USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 452 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 128 GLN : amide:sc= -1.5 X(o=-1.5,f=-2) USER MOD Single : A 136 GLN : amide:sc= -0.234 X(o=-0.23,f=-0.044) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= -0.0717 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 163:sc= 0.148 (180deg=0.0721) USER MOD Single : A 162 LYS NZ :NH3+ 172:sc= -0.765 (180deg=-0.907) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 166 THR OG1 : rot 180:sc= -0.0136 USER MOD Single : A 172 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 179 SER OG : rot 180:sc= 0 USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 127 -3.016 -16.590 3.230 1.00 0.00 N ATOM 2 CA ALA A 127 -4.181 -15.988 3.929 1.00 0.00 C ATOM 3 C ALA A 127 -5.275 -15.605 2.936 1.00 0.00 C ATOM 4 O ALA A 127 -5.118 -15.774 1.728 1.00 0.00 O ATOM 5 CB ALA A 127 -3.746 -14.769 4.728 1.00 0.00 C ATOM 0 HA ALA A 127 -4.587 -16.732 4.614 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -4.610 -14.339 5.234 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.002 -15.065 5.468 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -3.314 -14.028 4.055 1.00 0.00 H new ATOM 13 N GLN A 128 -6.383 -15.086 3.456 1.00 0.00 N ATOM 14 CA GLN A 128 -7.501 -14.676 2.617 1.00 0.00 C ATOM 15 C GLN A 128 -7.465 -13.173 2.356 1.00 0.00 C ATOM 16 O GLN A 128 -8.453 -12.470 2.570 1.00 0.00 O ATOM 17 CB GLN A 128 -8.828 -15.063 3.276 1.00 0.00 C ATOM 18 CG GLN A 128 -9.983 -15.183 2.296 1.00 0.00 C ATOM 19 CD GLN A 128 -10.771 -13.894 2.163 1.00 0.00 C ATOM 20 OE1 GLN A 128 -10.587 -13.135 1.213 1.00 0.00 O ATOM 21 NE2 GLN A 128 -11.655 -13.640 3.121 1.00 0.00 N ATOM 0 H GLN A 128 -6.529 -14.940 4.455 1.00 0.00 H new ATOM 0 HA GLN A 128 -7.415 -15.192 1.661 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -8.703 -16.013 3.795 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -9.079 -14.318 4.031 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -9.597 -15.471 1.318 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -10.650 -15.981 2.623 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -11.775 -14.298 3.891 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -12.214 -12.787 3.086 1.00 0.00 H new ATOM 30 N VAL A 129 -6.317 -12.686 1.896 1.00 0.00 N ATOM 31 CA VAL A 129 -6.151 -11.266 1.610 1.00 0.00 C ATOM 32 C VAL A 129 -5.515 -11.050 0.241 1.00 0.00 C ATOM 33 O VAL A 129 -4.515 -11.683 -0.097 1.00 0.00 O ATOM 34 CB VAL A 129 -5.284 -10.575 2.680 1.00 0.00 C ATOM 35 CG1 VAL A 129 -5.306 -9.066 2.492 1.00 0.00 C ATOM 36 CG2 VAL A 129 -5.755 -10.955 4.076 1.00 0.00 C ATOM 0 H VAL A 129 -5.489 -13.253 1.714 1.00 0.00 H new ATOM 0 HA VAL A 129 -7.147 -10.824 1.618 1.00 0.00 H new ATOM 0 HB VAL A 129 -4.255 -10.916 2.565 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.688 -8.595 3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.915 -8.817 1.505 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -6.330 -8.703 2.579 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -5.131 -10.458 4.818 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -6.792 -10.645 4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -5.680 -12.035 4.204 1.00 0.00 H new ATOM 46 N ALA A 130 -6.102 -10.150 -0.541 1.00 0.00 N ATOM 47 CA ALA A 130 -5.593 -9.844 -1.874 1.00 0.00 C ATOM 48 C ALA A 130 -4.576 -8.705 -1.838 1.00 0.00 C ATOM 49 O ALA A 130 -4.388 -8.001 -2.831 1.00 0.00 O ATOM 50 CB ALA A 130 -6.742 -9.496 -2.807 1.00 0.00 C ATOM 0 H ALA A 130 -6.931 -9.619 -0.275 1.00 0.00 H new ATOM 0 HA ALA A 130 -5.084 -10.732 -2.249 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -6.350 -9.270 -3.798 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -7.427 -10.342 -2.872 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.274 -8.627 -2.420 1.00 0.00 H new ATOM 56 N PHE A 131 -3.922 -8.526 -0.695 1.00 0.00 N ATOM 57 CA PHE A 131 -2.929 -7.469 -0.542 1.00 0.00 C ATOM 58 C PHE A 131 -1.943 -7.803 0.572 1.00 0.00 C ATOM 59 O PHE A 131 -2.203 -8.673 1.405 1.00 0.00 O ATOM 60 CB PHE A 131 -3.617 -6.135 -0.247 1.00 0.00 C ATOM 61 CG PHE A 131 -2.773 -4.937 -0.578 1.00 0.00 C ATOM 62 CD1 PHE A 131 -2.770 -4.409 -1.859 1.00 0.00 C ATOM 63 CD2 PHE A 131 -1.986 -4.339 0.392 1.00 0.00 C ATOM 64 CE1 PHE A 131 -1.996 -3.306 -2.166 1.00 0.00 C ATOM 65 CE2 PHE A 131 -1.210 -3.236 0.092 1.00 0.00 C ATOM 66 CZ PHE A 131 -1.214 -2.720 -1.190 1.00 0.00 C ATOM 0 H PHE A 131 -4.061 -9.098 0.138 1.00 0.00 H new ATOM 0 HA PHE A 131 -2.376 -7.387 -1.478 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -4.547 -6.082 -0.814 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -3.885 -6.100 0.809 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -3.379 -4.864 -2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -1.979 -4.740 1.395 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -2.003 -2.903 -3.168 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -0.602 -2.778 0.858 1.00 0.00 H new ATOM 0 HZ PHE A 131 -0.606 -1.860 -1.428 1.00 0.00 H new ATOM 76 N ARG A 132 -0.812 -7.107 0.583 1.00 0.00 N ATOM 77 CA ARG A 132 0.214 -7.328 1.596 1.00 0.00 C ATOM 78 C ARG A 132 0.633 -6.010 2.241 1.00 0.00 C ATOM 79 O ARG A 132 0.825 -5.005 1.556 1.00 0.00 O ATOM 80 CB ARG A 132 1.431 -8.020 0.975 1.00 0.00 C ATOM 81 CG ARG A 132 1.643 -9.441 1.476 1.00 0.00 C ATOM 82 CD ARG A 132 3.037 -9.629 2.052 1.00 0.00 C ATOM 83 NE ARG A 132 3.209 -10.952 2.648 1.00 0.00 N ATOM 84 CZ ARG A 132 2.730 -11.297 3.841 1.00 0.00 C ATOM 85 NH1 ARG A 132 2.049 -10.420 4.569 1.00 0.00 N ATOM 86 NH2 ARG A 132 2.933 -12.521 4.308 1.00 0.00 N ATOM 0 H ARG A 132 -0.582 -6.384 -0.099 1.00 0.00 H new ATOM 0 HA ARG A 132 -0.204 -7.972 2.370 1.00 0.00 H new ATOM 0 HB2 ARG A 132 1.314 -8.039 -0.109 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.323 -7.431 1.189 1.00 0.00 H new ATOM 0 HG2 ARG A 132 0.899 -9.673 2.238 1.00 0.00 H new ATOM 0 HG3 ARG A 132 1.490 -10.143 0.656 1.00 0.00 H new ATOM 0 HD2 ARG A 132 3.777 -9.487 1.264 1.00 0.00 H new ATOM 0 HD3 ARG A 132 3.224 -8.865 2.806 1.00 0.00 H new ATOM 0 HE ARG A 132 3.727 -11.653 2.118 1.00 0.00 H new ATOM 0 HH11 ARG A 132 1.891 -9.477 4.215 1.00 0.00 H new ATOM 0 HH12 ARG A 132 1.684 -10.690 5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 132 3.456 -13.198 3.753 1.00 0.00 H new ATOM 0 HH22 ARG A 132 2.566 -12.785 5.222 1.00 0.00 H new ATOM 100 N GLU A 133 0.774 -6.023 3.562 1.00 0.00 N ATOM 101 CA GLU A 133 1.171 -4.831 4.301 1.00 0.00 C ATOM 102 C GLU A 133 2.622 -4.466 4.003 1.00 0.00 C ATOM 103 O GLU A 133 3.479 -5.340 3.875 1.00 0.00 O ATOM 104 CB GLU A 133 0.985 -5.052 5.802 1.00 0.00 C ATOM 105 CG GLU A 133 1.666 -6.310 6.319 1.00 0.00 C ATOM 106 CD GLU A 133 2.152 -6.166 7.748 1.00 0.00 C ATOM 107 OE1 GLU A 133 1.581 -5.336 8.487 1.00 0.00 O ATOM 108 OE2 GLU A 133 3.099 -6.883 8.128 1.00 0.00 O ATOM 0 H GLU A 133 0.619 -6.847 4.143 1.00 0.00 H new ATOM 0 HA GLU A 133 0.535 -4.005 3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 133 1.377 -4.189 6.340 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -0.081 -5.108 6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.970 -7.146 6.259 1.00 0.00 H new ATOM 0 HG3 GLU A 133 2.511 -6.552 5.675 1.00 0.00 H new ATOM 115 N GLY A 134 2.889 -3.169 3.893 1.00 0.00 N ATOM 116 CA GLY A 134 4.237 -2.712 3.610 1.00 0.00 C ATOM 117 C GLY A 134 4.520 -2.605 2.121 1.00 0.00 C ATOM 118 O GLY A 134 5.561 -2.085 1.720 1.00 0.00 O ATOM 0 H GLY A 134 2.197 -2.427 3.995 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.391 -1.739 4.076 1.00 0.00 H new ATOM 0 HA3 GLY A 134 4.952 -3.399 4.063 1.00 0.00 H new ATOM 122 N ASP A 135 3.597 -3.099 1.302 1.00 0.00 N ATOM 123 CA ASP A 135 3.757 -3.056 -0.147 1.00 0.00 C ATOM 124 C ASP A 135 3.962 -1.624 -0.633 1.00 0.00 C ATOM 125 O ASP A 135 3.696 -0.667 0.094 1.00 0.00 O ATOM 126 CB ASP A 135 2.536 -3.668 -0.835 1.00 0.00 C ATOM 127 CG ASP A 135 2.875 -4.284 -2.177 1.00 0.00 C ATOM 128 OD1 ASP A 135 2.856 -3.552 -3.189 1.00 0.00 O ATOM 129 OD2 ASP A 135 3.160 -5.499 -2.218 1.00 0.00 O ATOM 0 H ASP A 135 2.730 -3.534 1.617 1.00 0.00 H new ATOM 0 HA ASP A 135 4.642 -3.638 -0.405 1.00 0.00 H new ATOM 0 HB2 ASP A 135 2.102 -4.430 -0.188 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.777 -2.898 -0.973 1.00 0.00 H new ATOM 134 N GLN A 136 4.439 -1.487 -1.867 1.00 0.00 N ATOM 135 CA GLN A 136 4.683 -0.172 -2.450 1.00 0.00 C ATOM 136 C GLN A 136 3.594 0.190 -3.457 1.00 0.00 C ATOM 137 O GLN A 136 3.212 -0.627 -4.294 1.00 0.00 O ATOM 138 CB GLN A 136 6.052 -0.139 -3.131 1.00 0.00 C ATOM 139 CG GLN A 136 7.214 -0.323 -2.168 1.00 0.00 C ATOM 140 CD GLN A 136 8.189 -1.392 -2.626 1.00 0.00 C ATOM 141 OE1 GLN A 136 9.398 -1.165 -2.677 1.00 0.00 O ATOM 142 NE2 GLN A 136 7.665 -2.564 -2.964 1.00 0.00 N ATOM 0 H GLN A 136 4.664 -2.269 -2.481 1.00 0.00 H new ATOM 0 HA GLN A 136 4.666 0.562 -1.644 1.00 0.00 H new ATOM 0 HB2 GLN A 136 6.091 -0.922 -3.888 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.168 0.813 -3.650 1.00 0.00 H new ATOM 0 HG2 GLN A 136 7.744 0.623 -2.059 1.00 0.00 H new ATOM 0 HG3 GLN A 136 6.827 -0.587 -1.184 1.00 0.00 H new ATOM 0 HE21 GLN A 136 6.657 -2.708 -2.906 1.00 0.00 H new ATOM 0 HE22 GLN A 136 8.271 -3.321 -3.282 1.00 0.00 H new ATOM 151 N VAL A 137 3.103 1.422 -3.367 1.00 0.00 N ATOM 152 CA VAL A 137 2.061 1.900 -4.269 1.00 0.00 C ATOM 153 C VAL A 137 2.299 3.356 -4.651 1.00 0.00 C ATOM 154 O VAL A 137 2.546 4.199 -3.789 1.00 0.00 O ATOM 155 CB VAL A 137 0.666 1.771 -3.630 1.00 0.00 C ATOM 156 CG1 VAL A 137 0.288 0.306 -3.455 1.00 0.00 C ATOM 157 CG2 VAL A 137 0.619 2.504 -2.298 1.00 0.00 C ATOM 0 H VAL A 137 3.410 2.108 -2.678 1.00 0.00 H new ATOM 0 HA VAL A 137 2.102 1.278 -5.163 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.062 2.231 -4.298 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.701 0.237 -3.002 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.277 -0.186 -4.428 1.00 0.00 H new ATOM 0 HG13 VAL A 137 1.018 -0.183 -2.810 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.374 2.402 -1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 137 1.359 2.076 -1.621 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.839 3.560 -2.456 1.00 0.00 H new ATOM 167 N ARG A 138 2.226 3.648 -5.946 1.00 0.00 N ATOM 168 CA ARG A 138 2.436 5.009 -6.429 1.00 0.00 C ATOM 169 C ARG A 138 1.184 5.855 -6.237 1.00 0.00 C ATOM 170 O ARG A 138 0.093 5.331 -6.006 1.00 0.00 O ATOM 171 CB ARG A 138 2.842 5.005 -7.905 1.00 0.00 C ATOM 172 CG ARG A 138 4.106 5.805 -8.193 1.00 0.00 C ATOM 173 CD ARG A 138 5.014 5.082 -9.175 1.00 0.00 C ATOM 174 NE ARG A 138 4.524 5.180 -10.547 1.00 0.00 N ATOM 175 CZ ARG A 138 5.277 4.954 -11.621 1.00 0.00 C ATOM 176 NH1 ARG A 138 6.554 4.619 -11.486 1.00 0.00 N ATOM 177 NH2 ARG A 138 4.753 5.064 -12.834 1.00 0.00 N ATOM 0 H ARG A 138 2.024 2.965 -6.676 1.00 0.00 H new ATOM 0 HA ARG A 138 3.244 5.447 -5.844 1.00 0.00 H new ATOM 0 HB2 ARG A 138 2.992 3.975 -8.229 1.00 0.00 H new ATOM 0 HB3 ARG A 138 2.023 5.410 -8.499 1.00 0.00 H new ATOM 0 HG2 ARG A 138 3.836 6.781 -8.597 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.644 5.983 -7.262 1.00 0.00 H new ATOM 0 HD2 ARG A 138 6.018 5.503 -9.118 1.00 0.00 H new ATOM 0 HD3 ARG A 138 5.092 4.032 -8.892 1.00 0.00 H new ATOM 0 HE ARG A 138 3.547 5.437 -10.691 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.963 4.534 -10.556 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.126 4.447 -12.313 1.00 0.00 H new ATOM 0 HH21 ARG A 138 3.772 5.322 -12.944 1.00 0.00 H new ATOM 0 HH22 ARG A 138 5.331 4.891 -13.657 1.00 0.00 H new ATOM 191 N VAL A 139 1.354 7.165 -6.334 1.00 0.00 N ATOM 192 CA VAL A 139 0.247 8.100 -6.171 1.00 0.00 C ATOM 193 C VAL A 139 -0.582 8.190 -7.451 1.00 0.00 C ATOM 194 O VAL A 139 -0.177 7.689 -8.499 1.00 0.00 O ATOM 195 CB VAL A 139 0.759 9.505 -5.795 1.00 0.00 C ATOM 196 CG1 VAL A 139 -0.369 10.363 -5.243 1.00 0.00 C ATOM 197 CG2 VAL A 139 1.900 9.409 -4.792 1.00 0.00 C ATOM 0 H VAL A 139 2.252 7.608 -6.526 1.00 0.00 H new ATOM 0 HA VAL A 139 -0.381 7.724 -5.363 1.00 0.00 H new ATOM 0 HB VAL A 139 1.136 9.982 -6.700 1.00 0.00 H new ATOM 0 HG11 VAL A 139 0.017 11.349 -4.985 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -1.151 10.465 -5.996 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -0.783 9.891 -4.352 1.00 0.00 H new ATOM 0 HG21 VAL A 139 2.248 10.411 -4.539 1.00 0.00 H new ATOM 0 HG22 VAL A 139 1.550 8.908 -3.890 1.00 0.00 H new ATOM 0 HG23 VAL A 139 2.721 8.839 -5.228 1.00 0.00 H new ATOM 207 N VAL A 140 -1.749 8.824 -7.358 1.00 0.00 N ATOM 208 CA VAL A 140 -2.633 8.964 -8.513 1.00 0.00 C ATOM 209 C VAL A 140 -2.181 10.092 -9.439 1.00 0.00 C ATOM 210 O VAL A 140 -1.789 9.845 -10.579 1.00 0.00 O ATOM 211 CB VAL A 140 -4.103 9.210 -8.096 1.00 0.00 C ATOM 212 CG1 VAL A 140 -4.801 7.890 -7.816 1.00 0.00 C ATOM 213 CG2 VAL A 140 -4.199 10.140 -6.890 1.00 0.00 C ATOM 0 H VAL A 140 -2.103 9.247 -6.500 1.00 0.00 H new ATOM 0 HA VAL A 140 -2.575 8.017 -9.049 1.00 0.00 H new ATOM 0 HB VAL A 140 -4.607 9.703 -8.927 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.834 8.079 -7.524 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -4.785 7.272 -8.714 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -4.285 7.370 -7.009 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.246 10.288 -6.627 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -3.673 9.696 -6.045 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -3.747 11.101 -7.135 1.00 0.00 H new ATOM 223 N SER A 141 -2.241 11.329 -8.954 1.00 0.00 N ATOM 224 CA SER A 141 -1.837 12.479 -9.755 1.00 0.00 C ATOM 225 C SER A 141 -1.530 13.681 -8.866 1.00 0.00 C ATOM 226 O SER A 141 -1.358 13.541 -7.654 1.00 0.00 O ATOM 227 CB SER A 141 -2.939 12.835 -10.756 1.00 0.00 C ATOM 228 OG SER A 141 -2.387 13.237 -11.998 1.00 0.00 O ATOM 0 H SER A 141 -2.564 11.560 -8.014 1.00 0.00 H new ATOM 0 HA SER A 141 -0.930 12.215 -10.299 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.591 11.975 -10.905 1.00 0.00 H new ATOM 0 HB3 SER A 141 -3.557 13.637 -10.352 1.00 0.00 H new ATOM 0 HG SER A 141 -3.110 13.458 -12.621 1.00 0.00 H new ATOM 234 N GLY A 142 -1.462 14.861 -9.475 1.00 0.00 N ATOM 235 CA GLY A 142 -1.173 16.068 -8.723 1.00 0.00 C ATOM 236 C GLY A 142 0.312 16.261 -8.482 1.00 0.00 C ATOM 237 O GLY A 142 1.137 15.718 -9.216 1.00 0.00 O ATOM 0 H GLY A 142 -1.602 15.002 -10.475 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.565 16.930 -9.262 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -1.691 16.028 -7.765 1.00 0.00 H new ATOM 241 N PRO A 143 0.686 17.034 -7.449 1.00 0.00 N ATOM 242 CA PRO A 143 2.094 17.287 -7.121 1.00 0.00 C ATOM 243 C PRO A 143 2.800 16.047 -6.580 1.00 0.00 C ATOM 244 O PRO A 143 4.022 16.035 -6.431 1.00 0.00 O ATOM 245 CB PRO A 143 2.018 18.371 -6.045 1.00 0.00 C ATOM 246 CG PRO A 143 0.680 18.193 -5.419 1.00 0.00 C ATOM 247 CD PRO A 143 -0.231 17.718 -6.518 1.00 0.00 C ATOM 0 HA PRO A 143 2.669 17.578 -8.000 1.00 0.00 H new ATOM 0 HB2 PRO A 143 2.816 18.257 -5.311 1.00 0.00 H new ATOM 0 HB3 PRO A 143 2.123 19.366 -6.478 1.00 0.00 H new ATOM 0 HG2 PRO A 143 0.723 17.468 -4.606 1.00 0.00 H new ATOM 0 HG3 PRO A 143 0.321 19.129 -4.992 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.998 17.042 -6.140 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -0.747 18.549 -7.000 1.00 0.00 H new ATOM 255 N PHE A 144 2.027 15.005 -6.284 1.00 0.00 N ATOM 256 CA PHE A 144 2.587 13.765 -5.755 1.00 0.00 C ATOM 257 C PHE A 144 2.491 12.636 -6.777 1.00 0.00 C ATOM 258 O PHE A 144 2.565 11.465 -6.416 1.00 0.00 O ATOM 259 CB PHE A 144 1.856 13.346 -4.476 1.00 0.00 C ATOM 260 CG PHE A 144 1.402 14.497 -3.622 1.00 0.00 C ATOM 261 CD1 PHE A 144 2.296 15.158 -2.796 1.00 0.00 C ATOM 262 CD2 PHE A 144 0.082 14.911 -3.645 1.00 0.00 C ATOM 263 CE1 PHE A 144 1.879 16.213 -2.007 1.00 0.00 C ATOM 264 CE2 PHE A 144 -0.343 15.965 -2.860 1.00 0.00 C ATOM 265 CZ PHE A 144 0.557 16.619 -2.039 1.00 0.00 C ATOM 0 H PHE A 144 1.014 14.995 -6.401 1.00 0.00 H new ATOM 0 HA PHE A 144 3.637 13.952 -5.531 1.00 0.00 H new ATOM 0 HB2 PHE A 144 0.988 12.745 -4.747 1.00 0.00 H new ATOM 0 HB3 PHE A 144 2.515 12.708 -3.887 1.00 0.00 H new ATOM 0 HD1 PHE A 144 3.329 14.846 -2.768 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -0.625 14.404 -4.285 1.00 0.00 H new ATOM 0 HE1 PHE A 144 2.585 16.720 -1.366 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -1.376 16.278 -2.887 1.00 0.00 H new ATOM 0 HZ PHE A 144 0.229 17.444 -1.425 1.00 0.00 H new ATOM 275 N ALA A 145 2.322 12.986 -8.049 1.00 0.00 N ATOM 276 CA ALA A 145 2.204 11.981 -9.105 1.00 0.00 C ATOM 277 C ALA A 145 3.560 11.409 -9.513 1.00 0.00 C ATOM 278 O ALA A 145 3.797 11.136 -10.692 1.00 0.00 O ATOM 279 CB ALA A 145 1.497 12.574 -10.315 1.00 0.00 C ATOM 0 H ALA A 145 2.264 13.951 -8.374 1.00 0.00 H new ATOM 0 HA ALA A 145 1.613 11.157 -8.706 1.00 0.00 H new ATOM 0 HB1 ALA A 145 1.414 11.817 -11.095 1.00 0.00 H new ATOM 0 HB2 ALA A 145 0.500 12.908 -10.027 1.00 0.00 H new ATOM 0 HB3 ALA A 145 2.069 13.422 -10.691 1.00 0.00 H new ATOM 285 N ASP A 146 4.442 11.217 -8.540 1.00 0.00 N ATOM 286 CA ASP A 146 5.762 10.662 -8.809 1.00 0.00 C ATOM 287 C ASP A 146 6.391 10.115 -7.535 1.00 0.00 C ATOM 288 O ASP A 146 7.601 10.212 -7.336 1.00 0.00 O ATOM 289 CB ASP A 146 6.673 11.721 -9.433 1.00 0.00 C ATOM 290 CG ASP A 146 6.629 13.036 -8.681 1.00 0.00 C ATOM 291 OD1 ASP A 146 7.379 13.181 -7.693 1.00 0.00 O ATOM 292 OD2 ASP A 146 5.845 13.923 -9.081 1.00 0.00 O ATOM 0 H ASP A 146 4.267 11.437 -7.559 1.00 0.00 H new ATOM 0 HA ASP A 146 5.644 9.840 -9.515 1.00 0.00 H new ATOM 0 HB2 ASP A 146 7.698 11.350 -9.451 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.376 11.887 -10.468 1.00 0.00 H new ATOM 297 N PHE A 147 5.561 9.541 -6.675 1.00 0.00 N ATOM 298 CA PHE A 147 6.037 8.980 -5.418 1.00 0.00 C ATOM 299 C PHE A 147 5.216 7.759 -5.020 1.00 0.00 C ATOM 300 O PHE A 147 4.119 7.543 -5.533 1.00 0.00 O ATOM 301 CB PHE A 147 5.974 10.032 -4.308 1.00 0.00 C ATOM 302 CG PHE A 147 6.799 11.255 -4.594 1.00 0.00 C ATOM 303 CD1 PHE A 147 8.162 11.149 -4.819 1.00 0.00 C ATOM 304 CD2 PHE A 147 6.212 12.509 -4.637 1.00 0.00 C ATOM 305 CE1 PHE A 147 8.925 12.272 -5.080 1.00 0.00 C ATOM 306 CE2 PHE A 147 6.968 13.635 -4.897 1.00 0.00 C ATOM 307 CZ PHE A 147 8.327 13.516 -5.120 1.00 0.00 C ATOM 0 H PHE A 147 4.556 9.452 -6.824 1.00 0.00 H new ATOM 0 HA PHE A 147 7.072 8.670 -5.559 1.00 0.00 H new ATOM 0 HB2 PHE A 147 4.936 10.330 -4.159 1.00 0.00 H new ATOM 0 HB3 PHE A 147 6.314 9.584 -3.374 1.00 0.00 H new ATOM 0 HD1 PHE A 147 8.634 10.178 -4.790 1.00 0.00 H new ATOM 0 HD2 PHE A 147 5.150 12.607 -4.465 1.00 0.00 H new ATOM 0 HE1 PHE A 147 9.987 12.176 -5.252 1.00 0.00 H new ATOM 0 HE2 PHE A 147 6.498 14.607 -4.926 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.920 14.395 -5.325 1.00 0.00 H new ATOM 317 N THR A 148 5.756 6.965 -4.102 1.00 0.00 N ATOM 318 CA THR A 148 5.074 5.767 -3.635 1.00 0.00 C ATOM 319 C THR A 148 4.779 5.860 -2.142 1.00 0.00 C ATOM 320 O THR A 148 5.063 6.874 -1.505 1.00 0.00 O ATOM 321 CB THR A 148 5.920 4.526 -3.924 1.00 0.00 C ATOM 322 OG1 THR A 148 7.300 4.820 -3.796 1.00 0.00 O ATOM 323 CG2 THR A 148 5.700 3.959 -5.309 1.00 0.00 C ATOM 0 H THR A 148 6.664 7.131 -3.667 1.00 0.00 H new ATOM 0 HA THR A 148 4.128 5.684 -4.171 1.00 0.00 H new ATOM 0 HB THR A 148 5.603 3.784 -3.191 1.00 0.00 H new ATOM 0 HG1 THR A 148 7.825 4.014 -3.983 1.00 0.00 H new ATOM 0 HG21 THR A 148 6.331 3.081 -5.447 1.00 0.00 H new ATOM 0 HG22 THR A 148 4.654 3.676 -5.424 1.00 0.00 H new ATOM 0 HG23 THR A 148 5.957 4.711 -6.055 1.00 0.00 H new ATOM 331 N GLY A 149 4.210 4.795 -1.588 1.00 0.00 N ATOM 332 CA GLY A 149 3.888 4.778 -0.175 1.00 0.00 C ATOM 333 C GLY A 149 4.007 3.394 0.431 1.00 0.00 C ATOM 334 O GLY A 149 3.674 2.397 -0.209 1.00 0.00 O ATOM 0 H GLY A 149 3.966 3.943 -2.093 1.00 0.00 H new ATOM 0 HA2 GLY A 149 4.553 5.461 0.354 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.872 5.147 -0.033 1.00 0.00 H new ATOM 338 N THR A 150 4.482 3.335 1.671 1.00 0.00 N ATOM 339 CA THR A 150 4.644 2.065 2.369 1.00 0.00 C ATOM 340 C THR A 150 3.482 1.822 3.326 1.00 0.00 C ATOM 341 O THR A 150 3.415 2.420 4.401 1.00 0.00 O ATOM 342 CB THR A 150 5.965 2.046 3.138 1.00 0.00 C ATOM 343 OG1 THR A 150 6.974 2.732 2.420 1.00 0.00 O ATOM 344 CG2 THR A 150 6.474 0.648 3.421 1.00 0.00 C ATOM 0 H THR A 150 4.762 4.152 2.213 1.00 0.00 H new ATOM 0 HA THR A 150 4.654 1.268 1.626 1.00 0.00 H new ATOM 0 HB THR A 150 5.752 2.537 4.087 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.811 2.710 2.930 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.414 0.707 3.969 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.740 0.107 4.018 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.635 0.122 2.480 1.00 0.00 H new ATOM 352 N VAL A 151 2.567 0.944 2.928 1.00 0.00 N ATOM 353 CA VAL A 151 1.407 0.625 3.752 1.00 0.00 C ATOM 354 C VAL A 151 1.829 0.040 5.096 1.00 0.00 C ATOM 355 O VAL A 151 2.592 -0.924 5.152 1.00 0.00 O ATOM 356 CB VAL A 151 0.469 -0.370 3.041 1.00 0.00 C ATOM 357 CG1 VAL A 151 -0.804 -0.575 3.849 1.00 0.00 C ATOM 358 CG2 VAL A 151 0.145 0.109 1.635 1.00 0.00 C ATOM 0 H VAL A 151 2.606 0.441 2.041 1.00 0.00 H new ATOM 0 HA VAL A 151 0.872 1.560 3.920 1.00 0.00 H new ATOM 0 HB VAL A 151 0.981 -1.329 2.963 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -1.454 -1.281 3.331 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -0.551 -0.970 4.833 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -1.321 0.378 3.962 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.518 -0.607 1.150 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -0.346 1.081 1.686 1.00 0.00 H new ATOM 0 HG23 VAL A 151 1.066 0.197 1.059 1.00 0.00 H new ATOM 368 N THR A 152 1.325 0.630 6.175 1.00 0.00 N ATOM 369 CA THR A 152 1.646 0.168 7.519 1.00 0.00 C ATOM 370 C THR A 152 0.421 -0.443 8.190 1.00 0.00 C ATOM 371 O THR A 152 0.533 -1.391 8.969 1.00 0.00 O ATOM 372 CB THR A 152 2.179 1.325 8.366 1.00 0.00 C ATOM 373 OG1 THR A 152 1.487 2.525 8.068 1.00 0.00 O ATOM 374 CG2 THR A 152 3.656 1.587 8.164 1.00 0.00 C ATOM 0 H THR A 152 0.692 1.429 6.144 1.00 0.00 H new ATOM 0 HA THR A 152 2.416 -0.599 7.438 1.00 0.00 H new ATOM 0 HB THR A 152 2.019 1.021 9.400 1.00 0.00 H new ATOM 0 HG1 THR A 152 1.841 3.253 8.621 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.967 2.420 8.795 1.00 0.00 H new ATOM 0 HG22 THR A 152 4.224 0.696 8.433 1.00 0.00 H new ATOM 0 HG23 THR A 152 3.842 1.834 7.119 1.00 0.00 H new ATOM 382 N GLU A 153 -0.751 0.105 7.882 1.00 0.00 N ATOM 383 CA GLU A 153 -1.999 -0.386 8.452 1.00 0.00 C ATOM 384 C GLU A 153 -3.081 -0.491 7.382 1.00 0.00 C ATOM 385 O GLU A 153 -3.009 0.169 6.346 1.00 0.00 O ATOM 386 CB GLU A 153 -2.466 0.538 9.578 1.00 0.00 C ATOM 387 CG GLU A 153 -1.889 0.178 10.938 1.00 0.00 C ATOM 388 CD GLU A 153 -1.001 1.270 11.503 1.00 0.00 C ATOM 389 OE1 GLU A 153 0.072 1.525 10.918 1.00 0.00 O ATOM 390 OE2 GLU A 153 -1.378 1.870 12.532 1.00 0.00 O ATOM 0 H GLU A 153 -0.861 0.890 7.240 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.818 -1.381 8.859 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -2.188 1.563 9.334 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -3.554 0.507 9.634 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -2.705 -0.018 11.634 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -1.314 -0.744 10.852 1.00 0.00 H new ATOM 397 N ILE A 154 -4.084 -1.326 7.639 1.00 0.00 N ATOM 398 CA ILE A 154 -5.179 -1.515 6.696 1.00 0.00 C ATOM 399 C ILE A 154 -6.522 -1.593 7.416 1.00 0.00 C ATOM 400 O ILE A 154 -6.648 -2.260 8.442 1.00 0.00 O ATOM 401 CB ILE A 154 -4.986 -2.794 5.859 1.00 0.00 C ATOM 402 CG1 ILE A 154 -4.784 -4.003 6.775 1.00 0.00 C ATOM 403 CG2 ILE A 154 -3.805 -2.636 4.913 1.00 0.00 C ATOM 404 CD1 ILE A 154 -4.640 -5.310 6.026 1.00 0.00 C ATOM 0 H ILE A 154 -4.160 -1.881 8.491 1.00 0.00 H new ATOM 0 HA ILE A 154 -5.175 -0.650 6.033 1.00 0.00 H new ATOM 0 HB ILE A 154 -5.883 -2.959 5.263 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -3.895 -3.843 7.384 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -5.630 -4.076 7.459 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -3.682 -3.548 4.329 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -3.986 -1.797 4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -2.899 -2.450 5.490 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -4.500 -6.124 6.738 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -5.539 -5.493 5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -3.777 -5.256 5.362 1.00 0.00 H new ATOM 416 N ASN A 155 -7.520 -0.908 6.870 1.00 0.00 N ATOM 417 CA ASN A 155 -8.855 -0.898 7.457 1.00 0.00 C ATOM 418 C ASN A 155 -9.886 -1.449 6.474 1.00 0.00 C ATOM 419 O ASN A 155 -10.540 -0.689 5.760 1.00 0.00 O ATOM 420 CB ASN A 155 -9.241 0.522 7.875 1.00 0.00 C ATOM 421 CG ASN A 155 -8.443 1.013 9.067 1.00 0.00 C ATOM 422 OD1 ASN A 155 -7.292 1.427 8.930 1.00 0.00 O ATOM 423 ND2 ASN A 155 -9.053 0.969 10.246 1.00 0.00 N ATOM 0 H ASN A 155 -7.430 -0.351 6.020 1.00 0.00 H new ATOM 0 HA ASN A 155 -8.841 -1.538 8.339 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -9.087 1.199 7.035 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -10.304 0.550 8.117 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -8.566 1.286 11.084 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -10.008 0.618 10.313 1.00 0.00 H new ATOM 430 N PRO A 156 -10.044 -2.781 6.424 1.00 0.00 N ATOM 431 CA PRO A 156 -11.002 -3.429 5.520 1.00 0.00 C ATOM 432 C PRO A 156 -12.416 -2.883 5.684 1.00 0.00 C ATOM 433 O PRO A 156 -13.219 -2.922 4.751 1.00 0.00 O ATOM 434 CB PRO A 156 -10.949 -4.902 5.934 1.00 0.00 C ATOM 435 CG PRO A 156 -9.612 -5.072 6.569 1.00 0.00 C ATOM 436 CD PRO A 156 -9.305 -3.762 7.239 1.00 0.00 C ATOM 0 HA PRO A 156 -10.749 -3.258 4.474 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -11.751 -5.146 6.630 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -11.064 -5.559 5.072 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -9.624 -5.887 7.292 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -8.854 -5.317 5.825 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -9.637 -3.754 8.277 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -8.235 -3.555 7.245 1.00 0.00 H new ATOM 444 N GLU A 157 -12.716 -2.373 6.875 1.00 0.00 N ATOM 445 CA GLU A 157 -14.035 -1.820 7.161 1.00 0.00 C ATOM 446 C GLU A 157 -14.366 -0.678 6.204 1.00 0.00 C ATOM 447 O GLU A 157 -15.190 -0.829 5.301 1.00 0.00 O ATOM 448 CB GLU A 157 -14.101 -1.328 8.609 1.00 0.00 C ATOM 449 CG GLU A 157 -15.236 -1.947 9.410 1.00 0.00 C ATOM 450 CD GLU A 157 -16.001 -0.922 10.224 1.00 0.00 C ATOM 451 OE1 GLU A 157 -16.654 -0.048 9.616 1.00 0.00 O ATOM 452 OE2 GLU A 157 -15.948 -0.994 11.470 1.00 0.00 O ATOM 0 H GLU A 157 -12.063 -2.331 7.657 1.00 0.00 H new ATOM 0 HA GLU A 157 -14.772 -2.610 7.020 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -13.155 -1.550 9.103 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -14.215 -0.244 8.611 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -15.923 -2.452 8.730 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -14.832 -2.708 10.078 1.00 0.00 H new ATOM 459 N ARG A 158 -13.719 0.465 6.410 1.00 0.00 N ATOM 460 CA ARG A 158 -13.946 1.633 5.566 1.00 0.00 C ATOM 461 C ARG A 158 -13.172 1.517 4.256 1.00 0.00 C ATOM 462 O ARG A 158 -13.601 2.031 3.223 1.00 0.00 O ATOM 463 CB ARG A 158 -13.533 2.907 6.305 1.00 0.00 C ATOM 464 CG ARG A 158 -14.294 3.133 7.600 1.00 0.00 C ATOM 465 CD ARG A 158 -13.706 4.285 8.399 1.00 0.00 C ATOM 466 NE ARG A 158 -13.761 4.039 9.837 1.00 0.00 N ATOM 467 CZ ARG A 158 -13.066 3.088 10.455 1.00 0.00 C ATOM 468 NH1 ARG A 158 -12.259 2.291 9.763 1.00 0.00 N ATOM 469 NH2 ARG A 158 -13.173 2.933 11.768 1.00 0.00 N ATOM 0 H ARG A 158 -13.035 0.607 7.153 1.00 0.00 H new ATOM 0 HA ARG A 158 -15.010 1.683 5.334 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -12.466 2.860 6.524 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -13.687 3.764 5.649 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -15.340 3.341 7.377 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -14.271 2.223 8.200 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.670 4.443 8.098 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -14.249 5.201 8.167 1.00 0.00 H new ATOM 0 HE ARG A 158 -14.369 4.632 10.402 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -12.170 2.407 8.754 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -11.728 1.563 10.241 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -13.789 3.543 12.305 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -12.639 2.203 12.241 1.00 0.00 H new ATOM 483 N GLY A 159 -12.031 0.838 4.306 1.00 0.00 N ATOM 484 CA GLY A 159 -11.216 0.666 3.118 1.00 0.00 C ATOM 485 C GLY A 159 -10.139 1.725 2.998 1.00 0.00 C ATOM 486 O GLY A 159 -9.952 2.313 1.933 1.00 0.00 O ATOM 0 H GLY A 159 -11.656 0.403 5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -10.752 -0.320 3.139 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -11.854 0.699 2.235 1.00 0.00 H new ATOM 490 N LYS A 160 -9.426 1.970 4.094 1.00 0.00 N ATOM 491 CA LYS A 160 -8.362 2.967 4.108 1.00 0.00 C ATOM 492 C LYS A 160 -6.990 2.298 4.126 1.00 0.00 C ATOM 493 O LYS A 160 -6.861 1.131 4.495 1.00 0.00 O ATOM 494 CB LYS A 160 -8.513 3.888 5.320 1.00 0.00 C ATOM 495 CG LYS A 160 -9.077 5.257 4.977 1.00 0.00 C ATOM 496 CD LYS A 160 -9.262 6.112 6.220 1.00 0.00 C ATOM 497 CE LYS A 160 -10.468 7.028 6.092 1.00 0.00 C ATOM 498 NZ LYS A 160 -10.452 8.113 7.112 1.00 0.00 N ATOM 0 H LYS A 160 -9.567 1.491 4.984 1.00 0.00 H new ATOM 0 HA LYS A 160 -8.443 3.562 3.198 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -9.164 3.409 6.051 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -7.540 4.014 5.794 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -8.407 5.764 4.282 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.034 5.140 4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -9.384 5.468 7.091 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -8.366 6.710 6.388 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -10.486 7.468 5.095 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -11.381 6.443 6.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -11.108 8.868 6.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -10.747 7.729 8.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -9.490 8.501 7.191 1.00 0.00 H new ATOM 512 N VAL A 161 -5.968 3.048 3.725 1.00 0.00 N ATOM 513 CA VAL A 161 -4.606 2.531 3.695 1.00 0.00 C ATOM 514 C VAL A 161 -3.601 3.605 4.096 1.00 0.00 C ATOM 515 O VAL A 161 -3.466 4.625 3.421 1.00 0.00 O ATOM 516 CB VAL A 161 -4.236 1.996 2.299 1.00 0.00 C ATOM 517 CG1 VAL A 161 -4.908 0.655 2.044 1.00 0.00 C ATOM 518 CG2 VAL A 161 -4.613 3.004 1.223 1.00 0.00 C ATOM 0 H VAL A 161 -6.058 4.016 3.416 1.00 0.00 H new ATOM 0 HA VAL A 161 -4.565 1.711 4.412 1.00 0.00 H new ATOM 0 HB VAL A 161 -3.157 1.847 2.262 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -4.634 0.294 1.053 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -4.582 -0.064 2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -5.990 0.774 2.101 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -4.344 2.608 0.244 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -5.687 3.188 1.257 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.079 3.938 1.396 1.00 0.00 H new ATOM 528 N LYS A 162 -2.900 3.371 5.200 1.00 0.00 N ATOM 529 CA LYS A 162 -1.906 4.319 5.689 1.00 0.00 C ATOM 530 C LYS A 162 -0.530 4.008 5.111 1.00 0.00 C ATOM 531 O LYS A 162 0.080 2.992 5.445 1.00 0.00 O ATOM 532 CB LYS A 162 -1.852 4.288 7.217 1.00 0.00 C ATOM 533 CG LYS A 162 -0.992 5.388 7.817 1.00 0.00 C ATOM 534 CD LYS A 162 -1.468 5.770 9.209 1.00 0.00 C ATOM 535 CE LYS A 162 -0.514 6.747 9.877 1.00 0.00 C ATOM 536 NZ LYS A 162 -0.935 8.161 9.671 1.00 0.00 N ATOM 0 H LYS A 162 -3.002 2.533 5.773 1.00 0.00 H new ATOM 0 HA LYS A 162 -2.198 5.317 5.364 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -2.865 4.375 7.610 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -1.467 3.321 7.539 1.00 0.00 H new ATOM 0 HG2 LYS A 162 0.045 5.056 7.864 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -1.017 6.265 7.170 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -2.461 6.216 9.145 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -1.560 4.873 9.822 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -0.465 6.534 10.945 1.00 0.00 H new ATOM 0 HE3 LYS A 162 0.490 6.605 9.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -0.341 8.788 10.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -0.828 8.413 8.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -1.931 8.271 9.951 1.00 0.00 H new ATOM 550 N VAL A 163 -0.046 4.889 4.243 1.00 0.00 N ATOM 551 CA VAL A 163 1.259 4.708 3.617 1.00 0.00 C ATOM 552 C VAL A 163 2.200 5.859 3.962 1.00 0.00 C ATOM 553 O VAL A 163 1.763 6.994 4.153 1.00 0.00 O ATOM 554 CB VAL A 163 1.139 4.596 2.086 1.00 0.00 C ATOM 555 CG1 VAL A 163 0.281 3.400 1.700 1.00 0.00 C ATOM 556 CG2 VAL A 163 0.572 5.879 1.496 1.00 0.00 C ATOM 0 H VAL A 163 -0.537 5.736 3.957 1.00 0.00 H new ATOM 0 HA VAL A 163 1.670 3.778 4.009 1.00 0.00 H new ATOM 0 HB VAL A 163 2.137 4.445 1.676 1.00 0.00 H new ATOM 0 HG11 VAL A 163 0.209 3.339 0.614 1.00 0.00 H new ATOM 0 HG12 VAL A 163 0.735 2.487 2.085 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -0.717 3.516 2.124 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.495 5.779 0.413 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -0.417 6.066 1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 163 1.231 6.713 1.737 1.00 0.00 H new ATOM 566 N MET A 164 3.492 5.557 4.035 1.00 0.00 N ATOM 567 CA MET A 164 4.494 6.568 4.352 1.00 0.00 C ATOM 568 C MET A 164 5.103 7.145 3.077 1.00 0.00 C ATOM 569 O MET A 164 5.771 6.439 2.323 1.00 0.00 O ATOM 570 CB MET A 164 5.592 5.970 5.235 1.00 0.00 C ATOM 571 CG MET A 164 6.432 4.913 4.538 1.00 0.00 C ATOM 572 SD MET A 164 8.063 5.520 4.065 1.00 0.00 S ATOM 573 CE MET A 164 9.023 5.065 5.509 1.00 0.00 C ATOM 0 H MET A 164 3.869 4.622 3.879 1.00 0.00 H new ATOM 0 HA MET A 164 4.003 7.375 4.896 1.00 0.00 H new ATOM 0 HB2 MET A 164 6.246 6.772 5.579 1.00 0.00 H new ATOM 0 HB3 MET A 164 5.134 5.530 6.121 1.00 0.00 H new ATOM 0 HG2 MET A 164 6.546 4.053 5.197 1.00 0.00 H new ATOM 0 HG3 MET A 164 5.906 4.565 3.649 1.00 0.00 H new ATOM 0 HE1 MET A 164 10.059 5.375 5.370 1.00 0.00 H new ATOM 0 HE2 MET A 164 8.612 5.559 6.390 1.00 0.00 H new ATOM 0 HE3 MET A 164 8.983 3.985 5.647 1.00 0.00 H new ATOM 583 N VAL A 165 4.862 8.431 2.843 1.00 0.00 N ATOM 584 CA VAL A 165 5.383 9.105 1.660 1.00 0.00 C ATOM 585 C VAL A 165 6.548 10.022 2.016 1.00 0.00 C ATOM 586 O VAL A 165 6.604 10.572 3.116 1.00 0.00 O ATOM 587 CB VAL A 165 4.289 9.932 0.960 1.00 0.00 C ATOM 588 CG1 VAL A 165 3.248 9.019 0.331 1.00 0.00 C ATOM 589 CG2 VAL A 165 3.639 10.899 1.939 1.00 0.00 C ATOM 0 H VAL A 165 4.309 9.027 3.458 1.00 0.00 H new ATOM 0 HA VAL A 165 5.732 8.327 0.981 1.00 0.00 H new ATOM 0 HB VAL A 165 4.755 10.515 0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 165 2.483 9.622 -0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 165 3.727 8.373 -0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 165 2.786 8.406 1.105 1.00 0.00 H new ATOM 0 HG21 VAL A 165 2.869 11.474 1.425 1.00 0.00 H new ATOM 0 HG22 VAL A 165 3.188 10.339 2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 165 4.394 11.577 2.336 1.00 0.00 H new ATOM 599 N THR A 166 7.477 10.182 1.079 1.00 0.00 N ATOM 600 CA THR A 166 8.642 11.033 1.294 1.00 0.00 C ATOM 601 C THR A 166 8.684 12.167 0.273 1.00 0.00 C ATOM 602 O THR A 166 9.338 12.059 -0.764 1.00 0.00 O ATOM 603 CB THR A 166 9.926 10.207 1.208 1.00 0.00 C ATOM 604 OG1 THR A 166 9.839 9.057 2.030 1.00 0.00 O ATOM 605 CG2 THR A 166 11.161 10.975 1.626 1.00 0.00 C ATOM 0 H THR A 166 7.446 9.734 0.163 1.00 0.00 H new ATOM 0 HA THR A 166 8.564 11.468 2.290 1.00 0.00 H new ATOM 0 HB THR A 166 10.024 9.936 0.157 1.00 0.00 H new ATOM 0 HG1 THR A 166 10.669 8.541 1.960 1.00 0.00 H new ATOM 0 HG21 THR A 166 12.036 10.331 1.541 1.00 0.00 H new ATOM 0 HG22 THR A 166 11.286 11.843 0.979 1.00 0.00 H new ATOM 0 HG23 THR A 166 11.052 11.305 2.659 1.00 0.00 H new ATOM 613 N ILE A 167 7.980 13.253 0.576 1.00 0.00 N ATOM 614 CA ILE A 167 7.936 14.407 -0.314 1.00 0.00 C ATOM 615 C ILE A 167 9.160 15.297 -0.120 1.00 0.00 C ATOM 616 O ILE A 167 9.380 15.840 0.961 1.00 0.00 O ATOM 617 CB ILE A 167 6.658 15.242 -0.091 1.00 0.00 C ATOM 618 CG1 ILE A 167 6.551 16.346 -1.145 1.00 0.00 C ATOM 619 CG2 ILE A 167 6.641 15.836 1.311 1.00 0.00 C ATOM 620 CD1 ILE A 167 5.745 15.945 -2.361 1.00 0.00 C ATOM 0 H ILE A 167 7.433 13.358 1.430 1.00 0.00 H new ATOM 0 HA ILE A 167 7.931 14.022 -1.334 1.00 0.00 H new ATOM 0 HB ILE A 167 5.795 14.583 -0.192 1.00 0.00 H new ATOM 0 HG12 ILE A 167 6.096 17.227 -0.692 1.00 0.00 H new ATOM 0 HG13 ILE A 167 7.554 16.633 -1.462 1.00 0.00 H new ATOM 0 HG21 ILE A 167 5.731 16.421 1.447 1.00 0.00 H new ATOM 0 HG22 ILE A 167 6.669 15.032 2.047 1.00 0.00 H new ATOM 0 HG23 ILE A 167 7.510 16.480 1.444 1.00 0.00 H new ATOM 0 HD11 ILE A 167 5.711 16.776 -3.065 1.00 0.00 H new ATOM 0 HD12 ILE A 167 6.211 15.083 -2.838 1.00 0.00 H new ATOM 0 HD13 ILE A 167 4.731 15.686 -2.056 1.00 0.00 H new ATOM 632 N PHE A 168 9.953 15.441 -1.177 1.00 0.00 N ATOM 633 CA PHE A 168 11.156 16.264 -1.125 1.00 0.00 C ATOM 634 C PHE A 168 12.129 15.738 -0.076 1.00 0.00 C ATOM 635 O PHE A 168 12.844 16.510 0.564 1.00 0.00 O ATOM 636 CB PHE A 168 10.790 17.717 -0.815 1.00 0.00 C ATOM 637 CG PHE A 168 9.927 18.355 -1.865 1.00 0.00 C ATOM 638 CD1 PHE A 168 10.224 18.206 -3.211 1.00 0.00 C ATOM 639 CD2 PHE A 168 8.816 19.104 -1.508 1.00 0.00 C ATOM 640 CE1 PHE A 168 9.432 18.792 -4.179 1.00 0.00 C ATOM 641 CE2 PHE A 168 8.020 19.691 -2.472 1.00 0.00 C ATOM 642 CZ PHE A 168 8.328 19.536 -3.810 1.00 0.00 C ATOM 0 H PHE A 168 9.784 14.998 -2.080 1.00 0.00 H new ATOM 0 HA PHE A 168 11.641 16.218 -2.100 1.00 0.00 H new ATOM 0 HB2 PHE A 168 10.272 17.756 0.143 1.00 0.00 H new ATOM 0 HB3 PHE A 168 11.705 18.299 -0.706 1.00 0.00 H new ATOM 0 HD1 PHE A 168 11.085 17.625 -3.506 1.00 0.00 H new ATOM 0 HD2 PHE A 168 8.570 19.230 -0.464 1.00 0.00 H new ATOM 0 HE1 PHE A 168 9.676 18.669 -5.224 1.00 0.00 H new ATOM 0 HE2 PHE A 168 7.157 20.271 -2.180 1.00 0.00 H new ATOM 0 HZ PHE A 168 7.707 19.995 -4.565 1.00 0.00 H new ATOM 652 N GLY A 169 12.153 14.421 0.096 1.00 0.00 N ATOM 653 CA GLY A 169 13.043 13.815 1.069 1.00 0.00 C ATOM 654 C GLY A 169 12.560 14.003 2.493 1.00 0.00 C ATOM 655 O GLY A 169 13.362 14.073 3.424 1.00 0.00 O ATOM 0 H GLY A 169 11.572 13.762 -0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 169 13.136 12.750 0.858 1.00 0.00 H new ATOM 0 HA3 GLY A 169 14.038 14.248 0.966 1.00 0.00 H new ATOM 659 N ARG A 170 11.245 14.084 2.662 1.00 0.00 N ATOM 660 CA ARG A 170 10.653 14.264 3.984 1.00 0.00 C ATOM 661 C ARG A 170 9.495 13.296 4.200 1.00 0.00 C ATOM 662 O ARG A 170 8.429 13.446 3.602 1.00 0.00 O ATOM 663 CB ARG A 170 10.165 15.704 4.156 1.00 0.00 C ATOM 664 CG ARG A 170 11.228 16.749 3.844 1.00 0.00 C ATOM 665 CD ARG A 170 10.762 17.723 2.772 1.00 0.00 C ATOM 666 NE ARG A 170 11.015 19.112 3.148 1.00 0.00 N ATOM 667 CZ ARG A 170 12.210 19.692 3.087 1.00 0.00 C ATOM 668 NH1 ARG A 170 13.267 19.007 2.667 1.00 0.00 N ATOM 669 NH2 ARG A 170 12.352 20.959 3.450 1.00 0.00 N ATOM 0 H ARG A 170 10.568 14.028 1.901 1.00 0.00 H new ATOM 0 HA ARG A 170 11.421 14.055 4.728 1.00 0.00 H new ATOM 0 HB2 ARG A 170 9.305 15.867 3.507 1.00 0.00 H new ATOM 0 HB3 ARG A 170 9.821 15.842 5.181 1.00 0.00 H new ATOM 0 HG2 ARG A 170 11.476 17.299 4.752 1.00 0.00 H new ATOM 0 HG3 ARG A 170 12.140 16.253 3.513 1.00 0.00 H new ATOM 0 HD2 ARG A 170 11.273 17.502 1.835 1.00 0.00 H new ATOM 0 HD3 ARG A 170 9.696 17.584 2.594 1.00 0.00 H new ATOM 0 HE ARG A 170 10.227 19.670 3.477 1.00 0.00 H new ATOM 0 HH11 ARG A 170 13.165 18.031 2.389 1.00 0.00 H new ATOM 0 HH12 ARG A 170 14.181 19.457 2.622 1.00 0.00 H new ATOM 0 HH21 ARG A 170 11.544 21.490 3.776 1.00 0.00 H new ATOM 0 HH22 ARG A 170 13.269 21.403 3.403 1.00 0.00 H new ATOM 683 N GLU A 171 9.710 12.303 5.057 1.00 0.00 N ATOM 684 CA GLU A 171 8.683 11.310 5.351 1.00 0.00 C ATOM 685 C GLU A 171 7.437 11.974 5.931 1.00 0.00 C ATOM 686 O GLU A 171 7.534 12.895 6.742 1.00 0.00 O ATOM 687 CB GLU A 171 9.220 10.264 6.328 1.00 0.00 C ATOM 688 CG GLU A 171 9.874 9.073 5.644 1.00 0.00 C ATOM 689 CD GLU A 171 11.323 8.886 6.054 1.00 0.00 C ATOM 690 OE1 GLU A 171 11.984 9.897 6.369 1.00 0.00 O ATOM 691 OE2 GLU A 171 11.793 7.730 6.061 1.00 0.00 O ATOM 0 H GLU A 171 10.586 12.165 5.560 1.00 0.00 H new ATOM 0 HA GLU A 171 8.410 10.817 4.418 1.00 0.00 H new ATOM 0 HB2 GLU A 171 9.946 10.736 6.990 1.00 0.00 H new ATOM 0 HB3 GLU A 171 8.401 9.909 6.954 1.00 0.00 H new ATOM 0 HG2 GLU A 171 9.313 8.169 5.883 1.00 0.00 H new ATOM 0 HG3 GLU A 171 9.820 9.205 4.563 1.00 0.00 H new ATOM 698 N THR A 172 6.270 11.500 5.512 1.00 0.00 N ATOM 699 CA THR A 172 5.007 12.050 5.989 1.00 0.00 C ATOM 700 C THR A 172 3.890 11.008 5.902 1.00 0.00 C ATOM 701 O THR A 172 3.447 10.657 4.809 1.00 0.00 O ATOM 702 CB THR A 172 4.627 13.288 5.175 1.00 0.00 C ATOM 703 OG1 THR A 172 5.671 14.244 5.205 1.00 0.00 O ATOM 704 CG2 THR A 172 3.368 13.967 5.666 1.00 0.00 C ATOM 0 H THR A 172 6.172 10.736 4.843 1.00 0.00 H new ATOM 0 HA THR A 172 5.135 12.334 7.034 1.00 0.00 H new ATOM 0 HB THR A 172 4.450 12.925 4.163 1.00 0.00 H new ATOM 0 HG1 THR A 172 5.411 15.028 4.678 1.00 0.00 H new ATOM 0 HG21 THR A 172 3.157 14.837 5.044 1.00 0.00 H new ATOM 0 HG22 THR A 172 2.532 13.269 5.609 1.00 0.00 H new ATOM 0 HG23 THR A 172 3.505 14.285 6.699 1.00 0.00 H new ATOM 712 N PRO A 173 3.416 10.500 7.054 1.00 0.00 N ATOM 713 CA PRO A 173 2.344 9.498 7.088 1.00 0.00 C ATOM 714 C PRO A 173 1.011 10.066 6.615 1.00 0.00 C ATOM 715 O PRO A 173 0.318 10.756 7.364 1.00 0.00 O ATOM 716 CB PRO A 173 2.265 9.103 8.565 1.00 0.00 C ATOM 717 CG PRO A 173 2.822 10.271 9.303 1.00 0.00 C ATOM 718 CD PRO A 173 3.879 10.857 8.408 1.00 0.00 C ATOM 0 HA PRO A 173 2.550 8.659 6.424 1.00 0.00 H new ATOM 0 HB2 PRO A 173 1.237 8.899 8.865 1.00 0.00 H new ATOM 0 HB3 PRO A 173 2.840 8.199 8.764 1.00 0.00 H new ATOM 0 HG2 PRO A 173 2.044 11.003 9.520 1.00 0.00 H new ATOM 0 HG3 PRO A 173 3.246 9.963 10.259 1.00 0.00 H new ATOM 0 HD2 PRO A 173 3.959 11.937 8.534 1.00 0.00 H new ATOM 0 HD3 PRO A 173 4.863 10.438 8.620 1.00 0.00 H new ATOM 726 N VAL A 174 0.659 9.776 5.366 1.00 0.00 N ATOM 727 CA VAL A 174 -0.590 10.260 4.792 1.00 0.00 C ATOM 728 C VAL A 174 -1.597 9.127 4.622 1.00 0.00 C ATOM 729 O VAL A 174 -1.282 8.086 4.045 1.00 0.00 O ATOM 730 CB VAL A 174 -0.353 10.940 3.427 1.00 0.00 C ATOM 731 CG1 VAL A 174 0.223 9.951 2.425 1.00 0.00 C ATOM 732 CG2 VAL A 174 -1.641 11.553 2.901 1.00 0.00 C ATOM 0 H VAL A 174 1.222 9.208 4.733 1.00 0.00 H new ATOM 0 HA VAL A 174 -0.995 10.994 5.489 1.00 0.00 H new ATOM 0 HB VAL A 174 0.372 11.742 3.567 1.00 0.00 H new ATOM 0 HG11 VAL A 174 0.382 10.452 1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 174 1.173 9.568 2.797 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -0.473 9.123 2.289 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -1.452 12.027 1.938 1.00 0.00 H new ATOM 0 HG22 VAL A 174 -2.392 10.773 2.780 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -2.004 12.299 3.608 1.00 0.00 H new ATOM 742 N GLU A 175 -2.809 9.340 5.123 1.00 0.00 N ATOM 743 CA GLU A 175 -3.864 8.337 5.023 1.00 0.00 C ATOM 744 C GLU A 175 -4.678 8.539 3.749 1.00 0.00 C ATOM 745 O GLU A 175 -5.229 9.614 3.515 1.00 0.00 O ATOM 746 CB GLU A 175 -4.781 8.403 6.246 1.00 0.00 C ATOM 747 CG GLU A 175 -5.250 9.810 6.580 1.00 0.00 C ATOM 748 CD GLU A 175 -6.359 9.823 7.615 1.00 0.00 C ATOM 749 OE1 GLU A 175 -7.437 9.256 7.337 1.00 0.00 O ATOM 750 OE2 GLU A 175 -6.149 10.400 8.702 1.00 0.00 O ATOM 0 H GLU A 175 -3.085 10.197 5.602 1.00 0.00 H new ATOM 0 HA GLU A 175 -3.397 7.353 4.986 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -5.652 7.771 6.071 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -4.255 7.990 7.107 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -4.406 10.393 6.949 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -5.601 10.298 5.671 1.00 0.00 H new ATOM 757 N LEU A 176 -4.745 7.498 2.926 1.00 0.00 N ATOM 758 CA LEU A 176 -5.486 7.561 1.671 1.00 0.00 C ATOM 759 C LEU A 176 -6.289 6.294 1.446 1.00 0.00 C ATOM 760 O LEU A 176 -6.554 5.529 2.373 1.00 0.00 O ATOM 761 CB LEU A 176 -4.537 7.730 0.483 1.00 0.00 C ATOM 762 CG LEU A 176 -3.138 8.259 0.817 1.00 0.00 C ATOM 763 CD1 LEU A 176 -2.146 7.113 0.919 1.00 0.00 C ATOM 764 CD2 LEU A 176 -2.685 9.267 -0.231 1.00 0.00 C ATOM 0 H LEU A 176 -4.295 6.600 3.105 1.00 0.00 H new ATOM 0 HA LEU A 176 -6.155 8.419 1.743 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.431 6.765 -0.013 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -5.000 8.408 -0.234 1.00 0.00 H new ATOM 0 HG LEU A 176 -3.181 8.763 1.783 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -1.158 7.507 1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -2.462 6.427 1.705 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -2.105 6.581 -0.032 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -1.690 9.632 0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -2.658 8.787 -1.209 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -3.383 10.104 -0.257 1.00 0.00 H new ATOM 776 N ASP A 177 -6.642 6.070 0.185 1.00 0.00 N ATOM 777 CA ASP A 177 -7.375 4.890 -0.200 1.00 0.00 C ATOM 778 C ASP A 177 -6.941 4.435 -1.587 1.00 0.00 C ATOM 779 O ASP A 177 -6.411 5.221 -2.369 1.00 0.00 O ATOM 780 CB ASP A 177 -8.883 5.146 -0.170 1.00 0.00 C ATOM 781 CG ASP A 177 -9.317 5.919 1.060 1.00 0.00 C ATOM 782 OD1 ASP A 177 -9.036 5.453 2.185 1.00 0.00 O ATOM 783 OD2 ASP A 177 -9.940 6.990 0.900 1.00 0.00 O ATOM 0 H ASP A 177 -6.426 6.701 -0.587 1.00 0.00 H new ATOM 0 HA ASP A 177 -7.154 4.100 0.518 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -9.172 5.699 -1.063 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -9.411 4.193 -0.201 1.00 0.00 H new ATOM 788 N PHE A 178 -7.159 3.161 -1.875 1.00 0.00 N ATOM 789 CA PHE A 178 -6.788 2.579 -3.165 1.00 0.00 C ATOM 790 C PHE A 178 -7.177 3.492 -4.329 1.00 0.00 C ATOM 791 O PHE A 178 -6.521 3.496 -5.370 1.00 0.00 O ATOM 792 CB PHE A 178 -7.454 1.214 -3.337 1.00 0.00 C ATOM 793 CG PHE A 178 -6.659 0.079 -2.760 1.00 0.00 C ATOM 794 CD1 PHE A 178 -6.281 0.085 -1.426 1.00 0.00 C ATOM 795 CD2 PHE A 178 -6.286 -0.996 -3.552 1.00 0.00 C ATOM 796 CE1 PHE A 178 -5.550 -0.959 -0.894 1.00 0.00 C ATOM 797 CE2 PHE A 178 -5.554 -2.042 -3.026 1.00 0.00 C ATOM 798 CZ PHE A 178 -5.185 -2.023 -1.694 1.00 0.00 C ATOM 0 H PHE A 178 -7.594 2.502 -1.230 1.00 0.00 H new ATOM 0 HA PHE A 178 -5.704 2.462 -3.174 1.00 0.00 H new ATOM 0 HB2 PHE A 178 -8.436 1.236 -2.864 1.00 0.00 H new ATOM 0 HB3 PHE A 178 -7.616 1.030 -4.399 1.00 0.00 H new ATOM 0 HD1 PHE A 178 -6.562 0.916 -0.796 1.00 0.00 H new ATOM 0 HD2 PHE A 178 -6.572 -1.016 -4.593 1.00 0.00 H new ATOM 0 HE1 PHE A 178 -5.264 -0.943 0.147 1.00 0.00 H new ATOM 0 HE2 PHE A 178 -5.270 -2.873 -3.654 1.00 0.00 H new ATOM 0 HZ PHE A 178 -4.612 -2.839 -1.280 1.00 0.00 H new ATOM 808 N SER A 179 -8.248 4.257 -4.149 1.00 0.00 N ATOM 809 CA SER A 179 -8.722 5.165 -5.189 1.00 0.00 C ATOM 810 C SER A 179 -7.731 6.303 -5.431 1.00 0.00 C ATOM 811 O SER A 179 -7.718 6.908 -6.503 1.00 0.00 O ATOM 812 CB SER A 179 -10.088 5.740 -4.805 1.00 0.00 C ATOM 813 OG SER A 179 -10.595 6.577 -5.830 1.00 0.00 O ATOM 0 H SER A 179 -8.804 4.267 -3.294 1.00 0.00 H new ATOM 0 HA SER A 179 -8.815 4.593 -6.112 1.00 0.00 H new ATOM 0 HB2 SER A 179 -10.788 4.927 -4.616 1.00 0.00 H new ATOM 0 HB3 SER A 179 -10.000 6.307 -3.878 1.00 0.00 H new ATOM 0 HG SER A 179 -11.469 6.931 -5.561 1.00 0.00 H new ATOM 819 N GLN A 180 -6.910 6.596 -4.429 1.00 0.00 N ATOM 820 CA GLN A 180 -5.924 7.667 -4.533 1.00 0.00 C ATOM 821 C GLN A 180 -4.522 7.118 -4.800 1.00 0.00 C ATOM 822 O GLN A 180 -3.616 7.868 -5.166 1.00 0.00 O ATOM 823 CB GLN A 180 -5.916 8.502 -3.251 1.00 0.00 C ATOM 824 CG GLN A 180 -7.276 9.077 -2.892 1.00 0.00 C ATOM 825 CD GLN A 180 -7.174 10.408 -2.172 1.00 0.00 C ATOM 826 OE1 GLN A 180 -6.605 11.366 -2.692 1.00 0.00 O ATOM 827 NE2 GLN A 180 -7.726 10.471 -0.965 1.00 0.00 N ATOM 0 H GLN A 180 -6.907 6.107 -3.534 1.00 0.00 H new ATOM 0 HA GLN A 180 -6.207 8.296 -5.377 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -5.563 7.883 -2.426 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.203 9.319 -3.364 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -7.864 9.204 -3.801 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -7.812 8.367 -2.262 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -8.188 9.651 -0.572 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -7.688 11.339 -0.431 1.00 0.00 H new ATOM 836 N VAL A 181 -4.338 5.813 -4.611 1.00 0.00 N ATOM 837 CA VAL A 181 -3.038 5.189 -4.834 1.00 0.00 C ATOM 838 C VAL A 181 -3.131 4.052 -5.847 1.00 0.00 C ATOM 839 O VAL A 181 -4.222 3.662 -6.259 1.00 0.00 O ATOM 840 CB VAL A 181 -2.444 4.644 -3.522 1.00 0.00 C ATOM 841 CG1 VAL A 181 -1.975 5.784 -2.632 1.00 0.00 C ATOM 842 CG2 VAL A 181 -3.458 3.774 -2.795 1.00 0.00 C ATOM 0 H VAL A 181 -5.069 5.171 -4.306 1.00 0.00 H new ATOM 0 HA VAL A 181 -2.383 5.966 -5.228 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.580 4.026 -3.767 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -1.559 5.378 -1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -1.210 6.361 -3.152 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -2.819 6.431 -2.395 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -3.019 3.399 -1.871 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -4.344 4.365 -2.562 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -3.739 2.934 -3.430 1.00 0.00 H new ATOM 852 N VAL A 182 -1.976 3.524 -6.242 1.00 0.00 N ATOM 853 CA VAL A 182 -1.925 2.430 -7.206 1.00 0.00 C ATOM 854 C VAL A 182 -0.760 1.491 -6.912 1.00 0.00 C ATOM 855 O VAL A 182 0.297 1.923 -6.450 1.00 0.00 O ATOM 856 CB VAL A 182 -1.793 2.956 -8.648 1.00 0.00 C ATOM 857 CG1 VAL A 182 -3.011 3.781 -9.029 1.00 0.00 C ATOM 858 CG2 VAL A 182 -0.518 3.770 -8.809 1.00 0.00 C ATOM 0 H VAL A 182 -1.064 3.836 -5.909 1.00 0.00 H new ATOM 0 HA VAL A 182 -2.863 1.883 -7.111 1.00 0.00 H new ATOM 0 HB VAL A 182 -1.736 2.100 -9.321 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.900 4.144 -10.051 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -3.906 3.162 -8.959 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -3.103 4.629 -8.351 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.444 4.132 -9.835 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -0.539 4.619 -8.125 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.345 3.143 -8.583 1.00 0.00 H new ATOM 868 N LYS A 183 -0.961 0.206 -7.183 1.00 0.00 N ATOM 869 CA LYS A 183 0.075 -0.794 -6.947 1.00 0.00 C ATOM 870 C LYS A 183 1.269 -0.570 -7.869 1.00 0.00 C ATOM 871 O LYS A 183 1.120 -0.501 -9.090 1.00 0.00 O ATOM 872 CB LYS A 183 -0.490 -2.202 -7.153 1.00 0.00 C ATOM 873 CG LYS A 183 -0.853 -2.906 -5.856 1.00 0.00 C ATOM 874 CD LYS A 183 -0.912 -4.415 -6.038 1.00 0.00 C ATOM 875 CE LYS A 183 -2.019 -5.034 -5.201 1.00 0.00 C ATOM 876 NZ LYS A 183 -2.525 -6.300 -5.800 1.00 0.00 N ATOM 0 H LYS A 183 -1.830 -0.168 -7.565 1.00 0.00 H new ATOM 0 HA LYS A 183 0.414 -0.694 -5.916 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -1.377 -2.140 -7.784 1.00 0.00 H new ATOM 0 HB3 LYS A 183 0.243 -2.804 -7.691 1.00 0.00 H new ATOM 0 HG2 LYS A 183 -0.119 -2.659 -5.089 1.00 0.00 H new ATOM 0 HG3 LYS A 183 -1.818 -2.543 -5.502 1.00 0.00 H new ATOM 0 HD2 LYS A 183 -1.075 -4.650 -7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 183 0.046 -4.854 -5.758 1.00 0.00 H new ATOM 0 HE2 LYS A 183 -1.647 -5.231 -4.196 1.00 0.00 H new ATOM 0 HE3 LYS A 183 -2.841 -4.324 -5.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -3.279 -6.691 -5.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -2.903 -6.108 -6.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -1.747 -6.986 -5.870 1.00 0.00 H new ATOM 890 N ALA A 184 2.454 -0.458 -7.277 1.00 0.00 N ATOM 891 CA ALA A 184 3.674 -0.242 -8.045 1.00 0.00 C ATOM 892 C ALA A 184 4.438 -1.546 -8.238 1.00 0.00 C ATOM 893 O ALA A 184 4.142 -2.518 -7.512 1.00 0.00 O ATOM 894 CB ALA A 184 4.555 0.790 -7.355 1.00 0.00 C ATOM 895 OXT ALA A 184 5.326 -1.587 -9.116 1.00 0.00 O ATOM 0 H ALA A 184 2.595 -0.513 -6.268 1.00 0.00 H new ATOM 0 HA ALA A 184 3.394 0.134 -9.029 1.00 0.00 H new ATOM 0 HB1 ALA A 184 5.463 0.942 -7.939 1.00 0.00 H new ATOM 0 HB2 ALA A 184 4.014 1.733 -7.272 1.00 0.00 H new ATOM 0 HB3 ALA A 184 4.819 0.435 -6.359 1.00 0.00 H new TER 901 ALA A 184