Browse entries in the PDBbind-CN Database
HEADER 6E0Q_COMPLEX COMPND 6E0Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 53 ALA MET GLU ASP PHE VAL ARG GLN CYS PHE ASN PRO MET SEQRES 2 A 53 ILE VAL GLU LEU ALA GLU LYS ALA MET LYS GLU TYR GLY SEQRES 3 A 53 GLU ASP PRO LYS ILE GLU THR ASN LYS PHE ALA ALA ILE SEQRES 4 A 53 CYS THR HIS LEU GLU VAL CYS PHE MET TYR SER ASP PHE SEQRES 5 A 53 GLY SEQRES 1 A 125 HIS ARG PHE GLU ILE ILE GLU GLY ARG ASP ARG ILE MET SEQRES 2 A 125 ALA TRP THR VAL VAL ASN SER ILE CYS ASN THR THR GLY SEQRES 3 A 125 VAL GLU LYS PRO LYS PHE LEU PRO ASP LEU TYR ASP TYR SEQRES 4 A 125 LYS GLU ASN ARG PHE ILE GLU ILE GLY VAL THR ARG ARG SEQRES 5 A 125 GLU VAL HIS ILE TYR TYR LEU GLU LYS ALA ASN LYS ILE SEQRES 6 A 125 LYS SER GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR SEQRES 7 A 125 GLY GLU GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP SEQRES 8 A 125 GLU GLU SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR SEQRES 9 A 125 ILE ARG GLN GLU MET ALA SER ARG SER LEU TRP ASP SER SEQRES 10 A 125 PHE ARG GLN SER GLU ARG GLY GLU HET MN A 1 1 HET MN A 2 1 HET HKD A 188 21 ATOM 1 N ALA A 0 -41.252 8.881 22.247 1.00 48.10 N ATOM 2 CA ALA A 0 -41.625 8.735 20.787 1.00 47.92 C ATOM 3 C ALA A 0 -40.381 8.983 19.928 1.00 47.55 C ATOM 4 O ALA A 0 -40.055 8.181 19.058 1.00 52.28 O ATOM 5 CB ALA A 0 -42.750 9.670 20.411 1.00 49.62 C ATOM 6 HN3 ALA A 0 -40.893 9.842 22.417 1.00 0.00 H ATOM 7 HN2 ALA A 0 -40.515 8.187 22.486 1.00 0.00 H ATOM 8 HN1 ALA A 0 -42.092 8.714 22.837 1.00 0.00 H ATOM 9 N MET A 1 -39.668 10.073 20.218 1.00 47.06 N ATOM 10 CA MET A 1 -38.453 10.427 19.486 1.00 48.02 C ATOM 11 C MET A 1 -37.403 9.341 19.725 1.00 45.59 C ATOM 12 O MET A 1 -36.694 8.954 18.780 1.00 44.03 O ATOM 13 CB MET A 1 -37.905 11.815 19.863 1.00 43.52 C ATOM 14 CG MET A 1 -36.587 12.196 19.159 1.00 42.97 C ATOM 15 SD MET A 1 -36.683 12.091 17.335 1.00 41.88 S ATOM 16 CE MET A 1 -37.376 13.698 16.962 1.00 38.58 C ATOM 17 H MET A 1 -39.987 10.691 20.991 1.00 0.00 H ATOM 18 N GLU A 2 -37.328 8.821 20.951 1.00 46.15 N ATOM 19 CA GLU A 2 -36.331 7.769 21.217 1.00 48.09 C ATOM 20 C GLU A 2 -36.683 6.501 20.433 1.00 43.86 C ATOM 21 O GLU A 2 -35.810 5.908 19.842 1.00 48.02 O ATOM 22 CB GLU A 2 -36.185 7.446 22.702 1.00 51.48 C ATOM 23 CG GLU A 2 -35.273 6.244 22.940 1.00 55.07 C ATOM 24 CD GLU A 2 -35.181 5.782 24.383 1.00 54.69 C ATOM 25 OE1 GLU A 2 -35.669 6.516 25.263 1.00 50.27 O ATOM 26 OE2 GLU A 2 -34.608 4.697 24.625 1.00 57.23 O ATOM 27 H GLU A 2 -37.962 9.152 21.706 1.00 0.00 H ATOM 28 N ASP A 3 -37.958 6.096 20.429 1.00 49.31 N ATOM 29 CA ASP A 3 -38.421 4.945 19.607 1.00 49.47 C ATOM 30 C ASP A 3 -38.098 5.216 18.136 1.00 49.76 C ATOM 31 O ASP A 3 -37.492 4.379 17.441 1.00 47.11 O ATOM 32 CB ASP A 3 -39.928 4.701 19.718 1.00 51.11 C ATOM 33 CG ASP A 3 -40.406 4.307 21.104 1.00 49.61 C ATOM 34 OD1 ASP A 3 -39.575 3.884 21.908 1.00 50.94 O ATOM 35 OD2 ASP A 3 -41.604 4.448 21.365 1.00 51.85 O ATOM 36 H ASP A 3 -38.648 6.602 21.020 1.00 0.00 H ATOM 37 N PHE A 4 -38.476 6.411 17.673 1.00 44.84 N ATOM 38 CA PHE A 4 -38.240 6.760 16.297 1.00 45.88 C ATOM 39 C PHE A 4 -36.788 6.451 15.931 1.00 39.04 C ATOM 40 O PHE A 4 -36.563 5.816 14.895 1.00 38.28 O ATOM 41 CB PHE A 4 -38.543 8.224 15.974 1.00 45.96 C ATOM 42 CG PHE A 4 -37.890 8.636 14.681 1.00 43.48 C ATOM 43 CD1 PHE A 4 -38.375 8.169 13.469 1.00 42.26 C ATOM 44 CD2 PHE A 4 -36.746 9.406 14.678 1.00 40.79 C ATOM 45 CE1 PHE A 4 -37.758 8.511 12.274 1.00 40.79 C ATOM 46 CE2 PHE A 4 -36.130 9.738 13.478 1.00 46.23 C ATOM 47 CZ PHE A 4 -36.631 9.282 12.279 1.00 41.81 C ATOM 48 H PHE A 4 -38.942 7.090 18.308 1.00 0.00 H ATOM 49 N VAL A 5 -35.822 6.866 16.762 1.00 38.77 N ATOM 50 CA VAL A 5 -34.409 6.673 16.341 1.00 39.93 C ATOM 51 C VAL A 5 -34.028 5.192 16.431 1.00 42.21 C ATOM 52 O VAL A 5 -33.273 4.696 15.592 1.00 42.51 O ATOM 53 CB VAL A 5 -33.371 7.585 17.028 1.00 39.85 C ATOM 54 CG1 VAL A 5 -33.949 8.531 18.045 1.00 46.15 C ATOM 55 CG2 VAL A 5 -32.201 6.822 17.610 1.00 42.33 C ATOM 56 H VAL A 5 -36.054 7.310 17.674 1.00 0.00 H ATOM 57 N ARG A 6 -34.553 4.457 17.415 1.00 50.03 N ATOM 58 CA ARG A 6 -34.133 3.039 17.543 1.00 52.67 C ATOM 59 C ARG A 6 -34.692 2.239 16.358 1.00 51.38 C ATOM 60 O ARG A 6 -34.146 1.204 16.009 1.00 56.63 O ATOM 61 CB ARG A 6 -34.530 2.413 18.886 1.00 52.27 C ATOM 62 CG ARG A 6 -34.336 3.317 20.096 1.00 51.63 C ATOM 63 CD ARG A 6 -34.203 2.574 21.408 1.00 49.67 C ATOM 64 NE ARG A 6 -32.791 2.334 21.642 1.00 54.27 N ATOM 65 CZ ARG A 6 -32.006 3.140 22.346 1.00 55.33 C ATOM 66 NH1 ARG A 6 -32.538 4.093 23.096 1.00 52.33 N ATOM 67 NH2 ARG A 6 -30.694 2.987 22.298 1.00 51.19 N ATOM 68 HE ARG A 6 -32.368 1.477 21.232 1.00 0.00 H ATOM 69 HH12 ARG A 6 -31.923 4.725 23.648 1.00 0.00 H ATOM 70 HH11 ARG A 6 -33.571 4.210 23.133 1.00 0.00 H ATOM 71 HH22 ARG A 6 -30.076 3.617 22.849 1.00 0.00 H ATOM 72 HH21 ARG A 6 -30.279 2.236 21.710 1.00 0.00 H ATOM 73 H ARG A 6 -35.241 4.869 18.077 1.00 0.00 H ATOM 74 N GLN A 7 -35.736 2.764 15.712 1.00 53.00 N ATOM 75 CA GLN A 7 -36.449 2.068 14.664 1.00 50.84 C ATOM 76 C GLN A 7 -35.998 2.491 13.265 1.00 54.50 C ATOM 77 O GLN A 7 -36.184 1.711 12.341 1.00 58.40 O ATOM 78 CB GLN A 7 -37.945 2.288 14.860 1.00 58.76 C ATOM 79 CG GLN A 7 -38.499 1.447 16.010 1.00 63.86 C ATOM 80 CD GLN A 7 -39.829 1.907 16.552 1.00 65.38 C ATOM 81 OE1 GLN A 7 -40.595 2.606 15.885 1.00 64.30 O ATOM 82 NE2 GLN A 7 -40.112 1.501 17.781 1.00 64.81 N ATOM 83 HE22 GLN A 7 -39.432 0.912 18.304 1.00 0.00 H ATOM 84 HE21 GLN A 7 -41.014 1.771 18.223 1.00 0.00 H ATOM 85 H GLN A 7 -36.052 3.719 15.975 1.00 0.00 H ATOM 86 N CYS A 8 -35.436 3.697 13.082 1.00 54.04 N ATOM 87 CA CYS A 8 -35.153 4.177 11.703 1.00 53.18 C ATOM 88 C CYS A 8 -33.647 4.260 11.397 1.00 55.39 C ATOM 89 O CYS A 8 -33.280 4.593 10.274 1.00 59.95 O ATOM 90 CB CYS A 8 -35.838 5.502 11.390 1.00 53.59 C ATOM 91 SG CYS A 8 -36.811 5.414 9.865 1.00 61.61 S ATOM 92 H CYS A 8 -35.200 4.293 13.901 1.00 0.00 H ATOM 93 N PHE A 9 -32.780 3.956 12.370 1.00 49.64 N ATOM 94 CA PHE A 9 -31.345 3.889 12.131 1.00 45.05 C ATOM 95 C PHE A 9 -30.874 2.506 12.562 1.00 49.91 C ATOM 96 O PHE A 9 -31.467 1.910 13.476 1.00 48.70 O ATOM 97 CB PHE A 9 -30.591 4.954 12.923 1.00 41.72 C ATOM 98 CG PHE A 9 -30.906 6.369 12.532 1.00 39.28 C ATOM 99 CD1 PHE A 9 -30.332 6.934 11.407 1.00 37.66 C ATOM 100 CD2 PHE A 9 -31.766 7.138 13.297 1.00 40.29 C ATOM 101 CE1 PHE A 9 -30.637 8.236 11.037 1.00 36.07 C ATOM 102 CE2 PHE A 9 -32.055 8.441 12.928 1.00 38.24 C ATOM 103 CZ PHE A 9 -31.484 8.985 11.803 1.00 34.92 C ATOM 104 H PHE A 9 -33.142 3.762 13.325 1.00 0.00 H ATOM 105 N ASN A 10 -29.827 2.013 11.899 1.00 47.95 N ATOM 106 CA ASN A 10 -29.408 0.666 12.097 1.00 51.30 C ATOM 107 C ASN A 10 -28.616 0.621 13.394 1.00 54.25 C ATOM 108 O ASN A 10 -27.914 1.571 13.744 1.00 50.90 O ATOM 109 CB ASN A 10 -28.681 0.076 10.885 1.00 54.32 C ATOM 110 CG ASN A 10 -27.193 0.325 10.848 1.00 58.69 C ATOM 111 OD1 ASN A 10 -26.473 0.019 11.797 1.00 63.30 O ATOM 112 ND2 ASN A 10 -26.713 0.825 9.718 1.00 70.65 N ATOM 113 HD22 ASN A 10 -27.360 1.070 8.941 1.00 0.00 H ATOM 114 HD21 ASN A 10 -25.689 0.973 9.608 1.00 0.00 H ATOM 115 H ASN A 10 -29.311 2.619 11.230 1.00 0.00 H ATOM 116 N PRO A 11 -28.724 -0.510 14.128 1.00 53.81 N ATOM 117 CA PRO A 11 -28.198 -0.616 15.488 1.00 48.93 C ATOM 118 C PRO A 11 -26.774 -0.078 15.710 1.00 45.63 C ATOM 119 O PRO A 11 -26.472 0.386 16.811 1.00 48.06 O ATOM 120 CB PRO A 11 -28.238 -2.130 15.762 1.00 47.57 C ATOM 121 CG PRO A 11 -29.379 -2.628 14.903 1.00 52.83 C ATOM 122 CD PRO A 11 -29.402 -1.740 13.675 1.00 50.80 C ATOM 123 N MET A 12 -25.898 -0.177 14.707 1.00 44.47 N ATOM 124 CA MET A 12 -24.518 0.295 14.868 1.00 47.90 C ATOM 125 C MET A 12 -24.523 1.824 15.000 1.00 44.86 C ATOM 126 O MET A 12 -23.806 2.380 15.835 1.00 45.50 O ATOM 127 CB MET A 12 -23.616 -0.094 13.692 1.00 52.65 C ATOM 128 CG MET A 12 -22.134 0.157 13.963 1.00 60.92 C ATOM 129 SD MET A 12 -21.102 0.160 12.464 1.00 85.29 S ATOM 130 CE MET A 12 -19.448 0.124 13.161 1.00 78.38 C ATOM 131 H MET A 12 -26.197 -0.593 13.802 1.00 0.00 H ATOM 132 N ILE A 13 -25.317 2.505 14.169 1.00 40.89 N ATOM 133 CA ILE A 13 -25.386 3.964 14.262 1.00 45.38 C ATOM 134 C ILE A 13 -25.969 4.342 15.634 1.00 41.42 C ATOM 135 O ILE A 13 -25.388 5.148 16.343 1.00 37.96 O ATOM 136 CB ILE A 13 -26.165 4.574 13.082 1.00 49.25 C ATOM 137 CG1 ILE A 13 -25.406 4.383 11.764 1.00 48.69 C ATOM 138 CG2 ILE A 13 -26.467 6.044 13.364 1.00 51.09 C ATOM 139 CD1 ILE A 13 -26.258 4.581 10.530 1.00 50.29 C ATOM 140 H ILE A 13 -25.884 2.000 13.458 1.00 0.00 H ATOM 141 N VAL A 14 -27.074 3.697 16.034 1.00 37.59 N ATOM 142 CA VAL A 14 -27.693 4.006 17.329 1.00 41.78 C ATOM 143 C VAL A 14 -26.666 3.816 18.467 1.00 45.43 C ATOM 144 O VAL A 14 -26.544 4.669 19.359 1.00 45.51 O ATOM 145 CB VAL A 14 -28.957 3.162 17.575 1.00 41.36 C ATOM 146 CG1 VAL A 14 -29.467 3.337 19.002 1.00 39.44 C ATOM 147 CG2 VAL A 14 -30.053 3.452 16.551 1.00 41.36 C ATOM 148 H VAL A 14 -27.497 2.971 15.421 1.00 0.00 H ATOM 149 N GLU A 15 -25.904 2.719 18.421 1.00 40.36 N ATOM 150 CA GLU A 15 -24.996 2.340 19.509 1.00 44.46 C ATOM 151 C GLU A 15 -23.810 3.315 19.579 1.00 41.67 C ATOM 152 O GLU A 15 -23.412 3.761 20.682 1.00 38.60 O ATOM 153 CB GLU A 15 -24.555 0.888 19.323 1.00 49.06 C ATOM 154 CG GLU A 15 -23.383 0.487 20.199 1.00 56.93 C ATOM 155 CD GLU A 15 -23.123 -1.013 20.231 1.00 65.06 C ATOM 156 OE1 GLU A 15 -22.035 -1.410 20.699 1.00 65.75 O ATOM 157 OE2 GLU A 15 -24.007 -1.780 19.779 1.00 68.17 O ATOM 158 H GLU A 15 -25.957 2.110 17.580 1.00 0.00 H ATOM 159 N LEU A 16 -23.258 3.656 18.411 1.00 37.98 N ATOM 160 CA LEU A 16 -22.195 4.629 18.314 1.00 39.87 C ATOM 161 C LEU A 16 -22.673 5.987 18.868 1.00 40.69 C ATOM 162 O LEU A 16 -21.933 6.650 19.632 1.00 35.58 O ATOM 163 CB LEU A 16 -21.730 4.704 16.852 1.00 40.28 C ATOM 164 CG LEU A 16 -20.801 3.563 16.405 1.00 42.07 C ATOM 165 CD1 LEU A 16 -20.604 3.532 14.901 1.00 41.20 C ATOM 166 CD2 LEU A 16 -19.446 3.667 17.087 1.00 44.02 C ATOM 167 H LEU A 16 -23.606 3.205 17.541 1.00 0.00 H ATOM 168 N ALA A 17 -23.920 6.374 18.544 1.00 40.35 N ATOM 169 CA ALA A 17 -24.469 7.686 18.956 1.00 43.60 C ATOM 170 C ALA A 17 -24.715 7.684 20.460 1.00 41.70 C ATOM 171 O ALA A 17 -24.331 8.620 21.161 1.00 45.52 O ATOM 172 CB ALA A 17 -25.742 8.013 18.208 1.00 44.30 C ATOM 173 H ALA A 17 -24.518 5.731 17.986 1.00 0.00 H ATOM 174 N GLU A 18 -25.366 6.617 20.921 1.00 42.24 N ATOM 175 CA GLU A 18 -25.719 6.427 22.327 1.00 47.02 C ATOM 176 C GLU A 18 -24.455 6.414 23.203 1.00 45.57 C ATOM 177 O GLU A 18 -24.424 7.045 24.285 1.00 46.68 O ATOM 178 CB GLU A 18 -26.512 5.131 22.470 1.00 47.57 C ATOM 179 CG GLU A 18 -27.320 5.022 23.737 1.00 50.36 C ATOM 180 CD GLU A 18 -28.458 4.040 23.567 1.00 57.98 C ATOM 181 OE1 GLU A 18 -28.267 3.055 22.788 1.00 50.33 O ATOM 182 OE2 GLU A 18 -29.538 4.274 24.173 1.00 57.86 O ATOM 183 H GLU A 18 -25.638 5.877 20.242 1.00 0.00 H ATOM 184 N LYS A 19 -23.417 5.716 22.734 1.00 44.59 N ATOM 185 CA LYS A 19 -22.156 5.616 23.455 1.00 48.27 C ATOM 186 C LYS A 19 -21.532 7.015 23.552 1.00 50.37 C ATOM 187 O LYS A 19 -21.220 7.498 24.661 1.00 51.83 O ATOM 188 CB LYS A 19 -21.242 4.590 22.783 1.00 55.05 C ATOM 189 CG LYS A 19 -19.851 4.449 23.396 1.00 64.72 C ATOM 190 CD LYS A 19 -18.761 4.171 22.362 1.00 69.06 C ATOM 191 CE LYS A 19 -17.370 4.005 22.945 1.00 68.76 C ATOM 192 NZ LYS A 19 -16.525 3.152 22.072 1.00 68.03 N ATOM 193 HZ1 LYS A 19 -16.962 2.213 21.979 1.00 0.00 H ATOM 194 HZ2 LYS A 19 -16.443 3.592 21.133 1.00 0.00 H ATOM 195 HZ3 LYS A 19 -15.580 3.055 22.494 1.00 0.00 H ATOM 196 H LYS A 19 -23.513 5.227 21.821 1.00 0.00 H ATOM 197 N ALA A 20 -21.405 7.699 22.406 1.00 50.62 N ATOM 198 CA ALA A 20 -20.813 9.029 22.378 1.00 45.78 C ATOM 199 C ALA A 20 -21.521 9.927 23.405 1.00 48.85 C ATOM 200 O ALA A 20 -20.869 10.628 24.179 1.00 50.65 O ATOM 201 CB ALA A 20 -20.877 9.601 20.984 1.00 46.40 C ATOM 202 H ALA A 20 -21.736 7.271 21.518 1.00 0.00 H ATOM 203 N MET A 21 -22.861 9.890 23.429 1.00 47.26 N ATOM 204 CA MET A 21 -23.636 10.754 24.342 1.00 48.16 C ATOM 205 C MET A 21 -23.336 10.393 25.807 1.00 50.69 C ATOM 206 O MET A 21 -23.069 11.282 26.633 1.00 48.57 O ATOM 207 CB MET A 21 -25.139 10.664 24.071 1.00 41.87 C ATOM 208 CG MET A 21 -25.558 11.474 22.865 1.00 40.58 C ATOM 209 SD MET A 21 -27.324 11.292 22.495 1.00 45.13 S ATOM 210 CE MET A 21 -27.985 12.583 23.545 1.00 38.84 C ATOM 211 H MET A 21 -23.365 9.240 22.792 1.00 0.00 H ATOM 212 N LYS A 22 -23.353 9.093 26.118 1.00 54.28 N ATOM 213 CA LYS A 22 -23.289 8.621 27.508 1.00 57.34 C ATOM 214 C LYS A 22 -21.882 8.837 28.090 1.00 55.56 C ATOM 215 O LYS A 22 -21.750 9.067 29.279 1.00 63.33 O ATOM 216 CB LYS A 22 -23.808 7.181 27.576 1.00 61.43 C ATOM 217 CG LYS A 22 -25.329 7.071 27.486 1.00 65.19 C ATOM 218 CD LYS A 22 -25.848 5.713 27.073 1.00 69.43 C ATOM 219 CE LYS A 22 -25.230 4.561 27.838 1.00 74.82 C ATOM 220 NZ LYS A 22 -25.789 3.256 27.401 1.00 81.12 N ATOM 221 HZ1 LYS A 22 -26.816 3.248 27.565 1.00 0.00 H ATOM 222 HZ2 LYS A 22 -25.597 3.120 26.388 1.00 0.00 H ATOM 223 HZ3 LYS A 22 -25.344 2.490 27.945 1.00 0.00 H ATOM 224 H LYS A 22 -23.413 8.393 25.351 1.00 0.00 H ATOM 225 N GLU A 23 -20.850 8.853 27.245 1.00 54.56 N ATOM 226 CA GLU A 23 -19.482 9.154 27.688 1.00 57.48 C ATOM 227 C GLU A 23 -19.321 10.630 28.110 1.00 56.09 C ATOM 228 O GLU A 23 -18.494 10.952 28.989 1.00 50.96 O ATOM 229 CB GLU A 23 -18.497 8.759 26.585 1.00 59.76 C ATOM 230 CG GLU A 23 -18.331 7.255 26.468 1.00 62.69 C ATOM 231 CD GLU A 23 -17.146 6.780 25.646 1.00 71.49 C ATOM 232 OE1 GLU A 23 -16.944 5.543 25.584 1.00 77.09 O ATOM 233 OE2 GLU A 23 -16.430 7.638 25.067 1.00 71.04 O ATOM 234 H GLU A 23 -21.019 8.646 26.240 1.00 0.00 H ATOM 235 N TYR A 24 -20.103 11.528 27.501 1.00 54.83 N ATOM 236 CA TYR A 24 -20.030 12.977 27.786 1.00 58.88 C ATOM 237 C TYR A 24 -21.162 13.376 28.754 1.00 57.67 C ATOM 238 O TYR A 24 -21.318 14.539 29.092 1.00 55.36 O ATOM 239 CB TYR A 24 -19.970 13.752 26.463 1.00 58.98 C ATOM 240 CG TYR A 24 -18.737 13.413 25.657 1.00 68.37 C ATOM 241 CD1 TYR A 24 -18.575 12.148 25.109 1.00 75.67 C ATOM 242 CD2 TYR A 24 -17.696 14.313 25.485 1.00 73.21 C ATOM 243 CE1 TYR A 24 -17.442 11.793 24.393 1.00 77.47 C ATOM 244 CE2 TYR A 24 -16.553 13.974 24.770 1.00 76.70 C ATOM 245 CZ TYR A 24 -16.417 12.706 24.227 1.00 78.99 C ATOM 246 OH TYR A 24 -15.301 12.335 23.526 1.00 76.00 O ATOM 247 HH TYR A 24 -15.399 11.397 23.224 1.00 0.00 H ATOM 248 H TYR A 24 -20.792 11.193 26.797 1.00 0.00 H ATOM 249 N GLY A 25 -21.919 12.381 29.233 1.00 58.68 N ATOM 250 CA GLY A 25 -22.884 12.546 30.306 1.00 57.78 C ATOM 251 C GLY A 25 -24.245 13.018 29.814 1.00 58.57 C ATOM 252 O GLY A 25 -25.028 13.573 30.590 1.00 55.76 O ATOM 253 H GLY A 25 -21.810 11.436 28.813 1.00 0.00 H ATOM 254 N GLU A 26 -24.536 12.790 28.529 1.00 59.80 N ATOM 255 CA GLU A 26 -25.834 13.135 27.947 1.00 57.10 C ATOM 256 C GLU A 26 -26.719 11.887 27.911 1.00 48.65 C ATOM 257 O GLU A 26 -26.343 10.880 27.339 1.00 47.44 O ATOM 258 CB GLU A 26 -25.649 13.703 26.542 1.00 57.08 C ATOM 259 CG GLU A 26 -24.526 14.708 26.458 1.00 61.61 C ATOM 260 CD GLU A 26 -24.773 15.888 25.535 1.00 68.65 C ATOM 261 OE1 GLU A 26 -25.890 16.478 25.574 1.00 79.67 O ATOM 262 OE2 GLU A 26 -23.841 16.236 24.796 1.00 63.39 O ATOM 263 H GLU A 26 -23.814 12.352 27.921 1.00 0.00 H ATOM 264 N ASP A 27 -27.909 11.975 28.505 1.00 44.98 N ATOM 265 CA ASP A 27 -28.881 10.882 28.420 1.00 47.05 C ATOM 266 C ASP A 27 -29.678 10.984 27.111 1.00 44.28 C ATOM 267 O ASP A 27 -30.403 11.947 26.884 1.00 35.80 O ATOM 268 CB ASP A 27 -29.816 10.864 29.631 1.00 47.08 C ATOM 269 CG ASP A 27 -30.710 9.639 29.674 1.00 47.97 C ATOM 270 OD1 ASP A 27 -30.642 8.814 28.725 1.00 48.36 O ATOM 271 OD2 ASP A 27 -31.487 9.530 30.634 1.00 54.67 O ATOM 272 H ASP A 27 -28.152 12.834 29.038 1.00 0.00 H ATOM 273 N PRO A 28 -29.583 9.988 26.204 1.00 44.18 N ATOM 274 CA PRO A 28 -30.360 10.014 24.967 1.00 42.48 C ATOM 275 C PRO A 28 -31.867 9.797 25.148 1.00 43.87 C ATOM 276 O PRO A 28 -32.607 9.903 24.185 1.00 50.23 O ATOM 277 CB PRO A 28 -29.758 8.909 24.095 1.00 41.04 C ATOM 278 CG PRO A 28 -28.957 8.029 25.040 1.00 42.52 C ATOM 279 CD PRO A 28 -28.667 8.842 26.285 1.00 44.65 C ATOM 280 N LYS A 29 -32.320 9.550 26.378 1.00 46.70 N ATOM 281 CA LYS A 29 -33.764 9.476 26.649 1.00 45.89 C ATOM 282 C LYS A 29 -34.323 10.879 26.937 1.00 39.51 C ATOM 283 O LYS A 29 -35.522 11.087 26.867 1.00 41.20 O ATOM 284 CB LYS A 29 -34.050 8.516 27.811 1.00 51.08 C ATOM 285 CG LYS A 29 -33.291 7.193 27.770 1.00 54.03 C ATOM 286 CD LYS A 29 -34.105 5.980 28.190 1.00 60.33 C ATOM 287 CE LYS A 29 -33.296 4.704 28.086 1.00 63.94 C ATOM 288 NZ LYS A 29 -34.077 3.606 27.476 1.00 62.87 N ATOM 289 HZ1 LYS A 29 -34.917 3.414 28.059 1.00 0.00 H ATOM 290 HZ2 LYS A 29 -34.374 3.884 26.519 1.00 0.00 H ATOM 291 HZ3 LYS A 29 -33.488 2.751 27.423 1.00 0.00 H ATOM 292 H LYS A 29 -31.644 9.408 27.155 1.00 0.00 H ATOM 293 N ILE A 30 -33.437 11.815 27.281 1.00 41.92 N ATOM 294 CA ILE A 30 -33.733 13.220 27.617 1.00 44.61 C ATOM 295 C ILE A 30 -33.412 14.119 26.416 1.00 42.60 C ATOM 296 O ILE A 30 -34.213 14.991 26.042 1.00 35.53 O ATOM 297 CB ILE A 30 -32.900 13.677 28.839 1.00 45.52 C ATOM 298 CG1 ILE A 30 -33.245 12.911 30.119 1.00 52.30 C ATOM 299 CG2 ILE A 30 -33.008 15.185 29.038 1.00 45.17 C ATOM 300 CD1 ILE A 30 -32.211 13.080 31.241 1.00 54.12 C ATOM 301 H ILE A 30 -32.439 11.525 27.316 1.00 0.00 H ATOM 302 N GLU A 31 -32.177 13.993 25.900 1.00 40.47 N ATOM 303 CA GLU A 31 -31.716 14.820 24.781 1.00 40.18 C ATOM 304 C GLU A 31 -32.017 14.070 23.481 1.00 37.46 C ATOM 305 O GLU A 31 -31.126 13.673 22.746 1.00 35.24 O ATOM 306 CB GLU A 31 -30.250 15.200 24.986 1.00 42.87 C ATOM 307 CG GLU A 31 -30.043 16.199 26.119 1.00 48.05 C ATOM 308 CD GLU A 31 -30.851 17.485 25.975 1.00 55.42 C ATOM 309 OE1 GLU A 31 -31.611 17.799 26.912 1.00 55.72 O ATOM 310 OE2 GLU A 31 -30.753 18.159 24.905 1.00 55.06 O ATOM 311 H GLU A 31 -31.530 13.288 26.307 1.00 0.00 H ATOM 312 N THR A 32 -33.315 13.872 23.237 1.00 38.70 N ATOM 313 CA THR A 32 -33.803 12.976 22.206 1.00 38.90 C ATOM 314 C THR A 32 -33.576 13.602 20.832 1.00 38.81 C ATOM 315 O THR A 32 -33.222 12.868 19.904 1.00 38.00 O ATOM 316 CB THR A 32 -35.273 12.619 22.435 1.00 39.78 C ATOM 317 OG1 THR A 32 -35.874 13.902 22.497 1.00 42.07 O ATOM 318 CG2 THR A 32 -35.527 11.801 23.685 1.00 37.54 C ATOM 319 HG1 THR A 32 -36.848 13.802 22.646 1.00 0.00 H ATOM 320 H THR A 32 -34.010 14.386 23.815 1.00 0.00 H ATOM 321 N ASN A 33 -33.736 14.935 20.721 1.00 36.14 N ATOM 322 CA ASN A 33 -33.454 15.656 19.450 1.00 39.21 C ATOM 323 C ASN A 33 -31.967 15.537 19.095 1.00 39.19 C ATOM 324 O ASN A 33 -31.630 15.251 17.922 1.00 38.20 O ATOM 325 CB ASN A 33 -33.954 17.108 19.443 1.00 38.66 C ATOM 326 CG ASN A 33 -35.465 17.182 19.342 1.00 38.62 C ATOM 327 OD1 ASN A 33 -36.106 16.215 18.948 1.00 37.01 O ATOM 328 ND2 ASN A 33 -36.054 18.302 19.721 1.00 38.07 N ATOM 329 HD22 ASN A 33 -35.481 19.105 20.051 1.00 0.00 H ATOM 330 HD21 ASN A 33 -37.091 18.381 19.690 1.00 0.00 H ATOM 331 H ASN A 33 -34.066 15.475 21.546 1.00 0.00 H ATOM 332 N LYS A 34 -31.092 15.718 20.093 1.00 36.44 N ATOM 333 CA LYS A 34 -29.632 15.554 19.915 1.00 38.26 C ATOM 334 C LYS A 34 -29.277 14.141 19.415 1.00 41.92 C ATOM 335 O LYS A 34 -28.394 13.936 18.570 1.00 36.85 O ATOM 336 CB LYS A 34 -28.922 15.774 21.249 1.00 41.74 C ATOM 337 CG LYS A 34 -27.430 16.006 21.136 1.00 46.23 C ATOM 338 CD LYS A 34 -26.881 16.735 22.320 1.00 52.15 C ATOM 339 CE LYS A 34 -25.815 17.736 21.953 1.00 56.61 C ATOM 340 NZ LYS A 34 -25.125 18.203 23.177 1.00 63.46 N ATOM 341 HZ1 LYS A 34 -25.815 18.651 23.813 1.00 0.00 H ATOM 342 HZ2 LYS A 34 -24.686 17.392 23.657 1.00 0.00 H ATOM 343 HZ3 LYS A 34 -24.391 18.893 22.918 1.00 0.00 H ATOM 344 H LYS A 34 -31.453 15.985 21.031 1.00 0.00 H ATOM 345 N PHE A 35 -29.979 13.159 19.980 1.00 44.12 N ATOM 346 CA PHE A 35 -29.807 11.746 19.692 1.00 41.12 C ATOM 347 C PHE A 35 -30.102 11.499 18.201 1.00 35.39 C ATOM 348 O PHE A 35 -29.279 10.913 17.475 1.00 34.13 O ATOM 349 CB PHE A 35 -30.710 10.969 20.661 1.00 38.95 C ATOM 350 CG PHE A 35 -30.582 9.470 20.647 1.00 39.07 C ATOM 351 CD1 PHE A 35 -29.382 8.850 20.327 1.00 37.64 C ATOM 352 CD2 PHE A 35 -31.658 8.679 21.040 1.00 37.66 C ATOM 353 CE1 PHE A 35 -29.285 7.463 20.335 1.00 40.46 C ATOM 354 CE2 PHE A 35 -31.555 7.297 21.058 1.00 38.30 C ATOM 355 CZ PHE A 35 -30.371 6.690 20.706 1.00 38.05 C ATOM 356 H PHE A 35 -30.703 13.424 20.678 1.00 0.00 H ATOM 357 N ALA A 36 -31.291 11.935 17.773 1.00 32.84 N ATOM 358 CA ALA A 36 -31.736 11.869 16.403 1.00 31.51 C ATOM 359 C ALA A 36 -30.734 12.577 15.484 1.00 32.66 C ATOM 360 O ALA A 36 -30.439 12.057 14.433 1.00 33.85 O ATOM 361 CB ALA A 36 -33.108 12.472 16.265 1.00 30.46 C ATOM 362 H ALA A 36 -31.938 12.349 18.474 1.00 0.00 H ATOM 363 N ALA A 37 -30.202 13.736 15.903 1.00 33.15 N ATOM 364 CA ALA A 37 -29.245 14.525 15.066 1.00 31.00 C ATOM 365 C ALA A 37 -27.899 13.813 14.924 1.00 29.00 C ATOM 366 O ALA A 37 -27.305 13.814 13.833 1.00 25.10 O ATOM 367 CB ALA A 37 -29.016 15.888 15.652 1.00 31.43 C ATOM 368 H ALA A 37 -30.464 14.098 16.842 1.00 0.00 H ATOM 369 N ILE A 38 -27.393 13.264 16.032 1.00 30.26 N ATOM 370 CA ILE A 38 -26.104 12.553 16.015 1.00 33.23 C ATOM 371 C ILE A 38 -26.211 11.339 15.077 1.00 37.33 C ATOM 372 O ILE A 38 -25.374 11.175 14.189 1.00 33.36 O ATOM 373 CB ILE A 38 -25.667 12.170 17.437 1.00 35.15 C ATOM 374 CG1 ILE A 38 -25.178 13.408 18.201 1.00 36.04 C ATOM 375 CG2 ILE A 38 -24.602 11.080 17.396 1.00 32.31 C ATOM 376 CD1 ILE A 38 -25.203 13.265 19.710 1.00 35.86 C ATOM 377 H ILE A 38 -27.921 13.341 16.925 1.00 0.00 H ATOM 378 N CYS A 39 -27.272 10.534 15.247 1.00 37.59 N ATOM 379 CA CYS A 39 -27.565 9.393 14.355 1.00 38.16 C ATOM 380 C CYS A 39 -27.643 9.880 12.905 1.00 37.15 C ATOM 381 O CYS A 39 -26.968 9.289 12.028 1.00 32.92 O ATOM 382 CB CYS A 39 -28.860 8.666 14.719 1.00 36.37 C ATOM 383 SG CYS A 39 -28.780 7.832 16.329 1.00 37.16 S ATOM 384 H CYS A 39 -27.916 10.722 16.042 1.00 0.00 H ATOM 385 N THR A 40 -28.414 10.966 12.670 1.00 34.93 N ATOM 386 CA THR A 40 -28.629 11.460 11.298 1.00 33.91 C ATOM 387 C THR A 40 -27.280 11.792 10.673 1.00 32.98 C ATOM 388 O THR A 40 -26.969 11.289 9.598 1.00 31.98 O ATOM 389 CB THR A 40 -29.577 12.657 11.180 1.00 33.97 C ATOM 390 OG1 THR A 40 -30.900 12.271 11.549 1.00 33.40 O ATOM 391 CG2 THR A 40 -29.666 13.197 9.767 1.00 37.27 C ATOM 392 HG1 THR A 40 -30.899 11.947 12.484 1.00 0.00 H ATOM 393 H THR A 40 -28.862 11.460 13.469 1.00 0.00 H ATOM 394 N HIS A 41 -26.481 12.593 11.384 1.00 32.29 N ATOM 395 CA HIS A 41 -25.200 13.075 10.869 1.00 33.72 C ATOM 396 C HIS A 41 -24.229 11.887 10.672 1.00 34.71 C ATOM 397 O HIS A 41 -23.421 11.866 9.712 1.00 29.93 O ATOM 398 CB HIS A 41 -24.633 14.174 11.789 1.00 30.57 C ATOM 399 CG HIS A 41 -23.210 14.525 11.498 1.00 33.10 C ATOM 400 ND1 HIS A 41 -22.146 13.876 12.093 1.00 34.94 N ATOM 401 CD2 HIS A 41 -22.662 15.455 10.685 1.00 34.50 C ATOM 402 CE1 HIS A 41 -21.006 14.398 11.668 1.00 34.50 C ATOM 403 NE2 HIS A 41 -21.294 15.367 10.813 1.00 37.33 N ATOM 404 H HIS A 41 -26.781 12.884 12.337 1.00 0.00 H ATOM 405 N LEU A 42 -24.267 10.921 11.598 1.00 32.85 N ATOM 406 CA LEU A 42 -23.408 9.745 11.487 1.00 34.92 C ATOM 407 C LEU A 42 -23.765 9.001 10.198 1.00 33.28 C ATOM 408 O LEU A 42 -22.896 8.637 9.398 1.00 33.35 O ATOM 409 CB LEU A 42 -23.583 8.809 12.689 1.00 40.19 C ATOM 410 CG LEU A 42 -22.296 8.336 13.373 1.00 43.66 C ATOM 411 CD1 LEU A 42 -22.545 7.062 14.179 1.00 45.07 C ATOM 412 CD2 LEU A 42 -21.173 8.109 12.381 1.00 42.68 C ATOM 413 H LEU A 42 -24.916 11.009 12.406 1.00 0.00 H ATOM 414 N GLU A 43 -25.059 8.778 10.001 1.00 31.59 N ATOM 415 CA GLU A 43 -25.505 8.039 8.851 1.00 33.52 C ATOM 416 C GLU A 43 -25.092 8.729 7.550 1.00 33.72 C ATOM 417 O GLU A 43 -24.813 8.029 6.529 1.00 36.16 O ATOM 418 CB GLU A 43 -27.020 7.879 8.856 1.00 36.66 C ATOM 419 CG GLU A 43 -27.523 7.181 7.613 1.00 38.95 C ATOM 420 CD GLU A 43 -28.808 6.416 7.803 1.00 42.71 C ATOM 421 OE1 GLU A 43 -29.722 6.966 8.407 1.00 40.69 O ATOM 422 OE2 GLU A 43 -28.884 5.273 7.346 1.00 53.28 O ATOM 423 H GLU A 43 -25.755 9.140 10.683 1.00 0.00 H ATOM 424 N VAL A 44 -25.139 10.074 7.536 1.00 30.94 N ATOM 425 CA VAL A 44 -24.780 10.815 6.342 1.00 28.85 C ATOM 426 C VAL A 44 -23.298 10.595 6.073 1.00 28.45 C ATOM 427 O VAL A 44 -22.939 10.383 4.939 1.00 33.15 O ATOM 428 CB VAL A 44 -25.122 12.318 6.406 1.00 28.99 C ATOM 429 CG1 VAL A 44 -24.333 13.125 5.391 1.00 26.20 C ATOM 430 CG2 VAL A 44 -26.597 12.557 6.201 1.00 28.18 C ATOM 431 H VAL A 44 -25.436 10.587 8.390 1.00 0.00 H ATOM 432 N CYS A 45 -22.458 10.685 7.110 1.00 29.57 N ATOM 433 CA CYS A 45 -21.012 10.460 6.962 1.00 31.22 C ATOM 434 C CYS A 45 -20.703 9.052 6.417 1.00 33.98 C ATOM 435 O CYS A 45 -19.819 8.899 5.579 1.00 36.44 O ATOM 436 CB CYS A 45 -20.288 10.669 8.283 1.00 30.68 C ATOM 437 SG CYS A 45 -20.262 12.408 8.786 1.00 33.76 S ATOM 438 H CYS A 45 -22.839 10.921 8.049 1.00 0.00 H ATOM 439 N PHE A 46 -21.422 8.033 6.901 1.00 34.57 N ATOM 440 CA PHE A 46 -21.236 6.652 6.458 1.00 37.46 C ATOM 441 C PHE A 46 -21.708 6.503 5.006 1.00 40.25 C ATOM 442 O PHE A 46 -21.065 5.806 4.221 1.00 38.68 O ATOM 443 CB PHE A 46 -21.983 5.663 7.359 1.00 37.33 C ATOM 444 CG PHE A 46 -21.403 5.441 8.730 1.00 38.81 C ATOM 445 CD1 PHE A 46 -20.230 6.057 9.139 1.00 43.12 C ATOM 446 CD2 PHE A 46 -22.033 4.588 9.618 1.00 43.13 C ATOM 447 CE1 PHE A 46 -19.726 5.847 10.416 1.00 43.38 C ATOM 448 CE2 PHE A 46 -21.515 4.362 10.881 1.00 36.49 C ATOM 449 CZ PHE A 46 -20.371 4.991 11.278 1.00 38.25 C ATOM 450 H PHE A 46 -22.144 8.231 7.623 1.00 0.00 H ATOM 451 N MET A 47 -22.819 7.167 4.654 1.00 39.24 N ATOM 452 CA MET A 47 -23.353 7.071 3.312 1.00 37.20 C ATOM 453 C MET A 47 -22.382 7.713 2.318 1.00 41.11 C ATOM 454 O MET A 47 -22.239 7.220 1.186 1.00 43.93 O ATOM 455 CB MET A 47 -24.704 7.771 3.184 1.00 39.35 C ATOM 456 CG MET A 47 -25.870 6.902 3.555 1.00 40.33 C ATOM 457 SD MET A 47 -27.385 7.885 3.590 1.00 40.30 S ATOM 458 CE MET A 47 -27.977 7.555 1.933 1.00 41.55 C ATOM 459 H MET A 47 -23.305 7.760 5.357 1.00 0.00 H ATOM 460 N TYR A 48 -21.736 8.804 2.747 1.00 37.73 N ATOM 461 CA TYR A 48 -20.874 9.627 1.912 1.00 37.11 C ATOM 462 C TYR A 48 -19.599 8.842 1.583 1.00 39.80 C ATOM 463 O TYR A 48 -19.103 8.864 0.448 1.00 37.05 O ATOM 464 CB TYR A 48 -20.534 10.912 2.663 1.00 35.43 C ATOM 465 CG TYR A 48 -20.064 12.096 1.859 1.00 37.17 C ATOM 466 CD1 TYR A 48 -18.878 12.092 1.139 1.00 35.77 C ATOM 467 CD2 TYR A 48 -20.788 13.274 1.900 1.00 36.58 C ATOM 468 CE1 TYR A 48 -18.445 13.218 0.449 1.00 35.11 C ATOM 469 CE2 TYR A 48 -20.372 14.403 1.219 1.00 39.83 C ATOM 470 CZ TYR A 48 -19.196 14.385 0.491 1.00 37.03 C ATOM 471 OH TYR A 48 -18.829 15.549 -0.133 1.00 30.80 O ATOM 472 HH TYR A 48 -19.534 15.815 -0.775 1.00 0.00 H ATOM 473 H TYR A 48 -21.858 9.082 3.742 1.00 0.00 H ATOM 474 N SER A 49 -19.062 8.185 2.611 1.00 41.32 N ATOM 475 CA SER A 49 -17.901 7.314 2.499 1.00 43.75 C ATOM 476 C SER A 49 -18.191 6.129 1.564 1.00 44.53 C ATOM 477 O SER A 49 -17.380 5.774 0.700 1.00 50.00 O ATOM 478 CB SER A 49 -17.511 6.836 3.852 1.00 45.76 C ATOM 479 OG SER A 49 -16.331 6.074 3.760 1.00 58.09 O ATOM 480 HG SER A 49 -16.073 5.757 4.662 1.00 0.00 H ATOM 481 H SER A 49 -19.498 8.301 3.548 1.00 0.00 H ATOM 482 N ASP A 50 -19.360 5.519 1.744 1.00 43.40 N ATOM 483 CA ASP A 50 -19.732 4.336 1.013 1.00 51.14 C ATOM 484 C ASP A 50 -19.858 4.643 -0.479 1.00 53.75 C ATOM 485 O ASP A 50 -19.693 3.746 -1.271 1.00 58.73 O ATOM 486 CB ASP A 50 -21.034 3.725 1.530 1.00 51.72 C ATOM 487 CG ASP A 50 -20.893 3.062 2.884 1.00 55.44 C ATOM 488 OD1 ASP A 50 -19.738 2.770 3.292 1.00 64.32 O ATOM 489 OD2 ASP A 50 -21.935 2.871 3.542 1.00 62.94 O ATOM 490 H ASP A 50 -20.029 5.911 2.437 1.00 0.00 H ATOM 491 N PHE A 51 -20.116 5.898 -0.858 1.00 59.68 N ATOM 492 CA PHE A 51 -20.194 6.245 -2.282 1.00 66.73 C ATOM 493 C PHE A 51 -18.794 6.574 -2.825 1.00 72.10 C ATOM 494 O PHE A 51 -18.645 7.455 -3.673 1.00 77.29 O ATOM 495 CB PHE A 51 -21.207 7.369 -2.519 1.00 66.85 C ATOM 496 CG PHE A 51 -22.610 7.071 -2.052 1.00 65.26 C ATOM 497 CD1 PHE A 51 -23.191 5.826 -2.245 1.00 70.36 C ATOM 498 CD2 PHE A 51 -23.362 8.046 -1.417 1.00 68.74 C ATOM 499 CE1 PHE A 51 -24.480 5.561 -1.797 1.00 69.67 C ATOM 500 CE2 PHE A 51 -24.653 7.780 -0.982 1.00 66.54 C ATOM 501 CZ PHE A 51 -25.209 6.539 -1.165 1.00 63.82 C ATOM 502 H PHE A 51 -20.263 6.635 -0.139 1.00 0.00 H ATOM 503 N GLY A 52 -17.786 5.812 -2.375 1.00 71.59 N ATOM 504 CA GLY A 52 -16.426 5.908 -2.867 1.00 68.94 C ATOM 505 C GLY A 52 -15.472 5.104 -2.003 1.00 73.16 C ATOM 506 O GLY A 52 -15.118 3.982 -2.343 1.00 73.42 O ATOM 507 H GLY A 52 -17.992 5.114 -1.632 1.00 0.00 H TER 508 GLY A 52 ATOM 509 N HIS A 74 -12.043 2.696 -2.123 1.00 57.47 N ATOM 510 CA HIS A 74 -11.540 3.341 -0.917 1.00 58.05 C ATOM 511 C HIS A 74 -11.039 4.762 -1.271 1.00 58.49 C ATOM 512 O HIS A 74 -9.841 5.075 -1.198 1.00 58.64 O ATOM 513 CB HIS A 74 -10.515 2.405 -0.244 1.00 66.12 C ATOM 514 CG HIS A 74 -10.053 2.836 1.116 1.00 73.73 C ATOM 515 ND1 HIS A 74 -10.900 2.887 2.221 1.00 77.64 N ATOM 516 CD2 HIS A 74 -8.835 3.225 1.564 1.00 73.11 C ATOM 517 CE1 HIS A 74 -10.227 3.310 3.275 1.00 77.56 C ATOM 518 NE2 HIS A 74 -8.955 3.522 2.900 1.00 73.10 N ATOM 519 HN3 HIS A 74 -11.279 2.632 -2.825 1.00 0.00 H ATOM 520 HN2 HIS A 74 -12.828 3.256 -2.513 1.00 0.00 H ATOM 521 HN1 HIS A 74 -12.381 1.741 -1.889 1.00 0.00 H ATOM 522 N ARG A 75 -11.982 5.622 -1.679 1.00 51.58 N ATOM 523 CA ARG A 75 -11.741 7.043 -1.984 1.00 49.14 C ATOM 524 C ARG A 75 -11.755 7.888 -0.707 1.00 49.77 C ATOM 525 O ARG A 75 -11.045 8.877 -0.650 1.00 56.97 O ATOM 526 CB ARG A 75 -12.810 7.628 -2.917 1.00 46.76 C ATOM 527 CG ARG A 75 -12.810 9.147 -2.973 1.00 45.75 C ATOM 528 CD ARG A 75 -13.722 9.760 -4.014 1.00 42.25 C ATOM 529 NE ARG A 75 -13.538 11.197 -3.966 1.00 39.06 N ATOM 530 CZ ARG A 75 -14.028 12.071 -4.837 1.00 42.85 C ATOM 531 NH1 ARG A 75 -14.862 11.685 -5.786 1.00 47.33 N ATOM 532 NH2 ARG A 75 -13.667 13.338 -4.763 1.00 44.34 N ATOM 533 HE ARG A 75 -12.972 11.577 -3.180 1.00 0.00 H ATOM 534 HH12 ARG A 75 -15.238 12.380 -6.462 1.00 0.00 H ATOM 535 HH11 ARG A 75 -15.142 10.686 -5.857 1.00 0.00 H ATOM 536 HH22 ARG A 75 -14.047 14.028 -5.442 1.00 0.00 H ATOM 537 HH21 ARG A 75 -13.002 13.647 -4.025 1.00 0.00 H ATOM 538 H ARG A 75 -12.951 5.261 -1.788 1.00 0.00 H ATOM 539 N PHE A 76 -12.604 7.512 0.264 1.00 51.29 N ATOM 540 CA PHE A 76 -12.812 8.260 1.494 1.00 45.20 C ATOM 541 C PHE A 76 -12.345 7.459 2.703 1.00 49.05 C ATOM 542 O PHE A 76 -12.544 6.255 2.776 1.00 53.70 O ATOM 543 CB PHE A 76 -14.283 8.626 1.673 1.00 42.91 C ATOM 544 CG PHE A 76 -14.796 9.523 0.580 1.00 42.33 C ATOM 545 CD1 PHE A 76 -14.378 10.842 0.502 1.00 41.78 C ATOM 546 CD2 PHE A 76 -15.676 9.047 -0.379 1.00 45.26 C ATOM 547 CE1 PHE A 76 -14.830 11.672 -0.510 1.00 44.49 C ATOM 548 CE2 PHE A 76 -16.132 9.879 -1.393 1.00 47.22 C ATOM 549 CZ PHE A 76 -15.713 11.190 -1.453 1.00 50.22 C ATOM 550 H PHE A 76 -13.145 6.634 0.128 1.00 0.00 H ATOM 551 N GLU A 77 -11.735 8.168 3.653 1.00 49.77 N ATOM 552 CA GLU A 77 -11.399 7.630 4.962 1.00 52.36 C ATOM 553 C GLU A 77 -12.415 8.158 5.984 1.00 48.84 C ATOM 554 O GLU A 77 -12.557 9.355 6.146 1.00 51.94 O ATOM 555 CB GLU A 77 -9.990 8.066 5.372 1.00 55.75 C ATOM 556 CG GLU A 77 -9.452 7.274 6.545 1.00 56.77 C ATOM 557 CD GLU A 77 -9.204 5.842 6.146 1.00 57.67 C ATOM 558 OE1 GLU A 77 -8.642 5.640 5.043 1.00 56.15 O ATOM 559 OE2 GLU A 77 -9.641 4.955 6.885 1.00 65.09 O ATOM 560 H GLU A 77 -11.487 9.157 3.448 1.00 0.00 H ATOM 561 N ILE A 78 -13.096 7.254 6.687 1.00 43.31 N ATOM 562 CA ILE A 78 -14.099 7.642 7.629 1.00 45.61 C ATOM 563 C ILE A 78 -13.403 8.013 8.941 1.00 47.66 C ATOM 564 O ILE A 78 -12.753 7.179 9.549 1.00 44.05 O ATOM 565 CB ILE A 78 -15.163 6.541 7.811 1.00 49.89 C ATOM 566 CG1 ILE A 78 -16.241 6.994 8.793 1.00 53.92 C ATOM 567 CG2 ILE A 78 -14.564 5.203 8.219 1.00 55.41 C ATOM 568 CD1 ILE A 78 -17.179 8.034 8.225 1.00 55.54 C ATOM 569 H ILE A 78 -12.893 6.244 6.547 1.00 0.00 H ATOM 570 N ILE A 79 -13.542 9.279 9.357 1.00 44.71 N ATOM 571 CA ILE A 79 -12.968 9.748 10.614 1.00 40.98 C ATOM 572 C ILE A 79 -14.078 9.830 11.662 1.00 39.14 C ATOM 573 O ILE A 79 -13.918 9.376 12.810 1.00 39.16 O ATOM 574 CB ILE A 79 -12.239 11.087 10.405 1.00 40.57 C ATOM 575 CG1 ILE A 79 -11.053 10.915 9.455 1.00 41.12 C ATOM 576 CG2 ILE A 79 -11.801 11.696 11.728 1.00 39.36 C ATOM 577 CD1 ILE A 79 -10.695 12.165 8.726 1.00 43.56 C ATOM 578 H ILE A 79 -14.075 9.948 8.766 1.00 0.00 H ATOM 579 N GLU A 80 -15.212 10.412 11.276 1.00 35.67 N ATOM 580 CA GLU A 80 -16.344 10.458 12.185 1.00 38.60 C ATOM 581 C GLU A 80 -16.747 9.018 12.527 1.00 39.69 C ATOM 582 O GLU A 80 -16.717 8.132 11.653 1.00 40.13 O ATOM 583 CB GLU A 80 -17.530 11.186 11.559 1.00 38.77 C ATOM 584 CG GLU A 80 -18.694 11.384 12.510 1.00 40.59 C ATOM 585 CD GLU A 80 -18.447 12.300 13.698 1.00 43.04 C ATOM 586 OE1 GLU A 80 -18.488 11.782 14.847 1.00 47.74 O ATOM 587 OE2 GLU A 80 -18.286 13.539 13.490 1.00 36.33 O ATOM 588 H GLU A 80 -15.287 10.832 10.327 1.00 0.00 H ATOM 589 N GLY A 81 -17.116 8.798 13.792 1.00 36.99 N ATOM 590 CA GLY A 81 -17.668 7.534 14.245 1.00 37.58 C ATOM 591 C GLY A 81 -16.676 6.733 15.060 1.00 35.43 C ATOM 592 O GLY A 81 -17.066 5.810 15.750 1.00 43.97 O ATOM 593 H GLY A 81 -17.003 9.567 14.483 1.00 0.00 H ATOM 594 N ARG A 82 -15.397 7.084 14.958 1.00 37.82 N ATOM 595 CA ARG A 82 -14.302 6.449 15.690 1.00 39.39 C ATOM 596 C ARG A 82 -14.104 7.136 17.034 1.00 40.41 C ATOM 597 O ARG A 82 -14.359 8.324 17.170 1.00 39.62 O ATOM 598 CB ARG A 82 -12.984 6.594 14.930 1.00 43.35 C ATOM 599 CG ARG A 82 -12.952 5.866 13.599 1.00 47.71 C ATOM 600 CD ARG A 82 -11.749 6.281 12.786 1.00 49.68 C ATOM 601 NE ARG A 82 -11.877 5.760 11.432 1.00 54.34 N ATOM 602 CZ ARG A 82 -11.316 4.649 10.976 1.00 52.20 C ATOM 603 NH1 ARG A 82 -10.701 3.830 11.813 1.00 48.08 N ATOM 604 NH2 ARG A 82 -11.351 4.389 9.677 1.00 49.15 N ATOM 605 HE ARG A 82 -12.459 6.307 10.765 1.00 0.00 H ATOM 606 HH12 ARG A 82 -10.260 2.958 11.457 1.00 0.00 H ATOM 607 HH11 ARG A 82 -10.658 4.058 12.827 1.00 0.00 H ATOM 608 HH22 ARG A 82 -10.914 3.520 9.309 1.00 0.00 H ATOM 609 HH21 ARG A 82 -11.816 5.054 9.026 1.00 0.00 H ATOM 610 H ARG A 82 -15.159 7.864 14.313 1.00 0.00 H ATOM 611 N ASP A 83 -13.558 6.396 18.002 1.00 46.56 N ATOM 612 CA ASP A 83 -13.100 7.008 19.247 1.00 46.04 C ATOM 613 C ASP A 83 -12.001 8.016 18.874 1.00 46.29 C ATOM 614 O ASP A 83 -11.464 8.030 17.740 1.00 48.03 O ATOM 615 CB ASP A 83 -12.641 5.961 20.269 1.00 47.83 C ATOM 616 CG ASP A 83 -11.359 5.266 19.852 1.00 47.51 C ATOM 617 OD1 ASP A 83 -11.432 4.405 18.975 1.00 56.88 O ATOM 618 OD2 ASP A 83 -10.301 5.670 20.325 1.00 50.93 O ATOM 619 H ASP A 83 -13.457 5.370 17.868 1.00 0.00 H ATOM 620 N ARG A 84 -11.680 8.875 19.832 1.00 47.67 N ATOM 621 CA ARG A 84 -10.833 10.022 19.578 1.00 48.57 C ATOM 622 C ARG A 84 -9.403 9.542 19.299 1.00 49.80 C ATOM 623 O ARG A 84 -8.722 10.082 18.399 1.00 47.30 O ATOM 624 CB ARG A 84 -10.978 11.035 20.721 1.00 47.73 C ATOM 625 CG ARG A 84 -11.846 12.222 20.334 1.00 47.77 C ATOM 626 CD ARG A 84 -12.711 12.804 21.434 1.00 51.49 C ATOM 627 NE ARG A 84 -13.159 14.095 20.927 1.00 56.37 N ATOM 628 CZ ARG A 84 -14.226 14.759 21.329 1.00 57.06 C ATOM 629 NH1 ARG A 84 -14.987 14.285 22.299 1.00 66.26 N ATOM 630 NH2 ARG A 84 -14.527 15.907 20.753 1.00 56.96 N ATOM 631 HE ARG A 84 -12.584 14.533 20.179 1.00 0.00 H ATOM 632 HH12 ARG A 84 -15.826 14.816 22.609 1.00 0.00 H ATOM 633 HH11 ARG A 84 -14.747 13.381 22.753 1.00 0.00 H ATOM 634 HH22 ARG A 84 -15.366 16.439 21.061 1.00 0.00 H ATOM 635 HH21 ARG A 84 -13.926 16.280 19.991 1.00 0.00 H ATOM 636 H ARG A 84 -12.047 8.721 20.793 1.00 0.00 H ATOM 637 N ILE A 85 -8.973 8.492 20.005 1.00 46.64 N ATOM 638 CA ILE A 85 -7.622 7.965 19.800 1.00 48.57 C ATOM 639 C ILE A 85 -7.462 7.546 18.337 1.00 46.30 C ATOM 640 O ILE A 85 -6.510 7.988 17.657 1.00 49.98 O ATOM 641 CB ILE A 85 -7.310 6.810 20.763 1.00 47.42 C ATOM 642 CG1 ILE A 85 -7.104 7.323 22.187 1.00 46.65 C ATOM 643 CG2 ILE A 85 -6.107 6.023 20.269 1.00 50.51 C ATOM 644 CD1 ILE A 85 -7.465 6.315 23.238 1.00 49.48 C ATOM 645 H ILE A 85 -9.601 8.047 20.704 1.00 0.00 H ATOM 646 N MET A 86 -8.398 6.720 17.859 1.00 49.06 N ATOM 647 CA MET A 86 -8.347 6.184 16.482 1.00 51.74 C ATOM 648 C MET A 86 -8.513 7.307 15.442 1.00 48.31 C ATOM 649 O MET A 86 -7.817 7.318 14.415 1.00 47.38 O ATOM 650 CB MET A 86 -9.411 5.100 16.259 1.00 55.12 C ATOM 651 CG MET A 86 -8.938 3.701 16.658 1.00 62.96 C ATOM 652 SD MET A 86 -7.369 3.184 15.853 1.00 68.46 S ATOM 653 CE MET A 86 -7.763 3.438 14.123 1.00 69.38 C ATOM 654 H MET A 86 -9.189 6.445 18.476 1.00 0.00 H ATOM 655 N ALA A 87 -9.431 8.248 15.691 1.00 43.99 N ATOM 656 CA ALA A 87 -9.646 9.369 14.745 1.00 45.59 C ATOM 657 C ALA A 87 -8.356 10.200 14.550 1.00 41.58 C ATOM 658 O ALA A 87 -7.989 10.557 13.421 1.00 36.57 O ATOM 659 CB ALA A 87 -10.798 10.212 15.230 1.00 43.91 C ATOM 660 H ALA A 87 -10.001 8.192 16.559 1.00 0.00 H ATOM 661 N TRP A 88 -7.660 10.507 15.649 1.00 39.61 N ATOM 662 CA TRP A 88 -6.410 11.284 15.572 1.00 44.16 C ATOM 663 C TRP A 88 -5.285 10.443 14.959 1.00 42.03 C ATOM 664 O TRP A 88 -4.481 10.984 14.195 1.00 41.82 O ATOM 665 CB TRP A 88 -6.025 11.882 16.936 1.00 43.43 C ATOM 666 CG TRP A 88 -6.833 13.106 17.236 1.00 44.05 C ATOM 667 CD1 TRP A 88 -7.814 13.255 18.177 1.00 42.70 C ATOM 668 CD2 TRP A 88 -6.776 14.347 16.518 1.00 40.14 C ATOM 669 NE1 TRP A 88 -8.341 14.512 18.113 1.00 42.10 N ATOM 670 CE2 TRP A 88 -7.735 15.200 17.094 1.00 39.48 C ATOM 671 CE3 TRP A 88 -5.999 14.819 15.461 1.00 43.83 C ATOM 672 CZ2 TRP A 88 -7.927 16.504 16.654 1.00 36.64 C ATOM 673 CZ3 TRP A 88 -6.200 16.103 15.014 1.00 40.12 C ATOM 674 CH2 TRP A 88 -7.145 16.933 15.611 1.00 39.89 C ATOM 675 HE1 TRP A 88 -9.083 14.888 18.737 1.00 0.00 H ATOM 676 H TRP A 88 -8.007 10.191 16.577 1.00 0.00 H ATOM 677 N THR A 89 -5.269 9.131 15.237 1.00 41.65 N ATOM 678 CA THR A 89 -4.349 8.202 14.560 1.00 41.73 C ATOM 679 C THR A 89 -4.589 8.209 13.050 1.00 40.65 C ATOM 680 O THR A 89 -3.641 8.247 12.254 1.00 41.13 O ATOM 681 CB THR A 89 -4.479 6.770 15.090 1.00 46.15 C ATOM 682 OG1 THR A 89 -4.317 6.865 16.501 1.00 41.79 O ATOM 683 CG2 THR A 89 -3.455 5.812 14.512 1.00 45.22 C ATOM 684 HG1 THR A 89 -5.021 7.453 16.874 1.00 0.00 H ATOM 685 H THR A 89 -5.926 8.759 15.952 1.00 0.00 H ATOM 686 N VAL A 90 -5.860 8.172 12.647 1.00 41.87 N ATOM 687 CA VAL A 90 -6.190 8.209 11.216 1.00 40.86 C ATOM 688 C VAL A 90 -5.746 9.561 10.613 1.00 44.51 C ATOM 689 O VAL A 90 -5.140 9.613 9.521 1.00 47.40 O ATOM 690 CB VAL A 90 -7.682 7.901 10.977 1.00 36.91 C ATOM 691 CG1 VAL A 90 -8.057 8.092 9.519 1.00 41.28 C ATOM 692 CG2 VAL A 90 -8.048 6.493 11.416 1.00 40.32 C ATOM 693 H VAL A 90 -6.623 8.117 13.351 1.00 0.00 H ATOM 694 N VAL A 91 -6.020 10.659 11.327 1.00 44.79 N ATOM 695 CA VAL A 91 -5.682 12.015 10.856 1.00 46.47 C ATOM 696 C VAL A 91 -4.158 12.204 10.783 1.00 46.52 C ATOM 697 O VAL A 91 -3.643 12.540 9.736 1.00 44.60 O ATOM 698 CB VAL A 91 -6.349 13.091 11.735 1.00 45.91 C ATOM 699 CG1 VAL A 91 -5.792 14.478 11.452 1.00 44.14 C ATOM 700 CG2 VAL A 91 -7.872 13.066 11.587 1.00 45.73 C ATOM 701 H VAL A 91 -6.489 10.552 12.249 1.00 0.00 H ATOM 702 N ASN A 92 -3.444 11.996 11.897 1.00 56.22 N ATOM 703 CA ASN A 92 -1.984 12.234 11.956 1.00 59.77 C ATOM 704 C ASN A 92 -1.318 11.403 10.859 1.00 57.51 C ATOM 705 O ASN A 92 -0.361 11.833 10.225 1.00 65.69 O ATOM 706 CB ASN A 92 -1.362 11.882 13.314 1.00 68.81 C ATOM 707 CG ASN A 92 -1.702 12.845 14.443 1.00 77.20 C ATOM 708 OD1 ASN A 92 -2.704 13.563 14.411 1.00 76.00 O ATOM 709 ND2 ASN A 92 -0.871 12.860 15.472 1.00 80.52 N ATOM 710 HD22 ASN A 92 -0.033 12.244 15.473 1.00 0.00 H ATOM 711 HD21 ASN A 92 -1.055 13.488 16.280 1.00 0.00 H ATOM 712 H ASN A 92 -3.932 11.656 12.750 1.00 0.00 H ATOM 713 N SER A 93 -1.873 10.214 10.633 1.00 52.93 N ATOM 714 CA SER A 93 -1.346 9.244 9.705 1.00 51.87 C ATOM 715 C SER A 93 -1.605 9.670 8.248 1.00 50.27 C ATOM 716 O SER A 93 -0.751 9.523 7.371 1.00 53.59 O ATOM 717 CB SER A 93 -1.934 7.907 10.031 1.00 54.19 C ATOM 718 OG SER A 93 -1.354 6.899 9.241 1.00 61.53 O ATOM 719 HG SER A 93 -1.758 6.026 9.474 1.00 0.00 H ATOM 720 H SER A 93 -2.738 9.970 11.157 1.00 0.00 H ATOM 721 N ILE A 94 -2.775 10.240 7.969 1.00 47.73 N ATOM 722 CA ILE A 94 -2.971 10.821 6.647 1.00 45.85 C ATOM 723 C ILE A 94 -1.981 11.980 6.447 1.00 42.90 C ATOM 724 O ILE A 94 -1.359 12.076 5.404 1.00 44.78 O ATOM 725 CB ILE A 94 -4.432 11.255 6.427 1.00 41.82 C ATOM 726 CG1 ILE A 94 -5.342 10.037 6.287 1.00 41.45 C ATOM 727 CG2 ILE A 94 -4.547 12.181 5.226 1.00 40.48 C ATOM 728 CD1 ILE A 94 -6.790 10.329 6.594 1.00 39.39 C ATOM 729 H ILE A 94 -3.534 10.270 8.680 1.00 0.00 H ATOM 730 N CYS A 95 -1.847 12.853 7.450 1.00 46.91 N ATOM 731 CA CYS A 95 -1.022 14.073 7.339 1.00 51.77 C ATOM 732 C CYS A 95 0.446 13.714 7.006 1.00 60.54 C ATOM 733 O CYS A 95 1.050 14.328 6.119 1.00 61.06 O ATOM 734 CB CYS A 95 -1.139 14.908 8.609 1.00 52.22 C ATOM 735 SG CYS A 95 -2.782 15.650 8.834 1.00 53.95 S ATOM 736 H CYS A 95 -2.344 12.666 8.344 1.00 0.00 H ATOM 737 N ASN A 96 1.001 12.685 7.664 1.00 60.60 N ATOM 738 CA ASN A 96 2.412 12.293 7.490 1.00 62.06 C ATOM 739 C ASN A 96 2.675 11.716 6.088 1.00 60.20 C ATOM 740 O ASN A 96 3.762 11.919 5.523 1.00 63.68 O ATOM 741 CB ASN A 96 2.851 11.343 8.600 1.00 63.01 C ATOM 742 CG ASN A 96 2.789 12.016 9.954 1.00 70.69 C ATOM 743 OD1 ASN A 96 3.043 13.214 10.064 1.00 67.07 O ATOM 744 ND2 ASN A 96 2.436 11.266 10.985 1.00 78.01 N ATOM 745 HD22 ASN A 96 2.230 10.256 10.847 1.00 0.00 H ATOM 746 HD21 ASN A 96 2.365 11.686 11.934 1.00 0.00 H ATOM 747 H ASN A 96 0.411 12.140 8.325 1.00 0.00 H ATOM 748 N THR A 97 1.690 11.033 5.504 1.00 60.08 N ATOM 749 CA THR A 97 1.886 10.414 4.197 1.00 59.25 C ATOM 750 C THR A 97 1.472 11.351 3.051 1.00 57.23 C ATOM 751 O THR A 97 1.739 11.038 1.905 1.00 55.81 O ATOM 752 CB THR A 97 1.154 9.072 4.094 1.00 60.01 C ATOM 753 OG1 THR A 97 -0.240 9.338 3.981 1.00 65.90 O ATOM 754 CG2 THR A 97 1.416 8.161 5.272 1.00 62.56 C ATOM 755 HG1 THR A 97 -0.546 9.834 4.781 1.00 0.00 H ATOM 756 H THR A 97 0.773 10.940 5.985 1.00 0.00 H ATOM 757 N THR A 98 0.792 12.469 3.335 1.00 58.18 N ATOM 758 CA THR A 98 0.333 13.363 2.253 1.00 56.53 C ATOM 759 C THR A 98 0.993 14.743 2.360 1.00 54.20 C ATOM 760 O THR A 98 1.258 15.389 1.340 1.00 58.94 O ATOM 761 CB THR A 98 -1.194 13.454 2.228 1.00 55.34 C ATOM 762 OG1 THR A 98 -1.592 13.846 3.540 1.00 52.07 O ATOM 763 CG2 THR A 98 -1.830 12.143 1.819 1.00 56.05 C ATOM 764 HG1 THR A 98 -1.286 13.168 4.193 1.00 0.00 H ATOM 765 H THR A 98 0.585 12.710 4.325 1.00 0.00 H ATOM 766 N GLY A 99 1.269 15.161 3.596 1.00 56.51 N ATOM 767 CA GLY A 99 1.927 16.411 3.913 1.00 60.53 C ATOM 768 C GLY A 99 0.931 17.500 4.273 1.00 68.07 C ATOM 769 O GLY A 99 1.346 18.606 4.632 1.00 69.12 O ATOM 770 H GLY A 99 0.992 14.546 4.388 1.00 0.00 H ATOM 771 N VAL A 100 -0.374 17.175 4.211 1.00 68.45 N ATOM 772 CA VAL A 100 -1.451 18.158 4.372 1.00 60.42 C ATOM 773 C VAL A 100 -1.508 18.573 5.841 1.00 56.11 C ATOM 774 O VAL A 100 -1.330 17.744 6.744 1.00 47.14 O ATOM 775 CB VAL A 100 -2.828 17.656 3.897 1.00 60.48 C ATOM 776 CG1 VAL A 100 -2.751 16.796 2.637 1.00 60.73 C ATOM 777 CG2 VAL A 100 -3.574 16.931 5.002 1.00 61.32 C ATOM 778 H VAL A 100 -0.630 16.181 4.041 1.00 0.00 H ATOM 779 N GLU A 101 -1.777 19.867 6.035 1.00 53.60 N ATOM 780 CA GLU A 101 -1.871 20.521 7.322 1.00 54.08 C ATOM 781 C GLU A 101 -2.791 19.733 8.265 1.00 50.09 C ATOM 782 O GLU A 101 -3.828 19.211 7.858 1.00 49.92 O ATOM 783 CB GLU A 101 -2.413 21.933 7.114 1.00 61.74 C ATOM 784 CG GLU A 101 -1.666 23.006 7.881 1.00 66.12 C ATOM 785 CD GLU A 101 -2.186 24.389 7.536 1.00 72.44 C ATOM 786 OE1 GLU A 101 -3.349 24.695 7.895 1.00 77.45 O ATOM 787 OE2 GLU A 101 -1.459 25.125 6.852 1.00 73.87 O ATOM 788 H GLU A 101 -1.932 20.453 5.190 1.00 0.00 H ATOM 789 N LYS A 102 -2.392 19.681 9.536 1.00 51.06 N ATOM 790 CA LYS A 102 -3.111 18.976 10.588 1.00 54.80 C ATOM 791 C LYS A 102 -4.286 19.846 11.020 1.00 54.53 C ATOM 792 O LYS A 102 -4.084 20.970 11.454 1.00 51.01 O ATOM 793 CB LYS A 102 -2.169 18.718 11.769 1.00 58.15 C ATOM 794 CG LYS A 102 -2.435 17.452 12.573 1.00 66.62 C ATOM 795 CD LYS A 102 -2.036 17.557 14.047 1.00 73.19 C ATOM 796 CE LYS A 102 -1.156 16.422 14.530 1.00 74.90 C ATOM 797 NZ LYS A 102 0.069 16.297 13.702 1.00 73.07 N ATOM 798 HZ1 LYS A 102 -0.199 16.111 12.715 1.00 0.00 H ATOM 799 HZ2 LYS A 102 0.613 17.182 13.754 1.00 0.00 H ATOM 800 HZ3 LYS A 102 0.649 15.511 14.059 1.00 0.00 H ATOM 801 H LYS A 102 -1.513 20.174 9.792 1.00 0.00 H ATOM 802 N PRO A 103 -5.549 19.385 10.936 1.00 54.10 N ATOM 803 CA PRO A 103 -6.672 20.202 11.387 1.00 51.32 C ATOM 804 C PRO A 103 -6.642 20.373 12.911 1.00 48.91 C ATOM 805 O PRO A 103 -6.019 19.561 13.604 1.00 47.50 O ATOM 806 CB PRO A 103 -7.883 19.377 10.943 1.00 54.99 C ATOM 807 CG PRO A 103 -7.384 17.957 11.045 1.00 53.57 C ATOM 808 CD PRO A 103 -5.971 18.047 10.497 1.00 54.33 C ATOM 809 N LYS A 104 -7.320 21.422 13.395 1.00 49.01 N ATOM 810 CA LYS A 104 -7.450 21.745 14.817 1.00 52.94 C ATOM 811 C LYS A 104 -8.515 20.841 15.425 1.00 52.04 C ATOM 812 O LYS A 104 -8.397 20.427 16.565 1.00 53.29 O ATOM 813 CB LYS A 104 -7.847 23.209 15.055 1.00 59.22 C ATOM 814 CG LYS A 104 -6.713 24.141 15.476 1.00 69.07 C ATOM 815 CD LYS A 104 -7.159 25.317 16.350 1.00 78.82 C ATOM 816 CE LYS A 104 -6.027 25.984 17.113 1.00 86.41 C ATOM 817 NZ LYS A 104 -5.338 25.045 18.037 1.00 86.80 N ATOM 818 HZ1 LYS A 104 -6.021 24.678 18.730 1.00 0.00 H ATOM 819 HZ2 LYS A 104 -4.938 24.255 17.492 1.00 0.00 H ATOM 820 HZ3 LYS A 104 -4.575 25.547 18.534 1.00 0.00 H ATOM 821 H LYS A 104 -7.787 22.052 12.712 1.00 0.00 H ATOM 822 N PHE A 105 -9.547 20.575 14.625 1.00 49.45 N ATOM 823 CA PHE A 105 -10.680 19.776 14.984 1.00 49.12 C ATOM 824 C PHE A 105 -10.779 18.540 14.074 1.00 45.07 C ATOM 825 O PHE A 105 -10.512 18.601 12.880 1.00 44.87 O ATOM 826 CB PHE A 105 -11.947 20.627 14.876 1.00 55.85 C ATOM 827 CG PHE A 105 -12.114 21.666 15.957 1.00 60.66 C ATOM 828 CD1 PHE A 105 -11.735 21.408 17.271 1.00 65.22 C ATOM 829 CD2 PHE A 105 -12.700 22.890 15.665 1.00 61.72 C ATOM 830 CE1 PHE A 105 -11.915 22.362 18.263 1.00 71.03 C ATOM 831 CE2 PHE A 105 -12.876 23.843 16.657 1.00 66.25 C ATOM 832 CZ PHE A 105 -12.490 23.577 17.953 1.00 69.65 C ATOM 833 H PHE A 105 -9.528 20.978 13.667 1.00 0.00 H ATOM 834 N LEU A 106 -11.188 17.417 14.667 1.00 39.01 N ATOM 835 CA LEU A 106 -11.499 16.237 13.919 1.00 38.23 C ATOM 836 C LEU A 106 -12.522 16.570 12.842 1.00 37.22 C ATOM 837 O LEU A 106 -13.646 16.942 13.139 1.00 38.40 O ATOM 838 CB LEU A 106 -12.031 15.172 14.873 1.00 35.45 C ATOM 839 CG LEU A 106 -10.946 14.494 15.701 1.00 36.54 C ATOM 840 CD1 LEU A 106 -11.553 13.478 16.638 1.00 37.28 C ATOM 841 CD2 LEU A 106 -9.898 13.837 14.813 1.00 35.61 C ATOM 842 H LEU A 106 -11.284 17.398 15.702 1.00 0.00 H ATOM 843 N PRO A 107 -12.174 16.419 11.552 1.00 35.28 N ATOM 844 CA PRO A 107 -13.167 16.465 10.482 1.00 34.21 C ATOM 845 C PRO A 107 -13.853 15.093 10.378 1.00 30.82 C ATOM 846 O PRO A 107 -13.618 14.254 11.200 1.00 26.69 O ATOM 847 CB PRO A 107 -12.344 16.849 9.236 1.00 35.70 C ATOM 848 CG PRO A 107 -10.894 16.605 9.599 1.00 37.41 C ATOM 849 CD PRO A 107 -10.820 16.168 11.051 1.00 36.52 C ATOM 850 N ASP A 108 -14.687 14.893 9.356 1.00 33.77 N ATOM 851 CA ASP A 108 -15.553 13.703 9.221 1.00 37.73 C ATOM 852 C ASP A 108 -14.976 12.635 8.275 1.00 38.40 C ATOM 853 O ASP A 108 -15.188 11.446 8.500 1.00 36.29 O ATOM 854 CB ASP A 108 -16.916 14.126 8.685 1.00 36.15 C ATOM 855 CG ASP A 108 -17.704 14.872 9.741 1.00 39.29 C ATOM 856 OD1 ASP A 108 -17.743 14.360 10.903 1.00 34.28 O ATOM 857 OD2 ASP A 108 -18.267 15.945 9.398 1.00 31.67 O ATOM 858 H ASP A 108 -14.730 15.617 8.611 1.00 0.00 H ATOM 859 N LEU A 109 -14.351 13.079 7.180 1.00 39.98 N ATOM 860 CA LEU A 109 -13.815 12.215 6.134 1.00 44.42 C ATOM 861 C LEU A 109 -12.459 12.758 5.684 1.00 45.08 C ATOM 862 O LEU A 109 -12.145 13.943 5.886 1.00 48.27 O ATOM 863 CB LEU A 109 -14.746 12.176 4.912 1.00 46.62 C ATOM 864 CG LEU A 109 -16.194 11.722 5.125 1.00 46.72 C ATOM 865 CD1 LEU A 109 -17.013 11.988 3.874 1.00 46.56 C ATOM 866 CD2 LEU A 109 -16.277 10.252 5.496 1.00 45.18 C ATOM 867 H LEU A 109 -14.240 14.107 7.066 1.00 0.00 H ATOM 868 N TYR A 110 -11.691 11.895 5.018 1.00 42.22 N ATOM 869 CA TYR A 110 -10.608 12.354 4.143 1.00 45.83 C ATOM 870 C TYR A 110 -10.897 11.875 2.717 1.00 42.65 C ATOM 871 O TYR A 110 -11.408 10.784 2.522 1.00 44.76 O ATOM 872 CB TYR A 110 -9.238 11.910 4.672 1.00 43.60 C ATOM 873 CG TYR A 110 -8.101 12.445 3.841 1.00 46.56 C ATOM 874 CD1 TYR A 110 -7.684 13.754 3.970 1.00 49.48 C ATOM 875 CD2 TYR A 110 -7.481 11.665 2.875 1.00 46.57 C ATOM 876 CE1 TYR A 110 -6.659 14.270 3.193 1.00 50.96 C ATOM 877 CE2 TYR A 110 -6.455 12.165 2.091 1.00 49.27 C ATOM 878 CZ TYR A 110 -6.030 13.473 2.255 1.00 50.55 C ATOM 879 OH TYR A 110 -5.017 13.989 1.488 1.00 52.96 O ATOM 880 HH TYR A 110 -4.855 14.931 1.748 1.00 0.00 H ATOM 881 H TYR A 110 -11.864 10.875 5.121 1.00 0.00 H ATOM 882 N ASP A 111 -10.582 12.719 1.734 1.00 41.12 N ATOM 883 CA ASP A 111 -10.796 12.424 0.323 1.00 44.17 C ATOM 884 C ASP A 111 -9.420 12.246 -0.338 1.00 48.67 C ATOM 885 O ASP A 111 -8.697 13.232 -0.500 1.00 48.79 O ATOM 886 CB ASP A 111 -11.634 13.540 -0.310 1.00 40.08 C ATOM 887 CG ASP A 111 -12.061 13.301 -1.750 1.00 41.85 C ATOM 888 OD1 ASP A 111 -11.486 12.397 -2.386 1.00 39.32 O ATOM 889 OD2 ASP A 111 -12.960 14.038 -2.239 1.00 39.37 O ATOM 890 H ASP A 111 -10.162 13.636 1.988 1.00 0.00 H ATOM 891 N TYR A 112 -9.061 10.997 -0.686 1.00 52.41 N ATOM 892 CA TYR A 112 -7.718 10.644 -1.253 1.00 53.77 C ATOM 893 C TYR A 112 -7.579 11.019 -2.739 1.00 52.61 C ATOM 894 O TYR A 112 -6.463 11.089 -3.261 1.00 68.23 O ATOM 895 CB TYR A 112 -7.450 9.142 -1.193 1.00 52.12 C ATOM 896 CG TYR A 112 -7.270 8.565 0.180 1.00 44.35 C ATOM 897 CD1 TYR A 112 -6.103 8.778 0.891 1.00 42.04 C ATOM 898 CD2 TYR A 112 -8.236 7.747 0.728 1.00 41.85 C ATOM 899 CE1 TYR A 112 -5.929 8.247 2.151 1.00 39.20 C ATOM 900 CE2 TYR A 112 -8.079 7.206 1.990 1.00 40.88 C ATOM 901 CZ TYR A 112 -6.926 7.461 2.700 1.00 42.04 C ATOM 902 OH TYR A 112 -6.774 6.900 3.931 1.00 46.11 O ATOM 903 HH TYR A 112 -7.505 7.205 4.524 1.00 0.00 H ATOM 904 H TYR A 112 -9.754 10.233 -0.554 1.00 0.00 H ATOM 905 N LYS A 113 -8.705 11.218 -3.419 1.00 50.59 N ATOM 906 CA LYS A 113 -8.743 11.712 -4.793 1.00 51.75 C ATOM 907 C LYS A 113 -8.382 13.206 -4.849 1.00 52.55 C ATOM 908 O LYS A 113 -7.462 13.592 -5.551 1.00 59.15 O ATOM 909 CB LYS A 113 -10.136 11.455 -5.365 1.00 53.58 C ATOM 910 CG LYS A 113 -10.400 12.083 -6.722 1.00 58.51 C ATOM 911 CD LYS A 113 -11.500 11.372 -7.464 1.00 62.99 C ATOM 912 CE LYS A 113 -12.146 12.238 -8.518 1.00 70.58 C ATOM 913 NZ LYS A 113 -12.818 11.394 -9.530 1.00 76.95 N ATOM 914 HZ1 LYS A 113 -12.117 10.772 -9.982 1.00 0.00 H ATOM 915 HZ2 LYS A 113 -13.549 10.816 -9.068 1.00 0.00 H ATOM 916 HZ3 LYS A 113 -13.259 12.002 -10.250 1.00 0.00 H ATOM 917 H LYS A 113 -9.608 11.010 -2.946 1.00 0.00 H ATOM 918 N GLU A 114 -9.107 14.032 -4.085 1.00 55.03 N ATOM 919 CA GLU A 114 -8.944 15.505 -4.040 1.00 51.44 C ATOM 920 C GLU A 114 -7.934 15.947 -2.961 1.00 51.23 C ATOM 921 O GLU A 114 -7.613 17.138 -2.878 1.00 53.92 O ATOM 922 CB GLU A 114 -10.298 16.147 -3.745 1.00 50.08 C ATOM 923 CG GLU A 114 -11.390 15.681 -4.678 1.00 51.17 C ATOM 924 CD GLU A 114 -11.171 16.095 -6.115 1.00 58.52 C ATOM 925 OE1 GLU A 114 -10.582 17.171 -6.318 1.00 61.36 O ATOM 926 OE2 GLU A 114 -11.571 15.334 -7.030 1.00 69.86 O ATOM 927 H GLU A 114 -9.838 13.609 -3.478 1.00 0.00 H ATOM 928 N ASN A 115 -7.498 15.002 -2.112 1.00 47.84 N ATOM 929 CA ASN A 115 -6.442 15.166 -1.087 1.00 51.78 C ATOM 930 C ASN A 115 -6.796 16.308 -0.135 1.00 51.23 C ATOM 931 O ASN A 115 -6.014 17.250 0.027 1.00 48.74 O ATOM 932 CB ASN A 115 -5.057 15.337 -1.713 1.00 52.91 C ATOM 933 CG ASN A 115 -4.748 14.195 -2.654 1.00 55.88 C ATOM 934 OD1 ASN A 115 -4.351 13.113 -2.217 1.00 57.92 O ATOM 935 ND2 ASN A 115 -4.989 14.409 -3.937 1.00 55.51 N ATOM 936 HD22 ASN A 115 -5.323 15.341 -4.255 1.00 0.00 H ATOM 937 HD21 ASN A 115 -4.844 13.645 -4.628 1.00 0.00 H ATOM 938 H ASN A 115 -7.945 14.065 -2.181 1.00 0.00 H ATOM 939 N ARG A 116 -7.973 16.192 0.496 1.00 47.82 N ATOM 940 CA ARG A 116 -8.463 17.178 1.446 1.00 43.25 C ATOM 941 C ARG A 116 -9.388 16.507 2.455 1.00 43.38 C ATOM 942 O ARG A 116 -10.122 15.594 2.102 1.00 45.52 O ATOM 943 CB ARG A 116 -9.247 18.274 0.732 1.00 43.55 C ATOM 944 CG ARG A 116 -10.464 17.785 -0.044 1.00 46.81 C ATOM 945 CD ARG A 116 -10.853 18.817 -1.082 1.00 45.39 C ATOM 946 NE ARG A 116 -12.124 18.510 -1.706 1.00 47.64 N ATOM 947 CZ ARG A 116 -12.478 18.922 -2.915 1.00 48.55 C ATOM 948 NH1 ARG A 116 -11.601 19.549 -3.677 1.00 52.99 N ATOM 949 NH2 ARG A 116 -13.698 18.710 -3.366 1.00 44.75 N ATOM 950 HE ARG A 116 -12.801 17.930 -1.171 1.00 0.00 H ATOM 951 HH12 ARG A 116 -11.875 19.874 -4.626 1.00 0.00 H ATOM 952 HH11 ARG A 116 -10.636 19.718 -3.328 1.00 0.00 H ATOM 953 HH22 ARG A 116 -13.965 19.037 -4.316 1.00 0.00 H ATOM 954 HH21 ARG A 116 -14.393 18.215 -2.772 1.00 0.00 H ATOM 955 H ARG A 116 -8.563 15.359 0.297 1.00 0.00 H ATOM 956 N PHE A 117 -9.370 16.999 3.695 1.00 40.42 N ATOM 957 CA PHE A 117 -10.396 16.633 4.647 1.00 41.47 C ATOM 958 C PHE A 117 -11.739 17.197 4.181 1.00 41.31 C ATOM 959 O PHE A 117 -11.784 18.139 3.378 1.00 44.27 O ATOM 960 CB PHE A 117 -10.002 17.066 6.054 1.00 39.40 C ATOM 961 CG PHE A 117 -8.776 16.345 6.534 1.00 38.06 C ATOM 962 CD1 PHE A 117 -8.866 15.060 7.043 1.00 37.41 C ATOM 963 CD2 PHE A 117 -7.527 16.915 6.395 1.00 37.16 C ATOM 964 CE1 PHE A 117 -7.733 14.395 7.479 1.00 40.67 C ATOM 965 CE2 PHE A 117 -6.396 16.246 6.825 1.00 37.64 C ATOM 966 CZ PHE A 117 -6.499 14.988 7.369 1.00 39.72 C ATOM 967 H PHE A 117 -8.612 17.651 3.980 1.00 0.00 H ATOM 968 N ILE A 118 -12.815 16.536 4.636 1.00 40.45 N ATOM 969 CA ILE A 118 -14.183 17.009 4.493 1.00 38.63 C ATOM 970 C ILE A 118 -14.805 17.117 5.880 1.00 34.63 C ATOM 971 O ILE A 118 -14.715 16.185 6.676 1.00 31.65 O ATOM 972 CB ILE A 118 -15.048 16.101 3.587 1.00 39.39 C ATOM 973 CG1 ILE A 118 -14.413 15.903 2.207 1.00 39.33 C ATOM 974 CG2 ILE A 118 -16.470 16.647 3.487 1.00 37.96 C ATOM 975 CD1 ILE A 118 -14.918 14.682 1.471 1.00 39.56 C ATOM 976 H ILE A 118 -12.661 15.629 5.121 1.00 0.00 H ATOM 977 N GLU A 119 -15.450 18.266 6.107 1.00 34.59 N ATOM 978 CA GLU A 119 -16.373 18.484 7.191 1.00 33.60 C ATOM 979 C GLU A 119 -17.801 18.440 6.633 1.00 32.57 C ATOM 980 O GLU A 119 -18.136 19.191 5.710 1.00 32.74 O ATOM 981 CB GLU A 119 -16.143 19.848 7.849 1.00 34.41 C ATOM 982 CG GLU A 119 -17.207 20.181 8.882 1.00 32.40 C ATOM 983 CD GLU A 119 -17.382 19.088 9.919 1.00 31.84 C ATOM 984 OE1 GLU A 119 -16.374 18.470 10.260 1.00 33.14 O ATOM 985 OE2 GLU A 119 -18.520 18.847 10.354 1.00 31.70 O ATOM 986 H GLU A 119 -15.273 19.057 5.456 1.00 0.00 H ATOM 987 N ILE A 120 -18.620 17.571 7.224 1.00 30.46 N ATOM 988 CA ILE A 120 -19.953 17.320 6.786 1.00 32.97 C ATOM 989 C ILE A 120 -20.918 18.002 7.754 1.00 33.36 C ATOM 990 O ILE A 120 -20.931 17.664 8.962 1.00 33.24 O ATOM 991 CB ILE A 120 -20.266 15.815 6.749 1.00 34.58 C ATOM 992 CG1 ILE A 120 -19.377 15.039 5.775 1.00 35.68 C ATOM 993 CG2 ILE A 120 -21.749 15.620 6.475 1.00 35.38 C ATOM 994 CD1 ILE A 120 -19.965 14.854 4.425 1.00 39.51 C ATOM 995 H ILE A 120 -18.267 17.047 8.050 1.00 0.00 H ATOM 996 N GLY A 121 -21.762 18.887 7.218 1.00 29.55 N ATOM 997 CA GLY A 121 -22.770 19.532 8.032 1.00 31.29 C ATOM 998 C GLY A 121 -24.153 19.076 7.635 1.00 31.32 C ATOM 999 O GLY A 121 -24.449 18.989 6.443 1.00 32.37 O ATOM 1000 H GLY A 121 -21.694 19.115 6.206 1.00 0.00 H ATOM 1001 N VAL A 122 -24.983 18.767 8.635 1.00 30.07 N ATOM 1002 CA VAL A 122 -26.392 18.494 8.400 1.00 31.48 C ATOM 1003 C VAL A 122 -27.193 19.455 9.281 1.00 31.60 C ATOM 1004 O VAL A 122 -26.957 19.486 10.483 1.00 28.23 O ATOM 1005 CB VAL A 122 -26.777 17.030 8.690 1.00 29.91 C ATOM 1006 CG1 VAL A 122 -28.284 16.805 8.549 1.00 28.99 C ATOM 1007 CG2 VAL A 122 -26.002 16.065 7.810 1.00 29.47 C ATOM 1008 H VAL A 122 -24.612 18.721 9.606 1.00 0.00 H ATOM 1009 N THR A 123 -28.125 20.198 8.666 1.00 31.91 N ATOM 1010 CA THR A 123 -28.797 21.328 9.316 1.00 34.32 C ATOM 1011 C THR A 123 -30.311 21.339 9.056 1.00 32.02 C ATOM 1012 O THR A 123 -30.769 21.076 7.957 1.00 27.00 O ATOM 1013 CB THR A 123 -28.214 22.668 8.838 1.00 37.25 C ATOM 1014 OG1 THR A 123 -28.756 23.726 9.641 1.00 36.79 O ATOM 1015 CG2 THR A 123 -28.475 22.926 7.367 1.00 38.79 C ATOM 1016 HG1 THR A 123 -28.515 23.576 10.589 1.00 0.00 H ATOM 1017 H THR A 123 -28.382 19.963 7.686 1.00 0.00 H ATOM 1018 N ARG A 124 -31.058 21.746 10.088 1.00 34.16 N ATOM 1019 CA ARG A 124 -32.466 22.077 9.995 1.00 36.57 C ATOM 1020 C ARG A 124 -32.644 23.522 9.507 1.00 35.55 C ATOM 1021 O ARG A 124 -33.715 23.901 9.116 1.00 40.56 O ATOM 1022 CB ARG A 124 -33.164 21.834 11.338 1.00 36.59 C ATOM 1023 CG ARG A 124 -33.271 20.357 11.687 1.00 41.73 C ATOM 1024 CD ARG A 124 -32.087 19.828 12.482 1.00 42.49 C ATOM 1025 NE ARG A 124 -32.274 20.100 13.882 1.00 38.86 N ATOM 1026 CZ ARG A 124 -31.485 19.689 14.862 1.00 41.03 C ATOM 1027 NH1 ARG A 124 -30.196 19.476 14.656 1.00 37.13 N ATOM 1028 NH2 ARG A 124 -32.008 19.526 16.066 1.00 44.01 N ATOM 1029 HE ARG A 124 -33.102 20.670 14.148 1.00 0.00 H ATOM 1030 HH12 ARG A 124 -29.591 19.153 15.438 1.00 0.00 H ATOM 1031 HH11 ARG A 124 -29.788 19.631 13.712 1.00 0.00 H ATOM 1032 HH22 ARG A 124 -31.410 19.204 16.854 1.00 0.00 H ATOM 1033 HH21 ARG A 124 -33.017 19.720 16.225 1.00 0.00 H ATOM 1034 H ARG A 124 -30.599 21.830 11.017 1.00 0.00 H ATOM 1035 N ARG A 125 -31.592 24.338 9.541 1.00 40.32 N ATOM 1036 CA ARG A 125 -31.682 25.729 9.061 1.00 38.00 C ATOM 1037 C ARG A 125 -31.276 25.810 7.584 1.00 41.57 C ATOM 1038 O ARG A 125 -31.110 24.788 6.900 1.00 42.37 O ATOM 1039 CB ARG A 125 -30.777 26.608 9.917 1.00 39.12 C ATOM 1040 CG ARG A 125 -31.169 26.646 11.384 1.00 38.16 C ATOM 1041 CD ARG A 125 -30.092 27.346 12.183 1.00 37.81 C ATOM 1042 NE ARG A 125 -28.985 26.475 12.521 1.00 38.41 N ATOM 1043 CZ ARG A 125 -27.764 26.913 12.805 1.00 39.24 C ATOM 1044 NH1 ARG A 125 -27.507 28.210 12.742 1.00 35.56 N ATOM 1045 NH2 ARG A 125 -26.811 26.057 13.139 1.00 33.81 N ATOM 1046 HE ARG A 125 -29.156 25.449 12.542 1.00 0.00 H ATOM 1047 HH12 ARG A 125 -26.554 28.563 12.963 1.00 0.00 H ATOM 1048 HH11 ARG A 125 -28.258 28.876 12.472 1.00 0.00 H ATOM 1049 HH22 ARG A 125 -25.856 26.403 13.361 1.00 0.00 H ATOM 1050 HH21 ARG A 125 -27.018 25.039 13.179 1.00 0.00 H ATOM 1051 H ARG A 125 -30.687 23.986 9.914 1.00 0.00 H ATOM 1052 N GLU A 126 -31.132 27.039 7.097 1.00 44.06 N ATOM 1053 CA GLU A 126 -30.606 27.303 5.772 1.00 47.40 C ATOM 1054 C GLU A 126 -29.160 26.845 5.665 1.00 43.14 C ATOM 1055 O GLU A 126 -28.354 27.019 6.571 1.00 41.15 O ATOM 1056 CB GLU A 126 -30.606 28.785 5.405 1.00 54.04 C ATOM 1057 CG GLU A 126 -31.571 29.117 4.283 1.00 63.18 C ATOM 1058 CD GLU A 126 -32.965 29.463 4.759 1.00 62.94 C ATOM 1059 OE1 GLU A 126 -33.076 30.117 5.817 1.00 65.84 O ATOM 1060 OE2 GLU A 126 -33.920 29.101 4.060 1.00 65.00 O ATOM 1061 H GLU A 126 -31.409 27.846 7.692 1.00 0.00 H ATOM 1062 N VAL A 127 -28.842 26.345 4.475 1.00 42.18 N ATOM 1063 CA VAL A 127 -27.553 25.761 4.202 1.00 43.28 C ATOM 1064 C VAL A 127 -26.454 26.839 4.234 1.00 42.05 C ATOM 1065 O VAL A 127 -25.353 26.559 4.746 1.00 41.97 O ATOM 1066 CB VAL A 127 -27.583 24.930 2.896 1.00 41.66 C ATOM 1067 CG1 VAL A 127 -28.508 23.728 3.058 1.00 38.95 C ATOM 1068 CG2 VAL A 127 -27.975 25.734 1.658 1.00 38.61 C ATOM 1069 H VAL A 127 -29.549 26.376 3.713 1.00 0.00 H ATOM 1070 N HIS A 128 -26.742 28.047 3.724 1.00 41.14 N ATOM 1071 CA HIS A 128 -25.741 29.152 3.681 1.00 42.94 C ATOM 1072 C HIS A 128 -25.381 29.558 5.119 1.00 42.40 C ATOM 1073 O HIS A 128 -24.202 29.789 5.448 1.00 36.46 O ATOM 1074 CB HIS A 128 -26.221 30.323 2.790 1.00 44.83 C ATOM 1075 CG HIS A 128 -27.238 31.220 3.414 1.00 52.92 C ATOM 1076 ND1 HIS A 128 -28.608 30.994 3.288 1.00 55.11 N ATOM 1077 CD2 HIS A 128 -27.103 32.327 4.183 1.00 52.74 C ATOM 1078 CE1 HIS A 128 -29.271 31.924 3.944 1.00 50.75 C ATOM 1079 NE2 HIS A 128 -28.370 32.753 4.507 1.00 58.83 N ATOM 1080 H HIS A 128 -27.696 28.218 3.346 1.00 0.00 H ATOM 1081 N ILE A 129 -26.411 29.578 5.974 1.00 41.32 N ATOM 1082 CA ILE A 129 -26.298 29.910 7.397 1.00 42.72 C ATOM 1083 C ILE A 129 -25.367 28.918 8.108 1.00 42.19 C ATOM 1084 O ILE A 129 -24.426 29.324 8.802 1.00 44.55 O ATOM 1085 CB ILE A 129 -27.703 29.952 8.028 1.00 42.78 C ATOM 1086 CG1 ILE A 129 -28.404 31.278 7.707 1.00 49.85 C ATOM 1087 CG2 ILE A 129 -27.656 29.673 9.521 1.00 42.70 C ATOM 1088 CD1 ILE A 129 -29.848 31.348 8.169 1.00 51.96 C ATOM 1089 H ILE A 129 -27.354 29.342 5.604 1.00 0.00 H ATOM 1090 N TYR A 130 -25.644 27.621 7.954 1.00 40.11 N ATOM 1091 CA TYR A 130 -24.834 26.604 8.610 1.00 39.19 C ATOM 1092 C TYR A 130 -23.464 26.511 7.925 1.00 37.91 C ATOM 1093 O TYR A 130 -22.492 26.270 8.589 1.00 40.18 O ATOM 1094 CB TYR A 130 -25.565 25.259 8.676 1.00 38.65 C ATOM 1095 CG TYR A 130 -24.955 24.268 9.636 1.00 39.22 C ATOM 1096 CD1 TYR A 130 -24.664 24.604 10.952 1.00 38.40 C ATOM 1097 CD2 TYR A 130 -24.677 22.972 9.229 1.00 43.40 C ATOM 1098 CE1 TYR A 130 -24.080 23.693 11.825 1.00 40.43 C ATOM 1099 CE2 TYR A 130 -24.132 22.038 10.101 1.00 42.34 C ATOM 1100 CZ TYR A 130 -23.830 22.396 11.402 1.00 39.28 C ATOM 1101 OH TYR A 130 -23.311 21.450 12.234 1.00 36.32 O ATOM 1102 HH TYR A 130 -23.952 20.701 12.320 1.00 0.00 H ATOM 1103 H TYR A 130 -26.447 27.334 7.359 1.00 0.00 H ATOM 1104 N TYR A 131 -23.393 26.751 6.611 1.00 38.57 N ATOM 1105 CA TYR A 131 -22.123 26.829 5.939 1.00 41.61 C ATOM 1106 C TYR A 131 -21.235 27.871 6.623 1.00 44.81 C ATOM 1107 O TYR A 131 -20.044 27.648 6.837 1.00 46.98 O ATOM 1108 CB TYR A 131 -22.255 27.182 4.456 1.00 43.09 C ATOM 1109 CG TYR A 131 -20.924 27.148 3.749 1.00 45.71 C ATOM 1110 CD1 TYR A 131 -20.063 28.237 3.783 1.00 48.52 C ATOM 1111 CD2 TYR A 131 -20.479 25.994 3.124 1.00 45.94 C ATOM 1112 CE1 TYR A 131 -18.822 28.199 3.165 1.00 48.21 C ATOM 1113 CE2 TYR A 131 -19.239 25.935 2.509 1.00 44.84 C ATOM 1114 CZ TYR A 131 -18.408 27.042 2.527 1.00 50.11 C ATOM 1115 OH TYR A 131 -17.193 26.994 1.905 1.00 58.90 O ATOM 1116 HH TYR A 131 -16.645 26.276 2.309 1.00 0.00 H ATOM 1117 H TYR A 131 -24.269 26.883 6.067 1.00 0.00 H ATOM 1118 N LEU A 132 -21.814 29.033 6.914 1.00 45.56 N ATOM 1119 CA LEU A 132 -21.050 30.129 7.479 1.00 47.45 C ATOM 1120 C LEU A 132 -20.552 29.737 8.867 1.00 41.15 C ATOM 1121 O LEU A 132 -19.419 29.999 9.173 1.00 44.82 O ATOM 1122 CB LEU A 132 -21.906 31.402 7.520 1.00 49.09 C ATOM 1123 CG LEU A 132 -22.036 32.109 6.176 1.00 49.67 C ATOM 1124 CD1 LEU A 132 -23.161 33.129 6.207 1.00 54.02 C ATOM 1125 CD2 LEU A 132 -20.714 32.748 5.783 1.00 51.95 C ATOM 1126 H LEU A 132 -22.831 29.158 6.733 1.00 0.00 H ATOM 1127 N GLU A 133 -21.406 29.098 9.669 1.00 39.38 N ATOM 1128 CA GLU A 133 -21.015 28.664 10.991 1.00 42.49 C ATOM 1129 C GLU A 133 -19.818 27.726 10.917 1.00 40.99 C ATOM 1130 O GLU A 133 -18.872 27.872 11.675 1.00 43.21 O ATOM 1131 CB GLU A 133 -22.144 27.952 11.718 1.00 46.50 C ATOM 1132 CG GLU A 133 -22.909 28.871 12.632 1.00 50.34 C ATOM 1133 CD GLU A 133 -23.983 28.172 13.444 1.00 56.30 C ATOM 1134 OE1 GLU A 133 -23.681 27.105 14.017 1.00 58.26 O ATOM 1135 OE2 GLU A 133 -25.111 28.710 13.512 1.00 55.92 O ATOM 1136 H GLU A 133 -22.373 28.908 9.336 1.00 0.00 H ATOM 1137 N LYS A 134 -19.868 26.774 9.986 1.00 41.85 N ATOM 1138 CA LYS A 134 -18.778 25.832 9.809 1.00 42.10 C ATOM 1139 C LYS A 134 -17.515 26.586 9.389 1.00 41.55 C ATOM 1140 O LYS A 134 -16.463 26.358 9.964 1.00 41.62 O ATOM 1141 CB LYS A 134 -19.137 24.744 8.789 1.00 41.58 C ATOM 1142 CG LYS A 134 -20.111 23.692 9.310 1.00 42.16 C ATOM 1143 CD LYS A 134 -19.624 23.000 10.532 1.00 39.55 C ATOM 1144 CE LYS A 134 -20.413 21.770 10.889 1.00 39.15 C ATOM 1145 NZ LYS A 134 -19.681 20.993 11.915 1.00 40.20 N ATOM 1146 HZ1 LYS A 134 -18.753 20.713 11.539 1.00 0.00 H ATOM 1147 HZ2 LYS A 134 -19.550 21.579 12.764 1.00 0.00 H ATOM 1148 HZ3 LYS A 134 -20.228 20.143 12.160 1.00 0.00 H ATOM 1149 H LYS A 134 -20.706 26.704 9.373 1.00 0.00 H ATOM 1150 N ALA A 135 -17.638 27.460 8.382 1.00 42.95 N ATOM 1151 CA ALA A 135 -16.469 28.092 7.746 1.00 49.51 C ATOM 1152 C ALA A 135 -15.751 28.977 8.762 1.00 48.29 C ATOM 1153 O ALA A 135 -14.544 29.083 8.726 1.00 58.64 O ATOM 1154 CB ALA A 135 -16.879 28.872 6.516 1.00 50.77 C ATOM 1155 H ALA A 135 -18.589 27.700 8.038 1.00 0.00 H ATOM 1156 N ASN A 136 -16.537 29.560 9.674 1.00 52.66 N ATOM 1157 CA ASN A 136 -16.080 30.415 10.761 1.00 49.73 C ATOM 1158 C ASN A 136 -15.451 29.572 11.872 1.00 46.96 C ATOM 1159 O ASN A 136 -14.429 29.961 12.403 1.00 51.13 O ATOM 1160 CB ASN A 136 -17.215 31.276 11.324 1.00 51.50 C ATOM 1161 CG ASN A 136 -16.731 32.281 12.345 1.00 53.88 C ATOM 1162 OD1 ASN A 136 -15.911 33.141 12.036 1.00 51.40 O ATOM 1163 ND2 ASN A 136 -17.238 32.187 13.559 1.00 54.12 N ATOM 1164 HD22 ASN A 136 -17.931 31.442 13.777 1.00 0.00 H ATOM 1165 HD21 ASN A 136 -16.945 32.858 14.298 1.00 0.00 H ATOM 1166 H ASN A 136 -17.560 29.388 9.601 1.00 0.00 H ATOM 1167 N LYS A 137 -16.061 28.433 12.223 1.00 47.12 N ATOM 1168 CA LYS A 137 -15.552 27.563 13.300 1.00 51.41 C ATOM 1169 C LYS A 137 -14.155 27.029 12.964 1.00 49.13 C ATOM 1170 O LYS A 137 -13.331 26.943 13.854 1.00 54.56 O ATOM 1171 CB LYS A 137 -16.498 26.392 13.579 1.00 56.74 C ATOM 1172 CG LYS A 137 -16.109 25.509 14.757 1.00 61.89 C ATOM 1173 CD LYS A 137 -17.203 24.502 15.121 1.00 75.06 C ATOM 1174 CE LYS A 137 -16.768 23.435 16.109 1.00 78.61 C ATOM 1175 NZ LYS A 137 -16.528 23.999 17.459 1.00 81.60 N ATOM 1176 HZ1 LYS A 137 -15.779 24.719 17.405 1.00 0.00 H ATOM 1177 HZ2 LYS A 137 -17.404 24.434 17.812 1.00 0.00 H ATOM 1178 HZ3 LYS A 137 -16.233 23.238 18.104 1.00 0.00 H ATOM 1179 H LYS A 137 -16.925 28.151 11.718 1.00 0.00 H ATOM 1180 N ILE A 138 -13.900 26.720 11.685 1.00 53.44 N ATOM 1181 CA ILE A 138 -12.635 26.105 11.210 1.00 57.11 C ATOM 1182 C ILE A 138 -11.926 27.056 10.226 1.00 60.12 C ATOM 1183 O ILE A 138 -11.153 26.630 9.363 1.00 58.84 O ATOM 1184 CB ILE A 138 -12.921 24.700 10.624 1.00 57.02 C ATOM 1185 CG1 ILE A 138 -13.587 24.748 9.243 1.00 52.49 C ATOM 1186 CG2 ILE A 138 -13.736 23.879 11.623 1.00 54.09 C ATOM 1187 CD1 ILE A 138 -14.300 23.462 8.848 1.00 53.28 C ATOM 1188 H ILE A 138 -14.636 26.924 10.979 1.00 0.00 H ATOM 1189 N LYS A 139 -12.161 28.358 10.432 1.00 69.92 N ATOM 1190 CA LYS A 139 -11.609 29.531 9.700 1.00 69.95 C ATOM 1191 C LYS A 139 -10.201 29.300 9.136 1.00 68.71 C ATOM 1192 O LYS A 139 -9.943 29.648 7.985 1.00 78.26 O ATOM 1193 CB LYS A 139 -11.549 30.732 10.652 1.00 76.08 C ATOM 1194 CG LYS A 139 -12.202 32.015 10.153 1.00 76.36 C ATOM 1195 CD LYS A 139 -12.219 33.127 11.187 1.00 75.22 C ATOM 1196 CE LYS A 139 -13.126 32.854 12.373 1.00 76.85 C ATOM 1197 NZ LYS A 139 -12.449 32.143 13.484 1.00 74.95 N ATOM 1198 HZ1 LYS A 139 -12.096 31.226 13.143 1.00 0.00 H ATOM 1199 HZ2 LYS A 139 -11.652 32.717 13.826 1.00 0.00 H ATOM 1200 HZ3 LYS A 139 -13.125 31.990 14.259 1.00 0.00 H ATOM 1201 H LYS A 139 -12.817 28.580 11.208 1.00 0.00 H ATOM 1202 N SER A 140 -9.286 28.754 9.946 1.00 76.25 N ATOM 1203 CA SER A 140 -7.848 28.683 9.588 1.00 77.15 C ATOM 1204 C SER A 140 -7.448 27.309 9.006 1.00 78.04 C ATOM 1205 O SER A 140 -6.251 27.055 8.813 1.00 90.47 O ATOM 1206 CB SER A 140 -6.990 29.056 10.776 1.00 76.78 C ATOM 1207 OG SER A 140 -7.337 28.285 11.919 1.00 79.65 O ATOM 1208 HG SER A 140 -6.762 28.548 12.680 1.00 0.00 H ATOM 1209 H SER A 140 -9.594 28.365 10.860 1.00 0.00 H ATOM 1210 N GLU A 141 -8.426 26.446 8.685 1.00 69.26 N ATOM 1211 CA GLU A 141 -8.167 25.132 8.060 1.00 69.13 C ATOM 1212 C GLU A 141 -8.416 25.226 6.547 1.00 66.23 C ATOM 1213 O GLU A 141 -9.065 26.143 6.074 1.00 66.64 O ATOM 1214 CB GLU A 141 -9.061 24.041 8.664 1.00 67.00 C ATOM 1215 CG GLU A 141 -8.745 23.688 10.118 1.00 62.96 C ATOM 1216 CD GLU A 141 -9.661 22.624 10.708 1.00 63.79 C ATOM 1217 OE1 GLU A 141 -10.298 21.894 9.917 1.00 59.63 O ATOM 1218 OE2 GLU A 141 -9.759 22.532 11.956 1.00 65.51 O ATOM 1219 H GLU A 141 -9.410 26.715 8.885 1.00 0.00 H ATOM 1220 N LYS A 142 -7.903 24.243 5.804 1.00 67.96 N ATOM 1221 CA LYS A 142 -8.149 24.107 4.367 1.00 64.46 C ATOM 1222 C LYS A 142 -9.019 22.866 4.146 1.00 55.35 C ATOM 1223 O LYS A 142 -8.812 22.115 3.208 1.00 57.74 O ATOM 1224 CB LYS A 142 -6.817 24.044 3.614 1.00 73.25 C ATOM 1225 CG LYS A 142 -5.857 25.193 3.917 1.00 79.29 C ATOM 1226 CD LYS A 142 -4.819 24.886 4.993 1.00 82.15 C ATOM 1227 CE LYS A 142 -3.710 23.972 4.510 1.00 81.18 C ATOM 1228 NZ LYS A 142 -3.122 24.436 3.231 1.00 80.88 N ATOM 1229 HZ1 LYS A 142 -3.862 24.463 2.500 1.00 0.00 H ATOM 1230 HZ2 LYS A 142 -2.725 25.389 3.359 1.00 0.00 H ATOM 1231 HZ3 LYS A 142 -2.369 23.781 2.939 1.00 0.00 H ATOM 1232 H LYS A 142 -7.297 23.537 6.270 1.00 0.00 H ATOM 1233 N THR A 143 -10.001 22.694 5.038 1.00 49.28 N ATOM 1234 CA THR A 143 -10.963 21.623 5.031 1.00 46.03 C ATOM 1235 C THR A 143 -12.149 21.984 4.131 1.00 46.88 C ATOM 1236 O THR A 143 -12.703 23.059 4.221 1.00 42.18 O ATOM 1237 CB THR A 143 -11.473 21.336 6.444 1.00 47.20 C ATOM 1238 OG1 THR A 143 -10.330 21.137 7.272 1.00 42.87 O ATOM 1239 CG2 THR A 143 -12.392 20.133 6.512 1.00 47.31 C ATOM 1240 HG1 THR A 143 -10.624 20.948 8.198 1.00 0.00 H ATOM 1241 H THR A 143 -10.076 23.395 5.803 1.00 0.00 H ATOM 1242 N HIS A 144 -12.533 21.043 3.261 1.00 45.40 N ATOM 1243 CA HIS A 144 -13.625 21.224 2.374 1.00 38.87 C ATOM 1244 C HIS A 144 -14.907 21.043 3.172 1.00 40.12 C ATOM 1245 O HIS A 144 -14.993 20.133 3.993 1.00 43.42 O ATOM 1246 CB HIS A 144 -13.522 20.237 1.220 1.00 41.76 C ATOM 1247 CG HIS A 144 -14.273 20.674 0.022 1.00 39.48 C ATOM 1248 ND1 HIS A 144 -13.715 21.521 -0.917 1.00 45.26 N ATOM 1249 CD2 HIS A 144 -15.528 20.401 -0.388 1.00 39.38 C ATOM 1250 CE1 HIS A 144 -14.608 21.764 -1.858 1.00 47.25 C ATOM 1251 NE2 HIS A 144 -15.736 21.088 -1.552 1.00 42.87 N ATOM 1252 H HIS A 144 -12.011 20.144 3.234 1.00 0.00 H ATOM 1253 N ILE A 145 -15.894 21.905 2.913 1.00 41.37 N ATOM 1254 CA ILE A 145 -17.130 21.897 3.672 1.00 39.26 C ATOM 1255 C ILE A 145 -18.292 21.467 2.771 1.00 37.30 C ATOM 1256 O ILE A 145 -18.461 21.971 1.668 1.00 38.89 O ATOM 1257 CB ILE A 145 -17.369 23.255 4.347 1.00 35.21 C ATOM 1258 CG1 ILE A 145 -16.289 23.527 5.396 1.00 36.74 C ATOM 1259 CG2 ILE A 145 -18.755 23.296 4.950 1.00 33.97 C ATOM 1260 CD1 ILE A 145 -16.244 24.954 5.911 1.00 37.44 C ATOM 1261 H ILE A 145 -15.773 22.599 2.148 1.00 0.00 H ATOM 1262 N HIS A 146 -19.098 20.526 3.273 1.00 33.64 N ATOM 1263 CA HIS A 146 -20.272 20.072 2.551 1.00 35.86 C ATOM 1264 C HIS A 146 -21.436 20.005 3.538 1.00 34.10 C ATOM 1265 O HIS A 146 -21.419 19.221 4.505 1.00 35.43 O ATOM 1266 CB HIS A 146 -19.980 18.756 1.803 1.00 36.45 C ATOM 1267 CG HIS A 146 -20.937 18.444 0.699 1.00 34.93 C ATOM 1268 ND1 HIS A 146 -20.593 17.632 -0.369 1.00 32.20 N ATOM 1269 CD2 HIS A 146 -22.228 18.803 0.503 1.00 35.20 C ATOM 1270 CE1 HIS A 146 -21.638 17.514 -1.171 1.00 33.75 C ATOM 1271 NE2 HIS A 146 -22.649 18.222 -0.664 1.00 31.21 N ATOM 1272 H HIS A 146 -18.879 20.110 4.201 1.00 0.00 H ATOM 1273 N ILE A 147 -22.416 20.872 3.275 1.00 31.28 N ATOM 1274 CA ILE A 147 -23.615 21.074 4.066 1.00 31.56 C ATOM 1275 C ILE A 147 -24.806 20.454 3.320 1.00 30.44 C ATOM 1276 O ILE A 147 -25.034 20.756 2.147 1.00 30.75 O ATOM 1277 CB ILE A 147 -23.877 22.584 4.307 1.00 33.41 C ATOM 1278 CG1 ILE A 147 -22.686 23.334 4.913 1.00 33.21 C ATOM 1279 CG2 ILE A 147 -25.142 22.803 5.123 1.00 34.92 C ATOM 1280 CD1 ILE A 147 -22.224 22.819 6.259 1.00 34.56 C ATOM 1281 H ILE A 147 -22.310 21.458 2.422 1.00 0.00 H ATOM 1282 N PHE A 148 -25.610 19.675 4.055 1.00 31.83 N ATOM 1283 CA PHE A 148 -26.895 19.157 3.618 1.00 31.28 C ATOM 1284 C PHE A 148 -28.013 19.658 4.533 1.00 30.00 C ATOM 1285 O PHE A 148 -27.820 19.891 5.707 1.00 30.99 O ATOM 1286 CB PHE A 148 -26.910 17.629 3.654 1.00 33.41 C ATOM 1287 CG PHE A 148 -25.928 16.980 2.715 1.00 32.51 C ATOM 1288 CD1 PHE A 148 -26.283 16.704 1.406 1.00 33.52 C ATOM 1289 CD2 PHE A 148 -24.668 16.617 3.153 1.00 29.79 C ATOM 1290 CE1 PHE A 148 -25.391 16.093 0.542 1.00 32.65 C ATOM 1291 CE2 PHE A 148 -23.774 16.012 2.287 1.00 34.41 C ATOM 1292 CZ PHE A 148 -24.133 15.755 0.984 1.00 35.58 C ATOM 1293 H PHE A 148 -25.290 19.422 5.012 1.00 0.00 H ATOM 1294 N SER A 149 -29.197 19.827 3.958 1.00 34.62 N ATOM 1295 CA SER A 149 -30.365 20.223 4.701 1.00 35.58 C ATOM 1296 C SER A 149 -31.353 19.069 4.614 1.00 30.76 C ATOM 1297 O SER A 149 -31.152 18.171 3.878 1.00 36.52 O ATOM 1298 CB SER A 149 -30.940 21.492 4.157 1.00 38.28 C ATOM 1299 OG SER A 149 -31.626 21.243 2.933 1.00 39.44 O ATOM 1300 HG SER A 149 -32.000 22.092 2.587 1.00 0.00 H ATOM 1301 H SER A 149 -29.284 19.668 2.934 1.00 0.00 H ATOM 1302 N PHE A 150 -32.420 19.133 5.384 1.00 32.89 N ATOM 1303 CA PHE A 150 -33.518 18.218 5.264 1.00 32.45 C ATOM 1304 C PHE A 150 -34.498 18.669 4.179 1.00 30.57 C ATOM 1305 O PHE A 150 -35.583 18.149 4.090 1.00 39.53 O ATOM 1306 CB PHE A 150 -34.210 18.082 6.614 1.00 33.60 C ATOM 1307 CG PHE A 150 -33.345 17.446 7.669 1.00 31.63 C ATOM 1308 CD1 PHE A 150 -32.436 18.204 8.384 1.00 28.30 C ATOM 1309 CD2 PHE A 150 -33.441 16.091 7.931 1.00 28.35 C ATOM 1310 CE1 PHE A 150 -31.668 17.620 9.379 1.00 29.63 C ATOM 1311 CE2 PHE A 150 -32.660 15.506 8.915 1.00 30.18 C ATOM 1312 CZ PHE A 150 -31.765 16.267 9.627 1.00 30.70 C ATOM 1313 H PHE A 150 -32.468 19.877 6.109 1.00 0.00 H ATOM 1314 N THR A 151 -34.085 19.559 3.290 1.00 30.81 N ATOM 1315 CA THR A 151 -34.996 20.061 2.256 1.00 34.33 C ATOM 1316 C THR A 151 -34.440 19.719 0.879 1.00 34.95 C ATOM 1317 O THR A 151 -35.049 20.082 -0.119 1.00 43.43 O ATOM 1318 CB THR A 151 -35.176 21.594 2.331 1.00 32.96 C ATOM 1319 OG1 THR A 151 -33.906 22.173 2.012 1.00 34.60 O ATOM 1320 CG2 THR A 151 -35.635 22.108 3.675 1.00 29.12 C ATOM 1321 HG1 THR A 151 -33.230 21.865 2.667 1.00 0.00 H ATOM 1322 H THR A 151 -33.105 19.906 3.325 1.00 0.00 H ATOM 1323 N GLY A 152 -33.243 19.121 0.830 1.00 38.66 N ATOM 1324 CA GLY A 152 -32.598 18.752 -0.439 1.00 38.96 C ATOM 1325 C GLY A 152 -31.674 19.837 -0.964 1.00 39.41 C ATOM 1326 O GLY A 152 -31.225 19.766 -2.101 1.00 43.73 O ATOM 1327 H GLY A 152 -32.752 18.910 1.722 1.00 0.00 H ATOM 1328 N GLU A 153 -31.397 20.858 -0.150 1.00 39.76 N ATOM 1329 CA GLU A 153 -30.400 21.861 -0.502 1.00 40.39 C ATOM 1330 C GLU A 153 -29.043 21.369 0.001 1.00 39.98 C ATOM 1331 O GLU A 153 -28.939 20.669 1.009 1.00 40.94 O ATOM 1332 CB GLU A 153 -30.731 23.236 0.080 1.00 46.52 C ATOM 1333 CG GLU A 153 -31.889 23.949 -0.615 1.00 53.37 C ATOM 1334 CD GLU A 153 -32.446 25.133 0.164 1.00 63.39 C ATOM 1335 OE1 GLU A 153 -33.518 24.974 0.795 1.00 73.41 O ATOM 1336 OE2 GLU A 153 -31.806 26.213 0.166 1.00 71.95 O ATOM 1337 H GLU A 153 -31.903 20.939 0.755 1.00 0.00 H ATOM 1338 N GLU A 154 -27.994 21.725 -0.729 1.00 42.98 N ATOM 1339 CA GLU A 154 -26.654 21.527 -0.266 1.00 41.37 C ATOM 1340 C GLU A 154 -25.881 22.816 -0.524 1.00 42.22 C ATOM 1341 O GLU A 154 -26.360 23.686 -1.220 1.00 40.42 O ATOM 1342 CB GLU A 154 -26.026 20.294 -0.912 1.00 42.96 C ATOM 1343 CG GLU A 154 -26.172 20.220 -2.417 1.00 41.39 C ATOM 1344 CD GLU A 154 -25.716 18.902 -3.035 1.00 42.49 C ATOM 1345 OE1 GLU A 154 -24.863 18.195 -2.430 1.00 38.49 O ATOM 1346 OE2 GLU A 154 -26.238 18.565 -4.114 1.00 42.18 O ATOM 1347 H GLU A 154 -28.149 22.159 -1.661 1.00 0.00 H ATOM 1348 N MET A 155 -24.740 22.943 0.148 1.00 40.90 N ATOM 1349 CA MET A 155 -23.783 23.948 -0.143 1.00 40.19 C ATOM 1350 C MET A 155 -22.403 23.387 0.209 1.00 39.69 C ATOM 1351 O MET A 155 -22.239 22.756 1.240 1.00 35.82 O ATOM 1352 CB MET A 155 -24.062 25.231 0.650 1.00 41.44 C ATOM 1353 CG MET A 155 -23.186 26.385 0.212 1.00 42.04 C ATOM 1354 SD MET A 155 -23.558 27.899 1.102 1.00 50.36 S ATOM 1355 CE MET A 155 -25.004 28.464 0.206 1.00 52.58 C ATOM 1356 H MET A 155 -24.541 22.276 0.921 1.00 0.00 H ATOM 1357 N ALA A 156 -21.436 23.589 -0.689 1.00 41.93 N ATOM 1358 CA ALA A 156 -20.080 23.099 -0.514 1.00 45.75 C ATOM 1359 C ALA A 156 -19.080 24.167 -0.968 1.00 45.74 C ATOM 1360 O ALA A 156 -19.361 24.946 -1.877 1.00 40.16 O ATOM 1361 CB ALA A 156 -19.886 21.806 -1.276 1.00 48.13 C ATOM 1362 H ALA A 156 -21.664 24.121 -1.553 1.00 0.00 H ATOM 1363 N THR A 157 -17.913 24.171 -0.317 1.00 45.11 N ATOM 1364 CA THR A 157 -16.778 24.987 -0.690 1.00 47.02 C ATOM 1365 C THR A 157 -16.604 25.005 -2.217 1.00 47.59 C ATOM 1366 O THR A 157 -16.530 23.938 -2.863 1.00 46.80 O ATOM 1367 CB THR A 157 -15.514 24.466 -0.002 1.00 47.15 C ATOM 1368 OG1 THR A 157 -15.834 24.302 1.381 1.00 38.61 O ATOM 1369 CG2 THR A 157 -14.330 25.388 -0.198 1.00 46.07 C ATOM 1370 HG1 THR A 157 -16.107 25.174 1.761 1.00 0.00 H ATOM 1371 H THR A 157 -17.814 23.548 0.510 1.00 0.00 H ATOM 1372 N LYS A 158 -16.567 26.231 -2.765 1.00 51.08 N ATOM 1373 CA LYS A 158 -16.263 26.566 -4.177 1.00 51.46 C ATOM 1374 C LYS A 158 -17.280 25.900 -5.104 1.00 47.91 C ATOM 1375 O LYS A 158 -16.992 25.685 -6.254 1.00 48.47 O ATOM 1376 CB LYS A 158 -14.823 26.179 -4.550 1.00 53.40 C ATOM 1377 CG LYS A 158 -13.765 27.215 -4.198 1.00 56.10 C ATOM 1378 CD LYS A 158 -12.513 26.616 -3.583 1.00 66.14 C ATOM 1379 CE LYS A 158 -11.589 27.654 -2.974 1.00 71.52 C ATOM 1380 NZ LYS A 158 -10.373 27.039 -2.384 1.00 73.54 N ATOM 1381 HZ1 LYS A 158 -10.651 26.372 -1.636 1.00 0.00 H ATOM 1382 HZ2 LYS A 158 -9.848 26.531 -3.125 1.00 0.00 H ATOM 1383 HZ3 LYS A 158 -9.771 27.784 -1.980 1.00 0.00 H ATOM 1384 H LYS A 158 -16.773 27.030 -2.132 1.00 0.00 H ATOM 1385 N ALA A 159 -18.474 25.617 -4.574 1.00 47.34 N ATOM 1386 CA ALA A 159 -19.515 24.844 -5.243 1.00 46.07 C ATOM 1387 C ALA A 159 -18.921 23.561 -5.829 1.00 47.29 C ATOM 1388 O ALA A 159 -19.340 23.100 -6.874 1.00 55.21 O ATOM 1389 CB ALA A 159 -20.211 25.681 -6.293 1.00 46.90 C ATOM 1390 H ALA A 159 -18.675 25.973 -3.618 1.00 0.00 H ATOM 1391 N ASP A 160 -17.964 22.970 -5.115 1.00 43.54 N ATOM 1392 CA ASP A 160 -17.444 21.682 -5.459 1.00 42.87 C ATOM 1393 C ASP A 160 -18.082 20.646 -4.506 1.00 42.51 C ATOM 1394 O ASP A 160 -17.802 20.594 -3.314 1.00 42.51 O ATOM 1395 CB ASP A 160 -15.915 21.699 -5.403 1.00 42.95 C ATOM 1396 CG ASP A 160 -15.329 20.310 -5.571 1.00 44.21 C ATOM 1397 OD1 ASP A 160 -16.116 19.390 -5.894 1.00 49.03 O ATOM 1398 OD2 ASP A 160 -14.112 20.151 -5.356 1.00 46.09 O ATOM 1399 H ASP A 160 -17.583 23.460 -4.281 1.00 0.00 H ATOM 1400 N TYR A 161 -18.942 19.799 -5.060 1.00 42.26 N ATOM 1401 CA TYR A 161 -19.846 18.947 -4.296 1.00 41.91 C ATOM 1402 C TYR A 161 -19.282 17.533 -4.109 1.00 41.51 C ATOM 1403 O TYR A 161 -19.977 16.666 -3.587 1.00 42.73 O ATOM 1404 CB TYR A 161 -21.197 18.939 -5.005 1.00 42.63 C ATOM 1405 CG TYR A 161 -21.900 20.263 -4.917 1.00 44.70 C ATOM 1406 CD1 TYR A 161 -22.494 20.659 -3.725 1.00 42.32 C ATOM 1407 CD2 TYR A 161 -21.939 21.139 -5.993 1.00 48.07 C ATOM 1408 CE1 TYR A 161 -23.145 21.871 -3.605 1.00 40.93 C ATOM 1409 CE2 TYR A 161 -22.603 22.356 -5.895 1.00 48.66 C ATOM 1410 CZ TYR A 161 -23.204 22.720 -4.697 1.00 47.73 C ATOM 1411 OH TYR A 161 -23.840 23.914 -4.565 1.00 46.96 O ATOM 1412 HH TYR A 161 -24.202 23.994 -3.647 1.00 0.00 H ATOM 1413 H TYR A 161 -18.972 19.740 -6.098 1.00 0.00 H ATOM 1414 N THR A 162 -18.032 17.316 -4.540 1.00 40.62 N ATOM 1415 CA THR A 162 -17.247 16.119 -4.283 1.00 43.45 C ATOM 1416 C THR A 162 -17.868 14.854 -4.911 1.00 42.21 C ATOM 1417 O THR A 162 -17.181 14.154 -5.627 1.00 36.39 O ATOM 1418 CB THR A 162 -16.980 15.945 -2.781 1.00 43.06 C ATOM 1419 OG1 THR A 162 -16.279 17.091 -2.290 1.00 44.25 O ATOM 1420 CG2 THR A 162 -16.189 14.685 -2.493 1.00 43.47 C ATOM 1421 HG1 THR A 162 -16.106 16.981 -1.322 1.00 0.00 H ATOM 1422 H THR A 162 -17.586 18.066 -5.106 1.00 0.00 H ATOM 1423 N LEU A 163 -19.122 14.516 -4.569 1.00 46.80 N ATOM 1424 CA LEU A 163 -19.778 13.277 -5.020 1.00 43.77 C ATOM 1425 C LEU A 163 -20.464 13.503 -6.370 1.00 42.90 C ATOM 1426 O LEU A 163 -20.680 14.627 -6.776 1.00 38.36 O ATOM 1427 CB LEU A 163 -20.803 12.845 -3.972 1.00 45.97 C ATOM 1428 CG LEU A 163 -20.227 12.392 -2.631 1.00 49.67 C ATOM 1429 CD1 LEU A 163 -21.339 11.971 -1.678 1.00 51.16 C ATOM 1430 CD2 LEU A 163 -19.226 11.262 -2.816 1.00 47.02 C ATOM 1431 H LEU A 163 -19.657 15.162 -3.954 1.00 0.00 H ATOM 1432 N ASP A 164 -20.833 12.404 -7.037 1.00 44.05 N ATOM 1433 CA ASP A 164 -21.634 12.472 -8.243 1.00 45.33 C ATOM 1434 C ASP A 164 -23.090 12.742 -7.846 1.00 44.50 C ATOM 1435 O ASP A 164 -23.464 12.566 -6.685 1.00 40.22 O ATOM 1436 CB ASP A 164 -21.460 11.215 -9.097 1.00 45.51 C ATOM 1437 CG ASP A 164 -21.926 9.914 -8.463 1.00 49.60 C ATOM 1438 OD1 ASP A 164 -22.603 9.956 -7.416 1.00 53.69 O ATOM 1439 OD2 ASP A 164 -21.590 8.856 -9.019 1.00 54.26 O ATOM 1440 H ASP A 164 -20.536 11.473 -6.680 1.00 0.00 H ATOM 1441 N GLU A 165 -23.908 13.132 -8.826 1.00 44.03 N ATOM 1442 CA GLU A 165 -25.271 13.605 -8.554 1.00 47.97 C ATOM 1443 C GLU A 165 -26.109 12.512 -7.871 1.00 47.17 C ATOM 1444 O GLU A 165 -27.016 12.802 -7.090 1.00 46.20 O ATOM 1445 CB GLU A 165 -25.979 14.050 -9.833 1.00 52.68 C ATOM 1446 CG GLU A 165 -25.863 15.541 -10.110 1.00 60.41 C ATOM 1447 CD GLU A 165 -24.553 15.996 -10.735 1.00 69.39 C ATOM 1448 OE1 GLU A 165 -23.964 15.208 -11.519 1.00 75.07 O ATOM 1449 OE2 GLU A 165 -24.126 17.145 -10.446 1.00 75.54 O ATOM 1450 H GLU A 165 -23.571 13.100 -9.809 1.00 0.00 H ATOM 1451 N GLU A 166 -25.816 11.254 -8.183 1.00 43.25 N ATOM 1452 CA GLU A 166 -26.612 10.138 -7.727 1.00 44.57 C ATOM 1453 C GLU A 166 -26.364 9.882 -6.230 1.00 40.14 C ATOM 1454 O GLU A 166 -27.289 9.562 -5.476 1.00 39.54 O ATOM 1455 CB GLU A 166 -26.283 8.915 -8.589 1.00 48.58 C ATOM 1456 CG GLU A 166 -26.694 7.576 -7.992 1.00 50.51 C ATOM 1457 CD GLU A 166 -25.658 6.506 -8.278 1.00 61.68 C ATOM 1458 OE1 GLU A 166 -24.677 6.391 -7.487 1.00 68.65 O ATOM 1459 OE2 GLU A 166 -25.794 5.836 -9.320 1.00 64.13 O ATOM 1460 H GLU A 166 -24.983 11.066 -8.777 1.00 0.00 H ATOM 1461 N SER A 167 -25.093 9.934 -5.833 1.00 36.39 N ATOM 1462 CA SER A 167 -24.702 9.748 -4.463 1.00 37.92 C ATOM 1463 C SER A 167 -25.283 10.881 -3.596 1.00 38.10 C ATOM 1464 O SER A 167 -25.720 10.662 -2.481 1.00 41.31 O ATOM 1465 CB SER A 167 -23.207 9.656 -4.374 1.00 41.35 C ATOM 1466 OG SER A 167 -22.706 8.582 -5.171 1.00 41.90 O ATOM 1467 HG SER A 167 -22.958 8.729 -6.117 1.00 0.00 H ATOM 1468 H SER A 167 -24.355 10.116 -6.543 1.00 0.00 H ATOM 1469 N ARG A 168 -25.334 12.092 -4.139 1.00 35.84 N ATOM 1470 CA ARG A 168 -25.851 13.243 -3.426 1.00 39.57 C ATOM 1471 C ARG A 168 -27.379 13.152 -3.333 1.00 38.33 C ATOM 1472 O ARG A 168 -27.935 13.411 -2.258 1.00 28.84 O ATOM 1473 CB ARG A 168 -25.353 14.521 -4.098 1.00 41.30 C ATOM 1474 CG ARG A 168 -23.839 14.645 -4.029 1.00 42.23 C ATOM 1475 CD ARG A 168 -23.227 15.468 -5.131 1.00 43.36 C ATOM 1476 NE ARG A 168 -23.844 16.777 -5.179 1.00 46.12 N ATOM 1477 CZ ARG A 168 -24.130 17.434 -6.298 1.00 52.54 C ATOM 1478 NH1 ARG A 168 -23.698 16.984 -7.465 1.00 53.74 N ATOM 1479 NH2 ARG A 168 -24.844 18.545 -6.245 1.00 52.71 N ATOM 1480 HE ARG A 168 -24.080 17.235 -4.275 1.00 0.00 H ATOM 1481 HH12 ARG A 168 -23.924 17.502 -8.338 1.00 0.00 H ATOM 1482 HH11 ARG A 168 -23.132 16.113 -7.509 1.00 0.00 H ATOM 1483 HH22 ARG A 168 -25.069 19.061 -7.120 1.00 0.00 H ATOM 1484 HH21 ARG A 168 -25.181 18.903 -5.329 1.00 0.00 H ATOM 1485 H ARG A 168 -24.990 12.219 -5.112 1.00 0.00 H ATOM 1486 N ALA A 169 -28.015 12.708 -4.427 1.00 34.46 N ATOM 1487 CA ALA A 169 -29.455 12.419 -4.484 1.00 35.44 C ATOM 1488 C ALA A 169 -29.869 11.377 -3.423 1.00 36.29 C ATOM 1489 O ALA A 169 -30.960 11.498 -2.793 1.00 33.54 O ATOM 1490 CB ALA A 169 -29.838 11.959 -5.867 1.00 37.68 C ATOM 1491 H ALA A 169 -27.454 12.559 -5.290 1.00 0.00 H ATOM 1492 N ARG A 170 -29.046 10.336 -3.240 1.00 35.48 N ATOM 1493 CA ARG A 170 -29.364 9.303 -2.251 1.00 38.66 C ATOM 1494 C ARG A 170 -29.375 9.942 -0.847 1.00 34.06 C ATOM 1495 O ARG A 170 -30.255 9.702 -0.069 1.00 30.97 O ATOM 1496 CB ARG A 170 -28.361 8.144 -2.291 1.00 46.24 C ATOM 1497 CG ARG A 170 -28.686 6.996 -3.237 1.00 52.78 C ATOM 1498 CD ARG A 170 -27.487 6.050 -3.349 1.00 64.06 C ATOM 1499 NE ARG A 170 -27.504 5.126 -4.487 1.00 76.07 N ATOM 1500 CZ ARG A 170 -26.428 4.529 -5.031 1.00 84.60 C ATOM 1501 NH1 ARG A 170 -25.207 4.765 -4.571 1.00 79.33 N ATOM 1502 NH2 ARG A 170 -26.579 3.707 -6.059 1.00 81.41 N ATOM 1503 HE ARG A 170 -28.429 4.913 -4.911 1.00 0.00 H ATOM 1504 HH12 ARG A 170 -24.388 4.294 -5.005 1.00 0.00 H ATOM 1505 HH11 ARG A 170 -25.069 5.421 -3.776 1.00 0.00 H ATOM 1506 HH22 ARG A 170 -25.749 3.244 -6.481 1.00 0.00 H ATOM 1507 HH21 ARG A 170 -27.528 3.524 -6.444 1.00 0.00 H ATOM 1508 H ARG A 170 -28.175 10.261 -3.804 1.00 0.00 H ATOM 1509 N ILE A 171 -28.359 10.747 -0.528 1.00 32.53 N ATOM 1510 CA ILE A 171 -28.252 11.385 0.789 1.00 32.79 C ATOM 1511 C ILE A 171 -29.468 12.295 1.017 1.00 32.31 C ATOM 1512 O ILE A 171 -30.135 12.220 2.060 1.00 29.25 O ATOM 1513 CB ILE A 171 -26.901 12.122 0.917 1.00 33.19 C ATOM 1514 CG1 ILE A 171 -25.762 11.113 1.014 1.00 32.11 C ATOM 1515 CG2 ILE A 171 -26.854 13.102 2.090 1.00 31.65 C ATOM 1516 CD1 ILE A 171 -24.462 11.658 0.518 1.00 35.41 C ATOM 1517 H ILE A 171 -27.619 10.928 -1.236 1.00 0.00 H ATOM 1518 N LYS A 172 -29.784 13.131 0.029 1.00 34.56 N ATOM 1519 CA LYS A 172 -30.859 14.078 0.188 1.00 33.18 C ATOM 1520 C LYS A 172 -32.163 13.310 0.371 1.00 32.26 C ATOM 1521 O LYS A 172 -33.034 13.723 1.154 1.00 31.93 O ATOM 1522 CB LYS A 172 -30.900 15.047 -0.994 1.00 35.19 C ATOM 1523 CG LYS A 172 -29.651 15.910 -1.154 1.00 36.26 C ATOM 1524 CD LYS A 172 -29.799 17.032 -2.147 1.00 35.94 C ATOM 1525 CE LYS A 172 -29.127 16.763 -3.470 1.00 38.49 C ATOM 1526 NZ LYS A 172 -28.534 17.999 -4.031 1.00 36.82 N ATOM 1527 HZ1 LYS A 172 -29.283 18.706 -4.176 1.00 0.00 H ATOM 1528 HZ2 LYS A 172 -27.825 18.374 -3.368 1.00 0.00 H ATOM 1529 HZ3 LYS A 172 -28.079 17.782 -4.941 1.00 0.00 H ATOM 1530 H LYS A 172 -29.251 13.100 -0.864 1.00 0.00 H ATOM 1531 N THR A 173 -32.302 12.189 -0.349 1.00 33.54 N ATOM 1532 CA THR A 173 -33.527 11.411 -0.259 1.00 31.37 C ATOM 1533 C THR A 173 -33.645 10.859 1.171 1.00 31.04 C ATOM 1534 O THR A 173 -34.724 10.924 1.789 1.00 32.00 O ATOM 1535 CB THR A 173 -33.580 10.278 -1.288 1.00 32.01 C ATOM 1536 OG1 THR A 173 -33.632 10.824 -2.607 1.00 32.98 O ATOM 1537 CG2 THR A 173 -34.787 9.385 -1.076 1.00 31.16 C ATOM 1538 HG1 THR A 173 -32.825 11.375 -2.767 1.00 0.00 H ATOM 1539 H THR A 173 -31.532 11.875 -0.974 1.00 0.00 H ATOM 1540 N ARG A 174 -32.527 10.348 1.700 1.00 26.55 N ATOM 1541 CA ARG A 174 -32.523 9.743 3.025 1.00 30.11 C ATOM 1542 C ARG A 174 -32.883 10.816 4.076 1.00 30.48 C ATOM 1543 O ARG A 174 -33.758 10.582 4.952 1.00 28.84 O ATOM 1544 CB ARG A 174 -31.189 9.037 3.275 1.00 30.28 C ATOM 1545 CG ARG A 174 -31.011 8.516 4.694 1.00 31.41 C ATOM 1546 CD ARG A 174 -32.055 7.491 5.092 1.00 32.25 C ATOM 1547 NE ARG A 174 -31.768 6.964 6.419 1.00 35.04 N ATOM 1548 CZ ARG A 174 -32.681 6.562 7.296 1.00 31.26 C ATOM 1549 NH1 ARG A 174 -33.949 6.555 6.969 1.00 31.36 N ATOM 1550 NH2 ARG A 174 -32.333 6.185 8.504 1.00 31.86 N ATOM 1551 HE ARG A 174 -30.770 6.897 6.702 1.00 0.00 H ATOM 1552 HH12 ARG A 174 -34.662 6.240 7.658 1.00 0.00 H ATOM 1553 HH11 ARG A 174 -34.243 6.865 6.021 1.00 0.00 H ATOM 1554 HH22 ARG A 174 -33.059 5.873 9.180 1.00 0.00 H ATOM 1555 HH21 ARG A 174 -31.332 6.199 8.785 1.00 0.00 H ATOM 1556 H ARG A 174 -31.643 10.384 1.154 1.00 0.00 H ATOM 1557 N LEU A 175 -32.263 11.997 3.966 1.00 29.38 N ATOM 1558 CA LEU A 175 -32.530 13.106 4.910 1.00 30.58 C ATOM 1559 C LEU A 175 -33.997 13.564 4.829 1.00 29.68 C ATOM 1560 O LEU A 175 -34.643 13.708 5.857 1.00 29.57 O ATOM 1561 CB LEU A 175 -31.600 14.278 4.635 1.00 28.31 C ATOM 1562 CG LEU A 175 -30.172 14.081 5.084 1.00 29.79 C ATOM 1563 CD1 LEU A 175 -29.298 15.179 4.509 1.00 31.45 C ATOM 1564 CD2 LEU A 175 -30.080 14.026 6.589 1.00 31.95 C ATOM 1565 H LEU A 175 -31.576 12.139 3.198 1.00 0.00 H ATOM 1566 N PHE A 176 -34.518 13.772 3.619 1.00 28.64 N ATOM 1567 CA PHE A 176 -35.931 14.149 3.451 1.00 28.73 C ATOM 1568 C PHE A 176 -36.842 13.079 4.083 1.00 30.31 C ATOM 1569 O PHE A 176 -37.830 13.388 4.767 1.00 31.04 O ATOM 1570 CB PHE A 176 -36.245 14.406 1.974 1.00 26.91 C ATOM 1571 CG PHE A 176 -37.582 15.044 1.724 1.00 28.03 C ATOM 1572 CD1 PHE A 176 -37.734 16.424 1.772 1.00 33.11 C ATOM 1573 CD2 PHE A 176 -38.690 14.275 1.447 1.00 27.24 C ATOM 1574 CE1 PHE A 176 -38.975 17.018 1.566 1.00 33.74 C ATOM 1575 CE2 PHE A 176 -39.928 14.867 1.235 1.00 30.63 C ATOM 1576 CZ PHE A 176 -40.071 16.234 1.280 1.00 32.36 C ATOM 1577 H PHE A 176 -33.915 13.666 2.779 1.00 0.00 H ATOM 1578 N THR A 177 -36.509 11.805 3.871 1.00 30.52 N ATOM 1579 CA THR A 177 -37.276 10.708 4.456 1.00 30.56 C ATOM 1580 C THR A 177 -37.255 10.780 5.988 1.00 29.09 C ATOM 1581 O THR A 177 -38.294 10.612 6.610 1.00 28.30 O ATOM 1582 CB THR A 177 -36.780 9.343 3.968 1.00 31.69 C ATOM 1583 OG1 THR A 177 -36.700 9.390 2.547 1.00 31.86 O ATOM 1584 CG2 THR A 177 -37.688 8.214 4.393 1.00 30.11 C ATOM 1585 HG1 THR A 177 -36.068 10.102 2.277 1.00 0.00 H ATOM 1586 H THR A 177 -35.684 11.588 3.276 1.00 0.00 H ATOM 1587 N ILE A 178 -36.096 11.051 6.599 1.00 29.86 N ATOM 1588 CA ILE A 178 -36.053 11.193 8.080 1.00 32.11 C ATOM 1589 C ILE A 178 -37.012 12.311 8.501 1.00 32.75 C ATOM 1590 O ILE A 178 -37.872 12.132 9.400 1.00 31.69 O ATOM 1591 CB ILE A 178 -34.620 11.409 8.597 1.00 34.42 C ATOM 1592 CG1 ILE A 178 -33.774 10.137 8.407 1.00 30.74 C ATOM 1593 CG2 ILE A 178 -34.633 11.892 10.052 1.00 34.44 C ATOM 1594 CD1 ILE A 178 -32.270 10.332 8.506 1.00 31.63 C ATOM 1595 H ILE A 178 -35.226 11.162 6.040 1.00 0.00 H ATOM 1596 N ARG A 179 -36.924 13.443 7.800 1.00 31.53 N ATOM 1597 CA ARG A 179 -37.804 14.569 8.099 1.00 32.29 C ATOM 1598 C ARG A 179 -39.264 14.117 8.052 1.00 30.43 C ATOM 1599 O ARG A 179 -40.043 14.448 8.937 1.00 29.70 O ATOM 1600 CB ARG A 179 -37.575 15.737 7.139 1.00 32.07 C ATOM 1601 CG ARG A 179 -38.656 16.802 7.190 1.00 31.65 C ATOM 1602 CD ARG A 179 -38.257 17.910 6.236 1.00 35.37 C ATOM 1603 NE ARG A 179 -39.371 18.718 5.761 1.00 35.44 N ATOM 1604 CZ ARG A 179 -39.304 19.525 4.706 1.00 36.98 C ATOM 1605 NH1 ARG A 179 -38.160 19.693 4.051 1.00 35.98 N ATOM 1606 NH2 ARG A 179 -40.387 20.146 4.299 1.00 36.93 N ATOM 1607 HE ARG A 179 -40.272 18.661 6.277 1.00 0.00 H ATOM 1608 HH12 ARG A 179 -38.121 20.327 3.227 1.00 0.00 H ATOM 1609 HH11 ARG A 179 -37.304 19.191 4.362 1.00 0.00 H ATOM 1610 HH22 ARG A 179 -40.345 20.779 3.475 1.00 0.00 H ATOM 1611 HH21 ARG A 179 -41.287 20.005 4.801 1.00 0.00 H ATOM 1612 H ARG A 179 -36.224 13.524 7.035 1.00 0.00 H ATOM 1613 N GLN A 180 -39.639 13.386 7.000 1.00 28.40 N ATOM 1614 CA GLN A 180 -41.029 13.065 6.822 1.00 27.40 C ATOM 1615 C GLN A 180 -41.445 11.993 7.823 1.00 28.68 C ATOM 1616 O GLN A 180 -42.562 12.056 8.334 1.00 30.83 O ATOM 1617 CB GLN A 180 -41.348 12.661 5.394 1.00 28.26 C ATOM 1618 CG GLN A 180 -41.180 13.806 4.408 1.00 30.77 C ATOM 1619 CD GLN A 180 -42.163 14.925 4.648 1.00 31.77 C ATOM 1620 OE1 GLN A 180 -43.310 14.711 5.027 1.00 34.19 O ATOM 1621 NE2 GLN A 180 -41.717 16.138 4.400 1.00 28.93 N ATOM 1622 HE22 GLN A 180 -40.737 16.276 4.080 1.00 0.00 H ATOM 1623 HE21 GLN A 180 -42.344 16.958 4.524 1.00 0.00 H ATOM 1624 H GLN A 180 -38.932 13.051 6.315 1.00 0.00 H ATOM 1625 N GLU A 181 -40.572 11.026 8.106 1.00 31.15 N ATOM 1626 CA GLU A 181 -40.895 10.069 9.157 1.00 35.05 C ATOM 1627 C GLU A 181 -41.114 10.849 10.459 1.00 33.97 C ATOM 1628 O GLU A 181 -42.083 10.588 11.162 1.00 33.89 O ATOM 1629 CB GLU A 181 -39.826 8.995 9.365 1.00 40.16 C ATOM 1630 CG GLU A 181 -40.219 7.609 8.884 1.00 47.55 C ATOM 1631 CD GLU A 181 -41.606 7.150 9.298 1.00 50.13 C ATOM 1632 OE1 GLU A 181 -41.886 7.059 10.538 1.00 59.10 O ATOM 1633 OE2 GLU A 181 -42.423 6.925 8.378 1.00 52.06 O ATOM 1634 H GLU A 181 -39.675 10.956 7.585 1.00 0.00 H ATOM 1635 N MET A 182 -40.231 11.809 10.766 1.00 32.30 N ATOM 1636 CA MET A 182 -40.411 12.594 12.004 1.00 33.58 C ATOM 1637 C MET A 182 -41.791 13.269 11.973 1.00 35.38 C ATOM 1638 O MET A 182 -42.534 13.174 12.960 1.00 32.21 O ATOM 1639 CB MET A 182 -39.299 13.619 12.235 1.00 32.14 C ATOM 1640 CG MET A 182 -38.013 12.988 12.714 1.00 34.81 C ATOM 1641 SD MET A 182 -36.766 14.213 12.988 1.00 33.53 S ATOM 1642 CE MET A 182 -35.288 13.283 13.337 1.00 32.41 C ATOM 1643 H MET A 182 -39.425 12.000 10.137 1.00 0.00 H ATOM 1644 N ALA A 183 -42.163 13.862 10.827 1.00 35.16 N ATOM 1645 CA ALA A 183 -43.462 14.552 10.692 1.00 38.30 C ATOM 1646 C ALA A 183 -44.647 13.575 10.841 1.00 39.50 C ATOM 1647 O ALA A 183 -45.691 13.949 11.398 1.00 40.38 O ATOM 1648 CB ALA A 183 -43.524 15.301 9.377 1.00 37.69 C ATOM 1649 H ALA A 183 -41.518 13.835 10.011 1.00 0.00 H ATOM 1650 N SER A 184 -44.529 12.354 10.300 1.00 40.69 N ATOM 1651 CA SER A 184 -45.566 11.315 10.490 1.00 41.03 C ATOM 1652 C SER A 184 -45.869 11.158 11.976 1.00 42.73 C ATOM 1653 O SER A 184 -47.040 11.048 12.353 1.00 40.79 O ATOM 1654 CB SER A 184 -45.162 9.998 9.941 1.00 40.49 C ATOM 1655 OG SER A 184 -45.522 9.934 8.582 1.00 51.60 O ATOM 1656 HG SER A 184 -45.254 9.056 8.212 1.00 0.00 H ATOM 1657 H SER A 184 -43.687 12.131 9.732 1.00 0.00 H ATOM 1658 N ARG A 185 -44.794 11.178 12.782 1.00 42.91 N ATOM 1659 CA ARG A 185 -44.827 10.979 14.217 1.00 41.30 C ATOM 1660 C ARG A 185 -44.981 12.297 15.002 1.00 39.56 C ATOM 1661 O ARG A 185 -44.787 12.305 16.209 1.00 40.89 O ATOM 1662 CB ARG A 185 -43.537 10.263 14.627 1.00 42.84 C ATOM 1663 CG ARG A 185 -43.518 8.792 14.235 1.00 42.33 C ATOM 1664 CD ARG A 185 -42.114 8.243 14.229 1.00 44.85 C ATOM 1665 NE ARG A 185 -42.046 7.021 13.455 1.00 48.39 N ATOM 1666 CZ ARG A 185 -41.629 5.859 13.939 1.00 55.01 C ATOM 1667 NH1 ARG A 185 -41.490 4.817 13.139 1.00 52.42 N ATOM 1668 NH2 ARG A 185 -41.314 5.751 15.219 1.00 61.03 N ATOM 1669 HE ARG A 185 -42.342 7.057 12.459 1.00 0.00 H ATOM 1670 HH12 ARG A 185 -41.163 3.907 13.522 1.00 0.00 H ATOM 1671 HH11 ARG A 185 -41.708 4.906 12.126 1.00 0.00 H ATOM 1672 HH22 ARG A 185 -40.987 4.840 15.599 1.00 0.00 H ATOM 1673 HH21 ARG A 185 -41.393 6.577 15.846 1.00 0.00 H ATOM 1674 H ARG A 185 -43.867 11.349 12.342 1.00 0.00 H ATOM 1675 N SER A 186 -45.321 13.409 14.344 1.00 37.79 N ATOM 1676 CA SER A 186 -45.433 14.716 15.028 1.00 38.57 C ATOM 1677 C SER A 186 -44.172 15.026 15.839 1.00 37.51 C ATOM 1678 O SER A 186 -44.278 15.451 16.964 1.00 42.06 O ATOM 1679 CB SER A 186 -46.661 14.747 15.914 1.00 42.26 C ATOM 1680 OG SER A 186 -47.774 15.306 15.224 1.00 46.67 O ATOM 1681 HG SER A 186 -48.562 15.315 15.823 1.00 0.00 H ATOM 1682 H SER A 186 -45.512 13.354 13.323 1.00 0.00 H ATOM 1683 N LEU A 187 -42.978 14.785 15.279 1.00 39.75 N ATOM 1684 CA LEU A 187 -41.699 15.092 15.985 1.00 38.30 C ATOM 1685 C LEU A 187 -40.894 16.148 15.236 1.00 35.71 C ATOM 1686 O LEU A 187 -39.958 16.732 15.805 1.00 36.75 O ATOM 1687 CB LEU A 187 -40.865 13.823 16.143 1.00 38.79 C ATOM 1688 CG LEU A 187 -41.554 12.685 16.887 1.00 42.20 C ATOM 1689 CD1 LEU A 187 -40.649 11.463 16.949 1.00 44.08 C ATOM 1690 CD2 LEU A 187 -41.947 13.124 18.283 1.00 44.07 C ATOM 1691 H LEU A 187 -42.942 14.372 14.325 1.00 0.00 H ATOM 1692 N TRP A 188 -41.254 16.379 13.967 1.00 35.89 N ATOM 1693 CA TRP A 188 -40.479 17.251 13.100 1.00 35.70 C ATOM 1694 C TRP A 188 -40.367 18.671 13.693 1.00 34.91 C ATOM 1695 O TRP A 188 -39.297 19.285 13.631 1.00 34.77 O ATOM 1696 CB TRP A 188 -41.056 17.280 11.678 1.00 35.23 C ATOM 1697 CG TRP A 188 -40.304 18.254 10.836 1.00 33.85 C ATOM 1698 CD1 TRP A 188 -40.762 19.457 10.387 1.00 32.24 C ATOM 1699 CD2 TRP A 188 -38.903 18.201 10.506 1.00 34.40 C ATOM 1700 NE1 TRP A 188 -39.758 20.126 9.746 1.00 35.35 N ATOM 1701 CE2 TRP A 188 -38.607 19.378 9.787 1.00 35.37 C ATOM 1702 CE3 TRP A 188 -37.871 17.278 10.711 1.00 39.67 C ATOM 1703 CZ2 TRP A 188 -37.333 19.645 9.278 1.00 37.21 C ATOM 1704 CZ3 TRP A 188 -36.612 17.537 10.192 1.00 40.69 C ATOM 1705 CH2 TRP A 188 -36.347 18.699 9.469 1.00 36.32 C ATOM 1706 HE1 TRP A 188 -39.851 21.059 9.296 1.00 0.00 H ATOM 1707 H TRP A 188 -42.110 15.923 13.592 1.00 0.00 H ATOM 1708 N ASP A 189 -41.446 19.185 14.290 1.00 37.67 N ATOM 1709 CA ASP A 189 -41.481 20.592 14.743 1.00 43.27 C ATOM 1710 C ASP A 189 -40.551 20.809 15.937 1.00 41.93 C ATOM 1711 O ASP A 189 -39.914 21.837 16.022 1.00 45.72 O ATOM 1712 CB ASP A 189 -42.897 21.044 15.081 1.00 46.60 C ATOM 1713 CG ASP A 189 -43.657 21.485 13.850 1.00 47.86 C ATOM 1714 OD1 ASP A 189 -43.036 22.097 12.950 1.00 54.14 O ATOM 1715 OD2 ASP A 189 -44.849 21.191 13.794 1.00 56.27 O ATOM 1716 H ASP A 189 -42.280 18.582 14.439 1.00 0.00 H ATOM 1717 N SER A 190 -40.496 19.831 16.842 1.00 38.85 N ATOM 1718 CA SER A 190 -39.518 19.836 17.882 1.00 39.85 C ATOM 1719 C SER A 190 -38.129 19.815 17.234 1.00 38.89 C ATOM 1720 O SER A 190 -37.288 20.691 17.483 1.00 32.64 O ATOM 1721 CB SER A 190 -39.729 18.677 18.835 1.00 40.81 C ATOM 1722 OG SER A 190 -38.698 18.613 19.823 1.00 42.16 O ATOM 1723 HG SER A 190 -38.868 17.847 20.426 1.00 0.00 H ATOM 1724 H SER A 190 -41.179 19.049 16.789 1.00 0.00 H ATOM 1725 N PHE A 191 -37.912 18.823 16.359 1.00 40.04 N ATOM 1726 CA PHE A 191 -36.564 18.560 15.840 1.00 36.43 C ATOM 1727 C PHE A 191 -36.028 19.809 15.123 1.00 36.73 C ATOM 1728 O PHE A 191 -34.911 20.251 15.380 1.00 40.43 O ATOM 1729 CB PHE A 191 -36.545 17.309 14.955 1.00 34.77 C ATOM 1730 CG PHE A 191 -35.149 16.925 14.540 1.00 34.56 C ATOM 1731 CD1 PHE A 191 -34.193 16.581 15.495 1.00 32.02 C ATOM 1732 CD2 PHE A 191 -34.775 16.954 13.208 1.00 32.10 C ATOM 1733 CE1 PHE A 191 -32.909 16.238 15.115 1.00 35.51 C ATOM 1734 CE2 PHE A 191 -33.481 16.624 12.832 1.00 31.84 C ATOM 1735 CZ PHE A 191 -32.548 16.270 13.780 1.00 35.37 C ATOM 1736 H PHE A 191 -38.708 18.233 16.044 1.00 0.00 H ATOM 1737 N ARG A 192 -36.846 20.425 14.271 1.00 39.74 N ATOM 1738 CA ARG A 192 -36.329 21.469 13.383 1.00 46.32 C ATOM 1739 C ARG A 192 -36.053 22.759 14.158 1.00 46.71 C ATOM 1740 O ARG A 192 -35.276 23.579 13.669 1.00 46.56 O ATOM 1741 CB ARG A 192 -37.241 21.690 12.166 1.00 47.28 C ATOM 1742 CG ARG A 192 -38.053 22.973 12.138 1.00 48.64 C ATOM 1743 CD ARG A 192 -39.427 22.718 12.710 1.00 54.57 C ATOM 1744 NE ARG A 192 -40.468 23.664 12.300 1.00 55.21 N ATOM 1745 CZ ARG A 192 -40.483 24.965 12.586 1.00 45.83 C ATOM 1746 NH1 ARG A 192 -41.633 25.553 12.844 1.00 46.05 N ATOM 1747 NH2 ARG A 192 -39.365 25.666 12.596 1.00 49.29 N ATOM 1748 HE ARG A 192 -41.260 23.289 11.740 1.00 0.00 H ATOM 1749 HH12 ARG A 192 -41.659 26.568 13.069 1.00 0.00 H ATOM 1750 HH11 ARG A 192 -42.515 25.002 12.823 1.00 0.00 H ATOM 1751 HH22 ARG A 192 -39.390 26.681 12.821 1.00 0.00 H ATOM 1752 HH21 ARG A 192 -38.459 25.203 12.379 1.00 0.00 H ATOM 1753 H ARG A 192 -37.852 20.165 14.236 1.00 0.00 H ATOM 1754 N GLN A 193 -36.698 22.938 15.322 1.00 43.04 N ATOM 1755 CA GLN A 193 -36.537 24.160 16.117 1.00 40.28 C ATOM 1756 C GLN A 193 -35.437 23.967 17.167 1.00 45.42 C ATOM 1757 O GLN A 193 -35.148 24.891 17.929 1.00 47.97 O ATOM 1758 CB GLN A 193 -37.850 24.533 16.804 1.00 38.89 C ATOM 1759 CG GLN A 193 -38.883 25.183 15.896 1.00 37.53 C ATOM 1760 CD GLN A 193 -40.047 25.677 16.717 1.00 39.00 C ATOM 1761 OE1 GLN A 193 -40.002 26.748 17.311 1.00 36.56 O ATOM 1762 NE2 GLN A 193 -41.080 24.862 16.813 1.00 41.35 N ATOM 1763 HE22 GLN A 193 -41.082 23.961 16.293 1.00 0.00 H ATOM 1764 HE21 GLN A 193 -41.893 25.120 17.408 1.00 0.00 H ATOM 1765 H GLN A 193 -37.330 22.189 15.670 1.00 0.00 H ATOM 1766 N SER A 194 -34.814 22.779 17.191 1.00 43.15 N ATOM 1767 CA SER A 194 -33.979 22.372 18.295 1.00 47.39 C ATOM 1768 C SER A 194 -32.477 22.578 18.055 1.00 52.80 C ATOM 1769 O SER A 194 -31.712 22.346 18.978 1.00 66.07 O ATOM 1770 CB SER A 194 -34.248 20.955 18.651 1.00 49.74 C ATOM 1771 OG SER A 194 -33.278 20.504 19.560 1.00 49.51 O ATOM 1772 HG SER A 194 -32.381 20.575 19.146 1.00 0.00 H ATOM 1773 H SER A 194 -34.937 22.130 16.388 1.00 0.00 H ATOM 1774 N GLU A 195 -32.031 22.927 16.846 1.00 49.80 N ATOM 1775 CA GLU A 195 -30.628 23.387 16.614 1.00 59.11 C ATOM 1776 C GLU A 195 -29.544 22.629 17.429 1.00 66.55 C ATOM 1777 O GLU A 195 -28.353 22.955 17.288 1.00 67.62 O ATOM 1778 CB GLU A 195 -30.567 24.886 16.927 1.00 58.33 C ATOM 1779 CG GLU A 195 -29.189 25.508 16.816 1.00 63.63 C ATOM 1780 CD GLU A 195 -29.197 27.024 16.890 1.00 72.71 C ATOM 1781 OE1 GLU A 195 -30.277 27.588 17.161 1.00 79.38 O ATOM 1782 OE2 GLU A 195 -28.122 27.636 16.693 1.00 67.97 O ATOM 1783 H GLU A 195 -32.683 22.877 16.037 1.00 0.00 H ATOM 1784 N ARG A 196 -29.906 21.631 18.263 1.00 63.47 N ATOM 1785 CA ARG A 196 -28.924 20.786 19.032 1.00 64.87 C ATOM 1786 C ARG A 196 -28.593 19.509 18.250 1.00 62.34 C ATOM 1787 O ARG A 196 -29.488 18.820 17.708 1.00 56.04 O ATOM 1788 CB ARG A 196 -29.458 20.345 20.398 1.00 64.69 C ATOM 1789 CG ARG A 196 -29.363 21.414 21.472 1.00 64.84 C ATOM 1790 CD ARG A 196 -30.610 21.371 22.321 1.00 65.45 C ATOM 1791 NE ARG A 196 -30.586 22.325 23.417 1.00 64.95 N ATOM 1792 CZ ARG A 196 -31.260 22.171 24.549 1.00 61.96 C ATOM 1793 NH1 ARG A 196 -31.701 20.973 24.893 1.00 60.27 N ATOM 1794 NH2 ARG A 196 -31.490 23.211 25.330 1.00 58.23 N ATOM 1795 HE ARG A 196 -30.005 23.181 23.307 1.00 0.00 H ATOM 1796 HH12 ARG A 196 -32.230 20.848 25.780 1.00 0.00 H ATOM 1797 HH11 ARG A 196 -31.519 20.155 24.277 1.00 0.00 H ATOM 1798 HH22 ARG A 196 -32.019 23.088 26.217 1.00 0.00 H ATOM 1799 HH21 ARG A 196 -31.142 24.153 25.058 1.00 0.00 H ATOM 1800 H ARG A 196 -30.920 21.434 18.381 1.00 0.00 H ATOM 1801 N GLY A 197 -27.300 19.178 18.252 1.00 62.94 N ATOM 1802 CA GLY A 197 -26.715 18.235 17.316 1.00 64.45 C ATOM 1803 C GLY A 197 -26.002 18.949 16.178 1.00 65.01 C ATOM 1804 O GLY A 197 -25.222 18.314 15.464 1.00 74.09 O ATOM 1805 H GLY A 197 -26.679 19.618 18.961 1.00 0.00 H ATOM 1806 N GLU A 198 -26.301 20.251 16.000 1.00 65.90 N ATOM 1807 CA GLU A 198 -25.554 21.193 15.137 1.00 59.71 C ATOM 1808 C GLU A 198 -24.541 21.950 16.011 1.00 56.22 C ATOM 1809 O GLU A 198 -23.502 22.394 15.512 1.00 57.37 O ATOM 1810 CB GLU A 198 -26.503 22.164 14.416 1.00 54.02 C ATOM 1811 CG GLU A 198 -27.390 21.504 13.372 1.00 51.21 C ATOM 1812 CD GLU A 198 -28.470 22.368 12.711 1.00 47.34 C ATOM 1813 OE1 GLU A 198 -28.212 23.539 12.317 1.00 43.81 O ATOM 1814 OE2 GLU A 198 -29.577 21.839 12.541 1.00 42.11 O ATOM 1815 H GLU A 198 -27.125 20.625 16.512 1.00 0.00 H TER 1816 GLU A 198 HETATM 1817 MN MN A 1 -19.721 17.094 10.654 1.00 34.37 MN HETATM 1818 MN MN A 2 -17.304 15.155 12.784 1.00 38.86 MN HETATM 1819 O HOH 3 -15.823 16.770 12.106 1.00 31.06 O HETATM 1820 O HOH 4 -38.474 28.745 17.575 1.00 38.57 O HETATM 1821 O HOH 5 -23.296 18.746 11.368 1.00 26.27 O HETATM 1822 O HOH 6 -17.230 21.124 12.910 1.00 38.37 O HETATM 1823 O HOH 7 -15.416 13.784 13.112 1.00 32.88 O HETATM 1824 O HOH 8 -22.636 12.026 14.249 1.00 39.30 O HETATM 1825 O HOH 9 -21.061 10.190 15.731 1.00 43.18 O HETATM 1826 OAA HKD A 10 -20.582 18.183 18.623 1.00 -0.57 O HETATM 1827 CAC HKD A 10 -19.767 18.611 17.779 1.00 0.05 C HETATM 1828 OAD HKD A 10 -18.857 19.400 18.131 1.00 -0.57 O HETATM 1829 CAF HKD A 10 -19.879 18.287 16.424 1.00 0.01 C HETATM 1830 CAG HKD A 10 -18.907 17.399 15.993 1.00 -0.01 C HETATM 1831 CAH HKD A 10 -18.634 16.921 14.730 1.00 0.17 C HETATM 1832 OAI HKD A 10 -17.573 16.075 14.705 1.00 -0.36 O HETATM 1833 H3 HKD A 10 -17.429 15.776 13.815 1.00 0.22 H HETATM 1834 CAL HKD A 10 -19.294 17.160 13.516 1.00 0.21 C HETATM 1835 OAM HKD A 10 -18.893 16.598 12.508 1.00 -0.36 O HETATM 1836 CAK HKD A 10 -20.437 17.962 13.355 1.00 0.16 C HETATM 1837 OAN HKD A 10 -20.942 18.014 12.068 1.00 -0.32 O HETATM 1838 H4 HKD A 10 -21.709 18.575 12.052 1.00 0.26 H HETATM 1839 CAJ HKD A 10 -21.136 18.707 14.315 1.00 -0.02 C HETATM 1840 CAE HKD A 10 -20.892 18.897 15.678 1.00 -0.05 C HETATM 1841 CAB HKD A 10 -21.799 19.763 16.365 1.00 -0.12 C HETATM 1842 H6 HKD A 10 -21.668 19.956 17.429 1.00 0.02 H HETATM 1843 H7 HKD A 10 -22.621 20.230 15.824 1.00 0.02 H HETATM 1844 H5 HKD A 10 -22.016 19.224 13.935 1.00 0.05 H HETATM 1845 H2 HKD A 10 -18.000 17.799 14.537 1.00 0.10 H HETATM 1846 H1 HKD A 10 -18.255 17.018 16.777 1.00 0.09 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 403 401 402 1817 CONECT 509 510 519 520 521 CONECT 519 509 CONECT 520 509 CONECT 521 509 CONECT 587 585 1818 CONECT 856 855 1818 CONECT 857 855 1817 CONECT 985 983 1817 CONECT 990 989 1817 CONECT 1817 403 857 985 990 CONECT 1818 587 856 CONECT 1826 1827 CONECT 1827 1826 1828 1829 CONECT 1828 1827 CONECT 1829 1827 1830 1840 CONECT 1830 1829 1831 1846 CONECT 1831 1830 1832 1834 1845 CONECT 1832 1831 1833 CONECT 1833 1832 CONECT 1834 1831 1835 1836 CONECT 1835 1834 CONECT 1836 1834 1837 1839 CONECT 1837 1836 1838 CONECT 1838 1837 CONECT 1839 1836 1840 1844 CONECT 1840 1829 1839 1841 CONECT 1841 1840 1842 1843 CONECT 1842 1841 CONECT 1843 1841 CONECT 1844 1839 CONECT 1845 1831 CONECT 1846 1830 MASTER 0 0 0 0 0 0 0 0 1844 2 37 15 END
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Related entries of code: 6e0q
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4avg
RCSB PDB
PDBbind
204aa, >4AVG_1|Chains... at 97%
4awf
RCSB PDB
PDBbind
204aa, >4AWF_1|Chains... at 97%
4awg
RCSB PDB
PDBbind
204aa, >4AWG_1|Chains... at 97%
4awm
RCSB PDB
PDBbind
192aa, >4AWM_1|Chain... at 96%
4e5f
RCSB PDB
PDBbind
187aa, >4E5F_1|Chains... at 91%
4e5g
RCSB PDB
PDBbind
187aa, >4E5G_1|Chains... at 91%
4e5h
RCSB PDB
PDBbind
187aa, >4E5H_1|Chains... at 91%
4e5i
RCSB PDB
PDBbind
187aa, >4E5I_1|Chains... at 91%
4e5j
RCSB PDB
PDBbind
187aa, >4E5J_1|Chains... at 91%
4kil
RCSB PDB
PDBbind
213aa, >4KIL_1|Chain... at 98%
4ln7
RCSB PDB
PDBbind
209aa, >4LN7_1|Chain... at 100%
4m4q
RCSB PDB
PDBbind
241aa, >4M4Q_1|Chain... *
4m5o
RCSB PDB
PDBbind
241aa, >4M5O_1|Chain... at 100%
4m5r
RCSB PDB
PDBbind
241aa, >4M5R_1|Chain... at 100%
4m5u
RCSB PDB
PDBbind
241aa, >4M5U_1|Chain... at 100%
4mk1
RCSB PDB
PDBbind
241aa, >4MK1_1|Chain... at 100%
4mk2
RCSB PDB
PDBbind
241aa, >4MK2_1|Chain... at 100%
4mk5
RCSB PDB
PDBbind
241aa, >4MK5_1|Chain... at 100%
4w9s
RCSB PDB
PDBbind
241aa, >4W9S_1|Chain... at 100%
5cgv
RCSB PDB
PDBbind
187aa, >5CGV_1|Chain... at 94%
5ega
RCSB PDB
PDBbind
187aa, >5EGA_1|Chain... at 94%
5w44
RCSB PDB
PDBbind
178aa, >5W44_1|Chain... at 98%
5w73
RCSB PDB
PDBbind
197aa, >5W73_1|Chain... at 93%
5w7u
RCSB PDB
PDBbind
197aa, >5W7U_1|Chain... at 93%
5w92
RCSB PDB
PDBbind
197aa, >5W92_1|Chain... at 93%
5w9g
RCSB PDB
PDBbind
197aa, >5W9G_1|Chain... at 93%
5wa7
RCSB PDB
PDBbind
197aa, >5WA7_1|Chain... at 93%
5wap
RCSB PDB
PDBbind
197aa, >5WAP_1|Chain... at 93%
5wb3
RCSB PDB
PDBbind
197aa, >5WB3_1|Chain... at 93%
5wdc
RCSB PDB
PDBbind
197aa, >5WDC_1|Chain... at 93%
5wdw
RCSB PDB
PDBbind
197aa, >5WDW_1|Chain... at 93%
5we9
RCSB PDB
PDBbind
187aa, >5WE9_1|Chain... at 94%
5web
RCSB PDB
PDBbind
197aa, >5WEB_1|Chain... at 93%
5wef
RCSB PDB
PDBbind
187aa, >5WEF_1|Chain... at 93%
5wei
RCSB PDB
PDBbind
197aa, >5WEI_1|Chain... at 92%
5wf3
RCSB PDB
PDBbind
197aa, >5WF3_1|Chain... at 92%
5wfm
RCSB PDB
PDBbind
197aa, >5WFM_1|Chain... at 92%
5wfw
RCSB PDB
PDBbind
197aa, >5WFW_1|Chain... at 92%
5wfz
RCSB PDB
PDBbind
197aa, >5WFZ_1|Chain... at 92%
5wg9
RCSB PDB
PDBbind
197aa, >5WG9_1|Chain... at 92%
6dcy
RCSB PDB
PDBbind
192aa, >6DCY_1|Chain... at 96%
6dcz
RCSB PDB
PDBbind
192aa, >6DCZ_1|Chain... at 96%
6dzq
RCSB PDB
PDBbind
192aa, >6DZQ_1|Chain... at 96%
6nem
RCSB PDB
PDBbind
241aa, >6NEM_1|Chain... at 100%
6nel
RCSB PDB
PDBbind
241aa, >6NEL_1|Chain... at 100%
6e6w
RCSB PDB
PDBbind
192aa, >6E6W_1|Chain... at 96%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
6e4c
RCSB PDB
PDBbind
192aa, >6E4C_1|Chain... at 96%
6e3p
RCSB PDB
PDBbind
192aa, >6E3P_1|Chain... at 96%
6e3n
RCSB PDB
PDBbind
192aa, >6E3N_1|Chain... at 96%
6e3o
RCSB PDB
PDBbind
192aa, >6E3O_1|Chain... at 96%
6e3m
RCSB PDB
PDBbind
192aa, >6E3M_1|Chain... at 96%
5wa6
RCSB PDB
PDBbind
197aa, >5WA6_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6e0q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
HKD
EC.Number
E.C.-.-.-.-
Resolution
2.35(Å)
Affinity (Kd/Ki/IC50)
IC50=8.0nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 10206-10217
Ligand Properties
Formula
C
9
H
8
O
5
Molecular Weight
196.157
Exact Mass
196.037
No. of atoms
22
No. of bonds
22
Polar Surface Area
94.83
LOGP Value
0.90 (
Computed with XLOGP3
)
-0.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 1
Canonical SMILES
OC(=O)C1=C[C@@H](O)C(=O)C(=CC1=C)O
InChI String
InChI=1S/C9H8O5/c1-4-2-6(10)8(12)7(11)3-5(4)9(13)14/h2-3,7,10-11H,1H2,(H,13,14)/t7-/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):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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