USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 775 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 HIS : no HE2:sc= 1.02 K(o=1,f=-3!) USER MOD Set 1.2: A 119 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 53 HIS : no HD1:sc= -0.0661 X(o=0.012,f=-0.39) USER MOD Set 2.2: A 94 SER OG : rot 180:sc= 0.0782 USER MOD Set 3.1: A 28 HIS : no HD1:sc= 1.09 K(o=2.4,f=-4.6!) USER MOD Set 3.2: A 40 SER OG : rot -130:sc= 1.28 USER MOD Set 4.1: A 22 TYR OH : rot -70:sc= 1.04 USER MOD Set 4.2: A 102 HIS : no HE2:sc= -0.303 K(o=2,f=2.5) USER MOD Set 4.3: A 105 SER OG : rot 167:sc= 1.25 USER MOD Single : A 21 LYS NZ :NH3+ 169:sc= 1.2 (180deg=1.09) USER MOD Single : A 29 SER OG : rot -67:sc= 0.982 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -154:sc= 1.79 (180deg=1.29) USER MOD Single : A 47 TYR OH : rot 7:sc= 1.3 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 85:sc= 1.29 USER MOD Single : A 64 MET CE :methyl -170:sc= -0.0984 (180deg=-0.172) USER MOD Single : A 65 GLN : amide:sc= 0.828 K(o=0.83,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 1.15 K(o=1.2,f=-0.37) USER MOD Single : A 69 CYS SG : rot 7:sc= -0.0847 USER MOD Single : A 71 CYS SG : rot 160:sc= -0.109 USER MOD Single : A 73 CYS SG : rot 166:sc= 1.75 USER MOD Single : A 80 SER OG : rot 74:sc= 0.0878 USER MOD Single : A 91 TYR OH : rot 180:sc= 0.0384 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot -90:sc= 0.636 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 15:sc= 0.0715 USER MOD Single : A 108 LYS NZ :NH3+ 147:sc= 1.11 (180deg=0.402) USER MOD Single : A 110 LYS NZ :NH3+ 167:sc= 1.25 (180deg=1.14) USER MOD Single : A 112 LYS NZ :NH3+ 166:sc= 1.21 (180deg=1.02) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 5.677 -4.514 2.890 1.00 10.00 N ATOM 47 CA ALA A 4 5.481 -3.351 3.751 1.00 10.00 C ATOM 48 C ALA A 4 6.786 -3.080 4.509 1.00 10.00 C ATOM 49 O ALA A 4 7.747 -3.842 4.386 1.00 10.00 O ATOM 50 CB ALA A 4 4.323 -3.628 4.720 1.00 10.00 C ATOM 0 HA ALA A 4 5.227 -2.470 3.161 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.173 -2.762 5.365 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.412 -3.820 4.153 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.560 -4.499 5.331 1.00 10.00 H new ATOM 56 N ASP A 5 6.815 -2.016 5.312 1.00 10.00 N ATOM 57 CA ASP A 5 7.959 -1.627 6.136 1.00 10.00 C ATOM 58 C ASP A 5 7.429 -0.895 7.370 1.00 10.00 C ATOM 59 O ASP A 5 6.341 -0.312 7.324 1.00 10.00 O ATOM 60 CB ASP A 5 8.899 -0.712 5.337 1.00 10.00 C ATOM 61 CG ASP A 5 10.129 -0.308 6.165 1.00 10.00 C ATOM 62 OD1 ASP A 5 11.088 -1.101 6.222 1.00 10.00 O ATOM 63 OD2 ASP A 5 10.071 0.766 6.805 1.00 10.00 O ATOM 0 H ASP A 5 6.021 -1.383 5.410 1.00 10.00 H new ATOM 0 HA ASP A 5 8.523 -2.509 6.438 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.222 -1.223 4.430 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.360 0.182 5.025 1.00 10.00 H new ATOM 68 N LEU A 6 8.172 -0.919 8.483 1.00 10.00 N ATOM 69 CA LEU A 6 7.777 -0.290 9.739 1.00 10.00 C ATOM 70 C LEU A 6 7.562 1.220 9.611 1.00 10.00 C ATOM 71 O LEU A 6 6.883 1.790 10.470 1.00 10.00 O ATOM 72 CB LEU A 6 8.827 -0.566 10.830 1.00 10.00 C ATOM 73 CG LEU A 6 8.987 -2.039 11.246 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.083 -2.143 12.307 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.689 -2.642 11.805 1.00 10.00 C ATOM 0 H LEU A 6 9.078 -1.385 8.532 1.00 10.00 H new ATOM 0 HA LEU A 6 6.820 -0.733 10.016 1.00 10.00 H new ATOM 0 HB2 LEU A 6 9.792 -0.200 10.480 1.00 10.00 H new ATOM 0 HB3 LEU A 6 8.567 0.016 11.714 1.00 10.00 H new ATOM 0 HG LEU A 6 9.250 -2.603 10.351 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.202 -3.184 12.607 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.023 -1.774 11.897 1.00 10.00 H new ATOM 0 HD13 LEU A 6 9.807 -1.545 13.175 1.00 10.00 H new ATOM 0 HD21 LEU A 6 7.861 -3.682 12.082 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.376 -2.079 12.684 1.00 10.00 H new ATOM 0 HD23 LEU A 6 6.908 -2.593 11.046 1.00 10.00 H new ATOM 87 N ALA A 7 8.113 1.880 8.591 1.00 10.00 N ATOM 88 CA ALA A 7 7.845 3.289 8.318 1.00 10.00 C ATOM 89 C ALA A 7 6.356 3.560 8.049 1.00 10.00 C ATOM 90 O ALA A 7 5.905 4.685 8.238 1.00 10.00 O ATOM 91 CB ALA A 7 8.686 3.754 7.126 1.00 10.00 C ATOM 0 H ALA A 7 8.759 1.449 7.930 1.00 10.00 H new ATOM 0 HA ALA A 7 8.119 3.853 9.209 1.00 10.00 H new ATOM 0 HB1 ALA A 7 8.483 4.806 6.926 1.00 10.00 H new ATOM 0 HB2 ALA A 7 9.744 3.626 7.355 1.00 10.00 H new ATOM 0 HB3 ALA A 7 8.431 3.162 6.247 1.00 10.00 H new ATOM 97 N LEU A 8 5.593 2.547 7.618 1.00 10.00 N ATOM 98 CA LEU A 8 4.163 2.676 7.331 1.00 10.00 C ATOM 99 C LEU A 8 3.317 2.665 8.613 1.00 10.00 C ATOM 100 O LEU A 8 2.112 2.897 8.545 1.00 10.00 O ATOM 101 CB LEU A 8 3.703 1.552 6.381 1.00 10.00 C ATOM 102 CG LEU A 8 4.441 1.489 5.027 1.00 10.00 C ATOM 103 CD1 LEU A 8 3.859 0.354 4.177 1.00 10.00 C ATOM 104 CD2 LEU A 8 4.350 2.800 4.235 1.00 10.00 C ATOM 0 H LEU A 8 5.957 1.608 7.458 1.00 10.00 H new ATOM 0 HA LEU A 8 4.014 3.641 6.846 1.00 10.00 H new ATOM 0 HB2 LEU A 8 3.828 0.596 6.889 1.00 10.00 H new ATOM 0 HB3 LEU A 8 2.637 1.674 6.190 1.00 10.00 H new ATOM 0 HG LEU A 8 5.493 1.311 5.249 1.00 10.00 H new ATOM 0 HD11 LEU A 8 4.381 0.311 3.221 1.00 10.00 H new ATOM 0 HD12 LEU A 8 3.983 -0.594 4.701 1.00 10.00 H new ATOM 0 HD13 LEU A 8 2.799 0.537 4.003 1.00 10.00 H new ATOM 0 HD21 LEU A 8 4.888 2.694 3.293 1.00 10.00 H new ATOM 0 HD22 LEU A 8 3.304 3.031 4.032 1.00 10.00 H new ATOM 0 HD23 LEU A 8 4.793 3.608 4.817 1.00 10.00 H new ATOM 116 N ILE A 9 3.919 2.387 9.776 1.00 10.00 N ATOM 117 CA ILE A 9 3.231 2.255 11.054 1.00 10.00 C ATOM 118 C ILE A 9 3.665 3.459 11.899 1.00 10.00 C ATOM 119 O ILE A 9 4.873 3.652 12.077 1.00 10.00 O ATOM 120 CB ILE A 9 3.615 0.892 11.681 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.030 -0.261 10.830 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.148 0.786 13.146 1.00 10.00 C ATOM 123 CD1 ILE A 9 3.604 -1.638 11.177 1.00 10.00 C ATOM 0 H ILE A 9 4.926 2.245 9.850 1.00 10.00 H new ATOM 0 HA ILE A 9 2.144 2.260 10.968 1.00 10.00 H new ATOM 0 HB ILE A 9 4.702 0.814 11.686 1.00 10.00 H new ATOM 0 HG12 ILE A 9 1.948 -0.285 10.962 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.218 -0.054 9.776 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.436 -0.184 13.550 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.613 1.577 13.734 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.064 0.890 13.191 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.146 -2.394 10.539 1.00 10.00 H new ATOM 0 HD12 ILE A 9 4.682 -1.633 11.018 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.393 -1.868 12.221 1.00 10.00 H new ATOM 135 N PRO A 10 2.742 4.262 12.460 1.00 10.00 N ATOM 136 CA PRO A 10 3.112 5.378 13.318 1.00 10.00 C ATOM 137 C PRO A 10 3.672 4.856 14.643 1.00 10.00 C ATOM 138 O PRO A 10 3.316 3.766 15.100 1.00 10.00 O ATOM 139 CB PRO A 10 1.828 6.190 13.507 1.00 10.00 C ATOM 140 CG PRO A 10 0.716 5.154 13.351 1.00 10.00 C ATOM 141 CD PRO A 10 1.293 4.166 12.336 1.00 10.00 C ATOM 0 HA PRO A 10 3.896 6.001 12.887 1.00 10.00 H new ATOM 0 HB2 PRO A 10 1.796 6.666 14.487 1.00 10.00 H new ATOM 0 HB3 PRO A 10 1.743 6.983 12.764 1.00 10.00 H new ATOM 0 HG2 PRO A 10 0.484 4.667 14.298 1.00 10.00 H new ATOM 0 HG3 PRO A 10 -0.208 5.607 12.991 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.950 3.152 12.541 1.00 10.00 H new ATOM 0 HD3 PRO A 10 0.971 4.413 11.324 1.00 10.00 H new ATOM 149 N ASP A 11 4.523 5.640 15.295 1.00 10.00 N ATOM 150 CA ASP A 11 5.132 5.337 16.592 1.00 10.00 C ATOM 151 C ASP A 11 4.205 5.656 17.767 1.00 10.00 C ATOM 152 O ASP A 11 4.227 4.952 18.777 1.00 10.00 O ATOM 153 CB ASP A 11 6.453 6.102 16.748 1.00 10.00 C ATOM 154 CG ASP A 11 6.305 7.630 16.724 1.00 10.00 C ATOM 155 OD1 ASP A 11 5.620 8.143 15.803 1.00 10.00 O ATOM 156 OD2 ASP A 11 6.900 8.301 17.587 1.00 10.00 O ATOM 0 H ASP A 11 4.822 6.541 14.922 1.00 10.00 H new ATOM 0 HA ASP A 11 5.321 4.264 16.611 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.920 5.809 17.688 1.00 10.00 H new ATOM 0 HB3 ASP A 11 7.130 5.802 15.948 1.00 10.00 H new ATOM 161 N VAL A 12 3.300 6.614 17.597 1.00 10.00 N ATOM 162 CA VAL A 12 2.259 6.965 18.562 1.00 10.00 C ATOM 163 C VAL A 12 0.951 7.125 17.788 1.00 10.00 C ATOM 164 O VAL A 12 0.934 7.785 16.749 1.00 10.00 O ATOM 165 CB VAL A 12 2.630 8.264 19.311 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.601 8.620 20.398 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.996 8.174 19.992 1.00 10.00 C ATOM 0 H VAL A 12 3.268 7.189 16.755 1.00 10.00 H new ATOM 0 HA VAL A 12 2.153 6.185 19.316 1.00 10.00 H new ATOM 0 HB VAL A 12 2.648 9.035 18.541 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.903 9.540 20.898 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.622 8.761 19.940 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.548 7.812 21.127 1.00 10.00 H new ATOM 0 HG21 VAL A 12 4.210 9.112 20.504 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.989 7.359 20.716 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.765 7.987 19.242 1.00 10.00 H new ATOM 177 N ASP A 13 -0.126 6.533 18.299 1.00 10.00 N ATOM 178 CA ASP A 13 -1.485 6.763 17.815 1.00 10.00 C ATOM 179 C ASP A 13 -2.411 6.592 19.010 1.00 10.00 C ATOM 180 O ASP A 13 -2.581 5.478 19.513 1.00 10.00 O ATOM 181 CB ASP A 13 -1.875 5.814 16.673 1.00 10.00 C ATOM 182 CG ASP A 13 -3.340 6.013 16.240 1.00 10.00 C ATOM 183 OD1 ASP A 13 -3.855 7.140 16.376 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.941 5.015 15.777 1.00 10.00 O ATOM 0 H ASP A 13 -0.078 5.870 19.073 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.561 7.766 17.394 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.218 5.982 15.820 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -1.727 4.782 16.991 1.00 10.00 H new ATOM 189 N ILE A 14 -2.886 7.716 19.542 1.00 10.00 N ATOM 190 CA ILE A 14 -3.610 7.808 20.806 1.00 10.00 C ATOM 191 C ILE A 14 -4.864 8.684 20.635 1.00 10.00 C ATOM 192 O ILE A 14 -5.214 9.459 21.524 1.00 10.00 O ATOM 193 CB ILE A 14 -2.658 8.262 21.943 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.001 9.638 21.670 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.606 7.171 22.235 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.230 10.199 22.871 1.00 10.00 C ATOM 0 H ILE A 14 -2.772 8.622 19.087 1.00 10.00 H new ATOM 0 HA ILE A 14 -3.973 6.825 21.106 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.268 8.400 22.836 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.321 9.545 20.823 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -2.774 10.350 21.381 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -0.946 7.506 23.035 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.109 6.253 22.540 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.019 6.982 21.336 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.797 11.164 22.607 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -1.910 10.325 23.713 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.434 9.508 23.147 1.00 10.00 H new ATOM 250 N VAL A 19 -9.776 10.237 29.893 1.00 10.00 N ATOM 251 CA VAL A 19 -9.137 8.967 30.232 1.00 10.00 C ATOM 252 C VAL A 19 -9.321 7.986 29.062 1.00 10.00 C ATOM 253 O VAL A 19 -10.426 7.854 28.540 1.00 10.00 O ATOM 254 CB VAL A 19 -9.736 8.402 31.541 1.00 10.00 C ATOM 255 CG1 VAL A 19 -9.062 7.081 31.953 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.602 9.381 32.723 1.00 10.00 C ATOM 0 HA VAL A 19 -8.070 9.119 30.397 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.791 8.237 31.323 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -9.511 6.716 32.877 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -9.201 6.341 31.165 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.996 7.249 32.109 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -10.038 8.935 33.616 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.548 9.594 32.901 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -10.125 10.308 32.488 1.00 10.00 H new ATOM 266 N PHE A 20 -8.274 7.232 28.713 1.00 10.00 N ATOM 267 CA PHE A 20 -8.350 6.097 27.794 1.00 10.00 C ATOM 268 C PHE A 20 -7.254 5.082 28.132 1.00 10.00 C ATOM 269 O PHE A 20 -6.226 5.430 28.721 1.00 10.00 O ATOM 270 CB PHE A 20 -8.279 6.551 26.324 1.00 10.00 C ATOM 271 CG PHE A 20 -7.079 7.390 25.927 1.00 10.00 C ATOM 272 CD1 PHE A 20 -5.912 6.774 25.440 1.00 10.00 C ATOM 273 CD2 PHE A 20 -7.146 8.793 25.997 1.00 10.00 C ATOM 274 CE1 PHE A 20 -4.817 7.555 25.036 1.00 10.00 C ATOM 275 CE2 PHE A 20 -6.049 9.577 25.601 1.00 10.00 C ATOM 276 CZ PHE A 20 -4.882 8.957 25.122 1.00 10.00 C ATOM 0 H PHE A 20 -7.333 7.398 29.069 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.318 5.611 27.919 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -8.297 5.663 25.692 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -9.181 7.120 26.100 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -5.858 5.697 25.377 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -8.045 9.270 26.357 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -3.924 7.078 24.659 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -6.102 10.654 25.665 1.00 10.00 H new ATOM 0 HZ PHE A 20 -4.036 9.557 24.820 1.00 10.00 H new ATOM 286 N LYS A 21 -7.505 3.805 27.819 1.00 10.00 N ATOM 287 CA LYS A 21 -6.542 2.717 28.008 1.00 10.00 C ATOM 288 C LYS A 21 -5.461 2.816 26.936 1.00 10.00 C ATOM 289 O LYS A 21 -5.747 3.276 25.830 1.00 10.00 O ATOM 290 CB LYS A 21 -7.249 1.354 27.913 1.00 10.00 C ATOM 291 CG LYS A 21 -8.336 1.146 28.980 1.00 10.00 C ATOM 292 CD LYS A 21 -8.961 -0.253 28.849 1.00 10.00 C ATOM 293 CE LYS A 21 -10.170 -0.453 29.778 1.00 10.00 C ATOM 294 NZ LYS A 21 -11.353 0.347 29.372 1.00 10.00 N ATOM 0 H LYS A 21 -8.393 3.496 27.423 1.00 10.00 H new ATOM 0 HA LYS A 21 -6.090 2.804 28.996 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.699 1.256 26.925 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.506 0.562 28.005 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.905 1.266 29.974 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -9.109 1.907 28.873 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.271 -0.412 27.816 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.206 -1.006 29.075 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -10.440 -1.509 29.792 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -9.888 -0.183 30.796 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -12.185 0.036 29.913 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -11.173 1.354 29.561 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -11.531 0.212 28.356 1.00 10.00 H new ATOM 308 N TYR A 22 -4.254 2.334 27.225 1.00 10.00 N ATOM 309 CA TYR A 22 -3.189 2.239 26.233 1.00 10.00 C ATOM 310 C TYR A 22 -2.319 1.010 26.504 1.00 10.00 C ATOM 311 O TYR A 22 -2.302 0.474 27.615 1.00 10.00 O ATOM 312 CB TYR A 22 -2.380 3.552 26.171 1.00 10.00 C ATOM 313 CG TYR A 22 -1.007 3.502 26.807 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.861 3.700 28.188 1.00 10.00 C ATOM 315 CD2 TYR A 22 0.124 3.235 26.013 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.408 3.625 28.780 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.401 3.172 26.595 1.00 10.00 C ATOM 318 CZ TYR A 22 1.549 3.383 27.981 1.00 10.00 C ATOM 319 OH TYR A 22 2.791 3.391 28.533 1.00 10.00 O ATOM 0 H TYR A 22 -3.989 2.000 28.151 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.628 2.103 25.244 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.267 3.840 25.126 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -2.958 4.338 26.657 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.728 3.911 28.797 1.00 10.00 H new ATOM 0 HD2 TYR A 22 0.010 3.078 24.951 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.514 3.752 29.847 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.266 2.963 25.983 1.00 10.00 H new ATOM 0 HH TYR A 22 3.031 4.307 28.785 1.00 10.00 H new ATOM 329 N VAL A 23 -1.586 0.577 25.482 1.00 10.00 N ATOM 330 CA VAL A 23 -0.664 -0.546 25.531 1.00 10.00 C ATOM 331 C VAL A 23 0.623 -0.084 24.842 1.00 10.00 C ATOM 332 O VAL A 23 0.586 0.640 23.840 1.00 10.00 O ATOM 333 CB VAL A 23 -1.295 -1.791 24.862 1.00 10.00 C ATOM 334 CG1 VAL A 23 -0.489 -3.074 25.125 1.00 10.00 C ATOM 335 CG2 VAL A 23 -2.725 -2.073 25.348 1.00 10.00 C ATOM 0 H VAL A 23 -1.622 1.018 24.563 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.439 -0.847 26.554 1.00 10.00 H new ATOM 0 HB VAL A 23 -1.296 -1.545 23.800 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -0.975 -3.916 24.633 1.00 10.00 H new ATOM 0 HG12 VAL A 23 0.520 -2.957 24.730 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -0.440 -3.259 26.198 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -3.113 -2.957 24.843 1.00 10.00 H new ATOM 0 HG22 VAL A 23 -2.716 -2.244 26.424 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -3.361 -1.217 25.122 1.00 10.00 H new ATOM 345 N LEU A 24 1.764 -0.506 25.389 1.00 10.00 N ATOM 346 CA LEU A 24 3.075 -0.354 24.772 1.00 10.00 C ATOM 347 C LEU A 24 3.360 -1.697 24.113 1.00 10.00 C ATOM 348 O LEU A 24 3.332 -2.731 24.788 1.00 10.00 O ATOM 349 CB LEU A 24 4.124 -0.008 25.845 1.00 10.00 C ATOM 350 CG LEU A 24 5.575 0.051 25.318 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.774 1.104 24.221 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.518 0.360 26.483 1.00 10.00 C ATOM 0 H LEU A 24 1.799 -0.974 26.295 1.00 10.00 H new ATOM 0 HA LEU A 24 3.108 0.455 24.042 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.871 0.956 26.287 1.00 10.00 H new ATOM 0 HB3 LEU A 24 4.069 -0.749 26.643 1.00 10.00 H new ATOM 0 HG LEU A 24 5.796 -0.920 24.876 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.813 1.096 23.893 1.00 10.00 H new ATOM 0 HD12 LEU A 24 5.125 0.876 23.376 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.525 2.090 24.614 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.544 0.403 26.119 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.249 1.320 26.924 1.00 10.00 H new ATOM 0 HD23 LEU A 24 6.433 -0.423 27.237 1.00 10.00 H new ATOM 364 N ILE A 25 3.577 -1.700 22.804 1.00 10.00 N ATOM 365 CA ILE A 25 3.624 -2.920 22.015 1.00 10.00 C ATOM 366 C ILE A 25 4.914 -2.862 21.199 1.00 10.00 C ATOM 367 O ILE A 25 5.250 -1.810 20.651 1.00 10.00 O ATOM 368 CB ILE A 25 2.348 -3.012 21.139 1.00 10.00 C ATOM 369 CG1 ILE A 25 1.042 -2.968 21.974 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.368 -4.296 20.296 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.222 -2.690 21.152 1.00 10.00 C ATOM 0 H ILE A 25 3.726 -0.851 22.259 1.00 10.00 H new ATOM 0 HA ILE A 25 3.636 -3.821 22.628 1.00 10.00 H new ATOM 0 HB ILE A 25 2.355 -2.136 20.490 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.923 -3.920 22.491 1.00 10.00 H new ATOM 0 HG13 ILE A 25 1.140 -2.199 22.740 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.465 -4.345 19.687 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.244 -4.292 19.647 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.409 -5.163 20.955 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.089 -2.676 21.812 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.128 -1.724 20.656 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.348 -3.472 20.403 1.00 10.00 H new ATOM 383 N ARG A 26 5.651 -3.966 21.141 1.00 10.00 N ATOM 384 CA ARG A 26 6.753 -4.121 20.210 1.00 10.00 C ATOM 385 C ARG A 26 6.148 -4.709 18.947 1.00 10.00 C ATOM 386 O ARG A 26 5.303 -5.594 19.033 1.00 10.00 O ATOM 387 CB ARG A 26 7.834 -5.018 20.827 1.00 10.00 C ATOM 388 CG ARG A 26 9.003 -5.271 19.860 1.00 10.00 C ATOM 389 CD ARG A 26 10.191 -5.923 20.575 1.00 10.00 C ATOM 390 NE ARG A 26 10.872 -4.951 21.444 1.00 10.00 N ATOM 391 CZ ARG A 26 11.383 -5.142 22.660 1.00 10.00 C ATOM 392 NH1 ARG A 26 11.345 -6.335 23.262 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.939 -4.101 23.259 1.00 10.00 N ATOM 0 H ARG A 26 5.498 -4.777 21.740 1.00 10.00 H new ATOM 0 HA ARG A 26 7.247 -3.178 19.978 1.00 10.00 H new ATOM 0 HB2 ARG A 26 8.212 -4.554 21.738 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.391 -5.971 21.116 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.670 -5.914 19.045 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.318 -4.328 19.414 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.845 -6.769 21.169 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.893 -6.316 19.840 1.00 10.00 H new ATOM 0 HE ARG A 26 10.965 -4.008 21.067 1.00 10.00 H new ATOM 0 HH11 ARG A 26 10.916 -7.131 22.790 1.00 10.00 H new ATOM 0 HH12 ARG A 26 11.745 -6.449 24.193 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.964 -3.196 22.789 1.00 10.00 H new ATOM 0 HH22 ARG A 26 12.342 -4.204 24.190 1.00 10.00 H new ATOM 407 N VAL A 27 6.573 -4.232 17.788 1.00 10.00 N ATOM 408 CA VAL A 27 6.100 -4.681 16.493 1.00 10.00 C ATOM 409 C VAL A 27 7.327 -5.156 15.721 1.00 10.00 C ATOM 410 O VAL A 27 8.408 -4.573 15.856 1.00 10.00 O ATOM 411 CB VAL A 27 5.275 -3.560 15.818 1.00 10.00 C ATOM 412 CG1 VAL A 27 6.030 -2.227 15.676 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.761 -3.984 14.437 1.00 10.00 C ATOM 0 H VAL A 27 7.279 -3.499 17.723 1.00 10.00 H new ATOM 0 HA VAL A 27 5.407 -5.520 16.550 1.00 10.00 H new ATOM 0 HB VAL A 27 4.437 -3.396 16.495 1.00 10.00 H new ATOM 0 HG11 VAL A 27 5.385 -1.493 15.194 1.00 10.00 H new ATOM 0 HG12 VAL A 27 6.318 -1.865 16.663 1.00 10.00 H new ATOM 0 HG13 VAL A 27 6.924 -2.378 15.070 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.187 -3.169 13.997 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.606 -4.222 13.792 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.124 -4.863 14.540 1.00 10.00 H new ATOM 423 N HIS A 28 7.153 -6.203 14.923 1.00 10.00 N ATOM 424 CA HIS A 28 8.195 -6.919 14.209 1.00 10.00 C ATOM 425 C HIS A 28 7.755 -6.996 12.754 1.00 10.00 C ATOM 426 O HIS A 28 6.604 -7.345 12.485 1.00 10.00 O ATOM 427 CB HIS A 28 8.321 -8.344 14.770 1.00 10.00 C ATOM 428 CG HIS A 28 8.518 -8.437 16.262 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.698 -8.234 16.937 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.581 -8.816 17.189 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.488 -8.508 18.232 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.211 -8.851 18.442 1.00 10.00 N ATOM 0 H HIS A 28 6.227 -6.594 14.749 1.00 10.00 H new ATOM 0 HA HIS A 28 9.156 -6.415 14.312 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.423 -8.902 14.504 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.160 -8.837 14.278 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.545 -9.046 16.990 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.245 -8.459 19.001 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.781 -9.090 19.336 1.00 10.00 H new ATOM 440 N SER A 29 8.638 -6.657 11.820 1.00 10.00 N ATOM 441 CA SER A 29 8.337 -6.756 10.397 1.00 10.00 C ATOM 442 C SER A 29 8.449 -8.212 9.922 1.00 10.00 C ATOM 443 O SER A 29 9.358 -8.937 10.329 1.00 10.00 O ATOM 444 CB SER A 29 9.231 -5.799 9.596 1.00 10.00 C ATOM 445 OG SER A 29 10.608 -5.947 9.875 1.00 10.00 O ATOM 0 H SER A 29 9.574 -6.309 12.026 1.00 10.00 H new ATOM 0 HA SER A 29 7.306 -6.449 10.223 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.064 -5.964 8.532 1.00 10.00 H new ATOM 0 HB3 SER A 29 8.934 -4.772 9.810 1.00 10.00 H new ATOM 0 HG SER A 29 10.788 -5.663 10.796 1.00 10.00 H new ATOM 451 N ALA A 30 7.525 -8.627 9.053 1.00 10.00 N ATOM 452 CA ALA A 30 7.553 -9.879 8.305 1.00 10.00 C ATOM 453 C ALA A 30 6.687 -9.677 7.047 1.00 10.00 C ATOM 454 O ALA A 30 5.608 -10.257 6.934 1.00 10.00 O ATOM 455 CB ALA A 30 7.063 -11.045 9.168 1.00 10.00 C ATOM 0 H ALA A 30 6.697 -8.069 8.844 1.00 10.00 H new ATOM 0 HA ALA A 30 8.571 -10.136 8.012 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.094 -11.966 8.586 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.706 -11.146 10.042 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.040 -10.854 9.491 1.00 10.00 H new ATOM 461 N PRO A 31 7.122 -8.799 6.121 1.00 10.00 N ATOM 462 CA PRO A 31 6.301 -8.334 5.006 1.00 10.00 C ATOM 463 C PRO A 31 5.904 -9.458 4.040 1.00 10.00 C ATOM 464 O PRO A 31 4.879 -9.360 3.375 1.00 10.00 O ATOM 465 CB PRO A 31 7.117 -7.221 4.348 1.00 10.00 C ATOM 466 CG PRO A 31 8.563 -7.533 4.717 1.00 10.00 C ATOM 467 CD PRO A 31 8.433 -8.173 6.097 1.00 10.00 C ATOM 0 HA PRO A 31 5.335 -7.961 5.348 1.00 10.00 H new ATOM 0 HB2 PRO A 31 6.977 -7.213 3.267 1.00 10.00 H new ATOM 0 HB3 PRO A 31 6.817 -6.240 4.716 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.026 -8.211 4.000 1.00 10.00 H new ATOM 0 HG3 PRO A 31 9.176 -6.632 4.746 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.220 -8.908 6.263 1.00 10.00 H new ATOM 0 HD3 PRO A 31 8.524 -7.425 6.885 1.00 10.00 H new ATOM 475 N ARG A 32 6.707 -10.525 3.958 1.00 10.00 N ATOM 476 CA ARG A 32 6.391 -11.781 3.287 1.00 10.00 C ATOM 477 C ARG A 32 7.204 -12.876 3.974 1.00 10.00 C ATOM 478 O ARG A 32 8.151 -12.568 4.705 1.00 10.00 O ATOM 479 CB ARG A 32 6.677 -11.714 1.770 1.00 10.00 C ATOM 480 CG ARG A 32 8.143 -11.438 1.391 1.00 10.00 C ATOM 481 CD ARG A 32 8.379 -11.766 -0.089 1.00 10.00 C ATOM 482 NE ARG A 32 9.746 -11.431 -0.528 1.00 10.00 N ATOM 483 CZ ARG A 32 10.857 -12.148 -0.306 1.00 10.00 C ATOM 484 NH1 ARG A 32 10.839 -13.253 0.432 1.00 10.00 N ATOM 485 NH2 ARG A 32 12.013 -11.731 -0.818 1.00 10.00 N ATOM 0 H ARG A 32 7.636 -10.532 4.378 1.00 10.00 H new ATOM 0 HA ARG A 32 5.325 -11.995 3.369 1.00 10.00 H new ATOM 0 HB2 ARG A 32 6.373 -12.658 1.317 1.00 10.00 H new ATOM 0 HB3 ARG A 32 6.053 -10.935 1.333 1.00 10.00 H new ATOM 0 HG2 ARG A 32 8.385 -10.393 1.582 1.00 10.00 H new ATOM 0 HG3 ARG A 32 8.806 -12.038 2.014 1.00 10.00 H new ATOM 0 HD2 ARG A 32 8.196 -12.827 -0.257 1.00 10.00 H new ATOM 0 HD3 ARG A 32 7.660 -11.219 -0.699 1.00 10.00 H new ATOM 0 HE ARG A 32 9.858 -10.565 -1.055 1.00 10.00 H new ATOM 0 HH11 ARG A 32 9.964 -13.575 0.846 1.00 10.00 H new ATOM 0 HH12 ARG A 32 11.700 -13.779 0.584 1.00 10.00 H new ATOM 0 HH21 ARG A 32 12.046 -10.875 -1.372 1.00 10.00 H new ATOM 0 HH22 ARG A 32 12.865 -12.267 -0.656 1.00 10.00 H new ATOM 499 N SER A 33 6.888 -14.139 3.695 1.00 10.00 N ATOM 500 CA SER A 33 7.719 -15.255 4.114 1.00 10.00 C ATOM 501 C SER A 33 9.123 -15.076 3.521 1.00 10.00 C ATOM 502 O SER A 33 9.265 -14.694 2.352 1.00 10.00 O ATOM 503 CB SER A 33 7.077 -16.569 3.650 1.00 10.00 C ATOM 504 OG SER A 33 5.711 -16.626 4.025 1.00 10.00 O ATOM 0 H SER A 33 6.054 -14.412 3.176 1.00 10.00 H new ATOM 0 HA SER A 33 7.803 -15.286 5.200 1.00 10.00 H new ATOM 0 HB2 SER A 33 7.165 -16.659 2.567 1.00 10.00 H new ATOM 0 HB3 SER A 33 7.613 -17.413 4.084 1.00 10.00 H new ATOM 0 HG SER A 33 5.322 -17.471 3.717 1.00 10.00 H new ATOM 510 N GLY A 34 10.157 -15.346 4.323 1.00 10.00 N ATOM 511 CA GLY A 34 11.556 -15.261 3.911 1.00 10.00 C ATOM 512 C GLY A 34 11.970 -13.876 3.404 1.00 10.00 C ATOM 513 O GLY A 34 12.822 -13.786 2.518 1.00 10.00 O ATOM 0 H GLY A 34 10.040 -15.635 5.294 1.00 10.00 H new ATOM 0 HA2 GLY A 34 12.190 -15.533 4.755 1.00 10.00 H new ATOM 0 HA3 GLY A 34 11.739 -15.994 3.126 1.00 10.00 H new ATOM 517 N ALA A 35 11.315 -12.802 3.867 1.00 10.00 N ATOM 518 CA ALA A 35 11.678 -11.439 3.492 1.00 10.00 C ATOM 519 C ALA A 35 13.105 -11.102 3.962 1.00 10.00 C ATOM 520 O ALA A 35 13.512 -11.566 5.025 1.00 10.00 O ATOM 521 CB ALA A 35 10.690 -10.445 4.108 1.00 10.00 C ATOM 0 H ALA A 35 10.524 -12.859 4.508 1.00 10.00 H new ATOM 0 HA ALA A 35 11.641 -11.365 2.405 1.00 10.00 H new ATOM 0 HB1 ALA A 35 10.969 -9.431 3.823 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.684 -10.660 3.747 1.00 10.00 H new ATOM 0 HB3 ALA A 35 10.712 -10.536 5.194 1.00 10.00 H new ATOM 527 N PRO A 36 13.836 -10.225 3.247 1.00 10.00 N ATOM 528 CA PRO A 36 15.145 -9.719 3.664 1.00 10.00 C ATOM 529 C PRO A 36 15.020 -8.614 4.734 1.00 10.00 C ATOM 530 O PRO A 36 15.765 -7.634 4.720 1.00 10.00 O ATOM 531 CB PRO A 36 15.793 -9.246 2.355 1.00 10.00 C ATOM 532 CG PRO A 36 14.601 -8.699 1.573 1.00 10.00 C ATOM 533 CD PRO A 36 13.483 -9.673 1.945 1.00 10.00 C ATOM 0 HA PRO A 36 15.759 -10.472 4.157 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.549 -8.480 2.530 1.00 10.00 H new ATOM 0 HB3 PRO A 36 16.284 -10.064 1.827 1.00 10.00 H new ATOM 0 HG2 PRO A 36 14.361 -7.676 1.863 1.00 10.00 H new ATOM 0 HG3 PRO A 36 14.790 -8.690 0.500 1.00 10.00 H new ATOM 0 HD2 PRO A 36 12.521 -9.162 1.987 1.00 10.00 H new ATOM 0 HD3 PRO A 36 13.392 -10.463 1.200 1.00 10.00 H new ATOM 541 N ALA A 37 14.039 -8.736 5.629 1.00 10.00 N ATOM 542 CA ALA A 37 13.688 -7.753 6.639 1.00 10.00 C ATOM 543 C ALA A 37 13.099 -8.484 7.843 1.00 10.00 C ATOM 544 O ALA A 37 12.234 -9.346 7.679 1.00 10.00 O ATOM 545 CB ALA A 37 12.660 -6.777 6.053 1.00 10.00 C ATOM 0 H ALA A 37 13.444 -9.563 5.666 1.00 10.00 H new ATOM 0 HA ALA A 37 14.569 -7.192 6.951 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.392 -6.036 6.806 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.088 -6.275 5.186 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.768 -7.326 5.750 1.00 10.00 H new ATOM 551 N ALA A 38 13.573 -8.126 9.038 1.00 10.00 N ATOM 552 CA ALA A 38 13.111 -8.640 10.327 1.00 10.00 C ATOM 553 C ALA A 38 13.344 -7.578 11.419 1.00 10.00 C ATOM 554 O ALA A 38 13.592 -7.902 12.582 1.00 10.00 O ATOM 555 CB ALA A 38 13.841 -9.956 10.642 1.00 10.00 C ATOM 0 H ALA A 38 14.322 -7.440 9.137 1.00 10.00 H new ATOM 0 HA ALA A 38 12.042 -8.850 10.290 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.498 -10.341 11.602 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.628 -10.686 9.861 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.915 -9.775 10.686 1.00 10.00 H new ATOM 561 N GLU A 39 13.328 -6.299 11.031 1.00 10.00 N ATOM 562 CA GLU A 39 13.489 -5.170 11.940 1.00 10.00 C ATOM 563 C GLU A 39 12.274 -5.097 12.868 1.00 10.00 C ATOM 564 O GLU A 39 11.188 -5.571 12.514 1.00 10.00 O ATOM 565 CB GLU A 39 13.627 -3.861 11.140 1.00 10.00 C ATOM 566 CG GLU A 39 14.842 -3.827 10.195 1.00 10.00 C ATOM 567 CD GLU A 39 16.190 -4.008 10.925 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.591 -3.088 11.667 1.00 10.00 O ATOM 569 OE2 GLU A 39 16.818 -5.073 10.748 1.00 10.00 O ATOM 0 H GLU A 39 13.200 -6.019 10.059 1.00 10.00 H new ATOM 0 HA GLU A 39 14.392 -5.307 12.535 1.00 10.00 H new ATOM 0 HB2 GLU A 39 12.720 -3.708 10.554 1.00 10.00 H new ATOM 0 HB3 GLU A 39 13.700 -3.027 11.838 1.00 10.00 H new ATOM 0 HG2 GLU A 39 14.734 -4.613 9.447 1.00 10.00 H new ATOM 0 HG3 GLU A 39 14.851 -2.877 9.661 1.00 10.00 H new ATOM 576 N SER A 40 12.432 -4.464 14.032 1.00 10.00 N ATOM 577 CA SER A 40 11.383 -4.290 15.032 1.00 10.00 C ATOM 578 C SER A 40 11.498 -2.899 15.671 1.00 10.00 C ATOM 579 O SER A 40 12.561 -2.286 15.621 1.00 10.00 O ATOM 580 CB SER A 40 11.509 -5.371 16.115 1.00 10.00 C ATOM 581 OG SER A 40 11.661 -6.677 15.576 1.00 10.00 O ATOM 0 H SER A 40 13.320 -4.047 14.311 1.00 10.00 H new ATOM 0 HA SER A 40 10.411 -4.382 14.547 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.365 -5.144 16.751 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.624 -5.346 16.751 1.00 10.00 H new ATOM 0 HG SER A 40 11.015 -7.282 15.997 1.00 10.00 H new ATOM 587 N LYS A 41 10.416 -2.405 16.282 1.00 10.00 N ATOM 588 CA LYS A 41 10.394 -1.154 17.050 1.00 10.00 C ATOM 589 C LYS A 41 9.309 -1.225 18.125 1.00 10.00 C ATOM 590 O LYS A 41 8.528 -2.173 18.132 1.00 10.00 O ATOM 591 CB LYS A 41 10.227 0.067 16.117 1.00 10.00 C ATOM 592 CG LYS A 41 8.825 0.246 15.507 1.00 10.00 C ATOM 593 CD LYS A 41 8.803 1.442 14.541 1.00 10.00 C ATOM 594 CE LYS A 41 7.376 1.747 14.061 1.00 10.00 C ATOM 595 NZ LYS A 41 7.345 2.841 13.060 1.00 10.00 N ATOM 0 H LYS A 41 9.510 -2.874 16.256 1.00 10.00 H new ATOM 0 HA LYS A 41 11.351 -1.024 17.555 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.479 0.968 16.677 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.950 -0.016 15.305 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.535 -0.661 14.977 1.00 10.00 H new ATOM 0 HG3 LYS A 41 8.094 0.400 16.301 1.00 10.00 H new ATOM 0 HD2 LYS A 41 9.217 2.320 15.037 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.440 1.230 13.682 1.00 10.00 H new ATOM 0 HE2 LYS A 41 6.940 0.847 13.627 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.757 2.021 14.916 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.417 3.309 13.086 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 8.089 3.534 13.280 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.507 2.448 12.111 1.00 10.00 H new ATOM 609 N GLU A 42 9.196 -0.204 18.974 1.00 10.00 N ATOM 610 CA GLU A 42 8.138 -0.094 19.974 1.00 10.00 C ATOM 611 C GLU A 42 7.173 1.003 19.539 1.00 10.00 C ATOM 612 O GLU A 42 7.604 2.032 18.996 1.00 10.00 O ATOM 613 CB GLU A 42 8.707 0.238 21.364 1.00 10.00 C ATOM 614 CG GLU A 42 9.550 -0.883 21.993 1.00 10.00 C ATOM 615 CD GLU A 42 10.965 -1.051 21.406 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.636 -0.036 21.126 1.00 10.00 O ATOM 617 OE2 GLU A 42 11.393 -2.224 21.277 1.00 10.00 O ATOM 0 H GLU A 42 9.847 0.581 18.985 1.00 10.00 H new ATOM 0 HA GLU A 42 7.624 -1.052 20.048 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.320 1.136 21.287 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.880 0.473 22.034 1.00 10.00 H new ATOM 0 HG2 GLU A 42 9.638 -0.692 23.063 1.00 10.00 H new ATOM 0 HG3 GLU A 42 9.014 -1.825 21.881 1.00 10.00 H new ATOM 624 N ILE A 43 5.884 0.819 19.821 1.00 10.00 N ATOM 625 CA ILE A 43 4.793 1.705 19.441 1.00 10.00 C ATOM 626 C ILE A 43 3.827 1.870 20.623 1.00 10.00 C ATOM 627 O ILE A 43 3.641 0.952 21.422 1.00 10.00 O ATOM 628 CB ILE A 43 4.070 1.166 18.179 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.495 -0.259 18.355 1.00 10.00 C ATOM 630 CG2 ILE A 43 5.009 1.218 16.960 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.540 -0.713 17.246 1.00 10.00 C ATOM 0 H ILE A 43 5.560 0.007 20.347 1.00 10.00 H new ATOM 0 HA ILE A 43 5.193 2.687 19.190 1.00 10.00 H new ATOM 0 HB ILE A 43 3.215 1.822 18.014 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.324 -0.965 18.412 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.970 -0.307 19.309 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.487 0.836 16.082 1.00 10.00 H new ATOM 0 HG22 ILE A 43 5.316 2.249 16.781 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.890 0.606 17.153 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.190 -1.723 17.458 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.687 -0.036 17.200 1.00 10.00 H new ATOM 0 HD13 ILE A 43 3.062 -0.703 16.289 1.00 10.00 H new ATOM 643 N VAL A 44 3.200 3.041 20.711 1.00 10.00 N ATOM 644 CA VAL A 44 2.224 3.392 21.738 1.00 10.00 C ATOM 645 C VAL A 44 0.866 3.413 21.038 1.00 10.00 C ATOM 646 O VAL A 44 0.703 4.150 20.056 1.00 10.00 O ATOM 647 CB VAL A 44 2.592 4.770 22.339 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.655 5.202 23.475 1.00 10.00 C ATOM 649 CG2 VAL A 44 4.024 4.805 22.902 1.00 10.00 C ATOM 0 H VAL A 44 3.364 3.797 20.046 1.00 10.00 H new ATOM 0 HA VAL A 44 2.205 2.682 22.565 1.00 10.00 H new ATOM 0 HB VAL A 44 2.496 5.457 21.498 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.967 6.176 23.853 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.634 5.268 23.099 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.698 4.469 24.281 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.230 5.794 23.311 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.123 4.059 23.690 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.734 4.587 22.104 1.00 10.00 H new ATOM 659 N ARG A 45 -0.099 2.617 21.506 1.00 10.00 N ATOM 660 CA ARG A 45 -1.453 2.548 20.957 1.00 10.00 C ATOM 661 C ARG A 45 -2.404 2.747 22.123 1.00 10.00 C ATOM 662 O ARG A 45 -2.175 2.146 23.171 1.00 10.00 O ATOM 663 CB ARG A 45 -1.698 1.156 20.343 1.00 10.00 C ATOM 664 CG ARG A 45 -0.789 0.752 19.170 1.00 10.00 C ATOM 665 CD ARG A 45 -1.067 1.516 17.872 1.00 10.00 C ATOM 666 NE ARG A 45 -0.236 2.719 17.814 1.00 10.00 N ATOM 667 CZ ARG A 45 0.758 2.956 16.964 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.909 2.291 15.818 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.648 3.868 17.301 1.00 10.00 N ATOM 0 H ARG A 45 0.044 1.988 22.296 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.599 3.301 20.183 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.588 0.412 21.132 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.733 1.110 20.004 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.250 0.912 19.458 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.907 -0.315 18.983 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.859 0.878 17.013 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.121 1.789 17.819 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.440 3.450 18.495 1.00 10.00 H new ATOM 0 HH11 ARG A 45 0.244 1.562 15.560 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.690 2.511 15.200 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.559 4.364 18.188 1.00 10.00 H new ATOM 0 HH22 ARG A 45 2.425 4.078 16.675 1.00 10.00 H new ATOM 683 N GLY A 46 -3.468 3.527 21.981 1.00 10.00 N ATOM 684 CA GLY A 46 -4.456 3.638 23.043 1.00 10.00 C ATOM 685 C GLY A 46 -5.713 4.323 22.564 1.00 10.00 C ATOM 686 O GLY A 46 -5.631 5.362 21.920 1.00 10.00 O ATOM 0 H GLY A 46 -3.667 4.085 21.151 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.702 2.644 23.417 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.032 4.196 23.878 1.00 10.00 H new ATOM 690 N TYR A 47 -6.871 3.749 22.898 1.00 10.00 N ATOM 691 CA TYR A 47 -8.154 4.225 22.400 1.00 10.00 C ATOM 692 C TYR A 47 -9.250 4.043 23.449 1.00 10.00 C ATOM 693 O TYR A 47 -9.313 3.016 24.132 1.00 10.00 O ATOM 694 CB TYR A 47 -8.528 3.462 21.126 1.00 10.00 C ATOM 695 CG TYR A 47 -7.426 3.334 20.087 1.00 10.00 C ATOM 696 CD1 TYR A 47 -7.179 4.380 19.178 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.640 2.164 20.042 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.153 4.256 18.222 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.623 2.030 19.083 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.371 3.080 18.170 1.00 10.00 C ATOM 701 OH TYR A 47 -4.393 2.917 17.238 1.00 10.00 O ATOM 0 H TYR A 47 -6.941 2.944 23.520 1.00 10.00 H new ATOM 0 HA TYR A 47 -8.063 5.288 22.179 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.855 2.461 21.407 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.381 3.959 20.664 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.777 5.279 19.214 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.821 1.367 20.748 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -5.963 5.061 17.527 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -5.034 1.126 19.043 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.273 3.753 16.740 1.00 10.00 H new ATOM 711 N LYS A 48 -10.146 5.033 23.553 1.00 10.00 N ATOM 712 CA LYS A 48 -11.214 5.076 24.554 1.00 10.00 C ATOM 713 C LYS A 48 -12.247 3.959 24.390 1.00 10.00 C ATOM 714 O LYS A 48 -12.856 3.577 25.380 1.00 10.00 O ATOM 715 CB LYS A 48 -11.881 6.466 24.558 1.00 10.00 C ATOM 716 CG LYS A 48 -12.663 6.796 23.272 1.00 10.00 C ATOM 717 CD LYS A 48 -13.187 8.240 23.298 1.00 10.00 C ATOM 718 CE LYS A 48 -14.117 8.550 22.112 1.00 10.00 C ATOM 719 NZ LYS A 48 -13.421 8.559 20.799 1.00 10.00 N ATOM 0 H LYS A 48 -10.147 5.841 22.931 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.748 4.901 25.524 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -12.560 6.528 25.409 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -11.113 7.225 24.707 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -12.018 6.656 22.405 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -13.499 6.105 23.163 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -13.724 8.412 24.231 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -12.343 8.930 23.284 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.917 7.810 22.085 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -14.586 9.521 22.272 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -14.105 8.774 20.045 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -12.675 9.283 20.807 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -12.996 7.626 20.625 1.00 10.00 H new ATOM 733 N TRP A 49 -12.463 3.457 23.169 1.00 10.00 N ATOM 734 CA TRP A 49 -13.461 2.416 22.924 1.00 10.00 C ATOM 735 C TRP A 49 -13.058 1.064 23.533 1.00 10.00 C ATOM 736 O TRP A 49 -13.911 0.193 23.637 1.00 10.00 O ATOM 737 CB TRP A 49 -13.764 2.297 21.417 1.00 10.00 C ATOM 738 CG TRP A 49 -12.589 2.189 20.485 1.00 10.00 C ATOM 739 CD1 TRP A 49 -12.196 3.148 19.617 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.623 1.099 20.330 1.00 10.00 C ATOM 741 NE1 TRP A 49 -11.052 2.748 18.961 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.614 1.525 19.416 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.462 -0.189 20.884 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.456 0.779 19.165 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.291 -0.940 20.663 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.270 -0.439 19.838 1.00 10.00 C ATOM 0 H TRP A 49 -11.958 3.757 22.335 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.378 2.717 23.431 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.395 1.421 21.268 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.351 3.167 21.121 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.703 4.088 19.461 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.589 3.289 18.231 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.252 -0.607 21.490 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.716 1.136 18.464 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.177 -1.907 21.131 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.347 -0.988 19.722 1.00 10.00 H new ATOM 757 N ALA A 50 -11.782 0.872 23.895 1.00 10.00 N ATOM 758 CA ALA A 50 -11.277 -0.417 24.341 1.00 10.00 C ATOM 759 C ALA A 50 -11.990 -0.882 25.610 1.00 10.00 C ATOM 760 O ALA A 50 -11.901 -0.218 26.657 1.00 10.00 O ATOM 761 CB ALA A 50 -9.769 -0.319 24.559 1.00 10.00 C ATOM 0 H ALA A 50 -11.078 1.610 23.884 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.478 -1.163 23.572 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.386 -1.283 24.893 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.283 -0.041 23.624 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.559 0.437 25.316 1.00 10.00 H new ATOM 767 N GLU A 51 -12.609 -2.058 25.551 1.00 10.00 N ATOM 768 CA GLU A 51 -13.277 -2.669 26.698 1.00 10.00 C ATOM 769 C GLU A 51 -12.242 -3.118 27.736 1.00 10.00 C ATOM 770 O GLU A 51 -12.472 -3.021 28.942 1.00 10.00 O ATOM 771 CB GLU A 51 -14.119 -3.871 26.237 1.00 10.00 C ATOM 772 CG GLU A 51 -15.355 -3.479 25.410 1.00 10.00 C ATOM 773 CD GLU A 51 -16.430 -2.754 26.248 1.00 10.00 C ATOM 774 OE1 GLU A 51 -17.241 -3.453 26.898 1.00 10.00 O ATOM 775 OE2 GLU A 51 -16.456 -1.504 26.253 1.00 10.00 O ATOM 0 H GLU A 51 -12.662 -2.618 24.700 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.935 -1.931 27.157 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.492 -4.536 25.644 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -14.442 -4.434 27.113 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -15.046 -2.834 24.587 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.789 -4.375 24.967 1.00 10.00 H new ATOM 782 N TYR A 52 -11.056 -3.538 27.279 1.00 10.00 N ATOM 783 CA TYR A 52 -9.955 -4.063 28.073 1.00 10.00 C ATOM 784 C TYR A 52 -8.654 -3.678 27.371 1.00 10.00 C ATOM 785 O TYR A 52 -8.660 -3.363 26.185 1.00 10.00 O ATOM 786 CB TYR A 52 -10.053 -5.597 28.164 1.00 10.00 C ATOM 787 CG TYR A 52 -11.335 -6.129 28.780 1.00 10.00 C ATOM 788 CD1 TYR A 52 -11.498 -6.129 30.179 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.366 -6.621 27.955 1.00 10.00 C ATOM 790 CE1 TYR A 52 -12.690 -6.610 30.753 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.561 -7.102 28.521 1.00 10.00 C ATOM 792 CZ TYR A 52 -13.732 -7.093 29.926 1.00 10.00 C ATOM 793 OH TYR A 52 -14.881 -7.561 30.490 1.00 10.00 O ATOM 0 H TYR A 52 -10.833 -3.516 26.284 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.989 -3.654 29.083 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -9.952 -6.011 27.161 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -9.209 -5.965 28.747 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -10.706 -5.759 30.813 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.238 -6.629 26.883 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -12.810 -6.610 31.826 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.348 -7.478 27.884 1.00 10.00 H new ATOM 0 HH TYR A 52 -15.496 -7.854 29.785 1.00 10.00 H new ATOM 803 N HIS A 53 -7.518 -3.756 28.070 1.00 10.00 N ATOM 804 CA HIS A 53 -6.209 -3.504 27.456 1.00 10.00 C ATOM 805 C HIS A 53 -5.961 -4.471 26.293 1.00 10.00 C ATOM 806 O HIS A 53 -5.455 -4.078 25.245 1.00 10.00 O ATOM 807 CB HIS A 53 -5.108 -3.623 28.516 1.00 10.00 C ATOM 808 CG HIS A 53 -5.291 -2.656 29.658 1.00 10.00 C ATOM 809 ND1 HIS A 53 -4.973 -1.302 29.623 1.00 10.00 N ATOM 810 CD2 HIS A 53 -5.847 -2.947 30.872 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.325 -0.807 30.818 1.00 10.00 C ATOM 812 NE2 HIS A 53 -5.865 -1.771 31.588 1.00 10.00 N ATOM 0 H HIS A 53 -7.477 -3.992 29.062 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.195 -2.492 27.052 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -5.094 -4.641 28.906 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -4.139 -3.447 28.049 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -6.203 -3.911 31.205 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -5.194 0.221 31.121 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -6.224 -1.651 32.535 1.00 10.00 H new ATOM 820 N ALA A 54 -6.390 -5.729 26.446 1.00 10.00 N ATOM 821 CA ALA A 54 -6.293 -6.733 25.394 1.00 10.00 C ATOM 822 C ALA A 54 -7.126 -6.390 24.150 1.00 10.00 C ATOM 823 O ALA A 54 -6.820 -6.902 23.080 1.00 10.00 O ATOM 824 CB ALA A 54 -6.700 -8.100 25.953 1.00 10.00 C ATOM 0 H ALA A 54 -6.814 -6.075 27.307 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.254 -6.757 25.065 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -6.628 -8.851 25.166 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -6.036 -8.370 26.774 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -7.726 -8.053 26.317 1.00 10.00 H new ATOM 830 N ASP A 55 -8.141 -5.529 24.277 1.00 10.00 N ATOM 831 CA ASP A 55 -8.978 -5.127 23.138 1.00 10.00 C ATOM 832 C ASP A 55 -8.141 -4.302 22.155 1.00 10.00 C ATOM 833 O ASP A 55 -8.209 -4.479 20.943 1.00 10.00 O ATOM 834 CB ASP A 55 -10.180 -4.307 23.643 1.00 10.00 C ATOM 835 CG ASP A 55 -11.356 -4.181 22.655 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.392 -4.909 21.644 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.249 -3.370 22.977 1.00 10.00 O ATOM 0 H ASP A 55 -8.405 -5.094 25.161 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.351 -6.013 22.625 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.548 -4.762 24.563 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -9.833 -3.306 23.899 1.00 10.00 H new ATOM 842 N ILE A 56 -7.263 -3.438 22.695 1.00 10.00 N ATOM 843 CA ILE A 56 -6.299 -2.671 21.910 1.00 10.00 C ATOM 844 C ILE A 56 -5.336 -3.660 21.263 1.00 10.00 C ATOM 845 O ILE A 56 -5.122 -3.594 20.054 1.00 10.00 O ATOM 846 CB ILE A 56 -5.544 -1.644 22.794 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.531 -0.677 23.476 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.501 -0.856 21.973 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.929 0.153 24.610 1.00 10.00 C ATOM 0 H ILE A 56 -7.208 -3.256 23.697 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.815 -2.095 21.142 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.015 -2.202 23.567 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -6.935 -0.000 22.723 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.369 -1.252 23.870 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -3.989 -0.145 22.621 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -3.774 -1.548 21.548 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.002 -0.318 21.169 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.695 0.804 25.031 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.551 -0.512 25.387 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.111 0.759 24.222 1.00 10.00 H new ATOM 861 N TYR A 57 -4.726 -4.542 22.062 1.00 10.00 N ATOM 862 CA TYR A 57 -3.693 -5.437 21.563 1.00 10.00 C ATOM 863 C TYR A 57 -4.217 -6.311 20.420 1.00 10.00 C ATOM 864 O TYR A 57 -3.523 -6.464 19.416 1.00 10.00 O ATOM 865 CB TYR A 57 -3.148 -6.290 22.708 1.00 10.00 C ATOM 866 CG TYR A 57 -2.021 -7.215 22.291 1.00 10.00 C ATOM 867 CD1 TYR A 57 -0.799 -6.676 21.846 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.199 -8.611 22.329 1.00 10.00 C ATOM 869 CE1 TYR A 57 0.247 -7.528 21.457 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.151 -9.470 21.953 1.00 10.00 C ATOM 871 CZ TYR A 57 0.082 -8.930 21.524 1.00 10.00 C ATOM 872 OH TYR A 57 1.112 -9.740 21.178 1.00 10.00 O ATOM 0 H TYR A 57 -4.934 -4.650 23.055 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.879 -4.836 21.158 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.793 -5.633 23.502 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -3.960 -6.885 23.125 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.666 -5.605 21.804 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.144 -9.024 22.648 1.00 10.00 H new ATOM 0 HE1 TYR A 57 1.179 -7.111 21.106 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -1.288 -10.541 21.992 1.00 10.00 H new ATOM 0 HH TYR A 57 0.840 -10.676 21.279 1.00 10.00 H new ATOM 882 N ASP A 58 -5.436 -6.837 20.535 1.00 10.00 N ATOM 883 CA ASP A 58 -6.056 -7.643 19.484 1.00 10.00 C ATOM 884 C ASP A 58 -6.307 -6.821 18.218 1.00 10.00 C ATOM 885 O ASP A 58 -5.932 -7.245 17.122 1.00 10.00 O ATOM 886 CB ASP A 58 -7.376 -8.248 19.974 1.00 10.00 C ATOM 887 CG ASP A 58 -8.057 -9.057 18.850 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.589 -10.183 18.569 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.036 -8.550 18.268 1.00 10.00 O ATOM 0 H ASP A 58 -6.022 -6.716 21.361 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.360 -8.446 19.240 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.189 -8.894 20.832 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.042 -7.454 20.312 1.00 10.00 H new ATOM 894 N LYS A 59 -6.853 -5.603 18.363 1.00 10.00 N ATOM 895 CA LYS A 59 -7.123 -4.702 17.240 1.00 10.00 C ATOM 896 C LYS A 59 -5.822 -4.406 16.503 1.00 10.00 C ATOM 897 O LYS A 59 -5.770 -4.497 15.275 1.00 10.00 O ATOM 898 CB LYS A 59 -7.831 -3.448 17.792 1.00 10.00 C ATOM 899 CG LYS A 59 -8.268 -2.393 16.760 1.00 10.00 C ATOM 900 CD LYS A 59 -7.161 -1.397 16.362 1.00 10.00 C ATOM 901 CE LYS A 59 -7.710 -0.202 15.563 1.00 10.00 C ATOM 902 NZ LYS A 59 -8.230 -0.580 14.222 1.00 10.00 N ATOM 0 H LYS A 59 -7.120 -5.217 19.269 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.788 -5.153 16.503 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.714 -3.770 18.344 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.164 -2.968 18.509 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -8.621 -2.903 15.864 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -9.114 -1.836 17.163 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -6.663 -1.032 17.261 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -6.407 -1.913 15.767 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -8.508 0.272 16.134 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -6.920 0.540 15.443 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -8.585 0.268 13.735 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -7.465 -1.007 13.661 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -9.004 -1.266 14.331 1.00 10.00 H new ATOM 916 N VAL A 60 -4.782 -4.026 17.244 1.00 10.00 N ATOM 917 CA VAL A 60 -3.484 -3.670 16.696 1.00 10.00 C ATOM 918 C VAL A 60 -2.867 -4.903 16.024 1.00 10.00 C ATOM 919 O VAL A 60 -2.453 -4.809 14.875 1.00 10.00 O ATOM 920 CB VAL A 60 -2.629 -3.073 17.832 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.180 -2.792 17.412 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.241 -1.742 18.319 1.00 10.00 C ATOM 0 H VAL A 60 -4.824 -3.957 18.261 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.557 -2.909 15.919 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.621 -3.823 18.623 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.631 -2.373 18.256 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.706 -3.721 17.096 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.172 -2.082 16.585 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.628 -1.331 19.121 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.278 -1.034 17.491 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.251 -1.920 18.689 1.00 10.00 H new ATOM 932 N SER A 61 -2.866 -6.068 16.674 1.00 10.00 N ATOM 933 CA SER A 61 -2.303 -7.282 16.087 1.00 10.00 C ATOM 934 C SER A 61 -3.017 -7.653 14.780 1.00 10.00 C ATOM 935 O SER A 61 -2.369 -8.140 13.852 1.00 10.00 O ATOM 936 CB SER A 61 -2.364 -8.437 17.095 1.00 10.00 C ATOM 937 OG SER A 61 -1.700 -8.092 18.296 1.00 10.00 O ATOM 0 H SER A 61 -3.250 -6.195 17.610 1.00 10.00 H new ATOM 0 HA SER A 61 -1.258 -7.090 15.844 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.404 -8.685 17.308 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.906 -9.327 16.663 1.00 10.00 H new ATOM 0 HG SER A 61 -2.316 -7.604 18.881 1.00 10.00 H new ATOM 943 N GLY A 62 -4.328 -7.413 14.682 1.00 10.00 N ATOM 944 CA GLY A 62 -5.071 -7.591 13.447 1.00 10.00 C ATOM 945 C GLY A 62 -4.548 -6.651 12.364 1.00 10.00 C ATOM 946 O GLY A 62 -4.258 -7.098 11.254 1.00 10.00 O ATOM 0 H GLY A 62 -4.898 -7.089 15.463 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.986 -8.624 13.111 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -6.130 -7.399 13.622 1.00 10.00 H new ATOM 950 N ASP A 63 -4.398 -5.361 12.676 1.00 10.00 N ATOM 951 CA ASP A 63 -3.919 -4.372 11.712 1.00 10.00 C ATOM 952 C ASP A 63 -2.511 -4.704 11.230 1.00 10.00 C ATOM 953 O ASP A 63 -2.279 -4.734 10.025 1.00 10.00 O ATOM 954 CB ASP A 63 -3.937 -2.951 12.285 1.00 10.00 C ATOM 955 CG ASP A 63 -3.586 -1.937 11.178 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.528 -1.505 10.478 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.393 -1.593 11.025 1.00 10.00 O ATOM 0 H ASP A 63 -4.604 -4.977 13.598 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.607 -4.411 10.867 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -4.921 -2.728 12.697 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.223 -2.870 13.104 1.00 10.00 H new ATOM 962 N MET A 64 -1.592 -5.049 12.137 1.00 10.00 N ATOM 963 CA MET A 64 -0.216 -5.355 11.776 1.00 10.00 C ATOM 964 C MET A 64 -0.155 -6.553 10.839 1.00 10.00 C ATOM 965 O MET A 64 0.645 -6.531 9.906 1.00 10.00 O ATOM 966 CB MET A 64 0.650 -5.599 13.019 1.00 10.00 C ATOM 967 CG MET A 64 1.275 -4.296 13.527 1.00 10.00 C ATOM 968 SD MET A 64 0.130 -3.150 14.327 1.00 10.00 S ATOM 969 CE MET A 64 0.386 -1.638 13.384 1.00 10.00 C ATOM 0 H MET A 64 -1.786 -5.122 13.136 1.00 10.00 H new ATOM 0 HA MET A 64 0.187 -4.487 11.254 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.042 -6.044 13.807 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.438 -6.314 12.781 1.00 10.00 H new ATOM 0 HG2 MET A 64 2.068 -4.544 14.233 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.745 -3.786 12.686 1.00 10.00 H new ATOM 0 HE1 MET A 64 -0.121 -0.810 13.880 1.00 10.00 H new ATOM 0 HE2 MET A 64 1.453 -1.425 13.321 1.00 10.00 H new ATOM 0 HE3 MET A 64 -0.019 -1.762 12.380 1.00 10.00 H new ATOM 979 N GLN A 65 -1.002 -7.566 11.027 1.00 10.00 N ATOM 980 CA GLN A 65 -1.041 -8.701 10.114 1.00 10.00 C ATOM 981 C GLN A 65 -1.495 -8.265 8.716 1.00 10.00 C ATOM 982 O GLN A 65 -0.974 -8.781 7.731 1.00 10.00 O ATOM 983 CB GLN A 65 -1.943 -9.795 10.694 1.00 10.00 C ATOM 984 CG GLN A 65 -1.223 -10.538 11.828 1.00 10.00 C ATOM 985 CD GLN A 65 -2.171 -11.476 12.574 1.00 10.00 C ATOM 986 OE1 GLN A 65 -2.255 -12.668 12.296 1.00 10.00 O ATOM 987 NE2 GLN A 65 -2.931 -10.937 13.521 1.00 10.00 N ATOM 0 H GLN A 65 -1.665 -7.621 11.800 1.00 10.00 H new ATOM 0 HA GLN A 65 -0.036 -9.110 10.005 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.866 -9.353 11.069 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -2.222 -10.499 9.910 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -0.391 -11.111 11.418 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.800 -9.816 12.526 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.847 -9.944 13.738 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -3.598 -11.516 14.031 1.00 10.00 H new ATOM 996 N LYS A 66 -2.422 -7.303 8.611 1.00 10.00 N ATOM 997 CA LYS A 66 -2.797 -6.723 7.322 1.00 10.00 C ATOM 998 C LYS A 66 -1.646 -5.919 6.705 1.00 10.00 C ATOM 999 O LYS A 66 -1.555 -5.886 5.481 1.00 10.00 O ATOM 1000 CB LYS A 66 -4.066 -5.860 7.437 1.00 10.00 C ATOM 1001 CG LYS A 66 -5.295 -6.681 7.844 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.535 -5.785 7.960 1.00 10.00 C ATOM 1003 CE LYS A 66 -7.740 -6.636 8.374 1.00 10.00 C ATOM 1004 NZ LYS A 66 -8.986 -5.837 8.485 1.00 10.00 N ATOM 0 H LYS A 66 -2.925 -6.912 9.408 1.00 10.00 H new ATOM 0 HA LYS A 66 -3.017 -7.555 6.653 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.900 -5.071 8.170 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -4.258 -5.372 6.481 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.475 -7.464 7.108 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -5.108 -7.176 8.797 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.362 -4.998 8.694 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.733 -5.294 7.007 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.886 -7.433 7.645 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -7.532 -7.114 9.331 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -9.772 -6.457 8.767 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.858 -5.092 9.200 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -9.202 -5.401 7.566 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.789 -5.284 7.514 1.00 10.00 N ATOM 1019 CA GLN A 67 0.381 -4.575 7.000 1.00 10.00 C ATOM 1020 C GLN A 67 1.381 -5.593 6.441 1.00 10.00 C ATOM 1021 O GLN A 67 1.765 -5.523 5.279 1.00 10.00 O ATOM 1022 CB GLN A 67 1.068 -3.689 8.069 1.00 10.00 C ATOM 1023 CG GLN A 67 0.188 -2.650 8.784 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.534 -1.654 7.874 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.138 -1.399 6.742 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.601 -1.053 8.369 1.00 10.00 N ATOM 0 H GLN A 67 -0.887 -5.249 8.529 1.00 10.00 H new ATOM 0 HA GLN A 67 0.038 -3.904 6.213 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.501 -4.344 8.825 1.00 10.00 H new ATOM 0 HB3 GLN A 67 1.895 -3.162 7.592 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.558 -3.179 9.377 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.812 -2.091 9.481 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -1.920 -1.275 9.312 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.106 -0.367 7.808 1.00 10.00 H new ATOM 1035 N GLY A 68 1.808 -6.520 7.298 1.00 10.00 N ATOM 1036 CA GLY A 68 2.901 -7.450 7.059 1.00 10.00 C ATOM 1037 C GLY A 68 3.834 -7.490 8.269 1.00 10.00 C ATOM 1038 O GLY A 68 5.052 -7.427 8.108 1.00 10.00 O ATOM 0 H GLY A 68 1.381 -6.645 8.216 1.00 10.00 H new ATOM 0 HA2 GLY A 68 2.504 -8.446 6.863 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.457 -7.148 6.171 1.00 10.00 H new ATOM 1042 N CYS A 69 3.273 -7.498 9.483 1.00 10.00 N ATOM 1043 CA CYS A 69 3.983 -7.386 10.745 1.00 10.00 C ATOM 1044 C CYS A 69 3.310 -8.289 11.786 1.00 10.00 C ATOM 1045 O CYS A 69 2.213 -8.797 11.564 1.00 10.00 O ATOM 1046 CB CYS A 69 3.951 -5.918 11.210 1.00 10.00 C ATOM 1047 SG CYS A 69 4.960 -4.851 10.140 1.00 10.00 S ATOM 0 H CYS A 69 2.265 -7.587 9.609 1.00 10.00 H new ATOM 0 HA CYS A 69 5.020 -7.700 10.623 1.00 10.00 H new ATOM 0 HB2 CYS A 69 2.921 -5.560 11.214 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.315 -5.853 12.235 1.00 10.00 H new ATOM 0 HG CYS A 69 5.381 -5.535 9.118 1.00 10.00 H new ATOM 1053 N ASP A 70 3.944 -8.428 12.945 1.00 10.00 N ATOM 1054 CA ASP A 70 3.455 -9.169 14.113 1.00 10.00 C ATOM 1055 C ASP A 70 3.816 -8.371 15.371 1.00 10.00 C ATOM 1056 O ASP A 70 4.637 -7.451 15.285 1.00 10.00 O ATOM 1057 CB ASP A 70 4.085 -10.571 14.143 1.00 10.00 C ATOM 1058 CG ASP A 70 3.599 -11.437 15.323 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.412 -11.310 15.700 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.418 -12.228 15.831 1.00 10.00 O ATOM 0 H ASP A 70 4.859 -8.008 13.109 1.00 10.00 H new ATOM 0 HA ASP A 70 2.373 -9.295 14.064 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.857 -11.083 13.208 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.169 -10.473 14.197 1.00 10.00 H new ATOM 1065 N CYS A 71 3.207 -8.670 16.518 1.00 10.00 N ATOM 1066 CA CYS A 71 3.287 -7.863 17.732 1.00 10.00 C ATOM 1067 C CYS A 71 3.650 -8.700 18.964 1.00 10.00 C ATOM 1068 O CYS A 71 3.498 -9.916 18.970 1.00 10.00 O ATOM 1069 CB CYS A 71 1.931 -7.182 17.968 1.00 10.00 C ATOM 1070 SG CYS A 71 1.565 -5.980 16.660 1.00 10.00 S ATOM 0 H CYS A 71 2.629 -9.503 16.630 1.00 10.00 H new ATOM 0 HA CYS A 71 4.077 -7.125 17.590 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.144 -7.935 18.004 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.936 -6.680 18.936 1.00 10.00 H new ATOM 0 HG CYS A 71 0.287 -5.742 16.634 1.00 10.00 H new ATOM 1076 N GLU A 72 4.068 -8.010 20.026 1.00 10.00 N ATOM 1077 CA GLU A 72 4.312 -8.540 21.353 1.00 10.00 C ATOM 1078 C GLU A 72 3.977 -7.404 22.327 1.00 10.00 C ATOM 1079 O GLU A 72 4.563 -6.319 22.239 1.00 10.00 O ATOM 1080 CB GLU A 72 5.788 -8.964 21.440 1.00 10.00 C ATOM 1081 CG GLU A 72 6.218 -9.406 22.842 1.00 10.00 C ATOM 1082 CD GLU A 72 5.593 -10.755 23.257 1.00 10.00 C ATOM 1083 OE1 GLU A 72 4.393 -10.768 23.610 1.00 10.00 O ATOM 1084 OE2 GLU A 72 6.321 -11.771 23.248 1.00 10.00 O ATOM 0 H GLU A 72 4.254 -7.009 19.972 1.00 10.00 H new ATOM 0 HA GLU A 72 3.708 -9.416 21.589 1.00 10.00 H new ATOM 0 HB2 GLU A 72 5.964 -9.781 20.741 1.00 10.00 H new ATOM 0 HB3 GLU A 72 6.416 -8.131 21.122 1.00 10.00 H new ATOM 0 HG2 GLU A 72 7.304 -9.487 22.876 1.00 10.00 H new ATOM 0 HG3 GLU A 72 5.933 -8.640 23.564 1.00 10.00 H new ATOM 1091 N CYS A 73 2.997 -7.583 23.211 1.00 10.00 N ATOM 1092 CA CYS A 73 2.694 -6.612 24.255 1.00 10.00 C ATOM 1093 C CYS A 73 3.873 -6.544 25.236 1.00 10.00 C ATOM 1094 O CYS A 73 4.318 -7.564 25.752 1.00 10.00 O ATOM 1095 CB CYS A 73 1.372 -6.978 24.956 1.00 10.00 C ATOM 1096 SG CYS A 73 1.217 -8.763 25.271 1.00 10.00 S ATOM 0 H CYS A 73 2.393 -8.405 23.222 1.00 10.00 H new ATOM 0 HA CYS A 73 2.558 -5.622 23.820 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.305 -6.439 25.901 1.00 10.00 H new ATOM 0 HB3 CYS A 73 0.535 -6.648 24.341 1.00 10.00 H new ATOM 0 HG CYS A 73 0.251 -8.972 26.115 1.00 10.00 H new ATOM 1102 N LEU A 74 4.363 -5.331 25.519 1.00 10.00 N ATOM 1103 CA LEU A 74 5.382 -5.112 26.548 1.00 10.00 C ATOM 1104 C LEU A 74 4.725 -4.768 27.887 1.00 10.00 C ATOM 1105 O LEU A 74 5.323 -4.973 28.939 1.00 10.00 O ATOM 1106 CB LEU A 74 6.366 -4.003 26.129 1.00 10.00 C ATOM 1107 CG LEU A 74 7.142 -4.271 24.821 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.201 -3.178 24.624 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.838 -5.639 24.795 1.00 10.00 C ATOM 0 H LEU A 74 4.065 -4.479 25.043 1.00 10.00 H new ATOM 0 HA LEU A 74 5.948 -6.037 26.664 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.812 -3.071 26.019 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.085 -3.854 26.935 1.00 10.00 H new ATOM 0 HG LEU A 74 6.407 -4.265 24.016 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.750 -3.365 23.701 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.713 -2.205 24.565 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.893 -3.186 25.466 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.364 -5.762 23.848 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.551 -5.700 25.617 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.094 -6.428 24.901 1.00 10.00 H new ATOM 1121 N GLY A 75 3.492 -4.248 27.863 1.00 10.00 N ATOM 1122 CA GLY A 75 2.703 -3.918 29.043 1.00 10.00 C ATOM 1123 C GLY A 75 1.640 -2.892 28.670 1.00 10.00 C ATOM 1124 O GLY A 75 1.556 -2.485 27.511 1.00 10.00 O ATOM 0 H GLY A 75 3.006 -4.041 26.991 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.233 -4.816 29.443 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.349 -3.521 29.826 1.00 10.00 H new ATOM 1128 N GLY A 76 0.838 -2.437 29.632 1.00 10.00 N ATOM 1129 CA GLY A 76 -0.160 -1.403 29.383 1.00 10.00 C ATOM 1130 C GLY A 76 -0.395 -0.519 30.599 1.00 10.00 C ATOM 1131 O GLY A 76 0.253 -0.675 31.636 1.00 10.00 O ATOM 0 H GLY A 76 0.862 -2.772 30.595 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.162 -0.785 28.545 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -1.100 -1.872 29.091 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.328 0.415 30.453 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.593 1.483 31.398 1.00 10.00 C ATOM 1137 C GLY A 77 -2.740 2.331 30.867 1.00 10.00 C ATOM 1138 O GLY A 77 -3.530 1.884 30.032 1.00 10.00 O ATOM 0 H GLY A 77 -1.942 0.446 29.639 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.849 1.070 32.374 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.702 2.096 31.535 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.862 3.566 31.343 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.908 4.502 30.927 1.00 10.00 C ATOM 1144 C ARG A 78 -3.287 5.881 30.773 1.00 10.00 C ATOM 1145 O ARG A 78 -2.203 6.134 31.291 1.00 10.00 O ATOM 1146 CB ARG A 78 -5.058 4.494 31.953 1.00 10.00 C ATOM 1147 CG ARG A 78 -6.123 3.427 31.637 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.870 2.924 32.873 1.00 10.00 C ATOM 1149 NE ARG A 78 -6.020 2.015 33.662 1.00 10.00 N ATOM 1150 CZ ARG A 78 -5.628 2.190 34.933 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -6.043 3.210 35.662 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.820 1.313 35.499 1.00 10.00 N ATOM 0 H ARG A 78 -2.227 3.954 32.041 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.334 4.205 29.968 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -4.652 4.313 32.948 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.528 5.477 31.974 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -6.843 3.842 30.931 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -5.643 2.582 31.143 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -7.175 3.770 33.489 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.780 2.406 32.569 1.00 10.00 H new ATOM 0 HE ARG A 78 -5.697 1.168 33.195 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -6.682 3.896 35.262 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -5.724 3.311 36.626 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.495 0.504 34.970 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -4.521 1.445 36.465 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.969 6.766 30.061 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.507 8.111 29.751 1.00 10.00 C ATOM 1168 C ILE A 79 -4.709 9.021 29.976 1.00 10.00 C ATOM 1169 O ILE A 79 -5.850 8.605 29.759 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.969 8.187 28.295 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.917 7.086 28.018 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.389 9.584 28.006 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.205 7.159 26.661 1.00 10.00 C ATOM 0 H ILE A 79 -4.889 6.561 29.671 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.673 8.416 30.383 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.808 8.013 27.621 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -1.163 7.127 28.804 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -2.407 6.116 28.097 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.017 9.619 26.982 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.168 10.335 28.135 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.571 9.788 28.696 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.492 6.339 26.580 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -1.940 7.082 25.860 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -0.676 8.109 26.578 1.00 10.00 H new ATOM 1185 N SER A 80 -4.469 10.248 30.431 1.00 10.00 N ATOM 1186 CA SER A 80 -5.474 11.291 30.523 1.00 10.00 C ATOM 1187 C SER A 80 -4.799 12.663 30.389 1.00 10.00 C ATOM 1188 O SER A 80 -3.569 12.766 30.333 1.00 10.00 O ATOM 1189 CB SER A 80 -6.235 11.139 31.846 1.00 10.00 C ATOM 1190 OG SER A 80 -7.481 11.815 31.792 1.00 10.00 O ATOM 0 H SER A 80 -3.548 10.546 30.752 1.00 10.00 H new ATOM 0 HA SER A 80 -6.198 11.204 29.713 1.00 10.00 H new ATOM 0 HB2 SER A 80 -6.399 10.082 32.057 1.00 10.00 H new ATOM 0 HB3 SER A 80 -5.635 11.538 32.664 1.00 10.00 H new ATOM 0 HG SER A 80 -8.103 11.311 31.227 1.00 10.00 H new ATOM 1314 N ILE A 88 -0.679 16.102 29.331 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.877 14.658 29.271 1.00 10.00 C ATOM 1316 C ILE A 88 -0.110 14.011 30.429 1.00 10.00 C ATOM 1317 O ILE A 88 1.055 14.339 30.681 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.475 14.090 27.885 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -1.339 14.706 26.759 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.623 12.556 27.861 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.938 14.268 25.343 1.00 10.00 C ATOM 0 HA ILE A 88 -1.935 14.420 29.385 1.00 10.00 H new ATOM 0 HB ILE A 88 0.569 14.354 27.713 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.381 14.437 26.928 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.276 15.792 26.822 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.336 12.178 26.880 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.022 12.116 28.622 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.660 12.287 28.064 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.594 14.746 24.615 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.094 14.562 25.150 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -1.029 13.185 25.258 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.748 13.045 31.089 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.176 12.266 32.169 1.00 10.00 C ATOM 1335 C HIS A 89 -0.584 10.817 31.927 1.00 10.00 C ATOM 1336 O HIS A 89 -1.762 10.521 31.727 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.679 12.800 33.521 1.00 10.00 C ATOM 1338 CG HIS A 89 0.223 12.483 34.691 1.00 10.00 C ATOM 1339 ND1 HIS A 89 0.696 11.247 35.080 1.00 10.00 N ATOM 1340 CD2 HIS A 89 0.723 13.396 35.582 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.456 11.419 36.173 1.00 10.00 C ATOM 1342 NE2 HIS A 89 1.522 12.717 36.504 1.00 10.00 N ATOM 0 H HIS A 89 -1.709 12.780 30.874 1.00 10.00 H new ATOM 0 HA HIS A 89 0.911 12.338 32.196 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.796 13.881 33.450 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.668 12.385 33.717 1.00 10.00 H new ATOM 0 HD1 HIS A 89 0.502 10.358 34.618 1.00 10.00 H new ATOM 0 HD2 HIS A 89 0.532 14.459 35.573 1.00 10.00 H new ATOM 0 HE1 HIS A 89 1.947 10.622 36.712 1.00 10.00 H new ATOM 1350 N VAL A 90 0.392 9.922 31.907 1.00 10.00 N ATOM 1351 CA VAL A 90 0.194 8.482 31.829 1.00 10.00 C ATOM 1352 C VAL A 90 0.083 8.001 33.280 1.00 10.00 C ATOM 1353 O VAL A 90 0.713 8.585 34.167 1.00 10.00 O ATOM 1354 CB VAL A 90 1.383 7.866 31.060 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.241 6.354 30.877 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.566 8.507 29.669 1.00 10.00 C ATOM 0 H VAL A 90 1.376 10.187 31.946 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.704 8.184 31.288 1.00 10.00 H new ATOM 0 HB VAL A 90 2.259 8.071 31.676 1.00 10.00 H new ATOM 0 HG11 VAL A 90 2.103 5.971 30.331 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.187 5.873 31.854 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.331 6.139 30.316 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.413 8.044 29.163 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.663 8.356 29.077 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.751 9.575 29.782 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.715 6.980 33.573 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.846 6.470 34.932 1.00 10.00 C ATOM 1368 C TYR A 91 -1.284 5.003 34.933 1.00 10.00 C ATOM 1369 O TYR A 91 -1.677 4.463 33.895 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.799 7.364 35.751 1.00 10.00 C ATOM 1371 CG TYR A 91 -3.280 7.103 35.544 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.918 7.463 34.340 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -4.021 6.482 36.567 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -5.278 7.160 34.141 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -5.376 6.177 36.377 1.00 10.00 C ATOM 1376 CZ TYR A 91 -6.001 6.479 35.150 1.00 10.00 C ATOM 1377 OH TYR A 91 -7.290 6.086 34.947 1.00 10.00 O ATOM 0 H TYR A 91 -1.283 6.488 32.884 1.00 10.00 H new ATOM 0 HA TYR A 91 0.131 6.504 35.413 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -1.570 7.236 36.809 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -1.594 8.406 35.504 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.362 7.973 33.568 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.543 6.239 37.504 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.768 7.446 33.222 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.941 5.711 37.171 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.624 5.632 35.749 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.266 4.386 36.113 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.796 3.049 36.315 1.00 10.00 C ATOM 1389 C GLY A 92 -0.906 1.971 35.699 1.00 10.00 C ATOM 1390 O GLY A 92 0.273 2.189 35.426 1.00 10.00 O ATOM 0 H GLY A 92 -0.880 4.807 36.958 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -1.903 2.861 37.383 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.793 2.986 35.879 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.500 0.798 35.484 1.00 10.00 N ATOM 1395 CA TYR A 93 -0.912 -0.335 34.781 1.00 10.00 C ATOM 1396 C TYR A 93 -2.040 -1.104 34.078 1.00 10.00 C ATOM 1397 O TYR A 93 -3.204 -0.683 34.137 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.092 -1.206 35.753 1.00 10.00 C ATOM 1399 CG TYR A 93 -0.821 -1.859 36.916 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -0.997 -1.162 38.126 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -1.230 -3.205 36.828 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -1.570 -1.803 39.239 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -1.823 -3.847 37.930 1.00 10.00 C ATOM 1404 CZ TYR A 93 -1.989 -3.148 39.149 1.00 10.00 C ATOM 1405 OH TYR A 93 -2.551 -3.759 40.230 1.00 10.00 O ATOM 0 H TYR A 93 -2.447 0.606 35.811 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.208 0.000 34.020 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.385 -1.996 35.172 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.705 -0.587 36.164 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -0.690 -0.129 38.200 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -1.087 -3.748 35.906 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -1.690 -1.264 40.167 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -2.151 -4.872 37.846 1.00 10.00 H new ATOM 0 HH TYR A 93 -2.784 -4.683 39.999 1.00 10.00 H new ATOM 1415 N SER A 94 -1.722 -2.219 33.413 1.00 10.00 N ATOM 1416 CA SER A 94 -2.682 -3.123 32.795 1.00 10.00 C ATOM 1417 C SER A 94 -2.694 -4.413 33.601 1.00 10.00 C ATOM 1418 O SER A 94 -1.636 -4.981 33.860 1.00 10.00 O ATOM 1419 CB SER A 94 -2.269 -3.379 31.339 1.00 10.00 C ATOM 1420 OG SER A 94 -2.877 -4.546 30.804 1.00 10.00 O ATOM 0 H SER A 94 -0.756 -2.522 33.289 1.00 10.00 H new ATOM 0 HA SER A 94 -3.684 -2.694 32.789 1.00 10.00 H new ATOM 0 HB2 SER A 94 -2.542 -2.518 30.729 1.00 10.00 H new ATOM 0 HB3 SER A 94 -1.185 -3.478 31.283 1.00 10.00 H new ATOM 0 HG SER A 94 -2.588 -4.669 29.876 1.00 10.00 H new ATOM 1426 N MET A 95 -3.884 -4.896 33.963 1.00 10.00 N ATOM 1427 CA MET A 95 -4.028 -6.220 34.569 1.00 10.00 C ATOM 1428 C MET A 95 -3.813 -7.337 33.534 1.00 10.00 C ATOM 1429 O MET A 95 -3.577 -8.474 33.927 1.00 10.00 O ATOM 1430 CB MET A 95 -5.412 -6.371 35.226 1.00 10.00 C ATOM 1431 CG MET A 95 -5.608 -5.405 36.399 1.00 10.00 C ATOM 1432 SD MET A 95 -7.169 -5.624 37.295 1.00 10.00 S ATOM 1433 CE MET A 95 -7.023 -4.260 38.482 1.00 10.00 C ATOM 0 H MET A 95 -4.762 -4.390 33.847 1.00 10.00 H new ATOM 0 HA MET A 95 -3.260 -6.314 35.337 1.00 10.00 H new ATOM 0 HB2 MET A 95 -6.187 -6.195 34.480 1.00 10.00 H new ATOM 0 HB3 MET A 95 -5.535 -7.395 35.578 1.00 10.00 H new ATOM 0 HG2 MET A 95 -4.781 -5.529 37.098 1.00 10.00 H new ATOM 0 HG3 MET A 95 -5.558 -4.383 36.024 1.00 10.00 H new ATOM 0 HE1 MET A 95 -7.904 -4.240 39.123 1.00 10.00 H new ATOM 0 HE2 MET A 95 -6.132 -4.404 39.093 1.00 10.00 H new ATOM 0 HE3 MET A 95 -6.945 -3.316 37.943 1.00 10.00 H new ATOM 1443 N ALA A 96 -3.914 -7.040 32.227 1.00 10.00 N ATOM 1444 CA ALA A 96 -3.772 -8.057 31.191 1.00 10.00 C ATOM 1445 C ALA A 96 -2.319 -8.529 31.081 1.00 10.00 C ATOM 1446 O ALA A 96 -2.094 -9.707 30.821 1.00 10.00 O ATOM 1447 CB ALA A 96 -4.267 -7.517 29.842 1.00 10.00 C ATOM 0 H ALA A 96 -4.094 -6.101 31.871 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.384 -8.915 31.469 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -4.155 -8.287 29.079 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -5.318 -7.239 29.925 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.681 -6.642 29.563 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.350 -7.622 31.272 1.00 10.00 N ATOM 1454 CA TYR A 97 0.063 -7.893 30.985 1.00 10.00 C ATOM 1455 C TYR A 97 0.977 -7.450 32.127 1.00 10.00 C ATOM 1456 O TYR A 97 1.895 -8.176 32.497 1.00 10.00 O ATOM 1457 CB TYR A 97 0.471 -7.167 29.689 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.442 -7.394 28.498 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.796 -8.703 28.120 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -0.969 -6.294 27.790 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.712 -8.919 27.080 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -1.867 -6.501 26.730 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.257 -7.818 26.388 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.162 -8.031 25.403 1.00 10.00 O ATOM 0 H TYR A 97 -1.525 -6.683 31.629 1.00 10.00 H new ATOM 0 HA TYR A 97 0.177 -8.971 30.869 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.516 -6.097 29.891 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.478 -7.483 29.418 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -0.359 -9.546 28.634 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.681 -5.290 28.064 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -1.999 -9.925 26.810 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.258 -5.659 26.178 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.696 -8.138 24.548 1.00 10.00 H new ATOM 1474 N GLY A 98 0.731 -6.259 32.679 1.00 10.00 N ATOM 1475 CA GLY A 98 1.575 -5.607 33.666 1.00 10.00 C ATOM 1476 C GLY A 98 1.718 -4.130 33.301 1.00 10.00 C ATOM 1477 O GLY A 98 1.117 -3.681 32.314 1.00 10.00 O ATOM 0 H GLY A 98 -0.093 -5.708 32.438 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.139 -5.709 34.660 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.555 -6.084 33.697 1.00 10.00 H new ATOM 1481 N PRO A 99 2.491 -3.349 34.072 1.00 10.00 N ATOM 1482 CA PRO A 99 2.812 -1.974 33.713 1.00 10.00 C ATOM 1483 C PRO A 99 3.589 -1.932 32.402 1.00 10.00 C ATOM 1484 O PRO A 99 4.517 -2.713 32.199 1.00 10.00 O ATOM 1485 CB PRO A 99 3.656 -1.417 34.863 1.00 10.00 C ATOM 1486 CG PRO A 99 4.211 -2.658 35.562 1.00 10.00 C ATOM 1487 CD PRO A 99 3.158 -3.735 35.306 1.00 10.00 C ATOM 0 HA PRO A 99 1.910 -1.381 33.565 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.457 -0.777 34.494 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.054 -0.814 35.542 1.00 10.00 H new ATOM 0 HG2 PRO A 99 5.181 -2.944 35.155 1.00 10.00 H new ATOM 0 HG3 PRO A 99 4.352 -2.485 36.629 1.00 10.00 H new ATOM 0 HD2 PRO A 99 3.619 -4.718 35.211 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.449 -3.794 36.132 1.00 10.00 H new ATOM 1495 N ALA A 100 3.226 -0.994 31.527 1.00 10.00 N ATOM 1496 CA ALA A 100 4.055 -0.660 30.386 1.00 10.00 C ATOM 1497 C ALA A 100 5.343 -0.035 30.919 1.00 10.00 C ATOM 1498 O ALA A 100 5.400 0.462 32.047 1.00 10.00 O ATOM 1499 CB ALA A 100 3.313 0.316 29.468 1.00 10.00 C ATOM 0 H ALA A 100 2.362 -0.456 31.593 1.00 10.00 H new ATOM 0 HA ALA A 100 4.288 -1.550 29.801 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.943 0.562 28.613 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.389 -0.145 29.118 1.00 10.00 H new ATOM 0 HB3 ALA A 100 3.078 1.227 30.019 1.00 10.00 H new ATOM 1505 N GLN A 101 6.381 0.008 30.085 1.00 10.00 N ATOM 1506 CA GLN A 101 7.584 0.768 30.364 1.00 10.00 C ATOM 1507 C GLN A 101 7.257 2.222 30.025 1.00 10.00 C ATOM 1508 O GLN A 101 7.721 2.754 29.017 1.00 10.00 O ATOM 1509 CB GLN A 101 8.783 0.185 29.599 1.00 10.00 C ATOM 1510 CG GLN A 101 9.127 -1.219 30.122 1.00 10.00 C ATOM 1511 CD GLN A 101 10.297 -1.834 29.352 1.00 10.00 C ATOM 1512 OE1 GLN A 101 10.114 -2.555 28.381 1.00 10.00 O ATOM 1513 NE2 GLN A 101 11.530 -1.546 29.750 1.00 10.00 N ATOM 0 H GLN A 101 6.405 -0.488 29.194 1.00 10.00 H new ATOM 0 HA GLN A 101 7.886 0.713 31.410 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.553 0.136 28.535 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.646 0.842 29.709 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.377 -1.162 31.181 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.253 -1.865 30.035 1.00 10.00 H new ATOM 0 HE21 GLN A 101 11.677 -0.944 30.560 1.00 10.00 H new ATOM 0 HE22 GLN A 101 12.331 -1.926 29.245 1.00 10.00 H new ATOM 1522 N HIS A 102 6.398 2.837 30.845 1.00 10.00 N ATOM 1523 CA HIS A 102 5.769 4.129 30.597 1.00 10.00 C ATOM 1524 C HIS A 102 6.771 5.222 30.217 1.00 10.00 C ATOM 1525 O HIS A 102 6.412 6.083 29.428 1.00 10.00 O ATOM 1526 CB HIS A 102 4.964 4.575 31.826 1.00 10.00 C ATOM 1527 CG HIS A 102 3.926 3.596 32.322 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.989 2.860 33.484 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.718 3.314 31.742 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.856 2.143 33.583 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.050 2.378 32.535 1.00 10.00 N ATOM 0 H HIS A 102 6.114 2.427 31.735 1.00 10.00 H new ATOM 0 HA HIS A 102 5.105 3.989 29.744 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.661 4.780 32.639 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.466 5.515 31.589 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.760 2.859 34.152 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.344 3.744 30.824 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.625 1.469 34.395 1.00 10.00 H new ATOM 1539 N ALA A 103 8.015 5.173 30.715 1.00 10.00 N ATOM 1540 CA ALA A 103 9.055 6.135 30.356 1.00 10.00 C ATOM 1541 C ALA A 103 9.319 6.172 28.841 1.00 10.00 C ATOM 1542 O ALA A 103 9.554 7.240 28.281 1.00 10.00 O ATOM 1543 CB ALA A 103 10.345 5.794 31.110 1.00 10.00 C ATOM 0 H ALA A 103 8.324 4.463 31.378 1.00 10.00 H new ATOM 0 HA ALA A 103 8.706 7.127 30.642 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.122 6.510 30.844 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.162 5.840 32.184 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.670 4.789 30.840 1.00 10.00 H new ATOM 1549 N ILE A 104 9.272 5.010 28.176 1.00 10.00 N ATOM 1550 CA ILE A 104 9.439 4.916 26.729 1.00 10.00 C ATOM 1551 C ILE A 104 8.259 5.650 26.086 1.00 10.00 C ATOM 1552 O ILE A 104 8.443 6.502 25.217 1.00 10.00 O ATOM 1553 CB ILE A 104 9.533 3.430 26.285 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.683 2.700 27.025 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.704 3.335 24.756 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.886 1.234 26.618 1.00 10.00 C ATOM 0 H ILE A 104 9.117 4.111 28.631 1.00 10.00 H new ATOM 0 HA ILE A 104 10.370 5.382 26.406 1.00 10.00 H new ATOM 0 HB ILE A 104 8.602 2.932 26.554 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.612 3.243 26.848 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.489 2.741 28.097 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.768 2.288 24.461 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.848 3.798 24.265 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.617 3.852 24.459 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.711 0.809 27.189 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.976 0.670 26.822 1.00 10.00 H new ATOM 0 HD13 ILE A 104 11.115 1.180 25.554 1.00 10.00 H new ATOM 1568 N SER A 105 7.039 5.319 26.520 1.00 10.00 N ATOM 1569 CA SER A 105 5.824 5.917 26.004 1.00 10.00 C ATOM 1570 C SER A 105 5.816 7.437 26.188 1.00 10.00 C ATOM 1571 O SER A 105 5.497 8.143 25.233 1.00 10.00 O ATOM 1572 CB SER A 105 4.612 5.256 26.671 1.00 10.00 C ATOM 1573 OG SER A 105 4.787 3.843 26.743 1.00 10.00 O ATOM 0 H SER A 105 6.876 4.621 27.246 1.00 10.00 H new ATOM 0 HA SER A 105 5.774 5.741 24.929 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.475 5.662 27.673 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.708 5.488 26.107 1.00 10.00 H new ATOM 0 HG SER A 105 4.113 3.460 27.343 1.00 10.00 H new ATOM 1579 N THR A 106 6.182 7.959 27.364 1.00 10.00 N ATOM 1580 CA THR A 106 6.125 9.389 27.614 1.00 10.00 C ATOM 1581 C THR A 106 7.084 10.142 26.698 1.00 10.00 C ATOM 1582 O THR A 106 6.698 11.196 26.212 1.00 10.00 O ATOM 1583 CB THR A 106 6.358 9.721 29.098 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.472 9.051 29.652 1.00 10.00 O ATOM 1585 CG2 THR A 106 5.143 9.324 29.935 1.00 10.00 C ATOM 0 H THR A 106 6.520 7.406 28.152 1.00 10.00 H new ATOM 0 HA THR A 106 5.116 9.727 27.378 1.00 10.00 H new ATOM 0 HB THR A 106 6.537 10.796 29.126 1.00 10.00 H new ATOM 0 HG1 THR A 106 8.026 8.686 28.931 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.327 9.567 30.982 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.266 9.869 29.585 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.968 8.253 29.836 1.00 10.00 H new ATOM 1593 N GLU A 107 8.277 9.621 26.408 1.00 10.00 N ATOM 1594 CA GLU A 107 9.202 10.295 25.500 1.00 10.00 C ATOM 1595 C GLU A 107 8.635 10.360 24.078 1.00 10.00 C ATOM 1596 O GLU A 107 8.719 11.394 23.415 1.00 10.00 O ATOM 1597 CB GLU A 107 10.558 9.577 25.489 1.00 10.00 C ATOM 1598 CG GLU A 107 11.370 9.786 26.779 1.00 10.00 C ATOM 1599 CD GLU A 107 11.874 11.234 26.935 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.959 11.554 26.409 1.00 10.00 O ATOM 1601 OE2 GLU A 107 11.172 12.049 27.591 1.00 10.00 O ATOM 0 H GLU A 107 8.623 8.739 26.787 1.00 10.00 H new ATOM 0 HA GLU A 107 9.339 11.314 25.861 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.394 8.510 25.340 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.142 9.932 24.639 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.752 9.526 27.639 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.222 9.106 26.781 1.00 10.00 H new ATOM 1608 N LYS A 108 8.014 9.271 23.617 1.00 10.00 N ATOM 1609 CA LYS A 108 7.401 9.218 22.291 1.00 10.00 C ATOM 1610 C LYS A 108 6.227 10.201 22.219 1.00 10.00 C ATOM 1611 O LYS A 108 6.142 10.997 21.286 1.00 10.00 O ATOM 1612 CB LYS A 108 6.973 7.770 22.003 1.00 10.00 C ATOM 1613 CG LYS A 108 8.155 6.831 21.706 1.00 10.00 C ATOM 1614 CD LYS A 108 7.682 5.369 21.616 1.00 10.00 C ATOM 1615 CE LYS A 108 8.840 4.407 21.302 1.00 10.00 C ATOM 1616 NZ LYS A 108 9.127 4.287 19.850 1.00 10.00 N ATOM 0 H LYS A 108 7.923 8.407 24.151 1.00 10.00 H new ATOM 0 HA LYS A 108 8.114 9.520 21.524 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.419 7.385 22.860 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.291 7.763 21.153 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.630 7.122 20.769 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.907 6.927 22.489 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.216 5.080 22.558 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.919 5.282 20.843 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.738 4.751 21.816 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.602 3.421 21.701 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 10.146 4.133 19.709 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.597 3.483 19.457 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 8.839 5.161 19.366 1.00 10.00 H new ATOM 1630 N ILE A 109 5.333 10.189 23.211 1.00 10.00 N ATOM 1631 CA ILE A 109 4.210 11.122 23.264 1.00 10.00 C ATOM 1632 C ILE A 109 4.762 12.553 23.342 1.00 10.00 C ATOM 1633 O ILE A 109 4.262 13.428 22.645 1.00 10.00 O ATOM 1634 CB ILE A 109 3.261 10.775 24.438 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.670 9.348 24.307 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.086 11.773 24.514 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.118 8.814 25.637 1.00 10.00 C ATOM 0 H ILE A 109 5.368 9.536 23.994 1.00 10.00 H new ATOM 0 HA ILE A 109 3.607 11.041 22.360 1.00 10.00 H new ATOM 0 HB ILE A 109 3.866 10.832 25.343 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.873 9.356 23.564 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.442 8.671 23.940 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.435 11.506 25.347 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.474 12.781 24.665 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.518 11.738 23.584 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.716 7.812 25.488 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.919 8.778 26.375 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.326 9.473 25.993 1.00 10.00 H new ATOM 1649 N LYS A 110 5.802 12.811 24.140 1.00 10.00 N ATOM 1650 CA LYS A 110 6.437 14.125 24.271 1.00 10.00 C ATOM 1651 C LYS A 110 6.964 14.618 22.923 1.00 10.00 C ATOM 1652 O LYS A 110 6.847 15.804 22.646 1.00 10.00 O ATOM 1653 CB LYS A 110 7.547 14.034 25.334 1.00 10.00 C ATOM 1654 CG LYS A 110 8.233 15.366 25.662 1.00 10.00 C ATOM 1655 CD LYS A 110 9.419 15.172 26.623 1.00 10.00 C ATOM 1656 CE LYS A 110 8.988 14.713 28.027 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.142 14.270 28.843 1.00 10.00 N ATOM 0 H LYS A 110 6.235 12.097 24.725 1.00 10.00 H new ATOM 0 HA LYS A 110 5.702 14.861 24.597 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.121 13.625 26.250 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.302 13.327 24.991 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.583 15.832 24.741 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.510 16.048 26.109 1.00 10.00 H new ATOM 0 HD2 LYS A 110 10.104 14.437 26.201 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.969 16.109 26.706 1.00 10.00 H new ATOM 0 HE2 LYS A 110 8.477 15.531 28.535 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.272 13.896 27.938 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 9.850 14.180 29.837 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.479 13.349 28.496 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 10.908 14.969 28.769 1.00 10.00 H new ATOM 1671 N ALA A 111 7.511 13.731 22.084 1.00 10.00 N ATOM 1672 CA ALA A 111 7.936 14.094 20.741 1.00 10.00 C ATOM 1673 C ALA A 111 6.750 14.604 19.908 1.00 10.00 C ATOM 1674 O ALA A 111 6.914 15.550 19.141 1.00 10.00 O ATOM 1675 CB ALA A 111 8.635 12.908 20.062 1.00 10.00 C ATOM 0 H ALA A 111 7.668 12.751 22.321 1.00 10.00 H new ATOM 0 HA ALA A 111 8.655 14.910 20.813 1.00 10.00 H new ATOM 0 HB1 ALA A 111 8.947 13.196 19.058 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.510 12.619 20.645 1.00 10.00 H new ATOM 0 HB3 ALA A 111 7.946 12.066 20.000 1.00 10.00 H new ATOM 1681 N LYS A 112 5.564 13.990 20.031 1.00 10.00 N ATOM 1682 CA LYS A 112 4.361 14.472 19.337 1.00 10.00 C ATOM 1683 C LYS A 112 3.829 15.775 19.945 1.00 10.00 C ATOM 1684 O LYS A 112 3.388 16.649 19.202 1.00 10.00 O ATOM 1685 CB LYS A 112 3.242 13.414 19.361 1.00 10.00 C ATOM 1686 CG LYS A 112 3.611 12.059 18.746 1.00 10.00 C ATOM 1687 CD LYS A 112 4.108 12.168 17.297 1.00 10.00 C ATOM 1688 CE LYS A 112 4.386 10.759 16.773 1.00 10.00 C ATOM 1689 NZ LYS A 112 4.979 10.755 15.417 1.00 10.00 N ATOM 0 H LYS A 112 5.412 13.160 20.604 1.00 10.00 H new ATOM 0 HA LYS A 112 4.659 14.664 18.306 1.00 10.00 H new ATOM 0 HB2 LYS A 112 2.937 13.254 20.395 1.00 10.00 H new ATOM 0 HB3 LYS A 112 2.376 13.812 18.831 1.00 10.00 H new ATOM 0 HG2 LYS A 112 4.384 11.590 19.354 1.00 10.00 H new ATOM 0 HG3 LYS A 112 2.740 11.404 18.776 1.00 10.00 H new ATOM 0 HD2 LYS A 112 3.361 12.663 16.676 1.00 10.00 H new ATOM 0 HD3 LYS A 112 5.012 12.775 17.251 1.00 10.00 H new ATOM 0 HE2 LYS A 112 5.060 10.248 17.460 1.00 10.00 H new ATOM 0 HE3 LYS A 112 3.455 10.192 16.759 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 5.362 9.811 15.208 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 4.248 10.994 14.718 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 5.745 11.457 15.371 1.00 10.00 H new ATOM 1786 N VAL A 118 5.254 15.713 29.203 1.00 10.00 N ATOM 1787 CA VAL A 118 4.411 14.539 29.414 1.00 10.00 C ATOM 1788 C VAL A 118 5.097 13.754 30.535 1.00 10.00 C ATOM 1789 O VAL A 118 6.331 13.698 30.567 1.00 10.00 O ATOM 1790 CB VAL A 118 4.297 13.699 28.119 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.276 12.556 28.273 1.00 10.00 C ATOM 1792 CG2 VAL A 118 3.900 14.548 26.904 1.00 10.00 C ATOM 0 HA VAL A 118 3.389 14.809 29.681 1.00 10.00 H new ATOM 0 HB VAL A 118 5.291 13.284 27.949 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.223 11.988 27.344 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.587 11.897 29.084 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.295 12.973 28.500 1.00 10.00 H new ATOM 0 HG21 VAL A 118 3.834 13.912 26.022 1.00 10.00 H new ATOM 0 HG22 VAL A 118 2.933 15.016 27.087 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.651 15.320 26.739 1.00 10.00 H new ATOM 1802 N THR A 119 4.327 13.147 31.437 1.00 10.00 N ATOM 1803 CA THR A 119 4.835 12.501 32.645 1.00 10.00 C ATOM 1804 C THR A 119 4.093 11.186 32.884 1.00 10.00 C ATOM 1805 O THR A 119 3.053 10.938 32.266 1.00 10.00 O ATOM 1806 CB THR A 119 4.671 13.467 33.838 1.00 10.00 C ATOM 1807 OG1 THR A 119 3.401 14.099 33.811 1.00 10.00 O ATOM 1808 CG2 THR A 119 5.733 14.566 33.823 1.00 10.00 C ATOM 0 H THR A 119 3.313 13.090 31.346 1.00 10.00 H new ATOM 0 HA THR A 119 5.893 12.267 32.530 1.00 10.00 H new ATOM 0 HB THR A 119 4.777 12.862 34.738 1.00 10.00 H new ATOM 0 HG1 THR A 119 3.321 14.704 34.577 1.00 10.00 H new ATOM 0 HG21 THR A 119 5.585 15.226 34.678 1.00 10.00 H new ATOM 0 HG22 THR A 119 6.724 14.115 33.880 1.00 10.00 H new ATOM 0 HG23 THR A 119 5.648 15.141 32.901 1.00 10.00 H new ATOM 1816 N TRP A 120 4.598 10.343 33.787 1.00 10.00 N ATOM 1817 CA TRP A 120 3.927 9.113 34.192 1.00 10.00 C ATOM 1818 C TRP A 120 4.046 8.899 35.699 1.00 10.00 C ATOM 1819 O TRP A 120 4.926 9.468 36.341 1.00 10.00 O ATOM 1820 CB TRP A 120 4.459 7.900 33.413 1.00 10.00 C ATOM 1821 CG TRP A 120 5.860 7.466 33.719 1.00 10.00 C ATOM 1822 CD1 TRP A 120 6.983 7.948 33.140 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.307 6.436 34.656 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.089 7.321 33.672 1.00 10.00 N ATOM 1825 CE2 TRP A 120 7.732 6.368 34.603 1.00 10.00 C ATOM 1826 CE3 TRP A 120 5.652 5.532 35.524 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 8.468 5.463 35.384 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 6.381 4.622 36.313 1.00 10.00 C ATOM 1829 CH2 TRP A 120 7.786 4.588 36.247 1.00 10.00 C ATOM 0 H TRP A 120 5.489 10.498 34.259 1.00 10.00 H new ATOM 0 HA TRP A 120 2.869 9.216 33.950 1.00 10.00 H new ATOM 0 HB2 TRP A 120 3.793 7.057 33.599 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.397 8.126 32.348 1.00 10.00 H new ATOM 0 HD1 TRP A 120 7.009 8.710 32.375 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.051 7.535 33.410 1.00 10.00 H new ATOM 0 HE3 TRP A 120 4.574 5.540 35.583 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 9.546 5.439 35.322 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 5.858 3.946 36.973 1.00 10.00 H new ATOM 0 HH2 TRP A 120 8.340 3.891 36.858 1.00 10.00 H new ATOM 1840 N ALA A 121 3.175 8.051 36.250 1.00 10.00 N ATOM 1841 CA ALA A 121 3.236 7.539 37.614 1.00 10.00 C ATOM 1842 C ALA A 121 2.640 6.128 37.633 1.00 10.00 C ATOM 1843 O ALA A 121 1.926 5.744 36.710 1.00 10.00 O ATOM 1844 CB ALA A 121 2.453 8.464 38.556 1.00 10.00 C ATOM 0 H ALA A 121 2.374 7.689 35.732 1.00 10.00 H new ATOM 0 HA ALA A 121 4.271 7.503 37.954 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.503 8.075 39.573 1.00 10.00 H new ATOM 0 HB2 ALA A 121 2.887 9.463 38.528 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.412 8.512 38.237 1.00 10.00 H new