USER MOD reduce.3.24.130724 H: found=0, std=0, add=481, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 482 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 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -1.42 K(o=-1.4,f=-3.7!) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot 90:sc= 0.63 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.63) USER MOD Single : A 128 MET CE :methyl -113:sc= -0.167 (180deg=-2.33) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -0.523 X(o=-0.52,f=-0.59) USER MOD Single : A 140 GLN : amide:sc= -1.88 X(o=-1.9,f=-1.5!) USER MOD Single : A 144 THR OG1 : rot 87:sc= 1.22 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ -156:sc= -1.05 (180deg=-1.46) USER MOD Single : A 160 TYR OH : rot 147:sc= -3.46! USER MOD ----------------------------------------------------------------- ATOM 66 N PHE A 105 7.909 10.389 -6.387 1.00 0.00 N ATOM 67 CA PHE A 105 7.324 9.054 -6.352 1.00 0.00 C ATOM 68 C PHE A 105 6.808 8.722 -4.955 1.00 0.00 C ATOM 69 O PHE A 105 5.715 8.176 -4.798 1.00 0.00 O ATOM 70 CB PHE A 105 8.356 8.011 -6.788 1.00 0.00 C ATOM 71 CG PHE A 105 8.027 6.617 -6.336 1.00 0.00 C ATOM 72 CD1 PHE A 105 7.047 5.879 -6.980 1.00 0.00 C ATOM 73 CD2 PHE A 105 8.698 6.044 -5.267 1.00 0.00 C ATOM 74 CE1 PHE A 105 6.741 4.596 -6.565 1.00 0.00 C ATOM 75 CE2 PHE A 105 8.397 4.762 -4.849 1.00 0.00 C ATOM 76 CZ PHE A 105 7.418 4.036 -5.499 1.00 0.00 C ATOM 0 HA PHE A 105 6.482 9.035 -7.045 1.00 0.00 H new ATOM 0 HB2 PHE A 105 8.436 8.023 -7.875 1.00 0.00 H new ATOM 0 HB3 PHE A 105 9.333 8.291 -6.394 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.516 6.311 -7.816 1.00 0.00 H new ATOM 0 HD2 PHE A 105 9.465 6.606 -4.755 1.00 0.00 H new ATOM 0 HE1 PHE A 105 5.973 4.032 -7.074 1.00 0.00 H new ATOM 0 HE2 PHE A 105 8.927 4.328 -4.014 1.00 0.00 H new ATOM 0 HZ PHE A 105 7.182 3.033 -5.175 1.00 0.00 H new ATOM 86 N LEU A 106 7.602 9.055 -3.943 1.00 0.00 N ATOM 87 CA LEU A 106 7.226 8.793 -2.558 1.00 0.00 C ATOM 88 C LEU A 106 5.986 9.591 -2.170 1.00 0.00 C ATOM 89 O LEU A 106 5.048 9.054 -1.579 1.00 0.00 O ATOM 90 CB LEU A 106 8.384 9.140 -1.621 1.00 0.00 C ATOM 91 CG LEU A 106 9.727 8.482 -1.940 1.00 0.00 C ATOM 92 CD1 LEU A 106 10.870 9.274 -1.324 1.00 0.00 C ATOM 93 CD2 LEU A 106 9.746 7.043 -1.447 1.00 0.00 C ATOM 0 H LEU A 106 8.510 9.507 -4.055 1.00 0.00 H new ATOM 0 HA LEU A 106 6.996 7.732 -2.464 1.00 0.00 H new ATOM 0 HB2 LEU A 106 8.521 10.221 -1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.099 8.864 -0.606 1.00 0.00 H new ATOM 0 HG LEU A 106 9.859 8.476 -3.022 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.817 8.790 -1.562 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.869 10.287 -1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.744 9.313 -0.242 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.709 6.590 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.591 7.026 -0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.951 6.480 -1.937 1.00 0.00 H new ATOM 105 N THR A 107 5.986 10.877 -2.507 1.00 0.00 N ATOM 106 CA THR A 107 4.860 11.749 -2.195 1.00 0.00 C ATOM 107 C THR A 107 3.590 11.280 -2.896 1.00 0.00 C ATOM 108 O THR A 107 2.525 11.204 -2.284 1.00 0.00 O ATOM 109 CB THR A 107 5.149 13.206 -2.602 1.00 0.00 C ATOM 110 OG1 THR A 107 6.365 13.653 -1.992 1.00 0.00 O ATOM 111 CG2 THR A 107 4.004 14.120 -2.191 1.00 0.00 C ATOM 0 H THR A 107 6.753 11.338 -2.996 1.00 0.00 H new ATOM 0 HA THR A 107 4.714 11.703 -1.116 1.00 0.00 H new ATOM 0 HB THR A 107 5.252 13.243 -3.687 1.00 0.00 H new ATOM 0 HG1 THR A 107 6.543 14.580 -2.257 1.00 0.00 H new ATOM 0 HG21 THR A 107 4.231 15.144 -2.489 1.00 0.00 H new ATOM 0 HG22 THR A 107 3.086 13.795 -2.680 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.874 14.077 -1.110 1.00 0.00 H new ATOM 119 N GLU A 108 3.711 10.965 -4.181 1.00 0.00 N ATOM 120 CA GLU A 108 2.571 10.503 -4.964 1.00 0.00 C ATOM 121 C GLU A 108 2.099 9.134 -4.482 1.00 0.00 C ATOM 122 O GLU A 108 0.898 8.873 -4.400 1.00 0.00 O ATOM 123 CB GLU A 108 2.937 10.434 -6.448 1.00 0.00 C ATOM 124 CG GLU A 108 3.134 11.798 -7.090 1.00 0.00 C ATOM 125 CD GLU A 108 3.051 11.747 -8.603 1.00 0.00 C ATOM 126 OE1 GLU A 108 3.615 10.804 -9.197 1.00 0.00 O ATOM 127 OE2 GLU A 108 2.423 12.651 -9.194 1.00 0.00 O ATOM 0 H GLU A 108 4.586 11.021 -4.702 1.00 0.00 H new ATOM 0 HA GLU A 108 1.758 11.217 -4.830 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.852 9.853 -6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.152 9.900 -6.983 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.378 12.486 -6.711 1.00 0.00 H new ATOM 0 HG3 GLU A 108 4.105 12.197 -6.796 1.00 0.00 H new ATOM 134 N PHE A 109 3.051 8.264 -4.166 1.00 0.00 N ATOM 135 CA PHE A 109 2.734 6.921 -3.693 1.00 0.00 C ATOM 136 C PHE A 109 2.033 6.973 -2.339 1.00 0.00 C ATOM 137 O PHE A 109 1.071 6.242 -2.098 1.00 0.00 O ATOM 138 CB PHE A 109 4.008 6.080 -3.589 1.00 0.00 C ATOM 139 CG PHE A 109 3.858 4.872 -2.709 1.00 0.00 C ATOM 140 CD1 PHE A 109 2.804 3.992 -2.892 1.00 0.00 C ATOM 141 CD2 PHE A 109 4.772 4.616 -1.700 1.00 0.00 C ATOM 142 CE1 PHE A 109 2.663 2.880 -2.083 1.00 0.00 C ATOM 143 CE2 PHE A 109 4.637 3.505 -0.888 1.00 0.00 C ATOM 144 CZ PHE A 109 3.582 2.636 -1.081 1.00 0.00 C ATOM 0 H PHE A 109 4.049 8.464 -4.229 1.00 0.00 H new ATOM 0 HA PHE A 109 2.060 6.458 -4.414 1.00 0.00 H new ATOM 0 HB2 PHE A 109 4.304 5.758 -4.587 1.00 0.00 H new ATOM 0 HB3 PHE A 109 4.815 6.703 -3.203 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.084 4.177 -3.676 1.00 0.00 H new ATOM 0 HD2 PHE A 109 5.600 5.292 -1.546 1.00 0.00 H new ATOM 0 HE1 PHE A 109 1.835 2.203 -2.234 1.00 0.00 H new ATOM 0 HE2 PHE A 109 5.356 3.317 -0.104 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.475 1.766 -0.449 1.00 0.00 H new ATOM 154 N ILE A 110 2.522 7.839 -1.459 1.00 0.00 N ATOM 155 CA ILE A 110 1.943 7.987 -0.129 1.00 0.00 C ATOM 156 C ILE A 110 0.556 8.617 -0.201 1.00 0.00 C ATOM 157 O ILE A 110 -0.378 8.163 0.459 1.00 0.00 O ATOM 158 CB ILE A 110 2.838 8.846 0.783 1.00 0.00 C ATOM 159 CG1 ILE A 110 4.168 8.136 1.043 1.00 0.00 C ATOM 160 CG2 ILE A 110 2.126 9.145 2.094 1.00 0.00 C ATOM 161 CD1 ILE A 110 5.237 9.044 1.609 1.00 0.00 C ATOM 0 H ILE A 110 3.318 8.449 -1.643 1.00 0.00 H new ATOM 0 HA ILE A 110 1.864 6.985 0.294 1.00 0.00 H new ATOM 0 HB ILE A 110 3.044 9.791 0.280 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.001 7.310 1.735 1.00 0.00 H new ATOM 0 HG13 ILE A 110 4.528 7.702 0.110 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.771 9.753 2.728 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.202 9.687 1.891 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.894 8.210 2.603 1.00 0.00 H new ATOM 0 HD11 ILE A 110 6.152 8.474 1.768 1.00 0.00 H new ATOM 0 HD12 ILE A 110 5.433 9.856 0.909 1.00 0.00 H new ATOM 0 HD13 ILE A 110 4.898 9.458 2.559 1.00 0.00 H new ATOM 173 N ASN A 111 0.429 9.665 -1.009 1.00 0.00 N ATOM 174 CA ASN A 111 -0.845 10.357 -1.168 1.00 0.00 C ATOM 175 C ASN A 111 -1.886 9.440 -1.802 1.00 0.00 C ATOM 176 O ASN A 111 -3.081 9.560 -1.530 1.00 0.00 O ATOM 177 CB ASN A 111 -0.663 11.611 -2.026 1.00 0.00 C ATOM 178 CG ASN A 111 0.179 12.667 -1.336 1.00 0.00 C ATOM 179 OD1 ASN A 111 0.288 12.686 -0.110 1.00 0.00 O ATOM 180 ND2 ASN A 111 0.780 13.551 -2.123 1.00 0.00 N ATOM 0 H ASN A 111 1.192 10.053 -1.563 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.198 10.649 -0.179 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.194 11.336 -2.971 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -1.641 12.029 -2.265 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.361 14.284 -1.716 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.661 13.497 -3.135 1.00 0.00 H new ATOM 187 N TYR A 112 -1.425 8.525 -2.646 1.00 0.00 N ATOM 188 CA TYR A 112 -2.317 7.588 -3.320 1.00 0.00 C ATOM 189 C TYR A 112 -2.956 6.629 -2.321 1.00 0.00 C ATOM 190 O TYR A 112 -4.111 6.233 -2.476 1.00 0.00 O ATOM 191 CB TYR A 112 -1.552 6.799 -4.384 1.00 0.00 C ATOM 192 CG TYR A 112 -2.447 6.010 -5.312 1.00 0.00 C ATOM 193 CD1 TYR A 112 -3.459 6.634 -6.031 1.00 0.00 C ATOM 194 CD2 TYR A 112 -2.280 4.639 -5.471 1.00 0.00 C ATOM 195 CE1 TYR A 112 -4.279 5.916 -6.880 1.00 0.00 C ATOM 196 CE2 TYR A 112 -3.095 3.914 -6.319 1.00 0.00 C ATOM 197 CZ TYR A 112 -4.093 4.557 -7.020 1.00 0.00 C ATOM 198 OH TYR A 112 -4.908 3.838 -7.866 1.00 0.00 O ATOM 0 H TYR A 112 -0.439 8.411 -2.880 1.00 0.00 H new ATOM 0 HA TYR A 112 -3.109 8.162 -3.802 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -0.950 7.490 -4.974 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -0.861 6.115 -3.891 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -3.607 7.698 -5.924 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -1.500 4.132 -4.922 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -5.061 6.417 -7.431 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -2.951 2.850 -6.432 1.00 0.00 H new ATOM 0 HH TYR A 112 -4.644 2.894 -7.851 1.00 0.00 H new ATOM 208 N ILE A 113 -2.196 6.261 -1.295 1.00 0.00 N ATOM 209 CA ILE A 113 -2.687 5.350 -0.269 1.00 0.00 C ATOM 210 C ILE A 113 -3.783 6.003 0.567 1.00 0.00 C ATOM 211 O ILE A 113 -4.816 5.393 0.841 1.00 0.00 O ATOM 212 CB ILE A 113 -1.552 4.888 0.664 1.00 0.00 C ATOM 213 CG1 ILE A 113 -0.438 4.221 -0.144 1.00 0.00 C ATOM 214 CG2 ILE A 113 -2.090 3.936 1.722 1.00 0.00 C ATOM 215 CD1 ILE A 113 0.869 4.104 0.610 1.00 0.00 C ATOM 0 H ILE A 113 -1.238 6.580 -1.152 1.00 0.00 H new ATOM 0 HA ILE A 113 -3.096 4.483 -0.787 1.00 0.00 H new ATOM 0 HB ILE A 113 -1.137 5.761 1.167 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.765 3.226 -0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.271 4.792 -1.058 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -1.276 3.618 2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -2.852 4.443 2.314 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -2.528 3.064 1.237 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.613 3.622 -0.024 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.219 5.098 0.888 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.718 3.508 1.510 1.00 0.00 H new ATOM 227 N LYS A 114 -3.551 7.248 0.967 1.00 0.00 N ATOM 228 CA LYS A 114 -4.519 7.987 1.769 1.00 0.00 C ATOM 229 C LYS A 114 -5.885 8.010 1.089 1.00 0.00 C ATOM 230 O LYS A 114 -6.903 7.697 1.707 1.00 0.00 O ATOM 231 CB LYS A 114 -4.031 9.418 2.004 1.00 0.00 C ATOM 232 CG LYS A 114 -2.533 9.520 2.236 1.00 0.00 C ATOM 233 CD LYS A 114 -2.177 10.756 3.044 1.00 0.00 C ATOM 234 CE LYS A 114 -0.687 11.056 2.977 1.00 0.00 C ATOM 235 NZ LYS A 114 -0.272 12.039 4.015 1.00 0.00 N ATOM 0 H LYS A 114 -2.700 7.767 0.749 1.00 0.00 H new ATOM 0 HA LYS A 114 -4.619 7.481 2.729 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.299 10.030 1.143 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.553 9.834 2.866 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.183 8.630 2.758 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.017 9.550 1.277 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.739 11.611 2.669 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.474 10.611 4.083 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.124 10.132 3.107 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.439 11.444 1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.750 12.217 3.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.790 12.930 3.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.485 11.658 4.959 1.00 0.00 H new ATOM 249 N LYS A 115 -5.899 8.380 -0.187 1.00 0.00 N ATOM 250 CA LYS A 115 -7.139 8.441 -0.952 1.00 0.00 C ATOM 251 C LYS A 115 -7.656 7.040 -1.262 1.00 0.00 C ATOM 252 O LYS A 115 -8.855 6.775 -1.167 1.00 0.00 O ATOM 253 CB LYS A 115 -6.921 9.215 -2.254 1.00 0.00 C ATOM 254 CG LYS A 115 -6.401 10.626 -2.043 1.00 0.00 C ATOM 255 CD LYS A 115 -6.129 11.324 -3.365 1.00 0.00 C ATOM 256 CE LYS A 115 -6.307 12.830 -3.248 1.00 0.00 C ATOM 257 NZ LYS A 115 -6.085 13.518 -4.549 1.00 0.00 N ATOM 0 H LYS A 115 -5.066 8.642 -0.713 1.00 0.00 H new ATOM 0 HA LYS A 115 -7.884 8.959 -0.348 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.216 8.667 -2.879 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.863 9.262 -2.801 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.129 11.201 -1.470 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.485 10.593 -1.453 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.114 11.101 -3.693 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.803 10.935 -4.128 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.312 13.050 -2.888 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.610 13.221 -2.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -6.216 14.542 -4.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.118 13.330 -4.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.767 13.163 -5.250 1.00 0.00 H new ATOM 271 N SER A 116 -6.745 6.145 -1.631 1.00 0.00 N ATOM 272 CA SER A 116 -7.110 4.772 -1.957 1.00 0.00 C ATOM 273 C SER A 116 -7.542 4.013 -0.705 1.00 0.00 C ATOM 274 O SER A 116 -6.709 3.515 0.052 1.00 0.00 O ATOM 275 CB SER A 116 -5.934 4.053 -2.622 1.00 0.00 C ATOM 276 OG SER A 116 -5.709 4.547 -3.931 1.00 0.00 O ATOM 0 H SER A 116 -5.748 6.347 -1.712 1.00 0.00 H new ATOM 0 HA SER A 116 -7.949 4.801 -2.652 1.00 0.00 H new ATOM 0 HB2 SER A 116 -5.035 4.186 -2.020 1.00 0.00 H new ATOM 0 HB3 SER A 116 -6.134 2.982 -2.663 1.00 0.00 H new ATOM 0 HG SER A 116 -5.083 5.300 -3.893 1.00 0.00 H new ATOM 282 N LYS A 117 -8.851 3.930 -0.494 1.00 0.00 N ATOM 283 CA LYS A 117 -9.397 3.232 0.663 1.00 0.00 C ATOM 284 C LYS A 117 -8.680 1.904 0.886 1.00 0.00 C ATOM 285 O LYS A 117 -8.245 1.601 1.997 1.00 0.00 O ATOM 286 CB LYS A 117 -10.897 2.989 0.478 1.00 0.00 C ATOM 287 CG LYS A 117 -11.653 2.830 1.785 1.00 0.00 C ATOM 288 CD LYS A 117 -12.997 2.154 1.573 1.00 0.00 C ATOM 289 CE LYS A 117 -14.061 3.151 1.139 1.00 0.00 C ATOM 290 NZ LYS A 117 -15.432 2.690 1.493 1.00 0.00 N ATOM 0 H LYS A 117 -9.554 4.338 -1.110 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.243 3.860 1.540 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -11.325 3.821 -0.081 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.040 2.093 -0.126 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -11.056 2.243 2.483 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -11.805 3.809 2.240 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -12.898 1.374 0.818 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -13.309 1.666 2.496 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -13.869 4.115 1.611 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.997 3.305 0.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -16.128 3.397 1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.625 1.783 1.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.502 2.568 2.523 1.00 0.00 H new ATOM 304 N VAL A 118 -8.559 1.116 -0.177 1.00 0.00 N ATOM 305 CA VAL A 118 -7.892 -0.178 -0.098 1.00 0.00 C ATOM 306 C VAL A 118 -6.817 -0.309 -1.171 1.00 0.00 C ATOM 307 O VAL A 118 -7.036 0.041 -2.331 1.00 0.00 O ATOM 308 CB VAL A 118 -8.896 -1.337 -0.250 1.00 0.00 C ATOM 309 CG1 VAL A 118 -8.182 -2.677 -0.164 1.00 0.00 C ATOM 310 CG2 VAL A 118 -9.987 -1.237 0.805 1.00 0.00 C ATOM 0 H VAL A 118 -8.914 1.351 -1.104 1.00 0.00 H new ATOM 0 HA VAL A 118 -7.428 -0.235 0.887 1.00 0.00 H new ATOM 0 HB VAL A 118 -9.363 -1.264 -1.232 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.907 -3.483 -0.273 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.440 -2.746 -0.960 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.686 -2.764 0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -10.688 -2.063 0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -9.539 -1.284 1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -10.518 -0.292 0.691 1.00 0.00 H new ATOM 320 N VAL A 119 -5.653 -0.815 -0.775 1.00 0.00 N ATOM 321 CA VAL A 119 -4.542 -0.993 -1.703 1.00 0.00 C ATOM 322 C VAL A 119 -3.897 -2.364 -1.530 1.00 0.00 C ATOM 323 O VAL A 119 -3.499 -2.740 -0.427 1.00 0.00 O ATOM 324 CB VAL A 119 -3.469 0.095 -1.510 1.00 0.00 C ATOM 325 CG1 VAL A 119 -2.366 -0.053 -2.546 1.00 0.00 C ATOM 326 CG2 VAL A 119 -4.096 1.479 -1.581 1.00 0.00 C ATOM 0 H VAL A 119 -5.455 -1.109 0.182 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.953 -0.912 -2.709 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.025 -0.028 -0.522 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -1.617 0.724 -2.394 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -1.899 -1.032 -2.443 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.790 0.043 -3.545 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.324 2.236 -1.443 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.567 1.615 -2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.847 1.579 -0.797 1.00 0.00 H new ATOM 336 N LEU A 120 -3.797 -3.106 -2.627 1.00 0.00 N ATOM 337 CA LEU A 120 -3.199 -4.437 -2.598 1.00 0.00 C ATOM 338 C LEU A 120 -1.744 -4.390 -3.054 1.00 0.00 C ATOM 339 O LEU A 120 -1.386 -3.621 -3.947 1.00 0.00 O ATOM 340 CB LEU A 120 -3.993 -5.394 -3.489 1.00 0.00 C ATOM 341 CG LEU A 120 -3.985 -6.864 -3.069 1.00 0.00 C ATOM 342 CD1 LEU A 120 -4.869 -7.077 -1.850 1.00 0.00 C ATOM 343 CD2 LEU A 120 -4.438 -7.750 -4.220 1.00 0.00 C ATOM 0 H LEU A 120 -4.122 -2.809 -3.547 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.228 -4.799 -1.570 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -5.027 -5.052 -3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.600 -5.324 -4.503 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.964 -7.140 -2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.850 -8.129 -1.566 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.500 -6.471 -1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -5.892 -6.783 -2.086 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.426 -8.793 -3.903 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.449 -7.472 -4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.763 -7.620 -5.066 1.00 0.00 H new ATOM 355 N LEU A 121 -0.909 -5.218 -2.436 1.00 0.00 N ATOM 356 CA LEU A 121 0.508 -5.273 -2.779 1.00 0.00 C ATOM 357 C LEU A 121 0.701 -5.733 -4.220 1.00 0.00 C ATOM 358 O LEU A 121 1.533 -5.191 -4.948 1.00 0.00 O ATOM 359 CB LEU A 121 1.247 -6.216 -1.827 1.00 0.00 C ATOM 360 CG LEU A 121 1.005 -5.988 -0.335 1.00 0.00 C ATOM 361 CD1 LEU A 121 1.518 -7.169 0.475 1.00 0.00 C ATOM 362 CD2 LEU A 121 1.669 -4.697 0.122 1.00 0.00 C ATOM 0 H LEU A 121 -1.189 -5.861 -1.695 1.00 0.00 H new ATOM 0 HA LEU A 121 0.921 -4.269 -2.679 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.962 -7.240 -2.068 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.316 -6.129 -2.019 1.00 0.00 H new ATOM 0 HG LEU A 121 -0.069 -5.899 -0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 121 1.337 -6.989 1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 121 0.997 -8.075 0.167 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.588 -7.290 0.305 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.486 -4.551 1.187 1.00 0.00 H new ATOM 0 HD22 LEU A 121 2.743 -4.757 -0.057 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.254 -3.857 -0.436 1.00 0.00 H new ATOM 374 N GLU A 122 -0.074 -6.734 -4.626 1.00 0.00 N ATOM 375 CA GLU A 122 0.013 -7.265 -5.982 1.00 0.00 C ATOM 376 C GLU A 122 -0.412 -6.215 -7.005 1.00 0.00 C ATOM 377 O GLU A 122 0.222 -6.057 -8.048 1.00 0.00 O ATOM 378 CB GLU A 122 -0.862 -8.513 -6.121 1.00 0.00 C ATOM 379 CG GLU A 122 -0.416 -9.670 -5.243 1.00 0.00 C ATOM 380 CD GLU A 122 0.846 -10.338 -5.754 1.00 0.00 C ATOM 381 OE1 GLU A 122 1.934 -9.743 -5.609 1.00 0.00 O ATOM 382 OE2 GLU A 122 0.744 -11.457 -6.299 1.00 0.00 O ATOM 0 H GLU A 122 -0.768 -7.193 -4.036 1.00 0.00 H new ATOM 0 HA GLU A 122 1.051 -7.535 -6.174 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -1.891 -8.254 -5.872 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -0.858 -8.835 -7.162 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.246 -9.307 -4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -1.216 -10.408 -5.187 1.00 0.00 H new ATOM 389 N ASP A 123 -1.490 -5.502 -6.699 1.00 0.00 N ATOM 390 CA ASP A 123 -2.001 -4.467 -7.590 1.00 0.00 C ATOM 391 C ASP A 123 -1.093 -3.242 -7.577 1.00 0.00 C ATOM 392 O ASP A 123 -0.897 -2.589 -8.603 1.00 0.00 O ATOM 393 CB ASP A 123 -3.421 -4.070 -7.185 1.00 0.00 C ATOM 394 CG ASP A 123 -4.458 -5.077 -7.644 1.00 0.00 C ATOM 395 OD1 ASP A 123 -4.400 -6.238 -7.186 1.00 0.00 O ATOM 396 OD2 ASP A 123 -5.325 -4.705 -8.462 1.00 0.00 O ATOM 0 H ASP A 123 -2.027 -5.622 -5.840 1.00 0.00 H new ATOM 0 HA ASP A 123 -2.021 -4.871 -8.602 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -3.472 -3.970 -6.101 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -3.656 -3.093 -7.607 1.00 0.00 H new ATOM 401 N LEU A 124 -0.543 -2.933 -6.408 1.00 0.00 N ATOM 402 CA LEU A 124 0.344 -1.784 -6.259 1.00 0.00 C ATOM 403 C LEU A 124 1.589 -1.942 -7.126 1.00 0.00 C ATOM 404 O LEU A 124 2.083 -0.973 -7.702 1.00 0.00 O ATOM 405 CB LEU A 124 0.747 -1.612 -4.794 1.00 0.00 C ATOM 406 CG LEU A 124 1.590 -0.378 -4.470 1.00 0.00 C ATOM 407 CD1 LEU A 124 0.807 0.894 -4.754 1.00 0.00 C ATOM 408 CD2 LEU A 124 2.049 -0.411 -3.020 1.00 0.00 C ATOM 0 H LEU A 124 -0.695 -3.462 -5.549 1.00 0.00 H new ATOM 0 HA LEU A 124 -0.195 -0.895 -6.587 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -0.160 -1.576 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 124 1.302 -2.498 -4.484 1.00 0.00 H new ATOM 0 HG LEU A 124 2.472 -0.387 -5.110 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.423 1.761 -4.517 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.529 0.923 -5.808 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.094 0.911 -4.141 1.00 0.00 H new ATOM 0 HD21 LEU A 124 2.648 0.475 -2.808 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.179 -0.427 -2.363 1.00 0.00 H new ATOM 0 HD23 LEU A 124 2.650 -1.304 -2.849 1.00 0.00 H new ATOM 420 N ALA A 125 2.090 -3.170 -7.215 1.00 0.00 N ATOM 421 CA ALA A 125 3.275 -3.455 -8.015 1.00 0.00 C ATOM 422 C ALA A 125 3.001 -3.236 -9.499 1.00 0.00 C ATOM 423 O ALA A 125 3.791 -2.601 -10.199 1.00 0.00 O ATOM 424 CB ALA A 125 3.747 -4.880 -7.768 1.00 0.00 C ATOM 0 H ALA A 125 1.694 -3.983 -6.743 1.00 0.00 H new ATOM 0 HA ALA A 125 4.063 -2.765 -7.712 1.00 0.00 H new ATOM 0 HB1 ALA A 125 4.632 -5.080 -8.371 1.00 0.00 H new ATOM 0 HB2 ALA A 125 3.991 -5.005 -6.713 1.00 0.00 H new ATOM 0 HB3 ALA A 125 2.956 -5.578 -8.042 1.00 0.00 H new ATOM 430 N PHE A 126 1.878 -3.765 -9.974 1.00 0.00 N ATOM 431 CA PHE A 126 1.502 -3.628 -11.376 1.00 0.00 C ATOM 432 C PHE A 126 1.113 -2.188 -11.697 1.00 0.00 C ATOM 433 O PHE A 126 1.450 -1.666 -12.759 1.00 0.00 O ATOM 434 CB PHE A 126 0.340 -4.567 -11.707 1.00 0.00 C ATOM 435 CG PHE A 126 -0.426 -4.163 -12.934 1.00 0.00 C ATOM 436 CD1 PHE A 126 -1.368 -3.148 -12.876 1.00 0.00 C ATOM 437 CD2 PHE A 126 -0.205 -4.797 -14.146 1.00 0.00 C ATOM 438 CE1 PHE A 126 -2.075 -2.774 -14.003 1.00 0.00 C ATOM 439 CE2 PHE A 126 -0.908 -4.428 -15.277 1.00 0.00 C ATOM 440 CZ PHE A 126 -1.844 -3.414 -15.205 1.00 0.00 C ATOM 0 H PHE A 126 1.213 -4.292 -9.409 1.00 0.00 H new ATOM 0 HA PHE A 126 2.364 -3.897 -11.986 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.727 -5.576 -11.846 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -0.342 -4.602 -10.858 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -1.552 -2.643 -11.939 1.00 0.00 H new ATOM 0 HD2 PHE A 126 0.526 -5.590 -14.208 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -2.807 -1.982 -13.944 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.726 -4.931 -16.215 1.00 0.00 H new ATOM 0 HZ PHE A 126 -2.394 -3.122 -16.087 1.00 0.00 H new ATOM 450 N GLN A 127 0.403 -1.552 -10.770 1.00 0.00 N ATOM 451 CA GLN A 127 -0.032 -0.173 -10.955 1.00 0.00 C ATOM 452 C GLN A 127 1.151 0.732 -11.282 1.00 0.00 C ATOM 453 O GLN A 127 1.090 1.539 -12.209 1.00 0.00 O ATOM 454 CB GLN A 127 -0.743 0.332 -9.699 1.00 0.00 C ATOM 455 CG GLN A 127 -2.218 -0.035 -9.645 1.00 0.00 C ATOM 456 CD GLN A 127 -2.914 0.150 -10.979 1.00 0.00 C ATOM 457 OE1 GLN A 127 -2.783 1.193 -11.621 1.00 0.00 O ATOM 458 NE2 GLN A 127 -3.661 -0.862 -11.403 1.00 0.00 N ATOM 0 H GLN A 127 0.117 -1.970 -9.884 1.00 0.00 H new ATOM 0 HA GLN A 127 -0.728 -0.148 -11.793 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -0.243 -0.076 -8.820 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.645 1.416 -9.647 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -2.319 -1.073 -9.328 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -2.714 0.578 -8.893 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -3.741 -1.708 -10.839 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -4.155 -0.794 -12.293 1.00 0.00 H new ATOM 467 N MET A 128 2.227 0.592 -10.515 1.00 0.00 N ATOM 468 CA MET A 128 3.425 1.396 -10.724 1.00 0.00 C ATOM 469 C MET A 128 4.513 0.582 -11.417 1.00 0.00 C ATOM 470 O MET A 128 5.592 1.094 -11.712 1.00 0.00 O ATOM 471 CB MET A 128 3.945 1.933 -9.389 1.00 0.00 C ATOM 472 CG MET A 128 2.929 2.774 -8.635 1.00 0.00 C ATOM 473 SD MET A 128 3.497 3.240 -6.988 1.00 0.00 S ATOM 474 CE MET A 128 2.613 4.779 -6.747 1.00 0.00 C ATOM 0 H MET A 128 2.294 -0.071 -9.743 1.00 0.00 H new ATOM 0 HA MET A 128 3.160 2.236 -11.366 1.00 0.00 H new ATOM 0 HB2 MET A 128 4.247 1.094 -8.762 1.00 0.00 H new ATOM 0 HB3 MET A 128 4.837 2.532 -9.571 1.00 0.00 H new ATOM 0 HG2 MET A 128 2.712 3.675 -9.209 1.00 0.00 H new ATOM 0 HG3 MET A 128 1.995 2.218 -8.549 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.323 5.606 -6.719 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.913 4.929 -7.569 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.064 4.740 -5.806 1.00 0.00 H new ATOM 484 N GLY A 129 4.222 -0.690 -11.673 1.00 0.00 N ATOM 485 CA GLY A 129 5.186 -1.555 -12.328 1.00 0.00 C ATOM 486 C GLY A 129 6.218 -2.106 -11.365 1.00 0.00 C ATOM 487 O GLY A 129 6.651 -3.252 -11.496 1.00 0.00 O ATOM 0 H GLY A 129 3.336 -1.137 -11.438 1.00 0.00 H new ATOM 0 HA2 GLY A 129 4.661 -2.382 -12.806 1.00 0.00 H new ATOM 0 HA3 GLY A 129 5.691 -0.999 -13.118 1.00 0.00 H new ATOM 491 N LEU A 130 6.617 -1.290 -10.396 1.00 0.00 N ATOM 492 CA LEU A 130 7.607 -1.702 -9.407 1.00 0.00 C ATOM 493 C LEU A 130 7.370 -3.142 -8.966 1.00 0.00 C ATOM 494 O LEU A 130 6.245 -3.641 -9.020 1.00 0.00 O ATOM 495 CB LEU A 130 7.563 -0.771 -8.194 1.00 0.00 C ATOM 496 CG LEU A 130 7.857 0.704 -8.469 1.00 0.00 C ATOM 497 CD1 LEU A 130 7.430 1.563 -7.288 1.00 0.00 C ATOM 498 CD2 LEU A 130 9.335 0.906 -8.771 1.00 0.00 C ATOM 0 H LEU A 130 6.270 -0.339 -10.274 1.00 0.00 H new ATOM 0 HA LEU A 130 8.593 -1.641 -9.869 1.00 0.00 H new ATOM 0 HB2 LEU A 130 6.575 -0.845 -7.740 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.280 -1.133 -7.457 1.00 0.00 H new ATOM 0 HG LEU A 130 7.283 1.012 -9.343 1.00 0.00 H new ATOM 0 HD11 LEU A 130 7.647 2.610 -7.502 1.00 0.00 H new ATOM 0 HD12 LEU A 130 6.360 1.442 -7.118 1.00 0.00 H new ATOM 0 HD13 LEU A 130 7.976 1.254 -6.397 1.00 0.00 H new ATOM 0 HD21 LEU A 130 9.526 1.962 -8.964 1.00 0.00 H new ATOM 0 HD22 LEU A 130 9.929 0.580 -7.917 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.610 0.321 -9.648 1.00 0.00 H new ATOM 510 N ARG A 131 8.435 -3.805 -8.527 1.00 0.00 N ATOM 511 CA ARG A 131 8.342 -5.188 -8.076 1.00 0.00 C ATOM 512 C ARG A 131 7.470 -5.295 -6.828 1.00 0.00 C ATOM 513 O ARG A 131 7.376 -4.353 -6.040 1.00 0.00 O ATOM 514 CB ARG A 131 9.736 -5.747 -7.785 1.00 0.00 C ATOM 515 CG ARG A 131 10.640 -5.792 -9.006 1.00 0.00 C ATOM 516 CD ARG A 131 11.434 -4.504 -9.160 1.00 0.00 C ATOM 517 NE ARG A 131 12.618 -4.687 -9.996 1.00 0.00 N ATOM 518 CZ ARG A 131 13.260 -3.687 -10.589 1.00 0.00 C ATOM 519 NH1 ARG A 131 12.835 -2.440 -10.439 1.00 0.00 N ATOM 520 NH2 ARG A 131 14.330 -3.933 -11.334 1.00 0.00 N ATOM 0 H ARG A 131 9.372 -3.406 -8.474 1.00 0.00 H new ATOM 0 HA ARG A 131 7.882 -5.773 -8.872 1.00 0.00 H new ATOM 0 HB2 ARG A 131 10.209 -5.138 -7.015 1.00 0.00 H new ATOM 0 HB3 ARG A 131 9.637 -6.754 -7.379 1.00 0.00 H new ATOM 0 HG2 ARG A 131 11.326 -6.635 -8.921 1.00 0.00 H new ATOM 0 HG3 ARG A 131 10.038 -5.959 -9.899 1.00 0.00 H new ATOM 0 HD2 ARG A 131 10.797 -3.735 -9.597 1.00 0.00 H new ATOM 0 HD3 ARG A 131 11.737 -4.145 -8.176 1.00 0.00 H new ATOM 0 HE ARG A 131 12.971 -5.634 -10.132 1.00 0.00 H new ATOM 0 HH11 ARG A 131 12.013 -2.247 -9.867 1.00 0.00 H new ATOM 0 HH12 ARG A 131 13.330 -1.674 -10.896 1.00 0.00 H new ATOM 0 HH21 ARG A 131 14.660 -4.891 -11.452 1.00 0.00 H new ATOM 0 HH22 ARG A 131 14.822 -3.164 -11.789 1.00 0.00 H new ATOM 534 N THR A 132 6.832 -6.449 -6.655 1.00 0.00 N ATOM 535 CA THR A 132 5.966 -6.678 -5.506 1.00 0.00 C ATOM 536 C THR A 132 6.719 -6.459 -4.198 1.00 0.00 C ATOM 537 O THR A 132 6.241 -5.757 -3.308 1.00 0.00 O ATOM 538 CB THR A 132 5.384 -8.105 -5.517 1.00 0.00 C ATOM 539 OG1 THR A 132 4.798 -8.384 -6.793 1.00 0.00 O ATOM 540 CG2 THR A 132 4.338 -8.271 -4.425 1.00 0.00 C ATOM 0 H THR A 132 6.899 -7.239 -7.297 1.00 0.00 H new ATOM 0 HA THR A 132 5.149 -5.960 -5.577 1.00 0.00 H new ATOM 0 HB THR A 132 6.196 -8.807 -5.329 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.432 -9.293 -6.793 1.00 0.00 H new ATOM 0 HG21 THR A 132 3.941 -9.286 -4.452 1.00 0.00 H new ATOM 0 HG22 THR A 132 4.795 -8.086 -3.453 1.00 0.00 H new ATOM 0 HG23 THR A 132 3.527 -7.560 -4.587 1.00 0.00 H new ATOM 548 N GLN A 133 7.897 -7.064 -4.091 1.00 0.00 N ATOM 549 CA GLN A 133 8.715 -6.934 -2.891 1.00 0.00 C ATOM 550 C GLN A 133 9.195 -5.498 -2.712 1.00 0.00 C ATOM 551 O GLN A 133 9.243 -4.983 -1.594 1.00 0.00 O ATOM 552 CB GLN A 133 9.915 -7.880 -2.961 1.00 0.00 C ATOM 553 CG GLN A 133 10.545 -8.165 -1.607 1.00 0.00 C ATOM 554 CD GLN A 133 9.796 -9.228 -0.827 1.00 0.00 C ATOM 555 OE1 GLN A 133 9.943 -10.423 -1.086 1.00 0.00 O ATOM 556 NE2 GLN A 133 8.988 -8.798 0.134 1.00 0.00 N ATOM 0 H GLN A 133 8.306 -7.649 -4.820 1.00 0.00 H new ATOM 0 HA GLN A 133 8.100 -7.202 -2.032 1.00 0.00 H new ATOM 0 HB2 GLN A 133 9.599 -8.821 -3.411 1.00 0.00 H new ATOM 0 HB3 GLN A 133 10.669 -7.449 -3.620 1.00 0.00 H new ATOM 0 HG2 GLN A 133 11.577 -8.485 -1.751 1.00 0.00 H new ATOM 0 HG3 GLN A 133 10.575 -7.245 -1.023 1.00 0.00 H new ATOM 0 HE21 GLN A 133 8.897 -7.798 0.314 1.00 0.00 H new ATOM 0 HE22 GLN A 133 8.458 -9.467 0.692 1.00 0.00 H new ATOM 565 N ASP A 134 9.549 -4.855 -3.819 1.00 0.00 N ATOM 566 CA ASP A 134 10.025 -3.477 -3.785 1.00 0.00 C ATOM 567 C ASP A 134 8.969 -2.553 -3.187 1.00 0.00 C ATOM 568 O ASP A 134 9.263 -1.750 -2.302 1.00 0.00 O ATOM 569 CB ASP A 134 10.394 -3.007 -5.193 1.00 0.00 C ATOM 570 CG ASP A 134 11.755 -3.509 -5.633 1.00 0.00 C ATOM 571 OD1 ASP A 134 12.203 -4.549 -5.106 1.00 0.00 O ATOM 572 OD2 ASP A 134 12.372 -2.862 -6.504 1.00 0.00 O ATOM 0 H ASP A 134 9.515 -5.266 -4.752 1.00 0.00 H new ATOM 0 HA ASP A 134 10.913 -3.441 -3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.638 -3.352 -5.898 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.385 -1.917 -5.223 1.00 0.00 H new ATOM 577 N ALA A 135 7.740 -2.671 -3.678 1.00 0.00 N ATOM 578 CA ALA A 135 6.640 -1.847 -3.192 1.00 0.00 C ATOM 579 C ALA A 135 6.371 -2.108 -1.714 1.00 0.00 C ATOM 580 O ALA A 135 6.163 -1.176 -0.937 1.00 0.00 O ATOM 581 CB ALA A 135 5.385 -2.103 -4.013 1.00 0.00 C ATOM 0 H ALA A 135 7.481 -3.330 -4.412 1.00 0.00 H new ATOM 0 HA ALA A 135 6.925 -0.801 -3.303 1.00 0.00 H new ATOM 0 HB1 ALA A 135 4.572 -1.481 -3.639 1.00 0.00 H new ATOM 0 HB2 ALA A 135 5.577 -1.859 -5.058 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.105 -3.153 -3.932 1.00 0.00 H new ATOM 587 N ILE A 136 6.374 -3.381 -1.332 1.00 0.00 N ATOM 588 CA ILE A 136 6.130 -3.764 0.053 1.00 0.00 C ATOM 589 C ILE A 136 7.180 -3.164 0.982 1.00 0.00 C ATOM 590 O ILE A 136 6.859 -2.675 2.064 1.00 0.00 O ATOM 591 CB ILE A 136 6.126 -5.295 0.221 1.00 0.00 C ATOM 592 CG1 ILE A 136 4.982 -5.915 -0.584 1.00 0.00 C ATOM 593 CG2 ILE A 136 6.007 -5.665 1.692 1.00 0.00 C ATOM 594 CD1 ILE A 136 5.165 -7.392 -0.853 1.00 0.00 C ATOM 0 H ILE A 136 6.543 -4.165 -1.963 1.00 0.00 H new ATOM 0 HA ILE A 136 5.147 -3.375 0.320 1.00 0.00 H new ATOM 0 HB ILE A 136 7.068 -5.691 -0.159 1.00 0.00 H new ATOM 0 HG12 ILE A 136 4.046 -5.765 -0.045 1.00 0.00 H new ATOM 0 HG13 ILE A 136 4.890 -5.389 -1.534 1.00 0.00 H new ATOM 0 HG21 ILE A 136 6.005 -6.750 1.795 1.00 0.00 H new ATOM 0 HG22 ILE A 136 6.852 -5.249 2.241 1.00 0.00 H new ATOM 0 HG23 ILE A 136 5.078 -5.261 2.095 1.00 0.00 H new ATOM 0 HD11 ILE A 136 4.317 -7.765 -1.428 1.00 0.00 H new ATOM 0 HD12 ILE A 136 6.084 -7.548 -1.419 1.00 0.00 H new ATOM 0 HD13 ILE A 136 5.226 -7.929 0.093 1.00 0.00 H new ATOM 606 N ASN A 137 8.436 -3.204 0.550 1.00 0.00 N ATOM 607 CA ASN A 137 9.535 -2.663 1.343 1.00 0.00 C ATOM 608 C ASN A 137 9.295 -1.193 1.673 1.00 0.00 C ATOM 609 O ASN A 137 9.594 -0.737 2.777 1.00 0.00 O ATOM 610 CB ASN A 137 10.859 -2.819 0.592 1.00 0.00 C ATOM 611 CG ASN A 137 11.314 -4.264 0.518 1.00 0.00 C ATOM 612 OD1 ASN A 137 11.221 -5.006 1.496 1.00 0.00 O ATOM 613 ND2 ASN A 137 11.811 -4.669 -0.645 1.00 0.00 N ATOM 0 H ASN A 137 8.719 -3.605 -0.344 1.00 0.00 H new ATOM 0 HA ASN A 137 9.587 -3.223 2.277 1.00 0.00 H new ATOM 0 HB2 ASN A 137 10.750 -2.423 -0.418 1.00 0.00 H new ATOM 0 HB3 ASN A 137 11.627 -2.224 1.087 1.00 0.00 H new ATOM 0 HD21 ASN A 137 12.135 -5.630 -0.754 1.00 0.00 H new ATOM 0 HD22 ASN A 137 11.869 -4.019 -1.429 1.00 0.00 H new ATOM 620 N ARG A 138 8.752 -0.457 0.709 1.00 0.00 N ATOM 621 CA ARG A 138 8.472 0.962 0.897 1.00 0.00 C ATOM 622 C ARG A 138 7.380 1.167 1.942 1.00 0.00 C ATOM 623 O ARG A 138 7.455 2.084 2.760 1.00 0.00 O ATOM 624 CB ARG A 138 8.051 1.600 -0.428 1.00 0.00 C ATOM 625 CG ARG A 138 9.132 1.556 -1.496 1.00 0.00 C ATOM 626 CD ARG A 138 10.288 2.483 -1.157 1.00 0.00 C ATOM 627 NE ARG A 138 11.224 1.870 -0.219 1.00 0.00 N ATOM 628 CZ ARG A 138 12.413 2.386 0.076 1.00 0.00 C ATOM 629 NH1 ARG A 138 12.808 3.517 -0.491 1.00 0.00 N ATOM 630 NH2 ARG A 138 13.208 1.769 0.941 1.00 0.00 N ATOM 0 H ARG A 138 8.497 -0.819 -0.210 1.00 0.00 H new ATOM 0 HA ARG A 138 9.384 1.443 1.251 1.00 0.00 H new ATOM 0 HB2 ARG A 138 7.163 1.090 -0.801 1.00 0.00 H new ATOM 0 HB3 ARG A 138 7.771 2.638 -0.249 1.00 0.00 H new ATOM 0 HG2 ARG A 138 9.501 0.536 -1.600 1.00 0.00 H new ATOM 0 HG3 ARG A 138 8.706 1.841 -2.458 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.816 2.753 -2.071 1.00 0.00 H new ATOM 0 HD3 ARG A 138 9.898 3.407 -0.729 1.00 0.00 H new ATOM 0 HE ARG A 138 10.951 0.998 0.235 1.00 0.00 H new ATOM 0 HH11 ARG A 138 12.199 3.994 -1.156 1.00 0.00 H new ATOM 0 HH12 ARG A 138 13.721 3.910 -0.262 1.00 0.00 H new ATOM 0 HH21 ARG A 138 12.907 0.899 1.380 1.00 0.00 H new ATOM 0 HH22 ARG A 138 14.120 2.165 1.167 1.00 0.00 H new ATOM 644 N ILE A 139 6.368 0.307 1.909 1.00 0.00 N ATOM 645 CA ILE A 139 5.261 0.394 2.854 1.00 0.00 C ATOM 646 C ILE A 139 5.721 0.069 4.271 1.00 0.00 C ATOM 647 O ILE A 139 5.425 0.803 5.213 1.00 0.00 O ATOM 648 CB ILE A 139 4.115 -0.559 2.467 1.00 0.00 C ATOM 649 CG1 ILE A 139 3.505 -0.142 1.127 1.00 0.00 C ATOM 650 CG2 ILE A 139 3.052 -0.578 3.556 1.00 0.00 C ATOM 651 CD1 ILE A 139 2.600 -1.192 0.522 1.00 0.00 C ATOM 0 H ILE A 139 6.291 -0.458 1.239 1.00 0.00 H new ATOM 0 HA ILE A 139 4.896 1.421 2.820 1.00 0.00 H new ATOM 0 HB ILE A 139 4.519 -1.566 2.363 1.00 0.00 H new ATOM 0 HG12 ILE A 139 2.938 0.778 1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.308 0.082 0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 139 2.248 -1.256 3.268 1.00 0.00 H new ATOM 0 HG22 ILE A 139 3.496 -0.918 4.492 1.00 0.00 H new ATOM 0 HG23 ILE A 139 2.649 0.426 3.689 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.203 -0.828 -0.426 1.00 0.00 H new ATOM 0 HD12 ILE A 139 3.168 -2.107 0.351 1.00 0.00 H new ATOM 0 HD13 ILE A 139 1.776 -1.399 1.205 1.00 0.00 H new ATOM 663 N GLN A 140 6.448 -1.034 4.412 1.00 0.00 N ATOM 664 CA GLN A 140 6.951 -1.455 5.715 1.00 0.00 C ATOM 665 C GLN A 140 7.923 -0.426 6.282 1.00 0.00 C ATOM 666 O GLN A 140 7.929 -0.159 7.484 1.00 0.00 O ATOM 667 CB GLN A 140 7.639 -2.817 5.604 1.00 0.00 C ATOM 668 CG GLN A 140 6.679 -3.992 5.693 1.00 0.00 C ATOM 669 CD GLN A 140 6.472 -4.470 7.117 1.00 0.00 C ATOM 670 OE1 GLN A 140 7.372 -4.378 7.952 1.00 0.00 O ATOM 671 NE2 GLN A 140 5.281 -4.984 7.402 1.00 0.00 N ATOM 0 H GLN A 140 6.702 -1.652 3.641 1.00 0.00 H new ATOM 0 HA GLN A 140 6.102 -1.539 6.394 1.00 0.00 H new ATOM 0 HB2 GLN A 140 8.175 -2.868 4.656 1.00 0.00 H new ATOM 0 HB3 GLN A 140 8.382 -2.905 6.396 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.718 -3.704 5.267 1.00 0.00 H new ATOM 0 HG3 GLN A 140 7.061 -4.815 5.089 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.564 -5.041 6.679 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.083 -5.322 8.344 1.00 0.00 H new ATOM 680 N ASP A 141 8.745 0.148 5.410 1.00 0.00 N ATOM 681 CA ASP A 141 9.721 1.149 5.823 1.00 0.00 C ATOM 682 C ASP A 141 9.029 2.437 6.257 1.00 0.00 C ATOM 683 O ASP A 141 9.354 3.009 7.298 1.00 0.00 O ATOM 684 CB ASP A 141 10.699 1.439 4.684 1.00 0.00 C ATOM 685 CG ASP A 141 12.036 1.950 5.184 1.00 0.00 C ATOM 686 OD1 ASP A 141 12.082 3.085 5.702 1.00 0.00 O ATOM 687 OD2 ASP A 141 13.037 1.213 5.059 1.00 0.00 O ATOM 0 H ASP A 141 8.754 -0.063 4.412 1.00 0.00 H new ATOM 0 HA ASP A 141 10.274 0.751 6.674 1.00 0.00 H new ATOM 0 HB2 ASP A 141 10.855 0.530 4.103 1.00 0.00 H new ATOM 0 HB3 ASP A 141 10.260 2.176 4.011 1.00 0.00 H new ATOM 692 N LEU A 142 8.074 2.889 5.452 1.00 0.00 N ATOM 693 CA LEU A 142 7.336 4.111 5.751 1.00 0.00 C ATOM 694 C LEU A 142 6.516 3.953 7.027 1.00 0.00 C ATOM 695 O LEU A 142 6.381 4.893 7.812 1.00 0.00 O ATOM 696 CB LEU A 142 6.418 4.475 4.583 1.00 0.00 C ATOM 697 CG LEU A 142 7.113 4.940 3.303 1.00 0.00 C ATOM 698 CD1 LEU A 142 6.170 4.831 2.114 1.00 0.00 C ATOM 699 CD2 LEU A 142 7.616 6.368 3.458 1.00 0.00 C ATOM 0 H LEU A 142 7.792 2.428 4.587 1.00 0.00 H new ATOM 0 HA LEU A 142 8.057 4.914 5.902 1.00 0.00 H new ATOM 0 HB2 LEU A 142 5.805 3.606 4.345 1.00 0.00 H new ATOM 0 HB3 LEU A 142 5.740 5.263 4.911 1.00 0.00 H new ATOM 0 HG LEU A 142 7.970 4.292 3.121 1.00 0.00 H new ATOM 0 HD11 LEU A 142 6.682 5.166 1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 142 5.859 3.794 1.990 1.00 0.00 H new ATOM 0 HD13 LEU A 142 5.293 5.455 2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 142 8.108 6.682 2.538 1.00 0.00 H new ATOM 0 HD22 LEU A 142 6.775 7.030 3.664 1.00 0.00 H new ATOM 0 HD23 LEU A 142 8.326 6.416 4.284 1.00 0.00 H new ATOM 711 N LEU A 143 5.971 2.759 7.230 1.00 0.00 N ATOM 712 CA LEU A 143 5.166 2.476 8.413 1.00 0.00 C ATOM 713 C LEU A 143 6.037 2.412 9.663 1.00 0.00 C ATOM 714 O LEU A 143 5.602 2.777 10.756 1.00 0.00 O ATOM 715 CB LEU A 143 4.411 1.157 8.236 1.00 0.00 C ATOM 716 CG LEU A 143 3.181 1.204 7.329 1.00 0.00 C ATOM 717 CD1 LEU A 143 2.559 -0.178 7.201 1.00 0.00 C ATOM 718 CD2 LEU A 143 2.163 2.202 7.861 1.00 0.00 C ATOM 0 H LEU A 143 6.072 1.971 6.590 1.00 0.00 H new ATOM 0 HA LEU A 143 4.447 3.286 8.535 1.00 0.00 H new ATOM 0 HB2 LEU A 143 5.104 0.416 7.837 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.099 0.805 9.219 1.00 0.00 H new ATOM 0 HG LEU A 143 3.497 1.531 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 143 1.685 -0.125 6.552 1.00 0.00 H new ATOM 0 HD12 LEU A 143 3.288 -0.867 6.773 1.00 0.00 H new ATOM 0 HD13 LEU A 143 2.258 -0.534 8.186 1.00 0.00 H new ATOM 0 HD21 LEU A 143 1.295 2.222 7.203 1.00 0.00 H new ATOM 0 HD22 LEU A 143 1.852 1.906 8.863 1.00 0.00 H new ATOM 0 HD23 LEU A 143 2.612 3.194 7.899 1.00 0.00 H new ATOM 730 N THR A 144 7.272 1.949 9.494 1.00 0.00 N ATOM 731 CA THR A 144 8.205 1.839 10.608 1.00 0.00 C ATOM 732 C THR A 144 8.640 3.215 11.099 1.00 0.00 C ATOM 733 O THR A 144 8.763 3.444 12.302 1.00 0.00 O ATOM 734 CB THR A 144 9.455 1.029 10.216 1.00 0.00 C ATOM 735 OG1 THR A 144 9.078 -0.300 9.836 1.00 0.00 O ATOM 736 CG2 THR A 144 10.446 0.970 11.368 1.00 0.00 C ATOM 0 H THR A 144 7.649 1.644 8.596 1.00 0.00 H new ATOM 0 HA THR A 144 7.680 1.319 11.409 1.00 0.00 H new ATOM 0 HB THR A 144 9.933 1.527 9.372 1.00 0.00 H new ATOM 0 HG1 THR A 144 8.852 -0.316 8.883 1.00 0.00 H new ATOM 0 HG21 THR A 144 11.320 0.393 11.067 1.00 0.00 H new ATOM 0 HG22 THR A 144 10.753 1.981 11.636 1.00 0.00 H new ATOM 0 HG23 THR A 144 9.976 0.494 12.228 1.00 0.00 H new ATOM 744 N GLU A 145 8.870 4.128 10.161 1.00 0.00 N ATOM 745 CA GLU A 145 9.291 5.482 10.500 1.00 0.00 C ATOM 746 C GLU A 145 8.124 6.292 11.057 1.00 0.00 C ATOM 747 O GLU A 145 8.320 7.298 11.737 1.00 0.00 O ATOM 748 CB GLU A 145 9.872 6.183 9.270 1.00 0.00 C ATOM 749 CG GLU A 145 11.023 5.428 8.627 1.00 0.00 C ATOM 750 CD GLU A 145 11.999 6.347 7.918 1.00 0.00 C ATOM 751 OE1 GLU A 145 12.861 6.940 8.601 1.00 0.00 O ATOM 752 OE2 GLU A 145 11.902 6.473 6.679 1.00 0.00 O ATOM 0 H GLU A 145 8.772 3.955 9.161 1.00 0.00 H new ATOM 0 HA GLU A 145 10.062 5.413 11.268 1.00 0.00 H new ATOM 0 HB2 GLU A 145 9.081 6.320 8.533 1.00 0.00 H new ATOM 0 HB3 GLU A 145 10.216 7.177 9.557 1.00 0.00 H new ATOM 0 HG2 GLU A 145 11.554 4.861 9.392 1.00 0.00 H new ATOM 0 HG3 GLU A 145 10.626 4.706 7.914 1.00 0.00 H new ATOM 759 N GLY A 146 6.907 5.844 10.761 1.00 0.00 N ATOM 760 CA GLY A 146 5.725 6.538 11.238 1.00 0.00 C ATOM 761 C GLY A 146 5.052 7.352 10.151 1.00 0.00 C ATOM 762 O GLY A 146 3.882 7.716 10.270 1.00 0.00 O ATOM 0 H GLY A 146 6.719 5.013 10.200 1.00 0.00 H new ATOM 0 HA2 GLY A 146 5.016 5.811 11.635 1.00 0.00 H new ATOM 0 HA3 GLY A 146 6.002 7.196 12.062 1.00 0.00 H new ATOM 766 N THR A 147 5.793 7.640 9.085 1.00 0.00 N ATOM 767 CA THR A 147 5.262 8.419 7.973 1.00 0.00 C ATOM 768 C THR A 147 3.869 7.940 7.582 1.00 0.00 C ATOM 769 O THR A 147 3.059 8.709 7.064 1.00 0.00 O ATOM 770 CB THR A 147 6.184 8.340 6.741 1.00 0.00 C ATOM 771 OG1 THR A 147 7.519 8.710 7.104 1.00 0.00 O ATOM 772 CG2 THR A 147 5.683 9.251 5.631 1.00 0.00 C ATOM 0 H THR A 147 6.763 7.345 8.969 1.00 0.00 H new ATOM 0 HA THR A 147 5.206 9.454 8.310 1.00 0.00 H new ATOM 0 HB THR A 147 6.179 7.313 6.376 1.00 0.00 H new ATOM 0 HG1 THR A 147 8.099 8.656 6.316 1.00 0.00 H new ATOM 0 HG21 THR A 147 6.350 9.178 4.772 1.00 0.00 H new ATOM 0 HG22 THR A 147 4.678 8.948 5.337 1.00 0.00 H new ATOM 0 HG23 THR A 147 5.661 10.281 5.987 1.00 0.00 H new ATOM 780 N LEU A 148 3.595 6.664 7.834 1.00 0.00 N ATOM 781 CA LEU A 148 2.297 6.082 7.509 1.00 0.00 C ATOM 782 C LEU A 148 1.830 5.141 8.615 1.00 0.00 C ATOM 783 O LEU A 148 2.633 4.437 9.227 1.00 0.00 O ATOM 784 CB LEU A 148 2.373 5.328 6.181 1.00 0.00 C ATOM 785 CG LEU A 148 2.326 6.187 4.917 1.00 0.00 C ATOM 786 CD1 LEU A 148 2.879 5.418 3.727 1.00 0.00 C ATOM 787 CD2 LEU A 148 0.903 6.651 4.640 1.00 0.00 C ATOM 0 H LEU A 148 4.254 6.013 8.262 1.00 0.00 H new ATOM 0 HA LEU A 148 1.575 6.893 7.419 1.00 0.00 H new ATOM 0 HB2 LEU A 148 3.296 4.748 6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 148 1.549 4.616 6.143 1.00 0.00 H new ATOM 0 HG LEU A 148 2.950 7.067 5.076 1.00 0.00 H new ATOM 0 HD11 LEU A 148 2.837 6.046 2.837 1.00 0.00 H new ATOM 0 HD12 LEU A 148 3.913 5.137 3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 148 2.283 4.520 3.566 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.889 7.261 3.737 1.00 0.00 H new ATOM 0 HD22 LEU A 148 0.258 5.783 4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 148 0.542 7.241 5.482 1.00 0.00 H new ATOM 799 N THR A 149 0.524 5.133 8.866 1.00 0.00 N ATOM 800 CA THR A 149 -0.051 4.279 9.897 1.00 0.00 C ATOM 801 C THR A 149 -1.013 3.262 9.295 1.00 0.00 C ATOM 802 O THR A 149 -1.983 3.627 8.632 1.00 0.00 O ATOM 803 CB THR A 149 -0.796 5.106 10.961 1.00 0.00 C ATOM 804 OG1 THR A 149 0.067 6.121 11.486 1.00 0.00 O ATOM 805 CG2 THR A 149 -1.287 4.216 12.093 1.00 0.00 C ATOM 0 H THR A 149 -0.155 5.709 8.369 1.00 0.00 H new ATOM 0 HA THR A 149 0.778 3.754 10.371 1.00 0.00 H new ATOM 0 HB THR A 149 -1.659 5.573 10.487 1.00 0.00 H new ATOM 0 HG1 THR A 149 -0.415 6.643 12.161 1.00 0.00 H new ATOM 0 HG21 THR A 149 -1.810 4.823 12.832 1.00 0.00 H new ATOM 0 HG22 THR A 149 -1.967 3.463 11.695 1.00 0.00 H new ATOM 0 HG23 THR A 149 -0.436 3.724 12.564 1.00 0.00 H new ATOM 813 N GLY A 150 -0.738 1.982 9.530 1.00 0.00 N ATOM 814 CA GLY A 150 -1.590 0.931 9.004 1.00 0.00 C ATOM 815 C GLY A 150 -1.298 -0.419 9.628 1.00 0.00 C ATOM 816 O GLY A 150 -0.358 -0.559 10.410 1.00 0.00 O ATOM 0 H GLY A 150 0.059 1.654 10.075 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -2.634 1.191 9.181 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -1.456 0.865 7.924 1.00 0.00 H new ATOM 820 N VAL A 151 -2.108 -1.415 9.285 1.00 0.00 N ATOM 821 CA VAL A 151 -1.933 -2.761 9.818 1.00 0.00 C ATOM 822 C VAL A 151 -2.001 -3.804 8.708 1.00 0.00 C ATOM 823 O VAL A 151 -2.699 -3.620 7.711 1.00 0.00 O ATOM 824 CB VAL A 151 -3.000 -3.087 10.880 1.00 0.00 C ATOM 825 CG1 VAL A 151 -2.824 -2.202 12.104 1.00 0.00 C ATOM 826 CG2 VAL A 151 -4.397 -2.933 10.297 1.00 0.00 C ATOM 0 H VAL A 151 -2.892 -1.315 8.640 1.00 0.00 H new ATOM 0 HA VAL A 151 -0.947 -2.792 10.283 1.00 0.00 H new ATOM 0 HB VAL A 151 -2.873 -4.124 11.190 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -3.587 -2.447 12.843 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -1.836 -2.368 12.534 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -2.923 -1.156 11.814 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -5.138 -3.167 11.061 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -4.538 -1.907 9.957 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -4.517 -3.614 9.455 1.00 0.00 H new ATOM 836 N ILE A 152 -1.271 -4.900 8.889 1.00 0.00 N ATOM 837 CA ILE A 152 -1.249 -5.974 7.904 1.00 0.00 C ATOM 838 C ILE A 152 -1.835 -7.259 8.479 1.00 0.00 C ATOM 839 O ILE A 152 -1.445 -7.702 9.559 1.00 0.00 O ATOM 840 CB ILE A 152 0.181 -6.252 7.406 1.00 0.00 C ATOM 841 CG1 ILE A 152 0.760 -5.008 6.729 1.00 0.00 C ATOM 842 CG2 ILE A 152 0.188 -7.434 6.448 1.00 0.00 C ATOM 843 CD1 ILE A 152 2.261 -5.064 6.544 1.00 0.00 C ATOM 0 H ILE A 152 -0.687 -5.067 9.709 1.00 0.00 H new ATOM 0 HA ILE A 152 -1.859 -5.644 7.063 1.00 0.00 H new ATOM 0 HB ILE A 152 0.806 -6.500 8.264 1.00 0.00 H new ATOM 0 HG12 ILE A 152 0.287 -4.880 5.756 1.00 0.00 H new ATOM 0 HG13 ILE A 152 0.508 -4.130 7.324 1.00 0.00 H new ATOM 0 HG21 ILE A 152 1.206 -7.618 6.105 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -0.188 -8.320 6.960 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -0.449 -7.212 5.592 1.00 0.00 H new ATOM 0 HD11 ILE A 152 2.602 -4.150 6.058 1.00 0.00 H new ATOM 0 HD12 ILE A 152 2.744 -5.160 7.516 1.00 0.00 H new ATOM 0 HD13 ILE A 152 2.519 -5.922 5.924 1.00 0.00 H new ATOM 855 N ASP A 153 -2.771 -7.854 7.749 1.00 0.00 N ATOM 856 CA ASP A 153 -3.409 -9.091 8.184 1.00 0.00 C ATOM 857 C ASP A 153 -2.704 -10.305 7.588 1.00 0.00 C ATOM 858 O ASP A 153 -1.772 -10.167 6.796 1.00 0.00 O ATOM 859 CB ASP A 153 -4.886 -9.097 7.785 1.00 0.00 C ATOM 860 CG ASP A 153 -5.086 -8.845 6.303 1.00 0.00 C ATOM 861 OD1 ASP A 153 -4.189 -9.208 5.513 1.00 0.00 O ATOM 862 OD2 ASP A 153 -6.140 -8.287 5.934 1.00 0.00 O ATOM 0 H ASP A 153 -3.105 -7.500 6.853 1.00 0.00 H new ATOM 0 HA ASP A 153 -3.334 -9.146 9.270 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -5.327 -10.058 8.050 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -5.417 -8.334 8.355 1.00 0.00 H new ATOM 867 N ASP A 154 -3.154 -11.494 7.975 1.00 0.00 N ATOM 868 CA ASP A 154 -2.566 -12.733 7.479 1.00 0.00 C ATOM 869 C ASP A 154 -2.918 -12.952 6.011 1.00 0.00 C ATOM 870 O ASP A 154 -2.516 -13.947 5.408 1.00 0.00 O ATOM 871 CB ASP A 154 -3.047 -13.920 8.314 1.00 0.00 C ATOM 872 CG ASP A 154 -4.555 -13.948 8.467 1.00 0.00 C ATOM 873 OD1 ASP A 154 -5.082 -13.176 9.295 1.00 0.00 O ATOM 874 OD2 ASP A 154 -5.208 -14.742 7.758 1.00 0.00 O ATOM 0 H ASP A 154 -3.924 -11.626 8.631 1.00 0.00 H new ATOM 0 HA ASP A 154 -1.482 -12.653 7.566 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -2.715 -14.847 7.847 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -2.586 -13.877 9.301 1.00 0.00 H new ATOM 879 N ARG A 155 -3.671 -12.016 5.443 1.00 0.00 N ATOM 880 CA ARG A 155 -4.079 -12.108 4.046 1.00 0.00 C ATOM 881 C ARG A 155 -3.280 -11.137 3.181 1.00 0.00 C ATOM 882 O ARG A 155 -3.727 -10.733 2.108 1.00 0.00 O ATOM 883 CB ARG A 155 -5.575 -11.818 3.909 1.00 0.00 C ATOM 884 CG ARG A 155 -6.189 -12.378 2.637 1.00 0.00 C ATOM 885 CD ARG A 155 -7.693 -12.560 2.778 1.00 0.00 C ATOM 886 NE ARG A 155 -8.034 -13.851 3.368 1.00 0.00 N ATOM 887 CZ ARG A 155 -9.249 -14.160 3.807 1.00 0.00 C ATOM 888 NH1 ARG A 155 -10.233 -13.275 3.723 1.00 0.00 N ATOM 889 NH2 ARG A 155 -9.482 -15.356 4.332 1.00 0.00 N ATOM 0 H ARG A 155 -4.011 -11.186 5.928 1.00 0.00 H new ATOM 0 HA ARG A 155 -3.880 -13.123 3.702 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -6.098 -12.236 4.769 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -5.731 -10.740 3.934 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -5.979 -11.707 1.804 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -5.726 -13.336 2.399 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -8.099 -11.760 3.397 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -8.162 -12.474 1.798 1.00 0.00 H new ATOM 0 HE ARG A 155 -7.299 -14.554 3.447 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -10.058 -12.354 3.320 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -11.165 -13.515 4.061 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -8.728 -16.039 4.399 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -10.415 -15.592 4.669 1.00 0.00 H new ATOM 903 N GLY A 156 -2.095 -10.765 3.657 1.00 0.00 N ATOM 904 CA GLY A 156 -1.254 -9.844 2.916 1.00 0.00 C ATOM 905 C GLY A 156 -2.034 -8.673 2.351 1.00 0.00 C ATOM 906 O GLY A 156 -1.827 -8.275 1.205 1.00 0.00 O ATOM 0 H GLY A 156 -1.703 -11.085 4.543 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -0.466 -9.470 3.570 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -0.765 -10.378 2.101 1.00 0.00 H new ATOM 910 N LYS A 157 -2.934 -8.120 3.157 1.00 0.00 N ATOM 911 CA LYS A 157 -3.749 -6.988 2.732 1.00 0.00 C ATOM 912 C LYS A 157 -3.329 -5.713 3.457 1.00 0.00 C ATOM 913 O LYS A 157 -2.880 -5.758 4.602 1.00 0.00 O ATOM 914 CB LYS A 157 -5.230 -7.272 2.994 1.00 0.00 C ATOM 915 CG LYS A 157 -6.168 -6.311 2.285 1.00 0.00 C ATOM 916 CD LYS A 157 -7.620 -6.733 2.440 1.00 0.00 C ATOM 917 CE LYS A 157 -8.560 -5.542 2.336 1.00 0.00 C ATOM 918 NZ LYS A 157 -8.391 -4.601 3.478 1.00 0.00 N ATOM 0 H LYS A 157 -3.118 -8.438 4.109 1.00 0.00 H new ATOM 0 HA LYS A 157 -3.597 -6.844 1.662 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -5.458 -8.290 2.677 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -5.416 -7.223 4.067 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -6.035 -5.307 2.688 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -5.912 -6.266 1.226 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -7.871 -7.465 1.672 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -7.757 -7.223 3.404 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -8.376 -5.014 1.400 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -9.591 -5.895 2.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -9.265 -4.053 3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -8.187 -5.139 4.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.603 -3.952 3.280 1.00 0.00 H new ATOM 932 N PHE A 158 -3.478 -4.578 2.782 1.00 0.00 N ATOM 933 CA PHE A 158 -3.115 -3.290 3.362 1.00 0.00 C ATOM 934 C PHE A 158 -4.360 -2.491 3.734 1.00 0.00 C ATOM 935 O PHE A 158 -5.221 -2.236 2.892 1.00 0.00 O ATOM 936 CB PHE A 158 -2.254 -2.490 2.382 1.00 0.00 C ATOM 937 CG PHE A 158 -1.507 -1.358 3.027 1.00 0.00 C ATOM 938 CD1 PHE A 158 -0.654 -1.592 4.093 1.00 0.00 C ATOM 939 CD2 PHE A 158 -1.658 -0.060 2.567 1.00 0.00 C ATOM 940 CE1 PHE A 158 0.034 -0.552 4.689 1.00 0.00 C ATOM 941 CE2 PHE A 158 -0.972 0.984 3.158 1.00 0.00 C ATOM 942 CZ PHE A 158 -0.124 0.738 4.220 1.00 0.00 C ATOM 0 H PHE A 158 -3.848 -4.524 1.833 1.00 0.00 H new ATOM 0 HA PHE A 158 -2.541 -3.477 4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -1.540 -3.162 1.906 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -2.891 -2.091 1.593 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -0.525 -2.599 4.463 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -2.320 0.138 1.737 1.00 0.00 H new ATOM 0 HE1 PHE A 158 0.695 -0.748 5.521 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -1.099 1.991 2.790 1.00 0.00 H new ATOM 0 HZ PHE A 158 0.414 1.552 4.683 1.00 0.00 H new ATOM 952 N ILE A 159 -4.447 -2.098 5.001 1.00 0.00 N ATOM 953 CA ILE A 159 -5.586 -1.327 5.484 1.00 0.00 C ATOM 954 C ILE A 159 -5.137 0.008 6.070 1.00 0.00 C ATOM 955 O ILE A 159 -4.430 0.049 7.077 1.00 0.00 O ATOM 956 CB ILE A 159 -6.378 -2.103 6.553 1.00 0.00 C ATOM 957 CG1 ILE A 159 -6.854 -3.445 5.992 1.00 0.00 C ATOM 958 CG2 ILE A 159 -7.560 -1.277 7.040 1.00 0.00 C ATOM 959 CD1 ILE A 159 -7.210 -4.454 7.060 1.00 0.00 C ATOM 0 H ILE A 159 -3.743 -2.301 5.711 1.00 0.00 H new ATOM 0 HA ILE A 159 -6.232 -1.146 4.625 1.00 0.00 H new ATOM 0 HB ILE A 159 -5.721 -2.297 7.401 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -7.725 -3.276 5.358 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -6.073 -3.861 5.356 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.110 -1.839 7.795 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -7.198 -0.345 7.473 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -8.219 -1.055 6.201 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -7.539 -5.381 6.590 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -6.335 -4.652 7.680 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -8.013 -4.058 7.682 1.00 0.00 H new ATOM 971 N TYR A 160 -5.553 1.096 5.433 1.00 0.00 N ATOM 972 CA TYR A 160 -5.194 2.434 5.890 1.00 0.00 C ATOM 973 C TYR A 160 -6.403 3.149 6.485 1.00 0.00 C ATOM 974 O TYR A 160 -7.520 3.029 5.980 1.00 0.00 O ATOM 975 CB TYR A 160 -4.620 3.254 4.734 1.00 0.00 C ATOM 976 CG TYR A 160 -3.687 4.357 5.178 1.00 0.00 C ATOM 977 CD1 TYR A 160 -2.509 4.067 5.856 1.00 0.00 C ATOM 978 CD2 TYR A 160 -3.982 5.690 4.919 1.00 0.00 C ATOM 979 CE1 TYR A 160 -1.654 5.072 6.265 1.00 0.00 C ATOM 980 CE2 TYR A 160 -3.132 6.701 5.323 1.00 0.00 C ATOM 981 CZ TYR A 160 -1.969 6.387 5.996 1.00 0.00 C ATOM 982 OH TYR A 160 -1.119 7.391 6.400 1.00 0.00 O ATOM 0 H TYR A 160 -6.139 1.079 4.598 1.00 0.00 H new ATOM 0 HA TYR A 160 -4.436 2.334 6.667 1.00 0.00 H new ATOM 0 HB2 TYR A 160 -4.085 2.587 4.058 1.00 0.00 H new ATOM 0 HB3 TYR A 160 -5.442 3.691 4.167 1.00 0.00 H new ATOM 0 HD1 TYR A 160 -2.258 3.038 6.067 1.00 0.00 H new ATOM 0 HD2 TYR A 160 -4.891 5.940 4.393 1.00 0.00 H new ATOM 0 HE1 TYR A 160 -0.744 4.829 6.793 1.00 0.00 H new ATOM 0 HE2 TYR A 160 -3.376 7.732 5.113 1.00 0.00 H new ATOM 0 HH TYR A 160 -1.150 8.126 5.752 1.00 0.00 H new ATOM 992 N ILE A 161 -6.171 3.894 7.561 1.00 0.00 N ATOM 993 CA ILE A 161 -7.240 4.630 8.224 1.00 0.00 C ATOM 994 C ILE A 161 -6.971 6.131 8.199 1.00 0.00 C ATOM 995 O ILE A 161 -6.183 6.646 8.992 1.00 0.00 O ATOM 996 CB ILE A 161 -7.414 4.176 9.685 1.00 0.00 C ATOM 997 CG1 ILE A 161 -7.662 2.668 9.747 1.00 0.00 C ATOM 998 CG2 ILE A 161 -8.557 4.934 10.343 1.00 0.00 C ATOM 999 CD1 ILE A 161 -7.471 2.080 11.128 1.00 0.00 C ATOM 0 H ILE A 161 -5.253 4.004 7.992 1.00 0.00 H new ATOM 0 HA ILE A 161 -8.157 4.418 7.674 1.00 0.00 H new ATOM 0 HB ILE A 161 -6.496 4.397 10.230 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -8.678 2.461 9.410 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -6.988 2.168 9.052 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -8.667 4.602 11.375 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -8.342 6.002 10.327 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -9.482 4.742 9.799 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -7.663 1.008 11.097 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -6.448 2.256 11.460 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -8.164 2.553 11.824 1.00 0.00 H new