USER MOD reduce.3.24.130724 H: found=0, std=0, add=588, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 594 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 158 SER OG : rot -150:sc= 0 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 172 SER OG : rot 73:sc= 0.232 USER MOD Single : A 173 HIS : no HE2:sc= -0.843 K(o=-0.84,f=-3.3!) USER MOD Single : A 182 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 THR OG1 : rot 46:sc= 1.12 USER MOD Single : B 158 SER OG : rot 113:sc= 0.426 USER MOD Single : B 163 LYS NZ :NH3+ -168:sc= -0.0272 (180deg=-0.197) USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 172 SER OG : rot 72:sc= 0.4 USER MOD Single : B 173 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-3.5!) USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD Single : B 188 THR OG1 : rot 180:sc=-0.00289 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 154 -25.307 4.348 -8.122 1.00 7.13 N ATOM 2 CA GLY A 154 -25.031 3.138 -7.297 1.00 6.87 C ATOM 3 C GLY A 154 -25.015 3.441 -5.813 1.00 6.46 C ATOM 4 O GLY A 154 -25.825 2.909 -5.054 1.00 6.66 O ATOM 0 HA2 GLY A 154 -25.788 2.381 -7.502 1.00 6.87 H new ATOM 0 HA3 GLY A 154 -24.070 2.714 -7.589 1.00 6.87 H new ATOM 10 N GLY A 155 -24.088 4.299 -5.397 1.00 6.07 N ATOM 11 CA GLY A 155 -23.986 4.658 -3.995 1.00 5.79 C ATOM 12 C GLY A 155 -24.256 6.130 -3.752 1.00 5.77 C ATOM 13 O GLY A 155 -24.400 6.906 -4.697 1.00 5.89 O ATOM 0 H GLY A 155 -23.406 4.751 -6.006 1.00 6.07 H new ATOM 0 HA2 GLY A 155 -24.693 4.062 -3.418 1.00 5.79 H new ATOM 0 HA3 GLY A 155 -22.989 4.410 -3.631 1.00 5.79 H new ATOM 17 N ILE A 156 -24.326 6.516 -2.482 1.00 5.76 N ATOM 18 CA ILE A 156 -24.581 7.903 -2.115 1.00 5.93 C ATOM 19 C ILE A 156 -23.374 8.782 -2.431 1.00 5.47 C ATOM 20 O ILE A 156 -23.471 9.731 -3.210 1.00 5.66 O ATOM 21 CB ILE A 156 -24.917 8.033 -0.616 1.00 6.19 C ATOM 22 CG1 ILE A 156 -26.126 7.164 -0.265 1.00 6.65 C ATOM 23 CG2 ILE A 156 -25.181 9.487 -0.252 1.00 6.57 C ATOM 24 CD1 ILE A 156 -26.475 7.181 1.207 1.00 7.47 C ATOM 0 H ILE A 156 -24.209 5.886 -1.689 1.00 5.76 H new ATOM 0 HA ILE A 156 -25.437 8.237 -2.702 1.00 5.93 H new ATOM 0 HB ILE A 156 -24.061 7.685 -0.038 1.00 6.19 H new ATOM 0 HG12 ILE A 156 -26.988 7.506 -0.838 1.00 6.65 H new ATOM 0 HG13 ILE A 156 -25.926 6.137 -0.571 1.00 6.65 H new ATOM 0 HG21 ILE A 156 -25.416 9.559 0.810 1.00 6.57 H new ATOM 0 HG22 ILE A 156 -24.294 10.083 -0.468 1.00 6.57 H new ATOM 0 HG23 ILE A 156 -26.021 9.862 -0.836 1.00 6.57 H new ATOM 0 HD11 ILE A 156 -27.341 6.543 1.383 1.00 7.47 H new ATOM 0 HD12 ILE A 156 -25.629 6.811 1.786 1.00 7.47 H new ATOM 0 HD13 ILE A 156 -26.707 8.201 1.514 1.00 7.47 H new ATOM 36 N PHE A 157 -22.239 8.458 -1.824 1.00 4.98 N ATOM 37 CA PHE A 157 -21.012 9.215 -2.037 1.00 4.58 C ATOM 38 C PHE A 157 -20.393 8.880 -3.388 1.00 4.34 C ATOM 39 O PHE A 157 -20.313 9.733 -4.271 1.00 4.45 O ATOM 40 CB PHE A 157 -20.008 8.921 -0.920 1.00 4.32 C ATOM 41 CG PHE A 157 -20.499 9.311 0.444 1.00 4.64 C ATOM 42 CD1 PHE A 157 -21.299 8.450 1.179 1.00 4.83 C ATOM 43 CD2 PHE A 157 -20.162 10.539 0.991 1.00 5.07 C ATOM 44 CE1 PHE A 157 -21.753 8.808 2.435 1.00 5.16 C ATOM 45 CE2 PHE A 157 -20.614 10.901 2.247 1.00 5.44 C ATOM 46 CZ PHE A 157 -21.411 10.034 2.969 1.00 5.37 C ATOM 0 H PHE A 157 -22.143 7.674 -1.179 1.00 4.98 H new ATOM 0 HA PHE A 157 -21.263 10.276 -2.025 1.00 4.58 H new ATOM 0 HB2 PHE A 157 -19.775 7.856 -0.923 1.00 4.32 H new ATOM 0 HB3 PHE A 157 -19.079 9.451 -1.128 1.00 4.32 H new ATOM 0 HD1 PHE A 157 -21.570 7.490 0.766 1.00 4.83 H new ATOM 0 HD2 PHE A 157 -19.540 11.221 0.430 1.00 5.07 H new ATOM 0 HE1 PHE A 157 -22.375 8.128 2.998 1.00 5.16 H new ATOM 0 HE2 PHE A 157 -20.344 11.860 2.663 1.00 5.44 H new ATOM 0 HZ PHE A 157 -21.766 10.315 3.950 1.00 5.37 H new ATOM 56 N SER A 158 -19.964 7.630 -3.543 1.00 4.12 N ATOM 57 CA SER A 158 -19.345 7.176 -4.782 1.00 4.02 C ATOM 58 C SER A 158 -18.211 8.110 -5.209 1.00 3.76 C ATOM 59 O SER A 158 -17.055 7.891 -4.855 1.00 3.52 O ATOM 60 CB SER A 158 -20.392 7.065 -5.894 1.00 4.46 C ATOM 61 OG SER A 158 -21.302 6.011 -5.635 1.00 4.61 O ATOM 0 H SER A 158 -20.035 6.912 -2.822 1.00 4.12 H new ATOM 0 HA SER A 158 -18.918 6.189 -4.602 1.00 4.02 H new ATOM 0 HB2 SER A 158 -20.936 8.006 -5.981 1.00 4.46 H new ATOM 0 HB3 SER A 158 -19.896 6.894 -6.849 1.00 4.46 H new ATOM 0 HG SER A 158 -21.627 5.644 -6.483 1.00 4.61 H new ATOM 67 N ALA A 159 -18.546 9.153 -5.961 1.00 3.90 N ATOM 68 CA ALA A 159 -17.547 10.105 -6.430 1.00 3.72 C ATOM 69 C ALA A 159 -16.772 10.716 -5.266 1.00 3.49 C ATOM 70 O ALA A 159 -15.557 10.553 -5.164 1.00 3.16 O ATOM 71 CB ALA A 159 -18.209 11.198 -7.255 1.00 4.05 C ATOM 0 H ALA A 159 -19.500 9.360 -6.258 1.00 3.90 H new ATOM 0 HA ALA A 159 -16.838 9.566 -7.058 1.00 3.72 H new ATOM 0 HB1 ALA A 159 -17.452 11.903 -7.599 1.00 4.05 H new ATOM 0 HB2 ALA A 159 -18.708 10.752 -8.115 1.00 4.05 H new ATOM 0 HB3 ALA A 159 -18.942 11.723 -6.642 1.00 4.05 H new ATOM 77 N GLU A 160 -17.485 11.415 -4.389 1.00 3.73 N ATOM 78 CA GLU A 160 -16.862 12.061 -3.237 1.00 3.65 C ATOM 79 C GLU A 160 -16.110 11.054 -2.370 1.00 3.31 C ATOM 80 O GLU A 160 -15.131 11.401 -1.711 1.00 3.18 O ATOM 81 CB GLU A 160 -17.916 12.785 -2.396 1.00 4.04 C ATOM 82 CG GLU A 160 -18.436 14.063 -3.038 1.00 4.66 C ATOM 83 CD GLU A 160 -19.159 13.810 -4.346 1.00 5.01 C ATOM 84 OE1 GLU A 160 -18.494 13.815 -5.403 1.00 5.46 O ATOM 85 OE2 GLU A 160 -20.392 13.608 -4.314 1.00 5.23 O ATOM 0 H GLU A 160 -18.494 11.549 -4.453 1.00 3.73 H new ATOM 0 HA GLU A 160 -16.143 12.787 -3.616 1.00 3.65 H new ATOM 0 HB2 GLU A 160 -18.754 12.110 -2.219 1.00 4.04 H new ATOM 0 HB3 GLU A 160 -17.489 13.025 -1.422 1.00 4.04 H new ATOM 0 HG2 GLU A 160 -19.112 14.563 -2.345 1.00 4.66 H new ATOM 0 HG3 GLU A 160 -17.601 14.741 -3.215 1.00 4.66 H new ATOM 92 N PHE A 161 -16.572 9.808 -2.373 1.00 3.23 N ATOM 93 CA PHE A 161 -15.937 8.761 -1.579 1.00 2.95 C ATOM 94 C PHE A 161 -14.624 8.310 -2.210 1.00 2.57 C ATOM 95 O PHE A 161 -13.592 8.247 -1.541 1.00 2.28 O ATOM 96 CB PHE A 161 -16.877 7.565 -1.426 1.00 3.11 C ATOM 97 CG PHE A 161 -16.318 6.471 -0.562 1.00 2.87 C ATOM 98 CD1 PHE A 161 -16.496 6.496 0.812 1.00 2.82 C ATOM 99 CD2 PHE A 161 -15.612 5.419 -1.123 1.00 3.09 C ATOM 100 CE1 PHE A 161 -15.981 5.493 1.610 1.00 2.72 C ATOM 101 CE2 PHE A 161 -15.094 4.413 -0.330 1.00 2.88 C ATOM 102 CZ PHE A 161 -15.279 4.449 1.039 1.00 2.54 C ATOM 0 H PHE A 161 -17.380 9.499 -2.913 1.00 3.23 H new ATOM 0 HA PHE A 161 -15.720 9.175 -0.594 1.00 2.95 H new ATOM 0 HB2 PHE A 161 -17.821 7.907 -1.001 1.00 3.11 H new ATOM 0 HB3 PHE A 161 -17.100 7.160 -2.413 1.00 3.11 H new ATOM 0 HD1 PHE A 161 -17.044 7.309 1.264 1.00 2.82 H new ATOM 0 HD2 PHE A 161 -15.465 5.385 -2.192 1.00 3.09 H new ATOM 0 HE1 PHE A 161 -16.127 5.525 2.680 1.00 2.72 H new ATOM 0 HE2 PHE A 161 -14.545 3.599 -0.780 1.00 2.88 H new ATOM 0 HZ PHE A 161 -14.876 3.663 1.661 1.00 2.54 H new ATOM 112 N LEU A 162 -14.668 7.995 -3.500 1.00 2.64 N ATOM 113 CA LEU A 162 -13.480 7.543 -4.215 1.00 2.41 C ATOM 114 C LEU A 162 -12.406 8.628 -4.243 1.00 2.23 C ATOM 115 O LEU A 162 -11.214 8.331 -4.154 1.00 1.96 O ATOM 116 CB LEU A 162 -13.847 7.125 -5.641 1.00 2.72 C ATOM 117 CG LEU A 162 -14.803 5.934 -5.737 1.00 2.97 C ATOM 118 CD1 LEU A 162 -15.028 5.544 -7.188 1.00 3.35 C ATOM 119 CD2 LEU A 162 -14.265 4.754 -4.941 1.00 2.73 C ATOM 0 H LEU A 162 -15.512 8.044 -4.071 1.00 2.64 H new ATOM 0 HA LEU A 162 -13.075 6.681 -3.685 1.00 2.41 H new ATOM 0 HB2 LEU A 162 -14.299 7.977 -6.149 1.00 2.72 H new ATOM 0 HB3 LEU A 162 -12.931 6.882 -6.180 1.00 2.72 H new ATOM 0 HG LEU A 162 -15.762 6.227 -5.310 1.00 2.97 H new ATOM 0 HD11 LEU A 162 -15.710 4.695 -7.235 1.00 3.35 H new ATOM 0 HD12 LEU A 162 -15.459 6.387 -7.729 1.00 3.35 H new ATOM 0 HD13 LEU A 162 -14.076 5.270 -7.643 1.00 3.35 H new ATOM 0 HD21 LEU A 162 -14.957 3.916 -5.020 1.00 2.73 H new ATOM 0 HD22 LEU A 162 -13.293 4.461 -5.337 1.00 2.73 H new ATOM 0 HD23 LEU A 162 -14.159 5.039 -3.894 1.00 2.73 H new ATOM 131 N LYS A 163 -12.830 9.882 -4.367 1.00 2.45 N ATOM 132 CA LYS A 163 -11.892 11.000 -4.402 1.00 2.39 C ATOM 133 C LYS A 163 -11.017 11.021 -3.152 1.00 2.08 C ATOM 134 O LYS A 163 -9.923 11.586 -3.158 1.00 1.99 O ATOM 135 CB LYS A 163 -12.642 12.328 -4.539 1.00 2.73 C ATOM 136 CG LYS A 163 -13.236 12.550 -5.921 1.00 3.30 C ATOM 137 CD LYS A 163 -13.732 13.976 -6.093 1.00 3.60 C ATOM 138 CE LYS A 163 -14.898 14.281 -5.168 1.00 3.55 C ATOM 139 NZ LYS A 163 -15.371 15.687 -5.315 1.00 3.93 N ATOM 0 H LYS A 163 -13.811 10.149 -4.445 1.00 2.45 H new ATOM 0 HA LYS A 163 -11.248 10.867 -5.271 1.00 2.39 H new ATOM 0 HB2 LYS A 163 -13.441 12.363 -3.799 1.00 2.73 H new ATOM 0 HB3 LYS A 163 -11.960 13.147 -4.310 1.00 2.73 H new ATOM 0 HG2 LYS A 163 -12.485 12.331 -6.680 1.00 3.30 H new ATOM 0 HG3 LYS A 163 -14.061 11.855 -6.079 1.00 3.30 H new ATOM 0 HD2 LYS A 163 -12.917 14.671 -5.893 1.00 3.60 H new ATOM 0 HD3 LYS A 163 -14.038 14.133 -7.127 1.00 3.60 H new ATOM 0 HE2 LYS A 163 -15.720 13.597 -5.382 1.00 3.55 H new ATOM 0 HE3 LYS A 163 -14.598 14.105 -4.135 1.00 3.55 H new ATOM 0 HZ1 LYS A 163 -16.167 15.855 -4.667 1.00 3.93 H new ATOM 0 HZ2 LYS A 163 -14.595 16.340 -5.086 1.00 3.93 H new ATOM 0 HZ3 LYS A 163 -15.682 15.848 -6.294 1.00 3.93 H new ATOM 153 N VAL A 164 -11.506 10.406 -2.080 1.00 2.04 N ATOM 154 CA VAL A 164 -10.765 10.352 -0.826 1.00 1.90 C ATOM 155 C VAL A 164 -10.390 8.916 -0.474 1.00 1.69 C ATOM 156 O VAL A 164 -10.288 8.560 0.700 1.00 1.85 O ATOM 157 CB VAL A 164 -11.574 10.959 0.335 1.00 2.27 C ATOM 158 CG1 VAL A 164 -11.760 12.455 0.132 1.00 2.48 C ATOM 159 CG2 VAL A 164 -12.920 10.261 0.468 1.00 2.51 C ATOM 0 H VAL A 164 -12.412 9.938 -2.055 1.00 2.04 H new ATOM 0 HA VAL A 164 -9.858 10.939 -0.969 1.00 1.90 H new ATOM 0 HB VAL A 164 -11.018 10.808 1.260 1.00 2.27 H new ATOM 0 HG11 VAL A 164 -12.334 12.866 0.962 1.00 2.48 H new ATOM 0 HG12 VAL A 164 -10.785 12.940 0.089 1.00 2.48 H new ATOM 0 HG13 VAL A 164 -12.295 12.632 -0.801 1.00 2.48 H new ATOM 0 HG21 VAL A 164 -13.479 10.702 1.293 1.00 2.51 H new ATOM 0 HG22 VAL A 164 -13.484 10.380 -0.457 1.00 2.51 H new ATOM 0 HG23 VAL A 164 -12.762 9.200 0.663 1.00 2.51 H new ATOM 169 N PHE A 165 -10.187 8.097 -1.500 1.00 1.49 N ATOM 170 CA PHE A 165 -9.824 6.697 -1.303 1.00 1.32 C ATOM 171 C PHE A 165 -8.690 6.294 -2.238 1.00 1.13 C ATOM 172 O PHE A 165 -7.613 5.898 -1.791 1.00 0.96 O ATOM 173 CB PHE A 165 -11.040 5.799 -1.538 1.00 1.48 C ATOM 174 CG PHE A 165 -10.738 4.334 -1.405 1.00 1.40 C ATOM 175 CD1 PHE A 165 -10.684 3.735 -0.156 1.00 1.57 C ATOM 176 CD2 PHE A 165 -10.511 3.554 -2.528 1.00 2.06 C ATOM 177 CE1 PHE A 165 -10.409 2.387 -0.030 1.00 1.61 C ATOM 178 CE2 PHE A 165 -10.235 2.205 -2.408 1.00 2.08 C ATOM 179 CZ PHE A 165 -10.184 1.620 -1.158 1.00 1.47 C ATOM 0 H PHE A 165 -10.268 8.378 -2.477 1.00 1.49 H new ATOM 0 HA PHE A 165 -9.483 6.574 -0.275 1.00 1.32 H new ATOM 0 HB2 PHE A 165 -11.822 6.067 -0.827 1.00 1.48 H new ATOM 0 HB3 PHE A 165 -11.436 5.991 -2.535 1.00 1.48 H new ATOM 0 HD1 PHE A 165 -10.859 4.329 0.729 1.00 1.57 H new ATOM 0 HD2 PHE A 165 -10.550 4.006 -3.508 1.00 2.06 H new ATOM 0 HE1 PHE A 165 -10.370 1.933 0.949 1.00 1.61 H new ATOM 0 HE2 PHE A 165 -10.059 1.609 -3.291 1.00 2.08 H new ATOM 0 HZ PHE A 165 -9.969 0.566 -1.062 1.00 1.47 H new ATOM 189 N LEU A 166 -8.937 6.400 -3.539 1.00 1.25 N ATOM 190 CA LEU A 166 -7.937 6.046 -4.539 1.00 1.22 C ATOM 191 C LEU A 166 -6.597 6.734 -4.266 1.00 1.03 C ATOM 192 O LEU A 166 -5.544 6.103 -4.370 1.00 0.95 O ATOM 193 CB LEU A 166 -8.436 6.400 -5.943 1.00 1.49 C ATOM 194 CG LEU A 166 -9.759 5.746 -6.339 1.00 1.76 C ATOM 195 CD1 LEU A 166 -10.232 6.270 -7.686 1.00 2.04 C ATOM 196 CD2 LEU A 166 -9.612 4.233 -6.377 1.00 1.79 C ATOM 0 H LEU A 166 -9.822 6.728 -3.926 1.00 1.25 H new ATOM 0 HA LEU A 166 -7.778 4.969 -4.478 1.00 1.22 H new ATOM 0 HB2 LEU A 166 -8.548 7.482 -6.011 1.00 1.49 H new ATOM 0 HB3 LEU A 166 -7.674 6.112 -6.667 1.00 1.49 H new ATOM 0 HG LEU A 166 -10.508 6.002 -5.590 1.00 1.76 H new ATOM 0 HD11 LEU A 166 -11.175 5.793 -7.951 1.00 2.04 H new ATOM 0 HD12 LEU A 166 -10.375 7.349 -7.627 1.00 2.04 H new ATOM 0 HD13 LEU A 166 -9.485 6.044 -8.447 1.00 2.04 H new ATOM 0 HD21 LEU A 166 -10.563 3.782 -6.661 1.00 1.79 H new ATOM 0 HD22 LEU A 166 -8.849 3.960 -7.106 1.00 1.79 H new ATOM 0 HD23 LEU A 166 -9.318 3.871 -5.392 1.00 1.79 H new ATOM 208 N PRO A 167 -6.609 8.035 -3.910 1.00 1.04 N ATOM 209 CA PRO A 167 -5.378 8.781 -3.627 1.00 0.94 C ATOM 210 C PRO A 167 -4.676 8.280 -2.369 1.00 0.80 C ATOM 211 O PRO A 167 -3.474 8.008 -2.383 1.00 0.85 O ATOM 212 CB PRO A 167 -5.856 10.227 -3.428 1.00 1.03 C ATOM 213 CG PRO A 167 -7.250 10.261 -3.959 1.00 1.28 C ATOM 214 CD PRO A 167 -7.800 8.882 -3.756 1.00 1.26 C ATOM 0 HA PRO A 167 -4.650 8.671 -4.431 1.00 0.94 H new ATOM 0 HB2 PRO A 167 -5.830 10.508 -2.375 1.00 1.03 H new ATOM 0 HB3 PRO A 167 -5.215 10.929 -3.961 1.00 1.03 H new ATOM 0 HG2 PRO A 167 -7.851 11.003 -3.432 1.00 1.28 H new ATOM 0 HG3 PRO A 167 -7.260 10.534 -5.014 1.00 1.28 H new ATOM 0 HD2 PRO A 167 -8.254 8.768 -2.772 1.00 1.26 H new ATOM 0 HD3 PRO A 167 -8.567 8.640 -4.491 1.00 1.26 H new ATOM 222 N SER A 168 -5.432 8.157 -1.282 1.00 0.76 N ATOM 223 CA SER A 168 -4.884 7.691 -0.011 1.00 0.70 C ATOM 224 C SER A 168 -4.027 6.442 -0.206 1.00 0.57 C ATOM 225 O SER A 168 -2.879 6.391 0.237 1.00 0.51 O ATOM 226 CB SER A 168 -6.013 7.395 0.977 1.00 0.82 C ATOM 227 OG SER A 168 -5.501 6.934 2.215 1.00 1.39 O ATOM 0 H SER A 168 -6.428 8.374 -1.255 1.00 0.76 H new ATOM 0 HA SER A 168 -4.252 8.483 0.391 1.00 0.70 H new ATOM 0 HB2 SER A 168 -6.605 8.296 1.138 1.00 0.82 H new ATOM 0 HB3 SER A 168 -6.682 6.645 0.555 1.00 0.82 H new ATOM 0 HG SER A 168 -6.243 6.754 2.829 1.00 1.39 H new ATOM 233 N LEU A 169 -4.591 5.440 -0.871 1.00 0.58 N ATOM 234 CA LEU A 169 -3.877 4.194 -1.123 1.00 0.51 C ATOM 235 C LEU A 169 -2.619 4.445 -1.948 1.00 0.41 C ATOM 236 O LEU A 169 -1.564 3.868 -1.682 1.00 0.36 O ATOM 237 CB LEU A 169 -4.784 3.197 -1.844 1.00 0.64 C ATOM 238 CG LEU A 169 -6.098 2.881 -1.128 1.00 0.77 C ATOM 239 CD1 LEU A 169 -6.851 1.783 -1.862 1.00 1.07 C ATOM 240 CD2 LEU A 169 -5.836 2.481 0.315 1.00 0.81 C ATOM 0 H LEU A 169 -5.540 5.466 -1.245 1.00 0.58 H new ATOM 0 HA LEU A 169 -3.581 3.774 -0.162 1.00 0.51 H new ATOM 0 HB2 LEU A 169 -5.013 3.589 -2.835 1.00 0.64 H new ATOM 0 HB3 LEU A 169 -4.234 2.267 -1.988 1.00 0.64 H new ATOM 0 HG LEU A 169 -6.716 3.779 -1.126 1.00 0.77 H new ATOM 0 HD11 LEU A 169 -7.784 1.570 -1.340 1.00 1.07 H new ATOM 0 HD12 LEU A 169 -7.071 2.109 -2.879 1.00 1.07 H new ATOM 0 HD13 LEU A 169 -6.239 0.881 -1.895 1.00 1.07 H new ATOM 0 HD21 LEU A 169 -6.782 2.260 0.809 1.00 0.81 H new ATOM 0 HD22 LEU A 169 -5.199 1.596 0.338 1.00 0.81 H new ATOM 0 HD23 LEU A 169 -5.338 3.300 0.835 1.00 0.81 H new ATOM 252 N LEU A 170 -2.738 5.307 -2.953 1.00 0.46 N ATOM 253 CA LEU A 170 -1.611 5.635 -3.816 1.00 0.47 C ATOM 254 C LEU A 170 -0.446 6.202 -3.015 1.00 0.38 C ATOM 255 O LEU A 170 0.691 5.751 -3.146 1.00 0.39 O ATOM 256 CB LEU A 170 -2.039 6.624 -4.894 1.00 0.60 C ATOM 257 CG LEU A 170 -2.942 6.063 -6.004 1.00 0.73 C ATOM 258 CD1 LEU A 170 -2.443 6.531 -7.354 1.00 0.88 C ATOM 259 CD2 LEU A 170 -3.025 4.539 -5.983 1.00 1.12 C ATOM 0 H LEU A 170 -3.604 5.791 -3.189 1.00 0.46 H new ATOM 0 HA LEU A 170 -1.276 4.713 -4.292 1.00 0.47 H new ATOM 0 HB2 LEU A 170 -2.560 7.452 -4.413 1.00 0.60 H new ATOM 0 HB3 LEU A 170 -1.143 7.037 -5.357 1.00 0.60 H new ATOM 0 HG LEU A 170 -3.948 6.441 -5.822 1.00 0.73 H new ATOM 0 HD11 LEU A 170 -3.086 6.131 -8.138 1.00 0.88 H new ATOM 0 HD12 LEU A 170 -2.460 7.620 -7.391 1.00 0.88 H new ATOM 0 HD13 LEU A 170 -1.423 6.179 -7.507 1.00 0.88 H new ATOM 0 HD21 LEU A 170 -3.676 4.199 -6.788 1.00 1.12 H new ATOM 0 HD22 LEU A 170 -2.029 4.118 -6.119 1.00 1.12 H new ATOM 0 HD23 LEU A 170 -3.430 4.210 -5.026 1.00 1.12 H new ATOM 271 N LEU A 171 -0.739 7.197 -2.184 1.00 0.36 N ATOM 272 CA LEU A 171 0.281 7.830 -1.357 1.00 0.37 C ATOM 273 C LEU A 171 0.999 6.797 -0.493 1.00 0.32 C ATOM 274 O LEU A 171 2.222 6.818 -0.370 1.00 0.35 O ATOM 275 CB LEU A 171 -0.348 8.906 -0.470 1.00 0.44 C ATOM 276 CG LEU A 171 -1.172 9.959 -1.213 1.00 0.54 C ATOM 277 CD1 LEU A 171 -1.679 11.019 -0.248 1.00 0.64 C ATOM 278 CD2 LEU A 171 -0.348 10.595 -2.322 1.00 0.62 C ATOM 0 H LEU A 171 -1.676 7.582 -2.066 1.00 0.36 H new ATOM 0 HA LEU A 171 1.012 8.296 -2.018 1.00 0.37 H new ATOM 0 HB2 LEU A 171 -0.988 8.420 0.266 1.00 0.44 H new ATOM 0 HB3 LEU A 171 0.446 9.410 0.081 1.00 0.44 H new ATOM 0 HG LEU A 171 -2.033 9.467 -1.664 1.00 0.54 H new ATOM 0 HD11 LEU A 171 -2.263 11.759 -0.795 1.00 0.64 H new ATOM 0 HD12 LEU A 171 -2.306 10.550 0.511 1.00 0.64 H new ATOM 0 HD13 LEU A 171 -0.832 11.508 0.233 1.00 0.64 H new ATOM 0 HD21 LEU A 171 -0.950 11.342 -2.840 1.00 0.62 H new ATOM 0 HD22 LEU A 171 0.533 11.073 -1.893 1.00 0.62 H new ATOM 0 HD23 LEU A 171 -0.035 9.827 -3.029 1.00 0.62 H new ATOM 290 N SER A 172 0.227 5.895 0.105 1.00 0.28 N ATOM 291 CA SER A 172 0.787 4.854 0.959 1.00 0.29 C ATOM 292 C SER A 172 1.803 4.009 0.195 1.00 0.25 C ATOM 293 O SER A 172 2.931 3.817 0.650 1.00 0.27 O ATOM 294 CB SER A 172 -0.328 3.960 1.508 1.00 0.35 C ATOM 295 OG SER A 172 -1.249 4.710 2.282 1.00 0.42 O ATOM 0 H SER A 172 -0.788 5.864 0.014 1.00 0.28 H new ATOM 0 HA SER A 172 1.298 5.339 1.791 1.00 0.29 H new ATOM 0 HB2 SER A 172 -0.851 3.477 0.682 1.00 0.35 H new ATOM 0 HB3 SER A 172 0.105 3.168 2.119 1.00 0.35 H new ATOM 0 HG SER A 172 -1.796 5.267 1.690 1.00 0.42 H new ATOM 301 N HIS A 173 1.397 3.508 -0.968 1.00 0.23 N ATOM 302 CA HIS A 173 2.275 2.684 -1.792 1.00 0.24 C ATOM 303 C HIS A 173 3.603 3.390 -2.045 1.00 0.22 C ATOM 304 O HIS A 173 4.672 2.815 -1.840 1.00 0.24 O ATOM 305 CB HIS A 173 1.599 2.352 -3.123 1.00 0.31 C ATOM 306 CG HIS A 173 0.420 1.441 -2.983 1.00 0.37 C ATOM 307 ND1 HIS A 173 -0.882 1.863 -3.145 1.00 0.42 N ATOM 308 CD2 HIS A 173 0.353 0.118 -2.700 1.00 0.52 C ATOM 309 CE1 HIS A 173 -1.700 0.840 -2.968 1.00 0.48 C ATOM 310 NE2 HIS A 173 -0.975 -0.230 -2.697 1.00 0.53 N ATOM 0 H HIS A 173 0.467 3.658 -1.360 1.00 0.23 H new ATOM 0 HA HIS A 173 2.473 1.757 -1.253 1.00 0.24 H new ATOM 0 HB2 HIS A 173 1.278 3.278 -3.599 1.00 0.31 H new ATOM 0 HB3 HIS A 173 2.329 1.889 -3.787 1.00 0.31 H new ATOM 0 HD1 HIS A 173 -1.169 2.816 -3.367 1.00 0.42 H new ATOM 0 HD2 HIS A 173 1.188 -0.540 -2.512 1.00 0.52 H new ATOM 0 HE1 HIS A 173 -2.777 0.873 -3.034 1.00 0.48 H new ATOM 319 N LEU A 174 3.527 4.638 -2.492 1.00 0.22 N ATOM 320 CA LEU A 174 4.722 5.424 -2.773 1.00 0.26 C ATOM 321 C LEU A 174 5.610 5.522 -1.537 1.00 0.24 C ATOM 322 O LEU A 174 6.818 5.297 -1.608 1.00 0.29 O ATOM 323 CB LEU A 174 4.334 6.823 -3.252 1.00 0.31 C ATOM 324 CG LEU A 174 3.471 6.856 -4.514 1.00 0.36 C ATOM 325 CD1 LEU A 174 3.060 8.282 -4.845 1.00 0.42 C ATOM 326 CD2 LEU A 174 4.217 6.230 -5.682 1.00 0.42 C ATOM 0 H LEU A 174 2.650 5.128 -2.668 1.00 0.22 H new ATOM 0 HA LEU A 174 5.283 4.921 -3.561 1.00 0.26 H new ATOM 0 HB2 LEU A 174 3.798 7.330 -2.450 1.00 0.31 H new ATOM 0 HB3 LEU A 174 5.244 7.393 -3.437 1.00 0.31 H new ATOM 0 HG LEU A 174 2.568 6.275 -4.329 1.00 0.36 H new ATOM 0 HD11 LEU A 174 2.447 8.284 -5.746 1.00 0.42 H new ATOM 0 HD12 LEU A 174 2.488 8.698 -4.016 1.00 0.42 H new ATOM 0 HD13 LEU A 174 3.951 8.888 -5.011 1.00 0.42 H new ATOM 0 HD21 LEU A 174 3.590 6.261 -6.573 1.00 0.42 H new ATOM 0 HD22 LEU A 174 5.137 6.786 -5.866 1.00 0.42 H new ATOM 0 HD23 LEU A 174 4.460 5.194 -5.445 1.00 0.42 H new ATOM 338 N LEU A 175 5.002 5.858 -0.404 1.00 0.23 N ATOM 339 CA LEU A 175 5.738 5.986 0.849 1.00 0.27 C ATOM 340 C LEU A 175 6.375 4.658 1.248 1.00 0.24 C ATOM 341 O LEU A 175 7.551 4.608 1.606 1.00 0.27 O ATOM 342 CB LEU A 175 4.812 6.477 1.963 1.00 0.32 C ATOM 343 CG LEU A 175 4.254 7.888 1.767 1.00 0.37 C ATOM 344 CD1 LEU A 175 3.352 8.274 2.929 1.00 0.46 C ATOM 345 CD2 LEU A 175 5.387 8.891 1.612 1.00 0.46 C ATOM 0 H LEU A 175 4.002 6.046 -0.328 1.00 0.23 H new ATOM 0 HA LEU A 175 6.533 6.717 0.699 1.00 0.27 H new ATOM 0 HB2 LEU A 175 3.977 5.782 2.053 1.00 0.32 H new ATOM 0 HB3 LEU A 175 5.356 6.446 2.907 1.00 0.32 H new ATOM 0 HG LEU A 175 3.658 7.898 0.855 1.00 0.37 H new ATOM 0 HD11 LEU A 175 2.965 9.281 2.771 1.00 0.46 H new ATOM 0 HD12 LEU A 175 2.521 7.572 2.993 1.00 0.46 H new ATOM 0 HD13 LEU A 175 3.923 8.246 3.857 1.00 0.46 H new ATOM 0 HD21 LEU A 175 4.973 9.890 1.473 1.00 0.46 H new ATOM 0 HD22 LEU A 175 6.010 8.877 2.506 1.00 0.46 H new ATOM 0 HD23 LEU A 175 5.992 8.626 0.745 1.00 0.46 H new ATOM 357 N ALA A 176 5.594 3.584 1.182 1.00 0.21 N ATOM 358 CA ALA A 176 6.090 2.260 1.538 1.00 0.21 C ATOM 359 C ALA A 176 7.381 1.943 0.790 1.00 0.19 C ATOM 360 O ALA A 176 8.392 1.574 1.395 1.00 0.21 O ATOM 361 CB ALA A 176 5.033 1.205 1.244 1.00 0.21 C ATOM 0 H ALA A 176 4.618 3.605 0.886 1.00 0.21 H new ATOM 0 HA ALA A 176 6.307 2.252 2.606 1.00 0.21 H new ATOM 0 HB1 ALA A 176 5.416 0.221 1.514 1.00 0.21 H new ATOM 0 HB2 ALA A 176 4.136 1.417 1.825 1.00 0.21 H new ATOM 0 HB3 ALA A 176 4.789 1.220 0.182 1.00 0.21 H new ATOM 367 N ILE A 177 7.343 2.091 -0.531 1.00 0.18 N ATOM 368 CA ILE A 177 8.512 1.829 -1.357 1.00 0.20 C ATOM 369 C ILE A 177 9.695 2.663 -0.881 1.00 0.21 C ATOM 370 O ILE A 177 10.825 2.178 -0.813 1.00 0.23 O ATOM 371 CB ILE A 177 8.234 2.131 -2.844 1.00 0.23 C ATOM 372 CG1 ILE A 177 7.084 1.259 -3.352 1.00 0.25 C ATOM 373 CG2 ILE A 177 9.485 1.905 -3.681 1.00 0.27 C ATOM 374 CD1 ILE A 177 6.824 1.403 -4.836 1.00 0.47 C ATOM 0 H ILE A 177 6.517 2.390 -1.049 1.00 0.18 H new ATOM 0 HA ILE A 177 8.750 0.770 -1.261 1.00 0.20 H new ATOM 0 HB ILE A 177 7.947 3.178 -2.938 1.00 0.23 H new ATOM 0 HG12 ILE A 177 7.305 0.215 -3.130 1.00 0.25 H new ATOM 0 HG13 ILE A 177 6.176 1.515 -2.806 1.00 0.25 H new ATOM 0 HG21 ILE A 177 9.268 2.123 -4.727 1.00 0.27 H new ATOM 0 HG22 ILE A 177 10.281 2.562 -3.331 1.00 0.27 H new ATOM 0 HG23 ILE A 177 9.804 0.867 -3.586 1.00 0.27 H new ATOM 0 HD11 ILE A 177 5.996 0.756 -5.125 1.00 0.47 H new ATOM 0 HD12 ILE A 177 6.571 2.439 -5.062 1.00 0.47 H new ATOM 0 HD13 ILE A 177 7.718 1.118 -5.391 1.00 0.47 H new ATOM 386 N GLY A 178 9.425 3.923 -0.550 1.00 0.20 N ATOM 387 CA GLY A 178 10.473 4.801 -0.072 1.00 0.23 C ATOM 388 C GLY A 178 11.158 4.243 1.157 1.00 0.22 C ATOM 389 O GLY A 178 12.381 4.309 1.281 1.00 0.23 O ATOM 0 H GLY A 178 8.500 4.349 -0.605 1.00 0.20 H new ATOM 0 HA2 GLY A 178 11.209 4.951 -0.862 1.00 0.23 H new ATOM 0 HA3 GLY A 178 10.050 5.779 0.160 1.00 0.23 H new ATOM 393 N LEU A 179 10.364 3.692 2.072 1.00 0.21 N ATOM 394 CA LEU A 179 10.900 3.109 3.295 1.00 0.23 C ATOM 395 C LEU A 179 11.894 2.003 2.960 1.00 0.21 C ATOM 396 O LEU A 179 12.987 1.944 3.522 1.00 0.24 O ATOM 397 CB LEU A 179 9.772 2.546 4.162 1.00 0.27 C ATOM 398 CG LEU A 179 8.678 3.547 4.531 1.00 0.30 C ATOM 399 CD1 LEU A 179 7.666 2.910 5.472 1.00 0.36 C ATOM 400 CD2 LEU A 179 9.286 4.792 5.159 1.00 0.36 C ATOM 0 H LEU A 179 9.349 3.638 1.988 1.00 0.21 H new ATOM 0 HA LEU A 179 11.412 3.893 3.852 1.00 0.23 H new ATOM 0 HB2 LEU A 179 9.314 1.708 3.636 1.00 0.27 H new ATOM 0 HB3 LEU A 179 10.204 2.148 5.080 1.00 0.27 H new ATOM 0 HG LEU A 179 8.158 3.842 3.619 1.00 0.30 H new ATOM 0 HD11 LEU A 179 6.895 3.638 5.724 1.00 0.36 H new ATOM 0 HD12 LEU A 179 7.208 2.049 4.985 1.00 0.36 H new ATOM 0 HD13 LEU A 179 8.170 2.586 6.383 1.00 0.36 H new ATOM 0 HD21 LEU A 179 8.493 5.494 5.416 1.00 0.36 H new ATOM 0 HD22 LEU A 179 9.832 4.515 6.061 1.00 0.36 H new ATOM 0 HD23 LEU A 179 9.970 5.260 4.451 1.00 0.36 H new ATOM 412 N GLY A 180 11.502 1.128 2.039 1.00 0.20 N ATOM 413 CA GLY A 180 12.372 0.039 1.639 1.00 0.23 C ATOM 414 C GLY A 180 13.717 0.532 1.144 1.00 0.24 C ATOM 415 O GLY A 180 14.758 -0.024 1.494 1.00 0.28 O ATOM 0 H GLY A 180 10.600 1.154 1.564 1.00 0.20 H new ATOM 0 HA2 GLY A 180 12.522 -0.633 2.484 1.00 0.23 H new ATOM 0 HA3 GLY A 180 11.888 -0.541 0.853 1.00 0.23 H new ATOM 419 N ILE A 181 13.694 1.579 0.325 1.00 0.26 N ATOM 420 CA ILE A 181 14.918 2.153 -0.220 1.00 0.32 C ATOM 421 C ILE A 181 15.813 2.695 0.891 1.00 0.33 C ATOM 422 O ILE A 181 17.017 2.440 0.911 1.00 0.34 O ATOM 423 CB ILE A 181 14.610 3.286 -1.217 1.00 0.41 C ATOM 424 CG1 ILE A 181 13.696 2.776 -2.333 1.00 0.47 C ATOM 425 CG2 ILE A 181 15.899 3.849 -1.796 1.00 0.52 C ATOM 426 CD1 ILE A 181 14.301 1.651 -3.144 1.00 0.90 C ATOM 0 H ILE A 181 12.839 2.047 0.024 1.00 0.26 H new ATOM 0 HA ILE A 181 15.439 1.351 -0.743 1.00 0.32 H new ATOM 0 HB ILE A 181 14.094 4.087 -0.687 1.00 0.41 H new ATOM 0 HG12 ILE A 181 12.758 2.434 -1.895 1.00 0.47 H new ATOM 0 HG13 ILE A 181 13.453 3.604 -2.999 1.00 0.47 H new ATOM 0 HG21 ILE A 181 15.664 4.648 -2.499 1.00 0.52 H new ATOM 0 HG22 ILE A 181 16.518 4.244 -0.990 1.00 0.52 H new ATOM 0 HG23 ILE A 181 16.441 3.058 -2.315 1.00 0.52 H new ATOM 0 HD11 ILE A 181 13.598 1.340 -3.916 1.00 0.90 H new ATOM 0 HD12 ILE A 181 15.224 1.995 -3.611 1.00 0.90 H new ATOM 0 HD13 ILE A 181 14.518 0.807 -2.490 1.00 0.90 H new ATOM 438 N TYR A 182 15.215 3.443 1.813 1.00 0.35 N ATOM 439 CA TYR A 182 15.956 4.022 2.928 1.00 0.42 C ATOM 440 C TYR A 182 16.719 2.941 3.686 1.00 0.40 C ATOM 441 O TYR A 182 17.906 3.089 3.978 1.00 0.46 O ATOM 442 CB TYR A 182 15.003 4.751 3.878 1.00 0.49 C ATOM 443 CG TYR A 182 15.696 5.415 5.046 1.00 0.62 C ATOM 444 CD1 TYR A 182 16.155 6.723 4.954 1.00 1.34 C ATOM 445 CD2 TYR A 182 15.888 4.736 6.244 1.00 1.16 C ATOM 446 CE1 TYR A 182 16.785 7.335 6.020 1.00 1.44 C ATOM 447 CE2 TYR A 182 16.517 5.343 7.315 1.00 1.25 C ATOM 448 CZ TYR A 182 16.963 6.641 7.197 1.00 0.93 C ATOM 449 OH TYR A 182 17.591 7.248 8.261 1.00 1.09 O ATOM 0 H TYR A 182 14.219 3.662 1.810 1.00 0.35 H new ATOM 0 HA TYR A 182 16.673 4.738 2.526 1.00 0.42 H new ATOM 0 HB2 TYR A 182 14.453 5.506 3.317 1.00 0.49 H new ATOM 0 HB3 TYR A 182 14.270 4.040 4.259 1.00 0.49 H new ATOM 0 HD1 TYR A 182 16.017 7.271 4.033 1.00 1.34 H new ATOM 0 HD2 TYR A 182 15.540 3.718 6.339 1.00 1.16 H new ATOM 0 HE1 TYR A 182 17.136 8.352 5.931 1.00 1.44 H new ATOM 0 HE2 TYR A 182 16.658 4.802 8.239 1.00 1.25 H new ATOM 0 HH TYR A 182 17.635 6.623 9.015 1.00 1.09 H new ATOM 459 N ILE A 183 16.026 1.858 4.014 1.00 0.36 N ATOM 460 CA ILE A 183 16.637 0.746 4.730 1.00 0.42 C ATOM 461 C ILE A 183 17.749 0.106 3.904 1.00 0.41 C ATOM 462 O ILE A 183 18.860 -0.102 4.391 1.00 0.46 O ATOM 463 CB ILE A 183 15.591 -0.326 5.091 1.00 0.47 C ATOM 464 CG1 ILE A 183 14.460 0.293 5.914 1.00 0.56 C ATOM 465 CG2 ILE A 183 16.245 -1.469 5.855 1.00 0.58 C ATOM 466 CD1 ILE A 183 13.359 -0.686 6.259 1.00 0.80 C ATOM 0 H ILE A 183 15.039 1.726 3.795 1.00 0.36 H new ATOM 0 HA ILE A 183 17.062 1.151 5.648 1.00 0.42 H new ATOM 0 HB ILE A 183 15.169 -0.726 4.169 1.00 0.47 H new ATOM 0 HG12 ILE A 183 14.874 0.702 6.836 1.00 0.56 H new ATOM 0 HG13 ILE A 183 14.032 1.128 5.359 1.00 0.56 H new ATOM 0 HG21 ILE A 183 15.493 -2.218 6.103 1.00 0.58 H new ATOM 0 HG22 ILE A 183 17.020 -1.923 5.237 1.00 0.58 H new ATOM 0 HG23 ILE A 183 16.691 -1.085 6.773 1.00 0.58 H new ATOM 0 HD11 ILE A 183 12.591 -0.179 6.843 1.00 0.80 H new ATOM 0 HD12 ILE A 183 12.919 -1.076 5.342 1.00 0.80 H new ATOM 0 HD13 ILE A 183 13.773 -1.509 6.841 1.00 0.80 H new ATOM 478 N GLY A 184 17.436 -0.204 2.647 1.00 0.39 N ATOM 479 CA GLY A 184 18.410 -0.823 1.765 1.00 0.46 C ATOM 480 C GLY A 184 19.623 0.051 1.505 1.00 0.50 C ATOM 481 O GLY A 184 20.761 -0.391 1.672 1.00 0.55 O ATOM 0 H GLY A 184 16.523 -0.037 2.224 1.00 0.39 H new ATOM 0 HA2 GLY A 184 18.737 -1.767 2.201 1.00 0.46 H new ATOM 0 HA3 GLY A 184 17.931 -1.060 0.815 1.00 0.46 H new ATOM 485 N ARG A 185 19.387 1.291 1.089 1.00 0.53 N ATOM 486 CA ARG A 185 20.477 2.219 0.800 1.00 0.65 C ATOM 487 C ARG A 185 21.341 2.466 2.037 1.00 0.67 C ATOM 488 O ARG A 185 22.464 2.959 1.926 1.00 0.76 O ATOM 489 CB ARG A 185 19.923 3.545 0.274 1.00 0.76 C ATOM 490 CG ARG A 185 19.057 4.281 1.274 1.00 0.72 C ATOM 491 CD ARG A 185 19.770 5.497 1.842 1.00 0.81 C ATOM 492 NE ARG A 185 20.042 6.499 0.816 1.00 1.27 N ATOM 493 CZ ARG A 185 20.705 7.627 1.045 1.00 1.59 C ATOM 494 NH1 ARG A 185 21.170 7.892 2.257 1.00 1.66 N ATOM 495 NH2 ARG A 185 20.904 8.493 0.059 1.00 2.24 N ATOM 0 H ARG A 185 18.454 1.677 0.944 1.00 0.53 H new ATOM 0 HA ARG A 185 21.105 1.765 0.033 1.00 0.65 H new ATOM 0 HB2 ARG A 185 20.755 4.187 -0.015 1.00 0.76 H new ATOM 0 HB3 ARG A 185 19.340 3.353 -0.627 1.00 0.76 H new ATOM 0 HG2 ARG A 185 18.130 4.593 0.793 1.00 0.72 H new ATOM 0 HG3 ARG A 185 18.784 3.607 2.085 1.00 0.72 H new ATOM 0 HD2 ARG A 185 19.160 5.940 2.629 1.00 0.81 H new ATOM 0 HD3 ARG A 185 20.708 5.186 2.302 1.00 0.81 H new ATOM 0 HE ARG A 185 19.704 6.323 -0.130 1.00 1.27 H new ATOM 0 HH11 ARG A 185 21.019 7.229 3.017 1.00 1.66 H new ATOM 0 HH12 ARG A 185 21.679 8.759 2.430 1.00 1.66 H new ATOM 0 HH21 ARG A 185 20.548 8.293 -0.875 1.00 2.24 H new ATOM 0 HH22 ARG A 185 21.413 9.359 0.236 1.00 2.24 H new ATOM 509 N ARG A 186 20.818 2.123 3.212 1.00 0.63 N ATOM 510 CA ARG A 186 21.554 2.312 4.458 1.00 0.73 C ATOM 511 C ARG A 186 21.950 0.971 5.068 1.00 0.74 C ATOM 512 O ARG A 186 21.804 0.760 6.272 1.00 0.86 O ATOM 513 CB ARG A 186 20.713 3.107 5.458 1.00 0.81 C ATOM 514 CG ARG A 186 20.292 4.475 4.948 1.00 1.80 C ATOM 515 CD ARG A 186 19.480 5.231 5.988 1.00 2.20 C ATOM 516 NE ARG A 186 20.275 5.574 7.164 1.00 2.90 N ATOM 517 CZ ARG A 186 21.022 6.672 7.260 1.00 3.61 C ATOM 518 NH1 ARG A 186 21.110 7.511 6.236 1.00 3.86 N ATOM 519 NH2 ARG A 186 21.690 6.925 8.376 1.00 4.48 N ATOM 0 H ARG A 186 19.891 1.714 3.327 1.00 0.63 H new ATOM 0 HA ARG A 186 22.462 2.870 4.230 1.00 0.73 H new ATOM 0 HB2 ARG A 186 19.822 2.532 5.708 1.00 0.81 H new ATOM 0 HB3 ARG A 186 21.281 3.231 6.380 1.00 0.81 H new ATOM 0 HG2 ARG A 186 21.177 5.054 4.684 1.00 1.80 H new ATOM 0 HG3 ARG A 186 19.703 4.360 4.038 1.00 1.80 H new ATOM 0 HD2 ARG A 186 19.081 6.142 5.543 1.00 2.20 H new ATOM 0 HD3 ARG A 186 18.627 4.624 6.292 1.00 2.20 H new ATOM 0 HE ARG A 186 20.257 4.935 7.959 1.00 2.90 H new ATOM 0 HH11 ARG A 186 20.604 7.316 5.372 1.00 3.86 H new ATOM 0 HH12 ARG A 186 21.683 8.351 6.313 1.00 3.86 H new ATOM 0 HH21 ARG A 186 21.632 6.278 9.163 1.00 4.48 H new ATOM 0 HH22 ARG A 186 22.262 7.766 8.448 1.00 4.48 H new ATOM 533 N LEU A 187 22.450 0.066 4.232 1.00 0.73 N ATOM 534 CA LEU A 187 22.865 -1.254 4.693 1.00 0.84 C ATOM 535 C LEU A 187 24.374 -1.311 4.903 1.00 1.03 C ATOM 536 O LEU A 187 24.862 -2.026 5.778 1.00 1.21 O ATOM 537 CB LEU A 187 22.438 -2.327 3.692 1.00 0.83 C ATOM 538 CG LEU A 187 20.934 -2.598 3.635 1.00 0.78 C ATOM 539 CD1 LEU A 187 20.616 -3.616 2.550 1.00 0.90 C ATOM 540 CD2 LEU A 187 20.431 -3.080 4.987 1.00 0.98 C ATOM 0 H LEU A 187 22.577 0.223 3.232 1.00 0.73 H new ATOM 0 HA LEU A 187 22.377 -1.444 5.649 1.00 0.84 H new ATOM 0 HB2 LEU A 187 22.776 -2.031 2.699 1.00 0.83 H new ATOM 0 HB3 LEU A 187 22.950 -3.257 3.939 1.00 0.83 H new ATOM 0 HG LEU A 187 20.423 -1.667 3.390 1.00 0.78 H new ATOM 0 HD11 LEU A 187 19.541 -3.796 2.524 1.00 0.90 H new ATOM 0 HD12 LEU A 187 20.943 -3.232 1.584 1.00 0.90 H new ATOM 0 HD13 LEU A 187 21.136 -4.550 2.764 1.00 0.90 H new ATOM 0 HD21 LEU A 187 19.359 -3.269 4.930 1.00 0.98 H new ATOM 0 HD22 LEU A 187 20.947 -4.000 5.260 1.00 0.98 H new ATOM 0 HD23 LEU A 187 20.626 -2.317 5.741 1.00 0.98 H new ATOM 552 N THR A 188 25.110 -0.556 4.094 1.00 1.13 N ATOM 553 CA THR A 188 26.563 -0.525 4.193 1.00 1.36 C ATOM 554 C THR A 188 27.010 -0.094 5.586 1.00 1.79 C ATOM 555 O THR A 188 27.183 -0.979 6.449 1.00 2.52 O ATOM 556 CB THR A 188 27.179 0.429 3.152 1.00 2.06 C ATOM 557 OG1 THR A 188 26.669 1.755 3.342 1.00 2.72 O ATOM 558 CG2 THR A 188 26.870 -0.040 1.740 1.00 2.69 C ATOM 559 OXT THR A 188 27.182 1.124 5.801 1.00 2.28 O ATOM 0 H THR A 188 24.724 0.042 3.363 1.00 1.13 H new ATOM 0 HA THR A 188 26.913 -1.538 3.998 1.00 1.36 H new ATOM 0 HB THR A 188 28.260 0.432 3.288 1.00 2.06 H new ATOM 0 HG1 THR A 188 26.695 1.982 4.295 1.00 2.72 H new ATOM 0 HG21 THR A 188 27.315 0.649 1.022 1.00 2.69 H new ATOM 0 HG22 THR A 188 27.283 -1.038 1.589 1.00 2.69 H new ATOM 0 HG23 THR A 188 25.790 -0.068 1.594 1.00 2.69 H new TER 567 THR A 188 ATOM 568 N GLY B 154 -28.411 -4.886 0.488 1.00 7.87 N ATOM 569 CA GLY B 154 -26.943 -4.697 0.332 1.00 7.57 C ATOM 570 C GLY B 154 -26.450 -5.097 -1.044 1.00 7.43 C ATOM 571 O GLY B 154 -27.192 -5.020 -2.022 1.00 7.85 O ATOM 0 HA2 GLY B 154 -26.693 -3.652 0.514 1.00 7.57 H new ATOM 0 HA3 GLY B 154 -26.422 -5.286 1.087 1.00 7.57 H new ATOM 577 N GLY B 155 -25.195 -5.526 -1.119 1.00 6.96 N ATOM 578 CA GLY B 155 -24.627 -5.933 -2.390 1.00 6.89 C ATOM 579 C GLY B 155 -24.479 -7.437 -2.505 1.00 6.80 C ATOM 580 O GLY B 155 -24.763 -8.169 -1.557 1.00 6.83 O ATOM 0 H GLY B 155 -24.562 -5.599 -0.323 1.00 6.96 H new ATOM 0 HA2 GLY B 155 -25.260 -5.571 -3.200 1.00 6.89 H new ATOM 0 HA3 GLY B 155 -23.651 -5.465 -2.515 1.00 6.89 H new ATOM 584 N ILE B 156 -24.036 -7.898 -3.670 1.00 6.79 N ATOM 585 CA ILE B 156 -23.849 -9.321 -3.907 1.00 6.85 C ATOM 586 C ILE B 156 -22.672 -9.860 -3.106 1.00 6.34 C ATOM 587 O ILE B 156 -22.783 -10.879 -2.426 1.00 6.39 O ATOM 588 CB ILE B 156 -23.607 -9.597 -5.401 1.00 7.07 C ATOM 589 CG1 ILE B 156 -24.575 -8.774 -6.248 1.00 7.61 C ATOM 590 CG2 ILE B 156 -23.758 -11.082 -5.698 1.00 7.32 C ATOM 591 CD1 ILE B 156 -26.022 -8.953 -5.850 1.00 7.93 C ATOM 0 H ILE B 156 -23.800 -7.304 -4.465 1.00 6.79 H new ATOM 0 HA ILE B 156 -24.760 -9.826 -3.587 1.00 6.85 H new ATOM 0 HB ILE B 156 -22.588 -9.303 -5.654 1.00 7.07 H new ATOM 0 HG12 ILE B 156 -24.311 -7.720 -6.167 1.00 7.61 H new ATOM 0 HG13 ILE B 156 -24.457 -9.052 -7.295 1.00 7.61 H new ATOM 0 HG21 ILE B 156 -23.584 -11.260 -6.759 1.00 7.32 H new ATOM 0 HG22 ILE B 156 -23.033 -11.646 -5.111 1.00 7.32 H new ATOM 0 HG23 ILE B 156 -24.766 -11.405 -5.437 1.00 7.32 H new ATOM 0 HD11 ILE B 156 -26.654 -8.340 -6.492 1.00 7.93 H new ATOM 0 HD12 ILE B 156 -26.302 -10.001 -5.958 1.00 7.93 H new ATOM 0 HD13 ILE B 156 -26.154 -8.647 -4.812 1.00 7.93 H new ATOM 603 N PHE B 157 -21.543 -9.166 -3.194 1.00 5.93 N ATOM 604 CA PHE B 157 -20.340 -9.571 -2.477 1.00 5.51 C ATOM 605 C PHE B 157 -20.444 -9.215 -0.999 1.00 5.28 C ATOM 606 O PHE B 157 -20.476 -10.096 -0.140 1.00 5.42 O ATOM 607 CB PHE B 157 -19.107 -8.900 -3.085 1.00 5.15 C ATOM 608 CG PHE B 157 -18.908 -9.215 -4.540 1.00 5.59 C ATOM 609 CD1 PHE B 157 -18.269 -10.382 -4.926 1.00 6.06 C ATOM 610 CD2 PHE B 157 -19.358 -8.345 -5.520 1.00 5.84 C ATOM 611 CE1 PHE B 157 -18.082 -10.675 -6.263 1.00 6.59 C ATOM 612 CE2 PHE B 157 -19.173 -8.634 -6.859 1.00 6.39 C ATOM 613 CZ PHE B 157 -18.534 -9.801 -7.231 1.00 6.69 C ATOM 0 H PHE B 157 -21.436 -8.321 -3.755 1.00 5.93 H new ATOM 0 HA PHE B 157 -20.240 -10.653 -2.569 1.00 5.51 H new ATOM 0 HB2 PHE B 157 -19.194 -7.820 -2.964 1.00 5.15 H new ATOM 0 HB3 PHE B 157 -18.223 -9.212 -2.530 1.00 5.15 H new ATOM 0 HD1 PHE B 157 -17.913 -11.070 -4.174 1.00 6.06 H new ATOM 0 HD2 PHE B 157 -19.859 -7.432 -5.235 1.00 5.84 H new ATOM 0 HE1 PHE B 157 -17.582 -11.588 -6.551 1.00 6.59 H new ATOM 0 HE2 PHE B 157 -19.528 -7.948 -7.614 1.00 6.39 H new ATOM 0 HZ PHE B 157 -18.388 -10.029 -8.277 1.00 6.69 H new ATOM 623 N SER B 158 -20.499 -7.918 -0.712 1.00 5.07 N ATOM 624 CA SER B 158 -20.597 -7.430 0.663 1.00 4.99 C ATOM 625 C SER B 158 -19.620 -8.164 1.586 1.00 4.62 C ATOM 626 O SER B 158 -18.473 -7.747 1.736 1.00 4.34 O ATOM 627 CB SER B 158 -22.032 -7.572 1.177 1.00 5.53 C ATOM 628 OG SER B 158 -22.914 -6.722 0.464 1.00 6.01 O ATOM 0 H SER B 158 -20.477 -7.181 -1.417 1.00 5.07 H new ATOM 0 HA SER B 158 -20.326 -6.374 0.665 1.00 4.99 H new ATOM 0 HB2 SER B 158 -22.358 -8.607 1.075 1.00 5.53 H new ATOM 0 HB3 SER B 158 -22.067 -7.330 2.239 1.00 5.53 H new ATOM 0 HG SER B 158 -23.533 -7.265 -0.067 1.00 6.01 H new ATOM 634 N ALA B 159 -20.069 -9.259 2.195 1.00 4.76 N ATOM 635 CA ALA B 159 -19.219 -10.030 3.095 1.00 4.49 C ATOM 636 C ALA B 159 -17.952 -10.495 2.388 1.00 4.07 C ATOM 637 O ALA B 159 -16.840 -10.226 2.843 1.00 3.63 O ATOM 638 CB ALA B 159 -19.982 -11.223 3.651 1.00 4.95 C ATOM 0 H ALA B 159 -21.012 -9.630 2.082 1.00 4.76 H new ATOM 0 HA ALA B 159 -18.927 -9.382 3.922 1.00 4.49 H new ATOM 0 HB1 ALA B 159 -19.335 -11.789 4.321 1.00 4.95 H new ATOM 0 HB2 ALA B 159 -20.855 -10.872 4.201 1.00 4.95 H new ATOM 0 HB3 ALA B 159 -20.303 -11.864 2.830 1.00 4.95 H new ATOM 644 N GLU B 160 -18.128 -11.192 1.271 1.00 4.30 N ATOM 645 CA GLU B 160 -17.002 -11.703 0.496 1.00 4.07 C ATOM 646 C GLU B 160 -16.064 -10.578 0.069 1.00 3.64 C ATOM 647 O GLU B 160 -14.843 -10.719 0.134 1.00 3.34 O ATOM 648 CB GLU B 160 -17.507 -12.457 -0.736 1.00 4.52 C ATOM 649 CG GLU B 160 -16.396 -12.898 -1.677 1.00 4.52 C ATOM 650 CD GLU B 160 -15.360 -13.767 -0.992 1.00 4.76 C ATOM 651 OE1 GLU B 160 -15.540 -15.002 -0.973 1.00 5.11 O ATOM 652 OE2 GLU B 160 -14.367 -13.212 -0.475 1.00 5.04 O ATOM 0 H GLU B 160 -19.043 -11.417 0.880 1.00 4.30 H new ATOM 0 HA GLU B 160 -16.442 -12.387 1.133 1.00 4.07 H new ATOM 0 HB2 GLU B 160 -18.066 -13.334 -0.411 1.00 4.52 H new ATOM 0 HB3 GLU B 160 -18.203 -11.820 -1.282 1.00 4.52 H new ATOM 0 HG2 GLU B 160 -16.830 -13.447 -2.513 1.00 4.52 H new ATOM 0 HG3 GLU B 160 -15.907 -12.017 -2.094 1.00 4.52 H new ATOM 659 N PHE B 161 -16.638 -9.463 -0.368 1.00 3.68 N ATOM 660 CA PHE B 161 -15.846 -8.322 -0.814 1.00 3.33 C ATOM 661 C PHE B 161 -14.865 -7.872 0.267 1.00 2.89 C ATOM 662 O PHE B 161 -13.665 -7.756 0.018 1.00 2.55 O ATOM 663 CB PHE B 161 -16.758 -7.160 -1.205 1.00 3.51 C ATOM 664 CG PHE B 161 -16.022 -5.998 -1.811 1.00 3.26 C ATOM 665 CD1 PHE B 161 -15.498 -6.085 -3.091 1.00 3.25 C ATOM 666 CD2 PHE B 161 -15.857 -4.820 -1.102 1.00 3.50 C ATOM 667 CE1 PHE B 161 -14.822 -5.019 -3.652 1.00 3.09 C ATOM 668 CE2 PHE B 161 -15.181 -3.749 -1.657 1.00 3.37 C ATOM 669 CZ PHE B 161 -14.663 -3.850 -2.935 1.00 2.95 C ATOM 0 H PHE B 161 -17.647 -9.324 -0.423 1.00 3.68 H new ATOM 0 HA PHE B 161 -15.273 -8.636 -1.686 1.00 3.33 H new ATOM 0 HB2 PHE B 161 -17.504 -7.517 -1.915 1.00 3.51 H new ATOM 0 HB3 PHE B 161 -17.296 -6.818 -0.321 1.00 3.51 H new ATOM 0 HD1 PHE B 161 -15.620 -6.997 -3.657 1.00 3.25 H new ATOM 0 HD2 PHE B 161 -16.261 -4.737 -0.104 1.00 3.50 H new ATOM 0 HE1 PHE B 161 -14.418 -5.100 -4.650 1.00 3.09 H new ATOM 0 HE2 PHE B 161 -15.058 -2.836 -1.094 1.00 3.37 H new ATOM 0 HZ PHE B 161 -14.135 -3.015 -3.372 1.00 2.95 H new ATOM 679 N LEU B 162 -15.382 -7.621 1.465 1.00 2.97 N ATOM 680 CA LEU B 162 -14.549 -7.176 2.576 1.00 2.68 C ATOM 681 C LEU B 162 -13.508 -8.231 2.944 1.00 2.45 C ATOM 682 O LEU B 162 -12.365 -7.901 3.261 1.00 2.10 O ATOM 683 CB LEU B 162 -15.415 -6.845 3.794 1.00 3.01 C ATOM 684 CG LEU B 162 -16.556 -5.862 3.528 1.00 3.29 C ATOM 685 CD1 LEU B 162 -17.166 -5.383 4.837 1.00 3.64 C ATOM 686 CD2 LEU B 162 -16.065 -4.682 2.700 1.00 3.06 C ATOM 0 H LEU B 162 -16.372 -7.718 1.691 1.00 2.97 H new ATOM 0 HA LEU B 162 -14.023 -6.276 2.259 1.00 2.68 H new ATOM 0 HB2 LEU B 162 -15.837 -7.771 4.183 1.00 3.01 H new ATOM 0 HB3 LEU B 162 -14.775 -6.433 4.575 1.00 3.01 H new ATOM 0 HG LEU B 162 -17.329 -6.380 2.960 1.00 3.29 H new ATOM 0 HD11 LEU B 162 -17.976 -4.684 4.627 1.00 3.64 H new ATOM 0 HD12 LEU B 162 -17.557 -6.237 5.390 1.00 3.64 H new ATOM 0 HD13 LEU B 162 -16.402 -4.884 5.433 1.00 3.64 H new ATOM 0 HD21 LEU B 162 -16.891 -3.994 2.521 1.00 3.06 H new ATOM 0 HD22 LEU B 162 -15.272 -4.164 3.239 1.00 3.06 H new ATOM 0 HD23 LEU B 162 -15.680 -5.042 1.746 1.00 3.06 H new ATOM 698 N LYS B 163 -13.907 -9.498 2.899 1.00 2.70 N ATOM 699 CA LYS B 163 -13.000 -10.593 3.226 1.00 2.58 C ATOM 700 C LYS B 163 -11.756 -10.544 2.346 1.00 2.20 C ATOM 701 O LYS B 163 -10.665 -10.922 2.774 1.00 2.01 O ATOM 702 CB LYS B 163 -13.704 -11.941 3.056 1.00 2.98 C ATOM 703 CG LYS B 163 -14.774 -12.207 4.103 1.00 3.10 C ATOM 704 CD LYS B 163 -15.504 -13.510 3.832 1.00 3.46 C ATOM 705 CE LYS B 163 -16.601 -13.758 4.854 1.00 3.83 C ATOM 706 NZ LYS B 163 -16.058 -13.874 6.236 1.00 4.17 N ATOM 0 H LYS B 163 -14.849 -9.792 2.640 1.00 2.70 H new ATOM 0 HA LYS B 163 -12.697 -10.481 4.267 1.00 2.58 H new ATOM 0 HB2 LYS B 163 -14.159 -11.981 2.066 1.00 2.98 H new ATOM 0 HB3 LYS B 163 -12.961 -12.737 3.098 1.00 2.98 H new ATOM 0 HG2 LYS B 163 -14.316 -12.244 5.092 1.00 3.10 H new ATOM 0 HG3 LYS B 163 -15.488 -11.384 4.113 1.00 3.10 H new ATOM 0 HD2 LYS B 163 -15.936 -13.485 2.832 1.00 3.46 H new ATOM 0 HD3 LYS B 163 -14.794 -14.337 3.851 1.00 3.46 H new ATOM 0 HE2 LYS B 163 -17.324 -12.943 4.815 1.00 3.83 H new ATOM 0 HE3 LYS B 163 -17.137 -14.672 4.597 1.00 3.83 H new ATOM 0 HZ1 LYS B 163 -16.797 -14.241 6.870 1.00 4.17 H new ATOM 0 HZ2 LYS B 163 -15.247 -14.525 6.237 1.00 4.17 H new ATOM 0 HZ3 LYS B 163 -15.751 -12.938 6.568 1.00 4.17 H new ATOM 720 N VAL B 164 -11.927 -10.075 1.115 1.00 2.21 N ATOM 721 CA VAL B 164 -10.820 -9.971 0.173 1.00 2.03 C ATOM 722 C VAL B 164 -10.452 -8.512 -0.072 1.00 1.85 C ATOM 723 O VAL B 164 -10.004 -8.148 -1.160 1.00 2.01 O ATOM 724 CB VAL B 164 -11.160 -10.638 -1.174 1.00 2.40 C ATOM 725 CG1 VAL B 164 -11.473 -12.113 -0.979 1.00 2.37 C ATOM 726 CG2 VAL B 164 -12.323 -9.922 -1.844 1.00 2.98 C ATOM 0 H VAL B 164 -12.824 -9.760 0.746 1.00 2.21 H new ATOM 0 HA VAL B 164 -9.972 -10.491 0.619 1.00 2.03 H new ATOM 0 HB VAL B 164 -10.290 -10.561 -1.826 1.00 2.40 H new ATOM 0 HG11 VAL B 164 -11.710 -12.565 -1.942 1.00 2.37 H new ATOM 0 HG12 VAL B 164 -10.607 -12.615 -0.546 1.00 2.37 H new ATOM 0 HG13 VAL B 164 -12.326 -12.218 -0.309 1.00 2.37 H new ATOM 0 HG21 VAL B 164 -12.550 -10.406 -2.794 1.00 2.98 H new ATOM 0 HG22 VAL B 164 -13.199 -9.965 -1.196 1.00 2.98 H new ATOM 0 HG23 VAL B 164 -12.055 -8.881 -2.022 1.00 2.98 H new ATOM 736 N PHE B 165 -10.645 -7.681 0.947 1.00 1.65 N ATOM 737 CA PHE B 165 -10.338 -6.258 0.842 1.00 1.50 C ATOM 738 C PHE B 165 -9.461 -5.797 2.003 1.00 1.26 C ATOM 739 O PHE B 165 -8.379 -5.247 1.794 1.00 1.09 O ATOM 740 CB PHE B 165 -11.630 -5.439 0.811 1.00 1.69 C ATOM 741 CG PHE B 165 -11.401 -3.955 0.796 1.00 1.63 C ATOM 742 CD1 PHE B 165 -11.132 -3.293 -0.390 1.00 1.70 C ATOM 743 CD2 PHE B 165 -11.457 -3.221 1.971 1.00 2.23 C ATOM 744 CE1 PHE B 165 -10.922 -1.927 -0.406 1.00 1.66 C ATOM 745 CE2 PHE B 165 -11.247 -1.855 1.961 1.00 2.32 C ATOM 746 CZ PHE B 165 -10.980 -1.207 0.771 1.00 1.70 C ATOM 0 H PHE B 165 -11.012 -7.968 1.854 1.00 1.65 H new ATOM 0 HA PHE B 165 -9.789 -6.101 -0.087 1.00 1.50 H new ATOM 0 HB2 PHE B 165 -12.206 -5.718 -0.071 1.00 1.69 H new ATOM 0 HB3 PHE B 165 -12.234 -5.696 1.681 1.00 1.69 H new ATOM 0 HD1 PHE B 165 -11.086 -3.851 -1.314 1.00 1.70 H new ATOM 0 HD2 PHE B 165 -11.667 -3.722 2.904 1.00 2.23 H new ATOM 0 HE1 PHE B 165 -10.713 -1.423 -1.338 1.00 1.66 H new ATOM 0 HE2 PHE B 165 -11.292 -1.295 2.883 1.00 2.32 H new ATOM 0 HZ PHE B 165 -10.817 -0.139 0.761 1.00 1.70 H new ATOM 756 N LEU B 166 -9.933 -6.025 3.224 1.00 1.37 N ATOM 757 CA LEU B 166 -9.190 -5.627 4.414 1.00 1.30 C ATOM 758 C LEU B 166 -7.802 -6.264 4.449 1.00 1.09 C ATOM 759 O LEU B 166 -6.814 -5.585 4.726 1.00 1.00 O ATOM 760 CB LEU B 166 -9.972 -5.986 5.680 1.00 1.59 C ATOM 761 CG LEU B 166 -11.237 -5.157 5.913 1.00 1.88 C ATOM 762 CD1 LEU B 166 -11.938 -5.598 7.189 1.00 2.18 C ATOM 763 CD2 LEU B 166 -10.897 -3.675 5.976 1.00 1.87 C ATOM 0 H LEU B 166 -10.824 -6.482 3.415 1.00 1.37 H new ATOM 0 HA LEU B 166 -9.059 -4.546 4.374 1.00 1.30 H new ATOM 0 HB2 LEU B 166 -10.249 -7.039 5.632 1.00 1.59 H new ATOM 0 HB3 LEU B 166 -9.314 -5.868 6.541 1.00 1.59 H new ATOM 0 HG LEU B 166 -11.915 -5.321 5.075 1.00 1.88 H new ATOM 0 HD11 LEU B 166 -12.835 -4.997 7.338 1.00 2.18 H new ATOM 0 HD12 LEU B 166 -12.215 -6.649 7.107 1.00 2.18 H new ATOM 0 HD13 LEU B 166 -11.267 -5.464 8.038 1.00 2.18 H new ATOM 0 HD21 LEU B 166 -11.808 -3.100 6.142 1.00 1.87 H new ATOM 0 HD22 LEU B 166 -10.200 -3.496 6.795 1.00 1.87 H new ATOM 0 HD23 LEU B 166 -10.439 -3.366 5.036 1.00 1.87 H new ATOM 775 N PRO B 167 -7.700 -7.577 4.168 1.00 1.11 N ATOM 776 CA PRO B 167 -6.419 -8.284 4.172 1.00 1.01 C ATOM 777 C PRO B 167 -5.653 -8.137 2.858 1.00 0.85 C ATOM 778 O PRO B 167 -4.685 -8.858 2.612 1.00 0.92 O ATOM 779 CB PRO B 167 -6.844 -9.734 4.378 1.00 1.14 C ATOM 780 CG PRO B 167 -8.163 -9.831 3.690 1.00 1.25 C ATOM 781 CD PRO B 167 -8.822 -8.483 3.841 1.00 1.36 C ATOM 0 HA PRO B 167 -5.738 -7.897 4.930 1.00 1.01 H new ATOM 0 HB2 PRO B 167 -6.119 -10.426 3.949 1.00 1.14 H new ATOM 0 HB3 PRO B 167 -6.929 -9.977 5.437 1.00 1.14 H new ATOM 0 HG2 PRO B 167 -8.034 -10.085 2.638 1.00 1.25 H new ATOM 0 HG3 PRO B 167 -8.776 -10.615 4.134 1.00 1.25 H new ATOM 0 HD2 PRO B 167 -9.327 -8.180 2.924 1.00 1.36 H new ATOM 0 HD3 PRO B 167 -9.573 -8.491 4.631 1.00 1.36 H new ATOM 789 N SER B 168 -6.086 -7.202 2.016 1.00 0.84 N ATOM 790 CA SER B 168 -5.435 -6.974 0.731 1.00 0.77 C ATOM 791 C SER B 168 -4.569 -5.717 0.771 1.00 0.60 C ATOM 792 O SER B 168 -3.430 -5.722 0.306 1.00 0.54 O ATOM 793 CB SER B 168 -6.480 -6.849 -0.378 1.00 0.90 C ATOM 794 OG SER B 168 -5.865 -6.645 -1.638 1.00 1.54 O ATOM 0 H SER B 168 -6.883 -6.592 2.201 1.00 0.84 H new ATOM 0 HA SER B 168 -4.792 -7.829 0.523 1.00 0.77 H new ATOM 0 HB2 SER B 168 -7.091 -7.751 -0.410 1.00 0.90 H new ATOM 0 HB3 SER B 168 -7.150 -6.018 -0.158 1.00 0.90 H new ATOM 0 HG SER B 168 -6.555 -6.570 -2.330 1.00 1.54 H new ATOM 800 N LEU B 169 -5.118 -4.643 1.328 1.00 0.60 N ATOM 801 CA LEU B 169 -4.397 -3.378 1.424 1.00 0.52 C ATOM 802 C LEU B 169 -3.123 -3.532 2.250 1.00 0.44 C ATOM 803 O LEU B 169 -2.059 -3.049 1.862 1.00 0.37 O ATOM 804 CB LEU B 169 -5.294 -2.302 2.040 1.00 0.63 C ATOM 805 CG LEU B 169 -6.547 -1.965 1.230 1.00 0.72 C ATOM 806 CD1 LEU B 169 -7.377 -0.912 1.947 1.00 0.86 C ATOM 807 CD2 LEU B 169 -6.166 -1.488 -0.164 1.00 0.76 C ATOM 0 H LEU B 169 -6.060 -4.623 1.720 1.00 0.60 H new ATOM 0 HA LEU B 169 -4.115 -3.074 0.416 1.00 0.52 H new ATOM 0 HB2 LEU B 169 -5.599 -2.630 3.034 1.00 0.63 H new ATOM 0 HB3 LEU B 169 -4.708 -1.392 2.170 1.00 0.63 H new ATOM 0 HG LEU B 169 -7.149 -2.868 1.132 1.00 0.72 H new ATOM 0 HD11 LEU B 169 -8.265 -0.684 1.357 1.00 0.86 H new ATOM 0 HD12 LEU B 169 -7.678 -1.289 2.924 1.00 0.86 H new ATOM 0 HD13 LEU B 169 -6.784 -0.006 2.075 1.00 0.86 H new ATOM 0 HD21 LEU B 169 -7.069 -1.252 -0.727 1.00 0.76 H new ATOM 0 HD22 LEU B 169 -5.544 -0.596 -0.086 1.00 0.76 H new ATOM 0 HD23 LEU B 169 -5.612 -2.273 -0.678 1.00 0.76 H new ATOM 819 N LEU B 170 -3.236 -4.208 3.389 1.00 0.51 N ATOM 820 CA LEU B 170 -2.088 -4.425 4.263 1.00 0.52 C ATOM 821 C LEU B 170 -0.989 -5.195 3.539 1.00 0.44 C ATOM 822 O LEU B 170 0.188 -4.845 3.629 1.00 0.40 O ATOM 823 CB LEU B 170 -2.507 -5.172 5.531 1.00 0.67 C ATOM 824 CG LEU B 170 -3.299 -4.344 6.547 1.00 0.80 C ATOM 825 CD1 LEU B 170 -4.486 -3.665 5.885 1.00 0.86 C ATOM 826 CD2 LEU B 170 -3.761 -5.222 7.702 1.00 0.93 C ATOM 0 H LEU B 170 -4.108 -4.614 3.728 1.00 0.51 H new ATOM 0 HA LEU B 170 -1.695 -3.449 4.546 1.00 0.52 H new ATOM 0 HB2 LEU B 170 -3.108 -6.035 5.243 1.00 0.67 H new ATOM 0 HB3 LEU B 170 -1.611 -5.556 6.019 1.00 0.67 H new ATOM 0 HG LEU B 170 -2.642 -3.568 6.941 1.00 0.80 H new ATOM 0 HD11 LEU B 170 -5.033 -3.083 6.627 1.00 0.86 H new ATOM 0 HD12 LEU B 170 -4.132 -3.004 5.094 1.00 0.86 H new ATOM 0 HD13 LEU B 170 -5.146 -4.420 5.458 1.00 0.86 H new ATOM 0 HD21 LEU B 170 -4.322 -4.619 8.416 1.00 0.93 H new ATOM 0 HD22 LEU B 170 -4.398 -6.020 7.320 1.00 0.93 H new ATOM 0 HD23 LEU B 170 -2.893 -5.657 8.198 1.00 0.93 H new ATOM 838 N LEU B 171 -1.377 -6.244 2.823 1.00 0.45 N ATOM 839 CA LEU B 171 -0.418 -7.054 2.081 1.00 0.45 C ATOM 840 C LEU B 171 0.330 -6.204 1.060 1.00 0.37 C ATOM 841 O LEU B 171 1.554 -6.271 0.959 1.00 0.38 O ATOM 842 CB LEU B 171 -1.130 -8.214 1.381 1.00 0.54 C ATOM 843 CG LEU B 171 -1.725 -9.266 2.319 1.00 0.65 C ATOM 844 CD1 LEU B 171 -2.475 -10.325 1.527 1.00 0.74 C ATOM 845 CD2 LEU B 171 -0.630 -9.901 3.163 1.00 0.74 C ATOM 0 H LEU B 171 -2.346 -6.553 2.741 1.00 0.45 H new ATOM 0 HA LEU B 171 0.305 -7.460 2.788 1.00 0.45 H new ATOM 0 HB2 LEU B 171 -1.929 -7.809 0.760 1.00 0.54 H new ATOM 0 HB3 LEU B 171 -0.423 -8.704 0.711 1.00 0.54 H new ATOM 0 HG LEU B 171 -2.434 -8.775 2.986 1.00 0.65 H new ATOM 0 HD11 LEU B 171 -2.891 -11.064 2.211 1.00 0.74 H new ATOM 0 HD12 LEU B 171 -3.283 -9.855 0.965 1.00 0.74 H new ATOM 0 HD13 LEU B 171 -1.790 -10.816 0.836 1.00 0.74 H new ATOM 0 HD21 LEU B 171 -1.068 -10.647 3.826 1.00 0.74 H new ATOM 0 HD22 LEU B 171 0.101 -10.379 2.511 1.00 0.74 H new ATOM 0 HD23 LEU B 171 -0.137 -9.132 3.758 1.00 0.74 H new ATOM 857 N SER B 172 -0.415 -5.402 0.305 1.00 0.32 N ATOM 858 CA SER B 172 0.181 -4.535 -0.704 1.00 0.31 C ATOM 859 C SER B 172 1.276 -3.667 -0.093 1.00 0.26 C ATOM 860 O SER B 172 2.388 -3.591 -0.618 1.00 0.30 O ATOM 861 CB SER B 172 -0.889 -3.648 -1.343 1.00 0.33 C ATOM 862 OG SER B 172 -1.899 -4.429 -1.958 1.00 0.40 O ATOM 0 H SER B 172 -1.431 -5.335 0.373 1.00 0.32 H new ATOM 0 HA SER B 172 0.626 -5.166 -1.473 1.00 0.31 H new ATOM 0 HB2 SER B 172 -1.334 -3.005 -0.583 1.00 0.33 H new ATOM 0 HB3 SER B 172 -0.429 -2.994 -2.084 1.00 0.33 H new ATOM 0 HG SER B 172 -2.451 -4.852 -1.268 1.00 0.40 H new ATOM 868 N HIS B 173 0.955 -3.014 1.019 1.00 0.22 N ATOM 869 CA HIS B 173 1.911 -2.151 1.703 1.00 0.23 C ATOM 870 C HIS B 173 3.166 -2.926 2.088 1.00 0.23 C ATOM 871 O HIS B 173 4.284 -2.484 1.828 1.00 0.25 O ATOM 872 CB HIS B 173 1.275 -1.538 2.952 1.00 0.28 C ATOM 873 CG HIS B 173 0.098 -0.663 2.654 1.00 0.28 C ATOM 874 ND1 HIS B 173 -1.170 -0.916 3.133 1.00 0.34 N ATOM 875 CD2 HIS B 173 0.002 0.474 1.923 1.00 0.36 C ATOM 876 CE1 HIS B 173 -1.995 0.026 2.710 1.00 0.35 C ATOM 877 NE2 HIS B 173 -1.308 0.879 1.974 1.00 0.36 N ATOM 0 H HIS B 173 0.040 -3.066 1.466 1.00 0.22 H new ATOM 0 HA HIS B 173 2.194 -1.352 1.018 1.00 0.23 H new ATOM 0 HB2 HIS B 173 0.962 -2.339 3.621 1.00 0.28 H new ATOM 0 HB3 HIS B 173 2.026 -0.954 3.484 1.00 0.28 H new ATOM 0 HD2 HIS B 173 0.806 0.969 1.398 1.00 0.36 H new ATOM 0 HE1 HIS B 173 -3.051 0.087 2.929 1.00 0.35 H new ATOM 0 HE2 HIS B 173 -1.690 1.707 1.516 1.00 0.36 H new ATOM 886 N LEU B 174 2.973 -4.085 2.711 1.00 0.24 N ATOM 887 CA LEU B 174 4.091 -4.920 3.131 1.00 0.27 C ATOM 888 C LEU B 174 4.962 -5.300 1.938 1.00 0.23 C ATOM 889 O LEU B 174 6.186 -5.190 1.990 1.00 0.24 O ATOM 890 CB LEU B 174 3.580 -6.180 3.832 1.00 0.33 C ATOM 891 CG LEU B 174 2.788 -5.928 5.116 1.00 0.40 C ATOM 892 CD1 LEU B 174 2.322 -7.244 5.723 1.00 0.48 C ATOM 893 CD2 LEU B 174 3.628 -5.147 6.115 1.00 0.47 C ATOM 0 H LEU B 174 2.054 -4.466 2.935 1.00 0.24 H new ATOM 0 HA LEU B 174 4.698 -4.348 3.832 1.00 0.27 H new ATOM 0 HB2 LEU B 174 2.950 -6.734 3.137 1.00 0.33 H new ATOM 0 HB3 LEU B 174 4.432 -6.818 4.068 1.00 0.33 H new ATOM 0 HG LEU B 174 1.908 -5.334 4.867 1.00 0.40 H new ATOM 0 HD11 LEU B 174 1.760 -7.045 6.636 1.00 0.48 H new ATOM 0 HD12 LEU B 174 1.684 -7.767 5.011 1.00 0.48 H new ATOM 0 HD13 LEU B 174 3.188 -7.863 5.958 1.00 0.48 H new ATOM 0 HD21 LEU B 174 3.049 -4.977 7.023 1.00 0.47 H new ATOM 0 HD22 LEU B 174 4.526 -5.715 6.359 1.00 0.47 H new ATOM 0 HD23 LEU B 174 3.912 -4.189 5.681 1.00 0.47 H new ATOM 905 N LEU B 175 4.320 -5.748 0.864 1.00 0.22 N ATOM 906 CA LEU B 175 5.036 -6.141 -0.343 1.00 0.23 C ATOM 907 C LEU B 175 5.788 -4.954 -0.936 1.00 0.21 C ATOM 908 O LEU B 175 6.936 -5.084 -1.362 1.00 0.23 O ATOM 909 CB LEU B 175 4.063 -6.717 -1.373 1.00 0.27 C ATOM 910 CG LEU B 175 3.340 -7.991 -0.935 1.00 0.32 C ATOM 911 CD1 LEU B 175 2.371 -8.453 -2.011 1.00 0.38 C ATOM 912 CD2 LEU B 175 4.345 -9.086 -0.612 1.00 0.38 C ATOM 0 H LEU B 175 3.307 -5.848 0.805 1.00 0.22 H new ATOM 0 HA LEU B 175 5.762 -6.909 -0.075 1.00 0.23 H new ATOM 0 HB2 LEU B 175 3.318 -5.958 -1.611 1.00 0.27 H new ATOM 0 HB3 LEU B 175 4.611 -6.926 -2.292 1.00 0.27 H new ATOM 0 HG LEU B 175 2.768 -7.771 -0.033 1.00 0.32 H new ATOM 0 HD11 LEU B 175 1.866 -9.361 -1.681 1.00 0.38 H new ATOM 0 HD12 LEU B 175 1.632 -7.673 -2.194 1.00 0.38 H new ATOM 0 HD13 LEU B 175 2.919 -8.657 -2.931 1.00 0.38 H new ATOM 0 HD21 LEU B 175 3.815 -9.986 -0.302 1.00 0.38 H new ATOM 0 HD22 LEU B 175 4.943 -9.304 -1.497 1.00 0.38 H new ATOM 0 HD23 LEU B 175 4.998 -8.754 0.195 1.00 0.38 H new ATOM 924 N ALA B 176 5.134 -3.798 -0.961 1.00 0.21 N ATOM 925 CA ALA B 176 5.746 -2.588 -1.495 1.00 0.23 C ATOM 926 C ALA B 176 7.097 -2.333 -0.837 1.00 0.22 C ATOM 927 O ALA B 176 8.107 -2.143 -1.518 1.00 0.24 O ATOM 928 CB ALA B 176 4.825 -1.394 -1.290 1.00 0.26 C ATOM 0 H ALA B 176 4.181 -3.674 -0.618 1.00 0.21 H new ATOM 0 HA ALA B 176 5.905 -2.727 -2.564 1.00 0.23 H new ATOM 0 HB1 ALA B 176 5.296 -0.498 -1.694 1.00 0.26 H new ATOM 0 HB2 ALA B 176 3.880 -1.571 -1.804 1.00 0.26 H new ATOM 0 HB3 ALA B 176 4.638 -1.257 -0.225 1.00 0.26 H new ATOM 934 N ILE B 177 7.106 -2.332 0.491 1.00 0.20 N ATOM 935 CA ILE B 177 8.332 -2.108 1.243 1.00 0.21 C ATOM 936 C ILE B 177 9.388 -3.140 0.864 1.00 0.21 C ATOM 937 O ILE B 177 10.558 -2.806 0.679 1.00 0.22 O ATOM 938 CB ILE B 177 8.084 -2.170 2.762 1.00 0.22 C ATOM 939 CG1 ILE B 177 6.961 -1.211 3.157 1.00 0.24 C ATOM 940 CG2 ILE B 177 9.360 -1.834 3.521 1.00 0.25 C ATOM 941 CD1 ILE B 177 6.667 -1.206 4.642 1.00 0.29 C ATOM 0 H ILE B 177 6.278 -2.484 1.067 1.00 0.20 H new ATOM 0 HA ILE B 177 8.688 -1.109 0.990 1.00 0.21 H new ATOM 0 HB ILE B 177 7.782 -3.184 3.024 1.00 0.22 H new ATOM 0 HG12 ILE B 177 7.229 -0.202 2.844 1.00 0.24 H new ATOM 0 HG13 ILE B 177 6.055 -1.483 2.616 1.00 0.24 H new ATOM 0 HG21 ILE B 177 9.169 -1.882 4.593 1.00 0.25 H new ATOM 0 HG22 ILE B 177 10.139 -2.550 3.259 1.00 0.25 H new ATOM 0 HG23 ILE B 177 9.687 -0.829 3.255 1.00 0.25 H new ATOM 0 HD11 ILE B 177 5.860 -0.504 4.851 1.00 0.29 H new ATOM 0 HD12 ILE B 177 6.368 -2.206 4.957 1.00 0.29 H new ATOM 0 HD13 ILE B 177 7.561 -0.905 5.189 1.00 0.29 H new ATOM 953 N GLY B 178 8.965 -4.396 0.745 1.00 0.21 N ATOM 954 CA GLY B 178 9.885 -5.455 0.376 1.00 0.23 C ATOM 955 C GLY B 178 10.604 -5.151 -0.923 1.00 0.23 C ATOM 956 O GLY B 178 11.811 -5.363 -1.038 1.00 0.26 O ATOM 0 H GLY B 178 8.003 -4.698 0.898 1.00 0.21 H new ATOM 0 HA2 GLY B 178 10.617 -5.594 1.172 1.00 0.23 H new ATOM 0 HA3 GLY B 178 9.338 -6.393 0.278 1.00 0.23 H new ATOM 960 N LEU B 179 9.858 -4.654 -1.904 1.00 0.21 N ATOM 961 CA LEU B 179 10.431 -4.308 -3.198 1.00 0.23 C ATOM 962 C LEU B 179 11.524 -3.260 -3.032 1.00 0.24 C ATOM 963 O LEU B 179 12.635 -3.422 -3.536 1.00 0.28 O ATOM 964 CB LEU B 179 9.346 -3.784 -4.142 1.00 0.25 C ATOM 965 CG LEU B 179 8.251 -4.790 -4.497 1.00 0.27 C ATOM 966 CD1 LEU B 179 7.258 -4.172 -5.470 1.00 0.34 C ATOM 967 CD2 LEU B 179 8.860 -6.055 -5.084 1.00 0.33 C ATOM 0 H LEU B 179 8.856 -4.482 -1.827 1.00 0.21 H new ATOM 0 HA LEU B 179 10.868 -5.208 -3.630 1.00 0.23 H new ATOM 0 HB2 LEU B 179 8.881 -2.911 -3.685 1.00 0.25 H new ATOM 0 HB3 LEU B 179 9.820 -3.447 -5.064 1.00 0.25 H new ATOM 0 HG LEU B 179 7.718 -5.058 -3.585 1.00 0.27 H new ATOM 0 HD11 LEU B 179 6.485 -4.901 -5.713 1.00 0.34 H new ATOM 0 HD12 LEU B 179 6.799 -3.295 -5.014 1.00 0.34 H new ATOM 0 HD13 LEU B 179 7.778 -3.877 -6.382 1.00 0.34 H new ATOM 0 HD21 LEU B 179 8.066 -6.760 -5.331 1.00 0.33 H new ATOM 0 HD22 LEU B 179 9.418 -5.805 -5.987 1.00 0.33 H new ATOM 0 HD23 LEU B 179 9.533 -6.507 -4.355 1.00 0.33 H new ATOM 979 N GLY B 180 11.200 -2.183 -2.323 1.00 0.23 N ATOM 980 CA GLY B 180 12.169 -1.127 -2.101 1.00 0.27 C ATOM 981 C GLY B 180 13.474 -1.654 -1.539 1.00 0.29 C ATOM 982 O GLY B 180 14.550 -1.336 -2.045 1.00 0.34 O ATOM 0 H GLY B 180 10.286 -2.024 -1.900 1.00 0.23 H new ATOM 0 HA2 GLY B 180 12.363 -0.611 -3.041 1.00 0.27 H new ATOM 0 HA3 GLY B 180 11.751 -0.391 -1.414 1.00 0.27 H new ATOM 986 N ILE B 181 13.379 -2.461 -0.488 1.00 0.27 N ATOM 987 CA ILE B 181 14.560 -3.039 0.140 1.00 0.32 C ATOM 988 C ILE B 181 15.310 -3.936 -0.838 1.00 0.37 C ATOM 989 O ILE B 181 16.538 -3.907 -0.909 1.00 0.44 O ATOM 990 CB ILE B 181 14.186 -3.862 1.387 1.00 0.34 C ATOM 991 CG1 ILE B 181 13.371 -3.011 2.361 1.00 0.32 C ATOM 992 CG2 ILE B 181 15.438 -4.397 2.064 1.00 0.42 C ATOM 993 CD1 ILE B 181 12.864 -3.785 3.559 1.00 0.67 C ATOM 0 H ILE B 181 12.496 -2.729 -0.053 1.00 0.27 H new ATOM 0 HA ILE B 181 15.201 -2.210 0.440 1.00 0.32 H new ATOM 0 HB ILE B 181 13.575 -4.709 1.075 1.00 0.34 H new ATOM 0 HG12 ILE B 181 13.986 -2.181 2.708 1.00 0.32 H new ATOM 0 HG13 ILE B 181 12.522 -2.579 1.831 1.00 0.32 H new ATOM 0 HG21 ILE B 181 15.157 -4.976 2.943 1.00 0.42 H new ATOM 0 HG22 ILE B 181 15.983 -5.035 1.368 1.00 0.42 H new ATOM 0 HG23 ILE B 181 16.073 -3.564 2.366 1.00 0.42 H new ATOM 0 HD11 ILE B 181 12.294 -3.119 4.208 1.00 0.67 H new ATOM 0 HD12 ILE B 181 12.223 -4.599 3.221 1.00 0.67 H new ATOM 0 HD13 ILE B 181 13.709 -4.195 4.112 1.00 0.67 H new ATOM 1005 N TYR B 182 14.557 -4.730 -1.592 1.00 0.36 N ATOM 1006 CA TYR B 182 15.144 -5.638 -2.572 1.00 0.42 C ATOM 1007 C TYR B 182 15.992 -4.872 -3.583 1.00 0.45 C ATOM 1008 O TYR B 182 17.101 -5.287 -3.919 1.00 0.51 O ATOM 1009 CB TYR B 182 14.042 -6.417 -3.296 1.00 0.46 C ATOM 1010 CG TYR B 182 14.565 -7.506 -4.204 1.00 0.58 C ATOM 1011 CD1 TYR B 182 14.946 -8.740 -3.692 1.00 1.20 C ATOM 1012 CD2 TYR B 182 14.673 -7.302 -5.574 1.00 1.48 C ATOM 1013 CE1 TYR B 182 15.422 -9.739 -4.519 1.00 1.25 C ATOM 1014 CE2 TYR B 182 15.148 -8.296 -6.408 1.00 1.56 C ATOM 1015 CZ TYR B 182 15.521 -9.512 -5.876 1.00 0.83 C ATOM 1016 OH TYR B 182 15.994 -10.505 -6.702 1.00 0.97 O ATOM 0 H TYR B 182 13.539 -4.763 -1.544 1.00 0.36 H new ATOM 0 HA TYR B 182 15.789 -6.340 -2.043 1.00 0.42 H new ATOM 0 HB2 TYR B 182 13.377 -6.862 -2.556 1.00 0.46 H new ATOM 0 HB3 TYR B 182 13.444 -5.721 -3.885 1.00 0.46 H new ATOM 0 HD1 TYR B 182 14.869 -8.921 -2.630 1.00 1.20 H new ATOM 0 HD2 TYR B 182 14.381 -6.351 -5.994 1.00 1.48 H new ATOM 0 HE1 TYR B 182 15.715 -10.693 -4.105 1.00 1.25 H new ATOM 0 HE2 TYR B 182 15.227 -8.121 -7.471 1.00 1.56 H new ATOM 0 HH TYR B 182 16.000 -10.185 -7.628 1.00 0.97 H new ATOM 1026 N ILE B 183 15.460 -3.760 -4.074 1.00 0.44 N ATOM 1027 CA ILE B 183 16.174 -2.934 -5.040 1.00 0.50 C ATOM 1028 C ILE B 183 17.461 -2.375 -4.437 1.00 0.52 C ATOM 1029 O ILE B 183 18.506 -2.357 -5.087 1.00 0.59 O ATOM 1030 CB ILE B 183 15.296 -1.768 -5.540 1.00 0.55 C ATOM 1031 CG1 ILE B 183 14.020 -2.306 -6.189 1.00 0.59 C ATOM 1032 CG2 ILE B 183 16.068 -0.900 -6.523 1.00 0.64 C ATOM 1033 CD1 ILE B 183 13.061 -1.221 -6.628 1.00 0.83 C ATOM 0 H ILE B 183 14.537 -3.409 -3.819 1.00 0.44 H new ATOM 0 HA ILE B 183 16.423 -3.574 -5.886 1.00 0.50 H new ATOM 0 HB ILE B 183 15.019 -1.152 -4.684 1.00 0.55 H new ATOM 0 HG12 ILE B 183 14.290 -2.913 -7.053 1.00 0.59 H new ATOM 0 HG13 ILE B 183 13.513 -2.964 -5.483 1.00 0.59 H new ATOM 0 HG21 ILE B 183 15.432 -0.083 -6.864 1.00 0.64 H new ATOM 0 HG22 ILE B 183 16.951 -0.491 -6.032 1.00 0.64 H new ATOM 0 HG23 ILE B 183 16.374 -1.503 -7.378 1.00 0.64 H new ATOM 0 HD11 ILE B 183 12.179 -1.676 -7.079 1.00 0.83 H new ATOM 0 HD12 ILE B 183 12.762 -0.628 -5.764 1.00 0.83 H new ATOM 0 HD13 ILE B 183 13.551 -0.576 -7.358 1.00 0.83 H new ATOM 1045 N GLY B 184 17.375 -1.917 -3.192 1.00 0.50 N ATOM 1046 CA GLY B 184 18.536 -1.357 -2.523 1.00 0.57 C ATOM 1047 C GLY B 184 19.663 -2.357 -2.347 1.00 0.62 C ATOM 1048 O GLY B 184 20.804 -2.086 -2.724 1.00 0.69 O ATOM 0 H GLY B 184 16.521 -1.924 -2.634 1.00 0.50 H new ATOM 0 HA2 GLY B 184 18.901 -0.504 -3.095 1.00 0.57 H new ATOM 0 HA3 GLY B 184 18.237 -0.980 -1.545 1.00 0.57 H new ATOM 1052 N ARG B 185 19.347 -3.514 -1.774 1.00 0.62 N ATOM 1053 CA ARG B 185 20.349 -4.551 -1.545 1.00 0.72 C ATOM 1054 C ARG B 185 21.002 -4.992 -2.852 1.00 0.79 C ATOM 1055 O ARG B 185 22.118 -5.513 -2.850 1.00 0.88 O ATOM 1056 CB ARG B 185 19.726 -5.753 -0.826 1.00 0.77 C ATOM 1057 CG ARG B 185 18.482 -6.303 -1.500 1.00 0.72 C ATOM 1058 CD ARG B 185 18.825 -7.303 -2.593 1.00 1.02 C ATOM 1059 NE ARG B 185 19.486 -8.490 -2.059 1.00 1.43 N ATOM 1060 CZ ARG B 185 19.564 -9.645 -2.712 1.00 2.03 C ATOM 1061 NH1 ARG B 185 19.036 -9.763 -3.922 1.00 2.27 N ATOM 1062 NH2 ARG B 185 20.174 -10.682 -2.154 1.00 2.56 N ATOM 0 H ARG B 185 18.408 -3.758 -1.460 1.00 0.62 H new ATOM 0 HA ARG B 185 21.126 -4.127 -0.909 1.00 0.72 H new ATOM 0 HB2 ARG B 185 20.470 -6.547 -0.757 1.00 0.77 H new ATOM 0 HB3 ARG B 185 19.475 -5.462 0.194 1.00 0.77 H new ATOM 0 HG2 ARG B 185 17.847 -6.783 -0.755 1.00 0.72 H new ATOM 0 HG3 ARG B 185 17.907 -5.481 -1.927 1.00 0.72 H new ATOM 0 HD2 ARG B 185 17.914 -7.598 -3.113 1.00 1.02 H new ATOM 0 HD3 ARG B 185 19.473 -6.827 -3.329 1.00 1.02 H new ATOM 0 HE ARG B 185 19.911 -8.430 -1.134 1.00 1.43 H new ATOM 0 HH11 ARG B 185 18.568 -8.966 -4.354 1.00 2.27 H new ATOM 0 HH12 ARG B 185 19.097 -10.651 -4.421 1.00 2.27 H new ATOM 0 HH21 ARG B 185 20.583 -10.593 -1.224 1.00 2.56 H new ATOM 0 HH22 ARG B 185 20.234 -11.568 -2.655 1.00 2.56 H new ATOM 1076 N ARG B 186 20.308 -4.781 -3.967 1.00 0.79 N ATOM 1077 CA ARG B 186 20.838 -5.156 -5.274 1.00 0.88 C ATOM 1078 C ARG B 186 21.975 -4.228 -5.683 1.00 0.95 C ATOM 1079 O ARG B 186 22.964 -4.663 -6.273 1.00 1.08 O ATOM 1080 CB ARG B 186 19.735 -5.127 -6.333 1.00 0.90 C ATOM 1081 CG ARG B 186 18.823 -6.341 -6.298 1.00 1.29 C ATOM 1082 CD ARG B 186 17.764 -6.272 -7.386 1.00 1.64 C ATOM 1083 NE ARG B 186 18.352 -6.260 -8.722 1.00 2.30 N ATOM 1084 CZ ARG B 186 17.638 -6.177 -9.839 1.00 2.97 C ATOM 1085 NH1 ARG B 186 16.316 -6.089 -9.778 1.00 3.23 N ATOM 1086 NH2 ARG B 186 18.243 -6.178 -11.019 1.00 3.82 N ATOM 0 H ARG B 186 19.382 -4.354 -3.992 1.00 0.79 H new ATOM 0 HA ARG B 186 21.226 -6.172 -5.199 1.00 0.88 H new ATOM 0 HB2 ARG B 186 19.134 -4.228 -6.195 1.00 0.90 H new ATOM 0 HB3 ARG B 186 20.193 -5.056 -7.320 1.00 0.90 H new ATOM 0 HG2 ARG B 186 19.416 -7.247 -6.423 1.00 1.29 H new ATOM 0 HG3 ARG B 186 18.341 -6.407 -5.323 1.00 1.29 H new ATOM 0 HD2 ARG B 186 17.093 -7.126 -7.293 1.00 1.64 H new ATOM 0 HD3 ARG B 186 17.160 -5.375 -7.248 1.00 1.64 H new ATOM 0 HE ARG B 186 19.367 -6.319 -8.802 1.00 2.30 H new ATOM 0 HH11 ARG B 186 15.846 -6.085 -8.873 1.00 3.23 H new ATOM 0 HH12 ARG B 186 15.769 -6.025 -10.637 1.00 3.23 H new ATOM 0 HH21 ARG B 186 19.260 -6.243 -11.071 1.00 3.82 H new ATOM 0 HH22 ARG B 186 17.692 -6.114 -11.875 1.00 3.82 H new ATOM 1100 N LEU B 187 21.826 -2.946 -5.367 1.00 0.93 N ATOM 1101 CA LEU B 187 22.844 -1.957 -5.696 1.00 1.07 C ATOM 1102 C LEU B 187 24.152 -2.280 -4.986 1.00 1.13 C ATOM 1103 O LEU B 187 25.236 -2.043 -5.517 1.00 1.37 O ATOM 1104 CB LEU B 187 22.368 -0.558 -5.303 1.00 1.20 C ATOM 1105 CG LEU B 187 21.050 -0.119 -5.941 1.00 1.42 C ATOM 1106 CD1 LEU B 187 20.671 1.277 -5.476 1.00 1.72 C ATOM 1107 CD2 LEU B 187 21.152 -0.169 -7.457 1.00 1.60 C ATOM 0 H LEU B 187 21.011 -2.568 -4.884 1.00 0.93 H new ATOM 0 HA LEU B 187 23.015 -1.984 -6.772 1.00 1.07 H new ATOM 0 HB2 LEU B 187 22.260 -0.519 -4.219 1.00 1.20 H new ATOM 0 HB3 LEU B 187 23.142 0.161 -5.572 1.00 1.20 H new ATOM 0 HG LEU B 187 20.267 -0.809 -5.626 1.00 1.42 H new ATOM 0 HD11 LEU B 187 19.730 1.572 -5.941 1.00 1.72 H new ATOM 0 HD12 LEU B 187 20.557 1.281 -4.392 1.00 1.72 H new ATOM 0 HD13 LEU B 187 21.453 1.980 -5.761 1.00 1.72 H new ATOM 0 HD21 LEU B 187 20.205 0.146 -7.896 1.00 1.60 H new ATOM 0 HD22 LEU B 187 21.947 0.498 -7.790 1.00 1.60 H new ATOM 0 HD23 LEU B 187 21.377 -1.188 -7.773 1.00 1.60 H new ATOM 1119 N THR B 188 24.039 -2.822 -3.778 1.00 1.14 N ATOM 1120 CA THR B 188 25.210 -3.182 -2.990 1.00 1.37 C ATOM 1121 C THR B 188 25.006 -4.516 -2.278 1.00 1.56 C ATOM 1122 O THR B 188 25.352 -5.559 -2.871 1.00 1.97 O ATOM 1123 CB THR B 188 25.544 -2.094 -1.951 1.00 1.53 C ATOM 1124 OG1 THR B 188 26.504 -2.590 -1.009 1.00 2.17 O ATOM 1125 CG2 THR B 188 24.292 -1.635 -1.217 1.00 1.63 C ATOM 1126 OXT THR B 188 24.504 -4.508 -1.135 1.00 2.16 O ATOM 0 H THR B 188 23.148 -3.021 -3.324 1.00 1.14 H new ATOM 0 HA THR B 188 26.045 -3.273 -3.685 1.00 1.37 H new ATOM 0 HB THR B 188 25.965 -1.239 -2.481 1.00 1.53 H new ATOM 0 HG1 THR B 188 26.711 -1.891 -0.354 1.00 2.17 H new ATOM 0 HG21 THR B 188 24.557 -0.867 -0.490 1.00 1.63 H new ATOM 0 HG22 THR B 188 23.580 -1.226 -1.933 1.00 1.63 H new ATOM 0 HG23 THR B 188 23.841 -2.483 -0.701 1.00 1.63 H new TER 1134 THR B 188