USER MOD reduce.3.24.130724 H: found=0, std=0, add=431, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 340 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 148 THR OG1 : rot 28:sc= 0.0373 USER MOD Set 1.2: A 168 SER OG : rot -173:sc= -0.715 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN :FLIP amide:sc= -0.23 F(o=-2.8,f=-0.23) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -1.55 K(o=-1.5,f=-2.2!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 LYS NZ :NH3+ -111:sc= 0.591 (180deg=-1.4!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.0682 K(o=-0.068,f=-0.74) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ -147:sc= 0.133 (180deg=-0.0103) USER MOD Single : A 175 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 131 -25.014 0.136 7.749 1.00 0.00 N ATOM 2 CA LYS A 131 -23.857 -0.020 6.886 1.00 0.00 C ATOM 3 C LYS A 131 -22.825 1.059 7.223 1.00 0.00 C ATOM 4 O LYS A 131 -21.730 1.075 6.663 1.00 0.00 O ATOM 5 CB LYS A 131 -24.280 -0.025 5.416 1.00 0.00 C ATOM 6 CG LYS A 131 -23.105 -0.387 4.507 1.00 0.00 C ATOM 7 CD LYS A 131 -22.904 0.673 3.422 1.00 0.00 C ATOM 8 CE LYS A 131 -21.650 1.506 3.695 1.00 0.00 C ATOM 9 NZ LYS A 131 -20.977 1.862 2.426 1.00 0.00 N ATOM 0 HA LYS A 131 -23.381 -0.985 7.061 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -25.090 -0.739 5.270 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -24.667 0.957 5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -22.196 -0.481 5.101 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -23.284 -1.357 4.044 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -22.819 0.190 2.448 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -23.776 1.325 3.380 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -21.919 2.412 4.237 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -20.965 0.945 4.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -20.128 2.427 2.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -20.703 0.994 1.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -21.627 2.415 1.832 1.00 0.00 H new ATOM 19 N VAL A 132 -23.211 1.936 8.139 1.00 0.00 N ATOM 20 CA VAL A 132 -22.335 3.016 8.558 1.00 0.00 C ATOM 21 C VAL A 132 -21.109 2.429 9.261 1.00 0.00 C ATOM 22 O VAL A 132 -19.983 2.591 8.791 1.00 0.00 O ATOM 23 CB VAL A 132 -23.106 4.008 9.430 1.00 0.00 C ATOM 24 CG1 VAL A 132 -22.165 5.049 10.041 1.00 0.00 C ATOM 25 CG2 VAL A 132 -24.227 4.681 8.637 1.00 0.00 C ATOM 0 H VAL A 132 -24.119 1.920 8.603 1.00 0.00 H new ATOM 0 HA VAL A 132 -21.978 3.575 7.693 1.00 0.00 H new ATOM 0 HB VAL A 132 -23.563 3.449 10.247 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -22.739 5.742 10.656 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -21.420 4.548 10.658 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -21.665 5.600 9.244 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -24.759 5.381 9.281 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -23.801 5.219 7.790 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -24.921 3.923 8.274 1.00 0.00 H new ATOM 35 N ASN A 133 -21.369 1.758 10.372 1.00 0.00 N ATOM 36 CA ASN A 133 -20.301 1.145 11.144 1.00 0.00 C ATOM 37 C ASN A 133 -19.240 0.593 10.190 1.00 0.00 C ATOM 38 O ASN A 133 -18.053 0.592 10.510 1.00 0.00 O ATOM 39 CB ASN A 133 -20.828 -0.016 11.989 1.00 0.00 C ATOM 40 CG ASN A 133 -22.143 -0.556 11.421 1.00 0.00 C ATOM 41 OD1 ASN A 133 -22.006 -1.214 10.273 1.00 0.00 O flip ATOM 42 ND2 ASN A 133 -23.210 -0.385 11.987 1.00 0.00 N flip ATOM 0 H ASN A 133 -22.304 1.625 10.757 1.00 0.00 H new ATOM 0 HA ASN A 133 -19.880 1.906 11.801 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -20.086 -0.814 12.020 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -20.981 0.317 13.016 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -23.244 0.130 12.867 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -24.068 -0.757 11.581 1.00 0.00 H new ATOM 48 N MET A 134 -19.708 0.136 9.037 1.00 0.00 N ATOM 49 CA MET A 134 -18.815 -0.418 8.034 1.00 0.00 C ATOM 50 C MET A 134 -18.032 0.689 7.326 1.00 0.00 C ATOM 51 O MET A 134 -16.802 0.657 7.287 1.00 0.00 O ATOM 52 CB MET A 134 -19.628 -1.207 7.006 1.00 0.00 C ATOM 53 CG MET A 134 -20.505 -2.258 7.689 1.00 0.00 C ATOM 54 SD MET A 134 -20.564 -3.742 6.700 1.00 0.00 S ATOM 55 CE MET A 134 -22.202 -4.322 7.107 1.00 0.00 C ATOM 0 H MET A 134 -20.694 0.138 8.776 1.00 0.00 H new ATOM 0 HA MET A 134 -18.105 -1.078 8.532 1.00 0.00 H new ATOM 0 HB2 MET A 134 -20.254 -0.525 6.431 1.00 0.00 H new ATOM 0 HB3 MET A 134 -18.954 -1.693 6.300 1.00 0.00 H new ATOM 0 HG2 MET A 134 -20.109 -2.486 8.678 1.00 0.00 H new ATOM 0 HG3 MET A 134 -21.512 -1.866 7.831 1.00 0.00 H new ATOM 0 HE1 MET A 134 -22.404 -5.249 6.570 1.00 0.00 H new ATOM 0 HE2 MET A 134 -22.268 -4.502 8.180 1.00 0.00 H new ATOM 0 HE3 MET A 134 -22.936 -3.569 6.820 1.00 0.00 H new ATOM 63 N ASP A 135 -18.775 1.642 6.783 1.00 0.00 N ATOM 64 CA ASP A 135 -18.166 2.756 6.079 1.00 0.00 C ATOM 65 C ASP A 135 -17.041 3.342 6.935 1.00 0.00 C ATOM 66 O ASP A 135 -16.021 3.785 6.408 1.00 0.00 O ATOM 67 CB ASP A 135 -19.186 3.866 5.816 1.00 0.00 C ATOM 68 CG ASP A 135 -18.690 5.001 4.918 1.00 0.00 C ATOM 69 OD1 ASP A 135 -17.530 5.420 5.122 1.00 0.00 O ATOM 70 OD2 ASP A 135 -19.482 5.424 4.048 1.00 0.00 O ATOM 0 H ASP A 135 -19.794 1.665 6.817 1.00 0.00 H new ATOM 0 HA ASP A 135 -17.784 2.384 5.128 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -20.072 3.424 5.361 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -19.496 4.288 6.772 1.00 0.00 H new ATOM 74 N LEU A 136 -17.265 3.325 8.240 1.00 0.00 N ATOM 75 CA LEU A 136 -16.282 3.849 9.175 1.00 0.00 C ATOM 76 C LEU A 136 -15.096 2.887 9.254 1.00 0.00 C ATOM 77 O LEU A 136 -13.947 3.297 9.100 1.00 0.00 O ATOM 78 CB LEU A 136 -16.933 4.137 10.530 1.00 0.00 C ATOM 79 CG LEU A 136 -16.030 4.782 11.584 1.00 0.00 C ATOM 80 CD1 LEU A 136 -15.845 6.275 11.306 1.00 0.00 C ATOM 81 CD2 LEU A 136 -16.562 4.522 12.994 1.00 0.00 C ATOM 0 H LEU A 136 -18.112 2.957 8.673 1.00 0.00 H new ATOM 0 HA LEU A 136 -15.893 4.805 8.824 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -17.791 4.789 10.367 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -17.317 3.200 10.933 1.00 0.00 H new ATOM 0 HG LEU A 136 -15.045 4.319 11.522 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -15.199 6.710 12.069 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -15.389 6.409 10.325 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -16.815 6.772 11.325 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -15.902 4.991 13.724 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.564 4.941 13.088 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -16.600 3.448 13.176 1.00 0.00 H new ATOM 92 N ARG A 137 -15.415 1.622 9.495 1.00 0.00 N ATOM 93 CA ARG A 137 -14.389 0.599 9.596 1.00 0.00 C ATOM 94 C ARG A 137 -13.374 0.750 8.462 1.00 0.00 C ATOM 95 O ARG A 137 -12.199 1.021 8.708 1.00 0.00 O ATOM 96 CB ARG A 137 -15.002 -0.802 9.539 1.00 0.00 C ATOM 97 CG ARG A 137 -15.981 -1.020 10.694 1.00 0.00 C ATOM 98 CD ARG A 137 -15.486 -2.125 11.630 1.00 0.00 C ATOM 99 NE ARG A 137 -15.500 -1.645 13.031 1.00 0.00 N ATOM 100 CZ ARG A 137 -15.119 -2.386 14.082 1.00 0.00 C ATOM 101 NH1 ARG A 137 -14.691 -3.641 13.896 1.00 0.00 N ATOM 102 NH2 ARG A 137 -15.165 -1.868 15.317 1.00 0.00 N ATOM 0 H ARG A 137 -16.369 1.284 9.623 1.00 0.00 H new ATOM 0 HA ARG A 137 -13.888 0.726 10.555 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -15.519 -0.938 8.589 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -14.211 -1.551 9.582 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -16.102 -0.092 11.253 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -16.962 -1.285 10.299 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -16.120 -3.007 11.532 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -14.476 -2.425 11.350 1.00 0.00 H new ATOM 0 HE ARG A 137 -15.819 -0.692 13.207 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -14.655 -4.033 12.955 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -14.401 -4.205 14.695 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -15.490 -0.911 15.457 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -14.876 -2.431 16.117 1.00 0.00 H new ATOM 113 N ALA A 138 -13.863 0.569 7.245 1.00 0.00 N ATOM 114 CA ALA A 138 -13.013 0.683 6.072 1.00 0.00 C ATOM 115 C ALA A 138 -12.403 2.086 6.022 1.00 0.00 C ATOM 116 O ALA A 138 -11.186 2.234 5.925 1.00 0.00 O ATOM 117 CB ALA A 138 -13.826 0.356 4.817 1.00 0.00 C ATOM 0 H ALA A 138 -14.838 0.344 7.045 1.00 0.00 H new ATOM 0 HA ALA A 138 -12.192 -0.032 6.124 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -13.188 0.442 3.938 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -14.211 -0.661 4.888 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -14.659 1.054 4.731 1.00 0.00 H new ATOM 123 N ASN A 139 -13.278 3.078 6.092 1.00 0.00 N ATOM 124 CA ASN A 139 -12.840 4.464 6.057 1.00 0.00 C ATOM 125 C ASN A 139 -11.512 4.594 6.803 1.00 0.00 C ATOM 126 O ASN A 139 -10.624 5.331 6.375 1.00 0.00 O ATOM 127 CB ASN A 139 -13.858 5.380 6.741 1.00 0.00 C ATOM 128 CG ASN A 139 -13.242 6.744 7.057 1.00 0.00 C ATOM 129 OD1 ASN A 139 -12.257 7.160 6.470 1.00 0.00 O ATOM 130 ND2 ASN A 139 -13.875 7.414 8.016 1.00 0.00 N ATOM 0 H ASN A 139 -14.287 2.951 6.173 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.734 4.758 5.013 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -14.727 5.510 6.096 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -14.211 4.914 7.661 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -13.541 8.335 8.301 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -14.695 7.007 8.467 1.00 0.00 H new ATOM 136 N LEU A 140 -11.415 3.867 7.907 1.00 0.00 N ATOM 137 CA LEU A 140 -10.209 3.891 8.716 1.00 0.00 C ATOM 138 C LEU A 140 -9.111 3.089 8.014 1.00 0.00 C ATOM 139 O LEU A 140 -7.998 3.580 7.833 1.00 0.00 O ATOM 140 CB LEU A 140 -10.507 3.412 10.138 1.00 0.00 C ATOM 141 CG LEU A 140 -10.193 4.403 11.260 1.00 0.00 C ATOM 142 CD1 LEU A 140 -8.690 4.682 11.340 1.00 0.00 C ATOM 143 CD2 LEU A 140 -11.007 5.688 11.102 1.00 0.00 C ATOM 0 H LEU A 140 -12.153 3.257 8.260 1.00 0.00 H new ATOM 0 HA LEU A 140 -9.841 4.912 8.819 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -11.563 3.149 10.198 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.941 2.498 10.318 1.00 0.00 H new ATOM 0 HG LEU A 140 -10.488 3.951 12.207 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.494 5.389 12.146 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -8.157 3.752 11.536 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.347 5.104 10.395 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -10.764 6.375 11.913 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -10.767 6.155 10.147 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.071 5.451 11.133 1.00 0.00 H new ATOM 154 N LYS A 141 -9.464 1.869 7.638 1.00 0.00 N ATOM 155 CA LYS A 141 -8.524 0.994 6.960 1.00 0.00 C ATOM 156 C LYS A 141 -9.114 0.561 5.616 1.00 0.00 C ATOM 157 O LYS A 141 -10.233 0.055 5.560 1.00 0.00 O ATOM 158 CB LYS A 141 -8.132 -0.176 7.865 1.00 0.00 C ATOM 159 CG LYS A 141 -6.688 -0.033 8.351 1.00 0.00 C ATOM 160 CD LYS A 141 -6.210 -1.317 9.033 1.00 0.00 C ATOM 161 CE LYS A 141 -4.737 -1.587 8.721 1.00 0.00 C ATOM 162 NZ LYS A 141 -3.934 -1.581 9.963 1.00 0.00 N ATOM 0 H LYS A 141 -10.388 1.466 7.790 1.00 0.00 H new ATOM 0 HA LYS A 141 -7.597 1.525 6.745 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -8.805 -0.220 8.721 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -8.246 -1.114 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -6.038 0.199 7.507 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.616 0.802 9.048 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -6.348 -1.234 10.111 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -6.817 -2.158 8.698 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -4.636 -2.550 8.220 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -4.360 -0.829 8.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -2.937 -1.766 9.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -4.016 -0.653 10.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -4.283 -2.320 10.606 1.00 0.00 H new ATOM 172 N GLN A 142 -8.334 0.777 4.566 1.00 0.00 N ATOM 173 CA GLN A 142 -8.765 0.416 3.227 1.00 0.00 C ATOM 174 C GLN A 142 -7.642 0.671 2.221 1.00 0.00 C ATOM 175 O GLN A 142 -7.840 1.369 1.227 1.00 0.00 O ATOM 176 CB GLN A 142 -10.034 1.175 2.836 1.00 0.00 C ATOM 177 CG GLN A 142 -9.889 2.671 3.121 1.00 0.00 C ATOM 178 CD GLN A 142 -10.651 3.504 2.090 1.00 0.00 C ATOM 179 OE1 GLN A 142 -11.756 3.178 1.685 1.00 0.00 O ATOM 180 NE2 GLN A 142 -10.003 4.592 1.687 1.00 0.00 N ATOM 0 H GLN A 142 -7.406 1.198 4.616 1.00 0.00 H new ATOM 0 HA GLN A 142 -9.000 -0.648 3.217 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -10.242 1.022 1.777 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -10.885 0.777 3.389 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -10.264 2.892 4.120 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -8.834 2.946 3.108 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -9.081 4.806 2.066 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -10.428 5.213 0.998 1.00 0.00 H new ATOM 187 N VAL A 143 -6.486 0.091 2.512 1.00 0.00 N ATOM 188 CA VAL A 143 -5.331 0.247 1.645 1.00 0.00 C ATOM 189 C VAL A 143 -4.884 1.710 1.655 1.00 0.00 C ATOM 190 O VAL A 143 -5.157 2.453 0.713 1.00 0.00 O ATOM 191 CB VAL A 143 -5.657 -0.268 0.242 1.00 0.00 C ATOM 192 CG1 VAL A 143 -4.668 0.283 -0.788 1.00 0.00 C ATOM 193 CG2 VAL A 143 -5.683 -1.798 0.212 1.00 0.00 C ATOM 0 H VAL A 143 -6.325 -0.488 3.336 1.00 0.00 H new ATOM 0 HA VAL A 143 -4.496 -0.350 2.011 1.00 0.00 H new ATOM 0 HB VAL A 143 -6.652 0.090 -0.023 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -4.922 -0.099 -1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -4.719 1.372 -0.795 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -3.658 -0.031 -0.527 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -5.917 -2.138 -0.797 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.708 -2.184 0.508 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -6.443 -2.163 0.903 1.00 0.00 H new ATOM 203 N LYS A 144 -4.205 2.081 2.731 1.00 0.00 N ATOM 204 CA LYS A 144 -3.718 3.441 2.877 1.00 0.00 C ATOM 205 C LYS A 144 -2.323 3.548 2.260 1.00 0.00 C ATOM 206 O LYS A 144 -1.451 2.727 2.542 1.00 0.00 O ATOM 207 CB LYS A 144 -3.779 3.879 4.342 1.00 0.00 C ATOM 208 CG LYS A 144 -5.115 3.488 4.976 1.00 0.00 C ATOM 209 CD LYS A 144 -5.983 4.722 5.230 1.00 0.00 C ATOM 210 CE LYS A 144 -7.035 4.889 4.132 1.00 0.00 C ATOM 211 NZ LYS A 144 -7.040 6.278 3.624 1.00 0.00 N ATOM 0 H LYS A 144 -3.981 1.462 3.510 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.360 4.135 2.335 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -2.961 3.420 4.897 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -3.643 4.958 4.409 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -5.644 2.796 4.321 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -4.937 2.965 5.915 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -6.475 4.632 6.199 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -5.354 5.611 5.273 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -6.829 4.198 3.315 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.020 4.635 4.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -7.760 6.373 2.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -7.259 6.932 4.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -6.104 6.508 3.232 1.00 0.00 H new ATOM 221 N LYS A 145 -2.153 4.566 1.430 1.00 0.00 N ATOM 222 CA LYS A 145 -0.877 4.791 0.771 1.00 0.00 C ATOM 223 C LYS A 145 -0.681 6.292 0.546 1.00 0.00 C ATOM 224 O LYS A 145 -1.520 6.945 -0.072 1.00 0.00 O ATOM 225 CB LYS A 145 -0.782 3.959 -0.509 1.00 0.00 C ATOM 226 CG LYS A 145 0.491 3.111 -0.519 1.00 0.00 C ATOM 227 CD LYS A 145 1.170 3.157 -1.889 1.00 0.00 C ATOM 228 CE LYS A 145 2.663 3.464 -1.750 1.00 0.00 C ATOM 229 NZ LYS A 145 2.943 4.863 -2.144 1.00 0.00 N ATOM 0 H LYS A 145 -2.878 5.245 1.198 1.00 0.00 H new ATOM 0 HA LYS A 145 -0.056 4.454 1.404 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -1.655 3.312 -0.592 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -0.791 4.618 -1.377 1.00 0.00 H new ATOM 0 HG2 LYS A 145 1.180 3.473 0.244 1.00 0.00 H new ATOM 0 HG3 LYS A 145 0.247 2.080 -0.265 1.00 0.00 H new ATOM 0 HD2 LYS A 145 1.037 2.202 -2.397 1.00 0.00 H new ATOM 0 HD3 LYS A 145 0.695 3.917 -2.509 1.00 0.00 H new ATOM 0 HE2 LYS A 145 2.980 3.300 -0.720 1.00 0.00 H new ATOM 0 HE3 LYS A 145 3.240 2.782 -2.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 3.486 4.872 -3.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 2.046 5.371 -2.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 3.494 5.331 -1.396 1.00 0.00 H new ATOM 239 N GLU A 146 0.432 6.794 1.060 1.00 0.00 N ATOM 240 CA GLU A 146 0.748 8.205 0.923 1.00 0.00 C ATOM 241 C GLU A 146 2.260 8.401 0.798 1.00 0.00 C ATOM 242 O GLU A 146 2.761 9.515 0.943 1.00 0.00 O ATOM 243 CB GLU A 146 0.187 9.010 2.097 1.00 0.00 C ATOM 244 CG GLU A 146 -1.005 9.862 1.657 1.00 0.00 C ATOM 245 CD GLU A 146 -0.599 11.329 1.491 1.00 0.00 C ATOM 246 OE1 GLU A 146 -0.303 11.956 2.530 1.00 0.00 O ATOM 247 OE2 GLU A 146 -0.594 11.787 0.327 1.00 0.00 O ATOM 0 H GLU A 146 1.126 6.249 1.572 1.00 0.00 H new ATOM 0 HA GLU A 146 0.276 8.575 0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.120 8.332 2.894 1.00 0.00 H new ATOM 0 HB3 GLU A 146 0.966 9.652 2.508 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -1.401 9.482 0.715 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.805 9.783 2.394 1.00 0.00 H new ATOM 252 N ASP A 147 2.948 7.299 0.531 1.00 0.00 N ATOM 253 CA ASP A 147 4.393 7.335 0.385 1.00 0.00 C ATOM 254 C ASP A 147 4.932 5.903 0.340 1.00 0.00 C ATOM 255 O ASP A 147 4.207 4.973 -0.010 1.00 0.00 O ATOM 256 CB ASP A 147 5.048 8.050 1.568 1.00 0.00 C ATOM 257 CG ASP A 147 6.103 9.092 1.189 1.00 0.00 C ATOM 258 OD1 ASP A 147 6.715 8.914 0.114 1.00 0.00 O ATOM 259 OD2 ASP A 147 6.274 10.041 1.984 1.00 0.00 O ATOM 0 H ASP A 147 2.530 6.376 0.412 1.00 0.00 H new ATOM 0 HA ASP A 147 4.626 7.872 -0.535 1.00 0.00 H new ATOM 0 HB2 ASP A 147 4.270 8.539 2.154 1.00 0.00 H new ATOM 0 HB3 ASP A 147 5.511 7.304 2.213 1.00 0.00 H new ATOM 263 N THR A 148 6.199 5.771 0.702 1.00 0.00 N ATOM 264 CA THR A 148 6.844 4.469 0.708 1.00 0.00 C ATOM 265 C THR A 148 6.805 3.861 2.111 1.00 0.00 C ATOM 266 O THR A 148 6.792 2.641 2.263 1.00 0.00 O ATOM 267 CB THR A 148 8.262 4.642 0.159 1.00 0.00 C ATOM 268 OG1 THR A 148 8.784 3.316 0.124 1.00 0.00 O ATOM 269 CG2 THR A 148 9.182 5.378 1.135 1.00 0.00 C ATOM 0 H THR A 148 6.797 6.544 0.993 1.00 0.00 H new ATOM 0 HA THR A 148 6.316 3.763 0.068 1.00 0.00 H new ATOM 0 HB THR A 148 8.222 5.187 -0.784 1.00 0.00 H new ATOM 0 HG1 THR A 148 8.049 2.678 0.011 1.00 0.00 H new ATOM 0 HG21 THR A 148 10.175 5.474 0.697 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.778 6.370 1.339 1.00 0.00 H new ATOM 0 HG23 THR A 148 9.249 4.815 2.066 1.00 0.00 H new ATOM 277 N GLU A 149 6.788 4.740 3.102 1.00 0.00 N ATOM 278 CA GLU A 149 6.751 4.305 4.488 1.00 0.00 C ATOM 279 C GLU A 149 5.375 4.582 5.094 1.00 0.00 C ATOM 280 O GLU A 149 5.014 4.002 6.118 1.00 0.00 O ATOM 281 CB GLU A 149 7.856 4.980 5.304 1.00 0.00 C ATOM 282 CG GLU A 149 9.197 4.272 5.102 1.00 0.00 C ATOM 283 CD GLU A 149 10.287 4.907 5.967 1.00 0.00 C ATOM 284 OE1 GLU A 149 10.021 5.089 7.174 1.00 0.00 O ATOM 285 OE2 GLU A 149 11.364 5.196 5.401 1.00 0.00 O ATOM 0 H GLU A 149 6.799 5.752 2.973 1.00 0.00 H new ATOM 0 HA GLU A 149 6.929 3.230 4.516 1.00 0.00 H new ATOM 0 HB2 GLU A 149 7.944 6.025 5.008 1.00 0.00 H new ATOM 0 HB3 GLU A 149 7.591 4.969 6.361 1.00 0.00 H new ATOM 0 HG2 GLU A 149 9.097 3.216 5.354 1.00 0.00 H new ATOM 0 HG3 GLU A 149 9.485 4.323 4.052 1.00 0.00 H new ATOM 290 N LYS A 150 4.640 5.469 4.437 1.00 0.00 N ATOM 291 CA LYS A 150 3.311 5.830 4.899 1.00 0.00 C ATOM 292 C LYS A 150 2.271 4.999 4.145 1.00 0.00 C ATOM 293 O LYS A 150 2.020 5.237 2.964 1.00 0.00 O ATOM 294 CB LYS A 150 3.095 7.340 4.782 1.00 0.00 C ATOM 295 CG LYS A 150 3.626 8.067 6.019 1.00 0.00 C ATOM 296 CD LYS A 150 4.893 8.860 5.687 1.00 0.00 C ATOM 297 CE LYS A 150 5.717 9.129 6.947 1.00 0.00 C ATOM 298 NZ LYS A 150 5.940 10.582 7.121 1.00 0.00 N ATOM 0 H LYS A 150 4.941 5.948 3.588 1.00 0.00 H new ATOM 0 HA LYS A 150 3.199 5.597 5.958 1.00 0.00 H new ATOM 0 HB2 LYS A 150 3.599 7.715 3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 150 2.033 7.551 4.660 1.00 0.00 H new ATOM 0 HG2 LYS A 150 2.861 8.741 6.405 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.841 7.344 6.806 1.00 0.00 H new ATOM 0 HD2 LYS A 150 5.494 8.306 4.966 1.00 0.00 H new ATOM 0 HD3 LYS A 150 4.622 9.805 5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 150 5.200 8.728 7.819 1.00 0.00 H new ATOM 0 HE3 LYS A 150 6.675 8.614 6.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 6.501 10.747 7.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 6.452 10.956 6.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 5.024 11.066 7.208 1.00 0.00 H new ATOM 308 N GLU A 151 1.694 4.043 4.856 1.00 0.00 N ATOM 309 CA GLU A 151 0.688 3.175 4.268 1.00 0.00 C ATOM 310 C GLU A 151 0.000 2.346 5.356 1.00 0.00 C ATOM 311 O GLU A 151 0.315 2.484 6.538 1.00 0.00 O ATOM 312 CB GLU A 151 1.300 2.273 3.197 1.00 0.00 C ATOM 313 CG GLU A 151 2.687 1.784 3.617 1.00 0.00 C ATOM 314 CD GLU A 151 2.710 1.405 5.099 1.00 0.00 C ATOM 315 OE1 GLU A 151 1.975 0.458 5.453 1.00 0.00 O ATOM 316 OE2 GLU A 151 3.460 2.071 5.844 1.00 0.00 O ATOM 0 H GLU A 151 1.904 3.850 5.835 1.00 0.00 H new ATOM 0 HA GLU A 151 -0.063 3.799 3.784 1.00 0.00 H new ATOM 0 HB2 GLU A 151 0.647 1.418 3.021 1.00 0.00 H new ATOM 0 HB3 GLU A 151 1.373 2.818 2.256 1.00 0.00 H new ATOM 0 HG2 GLU A 151 2.971 0.922 3.013 1.00 0.00 H new ATOM 0 HG3 GLU A 151 3.424 2.564 3.426 1.00 0.00 H new ATOM 321 N LYS A 152 -0.924 1.506 4.918 1.00 0.00 N ATOM 322 CA LYS A 152 -1.659 0.655 5.840 1.00 0.00 C ATOM 323 C LYS A 152 -2.341 -0.468 5.057 1.00 0.00 C ATOM 324 O LYS A 152 -3.254 -0.217 4.271 1.00 0.00 O ATOM 325 CB LYS A 152 -2.623 1.488 6.686 1.00 0.00 C ATOM 326 CG LYS A 152 -2.575 1.060 8.154 1.00 0.00 C ATOM 327 CD LYS A 152 -1.822 2.088 9.001 1.00 0.00 C ATOM 328 CE LYS A 152 -2.423 2.188 10.404 1.00 0.00 C ATOM 329 NZ LYS A 152 -2.095 3.496 11.016 1.00 0.00 N ATOM 0 H LYS A 152 -1.182 1.395 3.937 1.00 0.00 H new ATOM 0 HA LYS A 152 -0.978 0.183 6.548 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -2.366 2.544 6.603 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.638 1.376 6.304 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -3.589 0.942 8.535 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -2.088 0.088 8.237 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -0.771 1.807 9.071 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -1.860 3.063 8.515 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -3.505 2.065 10.352 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -2.040 1.381 11.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -2.510 3.548 11.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -1.062 3.599 11.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -2.482 4.261 10.428 1.00 0.00 H new ATOM 339 N ASP A 153 -1.872 -1.684 5.298 1.00 0.00 N ATOM 340 CA ASP A 153 -2.426 -2.846 4.624 1.00 0.00 C ATOM 341 C ASP A 153 -3.523 -3.461 5.496 1.00 0.00 C ATOM 342 O ASP A 153 -3.387 -3.526 6.717 1.00 0.00 O ATOM 343 CB ASP A 153 -1.353 -3.913 4.393 1.00 0.00 C ATOM 344 CG ASP A 153 -1.744 -5.327 4.825 1.00 0.00 C ATOM 345 OD1 ASP A 153 -2.898 -5.711 4.534 1.00 0.00 O ATOM 346 OD2 ASP A 153 -0.880 -5.994 5.435 1.00 0.00 O ATOM 0 H ASP A 153 -1.115 -1.889 5.950 1.00 0.00 H new ATOM 0 HA ASP A 153 -2.824 -2.520 3.663 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.101 -3.930 3.333 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.451 -3.622 4.930 1.00 0.00 H new ATOM 350 N LEU A 154 -4.585 -3.896 4.835 1.00 0.00 N ATOM 351 CA LEU A 154 -5.705 -4.503 5.534 1.00 0.00 C ATOM 352 C LEU A 154 -6.430 -5.465 4.591 1.00 0.00 C ATOM 353 O LEU A 154 -5.945 -5.749 3.496 1.00 0.00 O ATOM 354 CB LEU A 154 -6.612 -3.425 6.129 1.00 0.00 C ATOM 355 CG LEU A 154 -6.906 -2.223 5.230 1.00 0.00 C ATOM 356 CD1 LEU A 154 -5.840 -1.138 5.400 1.00 0.00 C ATOM 357 CD2 LEU A 154 -7.055 -2.654 3.770 1.00 0.00 C ATOM 0 H LEU A 154 -4.694 -3.840 3.822 1.00 0.00 H new ATOM 0 HA LEU A 154 -5.351 -5.093 6.380 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -7.560 -3.888 6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -6.155 -3.062 7.049 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.858 -1.791 5.538 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.072 -0.295 4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.824 -0.803 6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.863 -1.543 5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.264 -1.781 3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.131 -3.124 3.433 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -7.877 -3.365 3.683 1.00 0.00 H new ATOM 368 N ARG A 155 -7.578 -5.940 5.048 1.00 0.00 N ATOM 369 CA ARG A 155 -8.375 -6.863 4.259 1.00 0.00 C ATOM 370 C ARG A 155 -8.331 -6.472 2.780 1.00 0.00 C ATOM 371 O ARG A 155 -9.111 -5.632 2.334 1.00 0.00 O ATOM 372 CB ARG A 155 -9.830 -6.880 4.732 1.00 0.00 C ATOM 373 CG ARG A 155 -10.391 -5.461 4.830 1.00 0.00 C ATOM 374 CD ARG A 155 -11.432 -5.207 3.738 1.00 0.00 C ATOM 375 NE ARG A 155 -12.785 -5.143 4.334 1.00 0.00 N ATOM 376 CZ ARG A 155 -13.876 -4.722 3.678 1.00 0.00 C ATOM 377 NH1 ARG A 155 -13.779 -4.324 2.403 1.00 0.00 N ATOM 378 NH2 ARG A 155 -15.063 -4.697 4.300 1.00 0.00 N ATOM 0 H ARG A 155 -7.976 -5.703 5.957 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.952 -7.859 4.388 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -10.434 -7.467 4.040 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.894 -7.368 5.704 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -10.843 -5.312 5.810 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -9.580 -4.738 4.740 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.209 -4.274 3.221 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -11.391 -6.002 2.993 1.00 0.00 H new ATOM 0 HE ARG A 155 -12.894 -5.438 5.304 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -12.875 -4.341 1.931 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -14.609 -4.004 1.904 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -15.136 -4.998 5.272 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -15.893 -4.377 3.802 1.00 0.00 H new ATOM 389 N ASP A 156 -7.412 -7.099 2.061 1.00 0.00 N ATOM 390 CA ASP A 156 -7.256 -6.828 0.643 1.00 0.00 C ATOM 391 C ASP A 156 -5.766 -6.782 0.297 1.00 0.00 C ATOM 392 O ASP A 156 -5.399 -6.738 -0.876 1.00 0.00 O ATOM 393 CB ASP A 156 -7.868 -5.475 0.271 1.00 0.00 C ATOM 394 CG ASP A 156 -7.484 -4.950 -1.114 1.00 0.00 C ATOM 395 OD1 ASP A 156 -8.102 -5.424 -2.091 1.00 0.00 O ATOM 396 OD2 ASP A 156 -6.582 -4.087 -1.163 1.00 0.00 O ATOM 0 H ASP A 156 -6.767 -7.795 2.435 1.00 0.00 H new ATOM 0 HA ASP A 156 -7.763 -7.619 0.091 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -8.954 -5.558 0.323 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -7.568 -4.740 1.018 1.00 0.00 H new ATOM 400 N VAL A 157 -4.949 -6.795 1.339 1.00 0.00 N ATOM 401 CA VAL A 157 -3.508 -6.757 1.161 1.00 0.00 C ATOM 402 C VAL A 157 -3.154 -7.310 -0.221 1.00 0.00 C ATOM 403 O VAL A 157 -2.612 -6.593 -1.061 1.00 0.00 O ATOM 404 CB VAL A 157 -2.818 -7.510 2.300 1.00 0.00 C ATOM 405 CG1 VAL A 157 -3.842 -8.040 3.305 1.00 0.00 C ATOM 406 CG2 VAL A 157 -1.945 -8.644 1.758 1.00 0.00 C ATOM 0 H VAL A 157 -5.258 -6.831 2.310 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.146 -5.730 1.203 1.00 0.00 H new ATOM 0 HB VAL A 157 -2.168 -6.807 2.822 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -3.326 -8.571 4.105 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -4.403 -7.206 3.727 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -4.528 -8.721 2.801 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -1.466 -9.163 2.588 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -2.565 -9.346 1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -1.181 -8.232 1.099 1.00 0.00 H new ATOM 416 N GLY A 158 -3.476 -8.580 -0.415 1.00 0.00 N ATOM 417 CA GLY A 158 -3.200 -9.238 -1.682 1.00 0.00 C ATOM 418 C GLY A 158 -1.931 -8.676 -2.326 1.00 0.00 C ATOM 419 O GLY A 158 -0.915 -8.502 -1.654 1.00 0.00 O ATOM 0 H GLY A 158 -3.926 -9.172 0.284 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -3.087 -10.310 -1.522 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -4.045 -9.104 -2.357 1.00 0.00 H new ATOM 423 N ASP A 159 -2.031 -8.407 -3.619 1.00 0.00 N ATOM 424 CA ASP A 159 -0.905 -7.869 -4.361 1.00 0.00 C ATOM 425 C ASP A 159 -0.662 -6.421 -3.931 1.00 0.00 C ATOM 426 O ASP A 159 0.483 -5.992 -3.800 1.00 0.00 O ATOM 427 CB ASP A 159 -1.183 -7.875 -5.866 1.00 0.00 C ATOM 428 CG ASP A 159 -2.454 -7.137 -6.292 1.00 0.00 C ATOM 429 OD1 ASP A 159 -3.545 -7.684 -6.021 1.00 0.00 O ATOM 430 OD2 ASP A 159 -2.306 -6.044 -6.879 1.00 0.00 O ATOM 0 H ASP A 159 -2.876 -8.552 -4.172 1.00 0.00 H new ATOM 0 HA ASP A 159 -0.035 -8.492 -4.153 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -0.332 -7.428 -6.379 1.00 0.00 H new ATOM 0 HB3 ASP A 159 -1.251 -8.909 -6.204 1.00 0.00 H new ATOM 434 N TRP A 160 -1.759 -5.706 -3.725 1.00 0.00 N ATOM 435 CA TRP A 160 -1.679 -4.316 -3.312 1.00 0.00 C ATOM 436 C TRP A 160 -0.611 -4.206 -2.223 1.00 0.00 C ATOM 437 O TRP A 160 0.454 -3.633 -2.448 1.00 0.00 O ATOM 438 CB TRP A 160 -3.047 -3.798 -2.863 1.00 0.00 C ATOM 439 CG TRP A 160 -3.089 -3.337 -1.405 1.00 0.00 C ATOM 440 CD1 TRP A 160 -3.599 -3.987 -0.349 1.00 0.00 C ATOM 441 CD2 TRP A 160 -2.578 -2.093 -0.880 1.00 0.00 C ATOM 442 NE1 TRP A 160 -3.456 -3.255 0.813 1.00 0.00 N ATOM 443 CE2 TRP A 160 -2.815 -2.067 0.480 1.00 0.00 C ATOM 444 CE3 TRP A 160 -1.938 -1.026 -1.533 1.00 0.00 C ATOM 445 CZ2 TRP A 160 -2.443 -0.996 1.301 1.00 0.00 C ATOM 446 CZ3 TRP A 160 -1.572 0.037 -0.697 1.00 0.00 C ATOM 447 CH2 TRP A 160 -1.803 0.078 0.673 1.00 0.00 C ATOM 0 H TRP A 160 -2.708 -6.064 -3.837 1.00 0.00 H new ATOM 0 HA TRP A 160 -1.388 -3.681 -4.149 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -3.338 -2.966 -3.505 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -3.787 -4.585 -3.006 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.063 -4.961 -0.401 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -3.764 -3.534 1.744 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -1.744 -1.025 -2.595 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -2.640 -0.999 2.363 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -1.076 0.883 -1.148 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -1.490 0.935 1.250 1.00 0.00 H new ATOM 457 N ARG A 161 -0.932 -4.764 -1.065 1.00 0.00 N ATOM 458 CA ARG A 161 -0.013 -4.736 0.060 1.00 0.00 C ATOM 459 C ARG A 161 1.349 -5.297 -0.353 1.00 0.00 C ATOM 460 O ARG A 161 2.343 -4.573 -0.369 1.00 0.00 O ATOM 461 CB ARG A 161 -0.556 -5.550 1.236 1.00 0.00 C ATOM 462 CG ARG A 161 0.524 -5.771 2.297 1.00 0.00 C ATOM 463 CD ARG A 161 0.976 -7.233 2.324 1.00 0.00 C ATOM 464 NE ARG A 161 1.048 -7.714 3.721 1.00 0.00 N ATOM 465 CZ ARG A 161 0.994 -9.005 4.075 1.00 0.00 C ATOM 466 NH1 ARG A 161 0.866 -9.953 3.136 1.00 0.00 N ATOM 467 NH2 ARG A 161 1.068 -9.350 5.367 1.00 0.00 N ATOM 0 H ARG A 161 -1.816 -5.238 -0.882 1.00 0.00 H new ATOM 0 HA ARG A 161 0.097 -3.697 0.372 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.406 -5.031 1.680 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.921 -6.513 0.878 1.00 0.00 H new ATOM 0 HG2 ARG A 161 1.378 -5.126 2.091 1.00 0.00 H new ATOM 0 HG3 ARG A 161 0.140 -5.487 3.277 1.00 0.00 H new ATOM 0 HD2 ARG A 161 0.280 -7.848 1.754 1.00 0.00 H new ATOM 0 HD3 ARG A 161 1.951 -7.330 1.847 1.00 0.00 H new ATOM 0 HE ARG A 161 1.145 -7.019 4.461 1.00 0.00 H new ATOM 0 HH11 ARG A 161 0.810 -9.692 2.152 1.00 0.00 H new ATOM 0 HH12 ARG A 161 0.825 -10.936 3.406 1.00 0.00 H new ATOM 0 HH21 ARG A 161 1.166 -8.630 6.082 1.00 0.00 H new ATOM 0 HH22 ARG A 161 1.027 -10.333 5.635 1.00 0.00 H new ATOM 478 N LYS A 162 1.350 -6.582 -0.677 1.00 0.00 N ATOM 479 CA LYS A 162 2.574 -7.248 -1.089 1.00 0.00 C ATOM 480 C LYS A 162 3.511 -6.229 -1.739 1.00 0.00 C ATOM 481 O LYS A 162 4.662 -6.089 -1.330 1.00 0.00 O ATOM 482 CB LYS A 162 2.256 -8.448 -1.984 1.00 0.00 C ATOM 483 CG LYS A 162 3.378 -8.691 -2.996 1.00 0.00 C ATOM 484 CD LYS A 162 4.623 -9.255 -2.308 1.00 0.00 C ATOM 485 CE LYS A 162 4.806 -10.738 -2.636 1.00 0.00 C ATOM 486 NZ LYS A 162 6.134 -10.973 -3.247 1.00 0.00 N ATOM 0 H LYS A 162 0.523 -7.179 -0.663 1.00 0.00 H new ATOM 0 HA LYS A 162 3.096 -7.654 -0.223 1.00 0.00 H new ATOM 0 HB2 LYS A 162 2.117 -9.338 -1.370 1.00 0.00 H new ATOM 0 HB3 LYS A 162 1.318 -8.275 -2.511 1.00 0.00 H new ATOM 0 HG2 LYS A 162 3.036 -9.385 -3.764 1.00 0.00 H new ATOM 0 HG3 LYS A 162 3.628 -7.757 -3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 162 5.503 -8.697 -2.627 1.00 0.00 H new ATOM 0 HD3 LYS A 162 4.537 -9.125 -1.229 1.00 0.00 H new ATOM 0 HE2 LYS A 162 4.706 -11.333 -1.728 1.00 0.00 H new ATOM 0 HE3 LYS A 162 4.022 -11.065 -3.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 6.242 -11.984 -3.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 6.215 -10.420 -4.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 6.879 -10.680 -2.583 1.00 0.00 H new ATOM 496 N ASN A 163 2.982 -5.542 -2.742 1.00 0.00 N ATOM 497 CA ASN A 163 3.758 -4.539 -3.452 1.00 0.00 C ATOM 498 C ASN A 163 4.294 -3.512 -2.453 1.00 0.00 C ATOM 499 O ASN A 163 5.504 -3.318 -2.345 1.00 0.00 O ATOM 500 CB ASN A 163 2.894 -3.797 -4.474 1.00 0.00 C ATOM 501 CG ASN A 163 2.772 -4.597 -5.773 1.00 0.00 C ATOM 502 OD1 ASN A 163 3.727 -5.174 -6.269 1.00 0.00 O ATOM 503 ND2 ASN A 163 1.549 -4.598 -6.295 1.00 0.00 N ATOM 0 H ASN A 163 2.027 -5.660 -3.079 1.00 0.00 H new ATOM 0 HA ASN A 163 4.573 -5.047 -3.968 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.902 -3.620 -4.057 1.00 0.00 H new ATOM 0 HB3 ASN A 163 3.330 -2.820 -4.684 1.00 0.00 H new ATOM 0 HD21 ASN A 163 1.365 -5.102 -7.162 1.00 0.00 H new ATOM 0 HD22 ASN A 163 0.795 -4.094 -5.828 1.00 0.00 H new ATOM 509 N ILE A 164 3.367 -2.881 -1.747 1.00 0.00 N ATOM 510 CA ILE A 164 3.731 -1.878 -0.760 1.00 0.00 C ATOM 511 C ILE A 164 4.129 -2.573 0.544 1.00 0.00 C ATOM 512 O ILE A 164 4.166 -1.945 1.600 1.00 0.00 O ATOM 513 CB ILE A 164 2.604 -0.857 -0.593 1.00 0.00 C ATOM 514 CG1 ILE A 164 1.321 -1.531 -0.101 1.00 0.00 C ATOM 515 CG2 ILE A 164 2.379 -0.071 -1.886 1.00 0.00 C ATOM 516 CD1 ILE A 164 1.481 -2.031 1.337 1.00 0.00 C ATOM 0 H ILE A 164 2.364 -3.045 -1.839 1.00 0.00 H new ATOM 0 HA ILE A 164 4.598 -1.309 -1.097 1.00 0.00 H new ATOM 0 HB ILE A 164 2.904 -0.140 0.171 1.00 0.00 H new ATOM 0 HG12 ILE A 164 0.492 -0.826 -0.154 1.00 0.00 H new ATOM 0 HG13 ILE A 164 1.071 -2.367 -0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 164 1.573 0.648 -1.739 1.00 0.00 H new ATOM 0 HG22 ILE A 164 3.293 0.459 -2.153 1.00 0.00 H new ATOM 0 HG23 ILE A 164 2.111 -0.759 -2.688 1.00 0.00 H new ATOM 0 HD11 ILE A 164 0.555 -2.506 1.662 1.00 0.00 H new ATOM 0 HD12 ILE A 164 2.295 -2.754 1.382 1.00 0.00 H new ATOM 0 HD13 ILE A 164 1.707 -1.189 1.992 1.00 0.00 H new ATOM 527 N GLU A 165 4.417 -3.862 0.426 1.00 0.00 N ATOM 528 CA GLU A 165 4.810 -4.649 1.582 1.00 0.00 C ATOM 529 C GLU A 165 6.322 -4.885 1.574 1.00 0.00 C ATOM 530 O GLU A 165 6.967 -4.834 2.619 1.00 0.00 O ATOM 531 CB GLU A 165 4.049 -5.975 1.627 1.00 0.00 C ATOM 532 CG GLU A 165 3.983 -6.522 3.055 1.00 0.00 C ATOM 533 CD GLU A 165 4.185 -8.038 3.071 1.00 0.00 C ATOM 534 OE1 GLU A 165 3.633 -8.694 2.163 1.00 0.00 O ATOM 535 OE2 GLU A 165 4.889 -8.506 3.992 1.00 0.00 O ATOM 0 H GLU A 165 4.386 -4.380 -0.452 1.00 0.00 H new ATOM 0 HA GLU A 165 4.554 -4.090 2.482 1.00 0.00 H new ATOM 0 HB2 GLU A 165 3.039 -5.832 1.242 1.00 0.00 H new ATOM 0 HB3 GLU A 165 4.538 -6.701 0.978 1.00 0.00 H new ATOM 0 HG2 GLU A 165 4.747 -6.043 3.667 1.00 0.00 H new ATOM 0 HG3 GLU A 165 3.018 -6.275 3.499 1.00 0.00 H new ATOM 540 N GLU A 166 6.843 -5.136 0.382 1.00 0.00 N ATOM 541 CA GLU A 166 8.267 -5.380 0.224 1.00 0.00 C ATOM 542 C GLU A 166 8.962 -4.130 -0.318 1.00 0.00 C ATOM 543 O GLU A 166 10.139 -3.901 -0.042 1.00 0.00 O ATOM 544 CB GLU A 166 8.520 -6.585 -0.686 1.00 0.00 C ATOM 545 CG GLU A 166 7.925 -6.356 -2.077 1.00 0.00 C ATOM 546 CD GLU A 166 9.011 -6.412 -3.153 1.00 0.00 C ATOM 547 OE1 GLU A 166 9.376 -7.545 -3.532 1.00 0.00 O ATOM 548 OE2 GLU A 166 9.452 -5.320 -3.572 1.00 0.00 O ATOM 0 H GLU A 166 6.305 -5.176 -0.484 1.00 0.00 H new ATOM 0 HA GLU A 166 8.687 -5.611 1.203 1.00 0.00 H new ATOM 0 HB2 GLU A 166 9.592 -6.763 -0.770 1.00 0.00 H new ATOM 0 HB3 GLU A 166 8.082 -7.479 -0.242 1.00 0.00 H new ATOM 0 HG2 GLU A 166 7.166 -7.112 -2.281 1.00 0.00 H new ATOM 0 HG3 GLU A 166 7.426 -5.387 -2.108 1.00 0.00 H new ATOM 553 N LYS A 167 8.205 -3.353 -1.079 1.00 0.00 N ATOM 554 CA LYS A 167 8.734 -2.131 -1.660 1.00 0.00 C ATOM 555 C LYS A 167 8.462 -0.961 -0.713 1.00 0.00 C ATOM 556 O LYS A 167 9.112 0.080 -0.804 1.00 0.00 O ATOM 557 CB LYS A 167 8.177 -1.924 -3.070 1.00 0.00 C ATOM 558 CG LYS A 167 7.049 -0.890 -3.068 1.00 0.00 C ATOM 559 CD LYS A 167 6.546 -0.623 -4.488 1.00 0.00 C ATOM 560 CE LYS A 167 5.967 -1.893 -5.113 1.00 0.00 C ATOM 561 NZ LYS A 167 6.680 -2.227 -6.365 1.00 0.00 N ATOM 0 H LYS A 167 7.230 -3.546 -1.307 1.00 0.00 H new ATOM 0 HA LYS A 167 9.815 -2.202 -1.776 1.00 0.00 H new ATOM 0 HB2 LYS A 167 8.975 -1.595 -3.735 1.00 0.00 H new ATOM 0 HB3 LYS A 167 7.806 -2.871 -3.461 1.00 0.00 H new ATOM 0 HG2 LYS A 167 6.226 -1.246 -2.448 1.00 0.00 H new ATOM 0 HG3 LYS A 167 7.404 0.040 -2.624 1.00 0.00 H new ATOM 0 HD2 LYS A 167 5.784 0.156 -4.467 1.00 0.00 H new ATOM 0 HD3 LYS A 167 7.365 -0.251 -5.104 1.00 0.00 H new ATOM 0 HE2 LYS A 167 6.049 -2.721 -4.409 1.00 0.00 H new ATOM 0 HE3 LYS A 167 4.906 -1.753 -5.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 6.274 -3.092 -6.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 6.580 -1.443 -7.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 7.688 -2.381 -6.160 1.00 0.00 H new ATOM 571 N SER A 168 7.499 -1.169 0.173 1.00 0.00 N ATOM 572 CA SER A 168 7.134 -0.144 1.136 1.00 0.00 C ATOM 573 C SER A 168 6.963 -0.766 2.523 1.00 0.00 C ATOM 574 O SER A 168 5.993 -0.477 3.222 1.00 0.00 O ATOM 575 CB SER A 168 5.849 0.574 0.714 1.00 0.00 C ATOM 576 OG SER A 168 6.086 1.531 -0.315 1.00 0.00 O ATOM 0 H SER A 168 6.960 -2.032 0.244 1.00 0.00 H new ATOM 0 HA SER A 168 7.936 0.593 1.172 1.00 0.00 H new ATOM 0 HB2 SER A 168 5.121 -0.159 0.367 1.00 0.00 H new ATOM 0 HB3 SER A 168 5.411 1.072 1.579 1.00 0.00 H new ATOM 0 HG SER A 168 5.267 2.044 -0.479 1.00 0.00 H new ATOM 581 N GLY A 169 7.921 -1.609 2.880 1.00 0.00 N ATOM 582 CA GLY A 169 7.889 -2.274 4.172 1.00 0.00 C ATOM 583 C GLY A 169 9.292 -2.708 4.600 1.00 0.00 C ATOM 584 O GLY A 169 9.813 -2.232 5.607 1.00 0.00 O ATOM 0 H GLY A 169 8.724 -1.847 2.297 1.00 0.00 H new ATOM 0 HA2 GLY A 169 7.468 -1.602 4.920 1.00 0.00 H new ATOM 0 HA3 GLY A 169 7.235 -3.144 4.121 1.00 0.00 H new ATOM 588 N MET A 170 9.864 -3.608 3.813 1.00 0.00 N ATOM 589 CA MET A 170 11.197 -4.112 4.097 1.00 0.00 C ATOM 590 C MET A 170 12.193 -2.962 4.268 1.00 0.00 C ATOM 591 O MET A 170 13.177 -3.092 4.995 1.00 0.00 O ATOM 592 CB MET A 170 11.655 -5.020 2.954 1.00 0.00 C ATOM 593 CG MET A 170 13.001 -5.670 3.276 1.00 0.00 C ATOM 594 SD MET A 170 12.900 -7.436 3.034 1.00 0.00 S ATOM 595 CE MET A 170 14.000 -7.621 1.640 1.00 0.00 C ATOM 0 H MET A 170 9.428 -4.001 2.979 1.00 0.00 H new ATOM 0 HA MET A 170 11.160 -4.677 5.028 1.00 0.00 H new ATOM 0 HB2 MET A 170 10.907 -5.793 2.777 1.00 0.00 H new ATOM 0 HB3 MET A 170 11.738 -4.440 2.035 1.00 0.00 H new ATOM 0 HG2 MET A 170 13.779 -5.251 2.637 1.00 0.00 H new ATOM 0 HG3 MET A 170 13.283 -5.451 4.306 1.00 0.00 H new ATOM 0 HE1 MET A 170 14.054 -8.672 1.356 1.00 0.00 H new ATOM 0 HE2 MET A 170 13.624 -7.037 0.800 1.00 0.00 H new ATOM 0 HE3 MET A 170 14.995 -7.267 1.912 1.00 0.00 H new ATOM 603 N GLU A 171 11.903 -1.865 3.585 1.00 0.00 N ATOM 604 CA GLU A 171 12.761 -0.694 3.651 1.00 0.00 C ATOM 605 C GLU A 171 12.806 -0.150 5.080 1.00 0.00 C ATOM 606 O GLU A 171 13.870 -0.100 5.696 1.00 0.00 O ATOM 607 CB GLU A 171 12.296 0.382 2.669 1.00 0.00 C ATOM 608 CG GLU A 171 13.164 0.387 1.409 1.00 0.00 C ATOM 609 CD GLU A 171 14.565 0.925 1.712 1.00 0.00 C ATOM 610 OE1 GLU A 171 14.639 1.931 2.451 1.00 0.00 O ATOM 611 OE2 GLU A 171 15.529 0.318 1.198 1.00 0.00 O ATOM 0 H GLU A 171 11.086 -1.762 2.983 1.00 0.00 H new ATOM 0 HA GLU A 171 13.770 -0.990 3.363 1.00 0.00 H new ATOM 0 HB2 GLU A 171 11.255 0.206 2.397 1.00 0.00 H new ATOM 0 HB3 GLU A 171 12.339 1.360 3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 171 13.237 -0.624 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 171 12.693 1.000 0.641 1.00 0.00 H new ATOM 616 N GLY A 172 11.639 0.244 5.566 1.00 0.00 N ATOM 617 CA GLY A 172 11.532 0.784 6.911 1.00 0.00 C ATOM 618 C GLY A 172 12.106 -0.192 7.940 1.00 0.00 C ATOM 619 O GLY A 172 12.926 0.191 8.774 1.00 0.00 O ATOM 0 H GLY A 172 10.759 0.200 5.053 1.00 0.00 H new ATOM 0 HA2 GLY A 172 12.064 1.734 6.969 1.00 0.00 H new ATOM 0 HA3 GLY A 172 10.487 0.989 7.142 1.00 0.00 H new ATOM 623 N ARG A 173 11.653 -1.434 7.849 1.00 0.00 N ATOM 624 CA ARG A 173 12.112 -2.467 8.761 1.00 0.00 C ATOM 625 C ARG A 173 13.638 -2.440 8.870 1.00 0.00 C ATOM 626 O ARG A 173 14.184 -2.358 9.968 1.00 0.00 O ATOM 627 CB ARG A 173 11.664 -3.853 8.294 1.00 0.00 C ATOM 628 CG ARG A 173 10.472 -4.350 9.113 1.00 0.00 C ATOM 629 CD ARG A 173 10.275 -5.857 8.935 1.00 0.00 C ATOM 630 NE ARG A 173 8.952 -6.128 8.330 1.00 0.00 N ATOM 631 CZ ARG A 173 7.783 -5.865 8.931 1.00 0.00 C ATOM 632 NH1 ARG A 173 7.767 -5.323 10.156 1.00 0.00 N ATOM 633 NH2 ARG A 173 6.631 -6.143 8.306 1.00 0.00 N ATOM 0 H ARG A 173 10.972 -1.748 7.157 1.00 0.00 H new ATOM 0 HA ARG A 173 11.672 -2.266 9.738 1.00 0.00 H new ATOM 0 HB2 ARG A 173 11.394 -3.815 7.239 1.00 0.00 H new ATOM 0 HB3 ARG A 173 12.491 -4.557 8.386 1.00 0.00 H new ATOM 0 HG2 ARG A 173 10.630 -4.122 10.167 1.00 0.00 H new ATOM 0 HG3 ARG A 173 9.569 -3.823 8.805 1.00 0.00 H new ATOM 0 HD2 ARG A 173 11.064 -6.262 8.301 1.00 0.00 H new ATOM 0 HD3 ARG A 173 10.352 -6.358 9.900 1.00 0.00 H new ATOM 0 HE ARG A 173 8.928 -6.541 7.398 1.00 0.00 H new ATOM 0 HH11 ARG A 173 8.644 -5.111 10.631 1.00 0.00 H new ATOM 0 HH12 ARG A 173 6.878 -5.123 10.614 1.00 0.00 H new ATOM 0 HH21 ARG A 173 6.643 -6.555 7.373 1.00 0.00 H new ATOM 0 HH22 ARG A 173 5.741 -5.943 8.763 1.00 0.00 H new ATOM 644 N LYS A 174 14.283 -2.512 7.714 1.00 0.00 N ATOM 645 CA LYS A 174 15.734 -2.497 7.666 1.00 0.00 C ATOM 646 C LYS A 174 16.243 -1.147 8.177 1.00 0.00 C ATOM 647 O LYS A 174 17.298 -1.076 8.806 1.00 0.00 O ATOM 648 CB LYS A 174 16.227 -2.847 6.260 1.00 0.00 C ATOM 649 CG LYS A 174 15.581 -4.140 5.759 1.00 0.00 C ATOM 650 CD LYS A 174 16.446 -5.355 6.102 1.00 0.00 C ATOM 651 CE LYS A 174 15.712 -6.659 5.785 1.00 0.00 C ATOM 652 NZ LYS A 174 14.705 -6.952 6.829 1.00 0.00 N ATOM 0 H LYS A 174 13.827 -2.581 6.804 1.00 0.00 H new ATOM 0 HA LYS A 174 16.145 -3.263 8.323 1.00 0.00 H new ATOM 0 HB2 LYS A 174 15.995 -2.031 5.576 1.00 0.00 H new ATOM 0 HB3 LYS A 174 17.311 -2.957 6.268 1.00 0.00 H new ATOM 0 HG2 LYS A 174 14.594 -4.254 6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 174 15.437 -4.084 4.680 1.00 0.00 H new ATOM 0 HD2 LYS A 174 17.378 -5.312 5.539 1.00 0.00 H new ATOM 0 HD3 LYS A 174 16.711 -5.330 7.159 1.00 0.00 H new ATOM 0 HE2 LYS A 174 15.225 -6.582 4.813 1.00 0.00 H new ATOM 0 HE3 LYS A 174 16.427 -7.479 5.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 14.622 -7.981 6.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 15.000 -6.518 7.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 13.784 -6.563 6.542 1.00 0.00 H new ATOM 662 N LYS A 175 15.470 -0.111 7.888 1.00 0.00 N ATOM 663 CA LYS A 175 15.831 1.232 8.311 1.00 0.00 C ATOM 664 C LYS A 175 15.752 1.319 9.836 1.00 0.00 C ATOM 665 O LYS A 175 16.328 2.224 10.440 1.00 0.00 O ATOM 666 CB LYS A 175 14.968 2.270 7.590 1.00 0.00 C ATOM 667 CG LYS A 175 15.214 3.672 8.150 1.00 0.00 C ATOM 668 CD LYS A 175 13.991 4.177 8.920 1.00 0.00 C ATOM 669 CE LYS A 175 13.616 3.214 10.047 1.00 0.00 C ATOM 670 NZ LYS A 175 12.331 3.613 10.663 1.00 0.00 N ATOM 0 H LYS A 175 14.596 -0.174 7.366 1.00 0.00 H new ATOM 0 HA LYS A 175 16.860 1.457 8.031 1.00 0.00 H new ATOM 0 HB2 LYS A 175 15.192 2.256 6.523 1.00 0.00 H new ATOM 0 HB3 LYS A 175 13.915 2.011 7.698 1.00 0.00 H new ATOM 0 HG2 LYS A 175 16.082 3.657 8.809 1.00 0.00 H new ATOM 0 HG3 LYS A 175 15.444 4.358 7.335 1.00 0.00 H new ATOM 0 HD2 LYS A 175 14.200 5.163 9.334 1.00 0.00 H new ATOM 0 HD3 LYS A 175 13.148 4.290 8.238 1.00 0.00 H new ATOM 0 HE2 LYS A 175 13.539 2.199 9.656 1.00 0.00 H new ATOM 0 HE3 LYS A 175 14.401 3.206 10.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 12.091 2.949 11.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 12.417 4.573 11.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 11.581 3.598 9.943 1.00 0.00 H new ATOM 680 N MET A 176 15.035 0.368 10.416 1.00 0.00 N ATOM 681 CA MET A 176 14.875 0.327 11.859 1.00 0.00 C ATOM 682 C MET A 176 16.049 -0.397 12.521 1.00 0.00 C ATOM 683 O MET A 176 16.696 0.149 13.414 1.00 0.00 O ATOM 684 CB MET A 176 13.571 -0.393 12.208 1.00 0.00 C ATOM 685 CG MET A 176 13.733 -1.243 13.469 1.00 0.00 C ATOM 686 SD MET A 176 12.822 -0.512 14.819 1.00 0.00 S ATOM 687 CE MET A 176 11.208 -1.215 14.521 1.00 0.00 C ATOM 0 H MET A 176 14.558 -0.380 9.913 1.00 0.00 H new ATOM 0 HA MET A 176 14.847 1.351 12.231 1.00 0.00 H new ATOM 0 HB2 MET A 176 12.777 0.338 12.358 1.00 0.00 H new ATOM 0 HB3 MET A 176 13.267 -1.027 11.375 1.00 0.00 H new ATOM 0 HG2 MET A 176 13.374 -2.256 13.284 1.00 0.00 H new ATOM 0 HG3 MET A 176 14.788 -1.321 13.732 1.00 0.00 H new ATOM 0 HE1 MET A 176 10.511 -0.860 15.280 1.00 0.00 H new ATOM 0 HE2 MET A 176 10.856 -0.913 13.535 1.00 0.00 H new ATOM 0 HE3 MET A 176 11.271 -2.302 14.567 1.00 0.00 H new ATOM 695 N PHE A 177 16.290 -1.614 12.058 1.00 0.00 N ATOM 696 CA PHE A 177 17.376 -2.418 12.594 1.00 0.00 C ATOM 697 C PHE A 177 18.365 -2.807 11.493 1.00 0.00 C ATOM 698 O PHE A 177 19.556 -2.968 11.752 1.00 0.00 O ATOM 699 CB PHE A 177 16.748 -3.688 13.172 1.00 0.00 C ATOM 700 CG PHE A 177 16.036 -4.558 12.135 1.00 0.00 C ATOM 701 CD1 PHE A 177 14.846 -4.157 11.613 1.00 0.00 C ATOM 702 CD2 PHE A 177 16.592 -5.733 11.735 1.00 0.00 C ATOM 703 CE1 PHE A 177 14.185 -4.965 10.650 1.00 0.00 C ATOM 704 CE2 PHE A 177 15.931 -6.541 10.773 1.00 0.00 C ATOM 705 CZ PHE A 177 14.741 -6.140 10.250 1.00 0.00 C ATOM 0 H PHE A 177 15.752 -2.064 11.317 1.00 0.00 H new ATOM 0 HA PHE A 177 17.920 -1.853 13.350 1.00 0.00 H new ATOM 0 HB2 PHE A 177 17.527 -4.279 13.654 1.00 0.00 H new ATOM 0 HB3 PHE A 177 16.035 -3.408 13.947 1.00 0.00 H new ATOM 0 HD1 PHE A 177 14.404 -3.224 11.931 1.00 0.00 H new ATOM 0 HD2 PHE A 177 17.537 -6.052 12.150 1.00 0.00 H new ATOM 0 HE1 PHE A 177 13.240 -4.646 10.235 1.00 0.00 H new ATOM 0 HE2 PHE A 177 16.373 -7.474 10.456 1.00 0.00 H new ATOM 0 HZ PHE A 177 14.238 -6.754 9.518 1.00 0.00 H new ATOM 714 N GLU A 178 17.833 -2.948 10.288 1.00 0.00 N ATOM 715 CA GLU A 178 18.654 -3.315 9.146 1.00 0.00 C ATOM 716 C GLU A 178 19.079 -4.781 9.249 1.00 0.00 C ATOM 717 O GLU A 178 18.694 -5.603 8.418 1.00 0.00 O ATOM 718 CB GLU A 178 19.874 -2.398 9.030 1.00 0.00 C ATOM 719 CG GLU A 178 19.960 -1.774 7.635 1.00 0.00 C ATOM 720 CD GLU A 178 21.123 -0.785 7.548 1.00 0.00 C ATOM 721 OE1 GLU A 178 21.450 -0.198 8.603 1.00 0.00 O ATOM 722 OE2 GLU A 178 21.659 -0.638 6.429 1.00 0.00 O ATOM 0 H GLU A 178 16.844 -2.815 10.077 1.00 0.00 H new ATOM 0 HA GLU A 178 18.060 -3.191 8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 178 19.814 -1.611 9.781 1.00 0.00 H new ATOM 0 HB3 GLU A 178 20.781 -2.966 9.235 1.00 0.00 H new ATOM 0 HG2 GLU A 178 20.088 -2.558 6.889 1.00 0.00 H new ATOM 0 HG3 GLU A 178 19.025 -1.263 7.403 1.00 0.00 H new ATOM 727 N ALA A 179 19.868 -5.066 10.275 1.00 0.00 N ATOM 728 CA ALA A 179 20.349 -6.419 10.496 1.00 0.00 C ATOM 729 C ALA A 179 21.583 -6.665 9.626 1.00 0.00 C ATOM 730 O ALA A 179 21.488 -7.295 8.573 1.00 0.00 O ATOM 731 CB ALA A 179 19.224 -7.415 10.208 1.00 0.00 C ATOM 0 H ALA A 179 20.186 -4.383 10.962 1.00 0.00 H new ATOM 0 HA ALA A 179 20.646 -6.556 11.536 1.00 0.00 H new ATOM 0 HB1 ALA A 179 19.585 -8.430 10.374 1.00 0.00 H new ATOM 0 HB2 ALA A 179 18.383 -7.216 10.872 1.00 0.00 H new ATOM 0 HB3 ALA A 179 18.901 -7.310 9.172 1.00 0.00 H new ATOM 737 N GLY A 180 22.712 -6.157 10.098 1.00 0.00 N ATOM 738 CA GLY A 180 23.963 -6.314 9.375 1.00 0.00 C ATOM 739 C GLY A 180 24.897 -5.130 9.632 1.00 0.00 C ATOM 740 O GLY A 180 24.841 -4.509 10.692 1.00 0.00 O ATOM 0 H GLY A 180 22.787 -5.636 10.972 1.00 0.00 H new ATOM 0 HA2 GLY A 180 24.451 -7.240 9.681 1.00 0.00 H new ATOM 0 HA3 GLY A 180 23.762 -6.398 8.307 1.00 0.00 H new ATOM 744 N GLU A 181 25.733 -4.852 8.643 1.00 0.00 N ATOM 745 CA GLU A 181 26.678 -3.753 8.748 1.00 0.00 C ATOM 746 C GLU A 181 26.506 -2.790 7.571 1.00 0.00 C ATOM 747 O GLU A 181 26.276 -1.598 7.768 1.00 0.00 O ATOM 748 CB GLU A 181 28.115 -4.271 8.827 1.00 0.00 C ATOM 749 CG GLU A 181 29.045 -3.221 9.439 1.00 0.00 C ATOM 750 CD GLU A 181 30.494 -3.711 9.451 1.00 0.00 C ATOM 751 OE1 GLU A 181 30.762 -4.668 10.208 1.00 0.00 O ATOM 752 OE2 GLU A 181 31.299 -3.117 8.704 1.00 0.00 O ATOM 0 H GLU A 181 25.776 -5.369 7.765 1.00 0.00 H new ATOM 0 HA GLU A 181 26.472 -3.209 9.670 1.00 0.00 H new ATOM 0 HB2 GLU A 181 28.145 -5.181 9.426 1.00 0.00 H new ATOM 0 HB3 GLU A 181 28.465 -4.535 7.829 1.00 0.00 H new ATOM 0 HG2 GLU A 181 28.976 -2.294 8.871 1.00 0.00 H new ATOM 0 HG3 GLU A 181 28.725 -2.996 10.456 1.00 0.00 H new ATOM 757 N SER A 182 26.624 -3.344 6.373 1.00 0.00 N ATOM 758 CA SER A 182 26.485 -2.549 5.164 1.00 0.00 C ATOM 759 C SER A 182 25.607 -3.286 4.152 1.00 0.00 C ATOM 760 O SER A 182 25.901 -4.423 3.780 1.00 0.00 O ATOM 761 CB SER A 182 27.851 -2.234 4.552 1.00 0.00 C ATOM 762 OG SER A 182 27.938 -0.883 4.107 1.00 0.00 O ATOM 0 H SER A 182 26.814 -4.333 6.214 1.00 0.00 H new ATOM 0 HA SER A 182 26.009 -1.605 5.428 1.00 0.00 H new ATOM 0 HB2 SER A 182 28.631 -2.424 5.289 1.00 0.00 H new ATOM 0 HB3 SER A 182 28.036 -2.905 3.713 1.00 0.00 H new ATOM 0 HG SER A 182 28.826 -0.721 3.724 1.00 0.00 H new TER 767 SER A 182