USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 448 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 157 TYR OH : rot 76:sc= 0.765 USER MOD Single : A 164 THR OG1 : rot 180:sc= -0.0169 USER MOD Single : A 166 GLN : amide:sc= -2.03 K(o=-2,f=-8.7!) USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ 139:sc= -0.0803 (180deg=-0.538) USER MOD Single : A 175 LYS NZ :NH3+ 140:sc= 0.501 (180deg=-0.585) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 LYS NZ :NH3+ -117:sc= -1.27 (180deg=-4.64!) USER MOD Single : A 193 LYS NZ :NH3+ -134:sc= -0.0543 (180deg=-1.07) USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 ASN : amide:sc= -3.17 K(o=-3.2,f=-5.7!) USER MOD Single : A 205 THR OG1 : rot 99:sc= 0.0933 USER MOD Single : A 206 TYR OH : rot 180:sc= 0 USER MOD Single : A 210 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 15 N GLY A 154 1.513 1.128 -3.315 1.00 0.00 N ATOM 16 CA GLY A 154 1.956 2.499 -3.680 1.00 0.00 C ATOM 17 C GLY A 154 1.957 3.471 -2.512 1.00 0.00 C ATOM 18 O GLY A 154 1.480 3.184 -1.431 1.00 0.00 O ATOM 0 HA2 GLY A 154 2.961 2.447 -4.099 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.304 2.886 -4.463 1.00 0.00 H new ATOM 22 N GLU A 155 2.513 4.613 -2.802 1.00 0.00 N ATOM 23 CA GLU A 155 2.558 5.728 -1.816 1.00 0.00 C ATOM 24 C GLU A 155 2.089 6.935 -2.608 1.00 0.00 C ATOM 25 O GLU A 155 2.351 6.983 -3.791 1.00 0.00 O ATOM 26 CB GLU A 155 4.002 5.901 -1.331 1.00 0.00 C ATOM 27 CG GLU A 155 4.191 7.194 -0.506 1.00 0.00 C ATOM 28 CD GLU A 155 3.402 7.149 0.808 1.00 0.00 C ATOM 29 OE1 GLU A 155 2.189 7.272 0.746 1.00 0.00 O ATOM 30 OE2 GLU A 155 4.072 6.991 1.814 1.00 0.00 O ATOM 0 H GLU A 155 2.947 4.825 -3.700 1.00 0.00 H new ATOM 0 HA GLU A 155 1.943 5.566 -0.931 1.00 0.00 H new ATOM 0 HB2 GLU A 155 4.285 5.041 -0.724 1.00 0.00 H new ATOM 0 HB3 GLU A 155 4.672 5.919 -2.190 1.00 0.00 H new ATOM 0 HG2 GLU A 155 5.250 7.336 -0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 155 3.868 8.052 -1.095 1.00 0.00 H new ATOM 37 N GLU A 156 1.431 7.881 -1.996 1.00 0.00 N ATOM 38 CA GLU A 156 0.998 9.038 -2.821 1.00 0.00 C ATOM 39 C GLU A 156 1.812 10.272 -2.517 1.00 0.00 C ATOM 40 O GLU A 156 2.195 10.566 -1.401 1.00 0.00 O ATOM 41 CB GLU A 156 -0.488 9.341 -2.575 1.00 0.00 C ATOM 42 CG GLU A 156 -0.774 9.614 -1.097 1.00 0.00 C ATOM 43 CD GLU A 156 -2.255 9.979 -0.945 1.00 0.00 C ATOM 44 OE1 GLU A 156 -2.904 10.100 -1.970 1.00 0.00 O ATOM 45 OE2 GLU A 156 -2.658 10.118 0.195 1.00 0.00 O ATOM 0 H GLU A 156 1.184 7.905 -1.007 1.00 0.00 H new ATOM 0 HA GLU A 156 1.153 8.769 -3.866 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -0.786 10.205 -3.169 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.092 8.499 -2.913 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.537 8.735 -0.497 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -0.145 10.427 -0.734 1.00 0.00 H new ATOM 52 N TYR A 157 2.040 10.949 -3.600 1.00 0.00 N ATOM 53 CA TYR A 157 2.823 12.193 -3.616 1.00 0.00 C ATOM 54 C TYR A 157 1.855 13.129 -4.274 1.00 0.00 C ATOM 55 O TYR A 157 0.754 12.738 -4.608 1.00 0.00 O ATOM 56 CB TYR A 157 4.024 12.014 -4.489 1.00 0.00 C ATOM 57 CG TYR A 157 5.006 10.980 -3.944 1.00 0.00 C ATOM 58 CD1 TYR A 157 4.666 9.645 -3.868 1.00 0.00 C ATOM 59 CD2 TYR A 157 6.253 11.376 -3.522 1.00 0.00 C ATOM 60 CE1 TYR A 157 5.554 8.722 -3.380 1.00 0.00 C ATOM 61 CE2 TYR A 157 7.149 10.451 -3.031 1.00 0.00 C ATOM 62 CZ TYR A 157 6.805 9.115 -2.956 1.00 0.00 C ATOM 63 OH TYR A 157 7.695 8.182 -2.463 1.00 0.00 O ATOM 0 H TYR A 157 1.694 10.669 -4.518 1.00 0.00 H new ATOM 0 HA TYR A 157 3.185 12.522 -2.642 1.00 0.00 H new ATOM 0 HB2 TYR A 157 3.701 11.711 -5.485 1.00 0.00 H new ATOM 0 HB3 TYR A 157 4.534 12.971 -4.597 1.00 0.00 H new ATOM 0 HD1 TYR A 157 3.689 9.324 -4.197 1.00 0.00 H new ATOM 0 HD2 TYR A 157 6.532 12.418 -3.576 1.00 0.00 H new ATOM 0 HE1 TYR A 157 5.272 7.681 -3.327 1.00 0.00 H new ATOM 0 HE2 TYR A 157 8.126 10.773 -2.703 1.00 0.00 H new ATOM 0 HH TYR A 157 8.080 7.673 -3.206 1.00 0.00 H new ATOM 73 N ILE A 158 2.280 14.338 -4.440 1.00 0.00 N ATOM 74 CA ILE A 158 1.452 15.278 -5.170 1.00 0.00 C ATOM 75 C ILE A 158 2.413 15.759 -6.227 1.00 0.00 C ATOM 76 O ILE A 158 3.598 15.834 -5.971 1.00 0.00 O ATOM 77 CB ILE A 158 1.012 16.372 -4.197 1.00 0.00 C ATOM 78 CG1 ILE A 158 2.013 17.534 -4.093 1.00 0.00 C ATOM 79 CG2 ILE A 158 0.852 15.733 -2.828 1.00 0.00 C ATOM 80 CD1 ILE A 158 1.440 18.605 -3.136 1.00 0.00 C ATOM 0 H ILE A 158 3.168 14.704 -4.096 1.00 0.00 H new ATOM 0 HA ILE A 158 0.532 14.892 -5.608 1.00 0.00 H new ATOM 0 HB ILE A 158 0.080 16.797 -4.569 1.00 0.00 H new ATOM 0 HG12 ILE A 158 2.973 17.173 -3.723 1.00 0.00 H new ATOM 0 HG13 ILE A 158 2.193 17.966 -5.078 1.00 0.00 H new ATOM 0 HG21 ILE A 158 0.538 16.489 -2.108 1.00 0.00 H new ATOM 0 HG22 ILE A 158 0.100 14.946 -2.880 1.00 0.00 H new ATOM 0 HG23 ILE A 158 1.804 15.305 -2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 158 2.143 19.434 -3.055 1.00 0.00 H new ATOM 0 HD12 ILE A 158 0.490 18.971 -3.526 1.00 0.00 H new ATOM 0 HD13 ILE A 158 1.282 18.166 -2.151 1.00 0.00 H new ATOM 92 N ALA A 159 1.917 16.078 -7.383 1.00 0.00 N ATOM 93 CA ALA A 159 2.876 16.568 -8.392 1.00 0.00 C ATOM 94 C ALA A 159 2.966 18.039 -8.103 1.00 0.00 C ATOM 95 O ALA A 159 2.034 18.585 -7.556 1.00 0.00 O ATOM 96 CB ALA A 159 2.330 16.375 -9.788 1.00 0.00 C ATOM 0 H ALA A 159 0.938 16.025 -7.663 1.00 0.00 H new ATOM 0 HA ALA A 159 3.832 16.046 -8.344 1.00 0.00 H new ATOM 0 HB1 ALA A 159 3.053 16.743 -10.516 1.00 0.00 H new ATOM 0 HB2 ALA A 159 2.146 15.315 -9.963 1.00 0.00 H new ATOM 0 HB3 ALA A 159 1.396 16.927 -9.893 1.00 0.00 H new ATOM 102 N VAL A 160 4.078 18.606 -8.471 1.00 0.00 N ATOM 103 CA VAL A 160 4.284 20.069 -8.290 1.00 0.00 C ATOM 104 C VAL A 160 4.645 20.657 -9.650 1.00 0.00 C ATOM 105 O VAL A 160 4.857 21.844 -9.785 1.00 0.00 O ATOM 106 CB VAL A 160 5.418 20.302 -7.283 1.00 0.00 C ATOM 107 CG1 VAL A 160 4.985 19.741 -5.923 1.00 0.00 C ATOM 108 CG2 VAL A 160 6.683 19.563 -7.731 1.00 0.00 C ATOM 0 H VAL A 160 4.863 18.112 -8.895 1.00 0.00 H new ATOM 0 HA VAL A 160 3.383 20.548 -7.906 1.00 0.00 H new ATOM 0 HB VAL A 160 5.627 21.370 -7.217 1.00 0.00 H new ATOM 0 HG11 VAL A 160 5.780 19.898 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 160 4.081 20.252 -5.590 1.00 0.00 H new ATOM 0 HG13 VAL A 160 4.785 18.674 -6.017 1.00 0.00 H new ATOM 0 HG21 VAL A 160 7.481 19.736 -7.008 1.00 0.00 H new ATOM 0 HG22 VAL A 160 6.477 18.495 -7.795 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.993 19.932 -8.709 1.00 0.00 H new ATOM 118 N GLY A 161 4.712 19.792 -10.627 1.00 0.00 N ATOM 119 CA GLY A 161 5.011 20.247 -12.011 1.00 0.00 C ATOM 120 C GLY A 161 4.022 19.588 -12.971 1.00 0.00 C ATOM 121 O GLY A 161 3.354 18.639 -12.613 1.00 0.00 O ATOM 0 H GLY A 161 4.572 18.787 -10.523 1.00 0.00 H new ATOM 0 HA2 GLY A 161 4.934 21.332 -12.076 1.00 0.00 H new ATOM 0 HA3 GLY A 161 6.033 19.983 -12.282 1.00 0.00 H new ATOM 125 N ASP A 162 3.964 20.111 -14.163 1.00 0.00 N ATOM 126 CA ASP A 162 3.066 19.526 -15.202 1.00 0.00 C ATOM 127 C ASP A 162 3.976 18.776 -16.174 1.00 0.00 C ATOM 128 O ASP A 162 5.085 19.217 -16.402 1.00 0.00 O ATOM 129 CB ASP A 162 2.345 20.643 -15.943 1.00 0.00 C ATOM 130 CG ASP A 162 1.627 20.053 -17.159 1.00 0.00 C ATOM 131 OD1 ASP A 162 0.597 19.440 -16.948 1.00 0.00 O ATOM 132 OD2 ASP A 162 2.160 20.246 -18.239 1.00 0.00 O ATOM 0 H ASP A 162 4.502 20.923 -14.466 1.00 0.00 H new ATOM 0 HA ASP A 162 2.317 18.869 -14.760 1.00 0.00 H new ATOM 0 HB2 ASP A 162 1.628 21.131 -15.283 1.00 0.00 H new ATOM 0 HB3 ASP A 162 3.057 21.405 -16.260 1.00 0.00 H new ATOM 137 N PHE A 163 3.527 17.682 -16.728 1.00 0.00 N ATOM 138 CA PHE A 163 4.409 16.979 -17.704 1.00 0.00 C ATOM 139 C PHE A 163 3.573 16.521 -18.892 1.00 0.00 C ATOM 140 O PHE A 163 2.376 16.723 -18.915 1.00 0.00 O ATOM 141 CB PHE A 163 5.063 15.790 -16.983 1.00 0.00 C ATOM 142 CG PHE A 163 6.196 15.185 -17.820 1.00 0.00 C ATOM 143 CD1 PHE A 163 7.216 15.986 -18.297 1.00 0.00 C ATOM 144 CD2 PHE A 163 6.216 13.831 -18.100 1.00 0.00 C ATOM 145 CE1 PHE A 163 8.241 15.446 -19.044 1.00 0.00 C ATOM 146 CE2 PHE A 163 7.245 13.292 -18.848 1.00 0.00 C ATOM 147 CZ PHE A 163 8.255 14.097 -19.319 1.00 0.00 C ATOM 0 H PHE A 163 2.617 17.255 -16.555 1.00 0.00 H new ATOM 0 HA PHE A 163 5.191 17.639 -18.080 1.00 0.00 H new ATOM 0 HB2 PHE A 163 5.454 16.117 -16.020 1.00 0.00 H new ATOM 0 HB3 PHE A 163 4.311 15.027 -16.779 1.00 0.00 H new ATOM 0 HD1 PHE A 163 7.210 17.044 -18.083 1.00 0.00 H new ATOM 0 HD2 PHE A 163 5.425 13.193 -17.733 1.00 0.00 H new ATOM 0 HE1 PHE A 163 9.033 16.081 -19.413 1.00 0.00 H new ATOM 0 HE2 PHE A 163 7.256 12.234 -19.064 1.00 0.00 H new ATOM 0 HZ PHE A 163 9.058 13.672 -19.903 1.00 0.00 H new ATOM 157 N THR A 164 4.229 15.931 -19.851 1.00 0.00 N ATOM 158 CA THR A 164 3.521 15.401 -21.045 1.00 0.00 C ATOM 159 C THR A 164 4.023 13.977 -21.297 1.00 0.00 C ATOM 160 O THR A 164 5.075 13.614 -20.816 1.00 0.00 O ATOM 161 CB THR A 164 3.853 16.359 -22.176 1.00 0.00 C ATOM 162 OG1 THR A 164 3.301 17.590 -21.737 1.00 0.00 O ATOM 163 CG2 THR A 164 3.111 16.065 -23.485 1.00 0.00 C ATOM 0 H THR A 164 5.240 15.792 -19.857 1.00 0.00 H new ATOM 0 HA THR A 164 2.438 15.341 -20.933 1.00 0.00 H new ATOM 0 HB THR A 164 4.924 16.315 -22.372 1.00 0.00 H new ATOM 0 HG1 THR A 164 3.468 18.282 -22.410 1.00 0.00 H new ATOM 0 HG21 THR A 164 3.404 16.794 -24.241 1.00 0.00 H new ATOM 0 HG22 THR A 164 3.365 15.063 -23.830 1.00 0.00 H new ATOM 0 HG23 THR A 164 2.036 16.129 -23.316 1.00 0.00 H new ATOM 171 N ALA A 165 3.278 13.201 -22.036 1.00 0.00 N ATOM 172 CA ALA A 165 3.782 11.841 -22.379 1.00 0.00 C ATOM 173 C ALA A 165 4.316 11.967 -23.798 1.00 0.00 C ATOM 174 O ALA A 165 3.655 12.482 -24.678 1.00 0.00 O ATOM 175 CB ALA A 165 2.648 10.825 -22.358 1.00 0.00 C ATOM 0 H ALA A 165 2.361 13.443 -22.411 1.00 0.00 H new ATOM 0 HA ALA A 165 4.537 11.503 -21.669 1.00 0.00 H new ATOM 0 HB1 ALA A 165 3.038 9.839 -22.611 1.00 0.00 H new ATOM 0 HB2 ALA A 165 2.205 10.795 -21.363 1.00 0.00 H new ATOM 0 HB3 ALA A 165 1.888 11.112 -23.085 1.00 0.00 H new ATOM 181 N GLN A 166 5.514 11.487 -23.970 1.00 0.00 N ATOM 182 CA GLN A 166 6.189 11.566 -25.295 1.00 0.00 C ATOM 183 C GLN A 166 6.181 10.161 -25.877 1.00 0.00 C ATOM 184 O GLN A 166 6.134 9.964 -27.075 1.00 0.00 O ATOM 185 CB GLN A 166 7.640 12.034 -25.119 1.00 0.00 C ATOM 186 CG GLN A 166 7.751 13.547 -24.824 1.00 0.00 C ATOM 187 CD GLN A 166 6.981 13.950 -23.563 1.00 0.00 C ATOM 188 OE1 GLN A 166 5.825 14.313 -23.621 1.00 0.00 O ATOM 189 NE2 GLN A 166 7.583 13.900 -22.407 1.00 0.00 N ATOM 0 H GLN A 166 6.063 11.036 -23.238 1.00 0.00 H new ATOM 0 HA GLN A 166 5.677 12.272 -25.949 1.00 0.00 H new ATOM 0 HB2 GLN A 166 8.101 11.475 -24.304 1.00 0.00 H new ATOM 0 HB3 GLN A 166 8.204 11.803 -26.023 1.00 0.00 H new ATOM 0 HG2 GLN A 166 8.801 13.816 -24.708 1.00 0.00 H new ATOM 0 HG3 GLN A 166 7.370 14.110 -25.676 1.00 0.00 H new ATOM 0 HE21 GLN A 166 8.555 13.596 -22.351 1.00 0.00 H new ATOM 0 HE22 GLN A 166 7.082 14.165 -21.559 1.00 0.00 H new ATOM 198 N GLN A 167 6.223 9.228 -24.969 1.00 0.00 N ATOM 199 CA GLN A 167 6.240 7.790 -25.348 1.00 0.00 C ATOM 200 C GLN A 167 5.014 7.128 -24.751 1.00 0.00 C ATOM 201 O GLN A 167 4.198 7.771 -24.119 1.00 0.00 O ATOM 202 CB GLN A 167 7.500 7.136 -24.788 1.00 0.00 C ATOM 203 CG GLN A 167 7.490 7.288 -23.255 1.00 0.00 C ATOM 204 CD GLN A 167 8.685 6.542 -22.668 1.00 0.00 C ATOM 205 OE1 GLN A 167 9.826 6.832 -22.967 1.00 0.00 O ATOM 206 NE2 GLN A 167 8.461 5.570 -21.827 1.00 0.00 N ATOM 0 H GLN A 167 6.247 9.405 -23.965 1.00 0.00 H new ATOM 0 HA GLN A 167 6.234 7.681 -26.433 1.00 0.00 H new ATOM 0 HB2 GLN A 167 7.534 6.082 -25.064 1.00 0.00 H new ATOM 0 HB3 GLN A 167 8.389 7.605 -25.209 1.00 0.00 H new ATOM 0 HG2 GLN A 167 7.535 8.342 -22.982 1.00 0.00 H new ATOM 0 HG3 GLN A 167 6.561 6.891 -22.844 1.00 0.00 H new ATOM 0 HE21 GLN A 167 7.504 5.325 -21.574 1.00 0.00 H new ATOM 0 HE22 GLN A 167 9.243 5.055 -21.422 1.00 0.00 H new ATOM 215 N VAL A 168 4.927 5.849 -24.970 1.00 0.00 N ATOM 216 CA VAL A 168 3.809 5.088 -24.360 1.00 0.00 C ATOM 217 C VAL A 168 4.432 4.604 -23.059 1.00 0.00 C ATOM 218 O VAL A 168 5.631 4.411 -22.999 1.00 0.00 O ATOM 219 CB VAL A 168 3.436 3.916 -25.272 1.00 0.00 C ATOM 220 CG1 VAL A 168 2.260 3.149 -24.657 1.00 0.00 C ATOM 221 CG2 VAL A 168 3.002 4.470 -26.633 1.00 0.00 C ATOM 0 H VAL A 168 5.574 5.303 -25.539 1.00 0.00 H new ATOM 0 HA VAL A 168 2.892 5.657 -24.209 1.00 0.00 H new ATOM 0 HB VAL A 168 4.292 3.251 -25.387 1.00 0.00 H new ATOM 0 HG11 VAL A 168 1.992 2.314 -25.304 1.00 0.00 H new ATOM 0 HG12 VAL A 168 2.546 2.770 -23.676 1.00 0.00 H new ATOM 0 HG13 VAL A 168 1.405 3.817 -24.553 1.00 0.00 H new ATOM 0 HG21 VAL A 168 2.733 3.645 -27.293 1.00 0.00 H new ATOM 0 HG22 VAL A 168 2.140 5.125 -26.501 1.00 0.00 H new ATOM 0 HG23 VAL A 168 3.823 5.035 -27.074 1.00 0.00 H new ATOM 231 N GLY A 169 3.625 4.421 -22.054 1.00 0.00 N ATOM 232 CA GLY A 169 4.195 4.014 -20.741 1.00 0.00 C ATOM 233 C GLY A 169 4.025 5.209 -19.821 1.00 0.00 C ATOM 234 O GLY A 169 3.552 5.101 -18.711 1.00 0.00 O ATOM 0 H GLY A 169 2.612 4.533 -22.082 1.00 0.00 H new ATOM 0 HA2 GLY A 169 3.677 3.140 -20.345 1.00 0.00 H new ATOM 0 HA3 GLY A 169 5.246 3.744 -20.839 1.00 0.00 H new ATOM 238 N ASP A 170 4.428 6.328 -20.354 1.00 0.00 N ATOM 239 CA ASP A 170 4.346 7.618 -19.618 1.00 0.00 C ATOM 240 C ASP A 170 2.939 8.172 -19.489 1.00 0.00 C ATOM 241 O ASP A 170 1.979 7.729 -20.088 1.00 0.00 O ATOM 242 CB ASP A 170 5.136 8.658 -20.321 1.00 0.00 C ATOM 243 CG ASP A 170 5.982 9.491 -19.367 1.00 0.00 C ATOM 244 OD1 ASP A 170 7.078 9.038 -19.090 1.00 0.00 O ATOM 245 OD2 ASP A 170 5.480 10.530 -18.971 1.00 0.00 O ATOM 0 H ASP A 170 4.820 6.403 -21.293 1.00 0.00 H new ATOM 0 HA ASP A 170 4.728 7.394 -18.622 1.00 0.00 H new ATOM 0 HB2 ASP A 170 5.785 8.182 -21.056 1.00 0.00 H new ATOM 0 HB3 ASP A 170 4.460 9.314 -20.870 1.00 0.00 H new ATOM 250 N LEU A 171 2.942 9.167 -18.655 1.00 0.00 N ATOM 251 CA LEU A 171 1.735 9.975 -18.346 1.00 0.00 C ATOM 252 C LEU A 171 1.981 11.444 -18.686 1.00 0.00 C ATOM 253 O LEU A 171 3.026 11.822 -19.174 1.00 0.00 O ATOM 254 CB LEU A 171 1.404 9.848 -16.869 1.00 0.00 C ATOM 255 CG LEU A 171 0.389 8.750 -16.603 1.00 0.00 C ATOM 256 CD1 LEU A 171 0.074 8.699 -15.109 1.00 0.00 C ATOM 257 CD2 LEU A 171 -0.948 8.985 -17.271 1.00 0.00 C ATOM 0 H LEU A 171 3.775 9.468 -18.150 1.00 0.00 H new ATOM 0 HA LEU A 171 0.901 9.607 -18.944 1.00 0.00 H new ATOM 0 HB2 LEU A 171 2.317 9.641 -16.310 1.00 0.00 H new ATOM 0 HB3 LEU A 171 1.014 10.798 -16.502 1.00 0.00 H new ATOM 0 HG LEU A 171 0.844 7.839 -16.993 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -0.654 7.911 -14.917 1.00 0.00 H new ATOM 0 HD12 LEU A 171 0.987 8.492 -14.551 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -0.336 9.657 -14.791 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -1.622 8.161 -17.037 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -1.377 9.919 -16.908 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -0.810 9.045 -18.351 1.00 0.00 H new ATOM 269 N THR A 172 0.980 12.226 -18.405 1.00 0.00 N ATOM 270 CA THR A 172 1.039 13.688 -18.677 1.00 0.00 C ATOM 271 C THR A 172 0.984 14.417 -17.341 1.00 0.00 C ATOM 272 O THR A 172 1.933 15.059 -16.945 1.00 0.00 O ATOM 273 CB THR A 172 -0.160 14.043 -19.557 1.00 0.00 C ATOM 274 OG1 THR A 172 0.168 13.457 -20.809 1.00 0.00 O ATOM 275 CG2 THR A 172 -0.279 15.544 -19.831 1.00 0.00 C ATOM 0 H THR A 172 0.105 11.907 -17.989 1.00 0.00 H new ATOM 0 HA THR A 172 1.955 13.977 -19.193 1.00 0.00 H new ATOM 0 HB THR A 172 -1.082 13.712 -19.080 1.00 0.00 H new ATOM 0 HG1 THR A 172 -0.552 13.631 -21.450 1.00 0.00 H new ATOM 0 HG21 THR A 172 -1.149 15.731 -20.461 1.00 0.00 H new ATOM 0 HG22 THR A 172 -0.392 16.078 -18.888 1.00 0.00 H new ATOM 0 HG23 THR A 172 0.619 15.893 -20.340 1.00 0.00 H new ATOM 283 N PHE A 173 -0.145 14.257 -16.707 1.00 0.00 N ATOM 284 CA PHE A 173 -0.486 14.885 -15.394 1.00 0.00 C ATOM 285 C PHE A 173 -0.095 16.355 -15.207 1.00 0.00 C ATOM 286 O PHE A 173 0.665 16.939 -15.951 1.00 0.00 O ATOM 287 CB PHE A 173 0.164 14.052 -14.266 1.00 0.00 C ATOM 288 CG PHE A 173 1.699 14.122 -14.286 1.00 0.00 C ATOM 289 CD1 PHE A 173 2.362 15.229 -13.792 1.00 0.00 C ATOM 290 CD2 PHE A 173 2.444 13.076 -14.798 1.00 0.00 C ATOM 291 CE1 PHE A 173 3.738 15.295 -13.807 1.00 0.00 C ATOM 292 CE2 PHE A 173 3.822 13.141 -14.814 1.00 0.00 C ATOM 293 CZ PHE A 173 4.469 14.249 -14.319 1.00 0.00 C ATOM 0 H PHE A 173 -0.897 13.674 -17.074 1.00 0.00 H new ATOM 0 HA PHE A 173 -1.576 14.885 -15.362 1.00 0.00 H new ATOM 0 HB2 PHE A 173 -0.199 14.408 -13.302 1.00 0.00 H new ATOM 0 HB3 PHE A 173 -0.149 13.012 -14.361 1.00 0.00 H new ATOM 0 HD1 PHE A 173 1.794 16.054 -13.389 1.00 0.00 H new ATOM 0 HD2 PHE A 173 1.944 12.202 -15.188 1.00 0.00 H new ATOM 0 HE1 PHE A 173 4.242 16.167 -13.417 1.00 0.00 H new ATOM 0 HE2 PHE A 173 4.395 12.319 -15.217 1.00 0.00 H new ATOM 0 HZ PHE A 173 5.548 14.297 -14.332 1.00 0.00 H new ATOM 303 N LYS A 174 -0.660 16.917 -14.177 1.00 0.00 N ATOM 304 CA LYS A 174 -0.389 18.329 -13.827 1.00 0.00 C ATOM 305 C LYS A 174 0.345 18.475 -12.510 1.00 0.00 C ATOM 306 O LYS A 174 0.865 17.542 -11.943 1.00 0.00 O ATOM 307 CB LYS A 174 -1.706 19.054 -13.757 1.00 0.00 C ATOM 308 CG LYS A 174 -2.538 18.572 -12.557 1.00 0.00 C ATOM 309 CD LYS A 174 -3.813 19.419 -12.436 1.00 0.00 C ATOM 310 CE LYS A 174 -4.701 19.226 -13.673 1.00 0.00 C ATOM 311 NZ LYS A 174 -5.071 17.790 -13.819 1.00 0.00 N ATOM 0 H LYS A 174 -1.312 16.443 -13.552 1.00 0.00 H new ATOM 0 HA LYS A 174 0.259 18.754 -14.594 1.00 0.00 H new ATOM 0 HB2 LYS A 174 -1.531 20.127 -13.675 1.00 0.00 H new ATOM 0 HB3 LYS A 174 -2.264 18.892 -14.679 1.00 0.00 H new ATOM 0 HG2 LYS A 174 -2.799 17.521 -12.682 1.00 0.00 H new ATOM 0 HG3 LYS A 174 -1.951 18.648 -11.642 1.00 0.00 H new ATOM 0 HD2 LYS A 174 -4.362 19.135 -11.538 1.00 0.00 H new ATOM 0 HD3 LYS A 174 -3.550 20.471 -12.330 1.00 0.00 H new ATOM 0 HE2 LYS A 174 -5.601 19.834 -13.582 1.00 0.00 H new ATOM 0 HE3 LYS A 174 -4.175 19.566 -14.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 -6.069 17.716 -14.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 -4.472 17.349 -14.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 -4.930 17.301 -12.912 1.00 0.00 H new ATOM 325 N LYS A 175 0.323 19.704 -12.102 1.00 0.00 N ATOM 326 CA LYS A 175 0.972 20.199 -10.867 1.00 0.00 C ATOM 327 C LYS A 175 -0.008 20.329 -9.689 1.00 0.00 C ATOM 328 O LYS A 175 -1.210 20.374 -9.864 1.00 0.00 O ATOM 329 CB LYS A 175 1.572 21.525 -11.276 1.00 0.00 C ATOM 330 CG LYS A 175 1.759 22.459 -10.074 1.00 0.00 C ATOM 331 CD LYS A 175 2.454 23.736 -10.539 1.00 0.00 C ATOM 332 CE LYS A 175 2.607 24.669 -9.331 1.00 0.00 C ATOM 333 NZ LYS A 175 3.430 24.021 -8.271 1.00 0.00 N ATOM 0 H LYS A 175 -0.158 20.440 -12.619 1.00 0.00 H new ATOM 0 HA LYS A 175 1.724 19.504 -10.492 1.00 0.00 H new ATOM 0 HB2 LYS A 175 2.535 21.355 -11.758 1.00 0.00 H new ATOM 0 HB3 LYS A 175 0.927 22.004 -12.012 1.00 0.00 H new ATOM 0 HG2 LYS A 175 0.793 22.697 -9.629 1.00 0.00 H new ATOM 0 HG3 LYS A 175 2.353 21.967 -9.304 1.00 0.00 H new ATOM 0 HD2 LYS A 175 3.430 23.503 -10.965 1.00 0.00 H new ATOM 0 HD3 LYS A 175 1.872 24.221 -11.322 1.00 0.00 H new ATOM 0 HE2 LYS A 175 3.075 25.603 -9.643 1.00 0.00 H new ATOM 0 HE3 LYS A 175 1.624 24.922 -8.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 4.068 24.725 -7.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 2.806 23.633 -7.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 3.992 23.252 -8.689 1.00 0.00 H new ATOM 347 N GLY A 176 0.600 20.387 -8.531 1.00 0.00 N ATOM 348 CA GLY A 176 -0.069 20.529 -7.205 1.00 0.00 C ATOM 349 C GLY A 176 -1.350 19.740 -7.183 1.00 0.00 C ATOM 350 O GLY A 176 -2.395 20.192 -6.761 1.00 0.00 O ATOM 0 H GLY A 176 1.616 20.337 -8.453 1.00 0.00 H new ATOM 0 HA2 GLY A 176 0.596 20.180 -6.415 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -0.277 21.580 -7.005 1.00 0.00 H new ATOM 354 N GLU A 177 -1.172 18.549 -7.666 1.00 0.00 N ATOM 355 CA GLU A 177 -2.323 17.588 -7.672 1.00 0.00 C ATOM 356 C GLU A 177 -1.874 16.363 -6.918 1.00 0.00 C ATOM 357 O GLU A 177 -0.731 16.317 -6.532 1.00 0.00 O ATOM 358 CB GLU A 177 -2.698 17.158 -9.079 1.00 0.00 C ATOM 359 CG GLU A 177 -1.593 16.279 -9.689 1.00 0.00 C ATOM 360 CD GLU A 177 -2.227 15.403 -10.762 1.00 0.00 C ATOM 361 OE1 GLU A 177 -3.140 14.678 -10.402 1.00 0.00 O ATOM 362 OE2 GLU A 177 -1.756 15.506 -11.875 1.00 0.00 O ATOM 0 H GLU A 177 -0.298 18.194 -8.053 1.00 0.00 H new ATOM 0 HA GLU A 177 -3.191 18.071 -7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -3.638 16.607 -9.058 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -2.857 18.037 -9.703 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -0.807 16.899 -10.119 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -1.128 15.663 -8.920 1.00 0.00 H new ATOM 369 N ILE A 178 -2.740 15.408 -6.729 1.00 0.00 N ATOM 370 CA ILE A 178 -2.325 14.180 -5.999 1.00 0.00 C ATOM 371 C ILE A 178 -2.207 12.979 -6.948 1.00 0.00 C ATOM 372 O ILE A 178 -3.133 12.650 -7.662 1.00 0.00 O ATOM 373 CB ILE A 178 -3.369 13.895 -4.945 1.00 0.00 C ATOM 374 CG1 ILE A 178 -3.710 15.171 -4.136 1.00 0.00 C ATOM 375 CG2 ILE A 178 -2.866 12.766 -4.017 1.00 0.00 C ATOM 376 CD1 ILE A 178 -2.570 15.627 -3.209 1.00 0.00 C ATOM 0 H ILE A 178 -3.709 15.424 -7.046 1.00 0.00 H new ATOM 0 HA ILE A 178 -1.346 14.340 -5.548 1.00 0.00 H new ATOM 0 HB ILE A 178 -4.287 13.570 -5.435 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -3.951 15.978 -4.828 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -4.603 14.986 -3.539 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -3.618 12.559 -3.256 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -2.686 11.865 -4.604 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -1.939 13.077 -3.536 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -2.875 16.525 -2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -2.344 14.836 -2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -1.682 15.843 -3.803 1.00 0.00 H new ATOM 388 N LEU A 179 -1.051 12.369 -6.912 1.00 0.00 N ATOM 389 CA LEU A 179 -0.790 11.142 -7.723 1.00 0.00 C ATOM 390 C LEU A 179 -0.442 9.995 -6.766 1.00 0.00 C ATOM 391 O LEU A 179 -0.160 10.235 -5.610 1.00 0.00 O ATOM 392 CB LEU A 179 0.371 11.375 -8.650 1.00 0.00 C ATOM 393 CG LEU A 179 0.041 12.466 -9.681 1.00 0.00 C ATOM 394 CD1 LEU A 179 1.127 12.389 -10.695 1.00 0.00 C ATOM 395 CD2 LEU A 179 -1.252 12.186 -10.444 1.00 0.00 C ATOM 0 H LEU A 179 -0.262 12.676 -6.344 1.00 0.00 H new ATOM 0 HA LEU A 179 -1.673 10.897 -8.313 1.00 0.00 H new ATOM 0 HB2 LEU A 179 1.248 11.668 -8.073 1.00 0.00 H new ATOM 0 HB3 LEU A 179 0.622 10.447 -9.164 1.00 0.00 H new ATOM 0 HG LEU A 179 -0.058 13.421 -9.165 1.00 0.00 H new ATOM 0 HD11 LEU A 179 0.959 13.141 -11.466 1.00 0.00 H new ATOM 0 HD12 LEU A 179 2.088 12.571 -10.214 1.00 0.00 H new ATOM 0 HD13 LEU A 179 1.131 11.398 -11.149 1.00 0.00 H new ATOM 0 HD21 LEU A 179 -1.434 12.989 -11.158 1.00 0.00 H new ATOM 0 HD22 LEU A 179 -1.162 11.240 -10.978 1.00 0.00 H new ATOM 0 HD23 LEU A 179 -2.084 12.129 -9.742 1.00 0.00 H new ATOM 407 N LEU A 180 -0.467 8.786 -7.264 1.00 0.00 N ATOM 408 CA LEU A 180 -0.112 7.610 -6.419 1.00 0.00 C ATOM 409 C LEU A 180 1.114 6.981 -7.074 1.00 0.00 C ATOM 410 O LEU A 180 1.384 7.281 -8.215 1.00 0.00 O ATOM 411 CB LEU A 180 -1.312 6.663 -6.421 1.00 0.00 C ATOM 412 CG LEU A 180 -1.002 5.323 -5.736 1.00 0.00 C ATOM 413 CD1 LEU A 180 -0.785 5.539 -4.237 1.00 0.00 C ATOM 414 CD2 LEU A 180 -2.202 4.409 -5.948 1.00 0.00 C ATOM 0 H LEU A 180 -0.720 8.563 -8.227 1.00 0.00 H new ATOM 0 HA LEU A 180 0.116 7.862 -5.383 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -2.150 7.142 -5.914 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -1.624 6.479 -7.449 1.00 0.00 H new ATOM 0 HG LEU A 180 -0.098 4.882 -6.157 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -0.566 4.584 -3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 180 0.052 6.221 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -1.686 5.966 -3.797 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -2.014 3.446 -5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -3.089 4.865 -5.507 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -2.363 4.261 -7.016 1.00 0.00 H new ATOM 426 N VAL A 181 1.829 6.144 -6.370 1.00 0.00 N ATOM 427 CA VAL A 181 3.020 5.487 -6.980 1.00 0.00 C ATOM 428 C VAL A 181 2.917 3.989 -7.180 1.00 0.00 C ATOM 429 O VAL A 181 2.366 3.287 -6.363 1.00 0.00 O ATOM 430 CB VAL A 181 4.191 5.768 -6.097 1.00 0.00 C ATOM 431 CG1 VAL A 181 5.400 4.956 -6.550 1.00 0.00 C ATOM 432 CG2 VAL A 181 4.434 7.251 -6.188 1.00 0.00 C ATOM 0 H VAL A 181 1.640 5.888 -5.401 1.00 0.00 H new ATOM 0 HA VAL A 181 3.116 5.903 -7.983 1.00 0.00 H new ATOM 0 HB VAL A 181 4.006 5.480 -5.062 1.00 0.00 H new ATOM 0 HG11 VAL A 181 6.247 5.170 -5.898 1.00 0.00 H new ATOM 0 HG12 VAL A 181 5.164 3.893 -6.501 1.00 0.00 H new ATOM 0 HG13 VAL A 181 5.655 5.224 -7.575 1.00 0.00 H new ATOM 0 HG21 VAL A 181 5.283 7.520 -5.560 1.00 0.00 H new ATOM 0 HG22 VAL A 181 4.647 7.522 -7.222 1.00 0.00 H new ATOM 0 HG23 VAL A 181 3.548 7.786 -5.848 1.00 0.00 H new ATOM 442 N ILE A 182 3.459 3.534 -8.275 1.00 0.00 N ATOM 443 CA ILE A 182 3.536 2.073 -8.501 1.00 0.00 C ATOM 444 C ILE A 182 4.906 1.857 -9.177 1.00 0.00 C ATOM 445 O ILE A 182 4.987 1.648 -10.363 1.00 0.00 O ATOM 446 CB ILE A 182 2.444 1.552 -9.454 1.00 0.00 C ATOM 447 CG1 ILE A 182 1.049 2.222 -9.267 1.00 0.00 C ATOM 448 CG2 ILE A 182 2.400 0.072 -9.102 1.00 0.00 C ATOM 449 CD1 ILE A 182 0.249 1.708 -8.062 1.00 0.00 C ATOM 0 H ILE A 182 3.850 4.113 -9.019 1.00 0.00 H new ATOM 0 HA ILE A 182 3.404 1.543 -7.558 1.00 0.00 H new ATOM 0 HB ILE A 182 2.675 1.772 -10.496 1.00 0.00 H new ATOM 0 HG12 ILE A 182 1.189 3.298 -9.161 1.00 0.00 H new ATOM 0 HG13 ILE A 182 0.461 2.064 -10.171 1.00 0.00 H new ATOM 0 HG21 ILE A 182 1.651 -0.426 -9.718 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.377 -0.375 -9.286 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.140 -0.044 -8.050 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -0.707 2.230 -8.010 1.00 0.00 H new ATOM 0 HD12 ILE A 182 0.073 0.638 -8.172 1.00 0.00 H new ATOM 0 HD13 ILE A 182 0.812 1.891 -7.147 1.00 0.00 H new ATOM 461 N GLU A 183 5.921 1.942 -8.369 1.00 0.00 N ATOM 462 CA GLU A 183 7.380 1.760 -8.712 1.00 0.00 C ATOM 463 C GLU A 183 8.155 2.970 -8.214 1.00 0.00 C ATOM 464 O GLU A 183 7.637 4.066 -8.182 1.00 0.00 O ATOM 465 CB GLU A 183 7.618 1.704 -10.186 1.00 0.00 C ATOM 466 CG GLU A 183 9.089 1.431 -10.471 1.00 0.00 C ATOM 467 CD GLU A 183 9.325 1.536 -11.978 1.00 0.00 C ATOM 468 OE1 GLU A 183 9.182 2.650 -12.459 1.00 0.00 O ATOM 469 OE2 GLU A 183 9.631 0.508 -12.557 1.00 0.00 O ATOM 0 H GLU A 183 5.789 2.152 -7.380 1.00 0.00 H new ATOM 0 HA GLU A 183 7.697 0.824 -8.252 1.00 0.00 H new ATOM 0 HB2 GLU A 183 7.003 0.923 -10.632 1.00 0.00 H new ATOM 0 HB3 GLU A 183 7.320 2.646 -10.646 1.00 0.00 H new ATOM 0 HG2 GLU A 183 9.716 2.147 -9.940 1.00 0.00 H new ATOM 0 HG3 GLU A 183 9.365 0.439 -10.114 1.00 0.00 H new ATOM 476 N LYS A 184 9.384 2.740 -7.840 1.00 0.00 N ATOM 477 CA LYS A 184 10.227 3.875 -7.396 1.00 0.00 C ATOM 478 C LYS A 184 11.546 3.936 -8.164 1.00 0.00 C ATOM 479 O LYS A 184 12.229 2.945 -8.329 1.00 0.00 O ATOM 480 CB LYS A 184 10.500 3.729 -5.904 1.00 0.00 C ATOM 481 CG LYS A 184 9.147 3.770 -5.192 1.00 0.00 C ATOM 482 CD LYS A 184 9.363 3.882 -3.686 1.00 0.00 C ATOM 483 CE LYS A 184 7.992 3.979 -3.013 1.00 0.00 C ATOM 484 NZ LYS A 184 8.160 4.113 -1.540 1.00 0.00 N ATOM 0 H LYS A 184 9.833 1.824 -7.824 1.00 0.00 H new ATOM 0 HA LYS A 184 9.692 4.803 -7.596 1.00 0.00 H new ATOM 0 HB2 LYS A 184 11.016 2.791 -5.697 1.00 0.00 H new ATOM 0 HB3 LYS A 184 11.146 4.533 -5.550 1.00 0.00 H new ATOM 0 HG2 LYS A 184 8.562 4.618 -5.550 1.00 0.00 H new ATOM 0 HG3 LYS A 184 8.577 2.870 -5.422 1.00 0.00 H new ATOM 0 HD2 LYS A 184 9.908 3.014 -3.315 1.00 0.00 H new ATOM 0 HD3 LYS A 184 9.964 4.761 -3.452 1.00 0.00 H new ATOM 0 HE2 LYS A 184 7.444 4.836 -3.405 1.00 0.00 H new ATOM 0 HE3 LYS A 184 7.401 3.092 -3.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 7.225 4.178 -1.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 8.665 3.282 -1.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 8.707 4.972 -1.330 1.00 0.00 H new ATOM 498 N LYS A 185 11.809 5.142 -8.584 1.00 0.00 N ATOM 499 CA LYS A 185 13.046 5.568 -9.319 1.00 0.00 C ATOM 500 C LYS A 185 14.173 4.539 -9.436 1.00 0.00 C ATOM 501 O LYS A 185 15.140 4.542 -8.700 1.00 0.00 O ATOM 502 CB LYS A 185 13.568 6.824 -8.610 1.00 0.00 C ATOM 503 CG LYS A 185 13.613 7.995 -9.585 1.00 0.00 C ATOM 504 CD LYS A 185 13.905 9.253 -8.791 1.00 0.00 C ATOM 505 CE LYS A 185 13.869 10.486 -9.701 1.00 0.00 C ATOM 506 NZ LYS A 185 15.006 10.455 -10.662 1.00 0.00 N ATOM 0 H LYS A 185 11.161 5.915 -8.434 1.00 0.00 H new ATOM 0 HA LYS A 185 12.748 5.730 -10.355 1.00 0.00 H new ATOM 0 HB2 LYS A 185 12.924 7.068 -7.765 1.00 0.00 H new ATOM 0 HB3 LYS A 185 14.564 6.637 -8.208 1.00 0.00 H new ATOM 0 HG2 LYS A 185 14.383 7.833 -10.340 1.00 0.00 H new ATOM 0 HG3 LYS A 185 12.664 8.089 -10.112 1.00 0.00 H new ATOM 0 HD2 LYS A 185 13.172 9.363 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 185 14.884 9.172 -8.318 1.00 0.00 H new ATOM 0 HE2 LYS A 185 12.925 10.517 -10.245 1.00 0.00 H new ATOM 0 HE3 LYS A 185 13.919 11.393 -9.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 15.629 11.270 -10.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 15.544 9.574 -10.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 14.640 10.499 -11.634 1.00 0.00 H new ATOM 520 N PRO A 186 13.996 3.664 -10.388 1.00 0.00 N ATOM 521 CA PRO A 186 15.000 2.645 -10.723 1.00 0.00 C ATOM 522 C PRO A 186 16.110 3.429 -11.414 1.00 0.00 C ATOM 523 O PRO A 186 17.255 3.406 -11.013 1.00 0.00 O ATOM 524 CB PRO A 186 14.249 1.671 -11.620 1.00 0.00 C ATOM 525 CG PRO A 186 13.131 2.503 -12.274 1.00 0.00 C ATOM 526 CD PRO A 186 12.785 3.572 -11.240 1.00 0.00 C ATOM 0 HA PRO A 186 15.449 2.077 -9.908 1.00 0.00 H new ATOM 0 HB2 PRO A 186 14.909 1.239 -12.372 1.00 0.00 H new ATOM 0 HB3 PRO A 186 13.837 0.842 -11.044 1.00 0.00 H new ATOM 0 HG2 PRO A 186 13.467 2.951 -13.209 1.00 0.00 H new ATOM 0 HG3 PRO A 186 12.264 1.885 -12.510 1.00 0.00 H new ATOM 0 HD2 PRO A 186 12.560 4.527 -11.715 1.00 0.00 H new ATOM 0 HD3 PRO A 186 11.908 3.292 -10.656 1.00 0.00 H new ATOM 534 N ASP A 187 15.703 4.106 -12.452 1.00 0.00 N ATOM 535 CA ASP A 187 16.627 4.956 -13.231 1.00 0.00 C ATOM 536 C ASP A 187 15.937 6.299 -13.481 1.00 0.00 C ATOM 537 O ASP A 187 16.271 7.008 -14.410 1.00 0.00 O ATOM 538 CB ASP A 187 16.892 4.219 -14.498 1.00 0.00 C ATOM 539 CG ASP A 187 15.728 4.417 -15.463 1.00 0.00 C ATOM 540 OD1 ASP A 187 14.645 4.001 -15.094 1.00 0.00 O ATOM 541 OD2 ASP A 187 15.996 4.976 -16.514 1.00 0.00 O ATOM 0 H ASP A 187 14.743 4.101 -12.796 1.00 0.00 H new ATOM 0 HA ASP A 187 17.569 5.158 -12.721 1.00 0.00 H new ATOM 0 HB2 ASP A 187 17.817 4.576 -14.951 1.00 0.00 H new ATOM 0 HB3 ASP A 187 17.028 3.158 -14.291 1.00 0.00 H new ATOM 546 N GLY A 188 14.990 6.619 -12.638 1.00 0.00 N ATOM 547 CA GLY A 188 14.245 7.895 -12.825 1.00 0.00 C ATOM 548 C GLY A 188 12.734 7.712 -12.841 1.00 0.00 C ATOM 549 O GLY A 188 12.042 8.677 -12.587 1.00 0.00 O ATOM 0 H GLY A 188 14.704 6.057 -11.836 1.00 0.00 H new ATOM 0 HA2 GLY A 188 14.512 8.585 -12.024 1.00 0.00 H new ATOM 0 HA3 GLY A 188 14.558 8.357 -13.761 1.00 0.00 H new ATOM 553 N TRP A 189 12.228 6.536 -13.121 1.00 0.00 N ATOM 554 CA TRP A 189 10.745 6.455 -13.205 1.00 0.00 C ATOM 555 C TRP A 189 10.000 5.800 -12.055 1.00 0.00 C ATOM 556 O TRP A 189 10.480 4.999 -11.287 1.00 0.00 O ATOM 557 CB TRP A 189 10.409 5.732 -14.469 1.00 0.00 C ATOM 558 CG TRP A 189 10.812 6.635 -15.633 1.00 0.00 C ATOM 559 CD1 TRP A 189 10.340 7.891 -15.864 1.00 0.00 C ATOM 560 CD2 TRP A 189 11.697 6.316 -16.591 1.00 0.00 C ATOM 561 NE1 TRP A 189 10.983 8.245 -16.961 1.00 0.00 N ATOM 562 CE2 TRP A 189 11.826 7.362 -17.477 1.00 0.00 C ATOM 563 CE3 TRP A 189 12.421 5.162 -16.772 1.00 0.00 C ATOM 564 CZ2 TRP A 189 12.688 7.251 -18.548 1.00 0.00 C ATOM 565 CZ3 TRP A 189 13.280 5.050 -17.837 1.00 0.00 C ATOM 566 CH2 TRP A 189 13.416 6.093 -18.730 1.00 0.00 C ATOM 0 H TRP A 189 12.747 5.674 -13.287 1.00 0.00 H new ATOM 0 HA TRP A 189 10.406 7.490 -13.166 1.00 0.00 H new ATOM 0 HB2 TRP A 189 10.939 4.781 -14.520 1.00 0.00 H new ATOM 0 HB3 TRP A 189 9.344 5.506 -14.510 1.00 0.00 H new ATOM 0 HD1 TRP A 189 9.619 8.457 -15.292 1.00 0.00 H new ATOM 0 HE1 TRP A 189 10.838 9.158 -17.393 1.00 0.00 H new ATOM 0 HE3 TRP A 189 12.314 4.343 -16.076 1.00 0.00 H new ATOM 0 HZ2 TRP A 189 12.793 8.070 -19.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 189 13.851 4.144 -17.976 1.00 0.00 H new ATOM 0 HH2 TRP A 189 14.090 6.003 -19.569 1.00 0.00 H new ATOM 577 N TRP A 190 8.776 6.217 -11.994 1.00 0.00 N ATOM 578 CA TRP A 190 7.840 5.730 -10.964 1.00 0.00 C ATOM 579 C TRP A 190 6.641 5.351 -11.839 1.00 0.00 C ATOM 580 O TRP A 190 6.466 6.031 -12.829 1.00 0.00 O ATOM 581 CB TRP A 190 7.562 6.909 -10.033 1.00 0.00 C ATOM 582 CG TRP A 190 8.801 7.279 -9.178 1.00 0.00 C ATOM 583 CD1 TRP A 190 10.050 7.624 -9.626 1.00 0.00 C ATOM 584 CD2 TRP A 190 8.827 7.299 -7.822 1.00 0.00 C ATOM 585 NE1 TRP A 190 10.718 7.816 -8.515 1.00 0.00 N ATOM 586 CE2 TRP A 190 10.078 7.646 -7.377 1.00 0.00 C ATOM 587 CE3 TRP A 190 7.846 7.043 -6.897 1.00 0.00 C ATOM 588 CZ2 TRP A 190 10.358 7.735 -6.031 1.00 0.00 C ATOM 589 CZ3 TRP A 190 8.111 7.130 -5.545 1.00 0.00 C ATOM 590 CH2 TRP A 190 9.371 7.476 -5.111 1.00 0.00 C ATOM 0 H TRP A 190 8.375 6.898 -12.638 1.00 0.00 H new ATOM 0 HA TRP A 190 8.158 4.905 -10.327 1.00 0.00 H new ATOM 0 HB2 TRP A 190 7.258 7.773 -10.623 1.00 0.00 H new ATOM 0 HB3 TRP A 190 6.728 6.663 -9.375 1.00 0.00 H new ATOM 0 HD1 TRP A 190 10.398 7.715 -10.644 1.00 0.00 H new ATOM 0 HE1 TRP A 190 11.701 8.088 -8.531 1.00 0.00 H new ATOM 0 HE3 TRP A 190 6.856 6.770 -7.231 1.00 0.00 H new ATOM 0 HZ2 TRP A 190 11.349 8.007 -5.700 1.00 0.00 H new ATOM 0 HZ3 TRP A 190 7.330 6.927 -4.828 1.00 0.00 H new ATOM 0 HH2 TRP A 190 9.582 7.543 -4.054 1.00 0.00 H new ATOM 601 N ILE A 191 5.838 4.355 -11.544 1.00 0.00 N ATOM 602 CA ILE A 191 4.699 4.146 -12.500 1.00 0.00 C ATOM 603 C ILE A 191 3.495 4.585 -11.696 1.00 0.00 C ATOM 604 O ILE A 191 2.822 3.824 -11.041 1.00 0.00 O ATOM 605 CB ILE A 191 4.530 2.670 -12.907 1.00 0.00 C ATOM 606 CG1 ILE A 191 5.881 1.978 -13.208 1.00 0.00 C ATOM 607 CG2 ILE A 191 3.694 2.705 -14.162 1.00 0.00 C ATOM 608 CD1 ILE A 191 6.598 2.586 -14.405 1.00 0.00 C ATOM 0 H ILE A 191 5.907 3.721 -10.748 1.00 0.00 H new ATOM 0 HA ILE A 191 4.851 4.691 -13.432 1.00 0.00 H new ATOM 0 HB ILE A 191 4.074 2.102 -12.096 1.00 0.00 H new ATOM 0 HG12 ILE A 191 6.524 2.048 -12.331 1.00 0.00 H new ATOM 0 HG13 ILE A 191 5.708 0.918 -13.393 1.00 0.00 H new ATOM 0 HG21 ILE A 191 3.528 1.688 -14.517 1.00 0.00 H new ATOM 0 HG22 ILE A 191 2.735 3.175 -13.947 1.00 0.00 H new ATOM 0 HG23 ILE A 191 4.215 3.277 -14.930 1.00 0.00 H new ATOM 0 HD11 ILE A 191 7.539 2.062 -14.570 1.00 0.00 H new ATOM 0 HD12 ILE A 191 5.970 2.492 -15.291 1.00 0.00 H new ATOM 0 HD13 ILE A 191 6.799 3.640 -14.212 1.00 0.00 H new ATOM 620 N ALA A 192 3.257 5.855 -11.784 1.00 0.00 N ATOM 621 CA ALA A 192 2.204 6.468 -10.938 1.00 0.00 C ATOM 622 C ALA A 192 0.806 6.267 -11.464 1.00 0.00 C ATOM 623 O ALA A 192 0.619 5.720 -12.524 1.00 0.00 O ATOM 624 CB ALA A 192 2.474 7.930 -10.862 1.00 0.00 C ATOM 0 H ALA A 192 3.746 6.499 -12.406 1.00 0.00 H new ATOM 0 HA ALA A 192 2.245 5.980 -9.964 1.00 0.00 H new ATOM 0 HB1 ALA A 192 1.714 8.409 -10.245 1.00 0.00 H new ATOM 0 HB2 ALA A 192 3.457 8.096 -10.421 1.00 0.00 H new ATOM 0 HB3 ALA A 192 2.449 8.357 -11.865 1.00 0.00 H new ATOM 630 N LYS A 193 -0.128 6.714 -10.674 1.00 0.00 N ATOM 631 CA LYS A 193 -1.555 6.713 -11.061 1.00 0.00 C ATOM 632 C LYS A 193 -2.065 8.120 -10.769 1.00 0.00 C ATOM 633 O LYS A 193 -1.394 8.871 -10.092 1.00 0.00 O ATOM 634 CB LYS A 193 -2.249 5.669 -10.211 1.00 0.00 C ATOM 635 CG LYS A 193 -2.053 4.299 -10.841 1.00 0.00 C ATOM 636 CD LYS A 193 -2.808 3.252 -10.022 1.00 0.00 C ATOM 637 CE LYS A 193 -2.631 1.885 -10.696 1.00 0.00 C ATOM 638 NZ LYS A 193 -3.187 1.919 -12.077 1.00 0.00 N ATOM 0 H LYS A 193 0.052 7.092 -9.744 1.00 0.00 H new ATOM 0 HA LYS A 193 -1.733 6.471 -12.109 1.00 0.00 H new ATOM 0 HB2 LYS A 193 -1.843 5.678 -9.199 1.00 0.00 H new ATOM 0 HB3 LYS A 193 -3.312 5.897 -10.130 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -2.416 4.304 -11.869 1.00 0.00 H new ATOM 0 HG3 LYS A 193 -0.992 4.052 -10.878 1.00 0.00 H new ATOM 0 HD2 LYS A 193 -2.427 3.223 -9.001 1.00 0.00 H new ATOM 0 HD3 LYS A 193 -3.865 3.510 -9.960 1.00 0.00 H new ATOM 0 HE2 LYS A 193 -1.574 1.621 -10.728 1.00 0.00 H new ATOM 0 HE3 LYS A 193 -3.135 1.115 -10.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 -3.768 1.072 -12.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 -3.775 2.769 -12.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 -2.407 1.940 -12.765 1.00 0.00 H new ATOM 652 N ASP A 194 -3.222 8.452 -11.275 1.00 0.00 N ATOM 653 CA ASP A 194 -3.771 9.812 -10.989 1.00 0.00 C ATOM 654 C ASP A 194 -5.179 9.707 -10.414 1.00 0.00 C ATOM 655 O ASP A 194 -5.573 8.654 -9.951 1.00 0.00 O ATOM 656 CB ASP A 194 -3.795 10.613 -12.273 1.00 0.00 C ATOM 657 CG ASP A 194 -4.967 10.164 -13.134 1.00 0.00 C ATOM 658 OD1 ASP A 194 -5.114 8.967 -13.314 1.00 0.00 O ATOM 659 OD2 ASP A 194 -5.650 11.077 -13.562 1.00 0.00 O ATOM 0 H ASP A 194 -3.803 7.855 -11.863 1.00 0.00 H new ATOM 0 HA ASP A 194 -3.137 10.310 -10.255 1.00 0.00 H new ATOM 0 HB2 ASP A 194 -3.882 11.676 -12.049 1.00 0.00 H new ATOM 0 HB3 ASP A 194 -2.859 10.477 -12.815 1.00 0.00 H new ATOM 664 N ALA A 195 -5.906 10.792 -10.461 1.00 0.00 N ATOM 665 CA ALA A 195 -7.278 10.786 -9.899 1.00 0.00 C ATOM 666 C ALA A 195 -8.321 10.661 -11.016 1.00 0.00 C ATOM 667 O ALA A 195 -9.410 11.192 -10.926 1.00 0.00 O ATOM 668 CB ALA A 195 -7.458 12.081 -9.141 1.00 0.00 C ATOM 0 H ALA A 195 -5.605 11.679 -10.865 1.00 0.00 H new ATOM 0 HA ALA A 195 -7.416 9.932 -9.235 1.00 0.00 H new ATOM 0 HB1 ALA A 195 -8.459 12.115 -8.711 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -6.718 12.141 -8.343 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -7.327 12.922 -9.822 1.00 0.00 H new ATOM 674 N LYS A 196 -7.936 9.950 -12.041 1.00 0.00 N ATOM 675 CA LYS A 196 -8.865 9.669 -13.175 1.00 0.00 C ATOM 676 C LYS A 196 -8.852 8.165 -13.437 1.00 0.00 C ATOM 677 O LYS A 196 -9.852 7.584 -13.810 1.00 0.00 O ATOM 678 CB LYS A 196 -8.406 10.404 -14.433 1.00 0.00 C ATOM 679 CG LYS A 196 -9.439 10.171 -15.541 1.00 0.00 C ATOM 680 CD LYS A 196 -9.152 11.099 -16.731 1.00 0.00 C ATOM 681 CE LYS A 196 -7.728 10.876 -17.239 1.00 0.00 C ATOM 682 NZ LYS A 196 -7.508 11.662 -18.484 1.00 0.00 N ATOM 0 H LYS A 196 -7.005 9.546 -12.143 1.00 0.00 H new ATOM 0 HA LYS A 196 -9.869 10.009 -12.921 1.00 0.00 H new ATOM 0 HB2 LYS A 196 -8.302 11.470 -14.231 1.00 0.00 H new ATOM 0 HB3 LYS A 196 -7.427 10.042 -14.747 1.00 0.00 H new ATOM 0 HG2 LYS A 196 -9.408 9.131 -15.865 1.00 0.00 H new ATOM 0 HG3 LYS A 196 -10.443 10.356 -15.159 1.00 0.00 H new ATOM 0 HD2 LYS A 196 -9.866 10.908 -17.532 1.00 0.00 H new ATOM 0 HD3 LYS A 196 -9.281 12.139 -16.431 1.00 0.00 H new ATOM 0 HE2 LYS A 196 -7.009 11.176 -16.477 1.00 0.00 H new ATOM 0 HE3 LYS A 196 -7.563 9.816 -17.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 196 -6.538 11.507 -18.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 196 -8.185 11.356 -19.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 196 -7.648 12.673 -18.285 1.00 0.00 H new ATOM 696 N GLY A 197 -7.703 7.579 -13.226 1.00 0.00 N ATOM 697 CA GLY A 197 -7.544 6.121 -13.462 1.00 0.00 C ATOM 698 C GLY A 197 -6.211 5.832 -14.153 1.00 0.00 C ATOM 699 O GLY A 197 -5.561 4.857 -13.836 1.00 0.00 O ATOM 0 H GLY A 197 -6.863 8.055 -12.897 1.00 0.00 H new ATOM 0 HA2 GLY A 197 -7.592 5.586 -12.514 1.00 0.00 H new ATOM 0 HA3 GLY A 197 -8.366 5.754 -14.077 1.00 0.00 H new ATOM 703 N ASN A 198 -5.825 6.674 -15.075 1.00 0.00 N ATOM 704 CA ASN A 198 -4.548 6.404 -15.797 1.00 0.00 C ATOM 705 C ASN A 198 -3.341 6.270 -14.896 1.00 0.00 C ATOM 706 O ASN A 198 -3.322 6.715 -13.763 1.00 0.00 O ATOM 707 CB ASN A 198 -4.257 7.520 -16.783 1.00 0.00 C ATOM 708 CG ASN A 198 -4.093 8.861 -16.060 1.00 0.00 C ATOM 709 OD1 ASN A 198 -3.174 9.078 -15.298 1.00 0.00 O ATOM 710 ND2 ASN A 198 -4.974 9.797 -16.277 1.00 0.00 N ATOM 0 H ASN A 198 -6.325 7.518 -15.355 1.00 0.00 H new ATOM 0 HA ASN A 198 -4.703 5.447 -16.294 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -3.349 7.290 -17.341 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -5.068 7.590 -17.508 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -4.886 10.699 -15.809 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -5.751 9.628 -16.915 1.00 0.00 H new ATOM 717 N GLU A 199 -2.364 5.638 -15.480 1.00 0.00 N ATOM 718 CA GLU A 199 -1.082 5.418 -14.771 1.00 0.00 C ATOM 719 C GLU A 199 0.083 5.603 -15.748 1.00 0.00 C ATOM 720 O GLU A 199 -0.134 5.633 -16.943 1.00 0.00 O ATOM 721 CB GLU A 199 -1.107 3.998 -14.186 1.00 0.00 C ATOM 722 CG GLU A 199 -0.079 3.106 -14.859 1.00 0.00 C ATOM 723 CD GLU A 199 -0.135 1.742 -14.171 1.00 0.00 C ATOM 724 OE1 GLU A 199 -1.145 1.084 -14.358 1.00 0.00 O ATOM 725 OE2 GLU A 199 0.834 1.443 -13.494 1.00 0.00 O ATOM 0 H GLU A 199 -2.402 5.262 -16.427 1.00 0.00 H new ATOM 0 HA GLU A 199 -0.949 6.138 -13.963 1.00 0.00 H new ATOM 0 HB2 GLU A 199 -0.909 4.040 -13.115 1.00 0.00 H new ATOM 0 HB3 GLU A 199 -2.101 3.569 -14.310 1.00 0.00 H new ATOM 0 HG2 GLU A 199 -0.294 3.008 -15.923 1.00 0.00 H new ATOM 0 HG3 GLU A 199 0.918 3.538 -14.774 1.00 0.00 H new ATOM 732 N GLY A 200 1.286 5.721 -15.242 1.00 0.00 N ATOM 733 CA GLY A 200 2.432 5.846 -16.180 1.00 0.00 C ATOM 734 C GLY A 200 3.682 6.455 -15.575 1.00 0.00 C ATOM 735 O GLY A 200 3.704 6.900 -14.447 1.00 0.00 O ATOM 0 H GLY A 200 1.516 5.736 -14.248 1.00 0.00 H new ATOM 0 HA2 GLY A 200 2.677 4.857 -16.567 1.00 0.00 H new ATOM 0 HA3 GLY A 200 2.123 6.454 -17.031 1.00 0.00 H new ATOM 739 N LEU A 201 4.698 6.433 -16.390 1.00 0.00 N ATOM 740 CA LEU A 201 6.026 6.951 -16.017 1.00 0.00 C ATOM 741 C LEU A 201 6.110 8.413 -15.621 1.00 0.00 C ATOM 742 O LEU A 201 6.286 9.281 -16.451 1.00 0.00 O ATOM 743 CB LEU A 201 6.964 6.685 -17.172 1.00 0.00 C ATOM 744 CG LEU A 201 7.572 5.321 -16.977 1.00 0.00 C ATOM 745 CD1 LEU A 201 6.528 4.248 -17.128 1.00 0.00 C ATOM 746 CD2 LEU A 201 8.709 5.126 -17.959 1.00 0.00 C ATOM 0 H LEU A 201 4.651 6.059 -17.338 1.00 0.00 H new ATOM 0 HA LEU A 201 6.298 6.424 -15.103 1.00 0.00 H new ATOM 0 HB2 LEU A 201 6.425 6.729 -18.118 1.00 0.00 H new ATOM 0 HB3 LEU A 201 7.743 7.446 -17.213 1.00 0.00 H new ATOM 0 HG LEU A 201 7.972 5.247 -15.966 1.00 0.00 H new ATOM 0 HD11 LEU A 201 6.988 3.270 -16.983 1.00 0.00 H new ATOM 0 HD12 LEU A 201 5.745 4.395 -16.384 1.00 0.00 H new ATOM 0 HD13 LEU A 201 6.094 4.301 -18.126 1.00 0.00 H new ATOM 0 HD21 LEU A 201 9.148 4.138 -17.816 1.00 0.00 H new ATOM 0 HD22 LEU A 201 8.329 5.211 -18.977 1.00 0.00 H new ATOM 0 HD23 LEU A 201 9.470 5.889 -17.791 1.00 0.00 H new ATOM 758 N VAL A 202 5.976 8.649 -14.348 1.00 0.00 N ATOM 759 CA VAL A 202 6.171 10.038 -13.872 1.00 0.00 C ATOM 760 C VAL A 202 7.514 9.902 -13.169 1.00 0.00 C ATOM 761 O VAL A 202 7.826 8.844 -12.663 1.00 0.00 O ATOM 762 CB VAL A 202 5.077 10.442 -12.863 1.00 0.00 C ATOM 763 CG1 VAL A 202 3.709 10.098 -13.445 1.00 0.00 C ATOM 764 CG2 VAL A 202 5.256 9.714 -11.524 1.00 0.00 C ATOM 0 H VAL A 202 5.746 7.958 -13.634 1.00 0.00 H new ATOM 0 HA VAL A 202 6.130 10.793 -14.657 1.00 0.00 H new ATOM 0 HB VAL A 202 5.156 11.514 -12.681 1.00 0.00 H new ATOM 0 HG11 VAL A 202 2.931 10.381 -12.737 1.00 0.00 H new ATOM 0 HG12 VAL A 202 3.564 10.641 -14.379 1.00 0.00 H new ATOM 0 HG13 VAL A 202 3.654 9.026 -13.636 1.00 0.00 H new ATOM 0 HG21 VAL A 202 4.469 10.021 -10.835 1.00 0.00 H new ATOM 0 HG22 VAL A 202 5.198 8.637 -11.685 1.00 0.00 H new ATOM 0 HG23 VAL A 202 6.228 9.966 -11.100 1.00 0.00 H new ATOM 774 N PRO A 203 8.290 10.944 -13.148 1.00 0.00 N ATOM 775 CA PRO A 203 9.596 10.922 -12.466 1.00 0.00 C ATOM 776 C PRO A 203 9.353 11.269 -11.004 1.00 0.00 C ATOM 777 O PRO A 203 8.283 11.721 -10.653 1.00 0.00 O ATOM 778 CB PRO A 203 10.384 11.952 -13.214 1.00 0.00 C ATOM 779 CG PRO A 203 9.289 13.050 -13.422 1.00 0.00 C ATOM 780 CD PRO A 203 8.017 12.250 -13.797 1.00 0.00 C ATOM 0 HA PRO A 203 10.127 9.970 -12.464 1.00 0.00 H new ATOM 0 HB2 PRO A 203 11.236 12.319 -12.642 1.00 0.00 H new ATOM 0 HB3 PRO A 203 10.774 11.571 -14.158 1.00 0.00 H new ATOM 0 HG2 PRO A 203 9.137 13.638 -12.517 1.00 0.00 H new ATOM 0 HG3 PRO A 203 9.569 13.747 -14.212 1.00 0.00 H new ATOM 0 HD2 PRO A 203 7.110 12.717 -13.414 1.00 0.00 H new ATOM 0 HD3 PRO A 203 7.895 12.155 -14.876 1.00 0.00 H new ATOM 788 N ARG A 204 10.339 11.058 -10.178 1.00 0.00 N ATOM 789 CA ARG A 204 10.104 11.478 -8.759 1.00 0.00 C ATOM 790 C ARG A 204 10.332 12.977 -8.684 1.00 0.00 C ATOM 791 O ARG A 204 9.648 13.660 -7.955 1.00 0.00 O ATOM 792 CB ARG A 204 11.082 10.911 -7.768 1.00 0.00 C ATOM 793 CG ARG A 204 10.431 11.061 -6.380 1.00 0.00 C ATOM 794 CD ARG A 204 11.504 11.178 -5.311 1.00 0.00 C ATOM 795 NE ARG A 204 12.180 12.488 -5.527 1.00 0.00 N ATOM 796 CZ ARG A 204 11.995 13.444 -4.658 1.00 0.00 C ATOM 797 NH1 ARG A 204 12.726 13.468 -3.577 1.00 0.00 N ATOM 798 NH2 ARG A 204 11.083 14.344 -4.906 1.00 0.00 N ATOM 0 H ARG A 204 11.244 10.641 -10.397 1.00 0.00 H new ATOM 0 HA ARG A 204 9.101 11.132 -8.509 1.00 0.00 H new ATOM 0 HB2 ARG A 204 11.294 9.864 -7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 204 12.032 11.444 -7.811 1.00 0.00 H new ATOM 0 HG2 ARG A 204 9.792 11.944 -6.363 1.00 0.00 H new ATOM 0 HG3 ARG A 204 9.793 10.201 -6.174 1.00 0.00 H new ATOM 0 HD2 ARG A 204 11.065 11.128 -4.315 1.00 0.00 H new ATOM 0 HD3 ARG A 204 12.217 10.357 -5.386 1.00 0.00 H new ATOM 0 HE ARG A 204 12.777 12.635 -6.340 1.00 0.00 H new ATOM 0 HH11 ARG A 204 13.430 12.746 -3.421 1.00 0.00 H new ATOM 0 HH12 ARG A 204 12.594 14.209 -2.888 1.00 0.00 H new ATOM 0 HH21 ARG A 204 10.533 14.290 -5.764 1.00 0.00 H new ATOM 0 HH22 ARG A 204 10.920 15.101 -4.242 1.00 0.00 H new ATOM 812 N THR A 205 11.302 13.420 -9.437 1.00 0.00 N ATOM 813 CA THR A 205 11.667 14.873 -9.499 1.00 0.00 C ATOM 814 C THR A 205 10.556 15.872 -9.116 1.00 0.00 C ATOM 815 O THR A 205 10.769 16.689 -8.242 1.00 0.00 O ATOM 816 CB THR A 205 12.156 15.171 -10.914 1.00 0.00 C ATOM 817 OG1 THR A 205 11.110 14.718 -11.757 1.00 0.00 O ATOM 818 CG2 THR A 205 13.351 14.287 -11.290 1.00 0.00 C ATOM 0 H THR A 205 11.875 12.820 -10.030 1.00 0.00 H new ATOM 0 HA THR A 205 12.434 15.023 -8.739 1.00 0.00 H new ATOM 0 HB THR A 205 12.425 16.224 -10.998 1.00 0.00 H new ATOM 0 HG1 THR A 205 10.552 15.478 -12.023 1.00 0.00 H new ATOM 0 HG21 THR A 205 13.675 14.524 -12.303 1.00 0.00 H new ATOM 0 HG22 THR A 205 14.171 14.469 -10.595 1.00 0.00 H new ATOM 0 HG23 THR A 205 13.058 13.238 -11.239 1.00 0.00 H new ATOM 826 N TYR A 206 9.409 15.802 -9.749 1.00 0.00 N ATOM 827 CA TYR A 206 8.313 16.758 -9.393 1.00 0.00 C ATOM 828 C TYR A 206 7.170 16.026 -8.692 1.00 0.00 C ATOM 829 O TYR A 206 6.014 16.202 -9.021 1.00 0.00 O ATOM 830 CB TYR A 206 7.776 17.407 -10.657 1.00 0.00 C ATOM 831 CG TYR A 206 8.922 18.099 -11.388 1.00 0.00 C ATOM 832 CD1 TYR A 206 9.258 19.405 -11.100 1.00 0.00 C ATOM 833 CD2 TYR A 206 9.638 17.411 -12.341 1.00 0.00 C ATOM 834 CE1 TYR A 206 10.304 20.015 -11.762 1.00 0.00 C ATOM 835 CE2 TYR A 206 10.683 18.019 -13.004 1.00 0.00 C ATOM 836 CZ TYR A 206 11.023 19.324 -12.718 1.00 0.00 C ATOM 837 OH TYR A 206 12.069 19.932 -13.381 1.00 0.00 O ATOM 0 H TYR A 206 9.186 15.134 -10.487 1.00 0.00 H new ATOM 0 HA TYR A 206 8.719 17.516 -8.723 1.00 0.00 H new ATOM 0 HB2 TYR A 206 7.319 16.655 -11.301 1.00 0.00 H new ATOM 0 HB3 TYR A 206 6.998 18.129 -10.408 1.00 0.00 H new ATOM 0 HD1 TYR A 206 8.701 19.952 -10.354 1.00 0.00 H new ATOM 0 HD2 TYR A 206 9.380 16.388 -12.571 1.00 0.00 H new ATOM 0 HE1 TYR A 206 10.562 21.038 -11.531 1.00 0.00 H new ATOM 0 HE2 TYR A 206 11.238 17.470 -13.751 1.00 0.00 H new ATOM 0 HH TYR A 206 12.464 19.301 -14.018 1.00 0.00 H new ATOM 847 N LEU A 207 7.554 15.224 -7.738 1.00 0.00 N ATOM 848 CA LEU A 207 6.584 14.433 -6.929 1.00 0.00 C ATOM 849 C LEU A 207 7.023 14.600 -5.488 1.00 0.00 C ATOM 850 O LEU A 207 7.962 13.958 -5.058 1.00 0.00 O ATOM 851 CB LEU A 207 6.638 12.940 -7.264 1.00 0.00 C ATOM 852 CG LEU A 207 5.230 12.442 -7.553 1.00 0.00 C ATOM 853 CD1 LEU A 207 4.777 12.928 -8.921 1.00 0.00 C ATOM 854 CD2 LEU A 207 5.218 10.908 -7.492 1.00 0.00 C ATOM 0 H LEU A 207 8.530 15.080 -7.478 1.00 0.00 H new ATOM 0 HA LEU A 207 5.570 14.780 -7.126 1.00 0.00 H new ATOM 0 HB2 LEU A 207 7.281 12.772 -8.128 1.00 0.00 H new ATOM 0 HB3 LEU A 207 7.070 12.384 -6.432 1.00 0.00 H new ATOM 0 HG LEU A 207 4.539 12.834 -6.807 1.00 0.00 H new ATOM 0 HD11 LEU A 207 3.768 12.567 -9.120 1.00 0.00 H new ATOM 0 HD12 LEU A 207 4.783 14.018 -8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 207 5.455 12.548 -9.685 1.00 0.00 H new ATOM 0 HD21 LEU A 207 4.212 10.544 -7.698 1.00 0.00 H new ATOM 0 HD22 LEU A 207 5.908 10.509 -8.236 1.00 0.00 H new ATOM 0 HD23 LEU A 207 5.526 10.581 -6.499 1.00 0.00 H new ATOM 866 N GLU A 208 6.357 15.451 -4.769 1.00 0.00 N ATOM 867 CA GLU A 208 6.780 15.646 -3.358 1.00 0.00 C ATOM 868 C GLU A 208 5.776 14.870 -2.511 1.00 0.00 C ATOM 869 O GLU A 208 4.644 14.714 -2.916 1.00 0.00 O ATOM 870 CB GLU A 208 6.731 17.135 -3.056 1.00 0.00 C ATOM 871 CG GLU A 208 7.527 17.933 -4.115 1.00 0.00 C ATOM 872 CD GLU A 208 8.966 17.419 -4.247 1.00 0.00 C ATOM 873 OE1 GLU A 208 9.784 17.928 -3.499 1.00 0.00 O ATOM 874 OE2 GLU A 208 9.171 16.554 -5.082 1.00 0.00 O ATOM 0 H GLU A 208 5.561 16.006 -5.082 1.00 0.00 H new ATOM 0 HA GLU A 208 7.791 15.294 -3.155 1.00 0.00 H new ATOM 0 HB2 GLU A 208 5.695 17.474 -3.040 1.00 0.00 H new ATOM 0 HB3 GLU A 208 7.143 17.324 -2.065 1.00 0.00 H new ATOM 0 HG2 GLU A 208 7.024 17.860 -5.079 1.00 0.00 H new ATOM 0 HG3 GLU A 208 7.541 18.988 -3.842 1.00 0.00 H new ATOM 881 N PRO A 209 6.187 14.396 -1.365 1.00 0.00 N ATOM 882 CA PRO A 209 5.307 13.592 -0.481 1.00 0.00 C ATOM 883 C PRO A 209 4.039 14.353 -0.101 1.00 0.00 C ATOM 884 O PRO A 209 3.963 15.554 -0.272 1.00 0.00 O ATOM 885 CB PRO A 209 6.204 13.250 0.708 1.00 0.00 C ATOM 886 CG PRO A 209 7.216 14.425 0.718 1.00 0.00 C ATOM 887 CD PRO A 209 7.534 14.600 -0.774 1.00 0.00 C ATOM 0 HA PRO A 209 4.921 12.691 -0.957 1.00 0.00 H new ATOM 0 HB2 PRO A 209 5.639 13.194 1.639 1.00 0.00 H new ATOM 0 HB3 PRO A 209 6.701 12.288 0.578 1.00 0.00 H new ATOM 0 HG2 PRO A 209 6.785 15.328 1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 209 8.108 14.188 1.298 1.00 0.00 H new ATOM 0 HD2 PRO A 209 7.940 15.587 -0.998 1.00 0.00 H new ATOM 0 HD3 PRO A 209 8.259 13.868 -1.132 1.00 0.00 H new ATOM 895 N TYR A 210 3.079 13.628 0.407 1.00 0.00 N ATOM 896 CA TYR A 210 1.801 14.278 0.806 1.00 0.00 C ATOM 897 C TYR A 210 1.539 14.025 2.289 1.00 0.00 C ATOM 898 O TYR A 210 2.323 13.361 2.938 1.00 0.00 O ATOM 899 CB TYR A 210 0.703 13.694 -0.068 1.00 0.00 C ATOM 900 CG TYR A 210 -0.587 14.514 0.043 1.00 0.00 C ATOM 901 CD1 TYR A 210 -0.553 15.893 -0.016 1.00 0.00 C ATOM 902 CD2 TYR A 210 -1.803 13.887 0.186 1.00 0.00 C ATOM 903 CE1 TYR A 210 -1.704 16.635 0.064 1.00 0.00 C ATOM 904 CE2 TYR A 210 -2.966 14.629 0.268 1.00 0.00 C ATOM 905 CZ TYR A 210 -2.925 16.008 0.209 1.00 0.00 C ATOM 906 OH TYR A 210 -4.087 16.747 0.291 1.00 0.00 O ATOM 0 H TYR A 210 3.125 12.621 0.562 1.00 0.00 H new ATOM 0 HA TYR A 210 1.840 15.358 0.666 1.00 0.00 H new ATOM 0 HB2 TYR A 210 1.034 13.671 -1.106 1.00 0.00 H new ATOM 0 HB3 TYR A 210 0.509 12.663 0.228 1.00 0.00 H new ATOM 0 HD1 TYR A 210 0.396 16.396 -0.127 1.00 0.00 H new ATOM 0 HD2 TYR A 210 -1.849 12.809 0.234 1.00 0.00 H new ATOM 0 HE1 TYR A 210 -1.655 17.713 0.013 1.00 0.00 H new ATOM 0 HE2 TYR A 210 -3.915 14.126 0.379 1.00 0.00 H new ATOM 0 HH TYR A 210 -4.852 16.143 0.390 1.00 0.00 H new