.560 -2.230 5.160 1.00 0.00 O ATOM 864 CB GLU A 54 -4.234 -5.270 4.728 1.00 0.00 C ATOM 865 CG GLU A 54 -4.658 -6.254 3.636 1.00 0.00 C ATOM 866 CD GLU A 54 -6.127 -6.053 3.258 1.00 0.00 C ATOM 867 OE1 GLU A 54 -6.983 -6.429 4.088 1.00 0.00 O ATOM 868 OE2 GLU A 54 -6.361 -5.529 2.148 1.00 0.00 O ATOM 0 H GLU A 54 -2.190 -6.182 3.609 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.426 -3.801 3.414 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -3.941 -5.819 5.623 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -5.080 -4.640 5.003 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -4.030 -6.118 2.755 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.504 -7.276 3.983 1.00 0.00 H new ATOM 875 N GLU A 55 -2.306 -4.025 6.512 1.00 0.00 N ATOM 876 CA GLU A 55 -1.860 -3.243 7.653 1.00 0.00 C ATOM 877 C GLU A 55 -0.861 -2.175 7.205 1.00 0.00 C ATOM 878 O GLU A 55 -0.778 -1.105 7.808 1.00 0.00 O ATOM 879 CB GLU A 55 -1.252 -4.143 8.731 1.00 0.00 C ATOM 880 CG GLU A 55 -2.186 -4.259 9.937 1.00 0.00 C ATOM 881 CD GLU A 55 -2.075 -3.027 10.837 1.00 0.00 C ATOM 882 OE1 GLU A 55 -1.010 -2.883 11.474 1.00 0.00 O ATOM 883 OE2 GLU A 55 -3.059 -2.255 10.867 1.00 0.00 O ATOM 0 H GLU A 55 -2.353 -5.030 6.677 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.726 -2.745 8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.061 -5.133 8.318 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -0.291 -3.739 9.048 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -3.215 -4.372 9.595 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -1.939 -5.154 10.508 1.00 0.00 H new ATOM 890 N GLU A 56 -0.129 -2.501 6.150 1.00 0.00 N ATOM 891 CA GLU A 56 0.861 -1.581 5.614 1.00 0.00 C ATOM 892 C GLU A 56 0.177 -0.469 4.816 1.00 0.00 C ATOM 893 O GLU A 56 0.479 0.708 5.001 1.00 0.00 O ATOM 894 CB GLU A 56 1.887 -2.322 4.753 1.00 0.00 C ATOM 895 CG GLU A 56 3.302 -1.807 5.023 1.00 0.00 C ATOM 896 CD GLU A 56 3.625 -1.847 6.518 1.00 0.00 C ATOM 897 OE1 GLU A 56 3.263 -2.864 7.149 1.00 0.00 O ATOM 898 OE2 GLU A 56 4.226 -0.862 6.996 1.00 0.00 O ATOM 0 H GLU A 56 -0.201 -3.388 5.652 1.00 0.00 H new ATOM 0 HA GLU A 56 1.395 -1.126 6.448 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.839 -3.391 4.962 1.00 0.00 H new ATOM 0 HB3 GLU A 56 1.644 -2.192 3.698 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.024 -2.413 4.475 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.398 -0.786 4.654 1.00 0.00 H new ATOM 905 N VAL A 57 -0.733 -0.883 3.946 1.00 0.00 N ATOM 906 CA VAL A 57 -1.463 0.063 3.119 1.00 0.00 C ATOM 907 C VAL A 57 -2.331 0.952 4.014 1.00 0.00 C ATOM 908 O VAL A 57 -2.631 2.091 3.659 1.00 0.00 O ATOM 909 CB VAL A 57 -2.270 -0.684 2.056 1.00 0.00 C ATOM 910 CG1 VAL A 57 -2.638 0.243 0.896 1.00 0.00 C ATOM 911 CG2 VAL A 57 -1.509 -1.914 1.555 1.00 0.00 C ATOM 0 H VAL A 57 -0.981 -1.861 3.796 1.00 0.00 H new ATOM 0 HA VAL A 57 -0.772 0.715 2.584 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.196 -1.027 2.517 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -3.211 -0.313 0.154 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.237 1.074 1.270 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.728 0.630 0.437 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -2.104 -2.428 0.800 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.560 -1.602 1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.320 -2.590 2.389 1.00 0.00 H new ATOM 921 N LYS A 58 -2.708 0.396 5.156 1.00 0.00 N ATOM 922 CA LYS A 58 -3.536 1.123 6.103 1.00 0.00 C ATOM 923 C LYS A 58 -2.767 2.345 6.612 1.00 0.00 C ATOM 924 O LYS A 58 -3.253 3.471 6.520 1.00 0.00 O ATOM 925 CB LYS A 58 -4.019 0.192 7.217 1.00 0.00 C ATOM 926 CG LYS A 58 -5.382 0.638 7.752 1.00 0.00 C ATOM 927 CD LYS A 58 -6.439 -0.445 7.532 1.00 0.00 C ATOM 928 CE LYS A 58 -6.615 -1.303 8.786 1.00 0.00 C ATOM 929 NZ LYS A 58 -7.704 -2.285 8.593 1.00 0.00 N ATOM 0 H LYS A 58 -2.456 -0.549 5.447 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.438 1.493 5.616 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.089 -0.828 6.839 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.291 0.182 8.028 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.303 0.863 8.816 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.689 1.557 7.253 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.390 0.018 7.268 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.148 -1.077 6.693 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.684 -1.823 9.012 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.839 -0.666 9.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.810 -2.859 9.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.594 -1.783 8.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.475 -2.904 7.790 1.00 0.00 H new ATOM 943 N LYS A 59 -1.581 2.079 7.139 1.00 0.00 N ATOM 944 CA LYS A 59 -0.740 3.142 7.663 1.00 0.00 C ATOM 945 C LYS A 59 -0.735 4.314 6.680 1.00 0.00 C ATOM 946 O LYS A 59 -0.600 5.468 7.084 1.00 0.00 O ATOM 947 CB LYS A 59 0.654 2.609 7.993 1.00 0.00 C ATOM 948 CG LYS A 59 1.403 3.568 8.922 1.00 0.00 C ATOM 949 CD LYS A 59 2.916 3.453 8.725 1.00 0.00 C ATOM 950 CE LYS A 59 3.521 4.802 8.334 1.00 0.00 C ATOM 951 NZ LYS A 59 4.990 4.783 8.515 1.00 0.00 N ATOM 0 H LYS A 59 -1.182 1.143 7.214 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.142 3.517 8.604 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.570 1.630 8.466 1.00 0.00 H new ATOM 0 HB3 LYS A 59 1.222 2.471 7.073 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.084 4.592 8.727 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.150 3.347 9.959 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.380 3.095 9.644 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.131 2.716 7.951 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.279 5.028 7.295 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.084 5.593 8.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.349 5.759 8.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 5.224 4.300 9.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 5.431 4.276 7.721 1.00 0.00 H new ATOM 965 N LEU A 60 -0.884 3.977 5.407 1.00 0.00 N ATOM 966 CA LEU A 60 -0.897 4.987 4.363 1.00 0.00 C ATOM 967 C LEU A 60 -2.223 5.748 4.411 1.00 0.00 C ATOM 968 O LEU A 60 -2.263 6.909 4.812 1.00 0.00 O ATOM 969 CB LEU A 60 -0.601 4.354 3.001 1.00 0.00 C ATOM 970 CG LEU A 60 0.843 4.465 2.509 1.00 0.00 C ATOM 971 CD1 LEU A 60 1.421 3.085 2.190 1.00 0.00 C ATOM 972 CD2 LEU A 60 0.945 5.419 1.317 1.00 0.00 C ATOM 0 H LEU A 60 -0.997 3.019 5.075 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.104 5.716 4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.868 3.298 3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.253 4.815 2.259 1.00 0.00 H new ATOM 0 HG LEU A 60 1.446 4.889 3.312 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.448 3.192 1.842 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.404 2.467 3.088 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.822 2.611 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.982 5.480 0.987 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.326 5.048 0.500 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.600 6.410 1.613 1.00 0.00 H new ATOM 984 N GLU A 61 -3.278 5.061 3.997 1.00 0.00 N ATOM 985 CA GLU A 61 -4.604 5.658 3.989 1.00 0.00 C ATOM 986 C GLU A 61 -4.776 6.585 5.194 1.00 0.00 C ATOM 987 O GLU A 61 -5.142 7.748 5.039 1.00 0.00 O ATOM 988 CB GLU A 61 -5.690 4.580 3.966 1.00 0.00 C ATOM 989 CG GLU A 61 -5.994 4.138 2.533 1.00 0.00 C ATOM 990 CD GLU A 61 -7.421 4.517 2.134 1.00 0.00 C ATOM 991 OE1 GLU A 61 -8.305 4.400 3.010 1.00 0.00 O ATOM 992 OE2 GLU A 61 -7.596 4.915 0.962 1.00 0.00 O ATOM 0 H GLU A 61 -3.242 4.097 3.665 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.709 6.252 3.081 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -5.367 3.721 4.554 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.598 4.963 4.432 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.285 4.602 1.847 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.862 3.060 2.446 1.00 0.00 H new ATOM 999 N GLU A 62 -4.503 6.034 6.368 1.00 0.00 N ATOM 1000 CA GLU A 62 -4.623 6.796 7.598 1.00 0.00 C ATOM 1001 C GLU A 62 -3.809 8.088 7.504 1.00 0.00 C ATOM 1002 O GLU A 62 -4.374 9.181 7.479 1.00 0.00 O ATOM 1003 CB GLU A 62 -4.189 5.961 8.805 1.00 0.00 C ATOM 1004 CG GLU A 62 -5.404 5.421 9.562 1.00 0.00 C ATOM 1005 CD GLU A 62 -5.420 5.927 11.007 1.00 0.00 C ATOM 1006 OE1 GLU A 62 -4.456 5.601 11.733 1.00 0.00 O ATOM 1007 OE2 GLU A 62 -6.397 6.627 11.351 1.00 0.00 O ATOM 0 H GLU A 62 -4.199 5.068 6.493 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.671 7.060 7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.565 5.132 8.473 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.580 6.570 9.473 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.319 5.728 9.055 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.386 4.331 9.555 1.00 0.00 H new ATOM 1014 N GLU A 63 -2.496 7.920 7.454 1.00 0.00 N ATOM 1015 CA GLU A 63 -1.598 9.059 7.363 1.00 0.00 C ATOM 1016 C GLU A 63 -2.007 9.965 6.200 1.00 0.00 C ATOM 1017 O GLU A 63 -2.230 11.160 6.388 1.00 0.00 O ATOM 1018 CB GLU A 63 -0.146 8.603 7.219 1.00 0.00 C ATOM 1019 CG GLU A 63 0.780 9.429 8.113 1.00 0.00 C ATOM 1020 CD GLU A 63 1.199 8.634 9.352 1.00 0.00 C ATOM 1021 OE1 GLU A 63 0.337 8.475 10.242 1.00 0.00 O ATOM 1022 OE2 GLU A 63 2.373 8.204 9.380 1.00 0.00 O ATOM 0 H GLU A 63 -2.032 7.012 7.475 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.673 9.631 8.288 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.065 7.548 7.482 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.167 8.698 6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.665 9.726 7.550 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.275 10.345 8.418 1.00 0.00 H new ATOM 1029 N ILE A 64 -2.093 9.362 5.024 1.00 0.00 N ATOM 1030 CA ILE A 64 -2.470 10.098 3.830 1.00 0.00 C ATOM 1031 C ILE A 64 -3.700 10.956 4.133 1.00 0.00 C ATOM 1032 O ILE A 64 -3.675 12.172 3.948 1.00 0.00 O ATOM 1033 CB ILE A 64 -2.663 9.144 2.649 1.00 0.00 C ATOM 1034 CG1 ILE A 64 -1.360 8.413 2.318 1.00 0.00 C ATOM 1035 CG2 ILE A 64 -3.231 9.882 1.435 1.00 0.00 C ATOM 1036 CD1 ILE A 64 -1.369 7.903 0.876 1.00 0.00 C ATOM 0 H ILE A 64 -1.908 8.370 4.872 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.670 10.777 3.534 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.393 8.387 2.936 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.514 9.085 2.465 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.224 7.576 3.003 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.358 9.181 0.610 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -4.196 10.318 1.693 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.544 10.673 1.136 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -0.432 7.387 0.667 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.201 7.213 0.739 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.480 8.745 0.193 1.00 0.00 H new ATOM 1048 N LYS A 65 -4.748 10.290 4.595 1.00 0.00 N ATOM 1049 CA LYS A 65 -5.985 10.976 4.926 1.00 0.00 C ATOM 1050 C LYS A 65 -5.674 12.176 5.823 1.00 0.00 C ATOM 1051 O LYS A 65 -6.450 13.128 5.883 1.00 0.00 O ATOM 1052 CB LYS A 65 -6.994 9.999 5.534 1.00 0.00 C ATOM 1053 CG LYS A 65 -8.383 10.632 5.626 1.00 0.00 C ATOM 1054 CD LYS A 65 -9.367 9.696 6.330 1.00 0.00 C ATOM 1055 CE LYS A 65 -10.642 10.441 6.732 1.00 0.00 C ATOM 1056 NZ LYS A 65 -10.408 11.246 7.951 1.00 0.00 N ATOM 0 H LYS A 65 -4.766 9.282 4.748 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.457 11.366 4.024 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -7.042 9.095 4.927 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.661 9.698 6.527 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.321 11.575 6.169 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -8.748 10.863 4.625 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.620 8.866 5.671 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -8.897 9.268 7.216 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.964 11.089 5.917 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -11.447 9.728 6.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -11.313 11.622 8.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -9.978 10.648 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.768 12.035 7.728 1.00 0.00 H new ATOM 1070 N LYS A 66 -4.536 12.090 6.498 1.00 0.00 N ATOM 1071 CA LYS A 66 -4.113 13.157 7.389 1.00 0.00 C ATOM 1072 C LYS A 66 -3.148 14.082 6.647 1.00 0.00 C ATOM 1073 O LYS A 66 -3.080 15.276 6.937 1.00 0.00 O ATOM 1074 CB LYS A 66 -3.537 12.577 8.682 1.00 0.00 C ATOM 1075 CG LYS A 66 -4.081 13.317 9.905 1.00 0.00 C ATOM 1076 CD LYS A 66 -2.984 14.144 10.579 1.00 0.00 C ATOM 1077 CE LYS A 66 -2.797 13.723 12.038 1.00 0.00 C ATOM 1078 NZ LYS A 66 -1.672 12.771 12.163 1.00 0.00 N ATOM 0 H LYS A 66 -3.895 11.298 6.445 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.967 13.763 7.691 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.786 11.518 8.753 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -2.449 12.648 8.664 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -4.901 13.970 9.605 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.489 12.599 10.617 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.046 14.020 10.038 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.241 15.202 10.532 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.608 14.602 12.655 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.713 13.264 12.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.559 12.496 13.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.868 11.925 11.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.797 13.222 11.827 1.00 0.00 H new ATOM 1092 N LEU A 67 -2.426 13.498 5.702 1.00 0.00 N ATOM 1093 CA LEU A 67 -1.468 14.256 4.915 1.00 0.00 C ATOM 1094 C LEU A 67 -2.218 15.231 4.006 1.00 0.00 C ATOM 1095 O LEU A 67 -3.446 15.194 3.930 1.00 0.00 O ATOM 1096 CB LEU A 67 -0.526 13.312 4.163 1.00 0.00 C ATOM 1097 CG LEU A 67 0.310 12.368 5.029 1.00 0.00 C ATOM 1098 CD1 LEU A 67 0.578 11.050 4.300 1.00 0.00 C ATOM 1099 CD2 LEU A 67 1.604 13.045 5.485 1.00 0.00 C ATOM 0 H LEU A 67 -2.485 12.508 5.463 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.830 14.854 5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.120 12.711 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.152 13.914 3.558 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.262 12.129 5.926 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.174 10.397 4.937 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.369 10.564 4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.120 11.249 3.376 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.180 12.353 6.099 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.192 13.332 4.613 1.00 0.00 H new ATOM 0 HD23 LEU A 67 1.364 13.934 6.069 1.00 0.00 H new