Browse entries in the PDBbind-CN Database
HEADER 5AGT_COMPLEX COMPND 5AGT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 10 GLY ALA VAL ALA LEU PHE SER ALA ARG ALA SEQRES 1 A 71 VAL ASP ILE GLU VAL PHE THR THR ARG PRO ASP THR LEU SEQRES 2 A 71 PHE GLY ALA THR TYR LEU VAL LEU ALA PRO GLU HIS ASP SEQRES 3 A 71 LEU VAL ASP GLU LEU VAL ALA ALA SER TRP PRO ALA GLY SEQRES 4 A 71 VAL ASN PRO LEU TRP THR TYR GLY GLY GLY THR PRO GLY SEQRES 5 A 71 GLU ALA ILE ALA ALA TYR ARG ARG ALA ILE ALA ALA LYS SEQRES 6 A 71 SER ASP LEU GLU ARG GLN SEQRES 1 A 109 LYS THR GLY VAL PHE LEU GLY SER TYR ALA ILE ASN PRO SEQRES 2 A 109 ALA ASN GLY GLU PRO VAL PRO ILE PHE ILE ALA ASP TYR SEQRES 3 A 109 VAL LEU ALA GLY TYR GLY THR GLY ALA ILE MET ALA VAL SEQRES 4 A 109 PRO GLY HIS ASP GLN ARG ASP TRP ASP PHE ALA ARG ALA SEQRES 5 A 109 PHE GLY LEU PRO ILE VAL GLU VAL ILE ALA GLY GLY ASN SEQRES 6 A 109 ILE SER GLU SER ALA TYR THR GLY ASP GLY ILE LEU VAL SEQRES 7 A 109 ASN SER ASP TYR LEU ASN GLY MET SER VAL PRO ALA ALA SEQRES 8 A 109 LYS ARG ALA ILE VAL ASP ARG LEU GLU SER ALA GLY ARG SEQRES 9 A 109 GLY ARG ALA ARG ILE HET A A 2H 61 ATOM 1 N GLY A 313 2.468 20.900 3.570 1.00 20.71 N ATOM 2 CA GLY A 313 3.041 20.475 4.876 1.00 20.68 C ATOM 3 C GLY A 313 3.754 19.134 4.826 1.00 19.83 C ATOM 4 O GLY A 313 3.900 18.500 3.762 1.00 20.47 O ATOM 5 HN3 GLY A 313 1.775 20.193 3.250 1.00 0.00 H ATOM 6 HN2 GLY A 313 3.231 20.982 2.868 1.00 0.00 H ATOM 7 HN1 GLY A 313 1.999 21.821 3.682 1.00 0.00 H ATOM 8 N ALA A 314 4.237 18.704 5.985 1.00 18.54 N ATOM 9 CA ALA A 314 4.813 17.374 6.128 1.00 17.03 C ATOM 10 C ALA A 314 4.724 16.936 7.573 1.00 15.80 C ATOM 11 O ALA A 314 4.753 17.771 8.477 1.00 16.22 O ATOM 12 CB ALA A 314 6.263 17.347 5.678 1.00 17.44 C ATOM 13 H ALA A 314 4.203 19.333 6.812 1.00 0.00 H ATOM 14 N VAL A 315 4.637 15.625 7.784 1.00 14.38 N ATOM 15 CA VAL A 315 4.820 15.061 9.108 1.00 14.16 C ATOM 16 C VAL A 315 6.128 14.295 9.094 1.00 14.29 C ATOM 17 O VAL A 315 6.501 13.697 8.091 1.00 14.39 O ATOM 18 CB VAL A 315 3.641 14.169 9.552 1.00 14.16 C ATOM 19 CG1 VAL A 315 2.417 15.027 9.870 1.00 14.20 C ATOM 20 CG2 VAL A 315 3.322 13.116 8.488 1.00 15.25 C ATOM 21 H VAL A 315 4.434 14.992 6.984 1.00 0.00 H ATOM 22 N ALA A 316 6.844 14.343 10.207 1.00 14.49 N ATOM 23 CA ALA A 316 8.128 13.677 10.305 1.00 14.48 C ATOM 24 C ALA A 316 8.314 13.154 11.713 1.00 14.54 C ATOM 25 O ALA A 316 7.816 13.741 12.674 1.00 15.02 O ATOM 26 CB ALA A 316 9.274 14.639 9.936 1.00 14.73 C ATOM 27 H ALA A 316 6.478 14.869 11.027 1.00 0.00 H ATOM 28 N LEU A 317 9.030 12.043 11.823 1.00 14.00 N ATOM 29 CA LEU A 317 9.359 11.430 13.102 1.00 14.06 C ATOM 30 C LEU A 317 10.760 11.813 13.545 1.00 14.35 C ATOM 31 O LEU A 317 11.705 11.814 12.746 1.00 14.40 O ATOM 32 CB LEU A 317 9.310 9.910 13.011 1.00 14.81 C ATOM 33 CG LEU A 317 7.955 9.303 12.653 1.00 14.85 C ATOM 34 CD1 LEU A 317 8.064 7.783 12.593 1.00 16.66 C ATOM 35 CD2 LEU A 317 6.863 9.737 13.625 1.00 16.17 C ATOM 36 H LEU A 317 9.373 11.588 10.953 1.00 0.00 H ATOM 37 N PHE A 318 10.867 12.110 14.832 1.00 13.86 N ATOM 38 CA PHE A 318 12.142 12.257 15.522 1.00 14.12 C ATOM 39 C PHE A 318 12.188 11.154 16.570 1.00 15.23 C ATOM 40 O PHE A 318 11.312 11.079 17.434 1.00 14.88 O ATOM 41 CB PHE A 318 12.207 13.615 16.234 1.00 14.18 C ATOM 42 CG PHE A 318 12.523 14.790 15.340 1.00 14.11 C ATOM 43 CD1 PHE A 318 11.615 15.219 14.380 1.00 14.45 C ATOM 44 CD2 PHE A 318 13.714 15.492 15.499 1.00 14.19 C ATOM 45 CE1 PHE A 318 11.906 16.324 13.576 1.00 14.61 C ATOM 46 CE2 PHE A 318 13.998 16.604 14.712 1.00 14.96 C ATOM 47 CZ PHE A 318 13.092 17.011 13.752 1.00 14.05 C ATOM 48 H PHE A 318 9.993 12.246 15.380 1.00 0.00 H ATOM 49 N SER A 319 13.198 10.299 16.500 1.00 15.89 N ATOM 50 CA SER A 319 13.356 9.234 17.487 1.00 16.99 C ATOM 51 C SER A 319 13.862 9.791 18.811 1.00 17.24 C ATOM 52 O SER A 319 14.742 10.650 18.826 1.00 17.64 O ATOM 53 CB SER A 319 14.351 8.193 16.983 1.00 17.19 C ATOM 54 OG SER A 319 13.903 7.594 15.784 1.00 18.90 O ATOM 55 HG SER A 319 13.034 7.148 15.944 1.00 0.00 H ATOM 56 H SER A 319 13.890 10.388 15.729 1.00 0.00 H ATOM 57 N ALA A 320 13.312 9.302 19.922 1.00 18.38 N ATOM 58 CA ALA A 320 13.907 9.588 21.229 1.00 19.90 C ATOM 59 C ALA A 320 15.304 8.980 21.197 1.00 21.69 C ATOM 60 O ALA A 320 15.479 7.872 20.675 1.00 22.23 O ATOM 61 CB ALA A 320 13.107 8.968 22.348 1.00 20.93 C ATOM 62 H ALA A 320 12.456 8.714 19.860 1.00 0.00 H ATOM 63 N ARG A 321 16.298 9.700 21.714 1.00 22.96 N ATOM 64 CA ARG A 321 17.662 9.178 21.765 1.00 23.57 C ATOM 65 C ARG A 321 17.739 7.982 22.704 1.00 24.17 C ATOM 66 O ARG A 321 18.389 6.984 22.394 1.00 24.28 O ATOM 67 CB ARG A 321 18.655 10.251 22.212 1.00 23.68 C ATOM 68 CG ARG A 321 20.095 9.761 22.215 1.00 23.78 C ATOM 69 CD ARG A 321 21.081 10.888 22.428 1.00 23.69 C ATOM 70 NE ARG A 321 21.163 11.313 23.821 1.00 24.07 N ATOM 71 CZ ARG A 321 22.055 12.197 24.258 1.00 24.77 C ATOM 72 NH1 ARG A 321 22.915 12.729 23.405 1.00 25.28 N ATOM 73 NH2 ARG A 321 22.092 12.549 25.535 1.00 25.72 N ATOM 74 HE ARG A 321 20.493 10.906 24.504 1.00 0.00 H ATOM 75 HH12 ARG A 321 23.616 13.421 23.737 1.00 0.00 H ATOM 76 HH11 ARG A 321 22.890 12.455 22.402 1.00 0.00 H ATOM 77 HH22 ARG A 321 22.795 13.242 25.863 1.00 0.00 H ATOM 78 HH21 ARG A 321 21.418 12.133 26.209 1.00 0.00 H ATOM 79 H ARG A 321 16.100 10.650 22.088 1.00 0.00 H ATOM 80 N ALA A 322 17.075 8.094 23.851 1.00 24.70 N ATOM 81 CA ALA A 322 17.038 7.014 24.830 1.00 25.18 C ATOM 82 C ALA A 322 15.849 6.109 24.528 1.00 25.73 C ATOM 83 O ALA A 322 14.750 6.594 24.223 1.00 26.86 O ATOM 84 CB ALA A 322 16.934 7.579 26.230 1.00 25.46 C ATOM 85 H ALA A 322 16.567 8.978 24.056 1.00 0.00 H TER 86 ALA A 322 ATOM 87 N VAL A 330 10.770 5.347 21.319 1.00 23.88 N ATOM 88 CA VAL A 330 9.662 6.301 21.259 1.00 23.13 C ATOM 89 C VAL A 330 9.891 7.266 20.097 1.00 21.83 C ATOM 90 O VAL A 330 10.985 7.801 19.952 1.00 22.06 O ATOM 91 CB VAL A 330 9.550 7.094 22.581 1.00 23.68 C ATOM 92 CG1 VAL A 330 8.564 8.234 22.466 1.00 24.69 C ATOM 93 CG2 VAL A 330 9.156 6.163 23.718 1.00 24.82 C ATOM 94 HN3 VAL A 330 11.662 5.862 21.463 1.00 0.00 H ATOM 95 HN2 VAL A 330 10.816 4.815 20.427 1.00 0.00 H ATOM 96 HN1 VAL A 330 10.617 4.689 22.109 1.00 0.00 H ATOM 97 N ASP A 331 8.875 7.461 19.263 1.00 20.28 N ATOM 98 CA ASP A 331 8.948 8.424 18.152 1.00 19.84 C ATOM 99 C ASP A 331 8.048 9.610 18.436 1.00 18.73 C ATOM 100 O ASP A 331 6.898 9.438 18.862 1.00 19.27 O ATOM 101 CB ASP A 331 8.520 7.790 16.823 1.00 20.37 C ATOM 102 CG ASP A 331 9.491 6.735 16.326 1.00 22.26 C ATOM 103 OD1 ASP A 331 10.719 6.922 16.447 1.00 24.35 O ATOM 104 OD2 ASP A 331 9.008 5.717 15.787 1.00 27.94 O ATOM 105 H ASP A 331 8.000 6.916 19.400 1.00 0.00 H ATOM 106 N ILE A 332 8.571 10.805 18.181 1.00 16.98 N ATOM 107 CA ILE A 332 7.821 12.039 18.309 1.00 16.40 C ATOM 108 C ILE A 332 7.485 12.513 16.904 1.00 15.41 C ATOM 109 O ILE A 332 8.382 12.807 16.118 1.00 14.76 O ATOM 110 CB ILE A 332 8.654 13.121 19.018 1.00 16.65 C ATOM 111 CG1 ILE A 332 9.064 12.657 20.420 1.00 18.60 C ATOM 112 CG2 ILE A 332 7.870 14.432 19.094 1.00 17.75 C ATOM 113 CD1 ILE A 332 10.243 13.431 20.976 1.00 20.09 C ATOM 114 H ILE A 332 9.564 10.857 17.876 1.00 0.00 H ATOM 115 N GLU A 333 6.194 12.573 16.585 1.00 14.45 N ATOM 116 CA GLU A 333 5.746 13.063 15.287 1.00 14.48 C ATOM 117 C GLU A 333 5.547 14.566 15.363 1.00 13.77 C ATOM 118 O GLU A 333 4.873 15.066 16.271 1.00 14.39 O ATOM 119 CB GLU A 333 4.427 12.397 14.879 1.00 14.57 C ATOM 120 CG GLU A 333 4.050 12.603 13.421 1.00 16.98 C ATOM 121 CD GLU A 333 2.649 12.109 13.076 1.00 20.23 C ATOM 122 OE1 GLU A 333 1.913 11.615 13.964 1.00 22.88 O ATOM 123 OE2 GLU A 333 2.276 12.222 11.890 1.00 23.35 O ATOM 124 H GLU A 333 5.486 12.262 17.280 1.00 0.00 H ATOM 125 N VAL A 334 6.155 15.282 14.421 1.00 13.12 N ATOM 126 CA VAL A 334 5.958 16.722 14.279 1.00 13.65 C ATOM 127 C VAL A 334 5.230 17.030 12.977 1.00 13.65 C ATOM 128 O VAL A 334 5.330 16.275 12.018 1.00 13.99 O ATOM 129 CB VAL A 334 7.301 17.500 14.320 1.00 13.42 C ATOM 130 CG1 VAL A 334 8.074 17.170 15.597 1.00 13.85 C ATOM 131 CG2 VAL A 334 8.154 17.250 13.075 1.00 14.58 C ATOM 132 H VAL A 334 6.795 14.797 13.760 1.00 0.00 H ATOM 133 N PHE A 335 4.482 18.133 12.965 1.00 14.31 N ATOM 134 CA PHE A 335 3.932 18.674 11.739 1.00 14.33 C ATOM 135 C PHE A 335 4.676 19.967 11.430 1.00 13.51 C ATOM 136 O PHE A 335 4.801 20.832 12.293 1.00 13.54 O ATOM 137 CB PHE A 335 2.431 18.948 11.843 1.00 15.13 C ATOM 138 CG PHE A 335 1.873 19.568 10.601 1.00 17.72 C ATOM 139 CD1 PHE A 335 1.733 18.816 9.450 1.00 20.85 C ATOM 140 CD2 PHE A 335 1.566 20.920 10.552 1.00 20.54 C ATOM 141 CE1 PHE A 335 1.241 19.389 8.282 1.00 21.90 C ATOM 142 CE2 PHE A 335 1.076 21.496 9.384 1.00 20.87 C ATOM 143 CZ PHE A 335 0.923 20.730 8.255 1.00 20.86 C ATOM 144 H PHE A 335 4.287 18.620 13.863 1.00 0.00 H ATOM 145 N THR A 336 5.150 20.088 10.195 1.00 12.93 N ATOM 146 CA THR A 336 5.821 21.297 9.744 1.00 12.75 C ATOM 147 C THR A 336 5.352 21.720 8.357 1.00 12.65 C ATOM 148 O THR A 336 5.092 20.886 7.489 1.00 13.40 O ATOM 149 CB THR A 336 7.376 21.134 9.744 1.00 12.61 C ATOM 150 OG1 THR A 336 7.986 22.378 9.383 1.00 12.87 O ATOM 151 CG2 THR A 336 7.833 20.040 8.784 1.00 13.60 C ATOM 152 HG1 THR A 336 7.726 23.074 10.038 1.00 0.00 H ATOM 153 H THR A 336 5.038 19.295 9.531 1.00 0.00 H ATOM 154 N THR A 337 5.252 23.025 8.153 1.00 12.87 N ATOM 155 CA THR A 337 5.020 23.580 6.822 1.00 13.81 C ATOM 156 C THR A 337 6.335 23.891 6.091 1.00 13.23 C ATOM 157 O THR A 337 6.313 24.317 4.934 1.00 13.67 O ATOM 158 CB THR A 337 4.186 24.857 6.900 1.00 14.26 C ATOM 159 OG1 THR A 337 4.878 25.825 7.696 1.00 17.36 O ATOM 160 CG2 THR A 337 2.847 24.566 7.520 1.00 15.64 C ATOM 161 HG1 THR A 337 5.017 25.463 8.607 1.00 0.00 H ATOM 162 H THR A 337 5.341 23.672 8.962 1.00 0.00 H ATOM 163 N ARG A 338 7.476 23.638 6.748 1.00 12.60 N ATOM 164 CA ARG A 338 8.799 23.929 6.197 1.00 12.57 C ATOM 165 C ARG A 338 9.723 22.726 6.387 1.00 12.50 C ATOM 166 O ARG A 338 10.760 22.806 7.052 1.00 11.84 O ATOM 167 CB ARG A 338 9.389 25.173 6.858 1.00 12.30 C ATOM 168 CG ARG A 338 8.630 26.466 6.563 1.00 12.36 C ATOM 169 CD ARG A 338 8.611 26.798 5.079 1.00 13.43 C ATOM 170 NE ARG A 338 9.966 26.920 4.568 1.00 13.91 N ATOM 171 CZ ARG A 338 10.718 28.012 4.668 1.00 14.42 C ATOM 172 NH1 ARG A 338 10.237 29.133 5.215 1.00 14.70 N ATOM 173 NH2 ARG A 338 11.952 27.996 4.202 1.00 15.48 N ATOM 174 HE ARG A 338 10.377 26.093 4.089 1.00 0.00 H ATOM 175 HH12 ARG A 338 10.840 29.978 5.285 1.00 0.00 H ATOM 176 HH11 ARG A 338 9.260 29.160 5.571 1.00 0.00 H ATOM 177 HH22 ARG A 338 12.547 28.846 4.276 1.00 0.00 H ATOM 178 HH21 ARG A 338 12.330 27.134 3.760 1.00 0.00 H ATOM 179 H ARG A 338 7.417 23.214 7.696 1.00 0.00 H ATOM 180 N PRO A 339 9.374 21.585 5.775 1.00 12.39 N ATOM 181 CA PRO A 339 10.263 20.421 5.905 1.00 12.47 C ATOM 182 C PRO A 339 11.645 20.648 5.289 1.00 12.21 C ATOM 183 O PRO A 339 12.603 20.000 5.697 1.00 11.94 O ATOM 184 CB PRO A 339 9.508 19.310 5.170 1.00 13.08 C ATOM 185 CG PRO A 339 8.630 20.013 4.229 1.00 12.54 C ATOM 186 CD PRO A 339 8.235 21.315 4.886 1.00 12.87 C ATOM 187 N ASP A 340 11.736 21.596 4.356 1.00 11.84 N ATOM 188 CA ASP A 340 13.008 22.001 3.757 1.00 11.82 C ATOM 189 C ASP A 340 14.044 22.463 4.780 1.00 11.65 C ATOM 190 O ASP A 340 15.226 22.436 4.482 1.00 12.16 O ATOM 191 CB ASP A 340 12.803 23.131 2.734 1.00 12.35 C ATOM 192 CG ASP A 340 12.098 24.356 3.326 1.00 13.83 C ATOM 193 OD1 ASP A 340 10.985 24.199 3.851 1.00 13.77 O ATOM 194 OD2 ASP A 340 12.652 25.465 3.246 1.00 15.98 O ATOM 195 H ASP A 340 10.865 22.068 4.040 1.00 0.00 H ATOM 196 N THR A 341 13.592 22.922 5.955 1.00 11.26 N ATOM 197 CA THR A 341 14.470 23.475 6.994 1.00 11.60 C ATOM 198 C THR A 341 14.944 22.451 8.027 1.00 11.73 C ATOM 199 O THR A 341 15.511 22.824 9.044 1.00 12.04 O ATOM 200 CB THR A 341 13.796 24.664 7.754 1.00 11.27 C ATOM 201 OG1 THR A 341 12.645 24.196 8.462 1.00 11.45 O ATOM 202 CG2 THR A 341 13.419 25.777 6.788 1.00 11.82 C ATOM 203 HG1 THR A 341 11.999 23.809 7.820 1.00 0.00 H ATOM 204 H THR A 341 12.569 22.885 6.140 1.00 0.00 H ATOM 205 N LEU A 342 14.720 21.167 7.760 1.00 11.31 N ATOM 206 CA LEU A 342 14.998 20.113 8.735 1.00 11.65 C ATOM 207 C LEU A 342 16.430 20.134 9.296 1.00 11.62 C ATOM 208 O LEU A 342 16.626 19.866 10.479 1.00 11.17 O ATOM 209 CB LEU A 342 14.704 18.749 8.110 1.00 11.53 C ATOM 210 CG LEU A 342 14.977 17.483 8.927 1.00 11.94 C ATOM 211 CD1 LEU A 342 14.239 17.499 10.264 1.00 9.83 C ATOM 212 CD2 LEU A 342 14.592 16.254 8.096 1.00 9.98 C ATOM 213 H LEU A 342 14.336 20.905 6.830 1.00 0.00 H ATOM 214 N PHE A 343 17.427 20.461 8.470 1.00 11.42 N ATOM 215 CA PHE A 343 18.821 20.513 8.948 1.00 11.98 C ATOM 216 C PHE A 343 19.071 21.685 9.904 1.00 11.99 C ATOM 217 O PHE A 343 20.153 21.784 10.491 1.00 12.36 O ATOM 218 CB PHE A 343 19.823 20.584 7.795 1.00 12.07 C ATOM 219 CG PHE A 343 19.969 19.300 7.026 1.00 12.36 C ATOM 220 CD1 PHE A 343 19.107 18.989 5.981 1.00 12.68 C ATOM 221 CD2 PHE A 343 20.990 18.421 7.328 1.00 12.08 C ATOM 222 CE1 PHE A 343 19.251 17.815 5.257 1.00 12.67 C ATOM 223 CE2 PHE A 343 21.156 17.240 6.600 1.00 12.51 C ATOM 224 CZ PHE A 343 20.273 16.932 5.568 1.00 13.92 C ATOM 225 H PHE A 343 17.217 20.682 7.476 1.00 0.00 H ATOM 226 N GLY A 344 18.088 22.581 10.026 1.00 11.24 N ATOM 227 CA GLY A 344 18.142 23.688 10.975 1.00 11.59 C ATOM 228 C GLY A 344 17.264 23.526 12.200 1.00 11.37 C ATOM 229 O GLY A 344 17.115 24.466 12.982 1.00 11.59 O ATOM 230 H GLY A 344 17.249 22.486 9.419 1.00 0.00 H ATOM 231 N ALA A 345 16.706 22.331 12.391 1.00 11.01 N ATOM 232 CA ALA A 345 15.898 22.041 13.571 1.00 11.42 C ATOM 233 C ALA A 345 16.815 21.682 14.728 1.00 12.28 C ATOM 234 O ALA A 345 17.467 20.620 14.718 1.00 12.73 O ATOM 235 CB ALA A 345 14.900 20.918 13.298 1.00 11.71 C ATOM 236 H ALA A 345 16.850 21.585 11.680 1.00 0.00 H ATOM 237 N THR A 346 16.875 22.567 15.717 1.00 11.45 N ATOM 238 CA THR A 346 17.847 22.465 16.795 1.00 12.21 C ATOM 239 C THR A 346 17.238 22.067 18.130 1.00 11.56 C ATOM 240 O THR A 346 17.965 21.841 19.094 1.00 12.85 O ATOM 241 CB THR A 346 18.625 23.788 16.955 1.00 12.09 C ATOM 242 OG1 THR A 346 17.721 24.856 17.300 1.00 12.79 O ATOM 243 CG2 THR A 346 19.392 24.124 15.667 1.00 12.99 C ATOM 244 HG1 THR A 346 18.231 25.699 17.400 1.00 0.00 H ATOM 245 H THR A 346 16.203 23.361 15.721 1.00 0.00 H ATOM 246 N TYR A 347 15.912 21.982 18.207 1.00 11.59 N ATOM 247 CA TYR A 347 15.232 21.451 19.393 1.00 11.44 C ATOM 248 C TYR A 347 13.809 21.085 19.016 1.00 11.29 C ATOM 249 O TYR A 347 13.352 21.431 17.921 1.00 11.27 O ATOM 250 CB TYR A 347 15.289 22.422 20.602 1.00 11.32 C ATOM 251 CG TYR A 347 14.659 23.787 20.412 1.00 11.60 C ATOM 252 CD1 TYR A 347 15.298 24.780 19.685 1.00 11.42 C ATOM 253 CD2 TYR A 347 13.412 24.075 20.945 1.00 11.20 C ATOM 254 CE1 TYR A 347 14.720 26.034 19.507 1.00 12.47 C ATOM 255 CE2 TYR A 347 12.825 25.341 20.767 1.00 12.33 C ATOM 256 CZ TYR A 347 13.488 26.295 20.042 1.00 13.76 C ATOM 257 OH TYR A 347 12.907 27.543 19.843 1.00 15.48 O ATOM 258 HH TYR A 347 13.516 28.107 19.302 1.00 0.00 H ATOM 259 H TYR A 347 15.340 22.302 17.400 1.00 0.00 H ATOM 260 N LEU A 348 13.139 20.340 19.882 1.00 11.69 N ATOM 261 CA LEU A 348 11.737 19.979 19.687 1.00 12.21 C ATOM 262 C LEU A 348 10.935 20.611 20.793 1.00 12.91 C ATOM 263 O LEU A 348 11.439 20.771 21.905 1.00 12.92 O ATOM 264 CB LEU A 348 11.520 18.465 19.749 1.00 12.97 C ATOM 265 CG LEU A 348 12.185 17.623 18.676 1.00 13.43 C ATOM 266 CD1 LEU A 348 11.730 16.171 18.857 1.00 14.64 C ATOM 267 CD2 LEU A 348 11.857 18.123 17.271 1.00 14.34 C ATOM 268 H LEU A 348 13.630 19.999 20.733 1.00 0.00 H ATOM 269 N VAL A 349 9.690 20.958 20.501 1.00 12.79 N ATOM 270 CA VAL A 349 8.775 21.485 21.507 1.00 12.86 C ATOM 271 C VAL A 349 7.448 20.750 21.428 1.00 13.58 C ATOM 272 O VAL A 349 6.848 20.645 20.354 1.00 13.39 O ATOM 273 CB VAL A 349 8.533 22.981 21.353 1.00 12.76 C ATOM 274 CG1 VAL A 349 7.689 23.502 22.547 1.00 13.95 C ATOM 275 CG2 VAL A 349 9.861 23.708 21.255 1.00 12.80 C ATOM 276 H VAL A 349 9.354 20.851 19.522 1.00 0.00 H ATOM 277 N LEU A 350 7.018 20.224 22.572 1.00 13.63 N ATOM 278 CA LEU A 350 5.748 19.525 22.697 1.00 14.08 C ATOM 279 C LEU A 350 4.810 20.409 23.488 1.00 14.18 C ATOM 280 O LEU A 350 5.245 21.183 24.346 1.00 14.20 O ATOM 281 CB LEU A 350 5.916 18.190 23.433 1.00 14.43 C ATOM 282 CG LEU A 350 6.477 17.005 22.627 1.00 15.58 C ATOM 283 CD1 LEU A 350 7.786 17.335 21.930 1.00 17.12 C ATOM 284 CD2 LEU A 350 6.636 15.793 23.547 1.00 17.14 C ATOM 285 H LEU A 350 7.618 20.317 23.417 1.00 0.00 H ATOM 286 N ALA A 351 3.520 20.289 23.192 1.00 14.61 N ATOM 287 CA ALA A 351 2.483 20.924 24.013 1.00 15.06 C ATOM 288 C ALA A 351 2.630 20.409 25.447 1.00 15.50 C ATOM 289 O ALA A 351 2.997 19.247 25.655 1.00 14.99 O ATOM 290 CB ALA A 351 1.112 20.614 23.473 1.00 15.40 C ATOM 291 H ALA A 351 3.239 19.732 22.360 1.00 0.00 H ATOM 292 N PRO A 352 2.372 21.269 26.454 1.00 16.10 N ATOM 293 CA PRO A 352 2.548 20.802 27.836 1.00 16.87 C ATOM 294 C PRO A 352 1.727 19.564 28.187 1.00 17.64 C ATOM 295 O PRO A 352 2.127 18.795 29.067 1.00 17.89 O ATOM 296 CB PRO A 352 2.107 22.020 28.661 1.00 16.76 C ATOM 297 CG PRO A 352 2.432 23.168 27.800 1.00 16.79 C ATOM 298 CD PRO A 352 2.105 22.714 26.406 1.00 16.05 C ATOM 299 N GLU A 353 0.608 19.369 27.484 1.00 18.79 N ATOM 300 CA GLU A 353 -0.318 18.282 27.739 1.00 20.07 C ATOM 301 C GLU A 353 -0.067 17.064 26.837 1.00 20.32 C ATOM 302 O GLU A 353 -0.781 16.075 26.924 1.00 21.24 O ATOM 303 CB GLU A 353 -1.755 18.776 27.529 1.00 20.93 C ATOM 304 CG GLU A 353 -2.135 20.035 28.324 1.00 22.84 C ATOM 305 CD GLU A 353 -1.652 21.361 27.717 1.00 25.04 C ATOM 306 OE1 GLU A 353 -1.132 21.391 26.568 1.00 22.44 O ATOM 307 OE2 GLU A 353 -1.799 22.397 28.414 1.00 26.45 O ATOM 308 H GLU A 353 0.389 20.032 26.713 1.00 0.00 H ATOM 309 N HIS A 354 0.936 17.148 25.966 1.00 19.76 N ATOM 310 CA HIS A 354 1.260 16.062 25.037 1.00 19.91 C ATOM 311 C HIS A 354 1.464 14.741 25.788 1.00 20.03 C ATOM 312 O HIS A 354 2.152 14.704 26.809 1.00 19.60 O ATOM 313 CB HIS A 354 2.521 16.427 24.238 1.00 19.50 C ATOM 314 CG HIS A 354 2.820 15.491 23.112 1.00 19.68 C ATOM 315 ND1 HIS A 354 2.703 15.842 21.785 1.00 20.83 N ATOM 316 CD2 HIS A 354 3.254 14.212 23.122 1.00 18.21 C ATOM 317 CE1 HIS A 354 3.050 14.816 21.029 1.00 17.95 C ATOM 318 NE2 HIS A 354 3.380 13.809 21.816 1.00 21.18 N ATOM 319 H HIS A 354 1.510 18.015 25.944 1.00 0.00 H ATOM 320 N ASP A 355 0.870 13.665 25.277 1.00 20.96 N ATOM 321 CA ASP A 355 0.841 12.348 25.936 1.00 21.37 C ATOM 322 C ASP A 355 2.211 11.699 26.165 1.00 21.34 C ATOM 323 O ASP A 355 2.365 10.824 27.014 1.00 22.31 O ATOM 324 CB ASP A 355 -0.011 11.379 25.108 1.00 21.59 C ATOM 325 CG ASP A 355 -1.495 11.678 25.208 1.00 22.73 C ATOM 326 OD1 ASP A 355 -1.960 11.989 26.322 1.00 24.10 O ATOM 327 OD2 ASP A 355 -2.194 11.593 24.177 1.00 25.75 O ATOM 328 H ASP A 355 0.397 13.760 24.356 1.00 0.00 H ATOM 329 N LEU A 356 3.202 12.086 25.363 1.00 20.29 N ATOM 330 CA LEU A 356 4.548 11.515 25.471 1.00 19.62 C ATOM 331 C LEU A 356 5.432 12.226 26.490 1.00 19.02 C ATOM 332 O LEU A 356 6.496 11.722 26.838 1.00 17.98 O ATOM 333 CB LEU A 356 5.257 11.496 24.108 1.00 19.71 C ATOM 334 CG LEU A 356 4.662 10.579 23.035 1.00 20.73 C ATOM 335 CD1 LEU A 356 5.450 10.729 21.729 1.00 20.91 C ATOM 336 CD2 LEU A 356 4.658 9.126 23.504 1.00 22.49 C ATOM 337 H LEU A 356 3.016 12.812 24.642 1.00 0.00 H ATOM 338 N VAL A 357 5.010 13.392 26.969 1.00 18.79 N ATOM 339 CA VAL A 357 5.841 14.169 27.885 1.00 19.18 C ATOM 340 C VAL A 357 6.260 13.365 29.115 1.00 19.42 C ATOM 341 O VAL A 357 7.437 13.300 29.443 1.00 19.18 O ATOM 342 CB VAL A 357 5.137 15.473 28.328 1.00 18.64 C ATOM 343 CG1 VAL A 357 5.910 16.156 29.447 1.00 19.52 C ATOM 344 CG2 VAL A 357 4.967 16.412 27.144 1.00 19.94 C ATOM 345 H VAL A 357 4.077 13.755 26.688 1.00 0.00 H ATOM 346 N ASP A 358 5.299 12.739 29.784 1.00 20.04 N ATOM 347 CA ASP A 358 5.603 12.001 31.014 1.00 21.68 C ATOM 348 C ASP A 358 6.574 10.840 30.750 1.00 22.56 C ATOM 349 O ASP A 358 7.447 10.559 31.581 1.00 23.57 O ATOM 350 CB ASP A 358 4.309 11.508 31.673 1.00 21.36 C ATOM 351 CG ASP A 358 3.513 12.635 32.323 1.00 22.34 C ATOM 352 OD1 ASP A 358 4.052 13.758 32.434 1.00 22.16 O ATOM 353 OD2 ASP A 358 2.356 12.395 32.721 1.00 25.81 O ATOM 354 H ASP A 358 4.321 12.772 29.432 1.00 0.00 H ATOM 355 N GLU A 359 6.435 10.217 29.577 1.00 23.40 N ATOM 356 CA GLU A 359 7.328 9.142 29.078 1.00 24.25 C ATOM 357 C GLU A 359 8.775 9.602 28.866 1.00 23.44 C ATOM 358 O GLU A 359 9.731 8.852 29.103 1.00 23.38 O ATOM 359 CB GLU A 359 6.781 8.651 27.720 1.00 25.05 C ATOM 360 CG GLU A 359 7.100 7.239 27.299 1.00 28.30 C ATOM 361 CD GLU A 359 6.085 6.706 26.291 1.00 31.28 C ATOM 362 OE1 GLU A 359 4.866 6.930 26.484 1.00 34.83 O ATOM 363 OE2 GLU A 359 6.497 6.062 25.306 1.00 35.10 O ATOM 364 H GLU A 359 5.643 10.506 28.969 1.00 0.00 H ATOM 365 N LEU A 360 8.918 10.831 28.384 1.00 22.03 N ATOM 366 CA LEU A 360 10.198 11.371 27.936 1.00 21.52 C ATOM 367 C LEU A 360 10.954 12.078 29.050 1.00 21.35 C ATOM 368 O LEU A 360 12.156 12.307 28.921 1.00 21.79 O ATOM 369 CB LEU A 360 9.967 12.372 26.794 1.00 21.00 C ATOM 370 CG LEU A 360 9.458 11.813 25.466 1.00 21.23 C ATOM 371 CD1 LEU A 360 8.892 12.936 24.593 1.00 21.22 C ATOM 372 CD2 LEU A 360 10.577 11.076 24.754 1.00 21.94 C ATOM 373 H LEU A 360 8.076 11.439 28.323 1.00 0.00 H ATOM 374 N VAL A 361 10.256 12.438 30.125 1.00 21.41 N ATOM 375 CA VAL A 361 10.864 13.164 31.241 1.00 21.90 C ATOM 376 C VAL A 361 11.976 12.330 31.888 1.00 21.76 C ATOM 377 O VAL A 361 11.751 11.169 32.262 1.00 22.29 O ATOM 378 CB VAL A 361 9.793 13.592 32.285 1.00 22.00 C ATOM 379 CG1 VAL A 361 10.426 14.013 33.600 1.00 23.00 C ATOM 380 CG2 VAL A 361 8.952 14.739 31.734 1.00 22.72 C ATOM 381 H VAL A 361 9.246 12.195 30.173 1.00 0.00 H ATOM 382 N ALA A 362 13.170 12.912 31.986 1.00 20.91 N ATOM 383 CA ALA A 362 14.321 12.249 32.615 1.00 20.68 C ATOM 384 C ALA A 362 14.219 12.292 34.137 1.00 20.79 C ATOM 385 O ALA A 362 13.590 13.184 34.699 1.00 20.54 O ATOM 386 CB ALA A 362 15.623 12.892 32.164 1.00 20.24 C ATOM 387 H ALA A 362 13.292 13.871 31.603 1.00 0.00 H ATOM 388 N ALA A 363 14.861 11.330 34.799 1.00 21.32 N ATOM 389 CA ALA A 363 14.839 11.245 36.259 1.00 21.54 C ATOM 390 C ALA A 363 15.605 12.389 36.921 1.00 21.61 C ATOM 391 O ALA A 363 15.254 12.823 38.023 1.00 22.46 O ATOM 392 CB ALA A 363 15.412 9.887 36.719 1.00 21.84 C ATOM 393 H ALA A 363 15.394 10.618 34.261 1.00 0.00 H ATOM 394 N SER A 364 16.643 12.875 36.239 1.00 21.46 N ATOM 395 CA SER A 364 17.525 13.920 36.768 1.00 21.47 C ATOM 396 C SER A 364 17.978 14.851 35.650 1.00 21.16 C ATOM 397 O SER A 364 17.955 14.480 34.482 1.00 21.21 O ATOM 398 CB SER A 364 18.763 13.297 37.424 1.00 21.73 C ATOM 399 OG SER A 364 18.418 12.433 38.488 1.00 22.32 O ATOM 400 HG SER A 364 17.924 12.942 39.178 1.00 0.00 H ATOM 401 H SER A 364 16.835 12.496 35.290 1.00 0.00 H ATOM 402 N TRP A 365 18.404 16.056 36.009 1.00 21.03 N ATOM 403 CA TRP A 365 18.962 16.982 35.024 1.00 21.04 C ATOM 404 C TRP A 365 20.333 16.470 34.609 1.00 22.18 C ATOM 405 O TRP A 365 21.098 16.013 35.459 1.00 22.47 O ATOM 406 CB TRP A 365 19.124 18.395 35.575 1.00 20.65 C ATOM 407 CG TRP A 365 17.837 19.048 35.931 1.00 18.37 C ATOM 408 CD1 TRP A 365 17.459 19.443 37.166 1.00 16.73 C ATOM 409 CD2 TRP A 365 16.759 19.399 35.043 1.00 16.61 C ATOM 410 NE1 TRP A 365 16.206 20.001 37.122 1.00 16.13 N ATOM 411 CE2 TRP A 365 15.755 19.988 35.831 1.00 16.69 C ATOM 412 CE3 TRP A 365 16.542 19.259 33.662 1.00 16.68 C ATOM 413 CZ2 TRP A 365 14.555 20.441 35.298 1.00 13.99 C ATOM 414 CZ3 TRP A 365 15.348 19.716 33.126 1.00 15.17 C ATOM 415 CH2 TRP A 365 14.364 20.294 33.945 1.00 14.16 C ATOM 416 HE1 TRP A 365 15.683 20.374 37.940 1.00 0.00 H ATOM 417 H TRP A 365 18.340 16.346 37.006 1.00 0.00 H ATOM 418 N PRO A 366 20.649 16.558 33.308 1.00 23.39 N ATOM 419 CA PRO A 366 22.019 16.321 32.861 1.00 23.96 C ATOM 420 C PRO A 366 22.992 17.284 33.524 1.00 24.22 C ATOM 421 O PRO A 366 22.616 18.398 33.904 1.00 24.45 O ATOM 422 CB PRO A 366 21.947 16.587 31.353 1.00 24.23 C ATOM 423 CG PRO A 366 20.529 16.382 30.996 1.00 24.24 C ATOM 424 CD PRO A 366 19.738 16.820 32.180 1.00 23.69 C ATOM 425 N ALA A 367 24.241 16.861 33.677 1.00 24.63 N ATOM 426 CA ALA A 367 25.260 17.752 34.209 1.00 24.91 C ATOM 427 C ALA A 367 25.401 18.968 33.294 1.00 25.16 C ATOM 428 O ALA A 367 25.323 18.843 32.070 1.00 25.90 O ATOM 429 CB ALA A 367 26.603 17.027 34.347 1.00 25.06 C ATOM 430 H ALA A 367 24.492 15.886 33.415 1.00 0.00 H ATOM 431 N GLY A 368 25.580 20.132 33.904 1.00 25.37 N ATOM 432 CA GLY A 368 25.814 21.373 33.177 1.00 25.33 C ATOM 433 C GLY A 368 24.586 21.993 32.525 1.00 24.86 C ATOM 434 O GLY A 368 24.727 22.867 31.668 1.00 25.81 O ATOM 435 H GLY A 368 25.552 20.160 34.943 1.00 0.00 H ATOM 436 N VAL A 369 23.388 21.569 32.923 1.00 23.96 N ATOM 437 CA VAL A 369 22.161 22.118 32.335 1.00 22.73 C ATOM 438 C VAL A 369 22.038 23.618 32.598 1.00 21.95 C ATOM 439 O VAL A 369 22.299 24.096 33.699 1.00 21.76 O ATOM 440 CB VAL A 369 20.888 21.397 32.847 1.00 22.67 C ATOM 441 CG1 VAL A 369 20.649 21.683 34.328 1.00 23.43 C ATOM 442 CG2 VAL A 369 19.671 21.807 32.008 1.00 22.44 C ATOM 443 H VAL A 369 23.321 20.839 33.661 1.00 0.00 H ATOM 444 N ASN A 370 21.651 24.360 31.565 1.00 21.23 N ATOM 445 CA ASN A 370 21.372 25.786 31.696 1.00 20.49 C ATOM 446 C ASN A 370 20.212 25.991 32.685 1.00 20.56 C ATOM 447 O ASN A 370 19.130 25.444 32.483 1.00 19.41 O ATOM 448 CB ASN A 370 21.016 26.350 30.311 1.00 20.55 C ATOM 449 CG ASN A 370 20.884 27.866 30.292 1.00 20.34 C ATOM 450 OD1 ASN A 370 20.560 28.502 31.300 1.00 21.07 O ATOM 451 ND2 ASN A 370 21.112 28.454 29.116 1.00 22.17 N ATOM 452 HD22 ASN A 370 21.383 27.881 28.292 1.00 0.00 H ATOM 453 HD21 ASN A 370 21.019 29.486 29.024 1.00 0.00 H ATOM 454 H ASN A 370 21.544 23.910 30.634 1.00 0.00 H ATOM 455 N PRO A 371 20.427 26.770 33.763 1.00 20.51 N ATOM 456 CA PRO A 371 19.349 27.014 34.738 1.00 20.68 C ATOM 457 C PRO A 371 18.062 27.609 34.155 1.00 20.17 C ATOM 458 O PRO A 371 16.972 27.406 34.716 1.00 20.08 O ATOM 459 CB PRO A 371 19.991 27.996 35.737 1.00 20.66 C ATOM 460 CG PRO A 371 21.446 27.801 35.582 1.00 22.01 C ATOM 461 CD PRO A 371 21.678 27.457 34.149 1.00 21.32 C ATOM 462 N LEU A 372 18.171 28.325 33.033 1.00 19.33 N ATOM 463 CA LEU A 372 16.995 28.874 32.360 1.00 18.95 C ATOM 464 C LEU A 372 16.065 27.778 31.853 1.00 17.82 C ATOM 465 O LEU A 372 14.895 28.025 31.597 1.00 17.53 O ATOM 466 CB LEU A 372 17.409 29.756 31.172 1.00 19.53 C ATOM 467 CG LEU A 372 18.105 31.080 31.491 1.00 21.11 C ATOM 468 CD1 LEU A 372 18.716 31.673 30.217 1.00 23.20 C ATOM 469 CD2 LEU A 372 17.133 32.046 32.134 1.00 23.09 C ATOM 470 H LEU A 372 19.114 28.496 32.629 1.00 0.00 H ATOM 471 N TRP A 373 16.595 26.569 31.702 1.00 16.30 N ATOM 472 CA TRP A 373 15.842 25.466 31.127 1.00 15.96 C ATOM 473 C TRP A 373 15.050 24.654 32.142 1.00 15.32 C ATOM 474 O TRP A 373 14.240 23.823 31.751 1.00 15.10 O ATOM 475 CB TRP A 373 16.807 24.495 30.452 1.00 15.45 C ATOM 476 CG TRP A 373 17.526 25.015 29.240 1.00 15.15 C ATOM 477 CD1 TRP A 373 17.711 26.322 28.865 1.00 15.41 C ATOM 478 CD2 TRP A 373 18.196 24.217 28.262 1.00 15.70 C ATOM 479 NE1 TRP A 373 18.439 26.371 27.702 1.00 15.72 N ATOM 480 CE2 TRP A 373 18.757 25.097 27.317 1.00 14.97 C ATOM 481 CE3 TRP A 373 18.370 22.840 28.091 1.00 16.43 C ATOM 482 CZ2 TRP A 373 19.479 24.643 26.213 1.00 15.37 C ATOM 483 CZ3 TRP A 373 19.082 22.390 26.987 1.00 16.09 C ATOM 484 CH2 TRP A 373 19.627 23.294 26.067 1.00 15.06 C ATOM 485 HE1 TRP A 373 18.706 27.238 27.194 1.00 0.00 H ATOM 486 H TRP A 373 17.577 26.407 32.004 1.00 0.00 H ATOM 487 N THR A 374 15.296 24.872 33.432 1.00 15.04 N ATOM 488 CA THR A 374 14.807 23.955 34.470 1.00 15.33 C ATOM 489 C THR A 374 13.585 24.448 35.243 1.00 15.21 C ATOM 490 O THR A 374 13.079 23.731 36.105 1.00 14.50 O ATOM 491 CB THR A 374 15.916 23.685 35.496 1.00 15.87 C ATOM 492 OG1 THR A 374 16.164 24.883 36.234 1.00 17.26 O ATOM 493 CG2 THR A 374 17.209 23.221 34.809 1.00 17.06 C ATOM 494 HG1 THR A 374 16.879 24.718 36.899 1.00 0.00 H ATOM 495 H THR A 374 15.846 25.709 33.711 1.00 0.00 H ATOM 496 N TYR A 375 13.134 25.671 34.967 1.00 15.33 N ATOM 497 CA TYR A 375 11.968 26.258 35.648 1.00 15.62 C ATOM 498 C TYR A 375 12.160 26.327 37.169 1.00 15.76 C ATOM 499 O TYR A 375 11.196 26.395 37.926 1.00 14.78 O ATOM 500 CB TYR A 375 10.677 25.487 35.300 1.00 15.58 C ATOM 501 CG TYR A 375 9.444 26.352 35.209 1.00 15.43 C ATOM 502 CD1 TYR A 375 9.337 27.320 34.234 1.00 14.63 C ATOM 503 CD2 TYR A 375 8.383 26.187 36.089 1.00 15.17 C ATOM 504 CE1 TYR A 375 8.221 28.125 34.147 1.00 14.79 C ATOM 505 CE2 TYR A 375 7.255 26.970 35.998 1.00 14.11 C ATOM 506 CZ TYR A 375 7.185 27.942 35.033 1.00 14.70 C ATOM 507 OH TYR A 375 6.052 28.728 34.922 1.00 16.76 O ATOM 508 HH TYR A 375 6.170 29.372 34.180 1.00 0.00 H ATOM 509 H TYR A 375 13.625 26.233 34.242 1.00 0.00 H ATOM 510 N GLY A 376 13.413 26.316 37.613 1.00 16.78 N ATOM 511 CA GLY A 376 13.720 26.277 39.038 1.00 17.18 C ATOM 512 C GLY A 376 13.415 24.970 39.740 1.00 18.00 C ATOM 513 O GLY A 376 13.464 24.918 40.968 1.00 19.12 O ATOM 514 H GLY A 376 14.194 26.336 36.927 1.00 0.00 H ATOM 515 N GLY A 377 13.099 23.913 38.990 1.00 17.84 N ATOM 516 CA GLY A 377 12.749 22.628 39.574 1.00 18.15 C ATOM 517 C GLY A 377 13.966 21.758 39.836 1.00 18.49 C ATOM 518 O GLY A 377 14.916 21.755 39.054 1.00 19.08 O ATOM 519 H GLY A 377 13.103 24.011 37.955 1.00 0.00 H ATOM 520 N GLY A 378 13.933 21.003 40.931 1.00 18.69 N ATOM 521 CA GLY A 378 15.076 20.174 41.325 1.00 18.54 C ATOM 522 C GLY A 378 15.290 18.988 40.411 1.00 18.04 C ATOM 523 O GLY A 378 16.417 18.505 40.258 1.00 18.88 O ATOM 524 H GLY A 378 13.077 21.001 41.521 1.00 0.00 H ATOM 525 N THR A 379 14.200 18.524 39.809 1.00 17.75 N ATOM 526 CA THR A 379 14.218 17.440 38.843 1.00 17.43 C ATOM 527 C THR A 379 13.299 17.803 37.687 1.00 16.69 C ATOM 528 O THR A 379 12.416 18.663 37.836 1.00 15.20 O ATOM 529 CB THR A 379 13.684 16.122 39.451 1.00 17.64 C ATOM 530 OG1 THR A 379 12.300 16.271 39.815 1.00 19.37 O ATOM 531 CG2 THR A 379 14.504 15.712 40.677 1.00 19.81 C ATOM 532 HG1 THR A 379 11.969 15.422 40.203 1.00 0.00 H ATOM 533 H THR A 379 13.285 18.960 40.042 1.00 0.00 H ATOM 534 N PRO A 380 13.471 17.150 36.537 1.00 15.70 N ATOM 535 CA PRO A 380 12.582 17.439 35.417 1.00 15.76 C ATOM 536 C PRO A 380 11.102 17.210 35.737 1.00 15.52 C ATOM 537 O PRO A 380 10.245 18.006 35.345 1.00 15.97 O ATOM 538 CB PRO A 380 13.094 16.500 34.325 1.00 16.00 C ATOM 539 CG PRO A 380 14.545 16.362 34.646 1.00 15.77 C ATOM 540 CD PRO A 380 14.592 16.278 36.129 1.00 15.63 C ATOM 541 N GLY A 381 10.795 16.144 36.467 1.00 15.57 N ATOM 542 CA GLY A 381 9.422 15.853 36.818 1.00 15.50 C ATOM 543 C GLY A 381 8.795 16.954 37.648 1.00 15.38 C ATOM 544 O GLY A 381 7.655 17.348 37.401 1.00 15.00 O ATOM 545 H GLY A 381 11.552 15.509 36.791 1.00 0.00 H ATOM 546 N GLU A 382 9.532 17.453 38.633 1.00 15.28 N ATOM 547 CA GLU A 382 9.035 18.544 39.460 1.00 15.48 C ATOM 548 C GLU A 382 8.813 19.806 38.626 1.00 14.98 C ATOM 549 O GLU A 382 7.809 20.491 38.805 1.00 14.55 O ATOM 550 CB GLU A 382 9.983 18.842 40.615 1.00 15.98 C ATOM 551 CG GLU A 382 10.006 17.777 41.711 1.00 19.29 C ATOM 552 CD GLU A 382 11.111 18.049 42.711 1.00 23.06 C ATOM 553 OE1 GLU A 382 12.292 17.938 42.334 1.00 26.87 O ATOM 554 OE2 GLU A 382 10.801 18.400 43.872 1.00 29.45 O ATOM 555 H GLU A 382 10.477 17.060 38.817 1.00 0.00 H ATOM 556 N ALA A 383 9.742 20.090 37.720 1.00 13.91 N ATOM 557 CA ALA A 383 9.671 21.274 36.873 1.00 13.29 C ATOM 558 C ALA A 383 8.465 21.214 35.933 1.00 13.70 C ATOM 559 O ALA A 383 7.768 22.211 35.754 1.00 13.48 O ATOM 560 CB ALA A 383 10.963 21.448 36.072 1.00 13.52 C ATOM 561 H ALA A 383 10.550 19.444 37.611 1.00 0.00 H ATOM 562 N ILE A 384 8.215 20.048 35.339 1.00 13.62 N ATOM 563 CA ILE A 384 7.078 19.885 34.435 1.00 14.17 C ATOM 564 C ILE A 384 5.752 20.038 35.175 1.00 14.02 C ATOM 565 O ILE A 384 4.833 20.694 34.685 1.00 14.33 O ATOM 566 CB ILE A 384 7.136 18.528 33.703 1.00 15.14 C ATOM 567 CG1 ILE A 384 8.235 18.572 32.639 1.00 17.57 C ATOM 568 CG2 ILE A 384 5.772 18.134 33.125 1.00 15.67 C ATOM 569 CD1 ILE A 384 7.985 19.525 31.552 1.00 22.08 C ATOM 570 H ILE A 384 8.841 19.238 35.522 1.00 0.00 H ATOM 571 N ALA A 385 5.658 19.451 36.366 1.00 13.66 N ATOM 572 CA ALA A 385 4.464 19.578 37.184 1.00 13.65 C ATOM 573 C ALA A 385 4.224 21.039 37.559 1.00 13.65 C ATOM 574 O ALA A 385 3.094 21.514 37.525 1.00 14.21 O ATOM 575 CB ALA A 385 4.583 18.706 38.436 1.00 14.29 C ATOM 576 H ALA A 385 6.458 18.888 36.719 1.00 0.00 H ATOM 577 N ALA A 386 5.296 21.752 37.889 1.00 13.59 N ATOM 578 CA ALA A 386 5.198 23.167 38.257 1.00 13.58 C ATOM 579 C ALA A 386 4.782 24.015 37.062 1.00 13.91 C ATOM 580 O ALA A 386 3.932 24.904 37.198 1.00 13.51 O ATOM 581 CB ALA A 386 6.528 23.667 38.837 1.00 13.58 C ATOM 582 H ALA A 386 6.229 21.293 37.886 1.00 0.00 H ATOM 583 N TYR A 387 5.349 23.735 35.896 1.00 13.48 N ATOM 584 CA TYR A 387 4.992 24.467 34.675 1.00 13.50 C ATOM 585 C TYR A 387 3.504 24.291 34.354 1.00 14.08 C ATOM 586 O TYR A 387 2.788 25.261 34.074 1.00 13.79 O ATOM 587 CB TYR A 387 5.880 24.036 33.495 1.00 13.92 C ATOM 588 CG TYR A 387 5.707 24.898 32.266 1.00 14.27 C ATOM 589 CD1 TYR A 387 6.296 26.141 32.195 1.00 16.64 C ATOM 590 CD2 TYR A 387 4.970 24.465 31.183 1.00 13.46 C ATOM 591 CE1 TYR A 387 6.147 26.958 31.080 1.00 16.69 C ATOM 592 CE2 TYR A 387 4.810 25.276 30.057 1.00 14.72 C ATOM 593 CZ TYR A 387 5.397 26.518 30.019 1.00 14.96 C ATOM 594 OH TYR A 387 5.235 27.326 28.916 1.00 15.73 O ATOM 595 HH TYR A 387 5.721 28.177 29.057 1.00 0.00 H ATOM 596 H TYR A 387 6.062 22.980 35.846 1.00 0.00 H ATOM 597 N ARG A 388 3.020 23.056 34.421 1.00 14.04 N ATOM 598 CA ARG A 388 1.613 22.780 34.163 1.00 14.99 C ATOM 599 C ARG A 388 0.719 23.517 35.167 1.00 15.95 C ATOM 600 O ARG A 388 -0.314 24.075 34.795 1.00 16.38 O ATOM 601 CB ARG A 388 1.353 21.272 34.181 1.00 15.04 C ATOM 602 CG ARG A 388 1.987 20.552 33.004 1.00 15.83 C ATOM 603 CD ARG A 388 2.044 19.064 33.217 1.00 16.76 C ATOM 604 NE ARG A 388 2.264 18.361 31.958 1.00 17.09 N ATOM 605 CZ ARG A 388 2.496 17.055 31.856 1.00 18.41 C ATOM 606 NH1 ARG A 388 2.564 16.296 32.939 1.00 18.47 N ATOM 607 NH2 ARG A 388 2.673 16.510 30.659 1.00 19.22 N ATOM 608 HE ARG A 388 2.238 18.919 31.081 1.00 0.00 H ATOM 609 HH12 ARG A 388 2.746 15.276 32.849 1.00 0.00 H ATOM 610 HH11 ARG A 388 2.436 16.720 33.880 1.00 0.00 H ATOM 611 HH22 ARG A 388 2.855 15.490 30.574 1.00 0.00 H ATOM 612 HH21 ARG A 388 2.630 17.103 29.806 1.00 0.00 H ATOM 613 H ARG A 388 3.658 22.271 34.662 1.00 0.00 H ATOM 614 N ARG A 389 1.128 23.548 36.430 1.00 16.24 N ATOM 615 CA ARG A 389 0.335 24.219 37.458 1.00 17.02 C ATOM 616 C ARG A 389 0.336 25.737 37.242 1.00 16.98 C ATOM 617 O ARG A 389 -0.712 26.390 37.321 1.00 17.17 O ATOM 618 CB ARG A 389 0.847 23.830 38.845 1.00 17.92 C ATOM 619 CG ARG A 389 -0.001 24.335 40.004 1.00 21.09 C ATOM 620 CD ARG A 389 0.194 23.438 41.222 1.00 25.47 C ATOM 621 NE ARG A 389 -0.702 23.786 42.322 1.00 29.31 N ATOM 622 CZ ARG A 389 -1.021 22.977 43.332 1.00 32.14 C ATOM 623 NH1 ARG A 389 -0.533 21.741 43.408 1.00 33.81 N ATOM 624 NH2 ARG A 389 -1.842 23.409 44.277 1.00 34.04 N ATOM 625 HE ARG A 389 -1.123 24.737 42.317 1.00 0.00 H ATOM 626 HH12 ARG A 389 -0.795 21.127 44.205 1.00 0.00 H ATOM 627 HH11 ARG A 389 0.110 21.390 42.670 1.00 0.00 H ATOM 628 HH22 ARG A 389 -2.097 22.785 45.069 1.00 0.00 H ATOM 629 HH21 ARG A 389 -2.232 24.372 44.227 1.00 0.00 H ATOM 630 H ARG A 389 2.024 23.089 36.691 1.00 0.00 H ATOM 631 N ALA A 390 1.500 26.282 36.933 1.00 16.17 N ATOM 632 CA ALA A 390 1.650 27.727 36.710 1.00 16.54 C ATOM 633 C ALA A 390 0.846 28.219 35.526 1.00 17.08 C ATOM 634 O ALA A 390 0.153 29.243 35.623 1.00 16.28 O ATOM 635 CB ALA A 390 3.097 28.088 36.516 1.00 16.63 C ATOM 636 H ALA A 390 2.336 25.669 36.845 1.00 0.00 H ATOM 637 N ILE A 391 0.927 27.523 34.396 1.00 18.07 N ATOM 638 CA ILE A 391 0.271 28.051 33.192 1.00 19.03 C ATOM 639 C ILE A 391 -1.255 28.011 33.351 1.00 19.63 C ATOM 640 O ILE A 391 -1.969 28.764 32.688 1.00 20.44 O ATOM 641 CB ILE A 391 0.751 27.385 31.867 1.00 19.01 C ATOM 642 CG1 ILE A 391 0.364 25.911 31.812 1.00 18.54 C ATOM 643 CG2 ILE A 391 2.245 27.601 31.675 1.00 20.11 C ATOM 644 CD1 ILE A 391 0.935 25.191 30.610 1.00 20.33 C ATOM 645 H ILE A 391 1.445 26.622 34.365 1.00 0.00 H ATOM 646 N ALA A 392 -1.748 27.183 34.269 1.00 20.11 N ATOM 647 CA ALA A 392 -3.166 27.174 34.619 1.00 20.47 C ATOM 648 C ALA A 392 -3.616 28.515 35.239 1.00 20.40 C ATOM 649 O ALA A 392 -4.809 28.856 35.190 1.00 21.91 O ATOM 650 CB ALA A 392 -3.481 26.013 35.554 1.00 21.20 C ATOM 651 H ALA A 392 -1.105 26.523 34.751 1.00 0.00 H ATOM 652 N ALA A 393 -2.673 29.276 35.794 1.00 20.27 N ATOM 653 CA ALA A 393 -2.953 30.619 36.341 1.00 19.77 C ATOM 654 C ALA A 393 -2.937 31.732 35.285 1.00 20.32 C ATOM 655 O ALA A 393 -3.210 32.895 35.598 1.00 20.53 O ATOM 656 CB ALA A 393 -1.971 30.956 37.459 1.00 19.65 C ATOM 657 H ALA A 393 -1.701 28.909 35.844 1.00 0.00 H ATOM 658 N LYS A 394 -2.601 31.399 34.045 1.00 19.66 N ATOM 659 CA LYS A 394 -2.664 32.370 32.956 1.00 19.79 C ATOM 660 C LYS A 394 -4.111 32.570 32.532 1.00 19.69 C ATOM 661 O LYS A 394 -4.947 31.689 32.702 1.00 20.01 O ATOM 662 CB LYS A 394 -1.842 31.900 31.755 1.00 19.86 C ATOM 663 CG LYS A 394 -0.353 32.040 31.922 1.00 20.89 C ATOM 664 CD LYS A 394 0.353 31.586 30.644 1.00 22.51 C ATOM 665 CE LYS A 394 1.696 32.234 30.496 1.00 25.11 C ATOM 666 NZ LYS A 394 2.310 31.904 29.181 1.00 27.01 N ATOM 667 HZ1 LYS A 394 2.427 30.874 29.103 1.00 0.00 H ATOM 668 HZ2 LYS A 394 1.691 32.242 28.416 1.00 0.00 H ATOM 669 HZ3 LYS A 394 3.239 32.367 29.108 1.00 0.00 H ATOM 670 H LYS A 394 -2.287 30.428 33.845 1.00 0.00 H ATOM 671 N SER A 395 -4.393 33.746 31.984 1.00 19.44 N ATOM 672 CA SER A 395 -5.714 34.061 31.443 1.00 19.27 C ATOM 673 C SER A 395 -5.629 34.216 29.932 1.00 19.83 C ATOM 674 O SER A 395 -4.552 34.124 29.353 1.00 19.43 O ATOM 675 CB SER A 395 -6.232 35.359 32.063 1.00 18.96 C ATOM 676 OG SER A 395 -5.521 36.491 31.576 1.00 17.51 O ATOM 677 HG SER A 395 -4.561 36.398 31.800 1.00 0.00 H ATOM 678 H SER A 395 -3.647 34.469 31.938 1.00 0.00 H ATOM 679 N ASP A 396 -6.773 34.486 29.300 1.00 21.00 N ATOM 680 CA ASP A 396 -6.794 34.806 27.872 1.00 22.00 C ATOM 681 C ASP A 396 -5.821 35.941 27.538 1.00 22.45 C ATOM 682 O ASP A 396 -5.199 35.942 26.477 1.00 22.46 O ATOM 683 CB ASP A 396 -8.208 35.213 27.418 1.00 22.26 C ATOM 684 CG ASP A 396 -9.234 34.091 27.539 1.00 24.73 C ATOM 685 OD1 ASP A 396 -8.858 32.903 27.659 1.00 27.03 O ATOM 686 OD2 ASP A 396 -10.443 34.407 27.495 1.00 25.19 O ATOM 687 H ASP A 396 -7.666 34.469 29.832 1.00 0.00 H ATOM 688 N LEU A 397 -5.681 36.896 28.456 1.00 22.42 N ATOM 689 CA LEU A 397 -4.802 38.035 28.254 1.00 23.18 C ATOM 690 C LEU A 397 -3.361 37.589 28.015 1.00 23.79 C ATOM 691 O LEU A 397 -2.709 38.056 27.079 1.00 24.29 O ATOM 692 CB LEU A 397 -4.910 38.989 29.458 1.00 22.93 C ATOM 693 CG LEU A 397 -4.411 40.430 29.357 1.00 23.20 C ATOM 694 CD1 LEU A 397 -2.898 40.451 29.441 1.00 23.47 C ATOM 695 CD2 LEU A 397 -4.900 41.122 28.086 1.00 22.29 C ATOM 696 H LEU A 397 -6.217 36.824 29.344 1.00 0.00 H ATOM 697 N GLU A 398 -2.873 36.655 28.826 1.00 24.59 N ATOM 698 CA GLU A 398 -1.496 36.182 28.681 1.00 25.20 C ATOM 699 C GLU A 398 -1.321 35.306 27.440 1.00 26.67 C ATOM 700 O GLU A 398 -0.316 35.423 26.746 1.00 27.17 O ATOM 701 CB GLU A 398 -1.027 35.433 29.930 1.00 24.93 C ATOM 702 CG GLU A 398 -0.735 36.338 31.124 1.00 23.58 C ATOM 703 CD GLU A 398 -1.983 36.849 31.819 1.00 20.83 C ATOM 704 OE1 GLU A 398 -2.929 36.062 32.015 1.00 20.53 O ATOM 705 OE2 GLU A 398 -2.013 38.043 32.181 1.00 20.25 O ATOM 706 H GLU A 398 -3.477 36.256 29.572 1.00 0.00 H ATOM 707 N ARG A 399 -2.307 34.459 27.154 1.00 27.61 N ATOM 708 CA ARG A 399 -2.240 33.539 26.013 1.00 28.12 C ATOM 709 C ARG A 399 -2.282 34.273 24.670 1.00 28.82 C ATOM 710 O ARG A 399 -1.827 33.744 23.655 1.00 29.29 O ATOM 711 CB ARG A 399 -3.371 32.506 26.095 1.00 27.92 C ATOM 712 CG ARG A 399 -3.224 31.536 27.260 1.00 27.50 C ATOM 713 CD ARG A 399 -4.259 30.421 27.217 1.00 27.04 C ATOM 714 NE ARG A 399 -5.539 30.802 27.809 1.00 26.00 N ATOM 715 CZ ARG A 399 -5.813 30.724 29.108 1.00 25.89 C ATOM 716 NH1 ARG A 399 -4.894 30.288 29.957 1.00 26.17 N ATOM 717 NH2 ARG A 399 -7.008 31.080 29.560 1.00 25.54 N ATOM 718 HE ARG A 399 -6.283 31.157 27.175 1.00 0.00 H ATOM 719 HH12 ARG A 399 -5.111 30.228 30.972 1.00 0.00 H ATOM 720 HH11 ARG A 399 -3.956 30.006 29.608 1.00 0.00 H ATOM 721 HH22 ARG A 399 -7.219 31.018 30.576 1.00 0.00 H ATOM 722 HH21 ARG A 399 -7.734 31.421 28.898 1.00 0.00 H ATOM 723 H ARG A 399 -3.153 34.449 27.759 1.00 0.00 H ATOM 724 N GLN A 400 -2.837 35.487 24.669 1.00 29.49 N ATOM 725 CA GLN A 400 -2.868 36.309 23.459 1.00 29.79 C ATOM 726 C GLN A 400 -1.564 37.104 23.356 1.00 30.01 C ATOM 727 O GLN A 400 -1.237 37.640 22.298 1.00 30.40 O ATOM 728 CB GLN A 400 -4.110 37.226 23.448 1.00 29.89 C ATOM 729 CG GLN A 400 -3.888 38.679 23.864 1.00 29.99 C ATOM 730 CD GLN A 400 -3.852 39.614 22.669 1.00 29.73 C ATOM 731 OE1 GLN A 400 -4.844 39.759 21.956 1.00 31.78 O ATOM 732 NE2 GLN A 400 -2.716 40.259 22.450 1.00 30.58 N ATOM 733 HE22 GLN A 400 -1.902 40.106 23.079 1.00 0.00 H ATOM 734 HE21 GLN A 400 -2.638 40.918 21.649 1.00 0.00 H ATOM 735 H GLN A 400 -3.256 35.856 25.546 1.00 0.00 H TER 736 GLN A 400 ATOM 737 N LYS A 405 7.954 33.986 25.697 1.00 24.60 N ATOM 738 CA LYS A 405 8.189 32.554 25.491 1.00 24.28 C ATOM 739 C LYS A 405 8.762 31.881 26.735 1.00 22.90 C ATOM 740 O LYS A 405 9.875 32.194 27.167 1.00 23.72 O ATOM 741 CB LYS A 405 9.152 32.330 24.321 1.00 24.79 C ATOM 742 CG LYS A 405 8.617 32.752 22.960 1.00 26.40 C ATOM 743 CD LYS A 405 7.558 31.789 22.450 1.00 27.73 C ATOM 744 CE LYS A 405 7.120 32.124 21.030 1.00 29.13 C ATOM 745 NZ LYS A 405 6.389 33.421 20.931 1.00 30.72 N ATOM 746 HZ1 LYS A 405 5.535 33.382 21.523 1.00 0.00 H ATOM 747 HZ2 LYS A 405 7.006 34.191 21.260 1.00 0.00 H ATOM 748 HZ3 LYS A 405 6.119 33.591 19.941 1.00 0.00 H ATOM 749 HN3 LYS A 405 8.853 34.453 25.934 1.00 0.00 H ATOM 750 HN2 LYS A 405 7.278 34.117 26.477 1.00 0.00 H ATOM 751 HN1 LYS A 405 7.565 34.401 24.826 1.00 0.00 H ATOM 752 N THR A 406 7.991 30.962 27.308 1.00 21.35 N ATOM 753 CA THR A 406 8.420 30.179 28.463 1.00 19.63 C ATOM 754 C THR A 406 8.358 28.700 28.130 1.00 18.52 C ATOM 755 O THR A 406 7.726 28.302 27.167 1.00 17.97 O ATOM 756 CB THR A 406 7.524 30.427 29.692 1.00 19.34 C ATOM 757 OG1 THR A 406 6.173 30.024 29.419 1.00 19.56 O ATOM 758 CG2 THR A 406 7.559 31.914 30.097 1.00 20.42 C ATOM 759 HG1 THR A 406 5.612 30.190 30.218 1.00 0.00 H ATOM 760 H THR A 406 7.042 30.794 26.917 1.00 0.00 H ATOM 761 N GLY A 407 9.025 27.888 28.936 1.00 17.62 N ATOM 762 CA GLY A 407 9.052 26.458 28.696 1.00 16.91 C ATOM 763 C GLY A 407 9.989 25.764 29.653 1.00 16.25 C ATOM 764 O GLY A 407 10.602 26.402 30.509 1.00 16.36 O ATOM 765 H GLY A 407 9.536 28.281 29.752 1.00 0.00 H ATOM 766 N VAL A 408 10.084 24.446 29.506 1.00 15.50 N ATOM 767 CA VAL A 408 10.884 23.606 30.384 1.00 15.65 C ATOM 768 C VAL A 408 11.478 22.461 29.570 1.00 14.39 C ATOM 769 O VAL A 408 10.787 21.818 28.786 1.00 14.27 O ATOM 770 CB VAL A 408 10.032 22.996 31.525 1.00 16.08 C ATOM 771 CG1 VAL A 408 10.926 22.326 32.578 1.00 17.34 C ATOM 772 CG2 VAL A 408 9.169 24.048 32.175 1.00 18.75 C ATOM 773 H VAL A 408 9.562 23.995 28.728 1.00 0.00 H ATOM 774 N PHE A 409 12.765 22.231 29.778 1.00 13.57 N ATOM 775 CA PHE A 409 13.505 21.090 29.217 1.00 13.97 C ATOM 776 C PHE A 409 13.051 19.805 29.888 1.00 14.36 C ATOM 777 O PHE A 409 12.884 19.770 31.103 1.00 14.81 O ATOM 778 CB PHE A 409 14.984 21.369 29.453 1.00 13.49 C ATOM 779 CG PHE A 409 15.932 20.291 29.007 1.00 13.35 C ATOM 780 CD1 PHE A 409 15.779 19.619 27.801 1.00 14.11 C ATOM 781 CD2 PHE A 409 17.062 20.031 29.776 1.00 13.35 C ATOM 782 CE1 PHE A 409 16.707 18.660 27.401 1.00 13.67 C ATOM 783 CE2 PHE A 409 17.997 19.083 29.381 1.00 14.77 C ATOM 784 CZ PHE A 409 17.823 18.405 28.194 1.00 14.29 C ATOM 785 H PHE A 409 13.287 22.901 30.378 1.00 0.00 H ATOM 786 N LEU A 410 12.818 18.754 29.106 1.00 14.66 N ATOM 787 CA LEU A 410 12.398 17.475 29.674 1.00 14.95 C ATOM 788 C LEU A 410 13.558 16.664 30.253 1.00 15.20 C ATOM 789 O LEU A 410 13.321 15.666 30.938 1.00 15.48 O ATOM 790 CB LEU A 410 11.657 16.628 28.640 1.00 15.07 C ATOM 791 CG LEU A 410 10.383 17.217 28.027 1.00 16.37 C ATOM 792 CD1 LEU A 410 9.606 16.123 27.302 1.00 17.38 C ATOM 793 CD2 LEU A 410 9.484 17.902 29.056 1.00 19.33 C ATOM 794 H LEU A 410 12.936 18.844 28.077 1.00 0.00 H ATOM 795 N GLY A 411 14.788 17.081 29.972 1.00 15.67 N ATOM 796 CA GLY A 411 15.977 16.390 30.443 1.00 16.11 C ATOM 797 C GLY A 411 16.464 15.347 29.458 1.00 16.77 C ATOM 798 O GLY A 411 17.461 14.668 29.723 1.00 17.86 O ATOM 799 H GLY A 411 14.905 17.936 29.392 1.00 0.00 H ATOM 800 N SER A 412 15.794 15.266 28.307 1.00 16.38 N ATOM 801 CA SER A 412 16.031 14.209 27.326 1.00 16.59 C ATOM 802 C SER A 412 16.132 14.785 25.918 1.00 15.58 C ATOM 803 O SER A 412 15.774 15.943 25.669 1.00 14.77 O ATOM 804 CB SER A 412 14.908 13.183 27.384 1.00 17.20 C ATOM 805 OG SER A 412 13.651 13.776 27.118 1.00 19.98 O ATOM 806 HG SER A 412 12.945 13.084 27.163 1.00 0.00 H ATOM 807 H SER A 412 15.072 15.986 28.099 1.00 0.00 H ATOM 808 N TYR A 413 16.612 13.950 25.006 1.00 15.15 N ATOM 809 CA TYR A 413 16.951 14.354 23.650 1.00 14.87 C ATOM 810 C TYR A 413 16.267 13.482 22.621 1.00 14.69 C ATOM 811 O TYR A 413 15.955 12.317 22.878 1.00 15.30 O ATOM 812 CB TYR A 413 18.465 14.273 23.439 1.00 14.73 C ATOM 813 CG TYR A 413 19.218 15.197 24.343 1.00 16.29 C ATOM 814 CD1 TYR A 413 19.493 14.831 25.661 1.00 18.30 C ATOM 815 CD2 TYR A 413 19.648 16.438 23.904 1.00 18.01 C ATOM 816 CE1 TYR A 413 20.177 15.678 26.513 1.00 19.91 C ATOM 817 CE2 TYR A 413 20.344 17.298 24.765 1.00 18.64 C ATOM 818 CZ TYR A 413 20.597 16.895 26.069 1.00 20.14 C ATOM 819 OH TYR A 413 21.284 17.720 26.954 1.00 24.43 O ATOM 820 HH TYR A 413 20.786 18.568 27.067 1.00 0.00 H ATOM 821 H TYR A 413 16.753 12.955 25.274 1.00 0.00 H ATOM 822 N ALA A 414 16.043 14.064 21.446 1.00 14.50 N ATOM 823 CA ALA A 414 15.575 13.320 20.284 1.00 14.93 C ATOM 824 C ALA A 414 16.664 13.415 19.232 1.00 14.92 C ATOM 825 O ALA A 414 17.586 14.218 19.356 1.00 16.02 O ATOM 826 CB ALA A 414 14.239 13.900 19.770 1.00 14.79 C ATOM 827 H ALA A 414 16.208 15.087 21.353 1.00 0.00 H ATOM 828 N ILE A 415 16.575 12.582 18.206 1.00 14.32 N ATOM 829 CA ILE A 415 17.537 12.594 17.119 1.00 14.32 C ATOM 830 C ILE A 415 16.903 13.229 15.881 1.00 13.37 C ATOM 831 O ILE A 415 15.870 12.780 15.395 1.00 13.62 O ATOM 832 CB ILE A 415 18.007 11.162 16.781 1.00 14.29 C ATOM 833 CG1 ILE A 415 18.611 10.496 18.017 1.00 16.10 C ATOM 834 CG2 ILE A 415 19.021 11.186 15.638 1.00 14.72 C ATOM 835 CD1 ILE A 415 19.880 11.158 18.498 1.00 18.68 C ATOM 836 H ILE A 415 15.792 11.898 18.178 1.00 0.00 H ATOM 837 N ASN A 416 17.548 14.270 15.373 1.00 13.17 N ATOM 838 CA ASN A 416 17.136 14.874 14.127 1.00 13.29 C ATOM 839 C ASN A 416 17.428 13.888 12.991 1.00 14.31 C ATOM 840 O ASN A 416 18.565 13.470 12.802 1.00 14.18 O ATOM 841 CB ASN A 416 17.856 16.217 13.962 1.00 13.28 C ATOM 842 CG ASN A 416 17.550 16.905 12.655 1.00 13.05 C ATOM 843 OD1 ASN A 416 17.418 16.269 11.615 1.00 15.58 O ATOM 844 ND2 ASN A 416 17.449 18.228 12.698 1.00 12.74 N ATOM 845 HD22 ASN A 416 17.568 18.730 13.601 1.00 0.00 H ATOM 846 HD21 ASN A 416 17.251 18.763 11.828 1.00 0.00 H ATOM 847 H ASN A 416 18.367 14.660 15.882 1.00 0.00 H ATOM 848 N PRO A 417 16.390 13.485 12.253 1.00 14.24 N ATOM 849 CA PRO A 417 16.602 12.434 11.269 1.00 15.17 C ATOM 850 C PRO A 417 17.470 12.867 10.086 1.00 15.32 C ATOM 851 O PRO A 417 18.048 12.018 9.422 1.00 16.46 O ATOM 852 CB PRO A 417 15.177 12.104 10.809 1.00 15.11 C ATOM 853 CG PRO A 417 14.425 13.296 11.051 1.00 15.10 C ATOM 854 CD PRO A 417 14.976 13.896 12.295 1.00 14.48 C ATOM 855 N ALA A 418 17.546 14.166 9.812 1.00 15.08 N ATOM 856 CA ALA A 418 18.347 14.646 8.680 1.00 15.11 C ATOM 857 C ALA A 418 19.844 14.542 8.937 1.00 16.13 C ATOM 858 O ALA A 418 20.602 14.068 8.075 1.00 16.21 O ATOM 859 CB ALA A 418 17.974 16.083 8.325 1.00 14.93 C ATOM 860 H ALA A 418 17.033 14.848 10.406 1.00 0.00 H ATOM 861 N ASN A 419 20.271 15.011 10.109 1.00 16.95 N ATOM 862 CA ASN A 419 21.705 15.092 10.428 1.00 17.69 C ATOM 863 C ASN A 419 22.169 14.119 11.504 1.00 18.36 C ATOM 864 O ASN A 419 23.370 14.048 11.793 1.00 19.41 O ATOM 865 CB ASN A 419 22.103 16.531 10.784 1.00 17.66 C ATOM 866 CG ASN A 419 21.332 17.098 11.962 1.00 17.18 C ATOM 867 OD1 ASN A 419 20.774 16.364 12.768 1.00 17.56 O ATOM 868 ND2 ASN A 419 21.317 18.418 12.066 1.00 19.29 N ATOM 869 HD22 ASN A 419 21.805 19.001 11.357 1.00 0.00 H ATOM 870 HD21 ASN A 419 20.817 18.872 12.857 1.00 0.00 H ATOM 871 H ASN A 419 19.575 15.327 10.814 1.00 0.00 H ATOM 872 N GLY A 420 21.228 13.368 12.080 1.00 18.41 N ATOM 873 CA GLY A 420 21.525 12.394 13.107 1.00 18.96 C ATOM 874 C GLY A 420 21.958 12.994 14.430 1.00 19.09 C ATOM 875 O GLY A 420 22.421 12.266 15.313 1.00 19.54 O ATOM 876 H GLY A 420 20.240 13.488 11.778 1.00 0.00 H ATOM 877 N GLU A 421 21.802 14.309 14.584 1.00 18.86 N ATOM 878 CA GLU A 421 22.256 15.015 15.780 1.00 19.18 C ATOM 879 C GLU A 421 21.205 14.995 16.882 1.00 18.43 C ATOM 880 O GLU A 421 20.001 15.070 16.604 1.00 17.44 O ATOM 881 CB GLU A 421 22.611 16.470 15.452 1.00 19.70 C ATOM 882 CG GLU A 421 23.807 16.642 14.508 1.00 22.04 C ATOM 883 CD GLU A 421 25.119 16.163 15.114 1.00 24.89 C ATOM 884 OE1 GLU A 421 25.344 16.386 16.325 1.00 27.16 O ATOM 885 OE2 GLU A 421 25.930 15.565 14.372 1.00 27.35 O ATOM 886 H GLU A 421 21.341 14.852 13.826 1.00 0.00 H ATOM 887 N PRO A 422 21.646 14.904 18.146 1.00 17.44 N ATOM 888 CA PRO A 422 20.708 15.002 19.242 1.00 16.95 C ATOM 889 C PRO A 422 20.204 16.433 19.372 1.00 16.40 C ATOM 890 O PRO A 422 20.971 17.379 19.184 1.00 17.82 O ATOM 891 CB PRO A 422 21.547 14.622 20.461 1.00 17.41 C ATOM 892 CG PRO A 422 22.900 14.910 20.097 1.00 18.63 C ATOM 893 CD PRO A 422 23.022 14.690 18.632 1.00 17.26 C ATOM 894 N VAL A 423 18.920 16.576 19.670 1.00 15.22 N ATOM 895 CA VAL A 423 18.341 17.881 19.942 1.00 14.56 C ATOM 896 C VAL A 423 17.522 17.781 21.230 1.00 13.37 C ATOM 897 O VAL A 423 16.815 16.796 21.454 1.00 12.79 O ATOM 898 CB VAL A 423 17.448 18.387 18.764 1.00 14.86 C ATOM 899 CG1 VAL A 423 18.278 18.579 17.496 1.00 14.80 C ATOM 900 CG2 VAL A 423 16.303 17.452 18.500 1.00 16.53 C ATOM 901 H VAL A 423 18.312 15.733 19.710 1.00 0.00 H ATOM 902 N PRO A 424 17.601 18.807 22.088 1.00 12.92 N ATOM 903 CA PRO A 424 16.852 18.762 23.338 1.00 12.63 C ATOM 904 C PRO A 424 15.344 18.877 23.119 1.00 12.64 C ATOM 905 O PRO A 424 14.914 19.556 22.175 1.00 13.10 O ATOM 906 CB PRO A 424 17.390 19.976 24.108 1.00 12.90 C ATOM 907 CG PRO A 424 17.841 20.906 23.071 1.00 12.53 C ATOM 908 CD PRO A 424 18.401 20.037 21.974 1.00 12.26 C ATOM 909 N ILE A 425 14.574 18.248 24.000 1.00 12.27 N ATOM 910 CA ILE A 425 13.120 18.252 23.949 1.00 12.26 C ATOM 911 C ILE A 425 12.604 19.153 25.071 1.00 12.65 C ATOM 912 O ILE A 425 13.005 18.996 26.231 1.00 12.77 O ATOM 913 CB ILE A 425 12.539 16.840 24.151 1.00 12.46 C ATOM 914 CG1 ILE A 425 13.153 15.831 23.174 1.00 13.35 C ATOM 915 CG2 ILE A 425 11.020 16.863 24.008 1.00 13.93 C ATOM 916 CD1 ILE A 425 12.809 14.365 23.505 1.00 14.13 C ATOM 917 H ILE A 425 15.037 17.723 24.770 1.00 0.00 H ATOM 918 N PHE A 426 11.706 20.067 24.716 1.00 12.70 N ATOM 919 CA PHE A 426 11.043 20.968 25.667 1.00 12.67 C ATOM 920 C PHE A 426 9.535 20.790 25.607 1.00 12.99 C ATOM 921 O PHE A 426 8.999 20.288 24.610 1.00 12.94 O ATOM 922 CB PHE A 426 11.338 22.422 25.303 1.00 12.59 C ATOM 923 CG PHE A 426 12.759 22.828 25.513 1.00 12.44 C ATOM 924 CD1 PHE A 426 13.741 22.466 24.607 1.00 13.34 C ATOM 925 CD2 PHE A 426 13.119 23.601 26.621 1.00 14.10 C ATOM 926 CE1 PHE A 426 15.060 22.842 24.802 1.00 14.17 C ATOM 927 CE2 PHE A 426 14.433 23.974 26.823 1.00 14.32 C ATOM 928 CZ PHE A 426 15.411 23.596 25.913 1.00 14.88 C ATOM 929 H PHE A 426 11.460 20.148 23.709 1.00 0.00 H ATOM 930 N ILE A 427 8.850 21.233 26.661 1.00 13.07 N ATOM 931 CA ILE A 427 7.448 21.643 26.541 1.00 13.83 C ATOM 932 C ILE A 427 7.383 23.158 26.636 1.00 14.29 C ATOM 933 O ILE A 427 8.223 23.786 27.285 1.00 14.00 O ATOM 934 CB ILE A 427 6.514 21.017 27.597 1.00 14.12 C ATOM 935 CG1 ILE A 427 6.985 21.294 29.027 1.00 14.34 C ATOM 936 CG2 ILE A 427 6.355 19.528 27.363 1.00 14.06 C ATOM 937 CD1 ILE A 427 5.908 21.011 30.058 1.00 16.24 C ATOM 938 H ILE A 427 9.320 21.289 27.587 1.00 0.00 H ATOM 939 N ALA A 428 6.390 23.739 25.979 1.00 15.04 N ATOM 940 CA ALA A 428 6.215 25.190 26.002 1.00 15.95 C ATOM 941 C ALA A 428 4.781 25.462 25.637 1.00 17.03 C ATOM 942 O ALA A 428 4.224 24.816 24.741 1.00 16.78 O ATOM 943 CB ALA A 428 7.152 25.871 25.018 1.00 15.62 C ATOM 944 H ALA A 428 5.723 23.152 25.437 1.00 0.00 H ATOM 945 N ASP A 429 4.163 26.422 26.313 1.00 18.02 N ATOM 946 CA ASP A 429 2.762 26.692 26.045 1.00 18.49 C ATOM 947 C ASP A 429 2.499 27.414 24.711 1.00 18.35 C ATOM 948 O ASP A 429 1.343 27.522 24.330 1.00 19.99 O ATOM 949 CB ASP A 429 2.054 27.372 27.237 1.00 19.01 C ATOM 950 CG ASP A 429 2.452 28.817 27.441 1.00 20.57 C ATOM 951 OD1 ASP A 429 3.428 29.315 26.838 1.00 22.16 O ATOM 952 OD2 ASP A 429 1.768 29.460 28.275 1.00 24.44 O ATOM 953 H ASP A 429 4.677 26.976 27.028 1.00 0.00 H ATOM 954 N TYR A 430 3.547 27.832 23.989 1.00 18.05 N ATOM 955 CA TYR A 430 3.367 28.341 22.612 1.00 18.12 C ATOM 956 C TYR A 430 2.969 27.244 21.629 1.00 18.07 C ATOM 957 O TYR A 430 2.452 27.548 20.551 1.00 18.03 O ATOM 958 CB TYR A 430 4.557 29.203 22.120 1.00 18.23 C ATOM 959 CG TYR A 430 5.826 28.568 21.517 1.00 18.71 C ATOM 960 CD1 TYR A 430 6.919 28.214 22.316 1.00 18.74 C ATOM 961 CD2 TYR A 430 5.981 28.452 20.129 1.00 20.06 C ATOM 962 CE1 TYR A 430 8.108 27.700 21.757 1.00 17.82 C ATOM 963 CE2 TYR A 430 7.159 27.938 19.565 1.00 19.24 C ATOM 964 CZ TYR A 430 8.216 27.558 20.378 1.00 18.45 C ATOM 965 OH TYR A 430 9.394 27.068 19.832 1.00 18.56 O ATOM 966 HH TYR A 430 9.792 27.754 19.239 1.00 0.00 H ATOM 967 H TYR A 430 4.501 27.798 24.403 1.00 0.00 H ATOM 968 N VAL A 431 3.146 25.979 22.020 1.00 18.03 N ATOM 969 CA VAL A 431 2.700 24.841 21.220 1.00 17.64 C ATOM 970 C VAL A 431 1.396 24.303 21.781 1.00 18.58 C ATOM 971 O VAL A 431 1.310 23.976 22.977 1.00 18.14 O ATOM 972 CB VAL A 431 3.764 23.734 21.192 1.00 17.32 C ATOM 973 CG1 VAL A 431 3.262 22.515 20.414 1.00 15.85 C ATOM 974 CG2 VAL A 431 5.028 24.273 20.576 1.00 16.45 C ATOM 975 H VAL A 431 3.619 25.797 22.928 1.00 0.00 H ATOM 976 N LEU A 432 0.387 24.218 20.909 1.00 19.59 N ATOM 977 CA LEU A 432 -0.992 23.890 21.282 1.00 21.02 C ATOM 978 C LEU A 432 -1.272 22.393 21.161 1.00 21.55 C ATOM 979 O LEU A 432 -0.966 21.784 20.131 1.00 21.80 O ATOM 980 CB LEU A 432 -1.957 24.656 20.374 1.00 21.60 C ATOM 981 CG LEU A 432 -1.860 26.177 20.374 1.00 24.01 C ATOM 982 CD1 LEU A 432 -2.735 26.739 19.260 1.00 25.75 C ATOM 983 CD2 LEU A 432 -2.256 26.749 21.739 1.00 25.83 C ATOM 984 H LEU A 432 0.593 24.395 19.905 1.00 0.00 H ATOM 985 N ALA A 433 -1.868 21.800 22.194 1.00 22.32 N ATOM 986 CA ALA A 433 -2.008 20.339 22.270 1.00 23.27 C ATOM 987 C ALA A 433 -2.890 19.708 21.200 1.00 23.95 C ATOM 988 O ALA A 433 -2.609 18.598 20.737 1.00 25.18 O ATOM 989 CB ALA A 433 -2.518 19.921 23.647 1.00 23.44 C ATOM 990 H ALA A 433 -2.244 22.386 22.967 1.00 0.00 H ATOM 991 N GLY A 434 -3.962 20.395 20.826 1.00 24.29 N ATOM 992 CA GLY A 434 -4.949 19.846 19.897 1.00 24.13 C ATOM 993 C GLY A 434 -4.847 20.335 18.462 1.00 24.01 C ATOM 994 O GLY A 434 -5.837 20.306 17.727 1.00 24.66 O ATOM 995 H GLY A 434 -4.105 21.353 21.205 1.00 0.00 H ATOM 996 N TYR A 435 -3.657 20.770 18.058 1.00 22.82 N ATOM 997 CA TYR A 435 -3.407 21.228 16.700 1.00 22.03 C ATOM 998 C TYR A 435 -2.234 20.471 16.090 1.00 21.05 C ATOM 999 O TYR A 435 -1.241 20.233 16.758 1.00 19.95 O ATOM 1000 CB TYR A 435 -3.114 22.724 16.702 1.00 22.43 C ATOM 1001 CG TYR A 435 -3.152 23.309 15.328 1.00 24.73 C ATOM 1002 CD1 TYR A 435 -4.368 23.585 14.703 1.00 26.93 C ATOM 1003 CD2 TYR A 435 -1.980 23.565 14.634 1.00 26.73 C ATOM 1004 CE1 TYR A 435 -4.406 24.112 13.421 1.00 28.01 C ATOM 1005 CE2 TYR A 435 -2.005 24.089 13.357 1.00 27.09 C ATOM 1006 CZ TYR A 435 -3.219 24.362 12.757 1.00 27.85 C ATOM 1007 OH TYR A 435 -3.242 24.886 11.491 1.00 29.75 O ATOM 1008 HH TYR A 435 -4.181 25.022 11.208 1.00 0.00 H ATOM 1009 H TYR A 435 -2.873 20.783 18.741 1.00 0.00 H ATOM 1010 N GLY A 436 -2.345 20.099 14.818 1.00 20.11 N ATOM 1011 CA GLY A 436 -1.280 19.354 14.150 1.00 19.38 C ATOM 1012 C GLY A 436 -1.079 18.020 14.841 1.00 18.93 C ATOM 1013 O GLY A 436 -2.005 17.233 14.958 1.00 19.44 O ATOM 1014 H GLY A 436 -3.206 20.343 14.289 1.00 0.00 H ATOM 1015 N THR A 437 0.134 17.763 15.318 1.00 17.74 N ATOM 1016 CA THR A 437 0.413 16.574 16.115 1.00 16.92 C ATOM 1017 C THR A 437 0.643 16.937 17.581 1.00 16.46 C ATOM 1018 O THR A 437 0.974 16.062 18.388 1.00 17.42 O ATOM 1019 CB THR A 437 1.690 15.898 15.633 1.00 16.85 C ATOM 1020 OG1 THR A 437 2.764 16.820 15.813 1.00 15.65 O ATOM 1021 CG2 THR A 437 1.591 15.540 14.160 1.00 17.90 C ATOM 1022 HG1 THR A 437 3.609 16.405 15.507 1.00 0.00 H ATOM 1023 H THR A 437 0.907 18.429 15.117 1.00 0.00 H ATOM 1024 N GLY A 438 0.495 18.218 17.919 1.00 15.82 N ATOM 1025 CA GLY A 438 0.798 18.705 19.257 1.00 15.21 C ATOM 1026 C GLY A 438 2.285 18.806 19.538 1.00 14.68 C ATOM 1027 O GLY A 438 2.696 19.005 20.681 1.00 14.63 O ATOM 1028 H GLY A 438 0.152 18.891 17.204 1.00 0.00 H ATOM 1029 N ALA A 439 3.102 18.677 18.492 1.00 14.22 N ATOM 1030 CA ALA A 439 4.542 18.861 18.621 1.00 13.52 C ATOM 1031 C ALA A 439 5.122 19.504 17.375 1.00 13.28 C ATOM 1032 O ALA A 439 4.654 19.262 16.255 1.00 13.33 O ATOM 1033 CB ALA A 439 5.228 17.518 18.871 1.00 13.87 C ATOM 1034 H ALA A 439 2.702 18.439 17.562 1.00 0.00 H ATOM 1035 N ILE A 440 6.175 20.288 17.573 1.00 12.80 N ATOM 1036 CA ILE A 440 6.868 20.964 16.482 1.00 12.32 C ATOM 1037 C ILE A 440 8.354 20.633 16.499 1.00 12.27 C ATOM 1038 O ILE A 440 8.911 20.300 17.542 1.00 12.61 O ATOM 1039 CB ILE A 440 6.702 22.513 16.527 1.00 12.55 C ATOM 1040 CG1 ILE A 440 7.327 23.112 17.784 1.00 12.68 C ATOM 1041 CG2 ILE A 440 5.218 22.893 16.446 1.00 12.70 C ATOM 1042 CD1 ILE A 440 7.434 24.640 17.751 1.00 14.54 C ATOM 1043 H ILE A 440 6.519 20.426 18.545 1.00 0.00 H ATOM 1044 N MET A 441 8.985 20.755 15.334 1.00 12.06 N ATOM 1045 CA MET A 441 10.430 20.935 15.275 1.00 11.84 C ATOM 1046 C MET A 441 10.670 22.437 15.305 1.00 12.24 C ATOM 1047 O MET A 441 9.956 23.201 14.650 1.00 12.77 O ATOM 1048 CB MET A 441 11.034 20.267 14.043 1.00 12.21 C ATOM 1049 CG MET A 441 10.769 20.978 12.731 1.00 12.56 C ATOM 1050 SD MET A 441 11.384 19.994 11.353 1.00 14.40 S ATOM 1051 CE MET A 441 11.459 21.234 10.065 1.00 13.57 C ATOM 1052 H MET A 441 8.438 20.721 14.450 1.00 0.00 H ATOM 1053 N ALA A 442 11.644 22.870 16.086 1.00 11.52 N ATOM 1054 CA ALA A 442 11.919 24.291 16.205 1.00 11.25 C ATOM 1055 C ALA A 442 13.122 24.648 15.343 1.00 11.46 C ATOM 1056 O ALA A 442 14.190 24.027 15.441 1.00 12.21 O ATOM 1057 CB ALA A 442 12.135 24.668 17.650 1.00 11.93 C ATOM 1058 H ALA A 442 12.219 22.187 16.620 1.00 0.00 H ATOM 1059 N VAL A 443 12.919 25.630 14.470 1.00 11.64 N ATOM 1060 CA VAL A 443 13.919 26.086 13.523 1.00 11.56 C ATOM 1061 C VAL A 443 14.070 27.593 13.750 1.00 12.12 C ATOM 1062 O VAL A 443 13.428 28.400 13.084 1.00 12.04 O ATOM 1063 CB VAL A 443 13.523 25.773 12.067 1.00 11.65 C ATOM 1064 CG1 VAL A 443 14.601 26.227 11.087 1.00 11.87 C ATOM 1065 CG2 VAL A 443 13.233 24.260 11.884 1.00 12.00 C ATOM 1066 H VAL A 443 11.990 26.098 14.466 1.00 0.00 H ATOM 1067 N PRO A 444 14.876 27.971 14.743 1.00 12.19 N ATOM 1068 CA PRO A 444 14.997 29.385 15.093 1.00 12.26 C ATOM 1069 C PRO A 444 15.496 30.278 13.971 1.00 12.65 C ATOM 1070 O PRO A 444 15.141 31.461 13.921 1.00 13.17 O ATOM 1071 CB PRO A 444 16.003 29.390 16.252 1.00 12.78 C ATOM 1072 CG PRO A 444 16.457 28.020 16.420 1.00 14.13 C ATOM 1073 CD PRO A 444 15.632 27.093 15.650 1.00 12.55 C ATOM 1074 N GLY A 445 16.293 29.738 13.056 1.00 11.75 N ATOM 1075 CA GLY A 445 16.742 30.510 11.912 1.00 11.97 C ATOM 1076 C GLY A 445 15.632 31.044 11.019 1.00 11.86 C ATOM 1077 O GLY A 445 15.834 32.063 10.343 1.00 12.35 O ATOM 1078 H GLY A 445 16.599 28.750 13.161 1.00 0.00 H ATOM 1079 N HIS A 446 14.475 30.377 11.006 1.00 12.19 N ATOM 1080 CA HIS A 446 13.475 30.606 9.957 1.00 11.94 C ATOM 1081 C HIS A 446 12.028 30.699 10.405 1.00 12.09 C ATOM 1082 O HIS A 446 11.142 30.886 9.587 1.00 13.26 O ATOM 1083 CB HIS A 446 13.669 29.571 8.843 1.00 12.34 C ATOM 1084 CG HIS A 446 15.073 29.558 8.348 1.00 12.21 C ATOM 1085 ND1 HIS A 446 15.604 30.612 7.640 1.00 12.22 N ATOM 1086 CD2 HIS A 446 16.094 28.703 8.573 1.00 12.22 C ATOM 1087 CE1 HIS A 446 16.887 30.395 7.428 1.00 11.75 C ATOM 1088 NE2 HIS A 446 17.209 29.239 7.981 1.00 12.00 N ATOM 1089 H HIS A 446 14.279 29.682 11.754 1.00 0.00 H ATOM 1090 N ASP A 447 11.808 30.607 11.709 1.00 12.53 N ATOM 1091 CA ASP A 447 10.506 30.786 12.323 1.00 13.10 C ATOM 1092 C ASP A 447 10.742 31.739 13.486 1.00 13.08 C ATOM 1093 O ASP A 447 11.475 31.415 14.421 1.00 13.86 O ATOM 1094 CB ASP A 447 9.981 29.429 12.793 1.00 12.79 C ATOM 1095 CG ASP A 447 8.583 29.497 13.426 1.00 14.03 C ATOM 1096 OD1 ASP A 447 8.206 30.543 14.003 1.00 17.90 O ATOM 1097 OD2 ASP A 447 7.860 28.493 13.375 1.00 14.24 O ATOM 1098 H ASP A 447 12.616 30.394 12.328 1.00 0.00 H ATOM 1099 N GLN A 448 10.130 32.920 13.435 1.00 13.75 N ATOM 1100 CA GLN A 448 10.385 33.940 14.442 1.00 14.42 C ATOM 1101 C GLN A 448 9.957 33.521 15.850 1.00 14.51 C ATOM 1102 O GLN A 448 10.562 33.947 16.825 1.00 14.81 O ATOM 1103 CB GLN A 448 9.710 35.255 14.047 1.00 14.38 C ATOM 1104 CG GLN A 448 10.082 36.466 14.932 1.00 15.16 C ATOM 1105 CD GLN A 448 11.557 36.803 14.897 1.00 15.05 C ATOM 1106 OE1 GLN A 448 12.182 36.808 13.834 1.00 16.30 O ATOM 1107 NE2 GLN A 448 12.119 37.111 16.060 1.00 17.67 N ATOM 1108 HE22 GLN A 448 11.553 37.093 16.932 1.00 0.00 H ATOM 1109 HE21 GLN A 448 13.126 37.370 16.099 1.00 0.00 H ATOM 1110 H GLN A 448 9.460 33.117 12.664 1.00 0.00 H ATOM 1111 N ARG A 449 8.938 32.672 15.953 1.00 14.85 N ATOM 1112 CA ARG A 449 8.503 32.156 17.253 1.00 15.02 C ATOM 1113 C ARG A 449 9.617 31.310 17.870 1.00 14.62 C ATOM 1114 O ARG A 449 9.919 31.405 19.060 1.00 15.10 O ATOM 1115 CB ARG A 449 7.233 31.326 17.100 1.00 15.65 C ATOM 1116 CG ARG A 449 6.089 32.080 16.446 1.00 16.90 C ATOM 1117 CD ARG A 449 4.982 31.180 15.958 1.00 18.78 C ATOM 1118 NE ARG A 449 5.402 30.301 14.866 1.00 18.59 N ATOM 1119 CZ ARG A 449 4.585 29.512 14.174 1.00 20.53 C ATOM 1120 NH1 ARG A 449 3.279 29.502 14.412 1.00 21.29 N ATOM 1121 NH2 ARG A 449 5.077 28.726 13.225 1.00 18.87 N ATOM 1122 HE ARG A 449 6.411 30.293 14.613 1.00 0.00 H ATOM 1123 HH12 ARG A 449 2.655 28.879 13.861 1.00 0.00 H ATOM 1124 HH11 ARG A 449 2.880 30.118 15.149 1.00 0.00 H ATOM 1125 HH22 ARG A 449 4.442 28.107 12.681 1.00 0.00 H ATOM 1126 HH21 ARG A 449 6.098 28.729 13.025 1.00 0.00 H ATOM 1127 H ARG A 449 8.440 32.368 15.092 1.00 0.00 H ATOM 1128 N ASP A 450 10.248 30.487 17.044 1.00 13.93 N ATOM 1129 CA ASP A 450 11.372 29.669 17.501 1.00 13.95 C ATOM 1130 C ASP A 450 12.635 30.493 17.759 1.00 14.16 C ATOM 1131 O ASP A 450 13.422 30.176 18.653 1.00 14.50 O ATOM 1132 CB ASP A 450 11.673 28.574 16.483 1.00 13.32 C ATOM 1133 CG ASP A 450 10.493 27.641 16.236 1.00 13.96 C ATOM 1134 OD1 ASP A 450 9.597 27.524 17.103 1.00 14.30 O ATOM 1135 OD2 ASP A 450 10.485 26.984 15.167 1.00 13.30 O ATOM 1136 H ASP A 450 9.939 30.422 16.053 1.00 0.00 H ATOM 1137 N TRP A 451 12.833 31.539 16.958 1.00 13.96 N ATOM 1138 CA TRP A 451 13.951 32.462 17.121 1.00 14.22 C ATOM 1139 C TRP A 451 13.853 33.103 18.498 1.00 14.87 C ATOM 1140 O TRP A 451 14.824 33.128 19.247 1.00 15.52 O ATOM 1141 CB TRP A 451 13.909 33.524 16.012 1.00 14.66 C ATOM 1142 CG TRP A 451 15.161 34.354 15.834 1.00 15.16 C ATOM 1143 CD1 TRP A 451 16.155 34.170 14.915 1.00 17.53 C ATOM 1144 CD2 TRP A 451 15.515 35.536 16.570 1.00 17.88 C ATOM 1145 NE1 TRP A 451 17.111 35.152 15.037 1.00 17.74 N ATOM 1146 CE2 TRP A 451 16.738 36.002 16.047 1.00 18.92 C ATOM 1147 CE3 TRP A 451 14.917 36.236 17.625 1.00 19.64 C ATOM 1148 CZ2 TRP A 451 17.382 37.137 16.551 1.00 20.77 C ATOM 1149 CZ3 TRP A 451 15.553 37.368 18.120 1.00 20.19 C ATOM 1150 CH2 TRP A 451 16.771 37.801 17.586 1.00 20.60 C ATOM 1151 HE1 TRP A 451 17.972 35.236 14.460 1.00 0.00 H ATOM 1152 H TRP A 451 12.161 31.705 16.182 1.00 0.00 H ATOM 1153 N ASP A 452 12.662 33.591 18.825 1.00 15.76 N ATOM 1154 CA ASP A 452 12.446 34.253 20.105 1.00 17.36 C ATOM 1155 C ASP A 452 12.707 33.310 21.277 1.00 17.06 C ATOM 1156 O ASP A 452 13.361 33.693 22.251 1.00 17.99 O ATOM 1157 CB ASP A 452 11.035 34.830 20.179 1.00 17.77 C ATOM 1158 CG ASP A 452 10.859 36.072 19.311 1.00 19.82 C ATOM 1159 OD1 ASP A 452 11.858 36.729 18.961 1.00 22.66 O ATOM 1160 OD2 ASP A 452 9.702 36.395 18.990 1.00 24.35 O ATOM 1161 H ASP A 452 11.871 33.499 18.157 1.00 0.00 H ATOM 1162 N PHE A 453 12.218 32.075 21.180 1.00 16.93 N ATOM 1163 CA PHE A 453 12.401 31.091 22.244 1.00 16.36 C ATOM 1164 C PHE A 453 13.888 30.749 22.372 1.00 16.68 C ATOM 1165 O PHE A 453 14.435 30.703 23.470 1.00 16.51 O ATOM 1166 CB PHE A 453 11.551 29.837 21.954 1.00 16.91 C ATOM 1167 CG PHE A 453 11.570 28.799 23.050 1.00 16.62 C ATOM 1168 CD1 PHE A 453 12.570 27.844 23.108 1.00 15.98 C ATOM 1169 CD2 PHE A 453 10.566 28.771 24.016 1.00 17.42 C ATOM 1170 CE1 PHE A 453 12.585 26.899 24.113 1.00 17.01 C ATOM 1171 CE2 PHE A 453 10.569 27.811 25.023 1.00 17.96 C ATOM 1172 CZ PHE A 453 11.576 26.873 25.066 1.00 17.57 C ATOM 1173 H PHE A 453 11.692 31.804 20.325 1.00 0.00 H ATOM 1174 N ALA A 454 14.551 30.548 21.243 1.00 16.31 N ATOM 1175 CA ALA A 454 15.951 30.182 21.249 1.00 16.40 C ATOM 1176 C ALA A 454 16.817 31.281 21.856 1.00 16.82 C ATOM 1177 O ALA A 454 17.796 30.998 22.560 1.00 16.82 O ATOM 1178 CB ALA A 454 16.417 29.855 19.829 1.00 16.22 C ATOM 1179 H ALA A 454 14.056 30.655 20.335 1.00 0.00 H ATOM 1180 N ARG A 455 16.477 32.536 21.571 1.00 18.28 N ATOM 1181 CA ARG A 455 17.216 33.653 22.155 1.00 19.83 C ATOM 1182 C ARG A 455 17.001 33.709 23.664 1.00 19.98 C ATOM 1183 O ARG A 455 17.948 33.968 24.409 1.00 21.25 O ATOM 1184 CB ARG A 455 16.809 34.982 21.510 1.00 20.77 C ATOM 1185 CG ARG A 455 17.415 35.216 20.139 1.00 23.82 C ATOM 1186 CD ARG A 455 18.945 35.202 20.181 1.00 27.78 C ATOM 1187 NE ARG A 455 19.560 35.721 18.961 1.00 32.05 N ATOM 1188 CZ ARG A 455 19.957 36.982 18.768 1.00 34.70 C ATOM 1189 NH1 ARG A 455 19.799 37.911 19.711 1.00 36.05 N ATOM 1190 NH2 ARG A 455 20.510 37.322 17.607 1.00 35.82 N ATOM 1191 HE ARG A 455 19.700 35.052 18.177 1.00 0.00 H ATOM 1192 HH12 ARG A 455 20.116 38.886 19.538 1.00 0.00 H ATOM 1193 HH11 ARG A 455 19.359 37.660 20.619 1.00 0.00 H ATOM 1194 HH22 ARG A 455 20.822 38.301 17.447 1.00 0.00 H ATOM 1195 HH21 ARG A 455 20.630 36.609 16.860 1.00 0.00 H ATOM 1196 H ARG A 455 15.681 32.723 20.929 1.00 0.00 H ATOM 1197 N ALA A 456 15.775 33.449 24.106 1.00 20.19 N ATOM 1198 CA ALA A 456 15.444 33.496 25.544 1.00 20.22 C ATOM 1199 C ALA A 456 16.104 32.355 26.333 1.00 20.69 C ATOM 1200 O ALA A 456 16.440 32.524 27.513 1.00 22.12 O ATOM 1201 CB ALA A 456 13.928 33.478 25.748 1.00 20.46 C ATOM 1202 H ALA A 456 15.030 33.206 23.422 1.00 0.00 H ATOM 1203 N PHE A 457 16.315 31.215 25.680 1.00 19.44 N ATOM 1204 CA PHE A 457 16.838 30.017 26.341 1.00 19.17 C ATOM 1205 C PHE A 457 18.298 29.702 26.017 1.00 18.62 C ATOM 1206 O PHE A 457 18.879 28.794 26.601 1.00 19.03 O ATOM 1207 CB PHE A 457 15.959 28.818 25.984 1.00 19.55 C ATOM 1208 CG PHE A 457 14.704 28.738 26.789 1.00 20.85 C ATOM 1209 CD1 PHE A 457 13.669 29.640 26.581 1.00 22.36 C ATOM 1210 CD2 PHE A 457 14.543 27.751 27.756 1.00 22.83 C ATOM 1211 CE1 PHE A 457 12.507 29.574 27.326 1.00 23.93 C ATOM 1212 CE2 PHE A 457 13.381 27.684 28.506 1.00 22.31 C ATOM 1213 CZ PHE A 457 12.369 28.598 28.295 1.00 23.41 C ATOM 1214 H PHE A 457 16.101 31.173 24.663 1.00 0.00 H ATOM 1215 N GLY A 458 18.898 30.421 25.080 1.00 17.68 N ATOM 1216 CA GLY A 458 20.262 30.138 24.674 1.00 17.82 C ATOM 1217 C GLY A 458 20.372 28.831 23.907 1.00 17.74 C ATOM 1218 O GLY A 458 21.261 28.012 24.165 1.00 19.95 O ATOM 1219 H GLY A 458 18.382 31.202 24.627 1.00 0.00 H ATOM 1220 N LEU A 459 19.445 28.620 22.974 1.00 16.86 N ATOM 1221 CA LEU A 459 19.495 27.448 22.105 1.00 16.13 C ATOM 1222 C LEU A 459 20.152 27.822 20.776 1.00 16.54 C ATOM 1223 O LEU A 459 20.141 28.993 20.380 1.00 16.12 O ATOM 1224 CB LEU A 459 18.087 26.900 21.881 1.00 15.84 C ATOM 1225 CG LEU A 459 17.506 26.146 23.084 1.00 14.71 C ATOM 1226 CD1 LEU A 459 16.015 26.231 23.116 1.00 14.94 C ATOM 1227 CD2 LEU A 459 17.967 24.698 23.072 1.00 14.83 C ATOM 1228 H LEU A 459 18.670 29.304 22.862 1.00 0.00 H ATOM 1229 N PRO A 460 20.712 26.830 20.070 1.00 16.80 N ATOM 1230 CA PRO A 460 21.399 27.121 18.817 1.00 16.86 C ATOM 1231 C PRO A 460 20.472 27.645 17.725 1.00 16.53 C ATOM 1232 O PRO A 460 19.348 27.153 17.578 1.00 16.02 O ATOM 1233 CB PRO A 460 21.964 25.761 18.410 1.00 17.21 C ATOM 1234 CG PRO A 460 22.019 24.990 19.658 1.00 17.45 C ATOM 1235 CD PRO A 460 20.826 25.402 20.418 1.00 16.81 C ATOM 1236 N ILE A 461 20.962 28.625 16.968 1.00 16.17 N ATOM 1237 CA ILE A 461 20.220 29.212 15.845 1.00 16.26 C ATOM 1238 C ILE A 461 21.084 29.008 14.612 1.00 15.95 C ATOM 1239 O ILE A 461 22.210 29.503 14.540 1.00 16.53 O ATOM 1240 CB ILE A 461 19.899 30.707 16.061 1.00 16.32 C ATOM 1241 CG1 ILE A 461 19.131 30.896 17.373 1.00 17.68 C ATOM 1242 CG2 ILE A 461 19.116 31.282 14.864 1.00 16.07 C ATOM 1243 CD1 ILE A 461 18.653 32.316 17.632 1.00 19.28 C ATOM 1244 H ILE A 461 21.912 28.991 17.182 1.00 0.00 H ATOM 1245 N VAL A 462 20.555 28.244 13.664 1.00 14.93 N ATOM 1246 CA VAL A 462 21.280 27.759 12.500 1.00 14.96 C ATOM 1247 C VAL A 462 20.593 28.210 11.217 1.00 14.03 C ATOM 1248 O VAL A 462 19.377 28.058 11.065 1.00 13.45 O ATOM 1249 CB VAL A 462 21.340 26.212 12.526 1.00 15.05 C ATOM 1250 CG1 VAL A 462 21.936 25.651 11.219 1.00 17.57 C ATOM 1251 CG2 VAL A 462 22.156 25.742 13.745 1.00 16.40 C ATOM 1252 H VAL A 462 19.555 27.974 13.760 1.00 0.00 H ATOM 1253 N GLU A 463 21.374 28.781 10.308 1.00 13.57 N ATOM 1254 CA GLU A 463 20.854 29.188 9.008 1.00 13.36 C ATOM 1255 C GLU A 463 20.883 28.026 8.035 1.00 13.11 C ATOM 1256 O GLU A 463 21.924 27.421 7.809 1.00 13.26 O ATOM 1257 CB GLU A 463 21.683 30.332 8.440 1.00 13.52 C ATOM 1258 CG GLU A 463 21.195 30.832 7.092 1.00 15.14 C ATOM 1259 CD GLU A 463 22.063 31.934 6.531 1.00 18.50 C ATOM 1260 OE1 GLU A 463 23.242 31.662 6.217 1.00 22.84 O ATOM 1261 OE2 GLU A 463 21.569 33.076 6.402 1.00 20.61 O ATOM 1262 H GLU A 463 22.378 28.941 10.528 1.00 0.00 H ATOM 1263 N VAL A 464 19.728 27.699 7.478 1.00 11.77 N ATOM 1264 CA VAL A 464 19.662 26.729 6.374 1.00 11.63 C ATOM 1265 C VAL A 464 19.079 27.302 5.081 1.00 11.73 C ATOM 1266 O VAL A 464 19.220 26.696 4.015 1.00 11.53 O ATOM 1267 CB VAL A 464 18.972 25.410 6.784 1.00 11.51 C ATOM 1268 CG1 VAL A 464 19.866 24.634 7.774 1.00 12.82 C ATOM 1269 CG2 VAL A 464 17.576 25.646 7.362 1.00 11.98 C ATOM 1270 H VAL A 464 18.851 28.136 7.827 1.00 0.00 H ATOM 1271 N ILE A 465 18.459 28.480 5.149 1.00 11.97 N ATOM 1272 CA ILE A 465 17.955 29.172 3.965 1.00 11.98 C ATOM 1273 C ILE A 465 18.695 30.502 3.858 1.00 12.73 C ATOM 1274 O ILE A 465 18.481 31.393 4.688 1.00 13.32 O ATOM 1275 CB ILE A 465 16.437 29.465 4.063 1.00 11.93 C ATOM 1276 CG1 ILE A 465 15.664 28.231 4.524 1.00 12.94 C ATOM 1277 CG2 ILE A 465 15.879 29.979 2.732 1.00 13.22 C ATOM 1278 CD1 ILE A 465 15.804 27.034 3.596 1.00 13.47 C ATOM 1279 H ILE A 465 18.329 28.924 6.081 1.00 0.00 H ATOM 1280 N ALA A 466 19.555 30.639 2.851 1.00 12.66 N ATOM 1281 CA ALA A 466 20.244 31.902 2.590 1.00 12.99 C ATOM 1282 C ALA A 466 19.245 32.906 2.044 1.00 13.56 C ATOM 1283 O ALA A 466 18.343 32.548 1.278 1.00 13.94 O ATOM 1284 CB ALA A 466 21.395 31.709 1.609 1.00 13.47 C ATOM 1285 H ALA A 466 19.742 29.824 2.232 1.00 0.00 H ATOM 1286 N GLY A 467 19.408 34.167 2.436 1.00 13.82 N ATOM 1287 CA GLY A 467 18.519 35.226 1.985 1.00 14.17 C ATOM 1288 C GLY A 467 18.365 36.355 2.982 1.00 14.51 C ATOM 1289 O GLY A 467 18.167 37.503 2.586 1.00 15.29 O ATOM 1290 H GLY A 467 20.190 34.401 3.080 1.00 0.00 H ATOM 1291 N GLY A 468 18.484 36.042 4.268 1.00 14.69 N ATOM 1292 CA GLY A 468 18.319 37.028 5.324 1.00 15.08 C ATOM 1293 C GLY A 468 19.528 37.144 6.220 1.00 15.87 C ATOM 1294 O GLY A 468 20.661 36.889 5.811 1.00 16.44 O ATOM 1295 H GLY A 468 18.702 35.059 4.528 1.00 0.00 H ATOM 1296 N ASN A 469 19.277 37.540 7.464 1.00 17.23 N ATOM 1297 CA ASN A 469 20.328 37.746 8.444 1.00 18.33 C ATOM 1298 C ASN A 469 19.835 37.234 9.787 1.00 18.18 C ATOM 1299 O ASN A 469 19.160 37.952 10.533 1.00 17.92 O ATOM 1300 CB ASN A 469 20.715 39.224 8.530 1.00 19.31 C ATOM 1301 CG ASN A 469 21.933 39.440 9.400 1.00 21.79 C ATOM 1302 OD1 ASN A 469 22.181 38.675 10.338 1.00 24.56 O ATOM 1303 ND2 ASN A 469 22.724 40.460 9.077 1.00 26.53 N ATOM 1304 HD22 ASN A 469 22.475 41.078 8.279 1.00 0.00 H ATOM 1305 HD21 ASN A 469 23.591 40.639 9.623 1.00 0.00 H ATOM 1306 H ASN A 469 18.290 37.709 7.746 1.00 0.00 H ATOM 1307 N ILE A 470 20.154 35.980 10.086 1.00 18.38 N ATOM 1308 CA ILE A 470 19.595 35.309 11.249 1.00 19.03 C ATOM 1309 C ILE A 470 20.074 35.899 12.575 1.00 19.47 C ATOM 1310 O ILE A 470 19.494 35.606 13.615 1.00 19.36 O ATOM 1311 CB ILE A 470 19.854 33.773 11.247 1.00 18.88 C ATOM 1312 CG1 ILE A 470 21.355 33.455 11.311 1.00 20.29 C ATOM 1313 CG2 ILE A 470 19.207 33.117 10.018 1.00 19.73 C ATOM 1314 CD1 ILE A 470 21.667 32.078 11.841 1.00 22.04 C ATOM 1315 H ILE A 470 20.819 35.466 9.474 1.00 0.00 H ATOM 1316 N SER A 471 21.126 36.716 12.533 1.00 20.23 N ATOM 1317 CA SER A 471 21.596 37.385 13.739 1.00 21.15 C ATOM 1318 C SER A 471 20.629 38.479 14.168 1.00 21.56 C ATOM 1319 O SER A 471 20.627 38.867 15.334 1.00 22.05 O ATOM 1320 CB SER A 471 23.019 37.944 13.553 1.00 21.38 C ATOM 1321 OG SER A 471 23.024 39.123 12.779 1.00 23.36 O ATOM 1322 HG SER A 471 22.647 38.931 11.884 1.00 0.00 H ATOM 1323 H SER A 471 21.616 36.878 11.630 1.00 0.00 H ATOM 1324 N GLU A 472 19.796 38.972 13.251 1.00 21.93 N ATOM 1325 CA GLU A 472 18.833 40.020 13.602 1.00 22.42 C ATOM 1326 C GLU A 472 17.384 39.528 13.726 1.00 21.48 C ATOM 1327 O GLU A 472 16.632 39.997 14.588 1.00 21.34 O ATOM 1328 CB GLU A 472 18.968 41.220 12.654 1.00 23.59 C ATOM 1329 CG GLU A 472 18.443 41.025 11.260 1.00 26.42 C ATOM 1330 CD GLU A 472 18.871 42.133 10.298 1.00 30.56 C ATOM 1331 OE1 GLU A 472 20.048 42.569 10.350 1.00 34.05 O ATOM 1332 OE2 GLU A 472 18.031 42.553 9.475 1.00 32.83 O ATOM 1333 H GLU A 472 19.830 38.609 12.277 1.00 0.00 H ATOM 1334 N SER A 473 16.989 38.568 12.895 1.00 19.88 N ATOM 1335 CA SER A 473 15.644 38.014 12.972 1.00 18.70 C ATOM 1336 C SER A 473 15.592 36.728 12.175 1.00 17.30 C ATOM 1337 O SER A 473 16.494 36.457 11.372 1.00 17.15 O ATOM 1338 CB SER A 473 14.604 38.999 12.423 1.00 18.80 C ATOM 1339 OG SER A 473 14.677 39.120 11.013 1.00 20.19 O ATOM 1340 HG SER A 473 14.514 38.236 10.598 1.00 0.00 H ATOM 1341 H SER A 473 17.651 38.207 12.179 1.00 0.00 H ATOM 1342 N ALA A 474 14.540 35.947 12.389 1.00 15.70 N ATOM 1343 CA ALA A 474 14.311 34.764 11.560 1.00 14.91 C ATOM 1344 C ALA A 474 14.116 35.212 10.122 1.00 14.52 C ATOM 1345 O ALA A 474 13.484 36.240 9.864 1.00 14.79 O ATOM 1346 CB ALA A 474 13.102 33.996 12.036 1.00 14.63 C ATOM 1347 H ALA A 474 13.873 36.178 13.153 1.00 0.00 H ATOM 1348 N TYR A 475 14.682 34.452 9.192 1.00 14.13 N ATOM 1349 CA TYR A 475 14.460 34.698 7.772 1.00 14.00 C ATOM 1350 C TYR A 475 13.378 33.736 7.266 1.00 14.46 C ATOM 1351 O TYR A 475 13.601 32.526 7.213 1.00 13.62 O ATOM 1352 CB TYR A 475 15.755 34.574 6.954 1.00 14.28 C ATOM 1353 CG TYR A 475 15.432 34.782 5.502 1.00 13.06 C ATOM 1354 CD1 TYR A 475 14.925 36.010 5.070 1.00 13.27 C ATOM 1355 CD2 TYR A 475 15.518 33.748 4.579 1.00 14.10 C ATOM 1356 CE1 TYR A 475 14.573 36.208 3.764 1.00 13.81 C ATOM 1357 CE2 TYR A 475 15.145 33.945 3.260 1.00 12.89 C ATOM 1358 CZ TYR A 475 14.675 35.179 2.868 1.00 12.86 C ATOM 1359 OH TYR A 475 14.291 35.407 1.570 1.00 13.50 O ATOM 1360 HH TYR A 475 13.553 34.792 1.333 1.00 0.00 H ATOM 1361 H TYR A 475 15.297 33.665 9.482 1.00 0.00 H ATOM 1362 N THR A 476 12.209 34.273 6.904 1.00 15.38 N ATOM 1363 CA THR A 476 11.022 33.475 6.634 1.00 16.31 C ATOM 1364 C THR A 476 10.723 33.299 5.144 1.00 15.95 C ATOM 1365 O THR A 476 9.793 32.575 4.787 1.00 17.44 O ATOM 1366 CB THR A 476 9.769 34.110 7.284 1.00 16.47 C ATOM 1367 OG1 THR A 476 9.500 35.372 6.666 1.00 18.92 O ATOM 1368 CG2 THR A 476 9.975 34.322 8.776 1.00 18.82 C ATOM 1369 HG1 THR A 476 10.278 35.972 6.791 1.00 0.00 H ATOM 1370 H THR A 476 12.145 35.307 6.811 1.00 0.00 H ATOM 1371 N GLY A 477 11.510 33.947 4.284 1.00 14.91 N ATOM 1372 CA GLY A 477 11.241 33.962 2.852 1.00 14.94 C ATOM 1373 C GLY A 477 11.889 32.849 2.053 1.00 14.73 C ATOM 1374 O GLY A 477 12.449 31.893 2.596 1.00 14.39 O ATOM 1375 H GLY A 477 12.341 34.457 4.646 1.00 0.00 H ATOM 1376 N ASP A 478 11.798 32.985 0.737 1.00 14.45 N ATOM 1377 CA ASP A 478 12.412 32.038 -0.181 1.00 14.82 C ATOM 1378 C ASP A 478 13.921 32.229 -0.208 1.00 14.02 C ATOM 1379 O ASP A 478 14.441 33.218 0.276 1.00 13.95 O ATOM 1380 CB ASP A 478 11.824 32.236 -1.574 1.00 15.19 C ATOM 1381 CG ASP A 478 10.429 31.697 -1.694 1.00 19.25 C ATOM 1382 OD1 ASP A 478 10.158 30.620 -1.127 1.00 25.96 O ATOM 1383 OD2 ASP A 478 9.593 32.340 -2.359 1.00 26.02 O ATOM 1384 H ASP A 478 11.271 33.794 0.349 1.00 0.00 H ATOM 1385 N GLY A 479 14.648 31.282 -0.788 1.00 13.49 N ATOM 1386 CA GLY A 479 16.085 31.393 -0.793 1.00 13.31 C ATOM 1387 C GLY A 479 16.754 30.170 -1.341 1.00 12.85 C ATOM 1388 O GLY A 479 16.195 29.465 -2.181 1.00 14.31 O ATOM 1389 H GLY A 479 14.184 30.466 -1.236 1.00 0.00 H ATOM 1390 N ILE A 480 17.973 29.944 -0.866 1.00 12.58 N ATOM 1391 CA ILE A 480 18.829 28.884 -1.362 1.00 12.80 C ATOM 1392 C ILE A 480 19.335 28.111 -0.161 1.00 11.76 C ATOM 1393 O ILE A 480 19.798 28.695 0.811 1.00 12.26 O ATOM 1394 CB ILE A 480 19.979 29.480 -2.168 1.00 13.24 C ATOM 1395 CG1 ILE A 480 19.450 30.074 -3.477 1.00 14.24 C ATOM 1396 CG2 ILE A 480 21.063 28.444 -2.472 1.00 14.58 C ATOM 1397 CD1 ILE A 480 18.911 29.048 -4.463 1.00 14.88 C ATOM 1398 H ILE A 480 18.330 30.555 -0.104 1.00 0.00 H ATOM 1399 N LEU A 481 19.217 26.792 -0.222 1.00 11.47 N ATOM 1400 CA LEU A 481 19.610 25.929 0.886 1.00 11.23 C ATOM 1401 C LEU A 481 21.117 25.933 1.142 1.00 11.52 C ATOM 1402 O LEU A 481 21.936 25.828 0.203 1.00 12.06 O ATOM 1403 CB LEU A 481 19.148 24.497 0.624 1.00 11.19 C ATOM 1404 CG LEU A 481 17.743 24.160 1.110 1.00 10.82 C ATOM 1405 CD1 LEU A 481 17.679 23.965 2.636 1.00 12.44 C ATOM 1406 CD2 LEU A 481 16.713 25.219 0.676 1.00 12.45 C ATOM 1407 H LEU A 481 18.833 26.360 -1.086 1.00 0.00 H ATOM 1408 N VAL A 482 21.456 26.051 2.425 1.00 11.41 N ATOM 1409 CA VAL A 482 22.830 25.995 2.904 1.00 11.62 C ATOM 1410 C VAL A 482 22.871 25.124 4.159 1.00 12.00 C ATOM 1411 O VAL A 482 21.854 24.922 4.825 1.00 11.15 O ATOM 1412 CB VAL A 482 23.397 27.411 3.212 1.00 11.93 C ATOM 1413 CG1 VAL A 482 23.491 28.241 1.946 1.00 12.55 C ATOM 1414 CG2 VAL A 482 22.545 28.146 4.241 1.00 11.55 C ATOM 1415 H VAL A 482 20.698 26.191 3.123 1.00 0.00 H ATOM 1416 N ASN A 483 24.052 24.593 4.468 1.00 12.01 N ATOM 1417 CA ASN A 483 24.267 23.803 5.684 1.00 12.75 C ATOM 1418 C ASN A 483 23.301 22.615 5.781 1.00 12.28 C ATOM 1419 O ASN A 483 22.936 22.170 6.876 1.00 13.25 O ATOM 1420 CB ASN A 483 24.160 24.693 6.936 1.00 12.99 C ATOM 1421 CG ASN A 483 25.066 25.904 6.879 1.00 15.55 C ATOM 1422 OD1 ASN A 483 24.653 27.028 7.200 1.00 18.11 O ATOM 1423 ND2 ASN A 483 26.306 25.695 6.473 1.00 15.48 N ATOM 1424 HD22 ASN A 483 26.613 24.736 6.213 1.00 0.00 H ATOM 1425 HD21 ASN A 483 26.975 26.489 6.414 1.00 0.00 H ATOM 1426 H ASN A 483 24.853 24.744 3.822 1.00 0.00 H ATOM 1427 N SER A 484 22.941 22.071 4.622 1.00 12.41 N ATOM 1428 CA SER A 484 21.870 21.073 4.492 1.00 12.05 C ATOM 1429 C SER A 484 22.238 19.924 3.539 1.00 12.50 C ATOM 1430 O SER A 484 21.379 19.342 2.892 1.00 13.15 O ATOM 1431 CB SER A 484 20.554 21.735 4.051 1.00 12.18 C ATOM 1432 OG SER A 484 20.126 22.716 4.995 1.00 11.49 O ATOM 1433 HG SER A 484 20.820 23.417 5.078 1.00 0.00 H ATOM 1434 H SER A 484 23.444 22.368 3.762 1.00 0.00 H ATOM 1435 N ASP A 485 23.526 19.607 3.485 1.00 13.67 N ATOM 1436 CA ASP A 485 24.028 18.418 2.778 1.00 14.28 C ATOM 1437 C ASP A 485 23.422 18.290 1.371 1.00 13.36 C ATOM 1438 O ASP A 485 23.679 19.151 0.545 1.00 13.56 O ATOM 1439 CB ASP A 485 23.837 17.152 3.633 1.00 14.76 C ATOM 1440 CG ASP A 485 24.641 15.954 3.116 1.00 19.84 C ATOM 1441 OD1 ASP A 485 25.595 16.149 2.328 1.00 25.14 O ATOM 1442 OD2 ASP A 485 24.332 14.819 3.543 1.00 26.50 O ATOM 1443 H ASP A 485 24.211 20.226 3.964 1.00 0.00 H ATOM 1444 N TYR A 486 22.636 17.239 1.109 1.00 13.26 N ATOM 1445 CA TYR A 486 22.121 16.936 -0.237 1.00 13.55 C ATOM 1446 C TYR A 486 21.036 17.909 -0.710 1.00 13.60 C ATOM 1447 O TYR A 486 20.581 17.811 -1.845 1.00 14.13 O ATOM 1448 CB TYR A 486 21.579 15.487 -0.328 1.00 14.30 C ATOM 1449 CG TYR A 486 20.729 15.105 0.851 1.00 14.11 C ATOM 1450 CD1 TYR A 486 19.393 15.469 0.897 1.00 15.35 C ATOM 1451 CD2 TYR A 486 21.254 14.407 1.929 1.00 15.58 C ATOM 1452 CE1 TYR A 486 18.611 15.147 1.978 1.00 15.80 C ATOM 1453 CE2 TYR A 486 20.477 14.077 3.017 1.00 16.53 C ATOM 1454 CZ TYR A 486 19.154 14.451 3.035 1.00 16.58 C ATOM 1455 OH TYR A 486 18.362 14.131 4.122 1.00 18.63 O ATOM 1456 HH TYR A 486 18.336 13.147 4.232 1.00 0.00 H ATOM 1457 H TYR A 486 22.377 16.607 1.893 1.00 0.00 H ATOM 1458 N LEU A 487 20.625 18.843 0.151 1.00 12.77 N ATOM 1459 CA LEU A 487 19.717 19.912 -0.260 1.00 12.63 C ATOM 1460 C LEU A 487 20.447 21.166 -0.737 1.00 12.47 C ATOM 1461 O LEU A 487 19.831 22.054 -1.320 1.00 12.30 O ATOM 1462 CB LEU A 487 18.794 20.314 0.896 1.00 12.45 C ATOM 1463 CG LEU A 487 17.962 19.222 1.561 1.00 11.84 C ATOM 1464 CD1 LEU A 487 17.118 19.805 2.698 1.00 13.37 C ATOM 1465 CD2 LEU A 487 17.105 18.509 0.529 1.00 13.52 C ATOM 1466 H LEU A 487 20.958 18.809 1.136 1.00 0.00 H ATOM 1467 N ASN A 488 21.747 21.256 -0.469 1.00 12.37 N ATOM 1468 CA ASN A 488 22.488 22.508 -0.695 1.00 12.53 C ATOM 1469 C ASN A 488 22.359 23.012 -2.119 1.00 12.70 C ATOM 1470 O ASN A 488 22.501 22.239 -3.066 1.00 13.29 O ATOM 1471 CB ASN A 488 23.972 22.349 -0.367 1.00 12.82 C ATOM 1472 CG ASN A 488 24.251 22.299 1.114 1.00 13.59 C ATOM 1473 OD1 ASN A 488 25.375 21.960 1.537 1.00 15.73 O ATOM 1474 ND2 ASN A 488 23.268 22.646 1.914 1.00 11.45 N ATOM 1475 HD22 ASN A 488 22.347 22.922 1.517 1.00 0.00 H ATOM 1476 HD21 ASN A 488 23.411 22.645 2.944 1.00 0.00 H ATOM 1477 H ASN A 488 22.249 20.427 -0.093 1.00 0.00 H ATOM 1478 N GLY A 489 22.056 24.301 -2.253 1.00 12.50 N ATOM 1479 CA GLY A 489 21.920 24.948 -3.564 1.00 12.78 C ATOM 1480 C GLY A 489 20.506 24.977 -4.108 1.00 13.07 C ATOM 1481 O GLY A 489 20.211 25.702 -5.069 1.00 13.64 O ATOM 1482 H GLY A 489 21.910 24.872 -1.396 1.00 0.00 H ATOM 1483 N MET A 490 19.627 24.168 -3.529 1.00 12.77 N ATOM 1484 CA MET A 490 18.244 24.093 -3.983 1.00 13.04 C ATOM 1485 C MET A 490 17.448 25.303 -3.544 1.00 13.41 C ATOM 1486 O MET A 490 17.726 25.900 -2.508 1.00 12.78 O ATOM 1487 CB MET A 490 17.568 22.843 -3.442 1.00 13.80 C ATOM 1488 CG MET A 490 18.125 21.561 -4.006 1.00 13.48 C ATOM 1489 SD MET A 490 17.138 20.172 -3.446 1.00 15.79 S ATOM 1490 CE MET A 490 18.098 18.807 -4.109 1.00 17.20 C ATOM 1491 H MET A 490 19.933 23.573 -2.732 1.00 0.00 H ATOM 1492 N SER A 491 16.425 25.624 -4.323 1.00 14.00 N ATOM 1493 CA SER A 491 15.403 26.564 -3.892 1.00 14.51 C ATOM 1494 C SER A 491 14.559 25.929 -2.787 1.00 14.76 C ATOM 1495 O SER A 491 14.590 24.718 -2.569 1.00 14.00 O ATOM 1496 CB SER A 491 14.503 26.929 -5.064 1.00 15.55 C ATOM 1497 OG SER A 491 13.715 25.810 -5.434 1.00 17.17 O ATOM 1498 HG SER A 491 13.133 26.055 -6.196 1.00 0.00 H ATOM 1499 H SER A 491 16.351 25.193 -5.266 1.00 0.00 H ATOM 1500 N VAL A 492 13.780 26.742 -2.093 1.00 15.17 N ATOM 1501 CA VAL A 492 12.887 26.211 -1.074 1.00 15.26 C ATOM 1502 C VAL A 492 11.884 25.157 -1.620 1.00 15.81 C ATOM 1503 O VAL A 492 11.785 24.073 -1.053 1.00 14.98 O ATOM 1504 CB VAL A 492 12.212 27.361 -0.283 1.00 15.29 C ATOM 1505 CG1 VAL A 492 11.023 26.861 0.510 1.00 15.73 C ATOM 1506 CG2 VAL A 492 13.247 28.017 0.631 1.00 15.76 C ATOM 1507 H VAL A 492 13.806 27.765 -2.276 1.00 0.00 H ATOM 1508 N PRO A 493 11.161 25.455 -2.731 1.00 16.11 N ATOM 1509 CA PRO A 493 10.227 24.449 -3.244 1.00 16.69 C ATOM 1510 C PRO A 493 10.901 23.130 -3.642 1.00 16.09 C ATOM 1511 O PRO A 493 10.360 22.051 -3.364 1.00 16.65 O ATOM 1512 CB PRO A 493 9.596 25.136 -4.471 1.00 17.32 C ATOM 1513 CG PRO A 493 9.775 26.576 -4.249 1.00 18.02 C ATOM 1514 CD PRO A 493 11.041 26.738 -3.445 1.00 16.72 C ATOM 1515 N ALA A 494 12.071 23.215 -4.268 1.00 15.21 N ATOM 1516 CA ALA A 494 12.827 22.020 -4.636 1.00 14.89 C ATOM 1517 C ALA A 494 13.293 21.247 -3.405 1.00 14.78 C ATOM 1518 O ALA A 494 13.193 20.023 -3.362 1.00 14.98 O ATOM 1519 CB ALA A 494 14.010 22.383 -5.524 1.00 14.98 C ATOM 1520 H ALA A 494 12.456 24.152 -4.501 1.00 0.00 H ATOM 1521 N ALA A 495 13.772 21.959 -2.391 1.00 14.06 N ATOM 1522 CA ALA A 495 14.216 21.323 -1.159 1.00 14.05 C ATOM 1523 C ALA A 495 13.062 20.644 -0.413 1.00 13.76 C ATOM 1524 O ALA A 495 13.242 19.569 0.161 1.00 13.70 O ATOM 1525 CB ALA A 495 14.909 22.347 -0.261 1.00 12.99 C ATOM 1526 H ALA A 495 13.831 22.994 -2.479 1.00 0.00 H ATOM 1527 N LYS A 496 11.869 21.240 -0.433 1.00 14.40 N ATOM 1528 CA LYS A 496 10.709 20.616 0.203 1.00 14.93 C ATOM 1529 C LYS A 496 10.411 19.263 -0.444 1.00 15.35 C ATOM 1530 O LYS A 496 10.138 18.278 0.251 1.00 15.01 O ATOM 1531 CB LYS A 496 9.475 21.516 0.109 1.00 15.11 C ATOM 1532 CG LYS A 496 9.486 22.745 1.022 1.00 16.36 C ATOM 1533 CD LYS A 496 8.224 23.592 0.836 1.00 18.88 C ATOM 1534 CE LYS A 496 8.219 24.818 1.755 1.00 19.88 C ATOM 1535 NZ LYS A 496 7.169 25.832 1.399 1.00 22.25 N ATOM 1536 HZ1 LYS A 496 7.331 26.171 0.429 1.00 0.00 H ATOM 1537 HZ2 LYS A 496 6.229 25.392 1.462 1.00 0.00 H ATOM 1538 HZ3 LYS A 496 7.223 26.633 2.061 1.00 0.00 H ATOM 1539 H LYS A 496 11.762 22.160 -0.907 1.00 0.00 H ATOM 1540 N ARG A 497 10.486 19.207 -1.772 1.00 15.39 N ATOM 1541 CA ARG A 497 10.234 17.947 -2.468 1.00 15.89 C ATOM 1542 C ARG A 497 11.347 16.929 -2.187 1.00 15.39 C ATOM 1543 O ARG A 497 11.066 15.757 -1.922 1.00 15.43 O ATOM 1544 CB ARG A 497 10.037 18.188 -3.966 1.00 16.20 C ATOM 1545 CG ARG A 497 8.742 18.949 -4.270 1.00 17.98 C ATOM 1546 CD ARG A 497 8.520 19.166 -5.765 1.00 19.80 C ATOM 1547 NE ARG A 497 9.458 20.127 -6.349 1.00 21.20 N ATOM 1548 CZ ARG A 497 9.177 21.412 -6.555 1.00 22.58 C ATOM 1549 NH1 ARG A 497 7.987 21.894 -6.228 1.00 23.41 N ATOM 1550 NH2 ARG A 497 10.088 22.216 -7.088 1.00 22.87 N ATOM 1551 HE ARG A 497 10.402 19.785 -6.620 1.00 0.00 H ATOM 1552 HH12 ARG A 497 7.770 22.898 -6.390 1.00 0.00 H ATOM 1553 HH11 ARG A 497 7.270 21.268 -5.809 1.00 0.00 H ATOM 1554 HH22 ARG A 497 9.866 23.219 -7.248 1.00 0.00 H ATOM 1555 HH21 ARG A 497 11.024 21.843 -7.346 1.00 0.00 H ATOM 1556 H ARG A 497 10.724 20.061 -2.315 1.00 0.00 H ATOM 1557 N ALA A 498 12.602 17.375 -2.217 1.00 15.04 N ATOM 1558 CA ALA A 498 13.734 16.490 -1.997 1.00 14.55 C ATOM 1559 C ALA A 498 13.697 15.870 -0.613 1.00 14.20 C ATOM 1560 O ALA A 498 13.904 14.649 -0.444 1.00 13.44 O ATOM 1561 CB ALA A 498 15.058 17.233 -2.200 1.00 15.25 C ATOM 1562 H ALA A 498 12.776 18.383 -2.403 1.00 0.00 H ATOM 1563 N ILE A 499 13.425 16.678 0.414 1.00 13.34 N ATOM 1564 CA ILE A 499 13.464 16.167 1.782 1.00 14.17 C ATOM 1565 C ILE A 499 12.283 15.231 2.066 1.00 14.40 C ATOM 1566 O ILE A 499 12.440 14.262 2.801 1.00 14.13 O ATOM 1567 CB ILE A 499 13.570 17.307 2.839 1.00 14.87 C ATOM 1568 CG1 ILE A 499 14.022 16.755 4.197 1.00 15.64 C ATOM 1569 CG2 ILE A 499 12.279 18.064 2.951 1.00 14.99 C ATOM 1570 CD1 ILE A 499 15.400 16.175 4.206 1.00 16.30 C ATOM 1571 H ILE A 499 13.184 17.675 0.240 1.00 0.00 H ATOM 1572 N VAL A 500 11.128 15.493 1.468 1.00 15.06 N ATOM 1573 CA VAL A 500 10.004 14.569 1.613 1.00 16.10 C ATOM 1574 C VAL A 500 10.345 13.231 0.965 1.00 15.95 C ATOM 1575 O VAL A 500 10.031 12.159 1.516 1.00 16.14 O ATOM 1576 CB VAL A 500 8.696 15.154 1.049 1.00 16.01 C ATOM 1577 CG1 VAL A 500 7.611 14.068 0.936 1.00 18.17 C ATOM 1578 CG2 VAL A 500 8.233 16.285 1.941 1.00 18.10 C ATOM 1579 H VAL A 500 11.022 16.355 0.896 1.00 0.00 H ATOM 1580 N ASP A 501 10.982 13.279 -0.204 1.00 15.97 N ATOM 1581 CA ASP A 501 11.435 12.062 -0.884 1.00 16.60 C ATOM 1582 C ASP A 501 12.343 11.268 0.049 1.00 16.24 C ATOM 1583 O ASP A 501 12.198 10.048 0.202 1.00 16.70 O ATOM 1584 CB ASP A 501 12.184 12.412 -2.177 1.00 17.08 C ATOM 1585 CG ASP A 501 12.365 11.215 -3.105 1.00 18.80 C ATOM 1586 OD1 ASP A 501 12.403 10.065 -2.628 1.00 23.63 O ATOM 1587 OD2 ASP A 501 12.481 11.431 -4.326 1.00 21.97 O ATOM 1588 H ASP A 501 11.162 14.203 -0.645 1.00 0.00 H ATOM 1589 N ARG A 502 13.283 11.968 0.686 1.00 16.09 N ATOM 1590 CA ARG A 502 14.206 11.320 1.595 1.00 16.48 C ATOM 1591 C ARG A 502 13.478 10.731 2.798 1.00 16.02 C ATOM 1592 O ARG A 502 13.746 9.596 3.191 1.00 16.33 O ATOM 1593 CB ARG A 502 15.299 12.288 2.043 1.00 17.47 C ATOM 1594 CG ARG A 502 16.428 11.606 2.773 1.00 20.43 C ATOM 1595 CD ARG A 502 17.236 10.724 1.833 1.00 25.73 C ATOM 1596 NE ARG A 502 18.409 10.166 2.496 1.00 29.90 N ATOM 1597 CZ ARG A 502 19.444 9.610 1.870 1.00 32.86 C ATOM 1598 NH1 ARG A 502 19.476 9.516 0.540 1.00 33.89 N ATOM 1599 NH2 ARG A 502 20.457 9.141 2.583 1.00 34.07 N ATOM 1600 HE ARG A 502 18.439 10.205 3.535 1.00 0.00 H ATOM 1601 HH12 ARG A 502 20.293 9.078 0.069 1.00 0.00 H ATOM 1602 HH11 ARG A 502 18.683 9.880 -0.026 1.00 0.00 H ATOM 1603 HH22 ARG A 502 21.271 8.704 2.105 1.00 0.00 H ATOM 1604 HH21 ARG A 502 20.438 9.209 3.621 1.00 0.00 H ATOM 1605 H ARG A 502 13.354 12.993 0.528 1.00 0.00 H ATOM 1606 N LEU A 503 12.551 11.499 3.378 1.00 15.90 N ATOM 1607 CA LEU A 503 11.751 11.017 4.503 1.00 16.12 C ATOM 1608 C LEU A 503 10.966 9.771 4.130 1.00 16.14 C ATOM 1609 O LEU A 503 10.914 8.816 4.902 1.00 16.19 O ATOM 1610 CB LEU A 503 10.797 12.095 5.006 1.00 16.33 C ATOM 1611 CG LEU A 503 11.471 13.223 5.795 1.00 16.70 C ATOM 1612 CD1 LEU A 503 10.533 14.415 5.928 1.00 18.34 C ATOM 1613 CD2 LEU A 503 11.914 12.736 7.174 1.00 17.47 C ATOM 1614 H LEU A 503 12.395 12.463 3.021 1.00 0.00 H ATOM 1615 N GLU A 504 10.383 9.776 2.940 1.00 16.71 N ATOM 1616 CA GLU A 504 9.588 8.620 2.506 1.00 17.58 C ATOM 1617 C GLU A 504 10.466 7.413 2.254 1.00 18.13 C ATOM 1618 O GLU A 504 10.094 6.294 2.607 1.00 18.46 O ATOM 1619 CB GLU A 504 8.801 8.938 1.249 1.00 17.78 C ATOM 1620 CG GLU A 504 7.578 9.769 1.495 1.00 19.16 C ATOM 1621 CD GLU A 504 6.557 9.629 0.383 1.00 20.61 C ATOM 1622 OE1 GLU A 504 6.955 9.606 -0.811 1.00 23.42 O ATOM 1623 OE2 GLU A 504 5.359 9.547 0.708 1.00 18.71 O ATOM 1624 H GLU A 504 10.489 10.599 2.313 1.00 0.00 H ATOM 1625 N SER A 505 11.641 7.617 1.660 1.00 18.56 N ATOM 1626 CA SER A 505 12.543 6.488 1.412 1.00 19.65 C ATOM 1627 C SER A 505 12.980 5.819 2.722 1.00 19.11 C ATOM 1628 O SER A 505 13.167 4.596 2.778 1.00 20.51 O ATOM 1629 CB SER A 505 13.767 6.922 0.597 1.00 19.83 C ATOM 1630 OG SER A 505 14.683 7.663 1.382 1.00 23.80 O ATOM 1631 HG SER A 505 14.236 8.475 1.730 1.00 0.00 H ATOM 1632 H SER A 505 11.918 8.577 1.372 1.00 0.00 H ATOM 1633 N ALA A 506 13.142 6.624 3.773 1.00 18.43 N ATOM 1634 CA ALA A 506 13.551 6.131 5.084 1.00 18.14 C ATOM 1635 C ALA A 506 12.374 5.634 5.923 1.00 17.39 C ATOM 1636 O ALA A 506 12.586 5.034 6.979 1.00 18.33 O ATOM 1637 CB ALA A 506 14.286 7.237 5.845 1.00 17.95 C ATOM 1638 H ALA A 506 12.970 7.643 3.653 1.00 0.00 H ATOM 1639 N GLY A 507 11.148 5.924 5.483 1.00 16.99 N ATOM 1640 CA GLY A 507 9.941 5.553 6.218 1.00 16.46 C ATOM 1641 C GLY A 507 9.659 6.429 7.422 1.00 16.36 C ATOM 1642 O GLY A 507 8.946 6.011 8.333 1.00 17.01 O ATOM 1643 H GLY A 507 11.048 6.434 4.582 1.00 0.00 H ATOM 1644 N ARG A 508 10.163 7.664 7.408 1.00 16.02 N ATOM 1645 CA ARG A 508 10.114 8.527 8.592 1.00 16.17 C ATOM 1646 C ARG A 508 9.283 9.797 8.414 1.00 15.98 C ATOM 1647 O ARG A 508 9.286 10.663 9.288 1.00 16.43 O ATOM 1648 CB ARG A 508 11.530 8.899 9.016 1.00 16.39 C ATOM 1649 CG ARG A 508 12.467 7.698 9.203 1.00 17.03 C ATOM 1650 CD ARG A 508 12.005 6.760 10.289 1.00 18.08 C ATOM 1651 NE ARG A 508 12.068 7.372 11.612 1.00 19.40 N ATOM 1652 CZ ARG A 508 11.636 6.800 12.733 1.00 20.42 C ATOM 1653 NH1 ARG A 508 11.074 5.593 12.706 1.00 22.23 N ATOM 1654 NH2 ARG A 508 11.740 7.449 13.885 1.00 21.41 N ATOM 1655 HE ARG A 508 12.480 8.324 11.684 1.00 0.00 H ATOM 1656 HH12 ARG A 508 10.740 5.155 13.588 1.00 0.00 H ATOM 1657 HH11 ARG A 508 10.969 5.088 11.803 1.00 0.00 H ATOM 1658 HH22 ARG A 508 11.404 7.006 14.764 1.00 0.00 H ATOM 1659 HH21 ARG A 508 12.158 8.401 13.910 1.00 0.00 H ATOM 1660 H ARG A 508 10.601 8.023 6.536 1.00 0.00 H ATOM 1661 N GLY A 509 8.567 9.922 7.304 1.00 15.29 N ATOM 1662 CA GLY A 509 7.677 11.058 7.119 1.00 14.98 C ATOM 1663 C GLY A 509 6.841 10.996 5.857 1.00 14.87 C ATOM 1664 O GLY A 509 6.982 10.074 5.052 1.00 15.05 O ATOM 1665 H GLY A 509 8.643 9.201 6.559 1.00 0.00 H ATOM 1666 N ARG A 510 5.973 11.987 5.709 1.00 14.75 N ATOM 1667 CA ARG A 510 5.034 12.087 4.599 1.00 14.59 C ATOM 1668 C ARG A 510 4.739 13.548 4.310 1.00 15.03 C ATOM 1669 O ARG A 510 4.728 14.372 5.225 1.00 14.94 O ATOM 1670 CB ARG A 510 3.695 11.434 4.969 1.00 14.83 C ATOM 1671 CG ARG A 510 3.724 9.954 5.208 1.00 15.10 C ATOM 1672 CD ARG A 510 3.952 9.195 3.929 1.00 14.94 C ATOM 1673 NE ARG A 510 3.811 7.764 4.157 1.00 15.92 N ATOM 1674 CZ ARG A 510 4.156 6.822 3.288 1.00 16.17 C ATOM 1675 NH1 ARG A 510 4.685 7.138 2.114 1.00 17.52 N ATOM 1676 NH2 ARG A 510 3.972 5.547 3.610 1.00 18.17 N ATOM 1677 HE ARG A 510 3.411 7.458 5.067 1.00 0.00 H ATOM 1678 HH12 ARG A 510 4.950 6.388 1.444 1.00 0.00 H ATOM 1679 HH11 ARG A 510 4.835 8.136 1.863 1.00 0.00 H ATOM 1680 HH22 ARG A 510 4.237 4.798 2.939 1.00 0.00 H ATOM 1681 HH21 ARG A 510 3.562 5.298 4.533 1.00 0.00 H ATOM 1682 H ARG A 510 5.961 12.738 6.428 1.00 0.00 H ATOM 1683 N ALA A 511 4.466 13.863 3.052 1.00 15.56 N ATOM 1684 CA ALA A 511 3.848 15.131 2.712 1.00 16.49 C ATOM 1685 C ALA A 511 2.395 15.096 3.180 1.00 17.48 C ATOM 1686 O ALA A 511 1.741 14.046 3.110 1.00 17.30 O ATOM 1687 CB ALA A 511 3.909 15.366 1.217 1.00 16.64 C ATOM 1688 H ALA A 511 4.699 13.189 2.295 1.00 0.00 H ATOM 1689 N ARG A 512 1.893 16.222 3.677 1.00 18.24 N ATOM 1690 CA ARG A 512 0.489 16.325 4.090 1.00 19.14 C ATOM 1691 C ARG A 512 -0.077 17.718 3.781 1.00 20.38 C ATOM 1692 O ARG A 512 0.654 18.708 3.852 1.00 21.20 O ATOM 1693 CB ARG A 512 0.343 16.011 5.592 1.00 19.14 C ATOM 1694 CG ARG A 512 0.541 14.538 6.000 1.00 18.47 C ATOM 1695 CD ARG A 512 -0.551 13.630 5.435 1.00 16.61 C ATOM 1696 NE ARG A 512 -0.434 12.221 5.848 1.00 15.25 N ATOM 1697 CZ ARG A 512 -0.020 11.212 5.071 1.00 13.87 C ATOM 1698 NH1 ARG A 512 0.371 11.416 3.812 1.00 8.35 N ATOM 1699 NH2 ARG A 512 0.013 9.972 5.562 1.00 15.37 N ATOM 1700 HE ARG A 512 -0.696 11.990 6.828 1.00 0.00 H ATOM 1701 HH12 ARG A 512 0.688 10.615 3.230 1.00 0.00 H ATOM 1702 HH11 ARG A 512 0.359 12.376 3.413 1.00 0.00 H ATOM 1703 HH22 ARG A 512 0.334 9.184 4.964 1.00 0.00 H ATOM 1704 HH21 ARG A 512 -0.282 9.793 6.543 1.00 0.00 H ATOM 1705 H ARG A 512 2.512 17.052 3.776 1.00 0.00 H ATOM 1706 N ILE A 513 -1.377 17.780 3.471 1.00 21.66 N ATOM 1707 CA ILE A 513 -2.083 19.040 3.147 1.00 23.41 C ATOM 1708 C ILE A 513 -2.090 19.994 4.340 1.00 24.47 C ATOM 1709 O ILE A 513 -2.414 19.597 5.464 1.00 25.64 O ATOM 1710 CB ILE A 513 -3.559 18.799 2.752 1.00 23.82 C ATOM 1711 CG1 ILE A 513 -3.670 18.023 1.441 1.00 24.84 C ATOM 1712 CG2 ILE A 513 -4.310 20.127 2.619 1.00 25.94 C ATOM 1713 CD1 ILE A 513 -5.052 17.417 1.227 1.00 26.76 C ATOM 1714 OXT ILE A 513 -1.791 21.187 4.195 1.00 25.42 O ATOM 1715 H ILE A 513 -1.922 16.894 3.457 1.00 0.00 H TER 1716 ILE A 513 HETATM 1717 O HOH 1 -0.306 30.898 6.213 1.00 43.62 O HETATM 1718 O HOH 2 -4.561 24.366 5.437 1.00 37.18 O HETATM 1719 O HOH 3 -4.610 27.058 5.786 1.00 38.69 O HETATM 1720 O HOH 4 1.339 19.325 0.525 1.00 44.09 O HETATM 1721 O HOH 5 1.785 22.874 1.841 1.00 48.27 O HETATM 1722 O HOH 6 1.917 23.318 4.534 1.00 47.15 O HETATM 1723 O HOH 7 4.606 21.677 2.378 1.00 41.02 O HETATM 1724 O HOH 8 5.521 19.339 1.828 1.00 41.04 O HETATM 1725 O HOH 9 13.197 9.661 12.731 1.00 18.93 O HETATM 1726 O HOH 10 15.212 10.425 14.385 1.00 18.18 O HETATM 1727 O HOH 11 12.513 5.123 16.904 1.00 41.72 O HETATM 1728 O HOH 12 15.486 10.447 24.799 1.00 23.83 O HETATM 1729 O HOH 13 23.176 11.201 20.049 1.00 45.45 O HETATM 1730 O HOH 14 17.972 11.398 26.124 1.00 22.58 O HETATM 1731 O HOH 15 23.481 16.732 23.425 1.00 43.18 O HETATM 1732 O HOH 16 14.916 3.763 26.401 1.00 46.70 O HETATM 1733 O HOH 17 12.887 7.684 25.848 1.00 52.33 O HETATM 1734 O HOH 18 9.109 3.340 20.513 1.00 45.46 O HETATM 1735 O HOH 19 12.150 2.922 23.314 1.00 42.87 O HETATM 1736 O HOH 20 4.319 11.593 18.418 1.00 33.13 O HETATM 1737 O HOH 21 3.276 14.082 18.241 1.00 25.19 O HETATM 1738 O HOH 22 -0.273 12.404 11.190 1.00 40.87 O HETATM 1739 O HOH 23 7.273 21.953 13.128 1.00 12.40 O HETATM 1740 O HOH 24 5.310 28.061 6.233 1.00 23.48 O HETATM 1741 O HOH 25 7.612 30.030 6.128 1.00 26.08 O HETATM 1742 O HOH 26 9.679 30.341 1.925 1.00 27.70 O HETATM 1743 O HOH 27 12.778 30.835 5.037 1.00 15.61 O HETATM 1744 O HOH 28 17.462 22.116 6.022 1.00 12.57 O HETATM 1745 O HOH 29 21.084 22.063 13.064 1.00 21.80 O HETATM 1746 O HOH 30 22.686 22.369 9.506 1.00 17.03 O HETATM 1747 O HOH 31 17.758 27.197 13.041 1.00 12.85 O HETATM 1748 O HOH 32 20.094 19.890 14.551 1.00 18.24 O HETATM 1749 O HOH 33 -2.019 23.148 24.707 1.00 28.27 O HETATM 1750 O HOH 34 -4.249 22.957 29.344 1.00 39.30 O HETATM 1751 O HOH 35 -0.813 21.839 31.032 1.00 23.90 O HETATM 1752 O HOH 36 -0.842 24.948 27.702 1.00 34.44 O HETATM 1753 O HOH 37 2.351 13.719 29.369 1.00 21.94 O HETATM 1754 O HOH 38 -0.701 13.860 22.710 1.00 37.67 O HETATM 1755 O HOH 39 3.899 9.697 28.697 1.00 35.63 O HETATM 1756 O HOH 40 0.253 12.309 20.626 1.00 44.92 O HETATM 1757 O HOH 41 6.897 11.737 34.304 1.00 41.38 O HETATM 1758 O HOH 42 2.147 13.700 35.360 1.00 36.41 O HETATM 1759 O HOH 43 6.111 14.352 34.091 1.00 26.21 O HETATM 1760 O HOH 44 1.669 9.681 32.945 1.00 43.07 O HETATM 1761 O HOH 45 10.761 6.336 27.246 1.00 48.38 O HETATM 1762 O HOH 46 12.211 8.579 30.552 1.00 49.15 O HETATM 1763 O HOH 47 11.410 10.018 34.810 1.00 41.60 O HETATM 1764 O HOH 48 12.126 13.693 37.003 1.00 23.01 O HETATM 1765 O HOH 49 16.295 9.287 33.304 1.00 33.58 O HETATM 1766 O HOH 50 16.320 12.387 40.594 1.00 45.57 O HETATM 1767 O HOH 51 18.788 9.040 38.419 1.00 47.56 O HETATM 1768 O HOH 52 17.034 9.793 40.376 1.00 41.97 O HETATM 1769 O HOH 53 18.231 14.429 40.801 1.00 30.63 O HETATM 1770 O HOH 54 17.845 16.506 38.927 1.00 22.71 O HETATM 1771 O HOH 55 22.459 16.974 37.549 1.00 43.27 O HETATM 1772 O HOH 56 22.638 19.438 36.496 1.00 39.39 O HETATM 1773 O HOH 57 24.854 14.216 32.803 1.00 40.75 O HETATM 1774 O HOH 58 24.858 25.538 30.056 1.00 45.10 O HETATM 1775 O HOH 59 21.587 23.181 28.836 1.00 25.19 O HETATM 1776 O HOH 60 21.451 30.899 32.235 1.00 36.58 O HETATM 1777 O HOH 61 22.218 27.267 26.653 1.00 25.05 O HETATM 1778 O HOH 62 21.781 31.185 28.176 1.00 32.59 O HETATM 1779 O HOH 63 16.476 27.528 37.286 1.00 35.76 O HETATM 1780 O HOH 64 12.507 27.047 32.337 1.00 19.07 O HETATM 1781 O HOH 65 13.566 30.432 31.572 1.00 31.49 O HETATM 1782 O HOH 66 16.727 23.966 38.741 1.00 35.42 O HETATM 1783 O HOH 67 9.742 24.616 39.587 1.00 16.21 O HETATM 1784 O HOH 68 6.413 31.339 33.679 1.00 20.99 O HETATM 1785 O HOH 69 13.920 26.815 42.792 1.00 26.21 O HETATM 1786 O HOH 70 11.902 21.473 42.905 1.00 31.06 O HETATM 1787 O HOH 71 11.082 13.987 40.426 1.00 30.24 O HETATM 1788 O HOH 72 5.664 15.792 36.426 1.00 19.67 O HETATM 1789 O HOH 73 6.813 15.810 40.451 1.00 25.55 O HETATM 1790 O HOH 74 6.521 20.493 41.219 1.00 19.49 O HETATM 1791 O HOH 75 14.191 18.220 44.094 1.00 44.45 O HETATM 1792 O HOH 76 8.681 19.643 44.792 1.00 44.95 O HETATM 1793 O HOH 77 0.881 20.025 37.997 1.00 23.23 O HETATM 1794 O HOH 78 -2.089 23.309 33.032 1.00 23.88 O HETATM 1795 O HOH 79 -1.261 19.235 31.743 1.00 33.81 O HETATM 1796 O HOH 80 3.145 16.637 35.700 1.00 22.75 O HETATM 1797 O HOH 81 -2.735 26.627 39.084 1.00 27.50 O HETATM 1798 O HOH 82 -2.312 26.865 41.594 1.00 34.92 O HETATM 1799 O HOH 83 -2.250 25.323 45.741 1.00 45.48 O HETATM 1800 O HOH 84 -1.376 21.145 36.810 1.00 41.77 O HETATM 1801 O HOH 85 -2.659 28.639 30.136 1.00 30.97 O HETATM 1802 O HOH 86 -6.309 28.549 33.001 1.00 41.14 O HETATM 1803 O HOH 87 -4.785 28.298 38.793 1.00 41.69 O HETATM 1804 O HOH 88 -6.528 31.801 34.998 1.00 40.05 O HETATM 1805 O HOH 89 -4.256 34.280 37.443 1.00 23.12 O HETATM 1806 O HOH 90 -7.972 30.446 31.894 1.00 43.72 O HETATM 1807 O HOH 91 4.696 30.962 31.408 1.00 28.42 O HETATM 1808 O HOH 92 4.861 31.562 27.746 1.00 31.77 O HETATM 1809 O HOH 93 4.674 33.545 30.499 1.00 31.83 O HETATM 1810 O HOH 94 -7.045 38.247 33.084 1.00 16.87 O HETATM 1811 O HOH 95 -11.531 34.049 29.850 1.00 37.67 O HETATM 1812 O HOH 96 -9.029 33.301 30.968 1.00 27.44 O HETATM 1813 O HOH 97 1.564 35.563 24.128 1.00 45.20 O HETATM 1814 O HOH 98 2.182 36.614 28.731 1.00 39.83 O HETATM 1815 O HOH 99 -0.138 35.716 20.764 1.00 64.61 O HETATM 1816 O HOH 100 -6.410 37.252 18.749 1.00 43.81 O HETATM 1817 O HOH 101 5.963 36.718 25.538 1.00 44.04 O HETATM 1818 O HOH 102 10.388 35.310 23.656 1.00 54.78 O HETATM 1819 O HOH 103 7.496 35.313 18.426 1.00 43.34 O HETATM 1820 O HOH 104 3.673 31.907 19.293 1.00 34.87 O HETATM 1821 O HOH 105 5.601 36.132 22.167 1.00 39.03 O HETATM 1822 O HOH 106 5.935 29.294 25.511 1.00 21.76 O HETATM 1823 O HOH 107 10.442 29.553 31.314 1.00 23.13 O HETATM 1824 O HOH 108 23.173 15.816 28.295 1.00 31.30 O HETATM 1825 O HOH 109 21.966 20.046 26.521 1.00 44.80 O HETATM 1826 O HOH 110 22.007 20.399 29.213 1.00 47.30 O HETATM 1827 O HOH 111 19.634 12.661 6.043 1.00 21.76 O HETATM 1828 O HOH 112 23.013 14.220 5.874 1.00 38.36 O HETATM 1829 O HOH 113 25.905 16.427 11.679 1.00 42.05 O HETATM 1830 O HOH 114 23.259 19.793 10.239 1.00 24.59 O HETATM 1831 O HOH 115 25.154 19.082 11.824 1.00 48.56 O HETATM 1832 O HOH 116 25.516 20.742 14.830 1.00 66.38 O HETATM 1833 O HOH 117 21.811 18.421 21.697 1.00 34.31 O HETATM 1834 O HOH 118 -0.223 25.266 24.927 1.00 26.58 O HETATM 1835 O HOH 119 2.434 31.295 24.379 1.00 40.31 O HETATM 1836 O HOH 120 -1.008 28.416 28.210 1.00 38.08 O HETATM 1837 O HOH 121 3.040 29.328 18.368 1.00 21.45 O HETATM 1838 O HOH 122 -0.004 29.135 20.410 1.00 41.24 O HETATM 1839 O HOH 123 -5.037 23.049 21.974 1.00 41.24 O HETATM 1840 O HOH 124 -1.046 16.907 22.223 1.00 32.91 O HETATM 1841 O HOH 125 -5.227 17.253 16.085 1.00 40.47 O HETATM 1842 O HOH 126 -8.299 18.271 17.818 1.00 47.62 O HETATM 1843 O HOH 127 -5.320 19.452 14.253 1.00 36.38 O HETATM 1844 O HOH 128 2.049 19.762 15.303 1.00 16.05 O HETATM 1845 O HOH 129 -5.227 24.464 9.983 1.00 32.28 O HETATM 1846 O HOH 130 -4.217 27.783 11.881 1.00 50.41 O HETATM 1847 O HOH 131 -2.174 22.143 9.440 1.00 46.50 O HETATM 1848 O HOH 132 -3.472 20.622 11.401 1.00 23.83 O HETATM 1849 O HOH 133 -2.228 14.661 14.892 1.00 39.92 O HETATM 1850 O HOH 134 0.106 13.327 18.151 1.00 36.29 O HETATM 1851 O HOH 135 3.019 21.643 0.016 1.00 32.20 O HETATM 1852 O HOH 136 0.742 25.979 4.601 1.00 37.47 O HETATM 1853 O HOH 137 10.969 1.852 25.522 1.00 49.75 O HETATM 1854 O HOH 138 8.474 31.781 9.196 1.00 33.39 O HETATM 1855 O HOH 139 7.156 27.367 15.888 1.00 17.15 O HETATM 1856 O HOH 140 2.995 29.641 6.424 1.00 31.87 O HETATM 1857 O HOH 141 6.555 32.133 7.463 1.00 37.90 O HETATM 1858 O HOH 142 2.428 30.708 3.767 1.00 49.79 O HETATM 1859 O HOH 143 7.988 33.585 11.556 1.00 21.45 O HETATM 1860 O HOH 144 11.226 37.522 11.407 1.00 25.29 O HETATM 1861 O HOH 145 14.190 39.534 15.786 1.00 24.83 O HETATM 1862 O HOH 146 23.887 22.412 13.433 1.00 40.96 O HETATM 1863 O HOH 147 24.940 23.661 10.647 1.00 25.33 O HETATM 1864 O HOH 148 4.551 27.714 16.900 1.00 17.31 O HETATM 1865 O HOH 149 1.013 28.068 13.368 1.00 29.24 O HETATM 1866 O HOH 150 -3.716 24.915 31.479 1.00 41.86 O HETATM 1867 O HOH 151 2.948 8.094 30.619 1.00 42.48 O HETATM 1868 O HOH 152 13.743 36.366 23.128 1.00 25.88 O HETATM 1869 O HOH 153 13.051 37.943 21.055 1.00 47.39 O HETATM 1870 O HOH 154 8.993 38.760 17.733 1.00 36.46 O HETATM 1871 O HOH 155 9.911 12.103 36.466 1.00 40.10 O HETATM 1872 O HOH 156 20.915 31.469 21.125 1.00 29.83 O HETATM 1873 O HOH 157 17.389 6.875 37.834 1.00 38.04 O HETATM 1874 O HOH 158 20.947 14.027 41.141 1.00 38.87 O HETATM 1875 O HOH 159 20.710 33.248 23.113 1.00 37.19 O HETATM 1876 O HOH 160 20.044 33.232 27.248 1.00 39.97 O HETATM 1877 O HOH 161 24.358 15.038 37.245 1.00 35.86 O HETATM 1878 O HOH 162 25.019 13.341 35.302 1.00 29.85 O HETATM 1879 O HOH 163 23.009 24.691 27.113 1.00 38.21 O HETATM 1880 O HOH 164 13.970 32.349 29.704 1.00 34.24 O HETATM 1881 O HOH 165 16.560 34.865 28.886 1.00 33.93 O HETATM 1882 O HOH 166 22.131 24.915 23.732 1.00 38.83 O HETATM 1883 O HOH 167 23.515 26.761 22.497 1.00 40.31 O HETATM 1884 O HOH 168 10.127 23.528 42.307 1.00 28.12 O HETATM 1885 O HOH 169 9.455 31.591 33.018 1.00 27.84 O HETATM 1886 O HOH 170 15.691 28.109 41.291 1.00 48.80 O HETATM 1887 O HOH 171 23.370 29.929 17.833 1.00 30.46 O HETATM 1888 O HOH 172 24.590 29.743 13.322 1.00 39.66 O HETATM 1889 O HOH 173 4.957 14.638 38.923 1.00 26.37 O HETATM 1890 O HOH 174 5.879 17.954 41.903 1.00 24.25 O HETATM 1891 O HOH 175 7.971 21.918 43.132 1.00 28.27 O HETATM 1892 O HOH 176 24.275 29.035 10.774 1.00 22.73 O HETATM 1893 O HOH 177 25.263 29.870 6.641 1.00 33.27 O HETATM 1894 O HOH 178 24.281 31.899 3.781 1.00 39.90 O HETATM 1895 O HOH 179 18.979 33.722 5.890 1.00 14.51 O HETATM 1896 O HOH 180 22.247 34.907 8.226 1.00 24.83 O HETATM 1897 O HOH 181 21.649 34.857 4.241 1.00 17.96 O HETATM 1898 O HOH 182 1.059 17.367 37.526 1.00 25.85 O HETATM 1899 O HOH 183 1.817 20.105 40.820 1.00 30.90 O HETATM 1900 O HOH 184 -1.566 17.052 30.692 1.00 44.56 O HETATM 1901 O HOH 185 -4.269 26.268 43.476 1.00 58.60 O HETATM 1902 O HOH 186 -2.513 28.147 48.024 1.00 40.90 O HETATM 1903 O HOH 187 -4.957 32.311 39.188 1.00 42.92 O HETATM 1904 O HOH 188 17.899 40.126 3.033 1.00 20.62 O HETATM 1905 O HOH 189 -8.411 33.648 34.126 1.00 34.08 O HETATM 1906 O HOH 190 16.586 37.555 8.644 1.00 19.82 O HETATM 1907 O HOH 191 18.716 40.521 5.728 1.00 39.44 O HETATM 1908 O HOH 192 3.057 37.479 23.404 1.00 40.87 O HETATM 1909 O HOH 193 3.161 36.577 20.613 1.00 45.91 O HETATM 1910 O HOH 194 3.706 40.001 22.934 1.00 43.12 O HETATM 1911 O HOH 195 6.592 35.794 15.885 1.00 37.03 O HETATM 1912 O HOH 196 24.881 35.215 11.722 1.00 40.61 O HETATM 1913 O HOH 197 16.692 40.248 8.846 1.00 63.71 O HETATM 1914 O HOH 198 14.255 38.677 7.746 1.00 33.86 O HETATM 1915 O HOH 199 12.393 38.500 9.468 1.00 39.57 O HETATM 1916 O HOH 200 21.486 20.580 24.193 1.00 39.71 O HETATM 1917 O HOH 201 12.027 37.160 6.641 1.00 21.41 O HETATM 1918 O HOH 202 24.377 15.454 7.833 1.00 47.47 O HETATM 1919 O HOH 203 9.800 37.958 8.136 1.00 43.71 O HETATM 1920 O HOH 204 24.696 17.954 8.622 1.00 45.83 O HETATM 1921 O HOH 205 8.309 29.191 -0.540 1.00 43.29 O HETATM 1922 O HOH 206 13.105 29.541 -2.790 1.00 22.25 O HETATM 1923 O HOH 207 7.285 33.114 -3.105 1.00 40.27 O HETATM 1924 O HOH 208 8.358 32.397 1.081 1.00 44.04 O HETATM 1925 O HOH 209 24.751 25.579 -0.029 1.00 21.49 O HETATM 1926 O HOH 210 -4.842 16.650 18.544 1.00 34.85 O HETATM 1927 O HOH 211 -7.719 16.627 15.818 1.00 44.34 O HETATM 1928 O HOH 212 -3.509 14.329 17.396 1.00 46.78 O HETATM 1929 O HOH 213 -7.263 21.403 14.452 1.00 43.75 O HETATM 1930 O HOH 214 -4.360 26.293 8.213 1.00 35.92 O HETATM 1931 O HOH 215 -7.814 24.373 8.143 1.00 36.06 O HETATM 1932 O HOH 216 -7.542 25.396 11.607 1.00 48.69 O HETATM 1933 O HOH 217 -4.237 30.542 11.070 1.00 45.55 O HETATM 1934 O HOH 218 -8.263 21.328 9.651 1.00 47.98 O HETATM 1935 O HOH 219 26.196 25.219 2.541 1.00 16.71 O HETATM 1936 O HOH 220 27.877 23.579 6.453 1.00 50.74 O HETATM 1937 O HOH 221 27.307 27.289 3.783 1.00 37.32 O HETATM 1938 O HOH 222 -3.218 17.479 11.269 1.00 40.28 O HETATM 1939 O HOH 223 -4.860 13.706 14.452 1.00 34.21 O HETATM 1940 O HOH 224 -3.727 14.879 12.598 1.00 41.97 O HETATM 1941 O HOH 225 -3.398 12.116 15.536 1.00 37.35 O HETATM 1942 O HOH 226 -5.173 12.538 18.138 1.00 41.77 O HETATM 1943 O HOH 227 26.169 20.999 4.408 1.00 18.61 O HETATM 1944 O HOH 228 25.556 18.740 6.175 1.00 81.04 O HETATM 1945 O HOH 229 24.672 13.000 1.115 1.00 33.34 O HETATM 1946 O HOH 230 27.170 17.655 1.355 1.00 32.28 O HETATM 1947 O HOH 231 28.232 14.861 1.878 1.00 29.59 O HETATM 1948 O HOH 232 5.974 34.226 13.757 1.00 43.07 O HETATM 1949 O HOH 233 8.486 36.601 10.940 1.00 29.60 O HETATM 1950 O HOH 234 10.329 39.943 12.867 1.00 47.46 O HETATM 1951 O HOH 235 12.087 40.621 14.568 1.00 42.93 O HETATM 1952 O HOH 236 15.168 37.215 25.090 1.00 40.14 O HETATM 1953 O HOH 237 18.679 26.099 -7.318 1.00 24.40 O HETATM 1954 O HOH 238 14.563 34.888 31.203 1.00 39.39 O HETATM 1955 O HOH 239 14.423 36.509 27.628 1.00 43.11 O HETATM 1956 O HOH 240 16.383 24.336 -7.011 1.00 21.49 O HETATM 1957 O HOH 241 12.730 26.193 -8.053 1.00 33.71 O HETATM 1958 O HOH 242 11.481 28.210 -6.877 1.00 29.34 O HETATM 1959 O HOH 243 25.631 26.563 10.850 1.00 29.01 O HETATM 1960 O HOH 244 25.208 31.222 9.369 1.00 44.17 O HETATM 1961 O HOH 245 26.227 29.696 3.989 1.00 43.47 O HETATM 1962 O HOH 246 7.663 22.163 -3.245 1.00 24.65 O HETATM 1963 O HOH 247 13.526 18.621 -5.648 1.00 24.43 O HETATM 1964 O HOH 248 7.035 18.198 -0.400 1.00 33.58 O HETATM 1965 O HOH 249 5.004 25.051 -0.585 1.00 40.79 O HETATM 1966 O HOH 250 7.646 28.628 2.225 1.00 29.45 O HETATM 1967 O HOH 251 7.853 26.675 -1.294 1.00 27.08 O HETATM 1968 O HOH 252 8.477 14.671 -2.740 1.00 32.59 O HETATM 1969 O HOH 253 8.688 21.191 -10.189 1.00 46.53 O HETATM 1970 O HOH 254 11.020 8.371 -1.705 1.00 25.95 O HETATM 1971 O HOH 255 8.941 9.995 -2.541 1.00 34.48 O HETATM 1972 O HOH 256 13.687 7.956 -3.742 1.00 45.72 O HETATM 1973 O HOH 257 15.227 11.865 -6.005 1.00 44.86 O HETATM 1974 O HOH 258 14.070 14.156 -5.113 1.00 32.16 O HETATM 1975 O HOH 259 15.114 9.500 -1.275 1.00 40.21 O HETATM 1976 O HOH 260 17.139 21.825 -7.745 1.00 34.73 O HETATM 1977 O HOH 261 6.249 20.497 -1.818 1.00 35.21 O HETATM 1978 O HOH 262 6.314 24.629 -3.086 1.00 32.09 O HETATM 1979 O HOH 263 16.437 8.107 3.268 1.00 50.20 O HETATM 1980 O HOH 264 18.676 7.272 4.174 1.00 51.57 O HETATM 1981 O HOH 265 17.302 8.259 -0.455 1.00 50.34 O HETATM 1982 O HOH 266 23.090 8.827 2.534 1.00 36.97 O HETATM 1983 O HOH 267 5.845 26.752 -4.630 1.00 39.33 O HETATM 1984 O HOH 268 10.537 5.828 -1.522 1.00 37.49 O HETATM 1985 O HOH 269 14.876 9.358 -6.842 1.00 33.92 O HETATM 1986 O HOH 270 13.818 12.773 -8.002 1.00 36.93 O HETATM 1987 O HOH 271 12.834 4.580 -1.864 1.00 48.21 O HETATM 1988 O HOH 272 12.002 14.474 -8.806 1.00 35.89 O HETATM 1989 O HOH 273 13.068 12.106 -10.409 1.00 41.83 O HETATM 1990 O HOH 274 7.651 5.487 3.298 1.00 20.60 O HETATM 1991 O HOH 275 10.695 2.813 3.241 1.00 45.00 O HETATM 1992 O HOH 276 6.405 7.410 -2.398 1.00 29.67 O HETATM 1993 O HOH 277 6.019 11.399 -2.765 1.00 32.82 O HETATM 1994 O HOH 278 4.111 11.895 0.977 1.00 21.82 O HETATM 1995 O HOH 279 17.432 5.134 6.240 1.00 44.82 O HETATM 1996 O HOH 280 7.845 5.413 -1.227 1.00 42.71 O HETATM 1997 O HOH 281 15.533 4.243 7.944 1.00 47.66 O HETATM 1998 O HOH 282 -3.985 15.140 5.665 1.00 26.81 O HETATM 1999 O HOH 283 -5.828 14.653 10.162 1.00 35.87 O HETATM 2000 O HOH 284 -0.645 16.851 11.013 1.00 41.15 O HETATM 2001 O HOH 285 15.176 6.479 12.411 1.00 47.05 O HETATM 2002 O HOH 286 6.485 5.018 0.943 1.00 28.91 O HETATM 2003 O HOH 287 -3.996 13.373 7.880 1.00 36.35 O HETATM 2004 O HOH 288 -1.358 15.809 8.661 1.00 35.47 O HETATM 2005 O HOH 289 -2.003 14.774 10.928 1.00 37.66 O HETATM 2006 O HOH 290 -2.630 15.294 3.261 1.00 19.43 O HETATM 2007 O HOH 291 -3.251 17.476 6.884 1.00 30.48 O HETATM 2008 O HOH 292 -0.916 22.273 1.841 1.00 41.01 O HETATM 2009 O HOH 293 -1.019 24.066 7.266 1.00 34.74 O HETATM 2010 O HOH 294 0.838 27.890 6.779 1.00 52.34 O HETATM 2011 O HOH 295 -3.449 28.598 8.963 1.00 43.64 O HETATM 2012 O HOH 296 0.010 30.082 11.846 1.00 41.53 O HETATM 2013 O HOH 297 -0.644 27.301 15.892 1.00 46.95 O HETATM 2014 O HOH 298 3.942 32.061 7.868 1.00 41.02 O HETATM 2015 O HOH 299 21.189 22.600 22.772 1.00 33.84 O HETATM 2016 O HOH 300 22.392 21.073 21.193 1.00 38.30 O HETATM 2017 O HOH 301 -0.645 19.737 -9.429 1.00 37.06 O HETATM 2018 O HOH 302 -2.481 22.012 -11.660 1.00 44.17 O HETATM 2019 O HOH 303 -0.973 20.324 -4.785 1.00 63.87 O HETATM 2020 O HOH 304 1.506 21.345 -5.173 1.00 55.73 O HETATM 2021 O HOH 305 13.593 15.572 -10.437 1.00 41.36 O HETATM 2022 O1 A A 2 7.516 24.286 11.231 1.00 -0.37 O HETATM 2023 C10 A A 2 8.644 25.126 11.140 1.00 0.13 C HETATM 2024 C11 A A 2 8.356 26.369 10.429 1.00 -0.00 C HETATM 2025 C12 A A 2 7.003 26.505 10.628 1.00 -0.03 C HETATM 2026 C16 A A 2 6.429 27.679 10.146 1.00 0.09 C HETATM 2027 C15 A A 2 7.254 28.656 9.553 1.00 -0.04 C HETATM 2028 C14 A A 2 8.622 28.487 9.428 1.00 -0.06 C HETATM 2029 C13 A A 2 9.191 27.319 9.899 1.00 0.03 C HETATM 2030 CL A A 2 10.930 27.047 9.714 1.00 -0.09 CL HETATM 2031 H9 A A 2 9.235 29.255 8.970 1.00 0.06 H HETATM 2032 H10 A A 2 6.802 29.569 9.183 1.00 0.05 H HETATM 2033 O19 A A 2 5.083 27.860 10.252 1.00 -0.32 O HETATM 2034 C20 A A 2 4.460 29.091 9.852 1.00 0.07 C HETATM 2035 C21 A A 2 2.977 29.003 10.096 1.00 -0.04 C HETATM 2036 H20 A A 2 2.499 29.945 9.790 1.00 0.03 H HETATM 2037 H21 A A 2 2.791 28.828 11.166 1.00 0.03 H HETATM 2038 H22 A A 2 2.558 28.172 9.510 1.00 0.03 H HETATM 2039 H18 A A 2 4.646 29.266 8.782 1.00 0.06 H HETATM 2040 H19 A A 2 4.880 29.922 10.438 1.00 0.06 H HETATM 2041 C17 A A 2 9.625 25.155 12.258 1.00 0.00 C HETATM 2042 N18 A A 2 8.845 25.816 13.319 1.00 0.22 N HETATM 2043 H13 A A 2 9.410 25.898 14.150 1.00 0.20 H HETATM 2044 H14 A A 2 8.024 25.268 13.524 1.00 0.20 H HETATM 2045 H15 A A 2 8.567 26.734 13.009 1.00 0.20 H HETATM 2046 H11 A A 2 10.518 25.740 11.993 1.00 0.09 H HETATM 2047 H12 A A 2 9.926 24.139 12.555 1.00 0.09 H HETATM 2048 H7 A A 2 9.240 24.589 10.387 1.00 0.08 H HETATM 2049 O2' A A 2 5.969 25.386 12.612 1.00 -0.38 O HETATM 2050 C2' A A 2 4.828 24.582 12.894 1.00 0.14 C HETATM 2051 C1' A A 2 3.783 25.328 13.705 1.00 0.20 C HETATM 2052 N9 A A 2 2.929 24.360 14.443 1.00 -0.19 N HETATM 2053 C4 A A 2 2.404 24.586 15.642 1.00 0.16 C HETATM 2054 N3 A A 2 2.476 25.679 16.426 1.00 -0.27 N HETATM 2055 C2 A A 2 1.845 25.638 17.606 1.00 0.05 C HETATM 2056 N1 A A 2 1.165 24.568 18.022 1.00 -0.27 N HETATM 2057 C6 A A 2 1.066 23.446 17.273 1.00 0.13 C HETATM 2058 C5 A A 2 1.705 23.454 16.032 1.00 0.10 C HETATM 2059 N7 A A 2 1.837 22.530 15.050 1.00 -0.30 N HETATM 2060 C8 A A 2 2.585 23.107 14.089 1.00 0.11 C HETATM 2061 H5 A A 2 2.872 22.626 13.155 1.00 0.13 H HETATM 2062 N6 A A 2 0.369 22.373 17.709 1.00 -0.32 N HETATM 2063 H3 A A 2 0.305 21.528 17.124 1.00 0.18 H HETATM 2064 H4 A A 2 -0.099 22.401 18.626 1.00 0.18 H HETATM 2065 H2 A A 2 1.888 26.509 18.250 1.00 0.10 H HETATM 2066 O4' A A 2 3.060 26.086 12.740 1.00 -0.34 O HETATM 2067 C4' A A 2 3.169 25.496 11.435 1.00 0.12 C HETATM 2068 C3' A A 2 4.212 24.380 11.536 1.00 0.11 C HETATM 2069 O3' A A 2 5.304 24.583 10.648 1.00 -0.39 O HETATM 2070 H23 A A 2 3.758 23.387 11.404 1.00 0.06 H HETATM 2071 C5' A A 2 1.765 25.062 11.035 1.00 0.11 C HETATM 2072 O5' A A 2 1.017 26.273 10.951 1.00 -0.27 O HETATM 2073 P A A 2 -0.325 26.315 10.052 1.00 0.20 P HETATM 2074 O1P A A 2 -0.976 27.616 10.449 1.00 -0.55 O HETATM 2075 O2P A A 2 -1.004 25.067 10.498 1.00 -0.55 O HETATM 2076 O3P A A 2 0.174 26.265 8.629 1.00 -0.55 O HETATM 2077 H26 A A 2 1.335 24.393 11.795 1.00 0.06 H HETATM 2078 H27 A A 2 1.781 24.549 10.062 1.00 0.06 H HETATM 2079 H25 A A 2 3.525 26.240 10.707 1.00 0.07 H HETATM 2080 H6 A A 2 4.264 26.003 14.429 1.00 0.10 H HETATM 2081 H16 A A 2 5.109 23.638 13.383 1.00 0.07 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 87 88 94 95 96 CONECT 94 87 CONECT 95 87 CONECT 96 87 CONECT 737 738 749 750 751 CONECT 749 737 CONECT 750 737 CONECT 751 737 CONECT 2022 0 2023 CONECT 2023 2022 2024 2041 2048 CONECT 2024 2023 2025 2029 CONECT 2025 0 2024 2026 CONECT 2026 2025 2027 2033 CONECT 2027 2026 2028 2032 CONECT 2028 2027 2029 2031 CONECT 2029 2024 2028 2030 CONECT 2030 2029 CONECT 2031 2028 CONECT 2032 2027 CONECT 2033 2026 2034 CONECT 2034 2033 2035 2039 2040 CONECT 2035 2034 2036 2037 2038 CONECT 2036 2035 CONECT 2037 2035 CONECT 2038 2035 CONECT 2039 2034 CONECT 2040 2034 CONECT 2041 2023 2042 2046 2047 CONECT 2042 2041 2043 2044 2045 CONECT 2043 2042 CONECT 2044 2042 CONECT 2045 2042 CONECT 2046 2041 CONECT 2047 2041 CONECT 2048 2023 CONECT 2049 0 2050 CONECT 2050 2049 2051 2068 2081 CONECT 2051 2050 2052 2066 2080 CONECT 2052 2051 2053 2060 CONECT 2053 2052 2054 2058 CONECT 2054 2053 2055 CONECT 2055 2054 2056 2065 CONECT 2056 2055 2057 CONECT 2057 2056 2058 2062 CONECT 2058 2053 2057 2059 CONECT 2059 2058 2060 CONECT 2060 2052 2059 2061 CONECT 2061 2060 CONECT 2062 2057 2063 2064 CONECT 2063 2062 CONECT 2064 2062 CONECT 2065 2055 CONECT 2066 2051 2067 CONECT 2067 2066 2068 2071 2079 CONECT 2068 2050 2067 2069 2070 CONECT 2069 0 2068 CONECT 2070 2068 CONECT 2071 2067 2072 2077 2078 CONECT 2072 2071 2073 CONECT 2073 2072 2074 2075 2076 CONECT 2074 2073 CONECT 2075 2073 CONECT 2076 2073 CONECT 2077 2071 CONECT 2078 2071 CONECT 2079 2067 CONECT 2080 2051 CONECT 2081 2050 MASTER 0 0 0 0 0 0 0 0 2078 3 72 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5agt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5agr
RCSB PDB
PDBbind
232aa, >5AGR_1|Chain... *
5ags
RCSB PDB
PDBbind
232aa, >5AGS_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5fom
RCSB PDB
PDBbind
A2H
Entry Information
PDB ID
5agt
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
LeuRS editing domain of Mycobacterium tuberculosis
Ligand Name
A2H
EC.Number
E.C.-.-.-.-
Resolution
1.45(Å)
Affinity (Kd/Ki/IC50)
Kd=0.075uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Antimicrob.Agents Chemother. Vol. 60: pp. 6271-6280
Ligand Properties
Formula
C
2
0
H
2
6
BClN
6
O
9
P
Molecular Weight
571.693
Exact Mass
571.128
No. of atoms
64
No. of bonds
69
Polar Surface Area
226.92
LOGP Value
-3.48 (
Computed with XLOGP3
)
-0.45 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
CCOc1ccc(c2c1[B@]1(O[C@@H]3[C@H](O1)[C@H](O[C@H]3n1cnc3c1ncnc3N)COP(O)(O)O)O[C@@H]2C[NH3+])Cl
InChI String
InChI=1S/C20H26BClN6O9P/c1-2-32-10-4-3-9(22)13-11(5-23)35-21(14(10)13)36-16-12(6-33-38(29,30)31)34-20(17(16)37-21)28-8-27-15-18(24)25-7-26-19(15)28/h3-4,7-8,11-12,16-17,20,29-31,38H,2,5-6,23H2,1H3,(H2,24,25,26)/p+1/t11-,12-,16-,17-,20-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P9WFV1
Entrez Gene ID
NCBI Entrez Gene ID:
45424000
887040
ASD
Information of known allosteric effects of PDB entries
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