Browse entries in the PDBbind-CN Database
HEADER 5AGS_COMPLEX COMPND 5AGS_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 72 VAL ASP ILE GLU VAL PHE THR THR ARG PRO ASP THR LEU SEQRES 2 A 72 PHE GLY ALA THR TYR LEU VAL LEU ALA PRO GLU HIS ASP SEQRES 3 A 72 LEU VAL ASP GLU LEU VAL ALA ALA SER TRP PRO ALA GLY SEQRES 4 A 72 VAL ASN PRO LEU TRP THR TYR GLY GLY GLY THR PRO GLY SEQRES 5 A 72 GLU ALA ILE ALA ALA TYR ARG ARG ALA ILE ALA ALA LYS SEQRES 6 A 72 SER ASP LEU GLU ARG GLN GLU SEQRES 1 A 110 GLU LYS THR GLY VAL PHE LEU GLY SER TYR ALA ILE ASN SEQRES 2 A 110 PRO ALA ASN GLY GLU PRO VAL PRO ILE PHE ILE ALA ASP SEQRES 3 A 110 TYR VAL LEU ALA GLY TYR GLY THR GLY ALA ILE MET ALA SEQRES 4 A 110 VAL PRO GLY HIS ASP GLN ARG ASP TRP ASP PHE ALA ARG SEQRES 5 A 110 ALA PHE GLY LEU PRO ILE VAL GLU VAL ILE ALA GLY GLY SEQRES 6 A 110 ASN ILE SER GLU SER ALA TYR THR GLY ASP GLY ILE LEU SEQRES 7 A 110 VAL ASN SER ASP TYR LEU ASN GLY MET SER VAL PRO ALA SEQRES 8 A 110 ALA LYS ARG ALA ILE VAL ASP ARG LEU GLU SER ALA GLY SEQRES 9 A 110 ARG GLY ARG ALA ARG ILE HET UNN A 468 61 ATOM 1 N GLY A 313 -19.762 10.043 -3.453 1.00 17.58 N ATOM 2 CA GLY A 313 -18.788 10.378 -4.529 1.00 16.36 C ATOM 3 C GLY A 313 -18.392 11.841 -4.581 1.00 15.54 C ATOM 4 O GLY A 313 -18.484 12.565 -3.585 1.00 15.69 O ATOM 5 HN3 GLY A 313 -20.635 10.590 -3.595 1.00 0.00 H ATOM 6 HN2 GLY A 313 -19.350 10.280 -2.528 1.00 0.00 H ATOM 7 HN1 GLY A 313 -19.979 9.026 -3.487 1.00 0.00 H ATOM 8 N ALA A 314 -17.920 12.264 -5.752 1.00 14.07 N ATOM 9 CA ALA A 314 -17.435 13.614 -5.957 1.00 12.67 C ATOM 10 C ALA A 314 -17.598 13.998 -7.412 1.00 11.46 C ATOM 11 O ALA A 314 -17.553 13.146 -8.302 1.00 11.72 O ATOM 12 CB ALA A 314 -15.952 13.744 -5.551 1.00 13.26 C ATOM 13 H ALA A 314 -17.899 11.599 -6.551 1.00 0.00 H ATOM 14 N VAL A 315 -17.764 15.290 -7.655 1.00 10.20 N ATOM 15 CA VAL A 315 -17.562 15.826 -8.993 1.00 9.90 C ATOM 16 C VAL A 315 -16.255 16.603 -8.970 1.00 9.75 C ATOM 17 O VAL A 315 -15.915 17.230 -7.962 1.00 9.56 O ATOM 18 CB VAL A 315 -18.749 16.701 -9.474 1.00 10.12 C ATOM 19 CG1 VAL A 315 -19.947 15.819 -9.841 1.00 9.81 C ATOM 20 CG2 VAL A 315 -19.133 17.748 -8.409 1.00 10.63 C ATOM 21 H VAL A 315 -18.041 15.928 -6.882 1.00 0.00 H ATOM 22 N ALA A 316 -15.506 16.539 -10.064 1.00 10.48 N ATOM 23 CA ALA A 316 -14.227 17.244 -10.163 1.00 10.16 C ATOM 24 C ALA A 316 -14.042 17.788 -11.564 1.00 10.53 C ATOM 25 O ALA A 316 -14.497 17.172 -12.541 1.00 9.63 O ATOM 26 CB ALA A 316 -13.061 16.317 -9.811 1.00 10.87 C ATOM 27 H ALA A 316 -15.836 15.973 -10.872 1.00 0.00 H ATOM 28 N LEU A 317 -13.355 18.923 -11.664 1.00 10.45 N ATOM 29 CA LEU A 317 -13.014 19.521 -12.952 1.00 10.26 C ATOM 30 C LEU A 317 -11.620 19.153 -13.410 1.00 10.45 C ATOM 31 O LEU A 317 -10.679 19.140 -12.614 1.00 10.42 O ATOM 32 CB LEU A 317 -13.100 21.049 -12.886 1.00 11.52 C ATOM 33 CG LEU A 317 -14.452 21.638 -12.510 1.00 11.05 C ATOM 34 CD1 LEU A 317 -14.300 23.150 -12.455 1.00 12.98 C ATOM 35 CD2 LEU A 317 -15.589 21.214 -13.465 1.00 13.01 C ATOM 36 H LEU A 317 -13.050 19.402 -10.793 1.00 0.00 H ATOM 37 N PHE A 318 -11.512 18.854 -14.702 1.00 9.55 N ATOM 38 CA PHE A 318 -10.220 18.761 -15.382 1.00 10.33 C ATOM 39 C PHE A 318 -10.182 19.879 -16.415 1.00 11.45 C ATOM 40 O PHE A 318 -11.079 19.977 -17.255 1.00 11.93 O ATOM 41 CB PHE A 318 -10.106 17.423 -16.118 1.00 9.47 C ATOM 42 CG PHE A 318 -9.790 16.235 -15.230 1.00 9.49 C ATOM 43 CD1 PHE A 318 -10.728 15.762 -14.320 1.00 8.59 C ATOM 44 CD2 PHE A 318 -8.585 15.548 -15.369 1.00 10.61 C ATOM 45 CE1 PHE A 318 -10.458 14.643 -13.525 1.00 9.66 C ATOM 46 CE2 PHE A 318 -8.312 14.427 -14.575 1.00 10.62 C ATOM 47 CZ PHE A 318 -9.257 13.985 -13.644 1.00 9.93 C ATOM 48 H PHE A 318 -12.379 18.680 -15.249 1.00 0.00 H ATOM 49 N SER A 319 -9.149 20.717 -16.362 1.00 12.13 N ATOM 50 CA SER A 319 -8.988 21.806 -17.329 1.00 14.12 C ATOM 51 C SER A 319 -8.495 21.294 -18.677 1.00 14.78 C ATOM 52 O SER A 319 -7.671 20.416 -18.734 1.00 14.81 O ATOM 53 CB SER A 319 -7.992 22.828 -16.790 1.00 14.03 C ATOM 54 OG SER A 319 -8.554 23.576 -15.728 1.00 16.13 O ATOM 55 HG SER A 319 -9.357 24.056 -16.053 1.00 0.00 H ATOM 56 H SER A 319 -8.437 20.595 -15.614 1.00 0.00 H ATOM 57 N ALA A 320 -9.015 21.848 -19.770 1.00 16.77 N ATOM 58 CA ALA A 320 -8.395 21.615 -21.081 1.00 20.33 C ATOM 59 C ALA A 320 -6.935 22.136 -21.052 1.00 22.70 C ATOM 60 O ALA A 320 -6.669 23.208 -20.480 1.00 23.37 O ATOM 61 CB ALA A 320 -9.176 22.351 -22.144 1.00 20.62 C ATOM 62 H ALA A 320 -9.862 22.447 -19.696 1.00 0.00 H ATOM 63 N ARG A 321 -5.989 21.386 -21.631 1.00 24.70 N ATOM 64 CA ARG A 321 -4.601 21.857 -21.723 1.00 25.72 C ATOM 65 C ARG A 321 -4.516 23.050 -22.673 1.00 26.52 C ATOM 66 O ARG A 321 -3.828 24.042 -22.383 1.00 26.87 O ATOM 67 CB ARG A 321 -3.633 20.743 -22.156 1.00 25.82 C ATOM 68 CG ARG A 321 -2.157 21.177 -22.152 1.00 25.94 C ATOM 69 CD ARG A 321 -1.180 20.001 -22.161 1.00 25.87 C ATOM 70 NE ARG A 321 -0.892 19.501 -23.503 1.00 27.43 N ATOM 71 CZ ARG A 321 0.111 18.672 -23.783 1.00 27.02 C ATOM 72 NH1 ARG A 321 0.916 18.263 -22.815 1.00 27.56 N ATOM 73 NH2 ARG A 321 0.314 18.254 -25.027 1.00 27.10 N ATOM 74 HE ARG A 321 -1.505 19.810 -24.284 1.00 0.00 H ATOM 75 HH12 ARG A 321 1.701 17.615 -23.030 1.00 0.00 H ATOM 76 HH11 ARG A 321 0.764 18.589 -21.839 1.00 0.00 H ATOM 77 HH22 ARG A 321 1.100 17.606 -25.236 1.00 0.00 H ATOM 78 HH21 ARG A 321 -0.313 18.574 -25.792 1.00 0.00 H ATOM 79 H ARG A 321 -6.241 20.456 -22.022 1.00 0.00 H ATOM 80 N ALA A 322 -5.216 22.947 -23.802 1.00 27.63 N ATOM 81 CA ALA A 322 -5.305 24.033 -24.775 1.00 28.70 C ATOM 82 C ALA A 322 -6.619 24.791 -24.587 1.00 29.30 C ATOM 83 O ALA A 322 -7.689 24.184 -24.448 1.00 30.00 O ATOM 84 CB ALA A 322 -5.196 23.490 -26.192 1.00 28.93 C ATOM 85 H ALA A 322 -5.719 22.058 -23.998 1.00 0.00 H TER 86 ALA A 322 ATOM 87 N VAL A 330 -11.874 25.746 -21.067 1.00 21.70 N ATOM 88 CA VAL A 330 -12.896 24.702 -21.089 1.00 20.41 C ATOM 89 C VAL A 330 -12.616 23.698 -19.964 1.00 19.17 C ATOM 90 O VAL A 330 -11.502 23.185 -19.854 1.00 19.63 O ATOM 91 CB VAL A 330 -12.941 23.989 -22.480 1.00 21.36 C ATOM 92 CG1 VAL A 330 -13.844 22.765 -22.470 1.00 21.91 C ATOM 93 CG2 VAL A 330 -13.389 24.972 -23.565 1.00 22.57 C ATOM 94 HN3 VAL A 330 -10.938 25.316 -21.208 1.00 0.00 H ATOM 95 HN2 VAL A 330 -11.898 26.234 -20.149 1.00 0.00 H ATOM 96 HN1 VAL A 330 -12.061 26.429 -21.829 1.00 0.00 H ATOM 97 N ASP A 331 -13.615 23.445 -19.122 1.00 17.50 N ATOM 98 CA ASP A 331 -13.483 22.445 -18.048 1.00 16.95 C ATOM 99 C ASP A 331 -14.366 21.245 -18.307 1.00 16.06 C ATOM 100 O ASP A 331 -15.532 21.394 -18.676 1.00 16.69 O ATOM 101 CB ASP A 331 -13.864 23.035 -16.690 1.00 17.39 C ATOM 102 CG ASP A 331 -12.977 24.178 -16.287 1.00 18.86 C ATOM 103 OD1 ASP A 331 -11.738 24.048 -16.374 1.00 19.95 O ATOM 104 OD2 ASP A 331 -13.540 25.213 -15.889 1.00 23.33 O ATOM 105 H ASP A 331 -14.510 23.965 -19.224 1.00 0.00 H ATOM 106 N ILE A 332 -13.804 20.058 -18.092 1.00 13.84 N ATOM 107 CA ILE A 332 -14.559 18.820 -18.184 1.00 12.77 C ATOM 108 C ILE A 332 -14.870 18.389 -16.764 1.00 11.75 C ATOM 109 O ILE A 332 -13.966 18.143 -15.962 1.00 11.61 O ATOM 110 CB ILE A 332 -13.770 17.703 -18.908 1.00 12.65 C ATOM 111 CG1 ILE A 332 -13.392 18.131 -20.330 1.00 13.44 C ATOM 112 CG2 ILE A 332 -14.603 16.391 -18.935 1.00 14.10 C ATOM 113 CD1 ILE A 332 -12.227 17.357 -20.890 1.00 14.47 C ATOM 114 H ILE A 332 -12.793 20.015 -17.851 1.00 0.00 H ATOM 115 N GLU A 333 -16.158 18.318 -16.462 1.00 10.95 N ATOM 116 CA GLU A 333 -16.618 17.817 -15.172 1.00 10.44 C ATOM 117 C GLU A 333 -16.860 16.317 -15.216 1.00 9.92 C ATOM 118 O GLU A 333 -17.590 15.814 -16.077 1.00 9.64 O ATOM 119 CB GLU A 333 -17.892 18.551 -14.749 1.00 11.05 C ATOM 120 CG GLU A 333 -18.355 18.189 -13.340 1.00 13.02 C ATOM 121 CD GLU A 333 -19.677 18.810 -12.962 1.00 16.07 C ATOM 122 OE1 GLU A 333 -20.355 19.403 -13.831 1.00 20.03 O ATOM 123 OE2 GLU A 333 -20.059 18.670 -11.787 1.00 16.52 O ATOM 124 H GLU A 333 -16.860 18.628 -17.164 1.00 0.00 H ATOM 125 N VAL A 334 -16.214 15.614 -14.287 1.00 9.18 N ATOM 126 CA VAL A 334 -16.403 14.176 -14.130 1.00 9.47 C ATOM 127 C VAL A 334 -17.129 13.872 -12.832 1.00 9.12 C ATOM 128 O VAL A 334 -17.061 14.657 -11.881 1.00 9.31 O ATOM 129 CB VAL A 334 -15.059 13.383 -14.161 1.00 8.69 C ATOM 130 CG1 VAL A 334 -14.274 13.675 -15.458 1.00 9.65 C ATOM 131 CG2 VAL A 334 -14.189 13.596 -12.902 1.00 9.76 C ATOM 132 H VAL A 334 -15.553 16.107 -13.653 1.00 0.00 H ATOM 133 N PHE A 335 -17.870 12.767 -12.815 1.00 9.23 N ATOM 134 CA PHE A 335 -18.385 12.214 -11.568 1.00 9.72 C ATOM 135 C PHE A 335 -17.646 10.928 -11.224 1.00 8.92 C ATOM 136 O PHE A 335 -17.554 10.006 -12.051 1.00 9.13 O ATOM 137 CB PHE A 335 -19.895 11.940 -11.641 1.00 10.88 C ATOM 138 CG PHE A 335 -20.433 11.285 -10.396 1.00 11.75 C ATOM 139 CD1 PHE A 335 -20.529 12.008 -9.203 1.00 14.04 C ATOM 140 CD2 PHE A 335 -20.755 9.937 -10.390 1.00 14.34 C ATOM 141 CE1 PHE A 335 -20.990 11.400 -8.031 1.00 15.24 C ATOM 142 CE2 PHE A 335 -21.220 9.322 -9.227 1.00 15.45 C ATOM 143 CZ PHE A 335 -21.339 10.054 -8.052 1.00 14.57 C ATOM 144 H PHE A 335 -18.087 12.287 -13.712 1.00 0.00 H ATOM 145 N THR A 336 -17.133 10.866 -9.990 1.00 8.02 N ATOM 146 CA THR A 336 -16.436 9.651 -9.529 1.00 8.87 C ATOM 147 C THR A 336 -16.897 9.180 -8.148 1.00 9.44 C ATOM 148 O THR A 336 -17.139 9.986 -7.263 1.00 10.20 O ATOM 149 CB THR A 336 -14.883 9.809 -9.586 1.00 8.83 C ATOM 150 OG1 THR A 336 -14.263 8.570 -9.222 1.00 8.16 O ATOM 151 CG2 THR A 336 -14.384 10.915 -8.649 1.00 9.00 C ATOM 152 HG1 THR A 336 -14.547 7.862 -9.854 1.00 0.00 H ATOM 153 H THR A 336 -17.226 11.681 -9.351 1.00 0.00 H ATOM 154 N THR A 337 -16.998 7.868 -7.979 1.00 8.77 N ATOM 155 CA THR A 337 -17.188 7.276 -6.651 1.00 9.69 C ATOM 156 C THR A 337 -15.866 6.985 -5.941 1.00 9.06 C ATOM 157 O THR A 337 -15.870 6.559 -4.772 1.00 9.89 O ATOM 158 CB THR A 337 -18.011 5.977 -6.740 1.00 9.30 C ATOM 159 OG1 THR A 337 -17.279 5.015 -7.511 1.00 12.19 O ATOM 160 CG2 THR A 337 -19.377 6.243 -7.376 1.00 12.22 C ATOM 161 HG1 THR A 337 -17.120 5.374 -8.420 1.00 0.00 H ATOM 162 H THR A 337 -16.941 7.244 -8.809 1.00 0.00 H ATOM 163 N ARG A 338 -14.740 7.259 -6.613 1.00 7.99 N ATOM 164 CA ARG A 338 -13.405 6.972 -6.069 1.00 7.93 C ATOM 165 C ARG A 338 -12.477 8.183 -6.240 1.00 7.48 C ATOM 166 O ARG A 338 -11.445 8.104 -6.916 1.00 8.94 O ATOM 167 CB ARG A 338 -12.798 5.698 -6.690 1.00 7.13 C ATOM 168 CG ARG A 338 -13.577 4.403 -6.354 1.00 7.93 C ATOM 169 CD ARG A 338 -13.564 4.104 -4.839 1.00 8.88 C ATOM 170 NE ARG A 338 -12.179 4.003 -4.362 1.00 8.91 N ATOM 171 CZ ARG A 338 -11.400 2.919 -4.502 1.00 8.66 C ATOM 172 NH1 ARG A 338 -11.879 1.796 -5.047 1.00 9.99 N ATOM 173 NH2 ARG A 338 -10.143 2.934 -4.083 1.00 9.40 N ATOM 174 HE ARG A 338 -11.772 4.831 -3.881 1.00 0.00 H ATOM 175 HH12 ARG A 338 -11.264 0.964 -5.149 1.00 0.00 H ATOM 176 HH11 ARG A 338 -12.867 1.755 -5.369 1.00 0.00 H ATOM 177 HH22 ARG A 338 -9.547 2.089 -4.196 1.00 0.00 H ATOM 178 HH21 ARG A 338 -9.752 3.791 -3.641 1.00 0.00 H ATOM 179 H ARG A 338 -14.813 7.691 -7.556 1.00 0.00 H ATOM 180 N PRO A 339 -12.849 9.337 -5.648 1.00 7.96 N ATOM 181 CA PRO A 339 -11.991 10.513 -5.784 1.00 8.20 C ATOM 182 C PRO A 339 -10.616 10.287 -5.162 1.00 7.67 C ATOM 183 O PRO A 339 -9.653 10.932 -5.570 1.00 8.21 O ATOM 184 CB PRO A 339 -12.753 11.615 -5.038 1.00 8.38 C ATOM 185 CG PRO A 339 -13.638 10.880 -4.059 1.00 7.97 C ATOM 186 CD PRO A 339 -14.016 9.590 -4.774 1.00 8.21 C ATOM 187 N ASP A 340 -10.514 9.343 -4.222 1.00 7.80 N ATOM 188 CA ASP A 340 -9.218 8.967 -3.631 1.00 7.85 C ATOM 189 C ASP A 340 -8.176 8.513 -4.644 1.00 7.76 C ATOM 190 O ASP A 340 -6.999 8.558 -4.343 1.00 7.59 O ATOM 191 CB ASP A 340 -9.398 7.854 -2.603 1.00 8.02 C ATOM 192 CG ASP A 340 -10.063 6.602 -3.185 1.00 8.63 C ATOM 193 OD1 ASP A 340 -11.205 6.708 -3.659 1.00 8.53 O ATOM 194 OD2 ASP A 340 -9.448 5.520 -3.126 1.00 10.64 O ATOM 195 H ASP A 340 -11.376 8.859 -3.898 1.00 0.00 H ATOM 196 N THR A 341 -8.627 8.060 -5.824 1.00 7.42 N ATOM 197 CA THR A 341 -7.728 7.501 -6.848 1.00 7.71 C ATOM 198 C THR A 341 -7.270 8.521 -7.889 1.00 8.01 C ATOM 199 O THR A 341 -6.682 8.141 -8.921 1.00 8.05 O ATOM 200 CB THR A 341 -8.379 6.292 -7.594 1.00 7.03 C ATOM 201 OG1 THR A 341 -9.485 6.765 -8.369 1.00 6.83 O ATOM 202 CG2 THR A 341 -8.842 5.202 -6.618 1.00 8.86 C ATOM 203 HG1 THR A 341 -10.151 7.186 -7.769 1.00 0.00 H ATOM 204 H THR A 341 -9.647 8.105 -6.022 1.00 0.00 H ATOM 205 N LEU A 342 -7.500 9.803 -7.616 1.00 7.50 N ATOM 206 CA LEU A 342 -7.205 10.883 -8.572 1.00 7.60 C ATOM 207 C LEU A 342 -5.798 10.816 -9.178 1.00 7.48 C ATOM 208 O LEU A 342 -5.632 11.048 -10.377 1.00 7.07 O ATOM 209 CB LEU A 342 -7.450 12.246 -7.920 1.00 7.69 C ATOM 210 CG LEU A 342 -7.305 13.524 -8.750 1.00 8.49 C ATOM 211 CD1 LEU A 342 -8.048 13.455 -10.095 1.00 7.91 C ATOM 212 CD2 LEU A 342 -7.826 14.688 -7.927 1.00 5.62 C ATOM 213 H LEU A 342 -7.904 10.052 -6.691 1.00 0.00 H ATOM 214 N PHE A 343 -4.787 10.489 -8.366 1.00 7.04 N ATOM 215 CA PHE A 343 -3.409 10.455 -8.874 1.00 7.58 C ATOM 216 C PHE A 343 -3.170 9.287 -9.845 1.00 7.88 C ATOM 217 O PHE A 343 -2.114 9.205 -10.483 1.00 9.02 O ATOM 218 CB PHE A 343 -2.377 10.405 -7.739 1.00 7.58 C ATOM 219 CG PHE A 343 -2.218 11.702 -6.975 1.00 8.12 C ATOM 220 CD1 PHE A 343 -3.086 12.040 -5.922 1.00 8.65 C ATOM 221 CD2 PHE A 343 -1.163 12.561 -7.284 1.00 8.54 C ATOM 222 CE1 PHE A 343 -2.918 13.228 -5.205 1.00 10.09 C ATOM 223 CE2 PHE A 343 -0.973 13.759 -6.566 1.00 9.94 C ATOM 224 CZ PHE A 343 -1.859 14.100 -5.530 1.00 8.85 C ATOM 225 H PHE A 343 -4.977 10.258 -7.370 1.00 0.00 H ATOM 226 N GLY A 344 -4.141 8.378 -9.919 1.00 8.04 N ATOM 227 CA GLY A 344 -4.115 7.282 -10.887 1.00 7.89 C ATOM 228 C GLY A 344 -5.008 7.452 -12.108 1.00 8.39 C ATOM 229 O GLY A 344 -5.173 6.503 -12.890 1.00 8.51 O ATOM 230 H GLY A 344 -4.946 8.450 -9.265 1.00 0.00 H ATOM 231 N ALA A 345 -5.578 8.649 -12.285 1.00 7.64 N ATOM 232 CA ALA A 345 -6.395 8.940 -13.472 1.00 7.38 C ATOM 233 C ALA A 345 -5.464 9.264 -14.624 1.00 8.02 C ATOM 234 O ALA A 345 -4.825 10.307 -14.628 1.00 9.33 O ATOM 235 CB ALA A 345 -7.355 10.102 -13.209 1.00 7.91 C ATOM 236 H ALA A 345 -5.440 9.389 -11.568 1.00 0.00 H ATOM 237 N THR A 346 -5.400 8.360 -15.597 1.00 8.44 N ATOM 238 CA THR A 346 -4.430 8.473 -16.685 1.00 7.95 C ATOM 239 C THR A 346 -5.029 8.918 -18.021 1.00 8.36 C ATOM 240 O THR A 346 -4.287 9.179 -18.975 1.00 8.47 O ATOM 241 CB THR A 346 -3.640 7.155 -16.885 1.00 8.60 C ATOM 242 OG1 THR A 346 -4.543 6.105 -17.225 1.00 8.93 O ATOM 243 CG2 THR A 346 -2.864 6.776 -15.607 1.00 10.51 C ATOM 244 HG1 THR A 346 -4.036 5.264 -17.352 1.00 0.00 H ATOM 245 H THR A 346 -6.056 7.553 -15.584 1.00 0.00 H ATOM 246 N TYR A 347 -6.359 8.974 -18.108 1.00 8.01 N ATOM 247 CA TYR A 347 -7.036 9.505 -19.302 1.00 8.10 C ATOM 248 C TYR A 347 -8.468 9.888 -18.908 1.00 7.93 C ATOM 249 O TYR A 347 -8.908 9.560 -17.799 1.00 8.18 O ATOM 250 CB TYR A 347 -6.962 8.519 -20.516 1.00 8.52 C ATOM 251 CG TYR A 347 -7.621 7.169 -20.312 1.00 7.96 C ATOM 252 CD1 TYR A 347 -6.983 6.164 -19.580 1.00 7.51 C ATOM 253 CD2 TYR A 347 -8.877 6.892 -20.847 1.00 7.08 C ATOM 254 CE1 TYR A 347 -7.586 4.918 -19.382 1.00 8.09 C ATOM 255 CE2 TYR A 347 -9.483 5.633 -20.649 1.00 7.48 C ATOM 256 CZ TYR A 347 -8.831 4.670 -19.922 1.00 9.08 C ATOM 257 OH TYR A 347 -9.461 3.444 -19.705 1.00 10.71 O ATOM 258 HH TYR A 347 -8.868 2.860 -19.168 1.00 0.00 H ATOM 259 H TYR A 347 -6.933 8.633 -17.311 1.00 0.00 H ATOM 260 N LEU A 348 -9.158 10.623 -19.774 1.00 8.09 N ATOM 261 CA LEU A 348 -10.571 10.969 -19.565 1.00 7.98 C ATOM 262 C LEU A 348 -11.386 10.337 -20.672 1.00 8.35 C ATOM 263 O LEU A 348 -10.886 10.172 -21.798 1.00 8.20 O ATOM 264 CB LEU A 348 -10.829 12.486 -19.567 1.00 8.94 C ATOM 265 CG LEU A 348 -10.161 13.365 -18.517 1.00 8.78 C ATOM 266 CD1 LEU A 348 -10.688 14.781 -18.684 1.00 11.68 C ATOM 267 CD2 LEU A 348 -10.419 12.835 -17.094 1.00 11.89 C ATOM 268 H LEU A 348 -8.680 10.966 -20.632 1.00 0.00 H ATOM 269 N VAL A 349 -12.629 9.986 -20.351 1.00 8.04 N ATOM 270 CA VAL A 349 -13.564 9.435 -21.326 1.00 8.75 C ATOM 271 C VAL A 349 -14.892 10.189 -21.269 1.00 9.16 C ATOM 272 O VAL A 349 -15.505 10.317 -20.209 1.00 8.76 O ATOM 273 CB VAL A 349 -13.769 7.926 -21.158 1.00 8.38 C ATOM 274 CG1 VAL A 349 -14.583 7.393 -22.334 1.00 9.15 C ATOM 275 CG2 VAL A 349 -12.437 7.188 -21.085 1.00 9.35 C ATOM 276 H VAL A 349 -12.946 10.109 -19.368 1.00 0.00 H ATOM 277 N LEU A 350 -15.304 10.718 -22.418 1.00 9.57 N ATOM 278 CA LEU A 350 -16.597 11.397 -22.547 1.00 10.48 C ATOM 279 C LEU A 350 -17.526 10.483 -23.317 1.00 10.17 C ATOM 280 O LEU A 350 -17.072 9.727 -24.177 1.00 10.33 O ATOM 281 CB LEU A 350 -16.456 12.727 -23.308 1.00 10.55 C ATOM 282 CG LEU A 350 -15.832 13.926 -22.575 1.00 12.44 C ATOM 283 CD1 LEU A 350 -14.559 13.604 -21.809 1.00 15.50 C ATOM 284 CD2 LEU A 350 -15.580 15.039 -23.591 1.00 14.99 C ATOM 285 H LEU A 350 -14.688 10.648 -23.253 1.00 0.00 H ATOM 286 N ALA A 351 -18.817 10.546 -23.008 1.00 10.30 N ATOM 287 CA ALA A 351 -19.816 9.881 -23.846 1.00 10.81 C ATOM 288 C ALA A 351 -19.682 10.417 -25.269 1.00 11.02 C ATOM 289 O ALA A 351 -19.361 11.587 -25.460 1.00 11.45 O ATOM 290 CB ALA A 351 -21.181 10.155 -23.331 1.00 10.95 C ATOM 291 H ALA A 351 -19.120 11.072 -22.164 1.00 0.00 H ATOM 292 N PRO A 352 -19.951 9.565 -26.280 1.00 11.79 N ATOM 293 CA PRO A 352 -19.772 10.036 -27.658 1.00 12.53 C ATOM 294 C PRO A 352 -20.622 11.261 -28.025 1.00 12.73 C ATOM 295 O PRO A 352 -20.234 12.021 -28.908 1.00 12.79 O ATOM 296 CB PRO A 352 -20.157 8.804 -28.497 1.00 12.46 C ATOM 297 CG PRO A 352 -19.821 7.634 -27.590 1.00 12.38 C ATOM 298 CD PRO A 352 -20.235 8.118 -26.222 1.00 12.07 C ATOM 299 N GLU A 353 -21.736 11.435 -27.309 1.00 12.80 N ATOM 300 CA GLU A 353 -22.702 12.503 -27.533 1.00 13.23 C ATOM 301 C GLU A 353 -22.403 13.780 -26.727 1.00 13.73 C ATOM 302 O GLU A 353 -23.035 14.816 -26.946 1.00 13.86 O ATOM 303 CB GLU A 353 -24.111 11.988 -27.202 1.00 13.06 C ATOM 304 CG GLU A 353 -24.572 10.764 -28.019 1.00 11.85 C ATOM 305 CD GLU A 353 -24.005 9.429 -27.518 1.00 10.56 C ATOM 306 OE1 GLU A 353 -23.531 9.355 -26.362 1.00 6.56 O ATOM 307 OE2 GLU A 353 -24.046 8.434 -28.284 1.00 11.68 O ATOM 308 H GLU A 353 -21.927 10.762 -26.539 1.00 0.00 H ATOM 309 N HIS A 354 -21.443 13.698 -25.803 1.00 14.07 N ATOM 310 CA HIS A 354 -21.140 14.787 -24.863 1.00 14.88 C ATOM 311 C HIS A 354 -20.978 16.108 -25.630 1.00 15.32 C ATOM 312 O HIS A 354 -20.307 16.151 -26.663 1.00 15.01 O ATOM 313 CB HIS A 354 -19.874 14.439 -24.066 1.00 14.62 C ATOM 314 CG HIS A 354 -19.564 15.390 -22.950 1.00 14.72 C ATOM 315 ND1 HIS A 354 -19.577 15.017 -21.621 1.00 16.80 N ATOM 316 CD2 HIS A 354 -19.225 16.699 -22.969 1.00 13.81 C ATOM 317 CE1 HIS A 354 -19.252 16.060 -20.874 1.00 12.90 C ATOM 318 NE2 HIS A 354 -19.025 17.088 -21.669 1.00 16.17 N ATOM 319 H HIS A 354 -20.884 12.823 -25.745 1.00 0.00 H ATOM 320 N ASP A 355 -21.597 17.172 -25.122 1.00 16.79 N ATOM 321 CA ASP A 355 -21.625 18.498 -25.754 1.00 17.15 C ATOM 322 C ASP A 355 -20.251 19.111 -26.007 1.00 17.31 C ATOM 323 O ASP A 355 -20.093 19.975 -26.861 1.00 18.03 O ATOM 324 CB ASP A 355 -22.410 19.466 -24.872 1.00 17.58 C ATOM 325 CG ASP A 355 -23.894 19.154 -24.834 1.00 18.58 C ATOM 326 OD1 ASP A 355 -24.436 18.714 -25.868 1.00 20.51 O ATOM 327 OD2 ASP A 355 -24.516 19.366 -23.773 1.00 21.47 O ATOM 328 H ASP A 355 -22.095 17.056 -24.216 1.00 0.00 H ATOM 329 N LEU A 356 -19.267 18.710 -25.199 1.00 16.40 N ATOM 330 CA LEU A 356 -17.915 19.276 -25.309 1.00 16.07 C ATOM 331 C LEU A 356 -17.028 18.606 -26.354 1.00 15.30 C ATOM 332 O LEU A 356 -15.976 19.134 -26.695 1.00 15.86 O ATOM 333 CB LEU A 356 -17.185 19.305 -23.947 1.00 16.21 C ATOM 334 CG LEU A 356 -17.637 20.313 -22.874 1.00 18.12 C ATOM 335 CD1 LEU A 356 -16.719 20.206 -21.665 1.00 19.18 C ATOM 336 CD2 LEU A 356 -17.672 21.748 -23.396 1.00 20.22 C ATOM 337 H LEU A 356 -19.460 17.985 -24.479 1.00 0.00 H ATOM 338 N VAL A 357 -17.453 17.456 -26.876 1.00 14.87 N ATOM 339 CA VAL A 357 -16.613 16.702 -27.801 1.00 15.27 C ATOM 340 C VAL A 357 -16.199 17.536 -29.022 1.00 15.59 C ATOM 341 O VAL A 357 -15.006 17.640 -29.329 1.00 15.85 O ATOM 342 CB VAL A 357 -17.273 15.364 -28.230 1.00 14.64 C ATOM 343 CG1 VAL A 357 -16.458 14.680 -29.324 1.00 15.08 C ATOM 344 CG2 VAL A 357 -17.425 14.444 -27.025 1.00 15.26 C ATOM 345 H VAL A 357 -18.393 17.092 -26.622 1.00 0.00 H ATOM 346 N ASP A 358 -17.171 18.152 -29.691 1.00 16.29 N ATOM 347 CA ASP A 358 -16.864 18.869 -30.933 1.00 18.06 C ATOM 348 C ASP A 358 -15.866 20.010 -30.688 1.00 18.77 C ATOM 349 O ASP A 358 -14.999 20.282 -31.521 1.00 20.34 O ATOM 350 CB ASP A 358 -18.143 19.365 -31.605 1.00 17.28 C ATOM 351 CG ASP A 358 -18.973 18.230 -32.198 1.00 18.72 C ATOM 352 OD1 ASP A 358 -18.431 17.110 -32.352 1.00 19.51 O ATOM 353 OD2 ASP A 358 -20.165 18.450 -32.506 1.00 21.09 O ATOM 354 H ASP A 358 -18.147 18.125 -29.333 1.00 0.00 H ATOM 355 N GLU A 359 -15.991 20.630 -29.517 1.00 19.98 N ATOM 356 CA GLU A 359 -15.146 21.729 -29.037 1.00 20.94 C ATOM 357 C GLU A 359 -13.706 21.284 -28.754 1.00 20.43 C ATOM 358 O GLU A 359 -12.751 22.054 -28.929 1.00 20.70 O ATOM 359 CB GLU A 359 -15.780 22.253 -27.744 1.00 21.31 C ATOM 360 CG GLU A 359 -15.343 23.598 -27.239 1.00 26.04 C ATOM 361 CD GLU A 359 -16.394 24.194 -26.316 1.00 29.66 C ATOM 362 OE1 GLU A 359 -17.571 24.287 -26.728 1.00 32.70 O ATOM 363 OE2 GLU A 359 -16.057 24.555 -25.176 1.00 32.69 O ATOM 364 H GLU A 359 -16.754 20.307 -28.888 1.00 0.00 H ATOM 365 N LEU A 360 -13.558 20.041 -28.304 1.00 19.33 N ATOM 366 CA LEU A 360 -12.268 19.534 -27.855 1.00 19.30 C ATOM 367 C LEU A 360 -11.497 18.806 -28.952 1.00 18.80 C ATOM 368 O LEU A 360 -10.319 18.509 -28.782 1.00 19.57 O ATOM 369 CB LEU A 360 -12.444 18.607 -26.644 1.00 18.68 C ATOM 370 CG LEU A 360 -12.920 19.227 -25.333 1.00 20.50 C ATOM 371 CD1 LEU A 360 -13.407 18.126 -24.410 1.00 20.87 C ATOM 372 CD2 LEU A 360 -11.826 20.045 -24.669 1.00 20.72 C ATOM 373 H LEU A 360 -14.387 19.413 -28.272 1.00 0.00 H ATOM 374 N VAL A 361 -12.162 18.527 -30.071 1.00 18.66 N ATOM 375 CA VAL A 361 -11.553 17.770 -31.166 1.00 18.72 C ATOM 376 C VAL A 361 -10.435 18.595 -31.816 1.00 18.42 C ATOM 377 O VAL A 361 -10.680 19.721 -32.274 1.00 18.25 O ATOM 378 CB VAL A 361 -12.617 17.359 -32.218 1.00 18.94 C ATOM 379 CG1 VAL A 361 -11.964 16.880 -33.514 1.00 19.95 C ATOM 380 CG2 VAL A 361 -13.517 16.267 -31.658 1.00 20.32 C ATOM 381 H VAL A 361 -13.143 18.857 -30.170 1.00 0.00 H ATOM 382 N ALA A 362 -9.225 18.036 -31.850 1.00 17.48 N ATOM 383 CA ALA A 362 -8.080 18.696 -32.484 1.00 17.43 C ATOM 384 C ALA A 362 -8.192 18.650 -34.009 1.00 17.65 C ATOM 385 O ALA A 362 -8.891 17.792 -34.570 1.00 17.26 O ATOM 386 CB ALA A 362 -6.756 18.068 -32.022 1.00 17.17 C ATOM 387 H ALA A 362 -9.089 17.102 -31.413 1.00 0.00 H ATOM 388 N ALA A 363 -7.516 19.590 -34.671 1.00 17.82 N ATOM 389 CA ALA A 363 -7.499 19.648 -36.136 1.00 18.01 C ATOM 390 C ALA A 363 -6.702 18.506 -36.769 1.00 17.97 C ATOM 391 O ALA A 363 -7.005 18.074 -37.884 1.00 18.95 O ATOM 392 CB ALA A 363 -6.947 21.008 -36.606 1.00 18.29 C ATOM 393 H ALA A 363 -6.985 20.303 -34.132 1.00 0.00 H ATOM 394 N SER A 364 -5.687 18.024 -36.051 1.00 17.72 N ATOM 395 CA SER A 364 -4.783 16.987 -36.551 1.00 17.82 C ATOM 396 C SER A 364 -4.365 16.039 -35.435 1.00 17.55 C ATOM 397 O SER A 364 -4.462 16.386 -34.250 1.00 17.88 O ATOM 398 CB SER A 364 -3.528 17.628 -37.156 1.00 17.95 C ATOM 399 OG SER A 364 -3.854 18.479 -38.237 1.00 18.83 O ATOM 400 HG SER A 364 -4.311 17.955 -38.942 1.00 0.00 H ATOM 401 H SER A 364 -5.531 18.401 -35.094 1.00 0.00 H ATOM 402 N TRP A 365 -3.889 14.854 -35.809 1.00 17.21 N ATOM 403 CA TRP A 365 -3.316 13.920 -34.851 1.00 17.28 C ATOM 404 C TRP A 365 -1.944 14.409 -34.430 1.00 18.42 C ATOM 405 O TRP A 365 -1.226 14.988 -35.256 1.00 18.68 O ATOM 406 CB TRP A 365 -3.160 12.530 -35.457 1.00 17.48 C ATOM 407 CG TRP A 365 -4.444 11.881 -35.808 1.00 14.63 C ATOM 408 CD1 TRP A 365 -4.843 11.497 -37.054 1.00 14.47 C ATOM 409 CD2 TRP A 365 -5.517 11.524 -34.914 1.00 12.83 C ATOM 410 NE1 TRP A 365 -6.090 10.931 -37.003 1.00 12.94 N ATOM 411 CE2 TRP A 365 -6.532 10.939 -35.705 1.00 13.09 C ATOM 412 CE3 TRP A 365 -5.715 11.642 -33.525 1.00 13.28 C ATOM 413 CZ2 TRP A 365 -7.724 10.464 -35.167 1.00 12.77 C ATOM 414 CZ3 TRP A 365 -6.917 11.173 -32.984 1.00 11.38 C ATOM 415 CH2 TRP A 365 -7.902 10.584 -33.808 1.00 11.83 C ATOM 416 HE1 TRP A 365 -6.616 10.556 -37.818 1.00 0.00 H ATOM 417 H TRP A 365 -3.927 14.588 -36.814 1.00 0.00 H ATOM 418 N PRO A 366 -1.553 14.143 -33.166 1.00 19.14 N ATOM 419 CA PRO A 366 -0.158 14.372 -32.797 1.00 19.27 C ATOM 420 C PRO A 366 0.775 13.462 -33.587 1.00 19.44 C ATOM 421 O PRO A 366 0.408 12.338 -33.940 1.00 18.71 O ATOM 422 CB PRO A 366 -0.106 13.970 -31.311 1.00 19.71 C ATOM 423 CG PRO A 366 -1.529 13.888 -30.859 1.00 19.42 C ATOM 424 CD PRO A 366 -2.302 13.484 -32.077 1.00 19.14 C ATOM 425 N ALA A 367 1.987 13.934 -33.866 1.00 19.83 N ATOM 426 CA ALA A 367 2.987 13.065 -34.473 1.00 20.45 C ATOM 427 C ALA A 367 3.229 11.841 -33.592 1.00 20.58 C ATOM 428 O ALA A 367 3.334 11.960 -32.372 1.00 21.79 O ATOM 429 CB ALA A 367 4.296 13.826 -34.701 1.00 20.47 C ATOM 430 H ALA A 367 2.221 14.924 -33.651 1.00 0.00 H ATOM 431 N GLY A 368 3.295 10.673 -34.217 1.00 21.19 N ATOM 432 CA GLY A 368 3.573 9.424 -33.504 1.00 20.46 C ATOM 433 C GLY A 368 2.393 8.808 -32.765 1.00 19.79 C ATOM 434 O GLY A 368 2.567 7.840 -32.024 1.00 20.65 O ATOM 435 H GLY A 368 3.145 10.643 -35.246 1.00 0.00 H ATOM 436 N VAL A 369 1.194 9.346 -32.975 1.00 18.78 N ATOM 437 CA VAL A 369 -0.014 8.778 -32.355 1.00 17.63 C ATOM 438 C VAL A 369 -0.131 7.261 -32.579 1.00 17.51 C ATOM 439 O VAL A 369 0.159 6.748 -33.675 1.00 17.57 O ATOM 440 CB VAL A 369 -1.301 9.521 -32.830 1.00 17.43 C ATOM 441 CG1 VAL A 369 -1.601 9.240 -34.309 1.00 17.12 C ATOM 442 CG2 VAL A 369 -2.503 9.150 -31.942 1.00 16.99 C ATOM 443 H VAL A 369 1.109 10.182 -33.588 1.00 0.00 H ATOM 444 N ASN A 370 -0.539 6.544 -31.529 1.00 16.65 N ATOM 445 CA ASN A 370 -0.850 5.117 -31.628 1.00 16.34 C ATOM 446 C ASN A 370 -2.003 4.942 -32.610 1.00 16.19 C ATOM 447 O ASN A 370 -3.067 5.516 -32.407 1.00 15.25 O ATOM 448 CB ASN A 370 -1.252 4.577 -30.243 1.00 16.09 C ATOM 449 CG ASN A 370 -1.315 3.049 -30.180 1.00 17.36 C ATOM 450 OD1 ASN A 370 -1.625 2.363 -31.160 1.00 16.66 O ATOM 451 ND2 ASN A 370 -1.038 2.511 -29.000 1.00 17.97 N ATOM 452 HD22 ASN A 370 -0.781 3.121 -28.198 1.00 0.00 H ATOM 453 HD21 ASN A 370 -1.078 1.479 -28.877 1.00 0.00 H ATOM 454 H ASN A 370 -0.639 7.016 -30.608 1.00 0.00 H ATOM 455 N PRO A 371 -1.798 4.164 -33.690 1.00 15.90 N ATOM 456 CA PRO A 371 -2.888 3.938 -34.655 1.00 15.95 C ATOM 457 C PRO A 371 -4.152 3.341 -34.039 1.00 15.52 C ATOM 458 O PRO A 371 -5.245 3.533 -34.581 1.00 15.50 O ATOM 459 CB PRO A 371 -2.269 2.971 -35.679 1.00 16.54 C ATOM 460 CG PRO A 371 -0.798 3.114 -35.509 1.00 17.68 C ATOM 461 CD PRO A 371 -0.557 3.459 -34.075 1.00 16.13 C ATOM 462 N LEU A 372 -4.016 2.641 -32.917 1.00 14.32 N ATOM 463 CA LEU A 372 -5.194 2.081 -32.239 1.00 14.14 C ATOM 464 C LEU A 372 -6.145 3.162 -31.748 1.00 13.58 C ATOM 465 O LEU A 372 -7.319 2.892 -31.515 1.00 13.40 O ATOM 466 CB LEU A 372 -4.782 1.198 -31.051 1.00 14.30 C ATOM 467 CG LEU A 372 -4.107 -0.132 -31.383 1.00 15.03 C ATOM 468 CD1 LEU A 372 -3.611 -0.792 -30.105 1.00 17.65 C ATOM 469 CD2 LEU A 372 -5.059 -1.043 -32.155 1.00 17.62 C ATOM 470 H LEU A 372 -3.069 2.488 -32.516 1.00 0.00 H ATOM 471 N TRP A 373 -5.630 4.376 -31.580 1.00 12.41 N ATOM 472 CA TRP A 373 -6.405 5.458 -30.994 1.00 11.76 C ATOM 473 C TRP A 373 -7.202 6.250 -32.023 1.00 11.62 C ATOM 474 O TRP A 373 -8.014 7.081 -31.643 1.00 11.51 O ATOM 475 CB TRP A 373 -5.468 6.457 -30.309 1.00 11.49 C ATOM 476 CG TRP A 373 -4.717 5.961 -29.101 1.00 10.68 C ATOM 477 CD1 TRP A 373 -4.484 4.659 -28.738 1.00 10.85 C ATOM 478 CD2 TRP A 373 -4.044 6.775 -28.136 1.00 10.55 C ATOM 479 NE1 TRP A 373 -3.722 4.618 -27.588 1.00 11.77 N ATOM 480 CE2 TRP A 373 -3.437 5.899 -27.200 1.00 10.31 C ATOM 481 CE3 TRP A 373 -3.905 8.161 -27.962 1.00 11.04 C ATOM 482 CZ2 TRP A 373 -2.700 6.371 -26.101 1.00 11.89 C ATOM 483 CZ3 TRP A 373 -3.164 8.635 -26.869 1.00 10.46 C ATOM 484 CH2 TRP A 373 -2.580 7.737 -25.952 1.00 10.62 C ATOM 485 HE1 TRP A 373 -3.415 3.755 -27.097 1.00 0.00 H ATOM 486 H TRP A 373 -4.649 4.556 -31.875 1.00 0.00 H ATOM 487 N THR A 374 -6.937 6.034 -33.316 1.00 11.75 N ATOM 488 CA THR A 374 -7.441 6.951 -34.354 1.00 11.47 C ATOM 489 C THR A 374 -8.660 6.476 -35.146 1.00 11.15 C ATOM 490 O THR A 374 -9.158 7.220 -36.008 1.00 10.51 O ATOM 491 CB THR A 374 -6.353 7.255 -35.407 1.00 11.41 C ATOM 492 OG1 THR A 374 -6.067 6.055 -36.142 1.00 13.80 O ATOM 493 CG2 THR A 374 -5.094 7.802 -34.754 1.00 12.45 C ATOM 494 HG1 THR A 374 -5.370 6.243 -36.819 1.00 0.00 H ATOM 495 H THR A 374 -6.368 5.208 -33.593 1.00 0.00 H ATOM 496 N TYR A 375 -9.112 5.250 -34.868 1.00 11.09 N ATOM 497 CA TYR A 375 -10.250 4.629 -35.557 1.00 11.69 C ATOM 498 C TYR A 375 -10.026 4.568 -37.076 1.00 11.66 C ATOM 499 O TYR A 375 -10.990 4.510 -37.848 1.00 11.55 O ATOM 500 CB TYR A 375 -11.566 5.370 -35.214 1.00 12.03 C ATOM 501 CG TYR A 375 -12.786 4.479 -35.105 1.00 10.89 C ATOM 502 CD1 TYR A 375 -12.881 3.502 -34.109 1.00 10.91 C ATOM 503 CD2 TYR A 375 -13.859 4.633 -35.977 1.00 9.93 C ATOM 504 CE1 TYR A 375 -13.990 2.678 -34.021 1.00 10.46 C ATOM 505 CE2 TYR A 375 -14.988 3.829 -35.884 1.00 10.03 C ATOM 506 CZ TYR A 375 -15.052 2.859 -34.894 1.00 10.04 C ATOM 507 OH TYR A 375 -16.172 2.057 -34.785 1.00 11.55 O ATOM 508 HH TYR A 375 -16.052 1.425 -34.032 1.00 0.00 H ATOM 509 H TYR A 375 -8.632 4.706 -34.123 1.00 0.00 H ATOM 510 N GLY A 376 -8.761 4.581 -37.493 1.00 12.15 N ATOM 511 CA GLY A 376 -8.398 4.647 -38.914 1.00 12.66 C ATOM 512 C GLY A 376 -8.796 5.931 -39.639 1.00 13.88 C ATOM 513 O GLY A 376 -8.799 5.974 -40.876 1.00 14.88 O ATOM 514 H GLY A 376 -8.001 4.543 -36.784 1.00 0.00 H ATOM 515 N GLY A 377 -9.129 6.981 -38.890 1.00 13.38 N ATOM 516 CA GLY A 377 -9.504 8.273 -39.483 1.00 13.78 C ATOM 517 C GLY A 377 -8.302 9.166 -39.740 1.00 14.25 C ATOM 518 O GLY A 377 -7.355 9.181 -38.955 1.00 14.34 O ATOM 519 H GLY A 377 -9.124 6.884 -37.855 1.00 0.00 H ATOM 520 N GLY A 378 -8.337 9.926 -40.835 1.00 14.37 N ATOM 521 CA GLY A 378 -7.197 10.775 -41.202 1.00 14.55 C ATOM 522 C GLY A 378 -7.016 11.969 -40.290 1.00 14.46 C ATOM 523 O GLY A 378 -5.898 12.462 -40.129 1.00 14.52 O ATOM 524 H GLY A 378 -9.184 9.917 -41.438 1.00 0.00 H ATOM 525 N THR A 379 -8.119 12.429 -39.706 1.00 13.84 N ATOM 526 CA THR A 379 -8.119 13.526 -38.726 1.00 14.25 C ATOM 527 C THR A 379 -9.008 13.129 -37.557 1.00 13.82 C ATOM 528 O THR A 379 -9.876 12.266 -37.713 1.00 13.50 O ATOM 529 CB THR A 379 -8.673 14.855 -39.300 1.00 14.85 C ATOM 530 OG1 THR A 379 -10.032 14.677 -39.712 1.00 15.79 O ATOM 531 CG2 THR A 379 -7.816 15.365 -40.476 1.00 16.41 C ATOM 532 HG1 THR A 379 -10.379 15.529 -40.077 1.00 0.00 H ATOM 533 H THR A 379 -9.028 11.990 -39.955 1.00 0.00 H ATOM 534 N PRO A 380 -8.816 13.763 -36.388 1.00 13.28 N ATOM 535 CA PRO A 380 -9.728 13.490 -35.267 1.00 13.20 C ATOM 536 C PRO A 380 -11.217 13.709 -35.586 1.00 13.03 C ATOM 537 O PRO A 380 -12.061 12.881 -35.220 1.00 13.38 O ATOM 538 CB PRO A 380 -9.231 14.455 -34.184 1.00 13.40 C ATOM 539 CG PRO A 380 -7.763 14.543 -34.435 1.00 13.18 C ATOM 540 CD PRO A 380 -7.630 14.533 -35.948 1.00 13.38 C ATOM 541 N GLY A 381 -11.544 14.786 -36.298 1.00 12.92 N ATOM 542 CA GLY A 381 -12.942 15.075 -36.615 1.00 11.89 C ATOM 543 C GLY A 381 -13.568 14.006 -37.502 1.00 11.75 C ATOM 544 O GLY A 381 -14.713 13.619 -37.300 1.00 12.30 O ATOM 545 H GLY A 381 -10.797 15.428 -36.632 1.00 0.00 H ATOM 546 N GLU A 382 -12.805 13.524 -38.482 1.00 11.93 N ATOM 547 CA GLU A 382 -13.269 12.419 -39.320 1.00 11.61 C ATOM 548 C GLU A 382 -13.461 11.124 -38.508 1.00 10.80 C ATOM 549 O GLU A 382 -14.426 10.384 -38.723 1.00 11.36 O ATOM 550 CB GLU A 382 -12.305 12.174 -40.479 1.00 12.51 C ATOM 551 CG GLU A 382 -12.346 13.251 -41.568 1.00 15.23 C ATOM 552 CD GLU A 382 -11.235 13.040 -42.578 1.00 19.26 C ATOM 553 OE1 GLU A 382 -10.054 13.150 -42.197 1.00 22.41 O ATOM 554 OE2 GLU A 382 -11.543 12.735 -43.751 1.00 24.55 O ATOM 555 H GLU A 382 -11.867 13.939 -38.653 1.00 0.00 H ATOM 556 N ALA A 383 -12.528 10.848 -37.602 1.00 10.74 N ATOM 557 CA ALA A 383 -12.602 9.630 -36.776 1.00 10.33 C ATOM 558 C ALA A 383 -13.794 9.663 -35.824 1.00 10.85 C ATOM 559 O ALA A 383 -14.470 8.646 -35.643 1.00 10.72 O ATOM 560 CB ALA A 383 -11.314 9.450 -36.005 1.00 10.28 C ATOM 561 H ALA A 383 -11.731 11.504 -37.474 1.00 0.00 H ATOM 562 N ILE A 384 -14.052 10.829 -35.231 1.00 10.95 N ATOM 563 CA ILE A 384 -15.192 10.998 -34.330 1.00 11.50 C ATOM 564 C ILE A 384 -16.541 10.847 -35.070 1.00 10.48 C ATOM 565 O ILE A 384 -17.450 10.184 -34.578 1.00 10.79 O ATOM 566 CB ILE A 384 -15.074 12.320 -33.501 1.00 12.15 C ATOM 567 CG1 ILE A 384 -14.173 12.126 -32.262 1.00 13.95 C ATOM 568 CG2 ILE A 384 -16.418 12.782 -33.016 1.00 13.43 C ATOM 569 CD1 ILE A 384 -12.786 11.594 -32.506 1.00 17.14 C ATOM 570 H ILE A 384 -13.426 11.639 -35.414 1.00 0.00 H ATOM 571 N ALA A 385 -16.661 11.423 -36.270 1.00 10.21 N ATOM 572 CA ALA A 385 -17.869 11.240 -37.069 1.00 10.24 C ATOM 573 C ALA A 385 -18.051 9.775 -37.439 1.00 10.43 C ATOM 574 O ALA A 385 -19.168 9.277 -37.396 1.00 11.41 O ATOM 575 CB ALA A 385 -17.839 12.120 -38.313 1.00 10.77 C ATOM 576 H ALA A 385 -15.885 12.008 -36.639 1.00 0.00 H ATOM 577 N ALA A 386 -16.948 9.098 -37.766 1.00 10.60 N ATOM 578 CA ALA A 386 -17.011 7.677 -38.127 1.00 10.54 C ATOM 579 C ALA A 386 -17.432 6.817 -36.934 1.00 10.92 C ATOM 580 O ALA A 386 -18.269 5.931 -37.073 1.00 10.47 O ATOM 581 CB ALA A 386 -15.677 7.197 -38.704 1.00 10.73 C ATOM 582 H ALA A 386 -16.029 9.585 -37.765 1.00 0.00 H ATOM 583 N TYR A 387 -16.875 7.102 -35.764 1.00 10.92 N ATOM 584 CA TYR A 387 -17.230 6.353 -34.564 1.00 10.55 C ATOM 585 C TYR A 387 -18.711 6.532 -34.232 1.00 10.65 C ATOM 586 O TYR A 387 -19.408 5.550 -33.966 1.00 10.24 O ATOM 587 CB TYR A 387 -16.311 6.748 -33.395 1.00 10.95 C ATOM 588 CG TYR A 387 -16.498 5.886 -32.155 1.00 10.38 C ATOM 589 CD1 TYR A 387 -16.001 4.586 -32.117 1.00 13.47 C ATOM 590 CD2 TYR A 387 -17.154 6.380 -31.028 1.00 10.59 C ATOM 591 CE1 TYR A 387 -16.174 3.776 -30.993 1.00 12.73 C ATOM 592 CE2 TYR A 387 -17.317 5.578 -29.898 1.00 10.91 C ATOM 593 CZ TYR A 387 -16.829 4.287 -29.895 1.00 10.53 C ATOM 594 OH TYR A 387 -17.007 3.509 -28.774 1.00 9.81 O ATOM 595 HH TYR A 387 -16.605 2.617 -28.926 1.00 0.00 H ATOM 596 H TYR A 387 -16.176 7.870 -35.702 1.00 0.00 H ATOM 597 N ARG A 388 -19.199 7.773 -34.286 1.00 10.84 N ATOM 598 CA ARG A 388 -20.606 8.057 -34.015 1.00 11.30 C ATOM 599 C ARG A 388 -21.512 7.314 -35.002 1.00 11.80 C ATOM 600 O ARG A 388 -22.532 6.750 -34.614 1.00 12.69 O ATOM 601 CB ARG A 388 -20.891 9.566 -34.019 1.00 11.27 C ATOM 602 CG ARG A 388 -20.339 10.294 -32.803 1.00 11.28 C ATOM 603 CD ARG A 388 -20.308 11.787 -33.062 1.00 10.56 C ATOM 604 NE ARG A 388 -20.147 12.525 -31.801 1.00 11.86 N ATOM 605 CZ ARG A 388 -19.836 13.813 -31.704 1.00 12.87 C ATOM 606 NH1 ARG A 388 -19.639 14.556 -32.789 1.00 13.97 N ATOM 607 NH2 ARG A 388 -19.741 14.364 -30.497 1.00 13.94 N ATOM 608 HE ARG A 388 -20.288 11.998 -30.916 1.00 0.00 H ATOM 609 HH12 ARG A 388 -19.396 15.563 -32.693 1.00 0.00 H ATOM 610 HH11 ARG A 388 -19.728 14.130 -33.734 1.00 0.00 H ATOM 611 HH22 ARG A 388 -19.498 15.371 -30.403 1.00 0.00 H ATOM 612 HH21 ARG A 388 -19.909 13.788 -29.648 1.00 0.00 H ATOM 613 H ARG A 388 -18.561 8.558 -34.527 1.00 0.00 H ATOM 614 N ARG A 389 -21.125 7.300 -36.274 1.00 11.77 N ATOM 615 CA ARG A 389 -21.916 6.595 -37.277 1.00 12.06 C ATOM 616 C ARG A 389 -21.869 5.079 -37.080 1.00 12.52 C ATOM 617 O ARG A 389 -22.903 4.408 -37.176 1.00 12.78 O ATOM 618 CB ARG A 389 -21.491 6.993 -38.690 1.00 12.21 C ATOM 619 CG ARG A 389 -22.238 6.258 -39.780 1.00 13.37 C ATOM 620 CD ARG A 389 -21.983 6.894 -41.132 1.00 15.73 C ATOM 621 NE ARG A 389 -22.522 8.247 -41.177 1.00 17.68 N ATOM 622 CZ ARG A 389 -23.791 8.531 -41.449 1.00 20.62 C ATOM 623 NH1 ARG A 389 -24.647 7.552 -41.710 1.00 21.80 N ATOM 624 NH2 ARG A 389 -24.203 9.791 -41.473 1.00 22.21 N ATOM 625 HE ARG A 389 -21.874 9.038 -40.985 1.00 0.00 H ATOM 626 HH12 ARG A 389 -25.641 7.773 -41.923 1.00 0.00 H ATOM 627 HH11 ARG A 389 -24.325 6.563 -41.702 1.00 0.00 H ATOM 628 HH22 ARG A 389 -25.197 10.009 -41.686 1.00 0.00 H ATOM 629 HH21 ARG A 389 -23.532 10.561 -41.278 1.00 0.00 H ATOM 630 H ARG A 389 -20.254 7.794 -36.555 1.00 0.00 H ATOM 631 N ALA A 390 -20.681 4.556 -36.779 1.00 12.71 N ATOM 632 CA ALA A 390 -20.489 3.100 -36.599 1.00 13.40 C ATOM 633 C ALA A 390 -21.282 2.558 -35.427 1.00 14.18 C ATOM 634 O ALA A 390 -21.925 1.513 -35.538 1.00 14.41 O ATOM 635 CB ALA A 390 -19.011 2.746 -36.429 1.00 13.41 C ATOM 636 H ALA A 390 -19.864 5.190 -36.667 1.00 0.00 H ATOM 637 N ILE A 391 -21.251 3.255 -34.296 1.00 15.26 N ATOM 638 CA ILE A 391 -21.895 2.692 -33.103 1.00 15.52 C ATOM 639 C ILE A 391 -23.421 2.743 -33.233 1.00 16.44 C ATOM 640 O ILE A 391 -24.114 1.982 -32.558 1.00 16.97 O ATOM 641 CB ILE A 391 -21.388 3.325 -31.769 1.00 16.02 C ATOM 642 CG1 ILE A 391 -21.742 4.816 -31.713 1.00 14.68 C ATOM 643 CG2 ILE A 391 -19.902 2.998 -31.544 1.00 16.36 C ATOM 644 CD1 ILE A 391 -21.267 5.531 -30.426 1.00 15.32 C ATOM 645 H ILE A 391 -20.780 4.181 -34.257 1.00 0.00 H ATOM 646 N ALA A 392 -23.932 3.581 -34.143 1.00 16.56 N ATOM 647 CA ALA A 392 -25.358 3.594 -34.474 1.00 17.37 C ATOM 648 C ALA A 392 -25.796 2.279 -35.142 1.00 17.58 C ATOM 649 O ALA A 392 -26.974 1.912 -35.083 1.00 18.85 O ATOM 650 CB ALA A 392 -25.711 4.787 -35.337 1.00 17.39 C ATOM 651 H ALA A 392 -23.296 4.244 -34.630 1.00 0.00 H ATOM 652 N ALA A 393 -24.847 1.549 -35.731 1.00 18.15 N ATOM 653 CA ALA A 393 -25.131 0.213 -36.286 1.00 17.97 C ATOM 654 C ALA A 393 -25.130 -0.903 -35.235 1.00 18.59 C ATOM 655 O ALA A 393 -25.447 -2.055 -35.537 1.00 19.31 O ATOM 656 CB ALA A 393 -24.154 -0.121 -37.423 1.00 17.95 C ATOM 657 H ALA A 393 -23.883 1.932 -35.800 1.00 0.00 H ATOM 658 N LYS A 394 -24.756 -0.576 -34.002 1.00 17.93 N ATOM 659 CA LYS A 394 -24.902 -1.524 -32.909 1.00 17.49 C ATOM 660 C LYS A 394 -26.378 -1.709 -32.559 1.00 17.23 C ATOM 661 O LYS A 394 -27.207 -0.812 -32.758 1.00 17.60 O ATOM 662 CB LYS A 394 -24.124 -1.060 -31.676 1.00 17.65 C ATOM 663 CG LYS A 394 -22.625 -1.279 -31.786 1.00 18.00 C ATOM 664 CD LYS A 394 -21.924 -0.852 -30.504 1.00 22.14 C ATOM 665 CE LYS A 394 -20.479 -1.274 -30.500 1.00 23.92 C ATOM 666 NZ LYS A 394 -19.944 -1.311 -29.095 1.00 24.93 N ATOM 667 HZ1 LYS A 394 -20.021 -0.364 -28.671 1.00 0.00 H ATOM 668 HZ2 LYS A 394 -20.496 -1.990 -28.533 1.00 0.00 H ATOM 669 HZ3 LYS A 394 -18.946 -1.604 -29.113 1.00 0.00 H ATOM 670 H LYS A 394 -24.356 0.366 -33.817 1.00 0.00 H ATOM 671 N SER A 395 -26.696 -2.902 -32.061 1.00 16.20 N ATOM 672 CA SER A 395 -28.047 -3.213 -31.584 1.00 15.76 C ATOM 673 C SER A 395 -28.016 -3.380 -30.071 1.00 15.86 C ATOM 674 O SER A 395 -26.957 -3.277 -29.457 1.00 16.31 O ATOM 675 CB SER A 395 -28.548 -4.505 -32.239 1.00 15.06 C ATOM 676 OG SER A 395 -27.881 -5.645 -31.705 1.00 13.23 O ATOM 677 HG SER A 395 -26.908 -5.564 -31.869 1.00 0.00 H ATOM 678 H SER A 395 -25.962 -3.637 -32.009 1.00 0.00 H ATOM 679 N ASP A 396 -29.173 -3.686 -29.472 1.00 16.08 N ATOM 680 CA ASP A 396 -29.222 -3.989 -28.042 1.00 16.19 C ATOM 681 C ASP A 396 -28.255 -5.113 -27.681 1.00 16.44 C ATOM 682 O ASP A 396 -27.687 -5.123 -26.592 1.00 16.71 O ATOM 683 CB ASP A 396 -30.639 -4.393 -27.606 1.00 15.83 C ATOM 684 CG ASP A 396 -31.641 -3.257 -27.692 1.00 17.66 C ATOM 685 OD1 ASP A 396 -31.252 -2.070 -27.834 1.00 19.03 O ATOM 686 OD2 ASP A 396 -32.848 -3.566 -27.583 1.00 18.63 O ATOM 687 H ASP A 396 -30.050 -3.709 -30.031 1.00 0.00 H ATOM 688 N LEU A 397 -28.062 -6.053 -28.604 1.00 16.42 N ATOM 689 CA LEU A 397 -27.174 -7.172 -28.366 1.00 17.32 C ATOM 690 C LEU A 397 -25.743 -6.727 -28.064 1.00 18.54 C ATOM 691 O LEU A 397 -25.144 -7.173 -27.084 1.00 18.81 O ATOM 692 CB LEU A 397 -27.235 -8.155 -29.556 1.00 16.86 C ATOM 693 CG LEU A 397 -26.637 -9.565 -29.444 1.00 17.35 C ATOM 694 CD1 LEU A 397 -25.108 -9.516 -29.478 1.00 17.72 C ATOM 695 CD2 LEU A 397 -27.140 -10.331 -28.204 1.00 15.34 C ATOM 696 H LEU A 397 -28.559 -5.982 -29.515 1.00 0.00 H ATOM 697 N GLU A 398 -25.201 -5.840 -28.890 1.00 19.72 N ATOM 698 CA GLU A 398 -23.837 -5.363 -28.678 1.00 20.95 C ATOM 699 C GLU A 398 -23.725 -4.530 -27.399 1.00 22.87 C ATOM 700 O GLU A 398 -22.790 -4.725 -26.615 1.00 23.27 O ATOM 701 CB GLU A 398 -23.317 -4.609 -29.904 1.00 20.89 C ATOM 702 CG GLU A 398 -23.001 -5.526 -31.117 1.00 18.14 C ATOM 703 CD GLU A 398 -24.235 -5.998 -31.881 1.00 15.01 C ATOM 704 OE1 GLU A 398 -25.193 -5.214 -32.044 1.00 17.12 O ATOM 705 OE2 GLU A 398 -24.225 -7.166 -32.323 1.00 15.27 O ATOM 706 H GLU A 398 -25.753 -5.482 -29.695 1.00 0.00 H ATOM 707 N ARG A 399 -24.704 -3.648 -27.181 1.00 23.78 N ATOM 708 CA ARG A 399 -24.713 -2.770 -26.010 1.00 24.81 C ATOM 709 C ARG A 399 -24.823 -3.562 -24.699 1.00 25.90 C ATOM 710 O ARG A 399 -24.393 -3.087 -23.643 1.00 26.17 O ATOM 711 CB ARG A 399 -25.829 -1.726 -26.136 1.00 24.36 C ATOM 712 CG ARG A 399 -25.579 -0.696 -27.236 1.00 23.54 C ATOM 713 CD ARG A 399 -26.668 0.366 -27.292 1.00 21.10 C ATOM 714 NE ARG A 399 -27.926 -0.139 -27.844 1.00 19.45 N ATOM 715 CZ ARG A 399 -28.259 -0.078 -29.132 1.00 18.41 C ATOM 716 NH1 ARG A 399 -27.430 0.473 -30.012 1.00 17.56 N ATOM 717 NH2 ARG A 399 -29.427 -0.560 -29.546 1.00 18.66 N ATOM 718 HE ARG A 399 -28.605 -0.574 -27.187 1.00 0.00 H ATOM 719 HH12 ARG A 399 -27.694 0.519 -31.017 1.00 0.00 H ATOM 720 HH11 ARG A 399 -26.517 0.859 -29.696 1.00 0.00 H ATOM 721 HH22 ARG A 399 -29.683 -0.510 -30.553 1.00 0.00 H ATOM 722 HH21 ARG A 399 -30.085 -0.987 -28.863 1.00 0.00 H ATOM 723 H ARG A 399 -25.485 -3.583 -27.865 1.00 0.00 H ATOM 724 N GLN A 400 -25.389 -4.768 -24.786 1.00 27.31 N ATOM 725 CA GLN A 400 -25.541 -5.676 -23.643 1.00 28.44 C ATOM 726 C GLN A 400 -24.259 -6.450 -23.336 1.00 29.13 C ATOM 727 O GLN A 400 -23.905 -6.643 -22.169 1.00 29.49 O ATOM 728 CB GLN A 400 -26.715 -6.639 -23.895 1.00 28.43 C ATOM 729 CG GLN A 400 -26.370 -8.127 -23.866 1.00 28.66 C ATOM 730 CD GLN A 400 -26.399 -8.716 -22.475 1.00 28.33 C ATOM 731 OE1 GLN A 400 -27.362 -8.534 -21.736 1.00 29.44 O ATOM 732 NE2 GLN A 400 -25.343 -9.438 -22.113 1.00 27.88 N ATOM 733 HE22 GLN A 400 -24.549 -9.565 -22.773 1.00 0.00 H ATOM 734 HE21 GLN A 400 -25.311 -9.875 -21.170 1.00 0.00 H ATOM 735 H GLN A 400 -25.741 -5.081 -25.713 1.00 0.00 H ATOM 736 N GLU A 401 -23.586 -6.910 -24.390 1.00 30.15 N ATOM 737 CA GLU A 401 -22.366 -7.712 -24.263 1.00 31.26 C ATOM 738 C GLU A 401 -21.231 -6.944 -23.594 1.00 31.72 C ATOM 739 O GLU A 401 -20.934 -7.167 -22.416 1.00 32.28 O ATOM 740 CB GLU A 401 -21.917 -8.240 -25.631 1.00 31.44 C ATOM 741 CG GLU A 401 -22.755 -9.414 -26.142 1.00 32.49 C ATOM 742 CD GLU A 401 -22.106 -10.164 -27.299 1.00 34.14 C ATOM 743 OE1 GLU A 401 -21.375 -9.528 -28.088 1.00 35.19 O ATOM 744 OE2 GLU A 401 -22.327 -11.392 -27.420 1.00 33.82 O ATOM 745 H GLU A 401 -23.941 -6.691 -25.343 1.00 0.00 H TER 746 GLU A 401 ATOM 747 N GLU A 404 -16.261 -5.816 -25.367 1.00 25.17 N ATOM 748 CA GLU A 404 -15.015 -5.278 -25.922 1.00 24.63 C ATOM 749 C GLU A 404 -15.047 -3.746 -25.883 1.00 23.73 C ATOM 750 O GLU A 404 -16.068 -3.139 -26.188 1.00 24.82 O ATOM 751 CB GLU A 404 -14.837 -5.791 -27.353 1.00 24.99 C ATOM 752 CG GLU A 404 -13.868 -5.003 -28.227 1.00 25.74 C ATOM 753 CD GLU A 404 -14.235 -5.032 -29.712 1.00 27.30 C ATOM 754 OE1 GLU A 404 -15.439 -4.932 -30.048 1.00 30.40 O ATOM 755 OE2 GLU A 404 -13.310 -5.130 -30.537 1.00 27.74 O ATOM 756 HN3 GLU A 404 -17.066 -5.474 -25.930 1.00 0.00 H ATOM 757 HN2 GLU A 404 -16.366 -5.499 -24.382 1.00 0.00 H ATOM 758 HN1 GLU A 404 -16.232 -6.855 -25.397 1.00 0.00 H ATOM 759 N LYS A 405 -13.926 -3.134 -25.508 1.00 22.22 N ATOM 760 CA LYS A 405 -13.844 -1.676 -25.399 1.00 20.71 C ATOM 761 C LYS A 405 -13.380 -1.029 -26.702 1.00 19.17 C ATOM 762 O LYS A 405 -12.313 -1.368 -27.223 1.00 20.10 O ATOM 763 CB LYS A 405 -12.909 -1.279 -24.251 1.00 20.68 C ATOM 764 CG LYS A 405 -13.368 -1.709 -22.852 1.00 21.31 C ATOM 765 CD LYS A 405 -14.496 -0.833 -22.333 1.00 21.00 C ATOM 766 CE LYS A 405 -14.965 -1.234 -20.935 1.00 21.33 C ATOM 767 NZ LYS A 405 -15.995 -2.324 -20.982 1.00 23.37 N ATOM 768 HZ1 LYS A 405 -16.821 -1.996 -21.522 1.00 0.00 H ATOM 769 HZ2 LYS A 405 -15.589 -3.163 -21.443 1.00 0.00 H ATOM 770 HZ3 LYS A 405 -16.286 -2.566 -20.013 1.00 0.00 H ATOM 771 H LYS A 405 -13.086 -3.706 -25.287 1.00 0.00 H ATOM 772 N THR A 406 -14.194 -0.107 -27.217 1.00 16.55 N ATOM 773 CA THR A 406 -13.845 0.671 -28.404 1.00 13.65 C ATOM 774 C THR A 406 -13.896 2.149 -28.076 1.00 12.33 C ATOM 775 O THR A 406 -14.423 2.548 -27.038 1.00 11.82 O ATOM 776 CB THR A 406 -14.815 0.429 -29.572 1.00 12.80 C ATOM 777 OG1 THR A 406 -16.125 0.909 -29.243 1.00 11.94 O ATOM 778 CG2 THR A 406 -14.862 -1.075 -29.942 1.00 14.67 C ATOM 779 HG1 THR A 406 -16.459 0.432 -28.442 1.00 0.00 H ATOM 780 H THR A 406 -15.111 0.065 -26.757 1.00 0.00 H ATOM 781 N GLY A 407 -13.370 2.967 -28.981 1.00 11.70 N ATOM 782 CA GLY A 407 -13.328 4.400 -28.737 1.00 11.04 C ATOM 783 C GLY A 407 -12.312 5.129 -29.594 1.00 10.60 C ATOM 784 O GLY A 407 -11.636 4.513 -30.428 1.00 10.99 O ATOM 785 H GLY A 407 -12.987 2.581 -29.867 1.00 0.00 H ATOM 786 N VAL A 408 -12.226 6.442 -29.394 1.00 10.59 N ATOM 787 CA VAL A 408 -11.398 7.314 -30.232 1.00 10.95 C ATOM 788 C VAL A 408 -10.814 8.461 -29.421 1.00 10.25 C ATOM 789 O VAL A 408 -11.518 9.115 -28.647 1.00 10.06 O ATOM 790 CB VAL A 408 -12.188 7.946 -31.424 1.00 11.91 C ATOM 791 CG1 VAL A 408 -11.196 8.476 -32.467 1.00 12.37 C ATOM 792 CG2 VAL A 408 -13.115 6.970 -32.074 1.00 14.56 C ATOM 793 H VAL A 408 -12.767 6.865 -28.613 1.00 0.00 H ATOM 794 N PHE A 409 -9.528 8.691 -29.637 1.00 9.50 N ATOM 795 CA PHE A 409 -8.800 9.840 -29.076 1.00 10.51 C ATOM 796 C PHE A 409 -9.252 11.132 -29.756 1.00 10.16 C ATOM 797 O PHE A 409 -9.410 11.173 -30.978 1.00 11.56 O ATOM 798 CB PHE A 409 -7.307 9.567 -29.281 1.00 10.22 C ATOM 799 CG PHE A 409 -6.357 10.671 -28.847 1.00 10.19 C ATOM 800 CD1 PHE A 409 -6.489 11.361 -27.634 1.00 9.82 C ATOM 801 CD2 PHE A 409 -5.248 10.949 -29.654 1.00 10.63 C ATOM 802 CE1 PHE A 409 -5.534 12.344 -27.272 1.00 8.62 C ATOM 803 CE2 PHE A 409 -4.298 11.909 -29.296 1.00 12.02 C ATOM 804 CZ PHE A 409 -4.433 12.604 -28.121 1.00 10.40 C ATOM 805 H PHE A 409 -9.003 8.022 -30.236 1.00 0.00 H ATOM 806 N LEU A 410 -9.490 12.181 -28.970 1.00 10.05 N ATOM 807 CA LEU A 410 -9.908 13.469 -29.546 1.00 10.31 C ATOM 808 C LEU A 410 -8.746 14.271 -30.128 1.00 10.55 C ATOM 809 O LEU A 410 -8.971 15.279 -30.805 1.00 11.21 O ATOM 810 CB LEU A 410 -10.704 14.319 -28.541 1.00 10.39 C ATOM 811 CG LEU A 410 -11.960 13.701 -27.924 1.00 11.97 C ATOM 812 CD1 LEU A 410 -12.711 14.786 -27.184 1.00 12.48 C ATOM 813 CD2 LEU A 410 -12.886 12.989 -28.913 1.00 13.40 C ATOM 814 H LEU A 410 -9.379 12.089 -27.940 1.00 0.00 H ATOM 815 N GLY A 411 -7.518 13.849 -29.840 1.00 10.82 N ATOM 816 CA GLY A 411 -6.325 14.571 -30.298 1.00 11.72 C ATOM 817 C GLY A 411 -5.914 15.655 -29.313 1.00 12.51 C ATOM 818 O GLY A 411 -4.949 16.402 -29.560 1.00 13.51 O ATOM 819 H GLY A 411 -7.400 12.984 -29.275 1.00 0.00 H ATOM 820 N SER A 412 -6.620 15.733 -28.181 1.00 12.29 N ATOM 821 CA SER A 412 -6.386 16.790 -27.204 1.00 13.10 C ATOM 822 C SER A 412 -6.262 16.237 -25.792 1.00 11.80 C ATOM 823 O SER A 412 -6.566 15.068 -25.547 1.00 11.58 O ATOM 824 CB SER A 412 -7.513 17.806 -27.256 1.00 13.48 C ATOM 825 OG SER A 412 -8.748 17.199 -26.936 1.00 18.07 O ATOM 826 HG SER A 412 -9.468 17.877 -26.976 1.00 0.00 H ATOM 827 H SER A 412 -7.355 15.022 -27.992 1.00 0.00 H ATOM 828 N TYR A 413 -5.819 17.099 -24.874 1.00 11.25 N ATOM 829 CA TYR A 413 -5.454 16.700 -23.518 1.00 11.68 C ATOM 830 C TYR A 413 -6.154 17.566 -22.499 1.00 10.95 C ATOM 831 O TYR A 413 -6.497 18.719 -22.766 1.00 12.33 O ATOM 832 CB TYR A 413 -3.934 16.804 -23.312 1.00 11.24 C ATOM 833 CG TYR A 413 -3.177 15.923 -24.271 1.00 12.31 C ATOM 834 CD1 TYR A 413 -2.919 16.362 -25.567 1.00 15.30 C ATOM 835 CD2 TYR A 413 -2.746 14.652 -23.901 1.00 13.64 C ATOM 836 CE1 TYR A 413 -2.248 15.558 -26.478 1.00 16.31 C ATOM 837 CE2 TYR A 413 -2.060 13.822 -24.826 1.00 14.19 C ATOM 838 CZ TYR A 413 -1.826 14.307 -26.110 1.00 17.03 C ATOM 839 OH TYR A 413 -1.162 13.549 -27.050 1.00 19.96 O ATOM 840 HH TYR A 413 -0.255 13.334 -26.718 1.00 0.00 H ATOM 841 H TYR A 413 -5.730 18.101 -25.137 1.00 0.00 H ATOM 842 N ALA A 414 -6.376 16.976 -21.327 1.00 11.18 N ATOM 843 CA ALA A 414 -6.835 17.707 -20.153 1.00 11.14 C ATOM 844 C ALA A 414 -5.750 17.624 -19.080 1.00 11.26 C ATOM 845 O ALA A 414 -4.812 16.830 -19.178 1.00 12.12 O ATOM 846 CB ALA A 414 -8.145 17.115 -19.635 1.00 11.17 C ATOM 847 H ALA A 414 -6.215 15.952 -21.246 1.00 0.00 H ATOM 848 N ILE A 415 -5.854 18.481 -18.076 1.00 10.95 N ATOM 849 CA ILE A 415 -4.898 18.492 -16.984 1.00 11.18 C ATOM 850 C ILE A 415 -5.478 17.805 -15.748 1.00 10.30 C ATOM 851 O ILE A 415 -6.511 18.206 -15.237 1.00 9.99 O ATOM 852 CB ILE A 415 -4.432 19.944 -16.657 1.00 11.37 C ATOM 853 CG1 ILE A 415 -3.822 20.633 -17.896 1.00 12.88 C ATOM 854 CG2 ILE A 415 -3.417 19.940 -15.508 1.00 12.26 C ATOM 855 CD1 ILE A 415 -2.592 19.959 -18.462 1.00 15.27 C ATOM 856 H ILE A 415 -6.640 19.163 -18.070 1.00 0.00 H ATOM 857 N ASN A 416 -4.792 16.772 -15.270 1.00 9.66 N ATOM 858 CA ASN A 416 -5.179 16.131 -14.012 1.00 10.05 C ATOM 859 C ASN A 416 -4.924 17.146 -12.884 1.00 11.00 C ATOM 860 O ASN A 416 -3.780 17.582 -12.714 1.00 11.14 O ATOM 861 CB ASN A 416 -4.389 14.829 -13.836 1.00 10.08 C ATOM 862 CG ASN A 416 -4.737 14.095 -12.546 1.00 10.17 C ATOM 863 OD1 ASN A 416 -4.899 14.708 -11.501 1.00 11.58 O ATOM 864 ND2 ASN A 416 -4.854 12.779 -12.617 1.00 9.70 N ATOM 865 HD22 ASN A 416 -4.709 12.292 -13.525 1.00 0.00 H ATOM 866 HD21 ASN A 416 -5.091 12.231 -11.765 1.00 0.00 H ATOM 867 H ASN A 416 -3.970 16.414 -15.796 1.00 0.00 H ATOM 868 N PRO A 417 -5.968 17.530 -12.136 1.00 10.91 N ATOM 869 CA PRO A 417 -5.801 18.569 -11.119 1.00 11.91 C ATOM 870 C PRO A 417 -4.931 18.146 -9.931 1.00 12.22 C ATOM 871 O PRO A 417 -4.375 19.013 -9.261 1.00 13.52 O ATOM 872 CB PRO A 417 -7.232 18.873 -10.679 1.00 12.30 C ATOM 873 CG PRO A 417 -7.967 17.614 -10.913 1.00 11.87 C ATOM 874 CD PRO A 417 -7.358 17.029 -12.175 1.00 11.16 C ATOM 875 N ALA A 418 -4.806 16.847 -9.658 1.00 11.64 N ATOM 876 CA ALA A 418 -3.950 16.393 -8.554 1.00 12.76 C ATOM 877 C ALA A 418 -2.454 16.480 -8.854 1.00 13.51 C ATOM 878 O ALA A 418 -1.676 16.973 -8.021 1.00 13.33 O ATOM 879 CB ALA A 418 -4.307 14.965 -8.151 1.00 12.88 C ATOM 880 H ALA A 418 -5.320 16.148 -10.232 1.00 0.00 H ATOM 881 N ASN A 419 -2.036 15.974 -10.018 1.00 14.59 N ATOM 882 CA ASN A 419 -0.602 15.899 -10.336 1.00 14.96 C ATOM 883 C ASN A 419 -0.130 16.903 -11.393 1.00 15.58 C ATOM 884 O ASN A 419 1.069 16.995 -11.669 1.00 16.60 O ATOM 885 CB ASN A 419 -0.182 14.462 -10.696 1.00 14.41 C ATOM 886 CG ASN A 419 -0.956 13.900 -11.857 1.00 14.52 C ATOM 887 OD1 ASN A 419 -1.541 14.643 -12.639 1.00 15.25 O ATOM 888 ND2 ASN A 419 -0.970 12.579 -11.976 1.00 15.67 N ATOM 889 HD22 ASN A 419 -0.459 11.989 -11.288 1.00 0.00 H ATOM 890 HD21 ASN A 419 -1.492 12.133 -12.757 1.00 0.00 H ATOM 891 H ASN A 419 -2.734 15.629 -10.708 1.00 0.00 H ATOM 892 N GLY A 420 -1.075 17.632 -11.986 1.00 15.33 N ATOM 893 CA GLY A 420 -0.777 18.628 -13.024 1.00 15.45 C ATOM 894 C GLY A 420 -0.381 18.025 -14.361 1.00 15.89 C ATOM 895 O GLY A 420 0.026 18.761 -15.279 1.00 16.33 O ATOM 896 H GLY A 420 -2.065 17.490 -11.702 1.00 0.00 H ATOM 897 N GLU A 421 -0.502 16.703 -14.482 1.00 15.59 N ATOM 898 CA GLU A 421 -0.084 15.985 -15.692 1.00 15.80 C ATOM 899 C GLU A 421 -1.134 16.034 -16.800 1.00 14.95 C ATOM 900 O GLU A 421 -2.335 15.937 -16.529 1.00 13.87 O ATOM 901 CB GLU A 421 0.274 14.527 -15.375 1.00 16.31 C ATOM 902 CG GLU A 421 1.522 14.346 -14.502 1.00 19.34 C ATOM 903 CD GLU A 421 2.802 14.833 -15.172 1.00 22.13 C ATOM 904 OE1 GLU A 421 2.933 14.683 -16.407 1.00 23.96 O ATOM 905 OE2 GLU A 421 3.685 15.361 -14.460 1.00 24.31 O ATOM 906 H GLU A 421 -0.907 16.162 -13.692 1.00 0.00 H ATOM 907 N PRO A 422 -0.689 16.176 -18.066 1.00 14.82 N ATOM 908 CA PRO A 422 -1.653 16.072 -19.150 1.00 14.32 C ATOM 909 C PRO A 422 -2.127 14.631 -19.291 1.00 13.79 C ATOM 910 O PRO A 422 -1.339 13.693 -19.117 1.00 15.03 O ATOM 911 CB PRO A 422 -0.849 16.476 -20.392 1.00 14.55 C ATOM 912 CG PRO A 422 0.562 16.239 -20.037 1.00 15.99 C ATOM 913 CD PRO A 422 0.670 16.475 -18.559 1.00 15.20 C ATOM 914 N VAL A 423 -3.416 14.473 -19.571 1.00 12.08 N ATOM 915 CA VAL A 423 -4.021 13.166 -19.836 1.00 10.95 C ATOM 916 C VAL A 423 -4.842 13.250 -21.133 1.00 9.86 C ATOM 917 O VAL A 423 -5.534 14.237 -21.371 1.00 9.43 O ATOM 918 CB VAL A 423 -4.885 12.641 -18.638 1.00 11.31 C ATOM 919 CG1 VAL A 423 -4.029 12.490 -17.384 1.00 11.03 C ATOM 920 CG2 VAL A 423 -6.070 13.534 -18.338 1.00 11.31 C ATOM 921 H VAL A 423 -4.023 15.316 -19.603 1.00 0.00 H ATOM 922 N PRO A 424 -4.753 12.214 -21.988 1.00 9.09 N ATOM 923 CA PRO A 424 -5.485 12.285 -23.255 1.00 8.95 C ATOM 924 C PRO A 424 -6.988 12.143 -23.039 1.00 8.67 C ATOM 925 O PRO A 424 -7.432 11.427 -22.106 1.00 9.47 O ATOM 926 CB PRO A 424 -4.912 11.101 -24.056 1.00 8.89 C ATOM 927 CG PRO A 424 -4.416 10.152 -23.014 1.00 9.31 C ATOM 928 CD PRO A 424 -3.888 11.020 -21.904 1.00 9.19 C ATOM 929 N ILE A 425 -7.763 12.779 -23.917 1.00 8.22 N ATOM 930 CA ILE A 425 -9.226 12.739 -23.859 1.00 8.28 C ATOM 931 C ILE A 425 -9.759 11.835 -24.962 1.00 8.89 C ATOM 932 O ILE A 425 -9.409 12.021 -26.135 1.00 10.11 O ATOM 933 CB ILE A 425 -9.854 14.144 -24.027 1.00 8.90 C ATOM 934 CG1 ILE A 425 -9.203 15.146 -23.064 1.00 9.18 C ATOM 935 CG2 ILE A 425 -11.383 14.075 -23.843 1.00 9.01 C ATOM 936 CD1 ILE A 425 -9.515 16.622 -23.411 1.00 10.74 C ATOM 937 H ILE A 425 -7.310 13.327 -24.676 1.00 0.00 H ATOM 938 N PHE A 426 -10.642 10.902 -24.594 1.00 8.22 N ATOM 939 CA PHE A 426 -11.279 9.980 -25.549 1.00 8.44 C ATOM 940 C PHE A 426 -12.789 10.122 -25.495 1.00 8.61 C ATOM 941 O PHE A 426 -13.343 10.559 -24.485 1.00 9.22 O ATOM 942 CB PHE A 426 -10.960 8.529 -25.156 1.00 8.03 C ATOM 943 CG PHE A 426 -9.545 8.115 -25.428 1.00 8.05 C ATOM 944 CD1 PHE A 426 -8.510 8.507 -24.570 1.00 8.66 C ATOM 945 CD2 PHE A 426 -9.231 7.302 -26.534 1.00 9.69 C ATOM 946 CE1 PHE A 426 -7.185 8.114 -24.815 1.00 11.46 C ATOM 947 CE2 PHE A 426 -7.894 6.909 -26.787 1.00 9.47 C ATOM 948 CZ PHE A 426 -6.873 7.330 -25.931 1.00 10.72 C ATOM 949 H PHE A 426 -10.891 10.824 -23.587 1.00 0.00 H ATOM 950 N ILE A 427 -13.454 9.725 -26.572 1.00 8.55 N ATOM 951 CA ILE A 427 -14.823 9.255 -26.449 1.00 8.96 C ATOM 952 C ILE A 427 -14.867 7.736 -26.537 1.00 8.94 C ATOM 953 O ILE A 427 -14.026 7.114 -27.176 1.00 9.00 O ATOM 954 CB ILE A 427 -15.787 9.865 -27.509 1.00 9.36 C ATOM 955 CG1 ILE A 427 -15.301 9.595 -28.933 1.00 9.10 C ATOM 956 CG2 ILE A 427 -16.012 11.342 -27.253 1.00 10.21 C ATOM 957 CD1 ILE A 427 -16.378 9.937 -29.998 1.00 11.04 C ATOM 958 H ILE A 427 -12.995 9.750 -27.505 1.00 0.00 H ATOM 959 N ALA A 428 -15.860 7.143 -25.883 1.00 9.39 N ATOM 960 CA ALA A 428 -16.014 5.692 -25.902 1.00 9.72 C ATOM 961 C ALA A 428 -17.437 5.384 -25.486 1.00 10.40 C ATOM 962 O ALA A 428 -17.966 6.010 -24.568 1.00 9.79 O ATOM 963 CB ALA A 428 -15.011 5.038 -24.943 1.00 9.91 C ATOM 964 H ALA A 428 -16.539 7.722 -25.349 1.00 0.00 H ATOM 965 N ASP A 429 -18.064 4.407 -26.139 1.00 11.06 N ATOM 966 CA ASP A 429 -19.465 4.137 -25.846 1.00 11.27 C ATOM 967 C ASP A 429 -19.719 3.392 -24.535 1.00 11.17 C ATOM 968 O ASP A 429 -20.880 3.133 -24.198 1.00 12.73 O ATOM 969 CB ASP A 429 -20.185 3.478 -27.036 1.00 11.85 C ATOM 970 CG ASP A 429 -19.720 2.048 -27.318 1.00 12.14 C ATOM 971 OD1 ASP A 429 -18.804 1.495 -26.663 1.00 13.32 O ATOM 972 OD2 ASP A 429 -20.308 1.452 -28.251 1.00 14.66 O ATOM 973 H ASP A 429 -17.558 3.842 -26.851 1.00 0.00 H ATOM 974 N TYR A 430 -18.656 3.068 -23.799 1.00 11.01 N ATOM 975 CA TYR A 430 -18.853 2.525 -22.447 1.00 11.30 C ATOM 976 C TYR A 430 -19.253 3.586 -21.454 1.00 10.80 C ATOM 977 O TYR A 430 -19.708 3.268 -20.354 1.00 11.22 O ATOM 978 CB TYR A 430 -17.690 1.659 -21.947 1.00 10.94 C ATOM 979 CG TYR A 430 -16.433 2.305 -21.345 1.00 11.36 C ATOM 980 CD1 TYR A 430 -15.354 2.673 -22.150 1.00 10.69 C ATOM 981 CD2 TYR A 430 -16.265 2.393 -19.945 1.00 11.66 C ATOM 982 CE1 TYR A 430 -14.171 3.194 -21.592 1.00 11.65 C ATOM 983 CE2 TYR A 430 -15.081 2.906 -19.375 1.00 11.45 C ATOM 984 CZ TYR A 430 -14.043 3.307 -20.204 1.00 10.52 C ATOM 985 OH TYR A 430 -12.854 3.792 -19.663 1.00 9.94 O ATOM 986 HH TYR A 430 -12.444 3.095 -19.092 1.00 0.00 H ATOM 987 H TYR A 430 -17.696 3.198 -24.178 1.00 0.00 H ATOM 988 N VAL A 431 -19.082 4.846 -21.847 1.00 10.70 N ATOM 989 CA VAL A 431 -19.557 5.971 -21.047 1.00 10.76 C ATOM 990 C VAL A 431 -20.879 6.466 -21.609 1.00 11.75 C ATOM 991 O VAL A 431 -20.981 6.772 -22.804 1.00 11.60 O ATOM 992 CB VAL A 431 -18.493 7.099 -20.972 1.00 10.11 C ATOM 993 CG1 VAL A 431 -19.035 8.325 -20.225 1.00 11.93 C ATOM 994 CG2 VAL A 431 -17.236 6.558 -20.289 1.00 10.67 C ATOM 995 H VAL A 431 -18.597 5.034 -22.748 1.00 0.00 H ATOM 996 N LEU A 432 -21.888 6.504 -20.739 1.00 12.44 N ATOM 997 CA LEU A 432 -23.261 6.874 -21.110 1.00 14.20 C ATOM 998 C LEU A 432 -23.550 8.364 -20.958 1.00 15.45 C ATOM 999 O LEU A 432 -23.258 8.958 -19.912 1.00 15.82 O ATOM 1000 CB LEU A 432 -24.263 6.074 -20.263 1.00 15.02 C ATOM 1001 CG LEU A 432 -24.057 4.564 -20.211 1.00 17.10 C ATOM 1002 CD1 LEU A 432 -24.925 3.959 -19.109 1.00 20.95 C ATOM 1003 CD2 LEU A 432 -24.372 3.918 -21.555 1.00 20.95 C ATOM 1004 H LEU A 432 -21.694 6.259 -19.747 1.00 0.00 H ATOM 1005 N ALA A 433 -24.147 8.968 -21.990 1.00 16.60 N ATOM 1006 CA ALA A 433 -24.351 10.429 -22.029 1.00 17.88 C ATOM 1007 C ALA A 433 -25.320 10.983 -20.986 1.00 19.19 C ATOM 1008 O ALA A 433 -25.163 12.123 -20.518 1.00 20.79 O ATOM 1009 CB ALA A 433 -24.791 10.875 -23.433 1.00 18.24 C ATOM 1010 H ALA A 433 -24.478 8.391 -22.790 1.00 0.00 H ATOM 1011 N GLY A 434 -26.326 10.194 -20.645 1.00 19.86 N ATOM 1012 CA GLY A 434 -27.400 10.677 -19.760 1.00 19.62 C ATOM 1013 C GLY A 434 -27.213 10.377 -18.287 1.00 19.62 C ATOM 1014 O GLY A 434 -28.145 10.528 -17.483 1.00 20.33 O ATOM 1015 H GLY A 434 -26.359 9.219 -21.007 1.00 0.00 H ATOM 1016 N TYR A 435 -26.000 9.977 -17.917 1.00 18.54 N ATOM 1017 CA TYR A 435 -25.724 9.544 -16.560 1.00 18.07 C ATOM 1018 C TYR A 435 -24.563 10.310 -15.944 1.00 16.67 C ATOM 1019 O TYR A 435 -23.546 10.519 -16.591 1.00 15.54 O ATOM 1020 CB TYR A 435 -25.415 8.054 -16.563 1.00 18.60 C ATOM 1021 CG TYR A 435 -25.443 7.451 -15.197 1.00 22.14 C ATOM 1022 CD1 TYR A 435 -26.654 7.076 -14.612 1.00 25.01 C ATOM 1023 CD2 TYR A 435 -24.268 7.253 -14.480 1.00 24.45 C ATOM 1024 CE1 TYR A 435 -26.689 6.525 -13.343 1.00 26.94 C ATOM 1025 CE2 TYR A 435 -24.290 6.705 -13.212 1.00 25.75 C ATOM 1026 CZ TYR A 435 -25.505 6.342 -12.651 1.00 27.08 C ATOM 1027 OH TYR A 435 -25.536 5.791 -11.396 1.00 28.67 O ATOM 1028 HH TYR A 435 -25.150 6.431 -10.746 1.00 0.00 H ATOM 1029 H TYR A 435 -25.231 9.974 -18.617 1.00 0.00 H ATOM 1030 N GLY A 436 -24.705 10.702 -14.682 1.00 15.78 N ATOM 1031 CA GLY A 436 -23.689 11.506 -14.008 1.00 14.48 C ATOM 1032 C GLY A 436 -23.514 12.826 -14.736 1.00 14.16 C ATOM 1033 O GLY A 436 -24.476 13.564 -14.946 1.00 14.98 O ATOM 1034 H GLY A 436 -25.562 10.429 -14.161 1.00 0.00 H ATOM 1035 N THR A 437 -22.286 13.113 -15.151 1.00 12.75 N ATOM 1036 CA THR A 437 -22.006 14.291 -15.960 1.00 12.21 C ATOM 1037 C THR A 437 -21.765 13.920 -17.423 1.00 12.17 C ATOM 1038 O THR A 437 -21.441 14.791 -18.240 1.00 12.70 O ATOM 1039 CB THR A 437 -20.735 14.959 -15.469 1.00 11.32 C ATOM 1040 OG1 THR A 437 -19.658 14.041 -15.689 1.00 11.00 O ATOM 1041 CG2 THR A 437 -20.833 15.283 -13.986 1.00 12.44 C ATOM 1042 HG1 THR A 437 -18.811 14.448 -15.378 1.00 0.00 H ATOM 1043 H THR A 437 -21.503 12.480 -14.891 1.00 0.00 H ATOM 1044 N GLY A 438 -21.902 12.633 -17.746 1.00 11.77 N ATOM 1045 CA GLY A 438 -21.559 12.129 -19.085 1.00 10.77 C ATOM 1046 C GLY A 438 -20.066 12.033 -19.363 1.00 11.15 C ATOM 1047 O GLY A 438 -19.645 11.794 -20.500 1.00 10.44 O ATOM 1048 H GLY A 438 -22.261 11.968 -17.032 1.00 0.00 H ATOM 1049 N ALA A 439 -19.254 12.162 -18.315 1.00 10.28 N ATOM 1050 CA ALA A 439 -17.814 12.002 -18.459 1.00 9.71 C ATOM 1051 C ALA A 439 -17.227 11.366 -17.212 1.00 9.76 C ATOM 1052 O ALA A 439 -17.707 11.579 -16.091 1.00 9.35 O ATOM 1053 CB ALA A 439 -17.151 13.360 -18.712 1.00 9.98 C ATOM 1054 H ALA A 439 -19.654 12.380 -17.380 1.00 0.00 H ATOM 1055 N ILE A 440 -16.160 10.608 -17.416 1.00 8.64 N ATOM 1056 CA ILE A 440 -15.454 9.970 -16.321 1.00 8.77 C ATOM 1057 C ILE A 440 -13.974 10.312 -16.335 1.00 8.72 C ATOM 1058 O ILE A 440 -13.396 10.660 -17.388 1.00 8.25 O ATOM 1059 CB ILE A 440 -15.609 8.421 -16.359 1.00 9.02 C ATOM 1060 CG1 ILE A 440 -14.910 7.807 -17.585 1.00 8.62 C ATOM 1061 CG2 ILE A 440 -17.088 8.007 -16.272 1.00 9.83 C ATOM 1062 CD1 ILE A 440 -14.753 6.275 -17.529 1.00 8.52 C ATOM 1063 H ILE A 440 -15.819 10.466 -18.388 1.00 0.00 H ATOM 1064 N MET A 441 -13.353 10.203 -15.165 1.00 8.57 N ATOM 1065 CA MET A 441 -11.910 10.020 -15.103 1.00 7.56 C ATOM 1066 C MET A 441 -11.652 8.518 -15.135 1.00 7.29 C ATOM 1067 O MET A 441 -12.371 7.748 -14.494 1.00 8.14 O ATOM 1068 CB MET A 441 -11.282 10.682 -13.873 1.00 7.43 C ATOM 1069 CG MET A 441 -11.534 9.970 -12.548 1.00 7.57 C ATOM 1070 SD MET A 441 -10.896 10.962 -11.187 1.00 8.68 S ATOM 1071 CE MET A 441 -10.936 9.753 -9.872 1.00 8.33 C ATOM 1072 H MET A 441 -13.904 10.249 -14.284 1.00 0.00 H ATOM 1073 N ALA A 442 -10.679 8.099 -15.937 1.00 7.24 N ATOM 1074 CA ALA A 442 -10.352 6.696 -16.067 1.00 7.11 C ATOM 1075 C ALA A 442 -9.140 6.330 -15.218 1.00 7.05 C ATOM 1076 O ALA A 442 -8.072 6.951 -15.336 1.00 7.07 O ATOM 1077 CB ALA A 442 -10.123 6.344 -17.512 1.00 7.53 C ATOM 1078 H ALA A 442 -10.138 8.798 -16.486 1.00 0.00 H ATOM 1079 N VAL A 443 -9.330 5.323 -14.360 1.00 7.15 N ATOM 1080 CA VAL A 443 -8.317 4.881 -13.414 1.00 7.48 C ATOM 1081 C VAL A 443 -8.133 3.377 -13.647 1.00 8.44 C ATOM 1082 O VAL A 443 -8.770 2.561 -12.983 1.00 8.44 O ATOM 1083 CB VAL A 443 -8.740 5.172 -11.942 1.00 6.12 C ATOM 1084 CG1 VAL A 443 -7.649 4.724 -10.970 1.00 7.28 C ATOM 1085 CG2 VAL A 443 -9.007 6.683 -11.725 1.00 8.45 C ATOM 1086 H VAL A 443 -10.247 4.832 -14.369 1.00 0.00 H ATOM 1087 N PRO A 444 -7.309 3.001 -14.631 1.00 8.80 N ATOM 1088 CA PRO A 444 -7.204 1.574 -14.961 1.00 8.77 C ATOM 1089 C PRO A 444 -6.706 0.714 -13.823 1.00 9.27 C ATOM 1090 O PRO A 444 -7.065 -0.468 -13.762 1.00 9.52 O ATOM 1091 CB PRO A 444 -6.205 1.542 -16.128 1.00 8.91 C ATOM 1092 CG PRO A 444 -6.120 2.912 -16.623 1.00 11.13 C ATOM 1093 CD PRO A 444 -6.554 3.857 -15.566 1.00 8.50 C ATOM 1094 N GLY A 445 -5.912 1.294 -12.920 1.00 8.73 N ATOM 1095 CA GLY A 445 -5.422 0.533 -11.765 1.00 8.98 C ATOM 1096 C GLY A 445 -6.525 -0.062 -10.904 1.00 8.87 C ATOM 1097 O GLY A 445 -6.314 -1.100 -10.250 1.00 9.40 O ATOM 1098 H GLY A 445 -5.639 2.291 -13.036 1.00 0.00 H ATOM 1099 N HIS A 446 -7.695 0.580 -10.897 1.00 8.75 N ATOM 1100 CA HIS A 446 -8.686 0.350 -9.831 1.00 8.22 C ATOM 1101 C HIS A 446 -10.139 0.240 -10.264 1.00 8.39 C ATOM 1102 O HIS A 446 -11.025 0.019 -9.435 1.00 9.07 O ATOM 1103 CB HIS A 446 -8.457 1.383 -8.711 1.00 8.40 C ATOM 1104 CG HIS A 446 -7.040 1.371 -8.229 1.00 8.60 C ATOM 1105 ND1 HIS A 446 -6.527 0.315 -7.509 1.00 8.33 N ATOM 1106 CD2 HIS A 446 -6.003 2.209 -8.465 1.00 9.20 C ATOM 1107 CE1 HIS A 446 -5.239 0.514 -7.302 1.00 7.36 C ATOM 1108 NE2 HIS A 446 -4.898 1.665 -7.863 1.00 9.06 N ATOM 1109 H HIS A 446 -7.911 1.255 -11.658 1.00 0.00 H ATOM 1110 N ASP A 447 -10.369 0.328 -11.570 1.00 8.07 N ATOM 1111 CA ASP A 447 -11.674 0.147 -12.174 1.00 8.64 C ATOM 1112 C ASP A 447 -11.474 -0.793 -13.357 1.00 8.92 C ATOM 1113 O ASP A 447 -10.777 -0.447 -14.305 1.00 9.77 O ATOM 1114 CB ASP A 447 -12.235 1.513 -12.601 1.00 8.34 C ATOM 1115 CG ASP A 447 -13.632 1.428 -13.252 1.00 8.93 C ATOM 1116 OD1 ASP A 447 -13.975 0.368 -13.846 1.00 10.05 O ATOM 1117 OD2 ASP A 447 -14.377 2.424 -13.195 1.00 8.01 O ATOM 1118 H ASP A 447 -9.565 0.539 -12.195 1.00 0.00 H ATOM 1119 N GLN A 448 -12.069 -1.985 -13.286 1.00 9.35 N ATOM 1120 CA GLN A 448 -11.858 -3.021 -14.297 1.00 10.18 C ATOM 1121 C GLN A 448 -12.261 -2.588 -15.702 1.00 10.22 C ATOM 1122 O GLN A 448 -11.641 -3.007 -16.682 1.00 10.36 O ATOM 1123 CB GLN A 448 -12.575 -4.328 -13.907 1.00 9.99 C ATOM 1124 CG GLN A 448 -12.174 -5.534 -14.802 1.00 11.88 C ATOM 1125 CD GLN A 448 -10.695 -5.878 -14.718 1.00 11.89 C ATOM 1126 OE1 GLN A 448 -10.116 -5.915 -13.634 1.00 12.22 O ATOM 1127 NE2 GLN A 448 -10.066 -6.129 -15.879 1.00 14.27 N ATOM 1128 HE22 GLN A 448 -10.592 -6.087 -16.775 1.00 0.00 H ATOM 1129 HE21 GLN A 448 -9.053 -6.365 -15.881 1.00 0.00 H ATOM 1130 H GLN A 448 -12.703 -2.184 -12.486 1.00 0.00 H ATOM 1131 N ARG A 449 -13.277 -1.732 -15.784 1.00 10.51 N ATOM 1132 CA ARG A 449 -13.748 -1.195 -17.075 1.00 10.27 C ATOM 1133 C ARG A 449 -12.646 -0.351 -17.718 1.00 10.14 C ATOM 1134 O ARG A 449 -12.380 -0.451 -18.920 1.00 10.72 O ATOM 1135 CB ARG A 449 -15.029 -0.377 -16.881 1.00 10.82 C ATOM 1136 CG ARG A 449 -16.135 -1.179 -16.200 1.00 11.26 C ATOM 1137 CD ARG A 449 -17.271 -0.321 -15.725 1.00 10.95 C ATOM 1138 NE ARG A 449 -16.866 0.589 -14.646 1.00 12.04 N ATOM 1139 CZ ARG A 449 -17.708 1.360 -13.964 1.00 12.03 C ATOM 1140 NH1 ARG A 449 -19.012 1.333 -14.216 1.00 12.21 N ATOM 1141 NH2 ARG A 449 -17.238 2.169 -13.010 1.00 10.12 N ATOM 1142 HE ARG A 449 -15.857 0.633 -14.400 1.00 0.00 H ATOM 1143 HH12 ARG A 449 -19.659 1.941 -13.675 1.00 0.00 H ATOM 1144 HH11 ARG A 449 -19.386 0.703 -14.954 1.00 0.00 H ATOM 1145 HH22 ARG A 449 -17.891 2.774 -12.473 1.00 0.00 H ATOM 1146 HH21 ARG A 449 -16.219 2.193 -12.804 1.00 0.00 H ATOM 1147 H ARG A 449 -13.754 -1.432 -14.910 1.00 0.00 H ATOM 1148 N ASP A 450 -11.980 0.462 -16.897 1.00 9.43 N ATOM 1149 CA ASP A 450 -10.879 1.296 -17.374 1.00 9.17 C ATOM 1150 C ASP A 450 -9.625 0.470 -17.645 1.00 9.22 C ATOM 1151 O ASP A 450 -8.846 0.800 -18.539 1.00 10.31 O ATOM 1152 CB ASP A 450 -10.579 2.407 -16.350 1.00 9.05 C ATOM 1153 CG ASP A 450 -11.764 3.344 -16.117 1.00 9.62 C ATOM 1154 OD1 ASP A 450 -12.714 3.448 -16.955 1.00 9.27 O ATOM 1155 OD2 ASP A 450 -11.744 4.008 -15.051 1.00 8.84 O ATOM 1156 H ASP A 450 -12.251 0.503 -15.894 1.00 0.00 H ATOM 1157 N TRP A 451 -9.421 -0.584 -16.853 1.00 9.09 N ATOM 1158 CA TRP A 451 -8.300 -1.505 -17.031 1.00 9.47 C ATOM 1159 C TRP A 451 -8.419 -2.159 -18.408 1.00 9.95 C ATOM 1160 O TRP A 451 -7.442 -2.187 -19.168 1.00 10.64 O ATOM 1161 CB TRP A 451 -8.336 -2.567 -15.915 1.00 9.77 C ATOM 1162 CG TRP A 451 -7.071 -3.423 -15.725 1.00 10.22 C ATOM 1163 CD1 TRP A 451 -6.081 -3.230 -14.807 1.00 10.89 C ATOM 1164 CD2 TRP A 451 -6.719 -4.625 -16.443 1.00 12.57 C ATOM 1165 NE1 TRP A 451 -5.123 -4.223 -14.907 1.00 12.77 N ATOM 1166 CE2 TRP A 451 -5.502 -5.097 -15.896 1.00 13.06 C ATOM 1167 CE3 TRP A 451 -7.324 -5.349 -17.484 1.00 14.35 C ATOM 1168 CZ2 TRP A 451 -4.851 -6.237 -16.383 1.00 13.91 C ATOM 1169 CZ3 TRP A 451 -6.686 -6.502 -17.954 1.00 14.71 C ATOM 1170 CH2 TRP A 451 -5.466 -6.928 -17.399 1.00 16.46 C ATOM 1171 HE1 TRP A 451 -4.261 -4.295 -14.330 1.00 0.00 H ATOM 1172 H TRP A 451 -10.089 -0.758 -16.075 1.00 0.00 H ATOM 1173 N ASP A 452 -9.612 -2.666 -18.717 1.00 10.65 N ATOM 1174 CA ASP A 452 -9.855 -3.334 -20.006 1.00 12.00 C ATOM 1175 C ASP A 452 -9.600 -2.379 -21.173 1.00 11.87 C ATOM 1176 O ASP A 452 -8.957 -2.748 -22.158 1.00 12.20 O ATOM 1177 CB ASP A 452 -11.293 -3.861 -20.071 1.00 12.23 C ATOM 1178 CG ASP A 452 -11.529 -5.064 -19.175 1.00 14.61 C ATOM 1179 OD1 ASP A 452 -10.557 -5.682 -18.683 1.00 16.44 O ATOM 1180 OD2 ASP A 452 -12.722 -5.395 -18.987 1.00 17.75 O ATOM 1181 H ASP A 452 -10.390 -2.588 -18.031 1.00 0.00 H ATOM 1182 N PHE A 453 -10.095 -1.148 -21.053 1.00 11.33 N ATOM 1183 CA PHE A 453 -9.919 -0.139 -22.101 1.00 10.38 C ATOM 1184 C PHE A 453 -8.436 0.196 -22.244 1.00 11.32 C ATOM 1185 O PHE A 453 -7.901 0.201 -23.340 1.00 11.65 O ATOM 1186 CB PHE A 453 -10.764 1.115 -21.792 1.00 10.84 C ATOM 1187 CG PHE A 453 -10.783 2.135 -22.911 1.00 11.06 C ATOM 1188 CD1 PHE A 453 -9.755 3.069 -23.032 1.00 9.91 C ATOM 1189 CD2 PHE A 453 -11.818 2.148 -23.852 1.00 11.08 C ATOM 1190 CE1 PHE A 453 -9.754 4.029 -24.070 1.00 11.00 C ATOM 1191 CE2 PHE A 453 -11.831 3.096 -24.882 1.00 12.06 C ATOM 1192 CZ PHE A 453 -10.796 4.035 -24.994 1.00 12.67 C ATOM 1193 H PHE A 453 -10.621 -0.896 -20.192 1.00 0.00 H ATOM 1194 N ALA A 454 -7.755 0.427 -21.127 1.00 11.01 N ATOM 1195 CA ALA A 454 -6.346 0.786 -21.176 1.00 11.38 C ATOM 1196 C ALA A 454 -5.495 -0.331 -21.765 1.00 11.85 C ATOM 1197 O ALA A 454 -4.525 -0.073 -22.476 1.00 11.74 O ATOM 1198 CB ALA A 454 -5.837 1.195 -19.781 1.00 11.65 C ATOM 1199 H ALA A 454 -8.234 0.350 -20.207 1.00 0.00 H ATOM 1200 N ARG A 455 -5.853 -1.578 -21.483 1.00 12.43 N ATOM 1201 CA ARG A 455 -5.083 -2.688 -22.041 1.00 14.07 C ATOM 1202 C ARG A 455 -5.275 -2.772 -23.553 1.00 13.93 C ATOM 1203 O ARG A 455 -4.309 -3.029 -24.296 1.00 15.42 O ATOM 1204 CB ARG A 455 -5.463 -4.012 -21.377 1.00 14.65 C ATOM 1205 CG ARG A 455 -4.785 -4.257 -20.025 1.00 18.10 C ATOM 1206 CD ARG A 455 -3.272 -4.446 -20.178 1.00 23.86 C ATOM 1207 NE ARG A 455 -2.621 -4.941 -18.965 1.00 28.67 N ATOM 1208 CZ ARG A 455 -2.286 -6.215 -18.753 1.00 31.46 C ATOM 1209 NH1 ARG A 455 -2.549 -7.143 -19.669 1.00 33.18 N ATOM 1210 NH2 ARG A 455 -1.687 -6.566 -17.620 1.00 32.90 N ATOM 1211 HE ARG A 455 -2.404 -4.252 -18.216 1.00 0.00 H ATOM 1212 HH12 ARG A 455 -2.285 -8.134 -19.496 1.00 0.00 H ATOM 1213 HH11 ARG A 455 -3.019 -6.878 -20.558 1.00 0.00 H ATOM 1214 HH22 ARG A 455 -1.426 -7.559 -17.456 1.00 0.00 H ATOM 1215 HH21 ARG A 455 -1.479 -5.847 -16.898 1.00 0.00 H ATOM 1216 H ARG A 455 -6.673 -1.763 -20.871 1.00 0.00 H ATOM 1217 N ALA A 456 -6.507 -2.541 -24.002 1.00 14.41 N ATOM 1218 CA ALA A 456 -6.822 -2.584 -25.445 1.00 14.61 C ATOM 1219 C ALA A 456 -6.166 -1.431 -26.215 1.00 14.73 C ATOM 1220 O ALA A 456 -5.767 -1.601 -27.372 1.00 16.29 O ATOM 1221 CB ALA A 456 -8.333 -2.608 -25.683 1.00 15.04 C ATOM 1222 H ALA A 456 -7.264 -2.326 -23.322 1.00 0.00 H ATOM 1223 N PHE A 457 -6.028 -0.268 -25.579 1.00 13.16 N ATOM 1224 CA PHE A 457 -5.520 0.920 -26.263 1.00 13.42 C ATOM 1225 C PHE A 457 -4.049 1.201 -25.999 1.00 13.10 C ATOM 1226 O PHE A 457 -3.433 1.986 -26.712 1.00 14.36 O ATOM 1227 CB PHE A 457 -6.395 2.141 -25.923 1.00 13.40 C ATOM 1228 CG PHE A 457 -7.684 2.172 -26.682 1.00 13.71 C ATOM 1229 CD1 PHE A 457 -8.742 1.343 -26.321 1.00 11.88 C ATOM 1230 CD2 PHE A 457 -7.843 3.037 -27.765 1.00 15.89 C ATOM 1231 CE1 PHE A 457 -9.943 1.344 -27.057 1.00 14.70 C ATOM 1232 CE2 PHE A 457 -9.047 3.059 -28.487 1.00 15.34 C ATOM 1233 CZ PHE A 457 -10.089 2.210 -28.131 1.00 16.24 C ATOM 1234 H PHE A 457 -6.287 -0.204 -24.574 1.00 0.00 H ATOM 1235 N GLY A 458 -3.468 0.556 -24.994 1.00 12.05 N ATOM 1236 CA GLY A 458 -2.097 0.870 -24.621 1.00 12.99 C ATOM 1237 C GLY A 458 -1.980 2.185 -23.873 1.00 13.13 C ATOM 1238 O GLY A 458 -1.136 3.028 -24.183 1.00 15.14 O ATOM 1239 H GLY A 458 -3.994 -0.175 -24.473 1.00 0.00 H ATOM 1240 N LEU A 459 -2.851 2.366 -22.888 1.00 12.34 N ATOM 1241 CA LEU A 459 -2.810 3.548 -22.022 1.00 12.21 C ATOM 1242 C LEU A 459 -2.160 3.184 -20.688 1.00 12.45 C ATOM 1243 O LEU A 459 -2.175 2.010 -20.304 1.00 12.96 O ATOM 1244 CB LEU A 459 -4.226 4.101 -21.811 1.00 11.59 C ATOM 1245 CG LEU A 459 -4.826 4.856 -23.007 1.00 11.83 C ATOM 1246 CD1 LEU A 459 -6.317 4.740 -23.060 1.00 12.45 C ATOM 1247 CD2 LEU A 459 -4.376 6.332 -22.992 1.00 10.41 C ATOM 1248 H LEU A 459 -3.585 1.647 -22.726 1.00 0.00 H ATOM 1249 N PRO A 460 -1.567 4.179 -19.983 1.00 12.23 N ATOM 1250 CA PRO A 460 -0.882 3.890 -18.718 1.00 12.57 C ATOM 1251 C PRO A 460 -1.815 3.354 -17.638 1.00 12.17 C ATOM 1252 O PRO A 460 -2.954 3.806 -17.499 1.00 12.17 O ATOM 1253 CB PRO A 460 -0.314 5.249 -18.301 1.00 12.77 C ATOM 1254 CG PRO A 460 -0.289 6.046 -19.556 1.00 11.88 C ATOM 1255 CD PRO A 460 -1.487 5.613 -20.316 1.00 13.06 C ATOM 1256 N ILE A 461 -1.301 2.380 -16.899 1.00 12.35 N ATOM 1257 CA ILE A 461 -2.014 1.768 -15.785 1.00 12.73 C ATOM 1258 C ILE A 461 -1.143 1.968 -14.551 1.00 12.61 C ATOM 1259 O ILE A 461 -0.037 1.432 -14.461 1.00 14.13 O ATOM 1260 CB ILE A 461 -2.313 0.274 -16.038 1.00 12.95 C ATOM 1261 CG1 ILE A 461 -3.130 0.109 -17.328 1.00 13.52 C ATOM 1262 CG2 ILE A 461 -3.059 -0.375 -14.829 1.00 13.23 C ATOM 1263 CD1 ILE A 461 -3.486 -1.328 -17.668 1.00 17.59 C ATOM 1264 H ILE A 461 -0.345 2.037 -17.125 1.00 0.00 H ATOM 1265 N VAL A 462 -1.663 2.735 -13.595 1.00 11.99 N ATOM 1266 CA VAL A 462 -0.898 3.233 -12.453 1.00 11.80 C ATOM 1267 C VAL A 462 -1.571 2.762 -11.174 1.00 10.83 C ATOM 1268 O VAL A 462 -2.779 2.926 -11.001 1.00 11.29 O ATOM 1269 CB VAL A 462 -0.857 4.787 -12.488 1.00 11.97 C ATOM 1270 CG1 VAL A 462 -0.315 5.375 -11.184 1.00 13.43 C ATOM 1271 CG2 VAL A 462 0.008 5.252 -13.679 1.00 12.62 C ATOM 1272 H VAL A 462 -2.668 2.994 -13.664 1.00 0.00 H ATOM 1273 N GLU A 463 -0.784 2.161 -10.287 1.00 10.38 N ATOM 1274 CA GLU A 463 -1.291 1.787 -8.964 1.00 9.52 C ATOM 1275 C GLU A 463 -1.250 2.964 -7.993 1.00 9.37 C ATOM 1276 O GLU A 463 -0.203 3.567 -7.769 1.00 9.53 O ATOM 1277 CB GLU A 463 -0.456 0.645 -8.389 1.00 9.08 C ATOM 1278 CG GLU A 463 -0.948 0.158 -7.024 1.00 10.68 C ATOM 1279 CD GLU A 463 -0.095 -0.964 -6.467 1.00 13.38 C ATOM 1280 OE1 GLU A 463 1.096 -0.710 -6.186 1.00 17.38 O ATOM 1281 OE2 GLU A 463 -0.616 -2.088 -6.320 1.00 14.58 O ATOM 1282 H GLU A 463 0.204 1.954 -10.535 1.00 0.00 H ATOM 1283 N VAL A 464 -2.402 3.277 -7.411 1.00 8.35 N ATOM 1284 CA VAL A 464 -2.475 4.258 -6.323 1.00 9.02 C ATOM 1285 C VAL A 464 -3.051 3.696 -5.022 1.00 8.90 C ATOM 1286 O VAL A 464 -2.929 4.318 -3.958 1.00 8.58 O ATOM 1287 CB VAL A 464 -3.202 5.571 -6.750 1.00 8.30 C ATOM 1288 CG1 VAL A 464 -2.333 6.325 -7.780 1.00 9.34 C ATOM 1289 CG2 VAL A 464 -4.603 5.295 -7.305 1.00 9.38 C ATOM 1290 H VAL A 464 -3.275 2.814 -7.735 1.00 0.00 H ATOM 1291 N ILE A 465 -3.652 2.515 -5.094 1.00 8.67 N ATOM 1292 CA ILE A 465 -4.149 1.822 -3.892 1.00 9.25 C ATOM 1293 C ILE A 465 -3.400 0.506 -3.772 1.00 9.74 C ATOM 1294 O ILE A 465 -3.631 -0.401 -4.583 1.00 10.07 O ATOM 1295 CB ILE A 465 -5.674 1.510 -3.967 1.00 9.26 C ATOM 1296 CG1 ILE A 465 -6.489 2.725 -4.450 1.00 8.94 C ATOM 1297 CG2 ILE A 465 -6.187 0.950 -2.615 1.00 10.34 C ATOM 1298 CD1 ILE A 465 -6.374 3.981 -3.551 1.00 9.31 C ATOM 1299 H ILE A 465 -3.776 2.066 -6.024 1.00 0.00 H ATOM 1300 N ALA A 466 -2.494 0.393 -2.799 1.00 9.50 N ATOM 1301 CA ALA A 466 -1.804 -0.883 -2.571 1.00 9.83 C ATOM 1302 C ALA A 466 -2.775 -1.896 -1.966 1.00 9.77 C ATOM 1303 O ALA A 466 -3.645 -1.542 -1.169 1.00 9.66 O ATOM 1304 CB ALA A 466 -0.616 -0.680 -1.647 1.00 10.38 C ATOM 1305 H ALA A 466 -2.275 1.213 -2.199 1.00 0.00 H ATOM 1306 N GLY A 467 -2.624 -3.161 -2.351 1.00 9.63 N ATOM 1307 CA GLY A 467 -3.509 -4.197 -1.853 1.00 10.13 C ATOM 1308 C GLY A 467 -3.687 -5.337 -2.830 1.00 10.97 C ATOM 1309 O GLY A 467 -3.893 -6.488 -2.417 1.00 11.17 O ATOM 1310 H GLY A 467 -1.864 -3.409 -3.016 1.00 0.00 H ATOM 1311 N GLY A 468 -3.607 -5.025 -4.121 1.00 10.97 N ATOM 1312 CA GLY A 468 -3.809 -6.031 -5.168 1.00 11.77 C ATOM 1313 C GLY A 468 -2.608 -6.211 -6.078 1.00 12.60 C ATOM 1314 O GLY A 468 -1.460 -6.057 -5.666 1.00 13.07 O ATOM 1315 H GLY A 468 -3.396 -4.044 -4.394 1.00 0.00 H ATOM 1316 N ASN A 469 -2.885 -6.585 -7.326 1.00 13.80 N ATOM 1317 CA ASN A 469 -1.839 -6.805 -8.321 1.00 14.81 C ATOM 1318 C ASN A 469 -2.330 -6.327 -9.669 1.00 14.54 C ATOM 1319 O ASN A 469 -3.043 -7.053 -10.375 1.00 14.28 O ATOM 1320 CB ASN A 469 -1.442 -8.282 -8.399 1.00 15.90 C ATOM 1321 CG ASN A 469 -0.215 -8.512 -9.279 1.00 18.48 C ATOM 1322 OD1 ASN A 469 0.141 -7.677 -10.124 1.00 20.41 O ATOM 1323 ND2 ASN A 469 0.452 -9.651 -9.069 1.00 23.36 N ATOM 1324 HD22 ASN A 469 0.118 -10.324 -8.350 1.00 0.00 H ATOM 1325 HD21 ASN A 469 1.305 -9.864 -9.625 1.00 0.00 H ATOM 1326 H ASN A 469 -3.878 -6.725 -7.601 1.00 0.00 H ATOM 1327 N ILE A 470 -1.938 -5.108 -10.014 1.00 14.82 N ATOM 1328 CA ILE A 470 -2.521 -4.415 -11.171 1.00 15.61 C ATOM 1329 C ILE A 470 -2.055 -5.008 -12.497 1.00 15.96 C ATOM 1330 O ILE A 470 -2.645 -4.699 -13.539 1.00 16.08 O ATOM 1331 CB ILE A 470 -2.295 -2.863 -11.156 1.00 15.11 C ATOM 1332 CG1 ILE A 470 -0.802 -2.501 -11.200 1.00 16.26 C ATOM 1333 CG2 ILE A 470 -3.030 -2.225 -9.963 1.00 16.23 C ATOM 1334 CD1 ILE A 470 -0.509 -1.123 -11.809 1.00 18.20 C ATOM 1335 H ILE A 470 -1.202 -4.632 -9.454 1.00 0.00 H ATOM 1336 N SER A 471 -1.031 -5.865 -12.447 1.00 16.42 N ATOM 1337 CA SER A 471 -0.603 -6.588 -13.646 1.00 17.83 C ATOM 1338 C SER A 471 -1.590 -7.703 -13.986 1.00 18.08 C ATOM 1339 O SER A 471 -1.648 -8.143 -15.143 1.00 19.01 O ATOM 1340 CB SER A 471 0.833 -7.111 -13.507 1.00 17.97 C ATOM 1341 OG SER A 471 0.930 -8.175 -12.582 1.00 21.70 O ATOM 1342 HG SER A 471 0.629 -7.865 -11.691 1.00 0.00 H ATOM 1343 H SER A 471 -0.533 -6.020 -11.547 1.00 0.00 H ATOM 1344 N GLU A 472 -2.390 -8.125 -12.997 1.00 18.00 N ATOM 1345 CA GLU A 472 -3.392 -9.185 -13.158 1.00 18.42 C ATOM 1346 C GLU A 472 -4.801 -8.644 -13.475 1.00 17.68 C ATOM 1347 O GLU A 472 -5.487 -9.136 -14.376 1.00 18.17 O ATOM 1348 CB GLU A 472 -3.466 -10.058 -11.893 1.00 19.26 C ATOM 1349 CG GLU A 472 -2.173 -10.754 -11.467 1.00 22.75 C ATOM 1350 CD GLU A 472 -2.307 -11.476 -10.129 1.00 26.80 C ATOM 1351 OE1 GLU A 472 -3.355 -11.338 -9.455 1.00 29.06 O ATOM 1352 OE2 GLU A 472 -1.357 -12.189 -9.745 1.00 29.44 O ATOM 1353 H GLU A 472 -2.295 -7.676 -12.064 1.00 0.00 H ATOM 1354 N SER A 473 -5.235 -7.631 -12.727 1.00 16.59 N ATOM 1355 CA SER A 473 -6.580 -7.086 -12.866 1.00 15.58 C ATOM 1356 C SER A 473 -6.626 -5.808 -12.044 1.00 14.20 C ATOM 1357 O SER A 473 -5.738 -5.573 -11.229 1.00 14.18 O ATOM 1358 CB SER A 473 -7.620 -8.070 -12.324 1.00 16.27 C ATOM 1359 OG SER A 473 -7.507 -8.207 -10.918 1.00 17.90 O ATOM 1360 HG SER A 473 -7.649 -7.326 -10.489 1.00 0.00 H ATOM 1361 H SER A 473 -4.594 -7.216 -12.021 1.00 0.00 H ATOM 1362 N ALA A 474 -7.666 -5.003 -12.254 1.00 12.70 N ATOM 1363 CA ALA A 474 -7.886 -3.808 -11.436 1.00 11.62 C ATOM 1364 C ALA A 474 -8.100 -4.213 -9.987 1.00 11.50 C ATOM 1365 O ALA A 474 -8.779 -5.210 -9.708 1.00 11.76 O ATOM 1366 CB ALA A 474 -9.070 -3.026 -11.937 1.00 10.80 C ATOM 1367 H ALA A 474 -8.337 -5.228 -13.016 1.00 0.00 H ATOM 1368 N TYR A 475 -7.496 -3.455 -9.075 1.00 10.82 N ATOM 1369 CA TYR A 475 -7.695 -3.714 -7.655 1.00 10.47 C ATOM 1370 C TYR A 475 -8.759 -2.754 -7.118 1.00 10.25 C ATOM 1371 O TYR A 475 -8.535 -1.540 -7.032 1.00 10.27 O ATOM 1372 CB TYR A 475 -6.398 -3.645 -6.829 1.00 10.89 C ATOM 1373 CG TYR A 475 -6.734 -3.851 -5.373 1.00 10.26 C ATOM 1374 CD1 TYR A 475 -7.263 -5.073 -4.946 1.00 11.44 C ATOM 1375 CD2 TYR A 475 -6.611 -2.814 -4.442 1.00 9.53 C ATOM 1376 CE1 TYR A 475 -7.629 -5.276 -3.628 1.00 10.41 C ATOM 1377 CE2 TYR A 475 -6.978 -3.007 -3.103 1.00 9.02 C ATOM 1378 CZ TYR A 475 -7.497 -4.245 -2.722 1.00 9.50 C ATOM 1379 OH TYR A 475 -7.898 -4.502 -1.429 1.00 10.16 O ATOM 1380 HH TYR A 475 -8.233 -5.431 -1.367 1.00 0.00 H ATOM 1381 H TYR A 475 -6.879 -2.674 -9.377 1.00 0.00 H ATOM 1382 N THR A 476 -9.900 -3.316 -6.737 1.00 11.27 N ATOM 1383 CA THR A 476 -11.090 -2.515 -6.442 1.00 11.57 C ATOM 1384 C THR A 476 -11.381 -2.347 -4.957 1.00 11.47 C ATOM 1385 O THR A 476 -12.305 -1.611 -4.588 1.00 12.98 O ATOM 1386 CB THR A 476 -12.361 -3.096 -7.125 1.00 12.09 C ATOM 1387 OG1 THR A 476 -12.738 -4.318 -6.482 1.00 14.21 O ATOM 1388 CG2 THR A 476 -12.096 -3.374 -8.603 1.00 12.93 C ATOM 1389 HG1 THR A 476 -11.997 -4.971 -6.556 1.00 0.00 H ATOM 1390 H THR A 476 -9.950 -4.351 -6.646 1.00 0.00 H ATOM 1391 N GLY A 477 -10.597 -3.010 -4.113 1.00 10.77 N ATOM 1392 CA GLY A 477 -10.850 -2.993 -2.661 1.00 10.72 C ATOM 1393 C GLY A 477 -10.192 -1.862 -1.893 1.00 10.12 C ATOM 1394 O GLY A 477 -9.605 -0.938 -2.464 1.00 10.78 O ATOM 1395 H GLY A 477 -9.790 -3.551 -4.484 1.00 0.00 H ATOM 1396 N ASP A 478 -10.309 -1.941 -0.571 1.00 10.33 N ATOM 1397 CA ASP A 478 -9.655 -0.967 0.311 1.00 9.74 C ATOM 1398 C ASP A 478 -8.145 -1.228 0.332 1.00 10.44 C ATOM 1399 O ASP A 478 -7.650 -2.244 -0.158 1.00 10.08 O ATOM 1400 CB ASP A 478 -10.267 -1.047 1.721 1.00 9.85 C ATOM 1401 CG ASP A 478 -10.124 0.261 2.549 1.00 8.97 C ATOM 1402 OD1 ASP A 478 -9.220 1.116 2.343 1.00 7.64 O ATOM 1403 OD2 ASP A 478 -10.934 0.406 3.489 1.00 9.94 O ATOM 1404 H ASP A 478 -10.875 -2.708 -0.154 1.00 0.00 H ATOM 1405 N GLY A 479 -7.398 -0.285 0.886 1.00 9.84 N ATOM 1406 CA GLY A 479 -5.965 -0.423 0.891 1.00 9.86 C ATOM 1407 C GLY A 479 -5.294 0.795 1.444 1.00 10.16 C ATOM 1408 O GLY A 479 -5.854 1.496 2.285 1.00 10.85 O ATOM 1409 H GLY A 479 -7.844 0.551 1.315 1.00 0.00 H ATOM 1410 N ILE A 480 -4.100 1.047 0.936 1.00 10.09 N ATOM 1411 CA ILE A 480 -3.252 2.127 1.408 1.00 10.11 C ATOM 1412 C ILE A 480 -2.721 2.909 0.205 1.00 9.98 C ATOM 1413 O ILE A 480 -2.196 2.323 -0.748 1.00 10.62 O ATOM 1414 CB ILE A 480 -2.089 1.587 2.281 1.00 10.46 C ATOM 1415 CG1 ILE A 480 -2.646 1.001 3.586 1.00 11.45 C ATOM 1416 CG2 ILE A 480 -1.051 2.669 2.568 1.00 11.44 C ATOM 1417 CD1 ILE A 480 -3.133 2.049 4.583 1.00 12.53 C ATOM 1418 H ILE A 480 -3.752 0.444 0.163 1.00 0.00 H ATOM 1419 N LEU A 481 -2.830 4.236 0.282 1.00 9.28 N ATOM 1420 CA LEU A 481 -2.461 5.100 -0.842 1.00 8.16 C ATOM 1421 C LEU A 481 -0.956 5.093 -1.110 1.00 8.67 C ATOM 1422 O LEU A 481 -0.133 5.237 -0.186 1.00 8.81 O ATOM 1423 CB LEU A 481 -2.932 6.529 -0.582 1.00 8.53 C ATOM 1424 CG LEU A 481 -4.347 6.908 -1.041 1.00 7.49 C ATOM 1425 CD1 LEU A 481 -4.398 7.115 -2.567 1.00 9.64 C ATOM 1426 CD2 LEU A 481 -5.387 5.858 -0.601 1.00 10.32 C ATOM 1427 H LEU A 481 -3.185 4.667 1.159 1.00 0.00 H ATOM 1428 N VAL A 482 -0.618 4.926 -2.389 1.00 8.25 N ATOM 1429 CA VAL A 482 0.758 4.978 -2.887 1.00 8.54 C ATOM 1430 C VAL A 482 0.775 5.853 -4.136 1.00 8.47 C ATOM 1431 O VAL A 482 -0.268 6.032 -4.778 1.00 8.57 O ATOM 1432 CB VAL A 482 1.305 3.571 -3.209 1.00 8.04 C ATOM 1433 CG1 VAL A 482 1.430 2.745 -1.918 1.00 7.44 C ATOM 1434 CG2 VAL A 482 0.405 2.817 -4.239 1.00 8.60 C ATOM 1435 H VAL A 482 -1.379 4.748 -3.075 1.00 0.00 H ATOM 1436 N ASN A 483 1.942 6.413 -4.461 1.00 8.30 N ATOM 1437 CA ASN A 483 2.137 7.213 -5.683 1.00 8.89 C ATOM 1438 C ASN A 483 1.157 8.385 -5.776 1.00 8.86 C ATOM 1439 O ASN A 483 0.756 8.801 -6.877 1.00 9.42 O ATOM 1440 CB ASN A 483 2.048 6.312 -6.939 1.00 9.42 C ATOM 1441 CG ASN A 483 2.967 5.084 -6.861 1.00 11.77 C ATOM 1442 OD1 ASN A 483 2.551 3.946 -7.149 1.00 13.11 O ATOM 1443 ND2 ASN A 483 4.210 5.302 -6.473 1.00 11.49 N ATOM 1444 HD22 ASN A 483 4.521 6.267 -6.241 1.00 0.00 H ATOM 1445 HD21 ASN A 483 4.879 4.509 -6.400 1.00 0.00 H ATOM 1446 H ASN A 483 2.751 6.279 -3.822 1.00 0.00 H ATOM 1447 N SER A 484 0.796 8.921 -4.609 1.00 8.51 N ATOM 1448 CA SER A 484 -0.252 9.929 -4.481 1.00 8.65 C ATOM 1449 C SER A 484 0.122 11.089 -3.561 1.00 9.44 C ATOM 1450 O SER A 484 -0.755 11.692 -2.935 1.00 9.45 O ATOM 1451 CB SER A 484 -1.561 9.276 -4.013 1.00 9.18 C ATOM 1452 OG SER A 484 -2.034 8.317 -4.956 1.00 8.56 O ATOM 1453 HG SER A 484 -1.354 7.607 -5.073 1.00 0.00 H ATOM 1454 H SER A 484 1.286 8.605 -3.748 1.00 0.00 H ATOM 1455 N ASP A 485 1.416 11.410 -3.504 1.00 9.62 N ATOM 1456 CA ASP A 485 1.904 12.625 -2.816 1.00 11.00 C ATOM 1457 C ASP A 485 1.311 12.753 -1.400 1.00 10.02 C ATOM 1458 O ASP A 485 1.585 11.890 -0.558 1.00 10.38 O ATOM 1459 CB ASP A 485 1.647 13.882 -3.677 1.00 11.90 C ATOM 1460 CG ASP A 485 2.387 15.122 -3.167 1.00 15.91 C ATOM 1461 OD1 ASP A 485 3.308 14.990 -2.329 1.00 21.92 O ATOM 1462 OD2 ASP A 485 2.044 16.233 -3.626 1.00 21.76 O ATOM 1463 H ASP A 485 2.108 10.782 -3.961 1.00 0.00 H ATOM 1464 N TYR A 486 0.502 13.795 -1.151 1.00 10.07 N ATOM 1465 CA TYR A 486 -0.006 14.094 0.190 1.00 9.82 C ATOM 1466 C TYR A 486 -1.071 13.124 0.694 1.00 9.70 C ATOM 1467 O TYR A 486 -1.514 13.225 1.846 1.00 10.73 O ATOM 1468 CB TYR A 486 -0.533 15.539 0.296 1.00 10.50 C ATOM 1469 CG TYR A 486 -1.398 15.930 -0.865 1.00 11.37 C ATOM 1470 CD1 TYR A 486 -2.737 15.559 -0.899 1.00 12.57 C ATOM 1471 CD2 TYR A 486 -0.884 16.666 -1.934 1.00 11.48 C ATOM 1472 CE1 TYR A 486 -3.546 15.909 -1.969 1.00 13.84 C ATOM 1473 CE2 TYR A 486 -1.689 17.026 -3.011 1.00 13.77 C ATOM 1474 CZ TYR A 486 -3.014 16.639 -3.014 1.00 13.27 C ATOM 1475 OH TYR A 486 -3.838 16.981 -4.070 1.00 15.15 O ATOM 1476 HH TYR A 486 -3.879 17.967 -4.149 1.00 0.00 H ATOM 1477 H TYR A 486 0.225 14.413 -1.940 1.00 0.00 H ATOM 1478 N LEU A 487 -1.468 12.171 -0.147 1.00 8.97 N ATOM 1479 CA LEU A 487 -2.384 11.120 0.286 1.00 8.43 C ATOM 1480 C LEU A 487 -1.657 9.862 0.761 1.00 8.53 C ATOM 1481 O LEU A 487 -2.290 8.987 1.344 1.00 8.44 O ATOM 1482 CB LEU A 487 -3.348 10.735 -0.849 1.00 8.00 C ATOM 1483 CG LEU A 487 -4.202 11.795 -1.520 1.00 7.17 C ATOM 1484 CD1 LEU A 487 -5.063 11.171 -2.648 1.00 9.26 C ATOM 1485 CD2 LEU A 487 -5.088 12.530 -0.518 1.00 9.13 C ATOM 1486 H LEU A 487 -1.120 12.175 -1.127 1.00 0.00 H ATOM 1487 N ASN A 488 -0.353 9.764 0.492 1.00 9.05 N ATOM 1488 CA ASN A 488 0.406 8.522 0.721 1.00 9.23 C ATOM 1489 C ASN A 488 0.276 8.032 2.146 1.00 9.72 C ATOM 1490 O ASN A 488 0.437 8.810 3.097 1.00 9.62 O ATOM 1491 CB ASN A 488 1.907 8.677 0.375 1.00 9.62 C ATOM 1492 CG ASN A 488 2.174 8.730 -1.125 1.00 10.25 C ATOM 1493 OD1 ASN A 488 3.284 9.082 -1.569 1.00 12.58 O ATOM 1494 ND2 ASN A 488 1.179 8.362 -1.913 1.00 8.82 N ATOM 1495 HD22 ASN A 488 0.268 8.075 -1.501 1.00 0.00 H ATOM 1496 HD21 ASN A 488 1.307 8.359 -2.945 1.00 0.00 H ATOM 1497 H ASN A 488 0.144 10.593 0.108 1.00 0.00 H ATOM 1498 N GLY A 489 -0.035 6.744 2.277 1.00 8.83 N ATOM 1499 CA GLY A 489 -0.145 6.095 3.584 1.00 9.26 C ATOM 1500 C GLY A 489 -1.545 6.094 4.153 1.00 9.29 C ATOM 1501 O GLY A 489 -1.810 5.398 5.136 1.00 10.08 O ATOM 1502 H GLY A 489 -0.206 6.179 1.420 1.00 0.00 H ATOM 1503 N MET A 490 -2.445 6.882 3.565 1.00 8.85 N ATOM 1504 CA MET A 490 -3.829 6.930 4.035 1.00 9.49 C ATOM 1505 C MET A 490 -4.627 5.713 3.585 1.00 9.74 C ATOM 1506 O MET A 490 -4.303 5.098 2.561 1.00 9.50 O ATOM 1507 CB MET A 490 -4.541 8.179 3.501 1.00 9.98 C ATOM 1508 CG MET A 490 -4.019 9.497 4.057 1.00 10.09 C ATOM 1509 SD MET A 490 -4.988 10.878 3.444 1.00 11.85 S ATOM 1510 CE MET A 490 -4.032 12.257 4.089 1.00 13.01 C ATOM 1511 H MET A 490 -2.158 7.473 2.758 1.00 0.00 H ATOM 1512 N SER A 491 -5.680 5.383 4.345 1.00 9.40 N ATOM 1513 CA SER A 491 -6.683 4.413 3.910 1.00 9.83 C ATOM 1514 C SER A 491 -7.527 5.035 2.800 1.00 9.58 C ATOM 1515 O SER A 491 -7.496 6.252 2.586 1.00 9.75 O ATOM 1516 CB SER A 491 -7.599 4.058 5.071 1.00 10.48 C ATOM 1517 OG SER A 491 -8.363 5.202 5.455 1.00 11.85 O ATOM 1518 HG SER A 491 -8.956 4.963 6.211 1.00 0.00 H ATOM 1519 H SER A 491 -5.787 5.833 5.277 1.00 0.00 H ATOM 1520 N VAL A 492 -8.309 4.210 2.114 1.00 10.09 N ATOM 1521 CA VAL A 492 -9.242 4.742 1.130 1.00 10.66 C ATOM 1522 C VAL A 492 -10.240 5.766 1.736 1.00 11.18 C ATOM 1523 O VAL A 492 -10.382 6.883 1.195 1.00 10.76 O ATOM 1524 CB VAL A 492 -9.916 3.598 0.325 1.00 9.93 C ATOM 1525 CG1 VAL A 492 -11.157 4.086 -0.452 1.00 9.84 C ATOM 1526 CG2 VAL A 492 -8.891 2.956 -0.621 1.00 11.29 C ATOM 1527 H VAL A 492 -8.255 3.185 2.279 1.00 0.00 H ATOM 1528 N PRO A 493 -10.898 5.430 2.871 1.00 11.38 N ATOM 1529 CA PRO A 493 -11.837 6.410 3.427 1.00 11.45 C ATOM 1530 C PRO A 493 -11.155 7.732 3.797 1.00 10.82 C ATOM 1531 O PRO A 493 -11.687 8.806 3.520 1.00 11.48 O ATOM 1532 CB PRO A 493 -12.367 5.702 4.683 1.00 11.86 C ATOM 1533 CG PRO A 493 -12.279 4.254 4.339 1.00 13.02 C ATOM 1534 CD PRO A 493 -10.990 4.135 3.573 1.00 12.20 C ATOM 1535 N ALA A 494 -9.971 7.661 4.402 1.00 10.05 N ATOM 1536 CA ALA A 494 -9.228 8.871 4.751 1.00 10.40 C ATOM 1537 C ALA A 494 -8.805 9.672 3.505 1.00 10.36 C ATOM 1538 O ALA A 494 -8.948 10.895 3.457 1.00 10.85 O ATOM 1539 CB ALA A 494 -8.031 8.525 5.613 1.00 10.76 C ATOM 1540 H ALA A 494 -9.568 6.730 4.630 1.00 0.00 H ATOM 1541 N ALA A 495 -8.347 8.965 2.474 1.00 9.83 N ATOM 1542 CA ALA A 495 -7.945 9.614 1.234 1.00 9.06 C ATOM 1543 C ALA A 495 -9.111 10.291 0.515 1.00 8.94 C ATOM 1544 O ALA A 495 -8.940 11.367 -0.046 1.00 8.36 O ATOM 1545 CB ALA A 495 -7.234 8.608 0.324 1.00 7.80 C ATOM 1546 H ALA A 495 -8.275 7.931 2.556 1.00 0.00 H ATOM 1547 N LYS A 496 -10.298 9.674 0.542 1.00 8.86 N ATOM 1548 CA LYS A 496 -11.474 10.299 -0.076 1.00 9.62 C ATOM 1549 C LYS A 496 -11.762 11.663 0.573 1.00 10.49 C ATOM 1550 O LYS A 496 -12.005 12.652 -0.133 1.00 10.44 O ATOM 1551 CB LYS A 496 -12.697 9.386 0.050 1.00 9.66 C ATOM 1552 CG LYS A 496 -12.662 8.137 -0.836 1.00 10.74 C ATOM 1553 CD LYS A 496 -13.919 7.303 -0.644 1.00 13.88 C ATOM 1554 CE LYS A 496 -14.052 6.192 -1.684 1.00 13.68 C ATOM 1555 NZ LYS A 496 -15.190 5.269 -1.348 1.00 18.18 N ATOM 1556 HZ1 LYS A 496 -15.020 4.836 -0.418 1.00 0.00 H ATOM 1557 HZ2 LYS A 496 -16.078 5.810 -1.323 1.00 0.00 H ATOM 1558 HZ3 LYS A 496 -15.256 4.525 -2.071 1.00 0.00 H ATOM 1559 H LYS A 496 -10.388 8.746 1.003 1.00 0.00 H ATOM 1560 N ARG A 497 -11.707 11.708 1.910 1.00 11.00 N ATOM 1561 CA ARG A 497 -11.951 12.949 2.647 1.00 11.41 C ATOM 1562 C ARG A 497 -10.888 14.003 2.329 1.00 11.58 C ATOM 1563 O ARG A 497 -11.213 15.170 2.086 1.00 11.44 O ATOM 1564 CB ARG A 497 -12.012 12.690 4.157 1.00 11.86 C ATOM 1565 CG ARG A 497 -13.271 11.977 4.637 1.00 13.35 C ATOM 1566 CD ARG A 497 -13.299 11.866 6.168 1.00 16.11 C ATOM 1567 NE ARG A 497 -12.350 10.883 6.708 1.00 16.47 N ATOM 1568 CZ ARG A 497 -12.618 9.588 6.853 1.00 17.70 C ATOM 1569 NH1 ARG A 497 -13.803 9.114 6.496 1.00 18.57 N ATOM 1570 NH2 ARG A 497 -11.706 8.767 7.357 1.00 19.16 N ATOM 1571 HE ARG A 497 -11.409 11.221 6.995 1.00 0.00 H ATOM 1572 HH12 ARG A 497 -14.014 8.102 6.609 1.00 0.00 H ATOM 1573 HH11 ARG A 497 -14.522 9.754 6.103 1.00 0.00 H ATOM 1574 HH22 ARG A 497 -11.921 7.756 7.468 1.00 0.00 H ATOM 1575 HH21 ARG A 497 -10.776 9.135 7.641 1.00 0.00 H ATOM 1576 H ARG A 497 -11.485 10.840 2.438 1.00 0.00 H ATOM 1577 N ALA A 498 -9.623 13.588 2.314 1.00 11.07 N ATOM 1578 CA ALA A 498 -8.520 14.503 2.079 1.00 10.60 C ATOM 1579 C ALA A 498 -8.584 15.131 0.694 1.00 10.14 C ATOM 1580 O ALA A 498 -8.391 16.347 0.525 1.00 10.29 O ATOM 1581 CB ALA A 498 -7.193 13.794 2.284 1.00 11.26 C ATOM 1582 H ALA A 498 -9.419 12.581 2.475 1.00 0.00 H ATOM 1583 N ILE A 499 -8.857 14.314 -0.321 1.00 10.03 N ATOM 1584 CA ILE A 499 -8.849 14.797 -1.697 1.00 11.27 C ATOM 1585 C ILE A 499 -10.050 15.706 -1.997 1.00 11.22 C ATOM 1586 O ILE A 499 -9.920 16.677 -2.731 1.00 10.91 O ATOM 1587 CB ILE A 499 -8.694 13.618 -2.726 1.00 11.75 C ATOM 1588 CG1 ILE A 499 -8.231 14.140 -4.098 1.00 13.67 C ATOM 1589 CG2 ILE A 499 -9.952 12.767 -2.789 1.00 11.17 C ATOM 1590 CD1 ILE A 499 -6.847 14.767 -4.105 1.00 14.60 C ATOM 1591 H ILE A 499 -9.079 13.316 -0.130 1.00 0.00 H ATOM 1592 N VAL A 500 -11.207 15.396 -1.409 1.00 11.94 N ATOM 1593 CA VAL A 500 -12.383 16.262 -1.527 1.00 13.35 C ATOM 1594 C VAL A 500 -12.113 17.614 -0.862 1.00 12.88 C ATOM 1595 O VAL A 500 -12.480 18.680 -1.412 1.00 12.78 O ATOM 1596 CB VAL A 500 -13.650 15.593 -0.969 1.00 13.90 C ATOM 1597 CG1 VAL A 500 -14.785 16.606 -0.818 1.00 16.65 C ATOM 1598 CG2 VAL A 500 -14.065 14.464 -1.885 1.00 16.30 C ATOM 1599 H VAL A 500 -11.276 14.519 -0.854 1.00 0.00 H ATOM 1600 N ASP A 501 -11.470 17.577 0.309 1.00 12.96 N ATOM 1601 CA ASP A 501 -11.019 18.789 1.010 1.00 13.42 C ATOM 1602 C ASP A 501 -10.138 19.623 0.082 1.00 12.84 C ATOM 1603 O ASP A 501 -10.329 20.836 -0.077 1.00 13.28 O ATOM 1604 CB ASP A 501 -10.243 18.404 2.284 1.00 14.14 C ATOM 1605 CG ASP A 501 -9.799 19.610 3.109 1.00 16.08 C ATOM 1606 OD1 ASP A 501 -9.110 20.505 2.576 1.00 20.07 O ATOM 1607 OD2 ASP A 501 -10.122 19.640 4.313 1.00 19.15 O ATOM 1608 H ASP A 501 -11.280 16.651 0.743 1.00 0.00 H ATOM 1609 N ARG A 502 -9.168 18.962 -0.554 1.00 12.47 N ATOM 1610 CA ARG A 502 -8.255 19.645 -1.473 1.00 12.74 C ATOM 1611 C ARG A 502 -8.982 20.243 -2.681 1.00 12.40 C ATOM 1612 O ARG A 502 -8.754 21.399 -3.048 1.00 12.75 O ATOM 1613 CB ARG A 502 -7.124 18.709 -1.922 1.00 13.62 C ATOM 1614 CG ARG A 502 -6.010 19.398 -2.712 1.00 16.39 C ATOM 1615 CD ARG A 502 -5.200 20.328 -1.824 1.00 23.14 C ATOM 1616 NE ARG A 502 -4.050 20.871 -2.543 1.00 28.02 N ATOM 1617 CZ ARG A 502 -2.982 21.406 -1.960 1.00 31.47 C ATOM 1618 NH1 ARG A 502 -2.903 21.487 -0.635 1.00 32.65 N ATOM 1619 NH2 ARG A 502 -1.985 21.864 -2.707 1.00 33.07 N ATOM 1620 HE ARG A 502 -4.068 20.837 -3.582 1.00 0.00 H ATOM 1621 HH12 ARG A 502 -2.063 21.907 -0.189 1.00 0.00 H ATOM 1622 HH11 ARG A 502 -3.681 21.130 -0.045 1.00 0.00 H ATOM 1623 HH22 ARG A 502 -1.147 22.283 -2.256 1.00 0.00 H ATOM 1624 HH21 ARG A 502 -2.042 21.803 -3.744 1.00 0.00 H ATOM 1625 H ARG A 502 -9.058 17.940 -0.393 1.00 0.00 H ATOM 1626 N LEU A 503 -9.875 19.459 -3.284 1.00 11.97 N ATOM 1627 CA LEU A 503 -10.675 19.934 -4.412 1.00 11.99 C ATOM 1628 C LEU A 503 -11.491 21.162 -4.022 1.00 12.25 C ATOM 1629 O LEU A 503 -11.535 22.142 -4.766 1.00 12.10 O ATOM 1630 CB LEU A 503 -11.588 18.829 -4.951 1.00 12.73 C ATOM 1631 CG LEU A 503 -10.910 17.721 -5.759 1.00 13.26 C ATOM 1632 CD1 LEU A 503 -11.899 16.586 -5.911 1.00 15.14 C ATOM 1633 CD2 LEU A 503 -10.401 18.203 -7.133 1.00 14.82 C ATOM 1634 H LEU A 503 -10.006 18.485 -2.944 1.00 0.00 H ATOM 1635 N GLU A 504 -12.102 21.126 -2.847 1.00 13.01 N ATOM 1636 CA GLU A 504 -12.885 22.281 -2.404 1.00 13.99 C ATOM 1637 C GLU A 504 -12.015 23.496 -2.148 1.00 14.22 C ATOM 1638 O GLU A 504 -12.388 24.630 -2.497 1.00 14.67 O ATOM 1639 CB GLU A 504 -13.667 21.947 -1.143 1.00 14.61 C ATOM 1640 CG GLU A 504 -14.909 21.161 -1.404 1.00 16.15 C ATOM 1641 CD GLU A 504 -15.944 21.343 -0.310 1.00 16.15 C ATOM 1642 OE1 GLU A 504 -15.573 21.315 0.888 1.00 18.23 O ATOM 1643 OE2 GLU A 504 -17.123 21.514 -0.658 1.00 12.35 O ATOM 1644 H GLU A 504 -12.026 20.283 -2.243 1.00 0.00 H ATOM 1645 N SER A 505 -10.868 23.283 -1.515 1.00 14.52 N ATOM 1646 CA SER A 505 -9.970 24.404 -1.245 1.00 15.55 C ATOM 1647 C SER A 505 -9.502 25.091 -2.542 1.00 15.30 C ATOM 1648 O SER A 505 -9.297 26.307 -2.568 1.00 16.07 O ATOM 1649 CB SER A 505 -8.793 23.976 -0.361 1.00 16.18 C ATOM 1650 OG SER A 505 -7.791 23.282 -1.082 1.00 20.93 O ATOM 1651 HG SER A 505 -8.181 22.466 -1.484 1.00 0.00 H ATOM 1652 H SER A 505 -10.609 22.322 -1.212 1.00 0.00 H ATOM 1653 N ALA A 506 -9.372 24.307 -3.616 1.00 13.87 N ATOM 1654 CA ALA A 506 -8.970 24.823 -4.925 1.00 13.19 C ATOM 1655 C ALA A 506 -10.135 25.329 -5.769 1.00 12.51 C ATOM 1656 O ALA A 506 -9.919 25.927 -6.820 1.00 13.53 O ATOM 1657 CB ALA A 506 -8.212 23.753 -5.698 1.00 13.81 C ATOM 1658 H ALA A 506 -9.564 23.290 -3.518 1.00 0.00 H ATOM 1659 N GLY A 507 -11.364 25.072 -5.316 1.00 11.97 N ATOM 1660 CA GLY A 507 -12.553 25.440 -6.068 1.00 12.16 C ATOM 1661 C GLY A 507 -12.829 24.561 -7.277 1.00 12.07 C ATOM 1662 O GLY A 507 -13.549 24.971 -8.178 1.00 11.96 O ATOM 1663 H GLY A 507 -11.474 24.595 -4.399 1.00 0.00 H ATOM 1664 N ARG A 508 -12.299 23.338 -7.269 1.00 11.91 N ATOM 1665 CA ARG A 508 -12.343 22.461 -8.451 1.00 11.73 C ATOM 1666 C ARG A 508 -13.172 21.187 -8.277 1.00 12.03 C ATOM 1667 O ARG A 508 -13.223 20.349 -9.176 1.00 12.04 O ATOM 1668 CB ARG A 508 -10.912 22.096 -8.905 1.00 11.71 C ATOM 1669 CG ARG A 508 -9.940 23.289 -9.125 1.00 12.14 C ATOM 1670 CD ARG A 508 -10.434 24.241 -10.198 1.00 12.24 C ATOM 1671 NE ARG A 508 -10.349 23.618 -11.524 1.00 13.29 N ATOM 1672 CZ ARG A 508 -10.795 24.160 -12.656 1.00 15.79 C ATOM 1673 NH1 ARG A 508 -11.379 25.350 -12.657 1.00 16.91 N ATOM 1674 NH2 ARG A 508 -10.647 23.501 -13.798 1.00 16.16 N ATOM 1675 HE ARG A 508 -9.906 22.679 -11.585 1.00 0.00 H ATOM 1676 HH12 ARG A 508 -11.722 25.760 -13.549 1.00 0.00 H ATOM 1677 HH11 ARG A 508 -11.494 25.874 -11.766 1.00 0.00 H ATOM 1678 HH22 ARG A 508 -10.992 23.917 -14.687 1.00 0.00 H ATOM 1679 HH21 ARG A 508 -10.186 22.569 -13.804 1.00 0.00 H ATOM 1680 H ARG A 508 -11.841 22.993 -6.402 1.00 0.00 H ATOM 1681 N GLY A 509 -13.860 21.043 -7.148 1.00 11.16 N ATOM 1682 CA GLY A 509 -14.691 19.864 -6.947 1.00 11.29 C ATOM 1683 C GLY A 509 -15.594 19.973 -5.731 1.00 10.11 C ATOM 1684 O GLY A 509 -15.470 20.913 -4.938 1.00 10.49 O ATOM 1685 H GLY A 509 -13.805 21.772 -6.409 1.00 0.00 H ATOM 1686 N ARG A 510 -16.482 18.999 -5.599 1.00 9.84 N ATOM 1687 CA ARG A 510 -17.456 18.926 -4.510 1.00 9.53 C ATOM 1688 C ARG A 510 -17.720 17.464 -4.200 1.00 10.05 C ATOM 1689 O ARG A 510 -17.636 16.610 -5.094 1.00 10.45 O ATOM 1690 CB ARG A 510 -18.785 19.555 -4.935 1.00 9.83 C ATOM 1691 CG ARG A 510 -18.797 21.068 -5.164 1.00 9.57 C ATOM 1692 CD ARG A 510 -18.556 21.839 -3.885 1.00 10.74 C ATOM 1693 NE ARG A 510 -18.728 23.268 -4.118 1.00 11.22 N ATOM 1694 CZ ARG A 510 -18.357 24.213 -3.258 1.00 11.25 C ATOM 1695 NH1 ARG A 510 -17.784 23.888 -2.092 1.00 11.88 N ATOM 1696 NH2 ARG A 510 -18.566 25.492 -3.570 1.00 12.14 N ATOM 1697 HE ARG A 510 -19.168 23.567 -5.012 1.00 0.00 H ATOM 1698 HH12 ARG A 510 -17.498 24.635 -1.427 1.00 0.00 H ATOM 1699 HH11 ARG A 510 -17.625 22.889 -1.851 1.00 0.00 H ATOM 1700 HH22 ARG A 510 -18.281 26.242 -2.908 1.00 0.00 H ATOM 1701 HH21 ARG A 510 -19.014 25.740 -4.475 1.00 0.00 H ATOM 1702 H ARG A 510 -16.487 18.242 -6.312 1.00 0.00 H ATOM 1703 N ALA A 511 -18.060 17.172 -2.948 1.00 10.94 N ATOM 1704 CA ALA A 511 -18.674 15.891 -2.599 1.00 12.12 C ATOM 1705 C ALA A 511 -20.104 15.893 -3.119 1.00 12.72 C ATOM 1706 O ALA A 511 -20.791 16.911 -3.048 1.00 11.90 O ATOM 1707 CB ALA A 511 -18.666 15.685 -1.092 1.00 11.80 C ATOM 1708 H ALA A 511 -17.885 17.872 -2.199 1.00 0.00 H ATOM 1709 N ARG A 512 -20.555 14.769 -3.668 1.00 13.83 N ATOM 1710 CA ARG A 512 -21.934 14.660 -4.165 1.00 15.14 C ATOM 1711 C ARG A 512 -22.484 13.259 -3.913 1.00 16.52 C ATOM 1712 O ARG A 512 -21.755 12.276 -4.087 1.00 16.52 O ATOM 1713 CB ARG A 512 -22.014 15.002 -5.671 1.00 15.00 C ATOM 1714 CG ARG A 512 -21.801 16.480 -6.048 1.00 14.84 C ATOM 1715 CD ARG A 512 -22.906 17.379 -5.490 1.00 11.54 C ATOM 1716 NE ARG A 512 -22.798 18.781 -5.902 1.00 10.18 N ATOM 1717 CZ ARG A 512 -22.486 19.788 -5.089 1.00 7.40 C ATOM 1718 NH1 ARG A 512 -22.208 19.553 -3.810 1.00 3.27 N ATOM 1719 NH2 ARG A 512 -22.447 21.035 -5.550 1.00 11.54 N ATOM 1720 HE ARG A 512 -22.978 19.006 -6.901 1.00 0.00 H ATOM 1721 HH12 ARG A 512 -21.965 20.342 -3.177 1.00 0.00 H ATOM 1722 HH11 ARG A 512 -22.234 18.580 -3.442 1.00 0.00 H ATOM 1723 HH22 ARG A 512 -22.203 21.818 -4.911 1.00 0.00 H ATOM 1724 HH21 ARG A 512 -22.661 21.227 -6.550 1.00 0.00 H ATOM 1725 H ARG A 512 -19.919 13.950 -3.747 1.00 0.00 H ATOM 1726 N ILE A 513 -23.753 13.179 -3.499 1.00 17.51 N ATOM 1727 CA ILE A 513 -24.438 11.910 -3.209 1.00 20.13 C ATOM 1728 C ILE A 513 -24.445 11.046 -4.470 1.00 21.28 C ATOM 1729 O ILE A 513 -24.799 11.525 -5.550 1.00 22.74 O ATOM 1730 CB ILE A 513 -25.889 12.120 -2.723 1.00 20.81 C ATOM 1731 CG1 ILE A 513 -25.902 12.844 -1.378 1.00 21.52 C ATOM 1732 CG2 ILE A 513 -26.611 10.771 -2.611 1.00 21.97 C ATOM 1733 CD1 ILE A 513 -27.223 13.519 -1.048 1.00 25.01 C ATOM 1734 OXT ILE A 513 -24.078 9.867 -4.441 1.00 22.71 O ATOM 1735 H ILE A 513 -24.286 14.064 -3.375 1.00 0.00 H TER 1736 ILE A 513 HETATM 1737 O HOH 1 -20.103 12.178 -0.525 1.00 43.67 O HETATM 1738 O HOH 2 -17.398 12.446 -0.826 1.00 33.63 O HETATM 1739 O HOH 3 -9.171 21.287 -12.567 1.00 14.05 O HETATM 1740 O HOH 4 -7.114 20.596 -14.214 1.00 14.36 O HETATM 1741 O HOH 5 -9.865 25.791 -16.952 1.00 34.62 O HETATM 1742 O HOH 6 -7.641 24.703 -13.070 1.00 34.92 O HETATM 1743 O HOH 7 -6.903 20.590 -24.729 1.00 29.20 O HETATM 1744 O HOH 8 1.198 15.105 -23.547 1.00 47.53 O HETATM 1745 O HOH 9 1.167 20.184 -19.677 1.00 60.00 O HETATM 1746 O HOH 10 -8.994 22.516 -26.056 1.00 38.16 O HETATM 1747 O HOH 11 -18.023 19.470 -18.319 1.00 24.90 O HETATM 1748 O HOH 12 -12.664 27.017 -14.474 1.00 32.92 O HETATM 1749 O HOH 13 -18.965 16.722 -18.193 1.00 19.25 O HETATM 1750 O HOH 14 -15.051 8.951 -12.962 1.00 7.80 O HETATM 1751 O HOH 15 -16.550 3.593 -3.135 1.00 20.56 O HETATM 1752 O HOH 16 -16.804 2.833 -6.003 1.00 17.31 O HETATM 1753 O HOH 17 -14.550 0.946 -6.005 1.00 16.99 O HETATM 1754 O HOH 18 -9.402 0.168 -4.912 1.00 11.79 O HETATM 1755 O HOH 19 -4.715 8.851 -5.898 1.00 8.37 O HETATM 1756 O HOH 20 0.492 8.593 -9.505 1.00 14.89 O HETATM 1757 O HOH 21 -1.040 8.917 -13.011 1.00 17.24 O HETATM 1758 O HOH 22 -4.419 3.750 -12.906 1.00 10.58 O HETATM 1759 O HOH 23 -2.168 11.150 -14.541 1.00 15.05 O HETATM 1760 O HOH 24 -1.679 9.346 -19.494 1.00 22.90 O HETATM 1761 O HOH 25 -25.489 14.206 -24.368 1.00 38.35 O HETATM 1762 O HOH 26 -23.903 17.084 -28.038 1.00 43.57 O HETATM 1763 O HOH 27 -24.430 7.443 -24.564 1.00 17.98 O HETATM 1764 O HOH 28 -26.569 7.644 -29.351 1.00 30.67 O HETATM 1765 O HOH 29 -22.990 5.905 -27.480 1.00 21.91 O HETATM 1766 O HOH 30 -23.086 8.857 -30.876 1.00 16.46 O HETATM 1767 O HOH 31 -24.273 11.108 -34.166 1.00 42.01 O HETATM 1768 O HOH 32 -20.039 17.238 -29.223 1.00 16.10 O HETATM 1769 O HOH 33 -23.342 16.722 -22.677 1.00 27.67 O HETATM 1770 O HOH 34 -18.538 21.130 -28.497 1.00 28.77 O HETATM 1771 O HOH 35 -15.540 19.193 -34.404 1.00 38.33 O HETATM 1772 O HOH 36 -20.572 17.203 -35.071 1.00 34.36 O HETATM 1773 O HOH 37 -16.219 16.467 -34.103 1.00 23.15 O HETATM 1774 O HOH 38 -20.809 21.224 -32.350 1.00 33.86 O HETATM 1775 O HOH 39 -9.917 22.826 -29.578 1.00 51.25 O HETATM 1776 O HOH 40 -11.935 24.855 -27.195 1.00 43.27 O HETATM 1777 O HOH 41 -10.716 20.696 -35.102 1.00 41.49 O HETATM 1778 O HOH 42 -10.234 17.181 -36.935 1.00 16.91 O HETATM 1779 O HOH 43 -4.117 20.046 -34.122 1.00 31.95 O HETATM 1780 O HOH 44 -6.429 21.691 -32.952 1.00 30.57 O HETATM 1781 O HOH 45 -9.130 18.981 -39.539 1.00 36.78 O HETATM 1782 O HOH 46 -3.425 16.493 -31.632 1.00 27.97 O HETATM 1783 O HOH 47 -3.865 16.557 -40.588 1.00 32.36 O HETATM 1784 O HOH 48 -0.421 17.505 -34.761 1.00 34.00 O HETATM 1785 O HOH 49 -4.400 14.436 -38.764 1.00 18.56 O HETATM 1786 O HOH 50 0.264 14.294 -37.405 1.00 31.27 O HETATM 1787 O HOH 51 0.378 11.514 -36.610 1.00 33.01 O HETATM 1788 O HOH 52 2.887 16.076 -32.312 1.00 32.66 O HETATM 1789 O HOH 53 2.432 10.831 -30.098 1.00 33.40 O HETATM 1790 O HOH 54 -0.715 7.716 -28.850 1.00 17.51 O HETATM 1791 O HOH 55 -0.543 0.025 -32.218 1.00 30.77 O HETATM 1792 O HOH 56 -0.365 -0.131 -27.909 1.00 40.27 O HETATM 1793 O HOH 57 -0.043 3.672 -26.637 1.00 20.37 O HETATM 1794 O HOH 58 -5.816 3.389 -37.257 1.00 26.89 O HETATM 1795 O HOH 59 -8.676 0.245 -31.288 1.00 37.61 O HETATM 1796 O HOH 60 -9.815 3.687 -32.280 1.00 15.72 O HETATM 1797 O HOH 61 -5.501 6.863 -38.659 1.00 27.79 O HETATM 1798 O HOH 62 -15.630 -0.453 -33.703 1.00 13.65 O HETATM 1799 O HOH 63 -8.072 4.066 -42.683 1.00 22.26 O HETATM 1800 O HOH 64 -6.262 7.733 -42.690 1.00 39.74 O HETATM 1801 O HOH 65 -11.976 7.086 -42.224 1.00 30.08 O HETATM 1802 O HOH 66 -10.336 9.622 -42.765 1.00 24.57 O HETATM 1803 O HOH 67 -3.568 11.388 -40.992 1.00 44.36 O HETATM 1804 O HOH 68 -11.236 16.922 -40.265 1.00 26.73 O HETATM 1805 O HOH 69 -16.707 15.074 -36.329 1.00 16.72 O HETATM 1806 O HOH 70 -13.774 16.731 -39.308 1.00 29.86 O HETATM 1807 O HOH 71 -15.778 10.408 -41.065 1.00 17.43 O HETATM 1808 O HOH 72 -7.885 13.045 -43.673 1.00 34.72 O HETATM 1809 O HOH 73 -13.708 11.256 -44.604 1.00 42.67 O HETATM 1810 O HOH 74 -21.405 10.840 -37.823 1.00 17.47 O HETATM 1811 O HOH 75 -24.340 7.530 -32.905 1.00 21.89 O HETATM 1812 O HOH 76 -19.220 14.101 -35.497 1.00 17.67 O HETATM 1813 O HOH 77 -23.742 9.471 -36.972 1.00 27.87 O HETATM 1814 O HOH 78 -23.020 7.671 -44.232 1.00 37.49 O HETATM 1815 O HOH 79 -20.658 10.618 -40.593 1.00 23.08 O HETATM 1816 O HOH 80 -25.974 9.208 -39.132 1.00 47.77 O HETATM 1817 O HOH 81 -26.766 1.925 -39.289 1.00 48.21 O HETATM 1818 O HOH 82 -25.201 1.377 -42.855 1.00 39.44 O HETATM 1819 O HOH 83 -24.843 2.247 -29.982 1.00 24.37 O HETATM 1820 O HOH 84 -28.596 2.373 -33.089 1.00 39.82 O HETATM 1821 O HOH 85 -28.851 -0.872 -34.940 1.00 31.00 O HETATM 1822 O HOH 86 -26.451 -3.458 -37.370 1.00 20.02 O HETATM 1823 O HOH 87 -30.358 0.408 -32.075 1.00 33.17 O HETATM 1824 O HOH 88 -17.461 -0.227 -31.441 1.00 18.75 O HETATM 1825 O HOH 89 -17.681 -2.908 -30.281 1.00 24.62 O HETATM 1826 O HOH 90 -17.437 -0.811 -27.530 1.00 16.84 O HETATM 1827 O HOH 91 -34.442 -1.936 -25.976 1.00 34.34 O HETATM 1828 O HOH 92 -31.339 -2.488 -31.159 1.00 18.94 O HETATM 1829 O HOH 93 -29.159 -3.234 -24.656 1.00 42.41 O HETATM 1830 O HOH 94 -20.371 -5.922 -28.458 1.00 47.82 O HETATM 1831 O HOH 95 -28.328 -6.785 -18.662 1.00 39.58 O HETATM 1832 O HOH 96 -16.858 -6.782 -31.424 1.00 14.31 O HETATM 1833 O HOH 97 -11.635 -6.747 -29.684 1.00 35.68 O HETATM 1834 O HOH 98 -11.842 -2.940 -31.284 1.00 19.01 O HETATM 1835 O HOH 99 -17.238 -4.058 -18.726 1.00 32.20 O HETATM 1836 O HOH 100 -14.369 -4.643 -21.221 1.00 30.66 O HETATM 1837 O HOH 101 -18.314 -0.964 -19.140 1.00 23.32 O HETATM 1838 O HOH 102 -16.363 1.559 -25.340 1.00 14.81 O HETATM 1839 O HOH 103 -11.944 1.357 -31.220 1.00 13.49 O HETATM 1840 O HOH 104 -4.720 19.634 -25.892 1.00 18.86 O HETATM 1841 O HOH 105 -0.439 11.225 -26.526 1.00 36.37 O HETATM 1842 O HOH 106 0.896 15.001 -28.198 1.00 25.83 O HETATM 1843 O HOH 107 -1.025 19.719 -9.281 1.00 37.08 O HETATM 1844 O HOH 108 -2.676 18.466 -5.940 1.00 17.09 O HETATM 1845 O HOH 109 0.829 16.788 -5.974 1.00 25.89 O HETATM 1846 O HOH 110 1.014 11.279 -10.296 1.00 18.65 O HETATM 1847 O HOH 111 -0.058 21.359 -15.730 1.00 39.68 O HETATM 1848 O HOH 112 3.744 14.460 -11.618 1.00 44.16 O HETATM 1849 O HOH 113 1.490 8.688 -13.600 1.00 27.20 O HETATM 1850 O HOH 114 3.142 11.781 -11.892 1.00 33.58 O HETATM 1851 O HOH 115 -0.638 11.567 -16.708 1.00 24.96 O HETATM 1852 O HOH 116 -0.315 12.591 -21.567 1.00 29.73 O HETATM 1853 O HOH 117 -22.520 5.524 -24.782 1.00 18.66 O HETATM 1854 O HOH 118 -22.971 1.466 -28.003 1.00 24.85 O HETATM 1855 O HOH 119 -15.773 10.470 1.655 1.00 36.18 O HETATM 1856 O HOH 120 -21.893 1.196 -20.564 1.00 44.27 O HETATM 1857 O HOH 121 -19.230 1.519 -18.311 1.00 12.94 O HETATM 1858 O HOH 122 -4.964 22.211 -13.208 1.00 31.63 O HETATM 1859 O HOH 123 -6.465 24.335 -9.989 1.00 32.01 O HETATM 1860 O HOH 124 -4.465 24.770 -14.107 1.00 42.32 O HETATM 1861 O HOH 125 -27.030 7.670 -21.508 1.00 49.25 O HETATM 1862 O HOH 126 -27.246 14.356 -18.594 1.00 28.23 O HETATM 1863 O HOH 127 -23.495 13.782 -21.888 1.00 32.89 O HETATM 1864 O HOH 128 -29.489 9.659 -14.315 1.00 37.07 O HETATM 1865 O HOH 129 -26.874 4.530 -8.389 1.00 38.10 O HETATM 1866 O HOH 130 -24.517 16.350 -14.967 1.00 34.37 O HETATM 1867 O HOH 131 -20.277 11.112 -15.049 1.00 11.34 O HETATM 1868 O HOH 132 -21.949 17.663 -18.157 1.00 43.57 O HETATM 1869 O HOH 133 -19.340 1.372 -6.103 1.00 30.20 O HETATM 1870 O HOH 134 -15.792 -0.957 -7.357 1.00 32.45 O HETATM 1871 O HOH 135 -19.333 -0.251 -3.595 1.00 45.17 O HETATM 1872 O HOH 136 2.642 7.297 -10.715 1.00 24.86 O HETATM 1873 O HOH 137 -1.077 8.516 -22.653 1.00 22.89 O HETATM 1874 O HOH 138 0.404 8.420 -16.793 1.00 43.17 O HETATM 1875 O HOH 139 -13.735 -0.672 -8.621 1.00 24.24 O HETATM 1876 O HOH 140 -23.572 14.119 -35.721 1.00 38.59 O HETATM 1877 O HOH 141 -16.062 -1.715 -12.022 1.00 35.75 O HETATM 1878 O HOH 142 -15.159 3.537 -15.681 1.00 10.16 O HETATM 1879 O HOH 143 -14.132 -2.642 -11.392 1.00 15.17 O HETATM 1880 O HOH 144 -11.000 -6.470 -11.189 1.00 19.27 O HETATM 1881 O HOH 145 -8.045 -8.607 -15.589 1.00 22.67 O HETATM 1882 O HOH 146 -12.400 18.986 -36.393 1.00 47.54 O HETATM 1883 O HOH 147 -14.938 -4.421 -17.476 1.00 36.26 O HETATM 1884 O HOH 148 -17.702 3.097 -16.703 1.00 10.70 O HETATM 1885 O HOH 149 -20.660 0.091 -16.345 1.00 24.77 O HETATM 1886 O HOH 150 -21.245 2.767 -13.056 1.00 21.33 O HETATM 1887 O HOH 151 -10.301 21.205 -38.803 1.00 39.79 O HETATM 1888 O HOH 152 3.078 17.853 -35.586 1.00 30.37 O HETATM 1889 O HOH 153 2.350 16.078 -37.459 1.00 25.29 O HETATM 1890 O HOH 154 -0.107 10.384 -29.255 1.00 31.77 O HETATM 1891 O HOH 155 0.901 6.244 -27.023 1.00 26.79 O HETATM 1892 O HOH 156 -1.915 -2.179 -27.313 1.00 39.34 O HETATM 1893 O HOH 157 -8.908 -5.420 -23.036 1.00 23.75 O HETATM 1894 O HOH 158 -13.235 -7.819 -17.834 1.00 31.22 O HETATM 1895 O HOH 159 -6.737 2.287 -41.335 1.00 46.26 O HETATM 1896 O HOH 160 -1.524 -0.522 -20.978 1.00 23.54 O HETATM 1897 O HOH 161 -17.581 16.130 -38.815 1.00 21.36 O HETATM 1898 O HOH 162 -1.655 -2.291 -23.197 1.00 24.00 O HETATM 1899 O HOH 163 -1.425 -3.950 -15.952 1.00 41.90 O HETATM 1900 O HOH 164 -15.643 15.130 -40.540 1.00 20.74 O HETATM 1901 O HOH 165 -14.326 9.037 -42.936 1.00 21.60 O HETATM 1902 O HOH 166 -16.465 12.907 -41.875 1.00 20.78 O HETATM 1903 O HOH 167 -15.714 13.328 -44.399 1.00 39.32 O HETATM 1904 O HOH 168 -21.065 13.413 -37.408 1.00 20.77 O HETATM 1905 O HOH 169 -8.472 -1.450 -29.312 1.00 38.04 O HETATM 1906 O HOH 170 -5.969 -3.982 -28.894 1.00 22.81 O HETATM 1907 O HOH 171 -24.228 5.850 -45.794 1.00 42.45 O HETATM 1908 O HOH 172 -26.483 -1.413 -42.586 1.00 40.59 O HETATM 1909 O HOH 173 1.059 4.208 -22.516 1.00 38.87 O HETATM 1910 O HOH 174 -28.191 4.890 -32.112 1.00 34.91 O HETATM 1911 O HOH 175 -30.855 -2.707 -34.245 1.00 36.24 O HETATM 1912 O HOH 176 1.115 1.091 -17.782 1.00 23.39 O HETATM 1913 O HOH 177 2.441 1.377 -13.334 1.00 32.32 O HETATM 1914 O HOH 178 2.056 1.985 -10.731 1.00 19.52 O HETATM 1915 O HOH 179 3.145 1.014 -6.536 1.00 23.73 O HETATM 1916 O HOH 180 -3.217 -2.743 -5.811 1.00 10.43 O HETATM 1917 O HOH 181 0.031 -3.939 -8.203 1.00 17.13 O HETATM 1918 O HOH 182 -0.431 -3.825 -4.182 1.00 13.16 O HETATM 1919 O HOH 183 -17.450 -9.266 -30.858 1.00 33.82 O HETATM 1920 O HOH 184 -10.523 -4.747 -27.690 1.00 32.50 O HETATM 1921 O HOH 185 -18.355 -3.944 -15.034 1.00 35.91 O HETATM 1922 O HOH 186 -4.099 -9.188 -2.823 1.00 15.11 O HETATM 1923 O HOH 187 -0.822 10.595 -24.040 1.00 33.69 O HETATM 1924 O HOH 188 -3.477 -9.421 -5.561 1.00 28.20 O HETATM 1925 O HOH 189 -5.600 -6.587 -8.427 1.00 15.35 O HETATM 1926 O HOH 190 2.770 -6.981 -10.253 1.00 72.54 O HETATM 1927 O HOH 191 -0.172 -10.692 -6.127 1.00 40.51 O HETATM 1928 O HOH 192 2.257 15.279 -8.025 1.00 34.14 O HETATM 1929 O HOH 193 2.228 12.638 -8.261 1.00 35.00 O HETATM 1930 O HOH 194 -2.132 24.036 -14.623 1.00 28.39 O HETATM 1931 O HOH 195 -4.841 -10.816 -16.473 1.00 32.42 O HETATM 1932 O HOH 196 -2.618 -11.346 -6.907 1.00 34.55 O HETATM 1933 O HOH 197 -1.141 -14.110 -8.092 1.00 34.13 O HETATM 1934 O HOH 198 -8.195 -7.673 -7.821 1.00 40.55 O HETATM 1935 O HOH 199 -10.175 -6.269 -6.662 1.00 17.30 O HETATM 1936 O HOH 200 -9.841 -6.354 -0.887 1.00 13.72 O HETATM 1937 O HOH 201 -29.761 14.163 -16.059 1.00 41.10 O HETATM 1938 O HOH 202 -13.058 -0.072 -1.631 1.00 30.05 O HETATM 1939 O HOH 203 -12.728 -6.712 -7.769 1.00 40.76 O HETATM 1940 O HOH 204 -9.295 0.745 5.662 1.00 15.10 O HETATM 1941 O HOH 205 -13.438 0.175 4.525 1.00 51.11 O HETATM 1942 O HOH 206 -16.110 -1.402 -9.777 1.00 36.90 O HETATM 1943 O HOH 207 -13.710 -5.494 -10.810 1.00 24.85 O HETATM 1944 O HOH 208 -11.678 -9.076 -12.571 1.00 43.60 O HETATM 1945 O HOH 209 -8.802 -9.315 -18.072 1.00 34.02 O HETATM 1946 O HOH 210 -10.042 -10.099 -14.289 1.00 43.76 O HETATM 1947 O HOH 211 -15.097 -6.623 -12.693 1.00 40.61 O HETATM 1948 O HOH 212 -15.961 -4.732 -15.009 1.00 42.40 O HETATM 1949 O HOH 213 -22.952 3.247 -15.687 1.00 44.69 O HETATM 1950 O HOH 214 2.684 5.436 0.011 1.00 13.72 O HETATM 1951 O HOH 215 -6.831 -6.251 -24.614 1.00 37.16 O HETATM 1952 O HOH 216 -12.819 -9.252 -15.427 1.00 36.52 O HETATM 1953 O HOH 217 4.083 5.808 -2.508 1.00 13.59 O HETATM 1954 O HOH 218 4.027 10.058 -7.187 1.00 33.39 O HETATM 1955 O HOH 219 5.559 7.525 -7.364 1.00 36.08 O HETATM 1956 O HOH 220 5.129 3.755 -3.916 1.00 30.35 O HETATM 1957 O HOH 221 -7.524 -3.988 -31.301 1.00 32.96 O HETATM 1958 O HOH 222 -7.654 -5.626 -27.574 1.00 33.21 O HETATM 1959 O HOH 223 0.747 7.012 -23.274 1.00 36.98 O HETATM 1960 O HOH 224 3.965 10.091 -4.307 1.00 15.33 O HETATM 1961 O HOH 225 5.175 13.496 -1.460 1.00 28.76 O HETATM 1962 O HOH 226 3.336 4.582 -10.786 1.00 27.76 O HETATM 1963 O HOH 227 -6.038 -8.576 -6.622 1.00 34.16 O HETATM 1964 O HOH 228 -3.341 5.009 7.410 1.00 21.30 O HETATM 1965 O HOH 229 -15.325 1.783 3.616 1.00 45.61 O HETATM 1966 O HOH 230 -14.479 8.622 3.450 1.00 21.42 O HETATM 1967 O HOH 231 -8.428 12.334 5.806 1.00 21.92 O HETATM 1968 O HOH 232 -14.432 2.036 -1.804 1.00 45.83 O HETATM 1969 O HOH 233 -17.254 6.391 0.578 1.00 34.58 O HETATM 1970 O HOH 234 -14.331 4.190 1.248 1.00 27.12 O HETATM 1971 O HOH 235 -15.590 6.189 3.001 1.00 25.75 O HETATM 1972 O HOH 236 -13.481 6.245 7.846 1.00 36.00 O HETATM 1973 O HOH 237 -6.231 11.508 7.467 1.00 32.41 O HETATM 1974 O HOH 238 -8.694 14.855 5.932 1.00 37.28 O HETATM 1975 O HOH 239 -6.662 19.388 6.040 1.00 39.95 O HETATM 1976 O HOH 240 -16.022 4.188 4.780 1.00 30.71 O HETATM 1977 O HOH 241 -8.615 15.931 9.985 1.00 35.62 O HETATM 1978 O HOH 242 -14.553 25.413 1.364 1.00 29.75 O HETATM 1979 O HOH 243 -9.390 26.321 1.918 1.00 38.18 O HETATM 1980 O HOH 244 -4.960 26.506 -6.504 1.00 39.49 O HETATM 1981 O HOH 245 -4.609 28.161 -8.776 1.00 34.04 O HETATM 1982 O HOH 246 -11.184 22.497 2.032 1.00 25.18 O HETATM 1983 O HOH 247 -7.054 21.603 1.335 1.00 42.12 O HETATM 1984 O HOH 248 -9.147 23.030 4.102 1.00 40.05 O HETATM 1985 O HOH 249 -8.765 16.961 4.943 1.00 24.48 O HETATM 1986 O HOH 250 -13.387 20.959 2.513 1.00 25.27 O HETATM 1987 O HOH 251 -6.907 18.172 3.582 1.00 85.12 O HETATM 1988 O HOH 252 -28.214 16.189 -9.848 1.00 35.69 O HETATM 1989 O HOH 253 -26.571 15.879 -5.640 1.00 24.00 O HETATM 1990 O HOH 254 -27.944 12.943 -8.140 1.00 35.54 O HETATM 1991 O HOH 255 -1.610 22.307 1.634 1.00 37.30 O HETATM 1992 O HOH 256 -0.323 21.071 -5.005 1.00 49.20 O HETATM 1993 O HOH 257 0.831 21.144 -2.304 1.00 37.46 O HETATM 1994 O HOH 258 -14.797 25.535 -3.149 1.00 17.20 O HETATM 1995 O HOH 259 -16.606 19.685 2.839 1.00 24.91 O HETATM 1996 O HOH 260 -16.091 23.508 2.608 1.00 24.56 O HETATM 1997 O HOH 261 -18.505 19.212 -1.007 1.00 14.64 O HETATM 1998 O HOH 262 -11.947 25.010 1.449 1.00 32.56 O HETATM 1999 O HOH 263 -10.750 27.951 -8.345 1.00 24.62 O HETATM 2000 O HOH 264 -6.851 26.402 -8.448 1.00 39.06 O HETATM 2001 O HOH 265 -15.368 23.666 -5.183 1.00 13.35 O HETATM 2002 O HOH 266 -16.038 26.105 -0.813 1.00 21.91 O HETATM 2003 O HOH 267 -26.544 17.773 -7.887 1.00 30.38 O HETATM 2004 O HOH 268 -23.758 14.797 -8.883 1.00 35.13 O HETATM 2005 O HOH 269 -25.142 15.716 -3.264 1.00 15.68 O HETATM 2006 O HOH 270 -25.703 13.610 -6.776 1.00 27.24 O HETATM 2007 O HOH 271 -22.762 1.666 -7.837 1.00 38.07 O HETATM 2008 O HOH 272 -22.366 1.166 -11.145 1.00 44.38 O HETATM 2009 O HOH 273 -21.645 4.410 -4.397 1.00 37.71 O HETATM 2010 O HOH 274 -18.244 -1.195 -8.052 1.00 36.54 O HETATM 2011 O HOH 275 -11.071 29.498 -25.118 1.00 38.52 O HETATM 2012 O1 UNN A 276 -14.656 6.583 -11.084 1.00 -0.37 O HETATM 2013 C10 UNN A 276 -13.412 5.924 -10.798 1.00 0.13 C HETATM 2014 C11 UNN A 276 -13.848 4.618 -10.267 1.00 -0.01 C HETATM 2015 C12 UNN A 276 -15.270 4.457 -10.444 1.00 -0.03 C HETATM 2016 C16 UNN A 276 -15.871 3.188 -9.957 1.00 0.09 C HETATM 2017 C15 UNN A 276 -15.022 2.205 -9.412 1.00 -0.04 C HETATM 2018 C14 UNN A 276 -13.643 2.368 -9.269 1.00 -0.07 C HETATM 2019 C13 UNN A 276 -13.020 3.546 -9.700 1.00 0.00 C HETATM 2020 BR UNN A 276 -11.192 3.856 -9.492 1.00 -0.07 BR HETATM 2021 H9 UNN A 276 -13.051 1.578 -8.822 1.00 0.06 H HETATM 2022 H10 UNN A 276 -15.464 1.270 -9.086 1.00 0.05 H HETATM 2023 O35 UNN A 276 -17.215 3.027 -10.088 1.00 -0.32 O HETATM 2024 C36 UNN A 276 -17.832 1.855 -9.519 1.00 0.07 C HETATM 2025 C37 UNN A 276 -19.315 2.050 -9.698 1.00 -0.04 C HETATM 2026 H22 UNN A 276 -19.851 1.184 -9.282 1.00 0.03 H HETATM 2027 H23 UNN A 276 -19.546 2.144 -10.769 1.00 0.03 H HETATM 2028 H24 UNN A 276 -19.631 2.964 -9.173 1.00 0.03 H HETATM 2029 H20 UNN A 276 -17.582 1.770 -8.451 1.00 0.06 H HETATM 2030 H21 UNN A 276 -17.497 0.950 -10.047 1.00 0.06 H HETATM 2031 C33 UNN A 276 -12.659 5.734 -12.134 1.00 0.00 C HETATM 2032 N34 UNN A 276 -13.493 5.083 -13.170 1.00 0.22 N HETATM 2033 H17 UNN A 276 -12.958 4.983 -14.018 1.00 0.20 H HETATM 2034 H18 UNN A 276 -14.307 5.650 -13.351 1.00 0.20 H HETATM 2035 H19 UNN A 276 -13.782 4.173 -12.846 1.00 0.20 H HETATM 2036 H15 UNN A 276 -11.772 5.110 -11.953 1.00 0.09 H HETATM 2037 H16 UNN A 276 -12.344 6.721 -12.504 1.00 0.09 H HETATM 2038 H7 UNN A 276 -12.797 6.479 -10.074 1.00 0.08 H HETATM 2039 O2' UNN A 276 -16.304 5.529 -12.398 1.00 -0.38 O HETATM 2040 C2' UNN A 276 -17.421 6.339 -12.704 1.00 0.14 C HETATM 2041 C1' UNN A 276 -18.467 5.584 -13.514 1.00 0.20 C HETATM 2042 N9 UNN A 276 -19.347 6.523 -14.272 1.00 -0.19 N HETATM 2043 C4 UNN A 276 -19.854 6.259 -15.487 1.00 0.16 C HETATM 2044 N3 UNN A 276 -19.749 5.160 -16.269 1.00 -0.27 N HETATM 2045 C2 UNN A 276 -20.374 5.158 -17.462 1.00 0.05 C HETATM 2046 N1 UNN A 276 -21.082 6.226 -17.866 1.00 -0.27 N HETATM 2047 C6 UNN A 276 -21.220 7.354 -17.132 1.00 0.13 C HETATM 2048 C5 UNN A 276 -20.589 7.370 -15.888 1.00 0.10 C HETATM 2049 N7 UNN A 276 -20.502 8.306 -14.913 1.00 -0.30 N HETATM 2050 C8 UNN A 276 -19.753 7.763 -13.937 1.00 0.11 C HETATM 2051 H5 UNN A 276 -19.507 8.260 -13.000 1.00 0.13 H HETATM 2052 N6 UNN A 276 -21.947 8.412 -17.577 1.00 -0.32 N HETATM 2053 H3 UNN A 276 -22.034 9.258 -16.996 1.00 0.18 H HETATM 2054 H4 UNN A 276 -22.411 8.368 -18.496 1.00 0.18 H HETATM 2055 H2 UNN A 276 -20.305 4.286 -18.102 1.00 0.10 H HETATM 2056 O4' UNN A 276 -19.173 4.795 -12.558 1.00 -0.34 O HETATM 2057 C4' UNN A 276 -19.071 5.403 -11.254 1.00 0.12 C HETATM 2058 C3' UNN A 276 -18.046 6.534 -11.346 1.00 0.11 C HETATM 2059 O3' UNN A 276 -16.963 6.337 -10.442 1.00 -0.39 O HETATM 2060 H13 UNN A 276 -18.513 7.521 -11.216 1.00 0.06 H HETATM 2061 C5' UNN A 276 -20.466 5.903 -10.897 1.00 0.11 C HETATM 2062 O5' UNN A 276 -21.341 4.773 -10.886 1.00 -0.27 O HETATM 2063 P UNN A 276 -22.668 4.792 -9.948 1.00 0.20 P HETATM 2064 O1P UNN A 276 -23.419 3.542 -10.354 1.00 -0.55 O HETATM 2065 O2P UNN A 276 -22.123 4.730 -8.538 1.00 -0.55 O HETATM 2066 O3P UNN A 276 -23.340 6.073 -10.284 1.00 -0.55 O HETATM 2067 H26 UNN A 276 -20.806 6.633 -11.646 1.00 0.06 H HETATM 2068 H27 UNN A 276 -20.452 6.376 -9.904 1.00 0.06 H HETATM 2069 H25 UNN A 276 -18.739 4.667 -10.507 1.00 0.07 H HETATM 2070 H6 UNN A 276 -17.970 4.921 -14.238 1.00 0.10 H HETATM 2071 H11 UNN A 276 -17.130 7.279 -13.195 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 747 748 756 757 758 CONECT 756 747 CONECT 757 747 CONECT 758 747 CONECT 2012 0 2013 CONECT 2013 2012 2014 2031 2038 CONECT 2014 2013 2015 2019 CONECT 2015 0 2014 2016 CONECT 2016 2015 2017 2023 CONECT 2017 2016 2018 2022 CONECT 2018 2017 2019 2021 CONECT 2019 2014 2018 2020 CONECT 2020 2019 CONECT 2021 2018 CONECT 2022 2017 CONECT 2023 2016 2024 CONECT 2024 2023 2025 2029 2030 CONECT 2025 2024 2026 2027 2028 CONECT 2026 2025 CONECT 2027 2025 CONECT 2028 2025 CONECT 2029 2024 CONECT 2030 2024 CONECT 2031 2013 2032 2036 2037 CONECT 2032 2031 2033 2034 2035 CONECT 2033 2032 CONECT 2034 2032 CONECT 2035 2032 CONECT 2036 2031 CONECT 2037 2031 CONECT 2038 2013 CONECT 2039 0 2040 CONECT 2040 2039 2041 2058 2071 CONECT 2041 2040 2042 2056 2070 CONECT 2042 2041 2043 2050 CONECT 2043 2042 2044 2048 CONECT 2044 2043 2045 CONECT 2045 2044 2046 2055 CONECT 2046 2045 2047 CONECT 2047 2046 2048 2052 CONECT 2048 2043 2047 2049 CONECT 2049 2048 2050 CONECT 2050 2042 2049 2051 CONECT 2051 2050 CONECT 2052 2047 2053 2054 CONECT 2053 2052 CONECT 2054 2052 CONECT 2055 2045 CONECT 2056 2041 2057 CONECT 2057 2056 2058 2061 2069 CONECT 2058 2040 2057 2059 2060 CONECT 2059 0 2058 CONECT 2060 2058 CONECT 2061 2057 2062 2067 2068 CONECT 2062 2061 2063 CONECT 2063 2062 2064 2065 2066 CONECT 2064 2063 CONECT 2065 2063 CONECT 2066 2063 CONECT 2067 2061 CONECT 2068 2061 CONECT 2069 2057 CONECT 2070 2041 CONECT 2071 2040 MASTER 0 0 0 0 0 0 0 0 2068 3 72 16 END
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Structure:
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Protein
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Related entries of code: 5ags
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5agr
RCSB PDB
PDBbind
232aa, >5AGR_1|Chain... *
5agt
RCSB PDB
PDBbind
232aa, >5AGT_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5ags
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
LeuRS editing domain of Mycobacterium tuberculosis
Ligand Name
38Y
EC.Number
E.C.-.-.-.-
Resolution
1.47(Å)
Affinity (Kd/Ki/IC50)
Kd=0.040uM
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
BBrN
6
O
9
P
Molecular Weight
616.144
Exact Mass
615.078
No. of atoms
64
No. of bonds
69
Polar Surface Area
226.92
LOGP Value
-3.42 (
Computed with XLOGP3
)
-0.34 (
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+])Br
InChI String
InChI=1S/C20H26BBrN6O9P/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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