USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 580 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 SER OG : rot 59:sc= 1.33 USER MOD Set 1.2: A 150 TYR OH : rot -15:sc= -0.917 USER MOD Single : A 93 SER OG : rot 29:sc= 0.00194 USER MOD Single : A 103 MET CE :methyl 164:sc= -0.0473 (180deg=-0.424) USER MOD Single : A 106 LYS NZ :NH3+ -167:sc= -0.0163 (180deg=-0.154) USER MOD Single : A 107 ASN : amide:sc= -0.337 K(o=-0.34,f=-2.4!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0213) USER MOD Single : A 120 MET CE :methyl 151:sc= -2.35 (180deg=-5.73!) USER MOD Single : A 122 GLN : amide:sc= -0.0424 X(o=-0.042,f=-0.32) USER MOD Single : A 124 THR OG1 : rot 180:sc= -0.425 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 161:sc= -1.2 (180deg=-2.53!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -0.836 X(o=-0.84,f=-0.53) USER MOD Single : A 144 ASN : amide:sc= -0.12 K(o=-0.12,f=-2.1!) USER MOD Single : A 157 MET CE :methyl -119:sc=-0.00381 (180deg=-0.11) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 1.111 15.759 -1.431 1.00 0.00 N ATOM 72 CA SER A 93 1.263 14.348 -1.768 1.00 0.00 C ATOM 73 C SER A 93 0.996 13.459 -0.556 1.00 0.00 C ATOM 74 O SER A 93 1.379 12.289 -0.538 1.00 0.00 O ATOM 75 CB SER A 93 2.667 14.081 -2.308 1.00 0.00 C ATOM 76 OG SER A 93 2.848 14.678 -3.581 1.00 0.00 O ATOM 0 HA SER A 93 0.530 14.107 -2.538 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.408 14.472 -1.611 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.834 13.006 -2.380 1.00 0.00 H new ATOM 0 HG SER A 93 2.275 15.470 -3.655 1.00 0.00 H new ATOM 82 N GLU A 94 0.337 14.018 0.456 1.00 0.00 N ATOM 83 CA GLU A 94 0.021 13.271 1.667 1.00 0.00 C ATOM 84 C GLU A 94 -1.475 12.983 1.753 1.00 0.00 C ATOM 85 O GLU A 94 -1.896 12.020 2.394 1.00 0.00 O ATOM 86 CB GLU A 94 0.475 14.047 2.904 1.00 0.00 C ATOM 87 CG GLU A 94 1.019 13.161 4.013 1.00 0.00 C ATOM 88 CD GLU A 94 2.533 13.095 4.017 1.00 0.00 C ATOM 89 OE1 GLU A 94 3.175 14.166 4.017 1.00 0.00 O ATOM 90 OE2 GLU A 94 3.079 11.971 4.021 1.00 0.00 O ATOM 0 H GLU A 94 0.012 14.985 0.460 1.00 0.00 H new ATOM 0 HA GLU A 94 0.554 12.321 1.628 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.244 14.762 2.612 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.366 14.623 3.290 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.673 13.537 4.976 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.616 12.155 3.900 1.00 0.00 H new ATOM 97 N GLU A 95 -2.275 13.824 1.104 1.00 0.00 N ATOM 98 CA GLU A 95 -3.723 13.658 1.107 1.00 0.00 C ATOM 99 C GLU A 95 -4.127 12.375 0.386 1.00 0.00 C ATOM 100 O GLU A 95 -5.154 11.773 0.698 1.00 0.00 O ATOM 101 CB GLU A 95 -4.397 14.864 0.448 1.00 0.00 C ATOM 102 CG GLU A 95 -4.963 15.864 1.443 1.00 0.00 C ATOM 103 CD GLU A 95 -6.194 16.576 0.918 1.00 0.00 C ATOM 104 OE1 GLU A 95 -6.153 17.062 -0.232 1.00 0.00 O ATOM 105 OE2 GLU A 95 -7.199 16.647 1.656 1.00 0.00 O ATOM 0 H GLU A 95 -1.944 14.627 0.570 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.053 13.588 2.143 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.673 15.370 -0.191 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.201 14.512 -0.198 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.214 15.347 2.369 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.198 16.601 1.687 1.00 0.00 H new ATOM 112 N GLU A 96 -3.312 11.963 -0.580 1.00 0.00 N ATOM 113 CA GLU A 96 -3.584 10.751 -1.346 1.00 0.00 C ATOM 114 C GLU A 96 -3.685 9.538 -0.427 1.00 0.00 C ATOM 115 O GLU A 96 -4.726 8.885 -0.356 1.00 0.00 O ATOM 116 CB GLU A 96 -2.489 10.525 -2.389 1.00 0.00 C ATOM 117 CG GLU A 96 -2.289 11.706 -3.325 1.00 0.00 C ATOM 118 CD GLU A 96 -1.032 11.577 -4.163 1.00 0.00 C ATOM 119 OE1 GLU A 96 -0.008 11.102 -3.628 1.00 0.00 O ATOM 120 OE2 GLU A 96 -1.072 11.952 -5.354 1.00 0.00 O ATOM 0 H GLU A 96 -2.458 12.450 -0.851 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.539 10.880 -1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.550 10.314 -1.878 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -2.737 9.642 -2.979 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -3.153 11.794 -3.983 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.239 12.624 -2.740 1.00 0.00 H new ATOM 127 N LEU A 97 -2.596 9.241 0.274 1.00 0.00 N ATOM 128 CA LEU A 97 -2.564 8.107 1.188 1.00 0.00 C ATOM 129 C LEU A 97 -3.576 8.286 2.314 1.00 0.00 C ATOM 130 O LEU A 97 -4.185 7.321 2.775 1.00 0.00 O ATOM 131 CB LEU A 97 -1.161 7.937 1.772 1.00 0.00 C ATOM 132 CG LEU A 97 -0.099 7.459 0.779 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.220 8.182 1.014 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.087 5.952 0.886 1.00 0.00 C ATOM 0 H LEU A 97 -1.725 9.770 0.226 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.828 7.212 0.625 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.841 8.891 2.192 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.211 7.226 2.597 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.439 7.693 -0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.962 7.828 0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.075 9.255 0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.569 7.982 2.027 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.845 5.628 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.405 5.695 1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.856 5.452 0.665 1.00 0.00 H new ATOM 146 N SER A 98 -3.752 9.529 2.755 1.00 0.00 N ATOM 147 CA SER A 98 -4.691 9.837 3.830 1.00 0.00 C ATOM 148 C SER A 98 -6.066 9.239 3.547 1.00 0.00 C ATOM 149 O SER A 98 -6.721 8.711 4.446 1.00 0.00 O ATOM 150 CB SER A 98 -4.811 11.351 4.013 1.00 0.00 C ATOM 151 OG SER A 98 -4.956 11.690 5.381 1.00 0.00 O ATOM 0 H SER A 98 -3.256 10.340 2.384 1.00 0.00 H new ATOM 0 HA SER A 98 -4.306 9.394 4.748 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.927 11.841 3.606 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.668 11.722 3.451 1.00 0.00 H new ATOM 0 HG SER A 98 -4.180 11.364 5.883 1.00 0.00 H new ATOM 157 N ASP A 99 -6.497 9.324 2.293 1.00 0.00 N ATOM 158 CA ASP A 99 -7.793 8.790 1.893 1.00 0.00 C ATOM 159 C ASP A 99 -7.697 7.300 1.577 1.00 0.00 C ATOM 160 O ASP A 99 -8.669 6.560 1.729 1.00 0.00 O ATOM 161 CB ASP A 99 -8.328 9.547 0.677 1.00 0.00 C ATOM 162 CG ASP A 99 -8.784 10.951 1.025 1.00 0.00 C ATOM 163 OD1 ASP A 99 -7.914 11.826 1.222 1.00 0.00 O ATOM 164 OD2 ASP A 99 -10.010 11.176 1.099 1.00 0.00 O ATOM 0 H ASP A 99 -5.968 9.758 1.537 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.483 8.922 2.727 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.551 9.599 -0.086 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.162 8.993 0.246 1.00 0.00 H new ATOM 169 N LEU A 100 -6.521 6.866 1.135 1.00 0.00 N ATOM 170 CA LEU A 100 -6.302 5.464 0.797 1.00 0.00 C ATOM 171 C LEU A 100 -6.315 4.590 2.048 1.00 0.00 C ATOM 172 O LEU A 100 -6.832 3.475 2.028 1.00 0.00 O ATOM 173 CB LEU A 100 -4.973 5.294 0.058 1.00 0.00 C ATOM 174 CG LEU A 100 -4.979 5.737 -1.407 1.00 0.00 C ATOM 175 CD1 LEU A 100 -3.566 5.741 -1.970 1.00 0.00 C ATOM 176 CD2 LEU A 100 -5.882 4.833 -2.234 1.00 0.00 C ATOM 0 H LEU A 100 -5.706 7.464 1.003 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.116 5.146 0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.206 5.859 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.683 4.244 0.102 1.00 0.00 H new ATOM 0 HG LEU A 100 -5.371 6.753 -1.457 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.591 6.059 -3.012 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.947 6.430 -1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.146 4.737 -1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.874 5.163 -3.273 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.520 3.806 -2.176 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.899 4.881 -1.846 1.00 0.00 H new ATOM 188 N PHE A 101 -5.740 5.101 3.132 1.00 0.00 N ATOM 189 CA PHE A 101 -5.683 4.361 4.390 1.00 0.00 C ATOM 190 C PHE A 101 -7.075 3.932 4.845 1.00 0.00 C ATOM 191 O PHE A 101 -7.347 2.742 5.006 1.00 0.00 O ATOM 192 CB PHE A 101 -5.020 5.208 5.478 1.00 0.00 C ATOM 193 CG PHE A 101 -4.492 4.400 6.629 1.00 0.00 C ATOM 194 CD1 PHE A 101 -3.721 3.270 6.405 1.00 0.00 C ATOM 195 CD2 PHE A 101 -4.765 4.772 7.935 1.00 0.00 C ATOM 196 CE1 PHE A 101 -3.233 2.526 7.464 1.00 0.00 C ATOM 197 CE2 PHE A 101 -4.281 4.032 8.997 1.00 0.00 C ATOM 198 CZ PHE A 101 -3.514 2.908 8.761 1.00 0.00 C ATOM 0 H PHE A 101 -5.307 6.024 3.166 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.087 3.464 4.220 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.201 5.775 5.037 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.743 5.932 5.854 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.499 2.967 5.392 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.363 5.651 8.126 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.633 1.648 7.277 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.502 4.332 10.011 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.134 2.329 9.590 1.00 0.00 H new ATOM 208 N ARG A 102 -7.952 4.908 5.056 1.00 0.00 N ATOM 209 CA ARG A 102 -9.314 4.630 5.499 1.00 0.00 C ATOM 210 C ARG A 102 -10.046 3.730 4.507 1.00 0.00 C ATOM 211 O ARG A 102 -10.943 2.977 4.884 1.00 0.00 O ATOM 212 CB ARG A 102 -10.087 5.938 5.686 1.00 0.00 C ATOM 213 CG ARG A 102 -10.101 6.435 7.123 1.00 0.00 C ATOM 214 CD ARG A 102 -10.465 7.910 7.202 1.00 0.00 C ATOM 215 NE ARG A 102 -11.737 8.125 7.887 1.00 0.00 N ATOM 216 CZ ARG A 102 -12.927 7.984 7.306 1.00 0.00 C ATOM 217 NH1 ARG A 102 -13.012 7.628 6.030 1.00 0.00 N ATOM 218 NH2 ARG A 102 -14.034 8.199 8.003 1.00 0.00 N ATOM 0 H ARG A 102 -7.744 5.898 4.927 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.255 4.107 6.454 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.647 6.705 5.049 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.114 5.795 5.349 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.816 5.852 7.703 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.121 6.277 7.573 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -9.676 8.450 7.725 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -10.521 8.324 6.195 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.712 8.400 8.869 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -12.163 7.461 5.490 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.926 7.521 5.590 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -13.974 8.472 8.984 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -14.946 8.091 7.558 1.00 0.00 H new ATOM 232 N MET A 103 -9.662 3.816 3.237 1.00 0.00 N ATOM 233 CA MET A 103 -10.289 3.011 2.194 1.00 0.00 C ATOM 234 C MET A 103 -9.668 1.618 2.122 1.00 0.00 C ATOM 235 O MET A 103 -10.323 0.657 1.718 1.00 0.00 O ATOM 236 CB MET A 103 -10.161 3.709 0.839 1.00 0.00 C ATOM 237 CG MET A 103 -11.170 3.226 -0.191 1.00 0.00 C ATOM 238 SD MET A 103 -10.391 2.477 -1.635 1.00 0.00 S ATOM 239 CE MET A 103 -9.655 3.916 -2.408 1.00 0.00 C ATOM 0 H MET A 103 -8.921 4.434 2.906 1.00 0.00 H new ATOM 0 HA MET A 103 -11.344 2.901 2.444 1.00 0.00 H new ATOM 0 HB2 MET A 103 -10.283 4.783 0.980 1.00 0.00 H new ATOM 0 HB3 MET A 103 -9.155 3.551 0.452 1.00 0.00 H new ATOM 0 HG2 MET A 103 -11.837 2.500 0.274 1.00 0.00 H new ATOM 0 HG3 MET A 103 -11.786 4.066 -0.511 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.912 3.596 -3.139 1.00 0.00 H new ATOM 0 HE2 MET A 103 -10.430 4.497 -2.908 1.00 0.00 H new ATOM 0 HE3 MET A 103 -9.174 4.532 -1.648 1.00 0.00 H new ATOM 249 N PHE A 104 -8.401 1.515 2.512 1.00 0.00 N ATOM 250 CA PHE A 104 -7.695 0.239 2.486 1.00 0.00 C ATOM 251 C PHE A 104 -7.982 -0.573 3.744 1.00 0.00 C ATOM 252 O PHE A 104 -8.118 -1.795 3.688 1.00 0.00 O ATOM 253 CB PHE A 104 -6.189 0.467 2.347 1.00 0.00 C ATOM 254 CG PHE A 104 -5.504 -0.558 1.491 1.00 0.00 C ATOM 255 CD1 PHE A 104 -5.302 -1.846 1.959 1.00 0.00 C ATOM 256 CD2 PHE A 104 -5.064 -0.234 0.218 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.673 -2.792 1.173 1.00 0.00 C ATOM 258 CE2 PHE A 104 -4.435 -1.176 -0.573 1.00 0.00 C ATOM 259 CZ PHE A 104 -4.239 -2.456 -0.095 1.00 0.00 C ATOM 0 H PHE A 104 -7.843 2.299 2.849 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.053 -0.324 1.624 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.017 1.456 1.923 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.736 0.462 3.338 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.640 -2.114 2.949 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -5.214 0.766 -0.160 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.521 -3.793 1.549 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -4.097 -0.911 -1.564 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.747 -3.194 -0.711 1.00 0.00 H new ATOM 269 N ASP A 105 -8.069 0.112 4.879 1.00 0.00 N ATOM 270 CA ASP A 105 -8.337 -0.547 6.152 1.00 0.00 C ATOM 271 C ASP A 105 -9.636 -1.346 6.094 1.00 0.00 C ATOM 272 O ASP A 105 -9.621 -2.576 6.153 1.00 0.00 O ATOM 273 CB ASP A 105 -8.407 0.485 7.279 1.00 0.00 C ATOM 274 CG ASP A 105 -8.102 -0.118 8.636 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.359 -1.326 8.819 1.00 0.00 O ATOM 276 OD2 ASP A 105 -7.606 0.618 9.515 1.00 0.00 O ATOM 0 H ASP A 105 -7.958 1.124 4.943 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.519 -1.239 6.352 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.701 1.290 7.075 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.401 0.931 7.298 1.00 0.00 H new ATOM 281 N LYS A 106 -10.759 -0.640 5.976 1.00 0.00 N ATOM 282 CA LYS A 106 -12.071 -1.283 5.908 1.00 0.00 C ATOM 283 C LYS A 106 -12.463 -1.906 7.249 1.00 0.00 C ATOM 284 O LYS A 106 -13.476 -2.598 7.345 1.00 0.00 O ATOM 285 CB LYS A 106 -12.081 -2.356 4.816 1.00 0.00 C ATOM 286 CG LYS A 106 -12.983 -2.018 3.639 1.00 0.00 C ATOM 287 CD LYS A 106 -12.178 -1.742 2.379 1.00 0.00 C ATOM 288 CE LYS A 106 -12.039 -2.990 1.522 1.00 0.00 C ATOM 289 NZ LYS A 106 -11.267 -4.057 2.217 1.00 0.00 N ATOM 0 H LYS A 106 -10.787 0.378 5.925 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.802 -0.512 5.666 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.064 -2.503 4.453 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -12.404 -3.302 5.251 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -13.671 -2.844 3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.589 -1.145 3.883 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.663 -0.955 1.801 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.189 -1.374 2.651 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -13.029 -3.367 1.266 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -11.543 -2.734 0.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.005 -4.796 1.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.406 -3.648 2.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.851 -4.473 2.970 1.00 0.00 H new ATOM 303 N ASN A 107 -11.660 -1.660 8.279 1.00 0.00 N ATOM 304 CA ASN A 107 -11.932 -2.202 9.607 1.00 0.00 C ATOM 305 C ASN A 107 -12.399 -1.107 10.567 1.00 0.00 C ATOM 306 O ASN A 107 -12.916 -1.398 11.645 1.00 0.00 O ATOM 307 CB ASN A 107 -10.681 -2.888 10.163 1.00 0.00 C ATOM 308 CG ASN A 107 -10.929 -4.341 10.519 1.00 0.00 C ATOM 309 OD1 ASN A 107 -11.902 -4.946 10.068 1.00 0.00 O ATOM 310 ND2 ASN A 107 -10.046 -4.910 11.331 1.00 0.00 N ATOM 0 H ASN A 107 -10.816 -1.090 8.221 1.00 0.00 H new ATOM 0 HA ASN A 107 -12.733 -2.936 9.514 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.880 -2.829 9.426 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.340 -2.353 11.049 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.160 -5.886 11.604 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.254 -4.371 11.681 1.00 0.00 H new ATOM 317 N ALA A 108 -12.213 0.151 10.172 1.00 0.00 N ATOM 318 CA ALA A 108 -12.615 1.281 11.002 1.00 0.00 C ATOM 319 C ALA A 108 -11.762 1.366 12.263 1.00 0.00 C ATOM 320 O ALA A 108 -12.238 1.783 13.319 1.00 0.00 O ATOM 321 CB ALA A 108 -14.090 1.177 11.365 1.00 0.00 C ATOM 0 H ALA A 108 -11.787 0.412 9.283 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.460 2.194 10.427 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -14.373 2.028 11.984 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -14.689 1.175 10.455 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.265 0.253 11.916 1.00 0.00 H new ATOM 327 N ASP A 109 -10.499 0.970 12.144 1.00 0.00 N ATOM 328 CA ASP A 109 -9.577 1.003 13.273 1.00 0.00 C ATOM 329 C ASP A 109 -8.430 1.972 13.008 1.00 0.00 C ATOM 330 O ASP A 109 -8.085 2.790 13.860 1.00 0.00 O ATOM 331 CB ASP A 109 -9.025 -0.397 13.550 1.00 0.00 C ATOM 332 CG ASP A 109 -8.329 -0.994 12.342 1.00 0.00 C ATOM 333 OD1 ASP A 109 -8.801 -0.760 11.210 1.00 0.00 O ATOM 334 OD2 ASP A 109 -7.313 -1.695 12.529 1.00 0.00 O ATOM 0 H ASP A 109 -10.091 0.622 11.276 1.00 0.00 H new ATOM 0 HA ASP A 109 -10.126 1.348 14.149 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.324 -0.350 14.383 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -9.841 -1.052 13.856 1.00 0.00 H new ATOM 339 N GLY A 110 -7.845 1.877 11.818 1.00 0.00 N ATOM 340 CA GLY A 110 -6.745 2.753 11.459 1.00 0.00 C ATOM 341 C GLY A 110 -5.421 2.021 11.354 1.00 0.00 C ATOM 342 O GLY A 110 -4.358 2.636 11.437 1.00 0.00 O ATOM 0 H GLY A 110 -8.113 1.209 11.096 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -6.966 3.234 10.506 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -6.659 3.545 12.203 1.00 0.00 H new ATOM 346 N TYR A 111 -5.480 0.705 11.168 1.00 0.00 N ATOM 347 CA TYR A 111 -4.270 -0.103 11.049 1.00 0.00 C ATOM 348 C TYR A 111 -4.494 -1.273 10.096 1.00 0.00 C ATOM 349 O TYR A 111 -5.631 -1.690 9.873 1.00 0.00 O ATOM 350 CB TYR A 111 -3.829 -0.631 12.421 1.00 0.00 C ATOM 351 CG TYR A 111 -4.364 0.164 13.594 1.00 0.00 C ATOM 352 CD1 TYR A 111 -3.903 1.447 13.857 1.00 0.00 C ATOM 353 CD2 TYR A 111 -5.330 -0.372 14.437 1.00 0.00 C ATOM 354 CE1 TYR A 111 -4.387 2.175 14.927 1.00 0.00 C ATOM 355 CE2 TYR A 111 -5.820 0.350 15.509 1.00 0.00 C ATOM 356 CZ TYR A 111 -5.346 1.622 15.749 1.00 0.00 C ATOM 357 OH TYR A 111 -5.831 2.344 16.816 1.00 0.00 O ATOM 0 H TYR A 111 -6.350 0.177 11.097 1.00 0.00 H new ATOM 0 HA TYR A 111 -3.482 0.535 10.648 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -4.153 -1.667 12.520 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -2.740 -0.633 12.464 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.153 1.884 13.214 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.704 -1.368 14.252 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -4.016 3.171 15.118 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -6.571 -0.080 16.155 1.00 0.00 H new ATOM 0 HH TYR A 111 -6.501 1.812 17.294 1.00 0.00 H new ATOM 367 N ILE A 112 -3.409 -1.803 9.534 1.00 0.00 N ATOM 368 CA ILE A 112 -3.512 -2.927 8.609 1.00 0.00 C ATOM 369 C ILE A 112 -2.788 -4.157 9.147 1.00 0.00 C ATOM 370 O ILE A 112 -1.630 -4.081 9.555 1.00 0.00 O ATOM 371 CB ILE A 112 -2.946 -2.574 7.219 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.533 -1.246 6.729 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.240 -3.694 6.230 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.204 -0.927 5.285 1.00 0.00 C ATOM 0 H ILE A 112 -2.458 -1.475 9.701 1.00 0.00 H new ATOM 0 HA ILE A 112 -4.574 -3.151 8.510 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.865 -2.462 7.297 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.616 -1.273 6.848 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.163 -0.440 7.363 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.835 -3.432 5.253 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -2.778 -4.618 6.578 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.318 -3.835 6.150 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.654 0.027 5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.123 -0.867 5.163 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.599 -1.712 4.640 1.00 0.00 H new ATOM 386 N ASP A 113 -3.482 -5.290 9.144 1.00 0.00 N ATOM 387 CA ASP A 113 -2.908 -6.540 9.630 1.00 0.00 C ATOM 388 C ASP A 113 -3.001 -7.627 8.564 1.00 0.00 C ATOM 389 O ASP A 113 -3.388 -7.361 7.426 1.00 0.00 O ATOM 390 CB ASP A 113 -3.624 -6.993 10.905 1.00 0.00 C ATOM 391 CG ASP A 113 -2.837 -6.663 12.158 1.00 0.00 C ATOM 392 OD1 ASP A 113 -1.592 -6.761 12.120 1.00 0.00 O ATOM 393 OD2 ASP A 113 -3.464 -6.308 13.177 1.00 0.00 O ATOM 0 H ASP A 113 -4.443 -5.369 8.811 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.856 -6.367 9.857 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.603 -6.516 10.958 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -3.795 -8.068 10.860 1.00 0.00 H new ATOM 398 N LEU A 114 -2.643 -8.852 8.938 1.00 0.00 N ATOM 399 CA LEU A 114 -2.684 -9.982 8.013 1.00 0.00 C ATOM 400 C LEU A 114 -4.018 -10.047 7.272 1.00 0.00 C ATOM 401 O LEU A 114 -4.091 -10.550 6.152 1.00 0.00 O ATOM 402 CB LEU A 114 -2.443 -11.292 8.767 1.00 0.00 C ATOM 403 CG LEU A 114 -0.987 -11.557 9.156 1.00 0.00 C ATOM 404 CD1 LEU A 114 -0.618 -10.774 10.406 1.00 0.00 C ATOM 405 CD2 LEU A 114 -0.756 -13.045 9.368 1.00 0.00 C ATOM 0 H LEU A 114 -2.321 -9.088 9.876 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.893 -9.838 7.277 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.050 -11.289 9.672 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.794 -12.119 8.150 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.345 -11.222 8.341 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.421 -10.975 10.668 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.745 -9.708 10.218 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.265 -11.077 11.229 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.285 -13.216 9.644 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.407 -13.404 10.165 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.980 -13.583 8.447 1.00 0.00 H new ATOM 417 N GLU A 115 -5.070 -9.534 7.904 1.00 0.00 N ATOM 418 CA GLU A 115 -6.397 -9.535 7.300 1.00 0.00 C ATOM 419 C GLU A 115 -6.469 -8.550 6.138 1.00 0.00 C ATOM 420 O GLU A 115 -6.755 -8.933 5.004 1.00 0.00 O ATOM 421 CB GLU A 115 -7.457 -9.186 8.346 1.00 0.00 C ATOM 422 CG GLU A 115 -7.453 -10.149 9.517 1.00 0.00 C ATOM 423 OE1 GLU A 115 -8.325 -11.042 9.554 1.00 0.00 O ATOM 424 OE2 GLU A 115 -6.578 -10.010 10.397 1.00 0.00 O ATOM 0 H GLU A 115 -5.029 -9.113 8.832 1.00 0.00 H new ATOM 0 HA GLU A 115 -6.591 -10.536 6.915 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.284 -8.174 8.711 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.441 -9.192 7.878 1.00 0.00 H new ATOM 429 N GLU A 116 -6.206 -7.279 6.427 1.00 0.00 N ATOM 430 CA GLU A 116 -6.241 -6.240 5.405 1.00 0.00 C ATOM 431 C GLU A 116 -5.091 -6.410 4.417 1.00 0.00 C ATOM 432 O GLU A 116 -5.218 -6.086 3.237 1.00 0.00 O ATOM 433 CB GLU A 116 -6.173 -4.856 6.053 1.00 0.00 C ATOM 434 CG GLU A 116 -7.459 -4.449 6.754 1.00 0.00 C ATOM 435 CD GLU A 116 -7.455 -4.801 8.228 1.00 0.00 C ATOM 436 OE1 GLU A 116 -6.408 -4.611 8.881 1.00 0.00 O ATOM 437 OE2 GLU A 116 -8.499 -5.268 8.730 1.00 0.00 O ATOM 0 H GLU A 116 -5.966 -6.945 7.360 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.180 -6.332 4.860 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.356 -4.841 6.774 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.936 -4.117 5.288 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.606 -3.375 6.641 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.304 -4.939 6.269 1.00 0.00 H new ATOM 444 N LEU A 117 -3.968 -6.927 4.907 1.00 0.00 N ATOM 445 CA LEU A 117 -2.796 -7.146 4.065 1.00 0.00 C ATOM 446 C LEU A 117 -3.144 -8.013 2.856 1.00 0.00 C ATOM 447 O LEU A 117 -2.450 -7.985 1.840 1.00 0.00 O ATOM 448 CB LEU A 117 -1.681 -7.806 4.876 1.00 0.00 C ATOM 449 CG LEU A 117 -0.260 -7.460 4.430 1.00 0.00 C ATOM 450 CD1 LEU A 117 0.009 -8.005 3.037 1.00 0.00 C ATOM 451 CD2 LEU A 117 -0.041 -5.955 4.468 1.00 0.00 C ATOM 0 H LEU A 117 -3.845 -7.202 5.882 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.452 -6.177 3.704 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.796 -7.521 5.922 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.808 -8.887 4.825 1.00 0.00 H new ATOM 0 HG LEU A 117 0.442 -7.926 5.122 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.025 -7.749 2.736 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.106 -9.089 3.042 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.699 -7.568 2.332 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.976 -5.727 4.148 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.750 -5.467 3.799 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.191 -5.591 5.484 1.00 0.00 H new ATOM 463 N LYS A 118 -4.221 -8.782 2.974 1.00 0.00 N ATOM 464 CA LYS A 118 -4.663 -9.658 1.895 1.00 0.00 C ATOM 465 C LYS A 118 -5.233 -8.853 0.730 1.00 0.00 C ATOM 466 O LYS A 118 -5.200 -9.295 -0.418 1.00 0.00 O ATOM 467 CB LYS A 118 -5.720 -10.632 2.416 1.00 0.00 C ATOM 468 CG LYS A 118 -6.132 -11.687 1.402 1.00 0.00 C ATOM 469 CD LYS A 118 -7.347 -11.247 0.600 1.00 0.00 C ATOM 470 CE LYS A 118 -8.549 -10.991 1.496 1.00 0.00 C ATOM 471 NZ LYS A 118 -9.775 -11.662 0.985 1.00 0.00 N ATOM 0 H LYS A 118 -4.806 -8.816 3.809 1.00 0.00 H new ATOM 0 HA LYS A 118 -3.798 -10.215 1.535 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.336 -11.128 3.307 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.602 -10.069 2.720 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -5.301 -11.886 0.725 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -6.354 -12.621 1.918 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -7.108 -10.340 0.044 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.596 -12.014 -0.133 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.333 -11.347 2.503 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -8.726 -9.918 1.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -10.617 -11.189 1.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -9.794 -11.607 -0.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -9.773 -12.660 1.278 1.00 0.00 H new ATOM 485 N ILE A 119 -5.765 -7.673 1.036 1.00 0.00 N ATOM 486 CA ILE A 119 -6.355 -6.807 0.019 1.00 0.00 C ATOM 487 C ILE A 119 -5.392 -6.567 -1.145 1.00 0.00 C ATOM 488 O ILE A 119 -5.668 -6.964 -2.277 1.00 0.00 O ATOM 489 CB ILE A 119 -6.790 -5.455 0.628 1.00 0.00 C ATOM 490 CG1 ILE A 119 -7.982 -5.664 1.564 1.00 0.00 C ATOM 491 CG2 ILE A 119 -7.138 -4.449 -0.463 1.00 0.00 C ATOM 492 CD1 ILE A 119 -7.958 -4.773 2.786 1.00 0.00 C ATOM 0 H ILE A 119 -5.800 -7.294 1.982 1.00 0.00 H new ATOM 0 HA ILE A 119 -7.236 -7.321 -0.367 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.955 -5.051 1.201 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.903 -5.482 1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -8.003 -6.706 1.885 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.441 -3.507 -0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.266 -4.282 -1.095 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -7.956 -4.838 -1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.833 -4.977 3.402 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.054 -4.970 3.362 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -7.969 -3.728 2.475 1.00 0.00 H new ATOM 504 N MET A 120 -4.269 -5.910 -0.866 1.00 0.00 N ATOM 505 CA MET A 120 -3.275 -5.615 -1.899 1.00 0.00 C ATOM 506 C MET A 120 -2.996 -6.838 -2.769 1.00 0.00 C ATOM 507 O MET A 120 -2.748 -6.714 -3.969 1.00 0.00 O ATOM 508 CB MET A 120 -1.968 -5.122 -1.272 1.00 0.00 C ATOM 509 CG MET A 120 -1.518 -5.929 -0.066 1.00 0.00 C ATOM 510 SD MET A 120 -0.508 -4.961 1.071 1.00 0.00 S ATOM 511 CE MET A 120 -1.771 -4.041 1.946 1.00 0.00 C ATOM 0 H MET A 120 -4.023 -5.572 0.064 1.00 0.00 H new ATOM 0 HA MET A 120 -3.688 -4.828 -2.530 1.00 0.00 H new ATOM 0 HB2 MET A 120 -1.182 -5.148 -2.027 1.00 0.00 H new ATOM 0 HB3 MET A 120 -2.090 -4.081 -0.974 1.00 0.00 H new ATOM 0 HG2 MET A 120 -2.393 -6.307 0.462 1.00 0.00 H new ATOM 0 HG3 MET A 120 -0.950 -6.796 -0.404 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.424 -3.816 2.955 1.00 0.00 H new ATOM 0 HE2 MET A 120 -1.976 -3.110 1.417 1.00 0.00 H new ATOM 0 HE3 MET A 120 -2.683 -4.636 2.000 1.00 0.00 H new ATOM 521 N LEU A 121 -3.038 -8.016 -2.158 1.00 0.00 N ATOM 522 CA LEU A 121 -2.789 -9.258 -2.880 1.00 0.00 C ATOM 523 C LEU A 121 -4.041 -9.721 -3.619 1.00 0.00 C ATOM 524 O LEU A 121 -3.954 -10.371 -4.660 1.00 0.00 O ATOM 525 CB LEU A 121 -2.319 -10.347 -1.916 1.00 0.00 C ATOM 526 CG LEU A 121 -1.815 -11.627 -2.585 1.00 0.00 C ATOM 527 CD1 LEU A 121 -0.677 -12.237 -1.781 1.00 0.00 C ATOM 528 CD2 LEU A 121 -2.952 -12.625 -2.750 1.00 0.00 C ATOM 0 H LEU A 121 -3.242 -8.137 -1.166 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.006 -9.070 -3.615 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -1.521 -9.941 -1.294 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.143 -10.603 -1.250 1.00 0.00 H new ATOM 0 HG LEU A 121 -1.436 -11.373 -3.575 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.331 -13.147 -2.272 1.00 0.00 H new ATOM 0 HD12 LEU A 121 0.145 -11.525 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.028 -12.477 -0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.576 -13.530 -3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.362 -12.875 -1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.734 -12.186 -3.370 1.00 0.00 H new ATOM 540 N GLN A 122 -5.205 -9.382 -3.073 1.00 0.00 N ATOM 541 CA GLN A 122 -6.475 -9.764 -3.682 1.00 0.00 C ATOM 542 C GLN A 122 -6.584 -9.223 -5.105 1.00 0.00 C ATOM 543 O GLN A 122 -7.263 -9.806 -5.950 1.00 0.00 O ATOM 544 CB GLN A 122 -7.643 -9.253 -2.834 1.00 0.00 C ATOM 545 CG GLN A 122 -8.529 -10.361 -2.289 1.00 0.00 C ATOM 546 CD GLN A 122 -9.766 -10.589 -3.135 1.00 0.00 C ATOM 547 OE1 GLN A 122 -10.476 -9.645 -3.483 1.00 0.00 O ATOM 548 NE2 GLN A 122 -10.031 -11.846 -3.471 1.00 0.00 N ATOM 0 H GLN A 122 -5.295 -8.844 -2.211 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.516 -10.852 -3.726 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -7.249 -8.671 -2.001 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.250 -8.577 -3.436 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -7.955 -11.286 -2.235 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -8.830 -10.113 -1.271 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -9.415 -12.598 -3.161 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -10.850 -12.060 -4.040 1.00 0.00 H new ATOM 557 N ALA A 123 -5.912 -8.106 -5.364 1.00 0.00 N ATOM 558 CA ALA A 123 -5.935 -7.489 -6.685 1.00 0.00 C ATOM 559 C ALA A 123 -5.236 -8.370 -7.715 1.00 0.00 C ATOM 560 O ALA A 123 -5.616 -8.394 -8.886 1.00 0.00 O ATOM 561 CB ALA A 123 -5.285 -6.114 -6.636 1.00 0.00 C ATOM 0 H ALA A 123 -5.345 -7.610 -4.677 1.00 0.00 H new ATOM 0 HA ALA A 123 -6.976 -7.377 -6.988 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.309 -5.665 -7.629 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.829 -5.479 -5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -4.250 -6.212 -6.307 1.00 0.00 H new ATOM 567 N THR A 124 -4.212 -9.091 -7.271 1.00 0.00 N ATOM 568 CA THR A 124 -3.460 -9.974 -8.155 1.00 0.00 C ATOM 569 C THR A 124 -4.003 -11.398 -8.096 1.00 0.00 C ATOM 570 O THR A 124 -4.145 -12.062 -9.122 1.00 0.00 O ATOM 571 CB THR A 124 -1.977 -9.964 -7.779 1.00 0.00 C ATOM 572 OG1 THR A 124 -1.251 -10.882 -8.577 1.00 0.00 O ATOM 573 CG2 THR A 124 -1.723 -10.315 -6.329 1.00 0.00 C ATOM 0 H THR A 124 -3.884 -9.081 -6.305 1.00 0.00 H new ATOM 0 HA THR A 124 -3.572 -9.606 -9.175 1.00 0.00 H new ATOM 0 HB THR A 124 -1.643 -8.941 -7.951 1.00 0.00 H new ATOM 0 HG1 THR A 124 -0.305 -10.860 -8.322 1.00 0.00 H new ATOM 0 HG21 THR A 124 -0.652 -10.289 -6.131 1.00 0.00 H new ATOM 0 HG22 THR A 124 -2.229 -9.594 -5.686 1.00 0.00 H new ATOM 0 HG23 THR A 124 -2.106 -11.315 -6.124 1.00 0.00 H new ATOM 581 N GLY A 125 -4.305 -11.861 -6.887 1.00 0.00 N ATOM 582 CA GLY A 125 -4.829 -13.204 -6.715 1.00 0.00 C ATOM 583 C GLY A 125 -3.923 -14.265 -7.312 1.00 0.00 C ATOM 584 O GLY A 125 -4.394 -15.303 -7.776 1.00 0.00 O ATOM 0 H GLY A 125 -4.196 -11.330 -6.023 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -4.965 -13.404 -5.652 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -5.813 -13.268 -7.180 1.00 0.00 H new ATOM 588 N GLU A 126 -2.621 -14.002 -7.300 1.00 0.00 N ATOM 589 CA GLU A 126 -1.646 -14.940 -7.845 1.00 0.00 C ATOM 590 C GLU A 126 -1.284 -16.009 -6.818 1.00 0.00 C ATOM 591 O GLU A 126 -1.815 -16.023 -5.708 1.00 0.00 O ATOM 592 CB GLU A 126 -0.386 -14.195 -8.293 1.00 0.00 C ATOM 593 CG GLU A 126 0.117 -14.617 -9.663 1.00 0.00 C ATOM 594 CD GLU A 126 -0.733 -14.067 -10.791 1.00 0.00 C ATOM 595 OE1 GLU A 126 -0.885 -12.829 -10.871 1.00 0.00 O ATOM 596 OE2 GLU A 126 -1.247 -14.873 -11.595 1.00 0.00 O ATOM 0 H GLU A 126 -2.216 -13.147 -6.919 1.00 0.00 H new ATOM 0 HA GLU A 126 -2.095 -15.431 -8.708 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -0.592 -13.125 -8.305 1.00 0.00 H new ATOM 0 HB3 GLU A 126 0.403 -14.359 -7.559 1.00 0.00 H new ATOM 0 HG2 GLU A 126 1.145 -14.277 -9.789 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.131 -15.705 -9.721 1.00 0.00 H new ATOM 603 N THR A 127 -0.375 -16.902 -7.197 1.00 0.00 N ATOM 604 CA THR A 127 0.061 -17.975 -6.310 1.00 0.00 C ATOM 605 C THR A 127 0.695 -17.416 -5.037 1.00 0.00 C ATOM 606 O THR A 127 0.794 -18.112 -4.027 1.00 0.00 O ATOM 607 CB THR A 127 1.056 -18.887 -7.030 1.00 0.00 C ATOM 608 OG1 THR A 127 1.411 -19.987 -6.212 1.00 0.00 O ATOM 609 CG2 THR A 127 2.333 -18.180 -7.430 1.00 0.00 C ATOM 0 H THR A 127 0.074 -16.904 -8.113 1.00 0.00 H new ATOM 0 HA THR A 127 -0.818 -18.554 -6.028 1.00 0.00 H new ATOM 0 HB THR A 127 0.544 -19.217 -7.934 1.00 0.00 H new ATOM 0 HG1 THR A 127 2.047 -20.559 -6.691 1.00 0.00 H new ATOM 0 HG21 THR A 127 2.995 -18.883 -7.936 1.00 0.00 H new ATOM 0 HG22 THR A 127 2.097 -17.355 -8.103 1.00 0.00 H new ATOM 0 HG23 THR A 127 2.828 -17.792 -6.540 1.00 0.00 H new ATOM 617 N ILE A 128 1.124 -16.158 -5.093 1.00 0.00 N ATOM 618 CA ILE A 128 1.750 -15.509 -3.944 1.00 0.00 C ATOM 619 C ILE A 128 0.862 -15.590 -2.703 1.00 0.00 C ATOM 620 O ILE A 128 1.349 -15.499 -1.576 1.00 0.00 O ATOM 621 CB ILE A 128 2.066 -14.031 -4.240 1.00 0.00 C ATOM 622 CG1 ILE A 128 0.807 -13.301 -4.711 1.00 0.00 C ATOM 623 CG2 ILE A 128 3.169 -13.920 -5.281 1.00 0.00 C ATOM 624 CD1 ILE A 128 1.037 -11.837 -5.017 1.00 0.00 C ATOM 0 H ILE A 128 1.050 -15.568 -5.921 1.00 0.00 H new ATOM 0 HA ILE A 128 2.680 -16.044 -3.751 1.00 0.00 H new ATOM 0 HB ILE A 128 2.414 -13.561 -3.320 1.00 0.00 H new ATOM 0 HG12 ILE A 128 0.423 -13.795 -5.604 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.038 -13.387 -3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.379 -12.869 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 128 4.071 -14.407 -4.909 1.00 0.00 H new ATOM 0 HG23 ILE A 128 2.849 -14.405 -6.203 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.102 -11.383 -5.345 1.00 0.00 H new ATOM 0 HD12 ILE A 128 1.392 -11.329 -4.120 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.783 -11.743 -5.806 1.00 0.00 H new ATOM 636 N THR A 129 -0.442 -15.759 -2.917 1.00 0.00 N ATOM 637 CA THR A 129 -1.401 -15.850 -1.816 1.00 0.00 C ATOM 638 C THR A 129 -0.902 -16.787 -0.719 1.00 0.00 C ATOM 639 O THR A 129 -0.207 -17.766 -0.992 1.00 0.00 O ATOM 640 CB THR A 129 -2.755 -16.338 -2.334 1.00 0.00 C ATOM 641 OG1 THR A 129 -2.665 -17.677 -2.788 1.00 0.00 O ATOM 642 CG2 THR A 129 -3.299 -15.503 -3.473 1.00 0.00 C ATOM 0 H THR A 129 -0.860 -15.836 -3.844 1.00 0.00 H new ATOM 0 HA THR A 129 -1.512 -14.853 -1.389 1.00 0.00 H new ATOM 0 HB THR A 129 -3.435 -16.252 -1.486 1.00 0.00 H new ATOM 0 HG1 THR A 129 -3.541 -17.972 -3.114 1.00 0.00 H new ATOM 0 HG21 THR A 129 -4.261 -15.905 -3.791 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.428 -14.473 -3.140 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.600 -15.529 -4.309 1.00 0.00 H new ATOM 650 N GLU A 130 -1.264 -16.479 0.523 1.00 0.00 N ATOM 651 CA GLU A 130 -0.857 -17.290 1.666 1.00 0.00 C ATOM 652 C GLU A 130 0.662 -17.422 1.730 1.00 0.00 C ATOM 653 O GLU A 130 1.194 -18.505 1.970 1.00 0.00 O ATOM 654 CB GLU A 130 -1.501 -18.676 1.588 1.00 0.00 C ATOM 655 CG GLU A 130 -2.879 -18.742 2.226 1.00 0.00 C ATOM 656 CD GLU A 130 -2.819 -19.001 3.718 1.00 0.00 C ATOM 657 OE1 GLU A 130 -2.033 -18.317 4.408 1.00 0.00 O ATOM 658 OE2 GLU A 130 -3.557 -19.887 4.198 1.00 0.00 O ATOM 0 H GLU A 130 -1.840 -15.672 0.764 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.196 -16.790 2.573 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.579 -18.973 0.542 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.848 -19.399 2.077 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -3.404 -17.804 2.045 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -3.460 -19.531 1.747 1.00 0.00 H new ATOM 665 N ASP A 131 1.352 -16.308 1.513 1.00 0.00 N ATOM 666 CA ASP A 131 2.810 -16.291 1.545 1.00 0.00 C ATOM 667 C ASP A 131 3.335 -14.868 1.388 1.00 0.00 C ATOM 668 O ASP A 131 4.289 -14.470 2.056 1.00 0.00 O ATOM 669 CB ASP A 131 3.377 -17.183 0.440 1.00 0.00 C ATOM 670 CG ASP A 131 4.633 -17.913 0.874 1.00 0.00 C ATOM 671 OD1 ASP A 131 5.614 -17.236 1.249 1.00 0.00 O ATOM 672 OD2 ASP A 131 4.637 -19.161 0.838 1.00 0.00 O ATOM 0 H ASP A 131 0.925 -15.404 1.313 1.00 0.00 H new ATOM 0 HA ASP A 131 3.135 -16.677 2.511 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.622 -17.910 0.141 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.598 -16.574 -0.437 1.00 0.00 H new ATOM 677 N ASP A 132 2.702 -14.107 0.502 1.00 0.00 N ATOM 678 CA ASP A 132 3.100 -12.727 0.258 1.00 0.00 C ATOM 679 C ASP A 132 2.660 -11.826 1.407 1.00 0.00 C ATOM 680 O ASP A 132 3.373 -10.900 1.792 1.00 0.00 O ATOM 681 CB ASP A 132 2.500 -12.228 -1.059 1.00 0.00 C ATOM 682 CG ASP A 132 3.560 -11.772 -2.043 1.00 0.00 C ATOM 683 OD1 ASP A 132 4.442 -12.588 -2.384 1.00 0.00 O ATOM 684 OD2 ASP A 132 3.509 -10.600 -2.471 1.00 0.00 O ATOM 0 H ASP A 132 1.911 -14.423 -0.059 1.00 0.00 H new ATOM 0 HA ASP A 132 4.187 -12.692 0.189 1.00 0.00 H new ATOM 0 HB2 ASP A 132 1.908 -13.025 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 132 1.819 -11.402 -0.855 1.00 0.00 H new ATOM 689 N ILE A 133 1.480 -12.105 1.950 1.00 0.00 N ATOM 690 CA ILE A 133 0.941 -11.321 3.055 1.00 0.00 C ATOM 691 C ILE A 133 1.781 -11.503 4.318 1.00 0.00 C ATOM 692 O ILE A 133 1.900 -10.587 5.132 1.00 0.00 O ATOM 693 CB ILE A 133 -0.529 -11.706 3.346 1.00 0.00 C ATOM 694 CG1 ILE A 133 -1.449 -11.146 2.256 1.00 0.00 C ATOM 695 CG2 ILE A 133 -0.964 -11.202 4.718 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.140 -12.215 1.439 1.00 0.00 C ATOM 0 H ILE A 133 0.878 -12.869 1.643 1.00 0.00 H new ATOM 0 HA ILE A 133 0.976 -10.273 2.758 1.00 0.00 H new ATOM 0 HB ILE A 133 -0.603 -12.793 3.346 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -2.203 -10.511 2.720 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -0.865 -10.512 1.589 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.001 -11.486 4.898 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -0.329 -11.643 5.486 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -0.874 -10.116 4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.774 -11.745 0.687 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -1.392 -12.836 0.946 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.752 -12.835 2.094 1.00 0.00 H new ATOM 708 N GLU A 134 2.355 -12.689 4.478 1.00 0.00 N ATOM 709 CA GLU A 134 3.177 -12.988 5.646 1.00 0.00 C ATOM 710 C GLU A 134 4.507 -12.242 5.590 1.00 0.00 C ATOM 711 O GLU A 134 4.988 -11.735 6.603 1.00 0.00 O ATOM 712 CB GLU A 134 3.429 -14.493 5.744 1.00 0.00 C ATOM 713 CG GLU A 134 3.417 -15.020 7.170 1.00 0.00 C ATOM 714 CD GLU A 134 2.673 -16.335 7.300 1.00 0.00 C ATOM 715 OE1 GLU A 134 1.504 -16.400 6.865 1.00 0.00 O ATOM 716 OE2 GLU A 134 3.259 -17.298 7.837 1.00 0.00 O ATOM 0 H GLU A 134 2.267 -13.459 3.815 1.00 0.00 H new ATOM 0 HA GLU A 134 2.635 -12.655 6.531 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.670 -15.019 5.165 1.00 0.00 H new ATOM 0 HB3 GLU A 134 4.393 -14.722 5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 134 4.443 -15.152 7.513 1.00 0.00 H new ATOM 0 HG3 GLU A 134 2.955 -14.280 7.823 1.00 0.00 H new ATOM 723 N GLU A 135 5.101 -12.184 4.402 1.00 0.00 N ATOM 724 CA GLU A 135 6.380 -11.506 4.220 1.00 0.00 C ATOM 725 C GLU A 135 6.188 -10.014 3.961 1.00 0.00 C ATOM 726 O GLU A 135 7.003 -9.193 4.380 1.00 0.00 O ATOM 727 CB GLU A 135 7.155 -12.141 3.062 1.00 0.00 C ATOM 728 CG GLU A 135 8.630 -12.351 3.361 1.00 0.00 C ATOM 729 CD GLU A 135 9.457 -12.545 2.105 1.00 0.00 C ATOM 730 OE1 GLU A 135 9.371 -11.690 1.199 1.00 0.00 O ATOM 731 OE2 GLU A 135 10.191 -13.553 2.027 1.00 0.00 O ATOM 0 H GLU A 135 4.718 -12.598 3.552 1.00 0.00 H new ATOM 0 HA GLU A 135 6.951 -11.619 5.142 1.00 0.00 H new ATOM 0 HB2 GLU A 135 6.702 -13.102 2.816 1.00 0.00 H new ATOM 0 HB3 GLU A 135 7.058 -11.508 2.180 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.011 -11.492 3.913 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.746 -13.222 4.006 1.00 0.00 H new ATOM 738 N LEU A 136 5.111 -9.670 3.263 1.00 0.00 N ATOM 739 CA LEU A 136 4.822 -8.275 2.945 1.00 0.00 C ATOM 740 C LEU A 136 4.464 -7.486 4.201 1.00 0.00 C ATOM 741 O LEU A 136 5.003 -6.406 4.442 1.00 0.00 O ATOM 742 CB LEU A 136 3.682 -8.187 1.926 1.00 0.00 C ATOM 743 CG LEU A 136 3.209 -6.768 1.598 1.00 0.00 C ATOM 744 CD1 LEU A 136 4.398 -5.840 1.406 1.00 0.00 C ATOM 745 CD2 LEU A 136 2.330 -6.774 0.356 1.00 0.00 C ATOM 0 H LEU A 136 4.425 -10.336 2.907 1.00 0.00 H new ATOM 0 HA LEU A 136 5.721 -7.836 2.512 1.00 0.00 H new ATOM 0 HB2 LEU A 136 4.004 -8.668 1.002 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.833 -8.757 2.304 1.00 0.00 H new ATOM 0 HG LEU A 136 2.618 -6.399 2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.042 -4.836 1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.990 -5.813 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 136 5.016 -6.205 0.585 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.003 -5.758 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.898 -7.162 -0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.459 -7.406 0.530 1.00 0.00 H new ATOM 757 N MET A 137 3.549 -8.032 4.997 1.00 0.00 N ATOM 758 CA MET A 137 3.110 -7.383 6.233 1.00 0.00 C ATOM 759 C MET A 137 4.297 -6.856 7.036 1.00 0.00 C ATOM 760 O MET A 137 4.192 -5.839 7.722 1.00 0.00 O ATOM 761 CB MET A 137 2.304 -8.363 7.087 1.00 0.00 C ATOM 762 CG MET A 137 1.623 -7.714 8.281 1.00 0.00 C ATOM 763 SD MET A 137 0.533 -6.359 7.806 1.00 0.00 S ATOM 764 CE MET A 137 0.925 -5.150 9.067 1.00 0.00 C ATOM 0 H MET A 137 3.094 -8.926 4.809 1.00 0.00 H new ATOM 0 HA MET A 137 2.480 -6.537 5.959 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.548 -8.839 6.463 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.967 -9.152 7.442 1.00 0.00 H new ATOM 0 HG2 MET A 137 1.047 -8.467 8.819 1.00 0.00 H new ATOM 0 HG3 MET A 137 2.382 -7.341 8.969 1.00 0.00 H new ATOM 0 HE1 MET A 137 0.606 -4.162 8.735 1.00 0.00 H new ATOM 0 HE2 MET A 137 0.407 -5.407 9.991 1.00 0.00 H new ATOM 0 HE3 MET A 137 2.001 -5.144 9.243 1.00 0.00 H new ATOM 774 N LYS A 138 5.425 -7.553 6.947 1.00 0.00 N ATOM 775 CA LYS A 138 6.630 -7.152 7.666 1.00 0.00 C ATOM 776 C LYS A 138 7.067 -5.749 7.255 1.00 0.00 C ATOM 777 O LYS A 138 7.651 -5.013 8.050 1.00 0.00 O ATOM 778 CB LYS A 138 7.761 -8.150 7.407 1.00 0.00 C ATOM 779 CG LYS A 138 7.904 -9.201 8.497 1.00 0.00 C ATOM 780 CD LYS A 138 7.481 -10.577 8.008 1.00 0.00 C ATOM 781 CE LYS A 138 8.245 -11.680 8.723 1.00 0.00 C ATOM 782 NZ LYS A 138 7.797 -11.841 10.134 1.00 0.00 N ATOM 0 H LYS A 138 5.530 -8.398 6.385 1.00 0.00 H new ATOM 0 HA LYS A 138 6.401 -7.144 8.732 1.00 0.00 H new ATOM 0 HB2 LYS A 138 7.584 -8.648 6.454 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.701 -7.606 7.313 1.00 0.00 H new ATOM 0 HG2 LYS A 138 8.940 -9.237 8.835 1.00 0.00 H new ATOM 0 HG3 LYS A 138 7.298 -8.918 9.358 1.00 0.00 H new ATOM 0 HD2 LYS A 138 6.411 -10.709 8.170 1.00 0.00 H new ATOM 0 HD3 LYS A 138 7.652 -10.651 6.934 1.00 0.00 H new ATOM 0 HE2 LYS A 138 8.109 -12.621 8.189 1.00 0.00 H new ATOM 0 HE3 LYS A 138 9.311 -11.454 8.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 8.342 -12.602 10.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 7.950 -10.951 10.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 6.785 -12.082 10.152 1.00 0.00 H new ATOM 796 N ASP A 139 6.779 -5.386 6.009 1.00 0.00 N ATOM 797 CA ASP A 139 7.141 -4.071 5.493 1.00 0.00 C ATOM 798 C ASP A 139 6.323 -2.977 6.170 1.00 0.00 C ATOM 799 O ASP A 139 6.872 -1.991 6.662 1.00 0.00 O ATOM 800 CB ASP A 139 6.931 -4.019 3.979 1.00 0.00 C ATOM 801 CG ASP A 139 8.022 -3.240 3.270 1.00 0.00 C ATOM 802 OD1 ASP A 139 8.486 -2.225 3.831 1.00 0.00 O ATOM 803 OD2 ASP A 139 8.412 -3.645 2.155 1.00 0.00 O ATOM 0 H ASP A 139 6.296 -5.984 5.338 1.00 0.00 H new ATOM 0 HA ASP A 139 8.195 -3.899 5.712 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.899 -5.035 3.584 1.00 0.00 H new ATOM 0 HB3 ASP A 139 5.965 -3.563 3.765 1.00 0.00 H new ATOM 808 N GLY A 140 5.005 -3.157 6.194 1.00 0.00 N ATOM 809 CA GLY A 140 4.133 -2.177 6.815 1.00 0.00 C ATOM 810 C GLY A 140 4.482 -1.933 8.270 1.00 0.00 C ATOM 811 O GLY A 140 4.838 -0.818 8.652 1.00 0.00 O ATOM 0 H GLY A 140 4.526 -3.964 5.794 1.00 0.00 H new ATOM 0 HA2 GLY A 140 4.198 -1.237 6.266 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.100 -2.517 6.744 1.00 0.00 H new ATOM 815 N ASP A 141 4.382 -2.980 9.082 1.00 0.00 N ATOM 816 CA ASP A 141 4.691 -2.877 10.503 1.00 0.00 C ATOM 817 C ASP A 141 6.140 -3.271 10.773 1.00 0.00 C ATOM 818 O ASP A 141 6.416 -4.363 11.268 1.00 0.00 O ATOM 819 CB ASP A 141 3.746 -3.764 11.316 1.00 0.00 C ATOM 820 CG ASP A 141 3.997 -3.664 12.808 1.00 0.00 C ATOM 821 OD1 ASP A 141 4.633 -2.679 13.238 1.00 0.00 O ATOM 822 OD2 ASP A 141 3.556 -4.570 13.546 1.00 0.00 O ATOM 0 H ASP A 141 4.089 -3.909 8.780 1.00 0.00 H new ATOM 0 HA ASP A 141 4.554 -1.839 10.807 1.00 0.00 H new ATOM 0 HB2 ASP A 141 2.715 -3.481 11.104 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.863 -4.800 11.000 1.00 0.00 H new ATOM 827 N LYS A 142 7.063 -2.372 10.444 1.00 0.00 N ATOM 828 CA LYS A 142 8.484 -2.624 10.651 1.00 0.00 C ATOM 829 C LYS A 142 8.970 -1.972 11.942 1.00 0.00 C ATOM 830 O LYS A 142 10.134 -1.586 12.054 1.00 0.00 O ATOM 831 CB LYS A 142 9.295 -2.101 9.464 1.00 0.00 C ATOM 832 CG LYS A 142 10.664 -2.748 9.330 1.00 0.00 C ATOM 833 CD LYS A 142 11.398 -2.249 8.096 1.00 0.00 C ATOM 834 CE LYS A 142 12.904 -2.392 8.249 1.00 0.00 C ATOM 835 NZ LYS A 142 13.643 -1.398 7.422 1.00 0.00 N ATOM 0 H LYS A 142 6.852 -1.463 10.033 1.00 0.00 H new ATOM 0 HA LYS A 142 8.628 -3.701 10.733 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.731 -2.270 8.547 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.420 -1.023 9.567 1.00 0.00 H new ATOM 0 HG2 LYS A 142 11.257 -2.534 10.219 1.00 0.00 H new ATOM 0 HG3 LYS A 142 10.552 -3.831 9.275 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.065 -2.809 7.222 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.147 -1.203 7.920 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.176 -2.266 9.297 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.204 -3.399 7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 14.666 -1.529 7.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 13.403 -1.534 6.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 13.376 -0.436 7.714 1.00 0.00 H new ATOM 849 N ASN A 143 8.071 -1.852 12.913 1.00 0.00 N ATOM 850 CA ASN A 143 8.406 -1.246 14.197 1.00 0.00 C ATOM 851 C ASN A 143 8.344 -2.273 15.328 1.00 0.00 C ATOM 852 O ASN A 143 8.821 -2.018 16.434 1.00 0.00 O ATOM 853 CB ASN A 143 7.458 -0.084 14.498 1.00 0.00 C ATOM 854 CG ASN A 143 7.461 0.962 13.401 1.00 0.00 C ATOM 855 OD1 ASN A 143 8.469 1.166 12.724 1.00 0.00 O ATOM 856 ND2 ASN A 143 6.330 1.634 13.220 1.00 0.00 N ATOM 0 H ASN A 143 7.104 -2.167 12.835 1.00 0.00 H new ATOM 0 HA ASN A 143 9.427 -0.870 14.132 1.00 0.00 H new ATOM 0 HB2 ASN A 143 6.446 -0.468 14.627 1.00 0.00 H new ATOM 0 HB3 ASN A 143 7.745 0.381 15.441 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.273 2.351 12.497 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.518 1.433 13.804 1.00 0.00 H new ATOM 863 N ASN A 144 7.754 -3.434 15.047 1.00 0.00 N ATOM 864 CA ASN A 144 7.633 -4.492 16.045 1.00 0.00 C ATOM 865 C ASN A 144 6.703 -4.067 17.178 1.00 0.00 C ATOM 866 O ASN A 144 7.075 -4.106 18.351 1.00 0.00 O ATOM 867 CB ASN A 144 9.010 -4.859 16.605 1.00 0.00 C ATOM 868 CG ASN A 144 9.083 -6.304 17.059 1.00 0.00 C ATOM 869 OD1 ASN A 144 8.140 -7.073 16.877 1.00 0.00 O ATOM 870 ND2 ASN A 144 10.209 -6.680 17.655 1.00 0.00 N ATOM 0 H ASN A 144 7.353 -3.664 14.138 1.00 0.00 H new ATOM 0 HA ASN A 144 7.205 -5.368 15.558 1.00 0.00 H new ATOM 0 HB2 ASN A 144 9.768 -4.682 15.842 1.00 0.00 H new ATOM 0 HB3 ASN A 144 9.244 -4.205 17.445 1.00 0.00 H new ATOM 0 HD21 ASN A 144 10.317 -7.640 17.982 1.00 0.00 H new ATOM 0 HD22 ASN A 144 10.966 -6.009 17.785 1.00 0.00 H new ATOM 877 N ASP A 145 5.489 -3.662 16.817 1.00 0.00 N ATOM 878 CA ASP A 145 4.503 -3.230 17.800 1.00 0.00 C ATOM 879 C ASP A 145 3.300 -4.168 17.813 1.00 0.00 C ATOM 880 O ASP A 145 2.781 -4.512 18.875 1.00 0.00 O ATOM 881 CB ASP A 145 4.047 -1.800 17.502 1.00 0.00 C ATOM 882 CG ASP A 145 3.486 -1.653 16.102 1.00 0.00 C ATOM 883 OD1 ASP A 145 2.324 -2.056 15.882 1.00 0.00 O ATOM 884 OD2 ASP A 145 4.208 -1.134 15.224 1.00 0.00 O ATOM 0 H ASP A 145 5.165 -3.624 15.851 1.00 0.00 H new ATOM 0 HA ASP A 145 4.972 -3.257 18.784 1.00 0.00 H new ATOM 0 HB2 ASP A 145 3.289 -1.505 18.227 1.00 0.00 H new ATOM 0 HB3 ASP A 145 4.889 -1.119 17.626 1.00 0.00 H new ATOM 889 N GLY A 146 2.862 -4.577 16.627 1.00 0.00 N ATOM 890 CA GLY A 146 1.724 -5.472 16.526 1.00 0.00 C ATOM 891 C GLY A 146 0.974 -5.314 15.218 1.00 0.00 C ATOM 892 O GLY A 146 0.350 -6.259 14.735 1.00 0.00 O ATOM 0 H GLY A 146 3.274 -4.305 15.735 1.00 0.00 H new ATOM 0 HA2 GLY A 146 2.067 -6.502 16.622 1.00 0.00 H new ATOM 0 HA3 GLY A 146 1.043 -5.284 17.356 1.00 0.00 H new ATOM 896 N ARG A 147 1.035 -4.117 14.642 1.00 0.00 N ATOM 897 CA ARG A 147 0.355 -3.840 13.382 1.00 0.00 C ATOM 898 C ARG A 147 0.915 -2.580 12.728 1.00 0.00 C ATOM 899 O ARG A 147 1.877 -1.990 13.219 1.00 0.00 O ATOM 900 CB ARG A 147 -1.149 -3.683 13.614 1.00 0.00 C ATOM 901 CG ARG A 147 -1.500 -2.595 14.617 1.00 0.00 C ATOM 902 CD ARG A 147 -1.926 -3.181 15.954 1.00 0.00 C ATOM 903 NE ARG A 147 -0.872 -3.075 16.960 1.00 0.00 N ATOM 904 CZ ARG A 147 -0.850 -3.781 18.088 1.00 0.00 C ATOM 905 NH1 ARG A 147 -1.820 -4.646 18.357 1.00 0.00 N ATOM 906 NH2 ARG A 147 0.146 -3.623 18.949 1.00 0.00 N ATOM 0 H ARG A 147 1.548 -3.324 15.028 1.00 0.00 H new ATOM 0 HA ARG A 147 0.526 -4.683 12.712 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -1.633 -3.459 12.664 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -1.555 -4.632 13.963 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -0.639 -1.943 14.763 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.304 -1.977 14.217 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.818 -2.665 16.308 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.196 -4.229 15.821 1.00 0.00 H new ATOM 0 HE ARG A 147 -0.108 -2.421 16.788 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -2.588 -4.773 17.698 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -1.798 -5.184 19.223 1.00 0.00 H new ATOM 0 HH21 ARG A 147 0.895 -2.961 18.747 1.00 0.00 H new ATOM 0 HH22 ARG A 147 0.163 -4.164 19.814 1.00 0.00 H new ATOM 920 N ILE A 148 0.305 -2.173 11.620 1.00 0.00 N ATOM 921 CA ILE A 148 0.744 -0.983 10.901 1.00 0.00 C ATOM 922 C ILE A 148 -0.341 0.090 10.919 1.00 0.00 C ATOM 923 O ILE A 148 -1.495 -0.181 10.593 1.00 0.00 O ATOM 924 CB ILE A 148 1.130 -1.325 9.444 1.00 0.00 C ATOM 925 CG1 ILE A 148 2.064 -0.259 8.874 1.00 0.00 C ATOM 926 CG2 ILE A 148 -0.099 -1.484 8.564 1.00 0.00 C ATOM 927 CD1 ILE A 148 1.404 1.089 8.691 1.00 0.00 C ATOM 0 H ILE A 148 -0.494 -2.649 11.201 1.00 0.00 H new ATOM 0 HA ILE A 148 1.627 -0.596 11.408 1.00 0.00 H new ATOM 0 HB ILE A 148 1.654 -2.281 9.455 1.00 0.00 H new ATOM 0 HG12 ILE A 148 2.922 -0.147 9.537 1.00 0.00 H new ATOM 0 HG13 ILE A 148 2.447 -0.600 7.912 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.210 -1.724 7.547 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -0.723 -2.289 8.953 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -0.667 -0.554 8.560 1.00 0.00 H new ATOM 0 HD11 ILE A 148 2.127 1.796 8.283 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.563 0.992 8.004 1.00 0.00 H new ATOM 0 HD13 ILE A 148 1.045 1.452 9.654 1.00 0.00 H new ATOM 939 N ASP A 149 0.033 1.304 11.315 1.00 0.00 N ATOM 940 CA ASP A 149 -0.919 2.408 11.391 1.00 0.00 C ATOM 941 C ASP A 149 -0.569 3.523 10.409 1.00 0.00 C ATOM 942 O ASP A 149 0.467 3.485 9.748 1.00 0.00 O ATOM 943 CB ASP A 149 -0.964 2.967 12.814 1.00 0.00 C ATOM 944 CG ASP A 149 0.361 3.568 13.244 1.00 0.00 C ATOM 945 OD1 ASP A 149 0.758 4.603 12.668 1.00 0.00 O ATOM 946 OD2 ASP A 149 1.001 3.003 14.155 1.00 0.00 O ATOM 0 H ASP A 149 0.985 1.547 11.587 1.00 0.00 H new ATOM 0 HA ASP A 149 -1.900 2.017 11.121 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -1.742 3.728 12.878 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -1.239 2.171 13.505 1.00 0.00 H new ATOM 951 N TYR A 150 -1.451 4.516 10.325 1.00 0.00 N ATOM 952 CA TYR A 150 -1.257 5.654 9.429 1.00 0.00 C ATOM 953 C TYR A 150 0.115 6.294 9.636 1.00 0.00 C ATOM 954 O TYR A 150 0.273 7.206 10.448 1.00 0.00 O ATOM 955 CB TYR A 150 -2.358 6.694 9.656 1.00 0.00 C ATOM 956 CG TYR A 150 -2.437 7.761 8.582 1.00 0.00 C ATOM 957 CD1 TYR A 150 -2.127 7.476 7.256 1.00 0.00 C ATOM 958 CD2 TYR A 150 -2.827 9.056 8.899 1.00 0.00 C ATOM 959 CE1 TYR A 150 -2.203 8.453 6.281 1.00 0.00 C ATOM 960 CE2 TYR A 150 -2.905 10.037 7.929 1.00 0.00 C ATOM 961 CZ TYR A 150 -2.592 9.731 6.622 1.00 0.00 C ATOM 962 OH TYR A 150 -2.669 10.705 5.653 1.00 0.00 O ATOM 0 H TYR A 150 -2.312 4.556 10.870 1.00 0.00 H new ATOM 0 HA TYR A 150 -1.310 5.289 8.403 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.319 6.182 9.715 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.194 7.176 10.620 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -1.822 6.476 6.984 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -3.074 9.300 9.922 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -1.959 8.216 5.256 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -3.210 11.039 8.194 1.00 0.00 H new ATOM 0 HH TYR A 150 -2.197 10.404 4.849 1.00 0.00 H new ATOM 972 N ASP A 151 1.102 5.804 8.893 1.00 0.00 N ATOM 973 CA ASP A 151 2.467 6.313 8.978 1.00 0.00 C ATOM 974 C ASP A 151 3.386 5.501 8.076 1.00 0.00 C ATOM 975 O ASP A 151 3.896 6.006 7.076 1.00 0.00 O ATOM 976 CB ASP A 151 2.973 6.267 10.423 1.00 0.00 C ATOM 977 CG ASP A 151 3.704 7.534 10.820 1.00 0.00 C ATOM 978 OD1 ASP A 151 4.283 8.190 9.929 1.00 0.00 O ATOM 979 OD2 ASP A 151 3.698 7.870 12.023 1.00 0.00 O ATOM 0 H ASP A 151 0.980 5.048 8.219 1.00 0.00 H new ATOM 0 HA ASP A 151 2.469 7.351 8.645 1.00 0.00 H new ATOM 0 HB2 ASP A 151 2.129 6.112 11.096 1.00 0.00 H new ATOM 0 HB3 ASP A 151 3.639 5.413 10.545 1.00 0.00 H new ATOM 984 N GLU A 152 3.576 4.233 8.423 1.00 0.00 N ATOM 985 CA GLU A 152 4.416 3.348 7.627 1.00 0.00 C ATOM 986 C GLU A 152 3.727 3.031 6.303 1.00 0.00 C ATOM 987 O GLU A 152 4.381 2.718 5.307 1.00 0.00 O ATOM 988 CB GLU A 152 4.714 2.057 8.391 1.00 0.00 C ATOM 989 CG GLU A 152 5.156 2.287 9.828 1.00 0.00 C ATOM 990 CD GLU A 152 4.506 1.322 10.799 1.00 0.00 C ATOM 991 OE1 GLU A 152 3.364 1.588 11.228 1.00 0.00 O ATOM 992 OE2 GLU A 152 5.141 0.299 11.133 1.00 0.00 O ATOM 0 H GLU A 152 3.161 3.797 9.247 1.00 0.00 H new ATOM 0 HA GLU A 152 5.361 3.852 7.425 1.00 0.00 H new ATOM 0 HB2 GLU A 152 3.822 1.430 8.390 1.00 0.00 H new ATOM 0 HB3 GLU A 152 5.492 1.505 7.864 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.239 2.186 9.892 1.00 0.00 H new ATOM 0 HG3 GLU A 152 4.913 3.309 10.120 1.00 0.00 H new ATOM 999 N PHE A 153 2.399 3.128 6.302 1.00 0.00 N ATOM 1000 CA PHE A 153 1.606 2.869 5.108 1.00 0.00 C ATOM 1001 C PHE A 153 2.017 3.819 3.986 1.00 0.00 C ATOM 1002 O PHE A 153 1.949 3.476 2.808 1.00 0.00 O ATOM 1003 CB PHE A 153 0.113 3.025 5.437 1.00 0.00 C ATOM 1004 CG PHE A 153 -0.757 3.340 4.251 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.607 2.650 3.061 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -1.726 4.326 4.332 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -1.406 2.938 1.972 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -2.529 4.619 3.247 1.00 0.00 C ATOM 1009 CZ PHE A 153 -2.369 3.923 2.065 1.00 0.00 C ATOM 0 H PHE A 153 1.849 3.386 7.122 1.00 0.00 H new ATOM 0 HA PHE A 153 1.785 1.848 4.770 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.243 2.104 5.898 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.002 3.817 6.177 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.144 1.877 2.983 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.855 4.872 5.255 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -1.278 2.393 1.048 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.281 5.391 3.323 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.996 4.149 1.215 1.00 0.00 H new ATOM 1019 N LEU A 154 2.453 5.013 4.365 1.00 0.00 N ATOM 1020 CA LEU A 154 2.885 6.008 3.395 1.00 0.00 C ATOM 1021 C LEU A 154 4.153 5.546 2.683 1.00 0.00 C ATOM 1022 O LEU A 154 4.438 5.971 1.563 1.00 0.00 O ATOM 1023 CB LEU A 154 3.112 7.352 4.090 1.00 0.00 C ATOM 1024 CG LEU A 154 2.002 7.778 5.058 1.00 0.00 C ATOM 1025 CD1 LEU A 154 2.107 9.262 5.371 1.00 0.00 C ATOM 1026 CD2 LEU A 154 0.627 7.452 4.487 1.00 0.00 C ATOM 0 H LEU A 154 2.517 5.315 5.337 1.00 0.00 H new ATOM 0 HA LEU A 154 2.103 6.132 2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.053 7.306 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.224 8.123 3.328 1.00 0.00 H new ATOM 0 HG LEU A 154 2.128 7.217 5.984 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.311 9.546 6.059 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.074 9.470 5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.011 9.836 4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -0.143 7.764 5.192 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.490 7.980 3.543 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.549 6.378 4.316 1.00 0.00 H new ATOM 1038 N GLU A 155 4.902 4.658 3.333 1.00 0.00 N ATOM 1039 CA GLU A 155 6.127 4.121 2.754 1.00 0.00 C ATOM 1040 C GLU A 155 5.807 3.044 1.716 1.00 0.00 C ATOM 1041 O GLU A 155 6.685 2.597 0.979 1.00 0.00 O ATOM 1042 CB GLU A 155 7.024 3.542 3.849 1.00 0.00 C ATOM 1043 CG GLU A 155 7.613 4.595 4.773 1.00 0.00 C ATOM 1044 CD GLU A 155 8.609 4.016 5.759 1.00 0.00 C ATOM 1045 OE1 GLU A 155 9.780 3.819 5.374 1.00 0.00 O ATOM 1046 OE2 GLU A 155 8.217 3.759 6.917 1.00 0.00 O ATOM 0 H GLU A 155 4.680 4.296 4.261 1.00 0.00 H new ATOM 0 HA GLU A 155 6.655 4.936 2.258 1.00 0.00 H new ATOM 0 HB2 GLU A 155 6.447 2.832 4.442 1.00 0.00 H new ATOM 0 HB3 GLU A 155 7.836 2.983 3.384 1.00 0.00 H new ATOM 0 HG2 GLU A 155 8.104 5.363 4.176 1.00 0.00 H new ATOM 0 HG3 GLU A 155 6.807 5.084 5.321 1.00 0.00 H new ATOM 1053 N PHE A 156 4.540 2.636 1.664 1.00 0.00 N ATOM 1054 CA PHE A 156 4.094 1.620 0.718 1.00 0.00 C ATOM 1055 C PHE A 156 4.085 2.180 -0.700 1.00 0.00 C ATOM 1056 O PHE A 156 4.725 1.638 -1.601 1.00 0.00 O ATOM 1057 CB PHE A 156 2.690 1.140 1.097 1.00 0.00 C ATOM 1058 CG PHE A 156 2.551 -0.352 1.177 1.00 0.00 C ATOM 1059 CD1 PHE A 156 2.859 -1.027 2.347 1.00 0.00 C ATOM 1060 CD2 PHE A 156 2.101 -1.078 0.087 1.00 0.00 C ATOM 1061 CE1 PHE A 156 2.722 -2.400 2.428 1.00 0.00 C ATOM 1062 CE2 PHE A 156 1.963 -2.451 0.161 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.274 -3.112 1.333 1.00 0.00 C ATOM 0 H PHE A 156 3.803 2.997 2.270 1.00 0.00 H new ATOM 0 HA PHE A 156 4.786 0.778 0.756 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.419 1.571 2.061 1.00 0.00 H new ATOM 0 HB3 PHE A 156 1.978 1.521 0.365 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.210 -0.474 3.206 1.00 0.00 H new ATOM 0 HD2 PHE A 156 1.855 -0.565 -0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 156 2.965 -2.915 3.346 1.00 0.00 H new ATOM 0 HE2 PHE A 156 1.612 -3.006 -0.696 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.167 -4.185 1.393 1.00 0.00 H new ATOM 1073 N MET A 157 3.350 3.271 -0.884 1.00 0.00 N ATOM 1074 CA MET A 157 3.242 3.920 -2.185 1.00 0.00 C ATOM 1075 C MET A 157 4.616 4.315 -2.725 1.00 0.00 C ATOM 1076 O MET A 157 4.810 4.413 -3.937 1.00 0.00 O ATOM 1077 CB MET A 157 2.341 5.156 -2.083 1.00 0.00 C ATOM 1078 CG MET A 157 3.004 6.349 -1.408 1.00 0.00 C ATOM 1079 SD MET A 157 3.253 7.738 -2.530 1.00 0.00 S ATOM 1080 CE MET A 157 1.561 8.251 -2.813 1.00 0.00 C ATOM 0 H MET A 157 2.817 3.727 -0.143 1.00 0.00 H new ATOM 0 HA MET A 157 2.799 3.208 -2.881 1.00 0.00 H new ATOM 0 HB2 MET A 157 2.025 5.447 -3.085 1.00 0.00 H new ATOM 0 HB3 MET A 157 1.440 4.892 -1.529 1.00 0.00 H new ATOM 0 HG2 MET A 157 2.390 6.672 -0.568 1.00 0.00 H new ATOM 0 HG3 MET A 157 3.966 6.041 -1.000 1.00 0.00 H new ATOM 0 HE1 MET A 157 1.326 8.160 -3.873 1.00 0.00 H new ATOM 0 HE2 MET A 157 0.887 7.617 -2.237 1.00 0.00 H new ATOM 0 HE3 MET A 157 1.438 9.288 -2.502 1.00 0.00 H new ATOM 1090 N LYS A 158 5.566 4.543 -1.821 1.00 0.00 N ATOM 1091 CA LYS A 158 6.920 4.931 -2.212 1.00 0.00 C ATOM 1092 C LYS A 158 7.459 4.014 -3.306 1.00 0.00 C ATOM 1093 O LYS A 158 8.141 4.464 -4.227 1.00 0.00 O ATOM 1094 CB LYS A 158 7.853 4.906 -1.000 1.00 0.00 C ATOM 1095 CG LYS A 158 8.050 6.270 -0.358 1.00 0.00 C ATOM 1096 CD LYS A 158 9.507 6.513 0.010 1.00 0.00 C ATOM 1097 CE LYS A 158 10.112 7.639 -0.813 1.00 0.00 C ATOM 1098 NZ LYS A 158 11.498 7.321 -1.257 1.00 0.00 N ATOM 0 H LYS A 158 5.424 4.466 -0.814 1.00 0.00 H new ATOM 0 HA LYS A 158 6.878 5.946 -2.606 1.00 0.00 H new ATOM 0 HB2 LYS A 158 7.451 4.218 -0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 158 8.823 4.514 -1.306 1.00 0.00 H new ATOM 0 HG2 LYS A 158 7.713 7.047 -1.044 1.00 0.00 H new ATOM 0 HG3 LYS A 158 7.431 6.344 0.536 1.00 0.00 H new ATOM 0 HD2 LYS A 158 9.579 6.757 1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 158 10.080 5.599 -0.147 1.00 0.00 H new ATOM 0 HE2 LYS A 158 9.486 7.828 -1.685 1.00 0.00 H new ATOM 0 HE3 LYS A 158 10.121 8.555 -0.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 11.874 8.114 -1.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 12.102 7.166 -0.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 11.487 6.461 -1.842 1.00 0.00 H new ATOM 1112 N GLY A 159 7.142 2.727 -3.203 1.00 0.00 N ATOM 1113 CA GLY A 159 7.598 1.773 -4.196 1.00 0.00 C ATOM 1114 C GLY A 159 7.090 2.106 -5.584 1.00 0.00 C ATOM 1115 O GLY A 159 7.748 1.814 -6.582 1.00 0.00 O ATOM 0 H GLY A 159 6.579 2.329 -2.451 1.00 0.00 H new ATOM 0 HA2 GLY A 159 8.688 1.753 -4.205 1.00 0.00 H new ATOM 0 HA3 GLY A 159 7.263 0.774 -3.918 1.00 0.00 H new ATOM 1119 N VAL A 160 5.915 2.725 -5.644 1.00 0.00 N ATOM 1120 CA VAL A 160 5.315 3.107 -6.913 1.00 0.00 C ATOM 1121 C VAL A 160 6.220 4.065 -7.682 1.00 0.00 C ATOM 1122 O VAL A 160 6.183 4.117 -8.911 1.00 0.00 O ATOM 1123 CB VAL A 160 3.941 3.770 -6.698 1.00 0.00 C ATOM 1124 CG1 VAL A 160 3.288 4.099 -8.031 1.00 0.00 C ATOM 1125 CG2 VAL A 160 3.039 2.875 -5.858 1.00 0.00 C ATOM 0 H VAL A 160 5.360 2.972 -4.825 1.00 0.00 H new ATOM 0 HA VAL A 160 5.185 2.195 -7.495 1.00 0.00 H new ATOM 0 HB VAL A 160 4.092 4.704 -6.156 1.00 0.00 H new ATOM 0 HG11 VAL A 160 2.319 4.566 -7.856 1.00 0.00 H new ATOM 0 HG12 VAL A 160 3.926 4.784 -8.589 1.00 0.00 H new ATOM 0 HG13 VAL A 160 3.150 3.183 -8.605 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.073 3.361 -5.717 1.00 0.00 H new ATOM 0 HG22 VAL A 160 2.895 1.922 -6.368 1.00 0.00 H new ATOM 0 HG23 VAL A 160 3.502 2.700 -4.887 1.00 0.00 H new ATOM 1135 N GLU A 161 7.030 4.824 -6.950 1.00 0.00 N ATOM 1136 CA GLU A 161 7.943 5.781 -7.564 1.00 0.00 C ATOM 1137 C GLU A 161 9.279 5.124 -7.894 1.00 0.00 C ATOM 1138 O GLU A 161 9.748 5.281 -9.041 1.00 0.00 O ATOM 1139 CB GLU A 161 8.164 6.975 -6.634 1.00 0.00 C ATOM 1140 CG GLU A 161 8.588 8.241 -7.359 1.00 0.00 C ATOM 1141 CD GLU A 161 9.573 9.070 -6.558 1.00 0.00 C ATOM 1142 OE1 GLU A 161 10.597 8.510 -6.114 1.00 0.00 O ATOM 1143 OE2 GLU A 161 9.320 10.279 -6.374 1.00 0.00 O ATOM 1144 OXT GLU A 161 9.847 4.459 -7.002 1.00 0.00 O ATOM 0 H GLU A 161 7.072 4.795 -5.931 1.00 0.00 H new ATOM 0 HA GLU A 161 7.492 6.131 -8.493 1.00 0.00 H new ATOM 0 HB2 GLU A 161 7.243 7.172 -6.085 1.00 0.00 H new ATOM 0 HB3 GLU A 161 8.925 6.716 -5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 161 9.037 7.974 -8.316 1.00 0.00 H new ATOM 0 HG3 GLU A 161 7.706 8.843 -7.578 1.00 0.00 H new ATOM 1226 N PHE B 132 3.800 -5.491 -7.069 1.00 0.00 N ATOM 1227 CA PHE B 132 3.095 -5.966 -8.250 1.00 0.00 C ATOM 1228 C PHE B 132 1.927 -5.029 -8.582 1.00 0.00 C ATOM 1229 O PHE B 132 2.148 -3.890 -8.991 1.00 0.00 O ATOM 1230 CB PHE B 132 2.627 -7.419 -8.062 1.00 0.00 C ATOM 1231 CG PHE B 132 2.197 -7.768 -6.658 1.00 0.00 C ATOM 1232 CD1 PHE B 132 3.122 -7.821 -5.626 1.00 0.00 C ATOM 1233 CD2 PHE B 132 0.870 -8.053 -6.373 1.00 0.00 C ATOM 1234 CE1 PHE B 132 2.732 -8.150 -4.342 1.00 0.00 C ATOM 1235 CE2 PHE B 132 0.475 -8.381 -5.090 1.00 0.00 C ATOM 1236 CZ PHE B 132 1.407 -8.429 -4.074 1.00 0.00 C ATOM 0 HA PHE B 132 3.781 -5.957 -9.097 1.00 0.00 H new ATOM 0 HB2 PHE B 132 1.795 -7.608 -8.740 1.00 0.00 H new ATOM 0 HB3 PHE B 132 3.436 -8.088 -8.356 1.00 0.00 H new ATOM 0 HD1 PHE B 132 4.160 -7.602 -5.829 1.00 0.00 H new ATOM 0 HD2 PHE B 132 0.136 -8.018 -7.164 1.00 0.00 H new ATOM 0 HE1 PHE B 132 3.464 -8.189 -3.548 1.00 0.00 H new ATOM 0 HE2 PHE B 132 -0.562 -8.600 -4.883 1.00 0.00 H new ATOM 0 HZ PHE B 132 1.100 -8.684 -3.070 1.00 0.00 H new ATOM 1246 N ASP B 133 0.691 -5.489 -8.393 1.00 0.00 N ATOM 1247 CA ASP B 133 -0.475 -4.657 -8.666 1.00 0.00 C ATOM 1248 C ASP B 133 -0.576 -3.529 -7.639 1.00 0.00 C ATOM 1249 O ASP B 133 -1.344 -2.583 -7.813 1.00 0.00 O ATOM 1250 CB ASP B 133 -1.750 -5.503 -8.643 1.00 0.00 C ATOM 1251 CG ASP B 133 -2.223 -5.874 -10.035 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -2.638 -4.963 -10.783 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -2.179 -7.074 -10.377 1.00 0.00 O ATOM 0 H ASP B 133 0.474 -6.426 -8.054 1.00 0.00 H new ATOM 0 HA ASP B 133 -0.362 -4.219 -9.658 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -1.569 -6.412 -8.069 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -2.538 -4.953 -8.129 1.00 0.00 H new ATOM 1258 N LEU B 134 0.209 -3.641 -6.569 1.00 0.00 N ATOM 1259 CA LEU B 134 0.219 -2.641 -5.510 1.00 0.00 C ATOM 1260 C LEU B 134 0.596 -1.270 -6.062 1.00 0.00 C ATOM 1261 O LEU B 134 0.024 -0.253 -5.672 1.00 0.00 O ATOM 1262 CB LEU B 134 1.208 -3.048 -4.415 1.00 0.00 C ATOM 1263 CG LEU B 134 0.745 -4.188 -3.504 1.00 0.00 C ATOM 1264 CD1 LEU B 134 0.272 -5.379 -4.325 1.00 0.00 C ATOM 1265 CD2 LEU B 134 1.865 -4.605 -2.565 1.00 0.00 C ATOM 0 H LEU B 134 0.849 -4.420 -6.415 1.00 0.00 H new ATOM 0 HA LEU B 134 -0.784 -2.580 -5.087 1.00 0.00 H new ATOM 0 HB2 LEU B 134 2.146 -3.340 -4.887 1.00 0.00 H new ATOM 0 HB3 LEU B 134 1.420 -2.175 -3.798 1.00 0.00 H new ATOM 0 HG LEU B 134 -0.094 -3.828 -2.909 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -0.052 -6.176 -3.656 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -0.561 -5.076 -4.959 1.00 0.00 H new ATOM 0 HD13 LEU B 134 1.090 -5.739 -4.949 1.00 0.00 H new ATOM 0 HD21 LEU B 134 1.519 -5.416 -1.924 1.00 0.00 H new ATOM 0 HD22 LEU B 134 2.722 -4.943 -3.148 1.00 0.00 H new ATOM 0 HD23 LEU B 134 2.158 -3.755 -1.948 1.00 0.00 H new ATOM 1277 N ARG B 135 1.566 -1.253 -6.971 1.00 0.00 N ATOM 1278 CA ARG B 135 2.027 -0.009 -7.578 1.00 0.00 C ATOM 1279 C ARG B 135 0.871 0.744 -8.232 1.00 0.00 C ATOM 1280 O ARG B 135 0.758 1.963 -8.098 1.00 0.00 O ATOM 1281 CB ARG B 135 3.117 -0.300 -8.614 1.00 0.00 C ATOM 1282 CG ARG B 135 3.557 0.924 -9.402 1.00 0.00 C ATOM 1283 CD ARG B 135 4.868 0.676 -10.131 1.00 0.00 C ATOM 1284 NE ARG B 135 5.441 1.911 -10.661 1.00 0.00 N ATOM 1285 CZ ARG B 135 5.021 2.504 -11.777 1.00 0.00 C ATOM 1286 NH1 ARG B 135 4.027 1.978 -12.482 1.00 0.00 N ATOM 1287 NH2 ARG B 135 5.596 3.626 -12.188 1.00 0.00 N ATOM 0 H ARG B 135 2.049 -2.088 -7.304 1.00 0.00 H new ATOM 0 HA ARG B 135 2.441 0.620 -6.790 1.00 0.00 H new ATOM 0 HB2 ARG B 135 3.983 -0.725 -8.107 1.00 0.00 H new ATOM 0 HB3 ARG B 135 2.752 -1.056 -9.309 1.00 0.00 H new ATOM 0 HG2 ARG B 135 2.784 1.191 -10.122 1.00 0.00 H new ATOM 0 HG3 ARG B 135 3.670 1.772 -8.726 1.00 0.00 H new ATOM 0 HD2 ARG B 135 5.579 0.209 -9.449 1.00 0.00 H new ATOM 0 HD3 ARG B 135 4.702 -0.026 -10.948 1.00 0.00 H new ATOM 0 HE ARG B 135 6.208 2.344 -10.146 1.00 0.00 H new ATOM 0 HH11 ARG B 135 3.581 1.116 -12.170 1.00 0.00 H new ATOM 0 HH12 ARG B 135 3.709 2.436 -13.336 1.00 0.00 H new ATOM 0 HH21 ARG B 135 6.360 4.035 -11.649 1.00 0.00 H new ATOM 0 HH22 ARG B 135 5.275 4.080 -13.043 1.00 0.00 H new ATOM 1301 N GLY B 136 0.019 0.014 -8.942 1.00 0.00 N ATOM 1302 CA GLY B 136 -1.111 0.635 -9.607 1.00 0.00 C ATOM 1303 C GLY B 136 -2.070 1.290 -8.633 1.00 0.00 C ATOM 1304 O GLY B 136 -2.189 0.863 -7.485 1.00 0.00 O ATOM 0 H GLY B 136 0.090 -0.996 -9.069 1.00 0.00 H new ATOM 0 HA2 GLY B 136 -0.747 1.383 -10.312 1.00 0.00 H new ATOM 0 HA3 GLY B 136 -1.645 -0.117 -10.187 1.00 0.00 H new ATOM 1308 N LYS B 137 -2.757 2.332 -9.093 1.00 0.00 N ATOM 1309 CA LYS B 137 -3.712 3.050 -8.256 1.00 0.00 C ATOM 1310 C LYS B 137 -3.014 3.703 -7.068 1.00 0.00 C ATOM 1311 O LYS B 137 -3.588 3.819 -5.985 1.00 0.00 O ATOM 1312 CB LYS B 137 -4.805 2.100 -7.761 1.00 0.00 C ATOM 1313 CG LYS B 137 -5.554 1.398 -8.882 1.00 0.00 C ATOM 1314 CD LYS B 137 -6.732 2.226 -9.370 1.00 0.00 C ATOM 1315 CE LYS B 137 -6.275 3.397 -10.225 1.00 0.00 C ATOM 1316 NZ LYS B 137 -7.165 3.608 -11.400 1.00 0.00 N ATOM 0 H LYS B 137 -2.670 2.698 -10.041 1.00 0.00 H new ATOM 0 HA LYS B 137 -4.168 3.834 -8.861 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -4.356 1.350 -7.110 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -5.517 2.662 -7.156 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -4.873 1.207 -9.712 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -5.909 0.429 -8.532 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -7.407 1.595 -9.947 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -7.296 2.597 -8.514 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -6.254 4.303 -9.619 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -5.256 3.219 -10.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -6.819 4.415 -11.957 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -7.166 2.753 -11.993 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -8.133 3.803 -11.072 1.00 0.00 H new ATOM 1330 N PHE B 138 -1.772 4.127 -7.278 1.00 0.00 N ATOM 1331 CA PHE B 138 -0.995 4.768 -6.223 1.00 0.00 C ATOM 1332 C PHE B 138 -0.112 5.875 -6.792 1.00 0.00 C ATOM 1333 O PHE B 138 1.010 6.086 -6.331 1.00 0.00 O ATOM 1334 CB PHE B 138 -0.133 3.734 -5.497 1.00 0.00 C ATOM 1335 CG PHE B 138 -0.821 3.091 -4.327 1.00 0.00 C ATOM 1336 CD1 PHE B 138 -0.828 3.707 -3.086 1.00 0.00 C ATOM 1337 CD2 PHE B 138 -1.459 1.870 -4.469 1.00 0.00 C ATOM 1338 CE1 PHE B 138 -1.460 3.116 -2.008 1.00 0.00 C ATOM 1339 CE2 PHE B 138 -2.092 1.274 -3.396 1.00 0.00 C ATOM 1340 CZ PHE B 138 -2.093 1.898 -2.163 1.00 0.00 C ATOM 0 H PHE B 138 -1.282 4.038 -8.168 1.00 0.00 H new ATOM 0 HA PHE B 138 -1.691 5.214 -5.513 1.00 0.00 H new ATOM 0 HB2 PHE B 138 0.163 2.959 -6.204 1.00 0.00 H new ATOM 0 HB3 PHE B 138 0.782 4.215 -5.150 1.00 0.00 H new ATOM 0 HD1 PHE B 138 -0.334 4.659 -2.960 1.00 0.00 H new ATOM 0 HD2 PHE B 138 -1.462 1.378 -5.430 1.00 0.00 H new ATOM 0 HE1 PHE B 138 -1.459 3.606 -1.046 1.00 0.00 H new ATOM 0 HE2 PHE B 138 -2.586 0.321 -3.520 1.00 0.00 H new ATOM 0 HZ PHE B 138 -2.588 1.434 -1.322 1.00 0.00 H new