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 Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 162:sc= -0.027 (180deg=-0.306) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -0.451 K(o=-0.45,f=-1.5!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -131:sc= -0.351 (180deg=-3.5!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 124 THR OG1 : rot -110:sc= -1.65 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 -177:sc= 0 (180deg=-0.00868) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 156:sc= -0.0712 (180deg=-0.4) USER MOD Single : A 143 ASN : amide:sc= 0.0106 K(o=0.011,f=-1.2) USER MOD Single : A 144 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.062) USER MOD Single : A 150 TYR OH : rot -165:sc= -0.664 USER MOD Single : A 157 MET CE :methyl 164:sc=-0.00557 (180deg=-0.111) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ -123:sc= -0.161 (180deg=-0.871) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 1.148 15.400 -0.204 1.00 0.00 N ATOM 72 CA SER A 93 2.225 14.752 0.534 1.00 0.00 C ATOM 73 C SER A 93 1.669 13.766 1.556 1.00 0.00 C ATOM 74 O SER A 93 1.954 12.570 1.498 1.00 0.00 O ATOM 75 CB SER A 93 3.092 15.798 1.237 1.00 0.00 C ATOM 76 OG SER A 93 4.079 15.183 2.047 1.00 0.00 O ATOM 0 HA SER A 93 2.839 14.201 -0.179 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.572 16.435 0.494 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.463 16.443 1.851 1.00 0.00 H new ATOM 0 HG SER A 93 4.621 15.873 2.484 1.00 0.00 H new ATOM 82 N GLU A 94 0.874 14.276 2.491 1.00 0.00 N ATOM 83 CA GLU A 94 0.278 13.440 3.527 1.00 0.00 C ATOM 84 C GLU A 94 -1.200 13.189 3.242 1.00 0.00 C ATOM 85 O GLU A 94 -1.749 12.155 3.624 1.00 0.00 O ATOM 86 CB GLU A 94 0.442 14.098 4.899 1.00 0.00 C ATOM 87 CG GLU A 94 0.907 13.139 5.982 1.00 0.00 C ATOM 88 CD GLU A 94 0.401 13.526 7.358 1.00 0.00 C ATOM 89 OE1 GLU A 94 -0.833 13.596 7.539 1.00 0.00 O ATOM 90 OE2 GLU A 94 1.239 13.758 8.255 1.00 0.00 O ATOM 0 H GLU A 94 0.628 15.264 2.553 1.00 0.00 H new ATOM 0 HA GLU A 94 0.796 12.481 3.528 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.158 14.915 4.817 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.510 14.537 5.198 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.564 12.132 5.743 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.997 13.111 5.994 1.00 0.00 H new ATOM 97 N GLU A 95 -1.839 14.140 2.569 1.00 0.00 N ATOM 98 CA GLU A 95 -3.253 14.021 2.234 1.00 0.00 C ATOM 99 C GLU A 95 -3.504 12.795 1.362 1.00 0.00 C ATOM 100 O GLU A 95 -4.571 12.184 1.426 1.00 0.00 O ATOM 101 CB GLU A 95 -3.736 15.283 1.514 1.00 0.00 C ATOM 102 CG GLU A 95 -4.459 16.262 2.424 1.00 0.00 C ATOM 103 CD GLU A 95 -4.873 17.531 1.704 1.00 0.00 C ATOM 104 OE1 GLU A 95 -4.937 17.511 0.456 1.00 0.00 O ATOM 105 OE2 GLU A 95 -5.134 18.543 2.387 1.00 0.00 O ATOM 0 H GLU A 95 -1.400 15.002 2.245 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.813 13.904 3.162 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.880 15.784 1.062 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.402 14.995 0.701 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.343 15.780 2.840 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.812 16.519 3.262 1.00 0.00 H new ATOM 112 N GLU A 96 -2.515 12.439 0.549 1.00 0.00 N ATOM 113 CA GLU A 96 -2.629 11.285 -0.335 1.00 0.00 C ATOM 114 C GLU A 96 -2.880 10.011 0.464 1.00 0.00 C ATOM 115 O GLU A 96 -3.937 9.391 0.347 1.00 0.00 O ATOM 116 CB GLU A 96 -1.360 11.131 -1.175 1.00 0.00 C ATOM 117 CG GLU A 96 -0.919 12.418 -1.853 1.00 0.00 C ATOM 118 CD GLU A 96 -0.202 12.169 -3.165 1.00 0.00 C ATOM 119 OE1 GLU A 96 0.560 11.183 -3.247 1.00 0.00 O ATOM 120 OE2 GLU A 96 -0.403 12.960 -4.111 1.00 0.00 O ATOM 0 H GLU A 96 -1.625 12.933 0.484 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.478 11.450 -0.999 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.553 10.772 -0.536 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.528 10.369 -1.936 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.791 13.047 -2.033 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -0.261 12.971 -1.183 1.00 0.00 H new ATOM 127 N LEU A 97 -1.902 9.625 1.277 1.00 0.00 N ATOM 128 CA LEU A 97 -2.017 8.424 2.095 1.00 0.00 C ATOM 129 C LEU A 97 -3.096 8.589 3.161 1.00 0.00 C ATOM 130 O LEU A 97 -3.698 7.612 3.605 1.00 0.00 O ATOM 131 CB LEU A 97 -0.675 8.105 2.752 1.00 0.00 C ATOM 132 CG LEU A 97 0.430 7.672 1.784 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.708 8.463 2.033 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.689 6.176 1.906 1.00 0.00 C ATOM 0 H LEU A 97 -1.021 10.127 1.387 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.303 7.597 1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.336 8.986 3.297 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.825 7.314 3.486 1.00 0.00 H new ATOM 0 HG LEU A 97 0.096 7.881 0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.479 8.138 1.334 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.512 9.526 1.889 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.049 8.292 3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.477 5.885 1.211 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.999 5.942 2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.223 5.628 1.670 1.00 0.00 H new ATOM 146 N SER A 98 -3.337 9.832 3.569 1.00 0.00 N ATOM 147 CA SER A 98 -4.344 10.124 4.584 1.00 0.00 C ATOM 148 C SER A 98 -5.701 9.552 4.186 1.00 0.00 C ATOM 149 O SER A 98 -6.419 8.995 5.016 1.00 0.00 O ATOM 150 CB SER A 98 -4.459 11.634 4.797 1.00 0.00 C ATOM 151 OG SER A 98 -5.568 11.950 5.622 1.00 0.00 O ATOM 0 H SER A 98 -2.848 10.653 3.212 1.00 0.00 H new ATOM 0 HA SER A 98 -4.031 9.654 5.516 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.543 12.011 5.253 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.564 12.133 3.834 1.00 0.00 H new ATOM 0 HG SER A 98 -5.619 12.921 5.744 1.00 0.00 H new ATOM 157 N ASP A 99 -6.046 9.696 2.911 1.00 0.00 N ATOM 158 CA ASP A 99 -7.317 9.195 2.400 1.00 0.00 C ATOM 159 C ASP A 99 -7.215 7.719 2.026 1.00 0.00 C ATOM 160 O ASP A 99 -8.203 6.987 2.080 1.00 0.00 O ATOM 161 CB ASP A 99 -7.757 10.011 1.184 1.00 0.00 C ATOM 162 CG ASP A 99 -9.261 10.194 1.123 1.00 0.00 C ATOM 163 OD1 ASP A 99 -9.973 9.186 0.930 1.00 0.00 O ATOM 164 OD2 ASP A 99 -9.726 11.343 1.270 1.00 0.00 O ATOM 0 H ASP A 99 -5.463 10.156 2.212 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.061 9.298 3.190 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.276 10.989 1.213 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.417 9.515 0.275 1.00 0.00 H new ATOM 169 N LEU A 100 -6.016 7.289 1.644 1.00 0.00 N ATOM 170 CA LEU A 100 -5.792 5.900 1.258 1.00 0.00 C ATOM 171 C LEU A 100 -5.968 4.963 2.449 1.00 0.00 C ATOM 172 O LEU A 100 -6.609 3.918 2.337 1.00 0.00 O ATOM 173 CB LEU A 100 -4.391 5.730 0.664 1.00 0.00 C ATOM 174 CG LEU A 100 -4.225 6.248 -0.766 1.00 0.00 C ATOM 175 CD1 LEU A 100 -2.752 6.452 -1.096 1.00 0.00 C ATOM 176 CD2 LEU A 100 -4.868 5.288 -1.757 1.00 0.00 C ATOM 0 H LEU A 100 -5.187 7.881 1.594 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.534 5.639 0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.676 6.245 1.306 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.131 4.672 0.683 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.728 7.212 -0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.656 6.821 -2.117 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.322 7.178 -0.406 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.223 5.504 -1.001 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.741 5.671 -2.769 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.393 4.310 -1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.931 5.194 -1.535 1.00 0.00 H new ATOM 188 N PHE A 101 -5.395 5.339 3.589 1.00 0.00 N ATOM 189 CA PHE A 101 -5.493 4.522 4.795 1.00 0.00 C ATOM 190 C PHE A 101 -6.948 4.326 5.208 1.00 0.00 C ATOM 191 O PHE A 101 -7.338 3.245 5.646 1.00 0.00 O ATOM 192 CB PHE A 101 -4.709 5.160 5.943 1.00 0.00 C ATOM 193 CG PHE A 101 -4.462 4.221 7.090 1.00 0.00 C ATOM 194 CD1 PHE A 101 -3.611 3.135 6.944 1.00 0.00 C ATOM 195 CD2 PHE A 101 -5.080 4.423 8.313 1.00 0.00 C ATOM 196 CE1 PHE A 101 -3.383 2.270 7.997 1.00 0.00 C ATOM 197 CE2 PHE A 101 -4.855 3.561 9.369 1.00 0.00 C ATOM 198 CZ PHE A 101 -4.005 2.483 9.211 1.00 0.00 C ATOM 0 H PHE A 101 -4.860 6.200 3.703 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.062 3.546 4.570 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -3.752 5.519 5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.255 6.031 6.307 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.121 2.964 5.997 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.745 5.264 8.443 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.719 1.428 7.871 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.343 3.730 10.317 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.828 1.808 10.036 1.00 0.00 H new ATOM 208 N ARG A 102 -7.747 5.379 5.068 1.00 0.00 N ATOM 209 CA ARG A 102 -9.159 5.319 5.430 1.00 0.00 C ATOM 210 C ARG A 102 -9.894 4.273 4.597 1.00 0.00 C ATOM 211 O ARG A 102 -10.607 3.426 5.136 1.00 0.00 O ATOM 212 CB ARG A 102 -9.816 6.688 5.240 1.00 0.00 C ATOM 213 CG ARG A 102 -8.974 7.846 5.755 1.00 0.00 C ATOM 214 CD ARG A 102 -9.802 8.814 6.585 1.00 0.00 C ATOM 215 NE ARG A 102 -9.601 8.618 8.018 1.00 0.00 N ATOM 216 CZ ARG A 102 -9.912 9.524 8.942 1.00 0.00 C ATOM 217 NH1 ARG A 102 -10.438 10.690 8.587 1.00 0.00 N ATOM 218 NH2 ARG A 102 -9.697 9.265 10.224 1.00 0.00 N ATOM 0 H ARG A 102 -7.442 6.283 4.707 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.224 5.033 6.480 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -10.018 6.840 4.180 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.778 6.694 5.752 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.152 7.459 6.358 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -8.529 8.376 4.913 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -9.538 9.837 6.319 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -10.858 8.685 6.346 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.198 7.734 8.329 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -10.606 10.895 7.602 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -10.675 11.381 9.299 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.293 8.371 10.503 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.936 9.960 10.932 1.00 0.00 H new ATOM 232 N MET A 103 -9.719 4.341 3.281 1.00 0.00 N ATOM 233 CA MET A 103 -10.370 3.402 2.373 1.00 0.00 C ATOM 234 C MET A 103 -9.796 1.997 2.529 1.00 0.00 C ATOM 235 O MET A 103 -10.491 1.005 2.304 1.00 0.00 O ATOM 236 CB MET A 103 -10.212 3.871 0.925 1.00 0.00 C ATOM 237 CG MET A 103 -10.998 3.037 -0.073 1.00 0.00 C ATOM 238 SD MET A 103 -10.548 3.395 -1.782 1.00 0.00 S ATOM 239 CE MET A 103 -8.933 2.628 -1.875 1.00 0.00 C ATOM 0 H MET A 103 -9.132 5.036 2.819 1.00 0.00 H new ATOM 0 HA MET A 103 -11.429 3.369 2.627 1.00 0.00 H new ATOM 0 HB2 MET A 103 -10.534 4.910 0.851 1.00 0.00 H new ATOM 0 HB3 MET A 103 -9.156 3.844 0.656 1.00 0.00 H new ATOM 0 HG2 MET A 103 -10.829 1.979 0.130 1.00 0.00 H new ATOM 0 HG3 MET A 103 -12.063 3.221 0.065 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.661 2.478 -2.920 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.196 3.273 -1.397 1.00 0.00 H new ATOM 0 HE3 MET A 103 -8.958 1.665 -1.365 1.00 0.00 H new ATOM 249 N PHE A 104 -8.527 1.917 2.913 1.00 0.00 N ATOM 250 CA PHE A 104 -7.863 0.631 3.097 1.00 0.00 C ATOM 251 C PHE A 104 -8.241 0.011 4.438 1.00 0.00 C ATOM 252 O PHE A 104 -8.535 -1.182 4.520 1.00 0.00 O ATOM 253 CB PHE A 104 -6.345 0.802 3.008 1.00 0.00 C ATOM 254 CG PHE A 104 -5.664 -0.273 2.210 1.00 0.00 C ATOM 255 CD1 PHE A 104 -5.584 -1.569 2.693 1.00 0.00 C ATOM 256 CD2 PHE A 104 -5.101 0.014 0.976 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.956 -2.559 1.961 1.00 0.00 C ATOM 258 CE2 PHE A 104 -4.472 -0.972 0.240 1.00 0.00 C ATOM 259 CZ PHE A 104 -4.400 -2.260 0.733 1.00 0.00 C ATOM 0 H PHE A 104 -7.937 2.727 3.103 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.193 -0.039 2.303 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.123 1.771 2.561 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.929 0.813 4.016 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -6.017 -1.809 3.653 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -5.155 1.020 0.586 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.900 -3.565 2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -4.037 -0.736 -0.720 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.910 -3.032 0.159 1.00 0.00 H new ATOM 269 N ASP A 105 -8.228 0.828 5.485 1.00 0.00 N ATOM 270 CA ASP A 105 -8.567 0.361 6.824 1.00 0.00 C ATOM 271 C ASP A 105 -10.058 0.056 6.934 1.00 0.00 C ATOM 272 O ASP A 105 -10.787 0.723 7.669 1.00 0.00 O ATOM 273 CB ASP A 105 -8.167 1.406 7.868 1.00 0.00 C ATOM 274 CG ASP A 105 -8.190 0.853 9.279 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.202 -0.387 9.431 1.00 0.00 O ATOM 276 OD2 ASP A 105 -8.196 1.659 10.233 1.00 0.00 O ATOM 0 H ASP A 105 -7.986 1.818 5.432 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.013 -0.559 7.012 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.167 1.776 7.642 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.844 2.258 7.804 1.00 0.00 H new ATOM 281 N LYS A 106 -10.505 -0.958 6.200 1.00 0.00 N ATOM 282 CA LYS A 106 -11.909 -1.354 6.217 1.00 0.00 C ATOM 283 C LYS A 106 -12.350 -1.727 7.630 1.00 0.00 C ATOM 284 O LYS A 106 -13.524 -1.602 7.979 1.00 0.00 O ATOM 285 CB LYS A 106 -12.139 -2.532 5.268 1.00 0.00 C ATOM 286 CG LYS A 106 -12.727 -2.126 3.926 1.00 0.00 C ATOM 287 CD LYS A 106 -11.737 -1.316 3.103 1.00 0.00 C ATOM 288 CE LYS A 106 -11.369 -2.028 1.811 1.00 0.00 C ATOM 289 NZ LYS A 106 -12.222 -1.589 0.673 1.00 0.00 N ATOM 0 H LYS A 106 -9.916 -1.520 5.586 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.506 -0.506 5.882 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.191 -3.043 5.100 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -12.807 -3.248 5.746 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -13.019 -3.018 3.371 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.632 -1.541 4.087 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.166 -0.341 2.872 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.836 -1.137 3.690 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.322 -1.835 1.576 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -11.472 -3.104 1.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.939 -2.098 -0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -13.219 -1.796 0.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -12.105 -0.566 0.526 1.00 0.00 H new ATOM 303 N ASN A 107 -11.399 -2.184 8.439 1.00 0.00 N ATOM 304 CA ASN A 107 -11.685 -2.573 9.814 1.00 0.00 C ATOM 305 C ASN A 107 -12.016 -1.353 10.666 1.00 0.00 C ATOM 306 O ASN A 107 -12.774 -1.444 11.632 1.00 0.00 O ATOM 307 CB ASN A 107 -10.488 -3.312 10.414 1.00 0.00 C ATOM 308 CG ASN A 107 -10.341 -4.718 9.868 1.00 0.00 C ATOM 309 OD1 ASN A 107 -11.294 -5.299 9.349 1.00 0.00 O ATOM 310 ND2 ASN A 107 -9.140 -5.272 9.983 1.00 0.00 N ATOM 0 H ASN A 107 -10.423 -2.294 8.165 1.00 0.00 H new ATOM 0 HA ASN A 107 -12.550 -3.236 9.805 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.577 -2.749 10.209 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.598 -3.356 11.498 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -8.979 -6.217 9.634 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.379 -4.753 10.421 1.00 0.00 H new ATOM 317 N ALA A 108 -11.439 -0.212 10.304 1.00 0.00 N ATOM 318 CA ALA A 108 -11.667 1.028 11.036 1.00 0.00 C ATOM 319 C ALA A 108 -11.137 0.924 12.463 1.00 0.00 C ATOM 320 O ALA A 108 -11.849 1.212 13.425 1.00 0.00 O ATOM 321 CB ALA A 108 -13.149 1.376 11.041 1.00 0.00 C ATOM 0 H ALA A 108 -10.809 -0.121 9.507 1.00 0.00 H new ATOM 0 HA ALA A 108 -11.123 1.827 10.531 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.303 2.304 11.591 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -13.497 1.500 10.016 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -13.710 0.573 11.520 1.00 0.00 H new ATOM 327 N ASP A 109 -9.880 0.508 12.591 1.00 0.00 N ATOM 328 CA ASP A 109 -9.252 0.364 13.899 1.00 0.00 C ATOM 329 C ASP A 109 -8.077 1.324 14.049 1.00 0.00 C ATOM 330 O ASP A 109 -7.936 1.992 15.074 1.00 0.00 O ATOM 331 CB ASP A 109 -8.778 -1.076 14.104 1.00 0.00 C ATOM 332 CG ASP A 109 -7.816 -1.527 13.022 1.00 0.00 C ATOM 333 OD1 ASP A 109 -8.019 -1.145 11.850 1.00 0.00 O ATOM 334 OD2 ASP A 109 -6.859 -2.262 13.346 1.00 0.00 O ATOM 0 H ASP A 109 -9.277 0.265 11.805 1.00 0.00 H new ATOM 0 HA ASP A 109 -9.995 0.607 14.659 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -8.293 -1.161 15.076 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -9.641 -1.741 14.119 1.00 0.00 H new ATOM 339 N GLY A 110 -7.236 1.391 13.022 1.00 0.00 N ATOM 340 CA GLY A 110 -6.086 2.276 13.064 1.00 0.00 C ATOM 341 C GLY A 110 -4.836 1.647 12.477 1.00 0.00 C ATOM 342 O GLY A 110 -3.881 2.349 12.145 1.00 0.00 O ATOM 0 H GLY A 110 -7.330 0.849 12.163 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -6.317 3.191 12.518 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -5.892 2.562 14.098 1.00 0.00 H new ATOM 346 N TYR A 111 -4.837 0.322 12.353 1.00 0.00 N ATOM 347 CA TYR A 111 -3.689 -0.394 11.804 1.00 0.00 C ATOM 348 C TYR A 111 -4.137 -1.438 10.784 1.00 0.00 C ATOM 349 O TYR A 111 -5.327 -1.728 10.663 1.00 0.00 O ATOM 350 CB TYR A 111 -2.900 -1.077 12.925 1.00 0.00 C ATOM 351 CG TYR A 111 -2.204 -0.116 13.865 1.00 0.00 C ATOM 352 CD1 TYR A 111 -2.931 0.767 14.652 1.00 0.00 C ATOM 353 CD2 TYR A 111 -0.819 -0.096 13.967 1.00 0.00 C ATOM 354 CE1 TYR A 111 -2.299 1.643 15.514 1.00 0.00 C ATOM 355 CE2 TYR A 111 -0.179 0.777 14.827 1.00 0.00 C ATOM 356 CZ TYR A 111 -0.923 1.644 15.598 1.00 0.00 C ATOM 357 OH TYR A 111 -0.290 2.514 16.455 1.00 0.00 O ATOM 0 H TYR A 111 -5.618 -0.276 12.624 1.00 0.00 H new ATOM 0 HA TYR A 111 -3.048 0.332 11.304 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -3.579 -1.705 13.502 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -2.155 -1.737 12.480 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -4.009 0.769 14.589 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -0.232 -0.774 13.365 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.880 2.323 16.119 1.00 0.00 H new ATOM 0 HE2 TYR A 111 0.899 0.780 14.894 1.00 0.00 H new ATOM 0 HH TYR A 111 0.680 2.386 16.394 1.00 0.00 H new ATOM 367 N ILE A 112 -3.178 -2.008 10.054 1.00 0.00 N ATOM 368 CA ILE A 112 -3.489 -3.025 9.053 1.00 0.00 C ATOM 369 C ILE A 112 -2.861 -4.364 9.423 1.00 0.00 C ATOM 370 O ILE A 112 -1.684 -4.434 9.777 1.00 0.00 O ATOM 371 CB ILE A 112 -3.000 -2.614 7.650 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.475 -1.197 7.313 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.487 -3.610 6.604 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.131 -0.758 5.904 1.00 0.00 C ATOM 0 H ILE A 112 -2.186 -1.784 10.137 1.00 0.00 H new ATOM 0 HA ILE A 112 -4.574 -3.123 9.032 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.910 -2.620 7.646 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.555 -1.144 7.447 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.031 -0.497 8.021 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.133 -3.305 5.619 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -3.100 -4.602 6.838 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.577 -3.636 6.606 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.499 0.255 5.738 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.049 -0.778 5.771 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.597 -1.435 5.188 1.00 0.00 H new ATOM 386 N ASP A 113 -3.655 -5.426 9.342 1.00 0.00 N ATOM 387 CA ASP A 113 -3.180 -6.765 9.671 1.00 0.00 C ATOM 388 C ASP A 113 -3.470 -7.740 8.533 1.00 0.00 C ATOM 389 O ASP A 113 -3.853 -7.332 7.437 1.00 0.00 O ATOM 390 CB ASP A 113 -3.834 -7.256 10.965 1.00 0.00 C ATOM 391 CG ASP A 113 -5.335 -7.435 10.829 1.00 0.00 C ATOM 392 OD1 ASP A 113 -5.876 -7.123 9.747 1.00 0.00 O ATOM 393 OD2 ASP A 113 -5.969 -7.889 11.805 1.00 0.00 O ATOM 0 H ASP A 113 -4.632 -5.385 9.051 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.101 -6.718 9.815 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -3.384 -8.204 11.258 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -3.628 -6.545 11.765 1.00 0.00 H new ATOM 398 N LEU A 114 -3.284 -9.030 8.800 1.00 0.00 N ATOM 399 CA LEU A 114 -3.525 -10.065 7.798 1.00 0.00 C ATOM 400 C LEU A 114 -4.908 -9.912 7.172 1.00 0.00 C ATOM 401 O LEU A 114 -5.111 -10.242 6.003 1.00 0.00 O ATOM 402 CB LEU A 114 -3.389 -11.453 8.428 1.00 0.00 C ATOM 403 CG LEU A 114 -1.954 -11.968 8.556 1.00 0.00 C ATOM 404 CD1 LEU A 114 -1.328 -11.484 9.854 1.00 0.00 C ATOM 405 CD2 LEU A 114 -1.926 -13.487 8.481 1.00 0.00 C ATOM 0 H LEU A 114 -2.967 -9.384 9.703 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.779 -9.953 7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.841 -11.431 9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.962 -12.163 7.832 1.00 0.00 H new ATOM 0 HG LEU A 114 -1.369 -11.572 7.726 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.308 -11.860 9.928 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -1.315 -10.394 9.868 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.912 -11.850 10.698 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.898 -13.837 8.574 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.525 -13.902 9.291 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -2.335 -13.812 7.524 1.00 0.00 H new ATOM 417 N GLU A 115 -5.855 -9.406 7.955 1.00 0.00 N ATOM 418 CA GLU A 115 -7.217 -9.207 7.476 1.00 0.00 C ATOM 419 C GLU A 115 -7.246 -8.195 6.335 1.00 0.00 C ATOM 420 O GLU A 115 -7.634 -8.521 5.213 1.00 0.00 O ATOM 421 CB GLU A 115 -8.119 -8.734 8.617 1.00 0.00 C ATOM 422 CG GLU A 115 -9.492 -9.377 8.574 1.00 0.00 C ATOM 423 OE1 GLU A 115 -10.074 -9.608 9.655 1.00 0.00 O ATOM 424 OE2 GLU A 115 -9.985 -9.650 7.459 1.00 0.00 O ATOM 0 H GLU A 115 -5.704 -9.126 8.924 1.00 0.00 H new ATOM 0 HA GLU A 115 -7.589 -10.161 7.103 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.644 -8.963 9.571 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.227 -7.651 8.566 1.00 0.00 H new ATOM 429 N GLU A 116 -6.831 -6.968 6.628 1.00 0.00 N ATOM 430 CA GLU A 116 -6.807 -5.911 5.625 1.00 0.00 C ATOM 431 C GLU A 116 -5.781 -6.218 4.538 1.00 0.00 C ATOM 432 O GLU A 116 -5.928 -5.789 3.393 1.00 0.00 O ATOM 433 CB GLU A 116 -6.495 -4.563 6.278 1.00 0.00 C ATOM 434 CG GLU A 116 -7.709 -3.658 6.415 1.00 0.00 C ATOM 435 CD GLU A 116 -7.737 -2.915 7.736 1.00 0.00 C ATOM 436 OE1 GLU A 116 -6.678 -2.830 8.392 1.00 0.00 O ATOM 437 OE2 GLU A 116 -8.818 -2.417 8.113 1.00 0.00 O ATOM 0 H GLU A 116 -6.507 -6.681 7.552 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.793 -5.859 5.163 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -6.069 -4.737 7.266 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.735 -4.050 5.689 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.714 -2.937 5.597 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.616 -4.256 6.319 1.00 0.00 H new ATOM 444 N LEU A 117 -4.744 -6.968 4.902 1.00 0.00 N ATOM 445 CA LEU A 117 -3.696 -7.337 3.955 1.00 0.00 C ATOM 446 C LEU A 117 -4.296 -7.983 2.710 1.00 0.00 C ATOM 447 O LEU A 117 -3.751 -7.869 1.613 1.00 0.00 O ATOM 448 CB LEU A 117 -2.697 -8.290 4.616 1.00 0.00 C ATOM 449 CG LEU A 117 -1.227 -7.899 4.460 1.00 0.00 C ATOM 450 CD1 LEU A 117 -0.794 -8.012 3.006 1.00 0.00 C ATOM 451 CD2 LEU A 117 -0.994 -6.488 4.979 1.00 0.00 C ATOM 0 H LEU A 117 -4.607 -7.332 5.845 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.172 -6.430 3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.929 -8.354 5.679 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.838 -9.287 4.198 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.623 -8.588 5.051 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.255 -7.730 2.916 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.924 -9.040 2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.403 -7.348 2.392 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.057 -6.226 4.860 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.609 -5.787 4.415 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.263 -6.439 6.034 1.00 0.00 H new ATOM 463 N LYS A 118 -5.429 -8.653 2.888 1.00 0.00 N ATOM 464 CA LYS A 118 -6.112 -9.308 1.780 1.00 0.00 C ATOM 465 C LYS A 118 -6.464 -8.293 0.697 1.00 0.00 C ATOM 466 O LYS A 118 -6.387 -8.586 -0.496 1.00 0.00 O ATOM 467 CB LYS A 118 -7.379 -10.005 2.281 1.00 0.00 C ATOM 468 CG LYS A 118 -7.923 -11.052 1.322 1.00 0.00 C ATOM 469 CD LYS A 118 -8.814 -10.431 0.257 1.00 0.00 C ATOM 470 CE LYS A 118 -9.980 -9.673 0.872 1.00 0.00 C ATOM 471 NZ LYS A 118 -11.110 -9.519 -0.085 1.00 0.00 N ATOM 0 H LYS A 118 -5.894 -8.757 3.790 1.00 0.00 H new ATOM 0 HA LYS A 118 -5.444 -10.055 1.352 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -7.167 -10.479 3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -8.149 -9.254 2.460 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -7.094 -11.573 0.844 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -8.489 -11.798 1.880 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -8.225 -9.753 -0.361 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -9.194 -11.213 -0.401 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -10.327 -10.200 1.761 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -9.642 -8.689 1.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -11.884 -8.997 0.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -10.787 -8.994 -0.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -11.450 -10.458 -0.375 1.00 0.00 H new ATOM 485 N ILE A 119 -6.845 -7.093 1.128 1.00 0.00 N ATOM 486 CA ILE A 119 -7.207 -6.021 0.206 1.00 0.00 C ATOM 487 C ILE A 119 -6.132 -5.821 -0.860 1.00 0.00 C ATOM 488 O ILE A 119 -6.428 -5.428 -1.988 1.00 0.00 O ATOM 489 CB ILE A 119 -7.430 -4.693 0.960 1.00 0.00 C ATOM 490 CG1 ILE A 119 -8.519 -4.864 2.021 1.00 0.00 C ATOM 491 CG2 ILE A 119 -7.797 -3.574 -0.009 1.00 0.00 C ATOM 492 CD1 ILE A 119 -8.284 -4.039 3.268 1.00 0.00 C ATOM 0 H ILE A 119 -6.911 -6.839 2.114 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.137 -6.317 -0.280 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.499 -4.418 1.456 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.481 -4.589 1.590 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -8.583 -5.916 2.298 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.949 -2.648 0.545 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.990 -3.437 -0.729 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.714 -3.836 -0.537 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.095 -4.210 3.976 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.337 -4.330 3.724 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.250 -2.982 3.004 1.00 0.00 H new ATOM 504 N MET A 120 -4.884 -6.098 -0.497 1.00 0.00 N ATOM 505 CA MET A 120 -3.768 -5.952 -1.425 1.00 0.00 C ATOM 506 C MET A 120 -3.834 -7.018 -2.512 1.00 0.00 C ATOM 507 O MET A 120 -3.433 -6.784 -3.653 1.00 0.00 O ATOM 508 CB MET A 120 -2.433 -6.050 -0.682 1.00 0.00 C ATOM 509 CG MET A 120 -2.444 -5.400 0.694 1.00 0.00 C ATOM 510 SD MET A 120 -1.119 -4.194 0.908 1.00 0.00 S ATOM 511 CE MET A 120 -1.317 -3.777 2.638 1.00 0.00 C ATOM 0 H MET A 120 -4.620 -6.425 0.432 1.00 0.00 H new ATOM 0 HA MET A 120 -3.840 -4.969 -1.890 1.00 0.00 H new ATOM 0 HB2 MET A 120 -2.165 -7.101 -0.574 1.00 0.00 H new ATOM 0 HB3 MET A 120 -1.656 -5.583 -1.287 1.00 0.00 H new ATOM 0 HG2 MET A 120 -3.405 -4.909 0.851 1.00 0.00 H new ATOM 0 HG3 MET A 120 -2.352 -6.173 1.457 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.327 -2.693 2.752 1.00 0.00 H new ATOM 0 HE2 MET A 120 -2.256 -4.189 3.006 1.00 0.00 H new ATOM 0 HE3 MET A 120 -0.488 -4.194 3.210 1.00 0.00 H new ATOM 521 N LEU A 121 -4.342 -8.190 -2.148 1.00 0.00 N ATOM 522 CA LEU A 121 -4.462 -9.298 -3.088 1.00 0.00 C ATOM 523 C LEU A 121 -5.528 -9.012 -4.141 1.00 0.00 C ATOM 524 O LEU A 121 -5.448 -9.506 -5.266 1.00 0.00 O ATOM 525 CB LEU A 121 -4.797 -10.591 -2.341 1.00 0.00 C ATOM 526 CG LEU A 121 -4.014 -11.820 -2.798 1.00 0.00 C ATOM 527 CD1 LEU A 121 -4.235 -12.070 -4.281 1.00 0.00 C ATOM 528 CD2 LEU A 121 -2.533 -11.647 -2.498 1.00 0.00 C ATOM 0 H LEU A 121 -4.678 -8.397 -1.207 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.504 -9.416 -3.595 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.614 -10.437 -1.278 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.862 -10.794 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.377 -12.687 -2.247 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -3.670 -12.949 -4.590 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -5.296 -12.236 -4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.898 -11.204 -4.850 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.989 -12.531 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.155 -10.770 -3.024 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.392 -11.515 -1.425 1.00 0.00 H new ATOM 540 N GLN A 122 -6.524 -8.210 -3.775 1.00 0.00 N ATOM 541 CA GLN A 122 -7.600 -7.860 -4.699 1.00 0.00 C ATOM 542 C GLN A 122 -7.034 -7.318 -6.009 1.00 0.00 C ATOM 543 O GLN A 122 -7.636 -7.475 -7.071 1.00 0.00 O ATOM 544 CB GLN A 122 -8.532 -6.825 -4.064 1.00 0.00 C ATOM 545 CG GLN A 122 -9.829 -7.418 -3.537 1.00 0.00 C ATOM 546 CD GLN A 122 -10.959 -7.333 -4.543 1.00 0.00 C ATOM 547 OE1 GLN A 122 -10.750 -7.501 -5.745 1.00 0.00 O ATOM 548 NE2 GLN A 122 -12.166 -7.070 -4.057 1.00 0.00 N ATOM 0 H GLN A 122 -6.609 -7.791 -2.849 1.00 0.00 H new ATOM 0 HA GLN A 122 -8.169 -8.764 -4.915 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.009 -6.331 -3.245 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.766 -6.058 -4.802 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.664 -8.461 -3.268 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -10.119 -6.896 -2.625 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -12.294 -6.938 -3.054 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -12.965 -7.000 -4.687 1.00 0.00 H new ATOM 557 N ALA A 123 -5.870 -6.683 -5.921 1.00 0.00 N ATOM 558 CA ALA A 123 -5.213 -6.120 -7.094 1.00 0.00 C ATOM 559 C ALA A 123 -4.443 -7.187 -7.866 1.00 0.00 C ATOM 560 O ALA A 123 -4.048 -6.973 -9.012 1.00 0.00 O ATOM 561 CB ALA A 123 -4.275 -4.999 -6.678 1.00 0.00 C ATOM 0 H ALA A 123 -5.362 -6.545 -5.047 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.984 -5.720 -7.752 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -3.789 -4.585 -7.561 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -4.844 -4.216 -6.176 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -3.519 -5.391 -5.998 1.00 0.00 H new ATOM 567 N THR A 124 -4.229 -8.336 -7.231 1.00 0.00 N ATOM 568 CA THR A 124 -3.504 -9.433 -7.855 1.00 0.00 C ATOM 569 C THR A 124 -4.364 -10.688 -7.895 1.00 0.00 C ATOM 570 O THR A 124 -4.118 -11.647 -7.164 1.00 0.00 O ATOM 571 CB THR A 124 -2.211 -9.709 -7.091 1.00 0.00 C ATOM 572 OG1 THR A 124 -2.461 -9.808 -5.701 1.00 0.00 O ATOM 573 CG2 THR A 124 -1.160 -8.643 -7.293 1.00 0.00 C ATOM 0 H THR A 124 -4.549 -8.529 -6.282 1.00 0.00 H new ATOM 0 HA THR A 124 -3.259 -9.148 -8.878 1.00 0.00 H new ATOM 0 HB THR A 124 -1.834 -10.650 -7.492 1.00 0.00 H new ATOM 0 HG1 THR A 124 -2.078 -9.031 -5.244 1.00 0.00 H new ATOM 0 HG21 THR A 124 -0.267 -8.900 -6.723 1.00 0.00 H new ATOM 0 HG22 THR A 124 -0.908 -8.576 -8.351 1.00 0.00 H new ATOM 0 HG23 THR A 124 -1.545 -7.683 -6.950 1.00 0.00 H new ATOM 581 N GLY A 125 -5.378 -10.670 -8.750 1.00 0.00 N ATOM 582 CA GLY A 125 -6.266 -11.809 -8.868 1.00 0.00 C ATOM 583 C GLY A 125 -5.586 -13.020 -9.480 1.00 0.00 C ATOM 584 O GLY A 125 -5.940 -13.451 -10.577 1.00 0.00 O ATOM 0 H GLY A 125 -5.601 -9.887 -9.364 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -6.647 -12.071 -7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -7.126 -11.533 -9.479 1.00 0.00 H new ATOM 588 N GLU A 126 -4.608 -13.571 -8.767 1.00 0.00 N ATOM 589 CA GLU A 126 -3.877 -14.741 -9.242 1.00 0.00 C ATOM 590 C GLU A 126 -3.388 -15.587 -8.066 1.00 0.00 C ATOM 591 O GLU A 126 -3.896 -15.464 -6.952 1.00 0.00 O ATOM 592 CB GLU A 126 -2.700 -14.309 -10.124 1.00 0.00 C ATOM 593 CG GLU A 126 -1.582 -13.617 -9.361 1.00 0.00 C ATOM 594 CD GLU A 126 -0.458 -13.153 -10.267 1.00 0.00 C ATOM 595 OE1 GLU A 126 -0.543 -12.020 -10.784 1.00 0.00 O ATOM 596 OE2 GLU A 126 0.506 -13.924 -10.460 1.00 0.00 O ATOM 0 H GLU A 126 -4.303 -13.225 -7.857 1.00 0.00 H new ATOM 0 HA GLU A 126 -4.553 -15.352 -9.840 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -2.294 -15.187 -10.628 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -3.067 -13.637 -10.900 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -1.989 -12.760 -8.825 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -1.181 -14.300 -8.612 1.00 0.00 H new ATOM 603 N THR A 127 -2.406 -16.450 -8.317 1.00 0.00 N ATOM 604 CA THR A 127 -1.864 -17.314 -7.273 1.00 0.00 C ATOM 605 C THR A 127 -0.815 -16.585 -6.438 1.00 0.00 C ATOM 606 O THR A 127 0.355 -16.513 -6.816 1.00 0.00 O ATOM 607 CB THR A 127 -1.253 -18.572 -7.891 1.00 0.00 C ATOM 608 OG1 THR A 127 -1.919 -18.915 -9.094 1.00 0.00 O ATOM 609 CG2 THR A 127 -1.309 -19.776 -6.976 1.00 0.00 C ATOM 0 H THR A 127 -1.971 -16.569 -9.232 1.00 0.00 H new ATOM 0 HA THR A 127 -2.686 -17.598 -6.616 1.00 0.00 H new ATOM 0 HB THR A 127 -0.208 -18.324 -8.075 1.00 0.00 H new ATOM 0 HG1 THR A 127 -1.512 -19.721 -9.475 1.00 0.00 H new ATOM 0 HG21 THR A 127 -0.859 -20.634 -7.476 1.00 0.00 H new ATOM 0 HG22 THR A 127 -0.761 -19.562 -6.059 1.00 0.00 H new ATOM 0 HG23 THR A 127 -2.348 -20.001 -6.734 1.00 0.00 H new ATOM 617 N ILE A 128 -1.242 -16.052 -5.297 1.00 0.00 N ATOM 618 CA ILE A 128 -0.341 -15.332 -4.398 1.00 0.00 C ATOM 619 C ILE A 128 -0.884 -15.289 -2.970 1.00 0.00 C ATOM 620 O ILE A 128 -0.117 -15.193 -2.012 1.00 0.00 O ATOM 621 CB ILE A 128 -0.093 -13.888 -4.875 1.00 0.00 C ATOM 622 CG1 ILE A 128 -1.419 -13.126 -4.980 1.00 0.00 C ATOM 623 CG2 ILE A 128 0.654 -13.881 -6.202 1.00 0.00 C ATOM 624 CD1 ILE A 128 -2.171 -13.374 -6.270 1.00 0.00 C ATOM 0 H ILE A 128 -2.207 -16.104 -4.971 1.00 0.00 H new ATOM 0 HA ILE A 128 0.600 -15.881 -4.410 1.00 0.00 H new ATOM 0 HB ILE A 128 0.531 -13.380 -4.140 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -2.055 -13.407 -4.141 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -1.221 -12.058 -4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 128 0.819 -12.852 -6.521 1.00 0.00 H new ATOM 0 HG22 ILE A 128 1.614 -14.382 -6.081 1.00 0.00 H new ATOM 0 HG23 ILE A 128 0.064 -14.404 -6.954 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -3.097 -12.800 -6.267 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -1.555 -13.066 -7.115 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -2.403 -14.435 -6.358 1.00 0.00 H new ATOM 636 N THR A 129 -2.211 -15.349 -2.834 1.00 0.00 N ATOM 637 CA THR A 129 -2.867 -15.308 -1.525 1.00 0.00 C ATOM 638 C THR A 129 -2.091 -16.096 -0.472 1.00 0.00 C ATOM 639 O THR A 129 -1.379 -17.048 -0.793 1.00 0.00 O ATOM 640 CB THR A 129 -4.289 -15.864 -1.631 1.00 0.00 C ATOM 641 OG1 THR A 129 -4.270 -17.201 -2.099 1.00 0.00 O ATOM 642 CG2 THR A 129 -5.180 -15.068 -2.558 1.00 0.00 C ATOM 0 H THR A 129 -2.856 -15.427 -3.620 1.00 0.00 H new ATOM 0 HA THR A 129 -2.898 -14.265 -1.211 1.00 0.00 H new ATOM 0 HB THR A 129 -4.697 -15.802 -0.622 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.188 -17.540 -2.159 1.00 0.00 H new ATOM 0 HG21 THR A 129 -6.172 -15.519 -2.585 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.257 -14.042 -2.197 1.00 0.00 H new ATOM 0 HG23 THR A 129 -4.754 -15.068 -3.561 1.00 0.00 H new ATOM 650 N GLU A 130 -2.242 -15.690 0.786 1.00 0.00 N ATOM 651 CA GLU A 130 -1.567 -16.350 1.899 1.00 0.00 C ATOM 652 C GLU A 130 -0.052 -16.186 1.805 1.00 0.00 C ATOM 653 O GLU A 130 0.546 -15.421 2.561 1.00 0.00 O ATOM 654 CB GLU A 130 -1.932 -17.837 1.939 1.00 0.00 C ATOM 655 CG GLU A 130 -3.100 -18.150 2.859 1.00 0.00 C ATOM 656 CD GLU A 130 -3.198 -19.626 3.195 1.00 0.00 C ATOM 657 OE1 GLU A 130 -2.163 -20.221 3.563 1.00 0.00 O ATOM 658 OE2 GLU A 130 -4.309 -20.186 3.088 1.00 0.00 O ATOM 0 H GLU A 130 -2.829 -14.903 1.061 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.904 -15.875 2.821 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -2.175 -18.171 0.930 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -1.062 -18.408 2.263 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -2.995 -17.577 3.781 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -4.027 -17.826 2.386 1.00 0.00 H new ATOM 665 N ASP A 131 0.563 -16.913 0.877 1.00 0.00 N ATOM 666 CA ASP A 131 2.010 -16.853 0.689 1.00 0.00 C ATOM 667 C ASP A 131 2.493 -15.412 0.542 1.00 0.00 C ATOM 668 O ASP A 131 3.206 -14.896 1.402 1.00 0.00 O ATOM 669 CB ASP A 131 2.417 -17.665 -0.542 1.00 0.00 C ATOM 670 CG ASP A 131 2.439 -19.156 -0.270 1.00 0.00 C ATOM 671 OD1 ASP A 131 1.684 -19.608 0.617 1.00 0.00 O ATOM 672 OD2 ASP A 131 3.210 -19.871 -0.943 1.00 0.00 O ATOM 0 H ASP A 131 0.082 -17.551 0.243 1.00 0.00 H new ATOM 0 HA ASP A 131 2.479 -17.280 1.576 1.00 0.00 H new ATOM 0 HB2 ASP A 131 1.723 -17.457 -1.356 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.404 -17.345 -0.875 1.00 0.00 H new ATOM 677 N ASP A 132 2.101 -14.769 -0.553 1.00 0.00 N ATOM 678 CA ASP A 132 2.497 -13.390 -0.813 1.00 0.00 C ATOM 679 C ASP A 132 2.039 -12.464 0.310 1.00 0.00 C ATOM 680 O ASP A 132 2.799 -11.616 0.777 1.00 0.00 O ATOM 681 CB ASP A 132 1.919 -12.915 -2.147 1.00 0.00 C ATOM 682 CG ASP A 132 2.377 -11.517 -2.512 1.00 0.00 C ATOM 683 OD1 ASP A 132 3.598 -11.320 -2.691 1.00 0.00 O ATOM 684 OD2 ASP A 132 1.516 -10.619 -2.619 1.00 0.00 O ATOM 0 H ASP A 132 1.509 -15.181 -1.275 1.00 0.00 H new ATOM 0 HA ASP A 132 3.585 -13.358 -0.861 1.00 0.00 H new ATOM 0 HB2 ASP A 132 2.214 -13.608 -2.935 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.830 -12.936 -2.096 1.00 0.00 H new ATOM 689 N ILE A 133 0.791 -12.630 0.737 1.00 0.00 N ATOM 690 CA ILE A 133 0.232 -11.808 1.802 1.00 0.00 C ATOM 691 C ILE A 133 1.065 -11.908 3.077 1.00 0.00 C ATOM 692 O ILE A 133 1.383 -10.897 3.703 1.00 0.00 O ATOM 693 CB ILE A 133 -1.221 -12.211 2.114 1.00 0.00 C ATOM 694 CG1 ILE A 133 -2.060 -12.180 0.829 1.00 0.00 C ATOM 695 CG2 ILE A 133 -1.806 -11.288 3.175 1.00 0.00 C ATOM 696 CD1 ILE A 133 -3.536 -11.930 1.059 1.00 0.00 C ATOM 0 H ILE A 133 0.148 -13.327 0.361 1.00 0.00 H new ATOM 0 HA ILE A 133 0.248 -10.778 1.447 1.00 0.00 H new ATOM 0 HB ILE A 133 -1.236 -13.228 2.507 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -1.669 -11.403 0.172 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -1.940 -13.129 0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.834 -11.583 3.387 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -1.213 -11.359 4.086 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -1.791 -10.260 2.812 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -4.057 -11.923 0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -3.945 -12.720 1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -3.669 -10.967 1.552 1.00 0.00 H new ATOM 708 N GLU A 134 1.414 -13.132 3.456 1.00 0.00 N ATOM 709 CA GLU A 134 2.208 -13.363 4.657 1.00 0.00 C ATOM 710 C GLU A 134 3.599 -12.749 4.526 1.00 0.00 C ATOM 711 O GLU A 134 4.237 -12.416 5.524 1.00 0.00 O ATOM 712 CB GLU A 134 2.326 -14.863 4.934 1.00 0.00 C ATOM 713 CG GLU A 134 1.244 -15.398 5.859 1.00 0.00 C ATOM 714 CD GLU A 134 1.792 -16.338 6.915 1.00 0.00 C ATOM 715 OE1 GLU A 134 2.670 -15.909 7.693 1.00 0.00 O ATOM 716 OE2 GLU A 134 1.343 -17.502 6.964 1.00 0.00 O ATOM 0 H GLU A 134 1.160 -13.980 2.949 1.00 0.00 H new ATOM 0 HA GLU A 134 1.699 -12.882 5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.283 -15.403 3.988 1.00 0.00 H new ATOM 0 HB3 GLU A 134 3.302 -15.067 5.374 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.742 -14.562 6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.492 -15.920 5.268 1.00 0.00 H new ATOM 723 N GLU A 135 4.067 -12.605 3.290 1.00 0.00 N ATOM 724 CA GLU A 135 5.386 -12.036 3.035 1.00 0.00 C ATOM 725 C GLU A 135 5.333 -10.512 3.008 1.00 0.00 C ATOM 726 O GLU A 135 6.203 -9.843 3.566 1.00 0.00 O ATOM 727 CB GLU A 135 5.944 -12.561 1.711 1.00 0.00 C ATOM 728 CG GLU A 135 6.346 -14.026 1.759 1.00 0.00 C ATOM 729 CD GLU A 135 7.393 -14.309 2.819 1.00 0.00 C ATOM 730 OE1 GLU A 135 8.283 -13.455 3.016 1.00 0.00 O ATOM 731 OE2 GLU A 135 7.322 -15.383 3.452 1.00 0.00 O ATOM 0 H GLU A 135 3.554 -12.874 2.451 1.00 0.00 H new ATOM 0 HA GLU A 135 6.045 -12.341 3.848 1.00 0.00 H new ATOM 0 HB2 GLU A 135 5.195 -12.424 0.931 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.811 -11.964 1.429 1.00 0.00 H new ATOM 0 HG2 GLU A 135 5.463 -14.635 1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 135 6.731 -14.325 0.784 1.00 0.00 H new ATOM 738 N LEU A 136 4.311 -9.966 2.356 1.00 0.00 N ATOM 739 CA LEU A 136 4.157 -8.519 2.261 1.00 0.00 C ATOM 740 C LEU A 136 3.923 -7.902 3.637 1.00 0.00 C ATOM 741 O LEU A 136 4.538 -6.898 3.991 1.00 0.00 O ATOM 742 CB LEU A 136 2.997 -8.161 1.327 1.00 0.00 C ATOM 743 CG LEU A 136 2.652 -6.670 1.265 1.00 0.00 C ATOM 744 CD1 LEU A 136 3.919 -5.833 1.163 1.00 0.00 C ATOM 745 CD2 LEU A 136 1.724 -6.382 0.094 1.00 0.00 C ATOM 0 H LEU A 136 3.580 -10.501 1.888 1.00 0.00 H new ATOM 0 HA LEU A 136 5.081 -8.112 1.851 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.241 -8.504 0.322 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.111 -8.711 1.645 1.00 0.00 H new ATOM 0 HG LEU A 136 2.134 -6.399 2.185 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.655 -4.776 1.120 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.546 -6.015 2.036 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.465 -6.107 0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 136 1.491 -5.318 0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.213 -6.670 -0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 136 0.803 -6.952 0.211 1.00 0.00 H new ATOM 757 N MET A 137 3.025 -8.509 4.404 1.00 0.00 N ATOM 758 CA MET A 137 2.697 -8.025 5.744 1.00 0.00 C ATOM 759 C MET A 137 3.958 -7.686 6.537 1.00 0.00 C ATOM 760 O MET A 137 3.951 -6.782 7.373 1.00 0.00 O ATOM 761 CB MET A 137 1.876 -9.072 6.497 1.00 0.00 C ATOM 762 CG MET A 137 1.044 -8.493 7.631 1.00 0.00 C ATOM 763 SD MET A 137 1.948 -8.425 9.189 1.00 0.00 S ATOM 764 CE MET A 137 0.887 -7.347 10.148 1.00 0.00 C ATOM 0 H MET A 137 2.508 -9.341 4.121 1.00 0.00 H new ATOM 0 HA MET A 137 2.109 -7.114 5.635 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.214 -9.578 5.794 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.549 -9.828 6.901 1.00 0.00 H new ATOM 0 HG2 MET A 137 0.717 -7.489 7.361 1.00 0.00 H new ATOM 0 HG3 MET A 137 0.146 -9.096 7.762 1.00 0.00 H new ATOM 0 HE1 MET A 137 1.339 -7.164 11.123 1.00 0.00 H new ATOM 0 HE2 MET A 137 0.761 -6.400 9.623 1.00 0.00 H new ATOM 0 HE3 MET A 137 -0.086 -7.820 10.283 1.00 0.00 H new ATOM 774 N LYS A 138 5.037 -8.415 6.270 1.00 0.00 N ATOM 775 CA LYS A 138 6.301 -8.185 6.961 1.00 0.00 C ATOM 776 C LYS A 138 6.852 -6.799 6.640 1.00 0.00 C ATOM 777 O LYS A 138 7.541 -6.189 7.457 1.00 0.00 O ATOM 778 CB LYS A 138 7.321 -9.259 6.572 1.00 0.00 C ATOM 779 CG LYS A 138 7.481 -10.352 7.616 1.00 0.00 C ATOM 780 CD LYS A 138 8.548 -9.994 8.638 1.00 0.00 C ATOM 781 CE LYS A 138 9.372 -11.210 9.032 1.00 0.00 C ATOM 782 NZ LYS A 138 10.575 -10.833 9.824 1.00 0.00 N ATOM 0 H LYS A 138 5.062 -9.168 5.582 1.00 0.00 H new ATOM 0 HA LYS A 138 6.117 -8.242 8.034 1.00 0.00 H new ATOM 0 HB2 LYS A 138 7.018 -9.711 5.628 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.288 -8.786 6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 138 6.530 -10.514 8.123 1.00 0.00 H new ATOM 0 HG3 LYS A 138 7.745 -11.289 7.126 1.00 0.00 H new ATOM 0 HD2 LYS A 138 9.204 -9.226 8.227 1.00 0.00 H new ATOM 0 HD3 LYS A 138 8.077 -9.570 9.524 1.00 0.00 H new ATOM 0 HE2 LYS A 138 8.754 -11.894 9.614 1.00 0.00 H new ATOM 0 HE3 LYS A 138 9.682 -11.745 8.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 11.109 -11.690 10.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.178 -10.200 9.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 10.279 -10.345 10.693 1.00 0.00 H new ATOM 796 N ASP A 139 6.543 -6.307 5.444 1.00 0.00 N ATOM 797 CA ASP A 139 7.005 -4.993 5.012 1.00 0.00 C ATOM 798 C ASP A 139 6.216 -3.883 5.701 1.00 0.00 C ATOM 799 O ASP A 139 6.794 -2.927 6.217 1.00 0.00 O ATOM 800 CB ASP A 139 6.875 -4.859 3.494 1.00 0.00 C ATOM 801 CG ASP A 139 8.046 -4.120 2.877 1.00 0.00 C ATOM 802 OD1 ASP A 139 9.181 -4.637 2.951 1.00 0.00 O ATOM 803 OD2 ASP A 139 7.829 -3.023 2.319 1.00 0.00 O ATOM 0 H ASP A 139 5.974 -6.800 4.756 1.00 0.00 H new ATOM 0 HA ASP A 139 8.054 -4.895 5.292 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.800 -5.851 3.049 1.00 0.00 H new ATOM 0 HB3 ASP A 139 5.951 -4.333 3.256 1.00 0.00 H new ATOM 808 N GLY A 140 4.892 -4.016 5.705 1.00 0.00 N ATOM 809 CA GLY A 140 4.046 -3.015 6.334 1.00 0.00 C ATOM 810 C GLY A 140 4.469 -2.709 7.756 1.00 0.00 C ATOM 811 O GLY A 140 4.839 -1.578 8.072 1.00 0.00 O ATOM 0 H GLY A 140 4.390 -4.798 5.284 1.00 0.00 H new ATOM 0 HA2 GLY A 140 4.074 -2.098 5.745 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.013 -3.364 6.333 1.00 0.00 H new ATOM 815 N ASP A 141 4.414 -3.719 8.617 1.00 0.00 N ATOM 816 CA ASP A 141 4.793 -3.553 10.013 1.00 0.00 C ATOM 817 C ASP A 141 6.308 -3.637 10.178 1.00 0.00 C ATOM 818 O ASP A 141 6.858 -4.711 10.419 1.00 0.00 O ATOM 819 CB ASP A 141 4.110 -4.616 10.876 1.00 0.00 C ATOM 820 CG ASP A 141 4.466 -4.487 12.344 1.00 0.00 C ATOM 821 OD1 ASP A 141 4.727 -3.351 12.795 1.00 0.00 O ATOM 822 OD2 ASP A 141 4.483 -5.521 13.044 1.00 0.00 O ATOM 0 H ASP A 141 4.110 -4.661 8.372 1.00 0.00 H new ATOM 0 HA ASP A 141 4.466 -2.566 10.341 1.00 0.00 H new ATOM 0 HB2 ASP A 141 3.029 -4.535 10.759 1.00 0.00 H new ATOM 0 HB3 ASP A 141 4.396 -5.606 10.522 1.00 0.00 H new ATOM 827 N LYS A 142 6.975 -2.495 10.045 1.00 0.00 N ATOM 828 CA LYS A 142 8.426 -2.438 10.178 1.00 0.00 C ATOM 829 C LYS A 142 8.827 -1.967 11.574 1.00 0.00 C ATOM 830 O LYS A 142 9.872 -1.341 11.752 1.00 0.00 O ATOM 831 CB LYS A 142 9.019 -1.503 9.121 1.00 0.00 C ATOM 832 CG LYS A 142 10.289 -2.039 8.480 1.00 0.00 C ATOM 833 CD LYS A 142 9.977 -2.947 7.301 1.00 0.00 C ATOM 834 CE LYS A 142 10.029 -2.188 5.985 1.00 0.00 C ATOM 835 NZ LYS A 142 11.410 -1.740 5.655 1.00 0.00 N ATOM 0 H LYS A 142 6.534 -1.597 9.845 1.00 0.00 H new ATOM 0 HA LYS A 142 8.820 -3.443 10.027 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.275 -1.328 8.344 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.233 -0.538 9.580 1.00 0.00 H new ATOM 0 HG2 LYS A 142 10.908 -1.207 8.146 1.00 0.00 H new ATOM 0 HG3 LYS A 142 10.868 -2.590 9.222 1.00 0.00 H new ATOM 0 HD2 LYS A 142 10.691 -3.771 7.276 1.00 0.00 H new ATOM 0 HD3 LYS A 142 8.988 -3.386 7.430 1.00 0.00 H new ATOM 0 HE2 LYS A 142 9.653 -2.825 5.184 1.00 0.00 H new ATOM 0 HE3 LYS A 142 9.370 -1.322 6.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 11.495 -1.604 4.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 11.609 -0.842 6.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 12.092 -2.461 5.966 1.00 0.00 H new ATOM 849 N ASN A 143 7.990 -2.275 12.560 1.00 0.00 N ATOM 850 CA ASN A 143 8.257 -1.885 13.940 1.00 0.00 C ATOM 851 C ASN A 143 8.539 -3.106 14.815 1.00 0.00 C ATOM 852 O ASN A 143 9.019 -2.974 15.941 1.00 0.00 O ATOM 853 CB ASN A 143 7.070 -1.100 14.506 1.00 0.00 C ATOM 854 CG ASN A 143 7.398 0.364 14.725 1.00 0.00 C ATOM 855 OD1 ASN A 143 8.511 0.711 15.119 1.00 0.00 O ATOM 856 ND2 ASN A 143 6.426 1.233 14.471 1.00 0.00 N ATOM 0 H ASN A 143 7.121 -2.793 12.429 1.00 0.00 H new ATOM 0 HA ASN A 143 9.143 -1.251 13.945 1.00 0.00 H new ATOM 0 HB2 ASN A 143 6.225 -1.182 13.823 1.00 0.00 H new ATOM 0 HB3 ASN A 143 6.760 -1.546 15.451 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.588 2.232 14.601 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.518 0.902 14.146 1.00 0.00 H new ATOM 863 N ASN A 144 8.239 -4.295 14.294 1.00 0.00 N ATOM 864 CA ASN A 144 8.461 -5.533 15.033 1.00 0.00 C ATOM 865 C ASN A 144 7.523 -5.627 16.231 1.00 0.00 C ATOM 866 O ASN A 144 7.900 -6.128 17.290 1.00 0.00 O ATOM 867 CB ASN A 144 9.916 -5.626 15.499 1.00 0.00 C ATOM 868 CG ASN A 144 10.346 -7.054 15.773 1.00 0.00 C ATOM 869 OD1 ASN A 144 10.840 -7.369 16.855 1.00 0.00 O ATOM 870 ND2 ASN A 144 10.160 -7.926 14.789 1.00 0.00 N ATOM 0 H ASN A 144 7.842 -4.425 13.364 1.00 0.00 H new ATOM 0 HA ASN A 144 8.251 -6.367 14.363 1.00 0.00 H new ATOM 0 HB2 ASN A 144 10.566 -5.193 14.739 1.00 0.00 H new ATOM 0 HB3 ASN A 144 10.044 -5.031 16.404 1.00 0.00 H new ATOM 0 HD21 ASN A 144 10.430 -8.901 14.914 1.00 0.00 H new ATOM 0 HD22 ASN A 144 9.747 -7.620 13.908 1.00 0.00 H new ATOM 877 N ASP A 145 6.298 -5.142 16.055 1.00 0.00 N ATOM 878 CA ASP A 145 5.303 -5.172 17.122 1.00 0.00 C ATOM 879 C ASP A 145 4.128 -6.068 16.742 1.00 0.00 C ATOM 880 O ASP A 145 3.595 -6.797 17.579 1.00 0.00 O ATOM 881 CB ASP A 145 4.805 -3.757 17.424 1.00 0.00 C ATOM 882 CG ASP A 145 4.240 -3.068 16.197 1.00 0.00 C ATOM 883 OD1 ASP A 145 4.998 -2.877 15.222 1.00 0.00 O ATOM 884 OD2 ASP A 145 3.041 -2.720 16.211 1.00 0.00 O ATOM 0 H ASP A 145 5.970 -4.724 15.184 1.00 0.00 H new ATOM 0 HA ASP A 145 5.775 -5.581 18.015 1.00 0.00 H new ATOM 0 HB2 ASP A 145 4.038 -3.802 18.197 1.00 0.00 H new ATOM 0 HB3 ASP A 145 5.627 -3.163 17.824 1.00 0.00 H new ATOM 889 N GLY A 146 3.730 -6.009 15.475 1.00 0.00 N ATOM 890 CA GLY A 146 2.623 -6.822 15.007 1.00 0.00 C ATOM 891 C GLY A 146 1.434 -5.990 14.565 1.00 0.00 C ATOM 892 O GLY A 146 0.289 -6.429 14.669 1.00 0.00 O ATOM 0 H GLY A 146 4.154 -5.413 14.764 1.00 0.00 H new ATOM 0 HA2 GLY A 146 2.958 -7.441 14.175 1.00 0.00 H new ATOM 0 HA3 GLY A 146 2.312 -7.499 15.803 1.00 0.00 H new ATOM 896 N ARG A 147 1.705 -4.785 14.072 1.00 0.00 N ATOM 897 CA ARG A 147 0.645 -3.894 13.615 1.00 0.00 C ATOM 898 C ARG A 147 1.220 -2.710 12.841 1.00 0.00 C ATOM 899 O ARG A 147 2.270 -2.174 13.194 1.00 0.00 O ATOM 900 CB ARG A 147 -0.177 -3.396 14.807 1.00 0.00 C ATOM 901 CG ARG A 147 -1.638 -3.809 14.752 1.00 0.00 C ATOM 902 CD ARG A 147 -2.306 -3.674 16.111 1.00 0.00 C ATOM 903 NE ARG A 147 -3.603 -4.346 16.152 1.00 0.00 N ATOM 904 CZ ARG A 147 -4.534 -4.105 17.073 1.00 0.00 C ATOM 905 NH1 ARG A 147 -4.316 -3.212 18.030 1.00 0.00 N ATOM 906 NH2 ARG A 147 -5.687 -4.759 17.036 1.00 0.00 N ATOM 0 H ARG A 147 2.647 -4.405 13.979 1.00 0.00 H new ATOM 0 HA ARG A 147 -0.005 -4.456 12.944 1.00 0.00 H new ATOM 0 HB2 ARG A 147 0.265 -3.777 15.727 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -0.117 -2.309 14.851 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -2.164 -3.192 14.024 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -1.713 -4.841 14.409 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -1.656 -4.094 16.878 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.437 -2.618 16.347 1.00 0.00 H new ATOM 0 HE ARG A 147 -3.807 -5.040 15.433 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -3.431 -2.706 18.063 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -5.033 -3.032 18.733 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -5.860 -5.446 16.302 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.401 -4.575 17.741 1.00 0.00 H new ATOM 920 N ILE A 148 0.520 -2.307 11.784 1.00 0.00 N ATOM 921 CA ILE A 148 0.953 -1.186 10.957 1.00 0.00 C ATOM 922 C ILE A 148 -0.148 -0.132 10.863 1.00 0.00 C ATOM 923 O ILE A 148 -1.281 -0.446 10.515 1.00 0.00 O ATOM 924 CB ILE A 148 1.347 -1.666 9.543 1.00 0.00 C ATOM 925 CG1 ILE A 148 2.234 -0.631 8.849 1.00 0.00 C ATOM 926 CG2 ILE A 148 0.120 -1.976 8.699 1.00 0.00 C ATOM 927 CD1 ILE A 148 1.499 0.625 8.434 1.00 0.00 C ATOM 0 H ILE A 148 -0.351 -2.742 11.480 1.00 0.00 H new ATOM 0 HA ILE A 148 1.829 -0.739 11.428 1.00 0.00 H new ATOM 0 HB ILE A 148 1.915 -2.590 9.653 1.00 0.00 H new ATOM 0 HG12 ILE A 148 3.050 -0.359 9.518 1.00 0.00 H new ATOM 0 HG13 ILE A 148 2.684 -1.086 7.966 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.434 -2.311 7.710 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -0.464 -2.761 9.180 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -0.491 -1.078 8.601 1.00 0.00 H new ATOM 0 HD11 ILE A 148 2.194 1.310 7.949 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.700 0.366 7.739 1.00 0.00 H new ATOM 0 HD13 ILE A 148 1.072 1.105 9.315 1.00 0.00 H new ATOM 939 N ASP A 149 0.184 1.115 11.188 1.00 0.00 N ATOM 940 CA ASP A 149 -0.802 2.193 11.151 1.00 0.00 C ATOM 941 C ASP A 149 -0.460 3.250 10.104 1.00 0.00 C ATOM 942 O ASP A 149 0.540 3.148 9.395 1.00 0.00 O ATOM 943 CB ASP A 149 -0.912 2.855 12.526 1.00 0.00 C ATOM 944 CG ASP A 149 0.442 3.211 13.110 1.00 0.00 C ATOM 945 OD1 ASP A 149 1.324 2.327 13.148 1.00 0.00 O ATOM 946 OD2 ASP A 149 0.620 4.373 13.530 1.00 0.00 O ATOM 0 H ASP A 149 1.119 1.403 11.477 1.00 0.00 H new ATOM 0 HA ASP A 149 -1.757 1.745 10.876 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -1.517 3.758 12.443 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -1.433 2.183 13.208 1.00 0.00 H new ATOM 951 N TYR A 150 -1.320 4.264 10.021 1.00 0.00 N ATOM 952 CA TYR A 150 -1.161 5.368 9.073 1.00 0.00 C ATOM 953 C TYR A 150 0.301 5.794 8.923 1.00 0.00 C ATOM 954 O TYR A 150 0.724 6.213 7.846 1.00 0.00 O ATOM 955 CB TYR A 150 -2.009 6.559 9.531 1.00 0.00 C ATOM 956 CG TYR A 150 -1.929 7.768 8.624 1.00 0.00 C ATOM 957 CD1 TYR A 150 -1.777 7.628 7.251 1.00 0.00 C ATOM 958 CD2 TYR A 150 -2.012 9.053 9.146 1.00 0.00 C ATOM 959 CE1 TYR A 150 -1.708 8.734 6.424 1.00 0.00 C ATOM 960 CE2 TYR A 150 -1.944 10.163 8.326 1.00 0.00 C ATOM 961 CZ TYR A 150 -1.791 9.998 6.967 1.00 0.00 C ATOM 962 OH TYR A 150 -1.723 11.101 6.146 1.00 0.00 O ATOM 0 H TYR A 150 -2.149 4.344 10.610 1.00 0.00 H new ATOM 0 HA TYR A 150 -1.499 5.021 8.096 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.049 6.242 9.603 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -1.694 6.850 10.533 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -1.712 6.639 6.822 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -2.132 9.186 10.211 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -1.590 8.608 5.358 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -2.010 11.155 8.748 1.00 0.00 H new ATOM 0 HH TYR A 150 -1.557 11.901 6.687 1.00 0.00 H new ATOM 972 N ASP A 151 1.065 5.686 10.004 1.00 0.00 N ATOM 973 CA ASP A 151 2.476 6.065 9.980 1.00 0.00 C ATOM 974 C ASP A 151 3.267 5.166 9.034 1.00 0.00 C ATOM 975 O ASP A 151 3.580 5.557 7.910 1.00 0.00 O ATOM 976 CB ASP A 151 3.067 5.998 11.391 1.00 0.00 C ATOM 977 CG ASP A 151 3.509 7.358 11.898 1.00 0.00 C ATOM 978 OD1 ASP A 151 2.891 8.368 11.500 1.00 0.00 O ATOM 979 OD2 ASP A 151 4.472 7.412 12.691 1.00 0.00 O ATOM 0 H ASP A 151 0.735 5.341 10.905 1.00 0.00 H new ATOM 0 HA ASP A 151 2.546 7.090 9.615 1.00 0.00 H new ATOM 0 HB2 ASP A 151 2.325 5.582 12.073 1.00 0.00 H new ATOM 0 HB3 ASP A 151 3.919 5.318 11.393 1.00 0.00 H new ATOM 984 N GLU A 152 3.588 3.960 9.494 1.00 0.00 N ATOM 985 CA GLU A 152 4.343 3.008 8.683 1.00 0.00 C ATOM 986 C GLU A 152 3.684 2.805 7.324 1.00 0.00 C ATOM 987 O GLU A 152 4.346 2.449 6.350 1.00 0.00 O ATOM 988 CB GLU A 152 4.465 1.669 9.411 1.00 0.00 C ATOM 989 CG GLU A 152 5.689 1.572 10.307 1.00 0.00 C ATOM 990 CD GLU A 152 5.434 0.749 11.554 1.00 0.00 C ATOM 991 OE1 GLU A 152 4.765 1.260 12.476 1.00 0.00 O ATOM 992 OE2 GLU A 152 5.904 -0.407 11.608 1.00 0.00 O ATOM 0 H GLU A 152 3.338 3.619 10.422 1.00 0.00 H new ATOM 0 HA GLU A 152 5.340 3.418 8.523 1.00 0.00 H new ATOM 0 HB2 GLU A 152 3.571 1.510 10.013 1.00 0.00 H new ATOM 0 HB3 GLU A 152 4.500 0.866 8.674 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.512 1.129 9.746 1.00 0.00 H new ATOM 0 HG3 GLU A 152 6.004 2.575 10.596 1.00 0.00 H new ATOM 999 N PHE A 153 2.376 3.041 7.262 1.00 0.00 N ATOM 1000 CA PHE A 153 1.634 2.889 6.017 1.00 0.00 C ATOM 1001 C PHE A 153 2.246 3.760 4.924 1.00 0.00 C ATOM 1002 O PHE A 153 2.343 3.349 3.768 1.00 0.00 O ATOM 1003 CB PHE A 153 0.160 3.259 6.231 1.00 0.00 C ATOM 1004 CG PHE A 153 -0.599 3.511 4.957 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.331 2.770 3.818 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -1.574 4.492 4.899 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -1.022 3.003 2.647 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -2.270 4.729 3.729 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.993 3.983 2.601 1.00 0.00 C ATOM 0 H PHE A 153 1.811 3.337 8.058 1.00 0.00 H new ATOM 0 HA PHE A 153 1.691 1.847 5.702 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.330 2.455 6.780 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.107 4.151 6.856 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.427 2.001 3.847 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.793 5.079 5.779 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.803 2.418 1.766 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.029 5.496 3.697 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.535 4.166 1.685 1.00 0.00 H new ATOM 1019 N LEU A 154 2.658 4.962 5.302 1.00 0.00 N ATOM 1020 CA LEU A 154 3.264 5.890 4.358 1.00 0.00 C ATOM 1021 C LEU A 154 4.538 5.303 3.755 1.00 0.00 C ATOM 1022 O LEU A 154 4.984 5.729 2.691 1.00 0.00 O ATOM 1023 CB LEU A 154 3.558 7.224 5.051 1.00 0.00 C ATOM 1024 CG LEU A 154 2.373 7.849 5.799 1.00 0.00 C ATOM 1025 CD1 LEU A 154 2.527 9.361 5.867 1.00 0.00 C ATOM 1026 CD2 LEU A 154 1.047 7.479 5.140 1.00 0.00 C ATOM 0 H LEU A 154 2.584 5.317 6.255 1.00 0.00 H new ATOM 0 HA LEU A 154 2.560 6.064 3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.375 7.075 5.757 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.909 7.934 4.302 1.00 0.00 H new ATOM 0 HG LEU A 154 2.368 7.450 6.813 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.679 9.790 6.401 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.449 9.610 6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.564 9.769 4.857 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.226 7.936 5.692 1.00 0.00 H new ATOM 0 HD22 LEU A 154 1.038 7.840 4.112 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.928 6.396 5.145 1.00 0.00 H new ATOM 1038 N GLU A 155 5.110 4.311 4.433 1.00 0.00 N ATOM 1039 CA GLU A 155 6.321 3.657 3.951 1.00 0.00 C ATOM 1040 C GLU A 155 6.007 2.761 2.752 1.00 0.00 C ATOM 1041 O GLU A 155 6.899 2.390 1.990 1.00 0.00 O ATOM 1042 CB GLU A 155 6.959 2.830 5.068 1.00 0.00 C ATOM 1043 CG GLU A 155 8.479 2.822 5.026 1.00 0.00 C ATOM 1044 CD GLU A 155 9.103 3.128 6.374 1.00 0.00 C ATOM 1045 OE1 GLU A 155 8.839 4.223 6.915 1.00 0.00 O ATOM 1046 OE2 GLU A 155 9.854 2.274 6.889 1.00 0.00 O ATOM 0 H GLU A 155 4.754 3.944 5.316 1.00 0.00 H new ATOM 0 HA GLU A 155 7.024 4.428 3.636 1.00 0.00 H new ATOM 0 HB2 GLU A 155 6.632 3.222 6.031 1.00 0.00 H new ATOM 0 HB3 GLU A 155 6.596 1.804 5.002 1.00 0.00 H new ATOM 0 HG2 GLU A 155 8.824 1.846 4.684 1.00 0.00 H new ATOM 0 HG3 GLU A 155 8.822 3.555 4.296 1.00 0.00 H new ATOM 1053 N PHE A 156 4.730 2.419 2.594 1.00 0.00 N ATOM 1054 CA PHE A 156 4.290 1.571 1.490 1.00 0.00 C ATOM 1055 C PHE A 156 4.467 2.283 0.152 1.00 0.00 C ATOM 1056 O PHE A 156 5.128 1.772 -0.752 1.00 0.00 O ATOM 1057 CB PHE A 156 2.822 1.181 1.682 1.00 0.00 C ATOM 1058 CG PHE A 156 2.549 -0.284 1.494 1.00 0.00 C ATOM 1059 CD1 PHE A 156 2.751 -1.177 2.533 1.00 0.00 C ATOM 1060 CD2 PHE A 156 2.084 -0.766 0.281 1.00 0.00 C ATOM 1061 CE1 PHE A 156 2.494 -2.525 2.366 1.00 0.00 C ATOM 1062 CE2 PHE A 156 1.827 -2.113 0.108 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.031 -2.993 1.152 1.00 0.00 C ATOM 0 H PHE A 156 3.981 2.717 3.219 1.00 0.00 H new ATOM 0 HA PHE A 156 4.905 0.671 1.485 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.507 1.473 2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.211 1.747 0.978 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.113 -0.816 3.484 1.00 0.00 H new ATOM 0 HD2 PHE A 156 1.921 -0.082 -0.538 1.00 0.00 H new ATOM 0 HE1 PHE A 156 2.655 -3.211 3.184 1.00 0.00 H new ATOM 0 HE2 PHE A 156 1.467 -2.477 -0.843 1.00 0.00 H new ATOM 0 HZ PHE A 156 1.829 -4.046 1.020 1.00 0.00 H new ATOM 1073 N MET A 157 3.867 3.463 0.032 1.00 0.00 N ATOM 1074 CA MET A 157 3.951 4.244 -1.197 1.00 0.00 C ATOM 1075 C MET A 157 5.389 4.669 -1.489 1.00 0.00 C ATOM 1076 O MET A 157 5.738 4.949 -2.635 1.00 0.00 O ATOM 1077 CB MET A 157 3.044 5.475 -1.108 1.00 0.00 C ATOM 1078 CG MET A 157 3.589 6.579 -0.215 1.00 0.00 C ATOM 1079 SD MET A 157 4.251 7.970 -1.152 1.00 0.00 S ATOM 1080 CE MET A 157 2.742 8.703 -1.779 1.00 0.00 C ATOM 0 H MET A 157 3.317 3.900 0.772 1.00 0.00 H new ATOM 0 HA MET A 157 3.614 3.612 -2.018 1.00 0.00 H new ATOM 0 HB2 MET A 157 2.891 5.874 -2.111 1.00 0.00 H new ATOM 0 HB3 MET A 157 2.067 5.168 -0.734 1.00 0.00 H new ATOM 0 HG2 MET A 157 2.795 6.934 0.442 1.00 0.00 H new ATOM 0 HG3 MET A 157 4.372 6.171 0.423 1.00 0.00 H new ATOM 0 HE1 MET A 157 2.948 9.714 -2.132 1.00 0.00 H new ATOM 0 HE2 MET A 157 2.361 8.101 -2.604 1.00 0.00 H new ATOM 0 HE3 MET A 157 1.998 8.741 -0.983 1.00 0.00 H new ATOM 1090 N LYS A 158 6.220 4.719 -0.448 1.00 0.00 N ATOM 1091 CA LYS A 158 7.618 5.113 -0.603 1.00 0.00 C ATOM 1092 C LYS A 158 8.264 4.386 -1.780 1.00 0.00 C ATOM 1093 O LYS A 158 9.171 4.911 -2.425 1.00 0.00 O ATOM 1094 CB LYS A 158 8.397 4.829 0.684 1.00 0.00 C ATOM 1095 CG LYS A 158 8.917 6.083 1.368 1.00 0.00 C ATOM 1096 CD LYS A 158 10.319 5.880 1.922 1.00 0.00 C ATOM 1097 CE LYS A 158 11.363 6.604 1.085 1.00 0.00 C ATOM 1098 NZ LYS A 158 12.375 7.292 1.933 1.00 0.00 N ATOM 0 H LYS A 158 5.949 4.492 0.509 1.00 0.00 H new ATOM 0 HA LYS A 158 7.647 6.184 -0.805 1.00 0.00 H new ATOM 0 HB2 LYS A 158 7.753 4.287 1.377 1.00 0.00 H new ATOM 0 HB3 LYS A 158 9.238 4.175 0.453 1.00 0.00 H new ATOM 0 HG2 LYS A 158 8.922 6.910 0.658 1.00 0.00 H new ATOM 0 HG3 LYS A 158 8.243 6.363 2.177 1.00 0.00 H new ATOM 0 HD2 LYS A 158 10.361 6.242 2.949 1.00 0.00 H new ATOM 0 HD3 LYS A 158 10.549 4.815 1.950 1.00 0.00 H new ATOM 0 HE2 LYS A 158 11.863 5.890 0.431 1.00 0.00 H new ATOM 0 HE3 LYS A 158 10.871 7.334 0.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 13.068 7.773 1.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 11.902 7.992 2.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 12.863 6.592 2.528 1.00 0.00 H new ATOM 1112 N GLY A 159 7.783 3.178 -2.059 1.00 0.00 N ATOM 1113 CA GLY A 159 8.317 2.407 -3.164 1.00 0.00 C ATOM 1114 C GLY A 159 7.895 2.969 -4.505 1.00 0.00 C ATOM 1115 O GLY A 159 8.702 3.068 -5.428 1.00 0.00 O ATOM 0 H GLY A 159 7.034 2.721 -1.539 1.00 0.00 H new ATOM 0 HA2 GLY A 159 9.405 2.393 -3.103 1.00 0.00 H new ATOM 0 HA3 GLY A 159 7.979 1.374 -3.082 1.00 0.00 H new ATOM 1119 N VAL A 160 6.624 3.347 -4.608 1.00 0.00 N ATOM 1120 CA VAL A 160 6.091 3.912 -5.838 1.00 0.00 C ATOM 1121 C VAL A 160 6.838 5.185 -6.223 1.00 0.00 C ATOM 1122 O VAL A 160 6.882 5.562 -7.394 1.00 0.00 O ATOM 1123 CB VAL A 160 4.590 4.228 -5.696 1.00 0.00 C ATOM 1124 CG1 VAL A 160 4.026 4.755 -7.003 1.00 0.00 C ATOM 1125 CG2 VAL A 160 3.826 2.995 -5.240 1.00 0.00 C ATOM 0 H VAL A 160 5.945 3.271 -3.851 1.00 0.00 H new ATOM 0 HA VAL A 160 6.226 3.167 -6.622 1.00 0.00 H new ATOM 0 HB VAL A 160 4.474 5.003 -4.939 1.00 0.00 H new ATOM 0 HG11 VAL A 160 2.965 4.972 -6.880 1.00 0.00 H new ATOM 0 HG12 VAL A 160 4.552 5.667 -7.285 1.00 0.00 H new ATOM 0 HG13 VAL A 160 4.155 4.005 -7.784 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.768 3.237 -5.145 1.00 0.00 H new ATOM 0 HG22 VAL A 160 3.952 2.198 -5.972 1.00 0.00 H new ATOM 0 HG23 VAL A 160 4.211 2.665 -4.275 1.00 0.00 H new ATOM 1135 N GLU A 161 7.425 5.845 -5.229 1.00 0.00 N ATOM 1136 CA GLU A 161 8.171 7.076 -5.463 1.00 0.00 C ATOM 1137 C GLU A 161 9.643 6.778 -5.730 1.00 0.00 C ATOM 1138 O GLU A 161 10.410 7.739 -5.947 1.00 0.00 O ATOM 1139 CB GLU A 161 8.038 8.014 -4.262 1.00 0.00 C ATOM 1140 CG GLU A 161 6.855 8.963 -4.359 1.00 0.00 C ATOM 1141 CD GLU A 161 7.190 10.363 -3.882 1.00 0.00 C ATOM 1142 OE1 GLU A 161 8.131 10.969 -4.436 1.00 0.00 O ATOM 1143 OE2 GLU A 161 6.511 10.853 -2.956 1.00 0.00 O ATOM 1144 OXT GLU A 161 10.016 5.586 -5.718 1.00 0.00 O ATOM 0 H GLU A 161 7.398 5.547 -4.254 1.00 0.00 H new ATOM 0 HA GLU A 161 7.752 7.563 -6.344 1.00 0.00 H new ATOM 0 HB2 GLU A 161 7.941 7.418 -3.355 1.00 0.00 H new ATOM 0 HB3 GLU A 161 8.954 8.597 -4.164 1.00 0.00 H new ATOM 0 HG2 GLU A 161 6.513 9.007 -5.393 1.00 0.00 H new ATOM 0 HG3 GLU A 161 6.029 8.569 -3.767 1.00 0.00 H new ATOM 1226 N PHE B 132 4.745 -5.184 -5.622 1.00 0.00 N ATOM 1227 CA PHE B 132 4.438 -5.753 -6.928 1.00 0.00 C ATOM 1228 C PHE B 132 3.381 -4.912 -7.659 1.00 0.00 C ATOM 1229 O PHE B 132 3.582 -3.716 -7.868 1.00 0.00 O ATOM 1230 CB PHE B 132 3.999 -7.218 -6.776 1.00 0.00 C ATOM 1231 CG PHE B 132 3.042 -7.469 -5.641 1.00 0.00 C ATOM 1232 CD1 PHE B 132 3.435 -7.270 -4.326 1.00 0.00 C ATOM 1233 CD2 PHE B 132 1.756 -7.919 -5.888 1.00 0.00 C ATOM 1234 CE1 PHE B 132 2.563 -7.514 -3.282 1.00 0.00 C ATOM 1235 CE2 PHE B 132 0.878 -8.163 -4.849 1.00 0.00 C ATOM 1236 CZ PHE B 132 1.282 -7.960 -3.544 1.00 0.00 C ATOM 0 HA PHE B 132 5.339 -5.735 -7.541 1.00 0.00 H new ATOM 0 HB2 PHE B 132 3.533 -7.543 -7.706 1.00 0.00 H new ATOM 0 HB3 PHE B 132 4.885 -7.836 -6.631 1.00 0.00 H new ATOM 0 HD1 PHE B 132 4.435 -6.920 -4.115 1.00 0.00 H new ATOM 0 HD2 PHE B 132 1.435 -8.081 -6.906 1.00 0.00 H new ATOM 0 HE1 PHE B 132 2.883 -7.356 -2.263 1.00 0.00 H new ATOM 0 HE2 PHE B 132 -0.123 -8.512 -5.057 1.00 0.00 H new ATOM 0 HZ PHE B 132 0.598 -8.150 -2.730 1.00 0.00 H new ATOM 1246 N ASP B 133 2.259 -5.523 -8.048 1.00 0.00 N ATOM 1247 CA ASP B 133 1.204 -4.799 -8.750 1.00 0.00 C ATOM 1248 C ASP B 133 0.668 -3.646 -7.903 1.00 0.00 C ATOM 1249 O ASP B 133 0.030 -2.729 -8.420 1.00 0.00 O ATOM 1250 CB ASP B 133 0.063 -5.750 -9.116 1.00 0.00 C ATOM 1251 CG ASP B 133 0.259 -6.391 -10.476 1.00 0.00 C ATOM 1252 OD1 ASP B 133 1.408 -6.410 -10.963 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -0.738 -6.874 -11.053 1.00 0.00 O ATOM 0 H ASP B 133 2.061 -6.511 -7.889 1.00 0.00 H new ATOM 0 HA ASP B 133 1.632 -4.383 -9.662 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -0.014 -6.529 -8.358 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -0.880 -5.203 -9.108 1.00 0.00 H new ATOM 1258 N LEU B 134 0.930 -3.699 -6.601 1.00 0.00 N ATOM 1259 CA LEU B 134 0.475 -2.663 -5.683 1.00 0.00 C ATOM 1260 C LEU B 134 1.043 -1.303 -6.073 1.00 0.00 C ATOM 1261 O LEU B 134 0.350 -0.287 -6.013 1.00 0.00 O ATOM 1262 CB LEU B 134 0.892 -3.009 -4.252 1.00 0.00 C ATOM 1263 CG LEU B 134 0.091 -4.134 -3.594 1.00 0.00 C ATOM 1264 CD1 LEU B 134 0.062 -5.366 -4.486 1.00 0.00 C ATOM 1265 CD2 LEU B 134 0.677 -4.478 -2.233 1.00 0.00 C ATOM 0 H LEU B 134 1.457 -4.451 -6.158 1.00 0.00 H new ATOM 0 HA LEU B 134 -0.612 -2.612 -5.739 1.00 0.00 H new ATOM 0 HB2 LEU B 134 1.946 -3.289 -4.255 1.00 0.00 H new ATOM 0 HB3 LEU B 134 0.802 -2.113 -3.638 1.00 0.00 H new ATOM 0 HG LEU B 134 -0.933 -3.788 -3.454 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -0.513 -6.154 -3.999 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -0.403 -5.114 -5.439 1.00 0.00 H new ATOM 0 HD13 LEU B 134 1.080 -5.714 -4.659 1.00 0.00 H new ATOM 0 HD21 LEU B 134 0.095 -5.280 -1.779 1.00 0.00 H new ATOM 0 HD22 LEU B 134 1.711 -4.803 -2.353 1.00 0.00 H new ATOM 0 HD23 LEU B 134 0.646 -3.598 -1.590 1.00 0.00 H new ATOM 1277 N ARG B 135 2.310 -1.294 -6.469 1.00 0.00 N ATOM 1278 CA ARG B 135 2.980 -0.062 -6.867 1.00 0.00 C ATOM 1279 C ARG B 135 2.318 0.547 -8.099 1.00 0.00 C ATOM 1280 O ARG B 135 1.943 1.720 -8.098 1.00 0.00 O ATOM 1281 CB ARG B 135 4.459 -0.338 -7.150 1.00 0.00 C ATOM 1282 CG ARG B 135 5.222 0.875 -7.657 1.00 0.00 C ATOM 1283 CD ARG B 135 6.725 0.658 -7.585 1.00 0.00 C ATOM 1284 NE ARG B 135 7.288 0.288 -8.881 1.00 0.00 N ATOM 1285 CZ ARG B 135 7.312 -0.956 -9.354 1.00 0.00 C ATOM 1286 NH1 ARG B 135 6.805 -1.956 -8.643 1.00 0.00 N ATOM 1287 NH2 ARG B 135 7.843 -1.202 -10.544 1.00 0.00 N ATOM 0 H ARG B 135 2.895 -2.128 -6.523 1.00 0.00 H new ATOM 0 HA ARG B 135 2.897 0.652 -6.047 1.00 0.00 H new ATOM 0 HB2 ARG B 135 4.933 -0.699 -6.237 1.00 0.00 H new ATOM 0 HB3 ARG B 135 4.536 -1.138 -7.886 1.00 0.00 H new ATOM 0 HG2 ARG B 135 4.932 1.084 -8.687 1.00 0.00 H new ATOM 0 HG3 ARG B 135 4.951 1.750 -7.066 1.00 0.00 H new ATOM 0 HD2 ARG B 135 7.206 1.569 -7.228 1.00 0.00 H new ATOM 0 HD3 ARG B 135 6.944 -0.124 -6.858 1.00 0.00 H new ATOM 0 HE ARG B 135 7.687 1.028 -9.459 1.00 0.00 H new ATOM 0 HH11 ARG B 135 6.393 -1.774 -7.728 1.00 0.00 H new ATOM 0 HH12 ARG B 135 6.827 -2.907 -9.012 1.00 0.00 H new ATOM 0 HH21 ARG B 135 8.233 -0.438 -11.096 1.00 0.00 H new ATOM 0 HH22 ARG B 135 7.862 -2.155 -10.907 1.00 0.00 H new ATOM 1301 N GLY B 136 2.184 -0.254 -9.151 1.00 0.00 N ATOM 1302 CA GLY B 136 1.573 0.229 -10.375 1.00 0.00 C ATOM 1303 C GLY B 136 0.083 0.468 -10.232 1.00 0.00 C ATOM 1304 O GLY B 136 -0.725 -0.208 -10.868 1.00 0.00 O ATOM 0 H GLY B 136 2.487 -1.228 -9.178 1.00 0.00 H new ATOM 0 HA2 GLY B 136 2.058 1.157 -10.676 1.00 0.00 H new ATOM 0 HA3 GLY B 136 1.746 -0.494 -11.172 1.00 0.00 H new ATOM 1308 N LYS B 137 -0.280 1.436 -9.396 1.00 0.00 N ATOM 1309 CA LYS B 137 -1.682 1.773 -9.167 1.00 0.00 C ATOM 1310 C LYS B 137 -1.810 2.838 -8.083 1.00 0.00 C ATOM 1311 O LYS B 137 -2.684 3.703 -8.147 1.00 0.00 O ATOM 1312 CB LYS B 137 -2.480 0.529 -8.770 1.00 0.00 C ATOM 1313 CG LYS B 137 -1.849 -0.265 -7.638 1.00 0.00 C ATOM 1314 CD LYS B 137 -2.764 -1.384 -7.170 1.00 0.00 C ATOM 1315 CE LYS B 137 -3.530 -0.990 -5.918 1.00 0.00 C ATOM 1316 NZ LYS B 137 -2.618 -0.674 -4.784 1.00 0.00 N ATOM 0 H LYS B 137 0.380 2.003 -8.864 1.00 0.00 H new ATOM 0 HA LYS B 137 -2.088 2.168 -10.098 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -3.485 0.831 -8.474 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -2.585 -0.118 -9.641 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -0.899 -0.684 -7.971 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -1.629 0.400 -6.803 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -3.467 -1.636 -7.964 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -2.174 -2.279 -6.970 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -4.155 -0.123 -6.133 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -4.198 -1.802 -5.631 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -2.847 -1.284 -3.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -1.633 -0.839 -5.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -2.736 0.323 -4.511 1.00 0.00 H new ATOM 1330 N PHE B 138 -0.931 2.768 -7.089 1.00 0.00 N ATOM 1331 CA PHE B 138 -0.939 3.723 -5.987 1.00 0.00 C ATOM 1332 C PHE B 138 -0.807 5.155 -6.501 1.00 0.00 C ATOM 1333 O PHE B 138 -1.314 6.094 -5.887 1.00 0.00 O ATOM 1334 CB PHE B 138 0.198 3.410 -5.010 1.00 0.00 C ATOM 1335 CG PHE B 138 -0.276 3.068 -3.627 1.00 0.00 C ATOM 1336 CD1 PHE B 138 -0.621 1.766 -3.302 1.00 0.00 C ATOM 1337 CD2 PHE B 138 -0.375 4.048 -2.653 1.00 0.00 C ATOM 1338 CE1 PHE B 138 -1.057 1.448 -2.031 1.00 0.00 C ATOM 1339 CE2 PHE B 138 -0.811 3.735 -1.379 1.00 0.00 C ATOM 1340 CZ PHE B 138 -1.152 2.433 -1.068 1.00 0.00 C ATOM 0 H PHE B 138 -0.202 2.058 -7.024 1.00 0.00 H new ATOM 0 HA PHE B 138 -1.893 3.633 -5.468 1.00 0.00 H new ATOM 0 HB2 PHE B 138 0.783 2.578 -5.401 1.00 0.00 H new ATOM 0 HB3 PHE B 138 0.865 4.270 -4.954 1.00 0.00 H new ATOM 0 HD1 PHE B 138 -0.548 0.991 -4.051 1.00 0.00 H new ATOM 0 HD2 PHE B 138 -0.109 5.067 -2.891 1.00 0.00 H new ATOM 0 HE1 PHE B 138 -1.324 0.429 -1.790 1.00 0.00 H new ATOM 0 HE2 PHE B 138 -0.885 4.507 -0.628 1.00 0.00 H new ATOM 0 HZ PHE B 138 -1.492 2.186 -0.073 1.00 0.00 H new