USER MOD reduce.3.24.130724 H: found=0, std=0, add=431, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 432 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 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN :FLIP amide:sc= -0.274 F(o=-2.5!,f=-0.27) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= -0.442 K(o=-0.44,f=-1.4!) USER MOD Single : A 144 LYS NZ :NH3+ -112:sc= -0.475 (180deg=-1.52!) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 110:sc= -0.102 USER MOD Single : A 150 LYS NZ :NH3+ -146:sc= -0.0524 (180deg=-0.496) 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= -0.102 K(o=-0.1,f=-0.73) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot 45:sc= 0.0231 USER MOD Single : A 170 MET CE :methyl 150:sc= -0.144 (180deg=-0.829) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -24.734 1.702 0.101 1.00 0.00 N ATOM 2 CA LYS A 131 -23.645 2.383 0.781 1.00 0.00 C ATOM 3 C LYS A 131 -22.837 3.188 -0.238 1.00 0.00 C ATOM 4 O LYS A 131 -21.627 3.006 -0.361 1.00 0.00 O ATOM 5 CB LYS A 131 -22.805 1.384 1.580 1.00 0.00 C ATOM 6 CG LYS A 131 -22.415 1.963 2.942 1.00 0.00 C ATOM 7 CD LYS A 131 -23.449 1.598 4.009 1.00 0.00 C ATOM 8 CE LYS A 131 -23.488 2.651 5.118 1.00 0.00 C ATOM 9 NZ LYS A 131 -24.745 3.430 5.049 1.00 0.00 N ATOM 0 HA LYS A 131 -24.036 3.092 1.511 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -23.367 0.461 1.721 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -21.906 1.128 1.019 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -21.436 1.585 3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.329 3.047 2.869 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -24.434 1.511 3.551 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -23.208 0.624 4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -23.407 2.166 6.091 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -22.633 3.320 5.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -24.755 4.140 5.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -24.807 3.908 4.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -25.557 2.790 5.163 1.00 0.00 H new ATOM 23 N VAL A 132 -23.539 4.063 -0.944 1.00 0.00 N ATOM 24 CA VAL A 132 -22.903 4.897 -1.949 1.00 0.00 C ATOM 25 C VAL A 132 -21.901 5.833 -1.269 1.00 0.00 C ATOM 26 O VAL A 132 -20.717 5.829 -1.602 1.00 0.00 O ATOM 27 CB VAL A 132 -23.965 5.644 -2.759 1.00 0.00 C ATOM 28 CG1 VAL A 132 -23.335 6.769 -3.583 1.00 0.00 C ATOM 29 CG2 VAL A 132 -24.750 4.682 -3.653 1.00 0.00 C ATOM 0 H VAL A 132 -24.543 4.212 -0.839 1.00 0.00 H new ATOM 0 HA VAL A 132 -22.346 4.284 -2.657 1.00 0.00 H new ATOM 0 HB VAL A 132 -24.666 6.095 -2.057 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -24.111 7.284 -4.149 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -22.843 7.477 -2.916 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -22.602 6.349 -4.272 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -25.498 5.238 -4.218 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -24.067 4.188 -4.344 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -25.245 3.933 -3.035 1.00 0.00 H new ATOM 39 N ASN A 133 -22.414 6.613 -0.328 1.00 0.00 N ATOM 40 CA ASN A 133 -21.579 7.552 0.402 1.00 0.00 C ATOM 41 C ASN A 133 -20.225 6.903 0.695 1.00 0.00 C ATOM 42 O ASN A 133 -19.209 7.591 0.781 1.00 0.00 O ATOM 43 CB ASN A 133 -22.220 7.935 1.737 1.00 0.00 C ATOM 44 CG ASN A 133 -23.173 6.841 2.222 1.00 0.00 C ATOM 45 OD1 ASN A 133 -22.568 5.703 2.551 1.00 0.00 O flip ATOM 46 ND2 ASN A 133 -24.378 7.018 2.293 1.00 0.00 N flip ATOM 0 H ASN A 133 -23.397 6.614 -0.055 1.00 0.00 H new ATOM 0 HA ASN A 133 -21.461 8.446 -0.211 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -21.443 8.102 2.483 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -22.764 8.873 1.627 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -24.778 7.917 2.025 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -24.985 6.267 2.621 1.00 0.00 H new ATOM 53 N MET A 134 -20.255 5.587 0.840 1.00 0.00 N ATOM 54 CA MET A 134 -19.042 4.838 1.122 1.00 0.00 C ATOM 55 C MET A 134 -18.234 4.601 -0.156 1.00 0.00 C ATOM 56 O MET A 134 -17.094 5.049 -0.266 1.00 0.00 O ATOM 57 CB MET A 134 -19.408 3.492 1.752 1.00 0.00 C ATOM 58 CG MET A 134 -19.085 3.480 3.247 1.00 0.00 C ATOM 59 SD MET A 134 -17.773 2.316 3.580 1.00 0.00 S ATOM 60 CE MET A 134 -17.859 2.253 5.362 1.00 0.00 C ATOM 0 H MET A 134 -21.100 5.020 0.768 1.00 0.00 H new ATOM 0 HA MET A 134 -18.431 5.419 1.813 1.00 0.00 H new ATOM 0 HB2 MET A 134 -20.470 3.294 1.604 1.00 0.00 H new ATOM 0 HB3 MET A 134 -18.862 2.692 1.252 1.00 0.00 H new ATOM 0 HG2 MET A 134 -18.788 4.477 3.571 1.00 0.00 H new ATOM 0 HG3 MET A 134 -19.974 3.211 3.817 1.00 0.00 H new ATOM 0 HE1 MET A 134 -17.101 1.566 5.739 1.00 0.00 H new ATOM 0 HE2 MET A 134 -17.682 3.248 5.770 1.00 0.00 H new ATOM 0 HE3 MET A 134 -18.846 1.906 5.667 1.00 0.00 H new ATOM 70 N ASP A 135 -18.857 3.896 -1.089 1.00 0.00 N ATOM 71 CA ASP A 135 -18.210 3.594 -2.355 1.00 0.00 C ATOM 72 C ASP A 135 -17.476 4.839 -2.857 1.00 0.00 C ATOM 73 O ASP A 135 -16.391 4.736 -3.428 1.00 0.00 O ATOM 74 CB ASP A 135 -19.237 3.191 -3.415 1.00 0.00 C ATOM 75 CG ASP A 135 -19.109 1.754 -3.926 1.00 0.00 C ATOM 76 OD1 ASP A 135 -18.471 0.952 -3.209 1.00 0.00 O ATOM 77 OD2 ASP A 135 -19.650 1.491 -5.021 1.00 0.00 O ATOM 0 H ASP A 135 -19.802 3.525 -0.994 1.00 0.00 H new ATOM 0 HA ASP A 135 -17.517 2.769 -2.192 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -20.236 3.326 -3.001 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -19.149 3.871 -4.262 1.00 0.00 H new ATOM 82 N LEU A 136 -18.096 5.987 -2.626 1.00 0.00 N ATOM 83 CA LEU A 136 -17.515 7.250 -3.047 1.00 0.00 C ATOM 84 C LEU A 136 -16.379 7.627 -2.095 1.00 0.00 C ATOM 85 O LEU A 136 -15.263 7.903 -2.532 1.00 0.00 O ATOM 86 CB LEU A 136 -18.598 8.324 -3.169 1.00 0.00 C ATOM 87 CG LEU A 136 -18.488 9.254 -4.379 1.00 0.00 C ATOM 88 CD1 LEU A 136 -19.029 8.578 -5.640 1.00 0.00 C ATOM 89 CD2 LEU A 136 -19.177 10.593 -4.106 1.00 0.00 C ATOM 0 H LEU A 136 -18.996 6.069 -2.152 1.00 0.00 H new ATOM 0 HA LEU A 136 -17.079 7.156 -4.042 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -19.569 7.830 -3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -18.581 8.933 -2.265 1.00 0.00 H new ATOM 0 HG LEU A 136 -17.433 9.465 -4.553 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -18.939 9.260 -6.485 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -18.456 7.673 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -20.077 8.319 -5.493 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -19.084 11.235 -4.982 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -20.232 10.422 -3.891 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -18.706 11.077 -3.250 1.00 0.00 H new ATOM 101 N ARG A 137 -16.702 7.627 -0.810 1.00 0.00 N ATOM 102 CA ARG A 137 -15.723 7.966 0.208 1.00 0.00 C ATOM 103 C ARG A 137 -14.354 7.388 -0.158 1.00 0.00 C ATOM 104 O ARG A 137 -13.359 8.110 -0.190 1.00 0.00 O ATOM 105 CB ARG A 137 -16.144 7.430 1.578 1.00 0.00 C ATOM 106 CG ARG A 137 -15.890 8.467 2.674 1.00 0.00 C ATOM 107 CD ARG A 137 -15.300 7.811 3.924 1.00 0.00 C ATOM 108 NE ARG A 137 -16.388 7.310 4.794 1.00 0.00 N ATOM 109 CZ ARG A 137 -16.189 6.712 5.976 1.00 0.00 C ATOM 110 NH1 ARG A 137 -14.943 6.536 6.437 1.00 0.00 N ATOM 111 NH2 ARG A 137 -17.236 6.289 6.698 1.00 0.00 N ATOM 0 H ARG A 137 -17.629 7.397 -0.451 1.00 0.00 H new ATOM 0 HA ARG A 137 -15.661 9.053 0.259 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -17.201 7.166 1.560 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -15.591 6.517 1.801 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -15.208 9.232 2.304 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -16.824 8.968 2.928 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -14.644 6.989 3.638 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -14.690 8.531 4.469 1.00 0.00 H new ATOM 0 HE ARG A 137 -17.349 7.428 4.473 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -14.146 6.857 5.888 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -14.792 6.081 7.337 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -18.185 6.422 6.347 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -17.084 5.834 7.598 1.00 0.00 H new ATOM 125 N ALA A 138 -14.348 6.090 -0.427 1.00 0.00 N ATOM 126 CA ALA A 138 -13.119 5.407 -0.790 1.00 0.00 C ATOM 127 C ALA A 138 -12.708 5.823 -2.204 1.00 0.00 C ATOM 128 O ALA A 138 -11.549 6.159 -2.444 1.00 0.00 O ATOM 129 CB ALA A 138 -13.317 3.895 -0.661 1.00 0.00 C ATOM 0 H ALA A 138 -15.175 5.494 -0.401 1.00 0.00 H new ATOM 0 HA ALA A 138 -12.310 5.688 -0.115 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.394 3.383 -0.934 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -13.578 3.649 0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -14.120 3.575 -1.326 1.00 0.00 H new ATOM 135 N ASN A 139 -13.680 5.786 -3.103 1.00 0.00 N ATOM 136 CA ASN A 139 -13.434 6.154 -4.487 1.00 0.00 C ATOM 137 C ASN A 139 -12.500 7.366 -4.529 1.00 0.00 C ATOM 138 O ASN A 139 -11.701 7.506 -5.453 1.00 0.00 O ATOM 139 CB ASN A 139 -14.735 6.536 -5.195 1.00 0.00 C ATOM 140 CG ASN A 139 -14.471 6.947 -6.645 1.00 0.00 C ATOM 141 OD1 ASN A 139 -14.120 6.141 -7.491 1.00 0.00 O ATOM 142 ND2 ASN A 139 -14.658 8.242 -6.883 1.00 0.00 N ATOM 0 H ASN A 139 -14.640 5.507 -2.900 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.988 5.296 -4.990 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -15.426 5.694 -5.172 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -15.215 7.357 -4.662 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.507 8.615 -7.820 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -14.953 8.862 -6.128 1.00 0.00 H new ATOM 149 N LEU A 140 -12.632 8.210 -3.516 1.00 0.00 N ATOM 150 CA LEU A 140 -11.810 9.404 -3.426 1.00 0.00 C ATOM 151 C LEU A 140 -10.626 9.135 -2.495 1.00 0.00 C ATOM 152 O LEU A 140 -9.477 9.125 -2.933 1.00 0.00 O ATOM 153 CB LEU A 140 -12.657 10.608 -3.010 1.00 0.00 C ATOM 154 CG LEU A 140 -12.519 11.859 -3.881 1.00 0.00 C ATOM 155 CD1 LEU A 140 -13.364 11.739 -5.151 1.00 0.00 C ATOM 156 CD2 LEU A 140 -12.856 13.121 -3.085 1.00 0.00 C ATOM 0 H LEU A 140 -13.296 8.090 -2.751 1.00 0.00 H new ATOM 0 HA LEU A 140 -11.397 9.656 -4.403 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -13.704 10.306 -3.006 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -12.398 10.873 -1.985 1.00 0.00 H new ATOM 0 HG LEU A 140 -11.478 11.944 -4.194 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -13.248 12.641 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -13.034 10.874 -5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -14.413 11.616 -4.880 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -12.750 13.995 -3.727 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -13.882 13.059 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.176 13.209 -2.237 1.00 0.00 H new ATOM 168 N LYS A 141 -10.948 8.923 -1.227 1.00 0.00 N ATOM 169 CA LYS A 141 -9.926 8.654 -0.230 1.00 0.00 C ATOM 170 C LYS A 141 -8.862 7.734 -0.833 1.00 0.00 C ATOM 171 O LYS A 141 -7.679 8.072 -0.846 1.00 0.00 O ATOM 172 CB LYS A 141 -10.558 8.106 1.051 1.00 0.00 C ATOM 173 CG LYS A 141 -9.596 7.164 1.777 1.00 0.00 C ATOM 174 CD LYS A 141 -8.387 7.927 2.322 1.00 0.00 C ATOM 175 CE LYS A 141 -7.339 6.965 2.885 1.00 0.00 C ATOM 176 NZ LYS A 141 -7.222 7.126 4.352 1.00 0.00 N ATOM 0 H LYS A 141 -11.902 8.932 -0.867 1.00 0.00 H new ATOM 0 HA LYS A 141 -9.424 9.577 0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -10.830 8.932 1.709 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -11.479 7.575 0.808 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -10.116 6.668 2.596 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -9.260 6.384 1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -7.944 8.529 1.528 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -8.709 8.616 3.102 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -7.615 5.938 2.647 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -6.374 7.153 2.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -6.507 6.466 4.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -6.938 8.102 4.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -8.140 6.924 4.798 1.00 0.00 H new ATOM 190 N GLN A 142 -9.320 6.589 -1.316 1.00 0.00 N ATOM 191 CA GLN A 142 -8.422 5.618 -1.918 1.00 0.00 C ATOM 192 C GLN A 142 -7.234 6.327 -2.571 1.00 0.00 C ATOM 193 O GLN A 142 -7.384 7.416 -3.124 1.00 0.00 O ATOM 194 CB GLN A 142 -9.162 4.742 -2.932 1.00 0.00 C ATOM 195 CG GLN A 142 -9.371 5.487 -4.252 1.00 0.00 C ATOM 196 CD GLN A 142 -9.791 4.525 -5.364 1.00 0.00 C ATOM 197 OE1 GLN A 142 -10.821 4.680 -5.999 1.00 0.00 O ATOM 198 NE2 GLN A 142 -8.938 3.524 -5.564 1.00 0.00 N ATOM 0 H GLN A 142 -10.301 6.311 -1.303 1.00 0.00 H new ATOM 0 HA GLN A 142 -8.043 4.966 -1.131 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -8.594 3.829 -3.112 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -10.127 4.442 -2.523 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -10.134 6.255 -4.123 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -8.450 5.997 -4.536 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -8.093 3.453 -4.997 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -9.129 2.828 -6.285 1.00 0.00 H new ATOM 207 N VAL A 143 -6.080 5.681 -2.485 1.00 0.00 N ATOM 208 CA VAL A 143 -4.867 6.237 -3.060 1.00 0.00 C ATOM 209 C VAL A 143 -4.827 7.744 -2.798 1.00 0.00 C ATOM 210 O VAL A 143 -5.326 8.530 -3.602 1.00 0.00 O ATOM 211 CB VAL A 143 -4.785 5.886 -4.547 1.00 0.00 C ATOM 212 CG1 VAL A 143 -6.181 5.752 -5.157 1.00 0.00 C ATOM 213 CG2 VAL A 143 -3.951 6.918 -5.308 1.00 0.00 C ATOM 0 H VAL A 143 -5.960 4.778 -2.026 1.00 0.00 H new ATOM 0 HA VAL A 143 -3.986 5.802 -2.588 1.00 0.00 H new ATOM 0 HB VAL A 143 -4.287 4.921 -4.636 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -6.094 5.502 -6.214 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -6.729 4.963 -4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -6.717 6.695 -5.050 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -3.908 6.645 -6.362 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.408 7.902 -5.206 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -2.941 6.943 -4.899 1.00 0.00 H new ATOM 223 N LYS A 144 -4.229 8.101 -1.671 1.00 0.00 N ATOM 224 CA LYS A 144 -4.117 9.499 -1.294 1.00 0.00 C ATOM 225 C LYS A 144 -2.725 9.757 -0.715 1.00 0.00 C ATOM 226 O LYS A 144 -2.425 9.337 0.401 1.00 0.00 O ATOM 227 CB LYS A 144 -5.257 9.893 -0.352 1.00 0.00 C ATOM 228 CG LYS A 144 -5.328 8.946 0.848 1.00 0.00 C ATOM 229 CD LYS A 144 -5.547 9.724 2.147 1.00 0.00 C ATOM 230 CE LYS A 144 -6.735 10.680 2.021 1.00 0.00 C ATOM 231 NZ LYS A 144 -6.265 12.076 1.879 1.00 0.00 N ATOM 0 H LYS A 144 -3.817 7.446 -1.007 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.222 10.139 -2.170 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -5.110 10.916 -0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -6.203 9.873 -0.892 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.140 8.233 0.706 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -4.405 8.369 0.916 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -5.722 9.027 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -4.647 10.287 2.394 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -7.341 10.405 1.158 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -7.374 10.593 2.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -6.520 12.616 2.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -5.232 12.084 1.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -6.712 12.510 1.046 1.00 0.00 H new ATOM 245 N LYS A 145 -1.911 10.448 -1.500 1.00 0.00 N ATOM 246 CA LYS A 145 -0.558 10.767 -1.079 1.00 0.00 C ATOM 247 C LYS A 145 -0.173 12.147 -1.616 1.00 0.00 C ATOM 248 O LYS A 145 -0.674 12.575 -2.655 1.00 0.00 O ATOM 249 CB LYS A 145 0.409 9.655 -1.494 1.00 0.00 C ATOM 250 CG LYS A 145 -0.072 8.959 -2.769 1.00 0.00 C ATOM 251 CD LYS A 145 -0.144 9.943 -3.938 1.00 0.00 C ATOM 252 CE LYS A 145 0.568 9.383 -5.171 1.00 0.00 C ATOM 253 NZ LYS A 145 -0.089 9.858 -6.409 1.00 0.00 N ATOM 0 H LYS A 145 -2.163 10.796 -2.425 1.00 0.00 H new ATOM 0 HA LYS A 145 -0.500 10.819 0.008 1.00 0.00 H new ATOM 0 HB2 LYS A 145 1.402 10.074 -1.656 1.00 0.00 H new ATOM 0 HB3 LYS A 145 0.498 8.926 -0.689 1.00 0.00 H new ATOM 0 HG2 LYS A 145 0.604 8.142 -3.018 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -1.055 8.519 -2.599 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -1.186 10.151 -4.179 1.00 0.00 H new ATOM 0 HD3 LYS A 145 0.312 10.890 -3.649 1.00 0.00 H new ATOM 0 HE2 LYS A 145 1.614 9.691 -5.166 1.00 0.00 H new ATOM 0 HE3 LYS A 145 0.557 8.293 -5.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 0.407 9.469 -7.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -1.080 9.543 -6.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -0.056 10.897 -6.443 1.00 0.00 H new ATOM 267 N GLU A 146 0.712 12.806 -0.883 1.00 0.00 N ATOM 268 CA GLU A 146 1.169 14.130 -1.272 1.00 0.00 C ATOM 269 C GLU A 146 2.676 14.114 -1.536 1.00 0.00 C ATOM 270 O GLU A 146 3.257 15.137 -1.898 1.00 0.00 O ATOM 271 CB GLU A 146 0.809 15.169 -0.208 1.00 0.00 C ATOM 272 CG GLU A 146 -0.173 16.203 -0.761 1.00 0.00 C ATOM 273 CD GLU A 146 0.533 17.528 -1.055 1.00 0.00 C ATOM 274 OE1 GLU A 146 1.421 17.515 -1.935 1.00 0.00 O ATOM 275 OE2 GLU A 146 0.170 18.524 -0.393 1.00 0.00 O ATOM 0 H GLU A 146 1.125 12.448 -0.022 1.00 0.00 H new ATOM 0 HA GLU A 146 0.661 14.413 -2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 146 0.370 14.672 0.657 1.00 0.00 H new ATOM 0 HB3 GLU A 146 1.714 15.670 0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -0.633 15.822 -1.673 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -0.977 16.367 -0.043 1.00 0.00 H new ATOM 282 N ASP A 147 3.266 12.944 -1.345 1.00 0.00 N ATOM 283 CA ASP A 147 4.694 12.782 -1.559 1.00 0.00 C ATOM 284 C ASP A 147 5.457 13.535 -0.467 1.00 0.00 C ATOM 285 O ASP A 147 4.945 14.498 0.102 1.00 0.00 O ATOM 286 CB ASP A 147 5.117 13.356 -2.912 1.00 0.00 C ATOM 287 CG ASP A 147 4.218 12.969 -4.088 1.00 0.00 C ATOM 288 OD1 ASP A 147 2.996 13.204 -3.969 1.00 0.00 O ATOM 289 OD2 ASP A 147 4.773 12.447 -5.079 1.00 0.00 O ATOM 0 H ASP A 147 2.781 12.098 -1.044 1.00 0.00 H new ATOM 0 HA ASP A 147 4.920 11.716 -1.533 1.00 0.00 H new ATOM 0 HB2 ASP A 147 5.143 14.443 -2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.134 13.027 -3.128 1.00 0.00 H new ATOM 294 N THR A 148 6.669 13.067 -0.206 1.00 0.00 N ATOM 295 CA THR A 148 7.508 13.684 0.807 1.00 0.00 C ATOM 296 C THR A 148 7.019 13.305 2.207 1.00 0.00 C ATOM 297 O THR A 148 6.509 14.151 2.940 1.00 0.00 O ATOM 298 CB THR A 148 7.520 15.193 0.556 1.00 0.00 C ATOM 299 OG1 THR A 148 7.745 15.309 -0.846 1.00 0.00 O ATOM 300 CG2 THR A 148 8.733 15.881 1.186 1.00 0.00 C ATOM 0 H THR A 148 7.090 12.267 -0.679 1.00 0.00 H new ATOM 0 HA THR A 148 8.534 13.321 0.745 1.00 0.00 H new ATOM 0 HB THR A 148 6.606 15.635 0.952 1.00 0.00 H new ATOM 0 HG1 THR A 148 6.929 15.633 -1.283 1.00 0.00 H new ATOM 0 HG21 THR A 148 8.693 16.950 0.978 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.723 15.720 2.264 1.00 0.00 H new ATOM 0 HG23 THR A 148 9.648 15.463 0.765 1.00 0.00 H new ATOM 308 N GLU A 149 7.191 12.033 2.535 1.00 0.00 N ATOM 309 CA GLU A 149 6.774 11.531 3.833 1.00 0.00 C ATOM 310 C GLU A 149 5.322 11.926 4.113 1.00 0.00 C ATOM 311 O GLU A 149 5.057 12.764 4.974 1.00 0.00 O ATOM 312 CB GLU A 149 7.702 12.036 4.940 1.00 0.00 C ATOM 313 CG GLU A 149 8.959 11.169 5.039 1.00 0.00 C ATOM 314 CD GLU A 149 9.117 10.593 6.448 1.00 0.00 C ATOM 315 OE1 GLU A 149 9.470 11.384 7.348 1.00 0.00 O ATOM 316 OE2 GLU A 149 8.883 9.373 6.591 1.00 0.00 O ATOM 0 H GLU A 149 7.614 11.335 1.924 1.00 0.00 H new ATOM 0 HA GLU A 149 6.838 10.443 3.818 1.00 0.00 H new ATOM 0 HB2 GLU A 149 7.984 13.070 4.740 1.00 0.00 H new ATOM 0 HB3 GLU A 149 7.174 12.028 5.894 1.00 0.00 H new ATOM 0 HG2 GLU A 149 8.903 10.357 4.314 1.00 0.00 H new ATOM 0 HG3 GLU A 149 9.836 11.764 4.785 1.00 0.00 H new ATOM 323 N LYS A 150 4.419 11.303 3.369 1.00 0.00 N ATOM 324 CA LYS A 150 3.001 11.578 3.526 1.00 0.00 C ATOM 325 C LYS A 150 2.213 10.777 2.488 1.00 0.00 C ATOM 326 O LYS A 150 1.944 11.269 1.393 1.00 0.00 O ATOM 327 CB LYS A 150 2.739 13.085 3.470 1.00 0.00 C ATOM 328 CG LYS A 150 3.476 13.726 2.293 1.00 0.00 C ATOM 329 CD LYS A 150 3.768 15.203 2.568 1.00 0.00 C ATOM 330 CE LYS A 150 2.568 15.885 3.228 1.00 0.00 C ATOM 331 NZ LYS A 150 2.860 16.190 4.646 1.00 0.00 N ATOM 0 H LYS A 150 4.642 10.609 2.656 1.00 0.00 H new ATOM 0 HA LYS A 150 2.656 11.254 4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.669 13.268 3.377 1.00 0.00 H new ATOM 0 HB3 LYS A 150 3.062 13.549 4.402 1.00 0.00 H new ATOM 0 HG2 LYS A 150 4.410 13.195 2.111 1.00 0.00 H new ATOM 0 HG3 LYS A 150 2.875 13.633 1.388 1.00 0.00 H new ATOM 0 HD2 LYS A 150 4.641 15.291 3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 150 4.010 15.710 1.634 1.00 0.00 H new ATOM 0 HE2 LYS A 150 2.326 16.804 2.695 1.00 0.00 H new ATOM 0 HE3 LYS A 150 1.693 15.238 3.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 1.990 16.096 5.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 3.576 15.526 5.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 3.219 17.163 4.725 1.00 0.00 H new ATOM 345 N GLU A 151 1.864 9.557 2.870 1.00 0.00 N ATOM 346 CA GLU A 151 1.111 8.684 1.986 1.00 0.00 C ATOM 347 C GLU A 151 -0.015 7.991 2.756 1.00 0.00 C ATOM 348 O GLU A 151 0.106 7.750 3.956 1.00 0.00 O ATOM 349 CB GLU A 151 2.029 7.659 1.316 1.00 0.00 C ATOM 350 CG GLU A 151 2.746 8.269 0.111 1.00 0.00 C ATOM 351 CD GLU A 151 4.250 8.386 0.369 1.00 0.00 C ATOM 352 OE1 GLU A 151 4.762 7.537 1.131 1.00 0.00 O ATOM 353 OE2 GLU A 151 4.853 9.320 -0.201 1.00 0.00 O ATOM 0 H GLU A 151 2.089 9.153 3.779 1.00 0.00 H new ATOM 0 HA GLU A 151 0.665 9.293 1.200 1.00 0.00 H new ATOM 0 HB2 GLU A 151 2.763 7.298 2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 151 1.445 6.796 0.997 1.00 0.00 H new ATOM 0 HG2 GLU A 151 2.572 7.652 -0.771 1.00 0.00 H new ATOM 0 HG3 GLU A 151 2.332 9.255 -0.102 1.00 0.00 H new ATOM 360 N LYS A 152 -1.085 7.691 2.035 1.00 0.00 N ATOM 361 CA LYS A 152 -2.232 7.031 2.636 1.00 0.00 C ATOM 362 C LYS A 152 -2.721 5.920 1.704 1.00 0.00 C ATOM 363 O LYS A 152 -3.198 6.193 0.604 1.00 0.00 O ATOM 364 CB LYS A 152 -3.312 8.054 2.993 1.00 0.00 C ATOM 365 CG LYS A 152 -3.245 8.426 4.475 1.00 0.00 C ATOM 366 CD LYS A 152 -3.344 9.941 4.665 1.00 0.00 C ATOM 367 CE LYS A 152 -2.390 10.420 5.761 1.00 0.00 C ATOM 368 NZ LYS A 152 -3.095 10.511 7.059 1.00 0.00 N ATOM 0 H LYS A 152 -1.182 7.893 1.040 1.00 0.00 H new ATOM 0 HA LYS A 152 -1.950 6.558 3.577 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -3.186 8.949 2.384 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -4.296 7.646 2.761 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -4.055 7.935 5.014 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -2.311 8.062 4.903 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -3.109 10.445 3.727 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -4.367 10.212 4.925 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -1.549 9.732 5.845 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -1.980 11.394 5.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -2.433 10.838 7.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -3.883 11.185 6.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -3.465 9.575 7.319 1.00 0.00 H new ATOM 382 N ASP A 153 -2.586 4.691 2.180 1.00 0.00 N ATOM 383 CA ASP A 153 -3.008 3.537 1.404 1.00 0.00 C ATOM 384 C ASP A 153 -4.301 2.975 1.997 1.00 0.00 C ATOM 385 O ASP A 153 -4.298 2.436 3.103 1.00 0.00 O ATOM 386 CB ASP A 153 -1.951 2.432 1.441 1.00 0.00 C ATOM 387 CG ASP A 153 -2.178 1.355 2.504 1.00 0.00 C ATOM 388 OD1 ASP A 153 -3.141 0.577 2.327 1.00 0.00 O ATOM 389 OD2 ASP A 153 -1.384 1.334 3.469 1.00 0.00 O ATOM 0 H ASP A 153 -2.190 4.469 3.094 1.00 0.00 H new ATOM 0 HA ASP A 153 -3.156 3.859 0.373 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.913 1.953 0.463 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.976 2.888 1.610 1.00 0.00 H new ATOM 394 N LEU A 154 -5.376 3.119 1.236 1.00 0.00 N ATOM 395 CA LEU A 154 -6.673 2.632 1.672 1.00 0.00 C ATOM 396 C LEU A 154 -6.586 1.127 1.936 1.00 0.00 C ATOM 397 O LEU A 154 -5.502 0.597 2.175 1.00 0.00 O ATOM 398 CB LEU A 154 -7.757 3.017 0.664 1.00 0.00 C ATOM 399 CG LEU A 154 -7.491 2.623 -0.790 1.00 0.00 C ATOM 400 CD1 LEU A 154 -6.384 1.571 -0.879 1.00 0.00 C ATOM 401 CD2 LEU A 154 -8.778 2.160 -1.477 1.00 0.00 C ATOM 0 H LEU A 154 -5.375 3.566 0.319 1.00 0.00 H new ATOM 0 HA LEU A 154 -6.961 3.105 2.611 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -8.696 2.560 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -7.898 4.097 0.707 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.140 3.506 -1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.215 1.308 -1.923 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.465 1.973 -0.452 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -6.682 0.681 -0.325 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -8.561 1.886 -2.509 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -9.182 1.296 -0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -9.509 2.968 -1.462 1.00 0.00 H new ATOM 413 N ARG A 155 -7.742 0.481 1.883 1.00 0.00 N ATOM 414 CA ARG A 155 -7.809 -0.952 2.114 1.00 0.00 C ATOM 415 C ARG A 155 -7.379 -1.712 0.857 1.00 0.00 C ATOM 416 O ARG A 155 -6.770 -2.777 0.950 1.00 0.00 O ATOM 417 CB ARG A 155 -9.226 -1.381 2.501 1.00 0.00 C ATOM 418 CG ARG A 155 -10.176 -1.277 1.306 1.00 0.00 C ATOM 419 CD ARG A 155 -11.563 -1.816 1.661 1.00 0.00 C ATOM 420 NE ARG A 155 -12.457 -1.727 0.484 1.00 0.00 N ATOM 421 CZ ARG A 155 -13.678 -2.276 0.425 1.00 0.00 C ATOM 422 NH1 ARG A 155 -14.158 -2.958 1.474 1.00 0.00 N ATOM 423 NH2 ARG A 155 -14.419 -2.144 -0.684 1.00 0.00 N ATOM 0 H ARG A 155 -8.639 0.924 1.684 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.133 -1.188 2.935 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -9.211 -2.406 2.870 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.590 -0.754 3.315 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -10.256 -0.237 0.990 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -9.769 -1.836 0.463 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.486 -2.852 1.992 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -11.982 -1.246 2.490 1.00 0.00 H new ATOM 0 HE ARG A 155 -12.123 -1.216 -0.333 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -13.594 -3.059 2.318 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -15.087 -3.376 1.429 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -14.053 -1.626 -1.483 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -15.348 -2.562 -0.729 1.00 0.00 H new ATOM 437 N ASP A 156 -7.712 -1.135 -0.288 1.00 0.00 N ATOM 438 CA ASP A 156 -7.367 -1.745 -1.561 1.00 0.00 C ATOM 439 C ASP A 156 -5.892 -2.150 -1.545 1.00 0.00 C ATOM 440 O ASP A 156 -5.560 -3.311 -1.779 1.00 0.00 O ATOM 441 CB ASP A 156 -7.576 -0.764 -2.716 1.00 0.00 C ATOM 442 CG ASP A 156 -8.132 -1.385 -3.999 1.00 0.00 C ATOM 443 OD1 ASP A 156 -9.373 -1.523 -4.071 1.00 0.00 O ATOM 444 OD2 ASP A 156 -7.305 -1.706 -4.879 1.00 0.00 O ATOM 0 H ASP A 156 -8.217 -0.252 -0.361 1.00 0.00 H new ATOM 0 HA ASP A 156 -8.010 -2.613 -1.704 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -8.255 0.022 -2.387 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -6.623 -0.287 -2.945 1.00 0.00 H new ATOM 449 N VAL A 157 -5.045 -1.169 -1.267 1.00 0.00 N ATOM 450 CA VAL A 157 -3.613 -1.409 -1.217 1.00 0.00 C ATOM 451 C VAL A 157 -3.251 -2.516 -2.209 1.00 0.00 C ATOM 452 O VAL A 157 -3.078 -2.256 -3.399 1.00 0.00 O ATOM 453 CB VAL A 157 -3.185 -1.727 0.217 1.00 0.00 C ATOM 454 CG1 VAL A 157 -4.255 -2.549 0.939 1.00 0.00 C ATOM 455 CG2 VAL A 157 -1.834 -2.445 0.239 1.00 0.00 C ATOM 0 H VAL A 157 -5.323 -0.207 -1.074 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.065 -0.515 -1.514 1.00 0.00 H new ATOM 0 HB VAL A 157 -3.072 -0.783 0.750 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -3.926 -2.761 1.956 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -5.188 -1.986 0.970 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -4.415 -3.486 0.406 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -1.553 -2.660 1.270 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -1.909 -3.379 -0.318 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -1.076 -1.809 -0.219 1.00 0.00 H new ATOM 465 N GLY A 158 -3.146 -3.727 -1.682 1.00 0.00 N ATOM 466 CA GLY A 158 -2.808 -4.875 -2.507 1.00 0.00 C ATOM 467 C GLY A 158 -1.862 -4.476 -3.641 1.00 0.00 C ATOM 468 O GLY A 158 -0.648 -4.423 -3.452 1.00 0.00 O ATOM 0 H GLY A 158 -3.289 -3.938 -0.694 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -2.340 -5.644 -1.892 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -3.717 -5.309 -2.923 1.00 0.00 H new ATOM 472 N ASP A 159 -2.455 -4.205 -4.795 1.00 0.00 N ATOM 473 CA ASP A 159 -1.680 -3.811 -5.960 1.00 0.00 C ATOM 474 C ASP A 159 -1.381 -2.313 -5.886 1.00 0.00 C ATOM 475 O ASP A 159 -0.219 -1.908 -5.869 1.00 0.00 O ATOM 476 CB ASP A 159 -2.457 -4.075 -7.252 1.00 0.00 C ATOM 477 CG ASP A 159 -1.662 -4.784 -8.350 1.00 0.00 C ATOM 478 OD1 ASP A 159 -0.997 -5.787 -8.012 1.00 0.00 O ATOM 479 OD2 ASP A 159 -1.738 -4.308 -9.503 1.00 0.00 O ATOM 0 H ASP A 159 -3.462 -4.250 -4.948 1.00 0.00 H new ATOM 0 HA ASP A 159 -0.759 -4.395 -5.966 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -3.335 -4.676 -7.014 1.00 0.00 H new ATOM 0 HB3 ASP A 159 -2.818 -3.123 -7.642 1.00 0.00 H new ATOM 484 N TRP A 160 -2.449 -1.530 -5.843 1.00 0.00 N ATOM 485 CA TRP A 160 -2.315 -0.085 -5.771 1.00 0.00 C ATOM 486 C TRP A 160 -1.110 0.235 -4.885 1.00 0.00 C ATOM 487 O TRP A 160 -0.233 1.004 -5.276 1.00 0.00 O ATOM 488 CB TRP A 160 -3.610 0.562 -5.275 1.00 0.00 C ATOM 489 CG TRP A 160 -3.407 1.575 -4.147 1.00 0.00 C ATOM 490 CD1 TRP A 160 -3.822 1.488 -2.876 1.00 0.00 C ATOM 491 CD2 TRP A 160 -2.719 2.840 -4.241 1.00 0.00 C ATOM 492 NE1 TRP A 160 -3.452 2.599 -2.146 1.00 0.00 N ATOM 493 CE2 TRP A 160 -2.760 3.448 -3.002 1.00 0.00 C ATOM 494 CE3 TRP A 160 -2.082 3.450 -5.335 1.00 0.00 C ATOM 495 CZ2 TRP A 160 -2.183 4.696 -2.741 1.00 0.00 C ATOM 496 CZ3 TRP A 160 -1.510 4.698 -5.058 1.00 0.00 C ATOM 497 CH2 TRP A 160 -1.543 5.323 -3.817 1.00 0.00 C ATOM 0 H TRP A 160 -3.411 -1.869 -5.857 1.00 0.00 H new ATOM 0 HA TRP A 160 -2.140 0.335 -6.761 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -4.099 1.059 -6.112 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -4.286 -0.220 -4.930 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.376 0.653 -2.473 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -3.650 2.767 -1.160 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -2.037 2.993 -6.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -2.229 5.151 -1.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -1.008 5.211 -5.865 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -1.077 6.288 -3.683 1.00 0.00 H new ATOM 508 N ARG A 161 -1.104 -0.372 -3.707 1.00 0.00 N ATOM 509 CA ARG A 161 -0.021 -0.162 -2.762 1.00 0.00 C ATOM 510 C ARG A 161 1.304 -0.639 -3.358 1.00 0.00 C ATOM 511 O ARG A 161 2.179 0.170 -3.664 1.00 0.00 O ATOM 512 CB ARG A 161 -0.281 -0.908 -1.451 1.00 0.00 C ATOM 513 CG ARG A 161 0.576 -0.340 -0.318 1.00 0.00 C ATOM 514 CD ARG A 161 1.412 -1.440 0.341 1.00 0.00 C ATOM 515 NE ARG A 161 1.964 -0.954 1.625 1.00 0.00 N ATOM 516 CZ ARG A 161 2.634 -1.724 2.494 1.00 0.00 C ATOM 517 NH1 ARG A 161 2.837 -3.020 2.222 1.00 0.00 N ATOM 518 NH2 ARG A 161 3.099 -1.198 3.635 1.00 0.00 N ATOM 0 H ARG A 161 -1.833 -1.010 -3.386 1.00 0.00 H new ATOM 0 HA ARG A 161 0.034 0.907 -2.554 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.336 -0.831 -1.188 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.062 -1.968 -1.582 1.00 0.00 H new ATOM 0 HG2 ARG A 161 1.233 0.437 -0.709 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -0.065 0.130 0.427 1.00 0.00 H new ATOM 0 HD2 ARG A 161 0.797 -2.323 0.511 1.00 0.00 H new ATOM 0 HD3 ARG A 161 2.223 -1.739 -0.323 1.00 0.00 H new ATOM 0 HE ARG A 161 1.826 0.028 1.864 1.00 0.00 H new ATOM 0 HH11 ARG A 161 2.482 -3.421 1.354 1.00 0.00 H new ATOM 0 HH12 ARG A 161 3.347 -3.606 2.883 1.00 0.00 H new ATOM 0 HH21 ARG A 161 2.943 -0.212 3.843 1.00 0.00 H new ATOM 0 HH22 ARG A 161 3.609 -1.784 4.296 1.00 0.00 H new ATOM 532 N LYS A 162 1.411 -1.951 -3.507 1.00 0.00 N ATOM 533 CA LYS A 162 2.615 -2.546 -4.061 1.00 0.00 C ATOM 534 C LYS A 162 3.330 -1.517 -4.939 1.00 0.00 C ATOM 535 O LYS A 162 4.546 -1.354 -4.847 1.00 0.00 O ATOM 536 CB LYS A 162 2.282 -3.850 -4.790 1.00 0.00 C ATOM 537 CG LYS A 162 2.261 -3.641 -6.305 1.00 0.00 C ATOM 538 CD LYS A 162 3.679 -3.489 -6.858 1.00 0.00 C ATOM 539 CE LYS A 162 3.990 -4.585 -7.879 1.00 0.00 C ATOM 540 NZ LYS A 162 5.365 -4.429 -8.404 1.00 0.00 N ATOM 0 H LYS A 162 0.683 -2.619 -3.254 1.00 0.00 H new ATOM 0 HA LYS A 162 3.305 -2.820 -3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 162 3.018 -4.612 -4.535 1.00 0.00 H new ATOM 0 HB3 LYS A 162 1.312 -4.220 -4.457 1.00 0.00 H new ATOM 0 HG2 LYS A 162 1.768 -4.486 -6.785 1.00 0.00 H new ATOM 0 HG3 LYS A 162 1.676 -2.753 -6.545 1.00 0.00 H new ATOM 0 HD2 LYS A 162 3.788 -2.510 -7.325 1.00 0.00 H new ATOM 0 HD3 LYS A 162 4.399 -3.534 -6.041 1.00 0.00 H new ATOM 0 HE2 LYS A 162 3.881 -5.565 -7.414 1.00 0.00 H new ATOM 0 HE3 LYS A 162 3.274 -4.540 -8.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 5.560 -5.181 -9.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 5.457 -3.502 -8.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 6.045 -4.495 -7.620 1.00 0.00 H new ATOM 554 N ASN A 163 2.544 -0.848 -5.770 1.00 0.00 N ATOM 555 CA ASN A 163 3.086 0.162 -6.664 1.00 0.00 C ATOM 556 C ASN A 163 3.626 1.331 -5.838 1.00 0.00 C ATOM 557 O ASN A 163 4.837 1.487 -5.693 1.00 0.00 O ATOM 558 CB ASN A 163 2.007 0.704 -7.602 1.00 0.00 C ATOM 559 CG ASN A 163 1.900 -0.150 -8.867 1.00 0.00 C ATOM 560 OD1 ASN A 163 2.887 -0.562 -9.454 1.00 0.00 O ATOM 561 ND2 ASN A 163 0.650 -0.393 -9.252 1.00 0.00 N ATOM 0 H ASN A 163 1.536 -0.985 -5.843 1.00 0.00 H new ATOM 0 HA ASN A 163 3.877 -0.300 -7.254 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.047 0.719 -7.087 1.00 0.00 H new ATOM 0 HB3 ASN A 163 2.240 1.734 -7.873 1.00 0.00 H new ATOM 0 HD21 ASN A 163 0.473 -0.955 -10.085 1.00 0.00 H new ATOM 0 HD22 ASN A 163 -0.131 -0.018 -8.714 1.00 0.00 H new ATOM 568 N ILE A 164 2.700 2.123 -5.317 1.00 0.00 N ATOM 569 CA ILE A 164 3.067 3.274 -4.509 1.00 0.00 C ATOM 570 C ILE A 164 3.970 2.818 -3.362 1.00 0.00 C ATOM 571 O ILE A 164 5.111 3.266 -3.250 1.00 0.00 O ATOM 572 CB ILE A 164 1.816 4.025 -4.047 1.00 0.00 C ATOM 573 CG1 ILE A 164 0.767 3.056 -3.498 1.00 0.00 C ATOM 574 CG2 ILE A 164 1.256 4.901 -5.169 1.00 0.00 C ATOM 575 CD1 ILE A 164 0.600 3.228 -1.987 1.00 0.00 C ATOM 0 H ILE A 164 1.696 1.990 -5.439 1.00 0.00 H new ATOM 0 HA ILE A 164 3.639 3.989 -5.101 1.00 0.00 H new ATOM 0 HB ILE A 164 2.099 4.690 -3.231 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -0.188 3.228 -3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 164 1.062 2.031 -3.721 1.00 0.00 H new ATOM 0 HG21 ILE A 164 0.368 5.423 -4.814 1.00 0.00 H new ATOM 0 HG22 ILE A 164 2.008 5.629 -5.472 1.00 0.00 H new ATOM 0 HG23 ILE A 164 0.992 4.275 -6.022 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -0.151 2.528 -1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 164 1.551 3.032 -1.491 1.00 0.00 H new ATOM 0 HD13 ILE A 164 0.281 4.248 -1.770 1.00 0.00 H new ATOM 587 N GLU A 165 3.427 1.934 -2.538 1.00 0.00 N ATOM 588 CA GLU A 165 4.170 1.413 -1.403 1.00 0.00 C ATOM 589 C GLU A 165 5.646 1.246 -1.767 1.00 0.00 C ATOM 590 O GLU A 165 6.526 1.643 -1.004 1.00 0.00 O ATOM 591 CB GLU A 165 3.572 0.092 -0.917 1.00 0.00 C ATOM 592 CG GLU A 165 4.662 -0.965 -0.726 1.00 0.00 C ATOM 593 CD GLU A 165 5.646 -0.547 0.368 1.00 0.00 C ATOM 594 OE1 GLU A 165 5.347 0.461 1.045 1.00 0.00 O ATOM 595 OE2 GLU A 165 6.675 -1.243 0.502 1.00 0.00 O ATOM 0 H GLU A 165 2.481 1.565 -2.634 1.00 0.00 H new ATOM 0 HA GLU A 165 4.097 2.130 -0.585 1.00 0.00 H new ATOM 0 HB2 GLU A 165 3.046 0.251 0.024 1.00 0.00 H new ATOM 0 HB3 GLU A 165 2.836 -0.265 -1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 165 4.206 -1.920 -0.464 1.00 0.00 H new ATOM 0 HG3 GLU A 165 5.197 -1.114 -1.664 1.00 0.00 H new ATOM 602 N GLU A 166 5.873 0.659 -2.933 1.00 0.00 N ATOM 603 CA GLU A 166 7.228 0.434 -3.407 1.00 0.00 C ATOM 604 C GLU A 166 7.879 1.762 -3.802 1.00 0.00 C ATOM 605 O GLU A 166 8.656 2.328 -3.035 1.00 0.00 O ATOM 606 CB GLU A 166 7.244 -0.553 -4.575 1.00 0.00 C ATOM 607 CG GLU A 166 8.671 -0.793 -5.071 1.00 0.00 C ATOM 608 CD GLU A 166 9.351 -1.905 -4.268 1.00 0.00 C ATOM 609 OE1 GLU A 166 8.833 -3.041 -4.321 1.00 0.00 O ATOM 610 OE2 GLU A 166 10.373 -1.593 -3.620 1.00 0.00 O ATOM 0 H GLU A 166 5.141 0.332 -3.564 1.00 0.00 H new ATOM 0 HA GLU A 166 7.808 -0.006 -2.595 1.00 0.00 H new ATOM 0 HB2 GLU A 166 6.800 -1.498 -4.263 1.00 0.00 H new ATOM 0 HB3 GLU A 166 6.632 -0.167 -5.390 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.652 -1.062 -6.127 1.00 0.00 H new ATOM 0 HG3 GLU A 166 9.249 0.127 -4.986 1.00 0.00 H new ATOM 617 N LYS A 167 7.537 2.218 -4.998 1.00 0.00 N ATOM 618 CA LYS A 167 8.078 3.468 -5.504 1.00 0.00 C ATOM 619 C LYS A 167 8.177 4.478 -4.358 1.00 0.00 C ATOM 620 O LYS A 167 9.126 5.258 -4.293 1.00 0.00 O ATOM 621 CB LYS A 167 7.254 3.966 -6.693 1.00 0.00 C ATOM 622 CG LYS A 167 5.761 3.972 -6.361 1.00 0.00 C ATOM 623 CD LYS A 167 5.142 5.343 -6.639 1.00 0.00 C ATOM 624 CE LYS A 167 5.605 6.372 -5.605 1.00 0.00 C ATOM 625 NZ LYS A 167 6.038 7.620 -6.274 1.00 0.00 N ATOM 0 H LYS A 167 6.892 1.745 -5.631 1.00 0.00 H new ATOM 0 HA LYS A 167 9.088 3.319 -5.886 1.00 0.00 H new ATOM 0 HB2 LYS A 167 7.574 4.972 -6.966 1.00 0.00 H new ATOM 0 HB3 LYS A 167 7.435 3.328 -7.558 1.00 0.00 H new ATOM 0 HG2 LYS A 167 5.250 3.212 -6.953 1.00 0.00 H new ATOM 0 HG3 LYS A 167 5.617 3.710 -5.313 1.00 0.00 H new ATOM 0 HD2 LYS A 167 5.420 5.676 -7.639 1.00 0.00 H new ATOM 0 HD3 LYS A 167 4.055 5.266 -6.620 1.00 0.00 H new ATOM 0 HE2 LYS A 167 4.794 6.588 -4.909 1.00 0.00 H new ATOM 0 HE3 LYS A 167 6.427 5.962 -5.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 6.349 8.308 -5.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 6.826 7.412 -6.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 5.243 8.018 -6.814 1.00 0.00 H new ATOM 639 N SER A 168 7.184 4.429 -3.483 1.00 0.00 N ATOM 640 CA SER A 168 7.146 5.330 -2.343 1.00 0.00 C ATOM 641 C SER A 168 8.318 5.035 -1.405 1.00 0.00 C ATOM 642 O SER A 168 8.695 3.878 -1.220 1.00 0.00 O ATOM 643 CB SER A 168 5.820 5.210 -1.590 1.00 0.00 C ATOM 644 OG SER A 168 4.702 5.482 -2.430 1.00 0.00 O ATOM 0 H SER A 168 6.399 3.780 -3.540 1.00 0.00 H new ATOM 0 HA SER A 168 7.232 6.352 -2.711 1.00 0.00 H new ATOM 0 HB2 SER A 168 5.727 4.205 -1.177 1.00 0.00 H new ATOM 0 HB3 SER A 168 5.817 5.902 -0.748 1.00 0.00 H new ATOM 0 HG SER A 168 4.814 5.016 -3.285 1.00 0.00 H new ATOM 650 N GLY A 169 8.862 6.101 -0.836 1.00 0.00 N ATOM 651 CA GLY A 169 9.984 5.970 0.079 1.00 0.00 C ATOM 652 C GLY A 169 11.314 6.000 -0.677 1.00 0.00 C ATOM 653 O GLY A 169 11.960 7.044 -0.762 1.00 0.00 O ATOM 0 H GLY A 169 8.547 7.059 -0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 169 9.958 6.779 0.810 1.00 0.00 H new ATOM 0 HA3 GLY A 169 9.898 5.036 0.634 1.00 0.00 H new ATOM 657 N MET A 170 11.684 4.843 -1.206 1.00 0.00 N ATOM 658 CA MET A 170 12.925 4.724 -1.951 1.00 0.00 C ATOM 659 C MET A 170 13.061 5.852 -2.975 1.00 0.00 C ATOM 660 O MET A 170 13.975 6.671 -2.885 1.00 0.00 O ATOM 661 CB MET A 170 12.961 3.374 -2.671 1.00 0.00 C ATOM 662 CG MET A 170 12.592 2.235 -1.719 1.00 0.00 C ATOM 663 SD MET A 170 13.449 0.742 -2.192 1.00 0.00 S ATOM 664 CE MET A 170 15.115 1.180 -1.727 1.00 0.00 C ATOM 0 H MET A 170 11.146 3.980 -1.133 1.00 0.00 H new ATOM 0 HA MET A 170 13.756 4.794 -1.249 1.00 0.00 H new ATOM 0 HB2 MET A 170 12.268 3.388 -3.513 1.00 0.00 H new ATOM 0 HB3 MET A 170 13.957 3.203 -3.080 1.00 0.00 H new ATOM 0 HG2 MET A 170 12.854 2.506 -0.696 1.00 0.00 H new ATOM 0 HG3 MET A 170 11.515 2.068 -1.739 1.00 0.00 H new ATOM 0 HE1 MET A 170 15.662 0.281 -1.444 1.00 0.00 H new ATOM 0 HE2 MET A 170 15.614 1.658 -2.570 1.00 0.00 H new ATOM 0 HE3 MET A 170 15.088 1.869 -0.883 1.00 0.00 H new ATOM 674 N GLU A 171 12.138 5.860 -3.926 1.00 0.00 N ATOM 675 CA GLU A 171 12.143 6.875 -4.965 1.00 0.00 C ATOM 676 C GLU A 171 12.302 8.266 -4.349 1.00 0.00 C ATOM 677 O GLU A 171 13.079 9.082 -4.842 1.00 0.00 O ATOM 678 CB GLU A 171 10.873 6.795 -5.816 1.00 0.00 C ATOM 679 CG GLU A 171 11.012 7.634 -7.088 1.00 0.00 C ATOM 680 CD GLU A 171 10.645 6.815 -8.327 1.00 0.00 C ATOM 681 OE1 GLU A 171 9.435 6.559 -8.501 1.00 0.00 O ATOM 682 OE2 GLU A 171 11.585 6.465 -9.074 1.00 0.00 O ATOM 0 H GLU A 171 11.382 5.179 -3.998 1.00 0.00 H new ATOM 0 HA GLU A 171 12.994 6.690 -5.621 1.00 0.00 H new ATOM 0 HB2 GLU A 171 10.673 5.757 -6.081 1.00 0.00 H new ATOM 0 HB3 GLU A 171 10.019 7.146 -5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 171 10.367 8.510 -7.022 1.00 0.00 H new ATOM 0 HG3 GLU A 171 12.036 7.998 -7.178 1.00 0.00 H new ATOM 689 N GLY A 172 11.554 8.494 -3.279 1.00 0.00 N ATOM 690 CA GLY A 172 11.603 9.772 -2.590 1.00 0.00 C ATOM 691 C GLY A 172 13.018 10.073 -2.092 1.00 0.00 C ATOM 692 O GLY A 172 13.699 10.941 -2.635 1.00 0.00 O ATOM 0 H GLY A 172 10.911 7.815 -2.873 1.00 0.00 H new ATOM 0 HA2 GLY A 172 11.274 10.564 -3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 172 10.912 9.762 -1.747 1.00 0.00 H new ATOM 696 N ARG A 173 13.419 9.338 -1.065 1.00 0.00 N ATOM 697 CA ARG A 173 14.740 9.515 -0.488 1.00 0.00 C ATOM 698 C ARG A 173 15.790 9.640 -1.594 1.00 0.00 C ATOM 699 O ARG A 173 16.792 10.335 -1.430 1.00 0.00 O ATOM 700 CB ARG A 173 15.106 8.342 0.423 1.00 0.00 C ATOM 701 CG ARG A 173 14.632 8.591 1.856 1.00 0.00 C ATOM 702 CD ARG A 173 15.810 8.586 2.832 1.00 0.00 C ATOM 703 NE ARG A 173 15.472 9.375 4.037 1.00 0.00 N ATOM 704 CZ ARG A 173 16.331 9.627 5.035 1.00 0.00 C ATOM 705 NH1 ARG A 173 17.583 9.154 4.977 1.00 0.00 N ATOM 706 NH2 ARG A 173 15.937 10.352 6.091 1.00 0.00 N ATOM 0 H ARG A 173 12.851 8.618 -0.618 1.00 0.00 H new ATOM 0 HA ARG A 173 14.722 10.429 0.106 1.00 0.00 H new ATOM 0 HB2 ARG A 173 14.655 7.426 0.041 1.00 0.00 H new ATOM 0 HB3 ARG A 173 16.186 8.193 0.414 1.00 0.00 H new ATOM 0 HG2 ARG A 173 14.114 9.549 1.910 1.00 0.00 H new ATOM 0 HG3 ARG A 173 13.914 7.823 2.144 1.00 0.00 H new ATOM 0 HD2 ARG A 173 16.055 7.562 3.114 1.00 0.00 H new ATOM 0 HD3 ARG A 173 16.694 9.003 2.350 1.00 0.00 H new ATOM 0 HE ARG A 173 14.527 9.751 4.113 1.00 0.00 H new ATOM 0 HH11 ARG A 173 17.883 8.602 4.173 1.00 0.00 H new ATOM 0 HH12 ARG A 173 18.236 9.346 5.736 1.00 0.00 H new ATOM 0 HH21 ARG A 173 14.984 10.712 6.135 1.00 0.00 H new ATOM 0 HH22 ARG A 173 16.590 10.544 6.850 1.00 0.00 H new ATOM 720 N LYS A 174 15.525 8.955 -2.698 1.00 0.00 N ATOM 721 CA LYS A 174 16.434 8.981 -3.831 1.00 0.00 C ATOM 722 C LYS A 174 16.410 10.371 -4.468 1.00 0.00 C ATOM 723 O LYS A 174 17.457 10.928 -4.793 1.00 0.00 O ATOM 724 CB LYS A 174 16.104 7.850 -4.808 1.00 0.00 C ATOM 725 CG LYS A 174 16.554 6.497 -4.253 1.00 0.00 C ATOM 726 CD LYS A 174 17.789 5.984 -4.996 1.00 0.00 C ATOM 727 CE LYS A 174 18.026 4.500 -4.706 1.00 0.00 C ATOM 728 NZ LYS A 174 18.914 3.907 -5.730 1.00 0.00 N ATOM 0 H LYS A 174 14.694 8.379 -2.831 1.00 0.00 H new ATOM 0 HA LYS A 174 17.457 8.799 -3.503 1.00 0.00 H new ATOM 0 HB2 LYS A 174 15.031 7.830 -4.998 1.00 0.00 H new ATOM 0 HB3 LYS A 174 16.594 8.036 -5.764 1.00 0.00 H new ATOM 0 HG2 LYS A 174 16.778 6.592 -3.190 1.00 0.00 H new ATOM 0 HG3 LYS A 174 15.743 5.774 -4.345 1.00 0.00 H new ATOM 0 HD2 LYS A 174 17.661 6.133 -6.068 1.00 0.00 H new ATOM 0 HD3 LYS A 174 18.664 6.561 -4.697 1.00 0.00 H new ATOM 0 HE2 LYS A 174 18.472 4.383 -3.718 1.00 0.00 H new ATOM 0 HE3 LYS A 174 17.074 3.970 -4.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 19.064 2.900 -5.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 18.474 4.002 -6.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 19.829 4.402 -5.725 1.00 0.00 H new ATOM 742 N LYS A 175 15.202 10.893 -4.628 1.00 0.00 N ATOM 743 CA LYS A 175 15.027 12.208 -5.220 1.00 0.00 C ATOM 744 C LYS A 175 15.357 13.280 -4.179 1.00 0.00 C ATOM 745 O LYS A 175 15.410 14.466 -4.500 1.00 0.00 O ATOM 746 CB LYS A 175 13.626 12.344 -5.820 1.00 0.00 C ATOM 747 CG LYS A 175 13.678 12.305 -7.348 1.00 0.00 C ATOM 748 CD LYS A 175 13.466 10.882 -7.869 1.00 0.00 C ATOM 749 CE LYS A 175 14.603 9.961 -7.425 1.00 0.00 C ATOM 750 NZ LYS A 175 15.195 9.268 -8.591 1.00 0.00 N ATOM 0 H LYS A 175 14.335 10.428 -4.358 1.00 0.00 H new ATOM 0 HA LYS A 175 15.719 12.346 -6.051 1.00 0.00 H new ATOM 0 HB2 LYS A 175 12.990 11.538 -5.454 1.00 0.00 H new ATOM 0 HB3 LYS A 175 13.175 13.281 -5.492 1.00 0.00 H new ATOM 0 HG2 LYS A 175 12.913 12.964 -7.758 1.00 0.00 H new ATOM 0 HG3 LYS A 175 14.641 12.682 -7.692 1.00 0.00 H new ATOM 0 HD2 LYS A 175 12.515 10.495 -7.503 1.00 0.00 H new ATOM 0 HD3 LYS A 175 13.407 10.894 -8.957 1.00 0.00 H new ATOM 0 HE2 LYS A 175 15.370 10.542 -6.912 1.00 0.00 H new ATOM 0 HE3 LYS A 175 14.227 9.228 -6.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 15.965 8.647 -8.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 14.465 8.698 -9.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 15.572 9.971 -9.258 1.00 0.00 H new ATOM 764 N MET A 176 15.570 12.823 -2.954 1.00 0.00 N ATOM 765 CA MET A 176 15.893 13.728 -1.864 1.00 0.00 C ATOM 766 C MET A 176 17.392 14.030 -1.828 1.00 0.00 C ATOM 767 O MET A 176 17.795 15.192 -1.839 1.00 0.00 O ATOM 768 CB MET A 176 15.466 13.100 -0.535 1.00 0.00 C ATOM 769 CG MET A 176 16.127 13.814 0.646 1.00 0.00 C ATOM 770 SD MET A 176 15.117 13.639 2.107 1.00 0.00 S ATOM 771 CE MET A 176 16.118 12.493 3.041 1.00 0.00 C ATOM 0 H MET A 176 15.525 11.838 -2.692 1.00 0.00 H new ATOM 0 HA MET A 176 15.357 14.664 -2.023 1.00 0.00 H new ATOM 0 HB2 MET A 176 14.382 13.152 -0.436 1.00 0.00 H new ATOM 0 HB3 MET A 176 15.737 12.044 -0.524 1.00 0.00 H new ATOM 0 HG2 MET A 176 17.117 13.396 0.826 1.00 0.00 H new ATOM 0 HG3 MET A 176 16.264 14.870 0.413 1.00 0.00 H new ATOM 0 HE1 MET A 176 15.630 12.274 3.991 1.00 0.00 H new ATOM 0 HE2 MET A 176 16.240 11.570 2.474 1.00 0.00 H new ATOM 0 HE3 MET A 176 17.097 12.935 3.230 1.00 0.00 H new ATOM 781 N PHE A 177 18.177 12.964 -1.786 1.00 0.00 N ATOM 782 CA PHE A 177 19.623 13.100 -1.749 1.00 0.00 C ATOM 783 C PHE A 177 20.177 13.452 -3.131 1.00 0.00 C ATOM 784 O PHE A 177 21.120 14.233 -3.245 1.00 0.00 O ATOM 785 CB PHE A 177 20.189 11.746 -1.315 1.00 0.00 C ATOM 786 CG PHE A 177 20.478 10.792 -2.476 1.00 0.00 C ATOM 787 CD1 PHE A 177 19.450 10.230 -3.166 1.00 0.00 C ATOM 788 CD2 PHE A 177 21.763 10.507 -2.818 1.00 0.00 C ATOM 789 CE1 PHE A 177 19.718 9.344 -4.243 1.00 0.00 C ATOM 790 CE2 PHE A 177 22.031 9.621 -3.896 1.00 0.00 C ATOM 791 CZ PHE A 177 21.003 9.059 -4.585 1.00 0.00 C ATOM 0 H PHE A 177 17.839 12.002 -1.777 1.00 0.00 H new ATOM 0 HA PHE A 177 19.904 13.898 -1.061 1.00 0.00 H new ATOM 0 HB2 PHE A 177 21.110 11.911 -0.756 1.00 0.00 H new ATOM 0 HB3 PHE A 177 19.483 11.270 -0.634 1.00 0.00 H new ATOM 0 HD1 PHE A 177 18.430 10.457 -2.895 1.00 0.00 H new ATOM 0 HD2 PHE A 177 22.580 10.954 -2.270 1.00 0.00 H new ATOM 0 HE1 PHE A 177 18.901 8.897 -4.790 1.00 0.00 H new ATOM 0 HE2 PHE A 177 23.051 9.394 -4.168 1.00 0.00 H new ATOM 0 HZ PHE A 177 21.207 8.386 -5.405 1.00 0.00 H new ATOM 801 N GLU A 178 19.566 12.859 -4.146 1.00 0.00 N ATOM 802 CA GLU A 178 19.986 13.100 -5.516 1.00 0.00 C ATOM 803 C GLU A 178 21.500 13.310 -5.578 1.00 0.00 C ATOM 804 O GLU A 178 21.981 14.434 -5.447 1.00 0.00 O ATOM 805 CB GLU A 178 19.242 14.295 -6.115 1.00 0.00 C ATOM 806 CG GLU A 178 19.150 14.176 -7.638 1.00 0.00 C ATOM 807 CD GLU A 178 18.748 15.511 -8.269 1.00 0.00 C ATOM 808 OE1 GLU A 178 19.205 16.548 -7.741 1.00 0.00 O ATOM 809 OE2 GLU A 178 17.994 15.464 -9.264 1.00 0.00 O ATOM 0 H GLU A 178 18.783 12.212 -4.047 1.00 0.00 H new ATOM 0 HA GLU A 178 19.736 12.222 -6.112 1.00 0.00 H new ATOM 0 HB2 GLU A 178 18.240 14.354 -5.690 1.00 0.00 H new ATOM 0 HB3 GLU A 178 19.756 15.219 -5.849 1.00 0.00 H new ATOM 0 HG2 GLU A 178 20.111 13.854 -8.040 1.00 0.00 H new ATOM 0 HG3 GLU A 178 18.421 13.410 -7.903 1.00 0.00 H new ATOM 816 N ALA A 179 22.210 12.209 -5.779 1.00 0.00 N ATOM 817 CA ALA A 179 23.660 12.258 -5.860 1.00 0.00 C ATOM 818 C ALA A 179 24.145 11.223 -6.877 1.00 0.00 C ATOM 819 O ALA A 179 24.980 11.527 -7.727 1.00 0.00 O ATOM 820 CB ALA A 179 24.257 12.033 -4.469 1.00 0.00 C ATOM 0 H ALA A 179 21.808 11.278 -5.888 1.00 0.00 H new ATOM 0 HA ALA A 179 23.992 13.238 -6.203 1.00 0.00 H new ATOM 0 HB1 ALA A 179 25.345 12.070 -4.530 1.00 0.00 H new ATOM 0 HB2 ALA A 179 23.905 12.811 -3.792 1.00 0.00 H new ATOM 0 HB3 ALA A 179 23.947 11.058 -4.094 1.00 0.00 H new ATOM 826 N GLY A 180 23.601 10.021 -6.756 1.00 0.00 N ATOM 827 CA GLY A 180 23.968 8.940 -7.654 1.00 0.00 C ATOM 828 C GLY A 180 22.990 8.846 -8.827 1.00 0.00 C ATOM 829 O GLY A 180 21.895 8.305 -8.685 1.00 0.00 O ATOM 0 H GLY A 180 22.909 9.772 -6.049 1.00 0.00 H new ATOM 0 HA2 GLY A 180 24.978 9.102 -8.030 1.00 0.00 H new ATOM 0 HA3 GLY A 180 23.979 7.997 -7.108 1.00 0.00 H new ATOM 833 N GLU A 181 23.421 9.381 -9.960 1.00 0.00 N ATOM 834 CA GLU A 181 22.598 9.365 -11.157 1.00 0.00 C ATOM 835 C GLU A 181 23.452 9.042 -12.384 1.00 0.00 C ATOM 836 O GLU A 181 24.456 9.706 -12.639 1.00 0.00 O ATOM 837 CB GLU A 181 21.862 10.695 -11.335 1.00 0.00 C ATOM 838 CG GLU A 181 20.565 10.503 -12.123 1.00 0.00 C ATOM 839 CD GLU A 181 19.656 11.726 -11.989 1.00 0.00 C ATOM 840 OE1 GLU A 181 20.177 12.845 -12.187 1.00 0.00 O ATOM 841 OE2 GLU A 181 18.461 11.514 -11.692 1.00 0.00 O ATOM 0 H GLU A 181 24.330 9.829 -10.074 1.00 0.00 H new ATOM 0 HA GLU A 181 21.846 8.584 -11.047 1.00 0.00 H new ATOM 0 HB2 GLU A 181 21.638 11.124 -10.358 1.00 0.00 H new ATOM 0 HB3 GLU A 181 22.506 11.404 -11.855 1.00 0.00 H new ATOM 0 HG2 GLU A 181 20.796 10.331 -13.174 1.00 0.00 H new ATOM 0 HG3 GLU A 181 20.044 9.617 -11.762 1.00 0.00 H new ATOM 848 N SER A 182 23.023 8.022 -13.113 1.00 0.00 N ATOM 849 CA SER A 182 23.736 7.603 -14.308 1.00 0.00 C ATOM 850 C SER A 182 23.055 8.177 -15.552 1.00 0.00 C ATOM 851 O SER A 182 22.690 9.352 -15.578 1.00 0.00 O ATOM 852 CB SER A 182 23.809 6.078 -14.399 1.00 0.00 C ATOM 853 OG SER A 182 25.090 5.630 -14.832 1.00 0.00 O ATOM 0 H SER A 182 22.190 7.473 -12.899 1.00 0.00 H new ATOM 0 HA SER A 182 24.755 7.986 -14.250 1.00 0.00 H new ATOM 0 HB2 SER A 182 23.584 5.645 -13.424 1.00 0.00 H new ATOM 0 HB3 SER A 182 23.047 5.719 -15.090 1.00 0.00 H new ATOM 0 HG SER A 182 25.097 4.651 -14.876 1.00 0.00 H new TER 859 SER A 182