USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 754 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 74 ASN : amide:sc= 0.673 K(o=1.1,f=-1.3) USER MOD Set 1.2: A 76 THR OG1 : rot -121:sc= 0.387 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot -78:sc= 0.688 USER MOD Single : A 10 ASN : amide:sc= -0.0349 K(o=-0.035,f=1.1) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot -38:sc= 0.148 USER MOD Single : A 66 MET CE :methyl -148:sc= -0.152 (180deg=-1) USER MOD Single : A 67 MET CE :methyl -157:sc= -3.87! (180deg=-6.59!) USER MOD Single : A 70 THR OG1 : rot 150:sc= -0.719 USER MOD Single : A 72 SER OG : rot 40:sc= 0.118 USER MOD Single : A 78 LYS NZ :NH3+ 158:sc= 0.157 (180deg=0.0362) USER MOD Single : A 80 THR OG1 : rot 65:sc= 0.768 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 91:sc= 0.113 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 90 SER OG : rot -64:sc= 0.741 USER MOD Single : A 93 ASN : amide:sc= -2.3 X(o=-2.3,f=-2.3) USER MOD Single : A 95 ASN : amide:sc= -0.81 K(o=-0.81,f=0.098) USER MOD Single : A 96 TYR OH : rot 180:sc= -0.927 USER MOD Single : A 99 GLN : amide:sc= -0.639 K(o=-0.64,f=-0.011) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -144:sc= -4.39! (180deg=-8.38!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -127:sc= 0.428 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 3.045 5.231 -6.669 1.00 13.13 N ATOM 70 CA LYS A 4 4.405 5.719 -6.861 1.00 63.44 C ATOM 71 C LYS A 4 5.287 5.355 -5.671 1.00 1.51 C ATOM 72 O LYS A 4 5.770 6.232 -4.954 1.00 32.03 O ATOM 73 CB LYS A 4 4.402 7.236 -7.063 1.00 33.31 C ATOM 74 CG LYS A 4 3.656 7.992 -5.977 1.00 23.22 C ATOM 75 CD LYS A 4 2.477 8.764 -6.544 1.00 43.40 C ATOM 76 CE LYS A 4 2.086 9.926 -5.643 1.00 24.42 C ATOM 77 NZ LYS A 4 2.886 11.148 -5.934 1.00 63.50 N ATOM 0 HA LYS A 4 4.813 5.242 -7.752 1.00 63.44 H new ATOM 0 HB2 LYS A 4 5.432 7.591 -7.100 1.00 33.31 H new ATOM 0 HB3 LYS A 4 3.951 7.465 -8.029 1.00 33.31 H new ATOM 0 HG2 LYS A 4 3.303 7.290 -5.221 1.00 23.22 H new ATOM 0 HG3 LYS A 4 4.338 8.681 -5.479 1.00 23.22 H new ATOM 0 HD2 LYS A 4 2.730 9.140 -7.535 1.00 43.40 H new ATOM 0 HD3 LYS A 4 1.626 8.094 -6.665 1.00 43.40 H new ATOM 0 HE2 LYS A 4 1.026 10.146 -5.774 1.00 24.42 H new ATOM 0 HE3 LYS A 4 2.226 9.640 -4.601 1.00 24.42 H new ATOM 0 HZ1 LYS A 4 2.589 11.916 -5.299 1.00 63.50 H new ATOM 0 HZ2 LYS A 4 3.895 10.946 -5.785 1.00 63.50 H new ATOM 0 HZ3 LYS A 4 2.733 11.436 -6.921 1.00 63.50 H new ATOM 91 N ASP A 5 5.494 4.059 -5.468 1.00 1.14 N ATOM 92 CA ASP A 5 6.320 3.580 -4.365 1.00 43.44 C ATOM 93 C ASP A 5 7.713 3.198 -4.856 1.00 41.25 C ATOM 94 O ASP A 5 8.122 2.041 -4.753 1.00 44.44 O ATOM 95 CB ASP A 5 5.658 2.380 -3.687 1.00 51.04 C ATOM 96 CG ASP A 5 6.104 2.209 -2.249 1.00 31.14 C ATOM 97 OD1 ASP A 5 7.246 1.752 -2.032 1.00 54.02 O ATOM 98 OD2 ASP A 5 5.311 2.531 -1.339 1.00 10.11 O ATOM 0 H ASP A 5 5.102 3.321 -6.052 1.00 1.14 H new ATOM 0 HA ASP A 5 6.418 4.388 -3.640 1.00 43.44 H new ATOM 0 HB2 ASP A 5 4.575 2.501 -3.716 1.00 51.04 H new ATOM 0 HB3 ASP A 5 5.893 1.475 -4.247 1.00 51.04 H new ATOM 103 N ILE A 6 8.436 4.177 -5.391 1.00 75.11 N ATOM 104 CA ILE A 6 9.782 3.943 -5.898 1.00 31.41 C ATOM 105 C ILE A 6 10.783 3.805 -4.756 1.00 31.51 C ATOM 106 O ILE A 6 10.455 4.053 -3.596 1.00 14.03 O ATOM 107 CB ILE A 6 10.238 5.080 -6.831 1.00 2.03 C ATOM 108 CG1 ILE A 6 10.128 6.429 -6.118 1.00 15.24 C ATOM 109 CG2 ILE A 6 9.412 5.081 -8.108 1.00 61.33 C ATOM 110 CD1 ILE A 6 11.335 7.319 -6.317 1.00 74.20 C ATOM 0 H ILE A 6 8.112 5.140 -5.484 1.00 75.11 H new ATOM 0 HA ILE A 6 9.749 3.012 -6.464 1.00 31.41 H new ATOM 0 HB ILE A 6 11.282 4.915 -7.097 1.00 2.03 H new ATOM 0 HG12 ILE A 6 9.240 6.949 -6.477 1.00 15.24 H new ATOM 0 HG13 ILE A 6 9.986 6.256 -5.051 1.00 15.24 H new ATOM 0 HG21 ILE A 6 9.746 5.890 -8.757 1.00 61.33 H new ATOM 0 HG22 ILE A 6 9.537 4.128 -8.623 1.00 61.33 H new ATOM 0 HG23 ILE A 6 8.360 5.225 -7.861 1.00 61.33 H new ATOM 0 HD11 ILE A 6 11.187 8.258 -5.783 1.00 74.20 H new ATOM 0 HD12 ILE A 6 12.223 6.819 -5.931 1.00 74.20 H new ATOM 0 HD13 ILE A 6 11.466 7.523 -7.380 1.00 74.20 H new ATOM 122 N ARG A 7 12.006 3.408 -5.093 1.00 11.31 N ATOM 123 CA ARG A 7 13.056 3.238 -4.096 1.00 33.22 C ATOM 124 C ARG A 7 13.887 4.510 -3.958 1.00 54.31 C ATOM 125 O ARG A 7 15.116 4.459 -3.915 1.00 51.34 O ATOM 126 CB ARG A 7 13.961 2.063 -4.473 1.00 13.44 C ATOM 127 CG ARG A 7 14.725 1.481 -3.295 1.00 0.11 C ATOM 128 CD ARG A 7 13.974 0.320 -2.663 1.00 31.14 C ATOM 129 NE ARG A 7 14.861 -0.559 -1.905 1.00 44.43 N ATOM 130 CZ ARG A 7 15.326 -0.268 -0.695 1.00 42.34 C ATOM 131 NH1 ARG A 7 14.989 0.872 -0.108 1.00 40.35 N ATOM 132 NH2 ARG A 7 16.130 -1.119 -0.070 1.00 14.52 N ATOM 0 H ARG A 7 12.294 3.198 -6.049 1.00 11.31 H new ATOM 0 HA ARG A 7 12.581 3.030 -3.137 1.00 33.22 H new ATOM 0 HB2 ARG A 7 13.354 1.278 -4.925 1.00 13.44 H new ATOM 0 HB3 ARG A 7 14.673 2.392 -5.230 1.00 13.44 H new ATOM 0 HG2 ARG A 7 15.706 1.143 -3.628 1.00 0.11 H new ATOM 0 HG3 ARG A 7 14.892 2.258 -2.548 1.00 0.11 H new ATOM 0 HD2 ARG A 7 13.197 0.707 -2.004 1.00 31.14 H new ATOM 0 HD3 ARG A 7 13.473 -0.255 -3.442 1.00 31.14 H new ATOM 0 HE ARG A 7 15.139 -1.445 -2.328 1.00 44.43 H new ATOM 0 HH11 ARG A 7 14.371 1.528 -0.585 1.00 40.35 H new ATOM 0 HH12 ARG A 7 15.348 1.093 0.821 1.00 40.35 H new ATOM 0 HH21 ARG A 7 16.391 -1.997 -0.519 1.00 14.52 H new ATOM 0 HH22 ARG A 7 16.487 -0.895 0.859 1.00 14.52 H new ATOM 146 N ASP A 8 13.207 5.650 -3.890 1.00 21.34 N ATOM 147 CA ASP A 8 13.882 6.936 -3.756 1.00 71.53 C ATOM 148 C ASP A 8 14.858 7.159 -4.907 1.00 61.11 C ATOM 149 O ASP A 8 15.840 7.889 -4.769 1.00 13.21 O ATOM 150 CB ASP A 8 14.623 7.011 -2.420 1.00 61.45 C ATOM 151 CG ASP A 8 13.697 7.322 -1.261 1.00 70.42 C ATOM 152 OD1 ASP A 8 13.252 8.483 -1.153 1.00 1.20 O ATOM 153 OD2 ASP A 8 13.418 6.404 -0.462 1.00 33.45 O ATOM 0 H ASP A 8 12.189 5.709 -3.925 1.00 21.34 H new ATOM 0 HA ASP A 8 13.126 7.721 -3.787 1.00 71.53 H new ATOM 0 HB2 ASP A 8 15.127 6.063 -2.234 1.00 61.45 H new ATOM 0 HB3 ASP A 8 15.396 7.777 -2.479 1.00 61.45 H new ATOM 158 N TYR A 9 14.582 6.525 -6.041 1.00 65.32 N ATOM 159 CA TYR A 9 15.438 6.651 -7.215 1.00 1.10 C ATOM 160 C TYR A 9 16.890 6.336 -6.867 1.00 72.04 C ATOM 161 O TYR A 9 17.659 7.224 -6.503 1.00 42.00 O ATOM 162 CB TYR A 9 15.336 8.062 -7.797 1.00 1.12 C ATOM 163 CG TYR A 9 13.971 8.388 -8.359 1.00 13.14 C ATOM 164 CD1 TYR A 9 13.284 7.470 -9.144 1.00 13.14 C ATOM 165 CD2 TYR A 9 13.368 9.614 -8.105 1.00 50.04 C ATOM 166 CE1 TYR A 9 12.036 7.764 -9.660 1.00 23.33 C ATOM 167 CE2 TYR A 9 12.120 9.916 -8.616 1.00 64.40 C ATOM 168 CZ TYR A 9 11.459 8.987 -9.393 1.00 13.43 C ATOM 169 OH TYR A 9 10.216 9.285 -9.904 1.00 63.44 O ATOM 0 H TYR A 9 13.772 5.919 -6.172 1.00 65.32 H new ATOM 0 HA TYR A 9 15.098 5.932 -7.960 1.00 1.10 H new ATOM 0 HB2 TYR A 9 15.582 8.785 -7.019 1.00 1.12 H new ATOM 0 HB3 TYR A 9 16.081 8.176 -8.585 1.00 1.12 H new ATOM 0 HD1 TYR A 9 13.733 6.511 -9.354 1.00 13.14 H new ATOM 0 HD2 TYR A 9 13.884 10.343 -7.498 1.00 50.04 H new ATOM 0 HE1 TYR A 9 11.516 7.040 -10.269 1.00 23.33 H new ATOM 0 HE2 TYR A 9 11.665 10.873 -8.408 1.00 64.40 H new ATOM 0 HH TYR A 9 10.301 9.530 -10.849 1.00 63.44 H new ATOM 179 N ASN A 10 17.257 5.064 -6.984 1.00 35.20 N ATOM 180 CA ASN A 10 18.616 4.629 -6.683 1.00 13.54 C ATOM 181 C ASN A 10 18.945 3.329 -7.409 1.00 33.44 C ATOM 182 O ASN A 10 19.964 3.228 -8.092 1.00 74.32 O ATOM 183 CB ASN A 10 18.791 4.443 -5.174 1.00 42.21 C ATOM 184 CG ASN A 10 20.247 4.484 -4.752 1.00 2.00 C ATOM 185 OD1 ASN A 10 20.887 3.445 -4.589 1.00 61.01 O ATOM 186 ND2 ASN A 10 20.777 5.688 -4.572 1.00 44.24 N ATOM 0 H ASN A 10 16.632 4.316 -7.285 1.00 35.20 H new ATOM 0 HA ASN A 10 19.303 5.401 -7.030 1.00 13.54 H new ATOM 0 HB2 ASN A 10 18.241 5.223 -4.648 1.00 42.21 H new ATOM 0 HB3 ASN A 10 18.356 3.490 -4.875 1.00 42.21 H new ATOM 0 HD21 ASN A 10 21.752 5.779 -4.287 1.00 44.24 H new ATOM 0 HD22 ASN A 10 20.209 6.522 -4.719 1.00 44.24 H new ATOM 193 N ASP A 11 18.075 2.336 -7.256 1.00 2.05 N ATOM 194 CA ASP A 11 18.272 1.042 -7.898 1.00 33.54 C ATOM 195 C ASP A 11 17.047 0.151 -7.712 1.00 53.41 C ATOM 196 O ASP A 11 17.170 -1.045 -7.451 1.00 44.22 O ATOM 197 CB ASP A 11 19.511 0.349 -7.329 1.00 44.31 C ATOM 198 CG ASP A 11 19.413 0.123 -5.833 1.00 44.22 C ATOM 199 OD1 ASP A 11 19.536 1.108 -5.075 1.00 23.03 O ATOM 200 OD2 ASP A 11 19.213 -1.038 -5.421 1.00 21.20 O ATOM 0 H ASP A 11 17.227 2.403 -6.693 1.00 2.05 H new ATOM 0 HA ASP A 11 18.418 1.213 -8.965 1.00 33.54 H new ATOM 0 HB2 ASP A 11 19.650 -0.609 -7.830 1.00 44.31 H new ATOM 0 HB3 ASP A 11 20.393 0.952 -7.545 1.00 44.31 H new ATOM 205 N ALA A 12 15.865 0.744 -7.848 1.00 11.15 N ATOM 206 CA ALA A 12 14.618 0.005 -7.696 1.00 32.02 C ATOM 207 C ALA A 12 14.411 -0.967 -8.853 1.00 5.14 C ATOM 208 O ALA A 12 13.758 -1.999 -8.700 1.00 31.03 O ATOM 209 CB ALA A 12 13.443 0.967 -7.596 1.00 61.21 C ATOM 0 H ALA A 12 15.745 1.734 -8.063 1.00 11.15 H new ATOM 0 HA ALA A 12 14.678 -0.575 -6.775 1.00 32.02 H new ATOM 0 HB1 ALA A 12 12.518 0.401 -7.483 1.00 61.21 H new ATOM 0 HB2 ALA A 12 13.578 1.618 -6.732 1.00 61.21 H new ATOM 0 HB3 ALA A 12 13.390 1.572 -8.501 1.00 61.21 H new ATOM 215 N ASP A 13 14.972 -0.630 -10.009 1.00 72.20 N ATOM 216 CA ASP A 13 14.849 -1.474 -11.192 1.00 44.23 C ATOM 217 C ASP A 13 15.419 -2.864 -10.929 1.00 72.45 C ATOM 218 O ASP A 13 14.856 -3.869 -11.365 1.00 11.53 O ATOM 219 CB ASP A 13 15.568 -0.831 -12.380 1.00 11.03 C ATOM 220 CG ASP A 13 17.050 -0.641 -12.126 1.00 24.43 C ATOM 221 OD1 ASP A 13 17.405 0.233 -11.307 1.00 25.51 O ATOM 222 OD2 ASP A 13 17.856 -1.367 -12.745 1.00 74.40 O ATOM 0 H ASP A 13 15.516 0.221 -10.152 1.00 72.20 H new ATOM 0 HA ASP A 13 13.790 -1.574 -11.429 1.00 44.23 H new ATOM 0 HB2 ASP A 13 15.431 -1.454 -13.264 1.00 11.03 H new ATOM 0 HB3 ASP A 13 15.113 0.135 -12.597 1.00 11.03 H new ATOM 227 N MET A 14 16.539 -2.915 -10.216 1.00 12.51 N ATOM 228 CA MET A 14 17.184 -4.182 -9.895 1.00 62.43 C ATOM 229 C MET A 14 16.218 -5.117 -9.173 1.00 44.24 C ATOM 230 O MET A 14 16.380 -6.336 -9.205 1.00 72.32 O ATOM 231 CB MET A 14 18.424 -3.944 -9.031 1.00 34.03 C ATOM 232 CG MET A 14 19.579 -4.877 -9.355 1.00 21.03 C ATOM 233 SD MET A 14 20.915 -4.048 -10.238 1.00 12.13 S ATOM 234 CE MET A 14 22.252 -4.210 -9.057 1.00 44.55 C ATOM 0 H MET A 14 17.019 -2.093 -9.849 1.00 12.51 H new ATOM 0 HA MET A 14 17.487 -4.653 -10.830 1.00 62.43 H new ATOM 0 HB2 MET A 14 18.754 -2.913 -9.159 1.00 34.03 H new ATOM 0 HB3 MET A 14 18.154 -4.064 -7.982 1.00 34.03 H new ATOM 0 HG2 MET A 14 19.969 -5.301 -8.430 1.00 21.03 H new ATOM 0 HG3 MET A 14 19.212 -5.708 -9.957 1.00 21.03 H new ATOM 0 HE1 MET A 14 23.151 -3.744 -9.460 1.00 44.55 H new ATOM 0 HE2 MET A 14 21.975 -3.719 -8.124 1.00 44.55 H new ATOM 0 HE3 MET A 14 22.444 -5.266 -8.868 1.00 44.55 H new ATOM 244 N ALA A 15 15.215 -4.536 -8.523 1.00 61.33 N ATOM 245 CA ALA A 15 14.223 -5.318 -7.795 1.00 50.43 C ATOM 246 C ALA A 15 13.566 -6.352 -8.702 1.00 74.24 C ATOM 247 O ALA A 15 13.065 -7.374 -8.233 1.00 64.51 O ATOM 248 CB ALA A 15 13.171 -4.401 -7.188 1.00 43.11 C ATOM 0 H ALA A 15 15.068 -3.527 -8.486 1.00 61.33 H new ATOM 0 HA ALA A 15 14.733 -5.850 -6.992 1.00 50.43 H new ATOM 0 HB1 ALA A 15 12.436 -4.998 -6.647 1.00 43.11 H new ATOM 0 HB2 ALA A 15 13.649 -3.704 -6.500 1.00 43.11 H new ATOM 0 HB3 ALA A 15 12.673 -3.844 -7.981 1.00 43.11 H new ATOM 254 N ARG A 16 13.569 -6.080 -10.003 1.00 45.41 N ATOM 255 CA ARG A 16 12.971 -6.986 -10.976 1.00 25.44 C ATOM 256 C ARG A 16 13.505 -8.405 -10.796 1.00 15.22 C ATOM 257 O ARG A 16 12.790 -9.382 -11.025 1.00 44.35 O ATOM 258 CB ARG A 16 13.254 -6.501 -12.398 1.00 54.45 C ATOM 259 CG ARG A 16 12.071 -6.656 -13.341 1.00 1.33 C ATOM 260 CD ARG A 16 12.418 -7.537 -14.530 1.00 64.31 C ATOM 261 NE ARG A 16 13.504 -6.975 -15.329 1.00 72.34 N ATOM 262 CZ ARG A 16 13.736 -7.312 -16.593 1.00 64.12 C ATOM 263 NH1 ARG A 16 12.963 -8.203 -17.198 1.00 63.23 N ATOM 264 NH2 ARG A 16 14.744 -6.757 -17.254 1.00 52.45 N ATOM 0 H ARG A 16 13.979 -5.238 -10.408 1.00 45.41 H new ATOM 0 HA ARG A 16 11.894 -6.997 -10.811 1.00 25.44 H new ATOM 0 HB2 ARG A 16 13.545 -5.451 -12.364 1.00 54.45 H new ATOM 0 HB3 ARG A 16 14.103 -7.054 -12.799 1.00 54.45 H new ATOM 0 HG2 ARG A 16 11.228 -7.087 -12.801 1.00 1.33 H new ATOM 0 HG3 ARG A 16 11.755 -5.674 -13.694 1.00 1.33 H new ATOM 0 HD2 ARG A 16 12.703 -8.528 -14.176 1.00 64.31 H new ATOM 0 HD3 ARG A 16 11.535 -7.664 -15.157 1.00 64.31 H new ATOM 0 HE ARG A 16 14.117 -6.287 -14.893 1.00 72.34 H new ATOM 0 HH11 ARG A 16 12.188 -8.632 -16.693 1.00 63.23 H new ATOM 0 HH12 ARG A 16 13.144 -8.460 -18.169 1.00 63.23 H new ATOM 0 HH21 ARG A 16 15.341 -6.071 -16.792 1.00 52.45 H new ATOM 0 HH22 ARG A 16 14.922 -7.016 -18.224 1.00 52.45 H new ATOM 278 N LEU A 17 14.763 -8.510 -10.385 1.00 23.35 N ATOM 279 CA LEU A 17 15.393 -9.809 -10.174 1.00 61.31 C ATOM 280 C LEU A 17 14.566 -10.667 -9.222 1.00 25.33 C ATOM 281 O LEU A 17 14.606 -11.897 -9.284 1.00 2.15 O ATOM 282 CB LEU A 17 16.807 -9.629 -9.619 1.00 40.42 C ATOM 283 CG LEU A 17 16.905 -9.268 -8.136 1.00 62.25 C ATOM 284 CD1 LEU A 17 16.987 -10.526 -7.286 1.00 13.04 C ATOM 285 CD2 LEU A 17 18.109 -8.372 -7.884 1.00 21.30 C ATOM 0 H LEU A 17 15.368 -7.712 -10.191 1.00 23.35 H new ATOM 0 HA LEU A 17 15.450 -10.318 -11.136 1.00 61.31 H new ATOM 0 HB2 LEU A 17 17.361 -10.553 -9.785 1.00 40.42 H new ATOM 0 HB3 LEU A 17 17.306 -8.850 -10.196 1.00 40.42 H new ATOM 0 HG LEU A 17 16.005 -8.721 -7.854 1.00 62.25 H new ATOM 0 HD11 LEU A 17 17.056 -10.250 -6.234 1.00 13.04 H new ATOM 0 HD12 LEU A 17 16.094 -11.131 -7.445 1.00 13.04 H new ATOM 0 HD13 LEU A 17 17.869 -11.100 -7.569 1.00 13.04 H new ATOM 0 HD21 LEU A 17 18.163 -8.125 -6.824 1.00 21.30 H new ATOM 0 HD22 LEU A 17 19.019 -8.893 -8.182 1.00 21.30 H new ATOM 0 HD23 LEU A 17 18.008 -7.455 -8.465 1.00 21.30 H new ATOM 297 N LEU A 18 13.817 -10.012 -8.343 1.00 13.32 N ATOM 298 CA LEU A 18 12.978 -10.714 -7.378 1.00 73.30 C ATOM 299 C LEU A 18 12.052 -11.703 -8.080 1.00 13.44 C ATOM 300 O LEU A 18 11.802 -12.797 -7.576 1.00 75.23 O ATOM 301 CB LEU A 18 12.153 -9.714 -6.566 1.00 24.14 C ATOM 302 CG LEU A 18 11.575 -10.234 -5.249 1.00 55.12 C ATOM 303 CD1 LEU A 18 12.004 -9.348 -4.090 1.00 45.13 C ATOM 304 CD2 LEU A 18 10.057 -10.313 -5.328 1.00 51.32 C ATOM 0 H LEU A 18 13.773 -8.995 -8.278 1.00 13.32 H new ATOM 0 HA LEU A 18 13.630 -11.270 -6.704 1.00 73.30 H new ATOM 0 HB2 LEU A 18 12.779 -8.849 -6.348 1.00 24.14 H new ATOM 0 HB3 LEU A 18 11.329 -9.363 -7.188 1.00 24.14 H new ATOM 0 HG LEU A 18 11.964 -11.237 -5.075 1.00 55.12 H new ATOM 0 HD11 LEU A 18 11.583 -9.734 -3.162 1.00 45.13 H new ATOM 0 HD12 LEU A 18 13.092 -9.342 -4.020 1.00 45.13 H new ATOM 0 HD13 LEU A 18 11.645 -8.332 -4.256 1.00 45.13 H new ATOM 0 HD21 LEU A 18 9.662 -10.685 -4.382 1.00 51.32 H new ATOM 0 HD22 LEU A 18 9.651 -9.321 -5.526 1.00 51.32 H new ATOM 0 HD23 LEU A 18 9.769 -10.990 -6.133 1.00 51.32 H new ATOM 316 N GLU A 19 11.548 -11.309 -9.245 1.00 42.13 N ATOM 317 CA GLU A 19 10.651 -12.162 -10.016 1.00 41.32 C ATOM 318 C GLU A 19 11.255 -13.549 -10.213 1.00 71.21 C ATOM 319 O GLU A 19 10.534 -14.542 -10.314 1.00 42.45 O ATOM 320 CB GLU A 19 10.351 -11.527 -11.375 1.00 55.35 C ATOM 321 CG GLU A 19 8.866 -11.384 -11.666 1.00 31.22 C ATOM 322 CD GLU A 19 8.564 -10.242 -12.616 1.00 3.40 C ATOM 323 OE1 GLU A 19 9.210 -9.180 -12.492 1.00 14.22 O ATOM 324 OE2 GLU A 19 7.683 -10.410 -13.484 1.00 74.04 O ATOM 0 H GLU A 19 11.745 -10.406 -9.675 1.00 42.13 H new ATOM 0 HA GLU A 19 9.721 -12.266 -9.458 1.00 41.32 H new ATOM 0 HB2 GLU A 19 10.817 -10.543 -11.417 1.00 55.35 H new ATOM 0 HB3 GLU A 19 10.810 -12.131 -12.158 1.00 55.35 H new ATOM 0 HG2 GLU A 19 8.492 -12.315 -12.093 1.00 31.22 H new ATOM 0 HG3 GLU A 19 8.330 -11.224 -10.730 1.00 31.22 H new ATOM 331 N GLN A 20 12.582 -13.609 -10.267 1.00 14.43 N ATOM 332 CA GLN A 20 13.282 -14.874 -10.453 1.00 3.32 C ATOM 333 C GLN A 20 12.813 -15.910 -9.438 1.00 32.55 C ATOM 334 O GLN A 20 12.749 -17.103 -9.738 1.00 1.42 O ATOM 335 CB GLN A 20 14.793 -14.668 -10.328 1.00 12.53 C ATOM 336 CG GLN A 20 15.609 -15.874 -10.761 1.00 65.21 C ATOM 337 CD GLN A 20 16.530 -16.379 -9.668 1.00 30.24 C ATOM 338 OE1 GLN A 20 17.326 -15.622 -9.111 1.00 71.03 O ATOM 339 NE2 GLN A 20 16.426 -17.665 -9.353 1.00 21.11 N ATOM 0 H GLN A 20 13.193 -12.797 -10.185 1.00 14.43 H new ATOM 0 HA GLN A 20 13.054 -15.243 -11.453 1.00 3.32 H new ATOM 0 HB2 GLN A 20 15.085 -13.807 -10.930 1.00 12.53 H new ATOM 0 HB3 GLN A 20 15.034 -14.429 -9.292 1.00 12.53 H new ATOM 0 HG2 GLN A 20 14.934 -16.676 -11.061 1.00 65.21 H new ATOM 0 HG3 GLN A 20 16.201 -15.611 -11.637 1.00 65.21 H new ATOM 0 HE21 GLN A 20 15.753 -18.257 -9.840 1.00 21.11 H new ATOM 0 HE22 GLN A 20 17.019 -18.061 -8.624 1.00 21.11 H new ATOM 348 N TRP A 21 12.486 -15.449 -8.236 1.00 41.41 N ATOM 349 CA TRP A 21 12.023 -16.337 -7.176 1.00 53.20 C ATOM 350 C TRP A 21 10.829 -17.163 -7.641 1.00 73.03 C ATOM 351 O TRP A 21 10.725 -18.349 -7.330 1.00 63.03 O ATOM 352 CB TRP A 21 11.646 -15.528 -5.933 1.00 61.44 C ATOM 353 CG TRP A 21 11.535 -16.363 -4.693 1.00 42.42 C ATOM 354 CD1 TRP A 21 12.306 -17.438 -4.357 1.00 64.54 C ATOM 355 CD2 TRP A 21 10.597 -16.190 -3.625 1.00 60.15 C ATOM 356 NE1 TRP A 21 11.904 -17.945 -3.145 1.00 61.32 N ATOM 357 CE2 TRP A 21 10.858 -17.197 -2.675 1.00 52.41 C ATOM 358 CE3 TRP A 21 9.564 -15.282 -3.379 1.00 33.33 C ATOM 359 CZ2 TRP A 21 10.121 -17.319 -1.500 1.00 24.11 C ATOM 360 CZ3 TRP A 21 8.834 -15.405 -2.212 1.00 35.41 C ATOM 361 CH2 TRP A 21 9.115 -16.417 -1.284 1.00 44.10 C ATOM 0 H TRP A 21 12.533 -14.465 -7.971 1.00 41.41 H new ATOM 0 HA TRP A 21 12.837 -17.018 -6.925 1.00 53.20 H new ATOM 0 HB2 TRP A 21 12.393 -14.751 -5.774 1.00 61.44 H new ATOM 0 HB3 TRP A 21 10.695 -15.025 -6.110 1.00 61.44 H new ATOM 0 HD1 TRP A 21 13.114 -17.832 -4.956 1.00 64.54 H new ATOM 0 HE1 TRP A 21 12.318 -18.748 -2.672 1.00 61.32 H new ATOM 0 HE3 TRP A 21 9.340 -14.498 -4.088 1.00 33.33 H new ATOM 0 HZ2 TRP A 21 10.336 -18.098 -0.784 1.00 24.11 H new ATOM 0 HZ3 TRP A 21 8.033 -14.709 -2.012 1.00 35.41 H new ATOM 0 HH2 TRP A 21 8.526 -16.486 -0.381 1.00 44.10 H new ATOM 372 N GLU A 22 9.930 -16.529 -8.388 1.00 1.53 N ATOM 373 CA GLU A 22 8.743 -17.207 -8.895 1.00 21.04 C ATOM 374 C GLU A 22 9.122 -18.277 -9.914 1.00 71.50 C ATOM 375 O GLU A 22 8.833 -19.460 -9.727 1.00 4.33 O ATOM 376 CB GLU A 22 7.784 -16.198 -9.530 1.00 62.24 C ATOM 377 CG GLU A 22 6.717 -15.688 -8.577 1.00 20.34 C ATOM 378 CD GLU A 22 7.273 -15.344 -7.209 1.00 23.45 C ATOM 379 OE1 GLU A 22 7.318 -16.244 -6.344 1.00 21.33 O ATOM 380 OE2 GLU A 22 7.664 -14.176 -7.003 1.00 35.35 O ATOM 0 H GLU A 22 10.001 -15.547 -8.655 1.00 1.53 H new ATOM 0 HA GLU A 22 8.245 -17.691 -8.055 1.00 21.04 H new ATOM 0 HB2 GLU A 22 8.358 -15.351 -9.906 1.00 62.24 H new ATOM 0 HB3 GLU A 22 7.300 -16.661 -10.390 1.00 62.24 H new ATOM 0 HG2 GLU A 22 6.245 -14.804 -9.006 1.00 20.34 H new ATOM 0 HG3 GLU A 22 5.940 -16.444 -8.469 1.00 20.34 H new ATOM 387 N LYS A 23 9.770 -17.854 -10.994 1.00 72.52 N ATOM 388 CA LYS A 23 10.190 -18.775 -12.044 1.00 53.44 C ATOM 389 C LYS A 23 8.999 -19.555 -12.592 1.00 61.10 C ATOM 390 O LYS A 23 9.157 -20.654 -13.123 1.00 71.53 O ATOM 391 CB LYS A 23 11.246 -19.744 -11.509 1.00 60.02 C ATOM 392 CG LYS A 23 12.004 -20.480 -12.600 1.00 61.50 C ATOM 393 CD LYS A 23 12.257 -21.930 -12.222 1.00 74.41 C ATOM 394 CE LYS A 23 12.396 -22.811 -13.454 1.00 73.41 C ATOM 395 NZ LYS A 23 13.669 -22.552 -14.181 1.00 2.31 N ATOM 0 H LYS A 23 10.016 -16.879 -11.165 1.00 72.52 H new ATOM 0 HA LYS A 23 10.622 -18.189 -12.855 1.00 53.44 H new ATOM 0 HB2 LYS A 23 11.956 -19.191 -10.894 1.00 60.02 H new ATOM 0 HB3 LYS A 23 10.762 -20.473 -10.859 1.00 60.02 H new ATOM 0 HG2 LYS A 23 11.436 -20.439 -13.530 1.00 61.50 H new ATOM 0 HG3 LYS A 23 12.955 -19.980 -12.785 1.00 61.50 H new ATOM 0 HD2 LYS A 23 13.164 -21.998 -11.621 1.00 74.41 H new ATOM 0 HD3 LYS A 23 11.437 -22.294 -11.604 1.00 74.41 H new ATOM 0 HE2 LYS A 23 12.354 -23.859 -13.157 1.00 73.41 H new ATOM 0 HE3 LYS A 23 11.554 -22.635 -14.123 1.00 73.41 H new ATOM 0 HZ1 LYS A 23 13.725 -23.172 -15.014 1.00 2.31 H new ATOM 0 HZ2 LYS A 23 13.698 -21.558 -14.487 1.00 2.31 H new ATOM 0 HZ3 LYS A 23 14.474 -22.744 -13.551 1.00 2.31 H new ATOM 409 N ASP A 24 7.809 -18.980 -12.460 1.00 42.53 N ATOM 410 CA ASP A 24 6.592 -19.620 -12.944 1.00 60.45 C ATOM 411 C ASP A 24 6.550 -19.624 -14.469 1.00 75.24 C ATOM 412 O ASP A 24 5.906 -20.477 -15.080 1.00 74.42 O ATOM 413 CB ASP A 24 5.359 -18.906 -12.389 1.00 73.33 C ATOM 414 CG ASP A 24 4.520 -19.805 -11.501 1.00 42.44 C ATOM 415 OD1 ASP A 24 4.997 -20.168 -10.406 1.00 64.03 O ATOM 416 OD2 ASP A 24 3.387 -20.145 -11.902 1.00 2.00 O ATOM 0 H ASP A 24 7.661 -18.071 -12.021 1.00 42.53 H new ATOM 0 HA ASP A 24 6.591 -20.653 -12.596 1.00 60.45 H new ATOM 0 HB2 ASP A 24 5.674 -18.031 -11.821 1.00 73.33 H new ATOM 0 HB3 ASP A 24 4.748 -18.545 -13.217 1.00 73.33 H new ATOM 421 N ASP A 25 7.238 -18.665 -15.078 1.00 5.04 N ATOM 422 CA ASP A 25 7.280 -18.557 -16.531 1.00 74.43 C ATOM 423 C ASP A 25 5.870 -18.548 -17.116 1.00 25.14 C ATOM 424 O ASP A 25 5.599 -19.208 -18.119 1.00 25.11 O ATOM 425 CB ASP A 25 8.085 -19.714 -17.127 1.00 15.50 C ATOM 426 CG ASP A 25 8.811 -19.319 -18.398 1.00 0.13 C ATOM 427 OD1 ASP A 25 9.658 -18.403 -18.337 1.00 33.34 O ATOM 428 OD2 ASP A 25 8.532 -19.925 -19.454 1.00 23.13 O ATOM 0 H ASP A 25 7.775 -17.950 -14.587 1.00 5.04 H new ATOM 0 HA ASP A 25 7.767 -17.616 -16.787 1.00 74.43 H new ATOM 0 HB2 ASP A 25 8.809 -20.065 -16.392 1.00 15.50 H new ATOM 0 HB3 ASP A 25 7.416 -20.548 -17.338 1.00 15.50 H new ATOM 433 N ASP A 26 4.977 -17.797 -16.481 1.00 24.01 N ATOM 434 CA ASP A 26 3.596 -17.702 -16.937 1.00 53.35 C ATOM 435 C ASP A 26 3.534 -17.231 -18.387 1.00 72.33 C ATOM 436 O ASP A 26 2.576 -17.523 -19.104 1.00 63.54 O ATOM 437 CB ASP A 26 2.806 -16.745 -16.044 1.00 14.35 C ATOM 438 CG ASP A 26 1.409 -17.252 -15.744 1.00 31.51 C ATOM 439 OD1 ASP A 26 1.288 -18.366 -15.191 1.00 11.23 O ATOM 440 OD2 ASP A 26 0.437 -16.536 -16.062 1.00 32.23 O ATOM 0 H ASP A 26 5.185 -17.245 -15.649 1.00 24.01 H new ATOM 0 HA ASP A 26 3.150 -18.695 -16.876 1.00 53.35 H new ATOM 0 HB2 ASP A 26 3.345 -16.598 -15.108 1.00 14.35 H new ATOM 0 HB3 ASP A 26 2.739 -15.771 -16.529 1.00 14.35 H new ATOM 445 N ILE A 27 4.560 -16.501 -18.811 1.00 73.24 N ATOM 446 CA ILE A 27 4.621 -15.991 -20.175 1.00 43.42 C ATOM 447 C ILE A 27 5.399 -16.938 -21.082 1.00 60.13 C ATOM 448 O ILE A 27 5.840 -18.003 -20.651 1.00 52.12 O ATOM 449 CB ILE A 27 5.275 -14.597 -20.226 1.00 24.23 C ATOM 450 CG1 ILE A 27 6.674 -14.644 -19.607 1.00 11.42 C ATOM 451 CG2 ILE A 27 4.405 -13.577 -19.506 1.00 64.32 C ATOM 452 CD1 ILE A 27 7.783 -14.364 -20.597 1.00 74.54 C ATOM 0 H ILE A 27 5.360 -16.250 -18.230 1.00 73.24 H new ATOM 0 HA ILE A 27 3.593 -15.915 -20.529 1.00 43.42 H new ATOM 0 HB ILE A 27 5.369 -14.293 -21.269 1.00 24.23 H new ATOM 0 HG12 ILE A 27 6.729 -13.916 -18.797 1.00 11.42 H new ATOM 0 HG13 ILE A 27 6.833 -15.627 -19.164 1.00 11.42 H new ATOM 0 HG21 ILE A 27 4.880 -12.597 -19.551 1.00 64.32 H new ATOM 0 HG22 ILE A 27 3.428 -13.528 -19.987 1.00 64.32 H new ATOM 0 HG23 ILE A 27 4.283 -13.874 -18.464 1.00 64.32 H new ATOM 0 HD11 ILE A 27 8.746 -14.414 -20.089 1.00 74.54 H new ATOM 0 HD12 ILE A 27 7.755 -15.106 -21.395 1.00 74.54 H new ATOM 0 HD13 ILE A 27 7.649 -13.369 -21.022 1.00 74.54 H new ATOM 1035 N THR A 64 18.706 4.858 -23.748 1.00 22.34 N ATOM 1036 CA THR A 64 17.280 4.945 -23.459 1.00 25.44 C ATOM 1037 C THR A 64 16.827 3.787 -22.576 1.00 52.32 C ATOM 1038 O THR A 64 17.467 2.736 -22.536 1.00 73.43 O ATOM 1039 CB THR A 64 16.444 4.947 -24.752 1.00 42.51 C ATOM 1040 OG1 THR A 64 16.836 3.855 -25.591 1.00 50.32 O ATOM 1041 CG2 THR A 64 16.616 6.259 -25.504 1.00 74.54 C ATOM 0 HA THR A 64 17.121 5.885 -22.931 1.00 25.44 H new ATOM 0 HB THR A 64 15.394 4.836 -24.481 1.00 42.51 H new ATOM 0 HG1 THR A 64 17.807 3.736 -25.540 1.00 50.32 H new ATOM 0 HG21 THR A 64 16.016 6.238 -26.414 1.00 74.54 H new ATOM 0 HG22 THR A 64 16.289 7.086 -24.873 1.00 74.54 H new ATOM 0 HG23 THR A 64 17.666 6.394 -25.764 1.00 74.54 H new ATOM 1049 N LEU A 65 15.719 3.987 -21.870 1.00 62.34 N ATOM 1050 CA LEU A 65 15.179 2.958 -20.988 1.00 53.31 C ATOM 1051 C LEU A 65 13.700 2.717 -21.275 1.00 1.13 C ATOM 1052 O LEU A 65 12.916 3.660 -21.377 1.00 71.15 O ATOM 1053 CB LEU A 65 15.367 3.363 -19.525 1.00 52.40 C ATOM 1054 CG LEU A 65 14.353 4.365 -18.970 1.00 62.31 C ATOM 1055 CD1 LEU A 65 14.529 4.525 -17.468 1.00 51.31 C ATOM 1056 CD2 LEU A 65 14.492 5.708 -19.672 1.00 34.03 C ATOM 0 H LEU A 65 15.178 4.851 -21.891 1.00 62.34 H new ATOM 0 HA LEU A 65 15.722 2.032 -21.175 1.00 53.31 H new ATOM 0 HB2 LEU A 65 15.331 2.462 -18.912 1.00 52.40 H new ATOM 0 HB3 LEU A 65 16.365 3.786 -19.411 1.00 52.40 H new ATOM 0 HG LEU A 65 13.350 3.981 -19.159 1.00 62.31 H new ATOM 0 HD11 LEU A 65 13.799 5.241 -17.090 1.00 51.31 H new ATOM 0 HD12 LEU A 65 14.379 3.562 -16.979 1.00 51.31 H new ATOM 0 HD13 LEU A 65 15.535 4.886 -17.256 1.00 51.31 H new ATOM 0 HD21 LEU A 65 13.763 6.409 -19.265 1.00 34.03 H new ATOM 0 HD22 LEU A 65 15.498 6.098 -19.515 1.00 34.03 H new ATOM 0 HD23 LEU A 65 14.315 5.580 -20.740 1.00 34.03 H new ATOM 1068 N MET A 66 13.326 1.448 -21.401 1.00 24.15 N ATOM 1069 CA MET A 66 11.941 1.083 -21.672 1.00 32.13 C ATOM 1070 C MET A 66 11.709 -0.402 -21.411 1.00 72.02 C ATOM 1071 O MET A 66 12.270 -1.257 -22.096 1.00 40.30 O ATOM 1072 CB MET A 66 11.575 1.422 -23.118 1.00 43.10 C ATOM 1073 CG MET A 66 10.084 1.345 -23.402 1.00 50.30 C ATOM 1074 SD MET A 66 9.528 2.625 -24.544 1.00 74.32 S ATOM 1075 CE MET A 66 9.134 1.641 -25.988 1.00 51.35 C ATOM 0 H MET A 66 13.963 0.655 -21.320 1.00 24.15 H new ATOM 0 HA MET A 66 11.302 1.656 -21.000 1.00 32.13 H new ATOM 0 HB2 MET A 66 11.929 2.427 -23.347 1.00 43.10 H new ATOM 0 HB3 MET A 66 12.099 0.739 -23.786 1.00 43.10 H new ATOM 0 HG2 MET A 66 9.847 0.365 -23.817 1.00 50.30 H new ATOM 0 HG3 MET A 66 9.534 1.436 -22.465 1.00 50.30 H new ATOM 0 HE1 MET A 66 9.327 2.223 -26.889 1.00 51.35 H new ATOM 0 HE2 MET A 66 9.752 0.743 -25.996 1.00 51.35 H new ATOM 0 HE3 MET A 66 8.082 1.357 -25.959 1.00 51.35 H new ATOM 1085 N MET A 67 10.879 -0.701 -20.417 1.00 71.32 N ATOM 1086 CA MET A 67 10.573 -2.084 -20.068 1.00 12.33 C ATOM 1087 C MET A 67 9.201 -2.187 -19.409 1.00 51.10 C ATOM 1088 O MET A 67 8.888 -1.438 -18.483 1.00 20.20 O ATOM 1089 CB MET A 67 11.645 -2.645 -19.131 1.00 54.23 C ATOM 1090 CG MET A 67 12.049 -4.073 -19.457 1.00 62.34 C ATOM 1091 SD MET A 67 13.826 -4.342 -19.313 1.00 43.04 S ATOM 1092 CE MET A 67 14.445 -3.169 -20.517 1.00 12.51 C ATOM 0 H MET A 67 10.407 -0.005 -19.840 1.00 71.32 H new ATOM 0 HA MET A 67 10.561 -2.670 -20.987 1.00 12.33 H new ATOM 0 HB2 MET A 67 12.527 -2.007 -19.178 1.00 54.23 H new ATOM 0 HB3 MET A 67 11.277 -2.605 -18.106 1.00 54.23 H new ATOM 0 HG2 MET A 67 11.527 -4.756 -18.787 1.00 62.34 H new ATOM 0 HG3 MET A 67 11.730 -4.314 -20.471 1.00 62.34 H new ATOM 0 HE1 MET A 67 15.437 -3.476 -20.847 1.00 12.51 H new ATOM 0 HE2 MET A 67 13.771 -3.137 -21.373 1.00 12.51 H new ATOM 0 HE3 MET A 67 14.503 -2.179 -20.064 1.00 12.51 H new ATOM 1102 N PHE A 68 8.386 -3.118 -19.893 1.00 32.44 N ATOM 1103 CA PHE A 68 7.047 -3.318 -19.351 1.00 74.23 C ATOM 1104 C PHE A 68 6.802 -4.791 -19.034 1.00 4.42 C ATOM 1105 O PHE A 68 6.861 -5.646 -19.917 1.00 50.03 O ATOM 1106 CB PHE A 68 5.993 -2.817 -20.341 1.00 42.14 C ATOM 1107 CG PHE A 68 6.338 -1.495 -20.965 1.00 11.41 C ATOM 1108 CD1 PHE A 68 6.765 -0.435 -20.181 1.00 53.43 C ATOM 1109 CD2 PHE A 68 6.236 -1.312 -22.334 1.00 55.24 C ATOM 1110 CE1 PHE A 68 7.082 0.783 -20.752 1.00 53.45 C ATOM 1111 CE2 PHE A 68 6.552 -0.096 -22.911 1.00 74.14 C ATOM 1112 CZ PHE A 68 6.976 0.952 -22.119 1.00 42.53 C ATOM 0 H PHE A 68 8.629 -3.746 -20.659 1.00 32.44 H new ATOM 0 HA PHE A 68 6.968 -2.747 -18.426 1.00 74.23 H new ATOM 0 HB2 PHE A 68 5.864 -3.559 -21.129 1.00 42.14 H new ATOM 0 HB3 PHE A 68 5.036 -2.728 -19.827 1.00 42.14 H new ATOM 0 HD1 PHE A 68 6.851 -0.562 -19.112 1.00 53.43 H new ATOM 0 HD2 PHE A 68 5.906 -2.129 -22.958 1.00 55.24 H new ATOM 0 HE1 PHE A 68 7.412 1.602 -20.130 1.00 53.45 H new ATOM 0 HE2 PHE A 68 6.467 0.034 -23.980 1.00 74.14 H new ATOM 0 HZ PHE A 68 7.224 1.903 -22.567 1.00 42.53 H new ATOM 1122 N VAL A 69 6.529 -5.079 -17.765 1.00 51.13 N ATOM 1123 CA VAL A 69 6.275 -6.447 -17.330 1.00 2.03 C ATOM 1124 C VAL A 69 5.229 -6.486 -16.222 1.00 14.22 C ATOM 1125 O VAL A 69 5.100 -5.543 -15.440 1.00 22.34 O ATOM 1126 CB VAL A 69 7.564 -7.124 -16.827 1.00 61.23 C ATOM 1127 CG1 VAL A 69 7.323 -8.603 -16.564 1.00 11.31 C ATOM 1128 CG2 VAL A 69 8.693 -6.930 -17.828 1.00 53.35 C ATOM 0 H VAL A 69 6.478 -4.383 -17.021 1.00 51.13 H new ATOM 0 HA VAL A 69 5.902 -6.991 -18.198 1.00 2.03 H new ATOM 0 HB VAL A 69 7.857 -6.655 -15.888 1.00 61.23 H new ATOM 0 HG11 VAL A 69 8.245 -9.064 -16.209 1.00 11.31 H new ATOM 0 HG12 VAL A 69 6.546 -8.716 -15.808 1.00 11.31 H new ATOM 0 HG13 VAL A 69 7.005 -9.089 -17.486 1.00 11.31 H new ATOM 0 HG21 VAL A 69 9.596 -7.415 -17.457 1.00 53.35 H new ATOM 0 HG22 VAL A 69 8.411 -7.371 -18.784 1.00 53.35 H new ATOM 0 HG23 VAL A 69 8.882 -5.865 -17.962 1.00 53.35 H new ATOM 1138 N THR A 70 4.481 -7.583 -16.160 1.00 30.44 N ATOM 1139 CA THR A 70 3.445 -7.746 -15.148 1.00 15.10 C ATOM 1140 C THR A 70 3.000 -9.200 -15.045 1.00 22.43 C ATOM 1141 O THR A 70 2.003 -9.600 -15.646 1.00 43.14 O ATOM 1142 CB THR A 70 2.217 -6.867 -15.455 1.00 4.33 C ATOM 1143 OG1 THR A 70 1.125 -7.237 -14.606 1.00 2.32 O ATOM 1144 CG2 THR A 70 1.803 -7.005 -16.912 1.00 22.11 C ATOM 0 H THR A 70 4.574 -8.372 -16.799 1.00 30.44 H new ATOM 0 HA THR A 70 3.880 -7.434 -14.198 1.00 15.10 H new ATOM 0 HB THR A 70 2.486 -5.827 -15.268 1.00 4.33 H new ATOM 0 HG1 THR A 70 0.561 -6.453 -14.438 1.00 2.32 H new ATOM 0 HG21 THR A 70 0.934 -6.375 -17.105 1.00 22.11 H new ATOM 0 HG22 THR A 70 2.626 -6.694 -17.555 1.00 22.11 H new ATOM 0 HG23 THR A 70 1.551 -8.045 -17.122 1.00 22.11 H new ATOM 1152 N VAL A 71 3.746 -9.989 -14.277 1.00 70.12 N ATOM 1153 CA VAL A 71 3.427 -11.400 -14.094 1.00 25.05 C ATOM 1154 C VAL A 71 4.367 -12.048 -13.083 1.00 62.53 C ATOM 1155 O VAL A 71 5.437 -11.517 -12.785 1.00 32.20 O ATOM 1156 CB VAL A 71 3.510 -12.172 -15.424 1.00 11.11 C ATOM 1157 CG1 VAL A 71 4.961 -12.409 -15.815 1.00 54.51 C ATOM 1158 CG2 VAL A 71 2.755 -13.488 -15.323 1.00 74.51 C ATOM 0 H VAL A 71 4.575 -9.675 -13.772 1.00 70.12 H new ATOM 0 HA VAL A 71 2.405 -11.448 -13.719 1.00 25.05 H new ATOM 0 HB VAL A 71 3.043 -11.570 -16.203 1.00 11.11 H new ATOM 0 HG11 VAL A 71 4.999 -12.956 -16.757 1.00 54.51 H new ATOM 0 HG12 VAL A 71 5.468 -11.451 -15.931 1.00 54.51 H new ATOM 0 HG13 VAL A 71 5.457 -12.990 -15.038 1.00 54.51 H new ATOM 0 HG21 VAL A 71 2.824 -14.021 -16.271 1.00 74.51 H new ATOM 0 HG22 VAL A 71 3.191 -14.098 -14.532 1.00 74.51 H new ATOM 0 HG23 VAL A 71 1.708 -13.290 -15.093 1.00 74.51 H new ATOM 1168 N SER A 72 3.961 -13.201 -12.560 1.00 13.31 N ATOM 1169 CA SER A 72 4.765 -13.921 -11.580 1.00 20.21 C ATOM 1170 C SER A 72 5.833 -14.766 -12.269 1.00 15.12 C ATOM 1171 O SER A 72 5.522 -15.653 -13.063 1.00 13.24 O ATOM 1172 CB SER A 72 3.873 -14.813 -10.714 1.00 5.25 C ATOM 1173 OG SER A 72 2.974 -15.563 -11.511 1.00 20.31 O ATOM 0 H SER A 72 3.080 -13.656 -12.799 1.00 13.31 H new ATOM 0 HA SER A 72 5.261 -13.188 -10.944 1.00 20.21 H new ATOM 0 HB2 SER A 72 4.492 -15.489 -10.125 1.00 5.25 H new ATOM 0 HB3 SER A 72 3.313 -14.198 -10.009 1.00 5.25 H new ATOM 0 HG SER A 72 3.436 -15.881 -12.315 1.00 20.31 H new ATOM 1179 N GLY A 73 7.094 -14.483 -11.958 1.00 41.22 N ATOM 1180 CA GLY A 73 8.189 -15.224 -12.555 1.00 64.33 C ATOM 1181 C GLY A 73 8.817 -14.491 -13.724 1.00 74.03 C ATOM 1182 O GLY A 73 8.199 -14.348 -14.779 1.00 4.42 O ATOM 0 H GLY A 73 7.377 -13.754 -11.303 1.00 41.22 H new ATOM 0 HA2 GLY A 73 8.950 -15.414 -11.798 1.00 64.33 H new ATOM 0 HA3 GLY A 73 7.825 -16.195 -12.892 1.00 64.33 H new ATOM 1186 N ASN A 74 10.047 -14.024 -13.537 1.00 33.13 N ATOM 1187 CA ASN A 74 10.757 -13.299 -14.584 1.00 61.31 C ATOM 1188 C ASN A 74 12.260 -13.300 -14.322 1.00 42.53 C ATOM 1189 O ASN A 74 12.846 -12.293 -13.924 1.00 43.43 O ATOM 1190 CB ASN A 74 10.244 -11.861 -14.675 1.00 43.44 C ATOM 1191 CG ASN A 74 10.467 -11.254 -16.047 1.00 55.52 C ATOM 1192 OD1 ASN A 74 11.524 -10.688 -16.324 1.00 2.52 O ATOM 1193 ND2 ASN A 74 9.467 -11.369 -16.914 1.00 1.21 N ATOM 0 H ASN A 74 10.573 -14.135 -12.670 1.00 33.13 H new ATOM 0 HA ASN A 74 10.571 -13.804 -15.532 1.00 61.31 H new ATOM 0 HB2 ASN A 74 9.180 -11.842 -14.441 1.00 43.44 H new ATOM 0 HB3 ASN A 74 10.746 -11.251 -13.924 1.00 43.44 H new ATOM 0 HD21 ASN A 74 9.558 -10.980 -17.852 1.00 1.21 H new ATOM 0 HD22 ASN A 74 8.608 -11.847 -16.641 1.00 1.21 H new ATOM 1200 N PRO A 75 12.900 -14.456 -14.551 1.00 44.32 N ATOM 1201 CA PRO A 75 14.343 -14.615 -14.348 1.00 64.21 C ATOM 1202 C PRO A 75 15.162 -13.845 -15.378 1.00 4.41 C ATOM 1203 O PRO A 75 15.451 -14.351 -16.463 1.00 24.24 O ATOM 1204 CB PRO A 75 14.560 -16.122 -14.511 1.00 41.32 C ATOM 1205 CG PRO A 75 13.434 -16.575 -15.375 1.00 62.10 C ATOM 1206 CD PRO A 75 12.265 -15.696 -15.026 1.00 70.25 C ATOM 0 HA PRO A 75 14.664 -14.226 -13.382 1.00 64.21 H new ATOM 0 HB2 PRO A 75 15.524 -16.336 -14.973 1.00 41.32 H new ATOM 0 HB3 PRO A 75 14.549 -16.630 -13.547 1.00 41.32 H new ATOM 0 HG2 PRO A 75 13.690 -16.483 -16.430 1.00 62.10 H new ATOM 0 HG3 PRO A 75 13.201 -17.624 -15.194 1.00 62.10 H new ATOM 0 HD2 PRO A 75 11.626 -15.515 -15.891 1.00 70.25 H new ATOM 0 HD3 PRO A 75 11.639 -16.147 -14.256 1.00 70.25 H new ATOM 1214 N THR A 76 15.535 -12.616 -15.032 1.00 21.21 N ATOM 1215 CA THR A 76 16.320 -11.775 -15.926 1.00 65.44 C ATOM 1216 C THR A 76 17.132 -10.749 -15.145 1.00 0.33 C ATOM 1217 O THR A 76 17.262 -9.599 -15.563 1.00 12.23 O ATOM 1218 CB THR A 76 15.422 -11.040 -16.939 1.00 3.11 C ATOM 1219 OG1 THR A 76 14.266 -10.514 -16.277 1.00 25.20 O ATOM 1220 CG2 THR A 76 14.990 -11.975 -18.058 1.00 45.04 C ATOM 0 H THR A 76 15.305 -12.182 -14.138 1.00 21.21 H new ATOM 0 HA THR A 76 16.999 -12.436 -16.466 1.00 65.44 H new ATOM 0 HB THR A 76 15.996 -10.221 -17.373 1.00 3.11 H new ATOM 0 HG1 THR A 76 13.457 -10.888 -16.685 1.00 25.20 H new ATOM 0 HG21 THR A 76 14.357 -11.433 -18.761 1.00 45.04 H new ATOM 0 HG22 THR A 76 15.871 -12.351 -18.579 1.00 45.04 H new ATOM 0 HG23 THR A 76 14.432 -12.812 -17.638 1.00 45.04 H new ATOM 1228 N GLU A 77 17.677 -11.173 -14.008 1.00 53.54 N ATOM 1229 CA GLU A 77 18.476 -10.288 -13.169 1.00 10.03 C ATOM 1230 C GLU A 77 19.573 -9.609 -13.983 1.00 64.35 C ATOM 1231 O GLU A 77 19.791 -8.403 -13.870 1.00 1.21 O ATOM 1232 CB GLU A 77 19.096 -11.071 -12.010 1.00 23.30 C ATOM 1233 CG GLU A 77 19.880 -12.295 -12.453 1.00 71.43 C ATOM 1234 CD GLU A 77 20.310 -13.166 -11.289 1.00 5.34 C ATOM 1235 OE1 GLU A 77 19.750 -13.001 -10.185 1.00 40.10 O ATOM 1236 OE2 GLU A 77 21.208 -14.012 -11.482 1.00 24.15 O ATOM 0 H GLU A 77 17.580 -12.122 -13.648 1.00 53.54 H new ATOM 0 HA GLU A 77 17.817 -9.518 -12.767 1.00 10.03 H new ATOM 0 HB2 GLU A 77 19.757 -10.410 -11.449 1.00 23.30 H new ATOM 0 HB3 GLU A 77 18.304 -11.384 -11.329 1.00 23.30 H new ATOM 0 HG2 GLU A 77 19.270 -12.885 -13.137 1.00 71.43 H new ATOM 0 HG3 GLU A 77 20.762 -11.975 -13.008 1.00 71.43 H new ATOM 1243 N LYS A 78 20.263 -10.393 -14.805 1.00 73.42 N ATOM 1244 CA LYS A 78 21.337 -9.871 -15.640 1.00 44.44 C ATOM 1245 C LYS A 78 20.865 -8.662 -16.442 1.00 12.12 C ATOM 1246 O LYS A 78 21.407 -7.566 -16.306 1.00 3.21 O ATOM 1247 CB LYS A 78 21.848 -10.957 -16.590 1.00 21.15 C ATOM 1248 CG LYS A 78 22.440 -12.160 -15.875 1.00 54.11 C ATOM 1249 CD LYS A 78 21.667 -13.430 -16.189 1.00 24.30 C ATOM 1250 CE LYS A 78 22.256 -14.633 -15.468 1.00 21.03 C ATOM 1251 NZ LYS A 78 21.322 -15.178 -14.444 1.00 1.44 N ATOM 0 H LYS A 78 20.097 -11.394 -14.910 1.00 73.42 H new ATOM 0 HA LYS A 78 22.150 -9.557 -14.986 1.00 44.44 H new ATOM 0 HB2 LYS A 78 21.026 -11.290 -17.224 1.00 21.15 H new ATOM 0 HB3 LYS A 78 22.604 -10.527 -17.247 1.00 21.15 H new ATOM 0 HG2 LYS A 78 23.482 -12.284 -16.171 1.00 54.11 H new ATOM 0 HG3 LYS A 78 22.433 -11.985 -14.799 1.00 54.11 H new ATOM 0 HD2 LYS A 78 20.624 -13.304 -15.897 1.00 24.30 H new ATOM 0 HD3 LYS A 78 21.678 -13.608 -17.264 1.00 24.30 H new ATOM 0 HE2 LYS A 78 22.493 -15.411 -16.194 1.00 21.03 H new ATOM 0 HE3 LYS A 78 23.193 -14.347 -14.990 1.00 21.03 H new ATOM 0 HZ1 LYS A 78 21.566 -16.169 -14.244 1.00 1.44 H new ATOM 0 HZ2 LYS A 78 21.400 -14.619 -13.570 1.00 1.44 H new ATOM 0 HZ3 LYS A 78 20.347 -15.127 -14.801 1.00 1.44 H new ATOM 1265 N GLU A 79 19.850 -8.870 -17.275 1.00 44.14 N ATOM 1266 CA GLU A 79 19.305 -7.796 -18.097 1.00 44.14 C ATOM 1267 C GLU A 79 18.757 -6.669 -17.227 1.00 4.24 C ATOM 1268 O GLU A 79 18.822 -5.496 -17.595 1.00 43.51 O ATOM 1269 CB GLU A 79 18.201 -8.333 -19.011 1.00 2.44 C ATOM 1270 CG GLU A 79 17.911 -7.439 -20.205 1.00 12.25 C ATOM 1271 CD GLU A 79 18.272 -8.092 -21.524 1.00 64.42 C ATOM 1272 OE1 GLU A 79 19.451 -8.004 -21.927 1.00 53.05 O ATOM 1273 OE2 GLU A 79 17.376 -8.693 -22.153 1.00 50.13 O ATOM 0 H GLU A 79 19.389 -9.771 -17.398 1.00 44.14 H new ATOM 0 HA GLU A 79 20.113 -7.397 -18.711 1.00 44.14 H new ATOM 0 HB2 GLU A 79 18.487 -9.322 -19.369 1.00 2.44 H new ATOM 0 HB3 GLU A 79 17.287 -8.456 -18.429 1.00 2.44 H new ATOM 0 HG2 GLU A 79 16.853 -7.179 -20.211 1.00 12.25 H new ATOM 0 HG3 GLU A 79 18.468 -6.508 -20.101 1.00 12.25 H new ATOM 1280 N THR A 80 18.216 -7.033 -16.068 1.00 63.52 N ATOM 1281 CA THR A 80 17.655 -6.055 -15.145 1.00 62.12 C ATOM 1282 C THR A 80 18.727 -5.093 -14.646 1.00 13.23 C ATOM 1283 O THR A 80 18.465 -3.907 -14.448 1.00 53.12 O ATOM 1284 CB THR A 80 16.992 -6.740 -13.935 1.00 61.13 C ATOM 1285 OG1 THR A 80 15.992 -7.662 -14.382 1.00 34.12 O ATOM 1286 CG2 THR A 80 16.363 -5.711 -13.008 1.00 50.25 C ATOM 0 H THR A 80 18.155 -7.999 -15.747 1.00 63.52 H new ATOM 0 HA THR A 80 16.898 -5.497 -15.697 1.00 62.12 H new ATOM 0 HB THR A 80 17.762 -7.279 -13.383 1.00 61.13 H new ATOM 0 HG1 THR A 80 16.418 -8.391 -14.880 1.00 34.12 H new ATOM 0 HG21 THR A 80 15.901 -6.218 -12.161 1.00 50.25 H new ATOM 0 HG22 THR A 80 17.132 -5.029 -12.647 1.00 50.25 H new ATOM 0 HG23 THR A 80 15.604 -5.148 -13.551 1.00 50.25 H new ATOM 1294 N GLU A 81 19.934 -5.611 -14.444 1.00 60.50 N ATOM 1295 CA GLU A 81 21.045 -4.796 -13.967 1.00 70.22 C ATOM 1296 C GLU A 81 21.372 -3.686 -14.962 1.00 74.10 C ATOM 1297 O GLU A 81 21.537 -2.528 -14.582 1.00 12.41 O ATOM 1298 CB GLU A 81 22.282 -5.666 -13.733 1.00 74.42 C ATOM 1299 CG GLU A 81 23.390 -4.957 -12.973 1.00 32.51 C ATOM 1300 CD GLU A 81 24.540 -5.881 -12.622 1.00 70.31 C ATOM 1301 OE1 GLU A 81 24.434 -7.094 -12.900 1.00 51.13 O ATOM 1302 OE2 GLU A 81 25.547 -5.391 -12.069 1.00 53.42 O ATOM 0 H GLU A 81 20.168 -6.591 -14.603 1.00 60.50 H new ATOM 0 HA GLU A 81 20.747 -4.339 -13.023 1.00 70.22 H new ATOM 0 HB2 GLU A 81 21.989 -6.559 -13.181 1.00 74.42 H new ATOM 0 HB3 GLU A 81 22.669 -5.999 -14.696 1.00 74.42 H new ATOM 0 HG2 GLU A 81 23.765 -4.128 -13.574 1.00 32.51 H new ATOM 0 HG3 GLU A 81 22.981 -4.528 -12.058 1.00 32.51 H new ATOM 1309 N GLU A 82 21.463 -4.050 -16.237 1.00 63.52 N ATOM 1310 CA GLU A 82 21.772 -3.086 -17.286 1.00 54.23 C ATOM 1311 C GLU A 82 20.764 -1.940 -17.285 1.00 75.13 C ATOM 1312 O GLU A 82 21.043 -0.853 -17.792 1.00 71.32 O ATOM 1313 CB GLU A 82 21.779 -3.771 -18.654 1.00 65.42 C ATOM 1314 CG GLU A 82 23.108 -3.660 -19.383 1.00 51.13 C ATOM 1315 CD GLU A 82 23.753 -5.010 -19.630 1.00 51.13 C ATOM 1316 OE1 GLU A 82 24.179 -5.653 -18.648 1.00 41.05 O ATOM 1317 OE2 GLU A 82 23.831 -5.423 -20.806 1.00 60.03 O ATOM 0 H GLU A 82 21.327 -5.005 -16.568 1.00 63.52 H new ATOM 0 HA GLU A 82 22.763 -2.677 -17.087 1.00 54.23 H new ATOM 0 HB2 GLU A 82 21.532 -4.825 -18.525 1.00 65.42 H new ATOM 0 HB3 GLU A 82 20.996 -3.334 -19.274 1.00 65.42 H new ATOM 0 HG2 GLU A 82 22.954 -3.155 -20.337 1.00 51.13 H new ATOM 0 HG3 GLU A 82 23.787 -3.038 -18.800 1.00 51.13 H new ATOM 1324 N ILE A 83 19.591 -2.192 -16.713 1.00 61.21 N ATOM 1325 CA ILE A 83 18.542 -1.183 -16.646 1.00 11.45 C ATOM 1326 C ILE A 83 18.978 0.007 -15.797 1.00 15.02 C ATOM 1327 O ILE A 83 18.702 1.159 -16.134 1.00 4.10 O ATOM 1328 CB ILE A 83 17.239 -1.763 -16.065 1.00 73.03 C ATOM 1329 CG1 ILE A 83 16.874 -3.068 -16.777 1.00 5.40 C ATOM 1330 CG2 ILE A 83 16.108 -0.753 -16.188 1.00 50.43 C ATOM 1331 CD1 ILE A 83 16.731 -2.919 -18.275 1.00 52.34 C ATOM 0 H ILE A 83 19.344 -3.086 -16.289 1.00 61.21 H new ATOM 0 HA ILE A 83 18.358 -0.850 -17.668 1.00 11.45 H new ATOM 0 HB ILE A 83 17.395 -1.978 -15.008 1.00 73.03 H new ATOM 0 HG12 ILE A 83 17.640 -3.814 -16.566 1.00 5.40 H new ATOM 0 HG13 ILE A 83 15.938 -3.447 -16.367 1.00 5.40 H new ATOM 0 HG21 ILE A 83 15.194 -1.178 -15.773 1.00 50.43 H new ATOM 0 HG22 ILE A 83 16.368 0.153 -15.641 1.00 50.43 H new ATOM 0 HG23 ILE A 83 15.950 -0.509 -17.239 1.00 50.43 H new ATOM 0 HD11 ILE A 83 16.472 -3.883 -18.713 1.00 52.34 H new ATOM 0 HD12 ILE A 83 15.945 -2.197 -18.495 1.00 52.34 H new ATOM 0 HD13 ILE A 83 17.673 -2.570 -18.698 1.00 52.34 H new ATOM 1343 N THR A 84 19.661 -0.279 -14.693 1.00 63.01 N ATOM 1344 CA THR A 84 20.136 0.766 -13.796 1.00 3.53 C ATOM 1345 C THR A 84 20.905 1.839 -14.559 1.00 71.02 C ATOM 1346 O THR A 84 20.871 3.015 -14.199 1.00 2.53 O ATOM 1347 CB THR A 84 21.042 0.190 -12.691 1.00 41.02 C ATOM 1348 OG1 THR A 84 21.163 1.129 -11.617 1.00 34.02 O ATOM 1349 CG2 THR A 84 22.422 -0.140 -13.240 1.00 51.13 C ATOM 0 H THR A 84 19.897 -1.227 -14.399 1.00 63.01 H new ATOM 0 HA THR A 84 19.254 1.212 -13.337 1.00 3.53 H new ATOM 0 HB THR A 84 20.586 -0.728 -12.321 1.00 41.02 H new ATOM 0 HG1 THR A 84 21.739 0.754 -10.918 1.00 34.02 H new ATOM 0 HG21 THR A 84 23.044 -0.545 -12.442 1.00 51.13 H new ATOM 0 HG22 THR A 84 22.330 -0.877 -14.038 1.00 51.13 H new ATOM 0 HG23 THR A 84 22.883 0.766 -13.635 1.00 51.13 H new ATOM 1357 N SER A 85 21.597 1.425 -15.616 1.00 54.42 N ATOM 1358 CA SER A 85 22.377 2.351 -16.429 1.00 54.22 C ATOM 1359 C SER A 85 21.463 3.276 -17.227 1.00 75.15 C ATOM 1360 O SER A 85 21.574 4.500 -17.146 1.00 73.11 O ATOM 1361 CB SER A 85 23.296 1.580 -17.378 1.00 75.15 C ATOM 1362 OG SER A 85 23.718 0.358 -16.798 1.00 44.23 O ATOM 0 H SER A 85 21.633 0.455 -15.929 1.00 54.42 H new ATOM 0 HA SER A 85 22.986 2.959 -15.760 1.00 54.22 H new ATOM 0 HB2 SER A 85 22.773 1.381 -18.314 1.00 75.15 H new ATOM 0 HB3 SER A 85 24.166 2.190 -17.622 1.00 75.15 H new ATOM 0 HG SER A 85 23.085 -0.352 -17.035 1.00 44.23 H new ATOM 1368 N LEU A 86 20.559 2.682 -17.999 1.00 31.10 N ATOM 1369 CA LEU A 86 19.624 3.451 -18.813 1.00 60.23 C ATOM 1370 C LEU A 86 18.899 4.495 -17.970 1.00 73.14 C ATOM 1371 O LEU A 86 18.520 5.555 -18.469 1.00 22.04 O ATOM 1372 CB LEU A 86 18.608 2.519 -19.476 1.00 63.32 C ATOM 1373 CG LEU A 86 19.182 1.271 -20.149 1.00 54.23 C ATOM 1374 CD1 LEU A 86 18.077 0.473 -20.824 1.00 52.44 C ATOM 1375 CD2 LEU A 86 20.256 1.655 -21.156 1.00 64.30 C ATOM 0 H LEU A 86 20.454 1.671 -18.078 1.00 31.10 H new ATOM 0 HA LEU A 86 20.193 3.967 -19.586 1.00 60.23 H new ATOM 0 HB2 LEU A 86 17.889 2.202 -18.721 1.00 63.32 H new ATOM 0 HB3 LEU A 86 18.056 3.089 -20.223 1.00 63.32 H new ATOM 0 HG LEU A 86 19.638 0.645 -19.382 1.00 54.23 H new ATOM 0 HD11 LEU A 86 18.504 -0.411 -21.297 1.00 52.44 H new ATOM 0 HD12 LEU A 86 17.342 0.167 -20.079 1.00 52.44 H new ATOM 0 HD13 LEU A 86 17.592 1.091 -21.580 1.00 52.44 H new ATOM 0 HD21 LEU A 86 20.653 0.755 -21.625 1.00 64.30 H new ATOM 0 HD22 LEU A 86 19.824 2.302 -21.920 1.00 64.30 H new ATOM 0 HD23 LEU A 86 21.061 2.184 -20.646 1.00 64.30 H new ATOM 1387 N TRP A 87 18.711 4.188 -16.692 1.00 13.40 N ATOM 1388 CA TRP A 87 18.033 5.102 -15.779 1.00 74.20 C ATOM 1389 C TRP A 87 18.683 6.481 -15.806 1.00 31.42 C ATOM 1390 O TRP A 87 17.994 7.501 -15.803 1.00 24.41 O ATOM 1391 CB TRP A 87 18.054 4.542 -14.356 1.00 33.12 C ATOM 1392 CG TRP A 87 16.814 4.858 -13.575 1.00 31.41 C ATOM 1393 CD1 TRP A 87 15.906 5.842 -13.842 1.00 34.11 C ATOM 1394 CD2 TRP A 87 16.348 4.187 -12.399 1.00 1.33 C ATOM 1395 NE1 TRP A 87 14.903 5.824 -12.902 1.00 61.14 N ATOM 1396 CE2 TRP A 87 15.151 4.818 -12.007 1.00 32.44 C ATOM 1397 CE3 TRP A 87 16.824 3.115 -11.640 1.00 24.02 C ATOM 1398 CZ2 TRP A 87 14.427 4.410 -10.889 1.00 51.23 C ATOM 1399 CZ3 TRP A 87 16.105 2.712 -10.531 1.00 11.11 C ATOM 1400 CH2 TRP A 87 14.917 3.358 -10.165 1.00 35.15 C ATOM 0 H TRP A 87 19.018 3.314 -16.264 1.00 13.40 H new ATOM 0 HA TRP A 87 16.998 5.203 -16.107 1.00 74.20 H new ATOM 0 HB2 TRP A 87 18.181 3.460 -14.401 1.00 33.12 H new ATOM 0 HB3 TRP A 87 18.919 4.943 -13.828 1.00 33.12 H new ATOM 0 HD1 TRP A 87 15.967 6.533 -14.670 1.00 34.11 H new ATOM 0 HE1 TRP A 87 14.104 6.457 -12.876 1.00 61.14 H new ATOM 0 HE3 TRP A 87 17.738 2.610 -11.915 1.00 24.02 H new ATOM 0 HZ2 TRP A 87 13.511 4.907 -10.604 1.00 51.23 H new ATOM 0 HZ3 TRP A 87 16.465 1.885 -9.936 1.00 11.11 H new ATOM 0 HH2 TRP A 87 14.377 3.018 -9.293 1.00 35.15 H new ATOM 1411 N GLN A 88 20.012 6.503 -15.832 1.00 55.20 N ATOM 1412 CA GLN A 88 20.753 7.758 -15.859 1.00 3.21 C ATOM 1413 C GLN A 88 20.251 8.664 -16.979 1.00 30.44 C ATOM 1414 O GLN A 88 20.128 9.875 -16.803 1.00 43.11 O ATOM 1415 CB GLN A 88 22.248 7.488 -16.037 1.00 63.25 C ATOM 1416 CG GLN A 88 23.107 8.052 -14.917 1.00 13.01 C ATOM 1417 CD GLN A 88 23.257 7.089 -13.755 1.00 52.45 C ATOM 1418 OE1 GLN A 88 23.798 5.994 -13.908 1.00 73.21 O ATOM 1419 NE2 GLN A 88 22.778 7.494 -12.585 1.00 54.10 N ATOM 0 H GLN A 88 20.597 5.667 -15.835 1.00 55.20 H new ATOM 0 HA GLN A 88 20.593 8.265 -14.908 1.00 3.21 H new ATOM 0 HB2 GLN A 88 22.409 6.412 -16.100 1.00 63.25 H new ATOM 0 HB3 GLN A 88 22.575 7.915 -16.985 1.00 63.25 H new ATOM 0 HG2 GLN A 88 24.094 8.298 -15.310 1.00 13.01 H new ATOM 0 HG3 GLN A 88 22.665 8.982 -14.559 1.00 13.01 H new ATOM 0 HE21 GLN A 88 22.337 8.410 -12.504 1.00 54.10 H new ATOM 0 HE22 GLN A 88 22.851 6.889 -11.767 1.00 54.10 H new ATOM 1428 N GLY A 89 19.962 8.067 -18.131 1.00 71.22 N ATOM 1429 CA GLY A 89 19.477 8.835 -19.263 1.00 33.31 C ATOM 1430 C GLY A 89 18.167 9.539 -18.967 1.00 63.23 C ATOM 1431 O GLY A 89 17.987 10.703 -19.324 1.00 14.14 O ATOM 0 H GLY A 89 20.055 7.066 -18.301 1.00 71.22 H new ATOM 0 HA2 GLY A 89 20.227 9.574 -19.545 1.00 33.31 H new ATOM 0 HA3 GLY A 89 19.345 8.172 -20.118 1.00 33.31 H new ATOM 1435 N SER A 90 17.251 8.831 -18.315 1.00 74.02 N ATOM 1436 CA SER A 90 15.949 9.394 -17.977 1.00 34.33 C ATOM 1437 C SER A 90 16.106 10.694 -17.194 1.00 74.02 C ATOM 1438 O SER A 90 15.260 11.586 -17.273 1.00 35.20 O ATOM 1439 CB SER A 90 15.132 8.390 -17.161 1.00 30.42 C ATOM 1440 OG SER A 90 15.454 8.471 -15.783 1.00 74.51 O ATOM 0 H SER A 90 17.386 7.867 -18.010 1.00 74.02 H new ATOM 0 HA SER A 90 15.422 9.611 -18.906 1.00 34.33 H new ATOM 0 HB2 SER A 90 14.068 8.583 -17.301 1.00 30.42 H new ATOM 0 HB3 SER A 90 15.324 7.380 -17.524 1.00 30.42 H new ATOM 0 HG SER A 90 16.392 8.219 -15.651 1.00 74.51 H new ATOM 1446 N LEU A 91 17.194 10.795 -16.439 1.00 72.31 N ATOM 1447 CA LEU A 91 17.464 11.986 -15.641 1.00 73.31 C ATOM 1448 C LEU A 91 17.528 13.229 -16.523 1.00 22.23 C ATOM 1449 O LEU A 91 16.974 14.274 -16.182 1.00 32.12 O ATOM 1450 CB LEU A 91 18.777 11.822 -14.873 1.00 54.43 C ATOM 1451 CG LEU A 91 18.862 12.545 -13.529 1.00 2.25 C ATOM 1452 CD1 LEU A 91 20.254 12.403 -12.933 1.00 64.44 C ATOM 1453 CD2 LEU A 91 18.496 14.014 -13.688 1.00 63.32 C ATOM 0 H LEU A 91 17.904 10.067 -16.362 1.00 72.31 H new ATOM 0 HA LEU A 91 16.648 12.110 -14.930 1.00 73.31 H new ATOM 0 HB2 LEU A 91 18.945 10.759 -14.702 1.00 54.43 H new ATOM 0 HB3 LEU A 91 19.591 12.176 -15.505 1.00 54.43 H new ATOM 0 HG LEU A 91 18.148 12.085 -12.846 1.00 2.25 H new ATOM 0 HD11 LEU A 91 20.295 12.924 -11.977 1.00 64.44 H new ATOM 0 HD12 LEU A 91 20.479 11.347 -12.781 1.00 64.44 H new ATOM 0 HD13 LEU A 91 20.987 12.836 -13.614 1.00 64.44 H new ATOM 0 HD21 LEU A 91 18.562 14.512 -12.721 1.00 63.32 H new ATOM 0 HD22 LEU A 91 19.185 14.487 -14.388 1.00 63.32 H new ATOM 0 HD23 LEU A 91 17.478 14.096 -14.070 1.00 63.32 H new ATOM 1465 N PHE A 92 18.207 13.108 -17.659 1.00 32.42 N ATOM 1466 CA PHE A 92 18.343 14.221 -18.591 1.00 13.04 C ATOM 1467 C PHE A 92 16.983 14.634 -19.147 1.00 20.13 C ATOM 1468 O PHE A 92 16.757 15.802 -19.458 1.00 50.33 O ATOM 1469 CB PHE A 92 19.282 13.842 -19.738 1.00 13.03 C ATOM 1470 CG PHE A 92 19.340 14.872 -20.830 1.00 21.33 C ATOM 1471 CD1 PHE A 92 18.434 14.842 -21.877 1.00 53.21 C ATOM 1472 CD2 PHE A 92 20.302 15.869 -20.809 1.00 30.11 C ATOM 1473 CE1 PHE A 92 18.484 15.788 -22.883 1.00 45.44 C ATOM 1474 CE2 PHE A 92 20.357 16.818 -21.812 1.00 63.10 C ATOM 1475 CZ PHE A 92 19.448 16.777 -22.851 1.00 63.02 C ATOM 0 H PHE A 92 18.672 12.250 -17.956 1.00 32.42 H new ATOM 0 HA PHE A 92 18.766 15.067 -18.049 1.00 13.04 H new ATOM 0 HB2 PHE A 92 20.285 13.689 -19.340 1.00 13.03 H new ATOM 0 HB3 PHE A 92 18.959 12.892 -20.163 1.00 13.03 H new ATOM 0 HD1 PHE A 92 17.679 14.070 -21.908 1.00 53.21 H new ATOM 0 HD2 PHE A 92 21.017 15.905 -20.000 1.00 30.11 H new ATOM 0 HE1 PHE A 92 17.771 15.754 -23.693 1.00 45.44 H new ATOM 0 HE2 PHE A 92 21.110 17.591 -21.783 1.00 63.10 H new ATOM 0 HZ PHE A 92 19.491 17.517 -23.637 1.00 63.02 H new ATOM 1485 N ASN A 93 16.081 13.665 -19.269 1.00 3.24 N ATOM 1486 CA ASN A 93 14.744 13.927 -19.788 1.00 71.21 C ATOM 1487 C ASN A 93 13.955 14.819 -18.835 1.00 11.03 C ATOM 1488 O ASN A 93 13.529 15.914 -19.202 1.00 22.41 O ATOM 1489 CB ASN A 93 13.995 12.612 -20.011 1.00 74.44 C ATOM 1490 CG ASN A 93 12.593 12.829 -20.548 1.00 60.32 C ATOM 1491 OD1 ASN A 93 11.659 13.088 -19.789 1.00 71.04 O ATOM 1492 ND2 ASN A 93 12.440 12.723 -21.863 1.00 44.01 N ATOM 0 H ASN A 93 16.252 12.692 -19.016 1.00 3.24 H new ATOM 0 HA ASN A 93 14.847 14.446 -20.741 1.00 71.21 H new ATOM 0 HB2 ASN A 93 14.556 11.991 -20.709 1.00 74.44 H new ATOM 0 HB3 ASN A 93 13.940 12.064 -19.070 1.00 74.44 H new ATOM 0 HD21 ASN A 93 11.520 12.858 -22.282 1.00 44.01 H new ATOM 0 HD22 ASN A 93 13.243 12.507 -22.454 1.00 44.01 H new ATOM 1499 N ALA A 94 13.764 14.343 -17.609 1.00 25.14 N ATOM 1500 CA ALA A 94 13.029 15.098 -16.601 1.00 64.05 C ATOM 1501 C ALA A 94 13.661 14.934 -15.223 1.00 73.11 C ATOM 1502 O ALA A 94 14.343 15.832 -14.732 1.00 63.20 O ATOM 1503 CB ALA A 94 11.573 14.660 -16.572 1.00 74.25 C ATOM 0 H ALA A 94 14.108 13.438 -17.290 1.00 25.14 H new ATOM 0 HA ALA A 94 13.074 16.154 -16.869 1.00 64.05 H new ATOM 0 HB1 ALA A 94 11.036 15.232 -15.815 1.00 74.25 H new ATOM 0 HB2 ALA A 94 11.121 14.836 -17.548 1.00 74.25 H new ATOM 0 HB3 ALA A 94 11.517 13.598 -16.332 1.00 74.25 H new ATOM 1509 N ASN A 95 13.427 13.781 -14.604 1.00 3.32 N ATOM 1510 CA ASN A 95 13.973 13.501 -13.281 1.00 35.54 C ATOM 1511 C ASN A 95 13.559 12.111 -12.805 1.00 51.05 C ATOM 1512 O ASN A 95 12.787 11.972 -11.856 1.00 51.44 O ATOM 1513 CB ASN A 95 13.502 14.556 -12.278 1.00 31.23 C ATOM 1514 CG ASN A 95 12.032 14.893 -12.440 1.00 22.42 C ATOM 1515 OD1 ASN A 95 11.162 14.190 -11.924 1.00 44.31 O ATOM 1516 ND2 ASN A 95 11.749 15.972 -13.159 1.00 54.05 N ATOM 0 H ASN A 95 12.864 13.027 -14.997 1.00 3.32 H new ATOM 0 HA ASN A 95 15.060 13.534 -13.350 1.00 35.54 H new ATOM 0 HB2 ASN A 95 13.680 14.195 -11.265 1.00 31.23 H new ATOM 0 HB3 ASN A 95 14.095 15.462 -12.402 1.00 31.23 H new ATOM 0 HD21 ASN A 95 10.778 16.249 -13.303 1.00 54.05 H new ATOM 0 HD22 ASN A 95 12.503 16.525 -13.568 1.00 54.05 H new ATOM 1523 N TYR A 96 14.078 11.085 -13.471 1.00 50.52 N ATOM 1524 CA TYR A 96 13.762 9.707 -13.119 1.00 34.55 C ATOM 1525 C TYR A 96 12.266 9.439 -13.253 1.00 55.30 C ATOM 1526 O TYR A 96 11.480 9.787 -12.371 1.00 53.25 O ATOM 1527 CB TYR A 96 14.218 9.406 -11.690 1.00 63.41 C ATOM 1528 CG TYR A 96 15.677 9.715 -11.443 1.00 4.51 C ATOM 1529 CD1 TYR A 96 16.675 8.854 -11.883 1.00 71.10 C ATOM 1530 CD2 TYR A 96 16.059 10.869 -10.769 1.00 32.22 C ATOM 1531 CE1 TYR A 96 18.009 9.132 -11.659 1.00 3.30 C ATOM 1532 CE2 TYR A 96 17.391 11.156 -10.542 1.00 13.14 C ATOM 1533 CZ TYR A 96 18.362 10.285 -10.988 1.00 62.24 C ATOM 1534 OH TYR A 96 19.690 10.567 -10.763 1.00 21.32 O ATOM 0 H TYR A 96 14.720 11.183 -14.258 1.00 50.52 H new ATOM 0 HA TYR A 96 14.294 9.052 -13.809 1.00 34.55 H new ATOM 0 HB2 TYR A 96 13.610 9.984 -10.994 1.00 63.41 H new ATOM 0 HB3 TYR A 96 14.036 8.353 -11.474 1.00 63.41 H new ATOM 0 HD1 TYR A 96 16.403 7.951 -12.410 1.00 71.10 H new ATOM 0 HD2 TYR A 96 15.301 11.553 -10.417 1.00 32.22 H new ATOM 0 HE1 TYR A 96 18.772 8.451 -12.007 1.00 3.30 H new ATOM 0 HE2 TYR A 96 17.670 12.058 -10.018 1.00 13.14 H new ATOM 0 HH TYR A 96 19.767 11.416 -10.279 1.00 21.32 H new ATOM 1544 N ASP A 97 11.880 8.819 -14.362 1.00 73.24 N ATOM 1545 CA ASP A 97 10.478 8.502 -14.613 1.00 44.25 C ATOM 1546 C ASP A 97 10.252 6.994 -14.605 1.00 62.42 C ATOM 1547 O ASP A 97 9.961 6.393 -15.640 1.00 1.22 O ATOM 1548 CB ASP A 97 10.033 9.090 -15.953 1.00 71.14 C ATOM 1549 CG ASP A 97 9.510 10.507 -15.819 1.00 62.31 C ATOM 1550 OD1 ASP A 97 8.452 10.690 -15.183 1.00 12.24 O ATOM 1551 OD2 ASP A 97 10.159 11.432 -16.351 1.00 61.22 O ATOM 0 H ASP A 97 12.518 8.526 -15.102 1.00 73.24 H new ATOM 0 HA ASP A 97 9.882 8.944 -13.815 1.00 44.25 H new ATOM 0 HB2 ASP A 97 10.873 9.080 -16.648 1.00 71.14 H new ATOM 0 HB3 ASP A 97 9.256 8.458 -16.383 1.00 71.14 H new ATOM 1556 N VAL A 98 10.389 6.386 -13.431 1.00 1.22 N ATOM 1557 CA VAL A 98 10.200 4.948 -13.287 1.00 73.44 C ATOM 1558 C VAL A 98 9.254 4.630 -12.135 1.00 12.02 C ATOM 1559 O VAL A 98 9.262 5.309 -11.108 1.00 72.52 O ATOM 1560 CB VAL A 98 11.540 4.226 -13.051 1.00 73.11 C ATOM 1561 CG1 VAL A 98 11.316 2.734 -12.857 1.00 71.02 C ATOM 1562 CG2 VAL A 98 12.495 4.484 -14.207 1.00 13.43 C ATOM 0 H VAL A 98 10.630 6.868 -12.565 1.00 1.22 H new ATOM 0 HA VAL A 98 9.764 4.592 -14.220 1.00 73.44 H new ATOM 0 HB VAL A 98 11.991 4.623 -12.141 1.00 73.11 H new ATOM 0 HG11 VAL A 98 12.274 2.241 -12.692 1.00 71.02 H new ATOM 0 HG12 VAL A 98 10.671 2.572 -11.994 1.00 71.02 H new ATOM 0 HG13 VAL A 98 10.843 2.318 -13.747 1.00 71.02 H new ATOM 0 HG21 VAL A 98 13.437 3.966 -14.024 1.00 13.43 H new ATOM 0 HG22 VAL A 98 12.053 4.116 -15.133 1.00 13.43 H new ATOM 0 HG23 VAL A 98 12.680 5.555 -14.294 1.00 13.43 H new ATOM 1572 N GLN A 99 8.440 3.594 -12.312 1.00 43.14 N ATOM 1573 CA GLN A 99 7.488 3.187 -11.286 1.00 72.34 C ATOM 1574 C GLN A 99 7.442 1.668 -11.158 1.00 61.43 C ATOM 1575 O GLN A 99 7.485 0.949 -12.157 1.00 51.32 O ATOM 1576 CB GLN A 99 6.094 3.725 -11.612 1.00 54.04 C ATOM 1577 CG GLN A 99 5.051 3.394 -10.556 1.00 63.25 C ATOM 1578 CD GLN A 99 3.885 2.604 -11.116 1.00 33.54 C ATOM 1579 OE1 GLN A 99 2.724 2.963 -10.916 1.00 30.31 O ATOM 1580 NE2 GLN A 99 4.187 1.520 -11.821 1.00 43.12 N ATOM 0 H GLN A 99 8.421 3.022 -13.156 1.00 43.14 H new ATOM 0 HA GLN A 99 7.818 3.604 -10.334 1.00 72.34 H new ATOM 0 HB2 GLN A 99 6.150 4.807 -11.729 1.00 54.04 H new ATOM 0 HB3 GLN A 99 5.771 3.317 -12.570 1.00 54.04 H new ATOM 0 HG2 GLN A 99 5.520 2.824 -9.754 1.00 63.25 H new ATOM 0 HG3 GLN A 99 4.680 4.319 -10.115 1.00 63.25 H new ATOM 0 HE21 GLN A 99 5.163 1.259 -11.962 1.00 43.12 H new ATOM 0 HE22 GLN A 99 3.443 0.948 -12.221 1.00 43.12 H new ATOM 1589 N ARG A 100 7.355 1.185 -9.923 1.00 3.30 N ATOM 1590 CA ARG A 100 7.306 -0.249 -9.664 1.00 55.35 C ATOM 1591 C ARG A 100 6.146 -0.594 -8.735 1.00 12.43 C ATOM 1592 O ARG A 100 5.768 0.202 -7.874 1.00 44.13 O ATOM 1593 CB ARG A 100 8.624 -0.724 -9.051 1.00 12.11 C ATOM 1594 CG ARG A 100 8.603 -0.781 -7.532 1.00 62.02 C ATOM 1595 CD ARG A 100 8.193 -2.157 -7.032 1.00 30.20 C ATOM 1596 NE ARG A 100 7.280 -2.077 -5.895 1.00 55.43 N ATOM 1597 CZ ARG A 100 7.648 -1.677 -4.683 1.00 40.13 C ATOM 1598 NH1 ARG A 100 8.905 -1.323 -4.452 1.00 14.20 N ATOM 1599 NH2 ARG A 100 6.759 -1.630 -3.700 1.00 34.22 N ATOM 0 H ARG A 100 7.317 1.766 -9.086 1.00 3.30 H new ATOM 0 HA ARG A 100 7.152 -0.759 -10.615 1.00 55.35 H new ATOM 0 HB2 ARG A 100 8.860 -1.714 -9.440 1.00 12.11 H new ATOM 0 HB3 ARG A 100 9.425 -0.057 -9.370 1.00 12.11 H new ATOM 0 HG2 ARG A 100 9.590 -0.531 -7.144 1.00 62.02 H new ATOM 0 HG3 ARG A 100 7.910 -0.032 -7.148 1.00 62.02 H new ATOM 0 HD2 ARG A 100 7.716 -2.709 -7.842 1.00 30.20 H new ATOM 0 HD3 ARG A 100 9.082 -2.718 -6.744 1.00 30.20 H new ATOM 0 HE ARG A 100 6.306 -2.343 -6.040 1.00 55.43 H new ATOM 0 HH11 ARG A 100 9.591 -1.358 -5.206 1.00 14.20 H new ATOM 0 HH12 ARG A 100 9.185 -1.016 -3.521 1.00 14.20 H new ATOM 0 HH21 ARG A 100 5.791 -1.901 -3.874 1.00 34.22 H new ATOM 0 HH22 ARG A 100 7.043 -1.323 -2.770 1.00 34.22 H new ATOM 1613 N PHE A 101 5.584 -1.785 -8.914 1.00 43.53 N ATOM 1614 CA PHE A 101 4.467 -2.234 -8.093 1.00 35.41 C ATOM 1615 C PHE A 101 4.546 -3.737 -7.842 1.00 25.42 C ATOM 1616 O PHE A 101 4.882 -4.510 -8.740 1.00 25.24 O ATOM 1617 CB PHE A 101 3.138 -1.889 -8.768 1.00 51.35 C ATOM 1618 CG PHE A 101 1.936 -2.203 -7.924 1.00 23.01 C ATOM 1619 CD1 PHE A 101 1.825 -1.697 -6.639 1.00 32.22 C ATOM 1620 CD2 PHE A 101 0.919 -3.005 -8.415 1.00 15.21 C ATOM 1621 CE1 PHE A 101 0.720 -1.984 -5.859 1.00 62.10 C ATOM 1622 CE2 PHE A 101 -0.189 -3.295 -7.640 1.00 45.20 C ATOM 1623 CZ PHE A 101 -0.287 -2.785 -6.360 1.00 53.11 C ATOM 0 H PHE A 101 5.884 -2.456 -9.621 1.00 43.53 H new ATOM 0 HA PHE A 101 4.524 -1.719 -7.134 1.00 35.41 H new ATOM 0 HB2 PHE A 101 3.131 -0.828 -9.016 1.00 51.35 H new ATOM 0 HB3 PHE A 101 3.065 -2.436 -9.708 1.00 51.35 H new ATOM 0 HD1 PHE A 101 2.611 -1.071 -6.242 1.00 32.22 H new ATOM 0 HD2 PHE A 101 0.992 -3.408 -9.414 1.00 15.21 H new ATOM 0 HE1 PHE A 101 0.645 -1.582 -4.859 1.00 62.10 H new ATOM 0 HE2 PHE A 101 -0.977 -3.919 -8.035 1.00 45.20 H new ATOM 0 HZ PHE A 101 -1.150 -3.012 -5.752 1.00 53.11 H new ATOM 1633 N ILE A 102 4.236 -4.144 -6.615 1.00 50.54 N ATOM 1634 CA ILE A 102 4.272 -5.553 -6.246 1.00 20.10 C ATOM 1635 C ILE A 102 3.002 -5.960 -5.507 1.00 74.54 C ATOM 1636 O ILE A 102 2.650 -5.373 -4.484 1.00 71.13 O ATOM 1637 CB ILE A 102 5.491 -5.872 -5.361 1.00 65.21 C ATOM 1638 CG1 ILE A 102 6.786 -5.493 -6.083 1.00 61.12 C ATOM 1639 CG2 ILE A 102 5.501 -7.346 -4.984 1.00 10.01 C ATOM 1640 CD1 ILE A 102 7.984 -5.397 -5.165 1.00 23.31 C ATOM 0 H ILE A 102 3.957 -3.517 -5.860 1.00 50.54 H new ATOM 0 HA ILE A 102 4.348 -6.120 -7.174 1.00 20.10 H new ATOM 0 HB ILE A 102 5.421 -5.283 -4.446 1.00 65.21 H new ATOM 0 HG12 ILE A 102 6.990 -6.232 -6.857 1.00 61.12 H new ATOM 0 HG13 ILE A 102 6.646 -4.536 -6.585 1.00 61.12 H new ATOM 0 HG21 ILE A 102 6.369 -7.556 -4.358 1.00 10.01 H new ATOM 0 HG22 ILE A 102 4.591 -7.587 -4.435 1.00 10.01 H new ATOM 0 HG23 ILE A 102 5.551 -7.953 -5.888 1.00 10.01 H new ATOM 0 HD11 ILE A 102 8.866 -5.125 -5.745 1.00 23.31 H new ATOM 0 HD12 ILE A 102 7.800 -4.637 -4.405 1.00 23.31 H new ATOM 0 HD13 ILE A 102 8.150 -6.360 -4.682 1.00 23.31 H new ATOM 1652 N VAL A 103 2.317 -6.972 -6.032 1.00 40.12 N ATOM 1653 CA VAL A 103 1.087 -7.461 -5.421 1.00 53.25 C ATOM 1654 C VAL A 103 0.902 -8.953 -5.675 1.00 43.33 C ATOM 1655 O VAL A 103 1.009 -9.418 -6.809 1.00 73.01 O ATOM 1656 CB VAL A 103 -0.144 -6.704 -5.956 1.00 32.45 C ATOM 1657 CG1 VAL A 103 -0.282 -6.901 -7.458 1.00 24.04 C ATOM 1658 CG2 VAL A 103 -1.403 -7.159 -5.233 1.00 12.34 C ATOM 0 H VAL A 103 2.594 -7.469 -6.879 1.00 40.12 H new ATOM 0 HA VAL A 103 1.175 -7.286 -4.349 1.00 53.25 H new ATOM 0 HB VAL A 103 -0.006 -5.640 -5.765 1.00 32.45 H new ATOM 0 HG11 VAL A 103 -1.157 -6.359 -7.817 1.00 24.04 H new ATOM 0 HG12 VAL A 103 0.610 -6.523 -7.958 1.00 24.04 H new ATOM 0 HG13 VAL A 103 -0.398 -7.963 -7.677 1.00 24.04 H new ATOM 0 HG21 VAL A 103 -2.263 -6.615 -5.623 1.00 12.34 H new ATOM 0 HG22 VAL A 103 -1.548 -8.228 -5.392 1.00 12.34 H new ATOM 0 HG23 VAL A 103 -1.301 -6.961 -4.166 1.00 12.34 H new ATOM 1668 N GLY A 104 0.624 -9.699 -4.610 1.00 44.13 N ATOM 1669 CA GLY A 104 0.429 -11.131 -4.739 1.00 21.23 C ATOM 1670 C GLY A 104 1.725 -11.871 -5.006 1.00 75.42 C ATOM 1671 O GLY A 104 2.743 -11.605 -4.368 1.00 51.31 O ATOM 0 H GLY A 104 0.530 -9.337 -3.661 1.00 44.13 H new ATOM 0 HA2 GLY A 104 -0.024 -11.517 -3.826 1.00 21.23 H new ATOM 0 HA3 GLY A 104 -0.272 -11.328 -5.550 1.00 21.23 H new ATOM 1675 N SER A 105 1.686 -12.805 -5.951 1.00 65.23 N ATOM 1676 CA SER A 105 2.865 -13.590 -6.298 1.00 23.51 C ATOM 1677 C SER A 105 3.480 -13.099 -7.605 1.00 23.12 C ATOM 1678 O SER A 105 4.442 -13.680 -8.108 1.00 72.33 O ATOM 1679 CB SER A 105 2.500 -15.071 -6.418 1.00 24.41 C ATOM 1680 OG SER A 105 1.837 -15.529 -5.252 1.00 61.33 O ATOM 0 H SER A 105 0.851 -13.036 -6.490 1.00 65.23 H new ATOM 0 HA SER A 105 3.600 -13.467 -5.502 1.00 23.51 H new ATOM 0 HB2 SER A 105 1.860 -15.222 -7.287 1.00 24.41 H new ATOM 0 HB3 SER A 105 3.403 -15.659 -6.581 1.00 24.41 H new ATOM 0 HG SER A 105 1.613 -16.478 -5.354 1.00 61.33 H new ATOM 1686 N ASP A 106 2.919 -12.025 -8.148 1.00 75.15 N ATOM 1687 CA ASP A 106 3.411 -11.453 -9.396 1.00 61.43 C ATOM 1688 C ASP A 106 3.757 -9.978 -9.219 1.00 30.30 C ATOM 1689 O ASP A 106 3.070 -9.252 -8.500 1.00 44.35 O ATOM 1690 CB ASP A 106 2.368 -11.616 -10.503 1.00 63.13 C ATOM 1691 CG ASP A 106 1.044 -10.968 -10.151 1.00 40.40 C ATOM 1692 OD1 ASP A 106 0.383 -11.446 -9.206 1.00 53.30 O ATOM 1693 OD2 ASP A 106 0.669 -9.983 -10.821 1.00 15.51 O ATOM 0 H ASP A 106 2.123 -11.532 -7.744 1.00 75.15 H new ATOM 0 HA ASP A 106 4.317 -11.988 -9.680 1.00 61.43 H new ATOM 0 HB2 ASP A 106 2.750 -11.178 -11.425 1.00 63.13 H new ATOM 0 HB3 ASP A 106 2.210 -12.677 -10.696 1.00 63.13 H new ATOM 1698 N ARG A 107 4.826 -9.543 -9.878 1.00 21.14 N ATOM 1699 CA ARG A 107 5.264 -8.155 -9.791 1.00 25.42 C ATOM 1700 C ARG A 107 5.377 -7.533 -11.179 1.00 51.14 C ATOM 1701 O ARG A 107 5.658 -8.223 -12.159 1.00 1.22 O ATOM 1702 CB ARG A 107 6.611 -8.068 -9.070 1.00 41.33 C ATOM 1703 CG ARG A 107 7.751 -8.728 -9.828 1.00 44.22 C ATOM 1704 CD ARG A 107 9.033 -7.916 -9.724 1.00 40.12 C ATOM 1705 NE ARG A 107 8.866 -6.561 -10.242 1.00 41.23 N ATOM 1706 CZ ARG A 107 9.652 -5.544 -9.907 1.00 42.21 C ATOM 1707 NH1 ARG A 107 10.655 -5.728 -9.059 1.00 54.11 N ATOM 1708 NH2 ARG A 107 9.437 -4.340 -10.421 1.00 54.41 N ATOM 0 H ARG A 107 5.404 -10.131 -10.478 1.00 21.14 H new ATOM 0 HA ARG A 107 4.518 -7.599 -9.222 1.00 25.42 H new ATOM 0 HB2 ARG A 107 6.857 -7.019 -8.902 1.00 41.33 H new ATOM 0 HB3 ARG A 107 6.520 -8.535 -8.089 1.00 41.33 H new ATOM 0 HG2 ARG A 107 7.920 -9.730 -9.433 1.00 44.22 H new ATOM 0 HG3 ARG A 107 7.475 -8.841 -10.876 1.00 44.22 H new ATOM 0 HD2 ARG A 107 9.349 -7.869 -8.682 1.00 40.12 H new ATOM 0 HD3 ARG A 107 9.827 -8.420 -10.276 1.00 40.12 H new ATOM 0 HE ARG A 107 8.104 -6.386 -10.897 1.00 41.23 H new ATOM 0 HH11 ARG A 107 10.824 -6.652 -8.662 1.00 54.11 H new ATOM 0 HH12 ARG A 107 11.257 -4.945 -8.804 1.00 54.11 H new ATOM 0 HH21 ARG A 107 8.667 -4.194 -11.074 1.00 54.41 H new ATOM 0 HH22 ARG A 107 10.041 -3.560 -10.163 1.00 54.41 H new ATOM 1722 N ALA A 108 5.155 -6.225 -11.256 1.00 12.25 N ATOM 1723 CA ALA A 108 5.233 -5.509 -12.523 1.00 74.20 C ATOM 1724 C ALA A 108 6.283 -4.405 -12.466 1.00 54.24 C ATOM 1725 O ALA A 108 6.480 -3.777 -11.426 1.00 44.51 O ATOM 1726 CB ALA A 108 3.873 -4.930 -12.886 1.00 44.23 C ATOM 0 H ALA A 108 4.919 -5.639 -10.455 1.00 12.25 H new ATOM 0 HA ALA A 108 5.532 -6.218 -13.295 1.00 74.20 H new ATOM 0 HB1 ALA A 108 3.946 -4.398 -13.834 1.00 44.23 H new ATOM 0 HB2 ALA A 108 3.147 -5.737 -12.978 1.00 44.23 H new ATOM 0 HB3 ALA A 108 3.552 -4.240 -12.106 1.00 44.23 H new ATOM 1732 N ILE A 109 6.953 -4.174 -13.590 1.00 60.22 N ATOM 1733 CA ILE A 109 7.982 -3.145 -13.667 1.00 64.24 C ATOM 1734 C ILE A 109 7.759 -2.233 -14.869 1.00 63.52 C ATOM 1735 O ILE A 109 7.555 -2.703 -15.989 1.00 30.01 O ATOM 1736 CB ILE A 109 9.390 -3.763 -13.760 1.00 41.04 C ATOM 1737 CG1 ILE A 109 10.456 -2.666 -13.714 1.00 22.42 C ATOM 1738 CG2 ILE A 109 9.524 -4.586 -15.033 1.00 24.02 C ATOM 1739 CD1 ILE A 109 11.222 -2.624 -12.410 1.00 44.42 C ATOM 0 H ILE A 109 6.802 -4.685 -14.459 1.00 60.22 H new ATOM 0 HA ILE A 109 7.911 -2.559 -12.751 1.00 64.24 H new ATOM 0 HB ILE A 109 9.538 -4.424 -12.906 1.00 41.04 H new ATOM 0 HG12 ILE A 109 11.158 -2.818 -14.534 1.00 22.42 H new ATOM 0 HG13 ILE A 109 9.979 -1.700 -13.877 1.00 22.42 H new ATOM 0 HG21 ILE A 109 10.524 -5.016 -15.085 1.00 24.02 H new ATOM 0 HG22 ILE A 109 8.784 -5.387 -15.028 1.00 24.02 H new ATOM 0 HG23 ILE A 109 9.360 -3.945 -15.899 1.00 24.02 H new ATOM 0 HD11 ILE A 109 11.961 -1.823 -12.448 1.00 44.42 H new ATOM 0 HD12 ILE A 109 10.530 -2.442 -11.587 1.00 44.42 H new ATOM 0 HD13 ILE A 109 11.728 -3.577 -12.254 1.00 44.42 H new ATOM 1751 N PHE A 110 7.801 -0.927 -14.630 1.00 5.02 N ATOM 1752 CA PHE A 110 7.605 0.052 -15.693 1.00 32.23 C ATOM 1753 C PHE A 110 8.591 1.208 -15.556 1.00 53.43 C ATOM 1754 O PHE A 110 8.608 1.907 -14.543 1.00 54.14 O ATOM 1755 CB PHE A 110 6.170 0.584 -15.666 1.00 64.20 C ATOM 1756 CG PHE A 110 5.788 1.340 -16.906 1.00 44.21 C ATOM 1757 CD1 PHE A 110 6.333 2.587 -17.168 1.00 54.30 C ATOM 1758 CD2 PHE A 110 4.886 0.804 -17.810 1.00 53.12 C ATOM 1759 CE1 PHE A 110 5.982 3.286 -18.308 1.00 22.30 C ATOM 1760 CE2 PHE A 110 4.532 1.498 -18.952 1.00 72.22 C ATOM 1761 CZ PHE A 110 5.082 2.740 -19.202 1.00 33.22 C ATOM 0 H PHE A 110 7.969 -0.522 -13.709 1.00 5.02 H new ATOM 0 HA PHE A 110 7.784 -0.443 -16.647 1.00 32.23 H new ATOM 0 HB2 PHE A 110 5.483 -0.252 -15.534 1.00 64.20 H new ATOM 0 HB3 PHE A 110 6.049 1.236 -14.801 1.00 64.20 H new ATOM 0 HD1 PHE A 110 7.040 3.017 -16.474 1.00 54.30 H new ATOM 0 HD2 PHE A 110 4.454 -0.168 -17.621 1.00 53.12 H new ATOM 0 HE1 PHE A 110 6.411 4.258 -18.499 1.00 22.30 H new ATOM 0 HE2 PHE A 110 3.826 1.069 -19.648 1.00 72.22 H new ATOM 0 HZ PHE A 110 4.809 3.283 -20.095 1.00 33.22 H new ATOM 1771 N MET A 111 9.411 1.403 -16.584 1.00 11.13 N ATOM 1772 CA MET A 111 10.400 2.475 -16.579 1.00 73.01 C ATOM 1773 C MET A 111 10.479 3.148 -17.946 1.00 34.40 C ATOM 1774 O MET A 111 10.579 2.477 -18.974 1.00 65.03 O ATOM 1775 CB MET A 111 11.774 1.929 -16.187 1.00 33.35 C ATOM 1776 CG MET A 111 12.233 0.762 -17.047 1.00 15.52 C ATOM 1777 SD MET A 111 12.159 -0.814 -16.175 1.00 63.45 S ATOM 1778 CE MET A 111 13.243 -0.485 -14.788 1.00 15.04 C ATOM 0 H MET A 111 9.410 0.833 -17.430 1.00 11.13 H new ATOM 0 HA MET A 111 10.089 3.218 -15.845 1.00 73.01 H new ATOM 0 HB2 MET A 111 12.508 2.732 -16.257 1.00 33.35 H new ATOM 0 HB3 MET A 111 11.746 1.612 -15.144 1.00 33.35 H new ATOM 0 HG2 MET A 111 11.612 0.708 -17.941 1.00 15.52 H new ATOM 0 HG3 MET A 111 13.255 0.941 -17.380 1.00 15.52 H new ATOM 0 HE1 MET A 111 13.803 -1.387 -14.542 1.00 15.04 H new ATOM 0 HE2 MET A 111 13.938 0.313 -15.050 1.00 15.04 H new ATOM 0 HE3 MET A 111 12.649 -0.180 -13.926 1.00 15.04 H new ATOM 1788 N LEU A 112 10.432 4.475 -17.951 1.00 12.25 N ATOM 1789 CA LEU A 112 10.498 5.239 -19.192 1.00 32.22 C ATOM 1790 C LEU A 112 11.145 6.600 -18.960 1.00 0.33 C ATOM 1791 O LEU A 112 11.043 7.170 -17.873 1.00 25.21 O ATOM 1792 CB LEU A 112 9.096 5.421 -19.777 1.00 22.31 C ATOM 1793 CG LEU A 112 8.990 5.347 -21.301 1.00 2.35 C ATOM 1794 CD1 LEU A 112 8.078 4.204 -21.718 1.00 24.24 C ATOM 1795 CD2 LEU A 112 8.485 6.667 -21.864 1.00 41.42 C ATOM 0 H LEU A 112 10.348 5.045 -17.109 1.00 12.25 H new ATOM 0 HA LEU A 112 11.111 4.682 -19.900 1.00 32.22 H new ATOM 0 HB2 LEU A 112 8.444 4.659 -19.350 1.00 22.31 H new ATOM 0 HB3 LEU A 112 8.711 6.388 -19.452 1.00 22.31 H new ATOM 0 HG LEU A 112 9.984 5.158 -21.707 1.00 2.35 H new ATOM 0 HD11 LEU A 112 8.015 4.167 -22.806 1.00 24.24 H new ATOM 0 HD12 LEU A 112 8.481 3.262 -21.346 1.00 24.24 H new ATOM 0 HD13 LEU A 112 7.083 4.362 -21.302 1.00 24.24 H new ATOM 0 HD21 LEU A 112 8.416 6.597 -22.950 1.00 41.42 H new ATOM 0 HD22 LEU A 112 7.500 6.886 -21.451 1.00 41.42 H new ATOM 0 HD23 LEU A 112 9.177 7.465 -21.596 1.00 41.42 H new ATOM 1807 N ARG A 113 11.808 7.117 -19.989 1.00 4.54 N ATOM 1808 CA ARG A 113 12.471 8.413 -19.897 1.00 62.21 C ATOM 1809 C ARG A 113 11.449 9.540 -19.792 1.00 13.55 C ATOM 1810 O ARG A 113 11.703 10.565 -19.159 1.00 1.43 O ATOM 1811 CB ARG A 113 13.370 8.637 -21.115 1.00 12.03 C ATOM 1812 CG ARG A 113 12.637 8.523 -22.442 1.00 1.25 C ATOM 1813 CD ARG A 113 12.171 9.883 -22.939 1.00 63.41 C ATOM 1814 NE ARG A 113 11.228 9.766 -24.048 1.00 32.24 N ATOM 1815 CZ ARG A 113 11.582 9.422 -25.281 1.00 12.30 C ATOM 1816 NH1 ARG A 113 12.851 9.163 -25.562 1.00 23.32 N ATOM 1817 NH2 ARG A 113 10.665 9.337 -26.236 1.00 51.34 N ATOM 0 H ARG A 113 11.901 6.659 -20.896 1.00 4.54 H new ATOM 0 HA ARG A 113 13.084 8.417 -18.996 1.00 62.21 H new ATOM 0 HB2 ARG A 113 13.824 9.625 -21.044 1.00 12.03 H new ATOM 0 HB3 ARG A 113 14.183 7.911 -21.095 1.00 12.03 H new ATOM 0 HG2 ARG A 113 13.294 8.069 -23.184 1.00 1.25 H new ATOM 0 HG3 ARG A 113 11.778 7.862 -22.329 1.00 1.25 H new ATOM 0 HD2 ARG A 113 11.701 10.427 -22.120 1.00 63.41 H new ATOM 0 HD3 ARG A 113 13.034 10.468 -23.257 1.00 63.41 H new ATOM 0 HE ARG A 113 10.243 9.959 -23.866 1.00 32.24 H new ATOM 0 HH11 ARG A 113 13.559 9.228 -24.830 1.00 23.32 H new ATOM 0 HH12 ARG A 113 13.120 8.899 -26.510 1.00 23.32 H new ATOM 0 HH21 ARG A 113 9.687 9.536 -26.024 1.00 51.34 H new ATOM 0 HH22 ARG A 113 10.938 9.073 -27.183 1.00 51.34 H new ATOM 1831 N ASP A 114 10.293 9.344 -20.416 1.00 13.02 N ATOM 1832 CA ASP A 114 9.231 10.344 -20.392 1.00 23.21 C ATOM 1833 C ASP A 114 8.436 10.261 -19.093 1.00 74.40 C ATOM 1834 O ASP A 114 8.419 11.202 -18.302 1.00 2.52 O ATOM 1835 CB ASP A 114 8.298 10.156 -21.589 1.00 40.51 C ATOM 1836 CG ASP A 114 8.297 11.356 -22.516 1.00 2.32 C ATOM 1837 OD1 ASP A 114 8.478 12.489 -22.021 1.00 25.20 O ATOM 1838 OD2 ASP A 114 8.116 11.163 -23.736 1.00 23.10 O ATOM 0 H ASP A 114 10.067 8.502 -20.945 1.00 13.02 H new ATOM 0 HA ASP A 114 9.692 11.330 -20.452 1.00 23.21 H new ATOM 0 HB2 ASP A 114 8.601 9.270 -22.147 1.00 40.51 H new ATOM 0 HB3 ASP A 114 7.284 9.976 -21.231 1.00 40.51 H new ATOM 1843 N GLY A 115 7.775 9.126 -18.881 1.00 2.22 N ATOM 1844 CA GLY A 115 6.985 8.942 -17.677 1.00 64.54 C ATOM 1845 C GLY A 115 5.509 9.194 -17.909 1.00 33.24 C ATOM 1846 O GLY A 115 4.750 8.266 -18.187 1.00 74.40 O ATOM 0 H GLY A 115 7.773 8.332 -19.521 1.00 2.22 H new ATOM 0 HA2 GLY A 115 7.123 7.926 -17.307 1.00 64.54 H new ATOM 0 HA3 GLY A 115 7.348 9.616 -16.901 1.00 64.54 H new ATOM 1850 N SER A 116 5.100 10.453 -17.792 1.00 13.04 N ATOM 1851 CA SER A 116 3.703 10.824 -17.984 1.00 73.04 C ATOM 1852 C SER A 116 3.177 10.290 -19.313 1.00 62.43 C ATOM 1853 O SER A 116 2.152 9.609 -19.360 1.00 24.32 O ATOM 1854 CB SER A 116 3.545 12.345 -17.935 1.00 64.04 C ATOM 1855 OG SER A 116 2.420 12.717 -17.159 1.00 32.41 O ATOM 0 H SER A 116 5.716 11.234 -17.565 1.00 13.04 H new ATOM 0 HA SER A 116 3.121 10.379 -17.177 1.00 73.04 H new ATOM 0 HB2 SER A 116 4.445 12.794 -17.514 1.00 64.04 H new ATOM 0 HB3 SER A 116 3.437 12.735 -18.947 1.00 64.04 H new ATOM 0 HG SER A 116 2.343 13.694 -17.142 1.00 32.41 H new ATOM 1861 N TYR A 117 3.886 10.603 -20.392 1.00 4.43 N ATOM 1862 CA TYR A 117 3.491 10.158 -21.723 1.00 25.34 C ATOM 1863 C TYR A 117 3.306 8.644 -21.757 1.00 71.34 C ATOM 1864 O TYR A 117 2.394 8.134 -22.407 1.00 73.22 O ATOM 1865 CB TYR A 117 4.538 10.578 -22.756 1.00 1.23 C ATOM 1866 CG TYR A 117 4.040 10.517 -24.182 1.00 12.21 C ATOM 1867 CD1 TYR A 117 2.950 11.275 -24.591 1.00 14.01 C ATOM 1868 CD2 TYR A 117 4.660 9.702 -25.121 1.00 3.12 C ATOM 1869 CE1 TYR A 117 2.491 11.222 -25.893 1.00 34.43 C ATOM 1870 CE2 TYR A 117 4.209 9.644 -26.425 1.00 61.43 C ATOM 1871 CZ TYR A 117 3.124 10.405 -26.806 1.00 73.32 C ATOM 1872 OH TYR A 117 2.670 10.350 -28.104 1.00 64.23 O ATOM 0 H TYR A 117 4.738 11.164 -20.371 1.00 4.43 H new ATOM 0 HA TYR A 117 2.539 10.629 -21.969 1.00 25.34 H new ATOM 0 HB2 TYR A 117 4.865 11.595 -22.537 1.00 1.23 H new ATOM 0 HB3 TYR A 117 5.412 9.934 -22.657 1.00 1.23 H new ATOM 0 HD1 TYR A 117 2.453 11.917 -23.879 1.00 14.01 H new ATOM 0 HD2 TYR A 117 5.509 9.104 -24.826 1.00 3.12 H new ATOM 0 HE1 TYR A 117 1.641 11.817 -26.194 1.00 34.43 H new ATOM 0 HE2 TYR A 117 4.703 9.006 -27.143 1.00 61.43 H new ATOM 0 HH TYR A 117 3.226 9.728 -28.619 1.00 64.23 H new ATOM 1882 N ALA A 118 4.178 7.931 -21.052 1.00 63.03 N ATOM 1883 CA ALA A 118 4.110 6.476 -20.999 1.00 63.12 C ATOM 1884 C ALA A 118 2.895 6.012 -20.203 1.00 64.31 C ATOM 1885 O ALA A 118 2.341 4.944 -20.465 1.00 1.20 O ATOM 1886 CB ALA A 118 5.387 5.910 -20.396 1.00 20.43 C ATOM 0 H ALA A 118 4.940 8.338 -20.509 1.00 63.03 H new ATOM 0 HA ALA A 118 4.007 6.104 -22.018 1.00 63.12 H new ATOM 0 HB1 ALA A 118 5.323 4.822 -20.362 1.00 20.43 H new ATOM 0 HB2 ALA A 118 6.240 6.204 -21.008 1.00 20.43 H new ATOM 0 HB3 ALA A 118 5.515 6.297 -19.385 1.00 20.43 H new ATOM 1892 N TRP A 119 2.487 6.819 -19.231 1.00 45.30 N ATOM 1893 CA TRP A 119 1.338 6.490 -18.396 1.00 12.00 C ATOM 1894 C TRP A 119 0.125 6.143 -19.252 1.00 70.51 C ATOM 1895 O TRP A 119 -0.723 5.347 -18.848 1.00 43.23 O ATOM 1896 CB TRP A 119 1.004 7.659 -17.468 1.00 23.03 C ATOM 1897 CG TRP A 119 -0.016 7.316 -16.424 1.00 43.52 C ATOM 1898 CD1 TRP A 119 -1.367 7.228 -16.597 1.00 54.13 C ATOM 1899 CD2 TRP A 119 0.235 7.019 -15.046 1.00 73.23 C ATOM 1900 NE1 TRP A 119 -1.973 6.893 -15.410 1.00 4.41 N ATOM 1901 CE2 TRP A 119 -1.011 6.758 -14.443 1.00 55.43 C ATOM 1902 CE3 TRP A 119 1.390 6.945 -14.264 1.00 21.32 C ATOM 1903 CZ2 TRP A 119 -1.132 6.431 -13.095 1.00 41.43 C ATOM 1904 CZ3 TRP A 119 1.269 6.620 -12.926 1.00 52.30 C ATOM 1905 CH2 TRP A 119 0.016 6.366 -12.353 1.00 13.12 C ATOM 0 H TRP A 119 2.935 7.706 -19.001 1.00 45.30 H new ATOM 0 HA TRP A 119 1.596 5.619 -17.793 1.00 12.00 H new ATOM 0 HB2 TRP A 119 1.917 7.996 -16.977 1.00 23.03 H new ATOM 0 HB3 TRP A 119 0.636 8.494 -18.065 1.00 23.03 H new ATOM 0 HD1 TRP A 119 -1.884 7.397 -17.530 1.00 54.13 H new ATOM 0 HE1 TRP A 119 -2.975 6.766 -15.271 1.00 4.41 H new ATOM 0 HE3 TRP A 119 2.360 7.138 -14.697 1.00 21.32 H new ATOM 0 HZ2 TRP A 119 -2.097 6.236 -12.651 1.00 41.43 H new ATOM 0 HZ3 TRP A 119 2.155 6.561 -12.312 1.00 52.30 H new ATOM 0 HH2 TRP A 119 -0.045 6.114 -11.305 1.00 13.12 H new ATOM 1916 N GLU A 120 0.049 6.744 -20.435 1.00 63.54 N ATOM 1917 CA GLU A 120 -1.062 6.496 -21.347 1.00 45.42 C ATOM 1918 C GLU A 120 -1.113 5.027 -21.756 1.00 53.21 C ATOM 1919 O GLU A 120 -2.104 4.339 -21.511 1.00 73.50 O ATOM 1920 CB GLU A 120 -0.936 7.379 -22.591 1.00 3.12 C ATOM 1921 CG GLU A 120 -2.137 8.281 -22.821 1.00 63.33 C ATOM 1922 CD GLU A 120 -3.259 7.579 -23.562 1.00 11.55 C ATOM 1923 OE1 GLU A 120 -3.022 7.118 -24.698 1.00 12.42 O ATOM 1924 OE2 GLU A 120 -4.374 7.492 -23.005 1.00 64.04 O ATOM 0 H GLU A 120 0.743 7.405 -20.784 1.00 63.54 H new ATOM 0 HA GLU A 120 -1.988 6.743 -20.827 1.00 45.42 H new ATOM 0 HB2 GLU A 120 -0.042 7.995 -22.500 1.00 3.12 H new ATOM 0 HB3 GLU A 120 -0.797 6.743 -23.465 1.00 3.12 H new ATOM 0 HG2 GLU A 120 -2.508 8.638 -21.860 1.00 63.33 H new ATOM 0 HG3 GLU A 120 -1.825 9.158 -23.388 1.00 63.33 H new ATOM 1931 N ILE A 121 -0.040 4.555 -22.381 1.00 21.23 N ATOM 1932 CA ILE A 121 0.037 3.168 -22.823 1.00 45.21 C ATOM 1933 C ILE A 121 0.152 2.218 -21.636 1.00 32.11 C ATOM 1934 O ILE A 121 -0.302 1.075 -21.695 1.00 70.11 O ATOM 1935 CB ILE A 121 1.236 2.943 -23.764 1.00 2.35 C ATOM 1936 CG1 ILE A 121 1.248 3.998 -24.872 1.00 11.34 C ATOM 1937 CG2 ILE A 121 1.188 1.544 -24.358 1.00 30.43 C ATOM 1938 CD1 ILE A 121 2.373 5.001 -24.739 1.00 53.04 C ATOM 0 H ILE A 121 0.788 5.112 -22.593 1.00 21.23 H new ATOM 0 HA ILE A 121 -0.885 2.958 -23.365 1.00 45.21 H new ATOM 0 HB ILE A 121 2.155 3.040 -23.186 1.00 2.35 H new ATOM 0 HG12 ILE A 121 1.330 3.498 -25.837 1.00 11.34 H new ATOM 0 HG13 ILE A 121 0.296 4.529 -24.867 1.00 11.34 H new ATOM 0 HG21 ILE A 121 2.042 1.401 -25.020 1.00 30.43 H new ATOM 0 HG22 ILE A 121 1.223 0.807 -23.556 1.00 30.43 H new ATOM 0 HG23 ILE A 121 0.265 1.421 -24.924 1.00 30.43 H new ATOM 0 HD11 ILE A 121 2.320 5.718 -25.558 1.00 53.04 H new ATOM 0 HD12 ILE A 121 2.281 5.527 -23.789 1.00 53.04 H new ATOM 0 HD13 ILE A 121 3.330 4.481 -24.774 1.00 53.04 H new ATOM 1950 N LYS A 122 0.760 2.699 -20.557 1.00 32.32 N ATOM 1951 CA LYS A 122 0.932 1.895 -19.353 1.00 31.52 C ATOM 1952 C LYS A 122 -0.396 1.292 -18.907 1.00 35.14 C ATOM 1953 O LYS A 122 -0.432 0.212 -18.317 1.00 61.30 O ATOM 1954 CB LYS A 122 1.522 2.746 -18.226 1.00 71.31 C ATOM 1955 CG LYS A 122 1.665 1.999 -16.911 1.00 43.21 C ATOM 1956 CD LYS A 122 2.045 2.936 -15.777 1.00 10.04 C ATOM 1957 CE LYS A 122 3.497 3.378 -15.881 1.00 33.23 C ATOM 1958 NZ LYS A 122 3.705 4.739 -15.313 1.00 35.54 N ATOM 0 H LYS A 122 1.142 3.642 -20.492 1.00 32.32 H new ATOM 0 HA LYS A 122 1.620 1.082 -19.585 1.00 31.52 H new ATOM 0 HB2 LYS A 122 2.501 3.113 -18.534 1.00 71.31 H new ATOM 0 HB3 LYS A 122 0.888 3.619 -18.071 1.00 71.31 H new ATOM 0 HG2 LYS A 122 0.727 1.498 -16.672 1.00 43.21 H new ATOM 0 HG3 LYS A 122 2.424 1.223 -17.013 1.00 43.21 H new ATOM 0 HD2 LYS A 122 1.395 3.811 -15.794 1.00 10.04 H new ATOM 0 HD3 LYS A 122 1.883 2.437 -14.822 1.00 10.04 H new ATOM 0 HE2 LYS A 122 4.132 2.665 -15.356 1.00 33.23 H new ATOM 0 HE3 LYS A 122 3.805 3.370 -16.927 1.00 33.23 H new ATOM 0 HZ1 LYS A 122 4.181 5.340 -16.016 1.00 35.54 H new ATOM 0 HZ2 LYS A 122 2.785 5.157 -15.067 1.00 35.54 H new ATOM 0 HZ3 LYS A 122 4.295 4.672 -14.459 1.00 35.54 H new ATOM 1972 N ASP A 123 -1.486 1.996 -19.193 1.00 30.12 N ATOM 1973 CA ASP A 123 -2.817 1.529 -18.823 1.00 71.21 C ATOM 1974 C ASP A 123 -3.139 0.206 -19.511 1.00 54.15 C ATOM 1975 O ASP A 123 -3.624 -0.733 -18.879 1.00 53.34 O ATOM 1976 CB ASP A 123 -3.869 2.578 -19.188 1.00 64.45 C ATOM 1977 CG ASP A 123 -5.278 2.120 -18.870 1.00 73.40 C ATOM 1978 OD1 ASP A 123 -5.543 1.785 -17.696 1.00 62.11 O ATOM 1979 OD2 ASP A 123 -6.117 2.097 -19.794 1.00 73.55 O ATOM 0 H ASP A 123 -1.474 2.892 -19.680 1.00 30.12 H new ATOM 0 HA ASP A 123 -2.833 1.370 -17.745 1.00 71.21 H new ATOM 0 HB2 ASP A 123 -3.660 3.501 -18.648 1.00 64.45 H new ATOM 0 HB3 ASP A 123 -3.796 2.807 -20.251 1.00 64.45 H new ATOM 1984 N PHE A 124 -2.868 0.139 -20.811 1.00 0.54 N ATOM 1985 CA PHE A 124 -3.131 -1.067 -21.586 1.00 20.43 C ATOM 1986 C PHE A 124 -2.170 -2.186 -21.194 1.00 3.24 C ATOM 1987 O PHE A 124 -2.580 -3.328 -20.985 1.00 72.33 O ATOM 1988 CB PHE A 124 -3.008 -0.775 -23.082 1.00 45.15 C ATOM 1989 CG PHE A 124 -4.254 -1.090 -23.860 1.00 3.14 C ATOM 1990 CD1 PHE A 124 -5.364 -0.266 -23.777 1.00 53.32 C ATOM 1991 CD2 PHE A 124 -4.314 -2.211 -24.672 1.00 55.41 C ATOM 1992 CE1 PHE A 124 -6.513 -0.552 -24.491 1.00 64.53 C ATOM 1993 CE2 PHE A 124 -5.460 -2.502 -25.389 1.00 24.22 C ATOM 1994 CZ PHE A 124 -6.560 -1.673 -25.297 1.00 54.14 C ATOM 0 H PHE A 124 -2.466 0.907 -21.349 1.00 0.54 H new ATOM 0 HA PHE A 124 -4.148 -1.393 -21.369 1.00 20.43 H new ATOM 0 HB2 PHE A 124 -2.760 0.278 -23.219 1.00 45.15 H new ATOM 0 HB3 PHE A 124 -2.179 -1.353 -23.490 1.00 45.15 H new ATOM 0 HD1 PHE A 124 -5.332 0.611 -23.147 1.00 53.32 H new ATOM 0 HD2 PHE A 124 -3.457 -2.864 -24.746 1.00 55.41 H new ATOM 0 HE1 PHE A 124 -7.372 0.099 -24.419 1.00 64.53 H new ATOM 0 HE2 PHE A 124 -5.494 -3.377 -26.021 1.00 24.22 H new ATOM 0 HZ PHE A 124 -7.456 -1.901 -25.855 1.00 54.14 H new ATOM 2004 N LEU A 125 -0.888 -1.849 -21.096 1.00 15.04 N ATOM 2005 CA LEU A 125 0.133 -2.824 -20.729 1.00 40.11 C ATOM 2006 C LEU A 125 -0.251 -3.560 -19.449 1.00 41.14 C ATOM 2007 O LEU A 125 -0.396 -4.782 -19.443 1.00 62.45 O ATOM 2008 CB LEU A 125 1.485 -2.132 -20.547 1.00 12.52 C ATOM 2009 CG LEU A 125 2.311 -1.927 -21.817 1.00 71.12 C ATOM 2010 CD1 LEU A 125 3.154 -0.666 -21.709 1.00 11.04 C ATOM 2011 CD2 LEU A 125 3.192 -3.139 -22.081 1.00 25.11 C ATOM 0 H LEU A 125 -0.531 -0.908 -21.266 1.00 15.04 H new ATOM 0 HA LEU A 125 0.210 -3.553 -21.536 1.00 40.11 H new ATOM 0 HB2 LEU A 125 1.313 -1.158 -20.088 1.00 12.52 H new ATOM 0 HB3 LEU A 125 2.077 -2.716 -19.843 1.00 12.52 H new ATOM 0 HG LEU A 125 1.627 -1.810 -22.657 1.00 71.12 H new ATOM 0 HD11 LEU A 125 3.735 -0.537 -22.622 1.00 11.04 H new ATOM 0 HD12 LEU A 125 2.502 0.196 -21.569 1.00 11.04 H new ATOM 0 HD13 LEU A 125 3.830 -0.752 -20.858 1.00 11.04 H new ATOM 0 HD21 LEU A 125 3.773 -2.976 -22.989 1.00 25.11 H new ATOM 0 HD22 LEU A 125 3.868 -3.288 -21.239 1.00 25.11 H new ATOM 0 HD23 LEU A 125 2.567 -4.023 -22.204 1.00 25.11 H new ATOM 2023 N VAL A 126 -0.416 -2.807 -18.367 1.00 13.24 N ATOM 2024 CA VAL A 126 -0.787 -3.387 -17.081 1.00 40.23 C ATOM 2025 C VAL A 126 -2.141 -4.082 -17.162 1.00 71.54 C ATOM 2026 O VAL A 126 -2.398 -5.049 -16.445 1.00 63.52 O ATOM 2027 CB VAL A 126 -0.838 -2.316 -15.976 1.00 2.52 C ATOM 2028 CG1 VAL A 126 -1.980 -1.342 -16.227 1.00 64.52 C ATOM 2029 CG2 VAL A 126 -0.974 -2.968 -14.608 1.00 45.23 C ATOM 0 H VAL A 126 -0.299 -1.794 -18.355 1.00 13.24 H new ATOM 0 HA VAL A 126 -0.020 -4.120 -16.831 1.00 40.23 H new ATOM 0 HB VAL A 126 0.096 -1.755 -15.995 1.00 2.52 H new ATOM 0 HG11 VAL A 126 -2.000 -0.593 -15.436 1.00 64.52 H new ATOM 0 HG12 VAL A 126 -1.834 -0.850 -17.189 1.00 64.52 H new ATOM 0 HG13 VAL A 126 -2.925 -1.884 -16.237 1.00 64.52 H new ATOM 0 HG21 VAL A 126 -1.008 -2.196 -13.839 1.00 45.23 H new ATOM 0 HG22 VAL A 126 -1.892 -3.555 -14.574 1.00 45.23 H new ATOM 0 HG23 VAL A 126 -0.119 -3.620 -14.429 1.00 45.23 H new ATOM 2039 N SER A 127 -3.005 -3.584 -18.041 1.00 43.12 N ATOM 2040 CA SER A 127 -4.335 -4.155 -18.214 1.00 71.43 C ATOM 2041 C SER A 127 -4.253 -5.661 -18.446 1.00 74.20 C ATOM 2042 O SER A 127 -5.162 -6.406 -18.079 1.00 2.11 O ATOM 2043 CB SER A 127 -5.052 -3.486 -19.388 1.00 13.52 C ATOM 2044 OG SER A 127 -6.296 -2.941 -18.982 1.00 31.22 O ATOM 0 H SER A 127 -2.807 -2.786 -18.645 1.00 43.12 H new ATOM 0 HA SER A 127 -4.902 -3.975 -17.301 1.00 71.43 H new ATOM 0 HB2 SER A 127 -4.423 -2.697 -19.801 1.00 13.52 H new ATOM 0 HB3 SER A 127 -5.212 -4.214 -20.183 1.00 13.52 H new ATOM 0 HG SER A 127 -6.734 -2.518 -19.750 1.00 31.22 H new ATOM 2050 N GLN A 128 -3.158 -6.101 -19.058 1.00 14.13 N ATOM 2051 CA GLN A 128 -2.958 -7.517 -19.339 1.00 60.44 C ATOM 2052 C GLN A 128 -2.760 -8.306 -18.049 1.00 73.43 C ATOM 2053 O GLN A 128 -3.349 -9.372 -17.865 1.00 41.13 O ATOM 2054 CB GLN A 128 -1.751 -7.710 -20.259 1.00 71.32 C ATOM 2055 CG GLN A 128 -1.843 -6.923 -21.556 1.00 62.14 C ATOM 2056 CD GLN A 128 -2.234 -7.789 -22.738 1.00 1.31 C ATOM 2057 OE1 GLN A 128 -1.491 -8.686 -23.138 1.00 13.12 O ATOM 2058 NE2 GLN A 128 -3.406 -7.524 -23.304 1.00 24.11 N ATOM 0 H GLN A 128 -2.397 -5.497 -19.368 1.00 14.13 H new ATOM 0 HA GLN A 128 -3.851 -7.892 -19.839 1.00 60.44 H new ATOM 0 HB2 GLN A 128 -0.848 -7.413 -19.727 1.00 71.32 H new ATOM 0 HB3 GLN A 128 -1.649 -8.770 -20.493 1.00 71.32 H new ATOM 0 HG2 GLN A 128 -2.573 -6.122 -21.440 1.00 62.14 H new ATOM 0 HG3 GLN A 128 -0.882 -6.451 -21.759 1.00 62.14 H new ATOM 0 HE21 GLN A 128 -3.990 -6.771 -22.940 1.00 24.11 H new ATOM 0 HE22 GLN A 128 -3.722 -8.073 -24.103 1.00 24.11 H new ATOM 2067 N ASP A 129 -1.928 -7.777 -17.159 1.00 52.45 N ATOM 2068 CA ASP A 129 -1.653 -8.431 -15.886 1.00 32.04 C ATOM 2069 C ASP A 129 -0.977 -9.781 -16.103 1.00 1.00 C ATOM 2070 O ASP A 129 -1.032 -10.660 -15.242 1.00 41.44 O ATOM 2071 CB ASP A 129 -2.948 -8.617 -15.093 1.00 72.14 C ATOM 2072 CG ASP A 129 -2.721 -8.577 -13.595 1.00 12.20 C ATOM 2073 OD1 ASP A 129 -2.543 -7.467 -13.051 1.00 50.51 O ATOM 2074 OD2 ASP A 129 -2.722 -9.655 -12.966 1.00 35.41 O ATOM 0 H ASP A 129 -1.432 -6.896 -17.296 1.00 52.45 H new ATOM 0 HA ASP A 129 -0.976 -7.793 -15.317 1.00 32.04 H new ATOM 0 HB2 ASP A 129 -3.656 -7.836 -15.371 1.00 72.14 H new ATOM 0 HB3 ASP A 129 -3.402 -9.570 -15.363 1.00 72.14 H new ATOM 2079 N ARG A 130 -0.340 -9.939 -17.259 1.00 14.11 N ATOM 2080 CA ARG A 130 0.344 -11.183 -17.590 1.00 45.54 C ATOM 2081 C ARG A 130 0.997 -11.094 -18.967 1.00 4.54 C ATOM 2082 O ARG A 130 0.629 -11.824 -19.888 1.00 2.43 O ATOM 2083 CB ARG A 130 -0.637 -12.355 -17.555 1.00 31.34 C ATOM 2084 CG ARG A 130 -1.954 -12.069 -18.257 1.00 13.21 C ATOM 2085 CD ARG A 130 -2.478 -13.299 -18.981 1.00 54.34 C ATOM 2086 NE ARG A 130 -2.754 -14.400 -18.062 1.00 44.41 N ATOM 2087 CZ ARG A 130 -3.552 -15.420 -18.355 1.00 55.33 C ATOM 2088 NH1 ARG A 130 -4.151 -15.479 -19.537 1.00 13.33 N ATOM 2089 NH2 ARG A 130 -3.753 -16.384 -17.466 1.00 12.32 N ATOM 0 H ARG A 130 -0.284 -9.221 -17.982 1.00 14.11 H new ATOM 0 HA ARG A 130 1.123 -11.348 -16.846 1.00 45.54 H new ATOM 0 HB2 ARG A 130 -0.169 -13.223 -18.019 1.00 31.34 H new ATOM 0 HB3 ARG A 130 -0.838 -12.618 -16.517 1.00 31.34 H new ATOM 0 HG2 ARG A 130 -2.691 -11.733 -17.527 1.00 13.21 H new ATOM 0 HG3 ARG A 130 -1.818 -11.256 -18.970 1.00 13.21 H new ATOM 0 HD2 ARG A 130 -3.389 -13.041 -19.521 1.00 54.34 H new ATOM 0 HD3 ARG A 130 -1.748 -13.621 -19.723 1.00 54.34 H new ATOM 0 HE ARG A 130 -2.309 -14.385 -17.144 1.00 44.41 H new ATOM 0 HH11 ARG A 130 -3.999 -14.740 -20.223 1.00 13.33 H new ATOM 0 HH12 ARG A 130 -4.764 -16.264 -19.760 1.00 13.33 H new ATOM 0 HH21 ARG A 130 -3.294 -16.342 -16.556 1.00 12.32 H new ATOM 0 HH22 ARG A 130 -4.366 -17.167 -17.693 1.00 12.32 H new ATOM 2103 N CYS A 131 1.967 -10.195 -19.099 1.00 33.03 N ATOM 2104 CA CYS A 131 2.670 -10.009 -20.363 1.00 22.41 C ATOM 2105 C CYS A 131 4.103 -9.545 -20.125 1.00 24.34 C ATOM 2106 O CYS A 131 4.376 -8.795 -19.188 1.00 54.22 O ATOM 2107 CB CYS A 131 1.932 -8.995 -21.237 1.00 74.24 C ATOM 2108 SG CYS A 131 2.407 -9.040 -22.981 1.00 54.24 S ATOM 0 H CYS A 131 2.284 -9.584 -18.346 1.00 33.03 H new ATOM 0 HA CYS A 131 2.699 -10.969 -20.878 1.00 22.41 H new ATOM 0 HB2 CYS A 131 0.860 -9.176 -21.159 1.00 74.24 H new ATOM 0 HB3 CYS A 131 2.116 -7.994 -20.847 1.00 74.24 H new ATOM 0 HG CYS A 131 1.727 -8.148 -23.639 1.00 54.24 H new ATOM 2114 N ALA A 132 5.016 -9.999 -20.978 1.00 2.45 N ATOM 2115 CA ALA A 132 6.421 -9.630 -20.860 1.00 5.30 C ATOM 2116 C ALA A 132 6.872 -8.795 -22.054 1.00 72.54 C ATOM 2117 O ALA A 132 6.765 -9.229 -23.201 1.00 23.31 O ATOM 2118 CB ALA A 132 7.285 -10.876 -20.728 1.00 51.53 C ATOM 0 H ALA A 132 4.807 -10.623 -21.758 1.00 2.45 H new ATOM 0 HA ALA A 132 6.537 -9.024 -19.962 1.00 5.30 H new ATOM 0 HB1 ALA A 132 8.332 -10.585 -20.641 1.00 51.53 H new ATOM 0 HB2 ALA A 132 6.988 -11.432 -19.839 1.00 51.53 H new ATOM 0 HB3 ALA A 132 7.155 -11.504 -21.609 1.00 51.53 H new ATOM 2124 N GLU A 133 7.374 -7.596 -21.777 1.00 62.31 N ATOM 2125 CA GLU A 133 7.839 -6.701 -22.830 1.00 71.45 C ATOM 2126 C GLU A 133 9.172 -6.062 -22.452 1.00 71.03 C ATOM 2127 O GLU A 133 9.423 -5.769 -21.283 1.00 63.13 O ATOM 2128 CB GLU A 133 6.798 -5.613 -23.102 1.00 72.52 C ATOM 2129 CG GLU A 133 6.227 -5.655 -24.510 1.00 21.22 C ATOM 2130 CD GLU A 133 5.199 -4.568 -24.755 1.00 2.40 C ATOM 2131 OE1 GLU A 133 4.033 -4.752 -24.347 1.00 42.41 O ATOM 2132 OE2 GLU A 133 5.560 -3.534 -25.354 1.00 42.54 O ATOM 0 H GLU A 133 7.469 -7.222 -20.833 1.00 62.31 H new ATOM 0 HA GLU A 133 7.983 -7.291 -23.735 1.00 71.45 H new ATOM 0 HB2 GLU A 133 5.983 -5.714 -22.385 1.00 72.52 H new ATOM 0 HB3 GLU A 133 7.252 -4.637 -22.932 1.00 72.52 H new ATOM 0 HG2 GLU A 133 7.038 -5.552 -25.230 1.00 21.22 H new ATOM 0 HG3 GLU A 133 5.769 -6.629 -24.683 1.00 21.22 H new ATOM 2139 N VAL A 134 10.024 -5.849 -23.450 1.00 54.25 N ATOM 2140 CA VAL A 134 11.331 -5.244 -23.224 1.00 52.01 C ATOM 2141 C VAL A 134 11.790 -4.454 -24.445 1.00 34.14 C ATOM 2142 O VAL A 134 11.595 -4.880 -25.584 1.00 32.04 O ATOM 2143 CB VAL A 134 12.391 -6.309 -22.887 1.00 62.00 C ATOM 2144 CG1 VAL A 134 12.452 -7.366 -23.979 1.00 23.20 C ATOM 2145 CG2 VAL A 134 13.752 -5.660 -22.685 1.00 41.02 C ATOM 0 H VAL A 134 9.832 -6.087 -24.423 1.00 54.25 H new ATOM 0 HA VAL A 134 11.224 -4.567 -22.376 1.00 52.01 H new ATOM 0 HB VAL A 134 12.106 -6.799 -21.956 1.00 62.00 H new ATOM 0 HG11 VAL A 134 13.207 -8.110 -23.723 1.00 23.20 H new ATOM 0 HG12 VAL A 134 11.480 -7.851 -24.070 1.00 23.20 H new ATOM 0 HG13 VAL A 134 12.713 -6.895 -24.927 1.00 23.20 H new ATOM 0 HG21 VAL A 134 14.489 -6.427 -22.448 1.00 41.02 H new ATOM 0 HG22 VAL A 134 14.048 -5.143 -23.598 1.00 41.02 H new ATOM 0 HG23 VAL A 134 13.696 -4.945 -21.865 1.00 41.02 H new ATOM 2155 N THR A 135 12.402 -3.299 -24.200 1.00 34.52 N ATOM 2156 CA THR A 135 12.888 -2.449 -25.278 1.00 43.34 C ATOM 2157 C THR A 135 14.133 -1.679 -24.852 1.00 42.04 C ATOM 2158 O THR A 135 14.098 -0.901 -23.898 1.00 43.21 O ATOM 2159 CB THR A 135 11.810 -1.447 -25.734 1.00 22.30 C ATOM 2160 OG1 THR A 135 10.658 -2.151 -26.211 1.00 30.11 O ATOM 2161 CG2 THR A 135 12.345 -0.538 -26.830 1.00 51.01 C ATOM 0 H THR A 135 12.572 -2.932 -23.264 1.00 34.52 H new ATOM 0 HA THR A 135 13.137 -3.107 -26.111 1.00 43.34 H new ATOM 0 HB THR A 135 11.531 -0.832 -24.878 1.00 22.30 H new ATOM 0 HG1 THR A 135 9.977 -1.507 -26.497 1.00 30.11 H new ATOM 0 HG21 THR A 135 11.566 0.161 -27.136 1.00 51.01 H new ATOM 0 HG22 THR A 135 13.204 0.018 -26.455 1.00 51.01 H new ATOM 0 HG23 THR A 135 12.649 -1.140 -27.686 1.00 51.01 H new ATOM 2169 N LEU A 136 15.232 -1.900 -25.565 1.00 42.22 N ATOM 2170 CA LEU A 136 16.490 -1.225 -25.261 1.00 74.51 C ATOM 2171 C LEU A 136 17.119 -0.650 -26.526 1.00 34.10 C ATOM 2172 O LEU A 136 17.132 -1.297 -27.573 1.00 4.23 O ATOM 2173 CB LEU A 136 17.463 -2.197 -24.590 1.00 54.33 C ATOM 2174 CG LEU A 136 17.887 -3.406 -25.425 1.00 53.51 C ATOM 2175 CD1 LEU A 136 19.373 -3.343 -25.739 1.00 5.43 C ATOM 2176 CD2 LEU A 136 17.547 -4.700 -24.700 1.00 50.24 C ATOM 0 H LEU A 136 15.278 -2.541 -26.357 1.00 42.22 H new ATOM 0 HA LEU A 136 16.277 -0.403 -24.578 1.00 74.51 H new ATOM 0 HB2 LEU A 136 18.359 -1.645 -24.306 1.00 54.33 H new ATOM 0 HB3 LEU A 136 17.006 -2.559 -23.669 1.00 54.33 H new ATOM 0 HG LEU A 136 17.337 -3.385 -26.366 1.00 53.51 H new ATOM 0 HD11 LEU A 136 19.656 -4.211 -26.334 1.00 5.43 H new ATOM 0 HD12 LEU A 136 19.588 -2.433 -26.300 1.00 5.43 H new ATOM 0 HD13 LEU A 136 19.942 -3.339 -24.809 1.00 5.43 H new ATOM 0 HD21 LEU A 136 17.856 -5.550 -25.309 1.00 50.24 H new ATOM 0 HD22 LEU A 136 18.070 -4.729 -23.744 1.00 50.24 H new ATOM 0 HD23 LEU A 136 16.472 -4.749 -24.527 1.00 50.24 H new