USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=26 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 HD1:sc= 0.925 K(o=2,f=-4.1!) USER MOD Set 1.2: A 119 THR OG1 : rot 84:sc= 1.11 USER MOD Set 2.1: A 53 HIS : no HD1:sc= -0.703 K(o=-0.57,f=-0.01) USER MOD Set 2.2: A 94 SER OG : rot 180:sc= 0.131 USER MOD Set 3.1: A 28 HIS : no HD1:sc= 1.07 K(o=2.3,f=-4.7!) USER MOD Set 3.2: A 40 SER OG : rot -114:sc= 1.25 USER MOD Set 4.1: A 22 TYR OH : rot -68:sc= 0.931 USER MOD Set 4.2: A 102 HIS : no HE2:sc= -0.318 K(o=1.8,f=1.2) USER MOD Set 4.3: A 105 SER OG : rot 159:sc= 1.2 USER MOD Single : A 21 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.17) USER MOD Single : A 29 SER OG : rot 180:sc= 0.00806 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 141:sc= 2.12 (180deg=0.462) USER MOD Single : A 47 TYR OH : rot -30:sc= 0 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= 0.0985 USER MOD Single : A 59 LYS NZ :NH3+ 150:sc= 1.19 (180deg=1.13) USER MOD Single : A 61 SER OG : rot 86:sc= 1.3 USER MOD Single : A 64 MET CE :methyl 180:sc= -0.0581 (180deg=-0.0581) USER MOD Single : A 65 GLN : amide:sc= 1.16 K(o=1.2,f=-0.42) 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=1.1,f=-0.39) USER MOD Single : A 69 CYS SG : rot 14:sc= -0.127 USER MOD Single : A 71 CYS SG : rot -120:sc= -0.271 USER MOD Single : A 73 CYS SG : rot -157:sc= 1.9 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl -179:sc= 0 (180deg=-0.00232) USER MOD Single : A 97 TYR OH : rot 135:sc= 0.164 USER MOD Single : A 101 GLN : amide:sc= 0.327 X(o=0.33,f=0) USER MOD Single : A 106 THR OG1 : rot 9:sc= 0.0464 USER MOD Single : A 108 LYS NZ :NH3+ -148:sc= 1.27 (180deg=1.06) USER MOD Single : A 110 LYS NZ :NH3+ 169:sc= 0.95 (180deg=0.855) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 5.401 -3.900 3.040 1.00 10.00 N ATOM 47 CA ALA A 4 5.230 -2.761 3.934 1.00 10.00 C ATOM 48 C ALA A 4 6.588 -2.511 4.599 1.00 10.00 C ATOM 49 O ALA A 4 7.538 -3.265 4.367 1.00 10.00 O ATOM 50 CB ALA A 4 4.156 -3.072 4.990 1.00 10.00 C ATOM 0 HA ALA A 4 4.901 -1.877 3.387 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.037 -2.214 5.652 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.208 -3.282 4.494 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.460 -3.941 5.574 1.00 10.00 H new ATOM 56 N ASP A 5 6.673 -1.498 5.456 1.00 10.00 N ATOM 57 CA ASP A 5 7.860 -1.213 6.259 1.00 10.00 C ATOM 58 C ASP A 5 7.401 -0.574 7.568 1.00 10.00 C ATOM 59 O ASP A 5 6.355 0.085 7.602 1.00 10.00 O ATOM 60 CB ASP A 5 8.805 -0.267 5.504 1.00 10.00 C ATOM 61 CG ASP A 5 10.115 -0.035 6.286 1.00 10.00 C ATOM 62 OD1 ASP A 5 11.046 -0.821 6.092 1.00 10.00 O ATOM 63 OD2 ASP A 5 10.116 0.908 7.118 1.00 10.00 O ATOM 0 H ASP A 5 5.909 -0.842 5.615 1.00 10.00 H new ATOM 0 HA ASP A 5 8.406 -2.134 6.461 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.034 -0.685 4.524 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.307 0.688 5.334 1.00 10.00 H new ATOM 68 N LEU A 6 8.153 -0.767 8.655 1.00 10.00 N ATOM 69 CA LEU A 6 7.838 -0.240 9.979 1.00 10.00 C ATOM 70 C LEU A 6 7.690 1.285 9.990 1.00 10.00 C ATOM 71 O LEU A 6 6.973 1.809 10.852 1.00 10.00 O ATOM 72 CB LEU A 6 8.929 -0.677 10.974 1.00 10.00 C ATOM 73 CG LEU A 6 8.918 -2.181 11.295 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.191 -2.569 12.046 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.705 -2.596 12.138 1.00 10.00 C ATOM 0 H LEU A 6 9.018 -1.307 8.635 1.00 10.00 H new ATOM 0 HA LEU A 6 6.872 -0.649 10.275 1.00 10.00 H new ATOM 0 HB2 LEU A 6 9.905 -0.410 10.568 1.00 10.00 H new ATOM 0 HB3 LEU A 6 8.806 -0.117 11.901 1.00 10.00 H new ATOM 0 HG LEU A 6 8.861 -2.702 10.339 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.172 -3.636 12.268 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.061 -2.342 11.429 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.250 -2.006 12.977 1.00 10.00 H new ATOM 0 HD21 LEU A 6 7.748 -3.667 12.335 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.716 -2.053 13.083 1.00 10.00 H new ATOM 0 HD23 LEU A 6 6.788 -2.363 11.596 1.00 10.00 H new ATOM 87 N ALA A 7 8.337 2.001 9.071 1.00 10.00 N ATOM 88 CA ALA A 7 8.201 3.448 8.932 1.00 10.00 C ATOM 89 C ALA A 7 6.770 3.880 8.589 1.00 10.00 C ATOM 90 O ALA A 7 6.396 5.009 8.890 1.00 10.00 O ATOM 91 CB ALA A 7 9.157 3.948 7.846 1.00 10.00 C ATOM 0 H ALA A 7 8.978 1.586 8.395 1.00 10.00 H new ATOM 0 HA ALA A 7 8.449 3.889 9.897 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.056 5.028 7.742 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.183 3.705 8.124 1.00 10.00 H new ATOM 0 HB3 ALA A 7 8.914 3.468 6.898 1.00 10.00 H new ATOM 97 N LEU A 8 5.977 3.002 7.962 1.00 10.00 N ATOM 98 CA LEU A 8 4.609 3.320 7.553 1.00 10.00 C ATOM 99 C LEU A 8 3.667 3.352 8.761 1.00 10.00 C ATOM 100 O LEU A 8 2.630 4.006 8.719 1.00 10.00 O ATOM 101 CB LEU A 8 4.096 2.292 6.526 1.00 10.00 C ATOM 102 CG LEU A 8 4.942 2.165 5.242 1.00 10.00 C ATOM 103 CD1 LEU A 8 4.325 1.097 4.327 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.050 3.489 4.470 1.00 10.00 C ATOM 0 H LEU A 8 6.268 2.053 7.726 1.00 10.00 H new ATOM 0 HA LEU A 8 4.623 4.308 7.093 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.047 1.315 7.007 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.078 2.560 6.245 1.00 10.00 H new ATOM 0 HG LEU A 8 5.949 1.880 5.547 1.00 10.00 H new ATOM 0 HD11 LEU A 8 4.922 1.006 3.419 1.00 10.00 H new ATOM 0 HD12 LEU A 8 4.307 0.139 4.847 1.00 10.00 H new ATOM 0 HD13 LEU A 8 3.307 1.387 4.065 1.00 10.00 H new ATOM 0 HD21 LEU A 8 5.656 3.341 3.576 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.054 3.824 4.181 1.00 10.00 H new ATOM 0 HD23 LEU A 8 5.517 4.243 5.104 1.00 10.00 H new ATOM 116 N ILE A 9 4.007 2.620 9.832 1.00 10.00 N ATOM 117 CA ILE A 9 3.204 2.548 11.044 1.00 10.00 C ATOM 118 C ILE A 9 3.495 3.834 11.837 1.00 10.00 C ATOM 119 O ILE A 9 4.675 4.137 12.066 1.00 10.00 O ATOM 120 CB ILE A 9 3.565 1.247 11.806 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.140 0.010 10.975 1.00 10.00 C ATOM 122 CG2 ILE A 9 2.920 1.205 13.206 1.00 10.00 C ATOM 123 CD1 ILE A 9 3.705 -1.315 11.496 1.00 10.00 C ATOM 0 H ILE A 9 4.858 2.058 9.873 1.00 10.00 H new ATOM 0 HA ILE A 9 2.132 2.497 10.852 1.00 10.00 H new ATOM 0 HB ILE A 9 4.646 1.231 11.946 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.052 -0.051 10.963 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.463 0.150 9.943 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.198 0.278 13.707 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.270 2.054 13.794 1.00 10.00 H new ATOM 0 HG23 ILE A 9 1.835 1.254 13.109 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.362 -2.132 10.861 1.00 10.00 H new ATOM 0 HD12 ILE A 9 4.794 -1.277 11.481 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.362 -1.481 12.517 1.00 10.00 H new ATOM 135 N PRO A 10 2.478 4.581 12.314 1.00 10.00 N ATOM 136 CA PRO A 10 2.707 5.761 13.136 1.00 10.00 C ATOM 137 C PRO A 10 3.275 5.340 14.492 1.00 10.00 C ATOM 138 O PRO A 10 2.918 4.282 15.019 1.00 10.00 O ATOM 139 CB PRO A 10 1.345 6.453 13.257 1.00 10.00 C ATOM 140 CG PRO A 10 0.339 5.318 13.071 1.00 10.00 C ATOM 141 CD PRO A 10 1.052 4.362 12.114 1.00 10.00 C ATOM 0 HA PRO A 10 3.436 6.446 12.703 1.00 10.00 H new ATOM 0 HB2 PRO A 10 1.227 6.937 14.227 1.00 10.00 H new ATOM 0 HB3 PRO A 10 1.221 7.226 12.498 1.00 10.00 H new ATOM 0 HG2 PRO A 10 0.100 4.834 14.018 1.00 10.00 H new ATOM 0 HG3 PRO A 10 -0.600 5.679 12.652 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.783 3.327 12.325 1.00 10.00 H new ATOM 0 HD3 PRO A 10 0.768 4.561 11.081 1.00 10.00 H new ATOM 149 N ASP A 11 4.147 6.158 15.075 1.00 10.00 N ATOM 150 CA ASP A 11 4.841 5.845 16.333 1.00 10.00 C ATOM 151 C ASP A 11 3.931 5.996 17.563 1.00 10.00 C ATOM 152 O ASP A 11 4.009 5.225 18.517 1.00 10.00 O ATOM 153 CB ASP A 11 6.054 6.770 16.464 1.00 10.00 C ATOM 154 CG ASP A 11 6.916 6.416 17.685 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.431 5.272 17.721 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.141 7.288 18.539 1.00 10.00 O ATOM 0 H ASP A 11 4.398 7.068 14.688 1.00 10.00 H new ATOM 0 HA ASP A 11 5.151 4.801 16.299 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.660 6.704 15.560 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.716 7.803 16.546 1.00 10.00 H new ATOM 161 N VAL A 12 2.961 6.910 17.472 1.00 10.00 N ATOM 162 CA VAL A 12 1.978 7.223 18.502 1.00 10.00 C ATOM 163 C VAL A 12 0.645 7.393 17.765 1.00 10.00 C ATOM 164 O VAL A 12 0.598 8.082 16.745 1.00 10.00 O ATOM 165 CB VAL A 12 2.387 8.513 19.251 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.424 8.839 20.405 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.808 8.437 19.824 1.00 10.00 C ATOM 0 H VAL A 12 2.838 7.478 16.634 1.00 10.00 H new ATOM 0 HA VAL A 12 1.904 6.440 19.256 1.00 10.00 H new ATOM 0 HB VAL A 12 2.345 9.302 18.500 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.749 9.752 20.903 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.418 8.979 20.010 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.422 8.017 21.120 1.00 10.00 H new ATOM 0 HG21 VAL A 12 4.043 9.368 20.339 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.873 7.607 20.528 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.519 8.281 19.013 1.00 10.00 H new ATOM 177 N ASP A 13 -0.409 6.759 18.269 1.00 10.00 N ATOM 178 CA ASP A 13 -1.781 6.965 17.798 1.00 10.00 C ATOM 179 C ASP A 13 -2.667 6.715 19.008 1.00 10.00 C ATOM 180 O ASP A 13 -2.753 5.570 19.484 1.00 10.00 O ATOM 181 CB ASP A 13 -2.140 6.033 16.623 1.00 10.00 C ATOM 182 CG ASP A 13 -3.514 6.364 15.978 1.00 10.00 C ATOM 183 OD1 ASP A 13 -4.286 7.143 16.570 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.746 5.848 14.866 1.00 10.00 O ATOM 0 H ASP A 13 -0.337 6.079 19.025 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.915 7.973 17.404 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.363 6.102 15.862 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -2.150 5.002 16.976 1.00 10.00 H new ATOM 189 N ILE A 14 -3.156 7.788 19.622 1.00 10.00 N ATOM 190 CA ILE A 14 -3.822 7.770 20.918 1.00 10.00 C ATOM 191 C ILE A 14 -5.076 8.660 20.892 1.00 10.00 C ATOM 192 O ILE A 14 -5.192 9.543 20.046 1.00 10.00 O ATOM 193 CB ILE A 14 -2.827 8.165 22.032 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.238 9.584 21.846 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.728 7.090 22.200 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.303 10.033 22.977 1.00 10.00 C ATOM 0 H ILE A 14 -3.097 8.723 19.218 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.163 6.759 21.139 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.395 8.208 22.962 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.691 9.617 20.904 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -3.058 10.297 21.764 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.041 7.393 22.990 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.188 6.138 22.464 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.180 6.981 21.264 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.935 11.037 22.768 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -1.849 10.036 23.921 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.460 9.345 23.047 1.00 10.00 H new ATOM 250 N VAL A 19 -9.575 10.616 29.835 1.00 10.00 N ATOM 251 CA VAL A 19 -8.951 9.357 30.227 1.00 10.00 C ATOM 252 C VAL A 19 -9.229 8.298 29.149 1.00 10.00 C ATOM 253 O VAL A 19 -10.357 8.208 28.661 1.00 10.00 O ATOM 254 CB VAL A 19 -9.453 8.904 31.619 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.659 7.694 32.138 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.343 10.030 32.667 1.00 10.00 C ATOM 0 HA VAL A 19 -7.873 9.494 30.309 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.500 8.633 31.484 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -9.038 7.403 33.118 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.770 6.861 31.444 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.605 7.959 32.221 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.706 9.668 33.629 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.301 10.336 32.764 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.944 10.882 32.350 1.00 10.00 H new ATOM 266 N PHE A 20 -8.243 7.458 28.827 1.00 10.00 N ATOM 267 CA PHE A 20 -8.406 6.278 27.980 1.00 10.00 C ATOM 268 C PHE A 20 -7.326 5.246 28.323 1.00 10.00 C ATOM 269 O PHE A 20 -6.228 5.614 28.754 1.00 10.00 O ATOM 270 CB PHE A 20 -8.350 6.653 26.488 1.00 10.00 C ATOM 271 CG PHE A 20 -7.069 7.330 26.037 1.00 10.00 C ATOM 272 CD1 PHE A 20 -6.911 8.717 26.208 1.00 10.00 C ATOM 273 CD2 PHE A 20 -6.036 6.582 25.447 1.00 10.00 C ATOM 274 CE1 PHE A 20 -5.717 9.345 25.815 1.00 10.00 C ATOM 275 CE2 PHE A 20 -4.840 7.206 25.057 1.00 10.00 C ATOM 276 CZ PHE A 20 -4.683 8.591 25.243 1.00 10.00 C ATOM 0 H PHE A 20 -7.286 7.584 29.157 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.387 5.843 28.171 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -8.490 5.748 25.897 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -9.188 7.313 26.264 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -7.709 9.301 26.642 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -6.163 5.521 25.293 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -5.596 10.409 25.954 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -4.044 6.625 24.616 1.00 10.00 H new ATOM 0 HZ PHE A 20 -3.764 9.074 24.945 1.00 10.00 H new ATOM 286 N LYS A 21 -7.646 3.958 28.176 1.00 10.00 N ATOM 287 CA LYS A 21 -6.676 2.875 28.355 1.00 10.00 C ATOM 288 C LYS A 21 -5.718 2.873 27.163 1.00 10.00 C ATOM 289 O LYS A 21 -6.107 3.231 26.051 1.00 10.00 O ATOM 290 CB LYS A 21 -7.372 1.506 28.482 1.00 10.00 C ATOM 291 CG LYS A 21 -8.420 1.480 29.608 1.00 10.00 C ATOM 292 CD LYS A 21 -9.002 0.078 29.845 1.00 10.00 C ATOM 293 CE LYS A 21 -10.098 0.171 30.920 1.00 10.00 C ATOM 294 NZ LYS A 21 -10.629 -1.149 31.334 1.00 10.00 N ATOM 0 H LYS A 21 -8.582 3.637 27.930 1.00 10.00 H new ATOM 0 HA LYS A 21 -6.126 3.045 29.280 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.853 1.258 27.536 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.623 0.737 28.670 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.965 1.841 30.531 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -9.229 2.168 29.362 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.415 -0.321 28.918 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.217 -0.607 30.165 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -9.697 0.683 31.794 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -10.918 0.782 30.541 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -11.288 -1.024 32.129 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -11.130 -1.588 30.535 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -9.843 -1.762 31.629 1.00 10.00 H new ATOM 308 N TYR A 22 -4.487 2.429 27.385 1.00 10.00 N ATOM 309 CA TYR A 22 -3.442 2.398 26.367 1.00 10.00 C ATOM 310 C TYR A 22 -2.524 1.200 26.612 1.00 10.00 C ATOM 311 O TYR A 22 -2.557 0.577 27.676 1.00 10.00 O ATOM 312 CB TYR A 22 -2.688 3.745 26.318 1.00 10.00 C ATOM 313 CG TYR A 22 -1.274 3.727 26.860 1.00 10.00 C ATOM 314 CD1 TYR A 22 -1.052 3.887 28.235 1.00 10.00 C ATOM 315 CD2 TYR A 22 -0.186 3.511 25.993 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.251 3.853 28.748 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.121 3.441 26.504 1.00 10.00 C ATOM 318 CZ TYR A 22 1.344 3.657 27.878 1.00 10.00 C ATOM 319 OH TYR A 22 2.614 3.696 28.358 1.00 10.00 O ATOM 0 H TYR A 22 -4.181 2.075 28.291 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.887 2.267 25.381 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.656 4.085 25.283 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -3.263 4.483 26.878 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.889 4.037 28.901 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.356 3.399 24.932 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.419 3.977 29.808 1.00 10.00 H new ATOM 0 HE2 TYR A 22 1.950 3.223 25.847 1.00 10.00 H new ATOM 0 HH TYR A 22 2.829 4.610 28.640 1.00 10.00 H new ATOM 329 N VAL A 23 -1.713 0.864 25.613 1.00 10.00 N ATOM 330 CA VAL A 23 -0.827 -0.281 25.616 1.00 10.00 C ATOM 331 C VAL A 23 0.460 0.128 24.880 1.00 10.00 C ATOM 332 O VAL A 23 0.418 0.895 23.906 1.00 10.00 O ATOM 333 CB VAL A 23 -1.615 -1.470 25.012 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.008 -1.243 23.547 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.916 -2.823 25.161 1.00 10.00 C ATOM 0 H VAL A 23 -1.658 1.406 24.751 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.505 -0.609 26.604 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.524 -1.510 25.612 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.557 -2.110 23.179 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.637 -0.356 23.472 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.109 -1.102 22.947 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.532 -3.602 24.713 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.050 -2.791 24.658 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.767 -3.041 26.219 1.00 10.00 H new ATOM 345 N LEU A 24 1.606 -0.364 25.351 1.00 10.00 N ATOM 346 CA LEU A 24 2.888 -0.253 24.662 1.00 10.00 C ATOM 347 C LEU A 24 3.099 -1.597 23.976 1.00 10.00 C ATOM 348 O LEU A 24 3.022 -2.636 24.633 1.00 10.00 O ATOM 349 CB LEU A 24 4.020 0.044 25.668 1.00 10.00 C ATOM 350 CG LEU A 24 5.433 0.050 25.033 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.698 1.299 24.179 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.515 -0.007 26.110 1.00 10.00 C ATOM 0 H LEU A 24 1.668 -0.860 26.240 1.00 10.00 H new ATOM 0 HA LEU A 24 2.895 0.565 23.942 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.836 1.013 26.132 1.00 10.00 H new ATOM 0 HB3 LEU A 24 3.992 -0.701 26.463 1.00 10.00 H new ATOM 0 HG LEU A 24 5.469 -0.832 24.394 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.703 1.247 23.760 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.970 1.347 23.369 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.609 2.190 24.800 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.498 -0.002 25.639 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.422 0.859 26.765 1.00 10.00 H new ATOM 0 HD23 LEU A 24 6.398 -0.919 26.695 1.00 10.00 H new ATOM 364 N ILE A 25 3.352 -1.591 22.670 1.00 10.00 N ATOM 365 CA ILE A 25 3.448 -2.815 21.879 1.00 10.00 C ATOM 366 C ILE A 25 4.743 -2.728 21.073 1.00 10.00 C ATOM 367 O ILE A 25 5.060 -1.679 20.511 1.00 10.00 O ATOM 368 CB ILE A 25 2.177 -2.986 21.006 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.911 -3.159 21.879 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.314 -4.206 20.081 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.413 -3.130 21.101 1.00 10.00 C ATOM 0 H ILE A 25 3.496 -0.738 22.130 1.00 10.00 H new ATOM 0 HA ILE A 25 3.491 -3.708 22.503 1.00 10.00 H new ATOM 0 HB ILE A 25 2.074 -2.080 20.408 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.982 -4.106 22.414 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.893 -2.369 22.630 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.412 -4.308 19.477 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.175 -4.072 19.427 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.452 -5.105 20.682 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.245 -3.258 21.794 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.513 -2.174 20.588 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.423 -3.937 20.369 1.00 10.00 H new ATOM 383 N ARG A 26 5.487 -3.824 21.016 1.00 10.00 N ATOM 384 CA ARG A 26 6.608 -4.000 20.117 1.00 10.00 C ATOM 385 C ARG A 26 6.067 -4.642 18.855 1.00 10.00 C ATOM 386 O ARG A 26 5.141 -5.444 18.907 1.00 10.00 O ATOM 387 CB ARG A 26 7.660 -4.895 20.794 1.00 10.00 C ATOM 388 CG ARG A 26 8.943 -5.071 19.967 1.00 10.00 C ATOM 389 CD ARG A 26 10.003 -5.856 20.747 1.00 10.00 C ATOM 390 NE ARG A 26 10.508 -5.095 21.902 1.00 10.00 N ATOM 391 CZ ARG A 26 10.827 -5.572 23.103 1.00 10.00 C ATOM 392 NH1 ARG A 26 10.624 -6.838 23.469 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.375 -4.728 23.973 1.00 10.00 N ATOM 0 H ARG A 26 5.319 -4.634 21.612 1.00 10.00 H new ATOM 0 HA ARG A 26 7.088 -3.052 19.872 1.00 10.00 H new ATOM 0 HB2 ARG A 26 7.918 -4.468 21.763 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.223 -5.875 20.984 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.711 -5.592 19.038 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.339 -4.093 19.693 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.577 -6.799 21.091 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.832 -6.104 20.084 1.00 10.00 H new ATOM 0 HE ARG A 26 10.627 -4.091 21.767 1.00 10.00 H new ATOM 0 HH11 ARG A 26 10.204 -7.497 22.814 1.00 10.00 H new ATOM 0 HH12 ARG A 26 10.889 -7.147 24.404 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.536 -3.756 23.709 1.00 10.00 H new ATOM 0 HH22 ARG A 26 11.634 -5.053 24.904 1.00 10.00 H new ATOM 407 N VAL A 27 6.639 -4.289 17.713 1.00 10.00 N ATOM 408 CA VAL A 27 6.232 -4.745 16.401 1.00 10.00 C ATOM 409 C VAL A 27 7.494 -5.266 15.725 1.00 10.00 C ATOM 410 O VAL A 27 8.578 -4.703 15.924 1.00 10.00 O ATOM 411 CB VAL A 27 5.570 -3.584 15.628 1.00 10.00 C ATOM 412 CG1 VAL A 27 5.033 -4.047 14.269 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.404 -2.961 16.410 1.00 10.00 C ATOM 0 H VAL A 27 7.433 -3.650 17.679 1.00 10.00 H new ATOM 0 HA VAL A 27 5.486 -5.539 16.443 1.00 10.00 H new ATOM 0 HB VAL A 27 6.353 -2.839 15.486 1.00 10.00 H new ATOM 0 HG11 VAL A 27 4.574 -3.204 13.753 1.00 10.00 H new ATOM 0 HG12 VAL A 27 5.854 -4.438 13.667 1.00 10.00 H new ATOM 0 HG13 VAL A 27 4.289 -4.829 14.419 1.00 10.00 H new ATOM 0 HG21 VAL A 27 3.969 -2.149 15.828 1.00 10.00 H new ATOM 0 HG22 VAL A 27 3.645 -3.720 16.598 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.770 -2.571 17.360 1.00 10.00 H new ATOM 423 N HIS A 28 7.347 -6.299 14.906 1.00 10.00 N ATOM 424 CA HIS A 28 8.413 -6.951 14.165 1.00 10.00 C ATOM 425 C HIS A 28 7.967 -6.976 12.706 1.00 10.00 C ATOM 426 O HIS A 28 6.810 -7.305 12.445 1.00 10.00 O ATOM 427 CB HIS A 28 8.611 -8.383 14.687 1.00 10.00 C ATOM 428 CG HIS A 28 8.694 -8.501 16.191 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.772 -8.167 16.978 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.708 -8.955 17.026 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.452 -8.437 18.255 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.202 -8.903 18.332 1.00 10.00 N ATOM 0 H HIS A 28 6.436 -6.724 14.734 1.00 10.00 H new ATOM 0 HA HIS A 28 9.360 -6.424 14.277 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.786 -9.002 14.333 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.524 -8.790 14.253 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.726 -9.292 16.729 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.111 -8.297 19.099 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.704 -9.170 19.181 1.00 10.00 H new ATOM 440 N SER A 29 8.828 -6.583 11.762 1.00 10.00 N ATOM 441 CA SER A 29 8.445 -6.636 10.357 1.00 10.00 C ATOM 442 C SER A 29 8.382 -8.089 9.864 1.00 10.00 C ATOM 443 O SER A 29 9.156 -8.935 10.293 1.00 10.00 O ATOM 444 CB SER A 29 9.348 -5.747 9.494 1.00 10.00 C ATOM 445 OG SER A 29 10.730 -5.924 9.723 1.00 10.00 O ATOM 0 H SER A 29 9.769 -6.234 11.942 1.00 10.00 H new ATOM 0 HA SER A 29 7.440 -6.227 10.258 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.137 -5.947 8.443 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.092 -4.703 9.677 1.00 10.00 H new ATOM 0 HG SER A 29 11.238 -5.326 9.136 1.00 10.00 H new ATOM 451 N ALA A 30 7.464 -8.341 8.927 1.00 10.00 N ATOM 452 CA ALA A 30 7.363 -9.568 8.145 1.00 10.00 C ATOM 453 C ALA A 30 6.649 -9.228 6.828 1.00 10.00 C ATOM 454 O ALA A 30 5.518 -9.667 6.589 1.00 10.00 O ATOM 455 CB ALA A 30 6.630 -10.647 8.941 1.00 10.00 C ATOM 0 H ALA A 30 6.741 -7.663 8.685 1.00 10.00 H new ATOM 0 HA ALA A 30 8.351 -9.970 7.920 1.00 10.00 H new ATOM 0 HB1 ALA A 30 6.562 -11.557 8.344 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.177 -10.856 9.860 1.00 10.00 H new ATOM 0 HB3 ALA A 30 5.627 -10.299 9.187 1.00 10.00 H new ATOM 461 N PRO A 31 7.247 -8.348 5.997 1.00 10.00 N ATOM 462 CA PRO A 31 6.607 -7.820 4.798 1.00 10.00 C ATOM 463 C PRO A 31 6.234 -8.972 3.864 1.00 10.00 C ATOM 464 O PRO A 31 6.960 -9.964 3.781 1.00 10.00 O ATOM 465 CB PRO A 31 7.620 -6.859 4.159 1.00 10.00 C ATOM 466 CG PRO A 31 8.722 -6.680 5.204 1.00 10.00 C ATOM 467 CD PRO A 31 8.636 -7.938 6.062 1.00 10.00 C ATOM 0 HA PRO A 31 5.681 -7.290 5.020 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.020 -7.269 3.232 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.155 -5.905 3.911 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.702 -6.584 4.736 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.563 -5.781 5.799 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.295 -8.719 5.683 1.00 10.00 H new ATOM 0 HD3 PRO A 31 8.939 -7.736 7.089 1.00 10.00 H new ATOM 475 N ARG A 32 5.109 -8.859 3.140 1.00 10.00 N ATOM 476 CA ARG A 32 4.580 -9.914 2.258 1.00 10.00 C ATOM 477 C ARG A 32 4.457 -11.281 2.976 1.00 10.00 C ATOM 478 O ARG A 32 4.382 -12.304 2.290 1.00 10.00 O ATOM 479 CB ARG A 32 5.428 -9.958 0.961 1.00 10.00 C ATOM 480 CG ARG A 32 4.628 -9.911 -0.356 1.00 10.00 C ATOM 481 CD ARG A 32 3.609 -11.041 -0.562 1.00 10.00 C ATOM 482 NE ARG A 32 4.235 -12.370 -0.499 1.00 10.00 N ATOM 483 CZ ARG A 32 4.732 -13.089 -1.512 1.00 10.00 C ATOM 484 NH1 ARG A 32 4.677 -12.633 -2.766 1.00 10.00 N ATOM 485 NH2 ARG A 32 5.281 -14.276 -1.269 1.00 10.00 N ATOM 0 H ARG A 32 4.531 -8.018 3.151 1.00 10.00 H new ATOM 0 HA ARG A 32 3.555 -9.672 1.978 1.00 10.00 H new ATOM 0 HB2 ARG A 32 6.124 -9.119 0.974 1.00 10.00 H new ATOM 0 HB3 ARG A 32 6.027 -10.869 0.970 1.00 10.00 H new ATOM 0 HG2 ARG A 32 4.100 -8.959 -0.404 1.00 10.00 H new ATOM 0 HG3 ARG A 32 5.333 -9.927 -1.187 1.00 10.00 H new ATOM 0 HD2 ARG A 32 2.832 -10.971 0.199 1.00 10.00 H new ATOM 0 HD3 ARG A 32 3.121 -10.916 -1.529 1.00 10.00 H new ATOM 0 HE ARG A 32 4.298 -12.794 0.427 1.00 10.00 H new ATOM 0 HH11 ARG A 32 4.252 -11.726 -2.961 1.00 10.00 H new ATOM 0 HH12 ARG A 32 5.060 -13.191 -3.529 1.00 10.00 H new ATOM 0 HH21 ARG A 32 5.321 -14.633 -0.315 1.00 10.00 H new ATOM 0 HH22 ARG A 32 5.662 -14.829 -2.037 1.00 10.00 H new ATOM 499 N SER A 33 4.438 -11.307 4.304 1.00 10.00 N ATOM 500 CA SER A 33 4.514 -12.519 5.117 1.00 10.00 C ATOM 501 C SER A 33 5.685 -13.447 4.724 1.00 10.00 C ATOM 502 O SER A 33 5.577 -14.659 4.894 1.00 10.00 O ATOM 503 CB SER A 33 3.147 -13.223 5.122 1.00 10.00 C ATOM 504 OG SER A 33 2.095 -12.318 5.414 1.00 10.00 O ATOM 0 H SER A 33 4.367 -10.458 4.864 1.00 10.00 H new ATOM 0 HA SER A 33 4.746 -12.228 6.141 1.00 10.00 H new ATOM 0 HB2 SER A 33 2.971 -13.685 4.150 1.00 10.00 H new ATOM 0 HB3 SER A 33 3.153 -14.025 5.860 1.00 10.00 H new ATOM 0 HG SER A 33 1.240 -12.797 5.408 1.00 10.00 H new ATOM 510 N GLY A 34 6.789 -12.908 4.185 1.00 10.00 N ATOM 511 CA GLY A 34 7.918 -13.741 3.766 1.00 10.00 C ATOM 512 C GLY A 34 9.125 -13.008 3.173 1.00 10.00 C ATOM 513 O GLY A 34 10.082 -13.671 2.787 1.00 10.00 O ATOM 0 H GLY A 34 6.920 -11.908 4.031 1.00 10.00 H new ATOM 0 HA2 GLY A 34 8.257 -14.315 4.628 1.00 10.00 H new ATOM 0 HA3 GLY A 34 7.558 -14.458 3.028 1.00 10.00 H new ATOM 517 N ALA A 35 9.101 -11.674 3.049 1.00 10.00 N ATOM 518 CA ALA A 35 10.260 -10.904 2.610 1.00 10.00 C ATOM 519 C ALA A 35 11.428 -11.082 3.605 1.00 10.00 C ATOM 520 O ALA A 35 11.180 -11.276 4.795 1.00 10.00 O ATOM 521 CB ALA A 35 9.875 -9.424 2.480 1.00 10.00 C ATOM 0 H ALA A 35 8.279 -11.105 3.251 1.00 10.00 H new ATOM 0 HA ALA A 35 10.587 -11.268 1.636 1.00 10.00 H new ATOM 0 HB1 ALA A 35 10.742 -8.850 2.152 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.073 -9.320 1.749 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.537 -9.050 3.446 1.00 10.00 H new ATOM 527 N PRO A 36 12.691 -10.958 3.156 1.00 10.00 N ATOM 528 CA PRO A 36 13.882 -11.129 3.990 1.00 10.00 C ATOM 529 C PRO A 36 14.144 -9.889 4.876 1.00 10.00 C ATOM 530 O PRO A 36 15.172 -9.229 4.748 1.00 10.00 O ATOM 531 CB PRO A 36 15.010 -11.447 2.996 1.00 10.00 C ATOM 532 CG PRO A 36 14.611 -10.641 1.762 1.00 10.00 C ATOM 533 CD PRO A 36 13.088 -10.765 1.765 1.00 10.00 C ATOM 0 HA PRO A 36 13.780 -11.934 4.718 1.00 10.00 H new ATOM 0 HB2 PRO A 36 15.984 -11.144 3.379 1.00 10.00 H new ATOM 0 HB3 PRO A 36 15.070 -12.514 2.780 1.00 10.00 H new ATOM 0 HG2 PRO A 36 14.934 -9.602 1.834 1.00 10.00 H new ATOM 0 HG3 PRO A 36 15.050 -11.049 0.851 1.00 10.00 H new ATOM 0 HD2 PRO A 36 12.625 -9.870 1.350 1.00 10.00 H new ATOM 0 HD3 PRO A 36 12.766 -11.605 1.149 1.00 10.00 H new ATOM 541 N ALA A 37 13.203 -9.560 5.762 1.00 10.00 N ATOM 542 CA ALA A 37 13.317 -8.496 6.747 1.00 10.00 C ATOM 543 C ALA A 37 12.671 -8.968 8.053 1.00 10.00 C ATOM 544 O ALA A 37 11.650 -9.646 8.022 1.00 10.00 O ATOM 545 CB ALA A 37 12.626 -7.229 6.226 1.00 10.00 C ATOM 0 H ALA A 37 12.309 -10.049 5.811 1.00 10.00 H new ATOM 0 HA ALA A 37 14.366 -8.260 6.928 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.714 -6.435 6.968 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.100 -6.912 5.297 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.572 -7.439 6.043 1.00 10.00 H new ATOM 551 N ALA A 38 13.288 -8.600 9.178 1.00 10.00 N ATOM 552 CA ALA A 38 12.882 -8.978 10.531 1.00 10.00 C ATOM 553 C ALA A 38 13.364 -7.905 11.521 1.00 10.00 C ATOM 554 O ALA A 38 13.890 -8.209 12.590 1.00 10.00 O ATOM 555 CB ALA A 38 13.440 -10.371 10.860 1.00 10.00 C ATOM 0 H ALA A 38 14.118 -8.007 9.170 1.00 10.00 H new ATOM 0 HA ALA A 38 11.796 -9.034 10.607 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.139 -10.655 11.868 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.050 -11.097 10.147 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.528 -10.351 10.799 1.00 10.00 H new ATOM 561 N GLU A 39 13.267 -6.636 11.113 1.00 10.00 N ATOM 562 CA GLU A 39 13.536 -5.484 11.973 1.00 10.00 C ATOM 563 C GLU A 39 12.412 -5.365 13.010 1.00 10.00 C ATOM 564 O GLU A 39 11.438 -6.125 12.989 1.00 10.00 O ATOM 565 CB GLU A 39 13.664 -4.209 11.119 1.00 10.00 C ATOM 566 CG GLU A 39 14.887 -4.255 10.187 1.00 10.00 C ATOM 567 CD GLU A 39 15.079 -2.929 9.413 1.00 10.00 C ATOM 568 OE1 GLU A 39 15.682 -2.012 9.999 1.00 10.00 O ATOM 569 OE2 GLU A 39 14.640 -2.866 8.254 1.00 10.00 O ATOM 0 H GLU A 39 12.996 -6.379 10.164 1.00 10.00 H new ATOM 0 HA GLU A 39 14.480 -5.618 12.501 1.00 10.00 H new ATOM 0 HB2 GLU A 39 12.760 -4.080 10.524 1.00 10.00 H new ATOM 0 HB3 GLU A 39 13.741 -3.341 11.774 1.00 10.00 H new ATOM 0 HG2 GLU A 39 15.782 -4.465 10.773 1.00 10.00 H new ATOM 0 HG3 GLU A 39 14.771 -5.075 9.478 1.00 10.00 H new ATOM 576 N SER A 40 12.515 -4.432 13.960 1.00 10.00 N ATOM 577 CA SER A 40 11.496 -4.230 14.988 1.00 10.00 C ATOM 578 C SER A 40 11.477 -2.780 15.477 1.00 10.00 C ATOM 579 O SER A 40 12.397 -2.007 15.235 1.00 10.00 O ATOM 580 CB SER A 40 11.734 -5.206 16.148 1.00 10.00 C ATOM 581 OG SER A 40 11.749 -6.545 15.693 1.00 10.00 O ATOM 0 H SER A 40 13.309 -3.796 14.036 1.00 10.00 H new ATOM 0 HA SER A 40 10.517 -4.432 14.554 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.681 -4.973 16.634 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.952 -5.082 16.897 1.00 10.00 H new ATOM 0 HG SER A 40 10.980 -7.025 16.065 1.00 10.00 H new ATOM 587 N LYS A 41 10.380 -2.405 16.143 1.00 10.00 N ATOM 588 CA LYS A 41 9.997 -1.047 16.540 1.00 10.00 C ATOM 589 C LYS A 41 9.076 -1.168 17.759 1.00 10.00 C ATOM 590 O LYS A 41 8.516 -2.237 17.973 1.00 10.00 O ATOM 591 CB LYS A 41 9.305 -0.399 15.322 1.00 10.00 C ATOM 592 CG LYS A 41 8.625 0.960 15.547 1.00 10.00 C ATOM 593 CD LYS A 41 8.210 1.571 14.201 1.00 10.00 C ATOM 594 CE LYS A 41 7.358 2.836 14.372 1.00 10.00 C ATOM 595 NZ LYS A 41 7.176 3.541 13.081 1.00 10.00 N ATOM 0 H LYS A 41 9.687 -3.092 16.440 1.00 10.00 H new ATOM 0 HA LYS A 41 10.842 -0.419 16.824 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.049 -0.279 14.534 1.00 10.00 H new ATOM 0 HB3 LYS A 41 8.554 -1.096 14.949 1.00 10.00 H new ATOM 0 HG2 LYS A 41 7.750 0.836 16.185 1.00 10.00 H new ATOM 0 HG3 LYS A 41 9.305 1.634 16.067 1.00 10.00 H new ATOM 0 HD2 LYS A 41 9.103 1.812 13.624 1.00 10.00 H new ATOM 0 HD3 LYS A 41 7.649 0.833 13.627 1.00 10.00 H new ATOM 0 HE2 LYS A 41 6.385 2.569 14.783 1.00 10.00 H new ATOM 0 HE3 LYS A 41 7.835 3.504 15.090 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.205 3.910 13.021 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.851 4.330 13.018 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.344 2.879 12.297 1.00 10.00 H new ATOM 609 N GLU A 42 8.852 -0.096 18.513 1.00 10.00 N ATOM 610 CA GLU A 42 7.908 -0.069 19.633 1.00 10.00 C ATOM 611 C GLU A 42 7.002 1.145 19.436 1.00 10.00 C ATOM 612 O GLU A 42 7.482 2.182 18.970 1.00 10.00 O ATOM 613 CB GLU A 42 8.680 -0.006 20.964 1.00 10.00 C ATOM 614 CG GLU A 42 9.265 -1.381 21.333 1.00 10.00 C ATOM 615 CD GLU A 42 10.330 -1.372 22.450 1.00 10.00 C ATOM 616 OE1 GLU A 42 10.421 -0.377 23.190 1.00 10.00 O ATOM 617 OE2 GLU A 42 11.057 -2.397 22.544 1.00 10.00 O ATOM 0 H GLU A 42 9.327 0.794 18.363 1.00 10.00 H new ATOM 0 HA GLU A 42 7.298 -0.972 19.665 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.484 0.726 20.887 1.00 10.00 H new ATOM 0 HB3 GLU A 42 8.015 0.334 21.758 1.00 10.00 H new ATOM 0 HG2 GLU A 42 8.448 -2.034 21.640 1.00 10.00 H new ATOM 0 HG3 GLU A 42 9.706 -1.821 20.438 1.00 10.00 H new ATOM 624 N ILE A 43 5.715 1.009 19.756 1.00 10.00 N ATOM 625 CA ILE A 43 4.674 1.982 19.437 1.00 10.00 C ATOM 626 C ILE A 43 3.719 2.165 20.620 1.00 10.00 C ATOM 627 O ILE A 43 3.532 1.252 21.425 1.00 10.00 O ATOM 628 CB ILE A 43 3.892 1.549 18.170 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.223 0.160 18.322 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.804 1.591 16.929 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.234 -0.202 17.210 1.00 10.00 C ATOM 0 H ILE A 43 5.360 0.196 20.258 1.00 10.00 H new ATOM 0 HA ILE A 43 5.155 2.939 19.236 1.00 10.00 H new ATOM 0 HB ILE A 43 3.083 2.267 18.036 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.002 -0.601 18.358 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.701 0.127 19.278 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.237 1.284 16.050 1.00 10.00 H new ATOM 0 HG22 ILE A 43 5.176 2.605 16.785 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.646 0.913 17.073 1.00 10.00 H new ATOM 0 HD11 ILE A 43 1.817 -1.191 17.402 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.429 0.533 17.185 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.751 -0.206 16.250 1.00 10.00 H new ATOM 643 N VAL A 44 3.075 3.333 20.683 1.00 10.00 N ATOM 644 CA VAL A 44 2.101 3.693 21.710 1.00 10.00 C ATOM 645 C VAL A 44 0.730 3.683 21.036 1.00 10.00 C ATOM 646 O VAL A 44 0.545 4.361 20.023 1.00 10.00 O ATOM 647 CB VAL A 44 2.447 5.089 22.283 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.582 5.445 23.501 1.00 10.00 C ATOM 649 CG2 VAL A 44 3.919 5.207 22.709 1.00 10.00 C ATOM 0 H VAL A 44 3.223 4.075 19.999 1.00 10.00 H new ATOM 0 HA VAL A 44 2.109 2.993 22.546 1.00 10.00 H new ATOM 0 HB VAL A 44 2.247 5.782 21.465 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.860 6.433 23.869 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.531 5.448 23.212 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.740 4.707 24.288 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.105 6.206 23.103 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.135 4.467 23.480 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.562 5.031 21.847 1.00 10.00 H new ATOM 659 N ARG A 45 -0.231 2.927 21.579 1.00 10.00 N ATOM 660 CA ARG A 45 -1.588 2.782 21.047 1.00 10.00 C ATOM 661 C ARG A 45 -2.541 2.970 22.218 1.00 10.00 C ATOM 662 O ARG A 45 -2.238 2.472 23.299 1.00 10.00 O ATOM 663 CB ARG A 45 -1.782 1.367 20.466 1.00 10.00 C ATOM 664 CG ARG A 45 -0.896 0.968 19.274 1.00 10.00 C ATOM 665 CD ARG A 45 -1.252 1.679 17.962 1.00 10.00 C ATOM 666 NE ARG A 45 -0.505 2.933 17.851 1.00 10.00 N ATOM 667 CZ ARG A 45 0.411 3.238 16.935 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.483 2.619 15.754 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.311 4.147 17.243 1.00 10.00 N ATOM 0 H ARG A 45 -0.079 2.382 22.428 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.770 3.509 20.256 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.614 0.647 21.267 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.824 1.267 20.161 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.144 1.183 19.520 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.972 -0.109 19.123 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -1.021 1.033 17.115 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.323 1.880 17.927 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.708 3.648 18.549 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.181 1.880 15.524 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.202 2.886 15.082 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.292 4.593 18.160 1.00 10.00 H new ATOM 0 HH22 ARG A 45 2.028 4.405 16.565 1.00 10.00 H new ATOM 683 N GLY A 46 -3.690 3.601 22.038 1.00 10.00 N ATOM 684 CA GLY A 46 -4.689 3.641 23.094 1.00 10.00 C ATOM 685 C GLY A 46 -5.949 4.335 22.633 1.00 10.00 C ATOM 686 O GLY A 46 -5.878 5.425 22.090 1.00 10.00 O ATOM 0 H GLY A 46 -3.953 4.088 21.181 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.926 2.626 23.412 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.283 4.160 23.962 1.00 10.00 H new ATOM 690 N TYR A 47 -7.090 3.700 22.888 1.00 10.00 N ATOM 691 CA TYR A 47 -8.377 4.178 22.404 1.00 10.00 C ATOM 692 C TYR A 47 -9.443 3.938 23.463 1.00 10.00 C ATOM 693 O TYR A 47 -9.469 2.880 24.099 1.00 10.00 O ATOM 694 CB TYR A 47 -8.745 3.451 21.111 1.00 10.00 C ATOM 695 CG TYR A 47 -7.665 3.450 20.045 1.00 10.00 C ATOM 696 CD1 TYR A 47 -7.487 4.570 19.215 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.821 2.329 19.903 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.474 4.571 18.239 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.814 2.316 18.922 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.639 3.444 18.080 1.00 10.00 C ATOM 701 OH TYR A 47 -4.686 3.421 17.114 1.00 10.00 O ATOM 0 H TYR A 47 -7.146 2.841 23.435 1.00 10.00 H new ATOM 0 HA TYR A 47 -8.313 5.247 22.201 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.997 2.418 21.352 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.643 3.910 20.697 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -8.129 5.431 19.327 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.949 1.475 20.552 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -6.335 5.437 17.609 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -5.177 1.451 18.810 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.978 3.965 16.353 1.00 10.00 H new ATOM 711 N LYS A 48 -10.329 4.915 23.651 1.00 10.00 N ATOM 712 CA LYS A 48 -11.304 4.926 24.739 1.00 10.00 C ATOM 713 C LYS A 48 -12.375 3.840 24.574 1.00 10.00 C ATOM 714 O LYS A 48 -12.954 3.436 25.573 1.00 10.00 O ATOM 715 CB LYS A 48 -11.900 6.340 24.832 1.00 10.00 C ATOM 716 CG LYS A 48 -12.637 6.604 26.152 1.00 10.00 C ATOM 717 CD LYS A 48 -12.992 8.092 26.260 1.00 10.00 C ATOM 718 CE LYS A 48 -13.776 8.374 27.546 1.00 10.00 C ATOM 719 NZ LYS A 48 -14.104 9.809 27.672 1.00 10.00 N ATOM 0 H LYS A 48 -10.390 5.732 23.043 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.807 4.683 25.679 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -11.100 7.072 24.718 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -12.591 6.491 24.002 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -13.543 6.000 26.200 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -12.011 6.308 26.994 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -12.081 8.690 26.246 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -13.583 8.393 25.395 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.695 7.787 27.550 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -13.190 8.056 28.408 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -14.635 9.968 28.552 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -13.226 10.365 27.692 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -14.683 10.105 26.861 1.00 10.00 H new ATOM 733 N TRP A 49 -12.625 3.362 23.349 1.00 10.00 N ATOM 734 CA TRP A 49 -13.572 2.273 23.120 1.00 10.00 C ATOM 735 C TRP A 49 -13.098 0.945 23.733 1.00 10.00 C ATOM 736 O TRP A 49 -13.915 0.056 23.894 1.00 10.00 O ATOM 737 CB TRP A 49 -13.895 2.130 21.618 1.00 10.00 C ATOM 738 CG TRP A 49 -12.739 2.024 20.663 1.00 10.00 C ATOM 739 CD1 TRP A 49 -12.376 2.984 19.780 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.773 0.937 20.478 1.00 10.00 C ATOM 741 NE1 TRP A 49 -11.256 2.582 19.083 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.802 1.360 19.523 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.588 -0.350 21.030 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.656 0.612 19.225 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.427 -1.101 20.764 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.443 -0.604 19.894 1.00 10.00 C ATOM 0 H TRP A 49 -12.181 3.716 22.501 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.496 2.534 23.637 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.517 1.244 21.491 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.498 2.988 21.321 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.888 3.925 19.642 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.819 3.122 18.336 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.353 -0.766 21.669 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.947 0.965 18.491 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.292 -2.065 21.232 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.527 -1.155 19.740 1.00 10.00 H new ATOM 757 N ALA A 50 -11.794 0.784 24.008 1.00 10.00 N ATOM 758 CA ALA A 50 -11.253 -0.476 24.500 1.00 10.00 C ATOM 759 C ALA A 50 -11.879 -0.846 25.842 1.00 10.00 C ATOM 760 O ALA A 50 -11.779 -0.077 26.810 1.00 10.00 O ATOM 761 CB ALA A 50 -9.732 -0.381 24.616 1.00 10.00 C ATOM 0 H ALA A 50 -11.098 1.521 23.894 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.499 -1.265 23.789 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.335 -1.327 24.984 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.305 -0.166 23.636 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.469 0.417 25.310 1.00 10.00 H new ATOM 767 N GLU A 51 -12.403 -2.064 25.933 1.00 10.00 N ATOM 768 CA GLU A 51 -12.924 -2.601 27.186 1.00 10.00 C ATOM 769 C GLU A 51 -11.764 -2.928 28.127 1.00 10.00 C ATOM 770 O GLU A 51 -11.840 -2.716 29.349 1.00 10.00 O ATOM 771 CB GLU A 51 -13.769 -3.857 26.917 1.00 10.00 C ATOM 772 CG GLU A 51 -15.101 -3.560 26.206 1.00 10.00 C ATOM 773 CD GLU A 51 -16.088 -2.754 27.085 1.00 10.00 C ATOM 774 OE1 GLU A 51 -16.759 -3.383 27.933 1.00 10.00 O ATOM 775 OE2 GLU A 51 -16.172 -1.522 26.920 1.00 10.00 O ATOM 0 H GLU A 51 -12.479 -2.705 25.143 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.562 -1.854 27.657 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.189 -4.552 26.310 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -13.975 -4.356 27.864 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -14.902 -3.004 25.290 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.568 -4.500 25.913 1.00 10.00 H new ATOM 782 N TYR A 52 -10.628 -3.401 27.586 1.00 10.00 N ATOM 783 CA TYR A 52 -9.458 -3.860 28.314 1.00 10.00 C ATOM 784 C TYR A 52 -8.217 -3.577 27.468 1.00 10.00 C ATOM 785 O TYR A 52 -8.317 -3.367 26.269 1.00 10.00 O ATOM 786 CB TYR A 52 -9.565 -5.374 28.581 1.00 10.00 C ATOM 787 CG TYR A 52 -10.759 -5.801 29.416 1.00 10.00 C ATOM 788 CD1 TYR A 52 -10.733 -5.644 30.817 1.00 10.00 C ATOM 789 CD2 TYR A 52 -11.895 -6.353 28.794 1.00 10.00 C ATOM 790 CE1 TYR A 52 -11.843 -6.026 31.594 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.008 -6.737 29.564 1.00 10.00 C ATOM 792 CZ TYR A 52 -12.994 -6.572 30.967 1.00 10.00 C ATOM 793 OH TYR A 52 -14.067 -6.947 31.716 1.00 10.00 O ATOM 0 H TYR A 52 -10.507 -3.472 26.576 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.390 -3.339 29.269 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -9.607 -5.893 27.624 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -8.655 -5.703 29.082 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -9.858 -5.229 31.296 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -11.912 -6.482 27.722 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -11.819 -5.904 32.667 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -13.876 -7.160 29.081 1.00 10.00 H new ATOM 0 HH TYR A 52 -14.769 -7.299 31.129 1.00 10.00 H new ATOM 803 N HIS A 53 -7.029 -3.656 28.082 1.00 10.00 N ATOM 804 CA HIS A 53 -5.757 -3.501 27.367 1.00 10.00 C ATOM 805 C HIS A 53 -5.646 -4.523 26.225 1.00 10.00 C ATOM 806 O HIS A 53 -5.160 -4.211 25.144 1.00 10.00 O ATOM 807 CB HIS A 53 -4.589 -3.657 28.351 1.00 10.00 C ATOM 808 CG HIS A 53 -4.699 -2.785 29.579 1.00 10.00 C ATOM 809 ND1 HIS A 53 -4.735 -1.393 29.589 1.00 10.00 N ATOM 810 CD2 HIS A 53 -4.788 -3.235 30.866 1.00 10.00 C ATOM 811 CE1 HIS A 53 -4.798 -1.034 30.878 1.00 10.00 C ATOM 812 NE2 HIS A 53 -4.823 -2.120 31.670 1.00 10.00 N ATOM 0 H HIS A 53 -6.923 -3.828 29.082 1.00 10.00 H new ATOM 0 HA HIS A 53 -5.718 -2.504 26.927 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -4.527 -4.700 28.663 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -3.658 -3.423 27.834 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -4.824 -4.265 31.189 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -4.825 -0.014 31.232 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -4.861 -2.117 32.689 1.00 10.00 H new ATOM 820 N ALA A 54 -6.122 -5.749 26.478 1.00 10.00 N ATOM 821 CA ALA A 54 -6.155 -6.829 25.496 1.00 10.00 C ATOM 822 C ALA A 54 -7.038 -6.512 24.278 1.00 10.00 C ATOM 823 O ALA A 54 -6.795 -7.067 23.221 1.00 10.00 O ATOM 824 CB ALA A 54 -6.637 -8.115 26.178 1.00 10.00 C ATOM 0 H ALA A 54 -6.500 -6.018 27.387 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.141 -6.954 25.115 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -6.664 -8.925 25.449 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -5.954 -8.376 26.986 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -7.637 -7.959 26.584 1.00 10.00 H new ATOM 830 N ASP A 55 -8.022 -5.624 24.429 1.00 10.00 N ATOM 831 CA ASP A 55 -8.898 -5.239 23.320 1.00 10.00 C ATOM 832 C ASP A 55 -8.058 -4.478 22.290 1.00 10.00 C ATOM 833 O ASP A 55 -8.053 -4.795 21.104 1.00 10.00 O ATOM 834 CB ASP A 55 -10.049 -4.375 23.869 1.00 10.00 C ATOM 835 CG ASP A 55 -11.260 -4.198 22.938 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.241 -4.701 21.782 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.219 -3.566 23.400 1.00 10.00 O ATOM 0 H ASP A 55 -8.233 -5.157 25.311 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.336 -6.112 22.836 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.395 -4.817 24.803 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -9.654 -3.388 24.110 1.00 10.00 H new ATOM 842 N ILE A 56 -7.246 -3.526 22.775 1.00 10.00 N ATOM 843 CA ILE A 56 -6.323 -2.763 21.942 1.00 10.00 C ATOM 844 C ILE A 56 -5.308 -3.734 21.327 1.00 10.00 C ATOM 845 O ILE A 56 -5.096 -3.695 20.117 1.00 10.00 O ATOM 846 CB ILE A 56 -5.604 -1.644 22.743 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.528 -0.820 23.664 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.898 -0.709 21.738 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.768 -0.048 24.747 1.00 10.00 C ATOM 0 H ILE A 56 -7.216 -3.268 23.761 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.888 -2.263 21.155 1.00 10.00 H new ATOM 0 HB ILE A 56 -4.896 -2.135 23.411 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.100 -0.116 23.059 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.246 -1.488 24.139 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.385 0.086 22.279 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -4.173 -1.279 21.158 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.637 -0.273 21.066 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.475 0.510 25.360 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.218 -0.749 25.375 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.069 0.644 24.278 1.00 10.00 H new ATOM 861 N TYR A 57 -4.668 -4.570 22.154 1.00 10.00 N ATOM 862 CA TYR A 57 -3.636 -5.491 21.687 1.00 10.00 C ATOM 863 C TYR A 57 -4.151 -6.391 20.555 1.00 10.00 C ATOM 864 O TYR A 57 -3.433 -6.572 19.574 1.00 10.00 O ATOM 865 CB TYR A 57 -3.101 -6.307 22.873 1.00 10.00 C ATOM 866 CG TYR A 57 -1.967 -7.282 22.582 1.00 10.00 C ATOM 867 CD1 TYR A 57 -0.922 -6.950 21.694 1.00 10.00 C ATOM 868 CD2 TYR A 57 -1.935 -8.522 23.251 1.00 10.00 C ATOM 869 CE1 TYR A 57 0.139 -7.848 21.476 1.00 10.00 C ATOM 870 CE2 TYR A 57 -0.874 -9.424 23.044 1.00 10.00 C ATOM 871 CZ TYR A 57 0.170 -9.085 22.157 1.00 10.00 C ATOM 872 OH TYR A 57 1.234 -9.919 21.997 1.00 10.00 O ATOM 0 H TYR A 57 -4.852 -4.624 23.156 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.813 -4.914 21.266 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.761 -5.610 23.639 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -3.931 -6.870 23.300 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.937 -6.001 21.179 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -2.733 -8.783 23.930 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.930 -7.591 20.787 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -0.859 -10.372 23.562 1.00 10.00 H new ATOM 0 HH TYR A 57 1.100 -10.727 22.535 1.00 10.00 H new ATOM 882 N ASP A 58 -5.380 -6.891 20.657 1.00 10.00 N ATOM 883 CA ASP A 58 -5.984 -7.722 19.612 1.00 10.00 C ATOM 884 C ASP A 58 -6.188 -6.943 18.312 1.00 10.00 C ATOM 885 O ASP A 58 -5.771 -7.402 17.249 1.00 10.00 O ATOM 886 CB ASP A 58 -7.324 -8.301 20.082 1.00 10.00 C ATOM 887 CG ASP A 58 -7.990 -9.129 18.957 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.528 -10.257 18.708 1.00 10.00 O ATOM 889 OD2 ASP A 58 -8.964 -8.609 18.363 1.00 10.00 O ATOM 0 H ASP A 58 -5.986 -6.734 21.462 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.289 -8.538 19.414 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.166 -8.930 20.958 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -7.988 -7.492 20.386 1.00 10.00 H new ATOM 894 N LYS A 59 -6.751 -5.721 18.391 1.00 10.00 N ATOM 895 CA LYS A 59 -6.958 -4.877 17.209 1.00 10.00 C ATOM 896 C LYS A 59 -5.622 -4.611 16.524 1.00 10.00 C ATOM 897 O LYS A 59 -5.512 -4.755 15.311 1.00 10.00 O ATOM 898 CB LYS A 59 -7.642 -3.544 17.578 1.00 10.00 C ATOM 899 CG LYS A 59 -9.169 -3.548 17.412 1.00 10.00 C ATOM 900 CD LYS A 59 -9.897 -4.413 18.447 1.00 10.00 C ATOM 901 CE LYS A 59 -11.414 -4.359 18.239 1.00 10.00 C ATOM 902 NZ LYS A 59 -12.129 -5.203 19.226 1.00 10.00 N ATOM 0 H LYS A 59 -7.069 -5.301 19.264 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.618 -5.409 16.524 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -7.402 -3.301 18.613 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.223 -2.751 16.958 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -9.536 -2.524 17.484 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -9.416 -3.906 16.413 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -9.553 -5.444 18.371 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -9.652 -4.068 19.451 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -11.757 -3.328 18.324 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -11.656 -4.693 17.230 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -13.067 -4.796 19.416 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -12.240 -6.164 18.845 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -11.583 -5.242 20.110 1.00 10.00 H new ATOM 916 N VAL A 60 -4.623 -4.183 17.298 1.00 10.00 N ATOM 917 CA VAL A 60 -3.331 -3.785 16.764 1.00 10.00 C ATOM 918 C VAL A 60 -2.640 -5.012 16.146 1.00 10.00 C ATOM 919 O VAL A 60 -2.154 -4.906 15.029 1.00 10.00 O ATOM 920 CB VAL A 60 -2.536 -3.081 17.879 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.110 -2.696 17.452 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.250 -1.778 18.307 1.00 10.00 C ATOM 0 H VAL A 60 -4.693 -4.105 18.313 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.421 -3.062 15.953 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.479 -3.799 18.697 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.602 -2.204 18.281 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.560 -3.594 17.171 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.156 -2.017 16.601 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.677 -1.291 19.096 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.330 -1.109 17.450 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.248 -2.014 18.677 1.00 10.00 H new ATOM 932 N SER A 61 -2.639 -6.164 16.821 1.00 10.00 N ATOM 933 CA SER A 61 -2.034 -7.376 16.269 1.00 10.00 C ATOM 934 C SER A 61 -2.672 -7.739 14.921 1.00 10.00 C ATOM 935 O SER A 61 -1.956 -8.045 13.971 1.00 10.00 O ATOM 936 CB SER A 61 -2.156 -8.536 17.263 1.00 10.00 C ATOM 937 OG SER A 61 -1.568 -8.189 18.509 1.00 10.00 O ATOM 0 H SER A 61 -3.049 -6.282 17.747 1.00 10.00 H new ATOM 0 HA SER A 61 -0.975 -7.184 16.097 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.206 -8.789 17.408 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.667 -9.422 16.858 1.00 10.00 H new ATOM 0 HG SER A 61 -2.228 -7.722 19.063 1.00 10.00 H new ATOM 943 N GLY A 62 -4.001 -7.644 14.824 1.00 10.00 N ATOM 944 CA GLY A 62 -4.713 -7.877 13.578 1.00 10.00 C ATOM 945 C GLY A 62 -4.270 -6.889 12.503 1.00 10.00 C ATOM 946 O GLY A 62 -3.998 -7.297 11.371 1.00 10.00 O ATOM 0 H GLY A 62 -4.607 -7.404 15.609 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.533 -8.896 13.237 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.786 -7.782 13.745 1.00 10.00 H new ATOM 950 N ASP A 63 -4.184 -5.599 12.829 1.00 10.00 N ATOM 951 CA ASP A 63 -3.827 -4.565 11.863 1.00 10.00 C ATOM 952 C ASP A 63 -2.417 -4.777 11.336 1.00 10.00 C ATOM 953 O ASP A 63 -2.232 -4.827 10.122 1.00 10.00 O ATOM 954 CB ASP A 63 -3.954 -3.156 12.454 1.00 10.00 C ATOM 955 CG ASP A 63 -3.733 -2.101 11.348 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.730 -1.717 10.711 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.568 -1.695 11.132 1.00 10.00 O ATOM 0 H ASP A 63 -4.360 -5.244 13.769 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.534 -4.649 11.038 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -4.940 -3.027 12.900 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.223 -3.019 13.251 1.00 10.00 H new ATOM 962 N MET A 64 -1.432 -4.999 12.215 1.00 10.00 N ATOM 963 CA MET A 64 -0.050 -5.213 11.804 1.00 10.00 C ATOM 964 C MET A 64 0.060 -6.432 10.897 1.00 10.00 C ATOM 965 O MET A 64 0.806 -6.380 9.921 1.00 10.00 O ATOM 966 CB MET A 64 0.876 -5.375 13.015 1.00 10.00 C ATOM 967 CG MET A 64 1.405 -4.028 13.526 1.00 10.00 C ATOM 968 SD MET A 64 0.190 -2.971 14.343 1.00 10.00 S ATOM 969 CE MET A 64 0.260 -1.460 13.364 1.00 10.00 C ATOM 0 H MET A 64 -1.575 -5.034 13.224 1.00 10.00 H new ATOM 0 HA MET A 64 0.266 -4.330 11.249 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.337 -5.879 13.817 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.716 -6.014 12.744 1.00 10.00 H new ATOM 0 HG2 MET A 64 2.221 -4.219 14.223 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.828 -3.481 12.683 1.00 10.00 H new ATOM 0 HE1 MET A 64 -0.443 -0.732 13.768 1.00 10.00 H new ATOM 0 HE2 MET A 64 1.269 -1.049 13.401 1.00 10.00 H new ATOM 0 HE3 MET A 64 -0.003 -1.684 12.330 1.00 10.00 H new ATOM 979 N GLN A 65 -0.682 -7.503 11.179 1.00 10.00 N ATOM 980 CA GLN A 65 -0.676 -8.689 10.338 1.00 10.00 C ATOM 981 C GLN A 65 -1.208 -8.366 8.935 1.00 10.00 C ATOM 982 O GLN A 65 -0.680 -8.892 7.956 1.00 10.00 O ATOM 983 CB GLN A 65 -1.447 -9.808 11.048 1.00 10.00 C ATOM 984 CG GLN A 65 -0.614 -10.372 12.219 1.00 10.00 C ATOM 985 CD GLN A 65 -1.410 -11.264 13.179 1.00 10.00 C ATOM 986 OE1 GLN A 65 -2.505 -11.727 12.874 1.00 10.00 O ATOM 987 NE2 GLN A 65 -0.873 -11.549 14.354 1.00 10.00 N ATOM 0 H GLN A 65 -1.297 -7.568 11.990 1.00 10.00 H new ATOM 0 HA GLN A 65 0.344 -9.043 10.186 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.397 -9.425 11.420 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.679 -10.604 10.341 1.00 10.00 H new ATOM 0 HG2 GLN A 65 0.220 -10.945 11.815 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.187 -9.541 12.781 1.00 10.00 H new ATOM 0 HE21 GLN A 65 0.037 -11.163 14.606 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.369 -12.154 15.008 1.00 10.00 H new ATOM 996 N LYS A 66 -2.201 -7.473 8.811 1.00 10.00 N ATOM 997 CA LYS A 66 -2.642 -6.970 7.509 1.00 10.00 C ATOM 998 C LYS A 66 -1.579 -6.086 6.838 1.00 10.00 C ATOM 999 O LYS A 66 -1.524 -6.097 5.609 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.975 -6.213 7.617 1.00 10.00 C ATOM 1001 CG LYS A 66 -5.127 -7.125 8.050 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.435 -6.332 8.175 1.00 10.00 C ATOM 1003 CE LYS A 66 -7.559 -7.270 8.626 1.00 10.00 C ATOM 1004 NZ LYS A 66 -8.862 -6.572 8.757 1.00 10.00 N ATOM 0 H LYS A 66 -2.714 -7.085 9.603 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.794 -7.845 6.877 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.871 -5.398 8.333 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -4.214 -5.762 6.654 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.252 -7.929 7.325 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.887 -7.592 9.005 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.314 -5.521 8.893 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.689 -5.876 7.218 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.657 -8.085 7.909 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -7.292 -7.718 9.583 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -9.589 -7.249 9.064 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.779 -5.810 9.460 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -9.133 -6.167 7.838 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.776 -5.338 7.599 1.00 10.00 N ATOM 1019 CA GLN A 67 0.291 -4.523 7.023 1.00 10.00 C ATOM 1020 C GLN A 67 1.363 -5.439 6.428 1.00 10.00 C ATOM 1021 O GLN A 67 1.746 -5.294 5.274 1.00 10.00 O ATOM 1022 CB GLN A 67 0.945 -3.565 8.049 1.00 10.00 C ATOM 1023 CG GLN A 67 0.015 -2.594 8.793 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.825 -1.672 7.904 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.503 -1.402 6.753 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.915 -1.155 8.438 1.00 10.00 N ATOM 0 H GLN A 67 -0.846 -5.281 8.615 1.00 10.00 H new ATOM 0 HA GLN A 67 -0.163 -3.901 6.251 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.466 -4.169 8.791 1.00 10.00 H new ATOM 0 HB3 GLN A 67 1.701 -2.977 7.529 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.659 -3.175 9.423 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.620 -1.977 9.457 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -2.173 -1.387 9.397 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.500 -0.523 7.892 1.00 10.00 H new ATOM 1035 N GLY A 68 1.852 -6.374 7.245 1.00 10.00 N ATOM 1036 CA GLY A 68 3.013 -7.204 6.971 1.00 10.00 C ATOM 1037 C GLY A 68 3.986 -7.126 8.143 1.00 10.00 C ATOM 1038 O GLY A 68 5.180 -6.884 7.948 1.00 10.00 O ATOM 0 H GLY A 68 1.429 -6.577 8.150 1.00 10.00 H new ATOM 0 HA2 GLY A 68 2.704 -8.237 6.810 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.503 -6.871 6.056 1.00 10.00 H new ATOM 1042 N CYS A 69 3.485 -7.208 9.375 1.00 10.00 N ATOM 1043 CA CYS A 69 4.219 -7.148 10.627 1.00 10.00 C ATOM 1044 C CYS A 69 3.512 -8.075 11.630 1.00 10.00 C ATOM 1045 O CYS A 69 2.438 -8.587 11.337 1.00 10.00 O ATOM 1046 CB CYS A 69 4.204 -5.694 11.135 1.00 10.00 C ATOM 1047 SG CYS A 69 5.244 -4.606 10.119 1.00 10.00 S ATOM 0 H CYS A 69 2.484 -7.326 9.529 1.00 10.00 H new ATOM 0 HA CYS A 69 5.254 -7.466 10.500 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.180 -5.321 11.134 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.552 -5.667 12.168 1.00 10.00 H new ATOM 0 HG CYS A 69 5.546 -5.209 9.007 1.00 10.00 H new ATOM 1053 N ASP A 70 4.060 -8.242 12.824 1.00 10.00 N ATOM 1054 CA ASP A 70 3.388 -8.924 13.936 1.00 10.00 C ATOM 1055 C ASP A 70 3.781 -8.245 15.248 1.00 10.00 C ATOM 1056 O ASP A 70 4.745 -7.467 15.251 1.00 10.00 O ATOM 1057 CB ASP A 70 3.736 -10.424 13.952 1.00 10.00 C ATOM 1058 CG ASP A 70 2.896 -11.212 14.982 1.00 10.00 C ATOM 1059 OD1 ASP A 70 1.712 -10.827 15.183 1.00 10.00 O ATOM 1060 OD2 ASP A 70 3.414 -12.201 15.522 1.00 10.00 O ATOM 0 H ASP A 70 4.994 -7.906 13.058 1.00 10.00 H new ATOM 0 HA ASP A 70 2.308 -8.849 13.809 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.574 -10.842 12.959 1.00 10.00 H new ATOM 0 HB3 ASP A 70 4.795 -10.546 14.181 1.00 10.00 H new ATOM 1065 N CYS A 71 3.060 -8.492 16.343 1.00 10.00 N ATOM 1066 CA CYS A 71 3.162 -7.743 17.585 1.00 10.00 C ATOM 1067 C CYS A 71 3.548 -8.613 18.789 1.00 10.00 C ATOM 1068 O CYS A 71 3.359 -9.820 18.799 1.00 10.00 O ATOM 1069 CB CYS A 71 1.815 -7.065 17.867 1.00 10.00 C ATOM 1070 SG CYS A 71 1.441 -5.837 16.593 1.00 10.00 S ATOM 0 H CYS A 71 2.370 -9.242 16.386 1.00 10.00 H new ATOM 0 HA CYS A 71 3.959 -7.011 17.455 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.024 -7.815 17.900 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.841 -6.585 18.845 1.00 10.00 H new ATOM 0 HG CYS A 71 1.317 -4.666 17.143 1.00 10.00 H new ATOM 1076 N GLU A 72 4.008 -7.931 19.841 1.00 10.00 N ATOM 1077 CA GLU A 72 4.362 -8.460 21.148 1.00 10.00 C ATOM 1078 C GLU A 72 4.029 -7.347 22.152 1.00 10.00 C ATOM 1079 O GLU A 72 4.620 -6.266 22.096 1.00 10.00 O ATOM 1080 CB GLU A 72 5.860 -8.824 21.142 1.00 10.00 C ATOM 1081 CG GLU A 72 6.431 -9.142 22.532 1.00 10.00 C ATOM 1082 CD GLU A 72 7.917 -9.572 22.454 1.00 10.00 C ATOM 1083 OE1 GLU A 72 8.796 -8.661 22.471 1.00 10.00 O ATOM 1084 OE2 GLU A 72 8.179 -10.786 22.423 1.00 10.00 O ATOM 0 H GLU A 72 4.151 -6.922 19.791 1.00 10.00 H new ATOM 0 HA GLU A 72 3.818 -9.367 21.413 1.00 10.00 H new ATOM 0 HB2 GLU A 72 6.011 -9.686 20.492 1.00 10.00 H new ATOM 0 HB3 GLU A 72 6.423 -7.997 20.710 1.00 10.00 H new ATOM 0 HG2 GLU A 72 6.339 -8.265 23.173 1.00 10.00 H new ATOM 0 HG3 GLU A 72 5.845 -9.937 22.993 1.00 10.00 H new ATOM 1091 N CYS A 73 3.028 -7.542 23.019 1.00 10.00 N ATOM 1092 CA CYS A 73 2.696 -6.557 24.043 1.00 10.00 C ATOM 1093 C CYS A 73 3.870 -6.415 25.024 1.00 10.00 C ATOM 1094 O CYS A 73 4.463 -7.413 25.422 1.00 10.00 O ATOM 1095 CB CYS A 73 1.428 -6.984 24.794 1.00 10.00 C ATOM 1096 SG CYS A 73 0.876 -5.622 25.850 1.00 10.00 S ATOM 0 H CYS A 73 2.437 -8.373 23.028 1.00 10.00 H new ATOM 0 HA CYS A 73 2.511 -5.594 23.566 1.00 10.00 H new ATOM 0 HB2 CYS A 73 0.644 -7.252 24.086 1.00 10.00 H new ATOM 0 HB3 CYS A 73 1.629 -7.869 25.397 1.00 10.00 H new ATOM 0 HG CYS A 73 0.145 -6.092 26.817 1.00 10.00 H new ATOM 1102 N LEU A 74 4.146 -5.178 25.447 1.00 10.00 N ATOM 1103 CA LEU A 74 5.140 -4.863 26.475 1.00 10.00 C ATOM 1104 C LEU A 74 4.483 -4.377 27.762 1.00 10.00 C ATOM 1105 O LEU A 74 5.160 -4.248 28.781 1.00 10.00 O ATOM 1106 CB LEU A 74 6.122 -3.800 25.962 1.00 10.00 C ATOM 1107 CG LEU A 74 6.881 -4.173 24.680 1.00 10.00 C ATOM 1108 CD1 LEU A 74 7.916 -3.084 24.383 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.598 -5.525 24.770 1.00 10.00 C ATOM 0 H LEU A 74 3.675 -4.352 25.077 1.00 10.00 H new ATOM 0 HA LEU A 74 5.683 -5.782 26.697 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.571 -2.876 25.783 1.00 10.00 H new ATOM 0 HB3 LEU A 74 6.849 -3.591 26.747 1.00 10.00 H new ATOM 0 HG LEU A 74 6.142 -4.255 23.883 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.461 -3.338 23.474 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.410 -2.128 24.247 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.615 -3.009 25.216 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.114 -5.727 23.831 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.323 -5.499 25.584 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.868 -6.312 24.959 1.00 10.00 H new ATOM 1121 N GLY A 75 3.171 -4.111 27.740 1.00 10.00 N ATOM 1122 CA GLY A 75 2.362 -3.855 28.925 1.00 10.00 C ATOM 1123 C GLY A 75 1.198 -2.914 28.632 1.00 10.00 C ATOM 1124 O GLY A 75 1.135 -2.327 27.556 1.00 10.00 O ATOM 0 H GLY A 75 2.635 -4.068 26.873 1.00 10.00 H new ATOM 0 HA2 GLY A 75 1.977 -4.799 29.311 1.00 10.00 H new ATOM 0 HA3 GLY A 75 2.989 -3.424 29.705 1.00 10.00 H new ATOM 1128 N GLY A 76 0.297 -2.750 29.610 1.00 10.00 N ATOM 1129 CA GLY A 76 -0.889 -1.903 29.508 1.00 10.00 C ATOM 1130 C GLY A 76 -0.920 -0.873 30.637 1.00 10.00 C ATOM 1131 O GLY A 76 -0.235 -1.036 31.644 1.00 10.00 O ATOM 0 H GLY A 76 0.379 -3.216 30.514 1.00 10.00 H new ATOM 0 HA2 GLY A 76 -0.895 -1.393 28.545 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -1.787 -2.520 29.548 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.705 0.187 30.462 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.794 1.330 31.358 1.00 10.00 C ATOM 1137 C GLY A 77 -2.897 2.262 30.867 1.00 10.00 C ATOM 1138 O GLY A 77 -3.787 1.857 30.118 1.00 10.00 O ATOM 0 H GLY A 77 -2.323 0.274 29.655 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -2.008 0.996 32.374 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.841 1.858 31.390 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.897 3.526 31.291 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.867 4.524 30.843 1.00 10.00 C ATOM 1144 C ARG A 78 -3.219 5.894 30.771 1.00 10.00 C ATOM 1145 O ARG A 78 -2.171 6.120 31.368 1.00 10.00 O ATOM 1146 CB ARG A 78 -5.124 4.516 31.728 1.00 10.00 C ATOM 1147 CG ARG A 78 -4.870 4.831 33.211 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.175 4.839 34.018 1.00 10.00 C ATOM 1149 NE ARG A 78 -6.841 3.521 33.991 1.00 10.00 N ATOM 1150 CZ ARG A 78 -7.313 2.843 35.051 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -7.346 3.395 36.255 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -7.763 1.604 34.851 1.00 10.00 N ATOM 0 H ARG A 78 -2.218 3.888 31.960 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.196 4.265 29.837 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -5.834 5.243 31.333 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.597 3.537 31.655 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -4.187 4.091 33.629 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -4.381 5.801 33.299 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -5.963 5.119 35.050 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -6.848 5.595 33.614 1.00 10.00 H new ATOM 0 HE ARG A 78 -6.954 3.082 33.077 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -7.010 4.349 36.388 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -7.708 2.866 37.049 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -7.742 1.199 33.915 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -8.128 1.061 35.634 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.863 6.808 30.058 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.402 8.165 29.806 1.00 10.00 C ATOM 1168 C ILE A 79 -4.572 9.073 30.178 1.00 10.00 C ATOM 1169 O ILE A 79 -5.729 8.655 30.116 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.964 8.316 28.323 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.873 7.276 27.971 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.488 9.750 28.015 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.218 7.392 26.588 1.00 10.00 C ATOM 0 H ILE A 79 -4.763 6.614 29.619 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.524 8.429 30.395 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.835 8.125 27.696 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -1.088 7.341 28.724 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -2.313 6.282 28.055 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.190 9.818 26.969 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.300 10.452 28.207 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.638 9.996 28.651 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.473 6.605 26.471 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -1.980 7.289 25.815 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -0.735 8.365 26.495 1.00 10.00 H new ATOM 1185 N SER A 80 -4.283 10.309 30.595 1.00 10.00 N ATOM 1186 CA SER A 80 -5.273 11.324 30.903 1.00 10.00 C ATOM 1187 C SER A 80 -4.778 12.680 30.403 1.00 10.00 C ATOM 1188 O SER A 80 -3.575 12.925 30.368 1.00 10.00 O ATOM 1189 CB SER A 80 -5.536 11.312 32.415 1.00 10.00 C ATOM 1190 OG SER A 80 -4.343 11.497 33.175 1.00 10.00 O ATOM 0 H SER A 80 -3.325 10.632 30.729 1.00 10.00 H new ATOM 0 HA SER A 80 -6.218 11.120 30.399 1.00 10.00 H new ATOM 0 HB2 SER A 80 -6.248 12.099 32.664 1.00 10.00 H new ATOM 0 HB3 SER A 80 -5.998 10.365 32.693 1.00 10.00 H new ATOM 0 HG SER A 80 -4.559 11.484 34.131 1.00 10.00 H new ATOM 1314 N ILE A 88 -0.613 15.975 29.776 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.693 14.540 29.528 1.00 10.00 C ATOM 1316 C ILE A 88 0.028 13.846 30.683 1.00 10.00 C ATOM 1317 O ILE A 88 1.176 14.166 31.018 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.141 14.139 28.140 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.972 14.799 27.017 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.202 12.603 27.972 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.453 14.521 25.601 1.00 10.00 C ATOM 0 HA ILE A 88 -1.735 14.221 29.495 1.00 10.00 H new ATOM 0 HB ILE A 88 0.893 14.478 28.071 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.002 14.449 27.089 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.990 15.877 27.180 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.188 12.328 26.992 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.398 12.128 28.748 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.236 12.268 28.057 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.093 15.021 24.874 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.566 14.897 25.506 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.462 13.447 25.415 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.639 12.877 31.313 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.064 12.050 32.358 1.00 10.00 C ATOM 1335 C HIS A 89 -0.460 10.601 32.104 1.00 10.00 C ATOM 1336 O HIS A 89 -1.548 10.357 31.581 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.529 12.548 33.732 1.00 10.00 C ATOM 1338 CG HIS A 89 0.224 11.898 34.865 1.00 10.00 C ATOM 1339 ND1 HIS A 89 1.512 12.195 35.255 1.00 10.00 N ATOM 1340 CD2 HIS A 89 -0.224 10.888 35.675 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.830 11.380 36.279 1.00 10.00 C ATOM 1342 NE2 HIS A 89 0.801 10.576 36.572 1.00 10.00 N ATOM 0 H HIS A 89 -1.610 12.647 31.103 1.00 10.00 H new ATOM 0 HA HIS A 89 1.024 12.114 32.348 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.399 13.629 33.786 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.595 12.349 33.846 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -1.195 10.417 35.629 1.00 10.00 H new ATOM 0 HE1 HIS A 89 2.781 11.376 36.791 1.00 10.00 H new ATOM 0 HE2 HIS A 89 0.771 9.871 37.309 1.00 10.00 H new ATOM 1350 N VAL A 90 0.394 9.665 32.491 1.00 10.00 N ATOM 1351 CA VAL A 90 0.291 8.252 32.147 1.00 10.00 C ATOM 1352 C VAL A 90 0.454 7.440 33.436 1.00 10.00 C ATOM 1353 O VAL A 90 1.387 7.678 34.193 1.00 10.00 O ATOM 1354 CB VAL A 90 1.369 7.912 31.095 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.240 6.465 30.617 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.303 8.843 29.865 1.00 10.00 C ATOM 0 H VAL A 90 1.205 9.874 33.073 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.677 8.010 31.709 1.00 10.00 H new ATOM 0 HB VAL A 90 2.328 8.055 31.592 1.00 10.00 H new ATOM 0 HG11 VAL A 90 2.013 6.256 29.877 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.357 5.790 31.465 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.258 6.316 30.168 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.081 8.563 29.155 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.327 8.749 29.389 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.455 9.875 30.181 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.462 6.520 33.724 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.506 5.791 34.993 1.00 10.00 C ATOM 1368 C TYR A 91 -1.263 4.472 34.805 1.00 10.00 C ATOM 1369 O TYR A 91 -1.493 4.041 33.675 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.105 6.695 36.093 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.587 7.025 35.983 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.055 7.923 35.000 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.497 6.474 36.908 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.421 8.254 34.933 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.861 6.811 36.854 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.330 7.706 35.868 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.656 8.011 35.807 1.00 10.00 O ATOM 0 H TYR A 91 -1.204 6.255 33.077 1.00 10.00 H new ATOM 0 HA TYR A 91 0.500 5.528 35.320 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.935 6.214 37.057 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.549 7.632 36.102 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.361 8.358 34.296 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.144 5.788 37.664 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -4.776 8.927 34.167 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.551 6.385 37.568 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.132 7.545 36.526 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.670 3.821 35.898 1.00 10.00 N ATOM 1388 CA GLY A 92 -2.269 2.491 35.862 1.00 10.00 C ATOM 1389 C GLY A 92 -1.206 1.414 35.618 1.00 10.00 C ATOM 1390 O GLY A 92 -0.013 1.702 35.665 1.00 10.00 O ATOM 0 H GLY A 92 -1.591 4.208 36.838 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.782 2.294 36.804 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -3.022 2.449 35.075 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.649 0.186 35.357 1.00 10.00 N ATOM 1395 CA TYR A 93 -0.831 -0.924 34.881 1.00 10.00 C ATOM 1396 C TYR A 93 -1.777 -1.970 34.274 1.00 10.00 C ATOM 1397 O TYR A 93 -2.981 -1.719 34.120 1.00 10.00 O ATOM 1398 CB TYR A 93 0.085 -1.497 35.990 1.00 10.00 C ATOM 1399 CG TYR A 93 -0.574 -2.141 37.198 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -1.009 -1.337 38.268 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -0.671 -3.543 37.299 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -1.565 -1.925 39.419 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -1.231 -4.136 38.447 1.00 10.00 C ATOM 1404 CZ TYR A 93 -1.687 -3.327 39.515 1.00 10.00 C ATOM 1405 OH TYR A 93 -2.231 -3.894 40.628 1.00 10.00 O ATOM 0 H TYR A 93 -2.629 -0.072 35.477 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.137 -0.580 34.114 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.740 -2.238 35.532 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.721 -0.688 36.349 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -0.916 -0.263 38.205 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -0.314 -4.166 36.492 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -1.900 -1.300 40.233 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -1.313 -5.211 38.513 1.00 10.00 H new ATOM 0 HH TYR A 93 -2.240 -4.869 40.527 1.00 10.00 H new ATOM 1415 N SER A 94 -1.263 -3.160 33.940 1.00 10.00 N ATOM 1416 CA SER A 94 -2.047 -4.304 33.511 1.00 10.00 C ATOM 1417 C SER A 94 -1.520 -5.528 34.245 1.00 10.00 C ATOM 1418 O SER A 94 -0.312 -5.734 34.312 1.00 10.00 O ATOM 1419 CB SER A 94 -1.907 -4.479 31.998 1.00 10.00 C ATOM 1420 OG SER A 94 -2.658 -5.603 31.559 1.00 10.00 O ATOM 0 H SER A 94 -0.261 -3.350 33.964 1.00 10.00 H new ATOM 0 HA SER A 94 -3.103 -4.163 33.739 1.00 10.00 H new ATOM 0 HB2 SER A 94 -2.253 -3.580 31.488 1.00 10.00 H new ATOM 0 HB3 SER A 94 -0.857 -4.610 31.736 1.00 10.00 H new ATOM 0 HG SER A 94 -2.561 -5.703 30.589 1.00 10.00 H new ATOM 1426 N MET A 95 -2.429 -6.355 34.758 1.00 10.00 N ATOM 1427 CA MET A 95 -2.083 -7.674 35.285 1.00 10.00 C ATOM 1428 C MET A 95 -1.853 -8.684 34.146 1.00 10.00 C ATOM 1429 O MET A 95 -1.275 -9.728 34.393 1.00 10.00 O ATOM 1430 CB MET A 95 -3.193 -8.171 36.228 1.00 10.00 C ATOM 1431 CG MET A 95 -3.282 -7.325 37.506 1.00 10.00 C ATOM 1432 SD MET A 95 -4.441 -7.941 38.762 1.00 10.00 S ATOM 1433 CE MET A 95 -6.031 -7.621 37.950 1.00 10.00 C ATOM 0 H MET A 95 -3.422 -6.131 34.820 1.00 10.00 H new ATOM 0 HA MET A 95 -1.153 -7.586 35.846 1.00 10.00 H new ATOM 0 HB2 MET A 95 -4.150 -8.144 35.708 1.00 10.00 H new ATOM 0 HB3 MET A 95 -3.004 -9.211 36.494 1.00 10.00 H new ATOM 0 HG2 MET A 95 -2.289 -7.262 37.951 1.00 10.00 H new ATOM 0 HG3 MET A 95 -3.573 -6.311 37.232 1.00 10.00 H new ATOM 0 HE1 MET A 95 -6.844 -7.930 38.607 1.00 10.00 H new ATOM 0 HE2 MET A 95 -6.122 -6.556 37.736 1.00 10.00 H new ATOM 0 HE3 MET A 95 -6.083 -8.184 37.018 1.00 10.00 H new ATOM 1443 N ALA A 96 -2.308 -8.386 32.917 1.00 10.00 N ATOM 1444 CA ALA A 96 -2.217 -9.330 31.805 1.00 10.00 C ATOM 1445 C ALA A 96 -0.772 -9.519 31.316 1.00 10.00 C ATOM 1446 O ALA A 96 -0.469 -10.556 30.745 1.00 10.00 O ATOM 1447 CB ALA A 96 -3.120 -8.863 30.655 1.00 10.00 C ATOM 0 H ALA A 96 -2.742 -7.495 32.675 1.00 10.00 H new ATOM 0 HA ALA A 96 -2.557 -10.301 32.165 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.050 -9.569 29.828 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.152 -8.811 31.001 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.800 -7.877 30.319 1.00 10.00 H new ATOM 1453 N TYR A 97 0.093 -8.512 31.517 1.00 10.00 N ATOM 1454 CA TYR A 97 1.493 -8.558 31.083 1.00 10.00 C ATOM 1455 C TYR A 97 2.385 -7.796 32.066 1.00 10.00 C ATOM 1456 O TYR A 97 3.401 -8.306 32.510 1.00 10.00 O ATOM 1457 CB TYR A 97 1.668 -7.975 29.658 1.00 10.00 C ATOM 1458 CG TYR A 97 0.420 -7.826 28.800 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.367 -6.658 28.894 1.00 10.00 C ATOM 1460 CD2 TYR A 97 0.053 -8.842 27.897 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.507 -6.500 28.086 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -1.091 -8.696 27.090 1.00 10.00 C ATOM 1463 CZ TYR A 97 -1.873 -7.527 27.182 1.00 10.00 C ATOM 1464 OH TYR A 97 -2.971 -7.378 26.397 1.00 10.00 O ATOM 0 H TYR A 97 -0.162 -7.643 31.986 1.00 10.00 H new ATOM 0 HA TYR A 97 1.793 -9.606 31.061 1.00 10.00 H new ATOM 0 HB2 TYR A 97 2.131 -6.993 29.751 1.00 10.00 H new ATOM 0 HB3 TYR A 97 2.372 -8.609 29.120 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -0.092 -5.880 29.591 1.00 10.00 H new ATOM 0 HD2 TYR A 97 0.652 -9.738 27.823 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -2.100 -5.600 28.154 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -1.369 -9.479 26.401 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.756 -7.648 25.480 1.00 10.00 H new ATOM 1474 N GLY A 98 1.981 -6.566 32.414 1.00 10.00 N ATOM 1475 CA GLY A 98 2.719 -5.645 33.266 1.00 10.00 C ATOM 1476 C GLY A 98 2.310 -4.209 32.928 1.00 10.00 C ATOM 1477 O GLY A 98 1.481 -4.011 32.027 1.00 10.00 O ATOM 0 H GLY A 98 1.094 -6.177 32.093 1.00 10.00 H new ATOM 0 HA2 GLY A 98 2.513 -5.857 34.315 1.00 10.00 H new ATOM 0 HA3 GLY A 98 3.791 -5.775 33.119 1.00 10.00 H new ATOM 1481 N PRO A 99 2.869 -3.197 33.608 1.00 10.00 N ATOM 1482 CA PRO A 99 2.700 -1.804 33.214 1.00 10.00 C ATOM 1483 C PRO A 99 3.285 -1.583 31.817 1.00 10.00 C ATOM 1484 O PRO A 99 4.269 -2.216 31.441 1.00 10.00 O ATOM 1485 CB PRO A 99 3.430 -0.979 34.279 1.00 10.00 C ATOM 1486 CG PRO A 99 4.481 -1.940 34.829 1.00 10.00 C ATOM 1487 CD PRO A 99 3.812 -3.310 34.711 1.00 10.00 C ATOM 0 HA PRO A 99 1.652 -1.510 33.157 1.00 10.00 H new ATOM 0 HB2 PRO A 99 3.888 -0.088 33.850 1.00 10.00 H new ATOM 0 HB3 PRO A 99 2.749 -0.642 35.060 1.00 10.00 H new ATOM 0 HG2 PRO A 99 5.406 -1.895 34.254 1.00 10.00 H new ATOM 0 HG3 PRO A 99 4.736 -1.706 35.863 1.00 10.00 H new ATOM 0 HD2 PRO A 99 4.549 -4.090 34.517 1.00 10.00 H new ATOM 0 HD3 PRO A 99 3.301 -3.577 35.636 1.00 10.00 H new ATOM 1495 N ALA A 100 2.725 -0.635 31.065 1.00 10.00 N ATOM 1496 CA ALA A 100 3.120 -0.300 29.696 1.00 10.00 C ATOM 1497 C ALA A 100 4.450 0.452 29.600 1.00 10.00 C ATOM 1498 O ALA A 100 4.645 1.236 28.672 1.00 10.00 O ATOM 1499 CB ALA A 100 1.997 0.515 29.069 1.00 10.00 C ATOM 0 H ALA A 100 1.956 -0.058 31.405 1.00 10.00 H new ATOM 0 HA ALA A 100 3.282 -1.233 29.157 1.00 10.00 H new ATOM 0 HB1 ALA A 100 2.266 0.779 28.046 1.00 10.00 H new ATOM 0 HB2 ALA A 100 1.080 -0.074 29.063 1.00 10.00 H new ATOM 0 HB3 ALA A 100 1.840 1.425 29.649 1.00 10.00 H new ATOM 1505 N GLN A 101 5.343 0.233 30.564 1.00 10.00 N ATOM 1506 CA GLN A 101 6.672 0.815 30.688 1.00 10.00 C ATOM 1507 C GLN A 101 6.624 2.292 30.290 1.00 10.00 C ATOM 1508 O GLN A 101 7.326 2.748 29.394 1.00 10.00 O ATOM 1509 CB GLN A 101 7.630 -0.073 29.883 1.00 10.00 C ATOM 1510 CG GLN A 101 7.971 -1.368 30.634 1.00 10.00 C ATOM 1511 CD GLN A 101 8.688 -2.376 29.729 1.00 10.00 C ATOM 1512 OE1 GLN A 101 9.883 -2.279 29.502 1.00 10.00 O ATOM 1513 NE2 GLN A 101 7.977 -3.379 29.220 1.00 10.00 N ATOM 0 H GLN A 101 5.138 -0.404 31.334 1.00 10.00 H new ATOM 0 HA GLN A 101 7.048 0.831 31.711 1.00 10.00 H new ATOM 0 HB2 GLN A 101 7.178 -0.318 28.922 1.00 10.00 H new ATOM 0 HB3 GLN A 101 8.547 0.478 29.673 1.00 10.00 H new ATOM 0 HG2 GLN A 101 8.602 -1.136 31.492 1.00 10.00 H new ATOM 0 HG3 GLN A 101 7.056 -1.815 31.023 1.00 10.00 H new ATOM 0 HE21 GLN A 101 6.979 -3.448 29.418 1.00 10.00 H new ATOM 0 HE22 GLN A 101 8.430 -4.079 28.632 1.00 10.00 H new ATOM 1522 N HIS A 102 5.736 3.021 30.977 1.00 10.00 N ATOM 1523 CA HIS A 102 5.256 4.359 30.663 1.00 10.00 C ATOM 1524 C HIS A 102 6.351 5.347 30.235 1.00 10.00 C ATOM 1525 O HIS A 102 6.088 6.142 29.340 1.00 10.00 O ATOM 1526 CB HIS A 102 4.438 4.901 31.850 1.00 10.00 C ATOM 1527 CG HIS A 102 3.419 3.919 32.393 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.324 3.484 33.696 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.478 3.224 31.681 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.385 2.527 33.749 1.00 10.00 C ATOM 1531 NE2 HIS A 102 1.848 2.319 32.537 1.00 10.00 N ATOM 0 H HIS A 102 5.307 2.658 31.828 1.00 10.00 H new ATOM 0 HA HIS A 102 4.620 4.264 29.783 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.121 5.181 32.652 1.00 10.00 H new ATOM 0 HB3 HIS A 102 3.923 5.810 31.539 1.00 10.00 H new ATOM 0 HD1 HIS A 102 3.872 3.829 34.484 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.260 3.354 30.631 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.100 1.996 34.645 1.00 10.00 H new ATOM 1539 N ALA A 103 7.563 5.271 30.802 1.00 10.00 N ATOM 1540 CA ALA A 103 8.671 6.142 30.411 1.00 10.00 C ATOM 1541 C ALA A 103 8.979 6.089 28.903 1.00 10.00 C ATOM 1542 O ALA A 103 9.291 7.117 28.310 1.00 10.00 O ATOM 1543 CB ALA A 103 9.922 5.765 31.212 1.00 10.00 C ATOM 0 H ALA A 103 7.798 4.607 31.540 1.00 10.00 H new ATOM 0 HA ALA A 103 8.369 7.166 30.632 1.00 10.00 H new ATOM 0 HB1 ALA A 103 10.749 6.413 30.922 1.00 10.00 H new ATOM 0 HB2 ALA A 103 9.722 5.886 32.277 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.186 4.727 31.008 1.00 10.00 H new ATOM 1549 N ILE A 104 8.864 4.900 28.291 1.00 10.00 N ATOM 1550 CA ILE A 104 9.099 4.714 26.858 1.00 10.00 C ATOM 1551 C ILE A 104 8.042 5.533 26.115 1.00 10.00 C ATOM 1552 O ILE A 104 8.348 6.367 25.264 1.00 10.00 O ATOM 1553 CB ILE A 104 9.057 3.203 26.491 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.104 2.412 27.319 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.259 3.003 24.971 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.158 0.906 27.041 1.00 10.00 C ATOM 0 H ILE A 104 8.605 4.043 28.779 1.00 10.00 H new ATOM 0 HA ILE A 104 10.090 5.063 26.568 1.00 10.00 H new ATOM 0 HB ILE A 104 8.072 2.810 26.743 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.090 2.836 27.127 1.00 10.00 H new ATOM 0 HG13 ILE A 104 9.894 2.562 28.378 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.226 1.939 24.736 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.467 3.519 24.428 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.226 3.410 24.676 1.00 10.00 H new ATOM 0 HD11 ILE A 104 10.921 0.447 27.670 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.188 0.460 27.263 1.00 10.00 H new ATOM 0 HD13 ILE A 104 10.403 0.738 25.992 1.00 10.00 H new ATOM 1568 N SER A 105 6.767 5.309 26.455 1.00 10.00 N ATOM 1569 CA SER A 105 5.648 5.975 25.826 1.00 10.00 C ATOM 1570 C SER A 105 5.689 7.493 26.026 1.00 10.00 C ATOM 1571 O SER A 105 5.408 8.212 25.070 1.00 10.00 O ATOM 1572 CB SER A 105 4.349 5.380 26.368 1.00 10.00 C ATOM 1573 OG SER A 105 4.425 3.962 26.358 1.00 10.00 O ATOM 0 H SER A 105 6.493 4.651 27.184 1.00 10.00 H new ATOM 0 HA SER A 105 5.706 5.810 24.750 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.171 5.736 27.383 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.506 5.712 25.762 1.00 10.00 H new ATOM 0 HG SER A 105 3.777 3.595 26.995 1.00 10.00 H new ATOM 1579 N THR A 106 6.030 7.995 27.215 1.00 10.00 N ATOM 1580 CA THR A 106 6.005 9.428 27.445 1.00 10.00 C ATOM 1581 C THR A 106 7.040 10.128 26.576 1.00 10.00 C ATOM 1582 O THR A 106 6.723 11.186 26.040 1.00 10.00 O ATOM 1583 CB THR A 106 6.156 9.777 28.931 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.249 9.131 29.540 1.00 10.00 O ATOM 1585 CG2 THR A 106 4.896 9.383 29.699 1.00 10.00 C ATOM 0 H THR A 106 6.321 7.436 28.017 1.00 10.00 H new ATOM 0 HA THR A 106 5.023 9.798 27.150 1.00 10.00 H new ATOM 0 HB THR A 106 6.324 10.853 28.969 1.00 10.00 H new ATOM 0 HG1 THR A 106 7.789 8.685 28.854 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.018 9.637 30.752 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.039 9.921 29.293 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.731 8.310 29.601 1.00 10.00 H new ATOM 1593 N GLU A 107 8.233 9.565 26.395 1.00 10.00 N ATOM 1594 CA GLU A 107 9.233 10.164 25.517 1.00 10.00 C ATOM 1595 C GLU A 107 8.743 10.190 24.068 1.00 10.00 C ATOM 1596 O GLU A 107 8.915 11.190 23.373 1.00 10.00 O ATOM 1597 CB GLU A 107 10.569 9.416 25.598 1.00 10.00 C ATOM 1598 CG GLU A 107 11.309 9.670 26.920 1.00 10.00 C ATOM 1599 CD GLU A 107 12.717 9.019 26.930 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.832 7.852 27.348 1.00 10.00 O ATOM 1601 OE2 GLU A 107 13.665 9.715 26.523 1.00 10.00 O ATOM 0 H GLU A 107 8.529 8.698 26.843 1.00 10.00 H new ATOM 0 HA GLU A 107 9.389 11.188 25.857 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.390 8.347 25.486 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.203 9.722 24.766 1.00 10.00 H new ATOM 0 HG2 GLU A 107 11.404 10.744 27.082 1.00 10.00 H new ATOM 0 HG3 GLU A 107 10.720 9.274 27.747 1.00 10.00 H new ATOM 1608 N LYS A 108 8.087 9.114 23.623 1.00 10.00 N ATOM 1609 CA LYS A 108 7.535 9.029 22.272 1.00 10.00 C ATOM 1610 C LYS A 108 6.455 10.093 22.064 1.00 10.00 C ATOM 1611 O LYS A 108 6.509 10.845 21.096 1.00 10.00 O ATOM 1612 CB LYS A 108 6.996 7.612 22.039 1.00 10.00 C ATOM 1613 CG LYS A 108 8.127 6.613 21.753 1.00 10.00 C ATOM 1614 CD LYS A 108 7.560 5.206 21.511 1.00 10.00 C ATOM 1615 CE LYS A 108 8.644 4.212 21.073 1.00 10.00 C ATOM 1616 NZ LYS A 108 9.163 4.508 19.718 1.00 10.00 N ATOM 0 H LYS A 108 7.925 8.281 24.189 1.00 10.00 H new ATOM 0 HA LYS A 108 8.318 9.225 21.539 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.437 7.287 22.916 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.298 7.621 21.201 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.693 6.937 20.880 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.821 6.591 22.593 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.086 4.845 22.424 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.784 5.255 20.747 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.466 4.236 21.788 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.236 3.201 21.091 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 9.435 3.621 19.249 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.425 4.983 19.160 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 9.994 5.129 19.793 1.00 10.00 H new ATOM 1630 N ILE A 109 5.502 10.207 22.995 1.00 10.00 N ATOM 1631 CA ILE A 109 4.477 11.244 22.960 1.00 10.00 C ATOM 1632 C ILE A 109 5.176 12.612 22.964 1.00 10.00 C ATOM 1633 O ILE A 109 4.821 13.480 22.174 1.00 10.00 O ATOM 1634 CB ILE A 109 3.490 11.057 24.140 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.723 9.713 24.043 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.452 12.195 24.210 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.048 9.304 25.360 1.00 10.00 C ATOM 0 H ILE A 109 5.424 9.579 23.795 1.00 10.00 H new ATOM 0 HA ILE A 109 3.877 11.176 22.052 1.00 10.00 H new ATOM 0 HB ILE A 109 4.104 11.066 25.040 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.966 9.790 23.263 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.416 8.928 23.738 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.781 12.024 25.051 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.965 13.148 24.343 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.876 12.219 23.285 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.529 8.355 25.223 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.804 9.195 26.138 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.331 10.071 25.655 1.00 10.00 H new ATOM 1649 N LYS A 110 6.175 12.825 23.823 1.00 10.00 N ATOM 1650 CA LYS A 110 6.865 14.106 23.951 1.00 10.00 C ATOM 1651 C LYS A 110 7.577 14.494 22.651 1.00 10.00 C ATOM 1652 O LYS A 110 7.550 15.656 22.283 1.00 10.00 O ATOM 1653 CB LYS A 110 7.810 14.039 25.160 1.00 10.00 C ATOM 1654 CG LYS A 110 8.292 15.429 25.604 1.00 10.00 C ATOM 1655 CD LYS A 110 8.962 15.440 26.993 1.00 10.00 C ATOM 1656 CE LYS A 110 8.048 14.836 28.075 1.00 10.00 C ATOM 1657 NZ LYS A 110 8.442 15.183 29.456 1.00 10.00 N ATOM 0 H LYS A 110 6.529 12.106 24.454 1.00 10.00 H new ATOM 0 HA LYS A 110 6.141 14.901 24.129 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.299 13.552 25.991 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.672 13.421 24.910 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.998 15.811 24.867 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.442 16.112 25.615 1.00 10.00 H new ATOM 0 HD2 LYS A 110 9.895 14.878 26.951 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.219 16.464 27.264 1.00 10.00 H new ATOM 0 HE2 LYS A 110 7.026 15.175 27.904 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.046 13.751 27.970 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 7.686 14.903 30.113 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 9.319 14.682 29.703 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 8.598 16.209 29.525 1.00 10.00 H new ATOM 1671 N ALA A 111 8.165 13.528 21.945 1.00 10.00 N ATOM 1672 CA ALA A 111 8.761 13.748 20.633 1.00 10.00 C ATOM 1673 C ALA A 111 7.721 14.214 19.607 1.00 10.00 C ATOM 1674 O ALA A 111 8.050 15.009 18.728 1.00 10.00 O ATOM 1675 CB ALA A 111 9.470 12.475 20.156 1.00 10.00 C ATOM 0 H ALA A 111 8.240 12.565 22.272 1.00 10.00 H new ATOM 0 HA ALA A 111 9.497 14.546 20.727 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.912 12.650 19.175 1.00 10.00 H new ATOM 0 HB2 ALA A 111 10.254 12.208 20.865 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.749 11.660 20.089 1.00 10.00 H new ATOM 1681 N LYS A 112 6.467 13.740 19.694 1.00 10.00 N ATOM 1682 CA LYS A 112 5.362 14.227 18.857 1.00 10.00 C ATOM 1683 C LYS A 112 4.771 15.556 19.376 1.00 10.00 C ATOM 1684 O LYS A 112 4.102 16.222 18.600 1.00 10.00 O ATOM 1685 CB LYS A 112 4.268 13.145 18.760 1.00 10.00 C ATOM 1686 CG LYS A 112 4.713 11.829 18.090 1.00 10.00 C ATOM 1687 CD LYS A 112 5.278 11.959 16.665 1.00 10.00 C ATOM 1688 CE LYS A 112 4.272 12.592 15.689 1.00 10.00 C ATOM 1689 NZ LYS A 112 4.800 12.667 14.301 1.00 10.00 N ATOM 0 H LYS A 112 6.192 13.007 20.348 1.00 10.00 H new ATOM 0 HA LYS A 112 5.763 14.430 17.864 1.00 10.00 H new ATOM 0 HB2 LYS A 112 3.909 12.921 19.765 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.424 13.552 18.203 1.00 10.00 H new ATOM 0 HG2 LYS A 112 5.470 11.361 18.719 1.00 10.00 H new ATOM 0 HG3 LYS A 112 3.860 11.152 18.061 1.00 10.00 H new ATOM 0 HD2 LYS A 112 6.184 12.564 16.691 1.00 10.00 H new ATOM 0 HD3 LYS A 112 5.563 10.973 16.299 1.00 10.00 H new ATOM 0 HE2 LYS A 112 3.350 12.010 15.693 1.00 10.00 H new ATOM 0 HE3 LYS A 112 4.018 13.595 16.033 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 4.086 13.101 13.681 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 5.665 13.244 14.289 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 5.018 11.709 13.960 1.00 10.00 H new ATOM 1786 N VAL A 118 4.528 15.952 29.162 1.00 10.00 N ATOM 1787 CA VAL A 118 4.098 14.571 29.311 1.00 10.00 C ATOM 1788 C VAL A 118 4.832 14.026 30.532 1.00 10.00 C ATOM 1789 O VAL A 118 6.043 14.222 30.663 1.00 10.00 O ATOM 1790 CB VAL A 118 4.429 13.744 28.048 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.610 12.448 28.038 1.00 10.00 C ATOM 1792 CG2 VAL A 118 4.196 14.458 26.710 1.00 10.00 C ATOM 0 HA VAL A 118 3.018 14.508 29.441 1.00 10.00 H new ATOM 0 HB VAL A 118 5.501 13.559 28.121 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.850 11.873 27.144 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.849 11.860 28.924 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.547 12.689 28.039 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.459 13.790 25.890 1.00 10.00 H new ATOM 0 HG22 VAL A 118 3.146 14.740 26.626 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.817 15.353 26.662 1.00 10.00 H new ATOM 1802 N THR A 119 4.142 13.306 31.426 1.00 10.00 N ATOM 1803 CA THR A 119 4.724 12.711 32.631 1.00 10.00 C ATOM 1804 C THR A 119 4.097 11.334 32.892 1.00 10.00 C ATOM 1805 O THR A 119 3.104 10.991 32.253 1.00 10.00 O ATOM 1806 CB THR A 119 4.534 13.664 33.827 1.00 10.00 C ATOM 1807 OG1 THR A 119 3.203 14.194 33.877 1.00 10.00 O ATOM 1808 CG2 THR A 119 5.498 14.850 33.794 1.00 10.00 C ATOM 0 H THR A 119 3.144 13.118 31.328 1.00 10.00 H new ATOM 0 HA THR A 119 5.795 12.564 32.489 1.00 10.00 H new ATOM 0 HB THR A 119 4.736 13.055 34.708 1.00 10.00 H new ATOM 0 HG1 THR A 119 2.613 13.554 34.327 1.00 10.00 H new ATOM 0 HG21 THR A 119 5.320 15.488 34.660 1.00 10.00 H new ATOM 0 HG22 THR A 119 6.525 14.485 33.818 1.00 10.00 H new ATOM 0 HG23 THR A 119 5.338 15.424 32.881 1.00 10.00 H new ATOM 1816 N TRP A 120 4.647 10.567 33.828 1.00 10.00 N ATOM 1817 CA TRP A 120 4.116 9.250 34.166 1.00 10.00 C ATOM 1818 C TRP A 120 4.225 8.942 35.657 1.00 10.00 C ATOM 1819 O TRP A 120 4.951 9.605 36.394 1.00 10.00 O ATOM 1820 CB TRP A 120 4.808 8.157 33.334 1.00 10.00 C ATOM 1821 CG TRP A 120 6.294 8.028 33.507 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.231 8.745 32.847 1.00 10.00 C ATOM 1823 CD2 TRP A 120 7.038 7.134 34.393 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.491 8.386 33.278 1.00 10.00 N ATOM 1825 CE2 TRP A 120 8.433 7.402 34.244 1.00 10.00 C ATOM 1826 CE3 TRP A 120 6.679 6.118 35.304 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 9.412 6.713 34.977 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 7.651 5.419 36.045 1.00 10.00 C ATOM 1829 CH2 TRP A 120 9.017 5.717 35.887 1.00 10.00 C ATOM 0 H TRP A 120 5.467 10.838 34.370 1.00 10.00 H new ATOM 0 HA TRP A 120 3.054 9.262 33.921 1.00 10.00 H new ATOM 0 HB2 TRP A 120 4.351 7.199 33.581 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.602 8.347 32.281 1.00 10.00 H new ATOM 0 HD1 TRP A 120 7.023 9.490 32.093 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.357 8.796 32.927 1.00 10.00 H new ATOM 0 HE3 TRP A 120 5.636 5.871 35.436 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 10.458 6.946 34.843 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 7.346 4.649 36.739 1.00 10.00 H new ATOM 0 HH2 TRP A 120 9.759 5.183 36.462 1.00 10.00 H new ATOM 1840 N ALA A 121 3.508 7.897 36.068 1.00 10.00 N ATOM 1841 CA ALA A 121 3.518 7.239 37.364 1.00 10.00 C ATOM 1842 C ALA A 121 3.301 5.734 37.121 1.00 10.00 C ATOM 1843 O ALA A 121 3.222 5.291 35.972 1.00 10.00 O ATOM 1844 CB ALA A 121 2.418 7.844 38.247 1.00 10.00 C ATOM 0 H ALA A 121 2.843 7.450 35.437 1.00 10.00 H new ATOM 0 HA ALA A 121 4.465 7.382 37.884 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.422 7.353 39.220 1.00 10.00 H new ATOM 0 HB2 ALA A 121 2.602 8.910 38.378 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.448 7.698 37.771 1.00 10.00 H new