Browse entries in the PDBbind-CN Database
HEADER 2XQQ_COMPLEX COMPND 2XQQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 87 ASP ARG LYS ALA VAL ILE LYS ASN ALA ASP MET SER GLU SEQRES 2 A 87 ASP MET GLN GLN ASP ALA VAL ASP CYS ALA THR GLN ALA SEQRES 3 A 87 MET GLU LYS TYR ASN ILE GLU LYS ASP ILE ALA ALA TYR SEQRES 4 A 87 ILE LYS LYS GLU PHE ASP LYS LYS TYR ASN PRO THR TRP SEQRES 5 A 87 HIS CYS ILE VAL GLY ARG ASN PHE GLY SER TYR VAL THR SEQRES 6 A 87 HIS GLU THR LYS HIS PHE ILE TYR PHE TYR LEU GLY GLN SEQRES 7 A 87 VAL ALA ILE LEU LEU PHE LYS SER GLY SEQRES 1 C 86 ARG LYS ALA VAL ILE LYS ASN ALA ASP MET SER GLU ASP SEQRES 2 C 86 MET GLN GLN ASP ALA VAL ASP CYS ALA THR GLN ALA MET SEQRES 3 C 86 GLU LYS TYR ASN ILE GLU LYS ASP ILE ALA ALA TYR ILE SEQRES 4 C 86 LYS LYS GLU PHE ASP LYS LYS TYR ASN PRO THR TRP HIS SEQRES 5 C 86 CYS ILE VAL GLY ARG ASN PHE GLY SER TYR VAL THR HIS SEQRES 6 C 86 GLU THR LYS HIS PHE ILE TYR PHE TYR LEU GLY GLN VAL SEQRES 7 C 86 ALA ILE LEU LEU PHE LYS SER GLY HET SAC A 330 109 ATOM 1 N ASP A 3 16.106 29.526 39.146 1.00 28.22 N ATOM 2 CA ASP A 3 16.399 28.598 37.989 1.00 26.70 C ATOM 3 C ASP A 3 17.837 28.699 37.551 1.00 24.64 C ATOM 4 O ASP A 3 18.296 29.686 36.926 1.00 25.68 O ATOM 5 CB ASP A 3 15.579 28.859 36.768 1.00 29.29 C ATOM 6 CG ASP A 3 15.428 30.288 36.505 1.00 29.66 C ATOM 7 OD1 ASP A 3 15.483 31.023 37.513 1.00 32.26 O ATOM 8 OD2 ASP A 3 15.257 30.643 35.316 1.00 33.30 O ATOM 9 HA ASP A 3 16.155 27.612 38.384 1.00 0.00 H ATOM 10 HB2 ASP A 3 16.065 28.393 35.911 1.00 0.00 H ATOM 11 HB3 ASP A 3 14.591 28.420 36.907 1.00 0.00 H ATOM 12 HN3 ASP A 3 16.295 30.507 38.858 1.00 0.00 H ATOM 13 HN2 ASP A 3 16.715 29.276 39.952 1.00 0.00 H ATOM 14 HN1 ASP A 3 15.108 29.430 39.421 1.00 0.00 H ATOM 15 N ARG A 4 18.535 27.640 37.868 1.00 23.15 N ATOM 16 CA ARG A 4 19.951 27.614 37.744 1.00 21.99 C ATOM 17 C ARG A 4 20.373 26.306 37.108 1.00 20.10 C ATOM 18 O ARG A 4 21.531 25.961 37.195 1.00 20.74 O ATOM 19 CB ARG A 4 20.600 27.805 39.102 1.00 24.03 C ATOM 20 CG ARG A 4 20.103 28.994 39.861 1.00 28.12 C ATOM 21 CD ARG A 4 20.644 30.279 39.267 1.00 32.21 C ATOM 22 NE ARG A 4 19.903 31.478 39.724 1.00 34.40 N ATOM 23 CZ ARG A 4 19.846 31.920 40.983 1.00 33.53 C ATOM 24 NH1 ARG A 4 20.424 31.255 42.016 1.00 33.91 N ATOM 25 NH2 ARG A 4 19.158 33.031 41.222 1.00 35.82 N ATOM 26 HA ARG A 4 20.280 28.433 37.104 1.00 0.00 H ATOM 27 HB2 ARG A 4 20.409 26.914 39.700 1.00 0.00 H ATOM 28 HB3 ARG A 4 21.674 27.919 38.954 1.00 0.00 H ATOM 29 HG2 ARG A 4 19.014 29.013 39.822 1.00 0.00 H ATOM 30 HG3 ARG A 4 20.427 28.916 40.899 1.00 0.00 H ATOM 31 HD2 ARG A 4 20.573 30.218 38.181 1.00 0.00 H ATOM 32 HD3 ARG A 4 21.690 30.384 39.556 1.00 0.00 H ATOM 33 HE ARG A 4 19.384 32.021 39.004 1.00 0.00 H ATOM 34 HH12 ARG A 4 20.356 31.634 42.982 1.00 0.00 H ATOM 35 HH11 ARG A 4 20.935 30.366 41.841 1.00 0.00 H ATOM 36 HH22 ARG A 4 19.093 33.404 42.191 1.00 0.00 H ATOM 37 HH21 ARG A 4 18.685 33.528 40.440 1.00 0.00 H ATOM 38 H ARG A 4 18.042 26.795 38.220 1.00 0.00 H ATOM 39 N LYS A 5 19.515 25.636 36.340 1.00 17.89 N ATOM 40 CA LYS A 5 19.908 24.441 35.620 1.00 17.63 C ATOM 41 C LYS A 5 21.060 24.781 34.672 1.00 15.00 C ATOM 42 O LYS A 5 20.948 25.709 33.855 1.00 16.39 O ATOM 43 CB LYS A 5 18.756 23.923 34.768 1.00 19.61 C ATOM 44 CG LYS A 5 19.070 22.547 34.189 1.00 23.17 C ATOM 45 HA LYS A 5 20.201 23.686 36.349 1.00 0.00 H ATOM 46 HB2 LYS A 5 17.861 23.853 35.386 1.00 0.00 H ATOM 47 HB3 LYS A 5 18.577 24.621 33.950 1.00 0.00 H ATOM 48 HG2 LYS A 5 19.962 22.611 33.565 1.00 0.00 H ATOM 49 HG3 LYS A 5 19.244 21.843 35.003 1.00 0.00 H ATOM 50 H LYS A 5 18.537 25.980 36.255 1.00 0.00 H ATOM 51 N ALA A 6 22.097 23.936 34.666 1.00 12.50 N ATOM 52 CA ALA A 6 23.284 24.189 33.842 1.00 10.66 C ATOM 53 C ALA A 6 23.277 23.499 32.492 1.00 11.58 C ATOM 54 O ALA A 6 23.016 22.313 32.407 1.00 13.68 O ATOM 55 CB ALA A 6 24.559 23.806 34.552 1.00 14.24 C ATOM 56 HA ALA A 6 23.246 25.264 33.669 1.00 0.00 H ATOM 57 HB1 ALA A 6 24.651 24.387 35.469 1.00 0.00 H ATOM 58 HB2 ALA A 6 24.533 22.744 34.795 1.00 0.00 H ATOM 59 HB3 ALA A 6 25.410 24.011 33.903 1.00 0.00 H ATOM 60 H ALA A 6 22.061 23.082 35.258 1.00 0.00 H ATOM 61 N VAL A 7 23.626 24.256 31.450 1.00 11.55 N ATOM 62 CA VAL A 7 23.700 23.736 30.093 1.00 13.70 C ATOM 63 C VAL A 7 25.025 24.250 29.514 1.00 12.29 C ATOM 64 O VAL A 7 25.206 25.433 29.399 1.00 12.88 O ATOM 65 CB VAL A 7 22.453 24.257 29.166 1.00 14.93 C ATOM 66 CG1 VAL A 7 22.660 23.797 27.716 1.00 20.60 C ATOM 67 CG2 VAL A 7 21.020 23.780 29.793 1.00 19.34 C ATOM 68 HA VAL A 7 23.644 22.647 30.104 1.00 0.00 H ATOM 69 HB VAL A 7 22.430 25.347 29.161 1.00 0.00 H ATOM 70 HG11 VAL A 7 23.593 24.212 27.334 1.00 0.00 H ATOM 71 HG12 VAL A 7 22.705 22.708 27.684 1.00 0.00 H ATOM 72 HG13 VAL A 7 21.829 24.146 27.103 1.00 0.00 H ATOM 73 HG21 VAL A 7 20.990 22.691 29.841 1.00 0.00 H ATOM 74 HG22 VAL A 7 20.908 24.193 30.796 1.00 0.00 H ATOM 75 HG23 VAL A 7 20.210 24.139 29.158 1.00 0.00 H ATOM 76 H VAL A 7 23.854 25.257 31.614 1.00 0.00 H ATOM 77 N ILE A 8 25.948 23.347 29.194 1.00 11.98 N ATOM 78 CA ILE A 8 27.222 23.720 28.576 1.00 10.37 C ATOM 79 C ILE A 8 27.031 23.902 27.087 1.00 10.83 C ATOM 80 O ILE A 8 26.484 23.000 26.428 1.00 13.55 O ATOM 81 CB ILE A 8 28.375 22.725 28.798 1.00 13.46 C ATOM 82 CG1 ILE A 8 28.589 22.311 30.250 1.00 18.52 C ATOM 83 CG2 ILE A 8 29.705 23.230 28.185 1.00 14.24 C ATOM 84 CD1 ILE A 8 28.627 23.382 31.110 1.00 16.78 C ATOM 85 HA ILE A 8 27.515 24.645 29.072 1.00 0.00 H ATOM 86 HB ILE A 8 28.055 21.827 28.270 1.00 0.00 H ATOM 87 HG12 ILE A 8 27.773 21.653 30.549 1.00 0.00 H ATOM 88 HG13 ILE A 8 29.534 21.772 30.323 1.00 0.00 H ATOM 89 HD11 ILE A 8 29.446 24.044 30.828 1.00 0.00 H ATOM 90 HD12 ILE A 8 27.684 23.925 31.054 1.00 0.00 H ATOM 91 HD13 ILE A 8 28.782 23.024 32.128 1.00 0.00 H ATOM 92 HG21 ILE A 8 29.579 23.371 27.112 1.00 0.00 H ATOM 93 HG22 ILE A 8 29.980 24.178 28.647 1.00 0.00 H ATOM 94 HG23 ILE A 8 30.489 22.495 28.366 1.00 0.00 H ATOM 95 H ILE A 8 25.759 22.343 29.389 1.00 0.00 H ATOM 96 N LYS A 9 27.339 25.095 26.568 1.00 10.46 N ATOM 97 CA LYS A 9 27.171 25.432 25.150 1.00 11.09 C ATOM 98 C LYS A 9 28.423 25.128 24.344 1.00 11.38 C ATOM 99 O LYS A 9 28.374 24.571 23.256 1.00 14.07 O ATOM 100 CB LYS A 9 26.718 26.857 24.931 1.00 12.89 C ATOM 101 CG LYS A 9 25.377 27.145 25.565 1.00 13.28 C ATOM 102 CD LYS A 9 24.261 26.598 24.836 1.00 18.11 C ATOM 103 CE LYS A 9 22.907 27.140 25.253 1.00 22.65 C ATOM 104 NZ LYS A 9 21.848 26.536 24.409 1.00 29.73 N ATOM 105 HA LYS A 9 26.370 24.789 24.785 1.00 0.00 H ATOM 106 HB2 LYS A 9 27.460 27.529 25.362 1.00 0.00 H ATOM 107 HB3 LYS A 9 26.644 27.039 23.859 1.00 0.00 H ATOM 108 HG2 LYS A 9 25.373 26.721 26.569 1.00 0.00 H ATOM 109 HG3 LYS A 9 25.251 28.226 25.627 1.00 0.00 H ATOM 110 HD2 LYS A 9 24.405 26.819 23.778 1.00 0.00 H ATOM 111 HD3 LYS A 9 24.255 25.518 24.983 1.00 0.00 H ATOM 112 HE2 LYS A 9 22.896 28.223 25.130 1.00 0.00 H ATOM 113 HE3 LYS A 9 22.723 26.893 26.299 1.00 0.00 H ATOM 114 HZ1 LYS A 9 22.024 26.773 23.412 1.00 0.00 H ATOM 115 HZ2 LYS A 9 21.859 25.503 24.528 1.00 0.00 H ATOM 116 HZ3 LYS A 9 20.921 26.910 24.697 1.00 0.00 H ATOM 117 H LYS A 9 27.719 25.824 27.205 1.00 0.00 H ATOM 118 N ASN A 10 29.569 25.518 24.856 1.00 10.25 N ATOM 119 CA ASN A 10 30.828 25.248 24.217 1.00 11.30 C ATOM 120 C ASN A 10 31.931 25.227 25.243 1.00 10.22 C ATOM 121 O ASN A 10 31.904 26.021 26.152 1.00 13.23 O ATOM 122 CB ASN A 10 31.202 26.410 23.233 1.00 14.30 C ATOM 123 CG ASN A 10 30.239 26.567 22.138 1.00 20.44 C ATOM 124 OD1 ASN A 10 29.279 27.338 22.239 1.00 27.71 O ATOM 125 ND2 ASN A 10 30.477 25.847 21.047 1.00 23.61 N ATOM 126 HA ASN A 10 30.729 24.295 23.698 1.00 0.00 H ATOM 127 HB2 ASN A 10 31.243 27.342 23.796 1.00 0.00 H ATOM 128 HB3 ASN A 10 32.183 26.201 22.806 1.00 0.00 H ATOM 129 HD22 ASN A 10 31.300 25.212 21.012 1.00 0.00 H ATOM 130 HD21 ASN A 10 29.840 25.919 20.228 1.00 0.00 H ATOM 131 H ASN A 10 29.565 26.040 25.755 1.00 0.00 H ATOM 132 N ALA A 11 32.885 24.329 25.102 1.00 10.57 N ATOM 133 CA ALA A 11 33.947 24.202 26.061 1.00 11.51 C ATOM 134 C ALA A 11 35.213 23.739 25.391 1.00 10.94 C ATOM 135 O ALA A 11 35.156 22.877 24.479 1.00 13.45 O ATOM 136 CB ALA A 11 33.530 23.292 27.206 1.00 14.19 C ATOM 137 HA ALA A 11 34.154 25.182 26.492 1.00 0.00 H ATOM 138 HB1 ALA A 11 32.655 23.712 27.702 1.00 0.00 H ATOM 139 HB2 ALA A 11 33.288 22.304 26.814 1.00 0.00 H ATOM 140 HB3 ALA A 11 34.349 23.210 27.920 1.00 0.00 H ATOM 141 H ALA A 11 32.869 23.697 24.276 1.00 0.00 H ATOM 142 N ASP A 12 36.316 24.266 25.862 1.00 9.45 N ATOM 143 CA ASP A 12 37.661 23.676 25.627 1.00 9.53 C ATOM 144 C ASP A 12 38.234 23.670 27.017 1.00 8.96 C ATOM 145 O ASP A 12 38.905 24.605 27.472 1.00 8.95 O ATOM 146 CB ASP A 12 38.480 24.527 24.657 1.00 11.25 C ATOM 147 CG ASP A 12 39.895 23.990 24.495 1.00 12.73 C ATOM 148 OD1 ASP A 12 40.103 22.826 24.728 1.00 17.61 O ATOM 149 OD2 ASP A 12 40.789 24.777 24.194 1.00 15.15 O ATOM 150 HA ASP A 12 37.648 22.690 25.162 1.00 0.00 H ATOM 151 HB2 ASP A 12 37.988 24.527 23.684 1.00 0.00 H ATOM 152 HB3 ASP A 12 38.530 25.547 25.037 1.00 0.00 H ATOM 153 H ASP A 12 36.248 25.137 26.426 1.00 0.00 H ATOM 154 N MET A 13 37.972 22.586 27.758 1.00 10.06 N ATOM 155 CA MET A 13 38.232 22.543 29.195 1.00 9.63 C ATOM 156 C MET A 13 38.062 21.115 29.651 1.00 11.39 C ATOM 157 O MET A 13 37.137 20.438 29.202 1.00 11.82 O ATOM 158 CB MET A 13 37.256 23.500 29.913 1.00 10.72 C ATOM 159 CG MET A 13 37.460 23.607 31.373 1.00 10.86 C ATOM 160 SD MET A 13 36.411 24.846 32.207 1.00 9.65 S ATOM 161 CE MET A 13 37.246 26.395 31.722 1.00 10.21 C ATOM 162 HA MET A 13 39.245 22.869 29.432 1.00 0.00 H ATOM 163 HB2 MET A 13 37.373 24.493 29.480 1.00 0.00 H ATOM 164 HB3 MET A 13 36.241 23.145 29.737 1.00 0.00 H ATOM 165 HG2 MET A 13 38.503 23.871 31.551 1.00 0.00 H ATOM 166 HG3 MET A 13 37.252 22.633 31.816 1.00 0.00 H ATOM 167 HE1 MET A 13 38.274 26.381 32.084 1.00 0.00 H ATOM 168 HE2 MET A 13 37.243 26.483 30.636 1.00 0.00 H ATOM 169 HE3 MET A 13 36.718 27.243 32.158 1.00 0.00 H ATOM 170 H MET A 13 37.570 21.746 27.295 1.00 0.00 H ATOM 171 N SER A 14 38.819 20.702 30.666 1.00 11.09 N ATOM 172 CA SER A 14 38.594 19.367 31.216 1.00 12.72 C ATOM 173 C SER A 14 37.203 19.216 31.819 1.00 11.73 C ATOM 174 O SER A 14 36.614 20.227 32.286 1.00 11.69 O ATOM 175 CB SER A 14 39.647 19.082 32.302 1.00 13.65 C ATOM 176 OG SER A 14 39.352 19.807 33.481 1.00 13.47 O ATOM 177 HA SER A 14 38.679 18.655 30.395 1.00 0.00 H ATOM 178 HB2 SER A 14 40.630 19.378 31.935 1.00 0.00 H ATOM 179 HB3 SER A 14 39.650 18.016 32.528 1.00 0.00 H ATOM 180 HG SER A 14 40.038 19.612 34.167 1.00 0.00 H ATOM 181 H SER A 14 39.558 21.319 31.060 1.00 0.00 H ATOM 182 N GLU A 15 36.685 18.013 31.859 1.00 13.06 N ATOM 183 CA GLU A 15 35.384 17.807 32.439 1.00 12.63 C ATOM 184 C GLU A 15 35.324 18.237 33.907 1.00 11.57 C ATOM 185 O GLU A 15 34.290 18.844 34.328 1.00 11.53 O ATOM 186 CB GLU A 15 34.924 16.349 32.294 1.00 13.71 C ATOM 187 CG GLU A 15 34.570 15.979 30.879 1.00 17.24 C ATOM 188 CD GLU A 15 34.207 14.521 30.747 1.00 25.41 C ATOM 189 OE1 GLU A 15 33.945 13.876 31.780 1.00 22.04 O ATOM 190 OE2 GLU A 15 34.190 14.031 29.606 1.00 33.36 O ATOM 191 HA GLU A 15 34.699 18.444 31.880 1.00 0.00 H ATOM 192 HB2 GLU A 15 35.728 15.696 32.633 1.00 0.00 H ATOM 193 HB3 GLU A 15 34.046 16.198 32.922 1.00 0.00 H ATOM 194 HG2 GLU A 15 33.721 16.583 30.559 1.00 0.00 H ATOM 195 HG3 GLU A 15 35.425 16.188 30.236 1.00 0.00 H ATOM 196 H GLU A 15 37.215 17.206 31.471 1.00 0.00 H ATOM 197 N ASP A 16 36.354 17.967 34.676 1.00 10.73 N ATOM 198 CA ASP A 16 36.291 18.341 36.067 1.00 10.83 C ATOM 199 C ASP A 16 36.332 19.876 36.241 1.00 11.30 C ATOM 200 O ASP A 16 35.680 20.426 37.128 1.00 10.83 O ATOM 201 CB ASP A 16 37.409 17.672 36.884 1.00 11.86 C ATOM 202 CG ASP A 16 37.128 16.141 37.059 1.00 12.84 C ATOM 203 OD1 ASP A 16 35.920 15.736 37.185 1.00 14.22 O ATOM 204 OD2 ASP A 16 38.120 15.407 37.068 1.00 16.66 O ATOM 205 HA ASP A 16 35.336 17.983 36.451 1.00 0.00 H ATOM 206 HB2 ASP A 16 38.359 17.805 36.366 1.00 0.00 H ATOM 207 HB3 ASP A 16 37.464 18.141 37.867 1.00 0.00 H ATOM 208 H ASP A 16 37.196 17.494 34.290 1.00 0.00 H ATOM 209 N MET A 17 37.116 20.576 35.441 1.00 9.59 N ATOM 210 CA MET A 17 37.125 22.020 35.514 1.00 9.29 C ATOM 211 C MET A 17 35.786 22.611 35.061 1.00 8.53 C ATOM 212 O MET A 17 35.336 23.613 35.634 1.00 8.14 O ATOM 213 CB MET A 17 38.293 22.641 34.735 1.00 9.52 C ATOM 214 CG MET A 17 39.533 22.607 35.520 1.00 11.27 C ATOM 215 SD MET A 17 41.020 23.299 34.746 1.00 14.59 S ATOM 216 CE MET A 17 40.153 24.704 34.032 1.00 12.76 C ATOM 217 HA MET A 17 37.272 22.276 36.563 1.00 0.00 H ATOM 218 HB2 MET A 17 38.441 22.082 33.811 1.00 0.00 H ATOM 219 HB3 MET A 17 38.051 23.677 34.497 1.00 0.00 H ATOM 220 HG2 MET A 17 39.742 21.564 35.759 1.00 0.00 H ATOM 221 HG3 MET A 17 39.354 23.161 36.441 1.00 0.00 H ATOM 222 HE1 MET A 17 39.376 24.345 33.358 1.00 0.00 H ATOM 223 HE2 MET A 17 39.700 25.293 34.829 1.00 0.00 H ATOM 224 HE3 MET A 17 40.860 25.322 33.478 1.00 0.00 H ATOM 225 H MET A 17 37.728 20.087 34.757 1.00 0.00 H ATOM 226 N GLN A 18 35.149 22.010 34.053 1.00 8.30 N ATOM 227 CA GLN A 18 33.803 22.432 33.670 1.00 8.24 C ATOM 228 C GLN A 18 32.848 22.350 34.846 1.00 7.87 C ATOM 229 O GLN A 18 32.044 23.281 35.085 1.00 8.57 O ATOM 230 CB GLN A 18 33.276 21.656 32.475 1.00 9.47 C ATOM 231 CG GLN A 18 34.010 21.836 31.160 1.00 10.19 C ATOM 232 CD GLN A 18 33.422 21.002 30.089 1.00 13.17 C ATOM 233 OE1 GLN A 18 32.203 20.980 29.945 1.00 15.33 O ATOM 234 NE2 GLN A 18 34.255 20.348 29.306 1.00 14.99 N ATOM 235 HA GLN A 18 33.871 23.476 33.364 1.00 0.00 H ATOM 236 HB2 GLN A 18 33.311 20.597 32.729 1.00 0.00 H ATOM 237 HB3 GLN A 18 32.240 21.957 32.318 1.00 0.00 H ATOM 238 HG2 GLN A 18 33.954 22.884 30.864 1.00 0.00 H ATOM 239 HG3 GLN A 18 35.054 21.553 31.296 1.00 0.00 H ATOM 240 HE22 GLN A 18 35.280 20.403 29.475 1.00 0.00 H ATOM 241 HE21 GLN A 18 33.888 19.776 28.518 1.00 0.00 H ATOM 242 H GLN A 18 35.614 21.236 33.537 1.00 0.00 H ATOM 243 N GLN A 19 32.875 21.226 35.574 1.00 8.25 N ATOM 244 CA GLN A 19 32.016 21.057 36.728 1.00 7.95 C ATOM 245 C GLN A 19 32.306 22.091 37.789 1.00 7.56 C ATOM 246 O GLN A 19 31.371 22.610 38.418 1.00 9.12 O ATOM 247 CB GLN A 19 32.104 19.644 37.298 1.00 9.91 C ATOM 248 CG GLN A 19 31.073 19.417 38.366 1.00 11.98 C ATOM 249 CD GLN A 19 29.698 19.462 37.799 1.00 15.60 C ATOM 250 OE1 GLN A 19 29.332 18.623 36.978 1.00 20.72 O ATOM 251 NE2 GLN A 19 28.866 20.417 38.326 1.00 16.76 N ATOM 252 HA GLN A 19 30.991 21.208 36.388 1.00 0.00 H ATOM 253 HB2 GLN A 19 31.945 18.926 36.493 1.00 0.00 H ATOM 254 HB3 GLN A 19 33.096 19.495 37.725 1.00 0.00 H ATOM 255 HG2 GLN A 19 31.240 18.440 38.821 1.00 0.00 H ATOM 256 HG3 GLN A 19 31.171 20.192 39.126 1.00 0.00 H ATOM 257 HE22 GLN A 19 29.233 21.101 39.018 1.00 0.00 H ATOM 258 HE21 GLN A 19 27.869 20.457 38.034 1.00 0.00 H ATOM 259 H GLN A 19 33.525 20.460 35.306 1.00 0.00 H ATOM 260 N ASP A 20 33.574 22.388 38.009 1.00 8.35 N ATOM 261 CA ASP A 20 33.936 23.366 38.995 1.00 8.49 C ATOM 262 C ASP A 20 33.393 24.756 38.577 1.00 7.63 C ATOM 263 O ASP A 20 32.967 25.540 39.400 1.00 8.39 O ATOM 264 CB ASP A 20 35.445 23.399 39.248 1.00 9.14 C ATOM 265 CG ASP A 20 35.818 24.111 40.508 1.00 12.68 C ATOM 266 OD1 ASP A 20 35.069 24.116 41.516 1.00 14.17 O ATOM 267 OD2 ASP A 20 36.937 24.605 40.524 1.00 19.61 O ATOM 268 HA ASP A 20 33.477 23.082 39.942 1.00 0.00 H ATOM 269 HB2 ASP A 20 35.808 22.373 39.309 1.00 0.00 H ATOM 270 HB3 ASP A 20 35.926 23.904 38.410 1.00 0.00 H ATOM 271 H ASP A 20 34.317 21.908 37.462 1.00 0.00 H ATOM 272 N ALA A 21 33.495 25.077 37.281 1.00 7.19 N ATOM 273 CA ALA A 21 32.974 26.337 36.781 1.00 7.32 C ATOM 274 C ALA A 21 31.476 26.467 37.056 1.00 7.82 C ATOM 275 O ALA A 21 30.982 27.526 37.496 1.00 7.65 O ATOM 276 CB ALA A 21 33.290 26.500 35.300 1.00 9.09 C ATOM 277 HA ALA A 21 33.470 27.146 37.318 1.00 0.00 H ATOM 278 HB1 ALA A 21 34.370 26.483 35.156 1.00 0.00 H ATOM 279 HB2 ALA A 21 32.835 25.683 34.741 1.00 0.00 H ATOM 280 HB3 ALA A 21 32.890 27.451 34.947 1.00 0.00 H ATOM 281 H ALA A 21 33.954 24.415 36.623 1.00 0.00 H ATOM 282 N VAL A 22 30.728 25.398 36.795 1.00 7.61 N ATOM 283 CA VAL A 22 29.305 25.373 37.052 1.00 7.58 C ATOM 284 C VAL A 22 29.066 25.554 38.567 1.00 7.70 C ATOM 285 O VAL A 22 28.137 26.322 38.958 1.00 8.34 O ATOM 286 CB VAL A 22 28.615 24.110 36.469 1.00 9.03 C ATOM 287 CG1 VAL A 22 27.195 23.911 36.983 1.00 12.06 C ATOM 288 CG2 VAL A 22 28.705 24.134 34.967 1.00 10.42 C ATOM 289 HA VAL A 22 28.834 26.204 36.528 1.00 0.00 H ATOM 290 HB VAL A 22 29.153 23.232 36.827 1.00 0.00 H ATOM 291 HG11 VAL A 22 27.214 23.806 38.068 1.00 0.00 H ATOM 292 HG12 VAL A 22 26.587 24.774 36.711 1.00 0.00 H ATOM 293 HG13 VAL A 22 26.771 23.011 36.537 1.00 0.00 H ATOM 294 HG21 VAL A 22 28.207 25.027 34.589 1.00 0.00 H ATOM 295 HG22 VAL A 22 29.753 24.146 34.667 1.00 0.00 H ATOM 296 HG23 VAL A 22 28.220 23.246 34.561 1.00 0.00 H ATOM 297 H VAL A 22 31.181 24.553 36.393 1.00 0.00 H ATOM 298 N ASP A 23 29.759 24.827 39.411 1.00 7.85 N ATOM 299 CA ASP A 23 29.530 24.920 40.826 1.00 8.33 C ATOM 300 C ASP A 23 29.855 26.352 41.332 1.00 7.53 C ATOM 301 O ASP A 23 29.166 26.902 42.181 1.00 8.55 O ATOM 302 CB ASP A 23 30.453 23.946 41.577 1.00 8.53 C ATOM 303 CG ASP A 23 30.076 22.486 41.438 1.00 11.84 C ATOM 304 OD1 ASP A 23 29.022 22.150 40.914 1.00 13.95 O ATOM 305 OD2 ASP A 23 30.937 21.686 41.801 1.00 13.15 O ATOM 306 HA ASP A 23 28.483 24.678 41.011 1.00 0.00 H ATOM 307 HB2 ASP A 23 31.466 24.074 41.195 1.00 0.00 H ATOM 308 HB3 ASP A 23 30.430 24.204 42.636 1.00 0.00 H ATOM 309 H ASP A 23 30.484 24.174 39.051 1.00 0.00 H ATOM 310 N CYS A 24 30.947 26.919 40.840 1.00 7.41 N ATOM 311 CA CYS A 24 31.335 28.266 41.187 1.00 7.24 C ATOM 312 C CYS A 24 30.309 29.290 40.786 1.00 6.81 C ATOM 313 O CYS A 24 29.928 30.118 41.606 1.00 8.04 O ATOM 314 CB CYS A 24 32.690 28.585 40.584 1.00 8.34 C ATOM 315 SG CYS A 24 33.323 30.144 40.902 1.00 10.83 S ATOM 316 HA CYS A 24 31.404 28.316 42.274 1.00 0.00 H ATOM 317 HB2 CYS A 24 32.605 28.477 39.503 1.00 0.00 H ATOM 318 HB3 CYS A 24 33.403 27.854 40.966 1.00 0.00 H ATOM 319 HG CYS A 24 34.552 30.274 40.287 1.00 0.00 H ATOM 320 H CYS A 24 31.544 26.377 40.183 1.00 0.00 H ATOM 321 N ALA A 25 29.794 29.199 39.559 1.00 7.01 N ATOM 322 CA ALA A 25 28.756 30.102 39.088 1.00 7.51 C ATOM 323 C ALA A 25 27.497 29.935 39.887 1.00 7.52 C ATOM 324 O ALA A 25 26.779 30.902 40.141 1.00 8.48 O ATOM 325 CB ALA A 25 28.554 29.917 37.637 1.00 9.04 C ATOM 326 HA ALA A 25 29.071 31.134 39.240 1.00 0.00 H ATOM 327 HB1 ALA A 25 29.485 30.131 37.112 1.00 0.00 H ATOM 328 HB2 ALA A 25 28.253 28.888 37.442 1.00 0.00 H ATOM 329 HB3 ALA A 25 27.775 30.596 37.290 1.00 0.00 H ATOM 330 H ALA A 25 30.146 28.459 38.919 1.00 0.00 H ATOM 331 N THR A 26 27.164 28.703 40.266 1.00 7.68 N ATOM 332 CA THR A 26 25.955 28.448 41.059 1.00 8.37 C ATOM 333 C THR A 26 26.075 29.138 42.415 1.00 8.36 C ATOM 334 O THR A 26 25.165 29.819 42.858 1.00 9.27 O ATOM 335 CB THR A 26 25.732 26.929 41.199 1.00 8.88 C ATOM 336 OG1 THR A 26 25.538 26.383 39.896 1.00 10.91 O ATOM 337 CG2 THR A 26 24.557 26.659 42.091 1.00 11.96 C ATOM 338 HA THR A 26 25.083 28.862 40.553 1.00 0.00 H ATOM 339 HB THR A 26 26.600 26.456 41.658 1.00 0.00 H ATOM 340 HG1 THR A 26 26.340 26.559 39.343 1.00 0.00 H ATOM 341 HG23 THR A 26 24.742 27.090 43.075 1.00 0.00 H ATOM 342 HG21 THR A 26 23.663 27.108 41.658 1.00 0.00 H ATOM 343 HG22 THR A 26 24.414 25.583 42.186 1.00 0.00 H ATOM 344 H THR A 26 27.773 27.905 39.995 1.00 0.00 H ATOM 345 N GLN A 27 27.213 29.007 43.062 1.00 8.03 N ATOM 346 CA GLN A 27 27.452 29.715 44.332 1.00 8.16 C ATOM 347 C GLN A 27 27.367 31.230 44.149 1.00 7.15 C ATOM 348 O GLN A 27 26.856 31.986 44.973 1.00 9.87 O ATOM 349 CB GLN A 27 28.813 29.310 44.922 1.00 10.90 C ATOM 350 CG GLN A 27 28.905 27.965 45.556 1.00 14.81 C ATOM 351 CD GLN A 27 30.212 27.648 46.400 1.00 24.02 C ATOM 352 OE1 GLN A 27 31.173 28.425 46.533 1.00 28.37 O ATOM 353 NE2 GLN A 27 30.258 26.418 46.844 1.00 31.27 N ATOM 354 HA GLN A 27 26.669 29.425 45.033 1.00 0.00 H ATOM 355 HB2 GLN A 27 29.544 29.343 44.114 1.00 0.00 H ATOM 356 HB3 GLN A 27 29.076 30.049 45.679 1.00 0.00 H ATOM 357 HG2 GLN A 27 28.050 27.857 46.223 1.00 0.00 H ATOM 358 HG3 GLN A 27 28.840 27.222 44.761 1.00 0.00 H ATOM 359 HE22 GLN A 27 29.439 25.789 46.719 1.00 0.00 H ATOM 360 HE21 GLN A 27 31.113 26.069 47.322 1.00 0.00 H ATOM 361 H GLN A 27 27.956 28.394 42.671 1.00 0.00 H ATOM 362 N ALA A 28 27.986 31.714 43.056 1.00 7.32 N ATOM 363 CA ALA A 28 27.978 33.156 42.741 1.00 7.29 C ATOM 364 C ALA A 28 26.603 33.678 42.647 1.00 7.66 C ATOM 365 O ALA A 28 26.268 34.775 43.163 1.00 8.93 O ATOM 366 CB ALA A 28 28.773 33.412 41.441 1.00 7.98 C ATOM 367 HA ALA A 28 28.464 33.694 43.555 1.00 0.00 H ATOM 368 HB1 ALA A 28 29.802 33.077 41.574 1.00 0.00 H ATOM 369 HB2 ALA A 28 28.313 32.861 40.621 1.00 0.00 H ATOM 370 HB3 ALA A 28 28.763 34.478 41.214 1.00 0.00 H ATOM 371 H ALA A 28 28.481 31.057 42.419 1.00 0.00 H ATOM 372 N MET A 29 25.729 32.946 41.930 1.00 8.38 N ATOM 373 CA MET A 29 24.339 33.393 41.746 1.00 9.56 C ATOM 374 C MET A 29 23.527 33.271 42.995 1.00 8.61 C ATOM 375 O MET A 29 22.548 34.016 43.123 1.00 12.52 O ATOM 376 CB MET A 29 23.667 32.669 40.580 1.00 11.17 C ATOM 377 CG MET A 29 24.301 33.042 39.267 1.00 12.97 C ATOM 378 SD MET A 29 23.421 32.413 37.824 1.00 21.45 S ATOM 379 CE MET A 29 22.083 33.558 37.691 1.00 26.25 C ATOM 380 HA MET A 29 24.387 34.454 41.502 1.00 0.00 H ATOM 381 HB2 MET A 29 23.762 31.593 40.728 1.00 0.00 H ATOM 382 HB3 MET A 29 22.611 32.939 40.555 1.00 0.00 H ATOM 383 HG2 MET A 29 25.316 32.644 39.251 1.00 0.00 H ATOM 384 HG3 MET A 29 24.337 34.129 39.200 1.00 0.00 H ATOM 385 HE1 MET A 29 21.488 33.527 38.604 1.00 0.00 H ATOM 386 HE2 MET A 29 22.480 34.563 37.548 1.00 0.00 H ATOM 387 HE3 MET A 29 21.458 33.288 36.840 1.00 0.00 H ATOM 388 H MET A 29 26.041 32.052 41.500 1.00 0.00 H ATOM 389 N GLU A 30 23.865 32.363 43.900 1.00 9.56 N ATOM 390 CA GLU A 30 23.192 32.305 45.203 1.00 10.80 C ATOM 391 C GLU A 30 23.503 33.574 45.993 1.00 9.64 C ATOM 392 O GLU A 30 22.719 34.017 46.793 1.00 11.71 O ATOM 393 CB GLU A 30 23.635 31.048 45.954 1.00 12.58 C ATOM 394 CG GLU A 30 23.112 29.696 45.420 1.00 16.69 C ATOM 395 CD GLU A 30 23.748 28.427 45.990 1.00 27.14 C ATOM 396 OE1 GLU A 30 24.695 28.501 46.861 1.00 33.02 O ATOM 397 OE2 GLU A 30 23.302 27.338 45.518 1.00 33.03 O ATOM 398 HA GLU A 30 22.112 32.249 45.066 1.00 0.00 H ATOM 399 HB2 GLU A 30 24.724 31.014 45.927 1.00 0.00 H ATOM 400 HB3 GLU A 30 23.301 31.146 46.987 1.00 0.00 H ATOM 401 HG2 GLU A 30 22.044 29.651 45.631 1.00 0.00 H ATOM 402 HG3 GLU A 30 23.269 29.686 44.341 1.00 0.00 H ATOM 403 H GLU A 30 24.619 31.681 43.683 1.00 0.00 H ATOM 404 N LYS A 31 24.706 34.094 45.889 1.00 9.25 N ATOM 405 CA LYS A 31 25.198 35.193 46.709 1.00 8.31 C ATOM 406 C LYS A 31 24.887 36.547 46.133 1.00 7.26 C ATOM 407 O LYS A 31 24.530 37.472 46.866 1.00 8.16 O ATOM 408 CB LYS A 31 26.714 35.107 46.888 1.00 9.99 C ATOM 409 CG LYS A 31 27.310 36.094 47.825 1.00 13.85 C ATOM 410 CD LYS A 31 28.754 35.723 48.287 1.00 18.52 C ATOM 411 CE LYS A 31 29.229 36.690 49.388 1.00 20.31 C ATOM 412 NZ LYS A 31 30.636 36.386 49.728 1.00 26.56 N ATOM 413 HA LYS A 31 24.683 35.090 47.664 1.00 0.00 H ATOM 414 HB2 LYS A 31 26.952 34.109 47.257 1.00 0.00 H ATOM 415 HB3 LYS A 31 27.175 35.251 45.911 1.00 0.00 H ATOM 416 HG2 LYS A 31 27.345 37.064 47.328 1.00 0.00 H ATOM 417 HG3 LYS A 31 26.672 36.162 48.706 1.00 0.00 H ATOM 418 HD2 LYS A 31 28.757 34.705 48.677 1.00 0.00 H ATOM 419 HD3 LYS A 31 29.432 35.787 47.436 1.00 0.00 H ATOM 420 HE2 LYS A 31 28.605 36.569 50.274 1.00 0.00 H ATOM 421 HE3 LYS A 31 29.154 37.717 49.029 1.00 0.00 H ATOM 422 HZ1 LYS A 31 30.705 35.406 50.070 1.00 0.00 H ATOM 423 HZ2 LYS A 31 31.229 36.502 48.881 1.00 0.00 H ATOM 424 HZ3 LYS A 31 30.960 37.037 50.471 1.00 0.00 H ATOM 425 H LYS A 31 25.348 33.695 45.175 1.00 0.00 H ATOM 426 N TYR A 32 25.041 36.719 44.816 1.00 7.47 N ATOM 427 CA TYR A 32 25.057 38.045 44.189 1.00 8.00 C ATOM 428 C TYR A 32 23.922 38.192 43.211 1.00 9.06 C ATOM 429 O TYR A 32 23.665 37.292 42.408 1.00 11.21 O ATOM 430 CB TYR A 32 26.384 38.245 43.467 1.00 8.93 C ATOM 431 CG TYR A 32 27.518 38.362 44.374 1.00 10.03 C ATOM 432 CD1 TYR A 32 27.685 39.484 45.205 1.00 10.90 C ATOM 433 CD2 TYR A 32 28.469 37.359 44.463 1.00 12.27 C ATOM 434 CE1 TYR A 32 28.734 39.610 46.061 1.00 13.52 C ATOM 435 CE2 TYR A 32 29.533 37.457 45.323 1.00 14.73 C ATOM 436 CZ TYR A 32 29.690 38.625 46.115 1.00 15.45 C ATOM 437 OH TYR A 32 30.745 38.701 46.975 1.00 21.53 O ATOM 438 HA TYR A 32 24.939 38.799 44.967 1.00 0.00 H ATOM 439 HB3 TYR A 32 26.321 39.156 42.871 1.00 0.00 H ATOM 440 HB2 TYR A 32 26.553 37.393 42.809 1.00 0.00 H ATOM 441 HD2 TYR A 32 28.370 36.473 43.836 1.00 0.00 H ATOM 442 HE2 TYR A 32 30.254 36.643 45.398 1.00 0.00 H ATOM 443 HE1 TYR A 32 28.816 40.488 46.701 1.00 0.00 H ATOM 444 HD1 TYR A 32 26.945 40.283 45.161 1.00 0.00 H ATOM 445 HH TYR A 32 30.718 39.568 47.452 1.00 0.00 H ATOM 446 H TYR A 32 25.154 35.880 44.212 1.00 0.00 H ATOM 447 N ASN A 33 23.260 39.358 43.267 1.00 8.45 N ATOM 448 CA ASN A 33 22.162 39.692 42.363 1.00 10.24 C ATOM 449 C ASN A 33 22.595 40.277 41.006 1.00 10.18 C ATOM 450 O ASN A 33 21.845 40.172 40.059 1.00 12.85 O ATOM 451 CB ASN A 33 21.210 40.706 43.085 1.00 10.91 C ATOM 452 CG ASN A 33 20.544 40.135 44.309 1.00 14.02 C ATOM 453 OD1 ASN A 33 20.184 38.946 44.396 1.00 18.32 O ATOM 454 ND2 ASN A 33 20.342 41.042 45.276 1.00 15.62 N ATOM 455 HA ASN A 33 21.661 38.752 42.130 1.00 0.00 H ATOM 456 HB2 ASN A 33 21.794 41.576 43.384 1.00 0.00 H ATOM 457 HB3 ASN A 33 20.436 41.014 42.382 1.00 0.00 H ATOM 458 HD22 ASN A 33 20.666 42.022 45.146 1.00 0.00 H ATOM 459 HD21 ASN A 33 19.862 40.766 46.156 1.00 0.00 H ATOM 460 H ASN A 33 23.541 40.055 43.986 1.00 0.00 H ATOM 461 N ILE A 34 23.710 40.964 40.955 1.00 9.43 N ATOM 462 CA ILE A 34 24.113 41.773 39.802 1.00 8.34 C ATOM 463 C ILE A 34 25.132 40.993 38.954 1.00 7.42 C ATOM 464 O ILE A 34 26.053 40.377 39.492 1.00 8.45 O ATOM 465 CB ILE A 34 24.784 43.108 40.278 1.00 8.99 C ATOM 466 CG1 ILE A 34 23.870 43.921 41.217 1.00 9.20 C ATOM 467 CG2 ILE A 34 25.216 43.942 39.058 1.00 10.50 C ATOM 468 CD1 ILE A 34 22.421 44.057 40.670 1.00 9.70 C ATOM 469 HA ILE A 34 23.224 42.000 39.214 1.00 0.00 H ATOM 470 HB ILE A 34 25.668 42.848 40.860 1.00 0.00 H ATOM 471 HG12 ILE A 34 23.833 43.423 42.186 1.00 0.00 H ATOM 472 HG13 ILE A 34 24.293 44.918 41.339 1.00 0.00 H ATOM 473 HD11 ILE A 34 22.444 44.562 39.704 1.00 0.00 H ATOM 474 HD12 ILE A 34 21.984 43.065 40.552 1.00 0.00 H ATOM 475 HD13 ILE A 34 21.822 44.638 41.371 1.00 0.00 H ATOM 476 HG21 ILE A 34 25.930 43.372 38.464 1.00 0.00 H ATOM 477 HG22 ILE A 34 24.341 44.175 38.451 1.00 0.00 H ATOM 478 HG23 ILE A 34 25.681 44.867 39.398 1.00 0.00 H ATOM 479 H ILE A 34 24.344 40.933 41.779 1.00 0.00 H ATOM 480 N GLU A 35 24.940 40.991 37.653 1.00 8.06 N ATOM 481 CA GLU A 35 25.794 40.197 36.739 1.00 7.61 C ATOM 482 C GLU A 35 27.259 40.482 36.922 1.00 6.99 C ATOM 483 O GLU A 35 28.050 39.538 36.960 1.00 7.31 O ATOM 484 CB GLU A 35 25.371 40.481 35.270 1.00 7.64 C ATOM 485 CG GLU A 35 23.969 39.985 34.916 1.00 8.84 C ATOM 486 CD GLU A 35 23.415 40.531 33.626 1.00 10.08 C ATOM 487 OE1 GLU A 35 23.873 41.569 33.120 1.00 10.40 O ATOM 488 OE2 GLU A 35 22.442 39.871 33.132 1.00 10.12 O ATOM 489 HA GLU A 35 25.648 39.144 36.978 1.00 0.00 H ATOM 490 HB2 GLU A 35 25.405 41.558 35.106 1.00 0.00 H ATOM 491 HB3 GLU A 35 26.085 39.992 34.607 1.00 0.00 H ATOM 492 HG2 GLU A 35 24.003 38.898 34.838 1.00 0.00 H ATOM 493 HG3 GLU A 35 23.294 40.270 35.723 1.00 0.00 H ATOM 494 H GLU A 35 24.168 41.562 37.255 1.00 0.00 H ATOM 495 N LYS A 36 27.694 41.734 37.063 1.00 7.13 N ATOM 496 CA LYS A 36 29.072 42.077 37.256 1.00 7.43 C ATOM 497 C LYS A 36 29.687 41.393 38.474 1.00 7.37 C ATOM 498 O LYS A 36 30.851 41.000 38.484 1.00 8.01 O ATOM 499 CB LYS A 36 29.178 43.573 37.395 1.00 9.15 C ATOM 500 CG LYS A 36 30.555 44.109 37.665 1.00 8.85 C ATOM 501 CD LYS A 36 30.533 45.672 37.803 1.00 11.48 C ATOM 502 CE LYS A 36 29.859 46.225 39.083 1.00 13.14 C ATOM 503 NZ LYS A 36 30.233 47.700 39.311 1.00 18.87 N ATOM 504 HA LYS A 36 29.632 41.726 36.389 1.00 0.00 H ATOM 505 HB2 LYS A 36 28.820 44.021 36.468 1.00 0.00 H ATOM 506 HB3 LYS A 36 28.532 43.879 38.218 1.00 0.00 H ATOM 507 HG2 LYS A 36 30.932 43.674 38.591 1.00 0.00 H ATOM 508 HG3 LYS A 36 31.213 43.833 36.841 1.00 0.00 H ATOM 509 HD2 LYS A 36 31.564 46.024 37.789 1.00 0.00 H ATOM 510 HD3 LYS A 36 30.000 46.077 36.942 1.00 0.00 H ATOM 511 HE2 LYS A 36 30.186 45.637 39.941 1.00 0.00 H ATOM 512 HE3 LYS A 36 28.777 46.143 38.980 1.00 0.00 H ATOM 513 HZ1 LYS A 36 31.265 47.783 39.415 1.00 0.00 H ATOM 514 HZ2 LYS A 36 29.919 48.266 38.497 1.00 0.00 H ATOM 515 HZ3 LYS A 36 29.768 48.045 40.175 1.00 0.00 H ATOM 516 H LYS A 36 26.995 42.504 37.031 1.00 0.00 H ATOM 517 N ASP A 37 28.904 41.349 39.563 1.00 7.11 N ATOM 518 CA ASP A 37 29.358 40.775 40.800 1.00 7.73 C ATOM 519 C ASP A 37 29.422 39.246 40.717 1.00 7.00 C ATOM 520 O ASP A 37 30.376 38.637 41.252 1.00 7.83 O ATOM 521 CB ASP A 37 28.467 41.239 41.948 1.00 7.93 C ATOM 522 CG ASP A 37 28.536 42.706 42.205 1.00 10.87 C ATOM 523 OD1 ASP A 37 29.584 43.297 42.047 1.00 13.97 O ATOM 524 OD2 ASP A 37 27.508 43.230 42.603 1.00 13.45 O ATOM 525 HA ASP A 37 30.373 41.123 40.992 1.00 0.00 H ATOM 526 HB2 ASP A 37 27.436 40.979 41.710 1.00 0.00 H ATOM 527 HB3 ASP A 37 28.772 40.716 42.854 1.00 0.00 H ATOM 528 H ASP A 37 27.942 41.741 39.510 1.00 0.00 H ATOM 529 N ILE A 38 28.506 38.630 40.036 1.00 6.80 N ATOM 530 CA ILE A 38 28.546 37.193 39.715 1.00 6.63 C ATOM 531 C ILE A 38 29.851 36.928 38.975 1.00 6.76 C ATOM 532 O ILE A 38 30.633 36.010 39.286 1.00 7.40 O ATOM 533 CB ILE A 38 27.285 36.751 38.967 1.00 7.10 C ATOM 534 CG1 ILE A 38 26.038 36.939 39.780 1.00 7.88 C ATOM 535 CG2 ILE A 38 27.408 35.312 38.440 1.00 8.12 C ATOM 536 CD1 ILE A 38 24.749 36.926 39.008 1.00 10.23 C ATOM 537 HA ILE A 38 28.539 36.581 40.617 1.00 0.00 H ATOM 538 HB ILE A 38 27.194 37.408 38.102 1.00 0.00 H ATOM 539 HG12 ILE A 38 25.995 36.138 40.518 1.00 0.00 H ATOM 540 HG13 ILE A 38 26.113 37.899 40.291 1.00 0.00 H ATOM 541 HD11 ILE A 38 24.759 37.730 38.273 1.00 0.00 H ATOM 542 HD12 ILE A 38 24.641 35.968 38.499 1.00 0.00 H ATOM 543 HD13 ILE A 38 23.914 37.070 39.694 1.00 0.00 H ATOM 544 HG21 ILE A 38 28.253 35.248 37.754 1.00 0.00 H ATOM 545 HG22 ILE A 38 27.566 34.632 39.277 1.00 0.00 H ATOM 546 HG23 ILE A 38 26.492 35.039 37.916 1.00 0.00 H ATOM 547 H ILE A 38 27.694 39.184 39.696 1.00 0.00 H ATOM 548 N ALA A 39 30.092 37.710 37.917 1.00 6.55 N ATOM 549 CA ALA A 39 31.316 37.564 37.086 1.00 6.34 C ATOM 550 C ALA A 39 32.565 37.700 37.945 1.00 5.81 C ATOM 551 O ALA A 39 33.512 36.939 37.756 1.00 7.24 O ATOM 552 CB ALA A 39 31.320 38.584 35.960 1.00 7.15 C ATOM 553 HA ALA A 39 31.316 36.568 36.643 1.00 0.00 H ATOM 554 HB1 ALA A 39 30.444 38.431 35.330 1.00 0.00 H ATOM 555 HB2 ALA A 39 31.296 39.589 36.382 1.00 0.00 H ATOM 556 HB3 ALA A 39 32.224 38.461 35.363 1.00 0.00 H ATOM 557 H ALA A 39 29.400 38.445 37.667 1.00 0.00 H ATOM 558 N ALA A 40 32.599 38.685 38.817 1.00 6.71 N ATOM 559 CA ALA A 40 33.731 38.933 39.648 1.00 7.46 C ATOM 560 C ALA A 40 34.031 37.793 40.590 1.00 7.07 C ATOM 561 O ALA A 40 35.196 37.373 40.732 1.00 8.27 O ATOM 562 CB ALA A 40 33.592 40.249 40.477 1.00 8.16 C ATOM 563 HA ALA A 40 34.563 39.038 38.952 1.00 0.00 H ATOM 564 HB1 ALA A 40 33.483 41.095 39.798 1.00 0.00 H ATOM 565 HB2 ALA A 40 32.714 40.181 41.119 1.00 0.00 H ATOM 566 HB3 ALA A 40 34.482 40.386 41.091 1.00 0.00 H ATOM 567 H ALA A 40 31.769 39.306 38.903 1.00 0.00 H ATOM 568 N TYR A 41 32.990 37.221 41.178 1.00 6.71 N ATOM 569 CA TYR A 41 33.193 36.063 42.047 1.00 7.54 C ATOM 570 C TYR A 41 33.858 34.913 41.321 1.00 7.07 C ATOM 571 O TYR A 41 34.789 34.263 41.813 1.00 8.37 O ATOM 572 CB TYR A 41 31.829 35.648 42.597 1.00 8.01 C ATOM 573 CG TYR A 41 31.839 34.473 43.535 1.00 8.15 C ATOM 574 CD1 TYR A 41 31.936 34.686 44.939 1.00 12.35 C ATOM 575 CD2 TYR A 41 31.851 33.158 43.086 1.00 9.23 C ATOM 576 CE1 TYR A 41 31.873 33.592 45.815 1.00 14.90 C ATOM 577 CE2 TYR A 41 31.789 32.093 43.978 1.00 10.46 C ATOM 578 CZ TYR A 41 31.817 32.311 45.321 1.00 13.87 C ATOM 579 OH TYR A 41 31.794 31.264 46.216 1.00 17.88 O ATOM 580 HA TYR A 41 33.867 36.335 42.859 1.00 0.00 H ATOM 581 HB3 TYR A 41 31.188 35.398 41.752 1.00 0.00 H ATOM 582 HB2 TYR A 41 31.408 36.500 43.131 1.00 0.00 H ATOM 583 HD2 TYR A 41 31.910 32.958 42.016 1.00 0.00 H ATOM 584 HE2 TYR A 41 31.717 31.074 43.598 1.00 0.00 H ATOM 585 HE1 TYR A 41 31.868 33.759 46.892 1.00 0.00 H ATOM 586 HD1 TYR A 41 32.059 35.695 45.332 1.00 0.00 H ATOM 587 HH TYR A 41 30.964 30.739 46.087 1.00 0.00 H ATOM 588 H TYR A 41 32.032 37.595 41.022 1.00 0.00 H ATOM 589 N ILE A 42 33.344 34.626 40.141 1.00 6.96 N ATOM 590 CA ILE A 42 33.825 33.502 39.365 1.00 6.79 C ATOM 591 C ILE A 42 35.255 33.706 38.906 1.00 7.39 C ATOM 592 O ILE A 42 36.132 32.866 39.084 1.00 7.40 O ATOM 593 CB ILE A 42 32.903 33.196 38.167 1.00 6.69 C ATOM 594 CG1 ILE A 42 31.466 32.868 38.565 1.00 6.98 C ATOM 595 CG2 ILE A 42 33.501 32.054 37.302 1.00 9.19 C ATOM 596 CD1 ILE A 42 30.463 33.021 37.406 1.00 8.88 C ATOM 597 HA ILE A 42 33.809 32.636 40.026 1.00 0.00 H ATOM 598 HB ILE A 42 32.852 34.114 37.581 1.00 0.00 H ATOM 599 HG12 ILE A 42 31.431 31.838 38.919 1.00 0.00 H ATOM 600 HG13 ILE A 42 31.168 33.538 39.371 1.00 0.00 H ATOM 601 HD11 ILE A 42 30.478 34.050 37.047 1.00 0.00 H ATOM 602 HD12 ILE A 42 30.742 32.348 36.595 1.00 0.00 H ATOM 603 HD13 ILE A 42 29.462 32.773 37.758 1.00 0.00 H ATOM 604 HG21 ILE A 42 34.480 32.356 36.929 1.00 0.00 H ATOM 605 HG22 ILE A 42 33.604 31.155 37.910 1.00 0.00 H ATOM 606 HG23 ILE A 42 32.838 31.851 36.461 1.00 0.00 H ATOM 607 H ILE A 42 32.579 35.218 39.760 1.00 0.00 H ATOM 608 N LYS A 43 35.543 34.898 38.351 1.00 6.96 N ATOM 609 CA LYS A 43 36.884 35.256 37.909 1.00 6.86 C ATOM 610 C LYS A 43 37.847 35.137 39.078 1.00 7.36 C ATOM 611 O LYS A 43 38.958 34.579 38.867 1.00 8.23 O ATOM 612 CB LYS A 43 36.826 36.661 37.319 1.00 7.24 C ATOM 613 CG LYS A 43 38.147 37.237 36.807 1.00 8.02 C ATOM 614 CD LYS A 43 39.061 37.824 37.897 1.00 8.94 C ATOM 615 CE LYS A 43 40.057 38.832 37.378 1.00 8.29 C ATOM 616 NZ LYS A 43 41.148 38.172 36.580 1.00 9.34 N ATOM 617 HA LYS A 43 37.251 34.582 37.135 1.00 0.00 H ATOM 618 HB2 LYS A 43 36.126 36.642 36.484 1.00 0.00 H ATOM 619 HB3 LYS A 43 36.449 37.331 38.092 1.00 0.00 H ATOM 620 HG2 LYS A 43 38.691 36.440 36.301 1.00 0.00 H ATOM 621 HG3 LYS A 43 37.918 38.029 36.094 1.00 0.00 H ATOM 622 HD2 LYS A 43 38.435 38.312 38.645 1.00 0.00 H ATOM 623 HD3 LYS A 43 39.610 37.006 38.363 1.00 0.00 H ATOM 624 HE2 LYS A 43 40.504 39.356 38.223 1.00 0.00 H ATOM 625 HE3 LYS A 43 39.537 39.548 36.742 1.00 0.00 H ATOM 626 HZ1 LYS A 43 41.653 37.491 37.182 1.00 0.00 H ATOM 627 HZ2 LYS A 43 40.730 37.675 35.768 1.00 0.00 H ATOM 628 HZ3 LYS A 43 41.813 38.895 36.240 1.00 0.00 H ATOM 629 H LYS A 43 34.777 35.592 38.233 1.00 0.00 H ATOM 630 N LYS A 44 37.569 35.721 40.208 1.00 7.05 N ATOM 631 CA LYS A 44 38.485 35.740 41.316 1.00 8.81 C ATOM 632 C LYS A 44 38.749 34.321 41.837 1.00 8.29 C ATOM 633 O LYS A 44 39.880 33.955 42.161 1.00 9.86 O ATOM 634 CB LYS A 44 37.939 36.641 42.441 1.00 9.81 C ATOM 635 CG LYS A 44 38.025 38.111 42.094 1.00 11.03 C ATOM 636 CD LYS A 44 37.288 39.001 43.102 1.00 12.55 C ATOM 637 CE LYS A 44 37.410 40.449 42.746 1.00 16.50 C ATOM 638 NZ LYS A 44 38.810 41.026 42.801 1.00 18.77 N ATOM 639 HA LYS A 44 39.434 36.149 40.970 1.00 0.00 H ATOM 640 HB2 LYS A 44 36.895 36.384 42.621 1.00 0.00 H ATOM 641 HB3 LYS A 44 38.518 36.460 43.347 1.00 0.00 H ATOM 642 HG2 LYS A 44 39.075 38.404 42.072 1.00 0.00 H ATOM 643 HG3 LYS A 44 37.586 38.263 41.108 1.00 0.00 H ATOM 644 HD2 LYS A 44 36.233 38.726 43.113 1.00 0.00 H ATOM 645 HD3 LYS A 44 37.714 38.842 44.093 1.00 0.00 H ATOM 646 HE2 LYS A 44 36.786 41.017 43.436 1.00 0.00 H ATOM 647 HE3 LYS A 44 37.035 40.577 41.731 1.00 0.00 H ATOM 648 HZ1 LYS A 44 39.185 40.931 43.766 1.00 0.00 H ATOM 649 HZ2 LYS A 44 39.422 40.510 42.137 1.00 0.00 H ATOM 650 HZ3 LYS A 44 38.780 42.031 42.537 1.00 0.00 H ATOM 651 H LYS A 44 36.648 36.192 40.313 1.00 0.00 H ATOM 652 N GLU A 45 37.705 33.487 41.901 1.00 8.55 N ATOM 653 CA GLU A 45 37.887 32.116 42.381 1.00 9.85 C ATOM 654 C GLU A 45 38.762 31.332 41.405 1.00 9.30 C ATOM 655 O GLU A 45 39.630 30.566 41.801 1.00 10.47 O ATOM 656 CB GLU A 45 36.576 31.394 42.659 1.00 11.44 C ATOM 657 CG GLU A 45 35.742 31.957 43.768 1.00 12.70 C ATOM 658 CD GLU A 45 36.157 31.730 45.197 1.00 19.16 C ATOM 659 OE1 GLU A 45 37.288 31.245 45.595 1.00 24.73 O ATOM 660 OE2 GLU A 45 35.186 32.011 45.915 1.00 14.26 O ATOM 661 HA GLU A 45 38.394 32.179 43.344 1.00 0.00 H ATOM 662 HB2 GLU A 45 35.980 31.420 41.747 1.00 0.00 H ATOM 663 HB3 GLU A 45 36.811 30.359 42.909 1.00 0.00 H ATOM 664 HG2 GLU A 45 35.700 33.036 43.617 1.00 0.00 H ATOM 665 HG3 GLU A 45 34.742 31.537 43.658 1.00 0.00 H ATOM 666 H GLU A 45 36.762 33.813 41.609 1.00 0.00 H ATOM 667 N PHE A 46 38.584 31.529 40.108 1.00 8.38 N ATOM 668 CA PHE A 46 39.392 30.831 39.113 1.00 9.10 C ATOM 669 C PHE A 46 40.839 31.324 39.105 1.00 9.07 C ATOM 670 O PHE A 46 41.749 30.528 38.987 1.00 9.94 O ATOM 671 CB PHE A 46 38.721 30.888 37.717 1.00 8.80 C ATOM 672 CG PHE A 46 37.840 29.669 37.483 1.00 7.85 C ATOM 673 CD1 PHE A 46 36.784 29.346 38.328 1.00 10.29 C ATOM 674 CD2 PHE A 46 38.129 28.787 36.445 1.00 8.28 C ATOM 675 CE1 PHE A 46 36.104 28.161 38.126 1.00 10.18 C ATOM 676 CE2 PHE A 46 37.431 27.641 36.276 1.00 9.40 C ATOM 677 CZ PHE A 46 36.396 27.357 37.131 1.00 9.32 C ATOM 678 HA PHE A 46 39.442 29.779 39.395 1.00 0.00 H ATOM 679 HB2 PHE A 46 38.109 31.788 37.652 1.00 0.00 H ATOM 680 HB3 PHE A 46 39.495 30.921 36.950 1.00 0.00 H ATOM 681 HD2 PHE A 46 38.936 29.026 35.753 1.00 0.00 H ATOM 682 HE2 PHE A 46 37.687 26.952 35.471 1.00 0.00 H ATOM 683 HZ PHE A 46 35.808 26.451 36.982 1.00 0.00 H ATOM 684 HE1 PHE A 46 35.303 27.886 38.812 1.00 0.00 H ATOM 685 HD1 PHE A 46 36.497 30.018 39.137 1.00 0.00 H ATOM 686 H PHE A 46 37.852 32.196 39.791 1.00 0.00 H ATOM 687 N ASP A 47 41.098 32.618 39.257 1.00 8.82 N ATOM 688 CA ASP A 47 42.472 33.105 39.410 1.00 8.95 C ATOM 689 C ASP A 47 43.127 32.396 40.604 1.00 10.43 C ATOM 690 O ASP A 47 44.299 32.052 40.541 1.00 12.87 O ATOM 691 CB ASP A 47 42.519 34.643 39.634 1.00 9.76 C ATOM 692 CG ASP A 47 42.417 35.482 38.373 1.00 9.16 C ATOM 693 OD1 ASP A 47 42.434 34.938 37.281 1.00 9.14 O ATOM 694 OD2 ASP A 47 42.342 36.731 38.573 1.00 11.87 O ATOM 695 HA ASP A 47 43.013 32.885 38.490 1.00 0.00 H ATOM 696 HB2 ASP A 47 41.691 34.914 40.288 1.00 0.00 H ATOM 697 HB3 ASP A 47 43.462 34.884 40.125 1.00 0.00 H ATOM 698 H ASP A 47 40.311 33.298 39.268 1.00 0.00 H ATOM 699 N LYS A 48 42.398 32.270 41.705 1.00 11.43 N ATOM 700 CA LYS A 48 42.982 31.701 42.908 1.00 13.55 C ATOM 701 C LYS A 48 43.285 30.230 42.690 1.00 12.96 C ATOM 702 O LYS A 48 44.342 29.740 43.105 1.00 16.69 O ATOM 703 CB LYS A 48 42.006 31.846 44.081 1.00 15.27 C ATOM 704 CG LYS A 48 42.450 31.343 45.401 1.00 20.91 C ATOM 705 CD LYS A 48 41.383 31.611 46.447 1.00 26.91 C ATOM 706 HA LYS A 48 43.906 32.233 43.135 1.00 0.00 H ATOM 707 HB2 LYS A 48 41.784 32.907 44.193 1.00 0.00 H ATOM 708 HB3 LYS A 48 41.094 31.311 43.816 1.00 0.00 H ATOM 709 HG2 LYS A 48 42.630 30.270 45.336 1.00 0.00 H ATOM 710 HG3 LYS A 48 43.372 31.848 45.688 1.00 0.00 H ATOM 711 HD2 LYS A 48 41.203 32.684 46.514 1.00 0.00 H ATOM 712 HD3 LYS A 48 40.461 31.104 46.162 1.00 0.00 H ATOM 713 H LYS A 48 41.405 32.579 41.707 1.00 0.00 H ATOM 714 N LYS A 49 42.375 29.477 42.119 1.00 13.65 N ATOM 715 CA LYS A 49 42.516 28.031 42.058 1.00 13.99 C ATOM 716 C LYS A 49 43.342 27.574 40.881 1.00 13.60 C ATOM 717 O LYS A 49 44.020 26.540 40.953 1.00 16.63 O ATOM 718 CB LYS A 49 41.131 27.429 41.862 1.00 14.85 C ATOM 719 CG LYS A 49 40.244 27.423 43.042 1.00 18.18 C ATOM 720 CD LYS A 49 38.822 26.803 42.624 1.00 17.45 C ATOM 721 CE LYS A 49 37.997 26.526 43.778 1.00 21.99 C ATOM 722 NZ LYS A 49 36.840 25.936 43.151 1.00 18.73 N ATOM 723 HA LYS A 49 43.004 27.716 42.980 1.00 0.00 H ATOM 724 HB2 LYS A 49 40.632 27.994 41.075 1.00 0.00 H ATOM 725 HB3 LYS A 49 41.261 26.396 41.539 1.00 0.00 H ATOM 726 HG2 LYS A 49 40.689 26.817 43.831 1.00 0.00 H ATOM 727 HG3 LYS A 49 40.107 28.443 43.402 1.00 0.00 H ATOM 728 HD2 LYS A 49 38.302 27.513 41.981 1.00 0.00 H ATOM 729 HD3 LYS A 49 38.988 25.874 42.078 1.00 0.00 H ATOM 730 HE2 LYS A 49 37.740 27.439 44.316 1.00 0.00 H ATOM 731 HE3 LYS A 49 38.483 25.828 44.460 1.00 0.00 H ATOM 732 HZ1 LYS A 49 36.417 26.621 42.492 1.00 0.00 H ATOM 733 HZ2 LYS A 49 37.127 25.083 42.630 1.00 0.00 H ATOM 734 HZ3 LYS A 49 36.144 25.681 43.881 1.00 0.00 H ATOM 735 H LYS A 49 41.534 29.924 41.701 1.00 0.00 H ATOM 736 N TYR A 50 43.286 28.289 39.764 1.00 12.32 N ATOM 737 CA TYR A 50 43.874 27.801 38.537 1.00 12.93 C ATOM 738 C TYR A 50 44.883 28.768 37.941 1.00 14.50 C ATOM 739 O TYR A 50 45.307 28.562 36.764 1.00 18.16 O ATOM 740 CB TYR A 50 42.781 27.519 37.507 1.00 13.29 C ATOM 741 CG TYR A 50 41.781 26.514 37.999 1.00 11.00 C ATOM 742 CD1 TYR A 50 42.165 25.202 38.267 1.00 12.43 C ATOM 743 CD2 TYR A 50 40.434 26.861 38.191 1.00 13.44 C ATOM 744 CE1 TYR A 50 41.234 24.280 38.719 1.00 15.35 C ATOM 745 CE2 TYR A 50 39.550 25.958 38.642 1.00 13.22 C ATOM 746 CZ TYR A 50 39.921 24.674 38.944 1.00 14.23 C ATOM 747 OH TYR A 50 38.981 23.751 39.372 1.00 19.42 O ATOM 748 HA TYR A 50 44.406 26.884 38.790 1.00 0.00 H ATOM 749 HB3 TYR A 50 43.245 27.136 36.598 1.00 0.00 H ATOM 750 HB2 TYR A 50 42.261 28.451 37.283 1.00 0.00 H ATOM 751 HD2 TYR A 50 40.103 27.876 37.971 1.00 0.00 H ATOM 752 HE2 TYR A 50 38.509 26.254 38.772 1.00 0.00 H ATOM 753 HE1 TYR A 50 41.532 23.247 38.898 1.00 0.00 H ATOM 754 HD1 TYR A 50 43.202 24.899 38.121 1.00 0.00 H ATOM 755 HH TYR A 50 38.558 24.075 40.206 1.00 0.00 H ATOM 756 H TYR A 50 42.812 29.215 39.772 1.00 0.00 H ATOM 757 N ASN A 51 45.291 29.769 38.728 1.00 13.02 N ATOM 758 CA ASN A 51 46.296 30.807 38.461 1.00 13.07 C ATOM 759 C ASN A 51 45.671 31.882 37.557 1.00 12.27 C ATOM 760 O ASN A 51 44.767 31.601 36.707 1.00 12.48 O ATOM 761 CB ASN A 51 47.566 30.233 37.825 1.00 16.00 C ATOM 762 CG ASN A 51 48.172 29.182 38.683 1.00 21.83 C ATOM 763 OD1 ASN A 51 48.512 28.073 38.229 1.00 31.43 O ATOM 764 ND2 ASN A 51 48.314 29.527 39.938 1.00 22.93 N ATOM 765 HA ASN A 51 46.598 31.248 39.411 1.00 0.00 H ATOM 766 HB2 ASN A 51 47.314 29.800 36.857 1.00 0.00 H ATOM 767 HB3 ASN A 51 48.288 31.037 37.685 1.00 0.00 H ATOM 768 HD22 ASN A 51 48.010 30.469 40.256 1.00 0.00 H ATOM 769 HD21 ASN A 51 48.731 28.859 40.617 1.00 0.00 H ATOM 770 H ASN A 51 44.833 29.820 39.660 1.00 0.00 H ATOM 771 N PRO A 52 46.165 33.113 37.639 1.00 12.24 N ATOM 772 CA PRO A 52 45.691 34.124 36.706 1.00 12.04 C ATOM 773 C PRO A 52 46.097 33.840 35.270 1.00 12.00 C ATOM 774 O PRO A 52 47.029 33.060 35.015 1.00 14.27 O ATOM 775 CB PRO A 52 46.310 35.438 37.197 1.00 15.07 C ATOM 776 CG PRO A 52 47.060 35.072 38.463 1.00 18.03 C ATOM 777 CD PRO A 52 47.042 33.665 38.703 1.00 13.89 C ATOM 778 HA PRO A 52 44.601 34.151 36.688 1.00 0.00 H ATOM 779 HD3 PRO A 52 48.047 33.249 38.628 1.00 0.00 H ATOM 780 HD2 PRO A 52 46.633 33.448 39.690 1.00 0.00 H ATOM 781 HG3 PRO A 52 46.595 35.580 39.308 1.00 0.00 H ATOM 782 HG2 PRO A 52 48.095 35.401 38.368 1.00 0.00 H ATOM 783 HB2 PRO A 52 46.993 35.842 36.450 1.00 0.00 H ATOM 784 HB3 PRO A 52 45.532 36.171 37.411 1.00 0.00 H ATOM 785 N THR A 53 45.459 34.394 34.251 1.00 10.67 N ATOM 786 CA THR A 53 44.493 35.499 34.359 1.00 10.03 C ATOM 787 C THR A 53 43.174 35.104 33.671 1.00 8.38 C ATOM 788 O THR A 53 43.187 34.877 32.479 1.00 9.06 O ATOM 789 CB THR A 53 45.050 36.764 33.682 1.00 10.47 C ATOM 790 OG1 THR A 53 46.347 37.057 34.236 1.00 13.83 O ATOM 791 CG2 THR A 53 44.119 37.927 33.922 1.00 12.95 C ATOM 792 HA THR A 53 44.316 35.703 35.415 1.00 0.00 H ATOM 793 HB THR A 53 45.136 36.598 32.608 1.00 0.00 H ATOM 794 HG1 THR A 53 46.955 36.293 34.071 1.00 0.00 H ATOM 795 HG23 THR A 53 43.140 37.700 33.501 1.00 0.00 H ATOM 796 HG21 THR A 53 44.024 38.099 34.994 1.00 0.00 H ATOM 797 HG22 THR A 53 44.523 38.819 33.444 1.00 0.00 H ATOM 798 H THR A 53 45.656 34.020 33.301 1.00 0.00 H ATOM 799 N TRP A 54 42.101 35.038 34.431 1.00 7.86 N ATOM 800 CA TRP A 54 40.788 34.723 33.928 1.00 7.13 C ATOM 801 C TRP A 54 39.955 35.989 33.705 1.00 6.84 C ATOM 802 O TRP A 54 40.213 37.037 34.278 1.00 7.38 O ATOM 803 CB TRP A 54 40.058 33.775 34.885 1.00 7.77 C ATOM 804 CG TRP A 54 40.771 32.429 34.974 1.00 7.45 C ATOM 805 CD1 TRP A 54 41.808 32.143 35.763 1.00 9.22 C ATOM 806 CD2 TRP A 54 40.411 31.213 34.318 1.00 7.60 C ATOM 807 NE1 TRP A 54 42.185 30.833 35.591 1.00 9.83 N ATOM 808 CE2 TRP A 54 41.335 30.234 34.714 1.00 7.40 C ATOM 809 CE3 TRP A 54 39.387 30.869 33.415 1.00 7.08 C ATOM 810 CZ2 TRP A 54 41.245 28.953 34.258 1.00 9.32 C ATOM 811 CZ3 TRP A 54 39.333 29.594 32.927 1.00 7.86 C ATOM 812 CH2 TRP A 54 40.201 28.630 33.386 1.00 8.92 C ATOM 813 HA TRP A 54 40.915 34.227 32.965 1.00 0.00 H ATOM 814 HB2 TRP A 54 40.024 34.226 35.877 1.00 0.00 H ATOM 815 HB3 TRP A 54 39.042 33.617 34.524 1.00 0.00 H ATOM 816 HE1 TRP A 54 42.992 30.372 36.057 1.00 0.00 H ATOM 817 HD1 TRP A 54 42.286 32.846 36.445 1.00 0.00 H ATOM 818 HZ2 TRP A 54 41.969 28.199 34.566 1.00 0.00 H ATOM 819 HH2 TRP A 54 40.072 27.597 33.064 1.00 0.00 H ATOM 820 HZ3 TRP A 54 38.595 29.338 32.167 1.00 0.00 H ATOM 821 HE3 TRP A 54 38.648 31.609 33.110 1.00 0.00 H ATOM 822 H TRP A 54 42.207 35.223 35.449 1.00 0.00 H ATOM 823 N HIS A 55 38.930 35.818 32.902 1.00 6.07 N ATOM 824 CA HIS A 55 37.995 36.879 32.523 1.00 6.25 C ATOM 825 C HIS A 55 36.615 36.270 32.459 1.00 5.56 C ATOM 826 O HIS A 55 36.481 35.154 31.996 1.00 6.46 O ATOM 827 CB HIS A 55 38.373 37.442 31.164 1.00 7.01 C ATOM 828 CG HIS A 55 39.829 37.738 31.021 1.00 7.09 C ATOM 829 ND1 HIS A 55 40.449 38.897 31.481 1.00 8.88 N ATOM 830 CD2 HIS A 55 40.786 36.952 30.501 1.00 7.58 C ATOM 831 CE1 HIS A 55 41.736 38.785 31.226 1.00 8.08 C ATOM 832 NE2 HIS A 55 41.970 37.635 30.616 1.00 9.52 N ATOM 833 HA HIS A 55 38.023 37.691 33.250 1.00 0.00 H ATOM 834 HB2 HIS A 55 38.092 36.716 30.400 1.00 0.00 H ATOM 835 HB3 HIS A 55 37.817 38.366 31.007 1.00 0.00 H ATOM 836 HD2 HIS A 55 40.648 35.960 30.070 1.00 0.00 H ATOM 837 HE1 HIS A 55 42.493 39.527 31.479 1.00 0.00 H ATOM 838 H HIS A 55 38.772 34.868 32.510 1.00 0.00 H ATOM 839 N CYS A 56 35.601 36.968 32.930 1.00 5.79 N ATOM 840 CA CYS A 56 34.263 36.420 33.013 1.00 5.38 C ATOM 841 C CYS A 56 33.231 37.424 32.579 1.00 5.49 C ATOM 842 O CYS A 56 33.261 38.571 33.043 1.00 6.26 O ATOM 843 CB CYS A 56 33.999 35.863 34.417 1.00 6.77 C ATOM 844 SG CYS A 56 32.468 34.961 34.590 1.00 7.05 S ATOM 845 HA CYS A 56 34.183 35.585 32.317 1.00 0.00 H ATOM 846 HB2 CYS A 56 33.981 36.699 35.116 1.00 0.00 H ATOM 847 HB3 CYS A 56 34.819 35.193 34.676 1.00 0.00 H ATOM 848 HG CYS A 56 32.344 34.513 35.889 1.00 0.00 H ATOM 849 H CYS A 56 35.767 37.943 33.252 1.00 0.00 H ATOM 850 N ILE A 57 32.303 36.969 31.736 1.00 5.41 N ATOM 851 CA ILE A 57 31.161 37.746 31.289 1.00 5.13 C ATOM 852 C ILE A 57 29.918 36.982 31.694 1.00 5.67 C ATOM 853 O ILE A 57 29.825 35.768 31.432 1.00 6.88 O ATOM 854 CB ILE A 57 31.146 37.975 29.755 1.00 7.22 C ATOM 855 CG1 ILE A 57 32.483 38.393 29.212 1.00 9.67 C ATOM 856 CG2 ILE A 57 29.979 38.851 29.337 1.00 8.67 C ATOM 857 CD1 ILE A 57 33.013 39.683 29.784 1.00 10.72 C ATOM 858 HA ILE A 57 31.210 38.734 31.747 1.00 0.00 H ATOM 859 HB ILE A 57 30.968 37.012 29.276 1.00 0.00 H ATOM 860 HG12 ILE A 57 33.202 37.603 29.430 1.00 0.00 H ATOM 861 HG13 ILE A 57 32.391 38.511 28.132 1.00 0.00 H ATOM 862 HD11 ILE A 57 32.314 40.490 29.565 1.00 0.00 H ATOM 863 HD12 ILE A 57 33.126 39.581 30.863 1.00 0.00 H ATOM 864 HD13 ILE A 57 33.981 39.907 29.336 1.00 0.00 H ATOM 865 HG21 ILE A 57 29.044 38.370 29.625 1.00 0.00 H ATOM 866 HG22 ILE A 57 30.058 39.819 29.831 1.00 0.00 H ATOM 867 HG23 ILE A 57 30.000 38.990 28.256 1.00 0.00 H ATOM 868 H ILE A 57 32.404 35.998 31.377 1.00 0.00 H ATOM 869 N VAL A 58 28.919 37.670 32.251 1.00 5.88 N ATOM 870 CA VAL A 58 27.681 37.108 32.694 1.00 6.24 C ATOM 871 C VAL A 58 26.544 37.952 32.147 1.00 6.39 C ATOM 872 O VAL A 58 26.488 39.138 32.400 1.00 6.66 O ATOM 873 CB VAL A 58 27.610 37.048 34.239 1.00 6.24 C ATOM 874 CG1 VAL A 58 26.187 36.552 34.726 1.00 7.67 C ATOM 875 CG2 VAL A 58 28.712 36.142 34.781 1.00 7.46 C ATOM 876 HA VAL A 58 27.601 36.085 32.325 1.00 0.00 H ATOM 877 HB VAL A 58 27.761 38.055 34.628 1.00 0.00 H ATOM 878 HG11 VAL A 58 25.422 37.240 34.368 1.00 0.00 H ATOM 879 HG12 VAL A 58 25.996 35.555 34.329 1.00 0.00 H ATOM 880 HG13 VAL A 58 26.168 36.520 35.815 1.00 0.00 H ATOM 881 HG21 VAL A 58 28.586 35.137 34.378 1.00 0.00 H ATOM 882 HG22 VAL A 58 29.684 36.535 34.482 1.00 0.00 H ATOM 883 HG23 VAL A 58 28.651 36.109 35.869 1.00 0.00 H ATOM 884 H VAL A 58 29.051 38.694 32.372 1.00 0.00 H ATOM 885 N GLY A 59 25.605 37.357 31.369 1.00 6.82 N ATOM 886 CA GLY A 59 24.574 38.213 30.835 1.00 7.80 C ATOM 887 C GLY A 59 23.532 37.461 30.049 1.00 8.11 C ATOM 888 O GLY A 59 23.660 36.316 29.727 1.00 8.92 O ATOM 889 HA3 GLY A 59 25.039 38.950 30.180 1.00 0.00 H ATOM 890 HA2 GLY A 59 24.083 38.724 31.663 1.00 0.00 H ATOM 891 H GLY A 59 25.627 36.337 31.168 1.00 0.00 H ATOM 892 N ARG A 60 22.462 38.192 29.713 1.00 8.68 N ATOM 893 CA ARG A 60 21.401 37.650 28.903 1.00 9.64 C ATOM 894 C ARG A 60 21.460 37.994 27.416 1.00 9.52 C ATOM 895 O ARG A 60 20.804 37.367 26.611 1.00 12.11 O ATOM 896 CB ARG A 60 20.067 38.105 29.484 1.00 11.37 C ATOM 897 CG ARG A 60 19.755 37.585 30.884 1.00 13.30 C ATOM 898 CD ARG A 60 18.377 38.240 31.478 1.00 20.17 C ATOM 899 NE ARG A 60 18.200 37.684 32.824 1.00 26.59 N ATOM 900 CZ ARG A 60 17.346 36.707 33.134 1.00 30.89 C ATOM 901 NH1 ARG A 60 16.530 36.227 32.207 1.00 33.27 N ATOM 902 NH2 ARG A 60 17.313 36.246 34.397 1.00 34.55 N ATOM 903 HA ARG A 60 21.521 36.567 28.939 1.00 0.00 H ATOM 904 HB2 ARG A 60 20.070 39.194 29.522 1.00 0.00 H ATOM 905 HB3 ARG A 60 19.275 37.768 28.815 1.00 0.00 H ATOM 906 HG2 ARG A 60 19.642 36.502 30.842 1.00 0.00 H ATOM 907 HG3 ARG A 60 20.582 37.838 31.548 1.00 0.00 H ATOM 908 HD2 ARG A 60 17.530 37.974 30.846 1.00 0.00 H ATOM 909 HD3 ARG A 60 18.466 39.325 31.527 1.00 0.00 H ATOM 910 HE ARG A 60 18.781 38.079 33.591 1.00 0.00 H ATOM 911 HH12 ARG A 60 15.863 35.465 32.445 1.00 0.00 H ATOM 912 HH11 ARG A 60 16.556 36.612 31.241 1.00 0.00 H ATOM 913 HH22 ARG A 60 16.653 35.485 34.656 1.00 0.00 H ATOM 914 HH21 ARG A 60 17.947 36.651 35.115 1.00 0.00 H ATOM 915 H ARG A 60 22.395 39.175 30.045 1.00 0.00 H ATOM 916 N ASN A 61 22.230 39.027 27.062 1.00 8.69 N ATOM 917 CA ASN A 61 22.319 39.449 25.657 1.00 9.12 C ATOM 918 C ASN A 61 23.705 39.982 25.349 1.00 9.14 C ATOM 919 O ASN A 61 24.074 41.129 25.707 1.00 9.95 O ATOM 920 CB ASN A 61 21.275 40.491 25.263 1.00 11.24 C ATOM 921 CG ASN A 61 21.391 40.866 23.823 1.00 12.93 C ATOM 922 OD1 ASN A 61 21.993 41.900 23.492 1.00 12.48 O ATOM 923 ND2 ASN A 61 21.038 39.950 22.926 1.00 15.75 N ATOM 924 HA ASN A 61 22.116 38.556 25.065 1.00 0.00 H ATOM 925 HB2 ASN A 61 20.281 40.082 25.444 1.00 0.00 H ATOM 926 HB3 ASN A 61 21.416 41.383 25.874 1.00 0.00 H ATOM 927 HD22 ASN A 61 20.534 39.092 23.229 1.00 0.00 H ATOM 928 HD21 ASN A 61 21.266 40.091 21.921 1.00 0.00 H ATOM 929 H ASN A 61 22.772 39.538 27.788 1.00 0.00 H ATOM 930 N PHE A 62 24.527 39.136 24.733 1.00 9.22 N ATOM 931 CA PHE A 62 25.847 39.538 24.306 1.00 8.22 C ATOM 932 C PHE A 62 26.428 38.537 23.327 1.00 8.10 C ATOM 933 O PHE A 62 26.107 37.336 23.344 1.00 8.75 O ATOM 934 CB PHE A 62 26.871 39.742 25.464 1.00 7.48 C ATOM 935 CG PHE A 62 27.267 38.536 26.226 1.00 8.19 C ATOM 936 CD1 PHE A 62 28.440 37.851 25.883 1.00 9.49 C ATOM 937 CD2 PHE A 62 26.501 38.032 27.295 1.00 8.66 C ATOM 938 CE1 PHE A 62 28.808 36.717 26.569 1.00 8.95 C ATOM 939 CE2 PHE A 62 26.890 36.886 27.964 1.00 9.25 C ATOM 940 CZ PHE A 62 28.059 36.235 27.576 1.00 9.30 C ATOM 941 HA PHE A 62 25.695 40.509 23.834 1.00 0.00 H ATOM 942 HB2 PHE A 62 27.775 40.172 25.033 1.00 0.00 H ATOM 943 HB3 PHE A 62 26.435 40.449 26.169 1.00 0.00 H ATOM 944 HD2 PHE A 62 25.592 38.551 27.598 1.00 0.00 H ATOM 945 HE2 PHE A 62 26.289 36.496 28.786 1.00 0.00 H ATOM 946 HZ PHE A 62 28.369 35.327 28.093 1.00 0.00 H ATOM 947 HE1 PHE A 62 29.726 36.199 26.291 1.00 0.00 H ATOM 948 HD1 PHE A 62 29.064 38.219 25.068 1.00 0.00 H ATOM 949 H PHE A 62 24.211 38.161 24.555 1.00 0.00 H ATOM 950 N GLY A 63 27.304 39.057 22.480 1.00 7.79 N ATOM 951 CA GLY A 63 28.223 38.254 21.686 1.00 8.51 C ATOM 952 C GLY A 63 29.632 38.555 22.059 1.00 8.18 C ATOM 953 O GLY A 63 29.937 39.628 22.612 1.00 9.61 O ATOM 954 HA3 GLY A 63 28.075 38.478 20.630 1.00 0.00 H ATOM 955 HA2 GLY A 63 28.022 37.197 21.863 1.00 0.00 H ATOM 956 H GLY A 63 27.337 40.091 22.377 1.00 0.00 H ATOM 957 N SER A 64 30.518 37.611 21.756 1.00 8.45 N ATOM 958 CA SER A 64 31.924 37.761 22.109 1.00 8.69 C ATOM 959 C SER A 64 32.815 37.270 21.008 1.00 8.36 C ATOM 960 O SER A 64 32.407 36.373 20.262 1.00 9.32 O ATOM 961 CB SER A 64 32.269 37.013 23.391 1.00 9.89 C ATOM 962 OG SER A 64 32.258 35.630 23.205 1.00 11.55 O ATOM 963 HA SER A 64 32.091 38.827 22.266 1.00 0.00 H ATOM 964 HB2 SER A 64 31.539 37.272 24.158 1.00 0.00 H ATOM 965 HB3 SER A 64 33.263 37.317 23.720 1.00 0.00 H ATOM 966 HG SER A 64 31.356 35.345 22.912 1.00 0.00 H ATOM 967 H SER A 64 30.203 36.753 21.260 1.00 0.00 H ATOM 968 N TYR A 65 34.051 37.752 21.046 1.00 7.76 N ATOM 969 CA TYR A 65 35.104 37.167 20.266 1.00 9.24 C ATOM 970 C TYR A 65 36.398 37.370 20.999 1.00 8.31 C ATOM 971 O TYR A 65 36.795 38.517 21.271 1.00 8.95 O ATOM 972 CB TYR A 65 35.133 37.727 18.819 1.00 9.58 C ATOM 973 CG TYR A 65 35.888 36.812 17.877 1.00 11.11 C ATOM 974 CD1 TYR A 65 35.291 35.708 17.327 1.00 12.14 C ATOM 975 CD2 TYR A 65 37.197 37.070 17.518 1.00 12.98 C ATOM 976 CE1 TYR A 65 35.983 34.843 16.470 1.00 15.30 C ATOM 977 CE2 TYR A 65 37.893 36.232 16.648 1.00 14.78 C ATOM 978 CZ TYR A 65 37.276 35.124 16.145 1.00 17.21 C ATOM 979 OH TYR A 65 37.971 34.311 15.258 1.00 21.71 O ATOM 980 HA TYR A 65 34.930 36.097 20.148 1.00 0.00 H ATOM 981 HB3 TYR A 65 35.618 38.703 18.828 1.00 0.00 H ATOM 982 HB2 TYR A 65 34.109 37.835 18.461 1.00 0.00 H ATOM 983 HD2 TYR A 65 37.697 37.949 17.924 1.00 0.00 H ATOM 984 HE2 TYR A 65 38.922 36.460 16.372 1.00 0.00 H ATOM 985 HE1 TYR A 65 35.493 33.956 16.068 1.00 0.00 H ATOM 986 HD1 TYR A 65 34.248 35.497 17.563 1.00 0.00 H ATOM 987 HH TYR A 65 37.394 33.554 14.985 1.00 0.00 H ATOM 988 H TYR A 65 34.261 38.570 21.653 1.00 0.00 H ATOM 989 N VAL A 66 36.985 36.241 21.472 1.00 9.23 N ATOM 990 CA VAL A 66 38.040 36.271 22.409 1.00 9.31 C ATOM 991 C VAL A 66 39.113 35.286 21.997 1.00 9.75 C ATOM 992 O VAL A 66 38.889 34.449 21.132 1.00 12.31 O ATOM 993 CB VAL A 66 37.573 35.982 23.889 1.00 9.57 C ATOM 994 CG1 VAL A 66 36.387 36.847 24.264 1.00 10.09 C ATOM 995 CG2 VAL A 66 37.272 34.467 24.061 1.00 12.37 C ATOM 996 HA VAL A 66 38.437 37.286 22.407 1.00 0.00 H ATOM 997 HB VAL A 66 38.379 36.243 24.575 1.00 0.00 H ATOM 998 HG11 VAL A 66 36.666 37.898 24.184 1.00 0.00 H ATOM 999 HG12 VAL A 66 35.558 36.637 23.588 1.00 0.00 H ATOM 1000 HG13 VAL A 66 36.087 36.626 25.288 1.00 0.00 H ATOM 1001 HG21 VAL A 66 36.482 34.174 23.370 1.00 0.00 H ATOM 1002 HG22 VAL A 66 38.174 33.892 23.849 1.00 0.00 H ATOM 1003 HG23 VAL A 66 36.950 34.276 25.085 1.00 0.00 H ATOM 1004 H VAL A 66 36.644 35.319 21.131 1.00 0.00 H ATOM 1005 N THR A 67 40.273 35.364 22.609 1.00 10.74 N ATOM 1006 CA THR A 67 41.351 34.379 22.416 1.00 11.51 C ATOM 1007 C THR A 67 41.710 33.761 23.737 1.00 11.36 C ATOM 1008 O THR A 67 41.993 34.481 24.687 1.00 17.06 O ATOM 1009 CB THR A 67 42.581 35.005 21.783 1.00 12.83 C ATOM 1010 OG1 THR A 67 42.245 35.603 20.528 1.00 14.76 O ATOM 1011 CG2 THR A 67 43.741 33.977 21.542 1.00 16.96 C ATOM 1012 HA THR A 67 40.987 33.610 21.734 1.00 0.00 H ATOM 1013 HB THR A 67 42.933 35.754 22.492 1.00 0.00 H ATOM 1014 HG1 THR A 67 41.885 34.910 19.919 1.00 0.00 H ATOM 1015 HG23 THR A 67 44.013 33.509 22.488 1.00 0.00 H ATOM 1016 HG21 THR A 67 43.408 33.213 20.840 1.00 0.00 H ATOM 1017 HG22 THR A 67 44.606 34.497 21.131 1.00 0.00 H ATOM 1018 H THR A 67 40.438 36.158 23.260 1.00 0.00 H ATOM 1019 N HIS A 68 41.628 32.452 23.844 1.00 10.79 N ATOM 1020 CA HIS A 68 41.903 31.792 25.093 1.00 10.97 C ATOM 1021 C HIS A 68 43.096 30.859 25.032 1.00 9.96 C ATOM 1022 O HIS A 68 43.491 30.378 23.976 1.00 12.14 O ATOM 1023 CB HIS A 68 40.691 31.002 25.574 1.00 11.53 C ATOM 1024 CG HIS A 68 40.300 29.869 24.676 1.00 12.67 C ATOM 1025 ND1 HIS A 68 40.789 28.600 24.854 1.00 13.23 N ATOM 1026 CD2 HIS A 68 39.564 29.818 23.543 1.00 15.47 C ATOM 1027 CE1 HIS A 68 40.322 27.818 23.886 1.00 12.26 C ATOM 1028 NE2 HIS A 68 39.544 28.526 23.096 1.00 16.20 N ATOM 1029 HA HIS A 68 42.139 32.592 25.795 1.00 0.00 H ATOM 1030 HB2 HIS A 68 40.917 30.595 26.559 1.00 0.00 H ATOM 1031 HB3 HIS A 68 39.845 31.686 25.650 1.00 0.00 H ATOM 1032 HD2 HIS A 68 39.070 30.664 23.066 1.00 0.00 H ATOM 1033 HE1 HIS A 68 40.548 26.758 23.766 1.00 0.00 H ATOM 1034 H HIS A 68 41.360 31.886 23.014 1.00 0.00 H ATOM 1035 N GLU A 69 43.640 30.582 26.205 1.00 10.46 N ATOM 1036 CA GLU A 69 44.619 29.557 26.341 1.00 10.72 C ATOM 1037 C GLU A 69 44.007 28.183 26.190 1.00 10.41 C ATOM 1038 O GLU A 69 42.901 27.946 26.681 1.00 11.12 O ATOM 1039 CB GLU A 69 45.356 29.673 27.652 1.00 11.86 C ATOM 1040 CG GLU A 69 46.075 31.045 27.819 1.00 14.82 C ATOM 1041 CD GLU A 69 46.598 31.339 29.219 1.00 19.33 C ATOM 1042 OE1 GLU A 69 46.743 30.411 30.014 1.00 22.67 O ATOM 1043 OE2 GLU A 69 46.830 32.521 29.532 1.00 18.99 O ATOM 1044 HA GLU A 69 45.341 29.691 25.535 1.00 0.00 H ATOM 1045 HB2 GLU A 69 44.641 29.552 28.466 1.00 0.00 H ATOM 1046 HB3 GLU A 69 46.102 28.880 27.704 1.00 0.00 H ATOM 1047 HG2 GLU A 69 46.920 31.068 27.131 1.00 0.00 H ATOM 1048 HG3 GLU A 69 45.369 31.831 27.551 1.00 0.00 H ATOM 1049 H GLU A 69 43.347 31.123 27.044 1.00 0.00 H ATOM 1050 N THR A 70 44.737 27.262 25.569 1.00 10.47 N ATOM 1051 CA THR A 70 44.284 25.897 25.328 1.00 10.63 C ATOM 1052 C THR A 70 43.771 25.312 26.629 1.00 10.17 C ATOM 1053 O THR A 70 44.425 25.398 27.661 1.00 11.39 O ATOM 1054 CB THR A 70 45.429 25.041 24.722 1.00 11.64 C ATOM 1055 OG1 THR A 70 44.935 23.729 24.569 1.00 14.20 O ATOM 1056 CG2 THR A 70 46.704 25.011 25.595 1.00 15.23 C ATOM 1057 HA THR A 70 43.471 25.898 24.602 1.00 0.00 H ATOM 1058 HB THR A 70 45.724 25.488 23.772 1.00 0.00 H ATOM 1059 HG1 THR A 70 44.152 23.741 23.964 1.00 0.00 H ATOM 1060 HG23 THR A 70 47.086 26.025 25.713 1.00 0.00 H ATOM 1061 HG21 THR A 70 46.463 24.596 26.574 1.00 0.00 H ATOM 1062 HG22 THR A 70 47.459 24.391 25.112 1.00 0.00 H ATOM 1063 H THR A 70 45.685 27.530 25.236 1.00 0.00 H ATOM 1064 N LYS A 71 42.589 24.673 26.559 1.00 9.80 N ATOM 1065 CA LYS A 71 41.989 23.969 27.646 1.00 10.59 C ATOM 1066 C LYS A 71 41.456 24.847 28.757 1.00 10.37 C ATOM 1067 O LYS A 71 41.090 24.380 29.813 1.00 10.85 O ATOM 1068 CB LYS A 71 42.850 22.794 28.101 1.00 13.09 C ATOM 1069 CG LYS A 71 42.809 21.632 27.018 1.00 15.99 C ATOM 1070 CD LYS A 71 41.541 20.847 26.973 1.00 17.60 C ATOM 1071 CE LYS A 71 41.471 19.910 25.758 1.00 23.60 C ATOM 1072 NZ LYS A 71 41.663 20.611 24.420 1.00 26.62 N ATOM 1073 HA LYS A 71 41.072 23.529 27.253 1.00 0.00 H ATOM 1074 HB2 LYS A 71 43.879 23.130 28.230 1.00 0.00 H ATOM 1075 HB3 LYS A 71 42.471 22.416 29.050 1.00 0.00 H ATOM 1076 HG2 LYS A 71 42.963 22.080 26.036 1.00 0.00 H ATOM 1077 HG3 LYS A 71 43.625 20.942 27.233 1.00 0.00 H ATOM 1078 HD2 LYS A 71 41.468 20.248 27.881 1.00 0.00 H ATOM 1079 HD3 LYS A 71 40.702 21.541 26.928 1.00 0.00 H ATOM 1080 HE2 LYS A 71 40.494 19.426 25.754 1.00 0.00 H ATOM 1081 HE3 LYS A 71 42.249 19.154 25.863 1.00 0.00 H ATOM 1082 HZ1 LYS A 71 40.921 21.329 24.297 1.00 0.00 H ATOM 1083 HZ2 LYS A 71 42.597 21.069 24.401 1.00 0.00 H ATOM 1084 HZ3 LYS A 71 41.602 19.912 23.652 1.00 0.00 H ATOM 1085 H LYS A 71 42.079 24.693 25.653 1.00 0.00 H ATOM 1086 N HIS A 72 41.333 26.166 28.456 1.00 8.95 N ATOM 1087 CA HIS A 72 40.787 27.091 29.481 1.00 8.66 C ATOM 1088 C HIS A 72 39.716 28.040 28.912 1.00 7.99 C ATOM 1089 O HIS A 72 39.855 29.275 28.961 1.00 8.99 O ATOM 1090 CB HIS A 72 41.944 27.889 30.056 1.00 9.29 C ATOM 1091 CG HIS A 72 42.926 27.006 30.811 1.00 11.42 C ATOM 1092 ND1 HIS A 72 43.868 26.224 30.190 1.00 15.81 N ATOM 1093 CD2 HIS A 72 42.991 26.684 32.111 1.00 17.00 C ATOM 1094 CE1 HIS A 72 44.523 25.526 31.089 1.00 17.69 C ATOM 1095 NE2 HIS A 72 43.994 25.760 32.275 1.00 18.69 N ATOM 1096 HA HIS A 72 40.294 26.502 30.254 1.00 0.00 H ATOM 1097 HB2 HIS A 72 42.471 28.384 29.240 1.00 0.00 H ATOM 1098 HB3 HIS A 72 41.548 28.640 30.740 1.00 0.00 H ATOM 1099 HD2 HIS A 72 42.357 27.086 32.901 1.00 0.00 H ATOM 1100 HE1 HIS A 72 45.365 24.863 30.889 1.00 0.00 H ATOM 1101 H HIS A 72 41.617 26.523 27.521 1.00 0.00 H ATOM 1102 N PHE A 73 38.624 27.440 28.424 1.00 7.24 N ATOM 1103 CA PHE A 73 37.491 28.172 27.898 1.00 7.00 C ATOM 1104 C PHE A 73 36.225 27.394 28.223 1.00 6.77 C ATOM 1105 O PHE A 73 36.119 26.198 27.920 1.00 7.38 O ATOM 1106 CB PHE A 73 37.618 28.309 26.331 1.00 8.27 C ATOM 1107 CG PHE A 73 36.445 29.023 25.691 1.00 8.61 C ATOM 1108 CD1 PHE A 73 36.514 30.377 25.420 1.00 9.52 C ATOM 1109 CD2 PHE A 73 35.327 28.299 25.293 1.00 9.26 C ATOM 1110 CE1 PHE A 73 35.485 30.994 24.769 1.00 9.10 C ATOM 1111 CE2 PHE A 73 34.253 28.941 24.672 1.00 10.82 C ATOM 1112 CZ PHE A 73 34.345 30.308 24.422 1.00 9.69 C ATOM 1113 HA PHE A 73 37.458 29.167 28.343 1.00 0.00 H ATOM 1114 HB2 PHE A 73 38.527 28.867 26.105 1.00 0.00 H ATOM 1115 HB3 PHE A 73 37.690 27.310 25.902 1.00 0.00 H ATOM 1116 HD2 PHE A 73 35.288 27.224 25.467 1.00 0.00 H ATOM 1117 HE2 PHE A 73 33.361 28.383 24.389 1.00 0.00 H ATOM 1118 HZ PHE A 73 33.514 30.834 23.952 1.00 0.00 H ATOM 1119 HE1 PHE A 73 35.569 32.052 24.519 1.00 0.00 H ATOM 1120 HD1 PHE A 73 37.389 30.951 25.726 1.00 0.00 H ATOM 1121 H PHE A 73 38.587 26.401 28.422 1.00 0.00 H ATOM 1122 N ILE A 74 35.220 28.122 28.686 1.00 6.73 N ATOM 1123 CA ILE A 74 33.885 27.556 28.815 1.00 6.60 C ATOM 1124 C ILE A 74 32.830 28.629 28.573 1.00 7.01 C ATOM 1125 O ILE A 74 32.976 29.788 29.009 1.00 7.52 O ATOM 1126 CB ILE A 74 33.658 26.832 30.182 1.00 6.89 C ATOM 1127 CG1 ILE A 74 32.455 25.936 30.195 1.00 7.76 C ATOM 1128 CG2 ILE A 74 33.715 27.820 31.380 1.00 8.01 C ATOM 1129 CD1 ILE A 74 32.177 25.171 31.524 1.00 10.78 C ATOM 1130 HA ILE A 74 33.788 26.787 28.049 1.00 0.00 H ATOM 1131 HB ILE A 74 34.500 26.151 30.311 1.00 0.00 H ATOM 1132 HG12 ILE A 74 31.581 26.550 29.976 1.00 0.00 H ATOM 1133 HG13 ILE A 74 32.584 25.195 29.406 1.00 0.00 H ATOM 1134 HD11 ILE A 74 33.029 24.533 31.760 1.00 0.00 H ATOM 1135 HD12 ILE A 74 32.025 25.889 32.330 1.00 0.00 H ATOM 1136 HD13 ILE A 74 31.283 24.558 31.409 1.00 0.00 H ATOM 1137 HG21 ILE A 74 34.693 28.301 31.407 1.00 0.00 H ATOM 1138 HG22 ILE A 74 32.940 28.577 31.262 1.00 0.00 H ATOM 1139 HG23 ILE A 74 33.552 27.273 32.309 1.00 0.00 H ATOM 1140 H ILE A 74 35.387 29.111 28.961 1.00 0.00 H ATOM 1141 N TYR A 75 31.737 28.215 27.963 1.00 7.32 N ATOM 1142 CA TYR A 75 30.615 29.048 27.715 1.00 6.65 C ATOM 1143 C TYR A 75 29.366 28.212 28.023 1.00 6.82 C ATOM 1144 O TYR A 75 29.152 27.155 27.425 1.00 8.30 O ATOM 1145 CB TYR A 75 30.591 29.566 26.270 1.00 7.93 C ATOM 1146 CG TYR A 75 29.378 30.370 25.890 1.00 7.53 C ATOM 1147 CD1 TYR A 75 29.041 31.566 26.545 1.00 7.07 C ATOM 1148 CD2 TYR A 75 28.541 29.947 24.872 1.00 8.35 C ATOM 1149 CE1 TYR A 75 27.942 32.293 26.169 1.00 8.16 C ATOM 1150 CE2 TYR A 75 27.394 30.677 24.511 1.00 10.33 C ATOM 1151 CZ TYR A 75 27.091 31.823 25.201 1.00 8.44 C ATOM 1152 OH TYR A 75 26.017 32.593 24.847 1.00 10.73 O ATOM 1153 HA TYR A 75 30.659 29.935 28.347 1.00 0.00 H ATOM 1154 HB3 TYR A 75 30.646 28.705 25.604 1.00 0.00 H ATOM 1155 HB2 TYR A 75 31.470 30.194 26.124 1.00 0.00 H ATOM 1156 HD2 TYR A 75 28.776 29.027 24.337 1.00 0.00 H ATOM 1157 HE2 TYR A 75 26.756 30.337 23.695 1.00 0.00 H ATOM 1158 HE1 TYR A 75 27.742 33.254 26.643 1.00 0.00 H ATOM 1159 HD1 TYR A 75 29.664 31.922 27.366 1.00 0.00 H ATOM 1160 HH TYR A 75 25.189 32.055 24.917 1.00 0.00 H ATOM 1161 H TYR A 75 31.695 27.225 27.647 1.00 0.00 H ATOM 1162 N PHE A 76 28.540 28.664 28.978 1.00 7.30 N ATOM 1163 CA PHE A 76 27.470 27.875 29.474 1.00 7.32 C ATOM 1164 C PHE A 76 26.332 28.759 29.956 1.00 7.26 C ATOM 1165 O PHE A 76 26.547 29.930 30.231 1.00 9.22 O ATOM 1166 CB PHE A 76 27.937 26.894 30.588 1.00 8.13 C ATOM 1167 CG PHE A 76 28.437 27.555 31.854 1.00 8.43 C ATOM 1168 CD1 PHE A 76 27.631 27.546 33.027 1.00 8.79 C ATOM 1169 CD2 PHE A 76 29.725 28.080 31.962 1.00 8.19 C ATOM 1170 CE1 PHE A 76 28.158 28.037 34.206 1.00 9.07 C ATOM 1171 CE2 PHE A 76 30.201 28.551 33.148 1.00 8.23 C ATOM 1172 CZ PHE A 76 29.425 28.546 34.275 1.00 9.00 C ATOM 1173 HA PHE A 76 27.102 27.263 28.650 1.00 0.00 H ATOM 1174 HB2 PHE A 76 27.095 26.254 30.850 1.00 0.00 H ATOM 1175 HB3 PHE A 76 28.744 26.283 30.184 1.00 0.00 H ATOM 1176 HD2 PHE A 76 30.363 28.114 31.079 1.00 0.00 H ATOM 1177 HE2 PHE A 76 31.218 28.939 33.200 1.00 0.00 H ATOM 1178 HZ PHE A 76 29.811 28.942 35.214 1.00 0.00 H ATOM 1179 HE1 PHE A 76 27.546 28.018 35.108 1.00 0.00 H ATOM 1180 HD1 PHE A 76 26.613 27.158 32.996 1.00 0.00 H ATOM 1181 H PHE A 76 28.688 29.618 29.365 1.00 0.00 H ATOM 1182 N TYR A 77 25.150 28.171 30.135 1.00 8.60 N ATOM 1183 CA TYR A 77 24.018 28.845 30.761 1.00 9.13 C ATOM 1184 C TYR A 77 23.754 28.228 32.115 1.00 9.05 C ATOM 1185 O TYR A 77 23.884 27.014 32.309 1.00 10.65 O ATOM 1186 CB TYR A 77 22.738 28.723 29.936 1.00 11.05 C ATOM 1187 CG TYR A 77 22.567 29.733 28.860 1.00 11.49 C ATOM 1188 CD1 TYR A 77 23.292 29.691 27.707 1.00 14.34 C ATOM 1189 CD2 TYR A 77 21.673 30.791 29.045 1.00 14.18 C ATOM 1190 CE1 TYR A 77 23.064 30.649 26.639 1.00 12.97 C ATOM 1191 CE2 TYR A 77 21.476 31.755 28.073 1.00 14.65 C ATOM 1192 CZ TYR A 77 22.160 31.700 26.888 1.00 14.53 C ATOM 1193 OH TYR A 77 21.912 32.670 25.864 1.00 19.16 O ATOM 1194 HA TYR A 77 24.280 29.900 30.842 1.00 0.00 H ATOM 1195 HB3 TYR A 77 21.891 28.811 30.616 1.00 0.00 H ATOM 1196 HB2 TYR A 77 22.730 27.736 29.474 1.00 0.00 H ATOM 1197 HD2 TYR A 77 21.116 30.858 29.980 1.00 0.00 H ATOM 1198 HE2 TYR A 77 20.770 32.566 28.252 1.00 0.00 H ATOM 1199 HE1 TYR A 77 23.574 30.558 25.680 1.00 0.00 H ATOM 1200 HD1 TYR A 77 24.057 28.924 27.584 1.00 0.00 H ATOM 1201 HH TYR A 77 22.114 33.575 26.212 1.00 0.00 H ATOM 1202 H TYR A 77 25.029 27.189 29.815 1.00 0.00 H ATOM 1203 N LEU A 78 23.359 29.129 33.054 1.00 9.21 N ATOM 1204 CA LEU A 78 22.687 28.730 34.292 1.00 10.18 C ATOM 1205 C LEU A 78 21.363 29.390 34.271 1.00 11.21 C ATOM 1206 O LEU A 78 21.268 30.605 34.237 1.00 15.37 O ATOM 1207 CB LEU A 78 23.360 29.125 35.587 1.00 14.51 C ATOM 1208 CG LEU A 78 24.685 28.606 35.941 1.00 15.57 C ATOM 1209 CD1 LEU A 78 25.021 29.121 37.384 1.00 17.56 C ATOM 1210 CD2 LEU A 78 24.728 27.121 35.910 1.00 17.98 C ATOM 1211 HA LEU A 78 22.677 27.640 34.296 1.00 0.00 H ATOM 1212 HB2 LEU A 78 23.447 30.211 35.572 1.00 0.00 H ATOM 1213 HB3 LEU A 78 22.686 28.827 36.390 1.00 0.00 H ATOM 1214 HG LEU A 78 25.416 28.957 35.213 1.00 0.00 H ATOM 1215 HD21 LEU A 78 24.005 26.723 36.622 1.00 0.00 H ATOM 1216 HD22 LEU A 78 24.482 26.773 34.907 1.00 0.00 H ATOM 1217 HD23 LEU A 78 25.728 26.782 36.179 1.00 0.00 H ATOM 1218 HD11 LEU A 78 25.024 30.211 37.388 1.00 0.00 H ATOM 1219 HD12 LEU A 78 24.268 28.756 38.083 1.00 0.00 H ATOM 1220 HD13 LEU A 78 26.003 28.753 37.680 1.00 0.00 H ATOM 1221 H LEU A 78 23.541 30.139 32.886 1.00 0.00 H ATOM 1222 N GLY A 79 20.324 28.567 34.099 1.00 14.05 N ATOM 1223 CA GLY A 79 19.003 29.129 33.799 1.00 16.42 C ATOM 1224 C GLY A 79 19.076 29.899 32.498 1.00 16.06 C ATOM 1225 O GLY A 79 19.556 29.409 31.445 1.00 15.80 O ATOM 1226 HA3 GLY A 79 18.700 29.799 34.604 1.00 0.00 H ATOM 1227 HA2 GLY A 79 18.276 28.323 33.706 1.00 0.00 H ATOM 1228 H GLY A 79 20.451 27.538 34.177 1.00 0.00 H ATOM 1229 N GLN A 80 18.580 31.125 32.544 1.00 17.68 N ATOM 1230 CA GLN A 80 18.521 32.015 31.434 1.00 17.55 C ATOM 1231 C GLN A 80 19.732 32.954 31.318 1.00 14.54 C ATOM 1232 O GLN A 80 19.737 33.795 30.438 1.00 16.02 O ATOM 1233 CB GLN A 80 17.227 32.811 31.570 1.00 19.56 C ATOM 1234 CG GLN A 80 15.949 31.967 31.820 1.00 23.31 C ATOM 1235 CD GLN A 80 14.781 32.759 31.319 1.00 42.89 C ATOM 1236 OE1 GLN A 80 14.233 32.519 30.228 1.00 48.07 O ATOM 1237 NE2 GLN A 80 14.492 33.808 32.068 1.00 56.13 N ATOM 1238 HA GLN A 80 18.543 31.427 30.516 1.00 0.00 H ATOM 1239 HB2 GLN A 80 17.343 33.502 32.405 1.00 0.00 H ATOM 1240 HB3 GLN A 80 17.082 33.377 30.650 1.00 0.00 H ATOM 1241 HG2 GLN A 80 16.016 31.021 31.282 1.00 0.00 H ATOM 1242 HG3 GLN A 80 15.836 31.770 32.886 1.00 0.00 H ATOM 1243 HE22 GLN A 80 14.986 33.954 32.972 1.00 0.00 H ATOM 1244 HE21 GLN A 80 13.771 34.488 31.754 1.00 0.00 H ATOM 1245 H GLN A 80 18.207 31.462 33.455 1.00 0.00 H ATOM 1246 N VAL A 81 20.736 32.789 32.159 1.00 12.01 N ATOM 1247 CA VAL A 81 21.907 33.668 32.135 1.00 11.17 C ATOM 1248 C VAL A 81 23.083 32.903 31.500 1.00 8.54 C ATOM 1249 O VAL A 81 23.391 31.799 31.906 1.00 10.14 O ATOM 1250 CB VAL A 81 22.187 34.104 33.557 1.00 12.74 C ATOM 1251 CG1 VAL A 81 23.362 34.938 33.544 1.00 15.54 C ATOM 1252 CG2 VAL A 81 20.965 34.849 34.157 1.00 16.02 C ATOM 1253 HA VAL A 81 21.742 34.562 31.534 1.00 0.00 H ATOM 1254 HB VAL A 81 22.364 33.235 34.191 1.00 0.00 H ATOM 1255 HG11 VAL A 81 24.205 34.370 33.151 1.00 0.00 H ATOM 1256 HG12 VAL A 81 23.182 35.807 32.912 1.00 0.00 H ATOM 1257 HG13 VAL A 81 23.585 35.266 34.559 1.00 0.00 H ATOM 1258 HG21 VAL A 81 20.748 35.731 33.555 1.00 0.00 H ATOM 1259 HG22 VAL A 81 20.100 34.185 34.157 1.00 0.00 H ATOM 1260 HG23 VAL A 81 21.192 35.152 35.179 1.00 0.00 H ATOM 1261 H VAL A 81 20.694 32.017 32.855 1.00 0.00 H ATOM 1262 N ALA A 82 23.712 33.532 30.529 1.00 8.47 N ATOM 1263 CA ALA A 82 24.923 32.995 29.847 1.00 8.15 C ATOM 1264 C ALA A 82 26.185 33.456 30.589 1.00 7.98 C ATOM 1265 O ALA A 82 26.249 34.594 31.042 1.00 8.72 O ATOM 1266 CB ALA A 82 24.973 33.454 28.433 1.00 10.09 C ATOM 1267 HA ALA A 82 24.875 31.906 29.858 1.00 0.00 H ATOM 1268 HB1 ALA A 82 24.085 33.103 27.907 1.00 0.00 H ATOM 1269 HB2 ALA A 82 25.006 34.543 28.407 1.00 0.00 H ATOM 1270 HB3 ALA A 82 25.865 33.051 27.953 1.00 0.00 H ATOM 1271 H ALA A 82 23.343 34.454 30.221 1.00 0.00 H ATOM 1272 N ILE A 83 27.153 32.552 30.682 1.00 7.09 N ATOM 1273 CA ILE A 83 28.419 32.775 31.359 1.00 6.99 C ATOM 1274 C ILE A 83 29.550 32.344 30.442 1.00 6.73 C ATOM 1275 O ILE A 83 29.605 31.209 29.986 1.00 7.14 O ATOM 1276 CB ILE A 83 28.479 32.042 32.701 1.00 6.88 C ATOM 1277 CG1 ILE A 83 27.245 32.444 33.519 1.00 7.69 C ATOM 1278 CG2 ILE A 83 29.824 32.326 33.365 1.00 8.28 C ATOM 1279 CD1 ILE A 83 27.189 31.891 34.908 1.00 7.40 C ATOM 1280 HA ILE A 83 28.520 33.837 31.583 1.00 0.00 H ATOM 1281 HB ILE A 83 28.435 30.958 32.594 1.00 0.00 H ATOM 1282 HG12 ILE A 83 27.227 33.532 33.589 1.00 0.00 H ATOM 1283 HG13 ILE A 83 26.360 32.101 32.984 1.00 0.00 H ATOM 1284 HD11 ILE A 83 27.190 30.802 34.864 1.00 0.00 H ATOM 1285 HD12 ILE A 83 28.058 32.234 35.470 1.00 0.00 H ATOM 1286 HD13 ILE A 83 26.279 32.235 35.398 1.00 0.00 H ATOM 1287 HG21 ILE A 83 30.628 31.975 32.718 1.00 0.00 H ATOM 1288 HG22 ILE A 83 29.928 33.399 33.527 1.00 0.00 H ATOM 1289 HG23 ILE A 83 29.872 31.806 34.322 1.00 0.00 H ATOM 1290 H ILE A 83 26.995 31.623 30.241 1.00 0.00 H ATOM 1291 N LEU A 84 30.419 33.285 30.183 1.00 6.12 N ATOM 1292 CA LEU A 84 31.656 33.060 29.444 1.00 6.52 C ATOM 1293 C LEU A 84 32.830 33.217 30.412 1.00 5.94 C ATOM 1294 O LEU A 84 32.919 34.239 31.080 1.00 6.66 O ATOM 1295 CB LEU A 84 31.818 34.101 28.300 1.00 7.22 C ATOM 1296 CG LEU A 84 33.140 34.143 27.601 1.00 8.03 C ATOM 1297 CD1 LEU A 84 33.515 32.880 26.856 1.00 10.40 C ATOM 1298 CD2 LEU A 84 33.173 35.350 26.583 1.00 10.79 C ATOM 1299 HA LEU A 84 31.631 32.061 29.008 1.00 0.00 H ATOM 1300 HB2 LEU A 84 31.056 33.887 27.550 1.00 0.00 H ATOM 1301 HB3 LEU A 84 31.640 35.088 28.726 1.00 0.00 H ATOM 1302 HG LEU A 84 33.873 34.260 28.399 1.00 0.00 H ATOM 1303 HD21 LEU A 84 32.380 35.224 25.846 1.00 0.00 H ATOM 1304 HD22 LEU A 84 33.022 36.284 27.124 1.00 0.00 H ATOM 1305 HD23 LEU A 84 34.139 35.372 26.079 1.00 0.00 H ATOM 1306 HD11 LEU A 84 33.560 32.046 27.557 1.00 0.00 H ATOM 1307 HD12 LEU A 84 32.765 32.674 26.092 1.00 0.00 H ATOM 1308 HD13 LEU A 84 34.489 33.013 26.385 1.00 0.00 H ATOM 1309 H LEU A 84 30.217 34.247 30.523 1.00 0.00 H ATOM 1310 N LEU A 85 33.699 32.219 30.456 1.00 6.09 N ATOM 1311 CA LEU A 85 34.814 32.186 31.403 1.00 5.53 C ATOM 1312 C LEU A 85 36.016 31.647 30.680 1.00 6.09 C ATOM 1313 O LEU A 85 35.951 30.529 30.147 1.00 7.19 O ATOM 1314 CB LEU A 85 34.435 31.346 32.624 1.00 6.61 C ATOM 1315 CG LEU A 85 35.545 31.101 33.631 1.00 6.36 C ATOM 1316 CD1 LEU A 85 36.006 32.404 34.338 1.00 7.91 C ATOM 1317 CD2 LEU A 85 35.054 30.036 34.650 1.00 8.96 C ATOM 1318 HA LEU A 85 35.050 33.183 31.775 1.00 0.00 H ATOM 1319 HB2 LEU A 85 33.621 31.855 33.141 1.00 0.00 H ATOM 1320 HB3 LEU A 85 34.087 30.376 32.268 1.00 0.00 H ATOM 1321 HG LEU A 85 36.425 30.731 33.105 1.00 0.00 H ATOM 1322 HD21 LEU A 85 34.163 30.405 35.158 1.00 0.00 H ATOM 1323 HD22 LEU A 85 34.817 29.112 34.122 1.00 0.00 H ATOM 1324 HD23 LEU A 85 35.839 29.847 35.382 1.00 0.00 H ATOM 1325 HD11 LEU A 85 36.377 33.108 33.593 1.00 0.00 H ATOM 1326 HD12 LEU A 85 35.163 32.846 34.869 1.00 0.00 H ATOM 1327 HD13 LEU A 85 36.800 32.170 35.047 1.00 0.00 H ATOM 1328 H LEU A 85 33.585 31.427 29.791 1.00 0.00 H ATOM 1329 N PHE A 86 37.136 32.389 30.648 1.00 5.96 N ATOM 1330 CA PHE A 86 38.293 31.976 29.908 1.00 6.73 C ATOM 1331 C PHE A 86 39.546 32.582 30.448 1.00 7.86 C ATOM 1332 O PHE A 86 39.514 33.602 31.126 1.00 7.46 O ATOM 1333 CB PHE A 86 38.115 32.193 28.401 1.00 6.68 C ATOM 1334 CG PHE A 86 38.173 33.671 28.028 1.00 7.44 C ATOM 1335 CD1 PHE A 86 39.320 34.271 27.602 1.00 8.35 C ATOM 1336 CD2 PHE A 86 37.072 34.496 28.216 1.00 7.94 C ATOM 1337 CE1 PHE A 86 39.349 35.574 27.261 1.00 9.61 C ATOM 1338 CE2 PHE A 86 37.133 35.847 27.904 1.00 9.84 C ATOM 1339 CZ PHE A 86 38.273 36.362 27.443 1.00 9.45 C ATOM 1340 HA PHE A 86 38.401 30.900 30.044 1.00 0.00 H ATOM 1341 HB2 PHE A 86 38.908 31.665 27.872 1.00 0.00 H ATOM 1342 HB3 PHE A 86 37.148 31.791 28.099 1.00 0.00 H ATOM 1343 HD2 PHE A 86 36.148 34.077 28.614 1.00 0.00 H ATOM 1344 HE2 PHE A 86 36.256 36.481 28.035 1.00 0.00 H ATOM 1345 HZ PHE A 86 38.334 37.426 27.213 1.00 0.00 H ATOM 1346 HE1 PHE A 86 40.257 35.996 26.831 1.00 0.00 H ATOM 1347 HD1 PHE A 86 40.235 33.683 27.536 1.00 0.00 H ATOM 1348 H PHE A 86 37.164 33.286 31.174 1.00 0.00 H ATOM 1349 N LYS A 87 40.671 31.913 30.151 1.00 7.58 N ATOM 1350 CA LYS A 87 41.985 32.403 30.554 1.00 8.37 C ATOM 1351 C LYS A 87 42.699 32.952 29.355 1.00 9.86 C ATOM 1352 O LYS A 87 42.686 32.338 28.297 1.00 11.52 O ATOM 1353 CB LYS A 87 42.766 31.291 31.293 1.00 10.22 C ATOM 1354 CG LYS A 87 44.141 31.590 31.761 1.00 11.66 C ATOM 1355 CD LYS A 87 44.645 30.464 32.628 1.00 15.41 C ATOM 1356 CE LYS A 87 46.019 30.657 33.208 1.00 18.83 C ATOM 1357 NZ LYS A 87 46.028 30.023 34.557 1.00 21.49 N ATOM 1358 HA LYS A 87 41.889 33.223 31.266 1.00 0.00 H ATOM 1359 HB2 LYS A 87 42.180 31.012 32.169 1.00 0.00 H ATOM 1360 HB3 LYS A 87 42.833 30.439 30.616 1.00 0.00 H ATOM 1361 HG2 LYS A 87 44.799 31.706 30.900 1.00 0.00 H ATOM 1362 HG3 LYS A 87 44.134 32.515 32.338 1.00 0.00 H ATOM 1363 HD2 LYS A 87 43.946 30.338 33.455 1.00 0.00 H ATOM 1364 HD3 LYS A 87 44.660 29.556 32.025 1.00 0.00 H ATOM 1365 HE2 LYS A 87 46.241 31.721 33.295 1.00 0.00 H ATOM 1366 HE3 LYS A 87 46.763 30.183 32.568 1.00 0.00 H ATOM 1367 HZ1 LYS A 87 45.312 30.479 35.158 1.00 0.00 H ATOM 1368 HZ2 LYS A 87 45.811 29.010 34.464 1.00 0.00 H ATOM 1369 HZ3 LYS A 87 46.968 30.139 34.987 1.00 0.00 H ATOM 1370 H LYS A 87 40.604 31.022 29.619 1.00 0.00 H ATOM 1371 N SER A 88 43.310 34.137 29.571 1.00 10.95 N ATOM 1372 CA SER A 88 44.231 34.764 28.583 1.00 12.43 C ATOM 1373 C SER A 88 45.087 35.784 29.313 1.00 14.06 C ATOM 1374 O SER A 88 44.597 36.701 29.869 1.00 14.22 O ATOM 1375 CB SER A 88 43.502 35.455 27.454 1.00 14.88 C ATOM 1376 OG SER A 88 44.372 36.014 26.467 1.00 15.41 O ATOM 1377 HA SER A 88 44.833 33.971 28.138 1.00 0.00 H ATOM 1378 HB2 SER A 88 42.897 36.258 27.875 1.00 0.00 H ATOM 1379 HB3 SER A 88 42.851 34.728 26.968 1.00 0.00 H ATOM 1380 HG SER A 88 44.963 36.685 26.892 1.00 0.00 H ATOM 1381 H SER A 88 43.129 34.633 30.467 1.00 0.00 H ATOM 1382 N GLY A 89 46.406 35.583 29.276 1.00 18.38 N ATOM 1383 CA GLY A 89 47.298 36.255 30.239 1.00 21.55 C ATOM 1384 C GLY A 89 47.454 35.324 31.490 1.00 23.06 C ATOM 1385 O GLY A 89 46.891 34.094 31.762 1.00 19.33 O ATOM 1386 HA3 GLY A 89 46.866 37.209 30.540 1.00 0.00 H ATOM 1387 HA2 GLY A 89 48.273 36.427 29.782 1.00 0.00 H ATOM 1388 OXT GLY A 89 48.184 35.981 32.321 1.00 26.29 O ATOM 1389 H GLY A 89 46.809 34.945 28.560 1.00 0.00 H TER 1390 GLY A 89 ATOM 1391 N ARG C 4 25.565 54.200 16.329 1.00 40.58 N ATOM 1392 CA ARG C 4 24.715 55.344 16.789 1.00 39.61 C ATOM 1393 C ARG C 4 25.515 56.125 17.846 1.00 38.18 C ATOM 1394 O ARG C 4 26.766 56.005 17.840 1.00 39.99 O ATOM 1395 CB ARG C 4 23.345 54.890 17.344 1.00 40.43 C ATOM 1396 CG ARG C 4 22.292 56.019 17.309 1.00 43.11 C ATOM 1397 CD ARG C 4 21.287 55.874 18.414 1.00 46.07 C ATOM 1398 NE ARG C 4 21.660 56.540 19.670 1.00 47.52 N ATOM 1399 CZ ARG C 4 20.964 56.390 20.810 1.00 50.14 C ATOM 1400 NH1 ARG C 4 19.891 55.579 20.860 1.00 53.37 N ATOM 1401 NH2 ARG C 4 21.339 57.028 21.916 1.00 47.63 N ATOM 1402 HA ARG C 4 24.482 55.980 15.935 1.00 0.00 H ATOM 1403 HB2 ARG C 4 22.983 54.055 16.744 1.00 0.00 H ATOM 1404 HB3 ARG C 4 23.476 54.565 18.376 1.00 0.00 H ATOM 1405 HG2 ARG C 4 22.798 56.978 17.415 1.00 0.00 H ATOM 1406 HG3 ARG C 4 21.772 55.988 16.352 1.00 0.00 H ATOM 1407 HD2 ARG C 4 21.156 54.811 18.618 1.00 0.00 H ATOM 1408 HD3 ARG C 4 20.342 56.296 18.072 1.00 0.00 H ATOM 1409 HE ARG C 4 22.499 57.154 19.677 1.00 0.00 H ATOM 1410 HH12 ARG C 4 19.361 55.472 21.748 1.00 0.00 H ATOM 1411 HH11 ARG C 4 19.592 55.060 20.010 1.00 0.00 H ATOM 1412 HH22 ARG C 4 20.796 56.908 22.795 1.00 0.00 H ATOM 1413 HH21 ARG C 4 22.175 57.647 21.901 1.00 0.00 H ATOM 1414 HN3 ARG C 4 25.789 53.588 17.140 1.00 0.00 H ATOM 1415 HN2 ARG C 4 26.446 54.568 15.918 1.00 0.00 H ATOM 1416 HN1 ARG C 4 25.048 53.652 15.612 1.00 0.00 H ATOM 1417 N LYS C 5 24.839 56.903 18.721 1.00 35.08 N ATOM 1418 CA LYS C 5 25.515 57.941 19.580 1.00 32.46 C ATOM 1419 C LYS C 5 26.582 57.283 20.477 1.00 29.38 C ATOM 1420 O LYS C 5 26.217 56.338 21.284 1.00 26.60 O ATOM 1421 CB LYS C 5 24.516 58.680 20.506 1.00 33.14 C ATOM 1422 HA LYS C 5 25.966 58.659 18.895 1.00 0.00 H ATOM 1423 HB2 LYS C 5 23.763 59.182 19.899 1.00 0.00 H ATOM 1424 HB3 LYS C 5 24.032 57.959 21.165 1.00 0.00 H ATOM 1425 H LYS C 5 23.810 56.780 18.805 1.00 0.00 H ATOM 1426 N ALA C 6 27.842 57.719 20.340 1.00 26.41 N ATOM 1427 CA ALA C 6 28.969 57.008 21.138 1.00 23.35 C ATOM 1428 C ALA C 6 29.211 57.666 22.481 1.00 20.79 C ATOM 1429 O ALA C 6 29.435 58.896 22.570 1.00 23.58 O ATOM 1430 CB ALA C 6 30.272 57.025 20.388 1.00 26.78 C ATOM 1431 HA ALA C 6 28.628 55.983 21.281 1.00 0.00 H ATOM 1432 HB1 ALA C 6 30.148 56.512 19.435 1.00 0.00 H ATOM 1433 HB2 ALA C 6 30.574 58.057 20.210 1.00 0.00 H ATOM 1434 HB3 ALA C 6 31.036 56.518 20.978 1.00 0.00 H ATOM 1435 H ALA C 6 28.061 58.518 19.711 1.00 0.00 H ATOM 1436 N VAL C 7 29.094 56.889 23.555 1.00 14.99 N ATOM 1437 CA VAL C 7 29.277 57.369 24.873 1.00 14.85 C ATOM 1438 C VAL C 7 30.307 56.490 25.596 1.00 13.24 C ATOM 1439 O VAL C 7 30.060 55.317 25.854 1.00 13.28 O ATOM 1440 CB VAL C 7 27.969 57.341 25.709 1.00 14.84 C ATOM 1441 CG1 VAL C 7 28.196 57.866 27.120 1.00 17.96 C ATOM 1442 CG2 VAL C 7 26.881 58.193 25.010 1.00 19.11 C ATOM 1443 HA VAL C 7 29.611 58.403 24.787 1.00 0.00 H ATOM 1444 HB VAL C 7 27.641 56.304 25.781 1.00 0.00 H ATOM 1445 HG11 VAL C 7 28.940 57.247 27.622 1.00 0.00 H ATOM 1446 HG12 VAL C 7 28.552 58.895 27.071 1.00 0.00 H ATOM 1447 HG13 VAL C 7 27.258 57.831 27.675 1.00 0.00 H ATOM 1448 HG21 VAL C 7 27.229 59.222 24.919 1.00 0.00 H ATOM 1449 HG22 VAL C 7 26.684 57.786 24.018 1.00 0.00 H ATOM 1450 HG23 VAL C 7 25.966 58.169 25.602 1.00 0.00 H ATOM 1451 H VAL C 7 28.858 55.885 23.419 1.00 0.00 H ATOM 1452 N ILE C 8 31.464 57.057 25.862 1.00 13.04 N ATOM 1453 CA ILE C 8 32.519 56.341 26.516 1.00 12.66 C ATOM 1454 C ILE C 8 32.354 56.329 28.015 1.00 12.39 C ATOM 1455 O ILE C 8 32.261 57.392 28.611 1.00 15.15 O ATOM 1456 CB ILE C 8 33.966 56.823 26.079 1.00 13.81 C ATOM 1457 CG1 ILE C 8 34.105 56.684 24.543 1.00 15.64 C ATOM 1458 CG2 ILE C 8 35.069 56.061 26.840 1.00 14.10 C ATOM 1459 CD1 ILE C 8 35.305 57.410 24.021 1.00 18.40 C ATOM 1460 HA ILE C 8 32.433 55.309 26.176 1.00 0.00 H ATOM 1461 HB ILE C 8 34.092 57.873 26.343 1.00 0.00 H ATOM 1462 HG12 ILE C 8 34.196 55.627 24.292 1.00 0.00 H ATOM 1463 HG13 ILE C 8 33.212 57.093 24.070 1.00 0.00 H ATOM 1464 HD11 ILE C 8 35.220 58.470 24.261 1.00 0.00 H ATOM 1465 HD12 ILE C 8 36.204 57.002 24.483 1.00 0.00 H ATOM 1466 HD13 ILE C 8 35.362 57.285 22.940 1.00 0.00 H ATOM 1467 HG21 ILE C 8 34.956 56.234 27.910 1.00 0.00 H ATOM 1468 HG22 ILE C 8 34.982 54.995 26.631 1.00 0.00 H ATOM 1469 HG23 ILE C 8 36.046 56.418 26.514 1.00 0.00 H ATOM 1470 H ILE C 8 31.617 58.049 25.591 1.00 0.00 H ATOM 1471 N LYS C 9 32.231 55.174 28.606 1.00 10.99 N ATOM 1472 CA LYS C 9 31.912 55.020 30.016 1.00 11.49 C ATOM 1473 C LYS C 9 33.183 54.867 30.845 1.00 10.73 C ATOM 1474 O LYS C 9 33.301 55.464 31.939 1.00 12.60 O ATOM 1475 CB LYS C 9 30.925 53.872 30.263 1.00 12.18 C ATOM 1476 CG LYS C 9 29.564 54.203 29.611 1.00 17.28 C ATOM 1477 CD LYS C 9 28.910 55.424 30.270 1.00 19.50 C ATOM 1478 CE LYS C 9 27.445 55.573 29.956 1.00 25.01 C ATOM 1479 NZ LYS C 9 26.900 56.745 30.716 1.00 27.00 N ATOM 1480 HA LYS C 9 31.410 55.931 30.341 1.00 0.00 H ATOM 1481 HB2 LYS C 9 31.321 52.954 29.829 1.00 0.00 H ATOM 1482 HB3 LYS C 9 30.789 53.736 31.336 1.00 0.00 H ATOM 1483 HG2 LYS C 9 29.719 54.411 28.552 1.00 0.00 H ATOM 1484 HG3 LYS C 9 28.901 53.344 29.718 1.00 0.00 H ATOM 1485 HD2 LYS C 9 29.023 55.333 31.350 1.00 0.00 H ATOM 1486 HD3 LYS C 9 29.428 56.319 29.926 1.00 0.00 H ATOM 1487 HE2 LYS C 9 26.914 54.668 30.250 1.00 0.00 H ATOM 1488 HE3 LYS C 9 27.315 55.738 28.886 1.00 0.00 H ATOM 1489 HZ1 LYS C 9 27.026 56.584 31.736 1.00 0.00 H ATOM 1490 HZ2 LYS C 9 27.409 57.607 30.434 1.00 0.00 H ATOM 1491 HZ3 LYS C 9 25.888 56.854 30.504 1.00 0.00 H ATOM 1492 H LYS C 9 32.369 54.314 28.037 1.00 0.00 H ATOM 1493 N ASN C 10 34.094 53.986 30.448 1.00 9.25 N ATOM 1494 CA ASN C 10 35.371 53.773 31.082 1.00 10.45 C ATOM 1495 C ASN C 10 36.411 53.686 30.021 1.00 11.84 C ATOM 1496 O ASN C 10 36.177 53.182 28.942 1.00 12.60 O ATOM 1497 CB ASN C 10 35.447 52.464 31.856 1.00 11.03 C ATOM 1498 CG ASN C 10 34.429 52.328 32.965 1.00 13.00 C ATOM 1499 OD1 ASN C 10 34.027 53.313 33.694 1.00 19.27 O ATOM 1500 ND2 ASN C 10 34.066 51.121 33.213 1.00 13.94 N ATOM 1501 HA ASN C 10 35.518 54.601 31.775 1.00 0.00 H ATOM 1502 HB2 ASN C 10 35.296 51.644 31.154 1.00 0.00 H ATOM 1503 HB3 ASN C 10 36.441 52.386 32.296 1.00 0.00 H ATOM 1504 HD22 ASN C 10 34.403 50.343 32.611 1.00 0.00 H ATOM 1505 HD21 ASN C 10 33.435 50.922 34.016 1.00 0.00 H ATOM 1506 H ASN C 10 33.869 53.405 29.615 1.00 0.00 H ATOM 1507 N ALA C 11 37.589 54.161 30.341 1.00 12.07 N ATOM 1508 CA ALA C 11 38.712 54.027 29.407 1.00 12.92 C ATOM 1509 C ALA C 11 40.026 54.135 30.157 1.00 12.89 C ATOM 1510 O ALA C 11 40.245 55.084 30.931 1.00 14.93 O ATOM 1511 CB ALA C 11 38.675 55.035 28.335 1.00 14.84 C ATOM 1512 HA ALA C 11 38.625 53.046 28.940 1.00 0.00 H ATOM 1513 HB1 ALA C 11 37.750 54.927 27.768 1.00 0.00 H ATOM 1514 HB2 ALA C 11 38.719 56.032 28.774 1.00 0.00 H ATOM 1515 HB3 ALA C 11 39.528 54.890 27.672 1.00 0.00 H ATOM 1516 H ALA C 11 37.728 54.633 31.257 1.00 0.00 H ATOM 1517 N ASP C 12 40.921 53.200 29.920 1.00 12.03 N ATOM 1518 CA ASP C 12 42.340 53.344 30.279 1.00 12.25 C ATOM 1519 C ASP C 12 43.042 53.111 28.966 1.00 12.49 C ATOM 1520 O ASP C 12 43.331 51.988 28.583 1.00 12.13 O ATOM 1521 CB ASP C 12 42.774 52.321 31.333 1.00 13.49 C ATOM 1522 CG ASP C 12 44.231 52.348 31.579 1.00 14.18 C ATOM 1523 OD1 ASP C 12 44.913 53.309 31.183 1.00 17.38 O ATOM 1524 OD2 ASP C 12 44.776 51.424 32.200 1.00 19.55 O ATOM 1525 HA ASP C 12 42.567 54.311 30.728 1.00 0.00 H ATOM 1526 HB2 ASP C 12 42.257 52.540 32.267 1.00 0.00 H ATOM 1527 HB3 ASP C 12 42.495 51.325 30.990 1.00 0.00 H ATOM 1528 H ASP C 12 40.611 52.321 29.459 1.00 0.00 H ATOM 1529 N MET C 13 43.245 54.200 28.184 1.00 12.63 N ATOM 1530 CA MET C 13 43.560 54.055 26.783 1.00 13.27 C ATOM 1531 C MET C 13 43.870 55.448 26.262 1.00 14.52 C ATOM 1532 O MET C 13 43.224 56.434 26.632 1.00 15.70 O ATOM 1533 CB MET C 13 42.347 53.464 26.029 1.00 13.57 C ATOM 1534 CG MET C 13 42.577 53.172 24.562 1.00 14.50 C ATOM 1535 SD MET C 13 41.204 52.349 23.703 1.00 13.56 S ATOM 1536 CE MET C 13 41.443 50.644 24.300 1.00 12.34 C ATOM 1537 HA MET C 13 44.405 53.383 26.635 1.00 0.00 H ATOM 1538 HB2 MET C 13 42.068 52.531 26.519 1.00 0.00 H ATOM 1539 HB3 MET C 13 41.524 54.174 26.106 1.00 0.00 H ATOM 1540 HG2 MET C 13 43.456 52.532 24.480 1.00 0.00 H ATOM 1541 HG3 MET C 13 42.770 54.119 24.057 1.00 0.00 H ATOM 1542 HE1 MET C 13 42.430 50.291 24.002 1.00 0.00 H ATOM 1543 HE2 MET C 13 41.363 50.626 25.387 1.00 0.00 H ATOM 1544 HE3 MET C 13 40.679 49.998 23.867 1.00 0.00 H ATOM 1545 H MET C 13 43.173 55.151 28.599 1.00 0.00 H ATOM 1546 N SER C 14 44.773 55.527 25.308 1.00 15.04 N ATOM 1547 CA SER C 14 45.101 56.822 24.703 1.00 16.54 C ATOM 1548 C SER C 14 43.880 57.399 23.981 1.00 15.61 C ATOM 1549 O SER C 14 42.994 56.663 23.488 1.00 17.50 O ATOM 1550 CB SER C 14 46.245 56.670 23.681 1.00 17.35 C ATOM 1551 OG SER C 14 45.801 56.027 22.525 1.00 20.21 O ATOM 1552 HA SER C 14 45.410 57.493 25.504 1.00 0.00 H ATOM 1553 HB2 SER C 14 47.048 56.084 24.129 1.00 0.00 H ATOM 1554 HB3 SER C 14 46.621 57.658 23.417 1.00 0.00 H ATOM 1555 HG SER C 14 45.074 56.558 22.112 1.00 0.00 H ATOM 1556 H SER C 14 45.257 54.666 24.981 1.00 0.00 H ATOM 1557 N GLU C 15 43.848 58.712 23.845 1.00 18.46 N ATOM 1558 CA GLU C 15 42.772 59.440 23.170 1.00 20.14 C ATOM 1559 C GLU C 15 42.622 58.895 21.704 1.00 19.11 C ATOM 1560 O GLU C 15 41.485 58.632 21.205 1.00 20.85 O ATOM 1561 CB GLU C 15 43.191 60.917 23.234 1.00 22.49 C ATOM 1562 CG GLU C 15 42.368 61.954 22.596 1.00 27.52 C ATOM 1563 CD GLU C 15 43.093 63.372 22.595 1.00 32.68 C ATOM 1564 OE1 GLU C 15 44.200 63.723 23.304 1.00 33.92 O ATOM 1565 OE2 GLU C 15 42.544 64.159 21.804 1.00 35.32 O ATOM 1566 HA GLU C 15 41.793 59.314 23.632 1.00 0.00 H ATOM 1567 HB2 GLU C 15 43.258 61.177 24.290 1.00 0.00 H ATOM 1568 HB3 GLU C 15 44.181 60.981 22.782 1.00 0.00 H ATOM 1569 HG2 GLU C 15 42.167 61.660 21.566 1.00 0.00 H ATOM 1570 HG3 GLU C 15 41.426 62.040 23.138 1.00 0.00 H ATOM 1571 H GLU C 15 44.636 59.263 24.242 1.00 0.00 H ATOM 1572 N ASP C 16 43.743 58.718 21.008 1.00 18.78 N ATOM 1573 CA ASP C 16 43.679 58.275 19.578 1.00 19.86 C ATOM 1574 C ASP C 16 43.154 56.865 19.496 1.00 18.70 C ATOM 1575 O ASP C 16 42.381 56.561 18.641 1.00 19.16 O ATOM 1576 CB ASP C 16 45.043 58.369 18.840 1.00 21.64 C ATOM 1577 HA ASP C 16 43.000 58.963 19.074 1.00 0.00 H ATOM 1578 HB2 ASP C 16 45.388 59.403 18.847 1.00 0.00 H ATOM 1579 HB3 ASP C 16 45.773 57.737 19.346 1.00 0.00 H ATOM 1580 H ASP C 16 44.665 58.888 21.458 1.00 0.00 H ATOM 1581 N MET C 17 43.575 55.993 20.414 1.00 17.41 N ATOM 1582 CA MET C 17 43.108 54.617 20.380 1.00 16.06 C ATOM 1583 C MET C 17 41.626 54.545 20.761 1.00 14.75 C ATOM 1584 O MET C 17 40.895 53.753 20.176 1.00 14.56 O ATOM 1585 CB MET C 17 44.011 53.745 21.237 1.00 15.21 C ATOM 1586 CG MET C 17 43.701 52.275 21.124 1.00 13.65 C ATOM 1587 SD MET C 17 44.759 51.222 22.133 1.00 16.40 S ATOM 1588 CE MET C 17 46.136 50.863 21.059 1.00 22.39 C ATOM 1589 HA MET C 17 43.171 54.222 19.366 1.00 0.00 H ATOM 1590 HB2 MET C 17 45.044 53.906 20.927 1.00 0.00 H ATOM 1591 HB3 MET C 17 43.895 54.044 22.279 1.00 0.00 H ATOM 1592 HG2 MET C 17 43.817 51.979 20.081 1.00 0.00 H ATOM 1593 HG3 MET C 17 42.667 52.118 21.432 1.00 0.00 H ATOM 1594 HE1 MET C 17 45.775 50.354 20.165 1.00 0.00 H ATOM 1595 HE2 MET C 17 46.626 51.794 20.775 1.00 0.00 H ATOM 1596 HE3 MET C 17 46.846 50.222 21.582 1.00 0.00 H ATOM 1597 H MET C 17 44.238 56.298 21.155 1.00 0.00 H ATOM 1598 N GLN C 18 41.185 55.359 21.732 1.00 14.71 N ATOM 1599 CA GLN C 18 39.754 55.428 22.023 1.00 15.67 C ATOM 1600 C GLN C 18 38.968 55.755 20.776 1.00 15.42 C ATOM 1601 O GLN C 18 37.925 55.178 20.499 1.00 15.02 O ATOM 1602 CB GLN C 18 39.428 56.426 23.110 1.00 15.38 C ATOM 1603 CG GLN C 18 39.971 56.056 24.504 1.00 14.01 C ATOM 1604 CD GLN C 18 39.623 57.039 25.581 1.00 15.18 C ATOM 1605 OE1 GLN C 18 38.480 57.515 25.629 1.00 19.00 O ATOM 1606 NE2 GLN C 18 40.596 57.358 26.431 1.00 16.97 N ATOM 1607 HA GLN C 18 39.466 54.442 22.386 1.00 0.00 H ATOM 1608 HB2 GLN C 18 39.850 57.390 22.825 1.00 0.00 H ATOM 1609 HB3 GLN C 18 38.344 56.512 23.179 1.00 0.00 H ATOM 1610 HG2 GLN C 18 39.563 55.084 24.783 1.00 0.00 H ATOM 1611 HG3 GLN C 18 41.057 55.988 24.441 1.00 0.00 H ATOM 1612 HE22 GLN C 18 41.535 56.921 26.335 1.00 0.00 H ATOM 1613 HE21 GLN C 18 40.418 58.044 27.192 1.00 0.00 H ATOM 1614 H GLN C 18 41.857 55.938 22.275 1.00 0.00 H ATOM 1615 N GLN C 19 39.434 56.783 20.051 1.00 17.06 N ATOM 1616 CA GLN C 19 38.692 57.176 18.850 1.00 17.35 C ATOM 1617 C GLN C 19 38.722 56.094 17.799 1.00 15.71 C ATOM 1618 O GLN C 19 37.709 55.851 17.146 1.00 18.08 O ATOM 1619 CB GLN C 19 39.203 58.507 18.277 1.00 19.08 C ATOM 1620 CG GLN C 19 38.378 58.999 17.104 1.00 23.32 C ATOM 1621 CD GLN C 19 36.963 59.339 17.507 1.00 25.78 C ATOM 1622 OE1 GLN C 19 36.768 60.081 18.483 1.00 32.69 O ATOM 1623 NE2 GLN C 19 35.954 58.747 16.810 1.00 30.57 N ATOM 1624 HA GLN C 19 37.655 57.320 19.152 1.00 0.00 H ATOM 1625 HB2 GLN C 19 39.172 59.260 19.065 1.00 0.00 H ATOM 1626 HB3 GLN C 19 40.233 58.371 17.946 1.00 0.00 H ATOM 1627 HG2 GLN C 19 38.850 59.891 16.691 1.00 0.00 H ATOM 1628 HG3 GLN C 19 38.349 58.219 16.343 1.00 0.00 H ATOM 1629 HE22 GLN C 19 36.172 58.134 15.999 1.00 0.00 H ATOM 1630 HE21 GLN C 19 34.965 58.908 17.089 1.00 0.00 H ATOM 1631 H GLN C 19 40.298 57.287 20.334 1.00 0.00 H ATOM 1632 N ASP C 20 39.805 55.366 17.683 1.00 16.37 N ATOM 1633 CA ASP C 20 39.863 54.272 16.751 1.00 16.24 C ATOM 1634 C ASP C 20 38.919 53.128 17.141 1.00 15.49 C ATOM 1635 O ASP C 20 38.315 52.520 16.281 1.00 16.67 O ATOM 1636 CB ASP C 20 41.260 53.728 16.647 1.00 18.84 C ATOM 1637 CG ASP C 20 41.474 53.029 15.330 1.00 23.27 C ATOM 1638 OD1 ASP C 20 40.749 53.369 14.311 1.00 30.31 O ATOM 1639 OD2 ASP C 20 42.383 52.216 15.299 1.00 33.51 O ATOM 1640 HA ASP C 20 39.547 54.673 15.788 1.00 0.00 H ATOM 1641 HB2 ASP C 20 41.970 54.551 16.733 1.00 0.00 H ATOM 1642 HB3 ASP C 20 41.427 53.019 17.458 1.00 0.00 H ATOM 1643 H ASP C 20 40.634 55.582 18.273 1.00 0.00 H ATOM 1644 N ALA C 21 38.800 52.853 18.451 1.00 14.18 N ATOM 1645 CA ALA C 21 37.842 51.863 18.928 1.00 13.62 C ATOM 1646 C ALA C 21 36.424 52.231 18.513 1.00 13.09 C ATOM 1647 O ALA C 21 35.668 51.409 18.017 1.00 13.47 O ATOM 1648 CB ALA C 21 38.001 51.706 20.448 1.00 13.30 C ATOM 1649 HA ALA C 21 38.044 50.896 18.468 1.00 0.00 H ATOM 1650 HB1 ALA C 21 39.015 51.376 20.674 1.00 0.00 H ATOM 1651 HB2 ALA C 21 37.813 52.664 20.933 1.00 0.00 H ATOM 1652 HB3 ALA C 21 37.287 50.967 20.812 1.00 0.00 H ATOM 1653 H ALA C 21 39.401 53.355 19.136 1.00 0.00 H ATOM 1654 N VAL C 22 36.059 53.487 18.707 1.00 13.80 N ATOM 1655 CA VAL C 22 34.747 53.964 18.320 1.00 14.90 C ATOM 1656 C VAL C 22 34.510 53.864 16.807 1.00 15.39 C ATOM 1657 O VAL C 22 33.472 53.392 16.378 1.00 17.05 O ATOM 1658 CB VAL C 22 34.527 55.437 18.804 1.00 16.05 C ATOM 1659 CG1 VAL C 22 33.298 56.010 18.161 1.00 19.76 C ATOM 1660 CG2 VAL C 22 34.479 55.427 20.406 1.00 17.51 C ATOM 1661 HA VAL C 22 34.020 53.314 18.807 1.00 0.00 H ATOM 1662 HB VAL C 22 35.346 56.090 18.501 1.00 0.00 H ATOM 1663 HG11 VAL C 22 33.419 56.002 17.078 1.00 0.00 H ATOM 1664 HG12 VAL C 22 32.432 55.408 18.436 1.00 0.00 H ATOM 1665 HG13 VAL C 22 33.154 57.034 18.504 1.00 0.00 H ATOM 1666 HG21 VAL C 22 33.658 54.793 20.740 1.00 0.00 H ATOM 1667 HG22 VAL C 22 35.421 55.038 20.794 1.00 0.00 H ATOM 1668 HG23 VAL C 22 34.326 56.443 20.770 1.00 0.00 H ATOM 1669 H VAL C 22 36.730 54.148 19.148 1.00 0.00 H ATOM 1670 N ASP C 23 35.510 54.270 16.052 1.00 16.33 N ATOM 1671 CA ASP C 23 35.439 54.238 14.605 1.00 18.79 C ATOM 1672 C ASP C 23 35.309 52.815 14.122 1.00 18.27 C ATOM 1673 O ASP C 23 34.433 52.499 13.272 1.00 19.21 O ATOM 1674 CB ASP C 23 36.678 54.886 14.024 1.00 20.27 C ATOM 1675 CG ASP C 23 36.700 56.378 14.164 1.00 24.93 C ATOM 1676 OD1 ASP C 23 35.673 56.968 14.529 1.00 29.53 O ATOM 1677 OD2 ASP C 23 37.790 56.961 13.959 1.00 31.87 O ATOM 1678 HA ASP C 23 34.561 54.793 14.274 1.00 0.00 H ATOM 1679 HB2 ASP C 23 37.551 54.479 14.535 1.00 0.00 H ATOM 1680 HB3 ASP C 23 36.731 54.639 12.964 1.00 0.00 H ATOM 1681 H ASP C 23 36.375 54.624 16.507 1.00 0.00 H ATOM 1682 N CYS C 24 36.101 51.920 14.706 1.00 17.27 N ATOM 1683 CA CYS C 24 36.080 50.540 14.300 1.00 16.17 C ATOM 1684 C CYS C 24 34.717 49.875 14.616 1.00 15.50 C ATOM 1685 O CYS C 24 34.122 49.156 13.793 1.00 15.73 O ATOM 1686 CB CYS C 24 37.207 49.845 15.024 1.00 15.24 C ATOM 1687 SG CYS C 24 37.287 48.142 14.695 1.00 13.51 S ATOM 1688 HA CYS C 24 36.212 50.462 13.221 1.00 0.00 H ATOM 1689 HB2 CYS C 24 37.068 49.985 16.096 1.00 0.00 H ATOM 1690 HB3 CYS C 24 38.149 50.301 14.718 1.00 0.00 H ATOM 1691 HG CYS C 24 37.476 47.945 13.342 1.00 0.00 H ATOM 1692 H CYS C 24 36.744 52.222 15.466 1.00 0.00 H ATOM 1693 N ALA C 25 34.174 50.162 15.826 1.00 13.54 N ATOM 1694 CA ALA C 25 32.870 49.635 16.214 1.00 14.15 C ATOM 1695 C ALA C 25 31.760 50.178 15.332 1.00 14.40 C ATOM 1696 O ALA C 25 30.763 49.513 15.065 1.00 15.21 O ATOM 1697 CB ALA C 25 32.613 49.895 17.723 1.00 14.31 C ATOM 1698 HA ALA C 25 32.874 48.556 16.062 1.00 0.00 H ATOM 1699 HB1 ALA C 25 33.387 49.403 18.312 1.00 0.00 H ATOM 1700 HB2 ALA C 25 32.636 50.968 17.915 1.00 0.00 H ATOM 1701 HB3 ALA C 25 31.636 49.496 17.998 1.00 0.00 H ATOM 1702 H ALA C 25 34.697 50.769 16.489 1.00 0.00 H ATOM 1703 N THR C 26 31.851 51.449 14.975 1.00 15.92 N ATOM 1704 CA THR C 26 30.846 52.054 14.126 1.00 17.45 C ATOM 1705 C THR C 26 30.822 51.354 12.743 1.00 17.49 C ATOM 1706 O THR C 26 29.765 50.998 12.246 1.00 19.26 O ATOM 1707 CB THR C 26 31.063 53.551 13.972 1.00 17.58 C ATOM 1708 OG1 THR C 26 31.099 54.192 15.223 1.00 20.10 O ATOM 1709 CG2 THR C 26 30.004 54.211 13.098 1.00 22.18 C ATOM 1710 HA THR C 26 29.877 51.918 14.606 1.00 0.00 H ATOM 1711 HB THR C 26 32.027 53.664 13.477 1.00 0.00 H ATOM 1712 HG1 THR C 26 31.841 53.819 15.762 1.00 0.00 H ATOM 1713 HG23 THR C 26 29.975 53.715 12.128 1.00 0.00 H ATOM 1714 HG21 THR C 26 29.031 54.125 13.581 1.00 0.00 H ATOM 1715 HG22 THR C 26 30.251 55.264 12.962 1.00 0.00 H ATOM 1716 H THR C 26 32.654 52.020 15.308 1.00 0.00 H ATOM 1717 N GLN C 27 31.988 51.109 12.186 1.00 17.35 N ATOM 1718 CA GLN C 27 32.108 50.342 10.940 1.00 18.60 C ATOM 1719 C GLN C 27 31.570 48.931 11.103 1.00 18.37 C ATOM 1720 O GLN C 27 30.794 48.457 10.248 1.00 19.03 O ATOM 1721 CB GLN C 27 33.535 50.350 10.458 1.00 20.18 C ATOM 1722 CG GLN C 27 34.030 51.768 9.996 1.00 24.79 C ATOM 1723 HA GLN C 27 31.495 50.823 10.178 1.00 0.00 H ATOM 1724 HB2 GLN C 27 34.176 50.008 11.270 1.00 0.00 H ATOM 1725 HB3 GLN C 27 33.619 49.663 9.616 1.00 0.00 H ATOM 1726 HG2 GLN C 27 33.405 52.120 9.176 1.00 0.00 H ATOM 1727 HG3 GLN C 27 33.962 52.465 10.831 1.00 0.00 H ATOM 1728 H GLN C 27 32.851 51.469 12.642 1.00 0.00 H ATOM 1729 N ALA C 28 31.888 48.288 12.238 1.00 17.05 N ATOM 1730 CA ALA C 28 31.369 46.962 12.492 1.00 16.66 C ATOM 1731 C ALA C 28 29.844 46.930 12.501 1.00 16.76 C ATOM 1732 O ALA C 28 29.263 45.984 11.956 1.00 17.44 O ATOM 1733 CB ALA C 28 31.902 46.421 13.802 1.00 15.36 C ATOM 1734 HA ALA C 28 31.709 46.328 11.673 1.00 0.00 H ATOM 1735 HB1 ALA C 28 32.990 46.372 13.758 1.00 0.00 H ATOM 1736 HB2 ALA C 28 31.600 47.080 14.616 1.00 0.00 H ATOM 1737 HB3 ALA C 28 31.499 45.423 13.972 1.00 0.00 H ATOM 1738 H ALA C 28 32.509 48.744 12.936 1.00 0.00 H ATOM 1739 N MET C 29 29.203 47.917 13.143 1.00 16.57 N ATOM 1740 CA MET C 29 27.759 47.957 13.273 1.00 18.65 C ATOM 1741 C MET C 29 27.030 48.280 11.973 1.00 20.17 C ATOM 1742 O MET C 29 25.886 47.888 11.795 1.00 21.75 O ATOM 1743 CB MET C 29 27.357 48.867 14.382 1.00 18.39 C ATOM 1744 CG MET C 29 27.809 48.284 15.700 1.00 20.47 C ATOM 1745 SD MET C 29 27.129 49.171 17.117 1.00 30.39 S ATOM 1746 CE MET C 29 25.455 48.525 17.049 1.00 35.31 C ATOM 1747 HA MET C 29 27.443 46.944 13.525 1.00 0.00 H ATOM 1748 HB2 MET C 29 27.821 49.843 14.238 1.00 0.00 H ATOM 1749 HB3 MET C 29 26.273 48.978 14.386 1.00 0.00 H ATOM 1750 HG2 MET C 29 28.897 48.329 15.748 1.00 0.00 H ATOM 1751 HG3 MET C 29 27.487 47.244 15.751 1.00 0.00 H ATOM 1752 HE1 MET C 29 25.006 48.784 16.090 1.00 0.00 H ATOM 1753 HE2 MET C 29 25.481 47.441 17.159 1.00 0.00 H ATOM 1754 HE3 MET C 29 24.866 48.960 17.857 1.00 0.00 H ATOM 1755 H MET C 29 29.764 48.685 13.565 1.00 0.00 H ATOM 1756 N GLU C 30 27.750 48.937 11.090 1.00 19.83 N ATOM 1757 CA GLU C 30 27.307 49.168 9.710 1.00 21.96 C ATOM 1758 C GLU C 30 27.315 47.872 8.918 1.00 22.43 C ATOM 1759 O GLU C 30 26.443 47.632 8.072 1.00 26.36 O ATOM 1760 CB GLU C 30 28.195 50.191 8.998 1.00 23.80 C ATOM 1761 CG GLU C 30 28.166 51.613 9.675 1.00 28.37 C ATOM 1762 CD GLU C 30 29.040 52.686 8.995 1.00 38.26 C ATOM 1763 OE1 GLU C 30 30.115 52.338 8.437 1.00 42.89 O ATOM 1764 OE2 GLU C 30 28.660 53.889 9.048 1.00 44.68 O ATOM 1765 HA GLU C 30 26.291 49.560 9.763 1.00 0.00 H ATOM 1766 HB2 GLU C 30 29.221 49.824 9.005 1.00 0.00 H ATOM 1767 HB3 GLU C 30 27.853 50.290 7.968 1.00 0.00 H ATOM 1768 HG2 GLU C 30 27.135 51.967 9.672 1.00 0.00 H ATOM 1769 HG3 GLU C 30 28.508 51.503 10.704 1.00 0.00 H ATOM 1770 H GLU C 30 28.676 49.310 11.383 1.00 0.00 H ATOM 1771 N LYS C 31 28.301 47.036 9.150 1.00 20.89 N ATOM 1772 CA LYS C 31 28.448 45.834 8.363 1.00 19.98 C ATOM 1773 C LYS C 31 27.598 44.651 8.873 1.00 19.78 C ATOM 1774 O LYS C 31 27.162 43.859 8.077 1.00 21.01 O ATOM 1775 CB LYS C 31 29.876 45.339 8.344 1.00 23.39 C ATOM 1776 CG LYS C 31 30.806 46.027 7.457 1.00 27.83 C ATOM 1777 CD LYS C 31 32.252 45.445 7.549 1.00 31.27 C ATOM 1778 CE LYS C 31 32.398 43.977 7.184 1.00 32.37 C ATOM 1779 NZ LYS C 31 32.882 43.774 5.845 1.00 30.84 N ATOM 1780 HA LYS C 31 28.112 46.135 7.371 1.00 0.00 H ATOM 1781 HB2 LYS C 31 30.266 45.423 9.358 1.00 0.00 H ATOM 1782 HB3 LYS C 31 29.856 44.290 8.049 1.00 0.00 H ATOM 1783 HG2 LYS C 31 30.452 45.927 6.431 1.00 0.00 H ATOM 1784 HG3 LYS C 31 30.834 47.082 7.729 1.00 0.00 H ATOM 1785 HD2 LYS C 31 32.888 46.022 6.878 1.00 0.00 H ATOM 1786 HD3 LYS C 31 32.599 45.571 8.575 1.00 0.00 H ATOM 1787 HE2 LYS C 31 31.424 43.497 7.277 1.00 0.00 H ATOM 1788 HE3 LYS C 31 33.098 43.514 7.880 1.00 0.00 H ATOM 1789 HZ1 LYS C 31 32.218 44.203 5.169 1.00 0.00 H ATOM 1790 HZ2 LYS C 31 33.817 44.219 5.744 1.00 0.00 H ATOM 1791 HZ3 LYS C 31 32.960 42.754 5.657 1.00 0.00 H ATOM 1792 H LYS C 31 28.983 47.242 9.908 1.00 0.00 H ATOM 1793 N TYR C 32 27.450 44.519 10.193 1.00 16.87 N ATOM 1794 CA TYR C 32 26.854 43.338 10.824 1.00 17.58 C ATOM 1795 C TYR C 32 25.738 43.669 11.760 1.00 18.70 C ATOM 1796 O TYR C 32 25.770 44.720 12.390 1.00 22.70 O ATOM 1797 CB TYR C 32 27.907 42.597 11.625 1.00 18.35 C ATOM 1798 CG TYR C 32 29.194 42.295 10.874 1.00 16.67 C ATOM 1799 CD1 TYR C 32 29.188 41.299 9.922 1.00 17.88 C ATOM 1800 CD2 TYR C 32 30.386 42.974 11.063 1.00 16.89 C ATOM 1801 CE1 TYR C 32 30.327 40.974 9.215 1.00 18.39 C ATOM 1802 CE2 TYR C 32 31.532 42.664 10.376 1.00 20.78 C ATOM 1803 CZ TYR C 32 31.480 41.642 9.422 1.00 19.64 C ATOM 1804 OH TYR C 32 32.625 41.399 8.800 1.00 25.48 O ATOM 1805 HA TYR C 32 26.456 42.732 10.010 1.00 0.00 H ATOM 1806 HB3 TYR C 32 27.478 41.651 11.954 1.00 0.00 H ATOM 1807 HB2 TYR C 32 28.158 43.203 12.496 1.00 0.00 H ATOM 1808 HD2 TYR C 32 30.415 43.788 11.787 1.00 0.00 H ATOM 1809 HE2 TYR C 32 32.461 43.201 10.569 1.00 0.00 H ATOM 1810 HE1 TYR C 32 30.295 40.169 8.481 1.00 0.00 H ATOM 1811 HD1 TYR C 32 28.264 40.756 9.723 1.00 0.00 H ATOM 1812 HH TYR C 32 32.496 40.666 8.147 1.00 0.00 H ATOM 1813 H TYR C 32 27.774 45.294 10.805 1.00 0.00 H ATOM 1814 N ASN C 33 24.798 42.739 11.915 1.00 18.82 N ATOM 1815 CA ASN C 33 23.716 42.773 12.840 1.00 20.89 C ATOM 1816 C ASN C 33 23.949 41.898 14.056 1.00 19.89 C ATOM 1817 O ASN C 33 23.520 42.236 15.179 1.00 23.33 O ATOM 1818 CB ASN C 33 22.386 42.355 12.102 1.00 23.11 C ATOM 1819 HA ASN C 33 23.633 43.794 13.212 1.00 0.00 H ATOM 1820 HB2 ASN C 33 22.191 43.050 11.286 1.00 0.00 H ATOM 1821 HB3 ASN C 33 22.495 41.346 11.704 1.00 0.00 H ATOM 1822 H ASN C 33 24.860 41.904 11.299 1.00 0.00 H ATOM 1823 N ILE C 34 24.679 40.824 13.877 1.00 16.64 N ATOM 1824 CA ILE C 34 24.893 39.789 14.917 1.00 14.08 C ATOM 1825 C ILE C 34 25.956 40.264 15.844 1.00 12.98 C ATOM 1826 O ILE C 34 27.074 40.590 15.402 1.00 12.77 O ATOM 1827 CB ILE C 34 25.222 38.459 14.310 1.00 14.28 C ATOM 1828 CG1 ILE C 34 24.042 37.971 13.432 1.00 16.43 C ATOM 1829 CG2 ILE C 34 25.490 37.438 15.405 1.00 16.25 C ATOM 1830 CD1 ILE C 34 24.444 36.710 12.581 1.00 21.97 C ATOM 1831 HA ILE C 34 23.972 39.638 15.481 1.00 0.00 H ATOM 1832 HB ILE C 34 26.113 38.568 13.692 1.00 0.00 H ATOM 1833 HG12 ILE C 34 23.203 37.711 14.077 1.00 0.00 H ATOM 1834 HG13 ILE C 34 23.745 38.774 12.758 1.00 0.00 H ATOM 1835 HD11 ILE C 34 25.279 36.965 11.929 1.00 0.00 H ATOM 1836 HD12 ILE C 34 24.737 35.900 13.250 1.00 0.00 H ATOM 1837 HD13 ILE C 34 23.593 36.394 11.977 1.00 0.00 H ATOM 1838 HG21 ILE C 34 26.330 37.772 16.014 1.00 0.00 H ATOM 1839 HG22 ILE C 34 24.603 37.337 16.031 1.00 0.00 H ATOM 1840 HG23 ILE C 34 25.728 36.475 14.952 1.00 0.00 H ATOM 1841 H ILE C 34 25.135 40.690 12.952 1.00 0.00 H ATOM 1842 N GLU C 35 25.700 40.222 17.149 1.00 12.26 N ATOM 1843 CA GLU C 35 26.720 40.760 18.124 1.00 10.78 C ATOM 1844 C GLU C 35 28.065 40.057 18.010 1.00 10.14 C ATOM 1845 O GLU C 35 29.109 40.751 18.103 1.00 10.02 O ATOM 1846 CB GLU C 35 26.157 40.776 19.539 1.00 10.66 C ATOM 1847 CG GLU C 35 24.991 41.700 19.753 1.00 11.74 C ATOM 1848 CD GLU C 35 24.156 41.377 20.965 1.00 11.35 C ATOM 1849 OE1 GLU C 35 24.169 40.298 21.489 1.00 12.59 O ATOM 1850 OE2 GLU C 35 23.385 42.347 21.337 1.00 12.40 O ATOM 1851 HA GLU C 35 26.927 41.796 17.856 1.00 0.00 H ATOM 1852 HB2 GLU C 35 25.836 39.764 19.786 1.00 0.00 H ATOM 1853 HB3 GLU C 35 26.956 41.078 20.217 1.00 0.00 H ATOM 1854 HG2 GLU C 35 25.375 42.714 19.863 1.00 0.00 H ATOM 1855 HG3 GLU C 35 24.349 41.649 18.873 1.00 0.00 H ATOM 1856 H GLU C 35 24.805 39.822 17.495 1.00 0.00 H ATOM 1857 N LYS C 36 28.080 38.745 17.921 1.00 10.30 N ATOM 1858 CA LYS C 36 29.313 37.981 17.804 1.00 10.74 C ATOM 1859 C LYS C 36 30.160 38.468 16.615 1.00 10.44 C ATOM 1860 O LYS C 36 31.389 38.597 16.709 1.00 10.63 O ATOM 1861 CB LYS C 36 28.972 36.495 17.627 1.00 13.40 C ATOM 1862 CG LYS C 36 30.208 35.576 17.462 1.00 14.31 C ATOM 1863 CD LYS C 36 29.782 34.117 17.397 1.00 19.61 C ATOM 1864 CE LYS C 36 28.839 33.731 16.395 1.00 24.85 C ATOM 1865 NZ LYS C 36 28.745 32.157 16.523 1.00 30.42 N ATOM 1866 HA LYS C 36 29.897 38.124 18.713 1.00 0.00 H ATOM 1867 HB2 LYS C 36 28.415 36.165 18.504 1.00 0.00 H ATOM 1868 HB3 LYS C 36 28.347 36.391 16.740 1.00 0.00 H ATOM 1869 HG2 LYS C 36 30.731 35.839 16.542 1.00 0.00 H ATOM 1870 HG3 LYS C 36 30.876 35.717 18.311 1.00 0.00 H ATOM 1871 HD2 LYS C 36 30.683 33.524 17.238 1.00 0.00 H ATOM 1872 HD3 LYS C 36 29.348 33.864 18.364 1.00 0.00 H ATOM 1873 HE2 LYS C 36 29.191 34.017 15.404 1.00 0.00 H ATOM 1874 HE3 LYS C 36 27.869 34.191 16.581 1.00 0.00 H ATOM 1875 HZ1 LYS C 36 29.683 31.740 16.354 1.00 0.00 H ATOM 1876 HZ2 LYS C 36 28.420 31.907 17.479 1.00 0.00 H ATOM 1877 HZ3 LYS C 36 28.071 31.793 15.820 1.00 0.00 H ATOM 1878 H LYS C 36 27.175 38.233 17.935 1.00 0.00 H ATOM 1879 N ASP C 37 29.505 38.778 15.509 1.00 10.70 N ATOM 1880 CA ASP C 37 30.199 39.180 14.324 1.00 11.33 C ATOM 1881 C ASP C 37 30.721 40.618 14.423 1.00 12.23 C ATOM 1882 O ASP C 37 31.837 40.914 13.910 1.00 12.47 O ATOM 1883 CB ASP C 37 29.263 38.950 13.084 1.00 12.83 C ATOM 1884 CG ASP C 37 29.055 37.471 12.774 1.00 18.10 C ATOM 1885 OD1 ASP C 37 29.535 36.579 13.460 1.00 21.91 O ATOM 1886 OD2 ASP C 37 28.375 37.217 11.801 1.00 24.78 O ATOM 1887 HA ASP C 37 31.090 38.565 14.200 1.00 0.00 H ATOM 1888 HB2 ASP C 37 28.293 39.404 13.289 1.00 0.00 H ATOM 1889 HB3 ASP C 37 29.711 39.430 12.214 1.00 0.00 H ATOM 1890 H ASP C 37 28.466 38.729 15.500 1.00 0.00 H ATOM 1891 N ILE C 38 29.971 41.499 15.092 1.00 12.29 N ATOM 1892 CA ILE C 38 30.480 42.824 15.391 1.00 11.55 C ATOM 1893 C ILE C 38 31.733 42.721 16.261 1.00 11.58 C ATOM 1894 O ILE C 38 32.760 43.346 15.995 1.00 11.40 O ATOM 1895 CB ILE C 38 29.380 43.653 16.103 1.00 11.17 C ATOM 1896 CG1 ILE C 38 28.139 43.814 15.191 1.00 13.88 C ATOM 1897 CG2 ILE C 38 29.884 44.990 16.624 1.00 12.65 C ATOM 1898 CD1 ILE C 38 26.928 44.366 15.868 1.00 17.49 C ATOM 1899 HA ILE C 38 30.752 43.328 14.463 1.00 0.00 H ATOM 1900 HB ILE C 38 29.080 43.091 16.987 1.00 0.00 H ATOM 1901 HG12 ILE C 38 28.404 44.483 14.373 1.00 0.00 H ATOM 1902 HG13 ILE C 38 27.885 42.833 14.789 1.00 0.00 H ATOM 1903 HD11 ILE C 38 26.635 43.703 16.682 1.00 0.00 H ATOM 1904 HD12 ILE C 38 27.155 45.355 16.266 1.00 0.00 H ATOM 1905 HD13 ILE C 38 26.113 44.441 15.148 1.00 0.00 H ATOM 1906 HG21 ILE C 38 30.687 44.820 17.342 1.00 0.00 H ATOM 1907 HG22 ILE C 38 30.260 45.585 15.791 1.00 0.00 H ATOM 1908 HG23 ILE C 38 29.066 45.520 17.111 1.00 0.00 H ATOM 1909 H ILE C 38 29.014 41.232 15.401 1.00 0.00 H ATOM 1910 N ALA C 39 31.662 41.911 17.323 1.00 10.24 N ATOM 1911 CA ALA C 39 32.786 41.696 18.235 1.00 10.49 C ATOM 1912 C ALA C 39 34.001 41.182 17.505 1.00 10.98 C ATOM 1913 O ALA C 39 35.108 41.629 17.760 1.00 11.16 O ATOM 1914 CB ALA C 39 32.375 40.756 19.378 1.00 10.39 C ATOM 1915 HA ALA C 39 33.060 42.658 18.668 1.00 0.00 H ATOM 1916 HB1 ALA C 39 31.547 41.199 19.932 1.00 0.00 H ATOM 1917 HB2 ALA C 39 32.064 39.797 18.964 1.00 0.00 H ATOM 1918 HB3 ALA C 39 33.223 40.607 20.047 1.00 0.00 H ATOM 1919 H ALA C 39 30.769 41.412 17.509 1.00 0.00 H ATOM 1920 N ALA C 40 33.804 40.206 16.616 1.00 11.12 N ATOM 1921 CA ALA C 40 34.881 39.591 15.890 1.00 10.14 C ATOM 1922 C ALA C 40 35.580 40.627 15.007 1.00 10.47 C ATOM 1923 O ALA C 40 36.807 40.638 14.898 1.00 12.01 O ATOM 1924 CB ALA C 40 34.374 38.425 15.027 1.00 12.44 C ATOM 1925 HA ALA C 40 35.593 39.195 16.614 1.00 0.00 H ATOM 1926 HB1 ALA C 40 33.912 37.674 15.668 1.00 0.00 H ATOM 1927 HB2 ALA C 40 33.639 38.796 14.313 1.00 0.00 H ATOM 1928 HB3 ALA C 40 35.212 37.981 14.490 1.00 0.00 H ATOM 1929 H ALA C 40 32.833 39.878 16.442 1.00 0.00 H ATOM 1930 N TYR C 41 34.828 41.459 14.314 1.00 11.91 N ATOM 1931 CA TYR C 41 35.456 42.476 13.494 1.00 11.96 C ATOM 1932 C TYR C 41 36.330 43.399 14.284 1.00 12.52 C ATOM 1933 O TYR C 41 37.458 43.684 13.888 1.00 13.53 O ATOM 1934 CB TYR C 41 34.355 43.222 12.785 1.00 13.73 C ATOM 1935 CG TYR C 41 34.853 44.323 11.875 1.00 15.04 C ATOM 1936 CD1 TYR C 41 34.980 44.117 10.519 1.00 16.68 C ATOM 1937 CD2 TYR C 41 35.108 45.575 12.339 1.00 16.84 C ATOM 1938 CE1 TYR C 41 35.370 45.150 9.674 1.00 19.81 C ATOM 1939 CE2 TYR C 41 35.509 46.633 11.528 1.00 17.96 C ATOM 1940 CZ TYR C 41 35.635 46.415 10.170 1.00 20.42 C ATOM 1941 OH TYR C 41 36.040 47.490 9.318 1.00 23.22 O ATOM 1942 HA TYR C 41 36.125 42.003 12.775 1.00 0.00 H ATOM 1943 HB3 TYR C 41 33.701 43.665 13.536 1.00 0.00 H ATOM 1944 HB2 TYR C 41 33.788 42.510 12.185 1.00 0.00 H ATOM 1945 HD2 TYR C 41 34.992 45.761 13.407 1.00 0.00 H ATOM 1946 HE2 TYR C 41 35.719 47.613 11.956 1.00 0.00 H ATOM 1947 HE1 TYR C 41 35.469 44.961 8.605 1.00 0.00 H ATOM 1948 HD1 TYR C 41 34.772 43.131 10.103 1.00 0.00 H ATOM 1949 HH TYR C 41 36.081 47.170 8.382 1.00 0.00 H ATOM 1950 H TYR C 41 33.791 41.386 14.355 1.00 0.00 H ATOM 1951 N ILE C 42 35.835 43.868 15.428 1.00 10.89 N ATOM 1952 CA ILE C 42 36.584 44.811 16.230 1.00 11.21 C ATOM 1953 C ILE C 42 37.870 44.135 16.798 1.00 11.20 C ATOM 1954 O ILE C 42 38.988 44.649 16.661 1.00 12.37 O ATOM 1955 CB ILE C 42 35.687 45.361 17.367 1.00 11.62 C ATOM 1956 CG1 ILE C 42 34.440 46.071 16.843 1.00 11.01 C ATOM 1957 CG2 ILE C 42 36.535 46.262 18.277 1.00 12.90 C ATOM 1958 CD1 ILE C 42 33.399 46.290 17.892 1.00 12.13 C ATOM 1959 HA ILE C 42 36.896 45.649 15.606 1.00 0.00 H ATOM 1960 HB ILE C 42 35.308 44.522 17.951 1.00 0.00 H ATOM 1961 HG12 ILE C 42 34.736 47.040 16.442 1.00 0.00 H ATOM 1962 HG13 ILE C 42 34.007 45.467 16.046 1.00 0.00 H ATOM 1963 HD11 ILE C 42 33.084 45.328 18.296 1.00 0.00 H ATOM 1964 HD12 ILE C 42 33.814 46.903 18.692 1.00 0.00 H ATOM 1965 HD13 ILE C 42 32.542 46.798 17.451 1.00 0.00 H ATOM 1966 HG21 ILE C 42 37.354 45.680 18.701 1.00 0.00 H ATOM 1967 HG22 ILE C 42 36.939 47.089 17.693 1.00 0.00 H ATOM 1968 HG23 ILE C 42 35.912 46.654 19.081 1.00 0.00 H ATOM 1969 H ILE C 42 34.898 43.552 15.749 1.00 0.00 H ATOM 1970 N LYS C 43 37.719 42.932 17.352 1.00 10.37 N ATOM 1971 CA LYS C 43 38.864 42.188 17.900 1.00 10.59 C ATOM 1972 C LYS C 43 39.926 42.000 16.848 1.00 11.86 C ATOM 1973 O LYS C 43 41.104 42.214 17.116 1.00 12.17 O ATOM 1974 CB LYS C 43 38.338 40.840 18.503 1.00 10.72 C ATOM 1975 CG LYS C 43 39.414 39.979 19.122 1.00 11.59 C ATOM 1976 CD LYS C 43 40.187 39.128 18.065 1.00 11.59 C ATOM 1977 CE LYS C 43 40.753 37.852 18.685 1.00 12.17 C ATOM 1978 NZ LYS C 43 41.904 38.166 19.619 1.00 11.91 N ATOM 1979 HA LYS C 43 39.343 42.749 18.703 1.00 0.00 H ATOM 1980 HB2 LYS C 43 37.601 41.073 19.272 1.00 0.00 H ATOM 1981 HB3 LYS C 43 37.861 40.271 17.705 1.00 0.00 H ATOM 1982 HG2 LYS C 43 40.125 40.625 19.637 1.00 0.00 H ATOM 1983 HG3 LYS C 43 38.950 39.304 19.842 1.00 0.00 H ATOM 1984 HD2 LYS C 43 39.505 38.859 17.258 1.00 0.00 H ATOM 1985 HD3 LYS C 43 41.008 39.722 17.662 1.00 0.00 H ATOM 1986 HE2 LYS C 43 41.108 37.196 17.890 1.00 0.00 H ATOM 1987 HE3 LYS C 43 39.966 37.348 19.246 1.00 0.00 H ATOM 1988 HZ1 LYS C 43 42.660 38.643 19.087 1.00 0.00 H ATOM 1989 HZ2 LYS C 43 41.570 38.788 20.382 1.00 0.00 H ATOM 1990 HZ3 LYS C 43 42.270 37.282 20.026 1.00 0.00 H ATOM 1991 H LYS C 43 36.770 42.509 17.398 1.00 0.00 H ATOM 1992 N LYS C 44 39.515 41.560 15.650 1.00 12.61 N ATOM 1993 CA LYS C 44 40.473 41.195 14.588 1.00 14.50 C ATOM 1994 C LYS C 44 41.193 42.457 14.139 1.00 14.91 C ATOM 1995 O LYS C 44 42.443 42.457 13.916 1.00 15.96 O ATOM 1996 CB LYS C 44 39.728 40.508 13.473 1.00 15.18 C ATOM 1997 CG LYS C 44 39.428 39.063 13.782 1.00 16.77 C ATOM 1998 CD LYS C 44 38.527 38.423 12.654 1.00 21.28 C ATOM 1999 CE LYS C 44 37.925 37.055 12.920 1.00 24.97 C ATOM 2000 NZ LYS C 44 37.092 36.624 11.691 1.00 28.50 N ATOM 2001 HA LYS C 44 41.228 40.495 14.944 1.00 0.00 H ATOM 2002 HB2 LYS C 44 38.787 41.032 13.306 1.00 0.00 H ATOM 2003 HB3 LYS C 44 40.334 40.554 12.568 1.00 0.00 H ATOM 2004 HG2 LYS C 44 40.365 38.510 13.848 1.00 0.00 H ATOM 2005 HG3 LYS C 44 38.904 39.003 14.736 1.00 0.00 H ATOM 2006 HD2 LYS C 44 37.702 39.111 12.467 1.00 0.00 H ATOM 2007 HD3 LYS C 44 39.140 38.340 11.756 1.00 0.00 H ATOM 2008 HE2 LYS C 44 37.282 37.103 13.799 1.00 0.00 H ATOM 2009 HE3 LYS C 44 38.722 36.332 13.093 1.00 0.00 H ATOM 2010 HZ1 LYS C 44 36.333 37.316 11.528 1.00 0.00 H ATOM 2011 HZ2 LYS C 44 37.708 36.580 10.854 1.00 0.00 H ATOM 2012 HZ3 LYS C 44 36.676 35.687 11.867 1.00 0.00 H ATOM 2013 H LYS C 44 38.495 41.474 15.464 1.00 0.00 H ATOM 2014 N GLU C 45 40.460 43.551 13.981 1.00 13.51 N ATOM 2015 CA GLU C 45 41.109 44.808 13.578 1.00 14.66 C ATOM 2016 C GLU C 45 42.090 45.274 14.607 1.00 14.82 C ATOM 2017 O GLU C 45 43.166 45.737 14.274 1.00 17.53 O ATOM 2018 CB GLU C 45 40.126 45.901 13.355 1.00 14.58 C ATOM 2019 CG GLU C 45 40.777 47.217 12.970 1.00 14.21 C ATOM 2020 CD GLU C 45 39.805 48.195 12.300 1.00 16.83 C ATOM 2021 OE1 GLU C 45 39.937 49.415 12.535 1.00 22.10 O ATOM 2022 OE2 GLU C 45 38.927 47.751 11.519 1.00 20.51 O ATOM 2023 HA GLU C 45 41.624 44.587 12.643 1.00 0.00 H ATOM 2024 HB2 GLU C 45 39.449 45.601 12.555 1.00 0.00 H ATOM 2025 HB3 GLU C 45 39.558 46.050 14.273 1.00 0.00 H ATOM 2026 HG2 GLU C 45 41.174 47.685 13.871 1.00 0.00 H ATOM 2027 HG3 GLU C 45 41.594 47.011 12.279 1.00 0.00 H ATOM 2028 H GLU C 45 39.433 43.520 14.141 1.00 0.00 H ATOM 2029 N PHE C 46 41.748 45.174 15.885 1.00 13.91 N ATOM 2030 CA PHE C 46 42.648 45.622 16.937 1.00 13.25 C ATOM 2031 C PHE C 46 43.862 44.718 17.026 1.00 14.50 C ATOM 2032 O PHE C 46 44.979 45.207 17.228 1.00 14.89 O ATOM 2033 CB PHE C 46 41.930 45.838 18.274 1.00 12.31 C ATOM 2034 CG PHE C 46 41.502 47.260 18.482 1.00 12.94 C ATOM 2035 CD1 PHE C 46 40.631 47.896 17.576 1.00 15.34 C ATOM 2036 CD2 PHE C 46 42.018 48.016 19.539 1.00 14.98 C ATOM 2037 CE1 PHE C 46 40.336 49.267 17.705 1.00 17.53 C ATOM 2038 CE2 PHE C 46 41.661 49.356 19.687 1.00 15.86 C ATOM 2039 CZ PHE C 46 40.847 49.966 18.775 1.00 17.36 C ATOM 2040 HA PHE C 46 43.019 46.611 16.668 1.00 0.00 H ATOM 2041 HB2 PHE C 46 41.046 45.201 18.302 1.00 0.00 H ATOM 2042 HB3 PHE C 46 42.605 45.556 19.082 1.00 0.00 H ATOM 2043 HD2 PHE C 46 42.703 47.556 20.251 1.00 0.00 H ATOM 2044 HE2 PHE C 46 42.035 49.923 20.539 1.00 0.00 H ATOM 2045 HZ PHE C 46 40.599 51.020 18.896 1.00 0.00 H ATOM 2046 HE1 PHE C 46 39.711 49.769 16.966 1.00 0.00 H ATOM 2047 HD1 PHE C 46 40.181 47.321 16.767 1.00 0.00 H ATOM 2048 H PHE C 46 40.824 44.770 16.138 1.00 0.00 H ATOM 2049 N ASP C 47 43.716 43.413 16.886 1.00 13.68 N ATOM 2050 CA ASP C 47 44.904 42.543 16.854 1.00 14.78 C ATOM 2051 C ASP C 47 45.876 42.933 15.719 1.00 17.31 C ATOM 2052 O ASP C 47 47.080 42.916 15.891 1.00 17.56 O ATOM 2053 CB ASP C 47 44.494 41.077 16.645 1.00 14.31 C ATOM 2054 CG ASP C 47 44.055 40.346 17.911 1.00 13.01 C ATOM 2055 OD1 ASP C 47 44.141 40.853 19.008 1.00 14.72 O ATOM 2056 OD2 ASP C 47 43.698 39.169 17.747 1.00 15.64 O ATOM 2057 HA ASP C 47 45.406 42.668 17.814 1.00 0.00 H ATOM 2058 HB2 ASP C 47 43.666 41.054 15.936 1.00 0.00 H ATOM 2059 HB3 ASP C 47 45.346 40.543 16.224 1.00 0.00 H ATOM 2060 H ASP C 47 42.765 43.001 16.799 1.00 0.00 H ATOM 2061 N LYS C 48 45.333 43.243 14.562 1.00 17.59 N ATOM 2062 CA LYS C 48 46.124 43.600 13.403 1.00 18.96 C ATOM 2063 C LYS C 48 46.807 44.944 13.603 1.00 20.12 C ATOM 2064 O LYS C 48 48.018 45.071 13.291 1.00 21.42 O ATOM 2065 CB LYS C 48 45.211 43.651 12.172 1.00 21.13 C ATOM 2066 CG LYS C 48 45.908 43.860 10.837 1.00 24.37 C ATOM 2067 CD LYS C 48 44.829 43.851 9.730 1.00 27.48 C ATOM 2068 HA LYS C 48 46.900 42.849 13.258 1.00 0.00 H ATOM 2069 HB2 LYS C 48 44.666 42.708 12.121 1.00 0.00 H ATOM 2070 HB3 LYS C 48 44.506 44.470 12.313 1.00 0.00 H ATOM 2071 HG2 LYS C 48 46.430 44.817 10.838 1.00 0.00 H ATOM 2072 HG3 LYS C 48 46.624 43.057 10.663 1.00 0.00 H ATOM 2073 HD2 LYS C 48 44.309 42.893 9.739 1.00 0.00 H ATOM 2074 HD3 LYS C 48 44.116 44.654 9.913 1.00 0.00 H ATOM 2075 H LYS C 48 44.297 43.231 14.476 1.00 0.00 H ATOM 2076 N LYS C 49 46.063 45.956 14.095 1.00 19.24 N ATOM 2077 CA LYS C 49 46.605 47.320 14.158 1.00 20.31 C ATOM 2078 C LYS C 49 47.486 47.484 15.376 1.00 19.72 C ATOM 2079 O LYS C 49 48.436 48.254 15.326 1.00 22.79 O ATOM 2080 CB LYS C 49 45.475 48.336 14.305 1.00 22.87 C ATOM 2081 CG LYS C 49 45.280 49.412 13.353 1.00 29.22 C ATOM 2082 CD LYS C 49 43.968 49.362 12.668 1.00 33.09 C ATOM 2083 CE LYS C 49 42.915 50.079 13.426 1.00 33.03 C ATOM 2084 NZ LYS C 49 42.180 50.983 12.450 1.00 31.51 N ATOM 2085 HA LYS C 49 47.168 47.485 13.239 1.00 0.00 H ATOM 2086 HB2 LYS C 49 44.548 47.763 14.312 1.00 0.00 H ATOM 2087 HB3 LYS C 49 45.615 48.810 15.277 1.00 0.00 H ATOM 2088 HG2 LYS C 49 45.357 50.361 13.884 1.00 0.00 H ATOM 2089 HG3 LYS C 49 46.066 49.354 12.600 1.00 0.00 H ATOM 2090 HD2 LYS C 49 44.067 49.821 11.684 1.00 0.00 H ATOM 2091 HD3 LYS C 49 43.671 48.320 12.553 1.00 0.00 H ATOM 2092 HE2 LYS C 49 43.368 50.676 14.217 1.00 0.00 H ATOM 2093 HE3 LYS C 49 42.220 49.363 13.865 1.00 0.00 H ATOM 2094 HZ1 LYS C 49 42.851 51.659 12.033 1.00 0.00 H ATOM 2095 HZ2 LYS C 49 41.755 50.405 11.697 1.00 0.00 H ATOM 2096 HZ3 LYS C 49 41.433 51.501 12.955 1.00 0.00 H ATOM 2097 H LYS C 49 45.097 45.769 14.433 1.00 0.00 H ATOM 2098 N TYR C 50 47.151 46.858 16.509 1.00 19.16 N ATOM 2099 CA TYR C 50 47.810 47.171 17.806 1.00 19.42 C ATOM 2100 C TYR C 50 48.398 45.933 18.513 1.00 20.91 C ATOM 2101 O TYR C 50 48.613 45.977 19.732 1.00 23.59 O ATOM 2102 CB TYR C 50 46.803 47.818 18.740 1.00 19.73 C ATOM 2103 CG TYR C 50 46.240 49.101 18.215 1.00 18.56 C ATOM 2104 CD1 TYR C 50 47.072 50.216 18.025 1.00 24.07 C ATOM 2105 CD2 TYR C 50 44.896 49.212 17.902 1.00 20.61 C ATOM 2106 CE1 TYR C 50 46.519 51.418 17.558 1.00 24.77 C ATOM 2107 CE2 TYR C 50 44.377 50.329 17.449 1.00 21.79 C ATOM 2108 CZ TYR C 50 45.167 51.458 17.262 1.00 25.31 C ATOM 2109 OH TYR C 50 44.672 52.602 16.786 1.00 32.15 O ATOM 2110 HA TYR C 50 48.638 47.841 17.575 1.00 0.00 H ATOM 2111 HB3 TYR C 50 47.295 48.021 19.691 1.00 0.00 H ATOM 2112 HB2 TYR C 50 45.981 47.120 18.899 1.00 0.00 H ATOM 2113 HD2 TYR C 50 44.249 48.345 18.036 1.00 0.00 H ATOM 2114 HE2 TYR C 50 43.313 50.372 17.216 1.00 0.00 H ATOM 2115 HE1 TYR C 50 47.142 52.303 17.431 1.00 0.00 H ATOM 2116 HD1 TYR C 50 48.139 50.148 18.239 1.00 0.00 H ATOM 2117 HH TYR C 50 45.396 53.275 16.730 1.00 0.00 H ATOM 2118 H TYR C 50 46.408 46.131 16.483 1.00 0.00 H ATOM 2119 N ASN C 51 48.565 44.831 17.747 1.00 18.30 N ATOM 2120 CA ASN C 51 49.145 43.597 18.177 1.00 19.61 C ATOM 2121 C ASN C 51 48.189 42.821 19.034 1.00 17.67 C ATOM 2122 O ASN C 51 47.378 43.368 19.783 1.00 18.19 O ATOM 2123 CB ASN C 51 50.418 43.777 18.991 1.00 21.39 C ATOM 2124 CG ASN C 51 51.530 44.379 18.194 1.00 26.84 C ATOM 2125 OD1 ASN C 51 51.551 44.329 16.937 1.00 32.34 O ATOM 2126 ND2 ASN C 51 52.496 44.949 18.919 1.00 31.47 N ATOM 2127 HA ASN C 51 49.381 43.066 17.255 1.00 0.00 H ATOM 2128 HB2 ASN C 51 50.202 44.429 19.837 1.00 0.00 H ATOM 2129 HB3 ASN C 51 50.739 42.802 19.358 1.00 0.00 H ATOM 2130 HD22 ASN C 51 52.428 44.962 19.957 1.00 0.00 H ATOM 2131 HD21 ASN C 51 53.316 45.379 18.446 1.00 0.00 H ATOM 2132 H ASN C 51 48.244 44.886 16.759 1.00 0.00 H ATOM 2133 N PRO C 52 48.266 41.509 18.957 1.00 17.39 N ATOM 2134 CA PRO C 52 47.448 40.690 19.841 1.00 17.91 C ATOM 2135 C PRO C 52 47.817 40.912 21.320 1.00 18.31 C ATOM 2136 O PRO C 52 48.891 41.414 21.625 1.00 19.37 O ATOM 2137 CB PRO C 52 47.758 39.241 19.409 1.00 19.88 C ATOM 2138 CG PRO C 52 48.822 39.351 18.417 1.00 21.26 C ATOM 2139 CD PRO C 52 49.064 40.715 18.024 1.00 18.97 C ATOM 2140 HA PRO C 52 46.389 40.936 19.764 1.00 0.00 H ATOM 2141 HD3 PRO C 52 50.122 40.961 18.115 1.00 0.00 H ATOM 2142 HD2 PRO C 52 48.740 40.884 16.997 1.00 0.00 H ATOM 2143 HG3 PRO C 52 48.540 38.777 17.535 1.00 0.00 H ATOM 2144 HG2 PRO C 52 49.739 38.940 18.839 1.00 0.00 H ATOM 2145 HB2 PRO C 52 48.092 38.651 20.263 1.00 0.00 H ATOM 2146 HB3 PRO C 52 46.875 38.776 18.971 1.00 0.00 H ATOM 2147 N THR C 53 46.977 40.510 22.273 1.00 15.55 N ATOM 2148 CA THR C 53 45.765 39.748 22.088 1.00 14.45 C ATOM 2149 C THR C 53 44.590 40.566 22.698 1.00 12.68 C ATOM 2150 O THR C 53 44.594 40.825 23.909 1.00 13.44 O ATOM 2151 CB THR C 53 45.851 38.408 22.839 1.00 14.66 C ATOM 2152 OG1 THR C 53 47.028 37.746 22.373 1.00 18.46 O ATOM 2153 CG2 THR C 53 44.630 37.506 22.571 1.00 16.68 C ATOM 2154 HA THR C 53 45.617 39.556 21.025 1.00 0.00 H ATOM 2155 HB THR C 53 45.877 38.601 23.912 1.00 0.00 H ATOM 2156 HG1 THR C 53 47.820 38.308 22.566 1.00 0.00 H ATOM 2157 HG23 THR C 53 43.727 38.004 22.924 1.00 0.00 H ATOM 2158 HG21 THR C 53 44.547 37.317 21.501 1.00 0.00 H ATOM 2159 HG22 THR C 53 44.755 36.561 23.099 1.00 0.00 H ATOM 2160 H THR C 53 47.219 40.772 23.250 1.00 0.00 H ATOM 2161 N TRP C 54 43.618 40.898 21.850 1.00 10.86 N ATOM 2162 CA TRP C 54 42.438 41.629 22.277 1.00 9.85 C ATOM 2163 C TRP C 54 41.281 40.697 22.406 1.00 9.31 C ATOM 2164 O TRP C 54 41.186 39.623 21.807 1.00 9.72 O ATOM 2165 CB TRP C 54 42.122 42.725 21.224 1.00 11.34 C ATOM 2166 CG TRP C 54 43.174 43.770 21.180 1.00 12.15 C ATOM 2167 CD1 TRP C 54 44.352 43.707 20.495 1.00 12.99 C ATOM 2168 CD2 TRP C 54 43.139 45.067 21.837 1.00 11.76 C ATOM 2169 NE1 TRP C 54 45.033 44.886 20.680 1.00 14.75 N ATOM 2170 CE2 TRP C 54 44.303 45.748 21.474 1.00 13.41 C ATOM 2171 CE3 TRP C 54 42.212 45.699 22.669 1.00 10.73 C ATOM 2172 CZ2 TRP C 54 44.617 46.979 22.023 1.00 12.68 C ATOM 2173 CZ3 TRP C 54 42.494 46.964 23.173 1.00 11.33 C ATOM 2174 CH2 TRP C 54 43.667 47.627 22.804 1.00 12.81 C ATOM 2175 HA TRP C 54 42.621 42.091 23.247 1.00 0.00 H ATOM 2176 HB2 TRP C 54 42.047 42.259 20.242 1.00 0.00 H ATOM 2177 HB3 TRP C 54 41.171 43.193 21.477 1.00 0.00 H ATOM 2178 HE1 TRP C 54 45.968 45.099 20.278 1.00 0.00 H ATOM 2179 HD1 TRP C 54 44.696 42.861 19.899 1.00 0.00 H ATOM 2180 HZ2 TRP C 54 45.592 47.433 21.846 1.00 0.00 H ATOM 2181 HH2 TRP C 54 43.837 48.653 23.129 1.00 0.00 H ATOM 2182 HZ3 TRP C 54 41.795 47.441 23.860 1.00 0.00 H ATOM 2183 HE3 TRP C 54 41.274 45.204 22.921 1.00 0.00 H ATOM 2184 H TRP C 54 43.707 40.625 20.850 1.00 0.00 H ATOM 2185 N HIS C 55 40.261 41.188 23.139 1.00 8.81 N ATOM 2186 CA HIS C 55 39.024 40.460 23.403 1.00 9.16 C ATOM 2187 C HIS C 55 37.909 41.461 23.320 1.00 7.96 C ATOM 2188 O HIS C 55 38.078 42.577 23.816 1.00 8.75 O ATOM 2189 CB HIS C 55 39.071 39.808 24.791 1.00 9.25 C ATOM 2190 CG HIS C 55 40.339 39.092 25.084 1.00 9.22 C ATOM 2191 ND1 HIS C 55 40.640 37.813 24.634 1.00 9.90 N ATOM 2192 CD2 HIS C 55 41.465 39.558 25.671 1.00 9.08 C ATOM 2193 CE1 HIS C 55 41.874 37.523 24.997 1.00 9.28 C ATOM 2194 NE2 HIS C 55 42.413 38.558 25.631 1.00 10.29 N ATOM 2195 HA HIS C 55 38.878 39.658 22.679 1.00 0.00 H ATOM 2196 HB2 HIS C 55 38.937 40.588 25.540 1.00 0.00 H ATOM 2197 HB3 HIS C 55 38.251 39.094 24.862 1.00 0.00 H ATOM 2198 HD2 HIS C 55 41.599 40.551 26.101 1.00 0.00 H ATOM 2199 HE1 HIS C 55 42.377 36.575 24.805 1.00 0.00 H ATOM 2200 H HIS C 55 40.362 42.142 23.540 1.00 0.00 H ATOM 2201 N CYS C 56 36.765 41.110 22.761 1.00 7.71 N ATOM 2202 CA CYS C 56 35.675 42.068 22.584 1.00 7.13 C ATOM 2203 C CYS C 56 34.357 41.393 22.902 1.00 6.60 C ATOM 2204 O CYS C 56 34.043 40.280 22.438 1.00 8.27 O ATOM 2205 CB CYS C 56 35.665 42.552 21.144 1.00 8.98 C ATOM 2206 SG CYS C 56 34.516 43.921 20.851 1.00 9.74 S ATOM 2207 HA CYS C 56 35.817 42.917 23.253 1.00 0.00 H ATOM 2208 HB2 CYS C 56 35.381 41.719 20.501 1.00 0.00 H ATOM 2209 HB3 CYS C 56 36.670 42.883 20.884 1.00 0.00 H ATOM 2210 HG CYS C 56 34.574 44.292 19.523 1.00 0.00 H ATOM 2211 H CYS C 56 36.637 40.129 22.439 1.00 0.00 H ATOM 2212 N ILE C 57 33.531 42.133 23.663 1.00 7.20 N ATOM 2213 CA ILE C 57 32.154 41.768 24.022 1.00 7.22 C ATOM 2214 C ILE C 57 31.258 42.877 23.539 1.00 7.89 C ATOM 2215 O ILE C 57 31.554 44.044 23.753 1.00 8.80 O ATOM 2216 CB ILE C 57 31.970 41.594 25.534 1.00 7.85 C ATOM 2217 CG1 ILE C 57 33.069 40.763 26.195 1.00 10.27 C ATOM 2218 CG2 ILE C 57 30.570 41.101 25.885 1.00 10.35 C ATOM 2219 CD1 ILE C 57 33.216 39.446 25.765 1.00 13.77 C ATOM 2220 HA ILE C 57 31.910 40.811 23.560 1.00 0.00 H ATOM 2221 HB ILE C 57 32.074 42.591 25.962 1.00 0.00 H ATOM 2222 HG12 ILE C 57 34.016 41.273 26.020 1.00 0.00 H ATOM 2223 HG13 ILE C 57 32.863 40.738 27.265 1.00 0.00 H ATOM 2224 HD11 ILE C 57 32.289 38.901 25.945 1.00 0.00 H ATOM 2225 HD12 ILE C 57 33.444 39.436 24.699 1.00 0.00 H ATOM 2226 HD13 ILE C 57 34.030 38.974 26.316 1.00 0.00 H ATOM 2227 HG21 ILE C 57 29.833 41.822 25.532 1.00 0.00 H ATOM 2228 HG22 ILE C 57 30.395 40.137 25.407 1.00 0.00 H ATOM 2229 HG23 ILE C 57 30.485 40.992 26.966 1.00 0.00 H ATOM 2230 H ILE C 57 33.897 43.036 24.027 1.00 0.00 H ATOM 2231 N VAL C 58 30.156 42.513 22.860 1.00 7.63 N ATOM 2232 CA VAL C 58 29.180 43.462 22.343 1.00 8.28 C ATOM 2233 C VAL C 58 27.793 42.975 22.783 1.00 8.44 C ATOM 2234 O VAL C 58 27.394 41.856 22.501 1.00 9.02 O ATOM 2235 CB VAL C 58 29.255 43.493 20.774 1.00 8.45 C ATOM 2236 CG1 VAL C 58 28.105 44.335 20.208 1.00 11.04 C ATOM 2237 CG2 VAL C 58 30.625 43.944 20.312 1.00 10.18 C ATOM 2238 HA VAL C 58 29.377 44.466 22.720 1.00 0.00 H ATOM 2239 HB VAL C 58 29.125 42.486 20.379 1.00 0.00 H ATOM 2240 HG11 VAL C 58 27.153 43.900 20.513 1.00 0.00 H ATOM 2241 HG12 VAL C 58 28.179 45.353 20.590 1.00 0.00 H ATOM 2242 HG13 VAL C 58 28.168 44.349 19.120 1.00 0.00 H ATOM 2243 HG21 VAL C 58 30.825 44.945 20.695 1.00 0.00 H ATOM 2244 HG22 VAL C 58 31.379 43.253 20.688 1.00 0.00 H ATOM 2245 HG23 VAL C 58 30.653 43.958 19.222 1.00 0.00 H ATOM 2246 H VAL C 58 29.992 41.499 22.695 1.00 0.00 H ATOM 2247 N GLY C 59 26.996 43.804 23.456 1.00 8.86 N ATOM 2248 CA GLY C 59 25.720 43.341 23.886 1.00 9.37 C ATOM 2249 C GLY C 59 24.914 44.375 24.595 1.00 9.66 C ATOM 2250 O GLY C 59 25.396 45.402 24.975 1.00 10.10 O ATOM 2251 HA3 GLY C 59 25.869 42.498 24.561 1.00 0.00 H ATOM 2252 HA2 GLY C 59 25.161 43.009 23.011 1.00 0.00 H ATOM 2253 H GLY C 59 27.302 44.776 23.664 1.00 0.00 H ATOM 2254 N ARG C 60 23.633 44.059 24.797 1.00 9.92 N ATOM 2255 CA ARG C 60 22.695 44.907 25.491 1.00 9.80 C ATOM 2256 C ARG C 60 22.528 44.561 26.969 1.00 10.16 C ATOM 2257 O ARG C 60 22.055 45.411 27.734 1.00 11.73 O ATOM 2258 CB ARG C 60 21.277 44.858 24.810 1.00 11.43 C ATOM 2259 CG ARG C 60 21.310 45.353 23.396 1.00 13.16 C ATOM 2260 CD ARG C 60 19.927 45.226 22.705 1.00 16.20 C ATOM 2261 NE ARG C 60 20.026 45.582 21.309 1.00 19.44 N ATOM 2262 CZ ARG C 60 19.787 46.813 20.861 1.00 23.72 C ATOM 2263 NH1 ARG C 60 19.496 47.751 21.739 1.00 24.91 N ATOM 2264 NH2 ARG C 60 19.905 47.137 19.559 1.00 26.51 N ATOM 2265 HA ARG C 60 23.121 45.908 25.427 1.00 0.00 H ATOM 2266 HB2 ARG C 60 20.921 43.828 24.813 1.00 0.00 H ATOM 2267 HB3 ARG C 60 20.590 45.480 25.384 1.00 0.00 H ATOM 2268 HG2 ARG C 60 21.609 46.401 23.396 1.00 0.00 H ATOM 2269 HG3 ARG C 60 22.039 44.769 22.835 1.00 0.00 H ATOM 2270 HD2 ARG C 60 19.217 45.892 23.196 1.00 0.00 H ATOM 2271 HD3 ARG C 60 19.576 44.197 22.789 1.00 0.00 H ATOM 2272 HE ARG C 60 20.295 44.846 20.625 1.00 0.00 H ATOM 2273 HH12 ARG C 60 19.305 48.722 21.419 1.00 0.00 H ATOM 2274 HH11 ARG C 60 19.458 47.521 22.752 1.00 0.00 H ATOM 2275 HH22 ARG C 60 19.710 48.109 19.245 1.00 0.00 H ATOM 2276 HH21 ARG C 60 20.191 46.415 18.867 1.00 0.00 H ATOM 2277 H ARG C 60 23.291 43.147 24.432 1.00 0.00 H ATOM 2278 N ASN C 61 22.872 43.353 27.366 1.00 9.05 N ATOM 2279 CA ASN C 61 22.735 42.980 28.768 1.00 8.78 C ATOM 2280 C ASN C 61 23.890 42.042 29.169 1.00 9.14 C ATOM 2281 O ASN C 61 23.887 40.832 28.844 1.00 9.45 O ATOM 2282 CB ASN C 61 21.419 42.288 29.066 1.00 9.17 C ATOM 2283 CG ASN C 61 21.311 41.914 30.523 1.00 10.89 C ATOM 2284 OD1 ASN C 61 21.506 40.728 30.872 1.00 10.85 O ATOM 2285 ND2 ASN C 61 21.127 42.919 31.412 1.00 12.66 N ATOM 2286 HA ASN C 61 22.763 43.904 29.345 1.00 0.00 H ATOM 2287 HB2 ASN C 61 20.599 42.959 28.810 1.00 0.00 H ATOM 2288 HB3 ASN C 61 21.349 41.384 28.461 1.00 0.00 H ATOM 2289 HD22 ASN C 61 20.968 43.890 31.074 1.00 0.00 H ATOM 2290 HD21 ASN C 61 21.144 42.720 32.433 1.00 0.00 H ATOM 2291 H ASN C 61 23.241 42.665 26.679 1.00 0.00 H ATOM 2292 N PHE C 62 24.852 42.593 29.905 1.00 7.75 N ATOM 2293 CA PHE C 62 25.905 41.798 30.476 1.00 7.41 C ATOM 2294 C PHE C 62 26.664 42.591 31.532 1.00 6.98 C ATOM 2295 O PHE C 62 26.730 43.826 31.482 1.00 7.54 O ATOM 2296 CB PHE C 62 26.933 41.263 29.420 1.00 7.56 C ATOM 2297 CG PHE C 62 27.761 42.326 28.740 1.00 7.08 C ATOM 2298 CD1 PHE C 62 29.029 42.623 29.200 1.00 7.69 C ATOM 2299 CD2 PHE C 62 27.301 43.026 27.619 1.00 7.79 C ATOM 2300 CE1 PHE C 62 29.844 43.581 28.568 1.00 8.12 C ATOM 2301 CE2 PHE C 62 28.089 43.968 26.987 1.00 9.06 C ATOM 2302 CZ PHE C 62 29.369 44.232 27.459 1.00 8.85 C ATOM 2303 HA PHE C 62 25.409 40.935 30.921 1.00 0.00 H ATOM 2304 HB2 PHE C 62 27.612 40.577 29.926 1.00 0.00 H ATOM 2305 HB3 PHE C 62 26.379 40.723 28.652 1.00 0.00 H ATOM 2306 HD2 PHE C 62 26.300 42.824 27.237 1.00 0.00 H ATOM 2307 HE2 PHE C 62 27.707 44.504 26.118 1.00 0.00 H ATOM 2308 HZ PHE C 62 29.998 44.959 26.946 1.00 0.00 H ATOM 2309 HE1 PHE C 62 30.839 43.802 28.955 1.00 0.00 H ATOM 2310 HD1 PHE C 62 29.410 42.101 30.078 1.00 0.00 H ATOM 2311 H PHE C 62 24.842 43.620 30.071 1.00 0.00 H ATOM 2312 N GLY C 63 27.259 41.827 32.464 1.00 6.50 N ATOM 2313 CA GLY C 63 28.278 42.325 33.345 1.00 6.47 C ATOM 2314 C GLY C 63 29.566 41.603 33.099 1.00 6.25 C ATOM 2315 O GLY C 63 29.573 40.460 32.568 1.00 7.90 O ATOM 2316 HA3 GLY C 63 27.969 42.170 34.379 1.00 0.00 H ATOM 2317 HA2 GLY C 63 28.421 43.391 33.166 1.00 0.00 H ATOM 2318 H GLY C 63 26.969 40.832 32.551 1.00 0.00 H ATOM 2319 N SER C 64 30.661 42.234 33.428 1.00 6.66 N ATOM 2320 CA SER C 64 31.983 41.686 33.171 1.00 6.47 C ATOM 2321 C SER C 64 32.872 41.853 34.375 1.00 6.48 C ATOM 2322 O SER C 64 32.698 42.794 35.161 1.00 7.65 O ATOM 2323 CB SER C 64 32.644 42.323 31.955 1.00 8.44 C ATOM 2324 OG SER C 64 33.110 43.616 32.260 1.00 9.46 O ATOM 2325 HA SER C 64 31.848 40.625 32.962 1.00 0.00 H ATOM 2326 HB2 SER C 64 31.917 42.386 31.145 1.00 0.00 H ATOM 2327 HB3 SER C 64 33.485 41.705 31.640 1.00 0.00 H ATOM 2328 HG SER C 64 33.773 43.562 32.993 1.00 0.00 H ATOM 2329 H SER C 64 30.585 43.162 33.891 1.00 0.00 H ATOM 2330 N TYR C 65 33.908 41.011 34.487 1.00 5.88 N ATOM 2331 CA TYR C 65 35.008 41.261 35.387 1.00 6.20 C ATOM 2332 C TYR C 65 36.230 40.649 34.698 1.00 6.10 C ATOM 2333 O TYR C 65 36.294 39.455 34.460 1.00 6.75 O ATOM 2334 CB TYR C 65 34.770 40.660 36.745 1.00 7.12 C ATOM 2335 CG TYR C 65 35.687 41.279 37.777 1.00 7.45 C ATOM 2336 CD1 TYR C 65 35.401 42.526 38.312 1.00 8.93 C ATOM 2337 CD2 TYR C 65 36.839 40.665 38.215 1.00 9.93 C ATOM 2338 CE1 TYR C 65 36.242 43.141 39.205 1.00 10.36 C ATOM 2339 CE2 TYR C 65 37.683 41.254 39.151 1.00 10.61 C ATOM 2340 CZ TYR C 65 37.356 42.512 39.642 1.00 11.09 C ATOM 2341 OH TYR C 65 38.224 43.052 40.562 1.00 13.98 O ATOM 2342 HA TYR C 65 35.142 42.326 35.574 1.00 0.00 H ATOM 2343 HB3 TYR C 65 34.957 39.587 36.699 1.00 0.00 H ATOM 2344 HB2 TYR C 65 33.734 40.835 37.037 1.00 0.00 H ATOM 2345 HD2 TYR C 65 37.098 39.685 37.815 1.00 0.00 H ATOM 2346 HE2 TYR C 65 38.582 40.740 39.492 1.00 0.00 H ATOM 2347 HE1 TYR C 65 36.010 44.144 39.564 1.00 0.00 H ATOM 2348 HD1 TYR C 65 34.482 43.032 38.015 1.00 0.00 H ATOM 2349 HH TYR C 65 37.895 43.943 40.841 1.00 0.00 H ATOM 2350 H TYR C 65 33.920 40.149 33.906 1.00 0.00 H ATOM 2351 N VAL C 66 37.170 41.518 34.305 1.00 6.55 N ATOM 2352 CA VAL C 66 38.275 41.163 33.478 1.00 7.11 C ATOM 2353 C VAL C 66 39.532 41.829 34.016 1.00 8.10 C ATOM 2354 O VAL C 66 39.466 42.705 34.900 1.00 9.19 O ATOM 2355 CB VAL C 66 38.059 41.559 31.982 1.00 7.68 C ATOM 2356 CG1 VAL C 66 36.726 41.077 31.456 1.00 8.58 C ATOM 2357 CG2 VAL C 66 38.245 43.087 31.707 1.00 10.60 C ATOM 2358 HA VAL C 66 38.376 40.078 33.505 1.00 0.00 H ATOM 2359 HB VAL C 66 38.849 41.047 31.433 1.00 0.00 H ATOM 2360 HG11 VAL C 66 36.678 39.991 31.532 1.00 0.00 H ATOM 2361 HG12 VAL C 66 35.923 41.519 32.045 1.00 0.00 H ATOM 2362 HG13 VAL C 66 36.619 41.375 30.413 1.00 0.00 H ATOM 2363 HG21 VAL C 66 37.527 43.652 32.301 1.00 0.00 H ATOM 2364 HG22 VAL C 66 39.258 43.383 31.980 1.00 0.00 H ATOM 2365 HG23 VAL C 66 38.080 43.287 30.648 1.00 0.00 H ATOM 2366 H VAL C 66 37.089 42.506 34.620 1.00 0.00 H ATOM 2367 N THR C 67 40.701 41.400 33.517 1.00 8.42 N ATOM 2368 CA THR C 67 41.981 42.021 33.836 1.00 8.90 C ATOM 2369 C THR C 67 42.638 42.462 32.546 1.00 10.06 C ATOM 2370 O THR C 67 42.744 41.691 31.619 1.00 13.36 O ATOM 2371 CB THR C 67 42.905 41.055 34.608 1.00 10.68 C ATOM 2372 OG1 THR C 67 42.258 40.578 35.781 1.00 10.89 O ATOM 2373 CG2 THR C 67 44.235 41.669 34.947 1.00 13.62 C ATOM 2374 HA THR C 67 41.806 42.881 34.482 1.00 0.00 H ATOM 2375 HB THR C 67 43.109 40.214 33.945 1.00 0.00 H ATOM 2376 HG1 THR C 67 42.864 39.961 36.263 1.00 0.00 H ATOM 2377 HG23 THR C 67 44.712 42.027 34.034 1.00 0.00 H ATOM 2378 HG21 THR C 67 44.084 42.504 35.631 1.00 0.00 H ATOM 2379 HG22 THR C 67 44.870 40.920 35.420 1.00 0.00 H ATOM 2380 H THR C 67 40.694 40.585 32.871 1.00 0.00 H ATOM 2381 N HIS C 68 43.023 43.727 32.498 1.00 9.89 N ATOM 2382 CA HIS C 68 43.593 44.249 31.275 1.00 10.04 C ATOM 2383 C HIS C 68 45.009 44.782 31.457 1.00 10.86 C ATOM 2384 O HIS C 68 45.405 45.148 32.548 1.00 12.43 O ATOM 2385 CB HIS C 68 42.695 45.372 30.729 1.00 10.64 C ATOM 2386 CG HIS C 68 42.659 46.590 31.592 1.00 10.17 C ATOM 2387 ND1 HIS C 68 43.531 47.636 31.443 1.00 10.29 N ATOM 2388 CD2 HIS C 68 41.820 46.974 32.564 1.00 11.75 C ATOM 2389 CE1 HIS C 68 43.245 48.581 32.317 1.00 13.14 C ATOM 2390 NE2 HIS C 68 42.215 48.204 33.036 1.00 13.13 N ATOM 2391 HA HIS C 68 43.649 43.419 30.571 1.00 0.00 H ATOM 2392 HB2 HIS C 68 43.064 45.659 29.744 1.00 0.00 H ATOM 2393 HB3 HIS C 68 41.680 44.986 30.637 1.00 0.00 H ATOM 2394 HD2 HIS C 68 40.963 46.404 32.923 1.00 0.00 H ATOM 2395 HE1 HIS C 68 43.779 49.525 32.425 1.00 0.00 H ATOM 2396 H HIS C 68 42.917 44.340 33.331 1.00 0.00 H ATOM 2397 N GLU C 69 45.704 44.829 30.342 1.00 11.11 N ATOM 2398 CA GLU C 69 47.030 45.507 30.316 1.00 12.49 C ATOM 2399 C GLU C 69 46.828 47.028 30.403 1.00 12.72 C ATOM 2400 O GLU C 69 45.878 47.605 29.883 1.00 12.44 O ATOM 2401 CB GLU C 69 47.813 45.114 29.067 1.00 13.73 C ATOM 2402 CG GLU C 69 48.146 43.611 29.053 1.00 14.85 C ATOM 2403 CD GLU C 69 48.833 43.061 27.827 1.00 15.69 C ATOM 2404 OE1 GLU C 69 49.494 43.831 27.102 1.00 24.37 O ATOM 2405 OE2 GLU C 69 48.766 41.803 27.640 1.00 21.04 O ATOM 2406 HA GLU C 69 47.618 45.187 31.176 1.00 0.00 H ATOM 2407 HB2 GLU C 69 47.217 45.352 28.186 1.00 0.00 H ATOM 2408 HB3 GLU C 69 48.743 45.682 29.039 1.00 0.00 H ATOM 2409 HG2 GLU C 69 48.793 43.412 29.907 1.00 0.00 H ATOM 2410 HG3 GLU C 69 47.209 43.068 29.174 1.00 0.00 H ATOM 2411 H GLU C 69 45.327 44.392 29.477 1.00 0.00 H ATOM 2412 N THR C 70 47.771 47.692 31.068 1.00 13.83 N ATOM 2413 CA THR C 70 47.710 49.134 31.252 1.00 15.07 C ATOM 2414 C THR C 70 47.565 49.800 29.892 1.00 13.56 C ATOM 2415 O THR C 70 48.238 49.386 28.916 1.00 14.48 O ATOM 2416 CB THR C 70 48.952 49.727 32.020 1.00 16.31 C ATOM 2417 OG1 THR C 70 48.772 51.139 32.232 1.00 17.94 O ATOM 2418 CG2 THR C 70 50.251 49.544 31.244 1.00 20.69 C ATOM 2419 HA THR C 70 46.844 49.343 31.880 1.00 0.00 H ATOM 2420 HB THR C 70 49.020 49.188 32.965 1.00 0.00 H ATOM 2421 HG1 THR C 70 49.557 51.502 32.715 1.00 0.00 H ATOM 2422 HG23 THR C 70 50.419 48.482 31.065 1.00 0.00 H ATOM 2423 HG21 THR C 70 50.180 50.068 30.291 1.00 0.00 H ATOM 2424 HG22 THR C 70 51.079 49.952 31.823 1.00 0.00 H ATOM 2425 H THR C 70 48.574 47.165 31.467 1.00 0.00 H ATOM 2426 N LYS C 71 46.665 50.794 29.824 1.00 13.53 N ATOM 2427 CA LYS C 71 46.425 51.594 28.657 1.00 14.90 C ATOM 2428 C LYS C 71 45.736 50.841 27.538 1.00 13.78 C ATOM 2429 O LYS C 71 45.603 51.365 26.450 1.00 14.08 O ATOM 2430 CB LYS C 71 47.726 52.261 28.065 1.00 17.35 C ATOM 2431 CG LYS C 71 48.502 53.069 29.010 1.00 25.22 C ATOM 2432 CD LYS C 71 47.750 54.206 29.661 1.00 30.24 C ATOM 2433 CE LYS C 71 46.971 55.154 28.798 1.00 34.90 C ATOM 2434 NZ LYS C 71 46.906 56.526 29.512 1.00 38.28 N ATOM 2435 HA LYS C 71 45.761 52.375 29.029 1.00 0.00 H ATOM 2436 HB2 LYS C 71 48.372 51.466 27.692 1.00 0.00 H ATOM 2437 HB3 LYS C 71 47.428 52.904 27.237 1.00 0.00 H ATOM 2438 HG2 LYS C 71 48.864 52.409 29.799 1.00 0.00 H ATOM 2439 HG3 LYS C 71 49.352 53.491 28.473 1.00 0.00 H ATOM 2440 HD2 LYS C 71 47.045 53.762 30.364 1.00 0.00 H ATOM 2441 HD3 LYS C 71 48.481 54.800 30.209 1.00 0.00 H ATOM 2442 HE2 LYS C 71 45.962 54.770 28.646 1.00 0.00 H ATOM 2443 HE3 LYS C 71 47.465 55.264 27.833 1.00 0.00 H ATOM 2444 HZ1 LYS C 71 46.435 56.414 30.433 1.00 0.00 H ATOM 2445 HZ2 LYS C 71 47.871 56.887 29.656 1.00 0.00 H ATOM 2446 HZ3 LYS C 71 46.368 57.196 28.925 1.00 0.00 H ATOM 2447 H LYS C 71 46.103 50.998 30.675 1.00 0.00 H ATOM 2448 N HIS C 72 45.115 49.687 27.854 1.00 11.82 N ATOM 2449 CA HIS C 72 44.422 48.928 26.825 1.00 11.07 C ATOM 2450 C HIS C 72 43.070 48.424 27.329 1.00 9.80 C ATOM 2451 O HIS C 72 42.793 47.205 27.308 1.00 10.56 O ATOM 2452 CB HIS C 72 45.289 47.768 26.333 1.00 11.10 C ATOM 2453 CG HIS C 72 46.554 48.260 25.670 1.00 15.03 C ATOM 2454 ND1 HIS C 72 47.719 48.529 26.333 1.00 22.29 N ATOM 2455 CD2 HIS C 72 46.767 48.632 24.392 1.00 19.07 C ATOM 2456 CE1 HIS C 72 48.627 48.974 25.484 1.00 22.49 C ATOM 2457 NE2 HIS C 72 48.085 49.035 24.286 1.00 22.84 N ATOM 2458 HA HIS C 72 44.235 49.594 25.983 1.00 0.00 H ATOM 2459 HB2 HIS C 72 45.556 47.141 27.183 1.00 0.00 H ATOM 2460 HB3 HIS C 72 44.718 47.180 25.614 1.00 0.00 H ATOM 2461 HD2 HIS C 72 46.032 48.618 23.587 1.00 0.00 H ATOM 2462 HE1 HIS C 72 49.653 49.245 25.733 1.00 0.00 H ATOM 2463 H HIS C 72 45.131 49.339 28.834 1.00 0.00 H ATOM 2464 N PHE C 73 42.170 49.347 27.685 1.00 9.40 N ATOM 2465 CA PHE C 73 40.781 48.979 28.107 1.00 9.05 C ATOM 2466 C PHE C 73 39.850 50.075 27.708 1.00 8.78 C ATOM 2467 O PHE C 73 40.125 51.277 27.974 1.00 9.96 O ATOM 2468 CB PHE C 73 40.741 48.863 29.644 1.00 8.66 C ATOM 2469 CG PHE C 73 39.397 48.526 30.218 1.00 8.13 C ATOM 2470 CD1 PHE C 73 39.028 47.226 30.424 1.00 8.18 C ATOM 2471 CD2 PHE C 73 38.533 49.513 30.620 1.00 9.55 C ATOM 2472 CE1 PHE C 73 37.871 46.868 30.949 1.00 9.54 C ATOM 2473 CE2 PHE C 73 37.301 49.148 31.170 1.00 11.49 C ATOM 2474 CZ PHE C 73 36.959 47.838 31.345 1.00 9.28 C ATOM 2475 HA PHE C 73 40.492 48.037 27.641 1.00 0.00 H ATOM 2476 HB2 PHE C 73 41.442 48.084 29.943 1.00 0.00 H ATOM 2477 HB3 PHE C 73 41.059 49.817 30.064 1.00 0.00 H ATOM 2478 HD2 PHE C 73 38.803 50.564 30.512 1.00 0.00 H ATOM 2479 HE2 PHE C 73 36.598 49.927 31.466 1.00 0.00 H ATOM 2480 HZ PHE C 73 36.000 47.562 31.782 1.00 0.00 H ATOM 2481 HE1 PHE C 73 37.631 45.812 31.072 1.00 0.00 H ATOM 2482 HD1 PHE C 73 39.728 46.441 30.139 1.00 0.00 H ATOM 2483 H PHE C 73 42.443 50.350 27.668 1.00 0.00 H ATOM 2484 N ILE C 74 38.715 49.745 27.124 1.00 8.47 N ATOM 2485 CA ILE C 74 37.659 50.704 26.867 1.00 9.03 C ATOM 2486 C ILE C 74 36.319 49.985 27.024 1.00 8.43 C ATOM 2487 O ILE C 74 36.153 48.814 26.636 1.00 8.68 O ATOM 2488 CB ILE C 74 37.807 51.416 25.492 1.00 9.81 C ATOM 2489 CG1 ILE C 74 36.895 52.648 25.402 1.00 10.42 C ATOM 2490 CG2 ILE C 74 37.606 50.410 24.328 1.00 9.85 C ATOM 2491 CD1 ILE C 74 37.047 53.430 24.071 1.00 13.37 C ATOM 2492 HA ILE C 74 37.722 51.514 27.593 1.00 0.00 H ATOM 2493 HB ILE C 74 38.825 51.794 25.399 1.00 0.00 H ATOM 2494 HG12 ILE C 74 35.860 52.320 25.494 1.00 0.00 H ATOM 2495 HG13 ILE C 74 37.137 53.318 26.227 1.00 0.00 H ATOM 2496 HD11 ILE C 74 38.076 53.775 23.969 1.00 0.00 H ATOM 2497 HD12 ILE C 74 36.798 52.775 23.236 1.00 0.00 H ATOM 2498 HD13 ILE C 74 36.374 54.287 24.076 1.00 0.00 H ATOM 2499 HG21 ILE C 74 38.354 49.620 24.399 1.00 0.00 H ATOM 2500 HG22 ILE C 74 36.609 49.974 24.394 1.00 0.00 H ATOM 2501 HG23 ILE C 74 37.714 50.931 23.377 1.00 0.00 H ATOM 2502 H ILE C 74 38.571 48.756 26.836 1.00 0.00 H ATOM 2503 N TYR C 75 35.349 50.742 27.538 1.00 8.62 N ATOM 2504 CA TYR C 75 33.971 50.290 27.682 1.00 8.23 C ATOM 2505 C TYR C 75 33.107 51.436 27.231 1.00 8.32 C ATOM 2506 O TYR C 75 33.170 52.522 27.862 1.00 9.79 O ATOM 2507 CB TYR C 75 33.667 49.866 29.115 1.00 8.18 C ATOM 2508 CG TYR C 75 32.228 49.485 29.385 1.00 7.57 C ATOM 2509 CD1 TYR C 75 31.664 48.394 28.739 1.00 8.33 C ATOM 2510 CD2 TYR C 75 31.461 50.191 30.286 1.00 9.60 C ATOM 2511 CE1 TYR C 75 30.383 47.980 28.996 1.00 9.05 C ATOM 2512 CE2 TYR C 75 30.197 49.827 30.527 1.00 11.08 C ATOM 2513 CZ TYR C 75 29.614 48.748 29.869 1.00 10.28 C ATOM 2514 OH TYR C 75 28.343 48.324 30.096 1.00 12.00 O ATOM 2515 HA TYR C 75 33.779 49.403 27.078 1.00 0.00 H ATOM 2516 HB3 TYR C 75 33.925 50.695 29.774 1.00 0.00 H ATOM 2517 HB2 TYR C 75 34.294 49.006 29.352 1.00 0.00 H ATOM 2518 HD2 TYR C 75 31.886 51.050 30.805 1.00 0.00 H ATOM 2519 HE2 TYR C 75 29.610 50.388 31.255 1.00 0.00 H ATOM 2520 HE1 TYR C 75 29.979 47.080 28.533 1.00 0.00 H ATOM 2521 HD1 TYR C 75 32.258 47.850 28.005 1.00 0.00 H ATOM 2522 HH TYR C 75 27.710 49.057 29.891 1.00 0.00 H ATOM 2523 H TYR C 75 35.588 51.704 27.852 1.00 0.00 H ATOM 2524 N PHE C 76 32.282 51.246 26.216 1.00 9.17 N ATOM 2525 CA PHE C 76 31.514 52.336 25.626 1.00 9.84 C ATOM 2526 C PHE C 76 30.245 51.863 25.001 1.00 9.73 C ATOM 2527 O PHE C 76 30.095 50.676 24.722 1.00 11.49 O ATOM 2528 CB PHE C 76 32.344 53.101 24.609 1.00 10.60 C ATOM 2529 CG PHE C 76 32.714 52.327 23.396 1.00 11.16 C ATOM 2530 CD1 PHE C 76 32.047 52.525 22.177 1.00 11.69 C ATOM 2531 CD2 PHE C 76 33.812 51.498 23.391 1.00 11.29 C ATOM 2532 CE1 PHE C 76 32.489 51.847 21.008 1.00 12.82 C ATOM 2533 CE2 PHE C 76 34.249 50.857 22.268 1.00 13.38 C ATOM 2534 CZ PHE C 76 33.607 51.046 21.069 1.00 13.34 C ATOM 2535 HA PHE C 76 31.248 53.007 26.443 1.00 0.00 H ATOM 2536 HB2 PHE C 76 31.773 53.974 24.293 1.00 0.00 H ATOM 2537 HB3 PHE C 76 33.263 53.426 25.097 1.00 0.00 H ATOM 2538 HD2 PHE C 76 34.356 51.347 24.323 1.00 0.00 H ATOM 2539 HE2 PHE C 76 35.111 50.192 22.323 1.00 0.00 H ATOM 2540 HZ PHE C 76 33.982 50.563 20.167 1.00 0.00 H ATOM 2541 HE1 PHE C 76 31.946 51.961 20.070 1.00 0.00 H ATOM 2542 HD1 PHE C 76 31.191 53.198 22.127 1.00 0.00 H ATOM 2543 H PHE C 76 32.177 50.288 25.825 1.00 0.00 H ATOM 2544 N TYR C 77 29.281 52.760 24.793 1.00 10.97 N ATOM 2545 CA TYR C 77 28.045 52.453 24.133 1.00 11.65 C ATOM 2546 C TYR C 77 28.002 53.074 22.750 1.00 12.90 C ATOM 2547 O TYR C 77 28.493 54.185 22.565 1.00 14.36 O ATOM 2548 CB TYR C 77 26.848 53.059 24.915 1.00 12.30 C ATOM 2549 CG TYR C 77 26.451 52.204 26.086 1.00 13.61 C ATOM 2550 CD1 TYR C 77 25.378 51.360 26.014 1.00 17.46 C ATOM 2551 CD2 TYR C 77 27.154 52.260 27.258 1.00 17.61 C ATOM 2552 CE1 TYR C 77 24.971 50.585 27.105 1.00 20.44 C ATOM 2553 CE2 TYR C 77 26.738 51.535 28.389 1.00 19.64 C ATOM 2554 CZ TYR C 77 25.653 50.662 28.280 1.00 19.41 C ATOM 2555 OH TYR C 77 25.144 49.926 29.335 1.00 28.35 O ATOM 2556 HA TYR C 77 27.978 51.366 24.077 1.00 0.00 H ATOM 2557 HB3 TYR C 77 25.997 53.150 24.241 1.00 0.00 H ATOM 2558 HB2 TYR C 77 27.129 54.047 25.279 1.00 0.00 H ATOM 2559 HD2 TYR C 77 28.051 52.876 27.316 1.00 0.00 H ATOM 2560 HE2 TYR C 77 27.257 51.653 29.340 1.00 0.00 H ATOM 2561 HE1 TYR C 77 24.111 49.922 27.014 1.00 0.00 H ATOM 2562 HD1 TYR C 77 24.823 51.289 25.079 1.00 0.00 H ATOM 2563 HH TYR C 77 25.850 49.330 29.691 1.00 0.00 H ATOM 2564 H TYR C 77 29.433 53.733 25.127 1.00 0.00 H ATOM 2565 N LEU C 78 27.406 52.367 21.819 1.00 13.53 N ATOM 2566 CA LEU C 78 26.871 52.943 20.566 1.00 14.89 C ATOM 2567 C LEU C 78 25.374 52.694 20.675 1.00 16.11 C ATOM 2568 O LEU C 78 24.888 51.551 20.591 1.00 17.35 O ATOM 2569 CB LEU C 78 27.460 52.254 19.334 1.00 17.31 C ATOM 2570 CG LEU C 78 28.960 52.514 19.136 1.00 20.05 C ATOM 2571 CD1 LEU C 78 29.445 51.741 17.907 1.00 20.65 C ATOM 2572 CD2 LEU C 78 29.393 53.972 18.945 1.00 26.58 C ATOM 2573 HA LEU C 78 27.120 53.997 20.447 1.00 0.00 H ATOM 2574 HB2 LEU C 78 27.308 51.179 19.435 1.00 0.00 H ATOM 2575 HB3 LEU C 78 26.929 52.613 18.452 1.00 0.00 H ATOM 2576 HG LEU C 78 29.405 52.188 20.076 1.00 0.00 H ATOM 2577 HD21 LEU C 78 28.904 54.382 18.061 1.00 0.00 H ATOM 2578 HD22 LEU C 78 29.107 54.552 19.822 1.00 0.00 H ATOM 2579 HD23 LEU C 78 30.475 54.015 18.816 1.00 0.00 H ATOM 2580 HD11 LEU C 78 29.274 50.675 18.059 1.00 0.00 H ATOM 2581 HD12 LEU C 78 28.895 52.077 17.028 1.00 0.00 H ATOM 2582 HD13 LEU C 78 30.510 51.922 17.762 1.00 0.00 H ATOM 2583 H LEU C 78 27.304 51.343 21.971 1.00 0.00 H ATOM 2584 N GLY C 79 24.587 53.757 20.870 1.00 17.59 N ATOM 2585 CA GLY C 79 23.160 53.589 21.202 1.00 18.60 C ATOM 2586 C GLY C 79 23.031 52.829 22.504 1.00 17.80 C ATOM 2587 O GLY C 79 23.656 53.187 23.482 1.00 19.92 O ATOM 2588 HA3 GLY C 79 22.664 53.033 20.406 1.00 0.00 H ATOM 2589 HA2 GLY C 79 22.693 54.568 21.305 1.00 0.00 H ATOM 2590 H GLY C 79 24.986 54.714 20.787 1.00 0.00 H ATOM 2591 N GLN C 80 22.158 51.810 22.529 1.00 18.00 N ATOM 2592 CA GLN C 80 21.917 50.965 23.683 1.00 18.81 C ATOM 2593 C GLN C 80 22.809 49.702 23.649 1.00 15.79 C ATOM 2594 O GLN C 80 22.630 48.839 24.483 1.00 18.25 O ATOM 2595 CB GLN C 80 20.416 50.556 23.706 1.00 22.53 C ATOM 2596 CG GLN C 80 19.476 51.760 23.813 1.00 27.81 C ATOM 2597 CD GLN C 80 19.788 52.652 24.974 1.00 30.75 C ATOM 2598 OE1 GLN C 80 19.986 53.898 24.825 1.00 38.55 O ATOM 2599 NE2 GLN C 80 19.889 52.041 26.156 1.00 35.17 N ATOM 2600 HA GLN C 80 22.166 51.523 24.585 1.00 0.00 H ATOM 2601 HB2 GLN C 80 20.188 50.016 22.787 1.00 0.00 H ATOM 2602 HB3 GLN C 80 20.245 49.903 24.562 1.00 0.00 H ATOM 2603 HG2 GLN C 80 19.555 52.344 22.896 1.00 0.00 H ATOM 2604 HG3 GLN C 80 18.455 51.394 23.922 1.00 0.00 H ATOM 2605 HE22 GLN C 80 19.718 51.018 26.229 1.00 0.00 H ATOM 2606 HE21 GLN C 80 20.139 52.588 27.004 1.00 0.00 H ATOM 2607 H GLN C 80 21.618 51.613 21.662 1.00 0.00 H ATOM 2608 N VAL C 81 23.769 49.592 22.722 1.00 14.61 N ATOM 2609 CA VAL C 81 24.677 48.430 22.653 1.00 12.06 C ATOM 2610 C VAL C 81 25.999 48.797 23.299 1.00 11.01 C ATOM 2611 O VAL C 81 26.656 49.798 22.944 1.00 12.23 O ATOM 2612 CB VAL C 81 24.910 48.045 21.192 1.00 14.45 C ATOM 2613 CG1 VAL C 81 25.812 46.895 21.149 1.00 14.89 C ATOM 2614 CG2 VAL C 81 23.572 47.628 20.540 1.00 15.85 C ATOM 2615 HA VAL C 81 24.232 47.585 23.178 1.00 0.00 H ATOM 2616 HB VAL C 81 25.334 48.896 20.659 1.00 0.00 H ATOM 2617 HG11 VAL C 81 26.759 47.160 21.618 1.00 0.00 H ATOM 2618 HG12 VAL C 81 25.360 46.060 21.685 1.00 0.00 H ATOM 2619 HG13 VAL C 81 25.986 46.610 20.111 1.00 0.00 H ATOM 2620 HG21 VAL C 81 23.158 46.774 21.077 1.00 0.00 H ATOM 2621 HG22 VAL C 81 22.871 48.462 20.586 1.00 0.00 H ATOM 2622 HG23 VAL C 81 23.746 47.355 19.499 1.00 0.00 H ATOM 2623 H VAL C 81 23.879 50.355 22.024 1.00 0.00 H ATOM 2624 N ALA C 82 26.384 48.034 24.305 1.00 9.35 N ATOM 2625 CA ALA C 82 27.661 48.196 25.030 1.00 10.17 C ATOM 2626 C ALA C 82 28.762 47.373 24.372 1.00 10.20 C ATOM 2627 O ALA C 82 28.507 46.254 23.933 1.00 10.27 O ATOM 2628 CB ALA C 82 27.447 47.811 26.490 1.00 12.10 C ATOM 2629 HA ALA C 82 27.986 49.236 24.990 1.00 0.00 H ATOM 2630 HB1 ALA C 82 26.687 48.459 26.928 1.00 0.00 H ATOM 2631 HB2 ALA C 82 27.118 46.773 26.546 1.00 0.00 H ATOM 2632 HB3 ALA C 82 28.383 47.927 27.036 1.00 0.00 H ATOM 2633 H ALA C 82 25.747 47.269 24.607 1.00 0.00 H ATOM 2634 N ILE C 83 29.935 47.948 24.340 1.00 9.69 N ATOM 2635 CA ILE C 83 31.119 47.355 23.769 1.00 8.86 C ATOM 2636 C ILE C 83 32.233 47.416 24.790 1.00 7.79 C ATOM 2637 O ILE C 83 32.604 48.489 25.274 1.00 9.75 O ATOM 2638 CB ILE C 83 31.547 48.048 22.456 1.00 10.77 C ATOM 2639 CG1 ILE C 83 30.381 47.964 21.490 1.00 14.56 C ATOM 2640 CG2 ILE C 83 32.791 47.334 21.857 1.00 11.53 C ATOM 2641 CD1 ILE C 83 30.528 48.597 20.103 1.00 21.12 C ATOM 2642 HA ILE C 83 30.897 46.319 23.514 1.00 0.00 H ATOM 2643 HB ILE C 83 31.812 49.089 22.642 1.00 0.00 H ATOM 2644 HG12 ILE C 83 30.165 46.906 21.339 1.00 0.00 H ATOM 2645 HG13 ILE C 83 29.529 48.443 21.973 1.00 0.00 H ATOM 2646 HD11 ILE C 83 30.722 49.664 20.211 1.00 0.00 H ATOM 2647 HD12 ILE C 83 31.358 48.127 19.577 1.00 0.00 H ATOM 2648 HD13 ILE C 83 29.608 48.449 19.538 1.00 0.00 H ATOM 2649 HG21 ILE C 83 33.613 47.379 22.571 1.00 0.00 H ATOM 2650 HG22 ILE C 83 32.546 46.292 21.649 1.00 0.00 H ATOM 2651 HG23 ILE C 83 33.083 47.831 20.932 1.00 0.00 H ATOM 2652 H ILE C 83 30.020 48.898 24.755 1.00 0.00 H ATOM 2653 N LEU C 84 32.803 46.238 25.151 1.00 7.40 N ATOM 2654 CA LEU C 84 33.947 46.065 26.012 1.00 7.11 C ATOM 2655 C LEU C 84 35.069 45.578 25.124 1.00 8.30 C ATOM 2656 O LEU C 84 34.923 44.572 24.420 1.00 8.81 O ATOM 2657 CB LEU C 84 33.635 45.040 27.086 1.00 8.05 C ATOM 2658 CG LEU C 84 34.796 44.638 27.987 1.00 8.49 C ATOM 2659 CD1 LEU C 84 35.324 45.812 28.760 1.00 12.43 C ATOM 2660 CD2 LEU C 84 34.328 43.518 28.952 1.00 11.08 C ATOM 2661 HA LEU C 84 34.218 46.993 26.516 1.00 0.00 H ATOM 2662 HB2 LEU C 84 32.848 45.450 27.719 1.00 0.00 H ATOM 2663 HB3 LEU C 84 33.270 44.140 26.592 1.00 0.00 H ATOM 2664 HG LEU C 84 35.610 44.268 27.363 1.00 0.00 H ATOM 2665 HD21 LEU C 84 33.502 43.886 29.561 1.00 0.00 H ATOM 2666 HD22 LEU C 84 33.998 42.656 28.373 1.00 0.00 H ATOM 2667 HD23 LEU C 84 35.156 43.228 29.598 1.00 0.00 H ATOM 2668 HD11 LEU C 84 35.674 46.575 28.065 1.00 0.00 H ATOM 2669 HD12 LEU C 84 34.529 46.223 29.383 1.00 0.00 H ATOM 2670 HD13 LEU C 84 36.151 45.487 29.392 1.00 0.00 H ATOM 2671 H LEU C 84 32.371 45.373 24.768 1.00 0.00 H ATOM 2672 N LEU C 85 36.234 46.248 25.179 1.00 7.36 N ATOM 2673 CA LEU C 85 37.379 45.923 24.315 1.00 7.52 C ATOM 2674 C LEU C 85 38.640 46.099 25.115 1.00 8.03 C ATOM 2675 O LEU C 85 38.875 47.184 25.680 1.00 9.00 O ATOM 2676 CB LEU C 85 37.378 46.821 23.060 1.00 8.15 C ATOM 2677 CG LEU C 85 38.544 46.721 22.140 1.00 9.34 C ATOM 2678 CD1 LEU C 85 38.622 45.308 21.494 1.00 10.25 C ATOM 2679 CD2 LEU C 85 38.524 47.798 21.050 1.00 11.11 C ATOM 2680 HA LEU C 85 37.312 44.891 23.971 1.00 0.00 H ATOM 2681 HB2 LEU C 85 36.486 46.576 22.484 1.00 0.00 H ATOM 2682 HB3 LEU C 85 37.317 47.855 23.399 1.00 0.00 H ATOM 2683 HG LEU C 85 39.434 46.886 22.747 1.00 0.00 H ATOM 2684 HD21 LEU C 85 37.616 47.695 20.456 1.00 0.00 H ATOM 2685 HD22 LEU C 85 38.545 48.784 21.515 1.00 0.00 H ATOM 2686 HD23 LEU C 85 39.396 47.679 20.407 1.00 0.00 H ATOM 2687 HD11 LEU C 85 38.727 44.557 22.277 1.00 0.00 H ATOM 2688 HD12 LEU C 85 37.710 45.118 20.927 1.00 0.00 H ATOM 2689 HD13 LEU C 85 39.483 45.262 20.827 1.00 0.00 H ATOM 2690 H LEU C 85 36.329 47.028 25.860 1.00 0.00 H ATOM 2691 N PHE C 86 39.422 45.030 25.226 1.00 7.82 N ATOM 2692 CA PHE C 86 40.610 45.098 26.069 1.00 8.44 C ATOM 2693 C PHE C 86 41.669 44.136 25.632 1.00 8.68 C ATOM 2694 O PHE C 86 41.370 43.144 24.948 1.00 9.16 O ATOM 2695 CB PHE C 86 40.256 44.928 27.547 1.00 7.91 C ATOM 2696 CG PHE C 86 39.799 43.579 27.917 1.00 7.88 C ATOM 2697 CD1 PHE C 86 40.676 42.670 28.485 1.00 8.46 C ATOM 2698 CD2 PHE C 86 38.493 43.155 27.642 1.00 8.49 C ATOM 2699 CE1 PHE C 86 40.253 41.411 28.821 1.00 9.80 C ATOM 2700 CE2 PHE C 86 38.105 41.891 27.942 1.00 10.08 C ATOM 2701 CZ PHE C 86 38.998 40.967 28.513 1.00 9.57 C ATOM 2702 HA PHE C 86 41.031 46.096 25.949 1.00 0.00 H ATOM 2703 HB2 PHE C 86 41.142 45.161 28.138 1.00 0.00 H ATOM 2704 HB3 PHE C 86 39.462 45.635 27.790 1.00 0.00 H ATOM 2705 HD2 PHE C 86 37.784 43.845 27.184 1.00 0.00 H ATOM 2706 HE2 PHE C 86 37.079 41.585 27.736 1.00 0.00 H ATOM 2707 HZ PHE C 86 38.700 39.936 28.703 1.00 0.00 H ATOM 2708 HE1 PHE C 86 40.936 40.745 29.348 1.00 0.00 H ATOM 2709 HD1 PHE C 86 41.711 42.959 28.666 1.00 0.00 H ATOM 2710 H PHE C 86 39.189 44.154 24.717 1.00 0.00 H ATOM 2711 N LYS C 87 42.892 44.414 26.065 1.00 9.27 N ATOM 2712 CA LYS C 87 43.989 43.520 25.819 1.00 11.07 C ATOM 2713 C LYS C 87 44.360 42.784 27.094 1.00 11.17 C ATOM 2714 O LYS C 87 44.458 43.401 28.159 1.00 13.03 O ATOM 2715 CB LYS C 87 45.202 44.334 25.293 1.00 13.19 C ATOM 2716 CG LYS C 87 46.167 43.689 24.353 1.00 15.23 C ATOM 2717 CD LYS C 87 47.291 44.700 23.964 1.00 17.05 C ATOM 2718 CE LYS C 87 48.514 44.064 23.198 1.00 19.49 C ATOM 2719 NZ LYS C 87 49.372 43.174 24.082 1.00 17.25 N ATOM 2720 HA LYS C 87 43.697 42.783 25.071 1.00 0.00 H ATOM 2721 HB2 LYS C 87 44.800 45.210 24.784 1.00 0.00 H ATOM 2722 HB3 LYS C 87 45.773 44.653 26.165 1.00 0.00 H ATOM 2723 HG2 LYS C 87 46.614 42.820 24.835 1.00 0.00 H ATOM 2724 HG3 LYS C 87 45.639 43.373 23.454 1.00 0.00 H ATOM 2725 HD2 LYS C 87 46.852 45.467 23.326 1.00 0.00 H ATOM 2726 HD3 LYS C 87 47.665 45.160 24.878 1.00 0.00 H ATOM 2727 HE2 LYS C 87 49.136 44.869 22.808 1.00 0.00 H ATOM 2728 HE3 LYS C 87 48.133 43.467 22.370 1.00 0.00 H ATOM 2729 HZ1 LYS C 87 49.751 43.734 24.872 1.00 0.00 H ATOM 2730 HZ2 LYS C 87 48.792 42.395 24.454 1.00 0.00 H ATOM 2731 HZ3 LYS C 87 50.158 42.786 23.522 1.00 0.00 H ATOM 2732 H LYS C 87 43.059 45.295 26.592 1.00 0.00 H ATOM 2733 N SER C 88 44.608 41.468 26.932 1.00 12.74 N ATOM 2734 CA SER C 88 45.237 40.668 27.963 1.00 14.39 C ATOM 2735 C SER C 88 45.854 39.417 27.302 1.00 16.34 C ATOM 2736 O SER C 88 45.135 38.589 26.706 1.00 15.47 O ATOM 2737 CB SER C 88 44.223 40.167 28.978 1.00 14.85 C ATOM 2738 OG SER C 88 44.774 39.393 30.057 1.00 14.93 O ATOM 2739 HA SER C 88 45.980 41.290 28.463 1.00 0.00 H ATOM 2740 HB2 SER C 88 43.497 39.546 28.453 1.00 0.00 H ATOM 2741 HB3 SER C 88 43.717 41.032 29.406 1.00 0.00 H ATOM 2742 HG SER C 88 45.227 38.593 29.690 1.00 0.00 H ATOM 2743 H SER C 88 44.339 41.012 26.037 1.00 0.00 H ATOM 2744 N GLY C 89 47.174 39.268 27.381 1.00 19.12 N ATOM 2745 CA GLY C 89 47.860 38.346 26.469 1.00 21.43 C ATOM 2746 C GLY C 89 48.377 39.201 25.225 1.00 23.72 C ATOM 2747 O GLY C 89 48.299 40.535 24.872 1.00 21.59 O ATOM 2748 HA3 GLY C 89 47.169 37.574 26.130 1.00 0.00 H ATOM 2749 HA2 GLY C 89 48.704 37.879 26.977 1.00 0.00 H ATOM 2750 OXT GLY C 89 48.992 38.421 24.388 1.00 28.48 O ATOM 2751 H GLY C 89 47.718 39.804 28.087 1.00 0.00 H TER 2752 GLY C 89 HETATM 2753 O HOH 1 13.911 32.836 36.225 1.00 36.19 O HETATM 2754 O HOH 2 24.138 22.205 38.120 1.00 45.07 O HETATM 2755 O HOH 3 22.486 29.460 41.896 1.00 25.09 O HETATM 2756 O HOH 4 25.487 29.002 21.706 1.00 32.16 O HETATM 2757 O HOH 5 19.942 45.347 38.549 1.00 50.16 O HETATM 2758 O HOH 6 23.742 47.268 38.767 1.00 22.76 O HETATM 2759 O HOH 7 20.053 26.737 31.273 1.00 29.92 O HETATM 2760 O HOH 8 40.085 19.853 38.089 1.00 35.83 O HETATM 2761 O HOH 9 22.095 21.695 36.587 1.00 24.83 O HETATM 2762 O HOH 10 24.595 22.560 24.632 1.00 16.07 O HETATM 2763 O HOH 11 22.275 23.946 23.802 1.00 29.33 O HETATM 2764 O HOH 12 29.141 23.315 19.089 1.00 31.35 O HETATM 2765 O HOH 13 29.705 29.485 20.903 1.00 35.80 O HETATM 2766 O HOH 14 26.798 26.501 21.239 1.00 29.68 O HETATM 2767 O HOH 15 21.611 24.895 41.280 1.00 40.40 O HETATM 2768 O HOH 16 34.093 20.278 24.653 1.00 54.24 O HETATM 2769 O HOH 17 22.496 30.379 49.907 1.00 29.90 O HETATM 2770 O HOH 18 42.787 23.896 22.788 1.00 21.00 O HETATM 2771 O HOH 19 34.860 36.988 45.798 1.00 27.35 O HETATM 2772 O HOH 20 22.263 45.390 37.108 1.00 18.98 O HETATM 2773 O HOH 21 36.960 20.291 26.058 1.00 22.28 O HETATM 2774 O HOH 22 28.582 47.614 43.441 1.00 41.07 O HETATM 2775 O HOH 23 40.938 19.005 35.567 1.00 30.41 O HETATM 2776 O HOH 24 41.808 19.961 34.800 1.00 32.21 O HETATM 2777 O HOH 25 33.789 13.452 34.358 1.00 24.09 O HETATM 2778 O HOH 26 38.404 15.866 30.867 1.00 25.13 O HETATM 2779 O HOH 27 31.456 17.985 33.682 1.00 35.94 O HETATM 2780 O HOH 28 38.478 16.048 33.921 1.00 20.64 O HETATM 2781 O HOH 29 37.687 13.262 35.511 1.00 34.33 O HETATM 2782 O HOH 30 33.675 15.643 35.744 1.00 22.26 O HETATM 2783 O HOH 31 35.350 19.579 39.690 1.00 17.18 O HETATM 2784 O HOH 32 42.352 22.306 41.932 1.00 40.53 O HETATM 2785 O HOH 33 30.942 19.788 27.916 1.00 45.94 O HETATM 2786 O HOH 34 30.760 18.910 31.574 1.00 74.43 O HETATM 2787 O HOH 35 26.063 20.463 37.061 1.00 38.20 O HETATM 2788 O HOH 36 19.572 37.878 20.193 1.00 32.50 O HETATM 2789 O HOH 37 33.320 22.563 42.760 1.00 14.18 O HETATM 2790 O HOH 38 26.527 23.256 41.315 1.00 27.63 O HETATM 2791 O HOH 39 27.599 25.226 43.920 1.00 22.83 O HETATM 2792 O HOH 40 28.060 19.618 41.283 1.00 20.35 O HETATM 2793 O HOH 41 23.397 24.941 39.090 1.00 25.00 O HETATM 2794 O HOH 42 28.592 24.654 46.110 1.00 24.08 O HETATM 2795 O HOH 43 27.129 31.213 47.727 1.00 31.80 O HETATM 2796 O HOH 44 21.242 27.487 43.258 1.00 36.17 O HETATM 2797 O HOH 45 26.464 26.543 47.883 1.00 43.91 O HETATM 2798 O HOH 46 20.897 32.186 48.073 1.00 30.04 O HETATM 2799 O HOH 47 24.394 37.424 49.571 1.00 9.97 O HETATM 2800 O HOH 48 31.162 40.799 48.506 1.00 32.45 O HETATM 2801 O HOH 49 32.725 36.880 47.537 1.00 33.83 O HETATM 2802 O HOH 50 21.601 35.868 41.229 1.00 20.95 O HETATM 2803 O HOH 51 21.510 38.133 37.268 1.00 45.17 O HETATM 2804 O HOH 52 21.004 36.229 44.298 1.00 48.07 O HETATM 2805 O HOH 53 20.517 41.576 38.040 1.00 31.32 O HETATM 2806 O HOH 54 19.251 37.180 42.533 1.00 33.48 O HETATM 2807 O HOH 55 22.619 42.612 36.655 1.00 13.78 O HETATM 2808 O HOH 56 29.139 49.292 37.116 1.00 30.49 O HETATM 2809 O HOH 57 29.944 48.639 41.578 1.00 61.84 O HETATM 2810 O HOH 58 30.180 45.492 43.461 1.00 24.69 O HETATM 2811 O HOH 59 27.016 45.915 42.485 1.00 26.12 O HETATM 2812 O HOH 60 31.836 39.855 43.593 1.00 23.85 O HETATM 2813 O HOH 61 32.470 43.427 40.925 1.00 37.70 O HETATM 2814 O HOH 62 30.011 32.007 48.699 1.00 51.56 O HETATM 2815 O HOH 63 35.463 34.558 44.507 1.00 17.64 O HETATM 2816 O HOH 64 33.788 39.283 44.233 1.00 24.30 O HETATM 2817 O HOH 65 33.401 26.172 42.888 1.00 23.83 O HETATM 2818 O HOH 66 43.781 24.295 42.497 1.00 33.07 O HETATM 2819 O HOH 67 35.234 25.166 45.789 1.00 25.25 O HETATM 2820 O HOH 68 20.034 34.711 26.602 1.00 23.37 O HETATM 2821 O HOH 69 21.100 40.064 19.991 1.00 24.02 O HETATM 2822 O HOH 70 34.073 33.539 22.845 1.00 25.73 O HETATM 2823 O HOH 71 39.721 27.807 19.767 1.00 40.34 O HETATM 2824 O HOH 72 47.173 27.238 32.923 1.00 44.67 O HETATM 2825 O HOH 73 47.154 28.279 24.336 1.00 22.08 O HETATM 2826 O HOH 74 46.676 22.436 22.806 1.00 33.83 O HETATM 2827 O HOH 75 41.009 22.362 31.621 1.00 14.46 O HETATM 2828 O HOH 76 19.888 31.985 36.168 1.00 33.71 O HETATM 2829 O HOH 77 17.805 32.335 34.868 1.00 55.65 O HETATM 2830 O HOH 78 18.227 34.126 28.250 1.00 31.49 O HETATM 2831 O HOH 79 20.239 37.735 15.194 1.00 40.09 O HETATM 2832 O HOH 80 49.083 62.871 23.311 1.00 24.19 O HETATM 2833 O HOH 81 28.534 59.835 18.468 1.00 44.17 O HETATM 2834 O HOH 82 31.950 59.789 25.278 1.00 26.57 O HETATM 2835 O HOH 83 30.782 59.658 29.150 1.00 26.22 O HETATM 2836 O HOH 84 53.634 41.602 29.285 1.00 50.04 O HETATM 2837 O HOH 85 28.166 59.287 30.216 1.00 26.45 O HETATM 2838 O HOH 86 32.884 52.798 35.885 1.00 96.38 O HETATM 2839 O HOH 87 32.182 50.201 35.317 1.00 30.94 O HETATM 2840 O HOH 88 23.177 53.810 27.860 1.00 53.89 O HETATM 2841 O HOH 89 24.561 52.103 7.879 1.00 41.65 O HETATM 2842 O HOH 90 38.850 57.372 31.145 1.00 34.49 O HETATM 2843 O HOH 91 23.626 45.410 17.107 1.00 61.86 O HETATM 2844 O HOH 92 22.077 36.935 17.165 1.00 22.40 O HETATM 2845 O HOH 93 23.075 34.624 15.793 1.00 28.81 O HETATM 2846 O HOH 94 31.445 32.106 13.287 1.00 36.65 O HETATM 2847 O HOH 95 30.950 29.270 13.643 1.00 71.39 O HETATM 2848 O HOH 96 25.763 33.778 11.543 1.00 29.00 O HETATM 2849 O HOH 97 43.759 66.086 24.400 1.00 32.18 O HETATM 2850 O HOH 98 46.059 60.167 25.101 1.00 34.30 O HETATM 2851 O HOH 99 46.764 63.620 21.961 1.00 30.55 O HETATM 2852 O HOH 100 39.321 60.156 22.042 1.00 38.67 O HETATM 2853 O HOH 101 44.986 63.223 17.929 1.00 50.88 O HETATM 2854 O HOH 102 46.557 62.049 16.073 1.00 20.23 O HETATM 2855 O HOH 103 48.867 60.544 19.289 1.00 46.68 O HETATM 2856 O HOH 104 46.251 59.824 21.875 1.00 29.00 O HETATM 2857 O HOH 105 42.224 57.874 16.075 1.00 43.38 O HETATM 2858 O HOH 106 45.547 49.297 35.460 1.00 45.77 O HETATM 2859 O HOH 107 54.303 42.818 26.081 1.00 48.85 O HETATM 2860 O HOH 108 40.125 56.185 13.762 1.00 45.21 O HETATM 2861 O HOH 109 27.373 52.164 12.793 1.00 34.47 O HETATM 2862 O HOH 110 29.271 56.118 15.815 1.00 36.80 O HETATM 2863 O HOH 111 24.695 55.509 26.937 1.00 43.03 O HETATM 2864 O HOH 112 33.789 54.652 11.257 1.00 43.48 O HETATM 2865 O HOH 113 25.262 51.227 11.846 1.00 43.87 O HETATM 2866 O HOH 114 34.962 45.025 5.491 1.00 36.78 O HETATM 2867 O HOH 115 24.280 46.646 13.822 1.00 30.25 O HETATM 2868 O HOH 116 23.878 46.498 10.190 1.00 48.44 O HETATM 2869 O HOH 117 22.979 39.458 17.926 1.00 17.04 O HETATM 2870 O HOH 118 27.739 30.927 18.165 1.00 47.05 O HETATM 2871 O HOH 119 28.722 31.940 13.928 1.00 35.81 O HETATM 2872 O HOH 120 25.827 33.916 15.681 1.00 33.28 O HETATM 2873 O HOH 121 31.408 35.011 13.464 1.00 41.62 O HETATM 2874 O HOH 122 26.898 38.139 9.879 1.00 21.80 O HETATM 2875 O HOH 123 32.895 39.256 11.797 1.00 20.64 O HETATM 2876 O HOH 124 27.432 34.519 13.497 1.00 21.61 O HETATM 2877 O HOH 125 35.220 39.216 11.036 1.00 43.07 O HETATM 2878 O HOH 126 49.120 50.277 13.083 1.00 39.18 O HETATM 2879 O HOH 127 45.879 54.757 17.840 1.00 47.45 O HETATM 2880 O HOH 128 46.859 35.752 20.046 1.00 37.18 O HETATM 2881 O HOH 129 21.691 48.107 27.163 1.00 30.58 O HETATM 2882 O HOH 130 21.106 45.626 30.549 1.00 23.50 O HETATM 2883 O HOH 131 20.996 42.792 34.319 1.00 20.01 O HETATM 2884 O HOH 132 35.505 44.966 32.882 1.00 12.79 O HETATM 2885 O HOH 133 42.519 49.219 35.601 1.00 23.97 O HETATM 2886 O HOH 134 50.647 48.117 28.307 1.00 59.35 O HETATM 2887 O HOH 135 53.294 45.098 26.209 1.00 41.86 O HETATM 2888 O HOH 136 46.308 53.191 24.572 1.00 18.23 O HETATM 2889 O HOH 137 24.732 55.678 23.753 1.00 28.66 O HETATM 2890 O HOH 138 20.782 50.842 20.137 1.00 37.19 O HETATM 2891 O HOH 139 38.984 25.807 21.228 1.00 33.48 O HETATM 2892 O HOH 140 36.207 23.467 22.060 1.00 33.73 O HETATM 2893 O HOH 141 32.784 23.474 21.466 1.00 23.44 O HETATM 2894 O HOH 142 32.676 27.464 18.539 1.00 39.46 O HETATM 2895 O HOH 143 33.737 30.889 17.015 1.00 29.69 O HETATM 2896 O HOH 144 32.778 29.185 20.561 1.00 25.01 O HETATM 2897 O HOH 145 27.505 34.987 24.044 1.00 10.68 O HETATM 2898 O HOH 146 24.227 31.035 23.379 1.00 16.89 O HETATM 2899 O HOH 147 27.388 30.769 20.736 1.00 19.31 O HETATM 2900 O HOH 148 23.483 31.662 19.270 1.00 42.43 O HETATM 2901 O HOH 149 20.706 35.482 19.210 1.00 25.13 O HETATM 2902 O HOH 150 20.285 37.201 23.254 1.00 23.25 O HETATM 2903 O HOH 151 39.921 48.402 39.516 1.00 36.26 O HETATM 2904 O HOH 152 44.182 44.836 39.485 1.00 49.27 O HETATM 2905 O HOH 153 35.438 49.295 34.745 1.00 13.44 O HETATM 2906 O HOH 154 28.843 45.666 31.015 1.00 8.83 O HETATM 2907 O HOH 155 29.592 49.686 34.430 1.00 16.75 O HETATM 2908 O HOH 156 27.032 50.410 31.578 1.00 17.93 O HETATM 2909 C1A SAC A 157 41.448 31.037 20.211 1.00 0.18 C HETATM 2910 C2A SAC A 157 42.337 29.828 20.303 1.00 0.03 C HETATM 2911 H SAC A 157 43.065 29.974 21.101 1.00 0.05 H HETATM 2912 H SAC A 157 41.731 28.948 20.519 1.00 0.05 H HETATM 2913 H SAC A 157 42.858 29.688 19.355 1.00 0.05 H HETATM 2914 OAC SAC A 157 40.777 31.321 21.249 1.00 -0.40 O HETATM 2915 N SAC A 157 41.149 31.534 18.933 1.00 -0.26 N HETATM 2916 CA SAC A 157 40.063 32.540 18.777 1.00 0.15 C HETATM 2917 C SAC A 157 38.752 31.937 18.465 1.00 0.21 C HETATM 2918 O SAC A 157 38.605 31.098 17.560 1.00 -0.39 O HETATM 2919 N SAC A 157 37.742 32.396 19.222 1.00 -0.26 N HETATM 2920 CA SAC A 157 36.379 31.904 19.001 1.00 0.13 C HETATM 2921 C SAC A 157 35.386 32.845 19.628 1.00 0.20 C HETATM 2922 O SAC A 157 35.740 33.722 20.415 1.00 -0.39 O HETATM 2923 N SAC A 157 34.152 32.676 19.188 1.00 -0.27 N HETATM 2924 CA SAC A 157 33.091 33.568 19.507 1.00 0.12 C HETATM 2925 C SAC A 157 31.893 32.858 20.114 1.00 0.20 C HETATM 2926 O SAC A 157 31.735 31.644 19.955 1.00 -0.39 O HETATM 2927 N SAC A 157 31.063 33.649 20.755 1.00 -0.26 N HETATM 2928 CA SAC A 157 29.806 33.180 21.329 1.00 0.16 C HETATM 2929 C SAC A 157 28.719 34.167 21.030 1.00 0.21 C HETATM 2930 O SAC A 157 29.006 35.353 20.813 1.00 -0.39 O HETATM 2931 N SAC A 157 27.472 33.707 21.016 1.00 -0.26 N HETATM 2932 CA SAC A 157 26.301 34.533 20.849 1.00 0.13 C HETATM 2933 C SAC A 157 25.172 33.999 21.722 1.00 0.20 C HETATM 2934 O SAC A 157 24.759 32.866 21.550 1.00 -0.39 O HETATM 2935 N SAC A 157 24.571 34.848 22.584 1.00 -0.26 N HETATM 2936 CA SAC A 157 23.434 34.440 23.388 1.00 0.16 C HETATM 2937 C SAC A 157 22.269 34.194 22.487 1.00 0.21 C HETATM 2938 O SAC A 157 22.150 34.814 21.404 1.00 -0.39 O HETATM 2939 N SAC A 157 21.417 33.283 22.944 1.00 -0.27 N HETATM 2940 CA SAC A 157 20.141 32.982 22.324 1.00 0.10 C HETATM 2941 C SAC A 157 19.107 34.126 22.438 1.00 0.06 C HETATM 2942 O SAC A 157 18.321 34.384 21.511 1.00 -0.57 O HETATM 2943 OXT SAC A 157 19.127 34.840 23.478 1.00 -0.57 O HETATM 2944 CB SAC A 157 19.614 31.651 22.996 1.00 -0.01 C HETATM 2945 CG SAC A 157 20.562 30.522 22.632 1.00 0.00 C HETATM 2946 CD SAC A 157 20.364 29.156 23.300 1.00 0.04 C HETATM 2947 OE1 SAC A 157 19.519 28.953 24.246 1.00 -0.57 O HETATM 2948 OE2 SAC A 157 21.141 28.240 22.835 1.00 -0.57 O HETATM 2949 H SAC A 157 21.546 30.859 22.959 1.00 0.04 H HETATM 2950 H SAC A 157 20.400 30.345 21.569 1.00 0.04 H HETATM 2951 H SAC A 157 18.610 31.425 22.638 1.00 0.03 H HETATM 2952 H SAC A 157 19.575 31.770 24.079 1.00 0.03 H HETATM 2953 H SAC A 157 20.283 32.859 21.250 1.00 0.07 H HETATM 2954 H SAC A 157 21.676 32.763 23.782 1.00 0.19 H HETATM 2955 CB SAC A 157 23.081 35.543 24.417 1.00 0.09 C HETATM 2956 OG1 SAC A 157 22.953 36.788 23.768 1.00 -0.39 O HETATM 2957 H SAC A 157 22.255 36.735 23.111 1.00 0.21 H HETATM 2958 CG2 SAC A 157 24.056 35.618 25.517 1.00 -0.03 C HETATM 2959 H SAC A 157 24.083 34.663 26.042 1.00 0.03 H HETATM 2960 H SAC A 157 25.043 35.839 25.111 1.00 0.03 H HETATM 2961 H SAC A 157 23.761 36.407 26.209 1.00 0.03 H HETATM 2962 H SAC A 157 22.125 35.277 24.868 1.00 0.06 H HETATM 2963 H SAC A 157 23.681 33.528 23.931 1.00 0.08 H HETATM 2964 H SAC A 157 24.926 35.800 22.672 1.00 0.19 H HETATM 2965 CB SAC A 157 25.899 34.569 19.380 1.00 0.00 C HETATM 2966 CG SAC A 157 24.662 35.414 19.118 1.00 0.04 C HETATM 2967 CD SAC A 157 24.831 36.847 19.528 1.00 0.17 C HETATM 2968 OE1 SAC A 157 25.749 37.520 19.047 1.00 -0.40 O HETATM 2969 NE2 SAC A 157 24.001 37.343 20.471 1.00 -0.30 N HETATM 2970 H SAC A 157 24.123 38.299 20.806 1.00 0.18 H HETATM 2971 H SAC A 157 23.253 36.762 20.848 1.00 0.18 H HETATM 2972 H SAC A 157 23.845 34.996 19.705 1.00 0.05 H HETATM 2973 H SAC A 157 24.470 35.397 18.045 1.00 0.05 H HETATM 2974 H SAC A 157 25.672 33.548 19.075 1.00 0.03 H HETATM 2975 H SAC A 157 26.725 35.011 18.822 1.00 0.03 H HETATM 2976 H SAC A 157 26.520 35.554 21.162 1.00 0.08 H HETATM 2977 H SAC A 157 27.334 32.703 21.131 1.00 0.19 H HETATM 2978 CB SAC A 157 29.915 32.960 22.887 1.00 0.09 C HETATM 2979 OG1 SAC A 157 30.043 34.255 23.547 1.00 -0.39 O HETATM 2980 H SAC A 157 30.832 34.699 23.228 1.00 0.21 H HETATM 2981 CG2 SAC A 157 31.096 32.080 23.260 1.00 -0.03 C HETATM 2982 H SAC A 157 30.985 31.105 22.786 1.00 0.03 H HETATM 2983 H SAC A 157 32.019 32.548 22.918 1.00 0.03 H HETATM 2984 H SAC A 157 31.129 31.958 24.343 1.00 0.03 H HETATM 2985 H SAC A 157 29.010 32.451 23.217 1.00 0.06 H HETATM 2986 H SAC A 157 29.571 32.217 20.876 1.00 0.08 H HETATM 2987 H SAC A 157 31.308 34.634 20.856 1.00 0.19 H HETATM 2988 H SAC A 157 32.765 34.045 18.583 1.00 0.08 H HETATM 2989 H SAC A 157 33.464 34.284 20.240 1.00 0.08 H HETATM 2990 H SAC A 157 33.951 31.871 18.594 1.00 0.19 H HETATM 2991 CB SAC A 157 36.208 30.531 19.575 1.00 -0.01 C HETATM 2992 CG SAC A 157 36.307 30.466 21.050 1.00 -0.02 C HETATM 2993 CD SAC A 157 36.515 29.047 21.655 1.00 0.06 C HETATM 2994 NE SAC A 157 35.363 28.227 21.380 1.00 -0.27 N HETATM 2995 CZ SAC A 157 35.259 26.896 21.476 1.00 0.29 C HETATM 2996 NH1 SAC A 157 36.261 26.108 21.829 1.00 -0.28 N HETATM 2997 H SAC A 157 37.173 26.509 22.045 1.00 0.26 H HETATM 2998 H SAC A 157 36.121 25.099 21.885 1.00 0.26 H HETATM 2999 NH2 SAC A 157 34.115 26.362 21.159 1.00 -0.28 N HETATM 3000 H SAC A 157 33.343 26.954 20.852 1.00 0.26 H HETATM 3001 H SAC A 157 33.990 25.351 21.217 1.00 0.26 H HETATM 3002 H SAC A 157 34.524 28.721 21.075 1.00 0.26 H HETATM 3003 H SAC A 157 36.649 29.131 22.733 1.00 0.07 H HETATM 3004 H SAC A 157 37.398 28.590 21.208 1.00 0.07 H HETATM 3005 H SAC A 157 35.355 30.829 21.438 1.00 0.03 H HETATM 3006 H SAC A 157 37.186 31.049 21.325 1.00 0.03 H HETATM 3007 H SAC A 157 37.013 29.915 19.174 1.00 0.03 H HETATM 3008 H SAC A 157 35.206 30.196 19.307 1.00 0.03 H HETATM 3009 H SAC A 157 36.203 31.854 17.927 1.00 0.08 H HETATM 3010 H SAC A 157 37.923 33.087 19.950 1.00 0.19 H HETATM 3011 CB SAC A 157 40.404 33.698 17.844 1.00 0.08 C HETATM 3012 OG SAC A 157 41.634 34.280 18.213 1.00 -0.39 O HETATM 3013 H SAC A 157 41.574 34.610 19.113 1.00 0.21 H HETATM 3014 H SAC A 157 39.620 34.452 17.912 1.00 0.06 H HETATM 3015 H SAC A 157 40.481 33.322 16.824 1.00 0.06 H HETATM 3016 H SAC A 157 39.973 32.988 19.767 1.00 0.08 H HETATM 3017 H SAC A 157 41.671 31.209 18.119 1.00 0.19 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 1391 1392 1414 1415 1416 CONECT 1414 1391 CONECT 1415 1391 CONECT 1416 1391 CONECT 2909 2910 2914 2915 CONECT 2910 2909 2911 2912 2913 CONECT 2911 2910 CONECT 2912 2910 CONECT 2913 2910 CONECT 2914 2909 CONECT 2915 2909 2916 3017 CONECT 2916 2915 2917 3011 3016 CONECT 2917 2916 2918 2919 CONECT 2918 2917 CONECT 2919 2917 2920 3010 CONECT 2920 2919 2921 2991 3009 CONECT 2921 2920 2922 2923 CONECT 2922 2921 CONECT 2923 2921 2924 2990 CONECT 2924 2923 2925 2988 2989 CONECT 2925 2924 2926 2927 CONECT 2926 2925 CONECT 2927 2925 2928 2987 CONECT 2928 2927 2929 2978 2986 CONECT 2929 2928 2930 2931 CONECT 2930 2929 CONECT 2931 2929 2932 2977 CONECT 2932 2931 2933 2965 2976 CONECT 2933 2932 2934 2935 CONECT 2934 2933 CONECT 2935 2933 2936 2964 CONECT 2936 2935 2937 2955 2963 CONECT 2937 2936 2938 2939 CONECT 2938 2937 CONECT 2939 2937 2940 2954 CONECT 2940 2939 2941 2944 2953 CONECT 2941 2940 2942 2943 CONECT 2942 2941 CONECT 2943 2941 CONECT 2944 2940 2945 2951 2952 CONECT 2945 2944 2946 2949 2950 CONECT 2946 2945 2947 2948 CONECT 2947 2946 CONECT 2948 2946 CONECT 2949 2945 CONECT 2950 2945 CONECT 2951 2944 CONECT 2952 2944 CONECT 2953 2940 CONECT 2954 2939 CONECT 2955 2936 2956 2958 2962 CONECT 2956 2955 2957 CONECT 2957 2956 CONECT 2958 2955 2959 2960 2961 CONECT 2959 2958 CONECT 2960 2958 CONECT 2961 2958 CONECT 2962 2955 CONECT 2963 2936 CONECT 2964 2935 CONECT 2965 2932 2966 2974 2975 CONECT 2966 2965 2967 2972 2973 CONECT 2967 2966 2968 2969 CONECT 2968 2967 CONECT 2969 2967 2970 2971 CONECT 2970 2969 CONECT 2971 2969 CONECT 2972 2966 CONECT 2973 2966 CONECT 2974 2965 CONECT 2975 2965 CONECT 2976 2932 CONECT 2977 2931 CONECT 2978 2928 2979 2981 2985 CONECT 2979 2978 2980 CONECT 2980 2979 CONECT 2981 2978 2982 2983 2984 CONECT 2982 2981 CONECT 2983 2981 CONECT 2984 2981 CONECT 2985 2978 CONECT 2986 2928 CONECT 2987 2927 CONECT 2988 2924 CONECT 2989 2924 CONECT 2990 2923 CONECT 2991 2920 2992 3007 3008 CONECT 2992 2991 2993 3005 3006 CONECT 2993 2992 2994 3003 3004 CONECT 2994 2993 2995 3002 CONECT 2995 2994 2996 2999 CONECT 2996 2995 2997 2998 CONECT 2997 2996 CONECT 2998 2996 CONECT 2999 2995 3000 3001 CONECT 3000 2999 CONECT 3001 2999 CONECT 3002 2994 CONECT 3003 2993 CONECT 3004 2993 CONECT 3005 2992 CONECT 3006 2992 CONECT 3007 2991 CONECT 3008 2991 CONECT 3009 2920 CONECT 3010 2919 CONECT 3011 2916 3012 3014 3015 CONECT 3012 3011 3013 CONECT 3013 3012 CONECT 3014 3011 CONECT 3015 3011 CONECT 3016 2916 CONECT 3017 2915 MASTER 0 0 0 0 0 0 0 0 3015 2 117 14 END
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Entry Information
PDB ID
2xqq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DYNEIN LIGHT CHAIN 2, CYTOPLASMIC
Ligand Name
7-mer
EC.Number
E.C.6.3.2.9
Resolution
1.31(Å)
Affinity (Kd/Ki/IC50)
Kd=15.2uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Plos One Vol. 6: pp. 18818
Ligand Properties
Formula
C
3
1
H
5
4
N
1
1
O
1
5
Molecular Weight
820.825
Exact Mass
820.380
No. of atoms
111
No. of bonds
110
Polar Surface Area
448.09
LOGP Value
-3.11 (
Computed with XLOGP3
)
-5.03 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 11
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 35
No. of Nitrogen and Oxygen Atoms: 26
No. of Rings: 0
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](O)C)CCC(=O)N)[C@H](O)C)CCC[NH+]=C(N)N)NC(=O)C
InChI String
InChI=1S/C31H53N11O15/c1-13(44)23(41-21(48)11-36-25(51)16(5-4-10-35-31(33)34)38-27(53)19(12-43)37-15(3)46)28(54)39-17(6-8-20(32)47)26(52)42-24(14(2)45)29(55)40-18(30(56)57)7-9-22(49)50/h13-14,16-19,23-24,43-45H,4-12H2,1-3H3,(H2,32,47)(H,36,51)(H,37,46)(H,38,53)(H,39,54)(H,40,55)(H,41,48)(H,42,52)(H,49,50)(H,56,57)(H4,33,34,35)/p+1/t13-,14-,16+,17+,18+,19+,23+,24+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q96FJ2
Entrez Gene ID
NCBI Entrez Gene ID:
140735
ASD
Information of known allosteric effects of PDB entries
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