Browse entries in the PDBbind-CN Database
HEADER 6SEN_COMPLEX COMPND 6SEN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 37 ARG SER VAL ALA SER SER LYS LEU TRP MET LEU GLU PHE SEQRES 2 A 37 SER ALA PHE LEU GLU GLN GLN GLN ASP PRO ASP THR TYR SEQRES 3 A 37 ASN LYS HIS LEU PHE VAL HIS ILE GLY GLN SER SEQRES 1 A 45 TYR LEU GLU ALA VAL ASP ILE ARG GLN ILE TYR ASP LYS SEQRES 2 A 45 PHE PRO GLU LYS LYS GLY GLY LEU LYS ASP LEU PHE GLU SEQRES 3 A 45 ARG GLY PRO SER ASN ALA PHE PHE LEU VAL LYS PHE TRP SEQRES 4 A 45 ALA ASP LEU ASN THR ASN SEQRES 1 A 33 SER SER PHE TYR GLY VAL SER SER GLN TYR GLU SER PRO SEQRES 2 A 33 GLU ASN MET ILE ILE THR CYS SER THR LYS VAL CYS SER SEQRES 3 A 33 PHE GLY LYS GLN VAL VAL GLU SEQRES 1 A 89 VAL GLU THR GLU TYR ALA ARG TYR GLU ASN GLY HIS TYR SEQRES 2 A 89 SER TYR ARG ILE HIS ARG SER PRO LEU CYS GLU TYR MET SEQRES 3 A 89 ILE ASN PHE ILE HIS LYS LEU LYS HIS LEU PRO GLU LYS SEQRES 4 A 89 TYR MET MET ASN SER VAL LEU GLU ASN PHE THR ILE LEU SEQRES 5 A 89 GLN VAL VAL THR ASN ARG ASP THR GLN GLU THR LEU LEU SEQRES 6 A 89 CYS ILE ALA TYR VAL PHE GLU VAL SER ALA SER GLU HIS SEQRES 7 A 89 GLY ALA GLN HIS HIS ILE TYR ARG LEU VAL LYS HET ACE A 330 273 ATOM 1 N ARG A 217 -10.111 16.260 12.188 1.00 51.13 N ATOM 2 CA ARG A 217 -8.968 15.359 12.072 1.00 50.55 C ATOM 3 C ARG A 217 -7.743 16.015 12.715 1.00 52.24 C ATOM 4 O ARG A 217 -6.634 16.028 12.162 1.00 53.05 O ATOM 5 CB ARG A 217 -8.727 14.968 10.596 1.00 52.60 C ATOM 6 HN3 ARG A 217 -9.897 17.154 11.701 1.00 0.00 H ATOM 7 HN2 ARG A 217 -10.302 16.448 13.193 1.00 0.00 H ATOM 8 HN1 ARG A 217 -10.945 15.818 11.752 1.00 0.00 H ATOM 9 N SER A 218 -7.951 16.524 13.930 1.00 44.50 N ATOM 10 CA SER A 218 -6.937 17.263 14.645 1.00 40.13 C ATOM 11 C SER A 218 -6.633 16.807 16.055 1.00 34.37 C ATOM 12 O SER A 218 -7.432 16.137 16.717 1.00 30.76 O ATOM 13 CB SER A 218 -7.309 18.741 14.676 1.00 42.72 C ATOM 14 OG SER A 218 -8.684 18.938 14.959 1.00 52.35 O ATOM 15 HG SER A 218 -8.882 19.908 14.970 1.00 0.00 H ATOM 16 H SER A 218 -8.878 16.383 14.379 1.00 0.00 H ATOM 17 N VAL A 219 -5.483 17.286 16.532 1.00 26.51 N ATOM 18 CA VAL A 219 -5.007 17.065 17.894 1.00 25.74 C ATOM 19 C VAL A 219 -5.700 18.158 18.682 1.00 28.55 C ATOM 20 O VAL A 219 -5.177 19.279 18.809 1.00 27.11 O ATOM 21 CB VAL A 219 -3.463 17.142 17.990 1.00 27.54 C ATOM 22 CG1 VAL A 219 -3.002 16.922 19.431 1.00 26.18 C ATOM 23 CG2 VAL A 219 -2.810 16.126 17.044 1.00 27.93 C ATOM 24 H VAL A 219 -4.888 17.852 15.894 1.00 0.00 H ATOM 25 N ALA A 220 -6.922 17.863 19.105 1.00 25.45 N ATOM 26 CA ALA A 220 -7.775 18.816 19.808 1.00 24.89 C ATOM 27 C ALA A 220 -8.685 18.133 20.808 1.00 29.00 C ATOM 28 O ALA A 220 -9.404 17.179 20.465 1.00 27.19 O ATOM 29 CB ALA A 220 -8.582 19.644 18.805 1.00 26.10 C ATOM 30 H ALA A 220 -7.290 16.907 18.927 1.00 0.00 H ATOM 31 N SER A 221 -8.653 18.622 22.067 1.00 25.86 N ATOM 32 CA SER A 221 -9.533 18.139 23.144 1.00 25.24 C ATOM 33 C SER A 221 -10.692 19.152 23.248 1.00 29.73 C ATOM 34 O SER A 221 -10.916 19.886 22.297 1.00 28.73 O ATOM 35 CB SER A 221 -8.744 18.083 24.452 1.00 28.35 C ATOM 36 OG SER A 221 -8.327 19.390 24.827 1.00 33.97 O ATOM 37 HG SER A 221 -7.817 19.342 25.674 1.00 0.00 H ATOM 38 H SER A 221 -7.973 19.377 22.286 1.00 0.00 H ATOM 39 N SER A 222 -11.402 19.213 24.390 1.00 27.05 N ATOM 40 CA SER A 222 -12.506 20.168 24.584 1.00 27.79 C ATOM 41 C SER A 222 -11.968 21.584 24.720 1.00 33.49 C ATOM 42 O SER A 222 -12.626 22.529 24.301 1.00 33.66 O ATOM 43 CB SER A 222 -13.288 19.837 25.858 1.00 29.40 C ATOM 44 OG SER A 222 -13.744 18.494 25.809 1.00 44.93 O ATOM 45 HG SER A 222 -12.967 17.885 25.735 1.00 0.00 H ATOM 46 H SER A 222 -11.162 18.561 25.164 1.00 0.00 H ATOM 47 N LYS A 223 -10.779 21.726 25.313 1.00 29.40 N ATOM 48 CA LYS A 223 -10.248 23.040 25.638 1.00 29.10 C ATOM 49 C LYS A 223 -8.981 23.459 24.931 1.00 27.72 C ATOM 50 O LYS A 223 -8.533 24.577 25.163 1.00 26.64 O ATOM 51 CB LYS A 223 -10.022 23.111 27.154 1.00 32.83 C ATOM 52 CG LYS A 223 -11.306 23.239 27.968 1.00 36.80 C ATOM 53 CD LYS A 223 -10.931 23.465 29.403 1.00 43.86 C ATOM 54 CE LYS A 223 -12.144 23.557 30.254 1.00 45.55 C ATOM 55 NZ LYS A 223 -11.827 23.457 31.697 1.00 56.75 N ATOM 56 HZ1 LYS A 223 -11.368 22.543 31.887 1.00 0.00 H ATOM 57 HZ2 LYS A 223 -11.186 24.231 31.964 1.00 0.00 H ATOM 58 HZ3 LYS A 223 -12.705 23.527 32.249 1.00 0.00 H ATOM 59 H LYS A 223 -10.222 20.879 25.547 1.00 0.00 H ATOM 60 N LEU A 224 -8.342 22.588 24.141 1.00 22.01 N ATOM 61 CA LEU A 224 -7.073 22.986 23.523 1.00 21.99 C ATOM 62 C LEU A 224 -6.820 22.235 22.232 1.00 26.77 C ATOM 63 O LEU A 224 -7.074 21.036 22.178 1.00 25.75 O ATOM 64 CB LEU A 224 -5.910 22.730 24.503 1.00 21.22 C ATOM 65 CG LEU A 224 -4.590 23.416 24.180 1.00 24.76 C ATOM 66 CD1 LEU A 224 -4.693 24.955 24.335 1.00 24.41 C ATOM 67 CD2 LEU A 224 -3.490 22.839 25.045 1.00 22.76 C ATOM 68 H LEU A 224 -8.740 21.643 23.968 1.00 0.00 H ATOM 69 N TRP A 225 -6.318 22.952 21.204 1.00 23.38 N ATOM 70 CA TRP A 225 -6.040 22.415 19.867 1.00 24.69 C ATOM 71 C TRP A 225 -4.608 22.711 19.524 1.00 25.38 C ATOM 72 O TRP A 225 -4.193 23.869 19.645 1.00 22.09 O ATOM 73 CB TRP A 225 -6.977 23.088 18.821 1.00 26.12 C ATOM 74 CG TRP A 225 -6.660 22.834 17.364 1.00 30.54 C ATOM 75 CD1 TRP A 225 -6.144 21.693 16.812 1.00 33.70 C ATOM 76 CD2 TRP A 225 -6.953 23.711 16.265 1.00 32.79 C ATOM 77 NE1 TRP A 225 -6.083 21.812 15.440 1.00 34.16 N ATOM 78 CE2 TRP A 225 -6.551 23.049 15.079 1.00 37.27 C ATOM 79 CE3 TRP A 225 -7.477 25.018 16.171 1.00 36.42 C ATOM 80 CZ2 TRP A 225 -6.636 23.653 13.817 1.00 38.51 C ATOM 81 CZ3 TRP A 225 -7.616 25.596 14.912 1.00 39.28 C ATOM 82 CH2 TRP A 225 -7.200 24.915 13.752 1.00 40.12 C ATOM 83 HE1 TRP A 225 -5.738 21.082 14.785 1.00 0.00 H ATOM 84 H TRP A 225 -6.114 23.958 21.372 1.00 0.00 H ATOM 85 N MET A 226 -3.840 21.686 19.142 1.00 21.81 N ATOM 86 CA MET A 226 -2.461 21.927 18.698 1.00 22.11 C ATOM 87 C MET A 226 -2.520 22.114 17.193 1.00 26.28 C ATOM 88 O MET A 226 -2.748 21.131 16.462 1.00 26.27 O ATOM 89 CB MET A 226 -1.493 20.771 19.060 1.00 24.02 C ATOM 90 CG MET A 226 -0.058 21.080 18.657 1.00 26.43 C ATOM 91 SD MET A 226 1.086 19.773 19.163 1.00 29.60 S ATOM 92 CE MET A 226 0.647 18.575 18.031 1.00 27.68 C ATOM 93 H MET A 226 -4.219 20.718 19.159 1.00 0.00 H ATOM 94 N LEU A 227 -2.388 23.371 16.748 1.00 23.10 N ATOM 95 CA LEU A 227 -2.464 23.761 15.325 1.00 25.84 C ATOM 96 C LEU A 227 -1.174 23.470 14.570 1.00 26.53 C ATOM 97 O LEU A 227 -1.228 23.204 13.372 1.00 26.54 O ATOM 98 CB LEU A 227 -2.664 25.289 15.151 1.00 28.29 C ATOM 99 CG LEU A 227 -3.876 25.951 15.697 1.00 38.09 C ATOM 100 CD1 LEU A 227 -3.529 26.589 16.986 1.00 38.81 C ATOM 101 CD2 LEU A 227 -4.341 27.042 14.722 1.00 45.02 C ATOM 102 H LEU A 227 -2.221 24.120 17.450 1.00 0.00 H ATOM 103 N GLU A 228 -0.019 23.609 15.232 1.00 21.69 N ATOM 104 CA GLU A 228 1.278 23.432 14.575 1.00 20.49 C ATOM 105 C GLU A 228 2.265 22.776 15.514 1.00 21.56 C ATOM 106 O GLU A 228 2.244 23.012 16.729 1.00 19.23 O ATOM 107 CB GLU A 228 1.882 24.798 14.155 1.00 21.48 C ATOM 108 CG GLU A 228 1.030 25.691 13.270 1.00 23.20 C ATOM 109 CD GLU A 228 1.500 27.126 13.082 1.00 45.87 C ATOM 110 OE1 GLU A 228 2.449 27.562 13.776 1.00 38.93 O ATOM 111 OE2 GLU A 228 0.890 27.828 12.244 1.00 42.97 O ATOM 112 H GLU A 228 -0.043 23.850 16.243 1.00 0.00 H ATOM 113 N PHE A 229 3.181 22.007 14.936 1.00 19.58 N ATOM 114 CA PHE A 229 4.240 21.350 15.673 1.00 19.06 C ATOM 115 C PHE A 229 5.338 21.075 14.623 1.00 22.36 C ATOM 116 O PHE A 229 5.027 20.681 13.497 1.00 20.67 O ATOM 117 CB PHE A 229 3.739 20.026 16.314 1.00 21.45 C ATOM 118 CG PHE A 229 4.804 19.248 17.043 1.00 23.17 C ATOM 119 CD1 PHE A 229 5.693 18.432 16.348 1.00 24.97 C ATOM 120 CD2 PHE A 229 4.959 19.375 18.419 1.00 26.55 C ATOM 121 CE1 PHE A 229 6.727 17.770 17.012 1.00 26.58 C ATOM 122 CE2 PHE A 229 5.965 18.676 19.092 1.00 28.50 C ATOM 123 CZ PHE A 229 6.832 17.859 18.385 1.00 26.45 C ATOM 124 H PHE A 229 3.135 21.870 13.906 1.00 0.00 H ATOM 125 N SER A 230 6.574 21.345 14.976 1.00 20.46 N ATOM 126 CA SER A 230 7.691 21.029 14.092 1.00 22.12 C ATOM 127 C SER A 230 8.963 20.899 14.906 1.00 25.14 C ATOM 128 O SER A 230 9.114 21.540 15.946 1.00 23.88 O ATOM 129 CB SER A 230 7.835 22.047 12.956 1.00 25.38 C ATOM 130 OG SER A 230 8.171 23.355 13.382 1.00 31.82 O ATOM 131 HG SER A 230 8.245 23.949 12.593 1.00 0.00 H ATOM 132 H SER A 230 6.759 21.790 15.898 1.00 0.00 H ATOM 133 N ALA A 231 9.853 20.056 14.455 1.00 21.58 N ATOM 134 CA ALA A 231 11.190 19.916 15.024 1.00 20.51 C ATOM 135 C ALA A 231 12.111 20.033 13.819 1.00 23.67 C ATOM 136 O ALA A 231 11.788 19.558 12.717 1.00 20.44 O ATOM 137 CB ALA A 231 11.353 18.593 15.729 1.00 21.63 C ATOM 138 H ALA A 231 9.596 19.453 13.648 1.00 0.00 H ATOM 139 N PHE A 232 13.161 20.806 13.978 1.00 22.94 N ATOM 140 CA PHE A 232 13.978 21.178 12.844 1.00 22.99 C ATOM 141 C PHE A 232 15.443 21.398 13.180 1.00 25.66 C ATOM 142 O PHE A 232 15.807 21.547 14.345 1.00 24.65 O ATOM 143 CB PHE A 232 13.374 22.486 12.240 1.00 23.82 C ATOM 144 CG PHE A 232 13.291 23.660 13.197 1.00 26.52 C ATOM 145 CD1 PHE A 232 14.403 24.458 13.442 1.00 29.35 C ATOM 146 CD2 PHE A 232 12.120 23.919 13.910 1.00 28.99 C ATOM 147 CE1 PHE A 232 14.328 25.546 14.319 1.00 31.35 C ATOM 148 CE2 PHE A 232 12.049 25.012 14.783 1.00 31.96 C ATOM 149 CZ PHE A 232 13.159 25.793 15.001 1.00 30.33 C ATOM 150 H PHE A 232 13.407 21.153 14.927 1.00 0.00 H ATOM 151 N LEU A 233 16.263 21.503 12.131 1.00 22.37 N ATOM 152 CA LEU A 233 17.676 21.890 12.205 1.00 22.86 C ATOM 153 C LEU A 233 17.812 23.144 11.345 1.00 27.48 C ATOM 154 O LEU A 233 17.483 23.114 10.162 1.00 27.84 O ATOM 155 CB LEU A 233 18.555 20.736 11.640 1.00 23.28 C ATOM 156 CG LEU A 233 20.046 21.053 11.352 1.00 28.55 C ATOM 157 CD1 LEU A 233 20.765 21.624 12.563 1.00 28.78 C ATOM 158 CD2 LEU A 233 20.773 19.831 10.743 1.00 29.27 C ATOM 159 H LEU A 233 15.870 21.295 11.191 1.00 0.00 H ATOM 160 N GLU A 234 18.278 24.255 11.947 1.00 24.12 N ATOM 161 CA GLU A 234 18.541 25.494 11.228 1.00 25.52 C ATOM 162 C GLU A 234 20.044 25.713 11.181 1.00 31.48 C ATOM 163 O GLU A 234 20.711 25.658 12.221 1.00 30.97 O ATOM 164 CB GLU A 234 17.823 26.676 11.887 1.00 27.78 C ATOM 165 CG GLU A 234 18.189 27.996 11.241 1.00 37.82 C ATOM 166 CD GLU A 234 17.621 29.139 12.042 1.00 59.19 C ATOM 167 OE1 GLU A 234 18.277 29.587 13.011 1.00 64.64 O ATOM 168 OE2 GLU A 234 16.491 29.559 11.715 1.00 46.47 O ATOM 169 H GLU A 234 18.458 24.227 12.971 1.00 0.00 H ATOM 170 N GLN A 235 20.581 25.921 9.965 1.00 28.95 N ATOM 171 CA GLN A 235 21.986 26.193 9.736 1.00 29.82 C ATOM 172 C GLN A 235 22.170 27.630 9.279 1.00 33.70 C ATOM 173 O GLN A 235 21.526 28.049 8.318 1.00 30.94 O ATOM 174 CB GLN A 235 22.614 25.201 8.742 1.00 31.93 C ATOM 175 CG GLN A 235 22.485 23.754 9.265 1.00 39.36 C ATOM 176 CD GLN A 235 22.954 22.685 8.303 1.00 56.86 C ATOM 177 OE1 GLN A 235 22.172 22.106 7.530 1.00 47.69 O ATOM 178 NE2 GLN A 235 24.237 22.373 8.361 1.00 51.62 N ATOM 179 HE22 GLN A 235 24.865 22.877 9.019 1.00 0.00 H ATOM 180 HE21 GLN A 235 24.618 21.624 7.749 1.00 0.00 H ATOM 181 H GLN A 235 19.950 25.884 9.139 1.00 0.00 H ATOM 182 N GLN A 236 23.037 28.372 9.976 1.00 32.69 N ATOM 183 CA GLN A 236 23.335 29.759 9.623 1.00 33.55 C ATOM 184 C GLN A 236 24.582 29.754 8.748 1.00 39.98 C ATOM 185 O GLN A 236 25.673 29.460 9.242 1.00 41.54 O ATOM 186 CB GLN A 236 23.549 30.603 10.890 1.00 35.34 C ATOM 187 CG GLN A 236 24.031 32.025 10.606 1.00 39.68 C ATOM 188 CD GLN A 236 24.465 32.721 11.865 1.00 63.65 C ATOM 189 OE1 GLN A 236 23.646 33.198 12.653 1.00 57.92 O ATOM 190 NE2 GLN A 236 25.770 32.772 12.088 1.00 64.06 N ATOM 191 HE22 GLN A 236 26.432 32.359 11.400 1.00 0.00 H ATOM 192 HE21 GLN A 236 26.133 33.225 12.951 1.00 0.00 H ATOM 193 H GLN A 236 23.515 27.948 10.797 1.00 0.00 H ATOM 194 N GLN A 237 24.417 30.020 7.443 1.00 37.26 N ATOM 195 CA GLN A 237 25.519 30.059 6.473 1.00 39.34 C ATOM 196 C GLN A 237 26.353 31.334 6.688 1.00 43.50 C ATOM 197 O GLN A 237 27.594 31.295 6.649 1.00 44.59 O ATOM 198 CB GLN A 237 24.945 29.984 5.042 1.00 42.38 C ATOM 199 CG GLN A 237 25.994 30.144 3.928 1.00 66.73 C ATOM 200 CD GLN A 237 25.390 30.340 2.555 1.00 91.42 C ATOM 201 OE1 GLN A 237 24.444 29.645 2.146 1.00 86.26 O ATOM 202 NE2 GLN A 237 25.944 31.287 1.803 1.00 82.39 N ATOM 203 HE22 GLN A 237 26.734 31.851 2.176 1.00 0.00 H ATOM 204 HE21 GLN A 237 25.587 31.464 0.842 1.00 0.00 H ATOM 205 H GLN A 237 23.454 30.209 7.099 1.00 0.00 H ATOM 206 N ASP A 238 25.657 32.468 6.907 1.00 38.60 N ATOM 207 CA ASP A 238 26.226 33.785 7.210 1.00 38.19 C ATOM 208 C ASP A 238 25.168 34.569 7.991 1.00 39.70 C ATOM 209 O ASP A 238 24.030 34.081 8.055 1.00 34.98 O ATOM 210 CB ASP A 238 26.713 34.526 5.944 1.00 41.12 C ATOM 211 CG ASP A 238 25.689 34.659 4.848 1.00 47.84 C ATOM 212 OD1 ASP A 238 24.655 35.341 5.078 1.00 44.72 O ATOM 213 OD2 ASP A 238 25.920 34.088 3.750 1.00 52.58 O ATOM 214 H ASP A 238 24.620 32.402 6.856 1.00 0.00 H ATOM 215 N PRO A 239 25.450 35.774 8.576 1.00 36.45 N ATOM 216 CA PRO A 239 24.395 36.444 9.353 1.00 35.42 C ATOM 217 C PRO A 239 23.097 36.716 8.598 1.00 34.75 C ATOM 218 O PRO A 239 22.076 36.890 9.250 1.00 35.07 O ATOM 219 CB PRO A 239 25.073 37.729 9.851 1.00 37.62 C ATOM 220 CG PRO A 239 26.518 37.401 9.868 1.00 42.23 C ATOM 221 CD PRO A 239 26.726 36.524 8.662 1.00 38.13 C ATOM 222 N ASP A 240 23.109 36.716 7.245 1.00 27.78 N ATOM 223 CA ASP A 240 21.858 36.947 6.485 1.00 25.24 C ATOM 224 C ASP A 240 21.302 35.726 5.790 1.00 30.61 C ATOM 225 O ASP A 240 20.291 35.853 5.097 1.00 29.87 O ATOM 226 CB ASP A 240 22.107 38.035 5.413 1.00 25.47 C ATOM 227 CG ASP A 240 22.401 39.400 5.994 1.00 30.28 C ATOM 228 OD1 ASP A 240 22.221 39.574 7.198 1.00 30.56 O ATOM 229 OD2 ASP A 240 22.876 40.253 5.256 1.00 32.90 O ATOM 230 H ASP A 240 24.001 36.553 6.736 1.00 0.00 H ATOM 231 N THR A 241 21.901 34.539 5.993 1.00 27.51 N ATOM 232 CA THR A 241 21.476 33.363 5.257 1.00 27.39 C ATOM 233 C THR A 241 21.289 32.191 6.193 1.00 29.41 C ATOM 234 O THR A 241 22.242 31.791 6.874 1.00 28.79 O ATOM 235 CB THR A 241 22.526 33.032 4.186 1.00 36.66 C ATOM 236 OG1 THR A 241 22.807 34.200 3.400 1.00 36.06 O ATOM 237 CG2 THR A 241 22.128 31.830 3.304 1.00 37.25 C ATOM 238 HG1 THR A 241 21.976 34.507 2.959 1.00 0.00 H ATOM 239 H THR A 241 22.675 34.463 6.683 1.00 0.00 H ATOM 240 N TYR A 242 20.089 31.615 6.156 1.00 27.94 N ATOM 241 CA TYR A 242 19.693 30.483 6.985 1.00 27.47 C ATOM 242 C TYR A 242 19.063 29.398 6.133 1.00 30.66 C ATOM 243 O TYR A 242 18.318 29.701 5.209 1.00 31.12 O ATOM 244 CB TYR A 242 18.674 30.940 8.062 1.00 30.10 C ATOM 245 CG TYR A 242 19.261 31.938 9.036 1.00 35.49 C ATOM 246 CD1 TYR A 242 19.324 33.298 8.722 1.00 37.54 C ATOM 247 CD2 TYR A 242 19.822 31.519 10.240 1.00 38.10 C ATOM 248 CE1 TYR A 242 19.941 34.208 9.577 1.00 39.05 C ATOM 249 CE2 TYR A 242 20.417 32.427 11.116 1.00 40.00 C ATOM 250 CZ TYR A 242 20.472 33.771 10.779 1.00 48.37 C ATOM 251 OH TYR A 242 21.073 34.669 11.627 1.00 53.38 O ATOM 252 HH TYR A 242 22.021 34.416 11.756 1.00 0.00 H ATOM 253 H TYR A 242 19.387 31.998 5.491 1.00 0.00 H ATOM 254 N ASN A 243 19.337 28.146 6.470 1.00 25.32 N ATOM 255 CA ASN A 243 18.729 26.976 5.803 1.00 25.20 C ATOM 256 C ASN A 243 18.043 26.208 6.912 1.00 30.04 C ATOM 257 O ASN A 243 18.644 26.012 7.969 1.00 32.06 O ATOM 258 CB ASN A 243 19.792 26.127 5.107 1.00 29.41 C ATOM 259 CG ASN A 243 20.385 26.881 3.942 1.00 54.18 C ATOM 260 OD1 ASN A 243 19.698 27.170 2.950 1.00 47.14 O ATOM 261 ND2 ASN A 243 21.655 27.269 4.058 1.00 51.24 N ATOM 262 HD22 ASN A 243 22.203 27.010 4.903 1.00 0.00 H ATOM 263 HD21 ASN A 243 22.098 27.831 3.303 1.00 0.00 H ATOM 264 H ASN A 243 20.013 27.979 7.242 1.00 0.00 H ATOM 265 N LYS A 244 16.773 25.853 6.726 1.00 23.85 N ATOM 266 CA LYS A 244 16.049 25.133 7.769 1.00 22.87 C ATOM 267 C LYS A 244 15.536 23.821 7.191 1.00 26.09 C ATOM 268 O LYS A 244 14.913 23.827 6.128 1.00 25.40 O ATOM 269 CB LYS A 244 14.907 25.976 8.326 1.00 25.79 C ATOM 270 CG LYS A 244 13.997 25.227 9.309 1.00 30.66 C ATOM 271 CD LYS A 244 13.189 26.203 10.140 1.00 34.93 C ATOM 272 CE LYS A 244 11.796 26.381 9.610 1.00 44.31 C ATOM 273 NZ LYS A 244 11.025 27.337 10.455 1.00 55.67 N ATOM 274 HZ1 LYS A 244 10.970 26.972 11.427 1.00 0.00 H ATOM 275 HZ2 LYS A 244 11.504 28.260 10.457 1.00 0.00 H ATOM 276 HZ3 LYS A 244 10.065 27.443 10.068 1.00 0.00 H ATOM 277 H LYS A 244 16.295 26.090 5.833 1.00 0.00 H ATOM 278 N HIS A 245 15.797 22.724 7.902 1.00 21.83 N ATOM 279 CA HIS A 245 15.343 21.372 7.517 1.00 20.60 C ATOM 280 C HIS A 245 14.328 20.919 8.564 1.00 24.37 C ATOM 281 O HIS A 245 14.681 20.845 9.740 1.00 25.05 O ATOM 282 CB HIS A 245 16.518 20.387 7.459 1.00 21.73 C ATOM 283 CG HIS A 245 16.051 18.969 7.319 1.00 24.01 C ATOM 284 ND1 HIS A 245 15.760 18.435 6.075 1.00 24.61 N ATOM 285 CD2 HIS A 245 15.703 18.070 8.269 1.00 24.87 C ATOM 286 CE1 HIS A 245 15.351 17.197 6.299 1.00 23.66 C ATOM 287 NE2 HIS A 245 15.275 16.940 7.605 1.00 24.56 N ATOM 288 H HIS A 245 16.351 22.826 8.776 1.00 0.00 H ATOM 289 N LEU A 246 13.105 20.558 8.152 1.00 21.00 N ATOM 290 CA LEU A 246 12.104 20.062 9.095 1.00 20.62 C ATOM 291 C LEU A 246 12.255 18.534 9.164 1.00 23.82 C ATOM 292 O LEU A 246 12.226 17.874 8.130 1.00 23.33 O ATOM 293 CB LEU A 246 10.654 20.384 8.651 1.00 21.72 C ATOM 294 CG LEU A 246 10.325 21.872 8.373 1.00 24.22 C ATOM 295 CD1 LEU A 246 8.819 22.039 8.083 1.00 24.44 C ATOM 296 CD2 LEU A 246 10.702 22.765 9.547 1.00 28.65 C ATOM 297 H LEU A 246 12.864 20.632 7.143 1.00 0.00 H ATOM 298 N PHE A 247 12.441 17.994 10.367 1.00 19.93 N ATOM 299 CA PHE A 247 12.441 16.549 10.596 1.00 19.78 C ATOM 300 C PHE A 247 11.021 15.998 10.568 1.00 21.93 C ATOM 301 O PHE A 247 10.775 14.939 9.982 1.00 21.95 O ATOM 302 CB PHE A 247 13.027 16.243 11.976 1.00 21.90 C ATOM 303 CG PHE A 247 14.509 16.516 12.017 1.00 23.35 C ATOM 304 CD1 PHE A 247 15.401 15.695 11.327 1.00 25.41 C ATOM 305 CD2 PHE A 247 15.011 17.601 12.730 1.00 25.91 C ATOM 306 CE1 PHE A 247 16.769 15.947 11.354 1.00 27.67 C ATOM 307 CE2 PHE A 247 16.390 17.863 12.750 1.00 27.39 C ATOM 308 CZ PHE A 247 17.252 17.033 12.060 1.00 27.18 C ATOM 309 H PHE A 247 12.593 18.627 11.178 1.00 0.00 H ATOM 310 N VAL A 248 10.094 16.696 11.251 1.00 19.99 N ATOM 311 CA VAL A 248 8.687 16.285 11.400 1.00 19.85 C ATOM 312 C VAL A 248 7.874 17.574 11.452 1.00 22.99 C ATOM 313 O VAL A 248 8.400 18.628 11.846 1.00 21.28 O ATOM 314 CB VAL A 248 8.407 15.407 12.674 1.00 21.77 C ATOM 315 CG1 VAL A 248 9.088 14.046 12.591 1.00 21.35 C ATOM 316 CG2 VAL A 248 8.772 16.122 13.988 1.00 22.32 C ATOM 317 H VAL A 248 10.391 17.584 11.703 1.00 0.00 H ATOM 318 N HIS A 249 6.614 17.496 11.061 1.00 19.74 N ATOM 319 CA HIS A 249 5.758 18.684 11.107 1.00 20.02 C ATOM 320 C HIS A 249 4.283 18.322 11.019 1.00 23.98 C ATOM 321 O HIS A 249 3.887 17.426 10.269 1.00 22.39 O ATOM 322 CB HIS A 249 6.109 19.733 10.003 1.00 20.48 C ATOM 323 CG HIS A 249 6.126 19.163 8.612 1.00 23.32 C ATOM 324 ND1 HIS A 249 4.968 19.045 7.869 1.00 25.85 N ATOM 325 CD2 HIS A 249 7.168 18.731 7.863 1.00 25.52 C ATOM 326 CE1 HIS A 249 5.330 18.532 6.700 1.00 25.36 C ATOM 327 NE2 HIS A 249 6.644 18.321 6.651 1.00 25.15 N ATOM 328 H HIS A 249 6.230 16.591 10.721 1.00 0.00 H ATOM 329 N ILE A 250 3.468 19.137 11.707 1.00 20.44 N ATOM 330 CA ILE A 250 2.014 19.078 11.641 1.00 19.68 C ATOM 331 C ILE A 250 1.584 20.548 11.431 1.00 25.28 C ATOM 332 O ILE A 250 2.157 21.434 12.063 1.00 24.66 O ATOM 333 CB ILE A 250 1.443 18.544 12.992 1.00 22.43 C ATOM 334 CG1 ILE A 250 1.860 17.056 13.244 1.00 23.41 C ATOM 335 CG2 ILE A 250 -0.099 18.712 13.029 1.00 24.14 C ATOM 336 CD1 ILE A 250 1.487 16.550 14.641 1.00 31.01 C ATOM 337 H ILE A 250 3.901 19.854 12.324 1.00 0.00 H ATOM 338 N GLY A 251 0.588 20.776 10.586 1.00 25.58 N ATOM 339 CA GLY A 251 0.005 22.119 10.423 1.00 27.77 C ATOM 340 C GLY A 251 0.632 23.059 9.418 1.00 40.30 C ATOM 341 O GLY A 251 0.285 24.246 9.383 1.00 41.41 O ATOM 342 H GLY A 251 0.209 19.987 10.024 1.00 0.00 H ATOM 343 N GLN A 252 1.543 22.551 8.593 1.00 41.93 N ATOM 344 CA GLN A 252 2.224 23.342 7.562 1.00 44.95 C ATOM 345 C GLN A 252 1.239 23.662 6.432 1.00 54.27 C ATOM 346 O GLN A 252 1.263 24.777 5.898 1.00 56.27 O ATOM 347 CB GLN A 252 3.448 22.564 7.054 1.00 46.50 C ATOM 348 CG GLN A 252 4.236 23.201 5.929 1.00 63.27 C ATOM 349 CD GLN A 252 5.045 22.133 5.248 1.00 75.38 C ATOM 350 OE1 GLN A 252 4.626 21.536 4.244 1.00 67.70 O ATOM 351 NE2 GLN A 252 6.203 21.844 5.811 1.00 62.56 N ATOM 352 HE22 GLN A 252 6.518 22.369 6.652 1.00 0.00 H ATOM 353 HE21 GLN A 252 6.801 21.092 5.414 1.00 0.00 H ATOM 354 H GLN A 252 1.785 21.543 8.683 1.00 0.00 H ATOM 355 N SER A 253 0.347 22.701 6.112 1.00 51.59 N ATOM 356 CA SER A 253 -0.680 22.818 5.071 1.00 86.83 C ATOM 357 C SER A 253 -1.913 21.980 5.420 1.00113.37 C ATOM 358 O SER A 253 -2.681 22.338 6.311 1.00 73.86 O ATOM 359 CB SER A 253 -0.122 22.382 3.717 1.00 90.42 C ATOM 360 OG SER A 253 0.268 21.018 3.726 1.00 99.47 O ATOM 361 HG SER A 253 0.623 20.772 2.835 1.00 0.00 H ATOM 362 H SER A 253 0.391 21.809 6.644 1.00 0.00 H TER 363 SER A 253 ATOM 364 N TYR A 261 -13.193 11.189 10.453 1.00 42.23 N ATOM 365 CA TYR A 261 -12.885 10.940 11.859 1.00 40.90 C ATOM 366 C TYR A 261 -11.498 10.324 12.026 1.00 41.51 C ATOM 367 O TYR A 261 -11.009 9.644 11.118 1.00 42.54 O ATOM 368 CB TYR A 261 -14.001 10.128 12.573 1.00 42.36 C ATOM 369 CG TYR A 261 -14.054 8.628 12.322 1.00 43.72 C ATOM 370 CD1 TYR A 261 -13.329 7.743 13.117 1.00 44.26 C ATOM 371 CD2 TYR A 261 -14.982 8.084 11.435 1.00 45.17 C ATOM 372 CE1 TYR A 261 -13.398 6.365 12.920 1.00 43.82 C ATOM 373 CE2 TYR A 261 -15.092 6.702 11.253 1.00 46.35 C ATOM 374 CZ TYR A 261 -14.297 5.845 11.999 1.00 52.37 C ATOM 375 OH TYR A 261 -14.417 4.481 11.826 1.00 48.55 O ATOM 376 HH TYR A 261 -13.784 4.016 12.429 1.00 0.00 H ATOM 377 HN3 TYR A 261 -13.165 10.291 9.929 1.00 0.00 H ATOM 378 HN2 TYR A 261 -12.490 11.845 10.056 1.00 0.00 H ATOM 379 HN1 TYR A 261 -14.142 11.607 10.376 1.00 0.00 H ATOM 380 N LEU A 262 -10.843 10.585 13.162 1.00 33.44 N ATOM 381 CA LEU A 262 -9.514 10.018 13.396 1.00 30.02 C ATOM 382 C LEU A 262 -9.644 8.573 13.785 1.00 31.91 C ATOM 383 O LEU A 262 -10.513 8.210 14.570 1.00 30.37 O ATOM 384 CB LEU A 262 -8.709 10.759 14.487 1.00 28.87 C ATOM 385 CG LEU A 262 -8.346 12.230 14.249 1.00 31.78 C ATOM 386 CD1 LEU A 262 -7.842 12.845 15.530 1.00 31.33 C ATOM 387 CD2 LEU A 262 -7.309 12.378 13.119 1.00 31.57 C ATOM 388 H LEU A 262 -11.280 11.194 13.883 1.00 0.00 H ATOM 389 N GLU A 263 -8.772 7.736 13.244 1.00 27.81 N ATOM 390 CA GLU A 263 -8.757 6.334 13.625 1.00 28.32 C ATOM 391 C GLU A 263 -8.326 6.218 15.093 1.00 28.69 C ATOM 392 O GLU A 263 -7.524 7.025 15.580 1.00 25.80 O ATOM 393 CB GLU A 263 -7.698 5.646 12.798 1.00 30.66 C ATOM 394 CG GLU A 263 -8.253 4.522 12.000 1.00 43.49 C ATOM 395 CD GLU A 263 -7.261 3.988 10.997 1.00 60.85 C ATOM 396 OE1 GLU A 263 -7.205 2.748 10.892 1.00 46.91 O ATOM 397 OE2 GLU A 263 -6.574 4.777 10.303 1.00 49.81 O ATOM 398 H GLU A 263 -8.091 8.086 12.540 1.00 0.00 H ATOM 399 N ALA A 264 -8.806 5.190 15.764 1.00 28.71 N ATOM 400 CA ALA A 264 -8.432 4.968 17.160 1.00 29.39 C ATOM 401 C ALA A 264 -7.284 3.983 17.237 1.00 33.40 C ATOM 402 O ALA A 264 -7.191 3.090 16.384 1.00 32.71 O ATOM 403 CB ALA A 264 -9.646 4.440 17.932 1.00 29.58 C ATOM 404 H ALA A 264 -9.458 4.529 15.295 1.00 0.00 H ATOM 405 N VAL A 265 -6.426 4.120 18.280 1.00 29.06 N ATOM 406 CA VAL A 265 -5.376 3.170 18.649 1.00 28.49 C ATOM 407 C VAL A 265 -5.642 2.746 20.103 1.00 29.09 C ATOM 408 O VAL A 265 -5.815 3.585 20.990 1.00 27.39 O ATOM 409 CB VAL A 265 -3.903 3.624 18.444 1.00 32.94 C ATOM 410 CG1 VAL A 265 -2.932 2.755 19.254 1.00 32.34 C ATOM 411 CG2 VAL A 265 -3.511 3.599 16.975 1.00 33.35 C ATOM 412 H VAL A 265 -6.523 4.973 18.867 1.00 0.00 H ATOM 413 N ASP A 266 -5.634 1.433 20.348 1.00 24.68 N ATOM 414 CA ASP A 266 -5.843 0.892 21.680 1.00 24.84 C ATOM 415 C ASP A 266 -4.595 1.204 22.495 1.00 27.84 C ATOM 416 O ASP A 266 -3.492 0.786 22.130 1.00 26.39 O ATOM 417 CB ASP A 266 -6.085 -0.628 21.580 1.00 26.06 C ATOM 418 CG ASP A 266 -6.136 -1.397 22.879 1.00 33.15 C ATOM 419 OD1 ASP A 266 -6.067 -0.762 23.957 1.00 28.71 O ATOM 420 OD2 ASP A 266 -6.226 -2.646 22.820 1.00 39.69 O ATOM 421 H ASP A 266 -5.473 0.776 19.558 1.00 0.00 H ATOM 422 N ILE A 267 -4.786 1.910 23.604 1.00 28.10 N ATOM 423 CA ILE A 267 -3.685 2.383 24.470 1.00 30.17 C ATOM 424 C ILE A 267 -2.865 1.241 25.078 1.00 34.89 C ATOM 425 O ILE A 267 -1.671 1.410 25.351 1.00 36.29 O ATOM 426 CB ILE A 267 -4.177 3.410 25.544 1.00 33.56 C ATOM 427 CG1 ILE A 267 -2.982 4.263 26.083 1.00 34.84 C ATOM 428 CG2 ILE A 267 -4.968 2.739 26.695 1.00 34.00 C ATOM 429 CD1 ILE A 267 -3.328 5.728 26.415 1.00 43.03 C ATOM 430 H ILE A 267 -5.762 2.142 23.878 1.00 0.00 H ATOM 431 N ARG A 268 -3.487 0.066 25.264 1.00 30.86 N ATOM 432 CA ARG A 268 -2.845 -1.104 25.829 1.00 31.06 C ATOM 433 C ARG A 268 -1.762 -1.608 24.894 1.00 33.63 C ATOM 434 O ARG A 268 -0.787 -2.200 25.337 1.00 35.28 O ATOM 435 CB ARG A 268 -3.908 -2.198 26.127 1.00 30.94 C ATOM 436 CG ARG A 268 -4.860 -1.770 27.244 1.00 48.75 C ATOM 437 CD ARG A 268 -6.330 -1.897 26.879 1.00 67.35 C ATOM 438 NE ARG A 268 -6.884 -3.191 27.277 1.00 83.65 N ATOM 439 CZ ARG A 268 -7.862 -3.819 26.631 1.00100.87 C ATOM 440 NH1 ARG A 268 -8.400 -3.284 25.540 1.00 87.52 N ATOM 441 NH2 ARG A 268 -8.307 -4.990 27.067 1.00 90.53 N ATOM 442 HE ARG A 268 -6.487 -3.650 28.121 1.00 0.00 H ATOM 443 HH12 ARG A 268 -9.165 -3.781 25.040 1.00 0.00 H ATOM 444 HH11 ARG A 268 -8.056 -2.368 25.186 1.00 0.00 H ATOM 445 HH22 ARG A 268 -9.072 -5.478 26.559 1.00 0.00 H ATOM 446 HH21 ARG A 268 -7.891 -5.421 27.917 1.00 0.00 H ATOM 447 H ARG A 268 -4.487 -0.009 24.987 1.00 0.00 H ATOM 448 N GLN A 269 -1.880 -1.280 23.613 1.00 29.00 N ATOM 449 CA GLN A 269 -0.911 -1.673 22.604 1.00 29.22 C ATOM 450 C GLN A 269 0.396 -0.847 22.609 1.00 30.77 C ATOM 451 O GLN A 269 1.350 -1.238 21.944 1.00 30.91 O ATOM 452 CB GLN A 269 -1.558 -1.660 21.211 1.00 31.66 C ATOM 453 CG GLN A 269 -2.745 -2.624 21.099 1.00 31.86 C ATOM 454 CD GLN A 269 -2.327 -4.043 21.413 1.00 31.73 C ATOM 455 OE1 GLN A 269 -1.332 -4.548 20.896 1.00 34.61 O ATOM 456 NE2 GLN A 269 -3.065 -4.715 22.269 1.00 37.28 N ATOM 457 HE22 GLN A 269 -3.903 -4.270 22.695 1.00 0.00 H ATOM 458 HE21 GLN A 269 -2.811 -5.692 22.520 1.00 0.00 H ATOM 459 H GLN A 269 -2.703 -0.716 23.318 1.00 0.00 H ATOM 460 N ILE A 270 0.404 0.322 23.271 1.00 28.01 N ATOM 461 CA ILE A 270 1.577 1.209 23.311 1.00 28.83 C ATOM 462 C ILE A 270 2.055 1.531 24.721 1.00 35.43 C ATOM 463 O ILE A 270 3.070 2.230 24.841 1.00 32.32 O ATOM 464 CB ILE A 270 1.367 2.534 22.516 1.00 31.19 C ATOM 465 CG1 ILE A 270 0.264 3.405 23.178 1.00 32.54 C ATOM 466 CG2 ILE A 270 1.131 2.282 21.019 1.00 32.00 C ATOM 467 CD1 ILE A 270 0.521 4.852 23.218 1.00 45.23 C ATOM 468 H ILE A 270 -0.457 0.613 23.777 1.00 0.00 H ATOM 469 N TYR A 271 1.317 1.097 25.783 1.00 34.15 N ATOM 470 CA TYR A 271 1.673 1.429 27.177 1.00 35.97 C ATOM 471 C TYR A 271 3.190 1.234 27.504 1.00 39.77 C ATOM 472 O TYR A 271 3.801 2.156 28.036 1.00 39.97 O ATOM 473 CB TYR A 271 0.760 0.712 28.223 1.00 38.98 C ATOM 474 CG TYR A 271 1.253 -0.641 28.709 1.00 45.11 C ATOM 475 CD1 TYR A 271 1.137 -1.777 27.912 1.00 48.06 C ATOM 476 CD2 TYR A 271 1.866 -0.779 29.955 1.00 47.17 C ATOM 477 CE1 TYR A 271 1.622 -3.018 28.338 1.00 48.08 C ATOM 478 CE2 TYR A 271 2.347 -2.017 30.395 1.00 48.45 C ATOM 479 CZ TYR A 271 2.230 -3.132 29.579 1.00 57.79 C ATOM 480 OH TYR A 271 2.705 -4.357 30.002 1.00 63.10 O ATOM 481 HH TYR A 271 2.539 -5.034 29.299 1.00 0.00 H ATOM 482 H TYR A 271 0.475 0.513 25.605 1.00 0.00 H ATOM 483 N ASP A 272 3.794 0.097 27.108 1.00 34.36 N ATOM 484 CA ASP A 272 5.205 -0.255 27.393 1.00 34.24 C ATOM 485 C ASP A 272 6.263 0.583 26.604 1.00 36.67 C ATOM 486 O ASP A 272 7.464 0.367 26.759 1.00 36.58 O ATOM 487 CB ASP A 272 5.424 -1.754 27.146 1.00 36.13 C ATOM 488 CG ASP A 272 5.445 -2.086 25.676 1.00 52.17 C ATOM 489 OD1 ASP A 272 4.646 -1.496 24.929 1.00 54.42 O ATOM 490 OD2 ASP A 272 6.276 -2.923 25.268 1.00 59.43 O ATOM 491 H ASP A 272 3.228 -0.584 26.562 1.00 0.00 H ATOM 492 N LYS A 273 5.815 1.498 25.740 1.00 30.05 N ATOM 493 CA LYS A 273 6.731 2.341 24.969 1.00 28.19 C ATOM 494 C LYS A 273 6.799 3.707 25.609 1.00 30.13 C ATOM 495 O LYS A 273 7.471 4.598 25.101 1.00 28.38 O ATOM 496 CB LYS A 273 6.260 2.461 23.503 1.00 30.12 C ATOM 497 CG LYS A 273 6.389 1.169 22.702 1.00 37.78 C ATOM 498 CD LYS A 273 7.853 0.834 22.388 1.00 38.61 C ATOM 499 CE LYS A 273 7.974 -0.448 21.625 1.00 46.59 C ATOM 500 NZ LYS A 273 9.227 -1.176 21.949 1.00 58.34 N ATOM 501 HZ1 LYS A 273 10.045 -0.579 21.711 1.00 0.00 H ATOM 502 HZ2 LYS A 273 9.243 -1.400 22.964 1.00 0.00 H ATOM 503 HZ3 LYS A 273 9.267 -2.057 21.397 1.00 0.00 H ATOM 504 H LYS A 273 4.790 1.615 25.612 1.00 0.00 H ATOM 505 N PHE A 274 6.061 3.891 26.709 1.00 25.19 N ATOM 506 CA PHE A 274 5.985 5.162 27.416 1.00 25.96 C ATOM 507 C PHE A 274 6.185 4.923 28.919 1.00 31.67 C ATOM 508 O PHE A 274 6.058 3.780 29.334 1.00 32.72 O ATOM 509 CB PHE A 274 4.627 5.859 27.115 1.00 26.36 C ATOM 510 CG PHE A 274 4.581 6.293 25.675 1.00 26.75 C ATOM 511 CD1 PHE A 274 5.201 7.472 25.270 1.00 27.51 C ATOM 512 CD2 PHE A 274 4.023 5.465 24.696 1.00 25.90 C ATOM 513 CE1 PHE A 274 5.223 7.845 23.921 1.00 28.66 C ATOM 514 CE2 PHE A 274 4.075 5.826 23.338 1.00 28.45 C ATOM 515 CZ PHE A 274 4.682 7.012 22.964 1.00 26.48 C ATOM 516 H PHE A 274 5.514 3.087 27.078 1.00 0.00 H ATOM 517 N PRO A 275 6.513 5.953 29.737 1.00 31.24 N ATOM 518 CA PRO A 275 6.677 5.721 31.197 1.00 31.33 C ATOM 519 C PRO A 275 5.381 5.233 31.830 1.00 36.15 C ATOM 520 O PRO A 275 4.316 5.781 31.496 1.00 35.89 O ATOM 521 CB PRO A 275 7.101 7.091 31.750 1.00 33.66 C ATOM 522 CG PRO A 275 7.455 7.921 30.559 1.00 38.27 C ATOM 523 CD PRO A 275 6.690 7.381 29.395 1.00 33.61 C ATOM 524 N GLU A 276 5.458 4.146 32.646 1.00 32.26 N ATOM 525 CA GLU A 276 4.317 3.516 33.322 1.00 33.25 C ATOM 526 C GLU A 276 4.614 3.275 34.786 1.00 40.48 C ATOM 527 O GLU A 276 5.456 2.437 35.134 1.00 40.74 O ATOM 528 CB GLU A 276 3.881 2.201 32.644 1.00 34.22 C ATOM 529 CG GLU A 276 3.518 2.332 31.173 1.00 39.23 C ATOM 530 CD GLU A 276 2.456 3.350 30.774 1.00 41.18 C ATOM 531 OE1 GLU A 276 1.732 3.866 31.652 1.00 33.84 O ATOM 532 OE2 GLU A 276 2.380 3.666 29.571 1.00 38.07 O ATOM 533 H GLU A 276 6.398 3.730 32.803 1.00 0.00 H ATOM 534 N LYS A 277 3.922 4.044 35.631 1.00 37.16 N ATOM 535 CA LYS A 277 4.013 4.151 37.090 1.00 39.22 C ATOM 536 C LYS A 277 3.078 5.351 37.415 1.00 45.79 C ATOM 537 O LYS A 277 2.342 5.777 36.530 1.00 44.99 O ATOM 538 CB LYS A 277 5.470 4.502 37.506 1.00 42.31 C ATOM 539 H LYS A 277 3.211 4.660 35.187 1.00 0.00 H ATOM 540 N LYS A 278 3.095 5.884 38.659 1.00 43.96 N ATOM 541 CA LYS A 278 2.292 7.054 39.045 1.00 43.48 C ATOM 542 C LYS A 278 2.672 8.220 38.121 1.00 45.34 C ATOM 543 O LYS A 278 3.857 8.477 37.926 1.00 45.51 O ATOM 544 CB LYS A 278 2.524 7.420 40.532 1.00 45.83 C ATOM 545 H LYS A 278 3.706 5.445 39.377 1.00 0.00 H ATOM 546 N GLY A 279 1.679 8.831 37.478 1.00 40.33 N ATOM 547 CA GLY A 279 1.910 9.929 36.533 1.00 38.93 C ATOM 548 C GLY A 279 2.299 9.492 35.129 1.00 38.24 C ATOM 549 O GLY A 279 2.571 10.332 34.266 1.00 36.41 O ATOM 550 H GLY A 279 0.703 8.518 37.652 1.00 0.00 H ATOM 551 N GLY A 280 2.355 8.176 34.910 1.00 34.69 N ATOM 552 CA GLY A 280 2.673 7.594 33.616 1.00 32.65 C ATOM 553 C GLY A 280 1.515 7.741 32.643 1.00 35.07 C ATOM 554 O GLY A 280 0.463 8.283 33.009 1.00 32.26 O ATOM 555 H GLY A 280 2.161 7.535 35.705 1.00 0.00 H ATOM 556 N LEU A 281 1.720 7.293 31.394 1.00 30.99 N ATOM 557 CA LEU A 281 0.691 7.413 30.358 1.00 29.67 C ATOM 558 C LEU A 281 -0.620 6.730 30.765 1.00 31.18 C ATOM 559 O LEU A 281 -1.671 7.373 30.706 1.00 28.73 O ATOM 560 CB LEU A 281 1.176 6.899 28.995 1.00 29.38 C ATOM 561 CG LEU A 281 0.104 6.875 27.878 1.00 31.75 C ATOM 562 CD1 LEU A 281 -0.441 8.267 27.576 1.00 30.92 C ATOM 563 CD2 LEU A 281 0.621 6.176 26.654 1.00 33.48 C ATOM 564 H LEU A 281 2.631 6.850 31.156 1.00 0.00 H ATOM 565 N LYS A 282 -0.552 5.460 31.216 1.00 29.07 N ATOM 566 CA LYS A 282 -1.749 4.727 31.629 1.00 29.57 C ATOM 567 C LYS A 282 -2.450 5.467 32.752 1.00 34.48 C ATOM 568 O LYS A 282 -3.652 5.695 32.670 1.00 34.64 O ATOM 569 CB LYS A 282 -1.400 3.293 32.051 1.00 32.32 C ATOM 570 CG LYS A 282 -2.636 2.430 32.346 1.00 45.71 C ATOM 571 CD LYS A 282 -2.285 0.993 32.741 1.00 40.81 C ATOM 572 CE LYS A 282 -1.855 0.937 34.173 1.00 39.45 C ATOM 573 NZ LYS A 282 -3.002 0.705 35.091 1.00 46.11 N ATOM 574 HZ1 LYS A 282 -3.689 1.479 34.988 1.00 0.00 H ATOM 575 HZ2 LYS A 282 -3.458 -0.199 34.853 1.00 0.00 H ATOM 576 HZ3 LYS A 282 -2.658 0.673 36.072 1.00 0.00 H ATOM 577 H LYS A 282 0.374 4.991 31.271 1.00 0.00 H ATOM 578 N ASP A 283 -1.686 5.908 33.760 1.00 34.17 N ATOM 579 CA ASP A 283 -2.188 6.655 34.897 1.00 34.71 C ATOM 580 C ASP A 283 -2.866 7.982 34.482 1.00 35.85 C ATOM 581 O ASP A 283 -3.953 8.311 34.970 1.00 32.57 O ATOM 582 CB ASP A 283 -1.053 6.894 35.887 1.00 37.77 C ATOM 583 CG ASP A 283 -1.549 7.124 37.280 1.00 46.80 C ATOM 584 OD1 ASP A 283 -2.360 6.285 37.773 1.00 50.28 O ATOM 585 OD2 ASP A 283 -1.116 8.106 37.896 1.00 45.74 O ATOM 586 H ASP A 283 -0.667 5.701 33.725 1.00 0.00 H ATOM 587 N LEU A 284 -2.238 8.731 33.569 1.00 31.35 N ATOM 588 CA LEU A 284 -2.846 9.961 33.066 1.00 29.84 C ATOM 589 C LEU A 284 -4.108 9.658 32.263 1.00 29.42 C ATOM 590 O LEU A 284 -5.084 10.383 32.387 1.00 27.34 O ATOM 591 CB LEU A 284 -1.867 10.702 32.159 1.00 29.86 C ATOM 592 CG LEU A 284 -0.738 11.409 32.878 1.00 34.82 C ATOM 593 CD1 LEU A 284 0.377 11.687 31.916 1.00 35.52 C ATOM 594 CD2 LEU A 284 -1.242 12.652 33.645 1.00 37.76 C ATOM 595 H LEU A 284 -1.307 8.435 33.213 1.00 0.00 H ATOM 596 N PHE A 285 -4.061 8.631 31.401 1.00 25.12 N ATOM 597 CA PHE A 285 -5.202 8.234 30.581 1.00 24.90 C ATOM 598 C PHE A 285 -6.389 7.880 31.451 1.00 30.20 C ATOM 599 O PHE A 285 -7.492 8.335 31.160 1.00 27.82 O ATOM 600 CB PHE A 285 -4.850 7.123 29.569 1.00 25.84 C ATOM 601 CG PHE A 285 -5.993 6.785 28.648 1.00 26.16 C ATOM 602 CD1 PHE A 285 -6.265 7.572 27.531 1.00 28.31 C ATOM 603 CD2 PHE A 285 -6.847 5.717 28.930 1.00 27.37 C ATOM 604 CE1 PHE A 285 -7.345 7.270 26.692 1.00 29.35 C ATOM 605 CE2 PHE A 285 -7.959 5.462 28.122 1.00 29.54 C ATOM 606 CZ PHE A 285 -8.175 6.210 26.989 1.00 27.10 C ATOM 607 H PHE A 285 -3.174 8.095 31.313 1.00 0.00 H ATOM 608 N GLU A 286 -6.167 7.120 32.538 1.00 29.07 N ATOM 609 CA GLU A 286 -7.233 6.757 33.477 1.00 30.29 C ATOM 610 C GLU A 286 -7.861 7.987 34.153 1.00 34.49 C ATOM 611 O GLU A 286 -9.053 7.965 34.424 1.00 33.32 O ATOM 612 CB GLU A 286 -6.707 5.830 34.576 1.00 32.20 C ATOM 613 CG GLU A 286 -6.286 4.454 34.105 1.00 44.45 C ATOM 614 CD GLU A 286 -5.346 3.752 35.074 1.00 62.25 C ATOM 615 OE1 GLU A 286 -4.857 4.404 36.026 1.00 42.63 O ATOM 616 OE2 GLU A 286 -5.100 2.543 34.883 1.00 54.78 O ATOM 617 H GLU A 286 -5.202 6.777 32.720 1.00 0.00 H ATOM 618 N ARG A 287 -7.058 9.038 34.433 1.00 32.35 N ATOM 619 CA ARG A 287 -7.529 10.278 35.059 1.00 32.38 C ATOM 620 C ARG A 287 -8.358 11.070 34.047 1.00 36.43 C ATOM 621 O ARG A 287 -9.241 11.838 34.437 1.00 36.28 O ATOM 622 CB ARG A 287 -6.346 11.127 35.520 1.00 33.84 C ATOM 623 CG ARG A 287 -6.525 11.734 36.907 1.00 46.98 C ATOM 624 CD ARG A 287 -5.247 12.405 37.388 1.00 54.71 C ATOM 625 NE ARG A 287 -4.169 11.435 37.584 1.00 56.15 N ATOM 626 CZ ARG A 287 -2.874 11.730 37.572 1.00 71.83 C ATOM 627 NH1 ARG A 287 -2.472 12.979 37.370 1.00 57.22 N ATOM 628 NH2 ARG A 287 -1.969 10.778 37.755 1.00 62.76 N ATOM 629 HE ARG A 287 -4.436 10.443 37.744 1.00 0.00 H ATOM 630 HH12 ARG A 287 -1.457 13.204 37.362 1.00 0.00 H ATOM 631 HH11 ARG A 287 -3.173 13.733 37.220 1.00 0.00 H ATOM 632 HH22 ARG A 287 -0.956 11.014 37.745 1.00 0.00 H ATOM 633 HH21 ARG A 287 -2.272 9.795 37.909 1.00 0.00 H ATOM 634 H ARG A 287 -6.049 8.963 34.191 1.00 0.00 H ATOM 635 N GLY A 288 -8.042 10.883 32.767 1.00 32.05 N ATOM 636 CA GLY A 288 -8.726 11.519 31.656 1.00 32.02 C ATOM 637 C GLY A 288 -8.577 13.040 31.596 1.00 32.47 C ATOM 638 O GLY A 288 -7.714 13.617 32.264 1.00 31.48 O ATOM 639 H GLY A 288 -7.254 10.240 32.549 1.00 0.00 H ATOM 640 N PRO A 289 -9.469 13.722 30.839 1.00 29.50 N ATOM 641 CA PRO A 289 -10.535 13.136 30.007 1.00 30.01 C ATOM 642 C PRO A 289 -9.952 12.375 28.824 1.00 33.59 C ATOM 643 O PRO A 289 -8.948 12.784 28.265 1.00 31.69 O ATOM 644 CB PRO A 289 -11.354 14.354 29.575 1.00 31.55 C ATOM 645 CG PRO A 289 -10.343 15.481 29.540 1.00 35.13 C ATOM 646 CD PRO A 289 -9.412 15.196 30.694 1.00 31.43 C ATOM 647 N SER A 290 -10.596 11.280 28.445 1.00 33.59 N ATOM 648 CA SER A 290 -10.115 10.425 27.355 1.00 34.61 C ATOM 649 C SER A 290 -10.034 11.133 25.969 1.00 36.76 C ATOM 650 O SER A 290 -9.122 10.800 25.208 1.00 37.57 O ATOM 651 CB SER A 290 -10.939 9.143 27.284 1.00 37.36 C ATOM 652 OG SER A 290 -12.267 9.416 26.886 1.00 43.95 O ATOM 653 HG SER A 290 -12.262 9.841 25.992 1.00 0.00 H ATOM 654 H SER A 290 -11.473 11.018 28.938 1.00 0.00 H ATOM 655 N ASN A 291 -10.868 12.186 25.711 1.00 28.71 N ATOM 656 CA ASN A 291 -10.834 12.947 24.442 1.00 27.54 C ATOM 657 C ASN A 291 -9.586 13.868 24.341 1.00 27.02 C ATOM 658 O ASN A 291 -9.434 14.595 23.371 1.00 26.83 O ATOM 659 CB ASN A 291 -12.138 13.747 24.183 1.00 29.17 C ATOM 660 CG ASN A 291 -12.360 14.948 25.081 1.00 39.22 C ATOM 661 OD1 ASN A 291 -11.972 14.961 26.249 1.00 33.63 O ATOM 662 ND2 ASN A 291 -13.024 15.980 24.569 1.00 35.35 N ATOM 663 HD22 ASN A 291 -13.345 15.953 23.580 1.00 0.00 H ATOM 664 HD21 ASN A 291 -13.222 16.814 25.157 1.00 0.00 H ATOM 665 H ASN A 291 -11.557 12.464 26.439 1.00 0.00 H ATOM 666 N ALA A 292 -8.690 13.827 25.342 1.00 24.34 N ATOM 667 CA ALA A 292 -7.493 14.674 25.329 1.00 23.44 C ATOM 668 C ALA A 292 -6.246 13.905 24.875 1.00 25.06 C ATOM 669 O ALA A 292 -5.173 14.509 24.753 1.00 24.48 O ATOM 670 CB ALA A 292 -7.258 15.244 26.725 1.00 24.82 C ATOM 671 H ALA A 292 -8.849 13.182 26.142 1.00 0.00 H ATOM 672 N PHE A 293 -6.381 12.573 24.644 1.00 21.21 N ATOM 673 CA PHE A 293 -5.236 11.686 24.377 1.00 22.05 C ATOM 674 C PHE A 293 -5.119 11.280 22.937 1.00 24.34 C ATOM 675 O PHE A 293 -6.069 10.696 22.369 1.00 24.22 O ATOM 676 CB PHE A 293 -5.299 10.448 25.297 1.00 23.66 C ATOM 677 CG PHE A 293 -5.035 10.799 26.733 1.00 24.28 C ATOM 678 CD1 PHE A 293 -5.997 11.465 27.494 1.00 27.20 C ATOM 679 CD2 PHE A 293 -3.804 10.513 27.321 1.00 25.82 C ATOM 680 CE1 PHE A 293 -5.713 11.864 28.819 1.00 27.73 C ATOM 681 CE2 PHE A 293 -3.543 10.876 28.651 1.00 27.92 C ATOM 682 CZ PHE A 293 -4.487 11.581 29.374 1.00 26.28 C ATOM 683 H PHE A 293 -7.336 12.161 24.656 1.00 0.00 H ATOM 684 N PHE A 294 -3.931 11.563 22.364 1.00 20.71 N ATOM 685 CA PHE A 294 -3.628 11.299 20.963 1.00 19.66 C ATOM 686 C PHE A 294 -2.323 10.565 20.800 1.00 22.31 C ATOM 687 O PHE A 294 -1.414 10.731 21.618 1.00 22.73 O ATOM 688 CB PHE A 294 -3.572 12.617 20.135 1.00 19.65 C ATOM 689 CG PHE A 294 -4.900 13.357 20.132 1.00 21.43 C ATOM 690 CD1 PHE A 294 -5.247 14.207 21.187 1.00 24.97 C ATOM 691 CD2 PHE A 294 -5.827 13.156 19.108 1.00 22.74 C ATOM 692 CE1 PHE A 294 -6.517 14.809 21.242 1.00 25.75 C ATOM 693 CE2 PHE A 294 -7.079 13.781 19.144 1.00 26.01 C ATOM 694 CZ PHE A 294 -7.419 14.606 20.210 1.00 23.95 C ATOM 695 H PHE A 294 -3.191 11.993 22.954 1.00 0.00 H ATOM 696 N LEU A 295 -2.246 9.763 19.744 1.00 18.76 N ATOM 697 CA LEU A 295 -0.995 9.097 19.365 1.00 19.85 C ATOM 698 C LEU A 295 -0.619 9.575 17.955 1.00 19.97 C ATOM 699 O LEU A 295 -1.454 9.514 17.035 1.00 23.04 O ATOM 700 CB LEU A 295 -1.146 7.558 19.430 1.00 20.45 C ATOM 701 CG LEU A 295 0.027 6.734 18.777 1.00 27.36 C ATOM 702 CD1 LEU A 295 1.288 6.848 19.582 1.00 28.23 C ATOM 703 CD2 LEU A 295 -0.356 5.242 18.623 1.00 32.36 C ATOM 704 H LEU A 295 -3.098 9.602 19.169 1.00 0.00 H ATOM 705 N VAL A 296 0.561 10.171 17.805 1.00 19.48 N ATOM 706 CA VAL A 296 1.001 10.618 16.502 1.00 18.14 C ATOM 707 C VAL A 296 2.097 9.688 16.047 1.00 20.92 C ATOM 708 O VAL A 296 3.072 9.505 16.767 1.00 21.22 O ATOM 709 CB VAL A 296 1.501 12.087 16.512 1.00 23.45 C ATOM 710 CG1 VAL A 296 2.163 12.448 15.184 1.00 23.60 C ATOM 711 CG2 VAL A 296 0.361 13.038 16.817 1.00 23.29 C ATOM 712 H VAL A 296 1.173 10.317 18.633 1.00 0.00 H ATOM 713 N LYS A 297 1.958 9.113 14.865 1.00 19.60 N ATOM 714 CA LYS A 297 3.084 8.350 14.327 1.00 19.50 C ATOM 715 C LYS A 297 3.753 9.260 13.301 1.00 21.81 C ATOM 716 O LYS A 297 3.088 9.682 12.345 1.00 22.48 O ATOM 717 CB LYS A 297 2.675 7.049 13.635 1.00 20.61 C ATOM 718 CG LYS A 297 3.941 6.374 13.072 1.00 24.57 C ATOM 719 CD LYS A 297 3.785 4.916 12.814 1.00 21.89 C ATOM 720 CE LYS A 297 4.988 4.369 12.095 1.00 26.35 C ATOM 721 NZ LYS A 297 4.865 2.903 11.910 1.00 26.63 N ATOM 722 HZ1 LYS A 297 4.790 2.443 12.840 1.00 0.00 H ATOM 723 HZ2 LYS A 297 4.014 2.696 11.349 1.00 0.00 H ATOM 724 HZ3 LYS A 297 5.705 2.546 11.412 1.00 0.00 H ATOM 725 H LYS A 297 1.070 9.201 14.331 1.00 0.00 H ATOM 726 N PHE A 298 5.025 9.601 13.510 1.00 19.57 N ATOM 727 CA PHE A 298 5.766 10.406 12.530 1.00 18.70 C ATOM 728 C PHE A 298 6.640 9.528 11.659 1.00 23.65 C ATOM 729 O PHE A 298 7.384 8.703 12.194 1.00 24.30 O ATOM 730 CB PHE A 298 6.706 11.389 13.247 1.00 18.61 C ATOM 731 CG PHE A 298 6.022 12.678 13.638 1.00 18.12 C ATOM 732 CD1 PHE A 298 5.365 13.458 12.681 1.00 18.80 C ATOM 733 CD2 PHE A 298 6.111 13.162 14.940 1.00 20.35 C ATOM 734 CE1 PHE A 298 4.754 14.680 13.038 1.00 19.11 C ATOM 735 CE2 PHE A 298 5.536 14.411 15.289 1.00 22.06 C ATOM 736 CZ PHE A 298 4.878 15.169 14.334 1.00 19.98 C ATOM 737 H PHE A 298 5.501 9.292 14.382 1.00 0.00 H ATOM 738 N TRP A 299 6.661 9.795 10.352 1.00 21.62 N ATOM 739 CA TRP A 299 7.670 9.263 9.436 1.00 22.67 C ATOM 740 C TRP A 299 8.604 10.484 9.272 1.00 25.43 C ATOM 741 O TRP A 299 8.232 11.487 8.632 1.00 22.04 O ATOM 742 CB TRP A 299 7.079 8.848 8.092 1.00 21.99 C ATOM 743 CG TRP A 299 6.465 7.498 8.150 1.00 23.04 C ATOM 744 CD1 TRP A 299 7.051 6.323 7.787 1.00 25.61 C ATOM 745 CD2 TRP A 299 5.138 7.168 8.594 1.00 23.78 C ATOM 746 NE1 TRP A 299 6.182 5.274 7.992 1.00 25.64 N ATOM 747 CE2 TRP A 299 4.996 5.764 8.476 1.00 27.17 C ATOM 748 CE3 TRP A 299 4.038 7.926 9.029 1.00 25.21 C ATOM 749 CZ2 TRP A 299 3.797 5.102 8.778 1.00 26.68 C ATOM 750 CZ3 TRP A 299 2.867 7.256 9.394 1.00 26.53 C ATOM 751 CH2 TRP A 299 2.755 5.869 9.255 1.00 27.00 C ATOM 752 HE1 TRP A 299 6.392 4.272 7.809 1.00 0.00 H ATOM 753 H TRP A 299 5.921 10.414 9.964 1.00 0.00 H ATOM 754 N ALA A 300 9.746 10.434 9.972 1.00 22.18 N ATOM 755 CA ALA A 300 10.718 11.529 10.023 1.00 22.15 C ATOM 756 C ALA A 300 11.622 11.628 8.796 1.00 24.46 C ATOM 757 O ALA A 300 12.133 10.632 8.282 1.00 25.55 O ATOM 758 CB ALA A 300 11.556 11.422 11.291 1.00 23.39 C ATOM 759 H ALA A 300 9.954 9.568 10.510 1.00 0.00 H ATOM 760 N ASP A 301 11.847 12.865 8.352 1.00 22.86 N ATOM 761 CA ASP A 301 12.729 13.125 7.218 1.00 23.56 C ATOM 762 C ASP A 301 14.127 13.360 7.819 1.00 26.69 C ATOM 763 O ASP A 301 14.400 14.431 8.359 1.00 24.38 O ATOM 764 CB ASP A 301 12.251 14.389 6.477 1.00 23.70 C ATOM 765 CG ASP A 301 13.111 14.832 5.294 1.00 31.00 C ATOM 766 OD1 ASP A 301 14.209 14.240 5.088 1.00 30.12 O ATOM 767 OD2 ASP A 301 12.682 15.762 4.562 1.00 28.32 O ATOM 768 H ASP A 301 11.382 13.666 8.826 1.00 0.00 H ATOM 769 N LEU A 302 15.004 12.366 7.715 1.00 26.48 N ATOM 770 CA LEU A 302 16.352 12.452 8.278 1.00 29.24 C ATOM 771 C LEU A 302 17.390 12.860 7.220 1.00 36.59 C ATOM 772 O LEU A 302 18.599 12.810 7.474 1.00 35.78 O ATOM 773 CB LEU A 302 16.715 11.087 8.939 1.00 30.35 C ATOM 774 CG LEU A 302 15.784 10.679 10.097 1.00 37.08 C ATOM 775 CD1 LEU A 302 16.091 9.273 10.591 1.00 37.59 C ATOM 776 CD2 LEU A 302 15.812 11.712 11.257 1.00 40.42 C ATOM 777 H LEU A 302 14.722 11.498 7.217 1.00 0.00 H ATOM 778 N ASN A 303 16.906 13.260 6.035 1.00 35.35 N ATOM 779 CA ASN A 303 17.768 13.591 4.906 1.00 37.44 C ATOM 780 C ASN A 303 18.194 15.059 4.923 1.00 43.28 C ATOM 781 O ASN A 303 17.562 15.916 4.302 1.00 43.74 O ATOM 782 CB ASN A 303 17.109 13.156 3.582 1.00 38.39 C ATOM 783 CG ASN A 303 17.932 13.375 2.330 1.00 66.47 C ATOM 784 OD1 ASN A 303 17.386 13.587 1.241 1.00 62.98 O ATOM 785 ND2 ASN A 303 19.256 13.319 2.440 1.00 58.64 N ATOM 786 HD22 ASN A 303 19.694 13.139 3.366 1.00 0.00 H ATOM 787 HD21 ASN A 303 19.854 13.455 1.600 1.00 0.00 H ATOM 788 H ASN A 303 15.876 13.337 5.916 1.00 0.00 H ATOM 789 N THR A 304 19.259 15.348 5.674 1.00 41.74 N ATOM 790 CA THR A 304 19.815 16.699 5.759 1.00 43.92 C ATOM 791 C THR A 304 21.349 16.657 5.587 1.00 50.77 C ATOM 792 O THR A 304 21.958 15.608 5.801 1.00 51.79 O ATOM 793 CB THR A 304 19.323 17.483 7.000 1.00 54.86 C ATOM 794 OG1 THR A 304 19.869 18.812 6.965 1.00 59.76 O ATOM 795 CG2 THR A 304 19.632 16.794 8.327 1.00 51.12 C ATOM 796 HG1 THR A 304 19.557 19.317 7.757 1.00 0.00 H ATOM 797 H THR A 304 19.710 14.585 6.219 1.00 0.00 H ATOM 798 N ASN A 305 21.944 17.785 5.142 1.00 48.38 N ATOM 799 CA ASN A 305 23.382 17.939 4.920 1.00 86.04 C ATOM 800 C ASN A 305 23.947 19.025 5.832 1.00118.76 C ATOM 801 O ASN A 305 24.879 18.772 6.594 1.00 83.04 O ATOM 802 CB ASN A 305 23.664 18.277 3.458 1.00 87.31 C ATOM 803 H ASN A 305 21.335 18.604 4.942 1.00 0.00 H TER 804 ASN A 305 ATOM 805 N SER A 311 27.190 26.797 14.061 1.00 47.21 N ATOM 806 CA SER A 311 26.276 27.390 13.090 1.00 45.03 C ATOM 807 C SER A 311 24.962 26.581 12.969 1.00 45.11 C ATOM 808 O SER A 311 24.070 27.005 12.238 1.00 46.50 O ATOM 809 CB SER A 311 26.954 27.544 11.730 1.00 49.18 C ATOM 810 OG SER A 311 27.322 26.299 11.160 1.00 58.42 O ATOM 811 HG SER A 311 27.755 26.454 10.283 1.00 0.00 H ATOM 812 HN3 SER A 311 27.428 25.829 13.765 1.00 0.00 H ATOM 813 HN2 SER A 311 26.734 26.773 14.995 1.00 0.00 H ATOM 814 HN1 SER A 311 28.058 27.368 14.112 1.00 0.00 H ATOM 815 N SER A 312 24.841 25.453 13.710 1.00 36.03 N ATOM 816 CA SER A 312 23.642 24.600 13.745 1.00 34.69 C ATOM 817 C SER A 312 22.804 24.927 14.973 1.00 35.77 C ATOM 818 O SER A 312 23.335 25.210 16.045 1.00 35.95 O ATOM 819 CB SER A 312 24.019 23.123 13.795 1.00 35.80 C ATOM 820 OG SER A 312 24.436 22.620 12.537 1.00 44.87 O ATOM 821 HG SER A 312 24.668 21.662 12.626 1.00 0.00 H ATOM 822 H SER A 312 25.653 25.170 14.295 1.00 0.00 H ATOM 823 N PHE A 313 21.490 24.923 14.807 1.00 28.67 N ATOM 824 CA PHE A 313 20.570 25.138 15.909 1.00 27.37 C ATOM 825 C PHE A 313 19.453 24.124 15.708 1.00 29.61 C ATOM 826 O PHE A 313 18.840 24.140 14.658 1.00 28.55 O ATOM 827 CB PHE A 313 20.007 26.579 15.907 1.00 29.16 C ATOM 828 CG PHE A 313 18.872 26.731 16.895 1.00 30.89 C ATOM 829 CD1 PHE A 313 19.115 26.704 18.270 1.00 35.74 C ATOM 830 CD2 PHE A 313 17.559 26.851 16.456 1.00 31.46 C ATOM 831 CE1 PHE A 313 18.056 26.802 19.184 1.00 37.19 C ATOM 832 CE2 PHE A 313 16.507 26.947 17.367 1.00 35.37 C ATOM 833 CZ PHE A 313 16.763 26.931 18.724 1.00 34.26 C ATOM 834 H PHE A 313 21.104 24.760 13.855 1.00 0.00 H ATOM 835 N TYR A 314 19.247 23.215 16.669 1.00 26.89 N ATOM 836 CA TYR A 314 18.176 22.232 16.662 1.00 26.26 C ATOM 837 C TYR A 314 17.074 22.782 17.533 1.00 27.30 C ATOM 838 O TYR A 314 17.293 23.095 18.716 1.00 26.77 O ATOM 839 CB TYR A 314 18.637 20.891 17.222 1.00 26.94 C ATOM 840 CG TYR A 314 19.616 20.157 16.330 1.00 28.91 C ATOM 841 CD1 TYR A 314 20.985 20.441 16.374 1.00 31.82 C ATOM 842 CD2 TYR A 314 19.182 19.164 15.454 1.00 29.96 C ATOM 843 CE1 TYR A 314 21.893 19.755 15.564 1.00 32.09 C ATOM 844 CE2 TYR A 314 20.080 18.490 14.620 1.00 30.05 C ATOM 845 CZ TYR A 314 21.432 18.797 14.676 1.00 34.80 C ATOM 846 OH TYR A 314 22.322 18.151 13.851 1.00 35.74 O ATOM 847 HH TYR A 314 22.291 17.178 14.031 1.00 0.00 H ATOM 848 H TYR A 314 19.900 23.212 17.479 1.00 0.00 H ATOM 849 N GLY A 315 15.900 22.911 16.951 1.00 22.45 N ATOM 850 CA GLY A 315 14.781 23.479 17.694 1.00 22.97 C ATOM 851 C GLY A 315 13.432 22.832 17.484 1.00 24.51 C ATOM 852 O GLY A 315 13.257 22.011 16.573 1.00 22.86 O ATOM 853 H GLY A 315 15.771 22.609 15.964 1.00 0.00 H ATOM 854 N VAL A 316 12.461 23.213 18.332 1.00 21.69 N ATOM 855 CA VAL A 316 11.063 22.747 18.267 1.00 22.82 C ATOM 856 C VAL A 316 10.184 23.978 18.311 1.00 25.26 C ATOM 857 O VAL A 316 10.493 24.929 19.027 1.00 24.82 O ATOM 858 CB VAL A 316 10.668 21.809 19.449 1.00 27.43 C ATOM 859 CG1 VAL A 316 9.316 21.129 19.223 1.00 27.83 C ATOM 860 CG2 VAL A 316 11.737 20.780 19.718 1.00 27.25 C ATOM 861 H VAL A 316 12.713 23.883 19.086 1.00 0.00 H ATOM 862 N SER A 317 9.057 23.926 17.609 1.00 21.32 N ATOM 863 CA SER A 317 8.059 24.982 17.641 1.00 20.82 C ATOM 864 C SER A 317 6.690 24.316 17.727 1.00 25.33 C ATOM 865 O SER A 317 6.508 23.177 17.289 1.00 25.07 O ATOM 866 CB SER A 317 8.176 25.888 16.424 1.00 26.67 C ATOM 867 OG SER A 317 9.353 26.673 16.559 1.00 34.09 O ATOM 868 HG SER A 317 9.443 27.269 15.773 1.00 0.00 H ATOM 869 H SER A 317 8.881 23.094 17.011 1.00 0.00 H ATOM 870 N SER A 318 5.772 24.979 18.402 1.00 22.07 N ATOM 871 CA SER A 318 4.415 24.479 18.515 1.00 21.24 C ATOM 872 C SER A 318 3.490 25.634 18.802 1.00 22.34 C ATOM 873 O SER A 318 3.925 26.692 19.282 1.00 22.68 O ATOM 874 CB SER A 318 4.293 23.364 19.558 1.00 24.34 C ATOM 875 OG SER A 318 4.546 23.875 20.862 1.00 34.01 O ATOM 876 HG SER A 318 4.463 23.143 21.524 1.00 0.00 H ATOM 877 H SER A 318 6.025 25.877 18.862 1.00 0.00 H ATOM 878 N GLN A 319 2.240 25.472 18.379 1.00 20.96 N ATOM 879 CA GLN A 319 1.211 26.492 18.568 1.00 20.98 C ATOM 880 C GLN A 319 -0.070 25.801 18.990 1.00 24.93 C ATOM 881 O GLN A 319 -0.405 24.729 18.476 1.00 21.28 O ATOM 882 CB GLN A 319 0.939 27.279 17.283 1.00 22.86 C ATOM 883 CG GLN A 319 0.256 28.622 17.580 1.00 45.32 C ATOM 884 CD GLN A 319 -0.788 29.064 16.579 1.00 64.92 C ATOM 885 OE1 GLN A 319 -0.759 28.682 15.397 1.00 56.22 O ATOM 886 NE2 GLN A 319 -1.728 29.913 17.041 1.00 47.97 N ATOM 887 HE22 GLN A 319 -1.717 30.208 18.038 1.00 0.00 H ATOM 888 HE21 GLN A 319 -2.464 30.272 16.400 1.00 0.00 H ATOM 889 H GLN A 319 1.985 24.587 17.896 1.00 0.00 H ATOM 890 N TYR A 320 -0.780 26.424 19.918 1.00 23.03 N ATOM 891 CA TYR A 320 -2.055 25.906 20.426 1.00 22.61 C ATOM 892 C TYR A 320 -3.066 27.004 20.460 1.00 23.28 C ATOM 893 O TYR A 320 -2.714 28.180 20.579 1.00 21.40 O ATOM 894 CB TYR A 320 -1.939 25.325 21.863 1.00 23.58 C ATOM 895 CG TYR A 320 -0.741 24.434 22.049 1.00 28.57 C ATOM 896 CD1 TYR A 320 0.527 24.978 22.267 1.00 32.30 C ATOM 897 CD2 TYR A 320 -0.840 23.059 21.876 1.00 29.68 C ATOM 898 CE1 TYR A 320 1.657 24.173 22.315 1.00 34.08 C ATOM 899 CE2 TYR A 320 0.277 22.235 21.997 1.00 30.84 C ATOM 900 CZ TYR A 320 1.520 22.799 22.243 1.00 38.67 C ATOM 901 OH TYR A 320 2.639 22.026 22.339 1.00 44.20 O ATOM 902 HH TYR A 320 2.530 21.380 23.081 1.00 0.00 H ATOM 903 H TYR A 320 -0.418 27.320 20.303 1.00 0.00 H ATOM 904 N GLU A 321 -4.328 26.631 20.365 1.00 20.84 N ATOM 905 CA GLU A 321 -5.403 27.618 20.519 1.00 21.78 C ATOM 906 C GLU A 321 -6.440 27.044 21.456 1.00 22.92 C ATOM 907 O GLU A 321 -6.613 25.825 21.537 1.00 20.53 O ATOM 908 CB GLU A 321 -6.059 27.986 19.194 1.00 24.47 C ATOM 909 CG GLU A 321 -5.325 29.087 18.444 1.00 38.63 C ATOM 910 CD GLU A 321 -5.850 29.327 17.039 1.00 53.03 C ATOM 911 OE1 GLU A 321 -7.012 28.957 16.768 1.00 40.77 O ATOM 912 OE2 GLU A 321 -5.098 29.883 16.208 1.00 46.84 O ATOM 913 H GLU A 321 -4.562 25.635 20.180 1.00 0.00 H ATOM 914 N SER A 322 -7.092 27.938 22.190 1.00 21.30 N ATOM 915 CA SER A 322 -8.171 27.590 23.098 1.00 21.78 C ATOM 916 C SER A 322 -9.243 28.682 23.098 1.00 27.87 C ATOM 917 O SER A 322 -8.912 29.862 22.948 1.00 26.54 O ATOM 918 CB SER A 322 -7.601 27.462 24.509 1.00 23.50 C ATOM 919 OG SER A 322 -8.601 27.163 25.474 1.00 24.59 O ATOM 920 HG SER A 322 -9.037 26.305 25.241 1.00 0.00 H ATOM 921 H SER A 322 -6.816 28.938 22.111 1.00 0.00 H ATOM 922 N PRO A 323 -10.529 28.333 23.392 1.00 28.49 N ATOM 923 CA PRO A 323 -11.524 29.392 23.627 1.00 29.18 C ATOM 924 C PRO A 323 -11.222 30.093 24.972 1.00 31.98 C ATOM 925 O PRO A 323 -11.732 31.186 25.200 1.00 31.88 O ATOM 926 CB PRO A 323 -12.866 28.632 23.708 1.00 31.33 C ATOM 927 CG PRO A 323 -12.524 27.227 23.980 1.00 35.10 C ATOM 928 CD PRO A 323 -11.089 26.974 23.604 1.00 29.88 C ATOM 929 N GLU A 324 -10.374 29.485 25.848 1.00 26.13 N ATOM 930 CA GLU A 324 -10.085 30.043 27.175 1.00 26.47 C ATOM 931 C GLU A 324 -8.701 30.593 27.378 1.00 30.98 C ATOM 932 O GLU A 324 -7.741 30.123 26.776 1.00 26.82 O ATOM 933 CB GLU A 324 -10.357 29.031 28.271 1.00 27.85 C ATOM 934 CG GLU A 324 -11.741 28.446 28.196 1.00 33.78 C ATOM 935 CD GLU A 324 -12.014 27.438 29.289 1.00 46.62 C ATOM 936 OE1 GLU A 324 -12.814 26.510 29.042 1.00 40.04 O ATOM 937 OE2 GLU A 324 -11.449 27.584 30.396 1.00 32.59 O ATOM 938 H GLU A 324 -9.915 28.595 25.567 1.00 0.00 H ATOM 939 N ASN A 325 -8.616 31.549 28.318 1.00 28.73 N ATOM 940 CA ASN A 325 -7.407 32.215 28.753 1.00 28.94 C ATOM 941 C ASN A 325 -6.873 31.462 29.998 1.00 31.42 C ATOM 942 O ASN A 325 -7.329 31.682 31.113 1.00 32.88 O ATOM 943 CB ASN A 325 -7.759 33.682 29.095 1.00 26.16 C ATOM 944 CG ASN A 325 -6.560 34.525 29.441 1.00 42.99 C ATOM 945 OD1 ASN A 325 -5.443 34.038 29.518 1.00 30.69 O ATOM 946 ND2 ASN A 325 -6.764 35.812 29.639 1.00 38.72 N ATOM 947 HD22 ASN A 325 -7.725 36.203 29.568 1.00 0.00 H ATOM 948 HD21 ASN A 325 -5.964 36.436 29.866 1.00 0.00 H ATOM 949 H ASN A 325 -9.503 31.838 28.777 1.00 0.00 H ATOM 950 N MET A 326 -5.922 30.583 29.799 1.00 26.65 N ATOM 951 CA MET A 326 -5.380 29.757 30.872 1.00 25.59 C ATOM 952 C MET A 326 -3.879 29.934 30.996 1.00 30.13 C ATOM 953 O MET A 326 -3.204 30.358 30.039 1.00 28.17 O ATOM 954 CB MET A 326 -5.646 28.262 30.558 1.00 27.24 C ATOM 955 CG MET A 326 -7.076 27.930 30.152 1.00 30.27 C ATOM 956 SD MET A 326 -7.304 26.210 29.635 1.00 33.43 S ATOM 957 CE MET A 326 -6.558 26.241 27.974 1.00 30.34 C ATOM 958 H MET A 326 -5.539 30.470 28.839 1.00 0.00 H ATOM 959 N ILE A 327 -3.341 29.521 32.155 1.00 26.34 N ATOM 960 CA ILE A 327 -1.897 29.413 32.351 1.00 25.64 C ATOM 961 C ILE A 327 -1.648 27.928 32.125 1.00 29.93 C ATOM 962 O ILE A 327 -2.244 27.098 32.815 1.00 29.85 O ATOM 963 CB ILE A 327 -1.394 29.895 33.737 1.00 29.39 C ATOM 964 CG1 ILE A 327 -1.775 31.378 33.985 1.00 30.27 C ATOM 965 CG2 ILE A 327 0.120 29.671 33.851 1.00 29.67 C ATOM 966 CD1 ILE A 327 -1.408 31.911 35.420 1.00 31.22 C ATOM 967 H ILE A 327 -3.974 29.269 32.941 1.00 0.00 H ATOM 968 N ILE A 328 -0.835 27.585 31.117 1.00 24.46 N ATOM 969 CA ILE A 328 -0.636 26.174 30.809 1.00 24.72 C ATOM 970 C ILE A 328 0.809 25.729 31.029 1.00 26.95 C ATOM 971 O ILE A 328 1.728 26.542 30.954 1.00 27.30 O ATOM 972 CB ILE A 328 -1.156 25.812 29.380 1.00 27.56 C ATOM 973 CG1 ILE A 328 -0.253 26.421 28.274 1.00 28.15 C ATOM 974 CG2 ILE A 328 -2.635 26.234 29.218 1.00 27.64 C ATOM 975 CD1 ILE A 328 -0.378 25.816 26.846 1.00 30.84 C ATOM 976 H ILE A 328 -0.351 28.318 30.560 1.00 0.00 H ATOM 977 N THR A 329 1.024 24.440 31.254 1.00 20.54 N ATOM 978 CA THR A 329 2.392 23.921 31.375 1.00 20.38 C ATOM 979 C THR A 329 2.518 22.759 30.431 1.00 24.43 C ATOM 980 O THR A 329 1.721 21.815 30.515 1.00 23.22 O ATOM 981 CB THR A 329 2.736 23.475 32.808 1.00 27.27 C ATOM 982 OG1 THR A 329 1.823 22.441 33.214 1.00 29.08 O ATOM 983 CG2 THR A 329 2.749 24.625 33.803 1.00 28.13 C ATOM 984 HG1 THR A 329 2.042 22.152 34.135 1.00 0.00 H ATOM 985 H THR A 329 0.217 23.791 31.346 1.00 0.00 H ATOM 986 N CYS A 330 3.478 22.839 29.508 1.00 22.35 N ATOM 987 CA CYS A 330 3.754 21.739 28.607 1.00 22.96 C ATOM 988 C CYS A 330 4.992 21.017 29.117 1.00 27.17 C ATOM 989 O CYS A 330 6.051 21.617 29.298 1.00 25.86 O ATOM 990 CB CYS A 330 3.939 22.200 27.163 1.00 23.80 C ATOM 991 SG CYS A 330 4.361 20.855 26.021 1.00 27.69 S ATOM 992 H CYS A 330 4.041 23.711 29.434 1.00 0.00 H ATOM 993 N SER A 331 4.826 19.742 29.389 1.00 24.80 N ATOM 994 CA SER A 331 5.879 18.820 29.799 1.00 25.36 C ATOM 995 C SER A 331 6.179 17.892 28.619 1.00 30.85 C ATOM 996 O SER A 331 5.253 17.383 27.954 1.00 29.87 O ATOM 997 CB SER A 331 5.434 18.018 31.013 1.00 30.43 C ATOM 998 OG SER A 331 6.133 16.788 31.080 1.00 40.93 O ATOM 999 HG SER A 331 5.951 16.261 30.262 1.00 0.00 H ATOM 1000 H SER A 331 3.863 19.358 29.305 1.00 0.00 H ATOM 1001 N THR A 332 7.460 17.734 28.304 1.00 25.56 N ATOM 1002 CA THR A 332 7.888 16.834 27.248 1.00 24.02 C ATOM 1003 C THR A 332 8.832 15.853 27.861 1.00 29.94 C ATOM 1004 O THR A 332 9.875 16.266 28.406 1.00 29.21 O ATOM 1005 CB THR A 332 8.528 17.585 26.081 1.00 32.78 C ATOM 1006 OG1 THR A 332 7.620 18.558 25.564 1.00 29.47 O ATOM 1007 CG2 THR A 332 8.987 16.629 24.973 1.00 31.97 C ATOM 1008 HG1 THR A 332 7.388 19.204 26.278 1.00 0.00 H ATOM 1009 H THR A 332 8.178 18.272 28.830 1.00 0.00 H ATOM 1010 N LYS A 333 8.500 14.550 27.726 1.00 24.32 N ATOM 1011 CA LYS A 333 9.303 13.462 28.235 1.00 24.02 C ATOM 1012 C LYS A 333 9.881 12.690 27.076 1.00 29.25 C ATOM 1013 O LYS A 333 9.141 12.240 26.187 1.00 28.75 O ATOM 1014 CB LYS A 333 8.498 12.551 29.178 1.00 26.57 C ATOM 1015 CG LYS A 333 8.135 13.243 30.468 1.00 32.27 C ATOM 1016 CD LYS A 333 7.233 12.439 31.335 1.00 41.48 C ATOM 1017 CE LYS A 333 6.982 13.229 32.599 1.00 43.50 C ATOM 1018 NZ LYS A 333 6.564 12.353 33.711 1.00 40.08 N ATOM 1019 HZ1 LYS A 333 5.686 11.860 33.451 1.00 0.00 H ATOM 1020 HZ2 LYS A 333 7.312 11.656 33.901 1.00 0.00 H ATOM 1021 HZ3 LYS A 333 6.401 12.929 34.562 1.00 0.00 H ATOM 1022 H LYS A 333 7.617 14.317 27.228 1.00 0.00 H ATOM 1023 N VAL A 334 11.209 12.617 27.027 1.00 25.57 N ATOM 1024 CA VAL A 334 11.909 11.843 25.998 1.00 26.22 C ATOM 1025 C VAL A 334 12.125 10.483 26.665 1.00 30.83 C ATOM 1026 O VAL A 334 12.562 10.422 27.832 1.00 28.83 O ATOM 1027 CB VAL A 334 13.239 12.480 25.522 1.00 30.27 C ATOM 1028 CG1 VAL A 334 13.889 11.626 24.423 1.00 30.07 C ATOM 1029 CG2 VAL A 334 13.017 13.920 25.030 1.00 29.92 C ATOM 1030 H VAL A 334 11.768 13.125 27.742 1.00 0.00 H ATOM 1031 N CYS A 335 11.792 9.407 25.937 1.00 27.62 N ATOM 1032 CA CYS A 335 11.876 8.059 26.475 1.00 29.32 C ATOM 1033 C CYS A 335 12.728 7.124 25.629 1.00 33.34 C ATOM 1034 O CYS A 335 12.800 7.272 24.408 1.00 32.01 O ATOM 1035 CB CYS A 335 10.479 7.493 26.695 1.00 31.02 C ATOM 1036 SG CYS A 335 9.361 8.630 27.557 1.00 35.58 S ATOM 1037 H CYS A 335 11.464 9.541 24.959 1.00 0.00 H ATOM 1038 N SER A 336 13.367 6.147 26.305 1.00 28.66 N ATOM 1039 CA SER A 336 14.192 5.146 25.646 1.00 27.66 C ATOM 1040 C SER A 336 13.754 3.831 26.229 1.00 30.22 C ATOM 1041 O SER A 336 13.847 3.654 27.447 1.00 29.31 O ATOM 1042 CB SER A 336 15.675 5.401 25.924 1.00 31.62 C ATOM 1043 OG SER A 336 16.454 4.366 25.351 1.00 35.21 O ATOM 1044 HG SER A 336 16.302 4.343 24.373 1.00 0.00 H ATOM 1045 H SER A 336 13.266 6.108 27.339 1.00 0.00 H ATOM 1046 N PHE A 337 13.206 2.932 25.389 1.00 29.61 N ATOM 1047 CA PHE A 337 12.661 1.620 25.826 1.00 29.36 C ATOM 1048 C PHE A 337 11.566 1.839 26.892 1.00 34.96 C ATOM 1049 O PHE A 337 11.490 1.117 27.899 1.00 36.01 O ATOM 1050 CB PHE A 337 13.781 0.648 26.295 1.00 32.08 C ATOM 1051 CG PHE A 337 14.767 0.274 25.208 1.00 34.56 C ATOM 1052 CD1 PHE A 337 15.890 1.064 24.960 1.00 38.12 C ATOM 1053 CD2 PHE A 337 14.585 -0.878 24.445 1.00 37.77 C ATOM 1054 CE1 PHE A 337 16.805 0.715 23.958 1.00 39.69 C ATOM 1055 CE2 PHE A 337 15.504 -1.231 23.451 1.00 40.79 C ATOM 1056 CZ PHE A 337 16.594 -0.422 23.202 1.00 39.59 C ATOM 1057 H PHE A 337 13.162 3.169 24.377 1.00 0.00 H ATOM 1058 N GLY A 338 10.772 2.891 26.664 1.00 32.40 N ATOM 1059 CA GLY A 338 9.646 3.282 27.501 1.00 32.75 C ATOM 1060 C GLY A 338 9.989 3.865 28.854 1.00 37.61 C ATOM 1061 O GLY A 338 9.089 4.075 29.672 1.00 39.06 O ATOM 1062 H GLY A 338 10.974 3.473 25.826 1.00 0.00 H ATOM 1063 N LYS A 339 11.279 4.172 29.090 1.00 31.15 N ATOM 1064 CA LYS A 339 11.699 4.766 30.349 1.00 31.79 C ATOM 1065 C LYS A 339 12.068 6.205 30.093 1.00 32.91 C ATOM 1066 O LYS A 339 12.745 6.493 29.117 1.00 31.78 O ATOM 1067 CB LYS A 339 12.901 4.015 30.963 1.00 35.55 C ATOM 1068 CG LYS A 339 12.628 2.547 31.272 1.00 45.84 C ATOM 1069 CD LYS A 339 12.199 2.340 32.720 1.00 59.15 C ATOM 1070 CE LYS A 339 12.162 0.879 33.095 1.00 70.44 C ATOM 1071 NZ LYS A 339 11.909 0.693 34.551 1.00 82.18 N ATOM 1072 HZ1 LYS A 339 12.667 1.153 35.095 1.00 0.00 H ATOM 1073 HZ2 LYS A 339 10.994 1.120 34.800 1.00 0.00 H ATOM 1074 HZ3 LYS A 339 11.890 -0.323 34.771 1.00 0.00 H ATOM 1075 H LYS A 339 11.990 3.980 28.356 1.00 0.00 H ATOM 1076 N GLN A 340 11.618 7.108 30.961 1.00 29.97 N ATOM 1077 CA GLN A 340 11.919 8.525 30.841 1.00 30.35 C ATOM 1078 C GLN A 340 13.418 8.773 31.010 1.00 31.30 C ATOM 1079 O GLN A 340 14.007 8.321 31.992 1.00 30.69 O ATOM 1080 CB GLN A 340 11.175 9.283 31.943 1.00 32.02 C ATOM 1081 CG GLN A 340 11.334 10.779 31.929 1.00 35.31 C ATOM 1082 CD GLN A 340 10.466 11.357 33.009 1.00 48.05 C ATOM 1083 OE1 GLN A 340 9.324 10.933 33.236 1.00 50.31 O ATOM 1084 NE2 GLN A 340 10.996 12.305 33.722 1.00 35.54 N ATOM 1085 HE22 GLN A 340 11.957 12.641 33.509 1.00 0.00 H ATOM 1086 HE21 GLN A 340 10.459 12.728 34.506 1.00 0.00 H ATOM 1087 H GLN A 340 11.028 6.788 31.756 1.00 0.00 H ATOM 1088 N VAL A 341 14.022 9.488 30.065 1.00 27.30 N ATOM 1089 CA VAL A 341 15.440 9.826 30.185 1.00 27.68 C ATOM 1090 C VAL A 341 15.612 11.352 30.332 1.00 30.88 C ATOM 1091 O VAL A 341 16.626 11.828 30.839 1.00 27.72 O ATOM 1092 CB VAL A 341 16.359 9.196 29.100 1.00 33.19 C ATOM 1093 CG1 VAL A 341 16.467 7.677 29.271 1.00 32.96 C ATOM 1094 CG2 VAL A 341 15.930 9.568 27.689 1.00 33.00 C ATOM 1095 H VAL A 341 13.483 9.809 29.236 1.00 0.00 H ATOM 1096 N VAL A 342 14.597 12.121 29.893 1.00 29.40 N ATOM 1097 CA VAL A 342 14.641 13.586 29.978 1.00 30.49 C ATOM 1098 C VAL A 342 13.213 14.079 30.239 1.00 34.01 C ATOM 1099 O VAL A 342 12.255 13.531 29.684 1.00 31.67 O ATOM 1100 CB VAL A 342 15.199 14.194 28.643 1.00 35.83 C ATOM 1101 CG1 VAL A 342 14.831 15.666 28.464 1.00 37.13 C ATOM 1102 CG2 VAL A 342 16.702 13.996 28.488 1.00 35.75 C ATOM 1103 H VAL A 342 13.758 11.664 29.482 1.00 0.00 H ATOM 1104 N GLU A 343 13.082 15.142 31.032 1.00 32.51 N ATOM 1105 CA GLU A 343 11.808 15.839 31.204 1.00 32.43 C ATOM 1106 C GLU A 343 12.077 17.331 31.096 1.00 38.14 C ATOM 1107 O GLU A 343 12.962 17.868 31.776 1.00 36.78 O ATOM 1108 CB GLU A 343 11.071 15.503 32.503 1.00 34.05 C ATOM 1109 CG GLU A 343 9.715 16.201 32.555 1.00 45.47 C ATOM 1110 CD GLU A 343 8.893 16.120 33.823 1.00 76.27 C ATOM 1111 OE1 GLU A 343 9.413 15.645 34.861 1.00 72.44 O ATOM 1112 OE2 GLU A 343 7.715 16.547 33.774 1.00 75.77 O ATOM 1113 H GLU A 343 13.916 15.489 31.547 1.00 0.00 H TER 1114 GLU A 343 ATOM 1115 N VAL A 345 10.035 21.100 30.986 1.00 33.90 N ATOM 1116 CA VAL A 345 8.761 21.717 31.330 1.00 35.12 C ATOM 1117 C VAL A 345 8.825 23.189 30.974 1.00 38.43 C ATOM 1118 O VAL A 345 9.828 23.854 31.270 1.00 37.11 O ATOM 1119 CB VAL A 345 8.354 21.494 32.820 1.00 41.14 C ATOM 1120 CG1 VAL A 345 6.998 22.125 33.131 1.00 40.67 C ATOM 1121 CG2 VAL A 345 8.336 20.009 33.185 1.00 41.39 C ATOM 1122 HN3 VAL A 345 10.798 21.562 31.521 1.00 0.00 H ATOM 1123 HN2 VAL A 345 10.209 21.211 29.967 1.00 0.00 H ATOM 1124 HN1 VAL A 345 10.005 20.088 31.225 1.00 0.00 H ATOM 1125 N GLU A 346 7.746 23.701 30.357 1.00 32.64 N ATOM 1126 CA GLU A 346 7.647 25.115 29.987 1.00 32.71 C ATOM 1127 C GLU A 346 6.279 25.646 30.405 1.00 33.76 C ATOM 1128 O GLU A 346 5.283 24.940 30.239 1.00 32.10 O ATOM 1129 CB GLU A 346 7.804 25.262 28.462 1.00 34.68 C ATOM 1130 CG GLU A 346 9.162 25.812 28.057 1.00 51.51 C ATOM 1131 CD GLU A 346 9.495 25.724 26.579 1.00 82.36 C ATOM 1132 OE1 GLU A 346 9.804 26.781 25.981 1.00 90.25 O ATOM 1133 OE2 GLU A 346 9.466 24.603 26.020 1.00 75.65 O ATOM 1134 H GLU A 346 6.951 23.069 30.134 1.00 0.00 H ATOM 1135 N THR A 347 6.232 26.855 30.961 1.00 28.78 N ATOM 1136 CA THR A 347 4.972 27.480 31.333 1.00 28.87 C ATOM 1137 C THR A 347 4.643 28.398 30.168 1.00 32.31 C ATOM 1138 O THR A 347 5.508 29.141 29.705 1.00 31.54 O ATOM 1139 CB THR A 347 5.070 28.162 32.708 1.00 40.16 C ATOM 1140 OG1 THR A 347 5.351 27.159 33.682 1.00 44.48 O ATOM 1141 CG2 THR A 347 3.776 28.885 33.111 1.00 34.79 C ATOM 1142 HG1 THR A 347 5.418 27.579 34.576 1.00 0.00 H ATOM 1143 H THR A 347 7.121 27.367 31.134 1.00 0.00 H ATOM 1144 N GLU A 348 3.410 28.311 29.651 1.00 28.62 N ATOM 1145 CA GLU A 348 3.006 29.166 28.542 1.00 26.87 C ATOM 1146 C GLU A 348 1.807 30.028 28.905 1.00 27.79 C ATOM 1147 O GLU A 348 0.861 29.569 29.561 1.00 25.41 O ATOM 1148 CB GLU A 348 2.764 28.357 27.260 1.00 27.90 C ATOM 1149 CG GLU A 348 4.028 27.705 26.683 1.00 38.24 C ATOM 1150 CD GLU A 348 5.249 28.583 26.447 1.00 63.98 C ATOM 1151 OE1 GLU A 348 5.088 29.739 25.990 1.00 61.43 O ATOM 1152 OE2 GLU A 348 6.378 28.100 26.699 1.00 57.62 O ATOM 1153 H GLU A 348 2.734 27.626 30.045 1.00 0.00 H ATOM 1154 N TYR A 349 1.842 31.255 28.440 1.00 24.52 N ATOM 1155 CA TYR A 349 0.776 32.219 28.687 1.00 24.54 C ATOM 1156 C TYR A 349 0.021 32.528 27.392 1.00 26.42 C ATOM 1157 O TYR A 349 0.575 32.382 26.306 1.00 26.78 O ATOM 1158 CB TYR A 349 1.343 33.480 29.357 1.00 27.58 C ATOM 1159 CG TYR A 349 1.955 33.197 30.720 1.00 31.81 C ATOM 1160 CD1 TYR A 349 3.287 32.804 30.842 1.00 34.75 C ATOM 1161 CD2 TYR A 349 1.201 33.314 31.879 1.00 33.37 C ATOM 1162 CE1 TYR A 349 3.851 32.532 32.091 1.00 36.30 C ATOM 1163 CE2 TYR A 349 1.756 33.056 33.134 1.00 35.72 C ATOM 1164 CZ TYR A 349 3.077 32.657 33.234 1.00 42.34 C ATOM 1165 OH TYR A 349 3.602 32.387 34.474 1.00 48.82 O ATOM 1166 HH TYR A 349 4.549 32.116 34.378 1.00 0.00 H ATOM 1167 H TYR A 349 2.662 31.551 27.873 1.00 0.00 H ATOM 1168 N ALA A 350 -1.248 32.923 27.510 1.00 23.18 N ATOM 1169 CA ALA A 350 -2.118 33.188 26.377 1.00 23.27 C ATOM 1170 C ALA A 350 -1.931 34.571 25.762 1.00 27.50 C ATOM 1171 O ALA A 350 -1.644 35.551 26.462 1.00 27.61 O ATOM 1172 CB ALA A 350 -3.602 32.993 26.778 1.00 23.89 C ATOM 1173 H ALA A 350 -1.636 33.048 28.467 1.00 0.00 H ATOM 1174 N ARG A 351 -2.201 34.666 24.461 1.00 22.86 N ATOM 1175 CA ARG A 351 -2.332 35.954 23.781 1.00 23.55 C ATOM 1176 C ARG A 351 -3.728 35.927 23.139 1.00 28.84 C ATOM 1177 O ARG A 351 -4.071 34.933 22.476 1.00 30.15 O ATOM 1178 CB ARG A 351 -1.249 36.147 22.698 1.00 19.60 C ATOM 1179 CG ARG A 351 -1.380 37.489 21.938 1.00 21.71 C ATOM 1180 CD ARG A 351 -0.226 37.632 20.959 1.00 28.10 C ATOM 1181 NE ARG A 351 0.971 38.130 21.647 1.00 32.73 N ATOM 1182 CZ ARG A 351 2.214 37.701 21.446 1.00 35.54 C ATOM 1183 NH1 ARG A 351 2.463 36.757 20.549 1.00 30.48 N ATOM 1184 NH2 ARG A 351 3.215 38.212 22.140 1.00 30.68 N ATOM 1185 HE ARG A 351 0.836 38.883 22.352 1.00 0.00 H ATOM 1186 HH12 ARG A 351 3.438 36.427 20.398 1.00 0.00 H ATOM 1187 HH11 ARG A 351 1.684 36.346 19.996 1.00 0.00 H ATOM 1188 HH22 ARG A 351 4.185 37.874 21.980 1.00 0.00 H ATOM 1189 HH21 ARG A 351 3.033 38.953 22.847 1.00 0.00 H ATOM 1190 H ARG A 351 -2.323 33.793 23.909 1.00 0.00 H ATOM 1191 N TYR A 352 -4.510 36.974 23.336 1.00 25.59 N ATOM 1192 CA TYR A 352 -5.816 37.098 22.701 1.00 27.91 C ATOM 1193 C TYR A 352 -5.597 37.193 21.193 1.00 35.96 C ATOM 1194 O TYR A 352 -4.673 37.881 20.739 1.00 35.32 O ATOM 1195 CB TYR A 352 -6.594 38.303 23.242 1.00 30.49 C ATOM 1196 CG TYR A 352 -7.923 38.521 22.552 1.00 35.15 C ATOM 1197 CD1 TYR A 352 -9.050 37.790 22.919 1.00 38.43 C ATOM 1198 CD2 TYR A 352 -8.052 39.444 21.519 1.00 36.41 C ATOM 1199 CE1 TYR A 352 -10.286 38.007 22.303 1.00 39.48 C ATOM 1200 CE2 TYR A 352 -9.273 39.650 20.877 1.00 37.89 C ATOM 1201 CZ TYR A 352 -10.384 38.915 21.260 1.00 50.06 C ATOM 1202 OH TYR A 352 -11.591 39.117 20.632 1.00 55.44 O ATOM 1203 HH TYR A 352 -12.271 38.515 21.025 1.00 0.00 H ATOM 1204 H TYR A 352 -4.183 37.735 23.965 1.00 0.00 H ATOM 1205 N GLU A 353 -6.433 36.475 20.428 1.00 37.50 N ATOM 1206 CA GLU A 353 -6.357 36.385 18.969 1.00 40.24 C ATOM 1207 C GLU A 353 -7.722 36.053 18.407 1.00 47.27 C ATOM 1208 O GLU A 353 -8.234 34.967 18.678 1.00 48.49 O ATOM 1209 CB GLU A 353 -5.346 35.278 18.553 1.00 42.08 C ATOM 1210 CG GLU A 353 -5.182 35.074 17.050 1.00 54.40 C ATOM 1211 CD GLU A 353 -4.411 33.830 16.647 1.00 67.81 C ATOM 1212 OE1 GLU A 353 -5.043 32.759 16.521 1.00 59.00 O ATOM 1213 OE2 GLU A 353 -3.178 33.920 16.446 1.00 56.41 O ATOM 1214 H GLU A 353 -7.189 35.944 20.906 1.00 0.00 H ATOM 1215 N ASN A 354 -8.312 36.982 17.634 1.00 45.24 N ATOM 1216 CA ASN A 354 -9.576 36.794 16.909 1.00 45.42 C ATOM 1217 C ASN A 354 -10.695 36.093 17.707 1.00 49.28 C ATOM 1218 O ASN A 354 -11.289 35.129 17.221 1.00 50.62 O ATOM 1219 CB ASN A 354 -9.286 36.017 15.597 1.00 47.26 C ATOM 1220 CG ASN A 354 -8.270 36.664 14.684 1.00 78.92 C ATOM 1221 OD1 ASN A 354 -8.411 37.824 14.266 1.00 79.22 O ATOM 1222 ND2 ASN A 354 -7.226 35.918 14.337 1.00 71.19 N ATOM 1223 HD22 ASN A 354 -7.135 34.949 14.703 1.00 0.00 H ATOM 1224 HD21 ASN A 354 -6.501 36.303 13.699 1.00 0.00 H ATOM 1225 H ASN A 354 -7.838 37.903 17.543 1.00 0.00 H ATOM 1226 N GLY A 355 -10.931 36.538 18.932 1.00 44.50 N ATOM 1227 CA GLY A 355 -11.955 35.949 19.786 1.00 44.26 C ATOM 1228 C GLY A 355 -11.506 34.774 20.636 1.00 47.10 C ATOM 1229 O GLY A 355 -12.173 34.460 21.627 1.00 48.86 O ATOM 1230 H GLY A 355 -10.368 37.333 19.296 1.00 0.00 H ATOM 1231 N HIS A 356 -10.363 34.142 20.290 1.00 39.01 N ATOM 1232 CA HIS A 356 -9.806 33.012 21.043 1.00 36.81 C ATOM 1233 C HIS A 356 -8.409 33.306 21.656 1.00 36.33 C ATOM 1234 O HIS A 356 -7.945 34.448 21.631 1.00 36.22 O ATOM 1235 CB HIS A 356 -9.799 31.731 20.182 1.00 37.15 C ATOM 1236 CG HIS A 356 -9.047 31.880 18.908 1.00 40.27 C ATOM 1237 ND1 HIS A 356 -9.695 32.185 17.724 1.00 41.79 N ATOM 1238 CD2 HIS A 356 -7.716 31.828 18.680 1.00 41.75 C ATOM 1239 CE1 HIS A 356 -8.746 32.271 16.812 1.00 40.88 C ATOM 1240 NE2 HIS A 356 -7.538 32.083 17.344 1.00 41.57 N ATOM 1241 H HIS A 356 -9.852 34.473 19.447 1.00 0.00 H ATOM 1242 N TYR A 357 -7.770 32.286 22.243 1.00 27.90 N ATOM 1243 CA TYR A 357 -6.468 32.451 22.883 1.00 25.00 C ATOM 1244 C TYR A 357 -5.448 31.584 22.221 1.00 27.32 C ATOM 1245 O TYR A 357 -5.720 30.420 21.957 1.00 25.47 O ATOM 1246 CB TYR A 357 -6.540 32.227 24.411 1.00 24.48 C ATOM 1247 CG TYR A 357 -7.384 33.309 25.068 1.00 26.53 C ATOM 1248 CD1 TYR A 357 -6.834 34.546 25.391 1.00 27.78 C ATOM 1249 CD2 TYR A 357 -8.765 33.167 25.179 1.00 29.10 C ATOM 1250 CE1 TYR A 357 -7.621 35.584 25.896 1.00 31.16 C ATOM 1251 CE2 TYR A 357 -9.565 34.193 25.698 1.00 30.22 C ATOM 1252 CZ TYR A 357 -8.985 35.402 26.049 1.00 38.96 C ATOM 1253 OH TYR A 357 -9.752 36.420 26.550 1.00 39.32 O ATOM 1254 HH TYR A 357 -9.176 37.201 26.744 1.00 0.00 H ATOM 1255 H TYR A 357 -8.215 31.346 22.243 1.00 0.00 H ATOM 1256 N SER A 358 -4.271 32.157 21.963 1.00 22.98 N ATOM 1257 CA SER A 358 -3.158 31.496 21.315 1.00 21.31 C ATOM 1258 C SER A 358 -1.996 31.285 22.285 1.00 24.44 C ATOM 1259 O SER A 358 -1.743 32.137 23.145 1.00 24.62 O ATOM 1260 CB SER A 358 -2.700 32.326 20.122 1.00 25.19 C ATOM 1261 OG SER A 358 -1.677 31.644 19.423 1.00 27.83 O ATOM 1262 HG SER A 358 -1.386 32.190 18.650 1.00 0.00 H ATOM 1263 H SER A 358 -4.144 33.149 22.248 1.00 0.00 H ATOM 1264 N TYR A 359 -1.292 30.158 22.137 1.00 21.02 N ATOM 1265 CA TYR A 359 -0.141 29.771 22.975 1.00 21.19 C ATOM 1266 C TYR A 359 0.900 29.328 21.960 1.00 25.74 C ATOM 1267 O TYR A 359 0.553 28.678 20.956 1.00 26.30 O ATOM 1268 CB TYR A 359 -0.487 28.570 23.922 1.00 22.06 C ATOM 1269 CG TYR A 359 -1.679 28.844 24.816 1.00 22.68 C ATOM 1270 CD1 TYR A 359 -2.983 28.679 24.348 1.00 24.19 C ATOM 1271 CD2 TYR A 359 -1.507 29.294 26.121 1.00 23.12 C ATOM 1272 CE1 TYR A 359 -4.087 28.995 25.146 1.00 23.72 C ATOM 1273 CE2 TYR A 359 -2.601 29.613 26.927 1.00 24.44 C ATOM 1274 CZ TYR A 359 -3.889 29.453 26.441 1.00 29.59 C ATOM 1275 OH TYR A 359 -4.968 29.794 27.230 1.00 31.26 O ATOM 1276 HH TYR A 359 -5.807 29.618 26.734 1.00 0.00 H ATOM 1277 H TYR A 359 -1.576 29.508 21.377 1.00 0.00 H ATOM 1278 N ARG A 360 2.157 29.681 22.206 1.00 22.94 N ATOM 1279 CA ARG A 360 3.190 29.343 21.259 1.00 24.93 C ATOM 1280 C ARG A 360 4.505 29.095 21.930 1.00 29.87 C ATOM 1281 O ARG A 360 4.893 29.832 22.857 1.00 27.71 O ATOM 1282 CB ARG A 360 3.297 30.457 20.184 1.00 28.68 C ATOM 1283 CG ARG A 360 4.489 30.363 19.235 1.00 34.97 C ATOM 1284 CD ARG A 360 5.043 31.728 18.818 1.00 47.34 C ATOM 1285 NE ARG A 360 4.203 32.411 17.827 1.00 64.56 N ATOM 1286 CZ ARG A 360 4.264 32.220 16.511 1.00 81.80 C ATOM 1287 NH1 ARG A 360 5.119 31.341 15.997 1.00 59.61 N ATOM 1288 NH2 ARG A 360 3.463 32.898 15.699 1.00 74.91 N ATOM 1289 HE ARG A 360 3.506 33.097 18.180 1.00 0.00 H ATOM 1290 HH12 ARG A 360 5.161 31.197 14.968 1.00 0.00 H ATOM 1291 HH11 ARG A 360 5.746 30.797 16.624 1.00 0.00 H ATOM 1292 HH22 ARG A 360 3.514 32.746 14.672 1.00 0.00 H ATOM 1293 HH21 ARG A 360 2.784 33.582 16.090 1.00 0.00 H ATOM 1294 H ARG A 360 2.394 30.198 23.077 1.00 0.00 H ATOM 1295 N ILE A 361 5.188 28.045 21.461 1.00 27.92 N ATOM 1296 CA ILE A 361 6.550 27.707 21.843 1.00 29.95 C ATOM 1297 C ILE A 361 7.305 27.986 20.556 1.00 32.55 C ATOM 1298 O ILE A 361 7.040 27.339 19.534 1.00 28.08 O ATOM 1299 CB ILE A 361 6.681 26.236 22.335 1.00 35.45 C ATOM 1300 CG1 ILE A 361 5.981 26.069 23.702 1.00 36.38 C ATOM 1301 CG2 ILE A 361 8.173 25.815 22.418 1.00 37.20 C ATOM 1302 CD1 ILE A 361 5.598 24.576 24.076 1.00 47.75 C ATOM 1303 H ILE A 361 4.711 27.426 20.774 1.00 0.00 H ATOM 1304 N HIS A 362 8.158 29.020 20.560 1.00 31.21 N ATOM 1305 CA HIS A 362 8.866 29.381 19.333 1.00 33.09 C ATOM 1306 C HIS A 362 10.329 29.104 19.453 1.00 34.81 C ATOM 1307 O HIS A 362 11.006 29.660 20.329 1.00 34.47 O ATOM 1308 CB HIS A 362 8.601 30.850 18.928 1.00 35.82 C ATOM 1309 CG HIS A 362 9.040 31.175 17.533 1.00 40.88 C ATOM 1310 ND1 HIS A 362 9.994 32.151 17.288 1.00 44.01 N ATOM 1311 CD2 HIS A 362 8.635 30.654 16.349 1.00 43.44 C ATOM 1312 CE1 HIS A 362 10.131 32.199 15.970 1.00 43.49 C ATOM 1313 NE2 HIS A 362 9.349 31.314 15.362 1.00 43.54 N ATOM 1314 H HIS A 362 8.316 29.563 21.433 1.00 0.00 H ATOM 1315 N ARG A 363 10.816 28.224 18.584 1.00 31.14 N ATOM 1316 CA ARG A 363 12.225 27.841 18.488 1.00 30.27 C ATOM 1317 C ARG A 363 12.814 27.463 19.850 1.00 32.65 C ATOM 1318 O ARG A 363 13.822 28.031 20.256 1.00 32.68 O ATOM 1319 CB ARG A 363 13.057 28.996 17.859 1.00 31.73 C ATOM 1320 CG ARG A 363 12.649 29.372 16.447 1.00 41.90 C ATOM 1321 CD ARG A 363 13.304 30.688 16.010 1.00 49.92 C ATOM 1322 NE ARG A 363 14.762 30.681 16.160 1.00 45.76 N ATOM 1323 CZ ARG A 363 15.603 30.174 15.268 1.00 59.19 C ATOM 1324 NH1 ARG A 363 15.144 29.624 14.151 1.00 51.21 N ATOM 1325 NH2 ARG A 363 16.910 30.204 15.490 1.00 51.67 N ATOM 1326 HE ARG A 363 15.164 31.101 17.022 1.00 0.00 H ATOM 1327 HH12 ARG A 363 15.808 29.228 13.455 1.00 0.00 H ATOM 1328 HH11 ARG A 363 14.120 29.589 13.971 1.00 0.00 H ATOM 1329 HH22 ARG A 363 17.566 29.805 14.788 1.00 0.00 H ATOM 1330 HH21 ARG A 363 17.279 30.626 16.366 1.00 0.00 H ATOM 1331 H ARG A 363 10.148 27.776 17.925 1.00 0.00 H ATOM 1332 N SER A 364 12.158 26.564 20.582 1.00 29.10 N ATOM 1333 CA SER A 364 12.713 26.142 21.870 1.00 29.36 C ATOM 1334 C SER A 364 13.878 25.182 21.521 1.00 32.14 C ATOM 1335 O SER A 364 13.721 24.349 20.616 1.00 29.75 O ATOM 1336 CB SER A 364 11.665 25.392 22.685 1.00 34.65 C ATOM 1337 OG SER A 364 12.163 25.062 23.968 1.00 48.85 O ATOM 1338 HG SER A 364 11.466 24.577 24.477 1.00 0.00 H ATOM 1339 H SER A 364 11.260 26.165 20.242 1.00 0.00 H ATOM 1340 N PRO A 365 15.053 25.309 22.164 1.00 29.66 N ATOM 1341 CA PRO A 365 16.167 24.397 21.812 1.00 29.49 C ATOM 1342 C PRO A 365 15.871 22.929 22.144 1.00 32.90 C ATOM 1343 O PRO A 365 15.313 22.623 23.194 1.00 31.90 O ATOM 1344 CB PRO A 365 17.369 24.936 22.611 1.00 31.70 C ATOM 1345 CG PRO A 365 16.800 25.823 23.650 1.00 36.06 C ATOM 1346 CD PRO A 365 15.418 26.254 23.243 1.00 32.17 C ATOM 1347 N LEU A 366 16.199 22.022 21.216 1.00 29.23 N ATOM 1348 CA LEU A 366 16.095 20.576 21.438 1.00 30.09 C ATOM 1349 C LEU A 366 17.185 20.263 22.513 1.00 32.95 C ATOM 1350 O LEU A 366 18.271 20.840 22.462 1.00 32.19 O ATOM 1351 CB LEU A 366 16.491 19.856 20.131 1.00 31.34 C ATOM 1352 CG LEU A 366 15.565 18.799 19.564 1.00 39.22 C ATOM 1353 CD1 LEU A 366 14.209 19.362 19.291 1.00 39.87 C ATOM 1354 CD2 LEU A 366 16.117 18.229 18.259 1.00 41.53 C ATOM 1355 H LEU A 366 16.544 22.358 20.294 1.00 0.00 H ATOM 1356 N CYS A 367 16.891 19.383 23.476 1.00 32.20 N ATOM 1357 CA CYS A 367 17.871 19.033 24.506 1.00 34.45 C ATOM 1358 C CYS A 367 19.044 18.274 23.889 1.00 35.50 C ATOM 1359 O CYS A 367 18.922 17.714 22.791 1.00 34.25 O ATOM 1360 CB CYS A 367 17.227 18.256 25.656 1.00 37.32 C ATOM 1361 SG CYS A 367 16.585 16.634 25.194 1.00 42.34 S ATOM 1362 H CYS A 367 15.950 18.940 23.494 1.00 0.00 H ATOM 1363 N GLU A 368 20.169 18.265 24.595 1.00 32.42 N ATOM 1364 CA GLU A 368 21.397 17.619 24.143 1.00 31.47 C ATOM 1365 C GLU A 368 21.211 16.137 23.880 1.00 34.26 C ATOM 1366 O GLU A 368 21.803 15.606 22.939 1.00 34.16 O ATOM 1367 CB GLU A 368 22.554 17.894 25.111 1.00 33.29 C ATOM 1368 CG GLU A 368 22.991 19.356 25.088 1.00 40.44 C ATOM 1369 CD GLU A 368 23.699 19.843 23.837 1.00 59.29 C ATOM 1370 OE1 GLU A 368 23.942 21.068 23.748 1.00 71.73 O ATOM 1371 OE2 GLU A 368 24.016 19.015 22.951 1.00 48.53 O ATOM 1372 H GLU A 368 20.175 18.743 25.518 1.00 0.00 H ATOM 1373 N TYR A 369 20.341 15.480 24.682 1.00 31.14 N ATOM 1374 CA TYR A 369 20.066 14.066 24.511 1.00 31.02 C ATOM 1375 C TYR A 369 19.525 13.835 23.108 1.00 34.10 C ATOM 1376 O TYR A 369 19.998 12.939 22.387 1.00 32.48 O ATOM 1377 CB TYR A 369 19.086 13.563 25.578 1.00 32.08 C ATOM 1378 CG TYR A 369 18.748 12.097 25.400 1.00 32.00 C ATOM 1379 CD1 TYR A 369 19.542 11.105 25.967 1.00 33.25 C ATOM 1380 CD2 TYR A 369 17.647 11.701 24.642 1.00 32.44 C ATOM 1381 CE1 TYR A 369 19.235 9.751 25.806 1.00 31.70 C ATOM 1382 CE2 TYR A 369 17.360 10.350 24.431 1.00 34.23 C ATOM 1383 CZ TYR A 369 18.165 9.378 25.007 1.00 34.89 C ATOM 1384 OH TYR A 369 17.866 8.045 24.832 1.00 36.36 O ATOM 1385 HH TYR A 369 17.882 7.829 23.866 1.00 0.00 H ATOM 1386 H TYR A 369 19.857 16.002 25.440 1.00 0.00 H ATOM 1387 N MET A 370 18.557 14.674 22.717 1.00 31.85 N ATOM 1388 CA MET A 370 17.886 14.616 21.419 1.00 32.25 C ATOM 1389 C MET A 370 18.849 14.855 20.265 1.00 32.57 C ATOM 1390 O MET A 370 18.863 14.075 19.304 1.00 31.07 O ATOM 1391 CB MET A 370 16.728 15.620 21.392 1.00 35.89 C ATOM 1392 CG MET A 370 15.524 15.109 22.062 1.00 42.86 C ATOM 1393 SD MET A 370 15.002 13.665 21.149 1.00 50.35 S ATOM 1394 CE MET A 370 14.512 14.437 19.560 1.00 47.36 C ATOM 1395 H MET A 370 18.262 15.417 23.382 1.00 0.00 H ATOM 1396 N ILE A 371 19.676 15.893 20.385 1.00 29.57 N ATOM 1397 CA ILE A 371 20.714 16.229 19.402 1.00 29.91 C ATOM 1398 C ILE A 371 21.646 15.016 19.216 1.00 35.34 C ATOM 1399 O ILE A 371 21.872 14.576 18.084 1.00 34.72 O ATOM 1400 CB ILE A 371 21.462 17.525 19.803 1.00 32.94 C ATOM 1401 CG1 ILE A 371 20.478 18.734 19.806 1.00 32.64 C ATOM 1402 CG2 ILE A 371 22.686 17.762 18.894 1.00 33.83 C ATOM 1403 CD1 ILE A 371 21.038 20.081 20.417 1.00 37.12 C ATOM 1404 H ILE A 371 19.581 16.501 21.224 1.00 0.00 H ATOM 1405 N ASN A 372 22.127 14.429 20.338 1.00 32.84 N ATOM 1406 CA ASN A 372 23.012 13.244 20.275 1.00 31.05 C ATOM 1407 C ASN A 372 22.312 12.051 19.595 1.00 33.29 C ATOM 1408 O ASN A 372 22.943 11.319 18.826 1.00 32.63 O ATOM 1409 CB ASN A 372 23.481 12.846 21.678 1.00 31.85 C ATOM 1410 CG ASN A 372 24.464 11.688 21.673 1.00 42.94 C ATOM 1411 OD1 ASN A 372 25.614 11.826 21.282 1.00 42.54 O ATOM 1412 ND2 ASN A 372 24.017 10.518 22.062 1.00 37.92 N ATOM 1413 HD22 ASN A 372 23.036 10.420 22.392 1.00 0.00 H ATOM 1414 HD21 ASN A 372 24.644 9.689 22.041 1.00 0.00 H ATOM 1415 H ASN A 372 21.868 14.820 21.266 1.00 0.00 H ATOM 1416 N PHE A 373 21.017 11.877 19.876 1.00 29.45 N ATOM 1417 CA PHE A 373 20.212 10.796 19.317 1.00 29.98 C ATOM 1418 C PHE A 373 20.111 10.929 17.785 1.00 32.88 C ATOM 1419 O PHE A 373 20.338 9.949 17.084 1.00 32.17 O ATOM 1420 CB PHE A 373 18.829 10.737 19.969 1.00 30.94 C ATOM 1421 CG PHE A 373 18.043 9.538 19.491 1.00 32.73 C ATOM 1422 CD1 PHE A 373 18.295 8.273 20.001 1.00 35.51 C ATOM 1423 CD2 PHE A 373 17.064 9.675 18.512 1.00 36.07 C ATOM 1424 CE1 PHE A 373 17.567 7.162 19.556 1.00 37.19 C ATOM 1425 CE2 PHE A 373 16.333 8.563 18.071 1.00 38.49 C ATOM 1426 CZ PHE A 373 16.615 7.317 18.567 1.00 36.71 C ATOM 1427 H PHE A 373 20.559 12.547 20.527 1.00 0.00 H ATOM 1428 N ILE A 374 19.832 12.145 17.285 1.00 31.28 N ATOM 1429 CA ILE A 374 19.764 12.412 15.838 1.00 31.65 C ATOM 1430 C ILE A 374 21.107 12.075 15.152 1.00 37.66 C ATOM 1431 O ILE A 374 21.128 11.368 14.142 1.00 37.45 O ATOM 1432 CB ILE A 374 19.270 13.859 15.598 1.00 34.36 C ATOM 1433 CG1 ILE A 374 17.806 13.961 16.067 1.00 32.87 C ATOM 1434 CG2 ILE A 374 19.419 14.268 14.117 1.00 36.63 C ATOM 1435 CD1 ILE A 374 17.263 15.389 16.135 1.00 37.19 C ATOM 1436 H ILE A 374 19.657 12.929 17.946 1.00 0.00 H ATOM 1437 N HIS A 375 22.213 12.488 15.770 1.00 36.73 N ATOM 1438 CA HIS A 375 23.567 12.228 15.273 1.00 38.93 C ATOM 1439 C HIS A 375 23.850 10.733 15.164 1.00 42.79 C ATOM 1440 O HIS A 375 24.374 10.286 14.143 1.00 42.11 O ATOM 1441 CB HIS A 375 24.606 12.934 16.165 1.00 41.16 C ATOM 1442 CG HIS A 375 24.582 14.431 16.066 1.00 46.24 C ATOM 1443 ND1 HIS A 375 25.307 15.222 16.945 1.00 48.91 N ATOM 1444 CD2 HIS A 375 23.908 15.238 15.212 1.00 49.11 C ATOM 1445 CE1 HIS A 375 25.077 16.471 16.575 1.00 48.64 C ATOM 1446 NE2 HIS A 375 24.228 16.531 15.549 1.00 48.99 N ATOM 1447 H HIS A 375 22.110 13.025 16.655 1.00 0.00 H ATOM 1448 N LYS A 376 23.450 9.964 16.196 1.00 39.38 N ATOM 1449 CA LYS A 376 23.626 8.517 16.287 1.00 39.75 C ATOM 1450 C LYS A 376 22.893 7.782 15.146 1.00 45.09 C ATOM 1451 O LYS A 376 23.463 6.865 14.578 1.00 43.41 O ATOM 1452 CB LYS A 376 23.106 8.011 17.648 1.00 43.12 C ATOM 1453 CG LYS A 376 23.712 6.685 18.095 1.00 65.46 C ATOM 1454 CD LYS A 376 22.973 6.107 19.290 1.00 80.72 C ATOM 1455 CE LYS A 376 23.457 4.712 19.614 1.00 99.58 C ATOM 1456 NZ LYS A 376 22.706 4.112 20.750 1.00110.06 N ATOM 1457 HZ1 LYS A 376 22.829 4.704 21.596 1.00 0.00 H ATOM 1458 HZ2 LYS A 376 21.696 4.058 20.507 1.00 0.00 H ATOM 1459 HZ3 LYS A 376 23.070 3.156 20.938 1.00 0.00 H ATOM 1460 H LYS A 376 22.978 10.439 16.992 1.00 0.00 H ATOM 1461 N LEU A 377 21.632 8.182 14.819 1.00 42.72 N ATOM 1462 CA LEU A 377 20.836 7.554 13.759 1.00 42.80 C ATOM 1463 C LEU A 377 21.494 7.648 12.391 1.00 51.04 C ATOM 1464 O LEU A 377 21.429 6.692 11.620 1.00 50.18 O ATOM 1465 CB LEU A 377 19.435 8.178 13.682 1.00 42.04 C ATOM 1466 CG LEU A 377 18.415 7.778 14.734 1.00 45.63 C ATOM 1467 CD1 LEU A 377 17.202 8.721 14.661 1.00 45.12 C ATOM 1468 CD2 LEU A 377 17.949 6.331 14.548 1.00 47.69 C ATOM 1469 H LEU A 377 21.213 8.973 15.348 1.00 0.00 H ATOM 1470 N LYS A 378 22.106 8.802 12.091 1.00 52.15 N ATOM 1471 CA LYS A 378 22.799 9.085 10.834 1.00 54.62 C ATOM 1472 C LYS A 378 24.065 8.210 10.649 1.00 64.79 C ATOM 1473 O LYS A 378 24.416 7.857 9.517 1.00 64.82 O ATOM 1474 CB LYS A 378 23.153 10.582 10.786 1.00 57.35 C ATOM 1475 CG LYS A 378 23.574 11.091 9.410 1.00 73.22 C ATOM 1476 CD LYS A 378 23.142 12.544 9.162 1.00 80.36 C ATOM 1477 CE LYS A 378 21.709 12.677 8.683 1.00 88.07 C ATOM 1478 NZ LYS A 378 21.477 12.014 7.368 1.00 93.48 N ATOM 1479 HZ1 LYS A 378 22.094 12.445 6.650 1.00 0.00 H ATOM 1480 HZ2 LYS A 378 21.693 11.000 7.449 1.00 0.00 H ATOM 1481 HZ3 LYS A 378 20.482 12.136 7.090 1.00 0.00 H ATOM 1482 H LYS A 378 22.087 9.555 12.808 1.00 0.00 H ATOM 1483 N HIS A 379 24.730 7.851 11.760 1.00 65.00 N ATOM 1484 CA HIS A 379 25.964 7.070 11.725 1.00 66.31 C ATOM 1485 C HIS A 379 25.716 5.562 11.879 1.00 71.43 C ATOM 1486 O HIS A 379 26.668 4.787 12.035 1.00 70.49 O ATOM 1487 CB HIS A 379 26.986 7.630 12.729 1.00 67.70 C ATOM 1488 CG HIS A 379 27.397 9.036 12.396 1.00 71.87 C ATOM 1489 ND1 HIS A 379 26.935 10.117 13.129 1.00 74.14 N ATOM 1490 CD2 HIS A 379 28.169 9.496 11.382 1.00 74.26 C ATOM 1491 CE1 HIS A 379 27.450 11.193 12.553 1.00 73.76 C ATOM 1492 NE2 HIS A 379 28.202 10.870 11.499 1.00 74.23 N ATOM 1493 H HIS A 379 24.350 8.141 12.684 1.00 0.00 H ATOM 1494 N LEU A 380 24.439 5.139 11.749 1.00 69.75 N ATOM 1495 CA LEU A 380 24.055 3.726 11.742 1.00 70.37 C ATOM 1496 C LEU A 380 24.316 3.198 10.314 1.00 76.51 C ATOM 1497 O LEU A 380 23.990 3.910 9.357 1.00 76.62 O ATOM 1498 CB LEU A 380 22.567 3.535 12.097 1.00 70.28 C ATOM 1499 CG LEU A 380 22.162 3.669 13.568 1.00 74.66 C ATOM 1500 CD1 LEU A 380 20.665 3.656 13.701 1.00 74.34 C ATOM 1501 CD2 LEU A 380 22.754 2.548 14.426 1.00 77.13 C ATOM 1502 H LEU A 380 23.690 5.854 11.649 1.00 0.00 H ATOM 1503 N PRO A 381 24.898 1.983 10.139 1.00 73.92 N ATOM 1504 CA PRO A 381 25.171 1.482 8.773 1.00 74.22 C ATOM 1505 C PRO A 381 23.973 1.442 7.808 1.00 78.86 C ATOM 1506 O PRO A 381 24.143 1.815 6.642 1.00 78.87 O ATOM 1507 CB PRO A 381 25.749 0.082 9.010 1.00 75.83 C ATOM 1508 CG PRO A 381 26.280 0.115 10.397 1.00 80.28 C ATOM 1509 CD PRO A 381 25.355 1.022 11.163 1.00 75.62 C ATOM 1510 N GLU A 382 22.770 1.033 8.287 1.00 74.75 N ATOM 1511 CA GLU A 382 21.570 0.930 7.446 1.00 74.21 C ATOM 1512 C GLU A 382 20.308 1.572 8.033 1.00 77.34 C ATOM 1513 O GLU A 382 20.220 1.781 9.246 1.00 77.22 O ATOM 1514 CB GLU A 382 21.296 -0.540 7.096 1.00 75.83 C ATOM 1515 H GLU A 382 22.695 0.782 9.293 1.00 0.00 H ATOM 1516 N LYS A 383 19.317 1.858 7.158 1.00 72.44 N ATOM 1517 CA LYS A 383 18.029 2.443 7.539 1.00 71.25 C ATOM 1518 C LYS A 383 17.108 1.382 8.142 1.00 71.91 C ATOM 1519 O LYS A 383 16.110 1.733 8.791 1.00 70.83 O ATOM 1520 CB LYS A 383 17.357 3.145 6.350 1.00 74.45 C ATOM 1521 H LYS A 383 19.479 1.650 6.152 1.00 0.00 H ATOM 1522 N TYR A 384 17.451 0.079 7.931 1.00 65.69 N ATOM 1523 CA TYR A 384 16.735 -1.067 8.495 1.00 64.18 C ATOM 1524 C TYR A 384 16.990 -1.041 9.999 1.00 64.78 C ATOM 1525 O TYR A 384 16.072 -1.289 10.793 1.00 64.69 O ATOM 1526 CB TYR A 384 17.237 -2.385 7.880 1.00 65.52 C ATOM 1527 H TYR A 384 18.277 -0.114 7.329 1.00 0.00 H ATOM 1528 N MET A 385 18.243 -0.678 10.378 1.00 57.84 N ATOM 1529 CA MET A 385 18.690 -0.511 11.756 1.00 55.56 C ATOM 1530 C MET A 385 18.033 0.747 12.349 1.00 53.51 C ATOM 1531 O MET A 385 17.637 0.721 13.514 1.00 51.79 O ATOM 1532 CB MET A 385 20.221 -0.398 11.822 1.00 57.85 C ATOM 1533 H MET A 385 18.939 -0.505 9.625 1.00 0.00 H ATOM 1534 N MET A 386 17.896 1.832 11.537 1.00 46.46 N ATOM 1535 CA MET A 386 17.271 3.097 11.978 1.00 44.06 C ATOM 1536 C MET A 386 15.854 2.864 12.518 1.00 42.69 C ATOM 1537 O MET A 386 15.567 3.275 13.639 1.00 41.48 O ATOM 1538 CB MET A 386 17.294 4.177 10.886 1.00 46.57 C ATOM 1539 CG MET A 386 18.687 4.743 10.570 1.00 50.00 C ATOM 1540 SD MET A 386 18.577 6.191 9.475 1.00 53.90 S ATOM 1541 CE MET A 386 20.214 6.127 8.642 1.00 51.89 C ATOM 1542 H MET A 386 18.248 1.767 10.560 1.00 0.00 H ATOM 1543 N ASN A 387 15.003 2.149 11.765 1.00 38.07 N ATOM 1544 CA ASN A 387 13.647 1.810 12.191 1.00 37.58 C ATOM 1545 C ASN A 387 13.607 0.961 13.457 1.00 40.57 C ATOM 1546 O ASN A 387 12.802 1.241 14.334 1.00 37.74 O ATOM 1547 CB ASN A 387 12.853 1.176 11.058 1.00 36.67 C ATOM 1548 CG ASN A 387 12.357 2.195 10.072 1.00 45.71 C ATOM 1549 OD1 ASN A 387 12.222 3.393 10.387 1.00 33.44 O ATOM 1550 ND2 ASN A 387 12.047 1.748 8.864 1.00 36.24 N ATOM 1551 HD22 ASN A 387 12.172 0.741 8.634 1.00 0.00 H ATOM 1552 HD21 ASN A 387 11.679 2.404 8.146 1.00 0.00 H ATOM 1553 H ASN A 387 15.325 1.820 10.832 1.00 0.00 H ATOM 1554 N SER A 388 14.517 -0.030 13.591 1.00 38.14 N ATOM 1555 CA SER A 388 14.586 -0.835 14.810 1.00 38.75 C ATOM 1556 C SER A 388 14.989 0.029 16.028 1.00 41.71 C ATOM 1557 O SER A 388 14.366 -0.095 17.084 1.00 41.98 O ATOM 1558 CB SER A 388 15.519 -2.036 14.625 1.00 44.03 C ATOM 1559 OG SER A 388 16.878 -1.632 14.564 1.00 58.33 O ATOM 1560 HG SER A 388 17.004 -1.015 13.800 1.00 0.00 H ATOM 1561 H SER A 388 15.180 -0.223 12.813 1.00 0.00 H ATOM 1562 N VAL A 389 15.975 0.948 15.852 1.00 37.94 N ATOM 1563 CA VAL A 389 16.430 1.896 16.888 1.00 37.56 C ATOM 1564 C VAL A 389 15.271 2.870 17.240 1.00 38.48 C ATOM 1565 O VAL A 389 14.931 3.035 18.418 1.00 35.63 O ATOM 1566 CB VAL A 389 17.730 2.629 16.458 1.00 42.35 C ATOM 1567 CG1 VAL A 389 18.063 3.799 17.381 1.00 42.36 C ATOM 1568 CG2 VAL A 389 18.905 1.651 16.394 1.00 42.41 C ATOM 1569 H VAL A 389 16.441 0.986 14.923 1.00 0.00 H ATOM 1570 N LEU A 390 14.605 3.416 16.207 1.00 34.71 N ATOM 1571 CA LEU A 390 13.470 4.339 16.378 1.00 33.22 C ATOM 1572 C LEU A 390 12.273 3.722 17.075 1.00 35.22 C ATOM 1573 O LEU A 390 11.507 4.442 17.729 1.00 33.28 O ATOM 1574 CB LEU A 390 13.032 4.937 15.043 1.00 32.38 C ATOM 1575 CG LEU A 390 13.868 6.059 14.482 1.00 34.92 C ATOM 1576 CD1 LEU A 390 13.366 6.437 13.092 1.00 34.83 C ATOM 1577 CD2 LEU A 390 13.816 7.294 15.387 1.00 34.08 C ATOM 1578 H LEU A 390 14.906 3.175 15.241 1.00 0.00 H ATOM 1579 N GLU A 391 12.122 2.393 16.982 1.00 32.70 N ATOM 1580 CA GLU A 391 11.030 1.695 17.655 1.00 33.77 C ATOM 1581 C GLU A 391 11.056 1.844 19.171 1.00 36.59 C ATOM 1582 O GLU A 391 10.006 1.725 19.803 1.00 37.28 O ATOM 1583 CB GLU A 391 11.032 0.211 17.299 1.00 36.07 C ATOM 1584 CG GLU A 391 9.714 -0.202 16.690 1.00 50.16 C ATOM 1585 CD GLU A 391 9.674 -1.649 16.254 1.00 59.90 C ATOM 1586 OE1 GLU A 391 9.622 -1.899 15.028 1.00 53.05 O ATOM 1587 OE2 GLU A 391 9.700 -2.533 17.139 1.00 42.27 O ATOM 1588 H GLU A 391 12.800 1.845 16.416 1.00 0.00 H ATOM 1589 N ASN A 392 12.245 2.094 19.747 1.00 31.24 N ATOM 1590 CA ASN A 392 12.423 2.240 21.188 1.00 31.15 C ATOM 1591 C ASN A 392 12.682 3.703 21.602 1.00 32.91 C ATOM 1592 O ASN A 392 13.033 3.968 22.747 1.00 33.37 O ATOM 1593 CB ASN A 392 13.531 1.303 21.681 1.00 31.22 C ATOM 1594 CG ASN A 392 13.331 -0.114 21.223 1.00 57.95 C ATOM 1595 OD1 ASN A 392 12.348 -0.758 21.579 1.00 45.83 O ATOM 1596 ND2 ASN A 392 14.262 -0.627 20.417 1.00 54.91 N ATOM 1597 HD22 ASN A 392 15.081 -0.051 20.136 1.00 0.00 H ATOM 1598 HD21 ASN A 392 14.168 -1.603 20.069 1.00 0.00 H ATOM 1599 H ASN A 392 13.080 2.188 19.134 1.00 0.00 H ATOM 1600 N PHE A 393 12.462 4.649 20.676 1.00 27.82 N ATOM 1601 CA PHE A 393 12.580 6.076 20.932 1.00 26.91 C ATOM 1602 C PHE A 393 11.178 6.676 20.853 1.00 28.71 C ATOM 1603 O PHE A 393 10.519 6.621 19.794 1.00 26.85 O ATOM 1604 CB PHE A 393 13.472 6.729 19.885 1.00 28.05 C ATOM 1605 CG PHE A 393 13.433 8.241 19.935 1.00 29.44 C ATOM 1606 CD1 PHE A 393 14.122 8.936 20.919 1.00 33.21 C ATOM 1607 CD2 PHE A 393 12.723 8.966 18.986 1.00 30.96 C ATOM 1608 CE1 PHE A 393 14.062 10.328 20.979 1.00 33.91 C ATOM 1609 CE2 PHE A 393 12.659 10.357 19.051 1.00 33.57 C ATOM 1610 CZ PHE A 393 13.327 11.023 20.046 1.00 32.75 C ATOM 1611 H PHE A 393 12.191 4.344 19.719 1.00 0.00 H ATOM 1612 N THR A 394 10.724 7.269 21.949 1.00 23.97 N ATOM 1613 CA THR A 394 9.389 7.888 21.922 1.00 23.48 C ATOM 1614 C THR A 394 9.394 9.190 22.677 1.00 26.17 C ATOM 1615 O THR A 394 10.262 9.407 23.519 1.00 25.48 O ATOM 1616 CB THR A 394 8.326 6.965 22.558 1.00 25.34 C ATOM 1617 OG1 THR A 394 8.627 6.738 23.950 1.00 27.80 O ATOM 1618 CG2 THR A 394 8.129 5.633 21.794 1.00 24.16 C ATOM 1619 HG1 THR A 394 7.938 6.146 24.343 1.00 0.00 H ATOM 1620 H THR A 394 11.302 7.296 22.813 1.00 0.00 H ATOM 1621 N ILE A 395 8.368 10.009 22.453 1.00 22.06 N ATOM 1622 CA ILE A 395 8.200 11.278 23.162 1.00 21.84 C ATOM 1623 C ILE A 395 6.777 11.320 23.681 1.00 23.97 C ATOM 1624 O ILE A 395 5.838 10.979 22.954 1.00 20.84 O ATOM 1625 CB ILE A 395 8.515 12.480 22.209 1.00 25.36 C ATOM 1626 CG1 ILE A 395 10.048 12.471 21.812 1.00 26.95 C ATOM 1627 CG2 ILE A 395 8.139 13.839 22.898 1.00 26.52 C ATOM 1628 CD1 ILE A 395 10.396 13.283 20.678 1.00 41.98 C ATOM 1629 H ILE A 395 7.657 9.735 21.745 1.00 0.00 H ATOM 1630 N LEU A 396 6.607 11.801 24.909 1.00 22.44 N ATOM 1631 CA LEU A 396 5.287 12.006 25.496 1.00 21.62 C ATOM 1632 C LEU A 396 5.154 13.457 25.891 1.00 25.88 C ATOM 1633 O LEU A 396 5.958 13.966 26.687 1.00 23.46 O ATOM 1634 CB LEU A 396 5.090 11.117 26.701 1.00 21.67 C ATOM 1635 CG LEU A 396 3.712 11.236 27.411 1.00 26.02 C ATOM 1636 CD1 LEU A 396 2.567 10.628 26.544 1.00 22.83 C ATOM 1637 CD2 LEU A 396 3.754 10.544 28.775 1.00 27.83 C ATOM 1638 H LEU A 396 7.447 12.040 25.473 1.00 0.00 H ATOM 1639 N GLN A 397 4.142 14.141 25.330 1.00 23.12 N ATOM 1640 CA GLN A 397 3.878 15.552 25.606 1.00 23.30 C ATOM 1641 C GLN A 397 2.559 15.682 26.393 1.00 27.12 C ATOM 1642 O GLN A 397 1.523 15.195 25.927 1.00 26.11 O ATOM 1643 CB GLN A 397 3.821 16.326 24.280 1.00 24.11 C ATOM 1644 CG GLN A 397 3.594 17.815 24.449 1.00 29.63 C ATOM 1645 CD GLN A 397 3.081 18.538 23.225 1.00 43.50 C ATOM 1646 OE1 GLN A 397 2.420 19.575 23.339 1.00 41.10 O ATOM 1647 NE2 GLN A 397 3.355 18.024 22.031 1.00 22.46 N ATOM 1648 HE22 GLN A 397 3.913 17.150 21.957 1.00 0.00 H ATOM 1649 HE21 GLN A 397 3.011 18.496 21.170 1.00 0.00 H ATOM 1650 H GLN A 397 3.516 13.642 24.667 1.00 0.00 H ATOM 1651 N VAL A 398 2.616 16.307 27.591 1.00 23.31 N ATOM 1652 CA VAL A 398 1.466 16.501 28.476 1.00 22.78 C ATOM 1653 C VAL A 398 1.287 18.007 28.687 1.00 25.08 C ATOM 1654 O VAL A 398 2.195 18.683 29.206 1.00 23.97 O ATOM 1655 CB VAL A 398 1.565 15.740 29.830 1.00 27.06 C ATOM 1656 CG1 VAL A 398 0.272 15.934 30.638 1.00 27.08 C ATOM 1657 CG2 VAL A 398 1.826 14.234 29.610 1.00 27.45 C ATOM 1658 H VAL A 398 3.537 16.674 27.904 1.00 0.00 H ATOM 1659 N VAL A 399 0.098 18.497 28.324 1.00 21.38 N ATOM 1660 CA VAL A 399 -0.239 19.908 28.438 1.00 21.80 C ATOM 1661 C VAL A 399 -1.311 19.997 29.493 1.00 25.32 C ATOM 1662 O VAL A 399 -2.375 19.416 29.336 1.00 24.59 O ATOM 1663 CB VAL A 399 -0.649 20.595 27.119 1.00 24.98 C ATOM 1664 CG1 VAL A 399 -0.869 22.096 27.352 1.00 25.21 C ATOM 1665 CG2 VAL A 399 0.397 20.357 26.029 1.00 24.35 C ATOM 1666 H VAL A 399 -0.616 17.843 27.944 1.00 0.00 H ATOM 1667 N THR A 400 -1.034 20.746 30.541 1.00 24.34 N ATOM 1668 CA THR A 400 -1.901 20.839 31.704 1.00 24.56 C ATOM 1669 C THR A 400 -2.308 22.275 31.994 1.00 28.05 C ATOM 1670 O THR A 400 -1.521 23.195 31.755 1.00 25.96 O ATOM 1671 CB THR A 400 -1.130 20.211 32.888 1.00 31.67 C ATOM 1672 OG1 THR A 400 -0.774 18.863 32.541 1.00 34.12 O ATOM 1673 CG2 THR A 400 -1.933 20.182 34.183 1.00 36.29 C ATOM 1674 HG1 THR A 400 -1.596 18.342 32.360 1.00 0.00 H ATOM 1675 H THR A 400 -0.152 21.297 30.536 1.00 0.00 H ATOM 1676 N ASN A 401 -3.534 22.464 32.536 1.00 27.57 N ATOM 1677 CA ASN A 401 -3.982 23.776 33.012 1.00 27.52 C ATOM 1678 C ASN A 401 -3.273 23.866 34.354 1.00 34.51 C ATOM 1679 O ASN A 401 -3.530 23.028 35.211 1.00 35.03 O ATOM 1680 CB ASN A 401 -5.496 23.841 33.204 1.00 29.28 C ATOM 1681 CG ASN A 401 -5.972 25.199 33.663 1.00 39.72 C ATOM 1682 OD1 ASN A 401 -5.338 25.872 34.484 1.00 33.45 O ATOM 1683 ND2 ASN A 401 -7.101 25.643 33.137 1.00 37.10 N ATOM 1684 HD22 ASN A 401 -7.618 25.060 32.448 1.00 0.00 H ATOM 1685 HD21 ASN A 401 -7.472 26.575 33.412 1.00 0.00 H ATOM 1686 H ASN A 401 -4.179 21.652 32.617 1.00 0.00 H ATOM 1687 N ARG A 402 -2.343 24.831 34.524 1.00 33.03 N ATOM 1688 CA ARG A 402 -1.565 24.963 35.765 1.00 34.70 C ATOM 1689 C ARG A 402 -2.423 25.208 37.023 1.00 41.89 C ATOM 1690 O ARG A 402 -2.049 24.743 38.096 1.00 42.60 O ATOM 1691 CB ARG A 402 -0.473 26.040 35.633 1.00 36.91 C ATOM 1692 CG ARG A 402 0.646 25.919 36.653 1.00 46.45 C ATOM 1693 CD ARG A 402 1.522 27.152 36.655 1.00 50.90 C ATOM 1694 NE ARG A 402 0.861 28.289 37.306 1.00 52.30 N ATOM 1695 CZ ARG A 402 1.335 29.532 37.308 1.00 64.23 C ATOM 1696 NH1 ARG A 402 2.473 29.819 36.686 1.00 51.45 N ATOM 1697 NH2 ARG A 402 0.669 30.500 37.920 1.00 50.28 N ATOM 1698 HE ARG A 402 -0.038 28.111 37.798 1.00 0.00 H ATOM 1699 HH12 ARG A 402 2.837 30.793 36.692 1.00 0.00 H ATOM 1700 HH11 ARG A 402 3.000 29.070 36.193 1.00 0.00 H ATOM 1701 HH22 ARG A 402 1.044 31.470 37.919 1.00 0.00 H ATOM 1702 HH21 ARG A 402 -0.228 30.290 38.402 1.00 0.00 H ATOM 1703 H ARG A 402 -2.171 25.504 33.750 1.00 0.00 H ATOM 1704 N ASP A 403 -3.550 25.918 36.890 1.00 39.95 N ATOM 1705 CA ASP A 403 -4.406 26.259 38.032 1.00 41.06 C ATOM 1706 C ASP A 403 -5.444 25.180 38.398 1.00 46.44 C ATOM 1707 O ASP A 403 -5.857 25.130 39.555 1.00 47.36 O ATOM 1708 CB ASP A 403 -5.080 27.635 37.830 1.00 42.99 C ATOM 1709 CG ASP A 403 -4.122 28.807 37.595 1.00 54.86 C ATOM 1710 OD1 ASP A 403 -3.111 28.919 38.339 1.00 56.65 O ATOM 1711 OD2 ASP A 403 -4.385 29.610 36.677 1.00 58.13 O ATOM 1712 H ASP A 403 -3.829 26.240 35.941 1.00 0.00 H ATOM 1713 N THR A 404 -5.872 24.329 37.448 1.00 43.01 N ATOM 1714 CA THR A 404 -6.874 23.285 37.748 1.00 41.94 C ATOM 1715 C THR A 404 -6.263 21.881 37.733 1.00 44.73 C ATOM 1716 O THR A 404 -6.917 20.919 38.150 1.00 43.80 O ATOM 1717 CB THR A 404 -8.060 23.343 36.754 1.00 47.15 C ATOM 1718 OG1 THR A 404 -7.617 22.870 35.482 1.00 40.26 O ATOM 1719 CG2 THR A 404 -8.694 24.744 36.630 1.00 44.17 C ATOM 1720 HG1 THR A 404 -8.369 22.903 34.839 1.00 0.00 H ATOM 1721 H THR A 404 -5.490 24.407 36.484 1.00 0.00 H ATOM 1722 N GLN A 405 -5.026 21.757 37.196 1.00 40.79 N ATOM 1723 CA GLN A 405 -4.291 20.494 36.998 1.00 39.37 C ATOM 1724 C GLN A 405 -4.986 19.549 35.983 1.00 38.76 C ATOM 1725 O GLN A 405 -4.589 18.396 35.862 1.00 38.81 O ATOM 1726 CB GLN A 405 -3.936 19.769 38.323 1.00 41.01 C ATOM 1727 CG GLN A 405 -2.709 20.377 39.027 1.00 54.19 C ATOM 1728 CD GLN A 405 -1.502 20.507 38.120 1.00 67.83 C ATOM 1729 OE1 GLN A 405 -0.895 19.514 37.700 1.00 63.79 O ATOM 1730 NE2 GLN A 405 -1.135 21.742 37.787 1.00 57.81 N ATOM 1731 HE22 GLN A 405 -1.664 22.559 38.155 1.00 0.00 H ATOM 1732 HE21 GLN A 405 -0.320 21.891 37.159 1.00 0.00 H ATOM 1733 H GLN A 405 -4.551 22.632 36.896 1.00 0.00 H ATOM 1734 N GLU A 406 -5.974 20.061 35.223 1.00 32.27 N ATOM 1735 CA GLU A 406 -6.669 19.336 34.170 1.00 30.80 C ATOM 1736 C GLU A 406 -5.691 19.033 33.012 1.00 30.60 C ATOM 1737 O GLU A 406 -4.928 19.917 32.596 1.00 29.21 O ATOM 1738 CB GLU A 406 -7.826 20.193 33.609 1.00 32.04 C ATOM 1739 CG GLU A 406 -8.662 19.481 32.545 1.00 41.91 C ATOM 1740 CD GLU A 406 -9.765 20.284 31.872 1.00 61.80 C ATOM 1741 OE1 GLU A 406 -9.967 21.464 32.242 1.00 45.39 O ATOM 1742 OE2 GLU A 406 -10.434 19.726 30.972 1.00 53.04 O ATOM 1743 H GLU A 406 -6.260 21.045 35.402 1.00 0.00 H ATOM 1744 N THR A 407 -5.758 17.806 32.479 1.00 26.38 N ATOM 1745 CA THR A 407 -4.998 17.417 31.297 1.00 25.93 C ATOM 1746 C THR A 407 -5.734 18.004 30.101 1.00 29.01 C ATOM 1747 O THR A 407 -6.853 17.592 29.756 1.00 30.12 O ATOM 1748 CB THR A 407 -4.821 15.898 31.174 1.00 27.13 C ATOM 1749 OG1 THR A 407 -4.039 15.456 32.294 1.00 26.28 O ATOM 1750 CG2 THR A 407 -4.095 15.517 29.885 1.00 24.06 C ATOM 1751 HG1 THR A 407 -3.158 15.908 32.279 1.00 0.00 H ATOM 1752 H THR A 407 -6.378 17.101 32.927 1.00 0.00 H ATOM 1753 N LEU A 408 -5.084 18.960 29.463 1.00 23.82 N ATOM 1754 CA LEU A 408 -5.634 19.637 28.287 1.00 22.31 C ATOM 1755 C LEU A 408 -5.328 18.849 27.035 1.00 23.78 C ATOM 1756 O LEU A 408 -6.184 18.744 26.177 1.00 23.06 O ATOM 1757 CB LEU A 408 -5.137 21.071 28.159 1.00 22.09 C ATOM 1758 CG LEU A 408 -5.474 22.009 29.322 1.00 25.05 C ATOM 1759 CD1 LEU A 408 -4.677 23.311 29.203 1.00 25.81 C ATOM 1760 CD2 LEU A 408 -6.995 22.290 29.396 1.00 26.59 C ATOM 1761 H LEU A 408 -4.145 19.243 29.809 1.00 0.00 H ATOM 1762 N LEU A 409 -4.132 18.294 26.918 1.00 21.02 N ATOM 1763 CA LEU A 409 -3.769 17.439 25.790 1.00 22.02 C ATOM 1764 C LEU A 409 -2.682 16.529 26.236 1.00 24.86 C ATOM 1765 O LEU A 409 -1.810 16.917 27.005 1.00 21.84 O ATOM 1766 CB LEU A 409 -3.184 18.223 24.578 1.00 22.22 C ATOM 1767 CG LEU A 409 -4.084 18.909 23.572 1.00 27.48 C ATOM 1768 CD1 LEU A 409 -3.198 19.697 22.555 1.00 28.44 C ATOM 1769 CD2 LEU A 409 -4.951 17.890 22.784 1.00 23.71 C ATOM 1770 H LEU A 409 -3.423 18.473 27.658 1.00 0.00 H ATOM 1771 N CYS A 410 -2.677 15.343 25.686 1.00 22.53 N ATOM 1772 CA CYS A 410 -1.589 14.400 25.908 1.00 22.23 C ATOM 1773 C CYS A 410 -1.301 13.733 24.577 1.00 25.96 C ATOM 1774 O CYS A 410 -2.183 13.103 23.995 1.00 26.81 O ATOM 1775 CB CYS A 410 -1.937 13.389 26.994 1.00 22.92 C ATOM 1776 SG CYS A 410 -0.676 12.118 27.259 1.00 27.04 S ATOM 1777 H CYS A 410 -3.471 15.065 25.074 1.00 0.00 H ATOM 1778 N ILE A 411 -0.109 13.933 24.057 1.00 20.52 N ATOM 1779 CA ILE A 411 0.262 13.379 22.746 1.00 19.74 C ATOM 1780 C ILE A 411 1.451 12.449 22.920 1.00 22.16 C ATOM 1781 O ILE A 411 2.513 12.863 23.407 1.00 20.35 O ATOM 1782 CB ILE A 411 0.573 14.509 21.729 1.00 23.68 C ATOM 1783 CG1 ILE A 411 -0.514 15.603 21.763 1.00 24.90 C ATOM 1784 CG2 ILE A 411 0.738 13.937 20.313 1.00 25.56 C ATOM 1785 CD1 ILE A 411 0.088 17.041 21.750 1.00 30.01 C ATOM 1786 H ILE A 411 0.587 14.496 24.586 1.00 0.00 H ATOM 1787 N ALA A 412 1.263 11.216 22.521 1.00 21.25 N ATOM 1788 CA ALA A 412 2.303 10.208 22.561 1.00 21.36 C ATOM 1789 C ALA A 412 2.827 10.122 21.112 1.00 24.93 C ATOM 1790 O ALA A 412 2.038 10.060 20.152 1.00 24.58 O ATOM 1791 CB ALA A 412 1.721 8.879 23.036 1.00 22.21 C ATOM 1792 H ALA A 412 0.325 10.948 22.159 1.00 0.00 H ATOM 1793 N TYR A 413 4.145 10.221 20.944 1.00 20.95 N ATOM 1794 CA TYR A 413 4.766 10.238 19.604 1.00 19.10 C ATOM 1795 C TYR A 413 5.625 9.009 19.409 1.00 22.20 C ATOM 1796 O TYR A 413 6.442 8.667 20.280 1.00 20.72 O ATOM 1797 CB TYR A 413 5.694 11.463 19.437 1.00 20.25 C ATOM 1798 CG TYR A 413 4.996 12.804 19.511 1.00 19.87 C ATOM 1799 CD1 TYR A 413 4.480 13.403 18.372 1.00 20.62 C ATOM 1800 CD2 TYR A 413 4.869 13.479 20.724 1.00 20.17 C ATOM 1801 CE1 TYR A 413 3.873 14.664 18.426 1.00 21.53 C ATOM 1802 CE2 TYR A 413 4.283 14.754 20.788 1.00 19.59 C ATOM 1803 CZ TYR A 413 3.804 15.343 19.632 1.00 22.66 C ATOM 1804 OH TYR A 413 3.169 16.560 19.693 1.00 27.43 O ATOM 1805 HH TYR A 413 2.893 16.833 18.782 1.00 0.00 H ATOM 1806 H TYR A 413 4.756 10.288 21.783 1.00 0.00 H ATOM 1807 N VAL A 414 5.435 8.357 18.262 1.00 20.58 N ATOM 1808 CA VAL A 414 6.194 7.195 17.787 1.00 21.40 C ATOM 1809 C VAL A 414 6.763 7.526 16.416 1.00 23.10 C ATOM 1810 O VAL A 414 6.216 8.358 15.693 1.00 22.90 O ATOM 1811 CB VAL A 414 5.407 5.849 17.815 1.00 23.99 C ATOM 1812 CG1 VAL A 414 4.934 5.534 19.235 1.00 24.09 C ATOM 1813 CG2 VAL A 414 4.218 5.879 16.845 1.00 23.78 C ATOM 1814 H VAL A 414 4.675 8.706 17.644 1.00 0.00 H ATOM 1815 N PHE A 415 7.854 6.870 16.058 1.00 20.38 N ATOM 1816 CA PHE A 415 8.627 7.224 14.899 1.00 19.93 C ATOM 1817 C PHE A 415 9.072 6.091 14.013 1.00 27.56 C ATOM 1818 O PHE A 415 9.378 5.005 14.490 1.00 27.19 O ATOM 1819 CB PHE A 415 9.911 7.945 15.413 1.00 20.25 C ATOM 1820 CG PHE A 415 9.604 9.229 16.135 1.00 20.79 C ATOM 1821 CD1 PHE A 415 9.410 9.242 17.521 1.00 24.27 C ATOM 1822 CD2 PHE A 415 9.581 10.438 15.451 1.00 20.58 C ATOM 1823 CE1 PHE A 415 9.163 10.446 18.199 1.00 24.44 C ATOM 1824 CE2 PHE A 415 9.275 11.632 16.118 1.00 22.01 C ATOM 1825 CZ PHE A 415 9.083 11.626 17.487 1.00 21.77 C ATOM 1826 H PHE A 415 8.165 6.065 16.639 1.00 0.00 H ATOM 1827 N GLU A 416 9.252 6.431 12.731 1.00 23.03 N ATOM 1828 CA GLU A 416 9.789 5.567 11.693 1.00 23.44 C ATOM 1829 C GLU A 416 10.505 6.539 10.770 1.00 29.98 C ATOM 1830 O GLU A 416 10.209 7.740 10.809 1.00 28.44 O ATOM 1831 CB GLU A 416 8.634 4.857 10.957 1.00 24.99 C ATOM 1832 CG GLU A 416 9.056 3.664 10.113 1.00 30.74 C ATOM 1833 CD GLU A 416 7.891 2.833 9.611 1.00 40.13 C ATOM 1834 OE1 GLU A 416 7.731 2.722 8.376 1.00 43.02 O ATOM 1835 OE2 GLU A 416 7.125 2.309 10.449 1.00 34.08 O ATOM 1836 H GLU A 416 8.984 7.397 12.454 1.00 0.00 H ATOM 1837 N VAL A 417 11.423 6.028 9.929 1.00 28.13 N ATOM 1838 CA VAL A 417 12.147 6.851 8.962 1.00 28.61 C ATOM 1839 C VAL A 417 11.211 7.008 7.791 1.00 29.24 C ATOM 1840 O VAL A 417 10.600 6.040 7.376 1.00 27.83 O ATOM 1841 CB VAL A 417 13.470 6.156 8.501 1.00 35.09 C ATOM 1842 CG1 VAL A 417 14.220 6.995 7.472 1.00 35.24 C ATOM 1843 CG2 VAL A 417 14.364 5.857 9.685 1.00 35.84 C ATOM 1844 H VAL A 417 11.625 5.009 9.969 1.00 0.00 H ATOM 1845 N SER A 418 11.102 8.211 7.257 1.00 26.48 N ATOM 1846 CA SER A 418 10.272 8.429 6.079 1.00 27.13 C ATOM 1847 C SER A 418 10.918 7.869 4.803 1.00 34.98 C ATOM 1848 O SER A 418 12.133 7.945 4.643 1.00 34.78 O ATOM 1849 CB SER A 418 10.033 9.919 5.893 1.00 28.52 C ATOM 1850 OG SER A 418 9.330 10.125 4.680 1.00 31.16 O ATOM 1851 HG SER A 418 8.463 9.649 4.718 1.00 0.00 H ATOM 1852 H SER A 418 11.614 9.011 7.681 1.00 0.00 H ATOM 1853 N ALA A 419 10.089 7.375 3.873 1.00 34.27 N ATOM 1854 CA ALA A 419 10.536 6.934 2.544 1.00 35.69 C ATOM 1855 C ALA A 419 9.775 7.766 1.488 1.00 40.49 C ATOM 1856 O ALA A 419 9.836 7.457 0.298 1.00 41.38 O ATOM 1857 CB ALA A 419 10.257 5.442 2.351 1.00 36.04 C ATOM 1858 H ALA A 419 9.078 7.300 4.103 1.00 0.00 H ATOM 1859 N SER A 420 9.034 8.808 1.929 1.00 36.11 N ATOM 1860 CA SER A 420 8.249 9.650 1.025 1.00 35.02 C ATOM 1861 C SER A 420 9.118 10.538 0.152 1.00 40.26 C ATOM 1862 O SER A 420 10.106 11.111 0.631 1.00 39.38 O ATOM 1863 CB SER A 420 7.288 10.537 1.817 1.00 36.46 C ATOM 1864 OG SER A 420 6.588 11.411 0.944 1.00 36.85 O ATOM 1865 HG SER A 420 6.071 10.878 0.290 1.00 0.00 H ATOM 1866 H SER A 420 9.022 9.019 2.947 1.00 0.00 H ATOM 1867 N GLU A 421 8.709 10.723 -1.112 1.00 37.71 N ATOM 1868 CA GLU A 421 9.414 11.660 -2.002 1.00 38.54 C ATOM 1869 C GLU A 421 8.901 13.097 -1.719 1.00 42.57 C ATOM 1870 O GLU A 421 9.449 14.050 -2.268 1.00 43.19 O ATOM 1871 CB GLU A 421 9.209 11.277 -3.486 1.00 40.42 C ATOM 1872 CG GLU A 421 9.910 9.990 -3.899 1.00 55.47 C ATOM 1873 CD GLU A 421 9.463 9.344 -5.203 1.00 90.19 C ATOM 1874 OE1 GLU A 421 8.248 9.380 -5.513 1.00 88.65 O ATOM 1875 OE2 GLU A 421 10.331 8.771 -5.903 1.00 83.62 O ATOM 1876 H GLU A 421 7.884 10.198 -1.467 1.00 0.00 H ATOM 1877 N HIS A 422 7.856 13.240 -0.851 1.00 36.81 N ATOM 1878 CA HIS A 422 7.203 14.509 -0.481 1.00 36.80 C ATOM 1879 C HIS A 422 7.526 14.984 0.950 1.00 38.50 C ATOM 1880 O HIS A 422 6.801 15.814 1.510 1.00 37.77 O ATOM 1881 CB HIS A 422 5.679 14.402 -0.675 1.00 38.63 C ATOM 1882 CG HIS A 422 5.303 13.918 -2.042 1.00 43.58 C ATOM 1883 ND1 HIS A 422 5.386 14.748 -3.152 1.00 46.31 N ATOM 1884 CD2 HIS A 422 4.938 12.679 -2.446 1.00 45.80 C ATOM 1885 CE1 HIS A 422 5.044 13.994 -4.185 1.00 45.94 C ATOM 1886 NE2 HIS A 422 4.764 12.744 -3.807 1.00 45.95 N ATOM 1887 H HIS A 422 7.487 12.373 -0.410 1.00 0.00 H ATOM 1888 N GLY A 423 8.604 14.457 1.517 1.00 33.92 N ATOM 1889 CA GLY A 423 9.059 14.821 2.855 1.00 32.07 C ATOM 1890 C GLY A 423 8.379 14.072 3.989 1.00 31.37 C ATOM 1891 O GLY A 423 7.681 13.075 3.765 1.00 31.25 O ATOM 1892 H GLY A 423 9.150 13.751 0.983 1.00 0.00 H ATOM 1893 N ALA A 424 8.596 14.549 5.227 1.00 25.16 N ATOM 1894 CA ALA A 424 8.063 13.934 6.442 1.00 22.58 C ATOM 1895 C ALA A 424 6.542 13.777 6.402 1.00 25.53 C ATOM 1896 O ALA A 424 5.830 14.619 5.838 1.00 24.91 O ATOM 1897 CB ALA A 424 8.476 14.749 7.654 1.00 23.11 C ATOM 1898 H ALA A 424 9.177 15.406 5.327 1.00 0.00 H ATOM 1899 N GLN A 425 6.051 12.713 7.024 1.00 21.32 N ATOM 1900 CA GLN A 425 4.621 12.403 7.065 1.00 22.11 C ATOM 1901 C GLN A 425 4.158 12.043 8.468 1.00 23.03 C ATOM 1902 O GLN A 425 4.980 11.822 9.365 1.00 21.74 O ATOM 1903 CB GLN A 425 4.285 11.278 6.057 1.00 23.26 C ATOM 1904 CG GLN A 425 4.754 11.555 4.612 1.00 22.96 C ATOM 1905 CD GLN A 425 4.038 12.674 3.882 1.00 31.82 C ATOM 1906 OE1 GLN A 425 2.845 12.959 4.097 1.00 27.06 O ATOM 1907 NE2 GLN A 425 4.755 13.310 2.968 1.00 29.33 N ATOM 1908 HE22 GLN A 425 5.749 13.048 2.812 1.00 0.00 H ATOM 1909 HE21 GLN A 425 4.324 14.071 2.406 1.00 0.00 H ATOM 1910 H GLN A 425 6.712 12.070 7.504 1.00 0.00 H ATOM 1911 N HIS A 426 2.826 11.983 8.670 1.00 21.81 N ATOM 1912 CA HIS A 426 2.295 11.604 9.958 1.00 22.27 C ATOM 1913 C HIS A 426 0.907 11.000 9.843 1.00 26.11 C ATOM 1914 O HIS A 426 0.194 11.231 8.853 1.00 23.92 O ATOM 1915 CB HIS A 426 2.220 12.829 10.891 1.00 23.10 C ATOM 1916 CG HIS A 426 1.358 13.948 10.365 1.00 28.49 C ATOM 1917 ND1 HIS A 426 -0.020 13.928 10.488 1.00 32.17 N ATOM 1918 CD2 HIS A 426 1.716 15.083 9.730 1.00 31.28 C ATOM 1919 CE1 HIS A 426 -0.450 15.048 9.924 1.00 31.94 C ATOM 1920 NE2 HIS A 426 0.563 15.774 9.461 1.00 31.54 N ATOM 1921 H HIS A 426 2.176 12.212 7.891 1.00 0.00 H ATOM 1922 N HIS A 427 0.536 10.227 10.866 1.00 24.62 N ATOM 1923 CA HIS A 427 -0.812 9.711 11.057 1.00 24.30 C ATOM 1924 C HIS A 427 -1.133 10.122 12.495 1.00 23.93 C ATOM 1925 O HIS A 427 -0.329 9.905 13.402 1.00 22.89 O ATOM 1926 CB HIS A 427 -0.949 8.167 10.907 1.00 26.77 C ATOM 1927 CG HIS A 427 -1.152 7.660 9.513 1.00 31.54 C ATOM 1928 ND1 HIS A 427 -2.158 8.152 8.690 1.00 34.53 N ATOM 1929 CD2 HIS A 427 -0.521 6.646 8.866 1.00 32.17 C ATOM 1930 CE1 HIS A 427 -2.041 7.483 7.547 1.00 32.76 C ATOM 1931 NE2 HIS A 427 -1.068 6.572 7.606 1.00 31.96 N ATOM 1932 H HIS A 427 1.257 9.977 11.573 1.00 0.00 H ATOM 1933 N ILE A 428 -2.283 10.746 12.679 1.00 21.41 N ATOM 1934 CA ILE A 428 -2.782 11.144 13.996 1.00 20.55 C ATOM 1935 C ILE A 428 -3.908 10.167 14.373 1.00 22.62 C ATOM 1936 O ILE A 428 -4.880 10.019 13.619 1.00 21.72 O ATOM 1937 CB ILE A 428 -3.287 12.601 13.984 1.00 23.83 C ATOM 1938 CG1 ILE A 428 -2.142 13.595 13.579 1.00 25.57 C ATOM 1939 CG2 ILE A 428 -3.904 12.953 15.367 1.00 26.65 C ATOM 1940 CD1 ILE A 428 -2.617 15.034 13.328 1.00 30.33 C ATOM 1941 H ILE A 428 -2.864 10.966 11.845 1.00 0.00 H ATOM 1942 N TYR A 429 -3.822 9.585 15.580 1.00 19.42 N ATOM 1943 CA TYR A 429 -4.849 8.673 16.086 1.00 18.84 C ATOM 1944 C TYR A 429 -5.379 9.152 17.430 1.00 22.43 C ATOM 1945 O TYR A 429 -4.654 9.785 18.202 1.00 22.73 O ATOM 1946 CB TYR A 429 -4.250 7.269 16.304 1.00 19.08 C ATOM 1947 CG TYR A 429 -3.617 6.660 15.071 1.00 22.09 C ATOM 1948 CD1 TYR A 429 -4.381 5.932 14.162 1.00 23.71 C ATOM 1949 CD2 TYR A 429 -2.244 6.758 14.846 1.00 23.32 C ATOM 1950 CE1 TYR A 429 -3.808 5.340 13.041 1.00 24.20 C ATOM 1951 CE2 TYR A 429 -1.657 6.181 13.709 1.00 24.40 C ATOM 1952 CZ TYR A 429 -2.449 5.486 12.804 1.00 26.72 C ATOM 1953 OH TYR A 429 -1.916 4.902 11.677 1.00 27.84 O ATOM 1954 HH TYR A 429 -2.637 4.458 11.164 1.00 0.00 H ATOM 1955 H TYR A 429 -2.995 9.790 16.177 1.00 0.00 H ATOM 1956 N ARG A 430 -6.607 8.754 17.751 1.00 20.11 N ATOM 1957 CA ARG A 430 -7.151 8.973 19.075 1.00 20.54 C ATOM 1958 C ARG A 430 -6.721 7.750 19.908 1.00 25.43 C ATOM 1959 O ARG A 430 -6.743 6.625 19.412 1.00 25.55 O ATOM 1960 CB ARG A 430 -8.681 9.091 19.030 1.00 26.10 C ATOM 1961 CG ARG A 430 -9.173 10.340 18.267 1.00 30.71 C ATOM 1962 CD ARG A 430 -10.681 10.365 18.058 1.00 34.99 C ATOM 1963 NE ARG A 430 -11.109 9.228 17.250 1.00 35.87 N ATOM 1964 CZ ARG A 430 -11.699 8.147 17.737 1.00 48.89 C ATOM 1965 NH1 ARG A 430 -11.988 7.126 16.939 1.00 39.51 N ATOM 1966 NH2 ARG A 430 -12.001 8.073 19.027 1.00 43.18 N ATOM 1967 HE ARG A 430 -10.940 9.269 16.225 1.00 0.00 H ATOM 1968 HH12 ARG A 430 -12.451 6.279 17.325 1.00 0.00 H ATOM 1969 HH11 ARG A 430 -11.751 7.173 15.927 1.00 0.00 H ATOM 1970 HH22 ARG A 430 -12.464 7.222 19.405 1.00 0.00 H ATOM 1971 HH21 ARG A 430 -11.774 8.866 19.660 1.00 0.00 H ATOM 1972 H ARG A 430 -7.189 8.275 17.035 1.00 0.00 H ATOM 1973 N LEU A 431 -6.324 7.957 21.163 1.00 21.55 N ATOM 1974 CA LEU A 431 -5.988 6.841 22.025 1.00 21.54 C ATOM 1975 C LEU A 431 -7.262 6.423 22.756 1.00 25.09 C ATOM 1976 O LEU A 431 -7.992 7.292 23.238 1.00 24.71 O ATOM 1977 CB LEU A 431 -4.896 7.232 23.027 1.00 21.45 C ATOM 1978 CG LEU A 431 -3.483 7.187 22.464 1.00 27.11 C ATOM 1979 CD1 LEU A 431 -2.502 7.928 23.400 1.00 27.94 C ATOM 1980 CD2 LEU A 431 -3.029 5.703 22.223 1.00 26.89 C ATOM 1981 H LEU A 431 -6.255 8.929 21.528 1.00 0.00 H ATOM 1982 N VAL A 432 -7.543 5.130 22.794 1.00 24.48 N ATOM 1983 CA VAL A 432 -8.739 4.572 23.458 1.00 26.21 C ATOM 1984 C VAL A 432 -8.368 3.417 24.397 1.00 31.67 C ATOM 1985 O VAL A 432 -7.320 2.806 24.209 1.00 31.22 O ATOM 1986 CB VAL A 432 -9.820 4.150 22.407 1.00 30.62 C ATOM 1987 CG1 VAL A 432 -10.246 5.349 21.546 1.00 30.36 C ATOM 1988 CG2 VAL A 432 -9.324 2.996 21.532 1.00 29.69 C ATOM 1989 H VAL A 432 -6.886 4.471 22.331 1.00 0.00 H ATOM 1990 N LYS A 433 -9.222 3.107 25.392 1.00 31.23 N ATOM 1991 CA LYS A 433 -8.903 2.002 26.314 1.00 46.39 C ATOM 1992 C LYS A 433 -9.431 0.672 25.819 1.00 74.47 C ATOM 1993 O LYS A 433 -10.616 0.570 25.551 1.00 41.78 O ATOM 1994 CB LYS A 433 -9.331 2.279 27.768 1.00 49.08 C ATOM 1995 CG LYS A 433 -10.817 2.574 28.006 1.00 62.45 C ATOM 1996 CD LYS A 433 -11.202 2.301 29.463 1.00 71.55 C ATOM 1997 CE LYS A 433 -12.665 2.572 29.720 1.00 83.80 C ATOM 1998 NZ LYS A 433 -13.012 2.452 31.161 1.00 90.56 N ATOM 1999 HZ1 LYS A 433 -12.798 1.488 31.489 1.00 0.00 H ATOM 2000 HZ2 LYS A 433 -12.454 3.138 31.709 1.00 0.00 H ATOM 2001 HZ3 LYS A 433 -14.026 2.646 31.290 1.00 0.00 H ATOM 2002 H LYS A 433 -10.104 3.646 25.509 1.00 0.00 H TER 2003 LYS A 433 HETATM 2004 O HOH 1 -6.146 1.395 9.023 1.00 27.72 O HETATM 2005 O HOH 2 -6.461 1.236 33.113 1.00 39.90 O HETATM 2006 O HOH 3 -13.874 31.464 26.626 1.00 59.15 O HETATM 2007 O HOH 4 -13.947 10.872 25.536 1.00 42.12 O HETATM 2008 O HOH 5 -2.101 35.444 18.262 1.00 38.28 O HETATM 2009 O HOH 6 -2.557 3.486 36.888 1.00 41.76 O HETATM 2010 O HOH 7 21.322 34.871 1.326 1.00 38.11 O HETATM 2011 O HOH 8 -5.103 13.101 32.888 1.00 33.22 O HETATM 2012 O HOH 9 7.275 1.471 29.876 1.00 47.66 O HETATM 2013 O HOH 10 4.066 10.643 0.537 1.00 38.47 O HETATM 2014 O HOH 11 15.294 29.885 9.351 1.00 49.41 O HETATM 2015 O HOH 12 0.701 15.805 6.041 1.00 35.95 O HETATM 2016 O HOH 13 -9.771 9.279 23.052 1.00 50.48 O HETATM 2017 O HOH 14 25.293 5.156 15.523 1.00 43.85 O HETATM 2018 O HOH 15 -9.214 18.690 28.822 1.00 35.46 O HETATM 2019 O HOH 16 4.406 32.013 27.235 1.00 34.49 O HETATM 2020 O HOH 17 1.153 4.365 34.228 1.00 36.58 O HETATM 2021 O HOH 18 -5.001 7.050 37.101 1.00 56.24 O HETATM 2022 O HOH 19 5.417 1.661 7.497 1.00 44.37 O HETATM 2023 O HOH 20 6.042 32.078 23.802 1.00 47.95 O HETATM 2024 O HOH 21 -7.101 0.403 16.609 1.00 36.17 O HETATM 2025 O HOH 22 15.911 2.841 28.983 1.00 40.41 O HETATM 2026 O HOH 23 16.443 4.811 22.686 1.00 40.59 O HETATM 2027 O HOH 24 -8.617 11.431 21.851 1.00 31.55 O HETATM 2028 O HOH 25 -8.822 1.218 12.424 1.00 53.78 O HETATM 2029 O HOH 26 16.550 3.124 20.584 1.00 44.85 O HETATM 2030 O HOH 27 -1.866 16.542 33.489 1.00 42.26 O HETATM 2031 O HOH 28 6.293 16.682 4.144 1.00 31.70 O HETATM 2032 O HOH 29 -3.381 37.955 18.358 1.00 41.56 O HETATM 2033 O HOH 30 -0.777 36.674 28.772 1.00 30.06 O HETATM 2034 O HOH 31 -11.911 3.503 12.194 1.00 40.07 O HETATM 2035 O HOH 32 8.942 -2.874 19.724 1.00 57.90 O HETATM 2036 O HOH 33 8.860 5.218 18.163 1.00 22.45 O HETATM 2037 O HOH 34 -3.222 22.123 11.874 1.00 45.51 O HETATM 2038 O HOH 35 -3.969 19.137 15.065 1.00 33.26 O HETATM 2039 O HOH 36 -11.587 12.870 33.284 1.00 39.84 O HETATM 2040 O HOH 37 1.279 22.009 35.960 1.00 50.15 O HETATM 2041 O HOH 38 15.410 30.022 21.234 1.00 47.79 O HETATM 2042 O HOH 39 10.505 2.612 13.796 1.00 33.22 O HETATM 2043 O HOH 40 10.896 12.006 3.473 1.00 43.91 O HETATM 2044 O HOH 41 7.990 20.993 27.101 1.00 32.22 O HETATM 2045 O HOH 42 -9.959 15.137 17.055 1.00 46.97 O HETATM 2046 O HOH 43 -7.482 15.937 33.705 1.00 36.36 O HETATM 2047 O HOH 44 6.533 21.402 22.141 1.00 51.56 O HETATM 2048 O HOH 45 1.286 13.154 6.352 1.00 22.12 O HETATM 2049 O HOH 46 19.270 23.043 20.626 1.00 36.11 O HETATM 2050 O HOH 47 15.756 7.295 23.235 1.00 35.40 O HETATM 2051 O HOH 48 21.221 10.561 23.061 1.00 32.66 O HETATM 2052 O HOH 49 -5.080 28.664 34.181 1.00 31.94 O HETATM 2053 O HOH 50 6.177 1.923 14.131 1.00 45.05 O HETATM 2054 O HOH 51 5.295 14.720 29.442 1.00 35.99 O HETATM 2055 O HOH 52 -10.384 29.658 31.902 1.00 59.90 O HETATM 2056 O HOH 53 11.373 3.593 6.308 1.00 41.38 O HETATM 2057 O HOH 54 2.449 30.955 24.820 1.00 24.10 O HETATM 2058 O HOH 55 -10.899 32.559 29.554 1.00 39.13 O HETATM 2059 O HOH 56 24.539 16.114 22.721 1.00 31.79 O HETATM 2060 O HOH 57 -2.502 33.070 30.020 1.00 33.74 O HETATM 2061 O HOH 58 -10.694 3.512 14.544 1.00 40.53 O HETATM 2062 O HOH 59 -6.545 8.774 11.730 1.00 26.58 O HETATM 2063 O HOH 60 9.324 25.747 12.035 1.00 43.37 O HETATM 2064 O HOH 61 1.977 19.174 32.032 1.00 30.54 O HETATM 2065 O HOH 62 -4.842 14.588 10.529 1.00 52.15 O HETATM 2066 O HOH 63 7.651 2.826 18.682 1.00 32.92 O HETATM 2067 O HOH 64 21.002 28.353 13.104 1.00 46.52 O HETATM 2068 O HOH 65 19.391 22.750 7.791 1.00 31.80 O HETATM 2069 O HOH 66 7.658 3.256 15.984 1.00 36.53 O HETATM 2070 O HOH 67 10.628 4.583 24.344 1.00 30.83 O HETATM 2071 O HOH 68 21.221 23.239 18.767 1.00 40.55 O HETATM 2072 O HOH 69 -4.675 7.547 9.965 1.00 51.53 O HETATM 2073 O HOH 70 12.495 21.688 32.381 1.00 42.27 O HETATM 2074 O HOH 71 5.902 28.723 16.952 1.00 38.74 O HETATM 2075 O HOH 72 4.260 23.222 11.127 1.00 41.60 O HETATM 2076 O HOH 73 -11.051 17.673 26.840 1.00 32.76 O HETATM 2077 O HOH 74 -14.441 15.367 22.095 1.00 50.70 O HETATM 2078 O HOH 75 9.881 27.742 13.892 1.00 38.44 O HETATM 2079 O HOH 76 3.940 15.674 7.868 1.00 25.75 O HETATM 2080 O HOH 77 26.757 13.409 18.752 1.00 50.48 O HETATM 2081 O HOH 78 8.938 30.302 23.108 1.00 48.56 O HETATM 2082 O HOH 79 5.764 14.951 9.753 1.00 22.55 O HETATM 2083 O HOH 80 14.283 10.221 5.762 1.00 30.65 O HETATM 2084 O HOH 81 8.284 4.044 33.685 1.00 50.94 O HETATM 2085 O HOH 82 -12.149 10.237 21.136 1.00 49.54 O HETATM 2086 O HOH 83 10.090 6.306 33.458 1.00 35.85 O HETATM 2087 O HOH 84 -8.540 20.455 12.303 1.00 63.88 O HETATM 2088 O HOH 85 -8.599 7.688 37.445 1.00 56.52 O HETATM 2089 O HOH 86 13.526 11.657 3.579 1.00 39.65 O HETATM 2090 O HOH 87 13.369 -0.867 29.301 1.00 61.74 O HETATM 2091 O HOH 88 12.662 29.915 10.045 1.00 47.45 O HETATM 2092 O HOH 89 8.749 0.774 12.594 1.00 37.02 O HETATM 2093 O HOH 90 11.648 3.029 36.608 1.00 49.94 O HETATM 2094 O HOH 91 -8.287 28.317 34.287 1.00 47.07 O HETATM 2095 O HOH 92 21.175 16.165 11.635 1.00 42.15 O HETATM 2096 O HOH 93 -9.554 24.855 20.768 1.00 49.01 O HETATM 2097 O HOH 94 -11.575 5.447 25.505 1.00 41.93 O HETATM 2098 O HOH 95 29.121 33.200 3.664 1.00 69.21 O HETATM 2099 O HOH 96 11.979 29.343 12.931 1.00 46.47 O HETATM 2100 O HOH 97 -3.008 12.555 9.959 1.00 38.38 O HETATM 2101 O HOH 98 -1.460 12.519 6.249 1.00 36.74 O HETATM 2102 O HOH 99 15.859 5.505 31.815 1.00 51.67 O HETATM 2103 O HOH 100 -5.826 20.321 12.341 1.00 52.33 O HETATM 2104 O HOH 101 20.819 7.860 22.871 1.00 42.60 O HETATM 2105 O HOH 102 25.937 15.357 20.485 1.00 50.10 O HETATM 2106 O HOH 103 3.146 15.295 32.965 1.00 52.08 O HETATM 2107 O HOH 104 0.429 15.768 34.761 1.00 46.92 O HETATM 2108 O HOH 105 -9.660 -5.774 31.034 1.00 42.23 O HETATM 2109 O HOH 106 16.653 21.040 27.456 1.00 50.95 O HETATM 2110 O HOH 107 -3.444 19.001 12.232 1.00 34.19 O HETATM 2111 O HOH 108 16.582 8.610 5.483 1.00 46.46 O HETATM 2112 O HOH 109 6.506 9.338 -2.190 1.00 45.78 O HETATM 2113 O HOH 110 -4.981 -0.398 18.064 1.00 33.43 O HETATM 2114 O HOH 111 -0.625 -2.144 6.743 1.00 39.31 O HETATM 2115 O HOH 112 -4.842 -1.395 3.923 1.00 57.10 O HETATM 2116 O HOH 113 -6.863 -3.941 20.506 1.00 37.16 O HETATM 2117 O HOH 114 3.462 10.693 -5.132 1.00 52.00 O HETATM 2118 O HOH 115 -0.832 -8.917 19.180 1.00 61.75 O HETATM 2119 O HOH 116 0.453 -4.290 13.559 1.00 50.57 O HETATM 2120 O HOH 117 2.355 -5.292 9.421 1.00 68.65 O HETATM 2121 O HOH 118 4.954 2.854 5.073 1.00 42.47 O HETATM 2122 O HOH 119 7.288 4.198 4.497 1.00 35.72 O HETATM 2123 O HOH 120 -1.808 6.069 4.629 1.00 42.24 O HETATM 2124 O HOH 121 -2.053 -7.366 14.168 1.00 41.17 O HETATM 2125 O HOH 122 1.470 -1.799 4.839 1.00 56.15 O HETATM 2126 O HOH 123 6.153 6.578 1.360 1.00 44.96 O HETATM 2127 O HOH 124 -7.453 -0.891 14.170 1.00 38.18 O HETATM 2128 O HOH 125 -1.785 -4.047 5.167 1.00 46.16 O HETATM 2129 C ACE A 126 8.733 -6.541 22.942 1.00 0.18 C HETATM 2130 O ACE A 126 9.607 -6.652 22.068 1.00 -0.40 O HETATM 2131 CH3 ACE A 126 9.090 -6.032 24.339 1.00 0.03 C HETATM 2132 H1 ACE A 126 8.184 -6.006 24.962 1.00 0.05 H HETATM 2133 H2 ACE A 126 9.512 -5.019 24.263 1.00 0.05 H HETATM 2134 H3 ACE A 126 9.831 -6.705 24.796 1.00 0.05 H HETATM 2135 N ACE A 126 7.447 -6.842 22.754 1.00 -0.27 N HETATM 2136 CA ACE A 126 6.884 -7.348 21.488 1.00 0.13 C HETATM 2137 C ACE A 126 7.158 -6.380 20.309 1.00 0.21 C HETATM 2138 O ACE A 126 6.913 -5.177 20.462 1.00 -0.39 O HETATM 2139 N ACE A 126 7.690 -6.864 19.149 1.00 -0.25 N HETATM 2140 CA ACE A 126 7.908 -5.947 18.012 1.00 0.13 C HETATM 2141 C ACE A 126 6.576 -5.336 17.574 1.00 0.20 C HETATM 2142 O ACE A 126 5.553 -6.027 17.592 1.00 -0.39 O HETATM 2143 N ACE A 126 6.586 -4.037 17.235 1.00 -0.26 N HETATM 2144 CA ACE A 126 5.396 -3.277 16.840 1.00 0.13 C HETATM 2145 C ACE A 126 4.557 -3.973 15.752 1.00 0.20 C HETATM 2146 O ACE A 126 3.334 -3.976 15.849 1.00 -0.39 O HETATM 2147 N ACE A 126 5.230 -4.622 14.767 1.00 -0.26 N HETATM 2148 CA ACE A 126 4.615 -5.339 13.643 1.00 0.13 C HETATM 2149 C ACE A 126 3.582 -6.407 14.043 1.00 0.20 C HETATM 2150 O ACE A 126 2.633 -6.637 13.290 1.00 -0.39 O HETATM 2151 N ACE A 126 3.748 -7.036 15.221 1.00 -0.26 N HETATM 2152 CA ACE A 126 2.828 -8.076 15.694 1.00 0.13 C HETATM 2153 C ACE A 126 1.773 -7.548 16.689 1.00 0.20 C HETATM 2154 O ACE A 126 1.029 -8.336 17.276 1.00 -0.39 O HETATM 2155 N ACE A 126 1.675 -6.228 16.848 1.00 -0.26 N HETATM 2156 CA ACE A 126 0.708 -5.644 17.782 1.00 0.13 C HETATM 2157 C ACE A 126 -0.633 -5.376 17.101 1.00 0.20 C HETATM 2158 O ACE A 126 -0.703 -5.348 15.867 1.00 -0.39 O HETATM 2159 N ACE A 126 -1.699 -5.230 17.907 1.00 -0.26 N HETATM 2160 CA ACE A 126 -3.068 -4.999 17.427 1.00 0.13 C HETATM 2161 C ACE A 126 -3.195 -3.549 16.996 1.00 0.20 C HETATM 2162 O ACE A 126 -3.710 -2.732 17.750 1.00 -0.39 O HETATM 2163 N ACE A 126 -2.663 -3.211 15.816 1.00 -0.26 N HETATM 2164 CA ACE A 126 -2.643 -1.805 15.379 1.00 0.13 C HETATM 2165 C ACE A 126 -3.366 -1.605 14.052 1.00 0.21 C HETATM 2166 O ACE A 126 -3.535 -2.574 13.327 1.00 -0.39 O HETATM 2167 N ACE A 126 -3.862 -0.388 13.741 1.00 -0.25 N HETATM 2168 CA ACE A 126 -4.505 -0.178 12.430 1.00 0.13 C HETATM 2169 C ACE A 126 -3.532 -0.496 11.284 1.00 0.20 C HETATM 2170 O ACE A 126 -2.314 -0.292 11.429 1.00 -0.39 O HETATM 2171 N ACE A 126 -4.085 -0.886 10.121 1.00 -0.26 N HETATM 2172 CA ACE A 126 -3.351 -1.156 8.878 1.00 0.13 C HETATM 2173 C ACE A 126 -2.581 0.124 8.486 1.00 0.20 C HETATM 2174 O ACE A 126 -1.423 0.042 8.085 1.00 -0.39 O HETATM 2175 N ACE A 126 -3.203 1.306 8.692 1.00 -0.26 N HETATM 2176 CA ACE A 126 -2.614 2.627 8.365 1.00 0.15 C HETATM 2177 C ACE A 126 -1.314 2.908 9.102 1.00 0.21 C HETATM 2178 O ACE A 126 -0.497 3.711 8.613 1.00 -0.39 O HETATM 2179 N ACE A 126 -1.105 2.246 10.271 1.00 -0.26 N HETATM 2180 CA ACE A 126 0.115 2.415 11.073 1.00 0.14 C HETATM 2181 C ACE A 126 1.391 2.048 10.282 1.00 0.21 C HETATM 2182 O ACE A 126 2.463 2.585 10.561 1.00 -0.39 O HETATM 2183 N ACE A 126 1.243 1.189 9.263 1.00 -0.26 N HETATM 2184 CA ACE A 126 2.343 0.699 8.428 1.00 0.14 C HETATM 2185 C ACE A 126 2.284 1.237 6.994 1.00 0.21 C HETATM 2186 O ACE A 126 2.991 0.732 6.108 1.00 -0.39 O HETATM 2187 N ACE A 126 1.436 2.256 6.771 1.00 -0.26 N HETATM 2188 CA ACE A 126 1.202 2.854 5.454 1.00 0.13 C HETATM 2189 C ACE A 126 1.533 4.335 5.515 1.00 0.20 C HETATM 2190 O ACE A 126 0.656 5.181 5.756 1.00 -0.39 O HETATM 2191 N ACE A 126 2.795 4.654 5.255 1.00 -0.26 N HETATM 2192 CA ACE A 126 3.183 6.072 5.278 1.00 0.13 C HETATM 2193 C ACE A 126 2.301 6.833 4.261 1.00 0.21 C HETATM 2194 O ACE A 126 2.182 6.370 3.112 1.00 -0.39 O HETATM 2195 N ACE A 126 1.675 7.968 4.660 1.00 -0.25 N HETATM 2196 CA ACE A 126 0.905 8.770 3.695 1.00 0.13 C HETATM 2197 C ACE A 126 1.769 9.207 2.507 1.00 0.20 C HETATM 2198 O ACE A 126 2.988 9.361 2.644 1.00 -0.39 O HETATM 2199 N ACE A 126 1.164 9.274 1.311 1.00 -0.30 N HETATM 2200 H134 ACE A 126 1.683 9.554 0.503 1.00 0.18 H HETATM 2201 H135 ACE A 126 0.194 9.044 1.228 1.00 0.18 H HETATM 2202 CB ACE A 126 0.503 10.006 4.522 1.00 -0.01 C HETATM 2203 CG ACE A 126 0.488 9.524 5.934 1.00 -0.03 C HETATM 2204 CD ACE A 126 1.691 8.621 5.985 1.00 0.04 C HETATM 2205 H132 ACE A 126 2.615 9.201 6.128 1.00 0.05 H HETATM 2206 H133 ACE A 126 1.595 7.880 6.792 1.00 0.05 H HETATM 2207 H130 ACE A 126 -0.435 8.968 6.154 1.00 0.03 H HETATM 2208 H131 ACE A 126 0.590 10.361 6.641 1.00 0.03 H HETATM 2209 H128 ACE A 126 -0.493 10.366 4.224 1.00 0.03 H HETATM 2210 H129 ACE A 126 1.238 10.814 4.395 1.00 0.03 H HETATM 2211 H127 ACE A 126 0.024 8.220 3.334 1.00 0.08 H HETATM 2212 CB ACE A 126 4.649 6.230 4.882 1.00 -0.00 C HETATM 2213 CG ACE A 126 5.087 7.686 4.911 1.00 0.00 C HETATM 2214 CD ACE A 126 6.562 7.980 4.702 1.00 0.04 C HETATM 2215 OE1 ACE A 126 6.939 9.167 4.839 1.00 -0.57 O HETATM 2216 OE2 ACE A 126 7.339 7.044 4.402 1.00 -0.57 O HETATM 2217 H125 ACE A 126 4.806 8.095 5.893 1.00 0.04 H HETATM 2218 H126 ACE A 126 4.531 8.213 4.121 1.00 0.04 H HETATM 2219 H123 ACE A 126 4.787 5.837 3.864 1.00 0.03 H HETATM 2220 H124 ACE A 126 5.272 5.657 5.585 1.00 0.03 H HETATM 2221 H122 ACE A 126 3.029 6.481 6.287 1.00 0.08 H HETATM 2222 H121 ACE A 126 3.468 3.944 5.048 1.00 0.19 H HETATM 2223 CB ACE A 126 -0.268 2.649 5.020 1.00 -0.00 C HETATM 2224 CG ACE A 126 -0.727 1.193 5.082 1.00 0.00 C HETATM 2225 CD ACE A 126 -2.184 0.893 4.768 1.00 0.04 C HETATM 2226 OE1 ACE A 126 -3.068 1.730 5.071 1.00 -0.57 O HETATM 2227 OE2 ACE A 126 -2.444 -0.216 4.250 1.00 -0.57 O HETATM 2228 H119 ACE A 126 -0.530 0.831 6.102 1.00 0.04 H HETATM 2229 H120 ACE A 126 -0.114 0.625 4.366 1.00 0.04 H HETATM 2230 H117 ACE A 126 -0.378 3.004 3.985 1.00 0.03 H HETATM 2231 H118 ACE A 126 -0.913 3.245 5.683 1.00 0.03 H HETATM 2232 H116 ACE A 126 1.860 2.369 4.718 1.00 0.08 H HETATM 2233 H115 ACE A 126 0.934 2.629 7.552 1.00 0.19 H HETATM 2234 CB ACE A 126 2.367 -0.849 8.451 1.00 0.00 C HETATM 2235 CG ACE A 126 2.391 -1.406 9.846 1.00 -0.04 C HETATM 2236 CD1 ACE A 126 1.360 -2.018 10.504 1.00 0.02 C HETATM 2237 NE1 ACE A 126 1.719 -2.277 11.808 1.00 -0.29 N HETATM 2238 CE2 ACE A 126 2.978 -1.777 12.027 1.00 0.06 C HETATM 2239 CD2 ACE A 126 3.424 -1.211 10.812 1.00 -0.02 C HETATM 2240 CE3 ACE A 126 4.694 -0.603 10.770 1.00 -0.07 C HETATM 2241 CZ3 ACE A 126 5.492 -0.641 11.901 1.00 -0.08 C HETATM 2242 CH2 ACE A 126 5.048 -1.268 13.074 1.00 -0.08 C HETATM 2243 CZ2 ACE A 126 3.781 -1.814 13.168 1.00 -0.04 C HETATM 2244 H112 ACE A 126 3.425 -2.254 14.093 1.00 0.05 H HETATM 2245 H114 ACE A 126 5.714 -1.326 13.928 1.00 0.05 H HETATM 2246 H113 ACE A 126 6.473 -0.180 11.879 1.00 0.05 H HETATM 2247 H111 ACE A 126 5.041 -0.114 9.867 1.00 0.05 H HETATM 2248 H110 ACE A 126 1.138 -2.766 12.504 1.00 0.22 H HETATM 2249 H109 ACE A 126 0.396 -2.264 10.061 1.00 0.08 H HETATM 2250 H107 ACE A 126 3.265 -1.195 7.918 1.00 0.04 H HETATM 2251 H108 ACE A 126 1.469 -1.223 7.938 1.00 0.04 H HETATM 2252 H106 ACE A 126 3.283 1.058 8.873 1.00 0.08 H HETATM 2253 H105 ACE A 126 0.321 0.861 9.059 1.00 0.19 H HETATM 2254 CB ACE A 126 -0.010 1.623 12.373 1.00 0.02 C HETATM 2255 CG ACE A 126 0.919 2.022 13.498 1.00 -0.04 C HETATM 2256 CD1 ACE A 126 0.546 2.999 14.414 1.00 -0.06 C HETATM 2257 CE1 ACE A 126 1.372 3.316 15.495 1.00 -0.07 C HETATM 2258 CZ ACE A 126 2.582 2.671 15.654 1.00 -0.07 C HETATM 2259 CE2 ACE A 126 2.983 1.721 14.736 1.00 -0.07 C HETATM 2260 CD2 ACE A 126 2.147 1.391 13.666 1.00 -0.06 C HETATM 2261 H101 ACE A 126 2.460 0.633 12.957 1.00 0.06 H HETATM 2262 H103 ACE A 126 3.944 1.232 14.845 1.00 0.06 H HETATM 2263 H104 ACE A 126 3.217 2.910 16.499 1.00 0.06 H HETATM 2264 H102 ACE A 126 1.062 4.070 16.210 1.00 0.06 H HETATM 2265 H100 ACE A 126 -0.396 3.520 14.288 1.00 0.06 H HETATM 2266 H98 ACE A 126 0.182 0.565 12.140 1.00 0.05 H HETATM 2267 H99 ACE A 126 -1.042 1.737 12.736 1.00 0.05 H HETATM 2268 H97 ACE A 126 0.194 3.479 11.338 1.00 0.08 H HETATM 2269 H96 ACE A 126 -1.811 1.618 10.599 1.00 0.19 H HETATM 2270 CB ACE A 126 -3.618 3.733 8.657 1.00 0.08 C HETATM 2271 OG ACE A 126 -3.860 3.803 10.049 1.00 -0.39 O HETATM 2272 H95 ACE A 126 -3.046 3.989 10.502 1.00 0.21 H HETATM 2273 H93 ACE A 126 -4.561 3.519 8.133 1.00 0.06 H HETATM 2274 H94 ACE A 126 -3.214 4.695 8.307 1.00 0.06 H HETATM 2275 H92 ACE A 126 -2.395 2.635 7.287 1.00 0.08 H HETATM 2276 H91 ACE A 126 -4.120 1.289 9.091 1.00 0.19 H HETATM 2277 CB ACE A 126 -4.325 -1.511 7.768 1.00 -0.02 C HETATM 2278 H88 ACE A 126 -3.767 -1.712 6.841 1.00 0.03 H HETATM 2279 H89 ACE A 126 -5.017 -0.672 7.605 1.00 0.03 H HETATM 2280 H90 ACE A 126 -4.896 -2.407 8.054 1.00 0.03 H HETATM 2281 H87 ACE A 126 -2.647 -1.987 9.033 1.00 0.08 H HETATM 2282 H86 ACE A 126 -5.078 -1.002 10.101 1.00 0.19 H HETATM 2283 CB ACE A 126 -4.807 1.333 12.411 1.00 -0.01 C HETATM 2284 CG ACE A 126 -4.649 1.808 13.794 1.00 -0.03 C HETATM 2285 CD ACE A 126 -3.705 0.885 14.480 1.00 0.04 C HETATM 2286 H84 ACE A 126 -2.672 1.256 14.408 1.00 0.05 H HETATM 2287 H85 ACE A 126 -3.977 0.761 15.539 1.00 0.05 H HETATM 2288 H82 ACE A 126 -5.622 1.800 14.307 1.00 0.03 H HETATM 2289 H83 ACE A 126 -4.242 2.830 13.796 1.00 0.03 H HETATM 2290 H80 ACE A 126 -5.835 1.511 12.063 1.00 0.03 H HETATM 2291 H81 ACE A 126 -4.101 1.853 11.748 1.00 0.03 H HETATM 2292 H79 ACE A 126 -5.421 -0.779 12.333 1.00 0.08 H HETATM 2293 CB ACE A 126 -1.187 -1.278 15.293 1.00 -0.01 C HETATM 2294 CG ACE A 126 -0.389 -1.262 16.618 1.00 -0.04 C HETATM 2295 CD1 ACE A 126 1.117 -1.159 16.350 1.00 -0.06 C HETATM 2296 H73 ACE A 126 1.660 -1.150 17.307 1.00 0.02 H HETATM 2297 H74 ACE A 126 1.329 -0.231 15.799 1.00 0.02 H HETATM 2298 H75 ACE A 126 1.443 -2.023 15.752 1.00 0.02 H HETATM 2299 CD2 ACE A 126 -0.883 -0.183 17.555 1.00 -0.06 C HETATM 2300 H76 ACE A 126 -1.965 -0.302 17.713 1.00 0.02 H HETATM 2301 H77 ACE A 126 -0.683 0.805 17.114 1.00 0.02 H HETATM 2302 H78 ACE A 126 -0.360 -0.267 18.519 1.00 0.02 H HETATM 2303 H72 ACE A 126 -0.564 -2.226 17.117 1.00 0.03 H HETATM 2304 H70 ACE A 126 -1.225 -0.247 14.911 1.00 0.03 H HETATM 2305 H71 ACE A 126 -0.641 -1.913 14.580 1.00 0.03 H HETATM 2306 H69 ACE A 126 -3.173 -1.213 16.140 1.00 0.08 H HETATM 2307 H68 ACE A 126 -2.276 -3.919 15.226 1.00 0.19 H HETATM 2308 CB ACE A 126 -4.107 -5.371 18.512 1.00 0.00 C HETATM 2309 CG ACE A 126 -4.206 -6.882 18.788 1.00 0.04 C HETATM 2310 CD ACE A 126 -5.342 -7.294 19.703 1.00 0.17 C HETATM 2311 OE1 ACE A 126 -6.011 -6.492 20.360 1.00 -0.40 O HETATM 2312 NE2 ACE A 126 -5.607 -8.577 19.751 1.00 -0.30 N HETATM 2313 H66 ACE A 126 -6.345 -8.914 20.336 1.00 0.18 H HETATM 2314 H67 ACE A 126 -5.071 -9.219 19.203 1.00 0.18 H HETATM 2315 H64 ACE A 126 -3.262 -7.207 19.249 1.00 0.05 H HETATM 2316 H65 ACE A 126 -4.340 -7.396 17.825 1.00 0.05 H HETATM 2317 H62 ACE A 126 -5.094 -5.013 18.184 1.00 0.03 H HETATM 2318 H63 ACE A 126 -3.827 -4.866 19.448 1.00 0.03 H HETATM 2319 H61 ACE A 126 -3.246 -5.640 16.551 1.00 0.08 H HETATM 2320 H60 ACE A 126 -1.551 -5.282 18.895 1.00 0.19 H HETATM 2321 CB ACE A 126 1.284 -4.407 18.505 1.00 -0.01 C HETATM 2322 CG ACE A 126 2.518 -4.761 19.346 1.00 -0.02 C HETATM 2323 CD ACE A 126 3.079 -3.575 20.109 1.00 0.06 C HETATM 2324 NE ACE A 126 4.271 -3.949 20.878 1.00 -0.27 N HETATM 2325 CZ ACE A 126 4.722 -3.289 21.939 1.00 0.29 C HETATM 2326 NH1 ACE A 126 4.088 -2.213 22.377 1.00 -0.28 N HETATM 2327 H56 ACE A 126 4.443 -1.706 23.200 1.00 0.26 H HETATM 2328 H57 ACE A 126 3.240 -1.883 21.895 1.00 0.26 H HETATM 2329 NH2 ACE A 126 5.800 -3.716 22.585 1.00 -0.28 N HETATM 2330 H58 ACE A 126 6.302 -4.552 22.253 1.00 0.26 H HETATM 2331 H59 ACE A 126 6.135 -3.211 23.418 1.00 0.26 H HETATM 2332 H55 ACE A 126 4.795 -4.782 20.574 1.00 0.26 H HETATM 2333 H53 ACE A 126 2.311 -3.198 20.800 1.00 0.07 H HETATM 2334 H54 ACE A 126 3.348 -2.784 19.394 1.00 0.07 H HETATM 2335 H51 ACE A 126 3.300 -5.147 18.675 1.00 0.03 H HETATM 2336 H52 ACE A 126 2.237 -5.541 20.069 1.00 0.03 H HETATM 2337 H49 ACE A 126 0.511 -3.989 19.166 1.00 0.03 H HETATM 2338 H50 ACE A 126 1.569 -3.656 17.753 1.00 0.03 H HETATM 2339 H48 ACE A 126 0.519 -6.399 18.559 1.00 0.08 H HETATM 2340 H47 ACE A 126 2.273 -5.625 16.320 1.00 0.19 H HETATM 2341 CB ACE A 126 3.614 -9.266 16.273 1.00 -0.02 C HETATM 2342 H44 ACE A 126 2.910 -10.035 16.622 1.00 0.03 H HETATM 2343 H45 ACE A 126 4.230 -8.923 17.117 1.00 0.03 H HETATM 2344 H46 ACE A 126 4.264 -9.691 15.493 1.00 0.03 H HETATM 2345 H43 ACE A 126 2.279 -8.444 14.815 1.00 0.08 H HETATM 2346 H42 ACE A 126 4.527 -6.785 15.795 1.00 0.19 H HETATM 2347 CB ACE A 126 5.694 -5.948 12.739 1.00 -0.01 C HETATM 2348 CG ACE A 126 6.320 -4.939 11.778 1.00 -0.02 C HETATM 2349 CD ACE A 126 5.545 -4.832 10.477 1.00 0.06 C HETATM 2350 NE ACE A 126 6.095 -3.800 9.598 1.00 -0.27 N HETATM 2351 CZ ACE A 126 5.545 -3.423 8.448 1.00 0.29 C HETATM 2352 NH1 ACE A 126 6.113 -2.476 7.714 1.00 -0.28 N HETATM 2353 H38 ACE A 126 5.683 -2.187 6.824 1.00 0.26 H HETATM 2354 H39 ACE A 126 6.984 -2.029 8.034 1.00 0.26 H HETATM 2355 NH2 ACE A 126 4.416 -3.983 8.028 1.00 -0.28 N HETATM 2356 H40 ACE A 126 3.966 -4.720 8.590 1.00 0.26 H HETATM 2357 H41 ACE A 126 3.990 -3.681 7.140 1.00 0.26 H HETATM 2358 H37 ACE A 126 6.966 -3.335 9.890 1.00 0.26 H HETATM 2359 H35 ACE A 126 4.498 -4.583 10.706 1.00 0.07 H HETATM 2360 H36 ACE A 126 5.587 -5.801 9.957 1.00 0.07 H HETATM 2361 H33 ACE A 126 7.349 -5.255 11.553 1.00 0.03 H HETATM 2362 H34 ACE A 126 6.338 -3.952 12.262 1.00 0.03 H HETATM 2363 H31 ACE A 126 5.239 -6.756 12.148 1.00 0.03 H HETATM 2364 H32 ACE A 126 6.489 -6.363 13.376 1.00 0.03 H HETATM 2365 H30 ACE A 126 4.074 -4.587 13.050 1.00 0.08 H HETATM 2366 H29 ACE A 126 6.229 -4.611 14.811 1.00 0.19 H HETATM 2367 CB ACE A 126 5.761 -1.839 16.438 1.00 -0.00 C HETATM 2368 CG ACE A 126 6.351 -1.010 17.577 1.00 -0.00 C HETATM 2369 SD ACE A 126 5.267 -0.657 18.987 1.00 -0.16 S HETATM 2370 CE ACE A 126 4.144 0.537 18.265 1.00 -0.02 C HETATM 2371 H26 ACE A 126 3.409 0.853 19.020 1.00 0.03 H HETATM 2372 H27 ACE A 126 3.620 0.079 17.413 1.00 0.03 H HETATM 2373 H28 ACE A 126 4.713 1.413 17.919 1.00 0.03 H HETATM 2374 H24 ACE A 126 6.670 -0.046 17.155 1.00 0.04 H HETATM 2375 H25 ACE A 126 7.229 -1.551 17.961 1.00 0.04 H HETATM 2376 H22 ACE A 126 4.850 -1.337 16.080 1.00 0.03 H HETATM 2377 H23 ACE A 126 6.499 -1.884 15.623 1.00 0.03 H HETATM 2378 H21 ACE A 126 4.757 -3.208 17.732 1.00 0.08 H HETATM 2379 H20 ACE A 126 7.463 -3.556 17.253 1.00 0.19 H HETATM 2380 CB ACE A 126 8.507 -6.854 16.927 1.00 -0.01 C HETATM 2381 CG ACE A 126 8.046 -8.229 17.284 1.00 -0.03 C HETATM 2382 CD ACE A 126 8.032 -8.255 18.785 1.00 0.04 C HETATM 2383 H18 ACE A 126 7.273 -8.958 19.159 1.00 0.05 H HETATM 2384 H19 ACE A 126 9.019 -8.535 19.183 1.00 0.05 H HETATM 2385 H16 ACE A 126 8.742 -8.985 16.890 1.00 0.03 H HETATM 2386 H17 ACE A 126 7.038 -8.415 16.884 1.00 0.03 H HETATM 2387 H14 ACE A 126 9.605 -6.798 16.938 1.00 0.03 H HETATM 2388 H15 ACE A 126 8.135 -6.566 15.932 1.00 0.03 H HETATM 2389 H13 ACE A 126 8.610 -5.144 18.279 1.00 0.08 H HETATM 2390 CB ACE A 126 5.366 -7.671 21.657 1.00 -0.01 C HETATM 2391 CG1 ACE A 126 4.651 -7.846 20.316 1.00 -0.06 C HETATM 2392 H7 ACE A 126 3.589 -8.071 20.493 1.00 0.02 H HETATM 2393 H8 ACE A 126 5.113 -8.675 19.759 1.00 0.02 H HETATM 2394 H9 ACE A 126 4.737 -6.918 19.731 1.00 0.02 H HETATM 2395 CG2 ACE A 126 5.159 -8.898 22.540 1.00 -0.06 C HETATM 2396 H10 ACE A 126 5.680 -8.752 23.498 1.00 0.02 H HETATM 2397 H11 ACE A 126 5.564 -9.787 22.034 1.00 0.02 H HETATM 2398 H12 ACE A 126 4.084 -9.039 22.725 1.00 0.02 H HETATM 2399 H6 ACE A 126 4.904 -6.812 22.166 1.00 0.03 H HETATM 2400 H5 ACE A 126 7.395 -8.293 21.254 1.00 0.08 H HETATM 2401 H4 ACE A 126 6.822 -6.716 23.524 1.00 0.19 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 364 365 377 378 379 CONECT 377 364 CONECT 378 364 CONECT 379 364 CONECT 805 806 812 813 814 CONECT 812 805 CONECT 813 805 CONECT 814 805 CONECT 1115 1116 1122 1123 1124 CONECT 1122 1115 CONECT 1123 1115 CONECT 1124 1115 CONECT 2129 2130 2131 2135 CONECT 2130 2129 CONECT 2131 2129 2132 2133 2134 CONECT 2132 2131 CONECT 2133 2131 CONECT 2134 2131 CONECT 2135 2129 2136 2401 CONECT 2136 2135 2137 2390 2400 CONECT 2137 2136 2138 2139 CONECT 2138 2137 CONECT 2139 2137 2140 2382 CONECT 2140 2139 2141 2380 2389 CONECT 2141 2140 2142 2143 CONECT 2142 2141 CONECT 2143 2141 2144 2379 CONECT 2144 2143 2145 2367 2378 CONECT 2145 2144 2146 2147 CONECT 2146 2145 CONECT 2147 2145 2148 2366 CONECT 2148 2147 2149 2347 2365 CONECT 2149 2148 2150 2151 CONECT 2150 2149 CONECT 2151 2149 2152 2346 CONECT 2152 2151 2153 2341 2345 CONECT 2153 2152 2154 2155 CONECT 2154 2153 CONECT 2155 2153 2156 2340 CONECT 2156 2155 2157 2321 2339 CONECT 2157 2156 2158 2159 CONECT 2158 2157 CONECT 2159 2157 2160 2320 CONECT 2160 2159 2161 2308 2319 CONECT 2161 2160 2162 2163 CONECT 2162 2161 CONECT 2163 2161 2164 2307 CONECT 2164 2163 2165 2293 2306 CONECT 2165 2164 2166 2167 CONECT 2166 2165 CONECT 2167 2165 2168 2285 CONECT 2168 2167 2169 2283 2292 CONECT 2169 2168 2170 2171 CONECT 2170 2169 CONECT 2171 2169 2172 2282 CONECT 2172 2171 2173 2277 2281 CONECT 2173 2172 2174 2175 CONECT 2174 2173 CONECT 2175 2173 2176 2276 CONECT 2176 2175 2177 2270 2275 CONECT 2177 2176 2178 2179 CONECT 2178 2177 CONECT 2179 2177 2180 2269 CONECT 2180 2179 2181 2254 2268 CONECT 2181 2180 2182 2183 CONECT 2182 2181 CONECT 2183 2181 2184 2253 CONECT 2184 2183 2185 2234 2252 CONECT 2185 2184 2186 2187 CONECT 2186 2185 CONECT 2187 2185 2188 2233 CONECT 2188 2187 2189 2223 2232 CONECT 2189 2188 2190 2191 CONECT 2190 2189 CONECT 2191 2189 2192 2222 CONECT 2192 2191 2193 2212 2221 CONECT 2193 2192 2194 2195 CONECT 2194 2193 CONECT 2195 2193 2196 2204 CONECT 2196 2195 2197 2202 2211 CONECT 2197 2196 2198 2199 CONECT 2198 2197 CONECT 2199 2197 2200 2201 CONECT 2200 2199 CONECT 2201 2199 CONECT 2202 2196 2203 2209 2210 CONECT 2203 2202 2204 2207 2208 CONECT 2204 2195 2203 2205 2206 CONECT 2205 2204 CONECT 2206 2204 CONECT 2207 2203 CONECT 2208 2203 CONECT 2209 2202 CONECT 2210 2202 CONECT 2211 2196 CONECT 2212 2192 2213 2219 2220 CONECT 2213 2212 2214 2217 2218 CONECT 2214 2213 2215 2216 CONECT 2215 2214 CONECT 2216 2214 CONECT 2217 2213 CONECT 2218 2213 CONECT 2219 2212 CONECT 2220 2212 CONECT 2221 2192 CONECT 2222 2191 CONECT 2223 2188 2224 2230 2231 CONECT 2224 2223 2225 2228 2229 CONECT 2225 2224 2226 2227 CONECT 2226 2225 CONECT 2227 2225 CONECT 2228 2224 CONECT 2229 2224 CONECT 2230 2223 CONECT 2231 2223 CONECT 2232 2188 CONECT 2233 2187 CONECT 2234 2184 2235 2250 2251 CONECT 2235 2234 2236 2239 CONECT 2236 2235 2237 2249 CONECT 2237 2236 2238 2248 CONECT 2238 2237 2239 2243 CONECT 2239 2235 2238 2240 CONECT 2240 2239 2241 2247 CONECT 2241 2240 2242 2246 CONECT 2242 2241 2243 2245 CONECT 2243 2238 2242 2244 CONECT 2244 2243 CONECT 2245 2242 CONECT 2246 2241 CONECT 2247 2240 CONECT 2248 2237 CONECT 2249 2236 CONECT 2250 2234 CONECT 2251 2234 CONECT 2252 2184 CONECT 2253 2183 CONECT 2254 2180 2255 2266 2267 CONECT 2255 2254 2256 2260 CONECT 2256 2255 2257 2265 CONECT 2257 2256 2258 2264 CONECT 2258 2257 2259 2263 CONECT 2259 2258 2260 2262 CONECT 2260 2255 2259 2261 CONECT 2261 2260 CONECT 2262 2259 CONECT 2263 2258 CONECT 2264 2257 CONECT 2265 2256 CONECT 2266 2254 CONECT 2267 2254 CONECT 2268 2180 CONECT 2269 2179 CONECT 2270 2176 2271 2273 2274 CONECT 2271 2270 2272 CONECT 2272 2271 CONECT 2273 2270 CONECT 2274 2270 CONECT 2275 2176 CONECT 2276 2175 CONECT 2277 2172 2278 2279 2280 CONECT 2278 2277 CONECT 2279 2277 CONECT 2280 2277 CONECT 2281 2172 CONECT 2282 2171 CONECT 2283 2168 2284 2290 2291 CONECT 2284 2283 2285 2288 2289 CONECT 2285 2167 2284 2286 2287 CONECT 2286 2285 CONECT 2287 2285 CONECT 2288 2284 CONECT 2289 2284 CONECT 2290 2283 CONECT 2291 2283 CONECT 2292 2168 CONECT 2293 2164 2294 2304 2305 CONECT 2294 2293 2295 2299 2303 CONECT 2295 2294 2296 2297 2298 CONECT 2296 2295 CONECT 2297 2295 CONECT 2298 2295 CONECT 2299 2294 2300 2301 2302 CONECT 2300 2299 CONECT 2301 2299 CONECT 2302 2299 CONECT 2303 2294 CONECT 2304 2293 CONECT 2305 2293 CONECT 2306 2164 CONECT 2307 2163 CONECT 2308 2160 2309 2317 2318 CONECT 2309 2308 2310 2315 2316 CONECT 2310 2309 2311 2312 CONECT 2311 2310 CONECT 2312 2310 2313 2314 CONECT 2313 2312 CONECT 2314 2312 CONECT 2315 2309 CONECT 2316 2309 CONECT 2317 2308 CONECT 2318 2308 CONECT 2319 2160 CONECT 2320 2159 CONECT 2321 2156 2322 2337 2338 CONECT 2322 2321 2323 2335 2336 CONECT 2323 2322 2324 2333 2334 CONECT 2324 2323 2325 2332 CONECT 2325 2324 2326 2329 CONECT 2326 2325 2327 2328 CONECT 2327 2326 CONECT 2328 2326 CONECT 2329 2325 2330 2331 CONECT 2330 2329 CONECT 2331 2329 CONECT 2332 2324 CONECT 2333 2323 CONECT 2334 2323 CONECT 2335 2322 CONECT 2336 2322 CONECT 2337 2321 CONECT 2338 2321 CONECT 2339 2156 CONECT 2340 2155 CONECT 2341 2152 2342 2343 2344 CONECT 2342 2341 CONECT 2343 2341 CONECT 2344 2341 CONECT 2345 2152 CONECT 2346 2151 CONECT 2347 2148 2348 2363 2364 CONECT 2348 2347 2349 2361 2362 CONECT 2349 2348 2350 2359 2360 CONECT 2350 2349 2351 2358 CONECT 2351 2350 2352 2355 CONECT 2352 2351 2353 2354 CONECT 2353 2352 CONECT 2354 2352 CONECT 2355 2351 2356 2357 CONECT 2356 2355 CONECT 2357 2355 CONECT 2358 2350 CONECT 2359 2349 CONECT 2360 2349 CONECT 2361 2348 CONECT 2362 2348 CONECT 2363 2347 CONECT 2364 2347 CONECT 2365 2148 CONECT 2366 2147 CONECT 2367 2144 2368 2376 2377 CONECT 2368 2367 2369 2374 2375 CONECT 2369 2368 2370 CONECT 2370 2369 2371 2372 2373 CONECT 2371 2370 CONECT 2372 2370 CONECT 2373 2370 CONECT 2374 2368 CONECT 2375 2368 CONECT 2376 2367 CONECT 2377 2367 CONECT 2378 2144 CONECT 2379 2143 CONECT 2380 2140 2381 2387 2388 CONECT 2381 2380 2382 2385 2386 CONECT 2382 2139 2381 2383 2384 CONECT 2383 2382 CONECT 2384 2382 CONECT 2385 2381 CONECT 2386 2381 CONECT 2387 2380 CONECT 2388 2380 CONECT 2389 2140 CONECT 2390 2136 2391 2395 2399 CONECT 2391 2390 2392 2393 2394 CONECT 2392 2391 CONECT 2393 2391 CONECT 2394 2391 CONECT 2395 2390 2396 2397 2398 CONECT 2396 2395 CONECT 2397 2395 CONECT 2398 2395 CONECT 2399 2390 CONECT 2400 2136 CONECT 2401 2135 MASTER 0 0 0 0 0 0 0 0 2397 4 289 17 END
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Entry Information
PDB ID
6sen
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
TEAD4
Ligand Name
18-mer
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=2.8uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2020) Protein Sci. Vol. 29: pp. 509-520
Ligand Properties
Formula
C
8
9
H
1
3
7
N
2
5
O
2
3
S
Molecular Weight
1957.260
Exact Mass
1956.000
No. of atoms
275
No. of bonds
280
Polar Surface Area
793.35
LOGP Value
3.69 (
Computed with XLOGP3
)
-0.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 72
No. of Nitrogen and Oxygen Atoms: 48
No. of Rings: 6
Canonical SMILES
CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)CCC(=O)O)CCC(=O)O)Cc1c[nH]c2c1cccc2)Cc1ccccc1)CO)C)CC(C)C)CCC(=O)N)CCC[NH+]=C(N)N)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)C
InChI String
InChI=1S/C89H135N25O23S/c1-46(2)41-63(110-78(128)57(28-31-68(90)117)104-76(126)56(24-15-36-97-89(94)95)102-73(123)48(5)99-75(125)55(23-14-35-96-88(92)93)103-79(129)59(34-40-138-8)106-84(134)67-27-18-39-114(67)87(137)71(47(3)4)101-50(7)116)86(136)113-38-17-26-66(113)83(133)100-49(6)74(124)111-64(45-115)82(132)108-61(42-51-19-10-9-11-20-51)80(130)109-62(43-52-44-98-54-22-13-12-21-53(52)54)81(131)105-58(29-32-69(118)119)77(127)107-60(30-33-70(120)121)85(135)112-37-16-25-65(112)72(91)122/h9-13,19-22,44,46-49,55-67,71,98,115H,14-18,23-43,45H2,1-8H3,(H2,90,117)(H2,91,122)(H,99,125)(H,100,133)(H,101,116)(H,102,123)(H,103,129)(H,104,126)(H,105,131)(H,106,134)(H,107,127)(H,108,132)(H,109,130)(H,110,128)(H,111,124)(H,118,119)(H,120,121)(H4,92,93,96)(H4,94,95,97)/p+2/t48-,49-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,71-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8N9Y4
Q15561
Entrez Gene ID
NCBI Entrez Gene ID:
90050
7004
ASD
Information of known allosteric effects of PDB entries
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