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= -0.002 X(o=-0.002,f=-0.13) USER MOD Single : A 106 SER OG : rot 180:sc= -0.0863 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.0177 X(o=-0.018,f=-0.36) 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 10.577 12.741 -0.548 1.00 0.00 N ATOM 2 CA ILE A 88 10.118 11.497 -1.154 1.00 0.00 C ATOM 3 C ILE A 88 11.159 10.393 -0.997 1.00 0.00 C ATOM 4 O ILE A 88 12.293 10.525 -1.456 1.00 0.00 O ATOM 5 CB ILE A 88 9.802 11.681 -2.649 1.00 0.00 C ATOM 6 CG1 ILE A 88 8.895 12.895 -2.856 1.00 0.00 C ATOM 7 CG2 ILE A 88 9.151 10.425 -3.211 1.00 0.00 C ATOM 8 CD1 ILE A 88 9.649 14.160 -3.202 1.00 0.00 C ATOM 0 HA ILE A 88 9.205 11.210 -0.632 1.00 0.00 H new ATOM 0 HB ILE A 88 10.736 11.854 -3.184 1.00 0.00 H new ATOM 0 HG12 ILE A 88 8.184 12.676 -3.653 1.00 0.00 H new ATOM 0 HG13 ILE A 88 8.315 13.064 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 88 8.933 10.570 -4.269 1.00 0.00 H new ATOM 0 HG22 ILE A 88 9.829 9.580 -3.093 1.00 0.00 H new ATOM 0 HG23 ILE A 88 8.224 10.224 -2.674 1.00 0.00 H new ATOM 0 HD11 ILE A 88 8.943 14.980 -3.335 1.00 0.00 H new ATOM 0 HD12 ILE A 88 10.340 14.404 -2.395 1.00 0.00 H new ATOM 0 HD13 ILE A 88 10.208 14.009 -4.126 1.00 0.00 H new ATOM 20 N ASP A 89 10.764 9.303 -0.348 1.00 0.00 N ATOM 21 CA ASP A 89 11.661 8.174 -0.133 1.00 0.00 C ATOM 22 C ASP A 89 11.060 6.888 -0.692 1.00 0.00 C ATOM 23 O ASP A 89 10.170 6.292 -0.085 1.00 0.00 O ATOM 24 CB ASP A 89 11.958 8.007 1.357 1.00 0.00 C ATOM 25 CG ASP A 89 13.362 8.448 1.722 1.00 0.00 C ATOM 26 OD1 ASP A 89 13.579 9.668 1.875 1.00 0.00 O ATOM 27 OD2 ASP A 89 14.244 7.573 1.851 1.00 0.00 O ATOM 0 H ASP A 89 9.828 9.178 0.038 1.00 0.00 H new ATOM 0 HA ASP A 89 12.593 8.377 -0.660 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.237 8.585 1.935 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.825 6.962 1.636 1.00 0.00 H new ATOM 32 N VAL A 90 11.551 6.467 -1.853 1.00 0.00 N ATOM 33 CA VAL A 90 11.063 5.252 -2.494 1.00 0.00 C ATOM 34 C VAL A 90 11.132 4.063 -1.544 1.00 0.00 C ATOM 35 O VAL A 90 10.306 3.151 -1.611 1.00 0.00 O ATOM 36 CB VAL A 90 11.868 4.926 -3.767 1.00 0.00 C ATOM 37 CG1 VAL A 90 11.719 6.038 -4.793 1.00 0.00 C ATOM 38 CG2 VAL A 90 13.332 4.696 -3.424 1.00 0.00 C ATOM 0 H VAL A 90 12.287 6.950 -2.369 1.00 0.00 H new ATOM 0 HA VAL A 90 10.024 5.435 -2.767 1.00 0.00 H new ATOM 0 HB VAL A 90 11.472 4.009 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.294 5.790 -5.685 1.00 0.00 H new ATOM 0 HG12 VAL A 90 10.668 6.149 -5.059 1.00 0.00 H new ATOM 0 HG13 VAL A 90 12.088 6.973 -4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 90 13.887 4.467 -4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 90 13.744 5.595 -2.964 1.00 0.00 H new ATOM 0 HG23 VAL A 90 13.416 3.861 -2.728 1.00 0.00 H new ATOM 48 N LEU A 91 12.121 4.078 -0.657 1.00 0.00 N ATOM 49 CA LEU A 91 12.299 3.000 0.310 1.00 0.00 C ATOM 50 C LEU A 91 11.037 2.803 1.143 1.00 0.00 C ATOM 51 O LEU A 91 10.531 1.687 1.266 1.00 0.00 O ATOM 52 CB LEU A 91 13.487 3.301 1.225 1.00 0.00 C ATOM 53 CG LEU A 91 13.754 2.282 2.333 1.00 0.00 C ATOM 54 CD1 LEU A 91 14.966 1.429 1.994 1.00 0.00 C ATOM 55 CD2 LEU A 91 13.952 2.986 3.668 1.00 0.00 C ATOM 0 H LEU A 91 12.812 4.825 -0.587 1.00 0.00 H new ATOM 0 HA LEU A 91 12.496 2.080 -0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 91 14.383 3.382 0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 91 13.328 4.276 1.686 1.00 0.00 H new ATOM 0 HG LEU A 91 12.886 1.627 2.414 1.00 0.00 H new ATOM 0 HD11 LEU A 91 15.140 0.710 2.794 1.00 0.00 H new ATOM 0 HD12 LEU A 91 14.786 0.896 1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 91 15.842 2.069 1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 91 14.141 2.246 4.445 1.00 0.00 H new ATOM 0 HD22 LEU A 91 14.802 3.665 3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.055 3.553 3.917 1.00 0.00 H new ATOM 67 N ARG A 92 10.532 3.894 1.711 1.00 0.00 N ATOM 68 CA ARG A 92 9.328 3.841 2.531 1.00 0.00 C ATOM 69 C ARG A 92 8.127 3.390 1.706 1.00 0.00 C ATOM 70 O ARG A 92 7.315 2.586 2.161 1.00 0.00 O ATOM 71 CB ARG A 92 9.049 5.210 3.153 1.00 0.00 C ATOM 72 CG ARG A 92 8.232 5.142 4.433 1.00 0.00 C ATOM 73 CD ARG A 92 7.763 6.522 4.868 1.00 0.00 C ATOM 74 NE ARG A 92 8.607 7.079 5.922 1.00 0.00 N ATOM 75 CZ ARG A 92 8.592 6.650 7.180 1.00 0.00 C ATOM 76 NH1 ARG A 92 7.781 5.664 7.537 1.00 0.00 N ATOM 77 NH2 ARG A 92 9.390 7.208 8.082 1.00 0.00 N ATOM 0 H ARG A 92 10.938 4.825 1.618 1.00 0.00 H new ATOM 0 HA ARG A 92 9.492 3.115 3.327 1.00 0.00 H new ATOM 0 HB2 ARG A 92 9.997 5.704 3.363 1.00 0.00 H new ATOM 0 HB3 ARG A 92 8.521 5.829 2.427 1.00 0.00 H new ATOM 0 HG2 ARG A 92 7.369 4.494 4.281 1.00 0.00 H new ATOM 0 HG3 ARG A 92 8.831 4.694 5.225 1.00 0.00 H new ATOM 0 HD2 ARG A 92 7.765 7.193 4.009 1.00 0.00 H new ATOM 0 HD3 ARG A 92 6.734 6.460 5.222 1.00 0.00 H new ATOM 0 HE ARG A 92 9.243 7.839 5.679 1.00 0.00 H new ATOM 0 HH11 ARG A 92 7.167 5.233 6.846 1.00 0.00 H new ATOM 0 HH12 ARG A 92 7.771 5.336 8.503 1.00 0.00 H new ATOM 0 HH21 ARG A 92 10.015 7.967 7.810 1.00 0.00 H new ATOM 0 HH22 ARG A 92 9.378 6.878 9.047 1.00 0.00 H new ATOM 91 N ALA A 93 8.021 3.915 0.489 1.00 0.00 N ATOM 92 CA ALA A 93 6.920 3.566 -0.400 1.00 0.00 C ATOM 93 C ALA A 93 6.798 2.054 -0.555 1.00 0.00 C ATOM 94 O ALA A 93 5.700 1.501 -0.506 1.00 0.00 O ATOM 95 CB ALA A 93 7.110 4.225 -1.758 1.00 0.00 C ATOM 0 H ALA A 93 8.684 4.583 0.097 1.00 0.00 H new ATOM 0 HA ALA A 93 5.995 3.935 0.044 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.281 3.956 -2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.140 5.308 -1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 93 8.046 3.884 -2.200 1.00 0.00 H new ATOM 101 N LYS A 94 7.934 1.390 -0.745 1.00 0.00 N ATOM 102 CA LYS A 94 7.956 -0.059 -0.907 1.00 0.00 C ATOM 103 C LYS A 94 7.499 -0.756 0.369 1.00 0.00 C ATOM 104 O LYS A 94 6.683 -1.677 0.328 1.00 0.00 O ATOM 105 CB LYS A 94 9.362 -0.529 -1.283 1.00 0.00 C ATOM 106 CG LYS A 94 9.386 -1.515 -2.439 1.00 0.00 C ATOM 107 CD LYS A 94 8.700 -2.820 -2.072 1.00 0.00 C ATOM 108 CE LYS A 94 7.659 -3.213 -3.108 1.00 0.00 C ATOM 109 NZ LYS A 94 7.470 -4.689 -3.174 1.00 0.00 N ATOM 0 H LYS A 94 8.852 1.833 -0.791 1.00 0.00 H new ATOM 0 HA LYS A 94 7.266 -0.321 -1.709 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.968 0.339 -1.544 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.826 -0.992 -0.412 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.892 -1.074 -3.305 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.418 -1.714 -2.728 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.444 -3.611 -1.984 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.224 -2.720 -1.096 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.709 -2.736 -2.867 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.963 -2.842 -4.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.752 -4.915 -3.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.370 -5.143 -3.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.155 -5.040 -2.247 1.00 0.00 H new ATOM 123 N ALA A 95 8.029 -0.311 1.503 1.00 0.00 N ATOM 124 CA ALA A 95 7.672 -0.890 2.792 1.00 0.00 C ATOM 125 C ALA A 95 6.166 -0.835 3.022 1.00 0.00 C ATOM 126 O ALA A 95 5.536 -1.848 3.324 1.00 0.00 O ATOM 127 CB ALA A 95 8.406 -0.172 3.915 1.00 0.00 C ATOM 0 H ALA A 95 8.707 0.449 1.555 1.00 0.00 H new ATOM 0 HA ALA A 95 7.974 -1.937 2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.130 -0.615 4.872 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.482 -0.269 3.767 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.133 0.883 3.912 1.00 0.00 H new ATOM 133 N ALA A 96 5.594 0.356 2.878 1.00 0.00 N ATOM 134 CA ALA A 96 4.161 0.544 3.069 1.00 0.00 C ATOM 135 C ALA A 96 3.360 -0.390 2.166 1.00 0.00 C ATOM 136 O ALA A 96 2.330 -0.929 2.572 1.00 0.00 O ATOM 137 CB ALA A 96 3.778 1.992 2.804 1.00 0.00 C ATOM 0 H ALA A 96 6.101 1.205 2.630 1.00 0.00 H new ATOM 0 HA ALA A 96 3.923 0.300 4.104 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.705 2.117 2.950 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.317 2.643 3.493 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.037 2.255 1.779 1.00 0.00 H new ATOM 143 N LYS A 97 3.840 -0.577 0.942 1.00 0.00 N ATOM 144 CA LYS A 97 3.171 -1.446 -0.018 1.00 0.00 C ATOM 145 C LYS A 97 3.175 -2.894 0.462 1.00 0.00 C ATOM 146 O LYS A 97 2.196 -3.619 0.285 1.00 0.00 O ATOM 147 CB LYS A 97 3.851 -1.351 -1.384 1.00 0.00 C ATOM 148 CG LYS A 97 2.939 -1.708 -2.545 1.00 0.00 C ATOM 149 CD LYS A 97 3.688 -1.699 -3.867 1.00 0.00 C ATOM 150 CE LYS A 97 3.356 -2.925 -4.704 1.00 0.00 C ATOM 151 NZ LYS A 97 4.523 -3.380 -5.509 1.00 0.00 N ATOM 0 H LYS A 97 4.691 -0.138 0.591 1.00 0.00 H new ATOM 0 HA LYS A 97 2.137 -1.114 -0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 97 4.224 -0.336 -1.525 1.00 0.00 H new ATOM 0 HB3 LYS A 97 4.717 -2.013 -1.396 1.00 0.00 H new ATOM 0 HG2 LYS A 97 2.506 -2.694 -2.378 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.112 -1.000 -2.590 1.00 0.00 H new ATOM 0 HD2 LYS A 97 3.434 -0.797 -4.424 1.00 0.00 H new ATOM 0 HD3 LYS A 97 4.761 -1.666 -3.678 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.029 -3.733 -4.050 1.00 0.00 H new ATOM 0 HE3 LYS A 97 2.523 -2.696 -5.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.256 -4.217 -6.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 4.820 -2.618 -6.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.310 -3.623 -4.873 1.00 0.00 H new ATOM 165 N GLU A 98 4.280 -3.306 1.074 1.00 0.00 N ATOM 166 CA GLU A 98 4.409 -4.667 1.582 1.00 0.00 C ATOM 167 C GLU A 98 3.344 -4.959 2.636 1.00 0.00 C ATOM 168 O GLU A 98 2.660 -5.981 2.575 1.00 0.00 O ATOM 169 CB GLU A 98 5.803 -4.884 2.176 1.00 0.00 C ATOM 170 CG GLU A 98 6.060 -6.314 2.618 1.00 0.00 C ATOM 171 CD GLU A 98 6.784 -6.392 3.948 1.00 0.00 C ATOM 172 OE1 GLU A 98 6.401 -5.652 4.878 1.00 0.00 O ATOM 173 OE2 GLU A 98 7.735 -7.195 4.060 1.00 0.00 O ATOM 0 H GLU A 98 5.098 -2.718 1.230 1.00 0.00 H new ATOM 0 HA GLU A 98 4.267 -5.353 0.747 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.552 -4.601 1.436 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.932 -4.220 3.031 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.110 -6.843 2.694 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.650 -6.825 1.857 1.00 0.00 H new ATOM 180 N ARG A 99 3.211 -4.054 3.599 1.00 0.00 N ATOM 181 CA ARG A 99 2.231 -4.214 4.667 1.00 0.00 C ATOM 182 C ARG A 99 0.828 -4.398 4.095 1.00 0.00 C ATOM 183 O ARG A 99 0.069 -5.252 4.551 1.00 0.00 O ATOM 184 CB ARG A 99 2.258 -3.001 5.598 1.00 0.00 C ATOM 185 CG ARG A 99 1.872 -3.326 7.033 1.00 0.00 C ATOM 186 CD ARG A 99 2.944 -4.155 7.723 1.00 0.00 C ATOM 187 NE ARG A 99 3.302 -3.608 9.029 1.00 0.00 N ATOM 188 CZ ARG A 99 2.518 -3.686 10.099 1.00 0.00 C ATOM 189 NH1 ARG A 99 1.339 -4.286 10.018 1.00 0.00 N ATOM 190 NH2 ARG A 99 2.915 -3.164 11.252 1.00 0.00 N ATOM 0 H ARG A 99 3.769 -3.202 3.662 1.00 0.00 H new ATOM 0 HA ARG A 99 2.493 -5.106 5.235 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.259 -2.569 5.589 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.579 -2.241 5.211 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.713 -2.401 7.587 1.00 0.00 H new ATOM 0 HG3 ARG A 99 0.927 -3.870 7.043 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.589 -5.179 7.843 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.832 -4.197 7.092 1.00 0.00 H new ATOM 0 HE ARG A 99 4.203 -3.140 9.125 1.00 0.00 H new ATOM 0 HH11 ARG A 99 1.032 -4.689 9.133 1.00 0.00 H new ATOM 0 HH12 ARG A 99 0.739 -4.345 10.841 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.822 -2.703 11.317 1.00 0.00 H new ATOM 0 HH22 ARG A 99 2.313 -3.224 12.073 1.00 0.00 H new ATOM 204 N ALA A 100 0.493 -3.591 3.094 1.00 0.00 N ATOM 205 CA ALA A 100 -0.817 -3.666 2.459 1.00 0.00 C ATOM 206 C ALA A 100 -0.971 -4.962 1.669 1.00 0.00 C ATOM 207 O ALA A 100 -2.076 -5.485 1.527 1.00 0.00 O ATOM 208 CB ALA A 100 -1.033 -2.464 1.550 1.00 0.00 C ATOM 0 H ALA A 100 1.110 -2.878 2.705 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.574 -3.656 3.243 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -2.015 -2.533 1.082 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.975 -1.548 2.138 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.264 -2.449 0.778 1.00 0.00 H new ATOM 214 N GLU A 101 0.144 -5.473 1.156 1.00 0.00 N ATOM 215 CA GLU A 101 0.131 -6.707 0.379 1.00 0.00 C ATOM 216 C GLU A 101 -0.318 -7.886 1.239 1.00 0.00 C ATOM 217 O GLU A 101 -1.296 -8.563 0.920 1.00 0.00 O ATOM 218 CB GLU A 101 1.519 -6.985 -0.199 1.00 0.00 C ATOM 219 CG GLU A 101 1.594 -6.816 -1.707 1.00 0.00 C ATOM 220 CD GLU A 101 2.484 -7.851 -2.368 1.00 0.00 C ATOM 221 OE1 GLU A 101 2.463 -9.019 -1.926 1.00 0.00 O ATOM 222 OE2 GLU A 101 3.200 -7.493 -3.326 1.00 0.00 O ATOM 0 H GLU A 101 1.067 -5.052 1.264 1.00 0.00 H new ATOM 0 HA GLU A 101 -0.579 -6.584 -0.439 1.00 0.00 H new ATOM 0 HB2 GLU A 101 2.240 -6.315 0.270 1.00 0.00 H new ATOM 0 HB3 GLU A 101 1.814 -8.002 0.060 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.590 -6.885 -2.127 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.969 -5.819 -1.939 1.00 0.00 H new ATOM 229 N ARG A 102 0.403 -8.125 2.329 1.00 0.00 N ATOM 230 CA ARG A 102 0.080 -9.222 3.233 1.00 0.00 C ATOM 231 C ARG A 102 -1.249 -8.973 3.938 1.00 0.00 C ATOM 232 O ARG A 102 -1.977 -9.911 4.263 1.00 0.00 O ATOM 233 CB ARG A 102 1.193 -9.403 4.268 1.00 0.00 C ATOM 234 CG ARG A 102 1.406 -8.185 5.152 1.00 0.00 C ATOM 235 CD ARG A 102 2.627 -8.350 6.042 1.00 0.00 C ATOM 236 NE ARG A 102 2.263 -8.491 7.450 1.00 0.00 N ATOM 237 CZ ARG A 102 3.122 -8.844 8.399 1.00 0.00 C ATOM 238 NH1 ARG A 102 4.388 -9.090 8.094 1.00 0.00 N ATOM 239 NH2 ARG A 102 2.715 -8.951 9.658 1.00 0.00 N ATOM 0 H ARG A 102 1.215 -7.574 2.608 1.00 0.00 H new ATOM 0 HA ARG A 102 -0.008 -10.133 2.641 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.957 -10.261 4.897 1.00 0.00 H new ATOM 0 HB3 ARG A 102 2.124 -9.634 3.751 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.525 -7.298 4.529 1.00 0.00 H new ATOM 0 HG3 ARG A 102 0.523 -8.024 5.770 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.192 -9.226 5.724 1.00 0.00 H new ATOM 0 HD3 ARG A 102 3.283 -7.488 5.922 1.00 0.00 H new ATOM 0 HE ARG A 102 1.296 -8.308 7.719 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.705 -9.008 7.128 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.045 -9.361 8.825 1.00 0.00 H new ATOM 0 HH21 ARG A 102 1.742 -8.762 9.897 1.00 0.00 H new ATOM 0 HH22 ARG A 102 3.376 -9.222 10.386 1.00 0.00 H new ATOM 253 N ARG A 103 -1.559 -7.702 4.173 1.00 0.00 N ATOM 254 CA ARG A 103 -2.800 -7.328 4.841 1.00 0.00 C ATOM 255 C ARG A 103 -4.012 -7.786 4.034 1.00 0.00 C ATOM 256 O ARG A 103 -5.033 -8.182 4.597 1.00 0.00 O ATOM 257 CB ARG A 103 -2.856 -5.814 5.050 1.00 0.00 C ATOM 258 CG ARG A 103 -2.302 -5.364 6.393 1.00 0.00 C ATOM 259 CD ARG A 103 -3.353 -5.454 7.488 1.00 0.00 C ATOM 260 NE ARG A 103 -3.443 -6.799 8.050 1.00 0.00 N ATOM 261 CZ ARG A 103 -2.596 -7.274 8.957 1.00 0.00 C ATOM 262 NH1 ARG A 103 -1.601 -6.518 9.401 1.00 0.00 N ATOM 263 NH2 ARG A 103 -2.743 -8.508 9.421 1.00 0.00 N ATOM 0 H ARG A 103 -0.967 -6.914 3.911 1.00 0.00 H new ATOM 0 HA ARG A 103 -2.823 -7.823 5.812 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -2.296 -5.325 4.253 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -3.890 -5.482 4.963 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -1.444 -5.981 6.659 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -1.944 -4.338 6.314 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -3.113 -4.745 8.280 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -4.323 -5.164 7.084 1.00 0.00 H new ATOM 0 HE ARG A 103 -4.197 -7.407 7.729 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -1.484 -5.569 9.046 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -0.953 -6.886 10.097 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -3.507 -9.093 9.082 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -2.092 -8.872 10.117 1.00 0.00 H new ATOM 277 N LEU A 104 -3.891 -7.728 2.712 1.00 0.00 N ATOM 278 CA LEU A 104 -4.976 -8.136 1.827 1.00 0.00 C ATOM 279 C LEU A 104 -5.107 -9.655 1.790 1.00 0.00 C ATOM 280 O LEU A 104 -6.204 -10.189 1.631 1.00 0.00 O ATOM 281 CB LEU A 104 -4.737 -7.599 0.414 1.00 0.00 C ATOM 282 CG LEU A 104 -4.894 -6.089 0.236 1.00 0.00 C ATOM 283 CD1 LEU A 104 -4.256 -5.637 -1.069 1.00 0.00 C ATOM 284 CD2 LEU A 104 -6.364 -5.697 0.277 1.00 0.00 C ATOM 0 H LEU A 104 -3.053 -7.403 2.230 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.905 -7.719 2.216 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.729 -7.878 0.106 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.428 -8.099 -0.265 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.383 -5.590 1.059 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.377 -4.559 -1.179 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.194 -5.884 -1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.739 -6.144 -1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.457 -4.619 0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.899 -6.205 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.791 -5.986 1.237 1.00 0.00 H new ATOM 296 N GLN A 105 -3.981 -10.345 1.940 1.00 0.00 N ATOM 297 CA GLN A 105 -3.971 -11.803 1.925 1.00 0.00 C ATOM 298 C GLN A 105 -4.904 -12.364 2.993 1.00 0.00 C ATOM 299 O GLN A 105 -5.481 -13.439 2.825 1.00 0.00 O ATOM 300 CB GLN A 105 -2.551 -12.326 2.146 1.00 0.00 C ATOM 301 CG GLN A 105 -1.912 -12.901 0.891 1.00 0.00 C ATOM 302 CD GLN A 105 -1.290 -14.263 1.125 1.00 0.00 C ATOM 303 OE1 GLN A 105 -0.636 -14.494 2.143 1.00 0.00 O ATOM 304 NE2 GLN A 105 -1.489 -15.175 0.181 1.00 0.00 N ATOM 0 H GLN A 105 -3.064 -9.918 2.073 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.325 -12.134 0.949 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -1.928 -11.514 2.522 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -2.572 -13.095 2.918 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.666 -12.980 0.107 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -1.147 -12.214 0.530 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -2.037 -14.941 -0.647 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -1.094 -16.110 0.283 1.00 0.00 H new ATOM 313 N SER A 106 -5.047 -11.631 4.093 1.00 0.00 N ATOM 314 CA SER A 106 -5.907 -12.057 5.190 1.00 0.00 C ATOM 315 C SER A 106 -7.323 -12.333 4.695 1.00 0.00 C ATOM 316 O SER A 106 -7.745 -11.805 3.667 1.00 0.00 O ATOM 317 CB SER A 106 -5.936 -10.992 6.288 1.00 0.00 C ATOM 318 OG SER A 106 -7.078 -11.140 7.112 1.00 0.00 O ATOM 0 H SER A 106 -4.578 -10.739 4.248 1.00 0.00 H new ATOM 0 HA SER A 106 -5.498 -12.980 5.601 1.00 0.00 H new ATOM 0 HB2 SER A 106 -5.034 -11.066 6.895 1.00 0.00 H new ATOM 0 HB3 SER A 106 -5.936 -10.000 5.837 1.00 0.00 H new ATOM 0 HG SER A 106 -7.072 -10.449 7.807 1.00 0.00 H new ATOM 324 N GLN A 107 -8.051 -13.163 5.435 1.00 0.00 N ATOM 325 CA GLN A 107 -9.420 -13.509 5.071 1.00 0.00 C ATOM 326 C GLN A 107 -10.417 -12.581 5.757 1.00 0.00 C ATOM 327 O GLN A 107 -11.501 -12.325 5.234 1.00 0.00 O ATOM 328 CB GLN A 107 -9.717 -14.962 5.446 1.00 0.00 C ATOM 329 CG GLN A 107 -10.408 -15.746 4.342 1.00 0.00 C ATOM 330 CD GLN A 107 -10.014 -17.210 4.331 1.00 0.00 C ATOM 331 OE1 GLN A 107 -9.322 -17.672 3.423 1.00 0.00 O ATOM 332 NE2 GLN A 107 -10.453 -17.949 5.343 1.00 0.00 N ATOM 0 H GLN A 107 -7.716 -13.608 6.290 1.00 0.00 H new ATOM 0 HA GLN A 107 -9.524 -13.390 3.992 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.782 -15.460 5.704 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -10.343 -14.978 6.338 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -11.488 -15.665 4.466 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -10.163 -15.301 3.378 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -11.024 -17.525 6.074 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.219 -18.941 5.389 1.00 0.00 H new ATOM 341 N GLN A 108 -10.042 -12.081 6.931 1.00 0.00 N ATOM 342 CA GLN A 108 -10.905 -11.181 7.688 1.00 0.00 C ATOM 343 C GLN A 108 -10.535 -9.725 7.428 1.00 0.00 C ATOM 344 O GLN A 108 -10.370 -8.940 8.362 1.00 0.00 O ATOM 345 CB GLN A 108 -10.807 -11.486 9.184 1.00 0.00 C ATOM 346 CG GLN A 108 -10.900 -12.968 9.509 1.00 0.00 C ATOM 347 CD GLN A 108 -11.736 -13.243 10.744 1.00 0.00 C ATOM 348 OE1 GLN A 108 -12.813 -13.833 10.660 1.00 0.00 O ATOM 349 NE2 GLN A 108 -11.243 -12.814 11.901 1.00 0.00 N ATOM 0 H GLN A 108 -9.148 -12.284 7.378 1.00 0.00 H new ATOM 0 HA GLN A 108 -11.932 -11.339 7.358 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -9.862 -11.097 9.565 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -11.603 -10.957 9.707 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -11.331 -13.496 8.658 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -9.897 -13.367 9.658 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -10.346 -12.329 11.925 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -11.762 -12.970 12.765 1.00 0.00 H new ATOM 358 N ASP A 109 -10.404 -9.371 6.154 1.00 0.00 N ATOM 359 CA ASP A 109 -10.054 -8.008 5.772 1.00 0.00 C ATOM 360 C ASP A 109 -11.305 -7.191 5.464 1.00 0.00 C ATOM 361 O ASP A 109 -11.348 -6.449 4.483 1.00 0.00 O ATOM 362 CB ASP A 109 -9.125 -8.019 4.557 1.00 0.00 C ATOM 363 CG ASP A 109 -9.675 -8.853 3.415 1.00 0.00 C ATOM 364 OD1 ASP A 109 -10.912 -8.884 3.246 1.00 0.00 O ATOM 365 OD2 ASP A 109 -8.869 -9.474 2.693 1.00 0.00 O ATOM 0 H ASP A 109 -10.535 -10.009 5.369 1.00 0.00 H new ATOM 0 HA ASP A 109 -9.537 -7.543 6.611 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.968 -6.996 4.214 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -8.151 -8.409 4.852 1.00 0.00 H new ATOM 370 N ASP A 110 -12.320 -7.334 6.309 1.00 0.00 N ATOM 371 CA ASP A 110 -13.573 -6.609 6.128 1.00 0.00 C ATOM 372 C ASP A 110 -13.323 -5.107 6.030 1.00 0.00 C ATOM 373 O ASP A 110 -13.824 -4.442 5.123 1.00 0.00 O ATOM 374 CB ASP A 110 -14.530 -6.906 7.283 1.00 0.00 C ATOM 375 CG ASP A 110 -15.943 -6.432 7.000 1.00 0.00 C ATOM 376 OD1 ASP A 110 -16.631 -7.071 6.177 1.00 0.00 O ATOM 377 OD2 ASP A 110 -16.360 -5.421 7.604 1.00 0.00 O ATOM 0 H ASP A 110 -12.300 -7.945 7.126 1.00 0.00 H new ATOM 0 HA ASP A 110 -14.027 -6.944 5.196 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.541 -7.979 7.475 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -14.163 -6.424 8.189 1.00 0.00 H new ATOM 382 N ILE A 111 -12.547 -4.580 6.971 1.00 0.00 N ATOM 383 CA ILE A 111 -12.232 -3.157 6.992 1.00 0.00 C ATOM 384 C ILE A 111 -10.847 -2.893 6.411 1.00 0.00 C ATOM 385 O ILE A 111 -10.600 -1.842 5.820 1.00 0.00 O ATOM 386 CB ILE A 111 -12.294 -2.587 8.421 1.00 0.00 C ATOM 387 CG1 ILE A 111 -13.617 -2.968 9.089 1.00 0.00 C ATOM 388 CG2 ILE A 111 -12.122 -1.076 8.396 1.00 0.00 C ATOM 389 CD1 ILE A 111 -13.478 -4.056 10.131 1.00 0.00 C ATOM 0 H ILE A 111 -12.125 -5.117 7.729 1.00 0.00 H new ATOM 0 HA ILE A 111 -12.983 -2.658 6.379 1.00 0.00 H new ATOM 0 HB ILE A 111 -11.479 -3.016 9.003 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -14.047 -2.082 9.556 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -14.319 -3.297 8.323 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -12.168 -0.688 9.413 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -11.156 -0.827 7.956 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -12.918 -0.629 7.801 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -14.455 -4.274 10.562 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -13.078 -4.957 9.666 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -12.801 -3.722 10.917 1.00 0.00 H new ATOM 401 N ASP A 112 -9.946 -3.855 6.582 1.00 0.00 N ATOM 402 CA ASP A 112 -8.586 -3.729 6.072 1.00 0.00 C ATOM 403 C ASP A 112 -8.590 -3.499 4.564 1.00 0.00 C ATOM 404 O ASP A 112 -7.671 -2.890 4.016 1.00 0.00 O ATOM 405 CB ASP A 112 -7.774 -4.981 6.408 1.00 0.00 C ATOM 406 CG ASP A 112 -6.956 -4.818 7.674 1.00 0.00 C ATOM 407 OD1 ASP A 112 -6.150 -3.866 7.741 1.00 0.00 O ATOM 408 OD2 ASP A 112 -7.121 -5.643 8.597 1.00 0.00 O ATOM 0 H ASP A 112 -10.134 -4.731 7.070 1.00 0.00 H new ATOM 0 HA ASP A 112 -8.123 -2.866 6.551 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -8.449 -5.829 6.522 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -7.109 -5.213 5.576 1.00 0.00 H new ATOM 413 N PHE A 113 -9.630 -3.990 3.899 1.00 0.00 N ATOM 414 CA PHE A 113 -9.753 -3.840 2.454 1.00 0.00 C ATOM 415 C PHE A 113 -9.669 -2.371 2.050 1.00 0.00 C ATOM 416 O PHE A 113 -8.827 -1.985 1.239 1.00 0.00 O ATOM 417 CB PHE A 113 -11.074 -4.440 1.967 1.00 0.00 C ATOM 418 CG PHE A 113 -10.900 -5.513 0.931 1.00 0.00 C ATOM 419 CD1 PHE A 113 -10.072 -6.597 1.170 1.00 0.00 C ATOM 420 CD2 PHE A 113 -11.565 -5.437 -0.281 1.00 0.00 C ATOM 421 CE1 PHE A 113 -9.910 -7.587 0.220 1.00 0.00 C ATOM 422 CE2 PHE A 113 -11.408 -6.424 -1.235 1.00 0.00 C ATOM 423 CZ PHE A 113 -10.578 -7.500 -0.986 1.00 0.00 C ATOM 0 H PHE A 113 -10.400 -4.495 4.338 1.00 0.00 H new ATOM 0 HA PHE A 113 -8.926 -4.375 1.987 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -11.612 -4.854 2.820 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -11.694 -3.645 1.554 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -9.546 -6.669 2.111 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -12.213 -4.597 -0.483 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -9.262 -8.428 0.420 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -11.934 -6.354 -2.176 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.452 -8.271 -1.732 1.00 0.00 H new ATOM 433 N LYS A 114 -10.549 -1.556 2.621 1.00 0.00 N ATOM 434 CA LYS A 114 -10.576 -0.129 2.323 1.00 0.00 C ATOM 435 C LYS A 114 -9.249 0.529 2.689 1.00 0.00 C ATOM 436 O LYS A 114 -8.692 1.300 1.907 1.00 0.00 O ATOM 437 CB LYS A 114 -11.720 0.550 3.081 1.00 0.00 C ATOM 438 CG LYS A 114 -12.268 1.781 2.380 1.00 0.00 C ATOM 439 CD LYS A 114 -13.571 2.246 3.009 1.00 0.00 C ATOM 440 CE LYS A 114 -14.389 3.085 2.039 1.00 0.00 C ATOM 441 NZ LYS A 114 -14.020 4.526 2.104 1.00 0.00 N ATOM 0 H LYS A 114 -11.254 -1.859 3.293 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.737 -0.010 1.251 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -12.528 -0.168 3.221 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.369 0.833 4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -11.533 2.585 2.426 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -12.431 1.558 1.325 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -14.154 1.380 3.324 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.356 2.829 3.905 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -14.238 2.717 1.024 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -15.449 2.971 2.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -14.600 5.064 1.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.188 4.884 3.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.014 4.638 1.863 1.00 0.00 H new ATOM 455 N ARG A 115 -8.749 0.218 3.880 1.00 0.00 N ATOM 456 CA ARG A 115 -7.487 0.779 4.349 1.00 0.00 C ATOM 457 C ARG A 115 -6.364 0.496 3.354 1.00 0.00 C ATOM 458 O ARG A 115 -5.521 1.354 3.096 1.00 0.00 O ATOM 459 CB ARG A 115 -7.126 0.203 5.719 1.00 0.00 C ATOM 460 CG ARG A 115 -7.100 1.243 6.828 1.00 0.00 C ATOM 461 CD ARG A 115 -5.961 2.232 6.637 1.00 0.00 C ATOM 462 NE ARG A 115 -4.743 1.802 7.319 1.00 0.00 N ATOM 463 CZ ARG A 115 -3.739 2.620 7.615 1.00 0.00 C ATOM 464 NH1 ARG A 115 -3.808 3.904 7.293 1.00 0.00 N ATOM 465 NH2 ARG A 115 -2.663 2.154 8.237 1.00 0.00 N ATOM 0 H ARG A 115 -9.198 -0.419 4.538 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.608 1.859 4.437 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -7.845 -0.574 5.978 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -6.148 -0.275 5.657 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -8.049 1.779 6.848 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -6.994 0.746 7.792 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -5.758 2.350 5.573 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.262 3.209 7.014 1.00 0.00 H new ATOM 0 HE ARG A 115 -4.659 0.820 7.582 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -4.634 4.267 6.817 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -3.035 4.529 7.522 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -2.606 1.167 8.488 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -1.893 2.783 8.464 1.00 0.00 H new ATOM 479 N ALA A 116 -6.361 -0.712 2.802 1.00 0.00 N ATOM 480 CA ALA A 116 -5.343 -1.108 1.836 1.00 0.00 C ATOM 481 C ALA A 116 -5.455 -0.289 0.554 1.00 0.00 C ATOM 482 O ALA A 116 -4.473 -0.108 -0.163 1.00 0.00 O ATOM 483 CB ALA A 116 -5.457 -2.593 1.528 1.00 0.00 C ATOM 0 H ALA A 116 -7.052 -1.434 3.007 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.365 -0.914 2.276 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -4.691 -2.875 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -5.319 -3.166 2.445 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.442 -2.804 1.113 1.00 0.00 H new ATOM 489 N GLU A 117 -6.659 0.202 0.275 1.00 0.00 N ATOM 490 CA GLU A 117 -6.898 1.000 -0.921 1.00 0.00 C ATOM 491 C GLU A 117 -6.307 2.398 -0.771 1.00 0.00 C ATOM 492 O GLU A 117 -5.596 2.883 -1.652 1.00 0.00 O ATOM 493 CB GLU A 117 -8.399 1.097 -1.205 1.00 0.00 C ATOM 494 CG GLU A 117 -8.724 1.715 -2.554 1.00 0.00 C ATOM 495 CD GLU A 117 -9.949 1.095 -3.199 1.00 0.00 C ATOM 496 OE1 GLU A 117 -10.872 0.695 -2.459 1.00 0.00 O ATOM 497 OE2 GLU A 117 -9.984 1.011 -4.445 1.00 0.00 O ATOM 0 H GLU A 117 -7.482 0.061 0.860 1.00 0.00 H new ATOM 0 HA GLU A 117 -6.407 0.506 -1.759 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.834 0.099 -1.158 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -8.871 1.688 -0.421 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.886 2.786 -2.430 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.869 1.597 -3.219 1.00 0.00 H new ATOM 504 N LEU A 118 -6.605 3.042 0.353 1.00 0.00 N ATOM 505 CA LEU A 118 -6.104 4.385 0.621 1.00 0.00 C ATOM 506 C LEU A 118 -4.578 4.403 0.642 1.00 0.00 C ATOM 507 O LEU A 118 -3.953 5.362 0.191 1.00 0.00 O ATOM 508 CB LEU A 118 -6.650 4.898 1.953 1.00 0.00 C ATOM 509 CG LEU A 118 -8.166 5.078 2.033 1.00 0.00 C ATOM 510 CD1 LEU A 118 -8.648 4.923 3.468 1.00 0.00 C ATOM 511 CD2 LEU A 118 -8.572 6.435 1.476 1.00 0.00 C ATOM 0 H LEU A 118 -7.191 2.655 1.093 1.00 0.00 H new ATOM 0 HA LEU A 118 -6.446 5.040 -0.180 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -6.345 4.207 2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.179 5.856 2.171 1.00 0.00 H new ATOM 0 HG LEU A 118 -8.637 4.303 1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -9.729 5.054 3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -8.391 3.929 3.833 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -8.170 5.675 4.096 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.654 6.546 1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -8.091 7.224 2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -8.262 6.508 0.434 1.00 0.00 H new ATOM 523 N ALA A 119 -3.987 3.336 1.168 1.00 0.00 N ATOM 524 CA ALA A 119 -2.535 3.227 1.244 1.00 0.00 C ATOM 525 C ALA A 119 -1.923 3.069 -0.142 1.00 0.00 C ATOM 526 O ALA A 119 -0.927 3.715 -0.470 1.00 0.00 O ATOM 527 CB ALA A 119 -2.139 2.059 2.135 1.00 0.00 C ATOM 0 H ALA A 119 -4.491 2.535 1.548 1.00 0.00 H new ATOM 0 HA ALA A 119 -2.149 4.149 1.679 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.052 1.990 2.182 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -2.537 2.215 3.138 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -2.544 1.134 1.724 1.00 0.00 H new ATOM 533 N LEU A 120 -2.523 2.205 -0.953 1.00 0.00 N ATOM 534 CA LEU A 120 -2.036 1.960 -2.306 1.00 0.00 C ATOM 535 C LEU A 120 -2.054 3.243 -3.132 1.00 0.00 C ATOM 536 O LEU A 120 -1.212 3.442 -4.008 1.00 0.00 O ATOM 537 CB LEU A 120 -2.886 0.888 -2.989 1.00 0.00 C ATOM 538 CG LEU A 120 -2.175 -0.425 -3.318 1.00 0.00 C ATOM 539 CD1 LEU A 120 -1.016 -0.180 -4.272 1.00 0.00 C ATOM 540 CD2 LEU A 120 -1.687 -1.100 -2.044 1.00 0.00 C ATOM 0 H LEU A 120 -3.348 1.662 -0.697 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.006 1.609 -2.237 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.738 0.665 -2.347 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.284 1.304 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.887 -1.089 -3.808 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.522 -1.126 -4.495 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.392 0.259 -5.196 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.302 0.502 -3.810 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.183 -2.033 -2.297 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -0.991 -0.440 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -2.537 -1.311 -1.395 1.00 0.00 H new ATOM 552 N LYS A 121 -3.018 4.111 -2.845 1.00 0.00 N ATOM 553 CA LYS A 121 -3.145 5.377 -3.557 1.00 0.00 C ATOM 554 C LYS A 121 -2.024 6.335 -3.167 1.00 0.00 C ATOM 555 O LYS A 121 -1.433 6.995 -4.023 1.00 0.00 O ATOM 556 CB LYS A 121 -4.503 6.018 -3.262 1.00 0.00 C ATOM 557 CG LYS A 121 -5.574 5.669 -4.282 1.00 0.00 C ATOM 558 CD LYS A 121 -6.356 6.899 -4.712 1.00 0.00 C ATOM 559 CE LYS A 121 -5.499 7.841 -5.543 1.00 0.00 C ATOM 560 NZ LYS A 121 -5.614 7.555 -7.000 1.00 0.00 N ATOM 0 H LYS A 121 -3.723 3.961 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 121 -3.071 5.173 -4.625 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.837 5.702 -2.274 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -4.385 7.101 -3.228 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.111 5.208 -5.154 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -6.256 4.933 -3.857 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -7.228 6.593 -5.290 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -6.725 7.423 -3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -5.799 8.871 -5.350 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.457 7.750 -5.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -5.015 8.218 -7.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -5.303 6.580 -7.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.604 7.666 -7.299 1.00 0.00 H new ATOM 574 N ARG A 122 -1.736 6.406 -1.872 1.00 0.00 N ATOM 575 CA ARG A 122 -0.685 7.284 -1.370 1.00 0.00 C ATOM 576 C ARG A 122 0.679 6.860 -1.906 1.00 0.00 C ATOM 577 O ARG A 122 1.461 7.691 -2.367 1.00 0.00 O ATOM 578 CB ARG A 122 -0.670 7.273 0.160 1.00 0.00 C ATOM 579 CG ARG A 122 -1.302 8.506 0.783 1.00 0.00 C ATOM 580 CD ARG A 122 -2.144 8.146 1.997 1.00 0.00 C ATOM 581 NE ARG A 122 -1.387 8.257 3.241 1.00 0.00 N ATOM 582 CZ ARG A 122 -1.868 7.905 4.428 1.00 0.00 C ATOM 583 NH1 ARG A 122 -3.098 7.422 4.532 1.00 0.00 N ATOM 584 NH2 ARG A 122 -1.117 8.035 5.515 1.00 0.00 N ATOM 0 H ARG A 122 -2.215 5.867 -1.151 1.00 0.00 H new ATOM 0 HA ARG A 122 -0.894 8.296 -1.717 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -1.197 6.387 0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 122 0.361 7.190 0.504 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -0.521 9.208 1.075 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -1.924 9.011 0.044 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.014 8.802 2.042 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -2.518 7.128 1.890 1.00 0.00 H new ATOM 0 HE ARG A 122 -0.437 8.625 3.196 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -3.678 7.320 3.699 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -3.465 7.153 5.445 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -0.170 8.406 5.439 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.487 7.764 6.426 1.00 0.00 H new ATOM 598 N ALA A 123 0.958 5.563 -1.841 1.00 0.00 N ATOM 599 CA ALA A 123 2.227 5.029 -2.320 1.00 0.00 C ATOM 600 C ALA A 123 2.410 5.303 -3.809 1.00 0.00 C ATOM 601 O ALA A 123 3.517 5.590 -4.265 1.00 0.00 O ATOM 602 CB ALA A 123 2.309 3.535 -2.042 1.00 0.00 C ATOM 0 H ALA A 123 0.322 4.862 -1.461 1.00 0.00 H new ATOM 0 HA ALA A 123 3.031 5.532 -1.783 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.262 3.149 -2.405 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.231 3.360 -0.969 1.00 0.00 H new ATOM 0 HB3 ALA A 123 1.493 3.025 -2.553 1.00 0.00 H new ATOM 608 N MET A 124 1.319 5.214 -4.561 1.00 0.00 N ATOM 609 CA MET A 124 1.360 5.453 -5.999 1.00 0.00 C ATOM 610 C MET A 124 1.681 6.914 -6.297 1.00 0.00 C ATOM 611 O MET A 124 2.403 7.220 -7.246 1.00 0.00 O ATOM 612 CB MET A 124 0.025 5.071 -6.641 1.00 0.00 C ATOM 613 CG MET A 124 0.093 4.939 -8.153 1.00 0.00 C ATOM 614 SD MET A 124 -1.154 5.934 -8.994 1.00 0.00 S ATOM 615 CE MET A 124 -2.141 4.656 -9.768 1.00 0.00 C ATOM 0 H MET A 124 0.395 4.978 -4.199 1.00 0.00 H new ATOM 0 HA MET A 124 2.149 4.831 -6.423 1.00 0.00 H new ATOM 0 HB2 MET A 124 -0.315 4.126 -6.217 1.00 0.00 H new ATOM 0 HB3 MET A 124 -0.721 5.823 -6.383 1.00 0.00 H new ATOM 0 HG2 MET A 124 1.083 5.239 -8.496 1.00 0.00 H new ATOM 0 HG3 MET A 124 -0.036 3.892 -8.429 1.00 0.00 H new ATOM 0 HE1 MET A 124 -2.956 5.115 -10.328 1.00 0.00 H new ATOM 0 HE2 MET A 124 -1.517 4.075 -10.447 1.00 0.00 H new ATOM 0 HE3 MET A 124 -2.552 3.999 -9.001 1.00 0.00 H new ATOM 625 N ASN A 125 1.139 7.813 -5.482 1.00 0.00 N ATOM 626 CA ASN A 125 1.367 9.243 -5.660 1.00 0.00 C ATOM 627 C ASN A 125 2.855 9.570 -5.577 1.00 0.00 C ATOM 628 O ASN A 125 3.389 10.298 -6.414 1.00 0.00 O ATOM 629 CB ASN A 125 0.599 10.038 -4.603 1.00 0.00 C ATOM 630 CG ASN A 125 0.161 11.400 -5.110 1.00 0.00 C ATOM 631 OD1 ASN A 125 -0.419 11.516 -6.190 1.00 0.00 O ATOM 632 ND2 ASN A 125 0.439 12.438 -4.330 1.00 0.00 N ATOM 0 H ASN A 125 0.539 7.577 -4.692 1.00 0.00 H new ATOM 0 HA ASN A 125 1.006 9.524 -6.649 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -0.278 9.470 -4.291 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.227 10.166 -3.721 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.170 13.379 -4.618 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.921 12.295 -3.443 1.00 0.00 H new ATOM 639 N ARG A 126 3.519 9.028 -4.561 1.00 0.00 N ATOM 640 CA ARG A 126 4.945 9.263 -4.368 1.00 0.00 C ATOM 641 C ARG A 126 5.748 8.734 -5.552 1.00 0.00 C ATOM 642 O ARG A 126 6.538 9.462 -6.156 1.00 0.00 O ATOM 643 CB ARG A 126 5.422 8.598 -3.076 1.00 0.00 C ATOM 644 CG ARG A 126 4.650 9.037 -1.843 1.00 0.00 C ATOM 645 CD ARG A 126 5.444 10.034 -1.013 1.00 0.00 C ATOM 646 NE ARG A 126 4.807 10.307 0.272 1.00 0.00 N ATOM 647 CZ ARG A 126 3.776 11.132 0.421 1.00 0.00 C ATOM 648 NH1 ARG A 126 3.268 11.761 -0.629 1.00 0.00 N ATOM 649 NH2 ARG A 126 3.251 11.328 1.623 1.00 0.00 N ATOM 0 H ARG A 126 3.092 8.423 -3.859 1.00 0.00 H new ATOM 0 HA ARG A 126 5.104 10.339 -4.295 1.00 0.00 H new ATOM 0 HB2 ARG A 126 5.337 7.516 -3.181 1.00 0.00 H new ATOM 0 HB3 ARG A 126 6.479 8.822 -2.931 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.704 9.486 -2.146 1.00 0.00 H new ATOM 0 HG3 ARG A 126 4.409 8.166 -1.234 1.00 0.00 H new ATOM 0 HD2 ARG A 126 6.449 9.646 -0.844 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.551 10.965 -1.570 1.00 0.00 H new ATOM 0 HE ARG A 126 5.173 9.839 1.101 1.00 0.00 H new ATOM 0 HH11 ARG A 126 3.668 11.613 -1.555 1.00 0.00 H new ATOM 0 HH12 ARG A 126 2.477 12.394 -0.511 1.00 0.00 H new ATOM 0 HH21 ARG A 126 3.639 10.845 2.434 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.460 11.961 1.737 1.00 0.00 H new ATOM 663 N LEU A 127 5.543 7.463 -5.880 1.00 0.00 N ATOM 664 CA LEU A 127 6.249 6.835 -6.991 1.00 0.00 C ATOM 665 C LEU A 127 6.047 7.626 -8.280 1.00 0.00 C ATOM 666 O LEU A 127 6.949 7.716 -9.112 1.00 0.00 O ATOM 667 CB LEU A 127 5.765 5.397 -7.181 1.00 0.00 C ATOM 668 CG LEU A 127 6.614 4.310 -6.521 1.00 0.00 C ATOM 669 CD1 LEU A 127 5.850 2.997 -6.462 1.00 0.00 C ATOM 670 CD2 LEU A 127 7.928 4.132 -7.268 1.00 0.00 C ATOM 0 H LEU A 127 4.893 6.847 -5.392 1.00 0.00 H new ATOM 0 HA LEU A 127 7.313 6.825 -6.755 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.749 5.322 -6.793 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.713 5.191 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 127 6.838 4.621 -5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 127 6.471 2.236 -5.989 1.00 0.00 H new ATOM 0 HD12 LEU A 127 4.937 3.133 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 127 5.594 2.680 -7.473 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.519 3.354 -6.784 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.724 3.844 -8.299 1.00 0.00 H new ATOM 0 HD23 LEU A 127 8.483 5.070 -7.256 1.00 0.00 H new ATOM 682 N SER A 128 4.857 8.199 -8.436 1.00 0.00 N ATOM 683 CA SER A 128 4.536 8.981 -9.625 1.00 0.00 C ATOM 684 C SER A 128 5.433 10.211 -9.724 1.00 0.00 C ATOM 685 O SER A 128 5.967 10.520 -10.790 1.00 0.00 O ATOM 686 CB SER A 128 3.067 9.408 -9.598 1.00 0.00 C ATOM 687 OG SER A 128 2.759 10.242 -10.701 1.00 0.00 O ATOM 0 H SER A 128 4.100 8.136 -7.755 1.00 0.00 H new ATOM 0 HA SER A 128 4.709 8.355 -10.500 1.00 0.00 H new ATOM 0 HB2 SER A 128 2.428 8.525 -9.616 1.00 0.00 H new ATOM 0 HB3 SER A 128 2.855 9.936 -8.668 1.00 0.00 H new ATOM 0 HG SER A 128 1.814 10.500 -10.662 1.00 0.00 H new ATOM 693 N VAL A 129 5.595 10.910 -8.605 1.00 0.00 N ATOM 694 CA VAL A 129 6.428 12.106 -8.564 1.00 0.00 C ATOM 695 C VAL A 129 7.905 11.751 -8.689 1.00 0.00 C ATOM 696 O VAL A 129 8.683 12.491 -9.291 1.00 0.00 O ATOM 697 CB VAL A 129 6.210 12.897 -7.260 1.00 0.00 C ATOM 698 CG1 VAL A 129 7.105 14.127 -7.227 1.00 0.00 C ATOM 699 CG2 VAL A 129 4.747 13.287 -7.112 1.00 0.00 C ATOM 0 H VAL A 129 5.160 10.668 -7.715 1.00 0.00 H new ATOM 0 HA VAL A 129 6.133 12.726 -9.410 1.00 0.00 H new ATOM 0 HB VAL A 129 6.478 12.259 -6.418 1.00 0.00 H new ATOM 0 HG11 VAL A 129 6.938 14.674 -6.299 1.00 0.00 H new ATOM 0 HG12 VAL A 129 8.149 13.819 -7.284 1.00 0.00 H new ATOM 0 HG13 VAL A 129 6.870 14.771 -8.075 1.00 0.00 H new ATOM 0 HG21 VAL A 129 4.611 13.845 -6.186 1.00 0.00 H new ATOM 0 HG22 VAL A 129 4.449 13.908 -7.957 1.00 0.00 H new ATOM 0 HG23 VAL A 129 4.131 12.388 -7.088 1.00 0.00 H new ATOM 709 N ALA A 130 8.286 10.613 -8.118 1.00 0.00 N ATOM 710 CA ALA A 130 9.670 10.158 -8.168 1.00 0.00 C ATOM 711 C ALA A 130 10.150 10.019 -9.609 1.00 0.00 C ATOM 712 O ALA A 130 11.164 10.601 -9.993 1.00 0.00 O ATOM 713 CB ALA A 130 9.818 8.836 -7.430 1.00 0.00 C ATOM 0 H ALA A 130 7.655 9.989 -7.615 1.00 0.00 H new ATOM 0 HA ALA A 130 10.291 10.907 -7.676 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.857 8.508 -7.475 1.00 0.00 H new ATOM 0 HB2 ALA A 130 9.524 8.966 -6.389 1.00 0.00 H new ATOM 0 HB3 ALA A 130 9.180 8.085 -7.896 1.00 0.00 H new ATOM 719 N GLU A 131 9.416 9.244 -10.401 1.00 0.00 N ATOM 720 CA GLU A 131 9.769 9.028 -11.799 1.00 0.00 C ATOM 721 C GLU A 131 9.989 10.357 -12.515 1.00 0.00 C ATOM 722 O GLU A 131 11.086 10.641 -12.995 1.00 0.00 O ATOM 723 CB GLU A 131 8.673 8.229 -12.507 1.00 0.00 C ATOM 724 CG GLU A 131 9.208 7.127 -13.406 1.00 0.00 C ATOM 725 CD GLU A 131 10.370 7.587 -14.265 1.00 0.00 C ATOM 726 OE1 GLU A 131 10.259 8.662 -14.888 1.00 0.00 O ATOM 727 OE2 GLU A 131 11.392 6.870 -14.312 1.00 0.00 O ATOM 0 H GLU A 131 8.573 8.755 -10.098 1.00 0.00 H new ATOM 0 HA GLU A 131 10.699 8.460 -11.830 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.015 7.788 -11.758 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.066 8.910 -13.103 1.00 0.00 H new ATOM 0 HG2 GLU A 131 9.526 6.285 -12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 131 8.406 6.767 -14.050 1.00 0.00 H new ATOM 734 N MET A 132 8.938 11.166 -12.584 1.00 0.00 N ATOM 735 CA MET A 132 9.016 12.466 -13.242 1.00 0.00 C ATOM 736 C MET A 132 9.374 13.560 -12.243 1.00 0.00 C ATOM 737 O MET A 132 8.805 14.652 -12.271 1.00 0.00 O ATOM 738 CB MET A 132 7.687 12.797 -13.924 1.00 0.00 C ATOM 739 CG MET A 132 7.318 11.831 -15.039 1.00 0.00 C ATOM 740 SD MET A 132 5.580 11.355 -14.999 1.00 0.00 S ATOM 741 CE MET A 132 5.536 10.122 -16.298 1.00 0.00 C ATOM 0 H MET A 132 8.022 10.945 -12.193 1.00 0.00 H new ATOM 0 HA MET A 132 9.801 12.417 -13.997 1.00 0.00 H new ATOM 0 HB2 MET A 132 6.894 12.796 -13.176 1.00 0.00 H new ATOM 0 HB3 MET A 132 7.739 13.807 -14.332 1.00 0.00 H new ATOM 0 HG2 MET A 132 7.543 12.290 -16.002 1.00 0.00 H new ATOM 0 HG3 MET A 132 7.937 10.937 -14.960 1.00 0.00 H new ATOM 0 HE1 MET A 132 4.523 9.732 -16.395 1.00 0.00 H new ATOM 0 HE2 MET A 132 5.842 10.576 -17.241 1.00 0.00 H new ATOM 0 HE3 MET A 132 6.216 9.307 -16.050 1.00 0.00 H new ATOM 751 N LYS A 133 10.321 13.262 -11.359 1.00 0.00 N ATOM 752 CA LYS A 133 10.756 14.220 -10.350 1.00 0.00 C ATOM 753 C LYS A 133 11.198 15.529 -10.998 1.00 0.00 C ATOM 754 O LYS A 133 11.638 15.546 -12.148 1.00 0.00 O ATOM 755 CB LYS A 133 11.903 13.635 -9.523 1.00 0.00 C ATOM 756 CG LYS A 133 13.155 13.350 -10.335 1.00 0.00 C ATOM 757 CD LYS A 133 14.402 13.381 -9.467 1.00 0.00 C ATOM 758 CE LYS A 133 15.322 12.209 -9.773 1.00 0.00 C ATOM 759 NZ LYS A 133 15.054 11.046 -8.882 1.00 0.00 N ATOM 0 H LYS A 133 10.802 12.363 -11.321 1.00 0.00 H new ATOM 0 HA LYS A 133 9.911 14.427 -9.693 1.00 0.00 H new ATOM 0 HB2 LYS A 133 12.151 14.329 -8.720 1.00 0.00 H new ATOM 0 HB3 LYS A 133 11.567 12.711 -9.053 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.066 12.374 -10.811 1.00 0.00 H new ATOM 0 HG3 LYS A 133 13.248 14.087 -11.133 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.937 14.317 -9.629 1.00 0.00 H new ATOM 0 HD3 LYS A 133 14.116 13.356 -8.416 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.193 11.908 -10.812 1.00 0.00 H new ATOM 0 HE3 LYS A 133 16.360 12.522 -9.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 15.701 10.268 -9.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.202 11.326 -7.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.071 10.730 -9.009 1.00 0.00 H new TER 773 LYS A 133