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 180:sc= 0 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot 139:sc= 0.278 USER MOD Single : A 172 SER OG : rot 73:sc= 1.28 USER MOD Single : A 173 HIS : no HE2:sc= -1.46! C(o=-1.5!,f=-3.4!) USER MOD Single : A 182 TYR OH : rot 150:sc= -0.0595 USER MOD Single : A 188 THR OG1 : rot 4:sc= 1.8 USER MOD Single : B 158 SER OG : rot 180:sc= 0.141 USER MOD Single : B 163 LYS NZ :NH3+ -176:sc= 0.0222 (180deg=0.0206) USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 172 SER OG : rot 70:sc= 0.758 USER MOD Single : B 173 HIS : no HD1:sc= -2.47! C(o=-2.5!,f=-4.2!) USER MOD Single : B 182 TYR OH : rot 180:sc= 0 USER MOD Single : B 188 THR OG1 : rot 81:sc= 0.12 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 154 -25.928 4.782 -5.860 1.00 7.13 N ATOM 2 CA GLY A 154 -24.594 5.413 -5.667 1.00 6.87 C ATOM 3 C GLY A 154 -24.231 5.567 -4.202 1.00 6.46 C ATOM 4 O GLY A 154 -25.014 5.211 -3.322 1.00 6.66 O ATOM 0 HA2 GLY A 154 -23.835 4.810 -6.165 1.00 6.87 H new ATOM 0 HA3 GLY A 154 -24.586 6.393 -6.145 1.00 6.87 H new ATOM 10 N GLY A 155 -23.043 6.101 -3.942 1.00 6.07 N ATOM 11 CA GLY A 155 -22.598 6.289 -2.573 1.00 5.79 C ATOM 12 C GLY A 155 -23.035 7.624 -1.997 1.00 5.77 C ATOM 13 O GLY A 155 -23.246 8.586 -2.735 1.00 5.89 O ATOM 0 H GLY A 155 -22.380 6.407 -4.654 1.00 6.07 H new ATOM 0 HA2 GLY A 155 -22.991 5.483 -1.953 1.00 5.79 H new ATOM 0 HA3 GLY A 155 -21.511 6.219 -2.535 1.00 5.79 H new ATOM 17 N ILE A 156 -23.167 7.681 -0.676 1.00 5.76 N ATOM 18 CA ILE A 156 -23.578 8.908 -0.001 1.00 5.93 C ATOM 19 C ILE A 156 -22.471 9.955 -0.050 1.00 5.47 C ATOM 20 O ILE A 156 -22.671 11.062 -0.550 1.00 5.66 O ATOM 21 CB ILE A 156 -23.951 8.645 1.471 1.00 6.19 C ATOM 22 CG1 ILE A 156 -25.005 7.540 1.567 1.00 6.65 C ATOM 23 CG2 ILE A 156 -24.456 9.923 2.123 1.00 6.57 C ATOM 24 CD1 ILE A 156 -25.399 7.204 2.990 1.00 7.47 C ATOM 0 H ILE A 156 -22.996 6.893 -0.051 1.00 5.76 H new ATOM 0 HA ILE A 156 -24.456 9.280 -0.529 1.00 5.93 H new ATOM 0 HB ILE A 156 -23.059 8.314 2.002 1.00 6.19 H new ATOM 0 HG12 ILE A 156 -25.893 7.847 1.015 1.00 6.65 H new ATOM 0 HG13 ILE A 156 -24.623 6.641 1.082 1.00 6.65 H new ATOM 0 HG21 ILE A 156 -24.716 9.723 3.162 1.00 6.57 H new ATOM 0 HG22 ILE A 156 -23.677 10.684 2.084 1.00 6.57 H new ATOM 0 HG23 ILE A 156 -25.338 10.279 1.591 1.00 6.57 H new ATOM 0 HD11 ILE A 156 -26.149 6.413 2.983 1.00 7.47 H new ATOM 0 HD12 ILE A 156 -24.521 6.866 3.541 1.00 7.47 H new ATOM 0 HD13 ILE A 156 -25.811 8.090 3.472 1.00 7.47 H new ATOM 36 N PHE A 157 -21.305 9.596 0.474 1.00 4.98 N ATOM 37 CA PHE A 157 -20.161 10.500 0.494 1.00 4.58 C ATOM 38 C PHE A 157 -19.511 10.585 -0.882 1.00 4.34 C ATOM 39 O PHE A 157 -19.407 11.665 -1.463 1.00 4.45 O ATOM 40 CB PHE A 157 -19.132 10.028 1.523 1.00 4.32 C ATOM 41 CG PHE A 157 -19.654 10.008 2.931 1.00 4.64 C ATOM 42 CD1 PHE A 157 -20.432 8.954 3.380 1.00 5.07 C ATOM 43 CD2 PHE A 157 -19.366 11.044 3.806 1.00 4.83 C ATOM 44 CE1 PHE A 157 -20.914 8.931 4.675 1.00 5.44 C ATOM 45 CE2 PHE A 157 -19.845 11.027 5.102 1.00 5.16 C ATOM 46 CZ PHE A 157 -20.619 9.969 5.538 1.00 5.37 C ATOM 0 H PHE A 157 -21.127 8.683 0.892 1.00 4.98 H new ATOM 0 HA PHE A 157 -20.518 11.492 0.771 1.00 4.58 H new ATOM 0 HB2 PHE A 157 -18.796 9.026 1.255 1.00 4.32 H new ATOM 0 HB3 PHE A 157 -18.260 10.680 1.477 1.00 4.32 H new ATOM 0 HD1 PHE A 157 -20.665 8.140 2.710 1.00 5.07 H new ATOM 0 HD2 PHE A 157 -18.761 11.873 3.471 1.00 4.83 H new ATOM 0 HE1 PHE A 157 -21.520 8.103 5.012 1.00 5.44 H new ATOM 0 HE2 PHE A 157 -19.614 11.841 5.774 1.00 5.16 H new ATOM 0 HZ PHE A 157 -20.993 9.953 6.551 1.00 5.37 H new ATOM 56 N SER A 158 -19.081 9.437 -1.397 1.00 4.12 N ATOM 57 CA SER A 158 -18.438 9.369 -2.705 1.00 4.02 C ATOM 58 C SER A 158 -17.271 10.352 -2.801 1.00 3.76 C ATOM 59 O SER A 158 -16.124 9.990 -2.541 1.00 3.52 O ATOM 60 CB SER A 158 -19.456 9.640 -3.816 1.00 4.46 C ATOM 61 OG SER A 158 -18.828 9.682 -5.087 1.00 4.61 O ATOM 0 H SER A 158 -19.167 8.537 -0.925 1.00 4.12 H new ATOM 0 HA SER A 158 -18.040 8.362 -2.831 1.00 4.02 H new ATOM 0 HB2 SER A 158 -20.220 8.863 -3.810 1.00 4.46 H new ATOM 0 HB3 SER A 158 -19.962 10.586 -3.626 1.00 4.46 H new ATOM 0 HG SER A 158 -19.500 9.855 -5.779 1.00 4.61 H new ATOM 67 N ALA A 159 -17.565 11.593 -3.173 1.00 3.90 N ATOM 68 CA ALA A 159 -16.532 12.615 -3.300 1.00 3.72 C ATOM 69 C ALA A 159 -15.795 12.834 -1.981 1.00 3.49 C ATOM 70 O ALA A 159 -14.579 12.666 -1.907 1.00 3.16 O ATOM 71 CB ALA A 159 -17.142 13.921 -3.787 1.00 4.05 C ATOM 0 H ALA A 159 -18.508 11.915 -3.391 1.00 3.90 H new ATOM 0 HA ALA A 159 -15.805 12.265 -4.033 1.00 3.72 H new ATOM 0 HB1 ALA A 159 -16.361 14.676 -3.878 1.00 4.05 H new ATOM 0 HB2 ALA A 159 -17.610 13.764 -4.759 1.00 4.05 H new ATOM 0 HB3 ALA A 159 -17.893 14.260 -3.074 1.00 4.05 H new ATOM 77 N GLU A 160 -16.542 13.205 -0.944 1.00 3.73 N ATOM 78 CA GLU A 160 -15.963 13.463 0.373 1.00 3.65 C ATOM 79 C GLU A 160 -15.193 12.256 0.900 1.00 3.31 C ATOM 80 O GLU A 160 -14.280 12.401 1.714 1.00 3.18 O ATOM 81 CB GLU A 160 -17.060 13.849 1.366 1.00 4.04 C ATOM 82 CG GLU A 160 -16.533 14.194 2.750 1.00 4.66 C ATOM 83 CD GLU A 160 -17.632 14.628 3.700 1.00 5.01 C ATOM 84 OE1 GLU A 160 -17.993 15.824 3.684 1.00 5.46 O ATOM 85 OE2 GLU A 160 -18.131 13.772 4.459 1.00 5.23 O ATOM 0 H GLU A 160 -17.553 13.334 -0.990 1.00 3.73 H new ATOM 0 HA GLU A 160 -15.260 14.289 0.265 1.00 3.65 H new ATOM 0 HB2 GLU A 160 -17.611 14.703 0.972 1.00 4.04 H new ATOM 0 HB3 GLU A 160 -17.768 13.025 1.451 1.00 4.04 H new ATOM 0 HG2 GLU A 160 -16.020 13.327 3.166 1.00 4.66 H new ATOM 0 HG3 GLU A 160 -15.795 14.991 2.665 1.00 4.66 H new ATOM 92 N PHE A 161 -15.561 11.066 0.439 1.00 3.23 N ATOM 93 CA PHE A 161 -14.901 9.842 0.881 1.00 2.95 C ATOM 94 C PHE A 161 -13.696 9.508 0.006 1.00 2.57 C ATOM 95 O PHE A 161 -12.594 9.288 0.508 1.00 2.28 O ATOM 96 CB PHE A 161 -15.888 8.672 0.873 1.00 3.11 C ATOM 97 CG PHE A 161 -15.256 7.352 1.212 1.00 2.87 C ATOM 98 CD1 PHE A 161 -15.052 6.985 2.532 1.00 3.09 C ATOM 99 CD2 PHE A 161 -14.863 6.481 0.209 1.00 2.82 C ATOM 100 CE1 PHE A 161 -14.467 5.772 2.846 1.00 2.88 C ATOM 101 CE2 PHE A 161 -14.279 5.267 0.516 1.00 2.72 C ATOM 102 CZ PHE A 161 -14.081 4.912 1.836 1.00 2.54 C ATOM 0 H PHE A 161 -16.310 10.922 -0.238 1.00 3.23 H new ATOM 0 HA PHE A 161 -14.546 10.009 1.898 1.00 2.95 H new ATOM 0 HB2 PHE A 161 -16.687 8.877 1.585 1.00 3.11 H new ATOM 0 HB3 PHE A 161 -16.349 8.603 -0.112 1.00 3.11 H new ATOM 0 HD1 PHE A 161 -15.353 7.654 3.325 1.00 3.09 H new ATOM 0 HD2 PHE A 161 -15.015 6.754 -0.825 1.00 2.82 H new ATOM 0 HE1 PHE A 161 -14.312 5.497 3.879 1.00 2.88 H new ATOM 0 HE2 PHE A 161 -13.978 4.596 -0.275 1.00 2.72 H new ATOM 0 HZ PHE A 161 -13.625 3.963 2.078 1.00 2.54 H new ATOM 112 N LEU A 162 -13.912 9.473 -1.304 1.00 2.64 N ATOM 113 CA LEU A 162 -12.850 9.150 -2.249 1.00 2.41 C ATOM 114 C LEU A 162 -11.710 10.165 -2.190 1.00 2.23 C ATOM 115 O LEU A 162 -10.542 9.801 -2.327 1.00 1.96 O ATOM 116 CB LEU A 162 -13.412 9.078 -3.670 1.00 2.72 C ATOM 117 CG LEU A 162 -14.430 7.961 -3.906 1.00 2.97 C ATOM 118 CD1 LEU A 162 -14.935 7.995 -5.340 1.00 3.35 C ATOM 119 CD2 LEU A 162 -13.818 6.606 -3.586 1.00 2.73 C ATOM 0 H LEU A 162 -14.816 9.665 -1.737 1.00 2.64 H new ATOM 0 HA LEU A 162 -12.445 8.178 -1.969 1.00 2.41 H new ATOM 0 HB2 LEU A 162 -13.881 10.033 -3.908 1.00 2.72 H new ATOM 0 HB3 LEU A 162 -12.584 8.947 -4.366 1.00 2.72 H new ATOM 0 HG LEU A 162 -15.278 8.120 -3.240 1.00 2.97 H new ATOM 0 HD11 LEU A 162 -15.658 7.193 -5.490 1.00 3.35 H new ATOM 0 HD12 LEU A 162 -15.412 8.955 -5.535 1.00 3.35 H new ATOM 0 HD13 LEU A 162 -14.097 7.860 -6.024 1.00 3.35 H new ATOM 0 HD21 LEU A 162 -14.556 5.823 -3.760 1.00 2.73 H new ATOM 0 HD22 LEU A 162 -12.953 6.437 -4.227 1.00 2.73 H new ATOM 0 HD23 LEU A 162 -13.506 6.585 -2.542 1.00 2.73 H new ATOM 131 N LYS A 163 -12.048 11.434 -1.985 1.00 2.45 N ATOM 132 CA LYS A 163 -11.042 12.484 -1.919 1.00 2.39 C ATOM 133 C LYS A 163 -10.001 12.184 -0.846 1.00 2.08 C ATOM 134 O LYS A 163 -8.847 12.600 -0.954 1.00 1.99 O ATOM 135 CB LYS A 163 -11.700 13.837 -1.653 1.00 2.73 C ATOM 136 CG LYS A 163 -12.419 13.924 -0.318 1.00 3.30 C ATOM 137 CD LYS A 163 -12.985 15.312 -0.085 1.00 3.60 C ATOM 138 CE LYS A 163 -13.874 15.755 -1.238 1.00 3.55 C ATOM 139 NZ LYS A 163 -14.525 17.066 -0.966 1.00 3.93 N ATOM 0 H LYS A 163 -13.007 11.758 -1.862 1.00 2.45 H new ATOM 0 HA LYS A 163 -10.534 12.522 -2.883 1.00 2.39 H new ATOM 0 HB2 LYS A 163 -10.937 14.615 -1.694 1.00 2.73 H new ATOM 0 HB3 LYS A 163 -12.412 14.046 -2.451 1.00 2.73 H new ATOM 0 HG2 LYS A 163 -13.225 13.191 -0.288 1.00 3.30 H new ATOM 0 HG3 LYS A 163 -11.728 13.671 0.486 1.00 3.30 H new ATOM 0 HD2 LYS A 163 -13.559 15.321 0.842 1.00 3.60 H new ATOM 0 HD3 LYS A 163 -12.168 16.023 0.039 1.00 3.60 H new ATOM 0 HE2 LYS A 163 -13.279 15.827 -2.148 1.00 3.55 H new ATOM 0 HE3 LYS A 163 -14.639 15.000 -1.417 1.00 3.55 H new ATOM 0 HZ1 LYS A 163 -15.122 17.332 -1.775 1.00 3.93 H new ATOM 0 HZ2 LYS A 163 -15.114 16.991 -0.112 1.00 3.93 H new ATOM 0 HZ3 LYS A 163 -13.795 17.792 -0.821 1.00 3.93 H new ATOM 153 N VAL A 164 -10.413 11.461 0.191 1.00 2.04 N ATOM 154 CA VAL A 164 -9.509 11.104 1.277 1.00 1.90 C ATOM 155 C VAL A 164 -9.325 9.592 1.370 1.00 1.69 C ATOM 156 O VAL A 164 -8.976 9.063 2.424 1.00 1.85 O ATOM 157 CB VAL A 164 -10.018 11.630 2.633 1.00 2.27 C ATOM 158 CG1 VAL A 164 -9.877 13.143 2.708 1.00 2.48 C ATOM 159 CG2 VAL A 164 -11.461 11.210 2.856 1.00 2.51 C ATOM 0 H VAL A 164 -11.365 11.112 0.301 1.00 2.04 H new ATOM 0 HA VAL A 164 -8.550 11.571 1.051 1.00 1.90 H new ATOM 0 HB VAL A 164 -9.408 11.194 3.424 1.00 2.27 H new ATOM 0 HG11 VAL A 164 -10.242 13.495 3.673 1.00 2.48 H new ATOM 0 HG12 VAL A 164 -8.828 13.417 2.595 1.00 2.48 H new ATOM 0 HG13 VAL A 164 -10.460 13.603 1.910 1.00 2.48 H new ATOM 0 HG21 VAL A 164 -11.806 11.589 3.818 1.00 2.51 H new ATOM 0 HG22 VAL A 164 -12.085 11.617 2.061 1.00 2.51 H new ATOM 0 HG23 VAL A 164 -11.528 10.122 2.850 1.00 2.51 H new ATOM 169 N PHE A 165 -9.563 8.902 0.258 1.00 1.49 N ATOM 170 CA PHE A 165 -9.422 7.450 0.216 1.00 1.32 C ATOM 171 C PHE A 165 -8.627 7.019 -1.012 1.00 1.13 C ATOM 172 O PHE A 165 -7.751 6.158 -0.925 1.00 0.96 O ATOM 173 CB PHE A 165 -10.798 6.781 0.205 1.00 1.48 C ATOM 174 CG PHE A 165 -10.736 5.281 0.293 1.00 1.40 C ATOM 175 CD1 PHE A 165 -10.516 4.656 1.510 1.00 2.06 C ATOM 176 CD2 PHE A 165 -10.897 4.499 -0.839 1.00 1.57 C ATOM 177 CE1 PHE A 165 -10.458 3.278 1.596 1.00 2.08 C ATOM 178 CE2 PHE A 165 -10.841 3.121 -0.759 1.00 1.61 C ATOM 179 CZ PHE A 165 -10.620 2.509 0.460 1.00 1.47 C ATOM 0 H PHE A 165 -9.854 9.324 -0.624 1.00 1.49 H new ATOM 0 HA PHE A 165 -8.881 7.137 1.109 1.00 1.32 H new ATOM 0 HB2 PHE A 165 -11.385 7.162 1.040 1.00 1.48 H new ATOM 0 HB3 PHE A 165 -11.323 7.062 -0.708 1.00 1.48 H new ATOM 0 HD1 PHE A 165 -10.388 5.252 2.401 1.00 2.06 H new ATOM 0 HD2 PHE A 165 -11.068 4.972 -1.795 1.00 1.57 H new ATOM 0 HE1 PHE A 165 -10.286 2.803 2.550 1.00 2.08 H new ATOM 0 HE2 PHE A 165 -10.970 2.522 -1.649 1.00 1.61 H new ATOM 0 HZ PHE A 165 -10.574 1.432 0.524 1.00 1.47 H new ATOM 189 N LEU A 166 -8.938 7.622 -2.154 1.00 1.25 N ATOM 190 CA LEU A 166 -8.255 7.300 -3.400 1.00 1.22 C ATOM 191 C LEU A 166 -6.779 7.693 -3.347 1.00 1.03 C ATOM 192 O LEU A 166 -5.905 6.847 -3.537 1.00 0.95 O ATOM 193 CB LEU A 166 -8.948 7.980 -4.585 1.00 1.49 C ATOM 194 CG LEU A 166 -10.376 7.506 -4.856 1.00 1.76 C ATOM 195 CD1 LEU A 166 -10.952 8.216 -6.073 1.00 2.04 C ATOM 196 CD2 LEU A 166 -10.407 5.997 -5.051 1.00 1.79 C ATOM 0 H LEU A 166 -9.660 8.337 -2.242 1.00 1.25 H new ATOM 0 HA LEU A 166 -8.307 6.220 -3.536 1.00 1.22 H new ATOM 0 HB2 LEU A 166 -8.965 9.055 -4.408 1.00 1.49 H new ATOM 0 HB3 LEU A 166 -8.350 7.814 -5.481 1.00 1.49 H new ATOM 0 HG LEU A 166 -10.992 7.754 -3.992 1.00 1.76 H new ATOM 0 HD11 LEU A 166 -11.969 7.866 -6.251 1.00 2.04 H new ATOM 0 HD12 LEU A 166 -10.964 9.291 -5.895 1.00 2.04 H new ATOM 0 HD13 LEU A 166 -10.336 8.000 -6.946 1.00 2.04 H new ATOM 0 HD21 LEU A 166 -11.431 5.676 -5.243 1.00 1.79 H new ATOM 0 HD22 LEU A 166 -9.777 5.727 -5.898 1.00 1.79 H new ATOM 0 HD23 LEU A 166 -10.035 5.506 -4.151 1.00 1.79 H new ATOM 208 N PRO A 167 -6.469 8.978 -3.085 1.00 1.04 N ATOM 209 CA PRO A 167 -5.080 9.443 -3.013 1.00 0.94 C ATOM 210 C PRO A 167 -4.302 8.754 -1.898 1.00 0.80 C ATOM 211 O PRO A 167 -3.093 8.550 -2.004 1.00 0.85 O ATOM 212 CB PRO A 167 -5.207 10.945 -2.731 1.00 1.03 C ATOM 213 CG PRO A 167 -6.579 11.120 -2.177 1.00 1.28 C ATOM 214 CD PRO A 167 -7.426 10.072 -2.839 1.00 1.26 C ATOM 0 HA PRO A 167 -4.531 9.221 -3.928 1.00 0.94 H new ATOM 0 HB2 PRO A 167 -4.450 11.279 -2.022 1.00 1.03 H new ATOM 0 HB3 PRO A 167 -5.071 11.530 -3.641 1.00 1.03 H new ATOM 0 HG2 PRO A 167 -6.582 10.998 -1.094 1.00 1.28 H new ATOM 0 HG3 PRO A 167 -6.960 12.120 -2.386 1.00 1.28 H new ATOM 0 HD2 PRO A 167 -8.248 9.753 -2.198 1.00 1.26 H new ATOM 0 HD3 PRO A 167 -7.868 10.437 -3.766 1.00 1.26 H new ATOM 222 N SER A 168 -5.006 8.394 -0.828 1.00 0.76 N ATOM 223 CA SER A 168 -4.383 7.725 0.308 1.00 0.70 C ATOM 224 C SER A 168 -3.689 6.441 -0.130 1.00 0.57 C ATOM 225 O SER A 168 -2.584 6.135 0.317 1.00 0.51 O ATOM 226 CB SER A 168 -5.430 7.409 1.378 1.00 0.82 C ATOM 227 OG SER A 168 -6.052 8.591 1.850 1.00 1.39 O ATOM 0 H SER A 168 -6.008 8.555 -0.725 1.00 0.76 H new ATOM 0 HA SER A 168 -3.635 8.398 0.727 1.00 0.70 H new ATOM 0 HB2 SER A 168 -6.184 6.738 0.966 1.00 0.82 H new ATOM 0 HB3 SER A 168 -4.958 6.886 2.210 1.00 0.82 H new ATOM 0 HG SER A 168 -7.014 8.435 1.953 1.00 1.39 H new ATOM 233 N LEU A 169 -4.347 5.690 -1.007 1.00 0.58 N ATOM 234 CA LEU A 169 -3.795 4.436 -1.505 1.00 0.51 C ATOM 235 C LEU A 169 -2.486 4.675 -2.252 1.00 0.41 C ATOM 236 O LEU A 169 -1.498 3.975 -2.032 1.00 0.36 O ATOM 237 CB LEU A 169 -4.805 3.737 -2.417 1.00 0.64 C ATOM 238 CG LEU A 169 -6.150 3.417 -1.765 1.00 0.77 C ATOM 239 CD1 LEU A 169 -7.061 2.692 -2.743 1.00 1.07 C ATOM 240 CD2 LEU A 169 -5.945 2.588 -0.507 1.00 0.81 C ATOM 0 H LEU A 169 -5.263 5.928 -1.387 1.00 0.58 H new ATOM 0 HA LEU A 169 -3.587 3.793 -0.650 1.00 0.51 H new ATOM 0 HB2 LEU A 169 -4.982 4.367 -3.289 1.00 0.64 H new ATOM 0 HB3 LEU A 169 -4.363 2.808 -2.779 1.00 0.64 H new ATOM 0 HG LEU A 169 -6.630 4.355 -1.485 1.00 0.77 H new ATOM 0 HD11 LEU A 169 -8.013 2.473 -2.260 1.00 1.07 H new ATOM 0 HD12 LEU A 169 -7.233 3.322 -3.615 1.00 1.07 H new ATOM 0 HD13 LEU A 169 -6.590 1.760 -3.056 1.00 1.07 H new ATOM 0 HD21 LEU A 169 -6.912 2.368 -0.054 1.00 0.81 H new ATOM 0 HD22 LEU A 169 -5.444 1.655 -0.764 1.00 0.81 H new ATOM 0 HD23 LEU A 169 -5.332 3.146 0.200 1.00 0.81 H new ATOM 252 N LEU A 170 -2.484 5.672 -3.132 1.00 0.46 N ATOM 253 CA LEU A 170 -1.292 5.998 -3.911 1.00 0.47 C ATOM 254 C LEU A 170 -0.141 6.415 -3.003 1.00 0.38 C ATOM 255 O LEU A 170 0.983 5.935 -3.149 1.00 0.39 O ATOM 256 CB LEU A 170 -1.593 7.114 -4.914 1.00 0.60 C ATOM 257 CG LEU A 170 -2.458 6.705 -6.109 1.00 0.73 C ATOM 258 CD1 LEU A 170 -3.766 6.085 -5.644 1.00 0.88 C ATOM 259 CD2 LEU A 170 -2.725 7.904 -7.007 1.00 1.12 C ATOM 0 H LEU A 170 -3.290 6.266 -3.324 1.00 0.46 H new ATOM 0 HA LEU A 170 -0.996 5.101 -4.456 1.00 0.47 H new ATOM 0 HB2 LEU A 170 -2.091 7.928 -4.388 1.00 0.60 H new ATOM 0 HB3 LEU A 170 -0.648 7.508 -5.289 1.00 0.60 H new ATOM 0 HG LEU A 170 -1.913 5.956 -6.683 1.00 0.73 H new ATOM 0 HD11 LEU A 170 -4.363 5.803 -6.511 1.00 0.88 H new ATOM 0 HD12 LEU A 170 -3.556 5.200 -5.044 1.00 0.88 H new ATOM 0 HD13 LEU A 170 -4.318 6.808 -5.043 1.00 0.88 H new ATOM 0 HD21 LEU A 170 -3.341 7.596 -7.852 1.00 1.12 H new ATOM 0 HD22 LEU A 170 -3.246 8.675 -6.439 1.00 1.12 H new ATOM 0 HD23 LEU A 170 -1.779 8.301 -7.374 1.00 1.12 H new ATOM 271 N LEU A 171 -0.427 7.311 -2.065 1.00 0.36 N ATOM 272 CA LEU A 171 0.588 7.793 -1.135 1.00 0.37 C ATOM 273 C LEU A 171 1.177 6.645 -0.323 1.00 0.32 C ATOM 274 O LEU A 171 2.391 6.566 -0.133 1.00 0.35 O ATOM 275 CB LEU A 171 -0.007 8.845 -0.197 1.00 0.44 C ATOM 276 CG LEU A 171 -0.517 10.113 -0.883 1.00 0.54 C ATOM 277 CD1 LEU A 171 -1.121 11.064 0.139 1.00 0.64 C ATOM 278 CD2 LEU A 171 0.610 10.794 -1.647 1.00 0.62 C ATOM 0 H LEU A 171 -1.352 7.718 -1.928 1.00 0.36 H new ATOM 0 HA LEU A 171 1.389 8.247 -1.718 1.00 0.37 H new ATOM 0 HB2 LEU A 171 -0.831 8.393 0.355 1.00 0.44 H new ATOM 0 HB3 LEU A 171 0.750 9.126 0.535 1.00 0.44 H new ATOM 0 HG LEU A 171 -1.295 9.833 -1.594 1.00 0.54 H new ATOM 0 HD11 LEU A 171 -1.479 11.961 -0.366 1.00 0.64 H new ATOM 0 HD12 LEU A 171 -1.954 10.575 0.644 1.00 0.64 H new ATOM 0 HD13 LEU A 171 -0.363 11.339 0.873 1.00 0.64 H new ATOM 0 HD21 LEU A 171 0.230 11.695 -2.129 1.00 0.62 H new ATOM 0 HD22 LEU A 171 1.409 11.062 -0.955 1.00 0.62 H new ATOM 0 HD23 LEU A 171 0.999 10.114 -2.404 1.00 0.62 H new ATOM 290 N SER A 172 0.312 5.756 0.153 1.00 0.28 N ATOM 291 CA SER A 172 0.751 4.612 0.946 1.00 0.29 C ATOM 292 C SER A 172 1.770 3.777 0.178 1.00 0.25 C ATOM 293 O SER A 172 2.852 3.481 0.684 1.00 0.27 O ATOM 294 CB SER A 172 -0.446 3.744 1.336 1.00 0.35 C ATOM 295 OG SER A 172 -1.381 4.480 2.106 1.00 0.42 O ATOM 0 H SER A 172 -0.696 5.805 0.004 1.00 0.28 H new ATOM 0 HA SER A 172 1.226 4.991 1.851 1.00 0.29 H new ATOM 0 HB2 SER A 172 -0.931 3.362 0.437 1.00 0.35 H new ATOM 0 HB3 SER A 172 -0.103 2.880 1.904 1.00 0.35 H new ATOM 0 HG SER A 172 -1.860 5.108 1.526 1.00 0.42 H new ATOM 301 N HIS A 173 1.416 3.399 -1.046 1.00 0.23 N ATOM 302 CA HIS A 173 2.299 2.596 -1.883 1.00 0.24 C ATOM 303 C HIS A 173 3.648 3.282 -2.069 1.00 0.22 C ATOM 304 O HIS A 173 4.698 2.675 -1.857 1.00 0.24 O ATOM 305 CB HIS A 173 1.650 2.335 -3.243 1.00 0.31 C ATOM 306 CG HIS A 173 0.393 1.527 -3.157 1.00 0.37 C ATOM 307 ND1 HIS A 173 -0.846 2.023 -3.506 1.00 0.42 N ATOM 308 CD2 HIS A 173 0.187 0.249 -2.761 1.00 0.52 C ATOM 309 CE1 HIS A 173 -1.759 1.086 -3.328 1.00 0.48 C ATOM 310 NE2 HIS A 173 -1.158 0.000 -2.877 1.00 0.53 N ATOM 0 H HIS A 173 0.524 3.636 -1.480 1.00 0.23 H new ATOM 0 HA HIS A 173 2.466 1.643 -1.381 1.00 0.24 H new ATOM 0 HB2 HIS A 173 1.428 3.289 -3.720 1.00 0.31 H new ATOM 0 HB3 HIS A 173 2.363 1.817 -3.884 1.00 0.31 H new ATOM 0 HD1 HIS A 173 -1.028 2.966 -3.848 1.00 0.42 H new ATOM 0 HD2 HIS A 173 0.940 -0.445 -2.418 1.00 0.52 H new ATOM 0 HE1 HIS A 173 -2.817 1.190 -3.519 1.00 0.48 H new ATOM 319 N LEU A 174 3.615 4.550 -2.468 1.00 0.22 N ATOM 320 CA LEU A 174 4.839 5.314 -2.680 1.00 0.26 C ATOM 321 C LEU A 174 5.688 5.335 -1.415 1.00 0.24 C ATOM 322 O LEU A 174 6.900 5.125 -1.464 1.00 0.29 O ATOM 323 CB LEU A 174 4.506 6.742 -3.113 1.00 0.31 C ATOM 324 CG LEU A 174 3.746 6.855 -4.436 1.00 0.36 C ATOM 325 CD1 LEU A 174 3.456 8.311 -4.763 1.00 0.42 C ATOM 326 CD2 LEU A 174 4.536 6.201 -5.559 1.00 0.42 C ATOM 0 H LEU A 174 2.756 5.069 -2.651 1.00 0.22 H new ATOM 0 HA LEU A 174 5.410 4.829 -3.472 1.00 0.26 H new ATOM 0 HB2 LEU A 174 3.914 7.215 -2.329 1.00 0.31 H new ATOM 0 HB3 LEU A 174 5.435 7.307 -3.195 1.00 0.31 H new ATOM 0 HG LEU A 174 2.795 6.332 -4.334 1.00 0.36 H new ATOM 0 HD11 LEU A 174 2.915 8.371 -5.707 1.00 0.42 H new ATOM 0 HD12 LEU A 174 2.850 8.748 -3.969 1.00 0.42 H new ATOM 0 HD13 LEU A 174 4.395 8.859 -4.847 1.00 0.42 H new ATOM 0 HD21 LEU A 174 3.982 6.290 -6.493 1.00 0.42 H new ATOM 0 HD22 LEU A 174 5.501 6.697 -5.661 1.00 0.42 H new ATOM 0 HD23 LEU A 174 4.692 5.147 -5.328 1.00 0.42 H new ATOM 338 N LEU A 175 5.042 5.591 -0.282 1.00 0.23 N ATOM 339 CA LEU A 175 5.739 5.634 0.997 1.00 0.27 C ATOM 340 C LEU A 175 6.371 4.282 1.311 1.00 0.24 C ATOM 341 O LEU A 175 7.532 4.208 1.710 1.00 0.27 O ATOM 342 CB LEU A 175 4.776 6.035 2.116 1.00 0.32 C ATOM 343 CG LEU A 175 4.276 7.479 2.056 1.00 0.37 C ATOM 344 CD1 LEU A 175 3.200 7.716 3.105 1.00 0.46 C ATOM 345 CD2 LEU A 175 5.430 8.450 2.248 1.00 0.46 C ATOM 0 H LEU A 175 4.040 5.771 -0.224 1.00 0.23 H new ATOM 0 HA LEU A 175 6.530 6.380 0.929 1.00 0.27 H new ATOM 0 HB2 LEU A 175 3.915 5.367 2.089 1.00 0.32 H new ATOM 0 HB3 LEU A 175 5.272 5.878 3.074 1.00 0.32 H new ATOM 0 HG LEU A 175 3.840 7.651 1.072 1.00 0.37 H new ATOM 0 HD11 LEU A 175 2.857 8.749 3.047 1.00 0.46 H new ATOM 0 HD12 LEU A 175 2.361 7.044 2.924 1.00 0.46 H new ATOM 0 HD13 LEU A 175 3.610 7.525 4.097 1.00 0.46 H new ATOM 0 HD21 LEU A 175 5.056 9.473 2.202 1.00 0.46 H new ATOM 0 HD22 LEU A 175 5.894 8.276 3.219 1.00 0.46 H new ATOM 0 HD23 LEU A 175 6.168 8.298 1.461 1.00 0.46 H new ATOM 357 N ALA A 176 5.600 3.214 1.125 1.00 0.21 N ATOM 358 CA ALA A 176 6.091 1.866 1.388 1.00 0.21 C ATOM 359 C ALA A 176 7.398 1.610 0.648 1.00 0.19 C ATOM 360 O ALA A 176 8.396 1.198 1.244 1.00 0.21 O ATOM 361 CB ALA A 176 5.044 0.836 0.989 1.00 0.21 C ATOM 0 H ALA A 176 4.636 3.256 0.794 1.00 0.21 H new ATOM 0 HA ALA A 176 6.283 1.775 2.457 1.00 0.21 H new ATOM 0 HB1 ALA A 176 5.424 -0.166 1.191 1.00 0.21 H new ATOM 0 HB2 ALA A 176 4.133 1.001 1.564 1.00 0.21 H new ATOM 0 HB3 ALA A 176 4.824 0.934 -0.074 1.00 0.21 H new ATOM 367 N ILE A 177 7.388 1.861 -0.657 1.00 0.18 N ATOM 368 CA ILE A 177 8.575 1.669 -1.477 1.00 0.20 C ATOM 369 C ILE A 177 9.727 2.509 -0.946 1.00 0.21 C ATOM 370 O ILE A 177 10.858 2.037 -0.843 1.00 0.23 O ATOM 371 CB ILE A 177 8.310 2.039 -2.950 1.00 0.23 C ATOM 372 CG1 ILE A 177 7.160 1.200 -3.508 1.00 0.25 C ATOM 373 CG2 ILE A 177 9.570 1.846 -3.782 1.00 0.27 C ATOM 374 CD1 ILE A 177 6.867 1.469 -4.968 1.00 0.47 C ATOM 0 H ILE A 177 6.571 2.197 -1.167 1.00 0.18 H new ATOM 0 HA ILE A 177 8.838 0.612 -1.428 1.00 0.20 H new ATOM 0 HB ILE A 177 8.026 3.090 -3.000 1.00 0.23 H new ATOM 0 HG12 ILE A 177 7.398 0.144 -3.382 1.00 0.25 H new ATOM 0 HG13 ILE A 177 6.261 1.396 -2.923 1.00 0.25 H new ATOM 0 HG21 ILE A 177 9.365 2.112 -4.819 1.00 0.27 H new ATOM 0 HG22 ILE A 177 10.364 2.484 -3.394 1.00 0.27 H new ATOM 0 HG23 ILE A 177 9.884 0.804 -3.730 1.00 0.27 H new ATOM 0 HD11 ILE A 177 6.040 0.839 -5.295 1.00 0.47 H new ATOM 0 HD12 ILE A 177 6.598 2.517 -5.098 1.00 0.47 H new ATOM 0 HD13 ILE A 177 7.752 1.245 -5.564 1.00 0.47 H new ATOM 386 N GLY A 178 9.428 3.758 -0.605 1.00 0.20 N ATOM 387 CA GLY A 178 10.447 4.644 -0.077 1.00 0.23 C ATOM 388 C GLY A 178 11.109 4.071 1.160 1.00 0.22 C ATOM 389 O GLY A 178 12.329 4.133 1.303 1.00 0.23 O ATOM 0 H GLY A 178 8.499 4.172 -0.685 1.00 0.20 H new ATOM 0 HA2 GLY A 178 11.202 4.825 -0.842 1.00 0.23 H new ATOM 0 HA3 GLY A 178 10.000 5.608 0.164 1.00 0.23 H new ATOM 393 N LEU A 179 10.299 3.515 2.057 1.00 0.21 N ATOM 394 CA LEU A 179 10.816 2.919 3.282 1.00 0.23 C ATOM 395 C LEU A 179 11.849 1.850 2.952 1.00 0.21 C ATOM 396 O LEU A 179 12.941 1.829 3.520 1.00 0.24 O ATOM 397 CB LEU A 179 9.678 2.310 4.105 1.00 0.27 C ATOM 398 CG LEU A 179 8.632 3.307 4.604 1.00 0.30 C ATOM 399 CD1 LEU A 179 7.549 2.594 5.399 1.00 0.36 C ATOM 400 CD2 LEU A 179 9.287 4.391 5.448 1.00 0.36 C ATOM 0 H LEU A 179 9.285 3.466 1.958 1.00 0.21 H new ATOM 0 HA LEU A 179 11.292 3.702 3.872 1.00 0.23 H new ATOM 0 HB2 LEU A 179 9.177 1.554 3.500 1.00 0.27 H new ATOM 0 HB3 LEU A 179 10.107 1.797 4.965 1.00 0.27 H new ATOM 0 HG LEU A 179 8.168 3.778 3.738 1.00 0.30 H new ATOM 0 HD11 LEU A 179 6.814 3.321 5.745 1.00 0.36 H new ATOM 0 HD12 LEU A 179 7.058 1.856 4.765 1.00 0.36 H new ATOM 0 HD13 LEU A 179 7.997 2.094 6.257 1.00 0.36 H new ATOM 0 HD21 LEU A 179 8.527 5.091 5.794 1.00 0.36 H new ATOM 0 HD22 LEU A 179 9.779 3.935 6.307 1.00 0.36 H new ATOM 0 HD23 LEU A 179 10.025 4.924 4.848 1.00 0.36 H new ATOM 412 N GLY A 180 11.493 0.962 2.028 1.00 0.20 N ATOM 413 CA GLY A 180 12.405 -0.092 1.628 1.00 0.23 C ATOM 414 C GLY A 180 13.722 0.459 1.116 1.00 0.24 C ATOM 415 O GLY A 180 14.792 -0.030 1.480 1.00 0.28 O ATOM 0 H GLY A 180 10.591 0.954 1.551 1.00 0.20 H new ATOM 0 HA2 GLY A 180 12.593 -0.750 2.476 1.00 0.23 H new ATOM 0 HA3 GLY A 180 11.939 -0.699 0.851 1.00 0.23 H new ATOM 419 N ILE A 181 13.642 1.481 0.269 1.00 0.26 N ATOM 420 CA ILE A 181 14.833 2.108 -0.293 1.00 0.32 C ATOM 421 C ILE A 181 15.693 2.722 0.807 1.00 0.33 C ATOM 422 O ILE A 181 16.909 2.532 0.842 1.00 0.34 O ATOM 423 CB ILE A 181 14.464 3.204 -1.312 1.00 0.41 C ATOM 424 CG1 ILE A 181 13.589 2.625 -2.425 1.00 0.47 C ATOM 425 CG2 ILE A 181 15.719 3.833 -1.893 1.00 0.52 C ATOM 426 CD1 ILE A 181 14.284 1.570 -3.255 1.00 0.90 C ATOM 0 H ILE A 181 12.763 1.893 -0.043 1.00 0.26 H new ATOM 0 HA ILE A 181 15.396 1.326 -0.802 1.00 0.32 H new ATOM 0 HB ILE A 181 13.898 3.980 -0.797 1.00 0.41 H new ATOM 0 HG12 ILE A 181 12.691 2.194 -1.982 1.00 0.47 H new ATOM 0 HG13 ILE A 181 13.265 3.434 -3.079 1.00 0.47 H new ATOM 0 HG21 ILE A 181 15.440 4.605 -2.611 1.00 0.52 H new ATOM 0 HG22 ILE A 181 16.307 4.279 -1.091 1.00 0.52 H new ATOM 0 HG23 ILE A 181 16.311 3.067 -2.395 1.00 0.52 H new ATOM 0 HD11 ILE A 181 13.603 1.205 -4.024 1.00 0.90 H new ATOM 0 HD12 ILE A 181 15.167 2.001 -3.727 1.00 0.90 H new ATOM 0 HD13 ILE A 181 14.584 0.742 -2.613 1.00 0.90 H new ATOM 438 N TYR A 182 15.048 3.462 1.702 1.00 0.35 N ATOM 439 CA TYR A 182 15.743 4.112 2.809 1.00 0.42 C ATOM 440 C TYR A 182 16.571 3.104 3.602 1.00 0.40 C ATOM 441 O TYR A 182 17.740 3.341 3.896 1.00 0.46 O ATOM 442 CB TYR A 182 14.731 4.797 3.727 1.00 0.49 C ATOM 443 CG TYR A 182 15.357 5.511 4.904 1.00 0.62 C ATOM 444 CD1 TYR A 182 16.081 6.683 4.725 1.00 1.16 C ATOM 445 CD2 TYR A 182 15.218 5.015 6.194 1.00 1.34 C ATOM 446 CE1 TYR A 182 16.651 7.339 5.799 1.00 1.25 C ATOM 447 CE2 TYR A 182 15.785 5.667 7.274 1.00 1.44 C ATOM 448 CZ TYR A 182 16.500 6.828 7.070 1.00 0.93 C ATOM 449 OH TYR A 182 17.065 7.480 8.143 1.00 1.09 O ATOM 0 H TYR A 182 14.042 3.628 1.683 1.00 0.35 H new ATOM 0 HA TYR A 182 16.421 4.860 2.397 1.00 0.42 H new ATOM 0 HB2 TYR A 182 14.154 5.515 3.144 1.00 0.49 H new ATOM 0 HB3 TYR A 182 14.029 4.051 4.099 1.00 0.49 H new ATOM 0 HD1 TYR A 182 16.200 7.088 3.731 1.00 1.16 H new ATOM 0 HD2 TYR A 182 14.658 4.106 6.356 1.00 1.34 H new ATOM 0 HE1 TYR A 182 17.212 8.248 5.643 1.00 1.25 H new ATOM 0 HE2 TYR A 182 15.668 5.269 8.271 1.00 1.44 H new ATOM 0 HH TYR A 182 16.522 7.323 8.944 1.00 1.09 H new ATOM 459 N ILE A 183 15.951 1.986 3.954 1.00 0.36 N ATOM 460 CA ILE A 183 16.628 0.939 4.709 1.00 0.42 C ATOM 461 C ILE A 183 17.798 0.349 3.922 1.00 0.41 C ATOM 462 O ILE A 183 18.880 0.132 4.466 1.00 0.46 O ATOM 463 CB ILE A 183 15.652 -0.194 5.085 1.00 0.47 C ATOM 464 CG1 ILE A 183 14.472 0.368 5.879 1.00 0.56 C ATOM 465 CG2 ILE A 183 16.369 -1.273 5.884 1.00 0.58 C ATOM 466 CD1 ILE A 183 13.418 -0.667 6.204 1.00 0.80 C ATOM 0 H ILE A 183 14.978 1.780 3.728 1.00 0.36 H new ATOM 0 HA ILE A 183 17.011 1.403 5.618 1.00 0.42 H new ATOM 0 HB ILE A 183 15.271 -0.645 4.168 1.00 0.47 H new ATOM 0 HG12 ILE A 183 14.843 0.802 6.808 1.00 0.56 H new ATOM 0 HG13 ILE A 183 14.013 1.177 5.310 1.00 0.56 H new ATOM 0 HG21 ILE A 183 15.665 -2.064 6.141 1.00 0.58 H new ATOM 0 HG22 ILE A 183 17.181 -1.689 5.287 1.00 0.58 H new ATOM 0 HG23 ILE A 183 16.776 -0.839 6.797 1.00 0.58 H new ATOM 0 HD11 ILE A 183 12.611 -0.200 6.768 1.00 0.80 H new ATOM 0 HD12 ILE A 183 13.020 -1.084 5.279 1.00 0.80 H new ATOM 0 HD13 ILE A 183 13.862 -1.464 6.800 1.00 0.80 H new ATOM 478 N GLY A 184 17.570 0.092 2.636 1.00 0.39 N ATOM 479 CA GLY A 184 18.603 -0.486 1.794 1.00 0.46 C ATOM 480 C GLY A 184 19.831 0.396 1.651 1.00 0.50 C ATOM 481 O GLY A 184 20.952 -0.052 1.887 1.00 0.55 O ATOM 0 H GLY A 184 16.686 0.275 2.162 1.00 0.39 H new ATOM 0 HA2 GLY A 184 18.903 -1.448 2.209 1.00 0.46 H new ATOM 0 HA3 GLY A 184 18.188 -0.681 0.805 1.00 0.46 H new ATOM 485 N ARG A 185 19.623 1.650 1.265 1.00 0.53 N ATOM 486 CA ARG A 185 20.729 2.586 1.081 1.00 0.65 C ATOM 487 C ARG A 185 21.560 2.719 2.353 1.00 0.67 C ATOM 488 O ARG A 185 22.769 2.941 2.293 1.00 0.76 O ATOM 489 CB ARG A 185 20.203 3.959 0.660 1.00 0.76 C ATOM 490 CG ARG A 185 19.225 4.563 1.652 1.00 0.72 C ATOM 491 CD ARG A 185 19.490 6.042 1.867 1.00 0.81 C ATOM 492 NE ARG A 185 19.511 6.781 0.608 1.00 1.27 N ATOM 493 CZ ARG A 185 18.433 7.320 0.040 1.00 1.59 C ATOM 494 NH1 ARG A 185 17.237 7.176 0.597 1.00 1.66 N ATOM 495 NH2 ARG A 185 18.551 7.993 -1.096 1.00 2.24 N ATOM 0 H ARG A 185 18.701 2.042 1.073 1.00 0.53 H new ATOM 0 HA ARG A 185 21.369 2.190 0.293 1.00 0.65 H new ATOM 0 HB2 ARG A 185 21.046 4.639 0.533 1.00 0.76 H new ATOM 0 HB3 ARG A 185 19.715 3.870 -0.311 1.00 0.76 H new ATOM 0 HG2 ARG A 185 18.206 4.424 1.290 1.00 0.72 H new ATOM 0 HG3 ARG A 185 19.300 4.037 2.604 1.00 0.72 H new ATOM 0 HD2 ARG A 185 18.721 6.457 2.519 1.00 0.81 H new ATOM 0 HD3 ARG A 185 20.444 6.169 2.378 1.00 0.81 H new ATOM 0 HE ARG A 185 20.407 6.892 0.134 1.00 1.27 H new ATOM 0 HH11 ARG A 185 17.139 6.650 1.465 1.00 1.66 H new ATOM 0 HH12 ARG A 185 16.416 7.591 0.157 1.00 1.66 H new ATOM 0 HH21 ARG A 185 19.466 8.098 -1.534 1.00 2.24 H new ATOM 0 HH22 ARG A 185 17.727 8.406 -1.532 1.00 2.24 H new ATOM 509 N ARG A 186 20.908 2.582 3.501 1.00 0.63 N ATOM 510 CA ARG A 186 21.593 2.691 4.782 1.00 0.73 C ATOM 511 C ARG A 186 22.043 1.325 5.291 1.00 0.74 C ATOM 512 O ARG A 186 22.149 1.107 6.498 1.00 0.86 O ATOM 513 CB ARG A 186 20.685 3.360 5.815 1.00 0.81 C ATOM 514 CG ARG A 186 20.547 4.861 5.625 1.00 1.80 C ATOM 515 CD ARG A 186 19.843 5.507 6.806 1.00 2.20 C ATOM 516 NE ARG A 186 20.587 5.325 8.049 1.00 2.90 N ATOM 517 CZ ARG A 186 20.152 5.735 9.237 1.00 3.61 C ATOM 518 NH1 ARG A 186 18.979 6.342 9.342 1.00 3.86 N ATOM 519 NH2 ARG A 186 20.891 5.535 10.320 1.00 4.48 N ATOM 0 H ARG A 186 19.908 2.396 3.571 1.00 0.63 H new ATOM 0 HA ARG A 186 22.480 3.306 4.632 1.00 0.73 H new ATOM 0 HB2 ARG A 186 19.696 2.904 5.766 1.00 0.81 H new ATOM 0 HB3 ARG A 186 21.078 3.163 6.813 1.00 0.81 H new ATOM 0 HG2 ARG A 186 21.534 5.306 5.500 1.00 1.80 H new ATOM 0 HG3 ARG A 186 19.988 5.064 4.711 1.00 1.80 H new ATOM 0 HD2 ARG A 186 19.713 6.572 6.613 1.00 2.20 H new ATOM 0 HD3 ARG A 186 18.846 5.079 6.913 1.00 2.20 H new ATOM 0 HE ARG A 186 21.492 4.857 8.004 1.00 2.90 H new ATOM 0 HH11 ARG A 186 18.408 6.495 8.511 1.00 3.86 H new ATOM 0 HH12 ARG A 186 18.647 6.656 10.254 1.00 3.86 H new ATOM 0 HH21 ARG A 186 21.794 5.066 10.242 1.00 4.48 H new ATOM 0 HH22 ARG A 186 20.557 5.850 11.231 1.00 4.48 H new ATOM 533 N LEU A 187 22.309 0.405 4.367 1.00 0.73 N ATOM 534 CA LEU A 187 22.758 -0.933 4.734 1.00 0.84 C ATOM 535 C LEU A 187 24.076 -0.870 5.496 1.00 1.03 C ATOM 536 O LEU A 187 24.282 -1.602 6.464 1.00 1.21 O ATOM 537 CB LEU A 187 22.914 -1.808 3.488 1.00 0.83 C ATOM 538 CG LEU A 187 21.693 -2.658 3.132 1.00 0.78 C ATOM 539 CD1 LEU A 187 21.930 -3.416 1.836 1.00 0.90 C ATOM 540 CD2 LEU A 187 21.371 -3.625 4.261 1.00 0.98 C ATOM 0 H LEU A 187 22.222 0.562 3.363 1.00 0.73 H new ATOM 0 HA LEU A 187 22.003 -1.377 5.382 1.00 0.84 H new ATOM 0 HB2 LEU A 187 23.149 -1.165 2.640 1.00 0.83 H new ATOM 0 HB3 LEU A 187 23.768 -2.470 3.633 1.00 0.83 H new ATOM 0 HG LEU A 187 20.841 -1.993 2.992 1.00 0.78 H new ATOM 0 HD11 LEU A 187 21.051 -4.015 1.599 1.00 0.90 H new ATOM 0 HD12 LEU A 187 22.115 -2.707 1.029 1.00 0.90 H new ATOM 0 HD13 LEU A 187 22.795 -4.070 1.950 1.00 0.90 H new ATOM 0 HD21 LEU A 187 20.500 -4.222 3.991 1.00 0.98 H new ATOM 0 HD22 LEU A 187 22.223 -4.283 4.431 1.00 0.98 H new ATOM 0 HD23 LEU A 187 21.159 -3.064 5.171 1.00 0.98 H new ATOM 552 N THR A 188 24.969 0.011 5.050 1.00 1.13 N ATOM 553 CA THR A 188 26.268 0.180 5.688 1.00 1.36 C ATOM 554 C THR A 188 26.933 -1.165 5.970 1.00 1.79 C ATOM 555 O THR A 188 26.708 -1.716 7.067 1.00 2.52 O ATOM 556 CB THR A 188 26.140 0.966 7.004 1.00 2.06 C ATOM 557 OG1 THR A 188 25.484 0.164 7.994 1.00 2.72 O ATOM 558 CG2 THR A 188 25.357 2.252 6.788 1.00 2.69 C ATOM 559 OXT THR A 188 27.672 -1.655 5.089 1.00 2.28 O ATOM 0 H THR A 188 24.814 0.620 4.246 1.00 1.13 H new ATOM 0 HA THR A 188 26.891 0.742 4.992 1.00 1.36 H new ATOM 0 HB THR A 188 27.142 1.220 7.350 1.00 2.06 H new ATOM 0 HG1 THR A 188 25.311 -0.729 7.629 1.00 2.72 H new ATOM 0 HG21 THR A 188 25.278 2.793 7.731 1.00 2.69 H new ATOM 0 HG22 THR A 188 25.873 2.873 6.056 1.00 2.69 H new ATOM 0 HG23 THR A 188 24.358 2.013 6.422 1.00 2.69 H new TER 567 THR A 188 ATOM 568 N GLY B 154 -26.889 -1.558 0.538 1.00 7.87 N ATOM 569 CA GLY B 154 -27.562 -2.834 0.171 1.00 7.57 C ATOM 570 C GLY B 154 -26.975 -3.462 -1.078 1.00 7.43 C ATOM 571 O GLY B 154 -27.604 -3.456 -2.136 1.00 7.85 O ATOM 0 HA2 GLY B 154 -27.479 -3.536 1.000 1.00 7.57 H new ATOM 0 HA3 GLY B 154 -28.625 -2.649 0.015 1.00 7.57 H new ATOM 577 N GLY B 155 -25.768 -4.004 -0.956 1.00 6.96 N ATOM 578 CA GLY B 155 -25.117 -4.631 -2.093 1.00 6.89 C ATOM 579 C GLY B 155 -25.085 -6.142 -1.982 1.00 6.80 C ATOM 580 O GLY B 155 -25.589 -6.711 -1.014 1.00 6.83 O ATOM 0 H GLY B 155 -25.228 -4.021 -0.091 1.00 6.96 H new ATOM 0 HA2 GLY B 155 -25.638 -4.348 -3.008 1.00 6.89 H new ATOM 0 HA3 GLY B 155 -24.098 -4.254 -2.177 1.00 6.89 H new ATOM 584 N ILE B 156 -24.490 -6.793 -2.976 1.00 6.79 N ATOM 585 CA ILE B 156 -24.397 -8.246 -2.987 1.00 6.85 C ATOM 586 C ILE B 156 -23.405 -8.738 -1.940 1.00 6.34 C ATOM 587 O ILE B 156 -23.780 -9.393 -0.968 1.00 6.39 O ATOM 588 CB ILE B 156 -23.963 -8.770 -4.369 1.00 7.07 C ATOM 589 CG1 ILE B 156 -24.906 -8.248 -5.456 1.00 7.61 C ATOM 590 CG2 ILE B 156 -23.931 -10.290 -4.373 1.00 7.32 C ATOM 591 CD1 ILE B 156 -24.528 -8.698 -6.851 1.00 7.93 C ATOM 0 H ILE B 156 -24.066 -6.337 -3.783 1.00 6.79 H new ATOM 0 HA ILE B 156 -25.391 -8.629 -2.755 1.00 6.85 H new ATOM 0 HB ILE B 156 -22.958 -8.405 -4.580 1.00 7.07 H new ATOM 0 HG12 ILE B 156 -25.920 -8.583 -5.237 1.00 7.61 H new ATOM 0 HG13 ILE B 156 -24.916 -7.158 -5.425 1.00 7.61 H new ATOM 0 HG21 ILE B 156 -23.623 -10.645 -5.356 1.00 7.32 H new ATOM 0 HG22 ILE B 156 -23.223 -10.641 -3.622 1.00 7.32 H new ATOM 0 HG23 ILE B 156 -24.924 -10.675 -4.143 1.00 7.32 H new ATOM 0 HD11 ILE B 156 -25.239 -8.291 -7.570 1.00 7.93 H new ATOM 0 HD12 ILE B 156 -23.526 -8.341 -7.090 1.00 7.93 H new ATOM 0 HD13 ILE B 156 -24.546 -9.787 -6.899 1.00 7.93 H new ATOM 603 N PHE B 157 -22.133 -8.414 -2.148 1.00 5.93 N ATOM 604 CA PHE B 157 -21.079 -8.821 -1.227 1.00 5.51 C ATOM 605 C PHE B 157 -21.064 -7.938 0.014 1.00 5.28 C ATOM 606 O PHE B 157 -21.219 -8.423 1.135 1.00 5.42 O ATOM 607 CB PHE B 157 -19.716 -8.759 -1.919 1.00 5.15 C ATOM 608 CG PHE B 157 -19.614 -9.652 -3.122 1.00 5.59 C ATOM 609 CD1 PHE B 157 -20.073 -9.227 -4.358 1.00 5.84 C ATOM 610 CD2 PHE B 157 -19.058 -10.916 -3.015 1.00 6.06 C ATOM 611 CE1 PHE B 157 -19.980 -10.047 -5.466 1.00 6.39 C ATOM 612 CE2 PHE B 157 -18.962 -11.741 -4.119 1.00 6.59 C ATOM 613 CZ PHE B 157 -19.424 -11.307 -5.347 1.00 6.69 C ATOM 0 H PHE B 157 -21.807 -7.870 -2.947 1.00 5.93 H new ATOM 0 HA PHE B 157 -21.282 -9.847 -0.920 1.00 5.51 H new ATOM 0 HB2 PHE B 157 -19.517 -7.731 -2.222 1.00 5.15 H new ATOM 0 HB3 PHE B 157 -18.941 -9.036 -1.204 1.00 5.15 H new ATOM 0 HD1 PHE B 157 -20.508 -8.244 -4.457 1.00 5.84 H new ATOM 0 HD2 PHE B 157 -18.695 -11.261 -2.058 1.00 6.06 H new ATOM 0 HE1 PHE B 157 -20.341 -9.704 -6.424 1.00 6.39 H new ATOM 0 HE2 PHE B 157 -18.526 -12.724 -4.022 1.00 6.59 H new ATOM 0 HZ PHE B 157 -19.351 -11.950 -6.211 1.00 6.69 H new ATOM 623 N SER B 158 -20.881 -6.636 -0.195 1.00 5.07 N ATOM 624 CA SER B 158 -20.835 -5.674 0.905 1.00 4.99 C ATOM 625 C SER B 158 -19.977 -6.195 2.063 1.00 4.62 C ATOM 626 O SER B 158 -18.765 -5.986 2.082 1.00 4.34 O ATOM 627 CB SER B 158 -22.251 -5.350 1.388 1.00 5.53 C ATOM 628 OG SER B 158 -22.912 -6.515 1.850 1.00 6.01 O ATOM 0 H SER B 158 -20.762 -6.221 -1.119 1.00 5.07 H new ATOM 0 HA SER B 158 -20.373 -4.759 0.534 1.00 4.99 H new ATOM 0 HB2 SER B 158 -22.205 -4.612 2.189 1.00 5.53 H new ATOM 0 HB3 SER B 158 -22.822 -4.902 0.575 1.00 5.53 H new ATOM 0 HG SER B 158 -23.814 -6.281 2.154 1.00 6.01 H new ATOM 634 N ALA B 159 -20.603 -6.874 3.024 1.00 4.76 N ATOM 635 CA ALA B 159 -19.876 -7.416 4.165 1.00 4.49 C ATOM 636 C ALA B 159 -18.819 -8.418 3.712 1.00 4.07 C ATOM 637 O ALA B 159 -17.646 -8.301 4.063 1.00 3.63 O ATOM 638 CB ALA B 159 -20.839 -8.069 5.146 1.00 4.95 C ATOM 0 H ALA B 159 -21.606 -7.060 3.033 1.00 4.76 H new ATOM 0 HA ALA B 159 -19.370 -6.592 4.667 1.00 4.49 H new ATOM 0 HB1 ALA B 159 -20.281 -8.469 5.992 1.00 4.95 H new ATOM 0 HB2 ALA B 159 -21.555 -7.328 5.501 1.00 4.95 H new ATOM 0 HB3 ALA B 159 -21.372 -8.879 4.648 1.00 4.95 H new ATOM 644 N GLU B 160 -19.249 -9.403 2.928 1.00 4.30 N ATOM 645 CA GLU B 160 -18.347 -10.432 2.424 1.00 4.07 C ATOM 646 C GLU B 160 -17.204 -9.823 1.614 1.00 3.64 C ATOM 647 O GLU B 160 -16.170 -10.460 1.411 1.00 3.34 O ATOM 648 CB GLU B 160 -19.113 -11.442 1.567 1.00 4.52 C ATOM 649 CG GLU B 160 -20.011 -12.371 2.372 1.00 4.52 C ATOM 650 CD GLU B 160 -21.137 -11.636 3.072 1.00 4.76 C ATOM 651 OE1 GLU B 160 -22.216 -11.483 2.461 1.00 5.04 O ATOM 652 OE2 GLU B 160 -20.941 -11.213 4.230 1.00 5.11 O ATOM 0 H GLU B 160 -20.218 -9.509 2.628 1.00 4.30 H new ATOM 0 HA GLU B 160 -17.918 -10.945 3.285 1.00 4.07 H new ATOM 0 HB2 GLU B 160 -19.721 -10.902 0.841 1.00 4.52 H new ATOM 0 HB3 GLU B 160 -18.399 -12.041 1.002 1.00 4.52 H new ATOM 0 HG2 GLU B 160 -20.433 -13.126 1.709 1.00 4.52 H new ATOM 0 HG3 GLU B 160 -19.410 -12.898 3.114 1.00 4.52 H new ATOM 659 N PHE B 161 -17.393 -8.590 1.154 1.00 3.68 N ATOM 660 CA PHE B 161 -16.374 -7.909 0.364 1.00 3.33 C ATOM 661 C PHE B 161 -15.303 -7.287 1.257 1.00 2.89 C ATOM 662 O PHE B 161 -14.124 -7.271 0.903 1.00 2.55 O ATOM 663 CB PHE B 161 -17.015 -6.829 -0.509 1.00 3.51 C ATOM 664 CG PHE B 161 -16.062 -6.208 -1.490 1.00 3.26 C ATOM 665 CD1 PHE B 161 -15.179 -5.221 -1.086 1.00 3.50 C ATOM 666 CD2 PHE B 161 -16.051 -6.613 -2.815 1.00 3.25 C ATOM 667 CE1 PHE B 161 -14.299 -4.649 -1.986 1.00 3.37 C ATOM 668 CE2 PHE B 161 -15.174 -6.045 -3.718 1.00 3.09 C ATOM 669 CZ PHE B 161 -14.296 -5.062 -3.304 1.00 2.95 C ATOM 0 H PHE B 161 -18.239 -8.044 1.314 1.00 3.68 H new ATOM 0 HA PHE B 161 -15.896 -8.652 -0.275 1.00 3.33 H new ATOM 0 HB2 PHE B 161 -17.853 -7.264 -1.054 1.00 3.51 H new ATOM 0 HB3 PHE B 161 -17.423 -6.048 0.133 1.00 3.51 H new ATOM 0 HD1 PHE B 161 -15.178 -4.894 -0.057 1.00 3.50 H new ATOM 0 HD2 PHE B 161 -16.735 -7.381 -3.145 1.00 3.25 H new ATOM 0 HE1 PHE B 161 -13.615 -3.880 -1.659 1.00 3.37 H new ATOM 0 HE2 PHE B 161 -15.175 -6.369 -4.748 1.00 3.09 H new ATOM 0 HZ PHE B 161 -13.609 -4.618 -4.009 1.00 2.95 H new ATOM 679 N LEU B 162 -15.717 -6.776 2.412 1.00 2.97 N ATOM 680 CA LEU B 162 -14.785 -6.149 3.346 1.00 2.68 C ATOM 681 C LEU B 162 -13.758 -7.157 3.855 1.00 2.45 C ATOM 682 O LEU B 162 -12.559 -6.882 3.875 1.00 2.10 O ATOM 683 CB LEU B 162 -15.539 -5.541 4.528 1.00 3.01 C ATOM 684 CG LEU B 162 -16.825 -4.798 4.165 1.00 3.29 C ATOM 685 CD1 LEU B 162 -17.381 -4.067 5.378 1.00 3.64 C ATOM 686 CD2 LEU B 162 -16.576 -3.829 3.020 1.00 3.06 C ATOM 0 H LEU B 162 -16.688 -6.783 2.724 1.00 2.97 H new ATOM 0 HA LEU B 162 -14.260 -5.357 2.811 1.00 2.68 H new ATOM 0 HB2 LEU B 162 -15.784 -6.337 5.231 1.00 3.01 H new ATOM 0 HB3 LEU B 162 -14.874 -4.851 5.047 1.00 3.01 H new ATOM 0 HG LEU B 162 -17.565 -5.529 3.839 1.00 3.29 H new ATOM 0 HD11 LEU B 162 -18.296 -3.544 5.100 1.00 3.64 H new ATOM 0 HD12 LEU B 162 -17.600 -4.786 6.168 1.00 3.64 H new ATOM 0 HD13 LEU B 162 -16.646 -3.346 5.737 1.00 3.64 H new ATOM 0 HD21 LEU B 162 -17.502 -3.309 2.775 1.00 3.06 H new ATOM 0 HD22 LEU B 162 -15.819 -3.102 3.316 1.00 3.06 H new ATOM 0 HD23 LEU B 162 -16.227 -4.380 2.146 1.00 3.06 H new ATOM 698 N LYS B 163 -14.240 -8.325 4.262 1.00 2.70 N ATOM 699 CA LYS B 163 -13.371 -9.378 4.776 1.00 2.58 C ATOM 700 C LYS B 163 -12.285 -9.731 3.764 1.00 2.20 C ATOM 701 O LYS B 163 -11.222 -10.235 4.130 1.00 2.01 O ATOM 702 CB LYS B 163 -14.197 -10.618 5.115 1.00 2.98 C ATOM 703 CG LYS B 163 -15.257 -10.361 6.174 1.00 3.10 C ATOM 704 CD LYS B 163 -16.503 -11.192 5.927 1.00 3.46 C ATOM 705 CE LYS B 163 -17.543 -10.971 7.013 1.00 3.83 C ATOM 706 NZ LYS B 163 -18.858 -11.571 6.654 1.00 4.17 N ATOM 0 H LYS B 163 -15.231 -8.568 4.246 1.00 2.70 H new ATOM 0 HA LYS B 163 -12.887 -9.012 5.681 1.00 2.58 H new ATOM 0 HB2 LYS B 163 -14.679 -10.984 4.209 1.00 2.98 H new ATOM 0 HB3 LYS B 163 -13.530 -11.407 5.462 1.00 2.98 H new ATOM 0 HG2 LYS B 163 -14.853 -10.594 7.159 1.00 3.10 H new ATOM 0 HG3 LYS B 163 -15.519 -9.303 6.179 1.00 3.10 H new ATOM 0 HD2 LYS B 163 -16.928 -10.934 4.957 1.00 3.46 H new ATOM 0 HD3 LYS B 163 -16.236 -12.248 5.887 1.00 3.46 H new ATOM 0 HE2 LYS B 163 -17.189 -11.405 7.948 1.00 3.83 H new ATOM 0 HE3 LYS B 163 -17.667 -9.902 7.185 1.00 3.83 H new ATOM 0 HZ1 LYS B 163 -19.557 -11.340 7.389 1.00 4.17 H new ATOM 0 HZ2 LYS B 163 -19.176 -11.189 5.741 1.00 4.17 H new ATOM 0 HZ3 LYS B 163 -18.760 -12.604 6.582 1.00 4.17 H new ATOM 720 N VAL B 164 -12.560 -9.464 2.492 1.00 2.21 N ATOM 721 CA VAL B 164 -11.605 -9.748 1.429 1.00 2.03 C ATOM 722 C VAL B 164 -11.189 -8.465 0.717 1.00 1.85 C ATOM 723 O VAL B 164 -10.892 -8.474 -0.477 1.00 2.01 O ATOM 724 CB VAL B 164 -12.190 -10.728 0.395 1.00 2.40 C ATOM 725 CG1 VAL B 164 -12.583 -12.037 1.064 1.00 2.37 C ATOM 726 CG2 VAL B 164 -13.382 -10.106 -0.315 1.00 2.98 C ATOM 0 H VAL B 164 -13.436 -9.051 2.173 1.00 2.21 H new ATOM 0 HA VAL B 164 -10.733 -10.205 1.896 1.00 2.03 H new ATOM 0 HB VAL B 164 -11.424 -10.942 -0.350 1.00 2.40 H new ATOM 0 HG11 VAL B 164 -12.994 -12.717 0.318 1.00 2.37 H new ATOM 0 HG12 VAL B 164 -11.704 -12.490 1.522 1.00 2.37 H new ATOM 0 HG13 VAL B 164 -13.333 -11.843 1.831 1.00 2.37 H new ATOM 0 HG21 VAL B 164 -13.782 -10.813 -1.042 1.00 2.98 H new ATOM 0 HG22 VAL B 164 -14.153 -9.861 0.415 1.00 2.98 H new ATOM 0 HG23 VAL B 164 -13.066 -9.198 -0.828 1.00 2.98 H new ATOM 736 N PHE B 165 -11.172 -7.363 1.461 1.00 1.65 N ATOM 737 CA PHE B 165 -10.797 -6.070 0.902 1.00 1.50 C ATOM 738 C PHE B 165 -9.876 -5.304 1.849 1.00 1.26 C ATOM 739 O PHE B 165 -8.886 -4.712 1.421 1.00 1.09 O ATOM 740 CB PHE B 165 -12.048 -5.239 0.607 1.00 1.69 C ATOM 741 CG PHE B 165 -11.749 -3.901 -0.005 1.00 1.63 C ATOM 742 CD1 PHE B 165 -11.202 -3.813 -1.275 1.00 1.70 C ATOM 743 CD2 PHE B 165 -12.016 -2.732 0.690 1.00 2.23 C ATOM 744 CE1 PHE B 165 -10.926 -2.583 -1.842 1.00 1.66 C ATOM 745 CE2 PHE B 165 -11.743 -1.499 0.128 1.00 2.32 C ATOM 746 CZ PHE B 165 -11.197 -1.425 -1.139 1.00 1.70 C ATOM 0 H PHE B 165 -11.414 -7.340 2.452 1.00 1.65 H new ATOM 0 HA PHE B 165 -10.257 -6.251 -0.027 1.00 1.50 H new ATOM 0 HB2 PHE B 165 -12.697 -5.800 -0.066 1.00 1.69 H new ATOM 0 HB3 PHE B 165 -12.602 -5.090 1.534 1.00 1.69 H new ATOM 0 HD1 PHE B 165 -10.989 -4.716 -1.828 1.00 1.70 H new ATOM 0 HD2 PHE B 165 -12.442 -2.785 1.681 1.00 2.23 H new ATOM 0 HE1 PHE B 165 -10.499 -2.527 -2.833 1.00 1.66 H new ATOM 0 HE2 PHE B 165 -11.956 -0.595 0.679 1.00 2.32 H new ATOM 0 HZ PHE B 165 -10.982 -0.463 -1.580 1.00 1.70 H new ATOM 756 N LEU B 166 -10.208 -5.320 3.136 1.00 1.37 N ATOM 757 CA LEU B 166 -9.410 -4.621 4.140 1.00 1.30 C ATOM 758 C LEU B 166 -8.008 -5.224 4.272 1.00 1.09 C ATOM 759 O LEU B 166 -7.024 -4.489 4.349 1.00 1.00 O ATOM 760 CB LEU B 166 -10.121 -4.633 5.498 1.00 1.59 C ATOM 761 CG LEU B 166 -11.480 -3.929 5.526 1.00 1.88 C ATOM 762 CD1 LEU B 166 -12.085 -3.991 6.920 1.00 2.18 C ATOM 763 CD2 LEU B 166 -11.337 -2.485 5.068 1.00 1.87 C ATOM 0 H LEU B 166 -11.022 -5.808 3.509 1.00 1.37 H new ATOM 0 HA LEU B 166 -9.299 -3.589 3.806 1.00 1.30 H new ATOM 0 HB2 LEU B 166 -10.259 -5.668 5.809 1.00 1.59 H new ATOM 0 HB3 LEU B 166 -9.470 -4.163 6.235 1.00 1.59 H new ATOM 0 HG LEU B 166 -12.151 -4.444 4.839 1.00 1.88 H new ATOM 0 HD11 LEU B 166 -13.051 -3.485 6.920 1.00 2.18 H new ATOM 0 HD12 LEU B 166 -12.221 -5.032 7.212 1.00 2.18 H new ATOM 0 HD13 LEU B 166 -11.418 -3.500 7.628 1.00 2.18 H new ATOM 0 HD21 LEU B 166 -12.311 -1.997 5.093 1.00 1.87 H new ATOM 0 HD22 LEU B 166 -10.651 -1.959 5.732 1.00 1.87 H new ATOM 0 HD23 LEU B 166 -10.946 -2.463 4.051 1.00 1.87 H new ATOM 775 N PRO B 167 -7.889 -6.566 4.301 1.00 1.11 N ATOM 776 CA PRO B 167 -6.591 -7.238 4.431 1.00 1.01 C ATOM 777 C PRO B 167 -5.704 -7.039 3.206 1.00 0.85 C ATOM 778 O PRO B 167 -4.494 -6.846 3.328 1.00 0.92 O ATOM 779 CB PRO B 167 -6.954 -8.723 4.588 1.00 1.14 C ATOM 780 CG PRO B 167 -8.418 -8.747 4.880 1.00 1.25 C ATOM 781 CD PRO B 167 -8.990 -7.534 4.207 1.00 1.36 C ATOM 0 HA PRO B 167 -6.019 -6.837 5.268 1.00 1.01 H new ATOM 0 HB2 PRO B 167 -6.726 -9.281 3.680 1.00 1.14 H new ATOM 0 HB3 PRO B 167 -6.385 -9.183 5.396 1.00 1.14 H new ATOM 0 HG2 PRO B 167 -8.878 -9.659 4.499 1.00 1.25 H new ATOM 0 HG3 PRO B 167 -8.603 -8.722 5.954 1.00 1.25 H new ATOM 0 HD2 PRO B 167 -9.264 -7.736 3.172 1.00 1.36 H new ATOM 0 HD3 PRO B 167 -9.888 -7.177 4.711 1.00 1.36 H new ATOM 789 N SER B 168 -6.313 -7.088 2.025 1.00 0.84 N ATOM 790 CA SER B 168 -5.579 -6.919 0.776 1.00 0.77 C ATOM 791 C SER B 168 -4.720 -5.658 0.808 1.00 0.60 C ATOM 792 O SER B 168 -3.573 -5.665 0.358 1.00 0.54 O ATOM 793 CB SER B 168 -6.549 -6.860 -0.404 1.00 0.90 C ATOM 794 OG SER B 168 -7.296 -8.059 -0.510 1.00 1.54 O ATOM 0 H SER B 168 -7.314 -7.244 1.907 1.00 0.84 H new ATOM 0 HA SER B 168 -4.919 -7.778 0.655 1.00 0.77 H new ATOM 0 HB2 SER B 168 -7.227 -6.015 -0.280 1.00 0.90 H new ATOM 0 HB3 SER B 168 -5.994 -6.691 -1.327 1.00 0.90 H new ATOM 0 HG SER B 168 -7.910 -7.996 -1.271 1.00 1.54 H new ATOM 800 N LEU B 169 -5.280 -4.577 1.341 1.00 0.60 N ATOM 801 CA LEU B 169 -4.563 -3.309 1.428 1.00 0.52 C ATOM 802 C LEU B 169 -3.291 -3.451 2.261 1.00 0.44 C ATOM 803 O LEU B 169 -2.221 -2.990 1.862 1.00 0.37 O ATOM 804 CB LEU B 169 -5.464 -2.231 2.033 1.00 0.63 C ATOM 805 CG LEU B 169 -6.687 -1.863 1.191 1.00 0.72 C ATOM 806 CD1 LEU B 169 -7.511 -0.792 1.887 1.00 0.86 C ATOM 807 CD2 LEU B 169 -6.256 -1.393 -0.191 1.00 0.76 C ATOM 0 H LEU B 169 -6.227 -4.553 1.719 1.00 0.60 H new ATOM 0 HA LEU B 169 -4.279 -3.014 0.418 1.00 0.52 H new ATOM 0 HB2 LEU B 169 -5.804 -2.570 3.011 1.00 0.63 H new ATOM 0 HB3 LEU B 169 -4.870 -1.332 2.196 1.00 0.63 H new ATOM 0 HG LEU B 169 -7.308 -2.751 1.076 1.00 0.72 H new ATOM 0 HD11 LEU B 169 -8.377 -0.543 1.273 1.00 0.86 H new ATOM 0 HD12 LEU B 169 -7.847 -1.163 2.855 1.00 0.86 H new ATOM 0 HD13 LEU B 169 -6.901 0.099 2.032 1.00 0.86 H new ATOM 0 HD21 LEU B 169 -7.137 -1.135 -0.779 1.00 0.76 H new ATOM 0 HD22 LEU B 169 -5.615 -0.517 -0.094 1.00 0.76 H new ATOM 0 HD23 LEU B 169 -5.707 -2.190 -0.692 1.00 0.76 H new ATOM 819 N LEU B 170 -3.415 -4.094 3.418 1.00 0.51 N ATOM 820 CA LEU B 170 -2.273 -4.289 4.305 1.00 0.52 C ATOM 821 C LEU B 170 -1.173 -5.082 3.612 1.00 0.44 C ATOM 822 O LEU B 170 -0.009 -4.680 3.613 1.00 0.40 O ATOM 823 CB LEU B 170 -2.702 -5.002 5.590 1.00 0.67 C ATOM 824 CG LEU B 170 -3.535 -4.161 6.560 1.00 0.80 C ATOM 825 CD1 LEU B 170 -4.932 -3.924 6.008 1.00 0.86 C ATOM 826 CD2 LEU B 170 -3.605 -4.837 7.922 1.00 0.93 C ATOM 0 H LEU B 170 -4.291 -4.487 3.762 1.00 0.51 H new ATOM 0 HA LEU B 170 -1.880 -3.305 4.563 1.00 0.52 H new ATOM 0 HB2 LEU B 170 -3.276 -5.889 5.319 1.00 0.67 H new ATOM 0 HB3 LEU B 170 -1.808 -5.347 6.110 1.00 0.67 H new ATOM 0 HG LEU B 170 -3.049 -3.192 6.678 1.00 0.80 H new ATOM 0 HD11 LEU B 170 -5.506 -3.324 6.715 1.00 0.86 H new ATOM 0 HD12 LEU B 170 -4.863 -3.396 5.057 1.00 0.86 H new ATOM 0 HD13 LEU B 170 -5.431 -4.881 5.856 1.00 0.86 H new ATOM 0 HD21 LEU B 170 -4.201 -4.227 8.601 1.00 0.93 H new ATOM 0 HD22 LEU B 170 -4.066 -5.819 7.817 1.00 0.93 H new ATOM 0 HD23 LEU B 170 -2.598 -4.950 8.324 1.00 0.93 H new ATOM 838 N LEU B 171 -1.546 -6.211 3.019 1.00 0.45 N ATOM 839 CA LEU B 171 -0.589 -7.059 2.322 1.00 0.45 C ATOM 840 C LEU B 171 0.183 -6.264 1.273 1.00 0.37 C ATOM 841 O LEU B 171 1.394 -6.424 1.127 1.00 0.38 O ATOM 842 CB LEU B 171 -1.307 -8.239 1.666 1.00 0.54 C ATOM 843 CG LEU B 171 -2.041 -9.163 2.637 1.00 0.65 C ATOM 844 CD1 LEU B 171 -2.704 -10.310 1.890 1.00 0.74 C ATOM 845 CD2 LEU B 171 -1.081 -9.694 3.691 1.00 0.74 C ATOM 0 H LEU B 171 -2.505 -6.559 3.008 1.00 0.45 H new ATOM 0 HA LEU B 171 0.123 -7.440 3.054 1.00 0.45 H new ATOM 0 HB2 LEU B 171 -2.024 -7.853 0.942 1.00 0.54 H new ATOM 0 HB3 LEU B 171 -0.577 -8.826 1.109 1.00 0.54 H new ATOM 0 HG LEU B 171 -2.820 -8.588 3.137 1.00 0.65 H new ATOM 0 HD11 LEU B 171 -3.221 -10.956 2.600 1.00 0.74 H new ATOM 0 HD12 LEU B 171 -3.422 -9.911 1.173 1.00 0.74 H new ATOM 0 HD13 LEU B 171 -1.945 -10.887 1.361 1.00 0.74 H new ATOM 0 HD21 LEU B 171 -1.619 -10.350 4.375 1.00 0.74 H new ATOM 0 HD22 LEU B 171 -0.281 -10.253 3.206 1.00 0.74 H new ATOM 0 HD23 LEU B 171 -0.655 -8.860 4.248 1.00 0.74 H new ATOM 857 N SER B 172 -0.527 -5.407 0.546 1.00 0.32 N ATOM 858 CA SER B 172 0.095 -4.586 -0.487 1.00 0.31 C ATOM 859 C SER B 172 1.206 -3.725 0.102 1.00 0.26 C ATOM 860 O SER B 172 2.333 -3.724 -0.394 1.00 0.30 O ATOM 861 CB SER B 172 -0.952 -3.698 -1.161 1.00 0.33 C ATOM 862 OG SER B 172 -1.980 -4.476 -1.750 1.00 0.40 O ATOM 0 H SER B 172 -1.531 -5.263 0.653 1.00 0.32 H new ATOM 0 HA SER B 172 0.531 -5.251 -1.233 1.00 0.31 H new ATOM 0 HB2 SER B 172 -1.383 -3.017 -0.427 1.00 0.33 H new ATOM 0 HB3 SER B 172 -0.475 -3.083 -1.924 1.00 0.33 H new ATOM 0 HG SER B 172 -2.525 -4.885 -1.046 1.00 0.40 H new ATOM 868 N HIS B 173 0.883 -2.995 1.165 1.00 0.22 N ATOM 869 CA HIS B 173 1.859 -2.133 1.822 1.00 0.23 C ATOM 870 C HIS B 173 3.127 -2.909 2.161 1.00 0.23 C ATOM 871 O HIS B 173 4.237 -2.453 1.892 1.00 0.25 O ATOM 872 CB HIS B 173 1.262 -1.526 3.092 1.00 0.28 C ATOM 873 CG HIS B 173 0.082 -0.642 2.832 1.00 0.28 C ATOM 874 ND1 HIS B 173 -1.135 -0.807 3.461 1.00 0.34 N ATOM 875 CD2 HIS B 173 -0.062 0.422 2.009 1.00 0.36 C ATOM 876 CE1 HIS B 173 -1.976 0.118 3.033 1.00 0.35 C ATOM 877 NE2 HIS B 173 -1.350 0.876 2.152 1.00 0.36 N ATOM 0 H HIS B 173 -0.045 -2.983 1.589 1.00 0.22 H new ATOM 0 HA HIS B 173 2.120 -1.329 1.133 1.00 0.23 H new ATOM 0 HB2 HIS B 173 0.963 -2.330 3.764 1.00 0.28 H new ATOM 0 HB3 HIS B 173 2.031 -0.950 3.607 1.00 0.28 H new ATOM 0 HD2 HIS B 173 0.695 0.837 1.360 1.00 0.36 H new ATOM 0 HE1 HIS B 173 -3.002 0.234 3.350 1.00 0.35 H new ATOM 0 HE2 HIS B 173 -1.757 1.670 1.658 1.00 0.36 H new ATOM 886 N LEU B 174 2.952 -4.084 2.755 1.00 0.24 N ATOM 887 CA LEU B 174 4.081 -4.925 3.131 1.00 0.27 C ATOM 888 C LEU B 174 4.924 -5.280 1.910 1.00 0.23 C ATOM 889 O LEU B 174 6.144 -5.116 1.917 1.00 0.24 O ATOM 890 CB LEU B 174 3.586 -6.201 3.813 1.00 0.33 C ATOM 891 CG LEU B 174 2.793 -5.979 5.103 1.00 0.40 C ATOM 892 CD1 LEU B 174 2.358 -7.310 5.695 1.00 0.48 C ATOM 893 CD2 LEU B 174 3.619 -5.190 6.107 1.00 0.47 C ATOM 0 H LEU B 174 2.039 -4.475 2.986 1.00 0.24 H new ATOM 0 HA LEU B 174 4.704 -4.366 3.830 1.00 0.27 H new ATOM 0 HB2 LEU B 174 2.961 -6.752 3.110 1.00 0.33 H new ATOM 0 HB3 LEU B 174 4.446 -6.832 4.037 1.00 0.33 H new ATOM 0 HG LEU B 174 1.900 -5.401 4.865 1.00 0.40 H new ATOM 0 HD11 LEU B 174 1.795 -7.134 6.612 1.00 0.48 H new ATOM 0 HD12 LEU B 174 1.729 -7.838 4.979 1.00 0.48 H new ATOM 0 HD13 LEU B 174 3.238 -7.913 5.919 1.00 0.48 H new ATOM 0 HD21 LEU B 174 3.039 -5.041 7.018 1.00 0.47 H new ATOM 0 HD22 LEU B 174 4.530 -5.741 6.342 1.00 0.47 H new ATOM 0 HD23 LEU B 174 3.881 -4.221 5.681 1.00 0.47 H new ATOM 905 N LEU B 175 4.266 -5.767 0.862 1.00 0.22 N ATOM 906 CA LEU B 175 4.958 -6.142 -0.367 1.00 0.23 C ATOM 907 C LEU B 175 5.710 -4.952 -0.952 1.00 0.21 C ATOM 908 O LEU B 175 6.852 -5.083 -1.390 1.00 0.23 O ATOM 909 CB LEU B 175 3.963 -6.689 -1.394 1.00 0.27 C ATOM 910 CG LEU B 175 3.319 -8.026 -1.025 1.00 0.32 C ATOM 911 CD1 LEU B 175 2.335 -8.460 -2.100 1.00 0.38 C ATOM 912 CD2 LEU B 175 4.385 -9.092 -0.816 1.00 0.38 C ATOM 0 H LEU B 175 3.256 -5.911 0.839 1.00 0.22 H new ATOM 0 HA LEU B 175 5.680 -6.921 -0.124 1.00 0.23 H new ATOM 0 HB2 LEU B 175 3.174 -5.952 -1.541 1.00 0.27 H new ATOM 0 HB3 LEU B 175 4.476 -6.802 -2.349 1.00 0.27 H new ATOM 0 HG LEU B 175 2.772 -7.898 -0.091 1.00 0.32 H new ATOM 0 HD11 LEU B 175 1.887 -9.413 -1.820 1.00 0.38 H new ATOM 0 HD12 LEU B 175 1.553 -7.708 -2.203 1.00 0.38 H new ATOM 0 HD13 LEU B 175 2.859 -8.571 -3.049 1.00 0.38 H new ATOM 0 HD21 LEU B 175 3.908 -10.037 -0.554 1.00 0.38 H new ATOM 0 HD22 LEU B 175 4.959 -9.217 -1.734 1.00 0.38 H new ATOM 0 HD23 LEU B 175 5.052 -8.786 -0.010 1.00 0.38 H new ATOM 924 N ALA B 176 5.064 -3.789 -0.955 1.00 0.21 N ATOM 925 CA ALA B 176 5.678 -2.580 -1.490 1.00 0.23 C ATOM 926 C ALA B 176 7.033 -2.323 -0.840 1.00 0.22 C ATOM 927 O ALA B 176 8.042 -2.144 -1.527 1.00 0.24 O ATOM 928 CB ALA B 176 4.757 -1.386 -1.287 1.00 0.26 C ATOM 0 H ALA B 176 4.119 -3.660 -0.594 1.00 0.21 H new ATOM 0 HA ALA B 176 5.837 -2.723 -2.559 1.00 0.23 H new ATOM 0 HB1 ALA B 176 5.228 -0.490 -1.691 1.00 0.26 H new ATOM 0 HB2 ALA B 176 3.813 -1.563 -1.802 1.00 0.26 H new ATOM 0 HB3 ALA B 176 4.569 -1.248 -0.222 1.00 0.26 H new ATOM 934 N ILE B 177 7.053 -2.308 0.489 1.00 0.20 N ATOM 935 CA ILE B 177 8.287 -2.078 1.228 1.00 0.21 C ATOM 936 C ILE B 177 9.346 -3.097 0.830 1.00 0.21 C ATOM 937 O ILE B 177 10.506 -2.751 0.612 1.00 0.22 O ATOM 938 CB ILE B 177 8.059 -2.152 2.750 1.00 0.22 C ATOM 939 CG1 ILE B 177 6.951 -1.183 3.167 1.00 0.24 C ATOM 940 CG2 ILE B 177 9.350 -1.840 3.493 1.00 0.25 C ATOM 941 CD1 ILE B 177 6.721 -1.135 4.664 1.00 0.29 C ATOM 0 H ILE B 177 6.230 -2.452 1.074 1.00 0.20 H new ATOM 0 HA ILE B 177 8.631 -1.075 0.977 1.00 0.21 H new ATOM 0 HB ILE B 177 7.748 -3.164 3.009 1.00 0.22 H new ATOM 0 HG12 ILE B 177 7.202 -0.183 2.814 1.00 0.24 H new ATOM 0 HG13 ILE B 177 6.023 -1.471 2.674 1.00 0.24 H new ATOM 0 HG21 ILE B 177 9.174 -1.896 4.567 1.00 0.25 H new ATOM 0 HG22 ILE B 177 10.115 -2.564 3.212 1.00 0.25 H new ATOM 0 HG23 ILE B 177 9.687 -0.837 3.232 1.00 0.25 H new ATOM 0 HD11 ILE B 177 5.922 -0.428 4.887 1.00 0.29 H new ATOM 0 HD12 ILE B 177 6.439 -2.126 5.021 1.00 0.29 H new ATOM 0 HD13 ILE B 177 7.637 -0.817 5.163 1.00 0.29 H new ATOM 953 N GLY B 178 8.936 -4.358 0.735 1.00 0.21 N ATOM 954 CA GLY B 178 9.860 -5.407 0.353 1.00 0.23 C ATOM 955 C GLY B 178 10.564 -5.094 -0.951 1.00 0.23 C ATOM 956 O GLY B 178 11.780 -5.246 -1.061 1.00 0.26 O ATOM 0 H GLY B 178 7.982 -4.670 0.916 1.00 0.21 H new ATOM 0 HA2 GLY B 178 10.600 -5.543 1.141 1.00 0.23 H new ATOM 0 HA3 GLY B 178 9.320 -6.349 0.257 1.00 0.23 H new ATOM 960 N LEU B 179 9.796 -4.655 -1.943 1.00 0.21 N ATOM 961 CA LEU B 179 10.356 -4.309 -3.243 1.00 0.23 C ATOM 962 C LEU B 179 11.449 -3.261 -3.081 1.00 0.24 C ATOM 963 O LEU B 179 12.538 -3.389 -3.639 1.00 0.28 O ATOM 964 CB LEU B 179 9.264 -3.780 -4.176 1.00 0.25 C ATOM 965 CG LEU B 179 8.077 -4.721 -4.386 1.00 0.27 C ATOM 966 CD1 LEU B 179 7.065 -4.099 -5.336 1.00 0.34 C ATOM 967 CD2 LEU B 179 8.550 -6.066 -4.915 1.00 0.33 C ATOM 0 H LEU B 179 8.786 -4.531 -1.871 1.00 0.21 H new ATOM 0 HA LEU B 179 10.786 -5.209 -3.683 1.00 0.23 H new ATOM 0 HB2 LEU B 179 8.893 -2.836 -3.777 1.00 0.25 H new ATOM 0 HB3 LEU B 179 9.711 -3.562 -5.146 1.00 0.25 H new ATOM 0 HG LEU B 179 7.591 -4.882 -3.424 1.00 0.27 H new ATOM 0 HD11 LEU B 179 6.227 -4.783 -5.474 1.00 0.34 H new ATOM 0 HD12 LEU B 179 6.702 -3.160 -4.917 1.00 0.34 H new ATOM 0 HD13 LEU B 179 7.539 -3.908 -6.299 1.00 0.34 H new ATOM 0 HD21 LEU B 179 7.692 -6.723 -5.058 1.00 0.33 H new ATOM 0 HD22 LEU B 179 9.061 -5.923 -5.867 1.00 0.33 H new ATOM 0 HD23 LEU B 179 9.237 -6.517 -4.199 1.00 0.33 H new ATOM 979 N GLY B 180 11.145 -2.222 -2.310 1.00 0.23 N ATOM 980 CA GLY B 180 12.110 -1.164 -2.079 1.00 0.27 C ATOM 981 C GLY B 180 13.420 -1.689 -1.526 1.00 0.29 C ATOM 982 O GLY B 180 14.494 -1.313 -1.996 1.00 0.34 O ATOM 0 H GLY B 180 10.248 -2.094 -1.841 1.00 0.23 H new ATOM 0 HA2 GLY B 180 12.299 -0.637 -3.014 1.00 0.27 H new ATOM 0 HA3 GLY B 180 11.690 -0.438 -1.383 1.00 0.27 H new ATOM 986 N ILE B 181 13.333 -2.563 -0.529 1.00 0.27 N ATOM 987 CA ILE B 181 14.524 -3.139 0.086 1.00 0.32 C ATOM 988 C ILE B 181 15.364 -3.881 -0.948 1.00 0.37 C ATOM 989 O ILE B 181 16.580 -3.701 -1.022 1.00 0.44 O ATOM 990 CB ILE B 181 14.157 -4.109 1.226 1.00 0.34 C ATOM 991 CG1 ILE B 181 13.305 -3.397 2.277 1.00 0.32 C ATOM 992 CG2 ILE B 181 15.416 -4.685 1.859 1.00 0.42 C ATOM 993 CD1 ILE B 181 12.854 -4.302 3.403 1.00 0.67 C ATOM 0 H ILE B 181 12.452 -2.888 -0.130 1.00 0.27 H new ATOM 0 HA ILE B 181 15.102 -2.312 0.499 1.00 0.32 H new ATOM 0 HB ILE B 181 13.575 -4.931 0.809 1.00 0.34 H new ATOM 0 HG12 ILE B 181 13.876 -2.568 2.695 1.00 0.32 H new ATOM 0 HG13 ILE B 181 12.428 -2.968 1.792 1.00 0.32 H new ATOM 0 HG21 ILE B 181 15.140 -5.368 2.662 1.00 0.42 H new ATOM 0 HG22 ILE B 181 15.988 -5.225 1.105 1.00 0.42 H new ATOM 0 HG23 ILE B 181 16.023 -3.875 2.264 1.00 0.42 H new ATOM 0 HD11 ILE B 181 12.254 -3.730 4.111 1.00 0.67 H new ATOM 0 HD12 ILE B 181 12.256 -5.118 2.997 1.00 0.67 H new ATOM 0 HD13 ILE B 181 13.726 -4.711 3.913 1.00 0.67 H new ATOM 1005 N TYR B 182 14.706 -4.716 -1.745 1.00 0.36 N ATOM 1006 CA TYR B 182 15.388 -5.486 -2.780 1.00 0.42 C ATOM 1007 C TYR B 182 16.222 -4.572 -3.672 1.00 0.45 C ATOM 1008 O TYR B 182 17.390 -4.848 -3.944 1.00 0.51 O ATOM 1009 CB TYR B 182 14.366 -6.251 -3.623 1.00 0.46 C ATOM 1010 CG TYR B 182 14.976 -7.010 -4.779 1.00 0.58 C ATOM 1011 CD1 TYR B 182 15.242 -6.376 -5.987 1.00 1.48 C ATOM 1012 CD2 TYR B 182 15.284 -8.360 -4.664 1.00 1.20 C ATOM 1013 CE1 TYR B 182 15.798 -7.067 -7.047 1.00 1.56 C ATOM 1014 CE2 TYR B 182 15.840 -9.056 -5.721 1.00 1.25 C ATOM 1015 CZ TYR B 182 16.094 -8.406 -6.910 1.00 0.83 C ATOM 1016 OH TYR B 182 16.648 -9.097 -7.964 1.00 0.97 O ATOM 0 H TYR B 182 13.700 -4.877 -1.694 1.00 0.36 H new ATOM 0 HA TYR B 182 16.056 -6.198 -2.296 1.00 0.42 H new ATOM 0 HB2 TYR B 182 13.831 -6.952 -2.982 1.00 0.46 H new ATOM 0 HB3 TYR B 182 13.629 -5.548 -4.011 1.00 0.46 H new ATOM 0 HD1 TYR B 182 15.011 -5.327 -6.099 1.00 1.48 H new ATOM 0 HD2 TYR B 182 15.086 -8.873 -3.735 1.00 1.20 H new ATOM 0 HE1 TYR B 182 16.000 -6.560 -7.979 1.00 1.56 H new ATOM 0 HE2 TYR B 182 16.075 -10.105 -5.616 1.00 1.25 H new ATOM 0 HH TYR B 182 16.796 -10.030 -7.702 1.00 0.97 H new ATOM 1026 N ILE B 183 15.611 -3.482 -4.122 1.00 0.44 N ATOM 1027 CA ILE B 183 16.289 -2.518 -4.981 1.00 0.50 C ATOM 1028 C ILE B 183 17.525 -1.946 -4.293 1.00 0.52 C ATOM 1029 O ILE B 183 18.572 -1.768 -4.915 1.00 0.59 O ATOM 1030 CB ILE B 183 15.344 -1.361 -5.365 1.00 0.55 C ATOM 1031 CG1 ILE B 183 14.094 -1.908 -6.057 1.00 0.59 C ATOM 1032 CG2 ILE B 183 16.058 -0.360 -6.260 1.00 0.64 C ATOM 1033 CD1 ILE B 183 13.051 -0.851 -6.350 1.00 0.83 C ATOM 0 H ILE B 183 14.643 -3.243 -3.905 1.00 0.44 H new ATOM 0 HA ILE B 183 16.594 -3.047 -5.884 1.00 0.50 H new ATOM 0 HB ILE B 183 15.039 -0.844 -4.455 1.00 0.55 H new ATOM 0 HG12 ILE B 183 14.387 -2.387 -6.992 1.00 0.59 H new ATOM 0 HG13 ILE B 183 13.650 -2.680 -5.429 1.00 0.59 H new ATOM 0 HG21 ILE B 183 15.374 0.448 -6.520 1.00 0.64 H new ATOM 0 HG22 ILE B 183 16.920 0.049 -5.733 1.00 0.64 H new ATOM 0 HG23 ILE B 183 16.392 -0.859 -7.170 1.00 0.64 H new ATOM 0 HD11 ILE B 183 12.194 -1.312 -6.841 1.00 0.83 H new ATOM 0 HD12 ILE B 183 12.730 -0.389 -5.417 1.00 0.83 H new ATOM 0 HD13 ILE B 183 13.478 -0.090 -7.004 1.00 0.83 H new ATOM 1045 N GLY B 184 17.389 -1.646 -3.007 1.00 0.50 N ATOM 1046 CA GLY B 184 18.498 -1.095 -2.252 1.00 0.57 C ATOM 1047 C GLY B 184 19.679 -2.044 -2.162 1.00 0.62 C ATOM 1048 O GLY B 184 20.816 -1.653 -2.423 1.00 0.69 O ATOM 0 H GLY B 184 16.529 -1.775 -2.473 1.00 0.50 H new ATOM 0 HA2 GLY B 184 18.821 -0.164 -2.717 1.00 0.57 H new ATOM 0 HA3 GLY B 184 18.159 -0.848 -1.246 1.00 0.57 H new ATOM 1052 N ARG B 185 19.411 -3.291 -1.790 1.00 0.62 N ATOM 1053 CA ARG B 185 20.461 -4.294 -1.653 1.00 0.72 C ATOM 1054 C ARG B 185 21.165 -4.569 -2.982 1.00 0.79 C ATOM 1055 O ARG B 185 22.383 -4.742 -3.020 1.00 0.88 O ATOM 1056 CB ARG B 185 19.883 -5.596 -1.092 1.00 0.77 C ATOM 1057 CG ARG B 185 18.795 -6.204 -1.953 1.00 0.72 C ATOM 1058 CD ARG B 185 18.573 -7.671 -1.615 1.00 1.02 C ATOM 1059 NE ARG B 185 18.297 -7.871 -0.196 1.00 1.43 N ATOM 1060 CZ ARG B 185 18.045 -9.058 0.345 1.00 2.03 C ATOM 1061 NH1 ARG B 185 18.038 -10.146 -0.414 1.00 2.27 N ATOM 1062 NH2 ARG B 185 17.801 -9.158 1.644 1.00 2.56 N ATOM 0 H ARG B 185 18.473 -3.632 -1.578 1.00 0.62 H new ATOM 0 HA ARG B 185 21.201 -3.896 -0.959 1.00 0.72 H new ATOM 0 HB2 ARG B 185 20.689 -6.320 -0.977 1.00 0.77 H new ATOM 0 HB3 ARG B 185 19.481 -5.405 -0.097 1.00 0.77 H new ATOM 0 HG2 ARG B 185 17.866 -5.652 -1.811 1.00 0.72 H new ATOM 0 HG3 ARG B 185 19.065 -6.108 -3.005 1.00 0.72 H new ATOM 0 HD2 ARG B 185 17.741 -8.056 -2.204 1.00 1.02 H new ATOM 0 HD3 ARG B 185 19.456 -8.245 -1.897 1.00 1.02 H new ATOM 0 HE ARG B 185 18.298 -7.054 0.415 1.00 1.43 H new ATOM 0 HH11 ARG B 185 18.226 -10.072 -1.414 1.00 2.27 H new ATOM 0 HH12 ARG B 185 17.844 -11.057 0.002 1.00 2.27 H new ATOM 0 HH21 ARG B 185 17.807 -8.323 2.230 1.00 2.56 H new ATOM 0 HH22 ARG B 185 17.608 -10.070 2.058 1.00 2.56 H new ATOM 1076 N ARG B 186 20.399 -4.607 -4.068 1.00 0.79 N ATOM 1077 CA ARG B 186 20.964 -4.877 -5.387 1.00 0.88 C ATOM 1078 C ARG B 186 21.839 -3.723 -5.868 1.00 0.95 C ATOM 1079 O ARG B 186 22.760 -3.921 -6.661 1.00 1.08 O ATOM 1080 CB ARG B 186 19.852 -5.144 -6.403 1.00 0.90 C ATOM 1081 CG ARG B 186 19.045 -3.912 -6.763 1.00 1.29 C ATOM 1082 CD ARG B 186 18.203 -4.149 -8.006 1.00 1.64 C ATOM 1083 NE ARG B 186 17.561 -2.924 -8.474 1.00 2.30 N ATOM 1084 CZ ARG B 186 17.083 -2.769 -9.703 1.00 2.97 C ATOM 1085 NH1 ARG B 186 17.185 -3.754 -10.585 1.00 3.23 N ATOM 1086 NH2 ARG B 186 16.503 -1.629 -10.052 1.00 3.82 N ATOM 0 H ARG B 186 19.390 -4.455 -4.062 1.00 0.79 H new ATOM 0 HA ARG B 186 21.590 -5.765 -5.299 1.00 0.88 H new ATOM 0 HB2 ARG B 186 20.293 -5.556 -7.311 1.00 0.90 H new ATOM 0 HB3 ARG B 186 19.180 -5.903 -6.002 1.00 0.90 H new ATOM 0 HG2 ARG B 186 18.398 -3.642 -5.929 1.00 1.29 H new ATOM 0 HG3 ARG B 186 19.717 -3.070 -6.931 1.00 1.29 H new ATOM 0 HD2 ARG B 186 18.833 -4.554 -8.798 1.00 1.64 H new ATOM 0 HD3 ARG B 186 17.441 -4.898 -7.790 1.00 1.64 H new ATOM 0 HE ARG B 186 17.475 -2.145 -7.821 1.00 2.30 H new ATOM 0 HH11 ARG B 186 17.631 -4.632 -10.320 1.00 3.23 H new ATOM 0 HH12 ARG B 186 16.817 -3.634 -11.529 1.00 3.23 H new ATOM 0 HH21 ARG B 186 16.423 -0.869 -9.376 1.00 3.82 H new ATOM 0 HH22 ARG B 186 16.136 -1.512 -10.997 1.00 3.82 H new ATOM 1100 N LEU B 187 21.549 -2.519 -5.387 1.00 0.93 N ATOM 1101 CA LEU B 187 22.313 -1.340 -5.780 1.00 1.07 C ATOM 1102 C LEU B 187 23.368 -0.993 -4.734 1.00 1.13 C ATOM 1103 O LEU B 187 24.416 -0.436 -5.056 1.00 1.37 O ATOM 1104 CB LEU B 187 21.381 -0.147 -5.994 1.00 1.20 C ATOM 1105 CG LEU B 187 20.366 -0.316 -7.125 1.00 1.42 C ATOM 1106 CD1 LEU B 187 19.560 0.960 -7.313 1.00 1.72 C ATOM 1107 CD2 LEU B 187 21.072 -0.700 -8.418 1.00 1.60 C ATOM 0 H LEU B 187 20.794 -2.334 -4.727 1.00 0.93 H new ATOM 0 HA LEU B 187 22.821 -1.569 -6.717 1.00 1.07 H new ATOM 0 HB2 LEU B 187 20.841 0.044 -5.067 1.00 1.20 H new ATOM 0 HB3 LEU B 187 21.986 0.736 -6.198 1.00 1.20 H new ATOM 0 HG LEU B 187 19.679 -1.118 -6.857 1.00 1.42 H new ATOM 0 HD11 LEU B 187 18.843 0.821 -8.122 1.00 1.72 H new ATOM 0 HD12 LEU B 187 19.027 1.193 -6.391 1.00 1.72 H new ATOM 0 HD13 LEU B 187 20.232 1.782 -7.561 1.00 1.72 H new ATOM 0 HD21 LEU B 187 20.336 -0.817 -9.214 1.00 1.60 H new ATOM 0 HD22 LEU B 187 21.781 0.081 -8.691 1.00 1.60 H new ATOM 0 HD23 LEU B 187 21.605 -1.640 -8.276 1.00 1.60 H new ATOM 1119 N THR B 188 23.081 -1.325 -3.481 1.00 1.14 N ATOM 1120 CA THR B 188 24.004 -1.046 -2.390 1.00 1.37 C ATOM 1121 C THR B 188 24.835 -2.275 -2.041 1.00 1.56 C ATOM 1122 O THR B 188 25.931 -2.431 -2.619 1.00 1.97 O ATOM 1123 CB THR B 188 23.260 -0.570 -1.133 1.00 1.53 C ATOM 1124 OG1 THR B 188 22.480 0.593 -1.433 1.00 2.17 O ATOM 1125 CG2 THR B 188 24.239 -0.257 -0.012 1.00 1.63 C ATOM 1126 OXT THR B 188 24.383 -3.072 -1.191 1.00 2.16 O ATOM 0 H THR B 188 22.217 -1.787 -3.196 1.00 1.14 H new ATOM 0 HA THR B 188 24.666 -0.251 -2.734 1.00 1.37 H new ATOM 0 HB THR B 188 22.599 -1.372 -0.804 1.00 1.53 H new ATOM 0 HG1 THR B 188 21.637 0.322 -1.854 1.00 2.17 H new ATOM 0 HG21 THR B 188 23.690 0.078 0.868 1.00 1.63 H new ATOM 0 HG22 THR B 188 24.808 -1.153 0.235 1.00 1.63 H new ATOM 0 HG23 THR B 188 24.922 0.529 -0.334 1.00 1.63 H new TER 1134 THR B 188