Browse entries in the PDBbind-CN Database
HEADER 2GJ5_COMPLEX COMPND 2GJ5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 161 ILE VAL THR GLN THR MET LYS GLY LEU ASP ILE GLN LYS SEQRES 2 A 161 VAL ALA GLY THR TRP TYR SER LEU ALA MET ALA ALA SER SEQRES 3 A 161 ASP ILE SER LEU LEU ASP ALA GLN SER ALA PRO LEU ARG SEQRES 4 A 161 VAL TYR VAL GLU GLU LEU LYS PRO THR PRO GLU GLY ASP SEQRES 5 A 161 LEU GLU ILE LEU LEU GLN LYS TRP GLU ASN GLY GLU CYS SEQRES 6 A 161 ALA GLN LYS LYS ILE ILE ALA GLU LYS THR LYS ILE PRO SEQRES 7 A 161 ALA VAL PHE LYS ILE ASP ALA LEU ASN GLU ASN LYS VAL SEQRES 8 A 161 LEU VAL LEU ASP THR ASP TYR LYS LYS TYR LEU LEU PHE SEQRES 9 A 161 CYS MET GLU ASN SER ALA GLU PRO GLU GLN SER LEU ALA SEQRES 10 A 161 CYS GLN CYS LEU VAL ARG THR PRO GLU VAL ASP ASP GLU SEQRES 11 A 161 ALA LEU GLU LYS PHE ASP LYS ALA LEU LYS ALA LEU PRO SEQRES 12 A 161 MET HIS ILE ARG LEU SER PHE ASN PRO THR GLN LEU GLU SEQRES 13 A 161 GLU GLN CYS HIS ILE HET VD A 3 76 SSBOND 1 CYS A 106 CYS A 119 SSBOND 2 CYS A 66 CYS A 160 ATOM 1 N ILE A 2 -19.715 12.441 20.303 1.00 80.03 N ATOM 2 CA ILE A 2 -19.928 12.759 21.710 1.00 73.69 C ATOM 3 C ILE A 2 -19.500 14.203 22.012 1.00 66.55 C ATOM 4 O ILE A 2 -20.091 14.872 22.862 1.00 64.79 O ATOM 5 CB ILE A 2 -19.150 11.754 22.609 1.00113.98 C ATOM 6 CG1 ILE A 2 -19.862 11.572 23.950 1.00114.66 C ATOM 7 CG2 ILE A 2 -17.723 12.231 22.821 1.00113.74 C ATOM 8 CD1 ILE A 2 -19.862 12.791 24.821 1.00 61.38 C ATOM 9 HA ILE A 2 -20.992 12.671 21.930 1.00 0.00 H ATOM 10 HB ILE A 2 -19.120 10.788 22.105 1.00 0.00 H ATOM 11 HG12 ILE A 2 -20.897 11.294 23.752 1.00 0.00 H ATOM 12 HG13 ILE A 2 -19.368 10.765 24.492 1.00 0.00 H ATOM 13 HD11 ILE A 2 -18.834 13.078 25.042 1.00 0.00 H ATOM 14 HD12 ILE A 2 -20.364 13.607 24.302 1.00 0.00 H ATOM 15 HD13 ILE A 2 -20.388 12.572 25.750 1.00 0.00 H ATOM 16 HG21 ILE A 2 -17.221 12.310 21.857 1.00 0.00 H ATOM 17 HG22 ILE A 2 -17.736 13.207 23.306 1.00 0.00 H ATOM 18 HG23 ILE A 2 -17.193 11.517 23.452 1.00 0.00 H ATOM 19 HN3 ILE A 2 -18.706 12.548 20.074 1.00 0.00 H ATOM 20 HN2 ILE A 2 -20.276 13.088 19.714 1.00 0.00 H ATOM 21 HN1 ILE A 2 -20.011 11.461 20.122 1.00 0.00 H ATOM 22 N VAL A 3 -18.480 14.679 21.303 1.00 72.30 N ATOM 23 CA VAL A 3 -17.981 16.040 21.483 1.00 67.44 C ATOM 24 C VAL A 3 -18.513 16.945 20.373 1.00 67.88 C ATOM 25 O VAL A 3 -18.383 16.632 19.188 1.00 65.54 O ATOM 26 CB VAL A 3 -16.430 16.095 21.450 1.00 48.90 C ATOM 27 CG1 VAL A 3 -15.951 17.536 21.632 1.00 46.79 C ATOM 28 CG2 VAL A 3 -15.852 15.203 22.535 1.00 48.17 C ATOM 29 HA VAL A 3 -18.328 16.380 22.459 1.00 0.00 H ATOM 30 HB VAL A 3 -16.084 15.733 20.482 1.00 0.00 H ATOM 31 HG11 VAL A 3 -16.349 18.154 20.827 1.00 0.00 H ATOM 32 HG12 VAL A 3 -16.303 17.916 22.591 1.00 0.00 H ATOM 33 HG13 VAL A 3 -14.862 17.561 21.607 1.00 0.00 H ATOM 34 HG21 VAL A 3 -16.202 15.545 23.509 1.00 0.00 H ATOM 35 HG22 VAL A 3 -16.177 14.176 22.371 1.00 0.00 H ATOM 36 HG23 VAL A 3 -14.764 15.251 22.501 1.00 0.00 H ATOM 37 H VAL A 3 -18.024 14.064 20.599 1.00 0.00 H ATOM 38 N THR A 4 -19.112 18.066 20.767 1.00 47.13 N ATOM 39 CA THR A 4 -19.664 19.025 19.812 1.00 48.57 C ATOM 40 C THR A 4 -19.162 20.445 20.091 1.00 45.73 C ATOM 41 O THR A 4 -19.943 21.389 20.245 1.00 47.18 O ATOM 42 CB THR A 4 -21.198 19.009 19.859 1.00 78.80 C ATOM 43 OG1 THR A 4 -21.632 19.007 21.228 1.00 82.68 O ATOM 44 CG2 THR A 4 -21.738 17.773 19.138 1.00 83.26 C ATOM 45 HA THR A 4 -19.327 18.726 18.819 1.00 0.00 H ATOM 46 HB THR A 4 -21.581 19.898 19.357 1.00 0.00 H ATOM 47 HG1 THR A 4 -21.278 18.203 21.684 1.00 0.00 H ATOM 48 HG23 THR A 4 -21.403 17.784 18.101 1.00 0.00 H ATOM 49 HG21 THR A 4 -21.367 16.875 19.632 1.00 0.00 H ATOM 50 HG22 THR A 4 -22.827 17.782 19.170 1.00 0.00 H ATOM 51 H THR A 4 -19.190 18.266 21.785 1.00 0.00 H ATOM 52 N GLN A 5 -17.843 20.580 20.148 1.00 59.53 N ATOM 53 CA GLN A 5 -17.209 21.859 20.409 1.00 56.73 C ATOM 54 C GLN A 5 -16.069 22.101 19.427 1.00 51.87 C ATOM 55 O GLN A 5 -15.110 22.796 19.754 1.00 51.47 O ATOM 56 CB GLN A 5 -16.647 21.875 21.825 1.00 45.61 C ATOM 57 CG GLN A 5 -17.677 21.756 22.933 1.00 52.78 C ATOM 58 CD GLN A 5 -17.046 21.352 24.254 1.00 55.21 C ATOM 59 OE1 GLN A 5 -16.928 20.164 24.562 1.00 56.78 O ATOM 60 NE2 GLN A 5 -16.615 22.339 25.030 1.00 56.30 N ATOM 61 HA GLN A 5 -17.958 22.643 20.293 1.00 0.00 H ATOM 62 HB2 GLN A 5 -15.951 21.042 21.921 1.00 0.00 H ATOM 63 HB3 GLN A 5 -16.110 22.813 21.964 1.00 0.00 H ATOM 64 HG2 GLN A 5 -18.172 22.719 23.059 1.00 0.00 H ATOM 65 HG3 GLN A 5 -18.414 21.004 22.650 1.00 0.00 H ATOM 66 HE22 GLN A 5 -16.736 23.327 24.730 1.00 0.00 H ATOM 67 HE21 GLN A 5 -16.157 22.124 25.938 1.00 0.00 H ATOM 68 H GLN A 5 -17.245 19.742 20.001 1.00 0.00 H ATOM 69 N THR A 6 -16.155 21.530 18.230 1.00 41.87 N ATOM 70 CA THR A 6 -15.084 21.720 17.258 1.00 43.68 C ATOM 71 C THR A 6 -14.884 23.192 16.980 1.00 41.93 C ATOM 72 O THR A 6 -15.791 24.000 17.170 1.00 41.15 O ATOM 73 CB THR A 6 -15.379 21.047 15.933 1.00 40.08 C ATOM 74 OG1 THR A 6 -16.579 21.601 15.383 1.00 45.12 O ATOM 75 CG2 THR A 6 -15.531 19.543 16.122 1.00 43.22 C ATOM 76 HA THR A 6 -14.192 21.273 17.697 1.00 0.00 H ATOM 77 HB THR A 6 -14.550 21.221 15.247 1.00 0.00 H ATOM 78 HG1 THR A 6 -16.458 22.574 15.244 1.00 0.00 H ATOM 79 HG23 THR A 6 -14.611 19.136 16.541 1.00 0.00 H ATOM 80 HG21 THR A 6 -16.360 19.345 16.802 1.00 0.00 H ATOM 81 HG22 THR A 6 -15.731 19.075 15.158 1.00 0.00 H ATOM 82 H THR A 6 -16.983 20.950 17.987 1.00 0.00 H ATOM 83 N MET A 7 -13.687 23.529 16.521 1.00 39.88 N ATOM 84 CA MET A 7 -13.337 24.902 16.209 1.00 39.18 C ATOM 85 C MET A 7 -13.679 25.280 14.773 1.00 37.74 C ATOM 86 O MET A 7 -13.525 24.482 13.851 1.00 39.91 O ATOM 87 CB MET A 7 -11.845 25.117 16.464 1.00 44.92 C ATOM 88 CG MET A 7 -11.169 26.008 15.447 1.00 43.06 C ATOM 89 SD MET A 7 -9.471 26.360 15.864 1.00 46.45 S ATOM 90 CE MET A 7 -9.539 28.137 16.057 1.00 43.75 C ATOM 91 HA MET A 7 -13.928 25.548 16.858 1.00 0.00 H ATOM 92 HB2 MET A 7 -11.727 25.570 17.449 1.00 0.00 H ATOM 93 HB3 MET A 7 -11.351 24.145 16.451 1.00 0.00 H ATOM 94 HG2 MET A 7 -11.716 26.949 15.388 1.00 0.00 H ATOM 95 HG3 MET A 7 -11.195 25.513 14.476 1.00 0.00 H ATOM 96 HE1 MET A 7 -9.863 28.591 15.120 1.00 0.00 H ATOM 97 HE2 MET A 7 -10.246 28.389 16.848 1.00 0.00 H ATOM 98 HE3 MET A 7 -8.549 28.511 16.320 1.00 0.00 H ATOM 99 H MET A 7 -12.975 22.784 16.380 1.00 0.00 H ATOM 100 N LYS A 8 -14.145 26.509 14.596 1.00 36.88 N ATOM 101 CA LYS A 8 -14.490 27.025 13.280 1.00 39.65 C ATOM 102 C LYS A 8 -13.327 27.808 12.693 1.00 43.68 C ATOM 103 O LYS A 8 -12.563 28.445 13.419 1.00 45.84 O ATOM 104 CB LYS A 8 -15.698 27.961 13.360 1.00 40.21 C ATOM 105 CG LYS A 8 -17.044 27.289 13.524 1.00 41.70 C ATOM 106 CD LYS A 8 -18.158 28.334 13.420 1.00 41.24 C ATOM 107 CE LYS A 8 -19.540 27.727 13.562 1.00 39.60 C ATOM 108 NZ LYS A 8 -20.583 28.771 13.487 1.00 34.00 N ATOM 109 HA LYS A 8 -14.726 26.169 12.648 1.00 0.00 H ATOM 110 HB2 LYS A 8 -15.550 28.626 14.211 1.00 0.00 H ATOM 111 HB3 LYS A 8 -15.727 28.549 12.442 1.00 0.00 H ATOM 112 HG2 LYS A 8 -17.174 26.541 12.742 1.00 0.00 H ATOM 113 HG3 LYS A 8 -17.091 26.804 14.499 1.00 0.00 H ATOM 114 HD2 LYS A 8 -18.018 29.074 14.208 1.00 0.00 H ATOM 115 HD3 LYS A 8 -18.089 28.823 12.448 1.00 0.00 H ATOM 116 HE2 LYS A 8 -19.611 27.220 14.524 1.00 0.00 H ATOM 117 HE3 LYS A 8 -19.698 27.006 12.760 1.00 0.00 H ATOM 118 HZ1 LYS A 8 -20.439 29.459 14.253 1.00 0.00 H ATOM 119 HZ2 LYS A 8 -20.522 29.255 12.569 1.00 0.00 H ATOM 120 HZ3 LYS A 8 -21.520 28.331 13.587 1.00 0.00 H ATOM 121 H LYS A 8 -14.268 27.124 15.425 1.00 0.00 H ATOM 122 N GLY A 9 -13.212 27.756 11.368 1.00 42.94 N ATOM 123 CA GLY A 9 -12.174 28.483 10.659 1.00 39.40 C ATOM 124 C GLY A 9 -10.753 28.037 10.921 1.00 36.97 C ATOM 125 O GLY A 9 -9.822 28.821 10.749 1.00 36.12 O ATOM 126 HA3 GLY A 9 -12.251 29.533 10.940 1.00 0.00 H ATOM 127 HA2 GLY A 9 -12.364 28.379 9.591 1.00 0.00 H ATOM 128 H GLY A 9 -13.885 27.178 10.825 1.00 0.00 H ATOM 129 N LEU A 10 -10.590 26.776 11.319 1.00 33.70 N ATOM 130 CA LEU A 10 -9.284 26.213 11.611 1.00 36.70 C ATOM 131 C LEU A 10 -8.339 26.233 10.426 1.00 41.16 C ATOM 132 O LEU A 10 -8.678 25.751 9.348 1.00 43.59 O ATOM 133 CB LEU A 10 -9.408 24.760 12.089 1.00 35.77 C ATOM 134 CG LEU A 10 -8.056 24.045 12.319 1.00 33.53 C ATOM 135 CD1 LEU A 10 -7.274 24.807 13.390 1.00 34.92 C ATOM 136 CD2 LEU A 10 -8.248 22.578 12.728 1.00 31.27 C ATOM 137 HA LEU A 10 -8.868 26.849 12.393 1.00 0.00 H ATOM 138 HB2 LEU A 10 -9.960 24.756 13.029 1.00 0.00 H ATOM 139 HB3 LEU A 10 -9.966 24.200 11.339 1.00 0.00 H ATOM 140 HG LEU A 10 -7.498 24.039 11.383 1.00 0.00 H ATOM 141 HD21 LEU A 10 -8.821 22.532 13.654 1.00 0.00 H ATOM 142 HD22 LEU A 10 -8.785 22.050 11.940 1.00 0.00 H ATOM 143 HD23 LEU A 10 -7.273 22.114 12.879 1.00 0.00 H ATOM 144 HD11 LEU A 10 -7.100 25.829 13.053 1.00 0.00 H ATOM 145 HD12 LEU A 10 -7.848 24.821 14.316 1.00 0.00 H ATOM 146 HD13 LEU A 10 -6.318 24.312 13.561 1.00 0.00 H ATOM 147 H LEU A 10 -11.430 26.172 11.425 1.00 0.00 H ATOM 148 N ASP A 11 -7.146 26.783 10.643 1.00 48.98 N ATOM 149 CA ASP A 11 -6.110 26.817 9.617 1.00 46.55 C ATOM 150 C ASP A 11 -5.053 25.826 10.114 1.00 42.25 C ATOM 151 O ASP A 11 -4.053 26.194 10.725 1.00 44.66 O ATOM 152 CB ASP A 11 -5.503 28.218 9.470 1.00 43.98 C ATOM 153 CG ASP A 11 -4.456 28.285 8.358 1.00 47.52 C ATOM 154 OD1 ASP A 11 -4.031 27.215 7.871 1.00 48.40 O ATOM 155 OD2 ASP A 11 -4.053 29.401 7.970 1.00 48.01 O ATOM 156 HA ASP A 11 -6.506 26.561 8.634 1.00 0.00 H ATOM 157 HB2 ASP A 11 -6.302 28.924 9.242 1.00 0.00 H ATOM 158 HB3 ASP A 11 -5.032 28.496 10.413 1.00 0.00 H ATOM 159 H ASP A 11 -6.947 27.202 11.574 1.00 0.00 H ATOM 160 N ILE A 12 -5.322 24.557 9.849 1.00 33.07 N ATOM 161 CA ILE A 12 -4.483 23.444 10.247 1.00 37.39 C ATOM 162 C ILE A 12 -2.973 23.663 10.072 1.00 39.80 C ATOM 163 O ILE A 12 -2.181 23.271 10.930 1.00 39.61 O ATOM 164 CB ILE A 12 -4.946 22.176 9.494 1.00 38.31 C ATOM 165 CG1 ILE A 12 -4.690 20.926 10.352 1.00 43.12 C ATOM 166 CG2 ILE A 12 -4.250 22.079 8.152 1.00 38.89 C ATOM 167 CD1 ILE A 12 -4.899 21.129 11.832 1.00 57.00 C ATOM 168 HA ILE A 12 -4.612 23.333 11.324 1.00 0.00 H ATOM 169 HB ILE A 12 -6.018 22.242 9.309 1.00 0.00 H ATOM 170 HG12 ILE A 12 -5.366 20.139 10.017 1.00 0.00 H ATOM 171 HG13 ILE A 12 -3.659 20.610 10.194 1.00 0.00 H ATOM 172 HD11 ILE A 12 -4.222 21.904 12.190 1.00 0.00 H ATOM 173 HD12 ILE A 12 -5.930 21.433 12.014 1.00 0.00 H ATOM 174 HD13 ILE A 12 -4.696 20.196 12.358 1.00 0.00 H ATOM 175 HG21 ILE A 12 -4.492 22.958 7.554 1.00 0.00 H ATOM 176 HG22 ILE A 12 -3.172 22.029 8.306 1.00 0.00 H ATOM 177 HG23 ILE A 12 -4.586 21.181 7.634 1.00 0.00 H ATOM 178 H ILE A 12 -6.192 24.345 9.321 1.00 0.00 H ATOM 179 N GLN A 13 -2.569 24.289 8.975 1.00 49.88 N ATOM 180 CA GLN A 13 -1.153 24.530 8.752 1.00 51.90 C ATOM 181 C GLN A 13 -0.528 25.272 9.928 1.00 49.19 C ATOM 182 O GLN A 13 0.625 25.025 10.291 1.00 52.12 O ATOM 183 CB GLN A 13 -0.943 25.349 7.478 1.00 41.96 C ATOM 184 CG GLN A 13 -1.294 24.615 6.202 1.00 44.16 C ATOM 185 CD GLN A 13 -0.529 23.315 6.054 1.00 49.25 C ATOM 186 OE1 GLN A 13 0.622 23.213 6.473 1.00 49.17 O ATOM 187 NE2 GLN A 13 -1.162 22.317 5.445 1.00 52.25 N ATOM 188 HA GLN A 13 -0.669 23.559 8.648 1.00 0.00 H ATOM 189 HB2 GLN A 13 -1.564 26.243 7.540 1.00 0.00 H ATOM 190 HB3 GLN A 13 0.106 25.640 7.428 1.00 0.00 H ATOM 191 HG2 GLN A 13 -2.361 24.395 6.207 1.00 0.00 H ATOM 192 HG3 GLN A 13 -1.061 25.257 5.353 1.00 0.00 H ATOM 193 HE22 GLN A 13 -2.137 22.449 5.107 1.00 0.00 H ATOM 194 HE21 GLN A 13 -0.683 21.404 5.307 1.00 0.00 H ATOM 195 H GLN A 13 -3.267 24.608 8.273 1.00 0.00 H ATOM 196 N LYS A 14 -1.305 26.172 10.524 1.00 39.73 N ATOM 197 CA LYS A 14 -0.844 26.991 11.636 1.00 36.48 C ATOM 198 C LYS A 14 -0.692 26.306 12.998 1.00 31.08 C ATOM 199 O LYS A 14 -0.382 26.965 13.980 1.00 36.33 O ATOM 200 CB LYS A 14 -1.746 28.219 11.769 1.00 38.77 C ATOM 201 CG LYS A 14 -1.713 29.150 10.552 1.00 44.15 C ATOM 202 CD LYS A 14 -2.563 30.406 10.788 1.00 47.08 C ATOM 203 CE LYS A 14 -2.516 31.348 9.588 1.00 51.56 C ATOM 204 NZ LYS A 14 -3.475 32.503 9.696 1.00 55.21 N ATOM 205 HA LYS A 14 0.179 27.253 11.367 1.00 0.00 H ATOM 206 HB2 LYS A 14 -2.771 27.878 11.913 1.00 0.00 H ATOM 207 HB3 LYS A 14 -1.427 28.786 12.644 1.00 0.00 H ATOM 208 HG2 LYS A 14 -0.682 29.449 10.361 1.00 0.00 H ATOM 209 HG3 LYS A 14 -2.101 28.616 9.685 1.00 0.00 H ATOM 210 HD2 LYS A 14 -3.596 30.107 10.963 1.00 0.00 H ATOM 211 HD3 LYS A 14 -2.184 30.930 11.665 1.00 0.00 H ATOM 212 HE2 LYS A 14 -2.761 30.778 8.692 1.00 0.00 H ATOM 213 HE3 LYS A 14 -1.505 31.745 9.500 1.00 0.00 H ATOM 214 HZ1 LYS A 14 -4.447 32.140 9.770 1.00 0.00 H ATOM 215 HZ2 LYS A 14 -3.247 33.063 10.542 1.00 0.00 H ATOM 216 HZ3 LYS A 14 -3.391 33.102 8.850 1.00 0.00 H ATOM 217 H LYS A 14 -2.280 26.296 10.183 1.00 0.00 H ATOM 218 N VAL A 15 -0.898 24.995 13.067 1.00 44.93 N ATOM 219 CA VAL A 15 -0.730 24.271 14.336 1.00 44.54 C ATOM 220 C VAL A 15 0.563 23.453 14.238 1.00 48.66 C ATOM 221 O VAL A 15 0.874 22.635 15.104 1.00 56.14 O ATOM 222 CB VAL A 15 -1.925 23.293 14.628 1.00 19.25 C ATOM 223 CG1 VAL A 15 -3.266 24.048 14.548 1.00 17.45 C ATOM 224 CG2 VAL A 15 -1.903 22.130 13.667 1.00 14.64 C ATOM 225 HA VAL A 15 -0.696 24.998 15.148 1.00 0.00 H ATOM 226 HB VAL A 15 -1.815 22.899 15.638 1.00 0.00 H ATOM 227 HG11 VAL A 15 -3.274 24.851 15.285 1.00 0.00 H ATOM 228 HG12 VAL A 15 -3.386 24.469 13.550 1.00 0.00 H ATOM 229 HG13 VAL A 15 -4.083 23.357 14.753 1.00 0.00 H ATOM 230 HG21 VAL A 15 -1.991 22.502 12.646 1.00 0.00 H ATOM 231 HG22 VAL A 15 -0.965 21.587 13.778 1.00 0.00 H ATOM 232 HG23 VAL A 15 -2.738 21.464 13.885 1.00 0.00 H ATOM 233 H VAL A 15 -1.182 24.474 12.213 1.00 0.00 H ATOM 234 N ALA A 16 1.315 23.706 13.172 1.00 32.73 N ATOM 235 CA ALA A 16 2.564 22.997 12.896 1.00 32.50 C ATOM 236 C ALA A 16 3.660 23.201 13.939 1.00 35.23 C ATOM 237 O ALA A 16 3.779 24.279 14.538 1.00 32.90 O ATOM 238 CB ALA A 16 3.081 23.395 11.525 1.00 27.63 C ATOM 239 HA ALA A 16 2.318 21.936 12.933 1.00 0.00 H ATOM 240 HB1 ALA A 16 2.340 23.134 10.769 1.00 0.00 H ATOM 241 HB2 ALA A 16 3.261 24.470 11.504 1.00 0.00 H ATOM 242 HB3 ALA A 16 4.012 22.866 11.321 1.00 0.00 H ATOM 243 H ALA A 16 1.002 24.440 12.505 1.00 0.00 H ATOM 244 N GLY A 17 4.447 22.145 14.154 1.00 40.57 N ATOM 245 CA GLY A 17 5.548 22.224 15.095 1.00 41.22 C ATOM 246 C GLY A 17 5.400 21.629 16.483 1.00 40.04 C ATOM 247 O GLY A 17 4.564 20.750 16.744 1.00 37.11 O ATOM 248 HA3 GLY A 17 5.774 23.282 15.228 1.00 0.00 H ATOM 249 HA2 GLY A 17 6.399 21.728 14.628 1.00 0.00 H ATOM 250 H GLY A 17 4.269 21.257 13.642 1.00 0.00 H ATOM 251 N THR A 18 6.224 22.156 17.382 1.00 37.21 N ATOM 252 CA THR A 18 6.304 21.717 18.775 1.00 36.03 C ATOM 253 C THR A 18 5.087 21.982 19.663 1.00 34.06 C ATOM 254 O THR A 18 4.532 23.077 19.652 1.00 33.60 O ATOM 255 CB THR A 18 7.542 22.366 19.457 1.00 37.60 C ATOM 256 OG1 THR A 18 8.715 22.076 18.689 1.00 37.75 O ATOM 257 CG2 THR A 18 7.723 21.838 20.876 1.00 38.43 C ATOM 258 HA THR A 18 6.370 20.632 18.694 1.00 0.00 H ATOM 259 HB THR A 18 7.384 23.443 19.506 1.00 0.00 H ATOM 260 HG1 THR A 18 9.503 22.489 19.123 1.00 0.00 H ATOM 261 HG23 THR A 18 6.830 22.059 21.461 1.00 0.00 H ATOM 262 HG21 THR A 18 7.881 20.760 20.844 1.00 0.00 H ATOM 263 HG22 THR A 18 8.587 22.319 21.334 1.00 0.00 H ATOM 264 H THR A 18 6.851 22.928 17.077 1.00 0.00 H ATOM 265 N TRP A 19 4.690 20.972 20.438 1.00 38.62 N ATOM 266 CA TRP A 19 3.576 21.095 21.390 1.00 36.24 C ATOM 267 C TRP A 19 3.854 20.251 22.637 1.00 32.76 C ATOM 268 O TRP A 19 4.537 19.235 22.565 1.00 28.43 O ATOM 269 CB TRP A 19 2.232 20.631 20.789 1.00 38.15 C ATOM 270 CG TRP A 19 1.586 21.597 19.830 1.00 32.73 C ATOM 271 CD1 TRP A 19 1.627 21.547 18.465 1.00 34.64 C ATOM 272 CD2 TRP A 19 0.830 22.771 20.164 1.00 28.28 C ATOM 273 NE1 TRP A 19 0.947 22.615 17.930 1.00 34.18 N ATOM 274 CE2 TRP A 19 0.449 23.383 18.948 1.00 29.33 C ATOM 275 CE3 TRP A 19 0.440 23.369 21.373 1.00 27.55 C ATOM 276 CZ2 TRP A 19 -0.307 24.567 18.908 1.00 29.27 C ATOM 277 CZ3 TRP A 19 -0.305 24.540 21.331 1.00 29.76 C ATOM 278 CH2 TRP A 19 -0.671 25.125 20.109 1.00 30.45 C ATOM 279 HA TRP A 19 3.499 22.153 21.641 1.00 0.00 H ATOM 280 HB2 TRP A 19 2.406 19.695 20.258 1.00 0.00 H ATOM 281 HB3 TRP A 19 1.538 20.457 21.611 1.00 0.00 H ATOM 282 HE1 TRP A 19 0.830 22.809 16.915 1.00 0.00 H ATOM 283 HD1 TRP A 19 2.127 20.772 17.884 1.00 0.00 H ATOM 284 HZ2 TRP A 19 -0.593 25.025 17.961 1.00 0.00 H ATOM 285 HH2 TRP A 19 -1.258 26.044 20.113 1.00 0.00 H ATOM 286 HZ3 TRP A 19 -0.611 25.013 22.264 1.00 0.00 H ATOM 287 HE3 TRP A 19 0.717 22.922 22.328 1.00 0.00 H ATOM 288 H TRP A 19 5.188 20.062 20.366 1.00 0.00 H ATOM 289 N TYR A 20 3.311 20.685 23.773 1.00 30.34 N ATOM 290 CA TYR A 20 3.457 19.979 25.036 1.00 33.83 C ATOM 291 C TYR A 20 2.083 19.547 25.548 1.00 30.35 C ATOM 292 O TYR A 20 1.124 20.316 25.483 1.00 36.98 O ATOM 293 CB TYR A 20 4.121 20.878 26.099 1.00 42.66 C ATOM 294 CG TYR A 20 5.595 21.160 25.883 1.00 44.08 C ATOM 295 CD1 TYR A 20 6.018 22.089 24.940 1.00 45.64 C ATOM 296 CD2 TYR A 20 6.568 20.478 26.620 1.00 44.66 C ATOM 297 CE1 TYR A 20 7.378 22.336 24.727 1.00 48.20 C ATOM 298 CE2 TYR A 20 7.930 20.713 26.416 1.00 47.44 C ATOM 299 CZ TYR A 20 8.327 21.643 25.465 1.00 48.77 C ATOM 300 OH TYR A 20 9.666 21.857 25.231 1.00 50.27 O ATOM 301 HA TYR A 20 4.088 19.107 24.863 1.00 0.00 H ATOM 302 HB3 TYR A 20 4.010 20.392 27.068 1.00 0.00 H ATOM 303 HB2 TYR A 20 3.594 21.832 26.110 1.00 0.00 H ATOM 304 HD2 TYR A 20 6.258 19.749 27.368 1.00 0.00 H ATOM 305 HE2 TYR A 20 8.675 20.171 26.999 1.00 0.00 H ATOM 306 HE1 TYR A 20 7.691 23.070 23.984 1.00 0.00 H ATOM 307 HD1 TYR A 20 5.277 22.635 24.356 1.00 0.00 H ATOM 308 HH TYR A 20 10.100 22.166 26.065 1.00 0.00 H ATOM 309 H TYR A 20 2.759 21.566 23.756 1.00 0.00 H ATOM 310 N SER A 21 1.997 18.318 26.055 1.00 26.27 N ATOM 311 CA SER A 21 0.749 17.781 26.618 1.00 23.72 C ATOM 312 C SER A 21 0.678 18.128 28.103 1.00 23.69 C ATOM 313 O SER A 21 1.005 17.311 28.955 1.00 26.44 O ATOM 314 CB SER A 21 0.694 16.262 26.448 1.00 18.12 C ATOM 315 OG SER A 21 0.597 15.897 25.079 1.00 30.09 O ATOM 316 HA SER A 21 -0.096 18.223 26.090 1.00 0.00 H ATOM 317 HB2 SER A 21 -0.175 15.876 26.981 1.00 0.00 H ATOM 318 HB3 SER A 21 1.600 15.825 26.869 1.00 0.00 H ATOM 319 HG SER A 21 0.563 14.910 25.003 1.00 0.00 H ATOM 320 H SER A 21 2.845 17.715 26.053 1.00 0.00 H ATOM 321 N LEU A 22 0.266 19.355 28.387 1.00 19.35 N ATOM 322 CA LEU A 22 0.145 19.871 29.747 1.00 22.77 C ATOM 323 C LEU A 22 -0.866 19.078 30.601 1.00 26.53 C ATOM 324 O LEU A 22 -0.580 18.700 31.738 1.00 26.35 O ATOM 325 CB LEU A 22 -0.262 21.342 29.680 1.00 22.28 C ATOM 326 CG LEU A 22 -0.364 22.118 30.983 1.00 22.97 C ATOM 327 CD1 LEU A 22 0.959 22.013 31.773 1.00 24.63 C ATOM 328 CD2 LEU A 22 -0.695 23.575 30.639 1.00 22.74 C ATOM 329 HA LEU A 22 1.114 19.761 30.234 1.00 0.00 H ATOM 330 HB2 LEU A 22 0.471 21.853 29.056 1.00 0.00 H ATOM 331 HB3 LEU A 22 -1.240 21.386 29.200 1.00 0.00 H ATOM 332 HG LEU A 22 -1.150 21.705 31.616 1.00 0.00 H ATOM 333 HD21 LEU A 22 0.097 23.988 30.014 1.00 0.00 H ATOM 334 HD22 LEU A 22 -1.642 23.614 30.101 1.00 0.00 H ATOM 335 HD23 LEU A 22 -0.774 24.155 31.558 1.00 0.00 H ATOM 336 HD11 LEU A 22 1.165 20.966 31.996 1.00 0.00 H ATOM 337 HD12 LEU A 22 1.772 22.425 31.175 1.00 0.00 H ATOM 338 HD13 LEU A 22 0.871 22.574 32.704 1.00 0.00 H ATOM 339 H LEU A 22 0.015 19.985 27.598 1.00 0.00 H ATOM 340 N ALA A 23 -2.051 18.848 30.049 1.00 26.75 N ATOM 341 CA ALA A 23 -3.063 18.072 30.753 1.00 21.30 C ATOM 342 C ALA A 23 -3.767 17.142 29.779 1.00 22.56 C ATOM 343 O ALA A 23 -3.736 17.323 28.565 1.00 27.39 O ATOM 344 CB ALA A 23 -4.088 18.982 31.436 1.00 20.68 C ATOM 345 HA ALA A 23 -2.565 17.486 31.525 1.00 0.00 H ATOM 346 HB1 ALA A 23 -3.580 19.624 32.156 1.00 0.00 H ATOM 347 HB2 ALA A 23 -4.583 19.598 30.685 1.00 0.00 H ATOM 348 HB3 ALA A 23 -4.828 18.370 31.952 1.00 0.00 H ATOM 349 H ALA A 23 -2.259 19.226 29.103 1.00 0.00 H ATOM 350 N MET A 24 -4.372 16.117 30.342 1.00 26.25 N ATOM 351 CA MET A 24 -5.121 15.154 29.570 1.00 23.83 C ATOM 352 C MET A 24 -6.249 14.600 30.426 1.00 24.89 C ATOM 353 O MET A 24 -6.200 14.624 31.662 1.00 32.23 O ATOM 354 CB MET A 24 -4.205 14.030 29.050 1.00 28.87 C ATOM 355 CG MET A 24 -3.136 13.527 30.013 1.00 34.31 C ATOM 356 SD MET A 24 -2.050 12.246 29.264 1.00 38.52 S ATOM 357 CE MET A 24 -0.684 13.196 28.673 1.00 37.14 C ATOM 358 HA MET A 24 -5.548 15.645 28.696 1.00 0.00 H ATOM 359 HB2 MET A 24 -4.837 13.183 28.784 1.00 0.00 H ATOM 360 HB3 MET A 24 -3.700 14.399 28.157 1.00 0.00 H ATOM 361 HG2 MET A 24 -3.627 13.100 30.887 1.00 0.00 H ATOM 362 HG3 MET A 24 -2.519 14.371 30.321 1.00 0.00 H ATOM 363 HE1 MET A 24 -1.039 13.927 27.946 1.00 0.00 H ATOM 364 HE2 MET A 24 -0.213 13.713 29.510 1.00 0.00 H ATOM 365 HE3 MET A 24 0.040 12.533 28.200 1.00 0.00 H ATOM 366 H MET A 24 -4.308 15.998 31.373 1.00 0.00 H ATOM 367 N ALA A 25 -7.288 14.128 29.754 1.00 25.99 N ATOM 368 CA ALA A 25 -8.416 13.564 30.455 1.00 22.51 C ATOM 369 C ALA A 25 -9.078 12.526 29.563 1.00 25.61 C ATOM 370 O ALA A 25 -8.913 12.542 28.332 1.00 30.89 O ATOM 371 CB ALA A 25 -9.390 14.664 30.821 1.00 23.17 C ATOM 372 HA ALA A 25 -8.087 13.082 31.376 1.00 0.00 H ATOM 373 HB1 ALA A 25 -8.891 15.391 31.462 1.00 0.00 H ATOM 374 HB2 ALA A 25 -9.737 15.157 29.913 1.00 0.00 H ATOM 375 HB3 ALA A 25 -10.240 14.234 31.350 1.00 0.00 H ATOM 376 H ALA A 25 -7.291 14.164 28.715 1.00 0.00 H ATOM 377 N ALA A 26 -9.809 11.613 30.200 1.00 23.12 N ATOM 378 CA ALA A 26 -10.518 10.574 29.503 1.00 25.16 C ATOM 379 C ALA A 26 -11.843 10.249 30.216 1.00 31.68 C ATOM 380 O ALA A 26 -12.092 10.685 31.345 1.00 37.33 O ATOM 381 CB ALA A 26 -9.652 9.339 29.405 1.00 28.86 C ATOM 382 HA ALA A 26 -10.752 10.922 28.497 1.00 0.00 H ATOM 383 HB1 ALA A 26 -8.738 9.580 28.861 1.00 0.00 H ATOM 384 HB2 ALA A 26 -9.399 8.993 30.407 1.00 0.00 H ATOM 385 HB3 ALA A 26 -10.196 8.556 28.876 1.00 0.00 H ATOM 386 H ALA A 26 -9.869 11.653 31.237 1.00 0.00 H ATOM 387 N SER A 27 -12.688 9.484 29.529 1.00 33.40 N ATOM 388 CA SER A 27 -13.981 9.074 30.052 1.00 35.94 C ATOM 389 C SER A 27 -13.844 7.832 30.933 1.00 39.13 C ATOM 390 O SER A 27 -14.794 7.423 31.578 1.00 44.55 O ATOM 391 CB SER A 27 -14.942 8.792 28.894 1.00 31.71 C ATOM 392 OG SER A 27 -14.430 7.779 28.045 1.00 32.59 O ATOM 393 HA SER A 27 -14.379 9.884 30.664 1.00 0.00 H ATOM 394 HB2 SER A 27 -15.082 9.705 28.316 1.00 0.00 H ATOM 395 HB3 SER A 27 -15.902 8.468 29.297 1.00 0.00 H ATOM 396 HG SER A 27 -15.068 7.616 27.306 1.00 0.00 H ATOM 397 H SER A 27 -12.412 9.166 28.578 1.00 0.00 H ATOM 398 N ASP A 28 -12.658 7.236 30.956 1.00 42.45 N ATOM 399 CA ASP A 28 -12.426 6.054 31.772 1.00 40.53 C ATOM 400 C ASP A 28 -11.026 6.058 32.389 1.00 39.50 C ATOM 401 O ASP A 28 -10.025 6.250 31.684 1.00 39.80 O ATOM 402 CB ASP A 28 -12.611 4.786 30.934 1.00 93.60 C ATOM 403 CG ASP A 28 -12.688 3.527 31.785 1.00102.70 C ATOM 404 OD1 ASP A 28 -11.754 3.272 32.576 1.00104.62 O ATOM 405 OD2 ASP A 28 -13.687 2.791 31.661 1.00108.48 O ATOM 406 HA ASP A 28 -13.155 6.069 32.582 1.00 0.00 H ATOM 407 HB2 ASP A 28 -13.534 4.877 30.361 1.00 0.00 H ATOM 408 HB3 ASP A 28 -11.768 4.694 30.249 1.00 0.00 H ATOM 409 H ASP A 28 -11.881 7.621 30.381 1.00 0.00 H ATOM 410 N ILE A 29 -10.974 5.833 33.705 1.00 41.72 N ATOM 411 CA ILE A 29 -9.729 5.793 34.475 1.00 36.92 C ATOM 412 C ILE A 29 -8.637 5.004 33.741 1.00 38.46 C ATOM 413 O ILE A 29 -7.529 5.503 33.516 1.00 34.40 O ATOM 414 CB ILE A 29 -9.941 5.099 35.858 1.00 47.12 C ATOM 415 CG1 ILE A 29 -11.173 5.665 36.575 1.00 42.42 C ATOM 416 CG2 ILE A 29 -8.693 5.250 36.717 1.00 44.99 C ATOM 417 CD1 ILE A 29 -11.103 7.117 36.905 1.00 55.86 C ATOM 418 HA ILE A 29 -9.423 6.831 34.607 1.00 0.00 H ATOM 419 HB ILE A 29 -10.118 4.037 35.688 1.00 0.00 H ATOM 420 HG12 ILE A 29 -12.040 5.506 35.934 1.00 0.00 H ATOM 421 HG13 ILE A 29 -11.305 5.113 37.506 1.00 0.00 H ATOM 422 HD11 ILE A 29 -10.251 7.299 37.560 1.00 0.00 H ATOM 423 HD12 ILE A 29 -10.986 7.692 35.986 1.00 0.00 H ATOM 424 HD13 ILE A 29 -12.021 7.418 37.409 1.00 0.00 H ATOM 425 HG21 ILE A 29 -7.846 4.787 36.210 1.00 0.00 H ATOM 426 HG22 ILE A 29 -8.488 6.309 36.875 1.00 0.00 H ATOM 427 HG23 ILE A 29 -8.854 4.762 37.678 1.00 0.00 H ATOM 428 H ILE A 29 -11.869 5.677 34.211 1.00 0.00 H ATOM 429 N SER A 30 -8.978 3.771 33.372 1.00 37.27 N ATOM 430 CA SER A 30 -8.073 2.842 32.693 1.00 41.85 C ATOM 431 C SER A 30 -7.442 3.329 31.391 1.00 45.34 C ATOM 432 O SER A 30 -6.432 2.776 30.946 1.00 48.22 O ATOM 433 CB SER A 30 -8.793 1.512 32.447 1.00 52.20 C ATOM 434 OG SER A 30 -10.004 1.711 31.728 1.00 53.21 O ATOM 435 HA SER A 30 -7.232 2.735 33.378 1.00 0.00 H ATOM 436 HB2 SER A 30 -9.020 1.047 33.406 1.00 0.00 H ATOM 437 HB3 SER A 30 -8.141 0.855 31.872 1.00 0.00 H ATOM 438 HG SER A 30 -10.602 2.304 32.249 1.00 0.00 H ATOM 439 H SER A 30 -9.945 3.449 33.578 1.00 0.00 H ATOM 440 N LEU A 31 -8.026 4.355 30.779 1.00 32.33 N ATOM 441 CA LEU A 31 -7.475 4.895 29.536 1.00 31.72 C ATOM 442 C LEU A 31 -6.191 5.708 29.789 1.00 32.24 C ATOM 443 O LEU A 31 -5.302 5.767 28.936 1.00 33.99 O ATOM 444 CB LEU A 31 -8.517 5.780 28.846 1.00 33.05 C ATOM 445 CG LEU A 31 -9.400 5.145 27.764 1.00 35.05 C ATOM 446 CD1 LEU A 31 -9.552 3.646 27.996 1.00 36.54 C ATOM 447 CD2 LEU A 31 -10.752 5.844 27.746 1.00 35.25 C ATOM 448 HA LEU A 31 -7.219 4.053 28.892 1.00 0.00 H ATOM 449 HB2 LEU A 31 -9.180 6.165 29.621 1.00 0.00 H ATOM 450 HB3 LEU A 31 -7.982 6.609 28.383 1.00 0.00 H ATOM 451 HG LEU A 31 -8.925 5.272 26.791 1.00 0.00 H ATOM 452 HD21 LEU A 31 -11.230 5.734 28.720 1.00 0.00 H ATOM 453 HD22 LEU A 31 -10.610 6.902 27.528 1.00 0.00 H ATOM 454 HD23 LEU A 31 -11.382 5.395 26.978 1.00 0.00 H ATOM 455 HD11 LEU A 31 -8.570 3.174 27.969 1.00 0.00 H ATOM 456 HD12 LEU A 31 -10.012 3.475 28.969 1.00 0.00 H ATOM 457 HD13 LEU A 31 -10.182 3.221 27.215 1.00 0.00 H ATOM 458 H LEU A 31 -8.883 4.778 31.188 1.00 0.00 H ATOM 459 N LEU A 32 -6.113 6.334 30.965 1.00 33.12 N ATOM 460 CA LEU A 32 -4.967 7.159 31.350 1.00 34.04 C ATOM 461 C LEU A 32 -4.365 6.657 32.660 1.00 35.02 C ATOM 462 O LEU A 32 -3.492 7.298 33.237 1.00 34.19 O ATOM 463 CB LEU A 32 -5.412 8.617 31.520 1.00 27.98 C ATOM 464 CG LEU A 32 -5.828 9.358 30.252 1.00 24.54 C ATOM 465 CD1 LEU A 32 -6.378 10.731 30.625 1.00 25.39 C ATOM 466 CD2 LEU A 32 -4.616 9.482 29.301 1.00 23.06 C ATOM 467 HA LEU A 32 -4.213 7.095 30.566 1.00 0.00 H ATOM 468 HB2 LEU A 32 -6.262 8.626 32.202 1.00 0.00 H ATOM 469 HB3 LEU A 32 -4.583 9.166 31.967 1.00 0.00 H ATOM 470 HG LEU A 32 -6.610 8.802 29.735 1.00 0.00 H ATOM 471 HD21 LEU A 32 -3.820 10.035 29.799 1.00 0.00 H ATOM 472 HD22 LEU A 32 -4.259 8.486 29.038 1.00 0.00 H ATOM 473 HD23 LEU A 32 -4.918 10.012 28.397 1.00 0.00 H ATOM 474 HD11 LEU A 32 -7.243 10.610 31.277 1.00 0.00 H ATOM 475 HD12 LEU A 32 -5.607 11.301 31.144 1.00 0.00 H ATOM 476 HD13 LEU A 32 -6.675 11.260 29.720 1.00 0.00 H ATOM 477 H LEU A 32 -6.900 6.231 31.637 1.00 0.00 H ATOM 478 N ASP A 33 -4.854 5.506 33.109 1.00 54.19 N ATOM 479 CA ASP A 33 -4.423 4.861 34.348 1.00 59.59 C ATOM 480 C ASP A 33 -2.909 4.881 34.575 1.00 59.65 C ATOM 481 O ASP A 33 -2.356 5.841 35.111 1.00 59.33 O ATOM 482 CB ASP A 33 -4.922 3.412 34.355 1.00 59.79 C ATOM 483 CG ASP A 33 -5.620 3.041 35.643 1.00 66.37 C ATOM 484 OD1 ASP A 33 -6.115 1.900 35.737 1.00 67.51 O ATOM 485 OD2 ASP A 33 -5.675 3.887 36.562 1.00 71.21 O ATOM 486 HA ASP A 33 -4.856 5.438 35.165 1.00 0.00 H ATOM 487 HB2 ASP A 33 -5.621 3.280 33.529 1.00 0.00 H ATOM 488 HB3 ASP A 33 -4.068 2.748 34.217 1.00 0.00 H ATOM 489 H ASP A 33 -5.589 5.035 32.544 1.00 0.00 H ATOM 490 N ALA A 34 -2.244 3.805 34.170 1.00 55.02 N ATOM 491 CA ALA A 34 -0.804 3.695 34.331 1.00 55.81 C ATOM 492 C ALA A 34 -0.060 4.367 33.192 1.00 56.48 C ATOM 493 O ALA A 34 -0.663 4.937 32.278 1.00 55.20 O ATOM 494 CB ALA A 34 -0.405 2.235 34.417 1.00 52.54 C ATOM 495 HA ALA A 34 -0.531 4.205 35.255 1.00 0.00 H ATOM 496 HB1 ALA A 34 -0.899 1.774 35.272 1.00 0.00 H ATOM 497 HB2 ALA A 34 -0.706 1.723 33.503 1.00 0.00 H ATOM 498 HB3 ALA A 34 0.676 2.162 34.538 1.00 0.00 H ATOM 499 H ALA A 34 -2.766 3.022 33.727 1.00 0.00 H ATOM 500 N GLN A 35 1.263 4.288 33.258 1.00 61.47 N ATOM 501 CA GLN A 35 2.132 4.881 32.256 1.00 63.73 C ATOM 502 C GLN A 35 1.971 4.194 30.910 1.00 61.12 C ATOM 503 O GLN A 35 2.199 4.799 29.868 1.00 57.65 O ATOM 504 CB GLN A 35 3.583 4.788 32.723 1.00124.60 C ATOM 505 CG GLN A 35 3.815 5.397 34.097 1.00135.01 C ATOM 506 CD GLN A 35 5.213 5.144 34.619 1.00141.21 C ATOM 507 OE1 GLN A 35 5.632 3.997 34.771 1.00144.41 O ATOM 508 NE2 GLN A 35 5.944 6.217 34.900 1.00144.88 N ATOM 509 HA GLN A 35 1.853 5.927 32.131 1.00 0.00 H ATOM 510 HB2 GLN A 35 3.868 3.737 32.758 1.00 0.00 H ATOM 511 HB3 GLN A 35 4.212 5.310 32.002 1.00 0.00 H ATOM 512 HG2 GLN A 35 3.656 6.473 34.033 1.00 0.00 H ATOM 513 HG3 GLN A 35 3.098 4.966 34.796 1.00 0.00 H ATOM 514 HE22 GLN A 35 5.548 7.168 34.756 1.00 0.00 H ATOM 515 HE21 GLN A 35 6.912 6.106 35.264 1.00 0.00 H ATOM 516 H GLN A 35 1.694 3.782 34.058 1.00 0.00 H ATOM 517 N SER A 36 1.576 2.927 30.936 1.00 61.09 N ATOM 518 CA SER A 36 1.391 2.168 29.703 1.00 60.74 C ATOM 519 C SER A 36 -0.068 2.134 29.266 1.00 58.68 C ATOM 520 O SER A 36 -0.408 1.481 28.283 1.00 60.07 O ATOM 521 CB SER A 36 1.896 0.737 29.875 1.00 57.72 C ATOM 522 OG SER A 36 1.115 0.043 30.826 1.00 60.31 O ATOM 523 HA SER A 36 1.968 2.675 28.930 1.00 0.00 H ATOM 524 HB2 SER A 36 2.932 0.761 30.212 1.00 0.00 H ATOM 525 HB3 SER A 36 1.838 0.219 28.918 1.00 0.00 H ATOM 526 HG SER A 36 1.458 -0.881 30.922 1.00 0.00 H ATOM 527 H SER A 36 1.395 2.467 31.851 1.00 0.00 H ATOM 528 N ALA A 37 -0.925 2.835 30.003 1.00 52.52 N ATOM 529 CA ALA A 37 -2.347 2.897 29.677 1.00 47.54 C ATOM 530 C ALA A 37 -2.517 3.158 28.173 1.00 46.96 C ATOM 531 O ALA A 37 -1.765 3.915 27.573 1.00 46.24 O ATOM 532 CB ALA A 37 -3.006 3.997 30.494 1.00 42.49 C ATOM 533 HA ALA A 37 -2.826 1.949 29.921 1.00 0.00 H ATOM 534 HB1 ALA A 37 -2.885 3.782 31.556 1.00 0.00 H ATOM 535 HB2 ALA A 37 -2.537 4.953 30.260 1.00 0.00 H ATOM 536 HB3 ALA A 37 -4.067 4.043 30.250 1.00 0.00 H ATOM 537 H ALA A 37 -0.573 3.353 30.833 1.00 0.00 H ATOM 538 N PRO A 38 -3.521 2.536 27.550 1.00 45.16 N ATOM 539 CA PRO A 38 -3.768 2.705 26.114 1.00 46.93 C ATOM 540 C PRO A 38 -3.696 4.121 25.537 1.00 48.23 C ATOM 541 O PRO A 38 -3.024 4.340 24.528 1.00 53.55 O ATOM 542 CB PRO A 38 -5.143 2.065 25.924 1.00 56.15 C ATOM 543 CG PRO A 38 -5.782 2.233 27.257 1.00 55.73 C ATOM 544 CD PRO A 38 -4.660 1.864 28.191 1.00 55.33 C ATOM 545 HA PRO A 38 -2.959 2.242 25.549 1.00 0.00 H ATOM 546 HD3 PRO A 38 -4.835 2.246 29.197 1.00 0.00 H ATOM 547 HD2 PRO A 38 -4.515 0.785 28.234 1.00 0.00 H ATOM 548 HG3 PRO A 38 -6.633 1.563 27.376 1.00 0.00 H ATOM 549 HG2 PRO A 38 -6.106 3.262 27.414 1.00 0.00 H ATOM 550 HB2 PRO A 38 -5.711 2.581 25.150 1.00 0.00 H ATOM 551 HB3 PRO A 38 -5.051 1.010 25.664 1.00 0.00 H ATOM 552 N LEU A 39 -4.381 5.078 26.155 1.00 52.77 N ATOM 553 CA LEU A 39 -4.362 6.442 25.635 1.00 45.55 C ATOM 554 C LEU A 39 -3.414 7.400 26.346 1.00 40.80 C ATOM 555 O LEU A 39 -3.516 8.615 26.187 1.00 34.73 O ATOM 556 CB LEU A 39 -5.772 7.025 25.634 1.00 46.44 C ATOM 557 CG LEU A 39 -6.755 6.323 24.694 1.00 48.13 C ATOM 558 CD1 LEU A 39 -8.069 7.104 24.665 1.00 50.58 C ATOM 559 CD2 LEU A 39 -6.168 6.214 23.297 1.00 48.27 C ATOM 560 HA LEU A 39 -3.973 6.348 24.621 1.00 0.00 H ATOM 561 HB2 LEU A 39 -6.167 6.961 26.648 1.00 0.00 H ATOM 562 HB3 LEU A 39 -5.706 8.072 25.337 1.00 0.00 H ATOM 563 HG LEU A 39 -6.945 5.314 25.059 1.00 0.00 H ATOM 564 HD21 LEU A 39 -5.961 7.213 22.913 1.00 0.00 H ATOM 565 HD22 LEU A 39 -5.243 5.639 23.337 1.00 0.00 H ATOM 566 HD23 LEU A 39 -6.881 5.712 22.643 1.00 0.00 H ATOM 567 HD11 LEU A 39 -8.489 7.144 25.670 1.00 0.00 H ATOM 568 HD12 LEU A 39 -7.881 8.116 24.308 1.00 0.00 H ATOM 569 HD13 LEU A 39 -8.771 6.606 23.996 1.00 0.00 H ATOM 570 H LEU A 39 -4.931 4.855 27.009 1.00 0.00 H ATOM 571 N ARG A 40 -2.494 6.853 27.132 1.00 47.59 N ATOM 572 CA ARG A 40 -1.517 7.671 27.842 1.00 47.52 C ATOM 573 C ARG A 40 -0.410 8.043 26.843 1.00 47.58 C ATOM 574 O ARG A 40 0.675 7.468 26.859 1.00 48.80 O ATOM 575 CB ARG A 40 -0.934 6.877 29.007 1.00 37.10 C ATOM 576 CG ARG A 40 -0.060 7.679 29.961 1.00 39.81 C ATOM 577 CD ARG A 40 -0.857 8.639 30.851 1.00 43.54 C ATOM 578 NE ARG A 40 -0.008 9.189 31.907 1.00 45.89 N ATOM 579 CZ ARG A 40 0.184 8.624 33.096 1.00 45.65 C ATOM 580 NH1 ARG A 40 -0.424 7.491 33.409 1.00 46.43 N ATOM 581 NH2 ARG A 40 1.022 9.169 33.963 1.00 47.08 N ATOM 582 HA ARG A 40 -1.982 8.572 28.243 1.00 0.00 H ATOM 583 HB2 ARG A 40 -1.762 6.458 29.579 1.00 0.00 H ATOM 584 HB3 ARG A 40 -0.331 6.067 28.596 1.00 0.00 H ATOM 585 HG2 ARG A 40 0.483 6.983 30.601 1.00 0.00 H ATOM 586 HG3 ARG A 40 0.651 8.261 29.374 1.00 0.00 H ATOM 587 HD2 ARG A 40 -1.689 8.100 31.304 1.00 0.00 H ATOM 588 HD3 ARG A 40 -1.244 9.455 30.241 1.00 0.00 H ATOM 589 HE ARG A 40 0.481 10.087 31.715 1.00 0.00 H ATOM 590 HH12 ARG A 40 -0.267 7.057 34.341 1.00 0.00 H ATOM 591 HH11 ARG A 40 -1.058 7.034 32.723 1.00 0.00 H ATOM 592 HH22 ARG A 40 1.170 8.726 34.892 1.00 0.00 H ATOM 593 HH21 ARG A 40 1.532 10.041 33.716 1.00 0.00 H ATOM 594 H ARG A 40 -2.470 5.819 27.244 1.00 0.00 H ATOM 595 N VAL A 41 -0.699 9.001 25.968 1.00 44.02 N ATOM 596 CA VAL A 41 0.260 9.428 24.960 1.00 41.12 C ATOM 597 C VAL A 41 0.719 10.861 25.177 1.00 39.38 C ATOM 598 O VAL A 41 -0.032 11.698 25.684 1.00 40.56 O ATOM 599 CB VAL A 41 -0.335 9.302 23.532 1.00 37.92 C ATOM 600 CG1 VAL A 41 -0.620 7.834 23.222 1.00 37.69 C ATOM 601 CG2 VAL A 41 -1.615 10.129 23.421 1.00 38.70 C ATOM 602 HA VAL A 41 1.121 8.767 25.059 1.00 0.00 H ATOM 603 HB VAL A 41 0.385 9.683 22.808 1.00 0.00 H ATOM 604 HG11 VAL A 41 0.308 7.265 23.279 1.00 0.00 H ATOM 605 HG12 VAL A 41 -1.333 7.443 23.948 1.00 0.00 H ATOM 606 HG13 VAL A 41 -1.038 7.750 22.219 1.00 0.00 H ATOM 607 HG21 VAL A 41 -2.344 9.767 24.146 1.00 0.00 H ATOM 608 HG22 VAL A 41 -1.388 11.176 23.623 1.00 0.00 H ATOM 609 HG23 VAL A 41 -2.022 10.032 22.415 1.00 0.00 H ATOM 610 H VAL A 41 -1.633 9.457 26.005 1.00 0.00 H ATOM 611 N TYR A 42 1.952 11.139 24.776 1.00 38.18 N ATOM 612 CA TYR A 42 2.544 12.462 24.933 1.00 35.94 C ATOM 613 C TYR A 42 2.894 13.012 23.560 1.00 34.57 C ATOM 614 O TYR A 42 3.643 12.398 22.816 1.00 36.65 O ATOM 615 CB TYR A 42 3.803 12.360 25.786 1.00 35.20 C ATOM 616 CG TYR A 42 3.585 11.660 27.112 1.00 35.67 C ATOM 617 CD1 TYR A 42 2.996 12.322 28.190 1.00 35.85 C ATOM 618 CD2 TYR A 42 3.987 10.340 27.295 1.00 36.67 C ATOM 619 CE1 TYR A 42 2.825 11.684 29.424 1.00 39.77 C ATOM 620 CE2 TYR A 42 3.814 9.697 28.519 1.00 40.87 C ATOM 621 CZ TYR A 42 3.239 10.371 29.577 1.00 41.32 C ATOM 622 OH TYR A 42 3.102 9.733 30.787 1.00 43.69 O ATOM 623 HA TYR A 42 1.836 13.129 25.425 1.00 0.00 H ATOM 624 HB3 TYR A 42 4.167 13.368 25.984 1.00 0.00 H ATOM 625 HB2 TYR A 42 4.556 11.807 25.224 1.00 0.00 H ATOM 626 HD2 TYR A 42 4.445 9.800 26.466 1.00 0.00 H ATOM 627 HE2 TYR A 42 4.133 8.662 28.641 1.00 0.00 H ATOM 628 HE1 TYR A 42 2.369 12.217 30.259 1.00 0.00 H ATOM 629 HD1 TYR A 42 2.664 13.353 28.069 1.00 0.00 H ATOM 630 HH TYR A 42 3.995 9.466 31.121 1.00 0.00 H ATOM 631 H TYR A 42 2.517 10.386 24.334 1.00 0.00 H ATOM 632 N VAL A 43 2.355 14.180 23.239 1.00 34.22 N ATOM 633 CA VAL A 43 2.585 14.788 21.945 1.00 37.63 C ATOM 634 C VAL A 43 3.901 15.545 21.855 1.00 41.33 C ATOM 635 O VAL A 43 4.243 16.328 22.742 1.00 40.78 O ATOM 636 CB VAL A 43 1.449 15.743 21.586 1.00 28.44 C ATOM 637 CG1 VAL A 43 1.686 16.305 20.201 1.00 32.38 C ATOM 638 CG2 VAL A 43 0.107 15.011 21.655 1.00 29.37 C ATOM 639 HA VAL A 43 2.629 13.959 21.239 1.00 0.00 H ATOM 640 HB VAL A 43 1.422 16.566 22.300 1.00 0.00 H ATOM 641 HG11 VAL A 43 2.634 16.843 20.186 1.00 0.00 H ATOM 642 HG12 VAL A 43 1.719 15.488 19.480 1.00 0.00 H ATOM 643 HG13 VAL A 43 0.876 16.987 19.943 1.00 0.00 H ATOM 644 HG21 VAL A 43 0.112 14.179 20.951 1.00 0.00 H ATOM 645 HG22 VAL A 43 -0.048 14.633 22.666 1.00 0.00 H ATOM 646 HG23 VAL A 43 -0.696 15.702 21.397 1.00 0.00 H ATOM 647 H VAL A 43 1.754 14.670 23.932 1.00 0.00 H ATOM 648 N GLU A 44 4.629 15.317 20.765 1.00 32.99 N ATOM 649 CA GLU A 44 5.917 15.976 20.564 1.00 37.93 C ATOM 650 C GLU A 44 5.825 17.093 19.541 1.00 37.69 C ATOM 651 O GLU A 44 6.288 18.206 19.768 1.00 38.10 O ATOM 652 CB GLU A 44 6.964 14.963 20.095 1.00 54.54 C ATOM 653 CG GLU A 44 7.163 13.784 21.031 1.00 60.99 C ATOM 654 CD GLU A 44 7.643 14.195 22.414 1.00 62.75 C ATOM 655 OE1 GLU A 44 6.864 14.831 23.166 1.00 60.67 O ATOM 656 OE2 GLU A 44 8.809 13.882 22.747 1.00 65.44 O ATOM 657 HA GLU A 44 6.211 16.404 21.522 1.00 0.00 H ATOM 658 HB2 GLU A 44 6.654 14.578 19.123 1.00 0.00 H ATOM 659 HB3 GLU A 44 7.917 15.481 19.992 1.00 0.00 H ATOM 660 HG2 GLU A 44 6.213 13.259 21.135 1.00 0.00 H ATOM 661 HG3 GLU A 44 7.902 13.113 20.592 1.00 0.00 H ATOM 662 H GLU A 44 4.275 14.658 20.043 1.00 0.00 H ATOM 663 N GLU A 45 5.212 16.788 18.408 1.00 45.17 N ATOM 664 CA GLU A 45 5.097 17.760 17.341 1.00 46.78 C ATOM 665 C GLU A 45 3.919 17.429 16.447 1.00 41.57 C ATOM 666 O GLU A 45 3.496 16.269 16.352 1.00 34.21 O ATOM 667 CB GLU A 45 6.392 17.749 16.523 1.00 44.93 C ATOM 668 CG GLU A 45 6.420 18.660 15.316 1.00 55.40 C ATOM 669 CD GLU A 45 7.776 18.648 14.620 1.00 59.18 C ATOM 670 OE1 GLU A 45 8.231 17.551 14.233 1.00 62.12 O ATOM 671 OE2 GLU A 45 8.383 19.734 14.461 1.00 60.64 O ATOM 672 HA GLU A 45 4.934 18.750 17.768 1.00 0.00 H ATOM 673 HB2 GLU A 45 7.207 18.045 17.184 1.00 0.00 H ATOM 674 HB3 GLU A 45 6.559 16.729 16.176 1.00 0.00 H ATOM 675 HG2 GLU A 45 5.659 18.331 14.609 1.00 0.00 H ATOM 676 HG3 GLU A 45 6.199 19.678 15.638 1.00 0.00 H ATOM 677 H GLU A 45 4.808 15.838 18.283 1.00 0.00 H ATOM 678 N LEU A 46 3.374 18.458 15.811 1.00 37.93 N ATOM 679 CA LEU A 46 2.270 18.266 14.888 1.00 38.39 C ATOM 680 C LEU A 46 2.795 18.587 13.495 1.00 40.27 C ATOM 681 O LEU A 46 3.334 19.664 13.256 1.00 37.13 O ATOM 682 CB LEU A 46 1.071 19.159 15.257 1.00 40.58 C ATOM 683 CG LEU A 46 0.267 18.685 16.489 1.00 36.62 C ATOM 684 CD1 LEU A 46 -1.081 19.418 16.583 1.00 33.54 C ATOM 685 CD2 LEU A 46 0.027 17.188 16.381 1.00 32.96 C ATOM 686 HA LEU A 46 1.907 17.239 14.932 1.00 0.00 H ATOM 687 HB2 LEU A 46 1.445 20.162 15.461 1.00 0.00 H ATOM 688 HB3 LEU A 46 0.395 19.191 14.402 1.00 0.00 H ATOM 689 HG LEU A 46 0.840 18.909 17.388 1.00 0.00 H ATOM 690 HD21 LEU A 46 -0.536 16.976 15.472 1.00 0.00 H ATOM 691 HD22 LEU A 46 0.985 16.669 16.346 1.00 0.00 H ATOM 692 HD23 LEU A 46 -0.540 16.849 17.248 1.00 0.00 H ATOM 693 HD11 LEU A 46 -0.905 20.490 16.671 1.00 0.00 H ATOM 694 HD12 LEU A 46 -1.666 19.217 15.685 1.00 0.00 H ATOM 695 HD13 LEU A 46 -1.625 19.065 17.459 1.00 0.00 H ATOM 696 H LEU A 46 3.743 19.416 15.976 1.00 0.00 H ATOM 697 N LYS A 47 2.649 17.632 12.586 1.00 38.02 N ATOM 698 CA LYS A 47 3.131 17.803 11.221 1.00 44.75 C ATOM 699 C LYS A 47 2.026 17.721 10.171 1.00 45.78 C ATOM 700 O LYS A 47 1.672 16.639 9.709 1.00 46.53 O ATOM 701 CB LYS A 47 4.195 16.748 10.898 1.00 72.43 C ATOM 702 CG LYS A 47 5.467 16.823 11.729 1.00 76.29 C ATOM 703 CD LYS A 47 6.455 15.749 11.276 1.00 80.07 C ATOM 704 CE LYS A 47 7.766 15.806 12.051 1.00 83.09 C ATOM 705 NZ LYS A 47 8.731 14.747 11.623 1.00 86.09 N ATOM 706 HA LYS A 47 3.552 18.807 11.177 1.00 0.00 H ATOM 707 HB2 LYS A 47 3.751 15.765 11.052 1.00 0.00 H ATOM 708 HB3 LYS A 47 4.472 16.860 9.850 1.00 0.00 H ATOM 709 HG2 LYS A 47 5.921 17.806 11.605 1.00 0.00 H ATOM 710 HG3 LYS A 47 5.221 16.667 12.779 1.00 0.00 H ATOM 711 HD2 LYS A 47 6.001 14.769 11.426 1.00 0.00 H ATOM 712 HD3 LYS A 47 6.667 15.892 10.216 1.00 0.00 H ATOM 713 HE2 LYS A 47 7.551 15.676 13.112 1.00 0.00 H ATOM 714 HE3 LYS A 47 8.224 16.782 11.892 1.00 0.00 H ATOM 715 HZ1 LYS A 47 8.307 13.810 11.778 1.00 0.00 H ATOM 716 HZ2 LYS A 47 8.950 14.867 10.613 1.00 0.00 H ATOM 717 HZ3 LYS A 47 9.605 14.830 12.181 1.00 0.00 H ATOM 718 H LYS A 47 2.181 16.743 12.853 1.00 0.00 H ATOM 719 N PRO A 48 1.463 18.872 9.787 1.00 43.16 N ATOM 720 CA PRO A 48 0.402 18.885 8.776 1.00 44.21 C ATOM 721 C PRO A 48 0.995 18.847 7.365 1.00 47.85 C ATOM 722 O PRO A 48 1.824 19.690 7.000 1.00 50.55 O ATOM 723 CB PRO A 48 -0.327 20.191 9.061 1.00 45.37 C ATOM 724 CG PRO A 48 0.786 21.093 9.505 1.00 45.46 C ATOM 725 CD PRO A 48 1.613 20.196 10.418 1.00 44.94 C ATOM 726 HA PRO A 48 -0.261 18.021 8.823 1.00 0.00 H ATOM 727 HD3 PRO A 48 2.657 20.508 10.436 1.00 0.00 H ATOM 728 HD2 PRO A 48 1.217 20.196 11.434 1.00 0.00 H ATOM 729 HG3 PRO A 48 0.399 21.955 10.049 1.00 0.00 H ATOM 730 HG2 PRO A 48 1.375 21.436 8.655 1.00 0.00 H ATOM 731 HB2 PRO A 48 -0.812 20.576 8.164 1.00 0.00 H ATOM 732 HB3 PRO A 48 -1.070 20.064 9.849 1.00 0.00 H ATOM 733 N THR A 49 0.575 17.863 6.577 1.00 48.73 N ATOM 734 CA THR A 49 1.063 17.734 5.211 1.00 50.25 C ATOM 735 C THR A 49 0.500 18.858 4.344 1.00 54.20 C ATOM 736 O THR A 49 -0.539 19.449 4.665 1.00 53.20 O ATOM 737 CB THR A 49 0.638 16.401 4.598 1.00 48.59 C ATOM 738 OG1 THR A 49 -0.744 16.466 4.225 1.00 48.86 O ATOM 739 CG2 THR A 49 0.830 15.283 5.601 1.00 48.90 C ATOM 740 HA THR A 49 2.151 17.787 5.245 1.00 0.00 H ATOM 741 HB THR A 49 1.251 16.204 3.718 1.00 0.00 H ATOM 742 HG1 THR A 49 -0.872 17.190 3.562 1.00 0.00 H ATOM 743 HG23 THR A 49 1.880 15.230 5.888 1.00 0.00 H ATOM 744 HG21 THR A 49 0.221 15.480 6.483 1.00 0.00 H ATOM 745 HG22 THR A 49 0.527 14.337 5.152 1.00 0.00 H ATOM 746 H THR A 49 -0.113 17.174 6.942 1.00 0.00 H ATOM 747 N PRO A 50 1.184 19.178 3.233 1.00 63.51 N ATOM 748 CA PRO A 50 0.687 20.246 2.360 1.00 63.75 C ATOM 749 C PRO A 50 -0.635 19.783 1.762 1.00 64.94 C ATOM 750 O PRO A 50 -1.492 20.586 1.404 1.00 65.52 O ATOM 751 CB PRO A 50 1.790 20.368 1.314 1.00 68.23 C ATOM 752 CG PRO A 50 2.253 18.954 1.171 1.00 68.49 C ATOM 753 CD PRO A 50 2.337 18.495 2.620 1.00 68.22 C ATOM 754 HA PRO A 50 0.492 21.202 2.845 1.00 0.00 H ATOM 755 HD3 PRO A 50 2.242 17.412 2.698 1.00 0.00 H ATOM 756 HD2 PRO A 50 3.273 18.810 3.081 1.00 0.00 H ATOM 757 HG3 PRO A 50 3.226 18.904 0.683 1.00 0.00 H ATOM 758 HG2 PRO A 50 1.535 18.358 0.608 1.00 0.00 H ATOM 759 HB2 PRO A 50 1.400 20.753 0.372 1.00 0.00 H ATOM 760 HB3 PRO A 50 2.596 21.014 1.663 1.00 0.00 H ATOM 761 N GLU A 51 -0.776 18.464 1.677 1.00 59.44 N ATOM 762 CA GLU A 51 -1.966 17.817 1.147 1.00 63.14 C ATOM 763 C GLU A 51 -3.169 18.060 2.072 1.00 62.04 C ATOM 764 O GLU A 51 -4.317 17.879 1.669 1.00 63.32 O ATOM 765 CB GLU A 51 -1.696 16.316 1.006 1.00114.45 C ATOM 766 CG GLU A 51 -0.367 16.007 0.314 1.00122.03 C ATOM 767 CD GLU A 51 0.049 14.550 0.436 1.00125.49 C ATOM 768 OE1 GLU A 51 0.164 14.056 1.578 1.00128.60 O ATOM 769 OE2 GLU A 51 0.269 13.901 -0.608 1.00125.60 O ATOM 770 HA GLU A 51 -2.203 18.238 0.170 1.00 0.00 H ATOM 771 HB2 GLU A 51 -1.681 15.871 2.001 1.00 0.00 H ATOM 772 HB3 GLU A 51 -2.503 15.872 0.423 1.00 0.00 H ATOM 773 HG2 GLU A 51 -0.462 16.253 -0.744 1.00 0.00 H ATOM 774 HG3 GLU A 51 0.409 16.628 0.762 1.00 0.00 H ATOM 775 H GLU A 51 0.006 17.863 2.007 1.00 0.00 H ATOM 776 N GLY A 52 -2.906 18.466 3.313 1.00 61.48 N ATOM 777 CA GLY A 52 -3.993 18.738 4.239 1.00 58.71 C ATOM 778 C GLY A 52 -4.196 17.755 5.381 1.00 54.62 C ATOM 779 O GLY A 52 -4.995 18.013 6.277 1.00 56.12 O ATOM 780 HA3 GLY A 52 -4.917 18.765 3.661 1.00 0.00 H ATOM 781 HA2 GLY A 52 -3.812 19.719 4.679 1.00 0.00 H ATOM 782 H GLY A 52 -1.920 18.589 3.620 1.00 0.00 H ATOM 783 N ASP A 53 -3.499 16.623 5.353 1.00 58.45 N ATOM 784 CA ASP A 53 -3.621 15.641 6.424 1.00 52.56 C ATOM 785 C ASP A 53 -2.821 16.109 7.633 1.00 48.65 C ATOM 786 O ASP A 53 -2.303 17.233 7.638 1.00 46.18 O ATOM 787 CB ASP A 53 -3.132 14.276 5.954 1.00 73.17 C ATOM 788 CG ASP A 53 -4.017 13.696 4.873 1.00 75.51 C ATOM 789 OD1 ASP A 53 -5.253 13.690 5.068 1.00 75.05 O ATOM 790 OD2 ASP A 53 -3.482 13.246 3.834 1.00 77.43 O ATOM 791 HA ASP A 53 -4.670 15.545 6.705 1.00 0.00 H ATOM 792 HB2 ASP A 53 -2.120 14.381 5.562 1.00 0.00 H ATOM 793 HB3 ASP A 53 -3.122 13.594 6.804 1.00 0.00 H ATOM 794 H ASP A 53 -2.858 16.435 4.556 1.00 0.00 H ATOM 795 N LEU A 54 -2.711 15.264 8.654 1.00 37.61 N ATOM 796 CA LEU A 54 -1.997 15.659 9.865 1.00 41.78 C ATOM 797 C LEU A 54 -1.165 14.561 10.518 1.00 43.17 C ATOM 798 O LEU A 54 -1.711 13.576 11.018 1.00 44.17 O ATOM 799 CB LEU A 54 -3.002 16.205 10.888 1.00 41.13 C ATOM 800 CG LEU A 54 -2.434 16.732 12.207 1.00 39.95 C ATOM 801 CD1 LEU A 54 -1.535 17.933 11.949 1.00 38.11 C ATOM 802 CD2 LEU A 54 -3.573 17.105 13.122 1.00 39.53 C ATOM 803 HA LEU A 54 -1.282 16.418 9.547 1.00 0.00 H ATOM 804 HB2 LEU A 54 -3.544 17.023 10.413 1.00 0.00 H ATOM 805 HB3 LEU A 54 -3.698 15.401 11.127 1.00 0.00 H ATOM 806 HG LEU A 54 -1.833 15.957 12.683 1.00 0.00 H ATOM 807 HD21 LEU A 54 -4.179 17.877 12.649 1.00 0.00 H ATOM 808 HD22 LEU A 54 -4.187 16.225 13.313 1.00 0.00 H ATOM 809 HD23 LEU A 54 -3.173 17.481 14.063 1.00 0.00 H ATOM 810 HD11 LEU A 54 -0.712 17.636 11.298 1.00 0.00 H ATOM 811 HD12 LEU A 54 -2.114 18.722 11.468 1.00 0.00 H ATOM 812 HD13 LEU A 54 -1.138 18.298 12.896 1.00 0.00 H ATOM 813 H LEU A 54 -3.136 14.317 8.590 1.00 0.00 H ATOM 814 N GLU A 55 0.155 14.744 10.516 1.00 47.19 N ATOM 815 CA GLU A 55 1.085 13.788 11.124 1.00 47.28 C ATOM 816 C GLU A 55 1.264 14.089 12.610 1.00 44.91 C ATOM 817 O GLU A 55 1.470 15.243 13.002 1.00 41.98 O ATOM 818 CB GLU A 55 2.470 13.857 10.470 1.00 80.74 C ATOM 819 CG GLU A 55 2.618 13.169 9.130 1.00 87.29 C ATOM 820 CD GLU A 55 4.081 13.025 8.721 1.00 91.18 C ATOM 821 OE1 GLU A 55 4.780 14.057 8.620 1.00 93.87 O ATOM 822 OE2 GLU A 55 4.536 11.880 8.506 1.00 93.64 O ATOM 823 HA GLU A 55 0.657 12.796 10.978 1.00 0.00 H ATOM 824 HB2 GLU A 55 2.720 14.909 10.332 1.00 0.00 H ATOM 825 HB3 GLU A 55 3.184 13.403 11.157 1.00 0.00 H ATOM 826 HG2 GLU A 55 2.170 12.177 9.192 1.00 0.00 H ATOM 827 HG3 GLU A 55 2.097 13.755 8.373 1.00 0.00 H ATOM 828 H GLU A 55 0.540 15.598 10.065 1.00 0.00 H ATOM 829 N ILE A 56 1.213 13.049 13.433 1.00 51.89 N ATOM 830 CA ILE A 56 1.384 13.229 14.869 1.00 50.84 C ATOM 831 C ILE A 56 2.630 12.523 15.384 1.00 49.29 C ATOM 832 O ILE A 56 2.763 11.304 15.256 1.00 44.97 O ATOM 833 CB ILE A 56 0.175 12.681 15.680 1.00 61.78 C ATOM 834 CG1 ILE A 56 -1.146 13.153 15.066 1.00 63.47 C ATOM 835 CG2 ILE A 56 0.277 13.147 17.122 1.00 62.96 C ATOM 836 CD1 ILE A 56 -1.258 14.640 14.930 1.00 56.02 C ATOM 837 HA ILE A 56 1.471 14.306 15.013 1.00 0.00 H ATOM 838 HB ILE A 56 0.196 11.592 15.650 1.00 0.00 H ATOM 839 HG12 ILE A 56 -1.241 12.710 14.075 1.00 0.00 H ATOM 840 HG13 ILE A 56 -1.962 12.804 15.699 1.00 0.00 H ATOM 841 HD11 ILE A 56 -1.178 15.101 15.915 1.00 0.00 H ATOM 842 HD12 ILE A 56 -0.456 15.006 14.289 1.00 0.00 H ATOM 843 HD13 ILE A 56 -2.222 14.892 14.487 1.00 0.00 H ATOM 844 HG21 ILE A 56 1.205 12.776 17.558 1.00 0.00 H ATOM 845 HG22 ILE A 56 0.270 14.237 17.152 1.00 0.00 H ATOM 846 HG23 ILE A 56 -0.571 12.762 17.688 1.00 0.00 H ATOM 847 H ILE A 56 1.049 12.096 13.049 1.00 0.00 H ATOM 848 N LEU A 57 3.547 13.299 15.950 1.00 41.83 N ATOM 849 CA LEU A 57 4.763 12.744 16.534 1.00 43.60 C ATOM 850 C LEU A 57 4.529 12.722 18.039 1.00 42.16 C ATOM 851 O LEU A 57 4.298 13.765 18.653 1.00 36.83 O ATOM 852 CB LEU A 57 5.977 13.611 16.186 1.00 70.41 C ATOM 853 CG LEU A 57 6.752 13.211 14.926 1.00 73.13 C ATOM 854 CD1 LEU A 57 7.392 11.853 15.148 1.00 72.36 C ATOM 855 CD2 LEU A 57 5.828 13.167 13.725 1.00 73.02 C ATOM 856 HA LEU A 57 4.972 11.746 16.148 1.00 0.00 H ATOM 857 HB2 LEU A 57 5.628 14.635 16.052 1.00 0.00 H ATOM 858 HB3 LEU A 57 6.667 13.571 17.029 1.00 0.00 H ATOM 859 HG LEU A 57 7.527 13.952 14.729 1.00 0.00 H ATOM 860 HD21 LEU A 57 5.038 12.437 13.902 1.00 0.00 H ATOM 861 HD22 LEU A 57 5.386 14.152 13.572 1.00 0.00 H ATOM 862 HD23 LEU A 57 6.397 12.881 12.841 1.00 0.00 H ATOM 863 HD11 LEU A 57 8.074 11.908 15.997 1.00 0.00 H ATOM 864 HD12 LEU A 57 6.615 11.116 15.352 1.00 0.00 H ATOM 865 HD13 LEU A 57 7.945 11.563 14.255 1.00 0.00 H ATOM 866 H LEU A 57 3.394 14.327 15.978 1.00 0.00 H ATOM 867 N LEU A 58 4.577 11.533 18.631 1.00 37.41 N ATOM 868 CA LEU A 58 4.318 11.414 20.056 1.00 42.06 C ATOM 869 C LEU A 58 5.141 10.362 20.788 1.00 42.84 C ATOM 870 O LEU A 58 5.902 9.613 20.187 1.00 40.88 O ATOM 871 CB LEU A 58 2.825 11.142 20.264 1.00 50.35 C ATOM 872 CG LEU A 58 2.253 9.883 19.602 1.00 51.48 C ATOM 873 CD1 LEU A 58 2.442 8.693 20.531 1.00 50.81 C ATOM 874 CD2 LEU A 58 0.767 10.080 19.301 1.00 54.22 C ATOM 875 HA LEU A 58 4.627 12.363 20.495 1.00 0.00 H ATOM 876 HB2 LEU A 58 2.651 11.059 21.337 1.00 0.00 H ATOM 877 HB3 LEU A 58 2.276 11.999 19.873 1.00 0.00 H ATOM 878 HG LEU A 58 2.779 9.697 18.665 1.00 0.00 H ATOM 879 HD21 LEU A 58 0.232 10.272 20.231 1.00 0.00 H ATOM 880 HD22 LEU A 58 0.643 10.928 18.627 1.00 0.00 H ATOM 881 HD23 LEU A 58 0.370 9.180 18.831 1.00 0.00 H ATOM 882 HD11 LEU A 58 3.505 8.551 20.726 1.00 0.00 H ATOM 883 HD12 LEU A 58 1.921 8.880 21.470 1.00 0.00 H ATOM 884 HD13 LEU A 58 2.035 7.798 20.060 1.00 0.00 H ATOM 885 H LEU A 58 4.801 10.685 18.072 1.00 0.00 H ATOM 886 N GLN A 59 4.983 10.318 22.105 1.00 43.28 N ATOM 887 CA GLN A 59 5.693 9.350 22.922 1.00 40.25 C ATOM 888 C GLN A 59 4.689 8.476 23.647 1.00 41.69 C ATOM 889 O GLN A 59 3.684 8.968 24.169 1.00 43.39 O ATOM 890 CB GLN A 59 6.573 10.062 23.947 1.00 54.19 C ATOM 891 CG GLN A 59 7.534 11.074 23.352 1.00 57.68 C ATOM 892 CD GLN A 59 8.279 11.865 24.419 1.00 61.07 C ATOM 893 OE1 GLN A 59 7.670 12.449 25.320 1.00 63.20 O ATOM 894 NE2 GLN A 59 9.601 11.895 24.314 1.00 65.82 N ATOM 895 HA GLN A 59 6.325 8.739 22.277 1.00 0.00 H ATOM 896 HB2 GLN A 59 5.924 10.581 24.652 1.00 0.00 H ATOM 897 HB3 GLN A 59 7.156 9.309 24.478 1.00 0.00 H ATOM 898 HG2 GLN A 59 8.262 10.546 22.736 1.00 0.00 H ATOM 899 HG3 GLN A 59 6.970 11.769 22.730 1.00 0.00 H ATOM 900 HE22 GLN A 59 10.073 11.388 23.538 1.00 0.00 H ATOM 901 HE21 GLN A 59 10.166 12.426 25.008 1.00 0.00 H ATOM 902 H GLN A 59 4.336 10.992 22.562 1.00 0.00 H ATOM 903 N LYS A 60 4.956 7.177 23.672 1.00 41.17 N ATOM 904 CA LYS A 60 4.092 6.226 24.359 1.00 46.75 C ATOM 905 C LYS A 60 4.965 5.264 25.155 1.00 49.22 C ATOM 906 O LYS A 60 5.998 4.803 24.669 1.00 50.45 O ATOM 907 CB LYS A 60 3.234 5.439 23.362 1.00 57.95 C ATOM 908 CG LYS A 60 2.376 4.365 24.019 1.00 62.76 C ATOM 909 CD LYS A 60 1.376 4.980 24.983 1.00 63.86 C ATOM 910 CE LYS A 60 1.073 4.059 26.160 1.00 66.01 C ATOM 911 NZ LYS A 60 0.446 2.778 25.753 1.00 64.79 N ATOM 912 HA LYS A 60 3.421 6.771 25.023 1.00 0.00 H ATOM 913 HB2 LYS A 60 2.577 6.138 22.844 1.00 0.00 H ATOM 914 HB3 LYS A 60 3.895 4.960 22.640 1.00 0.00 H ATOM 915 HG2 LYS A 60 1.836 3.818 23.246 1.00 0.00 H ATOM 916 HG3 LYS A 60 3.022 3.678 24.565 1.00 0.00 H ATOM 917 HD2 LYS A 60 1.785 5.916 25.365 1.00 0.00 H ATOM 918 HD3 LYS A 60 0.449 5.182 24.447 1.00 0.00 H ATOM 919 HE2 LYS A 60 0.396 4.576 26.840 1.00 0.00 H ATOM 920 HE3 LYS A 60 2.007 3.839 26.678 1.00 0.00 H ATOM 921 HZ1 LYS A 60 -0.452 2.972 25.266 1.00 0.00 H ATOM 922 HZ2 LYS A 60 1.086 2.268 25.111 1.00 0.00 H ATOM 923 HZ3 LYS A 60 0.266 2.198 26.597 1.00 0.00 H ATOM 924 H LYS A 60 5.807 6.827 23.187 1.00 0.00 H ATOM 925 N TRP A 61 4.556 4.959 26.379 1.00 61.60 N ATOM 926 CA TRP A 61 5.334 4.055 27.206 1.00 68.08 C ATOM 927 C TRP A 61 4.960 2.594 26.997 1.00 71.31 C ATOM 928 O TRP A 61 4.106 2.052 27.695 1.00 71.08 O ATOM 929 CB TRP A 61 5.191 4.425 28.683 1.00 69.15 C ATOM 930 CG TRP A 61 6.115 3.660 29.569 1.00 70.74 C ATOM 931 CD1 TRP A 61 5.881 2.447 30.151 1.00 71.65 C ATOM 932 CD2 TRP A 61 7.434 4.048 29.965 1.00 71.21 C ATOM 933 NE1 TRP A 61 6.973 2.057 30.890 1.00 72.27 N ATOM 934 CE2 TRP A 61 7.941 3.021 30.794 1.00 71.66 C ATOM 935 CE3 TRP A 61 8.240 5.166 29.700 1.00 70.56 C ATOM 936 CZ2 TRP A 61 9.217 3.078 31.363 1.00 71.56 C ATOM 937 CZ3 TRP A 61 9.511 5.223 30.267 1.00 69.43 C ATOM 938 CH2 TRP A 61 9.985 4.183 31.091 1.00 69.73 C ATOM 939 HA TRP A 61 6.374 4.168 26.899 1.00 0.00 H ATOM 940 HB2 TRP A 61 5.402 5.488 28.797 1.00 0.00 H ATOM 941 HB3 TRP A 61 4.166 4.224 28.994 1.00 0.00 H ATOM 942 HE1 TRP A 61 7.051 1.174 31.433 1.00 0.00 H ATOM 943 HD1 TRP A 61 4.962 1.871 30.045 1.00 0.00 H ATOM 944 HZ2 TRP A 61 9.588 2.275 31.999 1.00 0.00 H ATOM 945 HH2 TRP A 61 10.983 4.257 31.522 1.00 0.00 H ATOM 946 HZ3 TRP A 61 10.148 6.085 30.070 1.00 0.00 H ATOM 947 HE3 TRP A 61 7.879 5.973 29.063 1.00 0.00 H ATOM 948 H TRP A 61 3.674 5.369 26.748 1.00 0.00 H ATOM 949 N GLU A 62 5.604 1.969 26.018 1.00118.99 N ATOM 950 CA GLU A 62 5.376 0.563 25.715 1.00124.41 C ATOM 951 C GLU A 62 6.572 -0.186 26.288 1.00125.88 C ATOM 952 O GLU A 62 7.687 0.341 26.305 1.00127.13 O ATOM 953 CB GLU A 62 5.312 0.336 24.202 1.00 87.58 C ATOM 954 CG GLU A 62 4.294 1.194 23.468 1.00 89.37 C ATOM 955 CD GLU A 62 4.382 1.034 21.959 1.00 89.81 C ATOM 956 OE1 GLU A 62 3.717 1.808 21.236 1.00 89.57 O ATOM 957 OE2 GLU A 62 5.117 0.134 21.497 1.00 90.45 O ATOM 958 HA GLU A 62 4.432 0.221 26.139 1.00 0.00 H ATOM 959 HB2 GLU A 62 6.297 0.548 23.786 1.00 0.00 H ATOM 960 HB3 GLU A 62 5.062 -0.710 24.027 1.00 0.00 H ATOM 961 HG2 GLU A 62 3.294 0.907 23.793 1.00 0.00 H ATOM 962 HG3 GLU A 62 4.470 2.240 23.720 1.00 0.00 H ATOM 963 H GLU A 62 6.293 2.501 25.449 1.00 0.00 H ATOM 964 N ASN A 63 6.343 -1.406 26.757 1.00110.21 N ATOM 965 CA ASN A 63 7.415 -2.213 27.330 1.00110.69 C ATOM 966 C ASN A 63 7.979 -1.521 28.569 1.00110.36 C ATOM 967 O ASN A 63 7.229 -1.031 29.416 1.00111.38 O ATOM 968 CB ASN A 63 8.531 -2.417 26.298 1.00157.15 C ATOM 969 CG ASN A 63 8.006 -2.895 24.958 1.00159.52 C ATOM 970 OD1 ASN A 63 7.377 -3.949 24.863 1.00161.04 O ATOM 971 ND2 ASN A 63 8.264 -2.118 23.911 1.00160.39 N ATOM 972 HA ASN A 63 7.012 -3.185 27.613 1.00 0.00 H ATOM 973 HB2 ASN A 63 9.050 -1.469 26.152 1.00 0.00 H ATOM 974 HB3 ASN A 63 9.232 -3.158 26.683 1.00 0.00 H ATOM 975 HD22 ASN A 63 8.799 -1.235 24.038 1.00 0.00 H ATOM 976 HD21 ASN A 63 7.931 -2.393 22.965 1.00 0.00 H ATOM 977 H ASN A 63 5.379 -1.795 26.715 1.00 0.00 H ATOM 978 N GLY A 64 9.303 -1.484 28.670 1.00 87.42 N ATOM 979 CA GLY A 64 9.938 -0.845 29.806 1.00 87.34 C ATOM 980 C GLY A 64 10.681 0.404 29.380 1.00 84.70 C ATOM 981 O GLY A 64 11.713 0.754 29.955 1.00 84.60 O ATOM 982 HA3 GLY A 64 10.643 -1.542 30.260 1.00 0.00 H ATOM 983 HA2 GLY A 64 9.175 -0.575 30.536 1.00 0.00 H ATOM 984 H GLY A 64 9.889 -1.917 27.928 1.00 0.00 H ATOM 985 N GLU A 65 10.151 1.081 28.367 1.00 86.81 N ATOM 986 CA GLU A 65 10.780 2.292 27.860 1.00 82.90 C ATOM 987 C GLU A 65 9.816 3.212 27.125 1.00 77.41 C ATOM 988 O GLU A 65 8.710 2.822 26.742 1.00 73.58 O ATOM 989 CB GLU A 65 11.935 1.931 26.925 1.00114.15 C ATOM 990 CG GLU A 65 11.516 1.095 25.729 1.00118.87 C ATOM 991 CD GLU A 65 12.639 0.908 24.730 1.00120.68 C ATOM 992 OE1 GLU A 65 13.710 0.404 25.128 1.00121.89 O ATOM 993 OE2 GLU A 65 12.448 1.264 23.548 1.00121.85 O ATOM 994 HA GLU A 65 11.143 2.834 28.733 1.00 0.00 H ATOM 995 HB2 GLU A 65 12.383 2.855 26.559 1.00 0.00 H ATOM 996 HB3 GLU A 65 12.676 1.370 27.494 1.00 0.00 H ATOM 997 HG2 GLU A 65 11.195 0.115 26.082 1.00 0.00 H ATOM 998 HG3 GLU A 65 10.683 1.591 25.230 1.00 0.00 H ATOM 999 H GLU A 65 9.272 0.740 27.929 1.00 0.00 H ATOM 1000 N CYS A 66 10.263 4.442 26.924 1.00 59.15 N ATOM 1001 CA CYS A 66 9.475 5.444 26.241 1.00 54.54 C ATOM 1002 C CYS A 66 9.688 5.288 24.741 1.00 55.21 C ATOM 1003 O CYS A 66 10.791 5.501 24.233 1.00 55.07 O ATOM 1004 CB CYS A 66 9.907 6.835 26.704 1.00 58.12 C ATOM 1005 SG CYS A 66 8.786 8.161 26.176 1.00 55.86 S ATOM 1006 HA CYS A 66 8.417 5.318 26.470 1.00 0.00 H ATOM 1007 HB2 CYS A 66 10.898 7.040 26.299 1.00 0.00 H ATOM 1008 HB3 CYS A 66 9.953 6.836 27.793 1.00 0.00 H ATOM 1009 H CYS A 66 11.211 4.696 27.268 1.00 0.00 H ATOM 1010 N ALA A 67 8.628 4.913 24.035 1.00 48.62 N ATOM 1011 CA ALA A 67 8.712 4.708 22.600 1.00 46.28 C ATOM 1012 C ALA A 67 8.218 5.907 21.791 1.00 45.19 C ATOM 1013 O ALA A 67 7.219 6.533 22.130 1.00 46.75 O ATOM 1014 CB ALA A 67 7.930 3.451 22.217 1.00 49.43 C ATOM 1015 HA ALA A 67 9.767 4.586 22.354 1.00 0.00 H ATOM 1016 HB1 ALA A 67 8.354 2.590 22.733 1.00 0.00 H ATOM 1017 HB2 ALA A 67 6.886 3.572 22.507 1.00 0.00 H ATOM 1018 HB3 ALA A 67 7.994 3.299 21.140 1.00 0.00 H ATOM 1019 H ALA A 67 7.720 4.763 24.519 1.00 0.00 H ATOM 1020 N GLN A 68 8.931 6.224 20.718 1.00 51.91 N ATOM 1021 CA GLN A 68 8.558 7.335 19.854 1.00 53.17 C ATOM 1022 C GLN A 68 7.614 6.768 18.792 1.00 52.59 C ATOM 1023 O GLN A 68 7.921 5.758 18.158 1.00 57.61 O ATOM 1024 CB GLN A 68 9.810 7.931 19.206 1.00 66.84 C ATOM 1025 CG GLN A 68 9.695 9.389 18.759 1.00 73.16 C ATOM 1026 CD GLN A 68 8.781 9.586 17.560 1.00 76.51 C ATOM 1027 OE1 GLN A 68 7.557 9.582 17.687 1.00 78.30 O ATOM 1028 NE2 GLN A 68 9.378 9.752 16.385 1.00 77.62 N ATOM 1029 HA GLN A 68 8.069 8.131 20.415 1.00 0.00 H ATOM 1030 HB2 GLN A 68 10.625 7.865 19.927 1.00 0.00 H ATOM 1031 HB3 GLN A 68 10.052 7.330 18.330 1.00 0.00 H ATOM 1032 HG2 GLN A 68 9.305 9.975 19.591 1.00 0.00 H ATOM 1033 HG3 GLN A 68 10.690 9.749 18.498 1.00 0.00 H ATOM 1034 HE22 GLN A 68 10.416 9.748 16.324 1.00 0.00 H ATOM 1035 HE21 GLN A 68 8.807 9.885 15.526 1.00 0.00 H ATOM 1036 H GLN A 68 9.777 5.665 20.488 1.00 0.00 H ATOM 1037 N LYS A 69 6.459 7.408 18.620 1.00 53.35 N ATOM 1038 CA LYS A 69 5.455 6.970 17.653 1.00 48.98 C ATOM 1039 C LYS A 69 5.153 8.020 16.589 1.00 46.81 C ATOM 1040 O LYS A 69 5.183 9.217 16.856 1.00 45.94 O ATOM 1041 CB LYS A 69 4.158 6.616 18.384 1.00 75.15 C ATOM 1042 CG LYS A 69 3.973 5.142 18.679 1.00 74.94 C ATOM 1043 CD LYS A 69 3.618 4.386 17.408 1.00 77.23 C ATOM 1044 CE LYS A 69 3.309 2.925 17.691 1.00 78.10 C ATOM 1045 NZ LYS A 69 2.929 2.193 16.450 1.00 79.65 N ATOM 1046 HA LYS A 69 5.868 6.099 17.144 1.00 0.00 H ATOM 1047 HB2 LYS A 69 4.145 7.155 19.331 1.00 0.00 H ATOM 1048 HB3 LYS A 69 3.321 6.946 17.768 1.00 0.00 H ATOM 1049 HG2 LYS A 69 4.899 4.739 19.090 1.00 0.00 H ATOM 1050 HG3 LYS A 69 3.170 5.019 19.406 1.00 0.00 H ATOM 1051 HD2 LYS A 69 2.743 4.851 16.953 1.00 0.00 H ATOM 1052 HD3 LYS A 69 4.459 4.442 16.717 1.00 0.00 H ATOM 1053 HE2 LYS A 69 2.484 2.869 18.401 1.00 0.00 H ATOM 1054 HE3 LYS A 69 4.192 2.454 18.123 1.00 0.00 H ATOM 1055 HZ1 LYS A 69 2.083 2.633 16.035 1.00 0.00 H ATOM 1056 HZ2 LYS A 69 3.714 2.237 15.769 1.00 0.00 H ATOM 1057 HZ3 LYS A 69 2.726 1.200 16.683 1.00 0.00 H ATOM 1058 H LYS A 69 6.264 8.252 19.196 1.00 0.00 H ATOM 1059 N LYS A 70 4.853 7.565 15.381 1.00 61.07 N ATOM 1060 CA LYS A 70 4.515 8.477 14.296 1.00 61.65 C ATOM 1061 C LYS A 70 3.153 8.075 13.765 1.00 61.98 C ATOM 1062 O LYS A 70 3.008 7.029 13.136 1.00 63.95 O ATOM 1063 CB LYS A 70 5.553 8.401 13.179 1.00 71.64 C ATOM 1064 CG LYS A 70 5.506 9.576 12.217 1.00 74.43 C ATOM 1065 CD LYS A 70 6.802 9.661 11.424 1.00 77.96 C ATOM 1066 CE LYS A 70 6.974 11.018 10.769 1.00 80.63 C ATOM 1067 NZ LYS A 70 8.344 11.169 10.206 1.00 80.16 N ATOM 1068 HA LYS A 70 4.500 9.503 14.664 1.00 0.00 H ATOM 1069 HB2 LYS A 70 6.544 8.367 13.632 1.00 0.00 H ATOM 1070 HB3 LYS A 70 5.382 7.486 12.612 1.00 0.00 H ATOM 1071 HG2 LYS A 70 4.671 9.445 11.529 1.00 0.00 H ATOM 1072 HG3 LYS A 70 5.368 10.498 12.782 1.00 0.00 H ATOM 1073 HD2 LYS A 70 7.640 9.485 12.098 1.00 0.00 H ATOM 1074 HD3 LYS A 70 6.793 8.894 10.650 1.00 0.00 H ATOM 1075 HE2 LYS A 70 6.806 11.797 11.513 1.00 0.00 H ATOM 1076 HE3 LYS A 70 6.245 11.121 9.966 1.00 0.00 H ATOM 1077 HZ1 LYS A 70 9.044 11.076 10.970 1.00 0.00 H ATOM 1078 HZ2 LYS A 70 8.508 10.430 9.492 1.00 0.00 H ATOM 1079 HZ3 LYS A 70 8.434 12.106 9.764 1.00 0.00 H ATOM 1080 H LYS A 70 4.859 6.540 15.205 1.00 0.00 H ATOM 1081 N ILE A 71 2.150 8.900 14.043 1.00 72.65 N ATOM 1082 CA ILE A 71 0.789 8.624 13.601 1.00 72.25 C ATOM 1083 C ILE A 71 0.296 9.642 12.582 1.00 72.34 C ATOM 1084 O ILE A 71 0.621 10.826 12.656 1.00 75.66 O ATOM 1085 CB ILE A 71 -0.190 8.607 14.797 1.00 97.31 C ATOM 1086 CG1 ILE A 71 -0.028 7.302 15.583 1.00 99.48 C ATOM 1087 CG2 ILE A 71 -1.620 8.752 14.307 1.00 95.44 C ATOM 1088 CD1 ILE A 71 1.332 7.111 16.233 1.00 69.59 C ATOM 1089 HA ILE A 71 0.816 7.642 13.128 1.00 0.00 H ATOM 1090 HB ILE A 71 0.038 9.446 15.454 1.00 0.00 H ATOM 1091 HG12 ILE A 71 -0.784 7.283 16.368 1.00 0.00 H ATOM 1092 HG13 ILE A 71 -0.196 6.471 14.898 1.00 0.00 H ATOM 1093 HD11 ILE A 71 2.104 7.112 15.464 1.00 0.00 H ATOM 1094 HD12 ILE A 71 1.515 7.925 16.935 1.00 0.00 H ATOM 1095 HD13 ILE A 71 1.349 6.160 16.765 1.00 0.00 H ATOM 1096 HG21 ILE A 71 -1.726 9.696 13.772 1.00 0.00 H ATOM 1097 HG22 ILE A 71 -1.859 7.925 13.638 1.00 0.00 H ATOM 1098 HG23 ILE A 71 -2.298 8.738 15.160 1.00 0.00 H ATOM 1099 H ILE A 71 2.340 9.764 14.589 1.00 0.00 H ATOM 1100 N ILE A 72 -0.492 9.168 11.627 1.00 61.49 N ATOM 1101 CA ILE A 72 -1.047 10.030 10.598 1.00 61.87 C ATOM 1102 C ILE A 72 -2.574 10.057 10.682 1.00 56.23 C ATOM 1103 O ILE A 72 -3.246 9.025 10.624 1.00 50.86 O ATOM 1104 CB ILE A 72 -0.585 9.581 9.180 1.00 55.29 C ATOM 1105 CG1 ILE A 72 -1.577 10.065 8.120 1.00 57.76 C ATOM 1106 CG2 ILE A 72 -0.413 8.068 9.136 1.00 58.60 C ATOM 1107 CD1 ILE A 72 -1.773 11.560 8.095 1.00 55.56 C ATOM 1108 HA ILE A 72 -0.674 11.040 10.770 1.00 0.00 H ATOM 1109 HB ILE A 72 0.382 10.033 8.960 1.00 0.00 H ATOM 1110 HG12 ILE A 72 -1.213 9.751 7.142 1.00 0.00 H ATOM 1111 HG13 ILE A 72 -2.542 9.596 8.315 1.00 0.00 H ATOM 1112 HD11 ILE A 72 -2.150 11.892 9.062 1.00 0.00 H ATOM 1113 HD12 ILE A 72 -0.820 12.047 7.888 1.00 0.00 H ATOM 1114 HD13 ILE A 72 -2.491 11.818 7.316 1.00 0.00 H ATOM 1115 HG21 ILE A 72 0.337 7.767 9.868 1.00 0.00 H ATOM 1116 HG22 ILE A 72 -1.363 7.589 9.370 1.00 0.00 H ATOM 1117 HG23 ILE A 72 -0.090 7.769 8.139 1.00 0.00 H ATOM 1118 H ILE A 72 -0.719 8.153 11.614 1.00 0.00 H ATOM 1119 N ALA A 73 -3.102 11.263 10.847 1.00 40.48 N ATOM 1120 CA ALA A 73 -4.536 11.495 10.941 1.00 40.01 C ATOM 1121 C ALA A 73 -4.997 12.146 9.627 1.00 39.38 C ATOM 1122 O ALA A 73 -4.561 13.251 9.271 1.00 39.90 O ATOM 1123 CB ALA A 73 -4.826 12.401 12.128 1.00 23.14 C ATOM 1124 HA ALA A 73 -5.074 10.559 11.092 1.00 0.00 H ATOM 1125 HB1 ALA A 73 -4.474 11.924 13.042 1.00 0.00 H ATOM 1126 HB2 ALA A 73 -4.311 13.352 11.992 1.00 0.00 H ATOM 1127 HB3 ALA A 73 -5.900 12.574 12.197 1.00 0.00 H ATOM 1128 H ALA A 73 -2.462 12.080 10.912 1.00 0.00 H ATOM 1129 N GLU A 74 -5.868 11.450 8.905 1.00 49.87 N ATOM 1130 CA GLU A 74 -6.356 11.940 7.624 1.00 53.37 C ATOM 1131 C GLU A 74 -7.444 12.998 7.728 1.00 50.71 C ATOM 1132 O GLU A 74 -8.312 12.943 8.603 1.00 53.55 O ATOM 1133 CB GLU A 74 -6.844 10.765 6.783 1.00 96.18 C ATOM 1134 CG GLU A 74 -5.744 9.771 6.463 1.00 98.50 C ATOM 1135 CD GLU A 74 -6.278 8.489 5.872 1.00101.31 C ATOM 1136 OE1 GLU A 74 -6.992 8.555 4.849 1.00102.91 O ATOM 1137 OE2 GLU A 74 -5.983 7.414 6.433 1.00103.81 O ATOM 1138 HA GLU A 74 -5.512 12.436 7.145 1.00 0.00 H ATOM 1139 HB2 GLU A 74 -7.632 10.248 7.331 1.00 0.00 H ATOM 1140 HB3 GLU A 74 -7.248 11.151 5.847 1.00 0.00 H ATOM 1141 HG2 GLU A 74 -5.058 10.226 5.749 1.00 0.00 H ATOM 1142 HG3 GLU A 74 -5.207 9.536 7.382 1.00 0.00 H ATOM 1143 H GLU A 74 -6.209 10.535 9.263 1.00 0.00 H ATOM 1144 N LYS A 75 -7.385 13.969 6.826 1.00 41.86 N ATOM 1145 CA LYS A 75 -8.356 15.052 6.813 1.00 44.92 C ATOM 1146 C LYS A 75 -9.703 14.528 6.352 1.00 45.54 C ATOM 1147 O LYS A 75 -9.774 13.523 5.634 1.00 45.11 O ATOM 1148 CB LYS A 75 -7.913 16.160 5.859 1.00 43.90 C ATOM 1149 CG LYS A 75 -7.962 15.755 4.394 1.00 52.45 C ATOM 1150 CD LYS A 75 -7.717 16.933 3.465 1.00 57.84 C ATOM 1151 CE LYS A 75 -7.746 16.486 2.002 1.00 60.41 C ATOM 1152 NZ LYS A 75 -7.586 17.624 1.047 1.00 62.82 N ATOM 1153 HA LYS A 75 -8.433 15.453 7.824 1.00 0.00 H ATOM 1154 HB2 LYS A 75 -8.567 17.020 6.001 1.00 0.00 H ATOM 1155 HB3 LYS A 75 -6.889 16.439 6.106 1.00 0.00 H ATOM 1156 HG2 LYS A 75 -7.198 14.999 4.212 1.00 0.00 H ATOM 1157 HG3 LYS A 75 -8.945 15.335 4.178 1.00 0.00 H ATOM 1158 HD2 LYS A 75 -8.492 17.682 3.626 1.00 0.00 H ATOM 1159 HD3 LYS A 75 -6.742 17.367 3.687 1.00 0.00 H ATOM 1160 HE2 LYS A 75 -8.700 15.997 1.805 1.00 0.00 H ATOM 1161 HE3 LYS A 75 -6.935 15.776 1.838 1.00 0.00 H ATOM 1162 HZ1 LYS A 75 -8.360 18.305 1.188 1.00 0.00 H ATOM 1163 HZ2 LYS A 75 -6.674 18.094 1.219 1.00 0.00 H ATOM 1164 HZ3 LYS A 75 -7.613 17.263 0.072 1.00 0.00 H ATOM 1165 H LYS A 75 -6.628 13.956 6.113 1.00 0.00 H ATOM 1166 N THR A 76 -10.764 15.218 6.769 1.00 40.35 N ATOM 1167 CA THR A 76 -12.125 14.861 6.387 1.00 39.63 C ATOM 1168 C THR A 76 -12.757 16.099 5.757 1.00 44.08 C ATOM 1169 O THR A 76 -12.071 17.095 5.523 1.00 46.76 O ATOM 1170 CB THR A 76 -12.976 14.416 7.616 1.00 34.49 C ATOM 1171 OG1 THR A 76 -13.155 15.527 8.511 1.00 31.34 O ATOM 1172 CG2 THR A 76 -12.302 13.268 8.338 1.00 33.54 C ATOM 1173 HA THR A 76 -12.096 14.021 5.693 1.00 0.00 H ATOM 1174 HB THR A 76 -13.951 14.078 7.266 1.00 0.00 H ATOM 1175 HG1 THR A 76 -12.270 15.845 8.822 1.00 0.00 H ATOM 1176 HG23 THR A 76 -12.172 12.433 7.649 1.00 0.00 H ATOM 1177 HG21 THR A 76 -11.328 13.593 8.705 1.00 0.00 H ATOM 1178 HG22 THR A 76 -12.922 12.955 9.178 1.00 0.00 H ATOM 1179 H THR A 76 -10.616 16.040 7.389 1.00 0.00 H ATOM 1180 N LYS A 77 -14.057 16.041 5.488 1.00 43.44 N ATOM 1181 CA LYS A 77 -14.746 17.173 4.888 1.00 45.28 C ATOM 1182 C LYS A 77 -14.873 18.281 5.922 1.00 43.14 C ATOM 1183 O LYS A 77 -15.145 19.438 5.592 1.00 45.74 O ATOM 1184 CB LYS A 77 -16.115 16.742 4.371 1.00 64.32 C ATOM 1185 CG LYS A 77 -16.015 15.720 3.245 1.00 71.20 C ATOM 1186 CD LYS A 77 -17.368 15.115 2.886 1.00 75.92 C ATOM 1187 CE LYS A 77 -17.219 14.000 1.852 1.00 77.81 C ATOM 1188 NZ LYS A 77 -18.487 13.236 1.658 1.00 80.91 N ATOM 1189 HA LYS A 77 -14.174 17.547 4.039 1.00 0.00 H ATOM 1190 HB2 LYS A 77 -16.678 16.302 5.194 1.00 0.00 H ATOM 1191 HB3 LYS A 77 -16.642 17.621 4.001 1.00 0.00 H ATOM 1192 HG2 LYS A 77 -15.605 16.211 2.362 1.00 0.00 H ATOM 1193 HG3 LYS A 77 -15.345 14.919 3.558 1.00 0.00 H ATOM 1194 HD2 LYS A 77 -17.825 14.706 3.787 1.00 0.00 H ATOM 1195 HD3 LYS A 77 -18.010 15.896 2.477 1.00 0.00 H ATOM 1196 HE2 LYS A 77 -16.442 13.312 2.187 1.00 0.00 H ATOM 1197 HE3 LYS A 77 -16.926 14.441 0.899 1.00 0.00 H ATOM 1198 HZ1 LYS A 77 -18.772 12.804 2.560 1.00 0.00 H ATOM 1199 HZ2 LYS A 77 -19.233 13.882 1.331 1.00 0.00 H ATOM 1200 HZ3 LYS A 77 -18.336 12.491 0.948 1.00 0.00 H ATOM 1201 H LYS A 77 -14.589 15.175 5.709 1.00 0.00 H ATOM 1202 N ILE A 78 -14.656 17.926 7.181 1.00 48.53 N ATOM 1203 CA ILE A 78 -14.722 18.907 8.254 1.00 41.23 C ATOM 1204 C ILE A 78 -13.294 19.329 8.607 1.00 35.73 C ATOM 1205 O ILE A 78 -12.515 18.551 9.166 1.00 38.36 O ATOM 1206 CB ILE A 78 -15.433 18.319 9.491 1.00 51.98 C ATOM 1207 CG1 ILE A 78 -16.853 17.904 9.102 1.00 54.00 C ATOM 1208 CG2 ILE A 78 -15.468 19.343 10.623 1.00 51.67 C ATOM 1209 CD1 ILE A 78 -17.555 17.078 10.149 1.00 43.65 C ATOM 1210 HA ILE A 78 -15.297 19.773 7.926 1.00 0.00 H ATOM 1211 HB ILE A 78 -14.884 17.446 9.843 1.00 0.00 H ATOM 1212 HG12 ILE A 78 -17.439 18.806 8.926 1.00 0.00 H ATOM 1213 HG13 ILE A 78 -16.801 17.321 8.182 1.00 0.00 H ATOM 1214 HD11 ILE A 78 -16.989 16.164 10.329 1.00 0.00 H ATOM 1215 HD12 ILE A 78 -17.627 17.651 11.074 1.00 0.00 H ATOM 1216 HD13 ILE A 78 -18.555 16.824 9.799 1.00 0.00 H ATOM 1217 HG21 ILE A 78 -14.449 19.616 10.896 1.00 0.00 H ATOM 1218 HG22 ILE A 78 -16.007 20.231 10.292 1.00 0.00 H ATOM 1219 HG23 ILE A 78 -15.973 18.911 11.487 1.00 0.00 H ATOM 1220 H ILE A 78 -14.436 16.934 7.404 1.00 0.00 H ATOM 1221 N PRO A 79 -12.933 20.574 8.271 1.00 33.69 N ATOM 1222 CA PRO A 79 -11.604 21.136 8.531 1.00 38.27 C ATOM 1223 C PRO A 79 -11.000 20.922 9.922 1.00 44.32 C ATOM 1224 O PRO A 79 -9.788 21.035 10.091 1.00 48.10 O ATOM 1225 CB PRO A 79 -11.780 22.623 8.202 1.00 37.53 C ATOM 1226 CG PRO A 79 -13.290 22.850 8.273 1.00 36.07 C ATOM 1227 CD PRO A 79 -13.832 21.586 7.693 1.00 34.64 C ATOM 1228 HA PRO A 79 -10.867 20.611 7.924 1.00 0.00 H ATOM 1229 HD3 PRO A 79 -14.865 21.420 8.000 1.00 0.00 H ATOM 1230 HD2 PRO A 79 -13.774 21.592 6.605 1.00 0.00 H ATOM 1231 HG3 PRO A 79 -13.587 23.715 7.681 1.00 0.00 H ATOM 1232 HG2 PRO A 79 -13.621 22.985 9.303 1.00 0.00 H ATOM 1233 HB2 PRO A 79 -11.261 23.244 8.932 1.00 0.00 H ATOM 1234 HB3 PRO A 79 -11.402 22.845 7.204 1.00 0.00 H ATOM 1235 N ALA A 80 -11.824 20.597 10.912 1.00 48.98 N ATOM 1236 CA ALA A 80 -11.309 20.410 12.270 1.00 42.58 C ATOM 1237 C ALA A 80 -11.345 18.961 12.749 1.00 41.71 C ATOM 1238 O ALA A 80 -10.947 18.667 13.868 1.00 45.11 O ATOM 1239 CB ALA A 80 -12.087 21.305 13.250 1.00 27.43 C ATOM 1240 HA ALA A 80 -10.258 20.696 12.242 1.00 0.00 H ATOM 1241 HB1 ALA A 80 -11.968 22.349 12.959 1.00 0.00 H ATOM 1242 HB2 ALA A 80 -13.143 21.037 13.224 1.00 0.00 H ATOM 1243 HB3 ALA A 80 -11.699 21.161 14.258 1.00 0.00 H ATOM 1244 H ALA A 80 -12.839 20.475 10.722 1.00 0.00 H ATOM 1245 N VAL A 81 -11.824 18.061 11.899 1.00 39.85 N ATOM 1246 CA VAL A 81 -11.919 16.655 12.260 1.00 34.34 C ATOM 1247 C VAL A 81 -11.022 15.805 11.384 1.00 36.81 C ATOM 1248 O VAL A 81 -10.960 15.995 10.170 1.00 45.09 O ATOM 1249 CB VAL A 81 -13.373 16.145 12.134 1.00 30.55 C ATOM 1250 CG1 VAL A 81 -13.423 14.650 12.376 1.00 25.96 C ATOM 1251 CG2 VAL A 81 -14.263 16.882 13.134 1.00 36.03 C ATOM 1252 HA VAL A 81 -11.596 16.569 13.297 1.00 0.00 H ATOM 1253 HB VAL A 81 -13.739 16.341 11.126 1.00 0.00 H ATOM 1254 HG11 VAL A 81 -12.800 14.143 11.639 1.00 0.00 H ATOM 1255 HG12 VAL A 81 -13.053 14.433 13.378 1.00 0.00 H ATOM 1256 HG13 VAL A 81 -14.452 14.303 12.285 1.00 0.00 H ATOM 1257 HG21 VAL A 81 -13.900 16.698 14.145 1.00 0.00 H ATOM 1258 HG22 VAL A 81 -14.234 17.951 12.925 1.00 0.00 H ATOM 1259 HG23 VAL A 81 -15.287 16.520 13.043 1.00 0.00 H ATOM 1260 H VAL A 81 -12.138 18.367 10.956 1.00 0.00 H ATOM 1261 N PHE A 82 -10.331 14.861 12.010 1.00 35.07 N ATOM 1262 CA PHE A 82 -9.417 13.995 11.293 1.00 39.19 C ATOM 1263 C PHE A 82 -9.695 12.548 11.663 1.00 45.45 C ATOM 1264 O PHE A 82 -10.361 12.274 12.657 1.00 49.48 O ATOM 1265 CB PHE A 82 -7.962 14.405 11.595 1.00 23.35 C ATOM 1266 CG PHE A 82 -7.646 15.836 11.209 1.00 26.78 C ATOM 1267 CD1 PHE A 82 -8.064 16.902 12.008 1.00 28.69 C ATOM 1268 CD2 PHE A 82 -7.000 16.120 10.006 1.00 29.62 C ATOM 1269 CE1 PHE A 82 -7.845 18.238 11.607 1.00 30.90 C ATOM 1270 CE2 PHE A 82 -6.773 17.450 9.591 1.00 30.42 C ATOM 1271 CZ PHE A 82 -7.195 18.505 10.385 1.00 32.48 C ATOM 1272 HA PHE A 82 -9.567 14.097 10.218 1.00 0.00 H ATOM 1273 HB2 PHE A 82 -7.785 14.288 12.664 1.00 0.00 H ATOM 1274 HB3 PHE A 82 -7.295 13.743 11.043 1.00 0.00 H ATOM 1275 HD2 PHE A 82 -6.664 15.298 9.374 1.00 0.00 H ATOM 1276 HE2 PHE A 82 -6.266 17.647 8.646 1.00 0.00 H ATOM 1277 HZ PHE A 82 -7.025 19.534 10.067 1.00 0.00 H ATOM 1278 HE1 PHE A 82 -8.178 19.060 12.240 1.00 0.00 H ATOM 1279 HD1 PHE A 82 -8.566 16.700 12.954 1.00 0.00 H ATOM 1280 H PHE A 82 -10.448 14.740 13.036 1.00 0.00 H ATOM 1281 N LYS A 83 -9.205 11.628 10.838 1.00 35.15 N ATOM 1282 CA LYS A 83 -9.424 10.206 11.046 1.00 47.04 C ATOM 1283 C LYS A 83 -8.116 9.433 10.944 1.00 52.24 C ATOM 1284 O LYS A 83 -7.471 9.404 9.896 1.00 50.79 O ATOM 1285 CB LYS A 83 -10.420 9.686 10.007 1.00 73.08 C ATOM 1286 CG LYS A 83 -10.794 8.223 10.160 1.00 82.87 C ATOM 1287 CD LYS A 83 -11.791 7.802 9.088 1.00 89.06 C ATOM 1288 CE LYS A 83 -12.187 6.338 9.233 1.00 93.46 C ATOM 1289 NZ LYS A 83 -13.145 5.913 8.177 1.00 98.23 N ATOM 1290 HA LYS A 83 -9.828 10.059 12.048 1.00 0.00 H ATOM 1291 HB2 LYS A 83 -11.331 10.279 10.084 1.00 0.00 H ATOM 1292 HB3 LYS A 83 -9.982 9.823 9.018 1.00 0.00 H ATOM 1293 HG2 LYS A 83 -9.895 7.613 10.071 1.00 0.00 H ATOM 1294 HG3 LYS A 83 -11.240 8.069 11.143 1.00 0.00 H ATOM 1295 HD2 LYS A 83 -12.685 8.420 9.173 1.00 0.00 H ATOM 1296 HD3 LYS A 83 -11.340 7.951 8.107 1.00 0.00 H ATOM 1297 HE2 LYS A 83 -12.651 6.194 10.209 1.00 0.00 H ATOM 1298 HE3 LYS A 83 -11.290 5.722 9.164 1.00 0.00 H ATOM 1299 HZ1 LYS A 83 -14.007 6.491 8.240 1.00 0.00 H ATOM 1300 HZ2 LYS A 83 -12.708 6.041 7.242 1.00 0.00 H ATOM 1301 HZ3 LYS A 83 -13.387 4.911 8.314 1.00 0.00 H ATOM 1302 H LYS A 83 -8.646 11.936 10.016 1.00 0.00 H ATOM 1303 N ILE A 84 -7.727 8.809 12.048 1.00 60.03 N ATOM 1304 CA ILE A 84 -6.503 8.034 12.080 1.00 69.05 C ATOM 1305 C ILE A 84 -6.852 6.597 11.731 1.00 76.14 C ATOM 1306 O ILE A 84 -7.779 6.016 12.299 1.00 73.54 O ATOM 1307 CB ILE A 84 -5.827 8.116 13.472 1.00 63.76 C ATOM 1308 CG1 ILE A 84 -6.741 7.546 14.546 1.00 65.93 C ATOM 1309 CG2 ILE A 84 -5.522 9.568 13.813 1.00 61.94 C ATOM 1310 CD1 ILE A 84 -6.212 7.762 15.941 1.00 46.89 C ATOM 1311 HA ILE A 84 -5.791 8.434 11.358 1.00 0.00 H ATOM 1312 HB ILE A 84 -4.905 7.536 13.437 1.00 0.00 H ATOM 1313 HG12 ILE A 84 -7.716 8.027 14.465 1.00 0.00 H ATOM 1314 HG13 ILE A 84 -6.851 6.475 14.377 1.00 0.00 H ATOM 1315 HD11 ILE A 84 -5.241 7.277 16.039 1.00 0.00 H ATOM 1316 HD12 ILE A 84 -6.106 8.831 16.127 1.00 0.00 H ATOM 1317 HD13 ILE A 84 -6.908 7.334 16.662 1.00 0.00 H ATOM 1318 HG21 ILE A 84 -4.851 9.983 13.061 1.00 0.00 H ATOM 1319 HG22 ILE A 84 -6.450 10.139 13.829 1.00 0.00 H ATOM 1320 HG23 ILE A 84 -5.047 9.618 14.793 1.00 0.00 H ATOM 1321 H ILE A 84 -8.311 8.877 12.906 1.00 0.00 H ATOM 1322 N ASP A 85 -6.118 6.047 10.768 1.00129.28 N ATOM 1323 CA ASP A 85 -6.328 4.684 10.297 1.00137.33 C ATOM 1324 C ASP A 85 -5.868 3.619 11.285 1.00140.37 C ATOM 1325 O ASP A 85 -4.739 3.137 11.217 1.00141.23 O ATOM 1326 CB ASP A 85 -5.618 4.484 8.954 1.00120.56 C ATOM 1327 CG ASP A 85 -4.291 5.225 8.875 1.00123.58 C ATOM 1328 OD1 ASP A 85 -3.456 5.070 9.792 1.00124.35 O ATOM 1329 OD2 ASP A 85 -4.083 5.964 7.889 1.00125.71 O ATOM 1330 HA ASP A 85 -7.405 4.559 10.184 1.00 0.00 H ATOM 1331 HB2 ASP A 85 -5.432 3.419 8.813 1.00 0.00 H ATOM 1332 HB3 ASP A 85 -6.268 4.847 8.158 1.00 0.00 H ATOM 1333 H ASP A 85 -5.362 6.614 10.333 1.00 0.00 H ATOM 1334 N ALA A 86 -6.756 3.253 12.202 1.00 71.70 N ATOM 1335 CA ALA A 86 -6.454 2.237 13.201 1.00 75.64 C ATOM 1336 C ALA A 86 -7.376 1.047 12.977 1.00 78.08 C ATOM 1337 O ALA A 86 -8.233 1.080 12.093 1.00 77.95 O ATOM 1338 CB ALA A 86 -6.658 2.800 14.600 1.00134.42 C ATOM 1339 HA ALA A 86 -5.414 1.923 13.106 1.00 0.00 H ATOM 1340 HB1 ALA A 86 -5.996 3.654 14.747 1.00 0.00 H ATOM 1341 HB2 ALA A 86 -7.694 3.118 14.715 1.00 0.00 H ATOM 1342 HB3 ALA A 86 -6.429 2.030 15.337 1.00 0.00 H ATOM 1343 H ALA A 86 -7.693 3.704 12.207 1.00 0.00 H ATOM 1344 N LEU A 87 -7.197 -0.002 13.776 1.00 96.34 N ATOM 1345 CA LEU A 87 -8.023 -1.200 13.664 1.00 98.92 C ATOM 1346 C LEU A 87 -9.493 -0.812 13.549 1.00100.76 C ATOM 1347 O LEU A 87 -10.306 -1.545 12.981 1.00103.59 O ATOM 1348 CB LEU A 87 -7.824 -2.094 14.889 1.00132.64 C ATOM 1349 CG LEU A 87 -8.874 -3.190 15.083 1.00131.10 C ATOM 1350 CD1 LEU A 87 -8.887 -4.113 13.881 1.00129.98 C ATOM 1351 CD2 LEU A 87 -8.575 -3.961 16.353 1.00129.41 C ATOM 1352 HA LEU A 87 -7.724 -1.747 12.770 1.00 0.00 H ATOM 1353 HB2 LEU A 87 -6.850 -2.574 14.800 1.00 0.00 H ATOM 1354 HB3 LEU A 87 -7.835 -1.458 15.774 1.00 0.00 H ATOM 1355 HG LEU A 87 -9.861 -2.737 15.175 1.00 0.00 H ATOM 1356 HD21 LEU A 87 -7.587 -4.415 16.277 1.00 0.00 H ATOM 1357 HD22 LEU A 87 -8.599 -3.280 17.204 1.00 0.00 H ATOM 1358 HD23 LEU A 87 -9.325 -4.741 16.488 1.00 0.00 H ATOM 1359 HD11 LEU A 87 -9.128 -3.539 12.986 1.00 0.00 H ATOM 1360 HD12 LEU A 87 -7.905 -4.572 13.766 1.00 0.00 H ATOM 1361 HD13 LEU A 87 -9.638 -4.889 14.029 1.00 0.00 H ATOM 1362 H LEU A 87 -6.450 0.033 14.498 1.00 0.00 H ATOM 1363 N ASN A 88 -9.823 0.349 14.102 1.00109.73 N ATOM 1364 CA ASN A 88 -11.182 0.859 14.067 1.00106.77 C ATOM 1365 C ASN A 88 -11.141 2.298 13.579 1.00102.85 C ATOM 1366 O ASN A 88 -10.078 2.813 13.234 1.00104.48 O ATOM 1367 CB ASN A 88 -11.800 0.797 15.463 1.00132.16 C ATOM 1368 CG ASN A 88 -11.753 -0.596 16.055 1.00132.52 C ATOM 1369 OD1 ASN A 88 -12.346 -1.532 15.517 1.00133.01 O ATOM 1370 ND2 ASN A 88 -11.041 -0.742 17.167 1.00132.49 N ATOM 1371 HA ASN A 88 -11.791 0.254 13.395 1.00 0.00 H ATOM 1372 HB2 ASN A 88 -11.253 1.475 16.118 1.00 0.00 H ATOM 1373 HB3 ASN A 88 -12.840 1.116 15.400 1.00 0.00 H ATOM 1374 HD22 ASN A 88 -10.557 0.078 17.586 1.00 0.00 H ATOM 1375 HD21 ASN A 88 -10.968 -1.676 17.619 1.00 0.00 H ATOM 1376 H ASN A 88 -9.086 0.910 14.575 1.00 0.00 H ATOM 1377 N GLU A 89 -12.299 2.944 13.544 1.00108.71 N ATOM 1378 CA GLU A 89 -12.366 4.326 13.104 1.00110.05 C ATOM 1379 C GLU A 89 -12.285 5.268 14.298 1.00 81.11 C ATOM 1380 O GLU A 89 -13.224 5.368 15.089 1.00 79.06 O ATOM 1381 CB GLU A 89 -13.655 4.571 12.311 1.00178.03 C ATOM 1382 CG GLU A 89 -14.918 4.047 12.975 1.00176.44 C ATOM 1383 CD GLU A 89 -16.150 4.230 12.105 1.00179.35 C ATOM 1384 OE1 GLU A 89 -17.250 3.827 12.538 1.00170.16 O ATOM 1385 OE2 GLU A 89 -16.018 4.776 10.989 1.00164.37 O ATOM 1386 HA GLU A 89 -11.516 4.525 12.451 1.00 0.00 H ATOM 1387 HB2 GLU A 89 -13.767 5.646 12.168 1.00 0.00 H ATOM 1388 HB3 GLU A 89 -13.555 4.085 11.340 1.00 0.00 H ATOM 1389 HG2 GLU A 89 -14.790 2.984 13.182 1.00 0.00 H ATOM 1390 HG3 GLU A 89 -15.069 4.582 13.912 1.00 0.00 H ATOM 1391 H GLU A 89 -13.169 2.455 13.835 1.00 0.00 H ATOM 1392 N ASN A 90 -11.144 5.937 14.434 1.00 76.88 N ATOM 1393 CA ASN A 90 -10.934 6.879 15.523 1.00 65.06 C ATOM 1394 C ASN A 90 -10.813 8.290 14.976 1.00 55.81 C ATOM 1395 O ASN A 90 -9.982 8.571 14.108 1.00 54.70 O ATOM 1396 CB ASN A 90 -9.677 6.519 16.317 1.00115.30 C ATOM 1397 CG ASN A 90 -9.898 5.354 17.262 1.00116.42 C ATOM 1398 OD1 ASN A 90 -10.254 4.255 16.838 1.00119.61 O ATOM 1399 ND2 ASN A 90 -9.691 5.592 18.552 1.00116.52 N ATOM 1400 HA ASN A 90 -11.793 6.826 16.192 1.00 0.00 H ATOM 1401 HB2 ASN A 90 -8.885 6.255 15.616 1.00 0.00 H ATOM 1402 HB3 ASN A 90 -9.371 7.388 16.899 1.00 0.00 H ATOM 1403 HD22 ASN A 90 -9.390 6.537 18.865 1.00 0.00 H ATOM 1404 HD21 ASN A 90 -9.829 4.833 19.250 1.00 0.00 H ATOM 1405 H ASN A 90 -10.381 5.783 13.744 1.00 0.00 H ATOM 1406 N LYS A 91 -11.655 9.175 15.489 1.00 49.39 N ATOM 1407 CA LYS A 91 -11.652 10.558 15.050 1.00 42.66 C ATOM 1408 C LYS A 91 -10.849 11.450 15.985 1.00 39.02 C ATOM 1409 O LYS A 91 -10.783 11.226 17.197 1.00 39.93 O ATOM 1410 CB LYS A 91 -13.081 11.088 14.972 1.00 58.65 C ATOM 1411 CG LYS A 91 -13.986 10.313 14.050 1.00 66.15 C ATOM 1412 CD LYS A 91 -15.420 10.789 14.202 1.00 68.64 C ATOM 1413 CE LYS A 91 -16.375 9.959 13.366 1.00 71.44 C ATOM 1414 NZ LYS A 91 -17.792 10.257 13.708 1.00 76.26 N ATOM 1415 HA LYS A 91 -11.185 10.580 14.065 1.00 0.00 H ATOM 1416 HB2 LYS A 91 -13.510 11.060 15.974 1.00 0.00 H ATOM 1417 HB3 LYS A 91 -13.043 12.120 14.624 1.00 0.00 H ATOM 1418 HG2 LYS A 91 -13.664 10.462 13.019 1.00 0.00 H ATOM 1419 HG3 LYS A 91 -13.930 9.253 14.297 1.00 0.00 H ATOM 1420 HD2 LYS A 91 -15.709 10.713 15.250 1.00 0.00 H ATOM 1421 HD3 LYS A 91 -15.483 11.830 13.884 1.00 0.00 H ATOM 1422 HE2 LYS A 91 -16.180 8.902 13.548 1.00 0.00 H ATOM 1423 HE3 LYS A 91 -16.210 10.181 12.312 1.00 0.00 H ATOM 1424 HZ1 LYS A 91 -17.958 10.042 14.712 1.00 0.00 H ATOM 1425 HZ2 LYS A 91 -17.986 11.263 13.531 1.00 0.00 H ATOM 1426 HZ3 LYS A 91 -18.420 9.673 13.119 1.00 0.00 H ATOM 1427 H LYS A 91 -12.331 8.873 16.220 1.00 0.00 H ATOM 1428 N VAL A 92 -10.223 12.458 15.402 1.00 36.86 N ATOM 1429 CA VAL A 92 -9.468 13.418 16.173 1.00 32.83 C ATOM 1430 C VAL A 92 -10.166 14.729 15.888 1.00 37.15 C ATOM 1431 O VAL A 92 -10.385 15.078 14.736 1.00 42.83 O ATOM 1432 CB VAL A 92 -7.990 13.498 15.738 1.00 34.75 C ATOM 1433 CG1 VAL A 92 -7.349 14.716 16.348 1.00 24.24 C ATOM 1434 CG2 VAL A 92 -7.243 12.270 16.199 1.00 34.83 C ATOM 1435 HA VAL A 92 -9.440 13.151 17.229 1.00 0.00 H ATOM 1436 HB VAL A 92 -7.949 13.560 14.651 1.00 0.00 H ATOM 1437 HG11 VAL A 92 -7.875 15.609 16.011 1.00 0.00 H ATOM 1438 HG12 VAL A 92 -7.404 14.648 17.435 1.00 0.00 H ATOM 1439 HG13 VAL A 92 -6.305 14.769 16.039 1.00 0.00 H ATOM 1440 HG21 VAL A 92 -7.292 12.203 17.286 1.00 0.00 H ATOM 1441 HG22 VAL A 92 -7.698 11.383 15.758 1.00 0.00 H ATOM 1442 HG23 VAL A 92 -6.202 12.341 15.885 1.00 0.00 H ATOM 1443 H VAL A 92 -10.275 12.562 14.368 1.00 0.00 H ATOM 1444 N LEU A 93 -10.526 15.447 16.944 1.00 31.00 N ATOM 1445 CA LEU A 93 -11.232 16.710 16.795 1.00 27.21 C ATOM 1446 C LEU A 93 -10.534 17.873 17.484 1.00 25.50 C ATOM 1447 O LEU A 93 -10.188 17.791 18.663 1.00 32.40 O ATOM 1448 CB LEU A 93 -12.659 16.580 17.355 1.00 32.97 C ATOM 1449 CG LEU A 93 -13.563 15.453 16.826 1.00 37.10 C ATOM 1450 CD1 LEU A 93 -13.155 14.100 17.413 1.00 38.25 C ATOM 1451 CD2 LEU A 93 -14.996 15.759 17.193 1.00 39.37 C ATOM 1452 HA LEU A 93 -11.251 16.929 15.727 1.00 0.00 H ATOM 1453 HB2 LEU A 93 -12.569 16.440 18.432 1.00 0.00 H ATOM 1454 HB3 LEU A 93 -13.170 17.522 17.154 1.00 0.00 H ATOM 1455 HG LEU A 93 -13.458 15.396 15.743 1.00 0.00 H ATOM 1456 HD21 LEU A 93 -15.086 15.825 18.277 1.00 0.00 H ATOM 1457 HD22 LEU A 93 -15.290 16.708 16.744 1.00 0.00 H ATOM 1458 HD23 LEU A 93 -15.643 14.964 16.821 1.00 0.00 H ATOM 1459 HD11 LEU A 93 -12.124 13.881 17.135 1.00 0.00 H ATOM 1460 HD12 LEU A 93 -13.240 14.136 18.499 1.00 0.00 H ATOM 1461 HD13 LEU A 93 -13.811 13.323 17.021 1.00 0.00 H ATOM 1462 H LEU A 93 -10.299 15.100 17.898 1.00 0.00 H ATOM 1463 N VAL A 94 -10.332 18.955 16.734 1.00 32.17 N ATOM 1464 CA VAL A 94 -9.716 20.161 17.273 1.00 33.56 C ATOM 1465 C VAL A 94 -10.841 21.095 17.757 1.00 34.71 C ATOM 1466 O VAL A 94 -11.613 21.633 16.951 1.00 37.49 O ATOM 1467 CB VAL A 94 -8.896 20.905 16.207 1.00 29.62 C ATOM 1468 CG1 VAL A 94 -8.206 22.107 16.851 1.00 26.49 C ATOM 1469 CG2 VAL A 94 -7.883 19.955 15.552 1.00 25.91 C ATOM 1470 HA VAL A 94 -9.045 19.876 18.084 1.00 0.00 H ATOM 1471 HB VAL A 94 -9.557 21.267 15.419 1.00 0.00 H ATOM 1472 HG11 VAL A 94 -8.959 22.777 17.267 1.00 0.00 H ATOM 1473 HG12 VAL A 94 -7.545 21.762 17.646 1.00 0.00 H ATOM 1474 HG13 VAL A 94 -7.624 22.637 16.097 1.00 0.00 H ATOM 1475 HG21 VAL A 94 -7.207 19.566 16.313 1.00 0.00 H ATOM 1476 HG22 VAL A 94 -8.414 19.129 15.080 1.00 0.00 H ATOM 1477 HG23 VAL A 94 -7.311 20.498 14.800 1.00 0.00 H ATOM 1478 H VAL A 94 -10.622 18.939 15.735 1.00 0.00 H ATOM 1479 N LEU A 95 -10.907 21.281 19.072 1.00 32.51 N ATOM 1480 CA LEU A 95 -11.925 22.105 19.716 1.00 26.92 C ATOM 1481 C LEU A 95 -11.637 23.585 19.691 1.00 26.55 C ATOM 1482 O LEU A 95 -12.538 24.400 19.550 1.00 29.89 O ATOM 1483 CB LEU A 95 -12.106 21.690 21.183 1.00 33.69 C ATOM 1484 CG LEU A 95 -12.809 20.372 21.511 1.00 32.58 C ATOM 1485 CD1 LEU A 95 -12.100 19.195 20.841 1.00 34.27 C ATOM 1486 CD2 LEU A 95 -12.829 20.207 23.033 1.00 34.77 C ATOM 1487 HA LEU A 95 -12.829 21.933 19.132 1.00 0.00 H ATOM 1488 HB2 LEU A 95 -11.110 21.637 21.623 1.00 0.00 H ATOM 1489 HB3 LEU A 95 -12.675 22.483 21.669 1.00 0.00 H ATOM 1490 HG LEU A 95 -13.829 20.390 21.128 1.00 0.00 H ATOM 1491 HD21 LEU A 95 -11.806 20.190 23.409 1.00 0.00 H ATOM 1492 HD22 LEU A 95 -13.368 21.042 23.481 1.00 0.00 H ATOM 1493 HD23 LEU A 95 -13.327 19.272 23.289 1.00 0.00 H ATOM 1494 HD11 LEU A 95 -12.106 19.337 19.760 1.00 0.00 H ATOM 1495 HD12 LEU A 95 -11.071 19.142 21.197 1.00 0.00 H ATOM 1496 HD13 LEU A 95 -12.620 18.270 21.090 1.00 0.00 H ATOM 1497 H LEU A 95 -10.197 20.815 19.672 1.00 0.00 H ATOM 1498 N ASP A 96 -10.373 23.930 19.856 1.00 34.13 N ATOM 1499 CA ASP A 96 -10.005 25.328 19.881 1.00 32.74 C ATOM 1500 C ASP A 96 -8.502 25.473 19.959 1.00 34.39 C ATOM 1501 O ASP A 96 -7.809 24.600 20.465 1.00 37.03 O ATOM 1502 CB ASP A 96 -10.679 25.991 21.088 1.00 37.23 C ATOM 1503 CG ASP A 96 -10.381 27.463 21.188 1.00 40.60 C ATOM 1504 OD1 ASP A 96 -10.358 28.133 20.132 1.00 44.77 O ATOM 1505 OD2 ASP A 96 -10.186 27.946 22.326 1.00 44.51 O ATOM 1506 HA ASP A 96 -10.339 25.817 18.966 1.00 0.00 H ATOM 1507 HB2 ASP A 96 -11.757 25.859 21.001 1.00 0.00 H ATOM 1508 HB3 ASP A 96 -10.327 25.502 21.996 1.00 0.00 H ATOM 1509 H ASP A 96 -9.643 23.197 19.968 1.00 0.00 H ATOM 1510 N THR A 97 -8.001 26.586 19.451 1.00 29.47 N ATOM 1511 CA THR A 97 -6.567 26.855 19.472 1.00 33.61 C ATOM 1512 C THR A 97 -6.301 28.295 19.043 1.00 36.25 C ATOM 1513 O THR A 97 -7.020 28.848 18.203 1.00 39.43 O ATOM 1514 CB THR A 97 -5.798 25.887 18.524 1.00 34.00 C ATOM 1515 OG1 THR A 97 -4.385 26.037 18.724 1.00 34.72 O ATOM 1516 CG2 THR A 97 -6.142 26.175 17.055 1.00 37.46 C ATOM 1517 HA THR A 97 -6.212 26.699 20.491 1.00 0.00 H ATOM 1518 HB THR A 97 -6.097 24.865 18.757 1.00 0.00 H ATOM 1519 HG1 THR A 97 -4.161 25.823 19.664 1.00 0.00 H ATOM 1520 HG23 THR A 97 -7.216 26.060 16.905 1.00 0.00 H ATOM 1521 HG21 THR A 97 -5.846 27.194 16.807 1.00 0.00 H ATOM 1522 HG22 THR A 97 -5.608 25.474 16.414 1.00 0.00 H ATOM 1523 H THR A 97 -8.643 27.285 19.027 1.00 0.00 H ATOM 1524 N ASP A 98 -5.283 28.905 19.645 1.00 42.44 N ATOM 1525 CA ASP A 98 -4.909 30.268 19.298 1.00 41.79 C ATOM 1526 C ASP A 98 -3.599 30.214 18.518 1.00 43.61 C ATOM 1527 O ASP A 98 -2.941 31.233 18.315 1.00 44.18 O ATOM 1528 CB ASP A 98 -4.761 31.128 20.557 1.00 39.07 C ATOM 1529 CG ASP A 98 -3.456 30.882 21.292 1.00 41.03 C ATOM 1530 OD1 ASP A 98 -2.774 29.883 20.996 1.00 42.42 O ATOM 1531 OD2 ASP A 98 -3.117 31.694 22.176 1.00 41.16 O ATOM 1532 HA ASP A 98 -5.687 30.725 18.686 1.00 0.00 H ATOM 1533 HB2 ASP A 98 -4.805 32.178 20.268 1.00 0.00 H ATOM 1534 HB3 ASP A 98 -5.588 30.903 21.231 1.00 0.00 H ATOM 1535 H ASP A 98 -4.745 28.399 20.377 1.00 0.00 H ATOM 1536 N TYR A 99 -3.237 29.002 18.095 1.00 39.12 N ATOM 1537 CA TYR A 99 -2.022 28.735 17.318 1.00 42.40 C ATOM 1538 C TYR A 99 -0.675 29.007 18.002 1.00 43.32 C ATOM 1539 O TYR A 99 0.248 28.190 17.916 1.00 41.16 O ATOM 1540 CB TYR A 99 -2.078 29.503 15.992 1.00 46.63 C ATOM 1541 CG TYR A 99 -3.260 29.115 15.131 1.00 46.39 C ATOM 1542 CD1 TYR A 99 -3.340 27.843 14.564 1.00 48.37 C ATOM 1543 CD2 TYR A 99 -4.320 29.999 14.925 1.00 47.33 C ATOM 1544 CE1 TYR A 99 -4.446 27.457 13.815 1.00 47.07 C ATOM 1545 CE2 TYR A 99 -5.432 29.623 14.179 1.00 45.39 C ATOM 1546 CZ TYR A 99 -5.488 28.352 13.629 1.00 45.98 C ATOM 1547 OH TYR A 99 -6.582 27.967 12.897 1.00 52.13 O ATOM 1548 HA TYR A 99 -2.038 27.654 17.179 1.00 0.00 H ATOM 1549 HB3 TYR A 99 -1.162 29.302 15.436 1.00 0.00 H ATOM 1550 HB2 TYR A 99 -2.143 30.569 16.211 1.00 0.00 H ATOM 1551 HD2 TYR A 99 -4.276 30.999 15.355 1.00 0.00 H ATOM 1552 HE2 TYR A 99 -6.254 30.323 14.028 1.00 0.00 H ATOM 1553 HE1 TYR A 99 -4.493 26.460 13.378 1.00 0.00 H ATOM 1554 HD1 TYR A 99 -2.521 27.139 14.711 1.00 0.00 H ATOM 1555 HH TYR A 99 -6.456 27.037 12.582 1.00 0.00 H ATOM 1556 H TYR A 99 -3.853 28.198 18.330 1.00 0.00 H ATOM 1557 N LYS A 100 -0.569 30.144 18.680 1.00 52.01 N ATOM 1558 CA LYS A 100 0.666 30.538 19.344 1.00 53.13 C ATOM 1559 C LYS A 100 0.889 30.021 20.774 1.00 53.24 C ATOM 1560 O LYS A 100 2.025 29.745 21.154 1.00 52.81 O ATOM 1561 CB LYS A 100 0.774 32.066 19.341 1.00 65.19 C ATOM 1562 CG LYS A 100 -0.321 32.761 20.132 1.00 70.15 C ATOM 1563 CD LYS A 100 -0.159 34.271 20.096 1.00 74.98 C ATOM 1564 CE LYS A 100 -1.138 34.955 21.040 1.00 79.47 C ATOM 1565 NZ LYS A 100 -2.559 34.674 20.695 1.00 79.86 N ATOM 1566 HA LYS A 100 1.449 30.055 18.759 1.00 0.00 H ATOM 1567 HB2 LYS A 100 1.737 32.343 19.770 1.00 0.00 H ATOM 1568 HB3 LYS A 100 0.725 32.412 18.309 1.00 0.00 H ATOM 1569 HG2 LYS A 100 -1.289 32.498 19.705 1.00 0.00 H ATOM 1570 HG3 LYS A 100 -0.279 32.424 21.168 1.00 0.00 H ATOM 1571 HD2 LYS A 100 0.858 34.526 20.393 1.00 0.00 H ATOM 1572 HD3 LYS A 100 -0.339 34.624 19.080 1.00 0.00 H ATOM 1573 HE2 LYS A 100 -0.974 36.032 20.994 1.00 0.00 H ATOM 1574 HE3 LYS A 100 -0.949 34.603 22.054 1.00 0.00 H ATOM 1575 HZ1 LYS A 100 -2.754 35.013 19.731 1.00 0.00 H ATOM 1576 HZ2 LYS A 100 -2.730 33.649 20.744 1.00 0.00 H ATOM 1577 HZ3 LYS A 100 -3.181 35.164 21.369 1.00 0.00 H ATOM 1578 H LYS A 100 -1.395 30.774 18.739 1.00 0.00 H ATOM 1579 N LYS A 101 -0.174 29.895 21.566 1.00 49.41 N ATOM 1580 CA LYS A 101 -0.024 29.434 22.948 1.00 46.76 C ATOM 1581 C LYS A 101 -0.586 28.048 23.312 1.00 45.07 C ATOM 1582 O LYS A 101 0.079 27.285 24.016 1.00 46.06 O ATOM 1583 CB LYS A 101 -0.612 30.467 23.913 1.00 69.61 C ATOM 1584 CG LYS A 101 -0.006 31.859 23.814 1.00 74.62 C ATOM 1585 CD LYS A 101 -0.265 32.645 25.092 1.00 78.11 C ATOM 1586 CE LYS A 101 -1.745 32.631 25.478 1.00 82.63 C ATOM 1587 NZ LYS A 101 -1.950 33.037 26.900 1.00 85.46 N ATOM 1588 HA LYS A 101 1.056 29.321 23.045 1.00 0.00 H ATOM 1589 HB2 LYS A 101 -1.680 30.548 23.712 1.00 0.00 H ATOM 1590 HB3 LYS A 101 -0.461 30.104 24.930 1.00 0.00 H ATOM 1591 HG2 LYS A 101 1.069 31.772 23.657 1.00 0.00 H ATOM 1592 HG3 LYS A 101 -0.453 32.386 22.971 1.00 0.00 H ATOM 1593 HD2 LYS A 101 0.315 32.203 25.902 1.00 0.00 H ATOM 1594 HD3 LYS A 101 0.051 33.677 24.942 1.00 0.00 H ATOM 1595 HE2 LYS A 101 -2.137 31.624 25.338 1.00 0.00 H ATOM 1596 HE3 LYS A 101 -2.285 33.323 24.832 1.00 0.00 H ATOM 1597 HZ1 LYS A 101 -1.443 32.378 27.524 1.00 0.00 H ATOM 1598 HZ2 LYS A 101 -1.584 34.000 27.040 1.00 0.00 H ATOM 1599 HZ3 LYS A 101 -2.966 33.015 27.123 1.00 0.00 H ATOM 1600 H LYS A 101 -1.120 30.126 21.200 1.00 0.00 H ATOM 1601 N TYR A 102 -1.796 27.722 22.854 1.00 38.48 N ATOM 1602 CA TYR A 102 -2.394 26.422 23.182 1.00 32.71 C ATOM 1603 C TYR A 102 -3.280 25.816 22.097 1.00 32.14 C ATOM 1604 O TYR A 102 -3.640 26.466 21.122 1.00 33.58 O ATOM 1605 CB TYR A 102 -3.250 26.535 24.438 1.00 30.84 C ATOM 1606 CG TYR A 102 -4.541 27.259 24.154 1.00 32.05 C ATOM 1607 CD1 TYR A 102 -4.564 28.649 24.003 1.00 31.76 C ATOM 1608 CD2 TYR A 102 -5.727 26.551 23.950 1.00 33.57 C ATOM 1609 CE1 TYR A 102 -5.748 29.319 23.645 1.00 35.98 C ATOM 1610 CE2 TYR A 102 -6.912 27.208 23.594 1.00 32.29 C ATOM 1611 CZ TYR A 102 -6.914 28.590 23.442 1.00 37.58 C ATOM 1612 OH TYR A 102 -8.069 29.241 23.081 1.00 46.33 O ATOM 1613 HA TYR A 102 -1.535 25.764 23.311 1.00 0.00 H ATOM 1614 HB3 TYR A 102 -2.695 27.083 25.199 1.00 0.00 H ATOM 1615 HB2 TYR A 102 -3.477 25.534 24.805 1.00 0.00 H ATOM 1616 HD2 TYR A 102 -5.731 25.468 24.070 1.00 0.00 H ATOM 1617 HE2 TYR A 102 -7.828 26.638 23.437 1.00 0.00 H ATOM 1618 HE1 TYR A 102 -5.751 30.403 23.528 1.00 0.00 H ATOM 1619 HD1 TYR A 102 -3.651 29.222 24.165 1.00 0.00 H ATOM 1620 HH TYR A 102 -8.376 28.903 22.203 1.00 0.00 H ATOM 1621 H TYR A 102 -2.320 28.395 22.259 1.00 0.00 H ATOM 1622 N LEU A 103 -3.643 24.558 22.319 1.00 36.26 N ATOM 1623 CA LEU A 103 -4.509 23.804 21.428 1.00 33.12 C ATOM 1624 C LEU A 103 -5.208 22.677 22.203 1.00 32.24 C ATOM 1625 O LEU A 103 -4.568 21.912 22.936 1.00 34.83 O ATOM 1626 CB LEU A 103 -3.710 23.215 20.265 1.00 25.97 C ATOM 1627 CG LEU A 103 -4.525 22.406 19.255 1.00 28.43 C ATOM 1628 CD1 LEU A 103 -3.861 22.460 17.888 1.00 30.99 C ATOM 1629 CD2 LEU A 103 -4.654 20.990 19.720 1.00 29.18 C ATOM 1630 HA LEU A 103 -5.260 24.483 21.024 1.00 0.00 H ATOM 1631 HB2 LEU A 103 -3.234 24.038 19.732 1.00 0.00 H ATOM 1632 HB3 LEU A 103 -2.943 22.561 20.680 1.00 0.00 H ATOM 1633 HG LEU A 103 -5.523 22.837 19.173 1.00 0.00 H ATOM 1634 HD21 LEU A 103 -3.662 20.549 19.817 1.00 0.00 H ATOM 1635 HD22 LEU A 103 -5.158 20.971 20.686 1.00 0.00 H ATOM 1636 HD23 LEU A 103 -5.236 20.422 18.994 1.00 0.00 H ATOM 1637 HD11 LEU A 103 -3.802 23.496 17.555 1.00 0.00 H ATOM 1638 HD12 LEU A 103 -2.857 22.042 17.956 1.00 0.00 H ATOM 1639 HD13 LEU A 103 -4.450 21.881 17.176 1.00 0.00 H ATOM 1640 H LEU A 103 -3.289 24.087 23.176 1.00 0.00 H ATOM 1641 N LEU A 104 -6.526 22.600 22.043 1.00 36.41 N ATOM 1642 CA LEU A 104 -7.339 21.582 22.698 1.00 30.54 C ATOM 1643 C LEU A 104 -7.893 20.640 21.624 1.00 33.46 C ATOM 1644 O LEU A 104 -8.466 21.088 20.628 1.00 35.46 O ATOM 1645 CB LEU A 104 -8.499 22.240 23.441 1.00 25.21 C ATOM 1646 CG LEU A 104 -8.190 23.465 24.310 1.00 24.49 C ATOM 1647 CD1 LEU A 104 -9.484 24.127 24.705 1.00 23.56 C ATOM 1648 CD2 LEU A 104 -7.409 23.072 25.552 1.00 21.90 C ATOM 1649 HA LEU A 104 -6.731 21.028 23.413 1.00 0.00 H ATOM 1650 HB2 LEU A 104 -9.231 22.547 22.694 1.00 0.00 H ATOM 1651 HB3 LEU A 104 -8.940 21.484 24.090 1.00 0.00 H ATOM 1652 HG LEU A 104 -7.577 24.158 23.734 1.00 0.00 H ATOM 1653 HD21 LEU A 104 -7.995 22.366 26.140 1.00 0.00 H ATOM 1654 HD22 LEU A 104 -6.468 22.608 25.256 1.00 0.00 H ATOM 1655 HD23 LEU A 104 -7.205 23.962 26.148 1.00 0.00 H ATOM 1656 HD11 LEU A 104 -10.020 24.438 23.808 1.00 0.00 H ATOM 1657 HD12 LEU A 104 -10.095 23.421 25.268 1.00 0.00 H ATOM 1658 HD13 LEU A 104 -9.271 24.999 25.323 1.00 0.00 H ATOM 1659 H LEU A 104 -6.995 23.293 21.426 1.00 0.00 H ATOM 1660 N PHE A 105 -7.721 19.337 21.828 1.00 27.86 N ATOM 1661 CA PHE A 105 -8.208 18.349 20.870 1.00 26.95 C ATOM 1662 C PHE A 105 -8.689 17.136 21.642 1.00 29.54 C ATOM 1663 O PHE A 105 -8.303 16.923 22.782 1.00 32.43 O ATOM 1664 CB PHE A 105 -7.078 17.940 19.919 1.00 38.06 C ATOM 1665 CG PHE A 105 -6.129 16.924 20.505 1.00 37.63 C ATOM 1666 CD1 PHE A 105 -6.448 15.563 20.491 1.00 36.20 C ATOM 1667 CD2 PHE A 105 -4.929 17.327 21.090 1.00 33.44 C ATOM 1668 CE1 PHE A 105 -5.589 14.621 21.051 1.00 36.87 C ATOM 1669 CE2 PHE A 105 -4.060 16.395 21.654 1.00 32.78 C ATOM 1670 CZ PHE A 105 -4.387 15.039 21.637 1.00 36.01 C ATOM 1671 HA PHE A 105 -9.023 18.771 20.281 1.00 0.00 H ATOM 1672 HB2 PHE A 105 -7.522 17.517 19.018 1.00 0.00 H ATOM 1673 HB3 PHE A 105 -6.509 18.832 19.657 1.00 0.00 H ATOM 1674 HD2 PHE A 105 -4.667 18.385 21.106 1.00 0.00 H ATOM 1675 HE2 PHE A 105 -3.126 16.725 22.108 1.00 0.00 H ATOM 1676 HZ PHE A 105 -3.710 14.307 22.078 1.00 0.00 H ATOM 1677 HE1 PHE A 105 -5.851 13.563 21.034 1.00 0.00 H ATOM 1678 HD1 PHE A 105 -7.382 15.235 20.035 1.00 0.00 H ATOM 1679 H PHE A 105 -7.230 19.016 22.687 1.00 0.00 H ATOM 1680 N CYS A 106 -9.551 16.347 21.027 1.00 21.87 N ATOM 1681 CA CYS A 106 -10.055 15.147 21.671 1.00 23.51 C ATOM 1682 C CYS A 106 -9.926 13.982 20.694 1.00 25.98 C ATOM 1683 O CYS A 106 -9.889 14.164 19.477 1.00 30.52 O ATOM 1684 CB CYS A 106 -11.527 15.303 22.075 1.00 33.14 C ATOM 1685 SG CYS A 106 -11.955 16.464 23.421 1.00 35.45 S ATOM 1686 HA CYS A 106 -9.474 14.966 22.575 1.00 0.00 H ATOM 1687 HB2 CYS A 106 -11.882 14.318 22.377 1.00 0.00 H ATOM 1688 HB3 CYS A 106 -12.070 15.628 21.187 1.00 0.00 H ATOM 1689 H CYS A 106 -9.873 16.588 20.068 1.00 0.00 H ATOM 1690 N MET A 107 -9.852 12.783 21.243 1.00 33.95 N ATOM 1691 CA MET A 107 -9.732 11.567 20.457 1.00 39.34 C ATOM 1692 C MET A 107 -10.996 10.789 20.829 1.00 40.90 C ATOM 1693 O MET A 107 -11.263 10.518 22.004 1.00 38.92 O ATOM 1694 CB MET A 107 -8.461 10.815 20.870 1.00 74.95 C ATOM 1695 CG MET A 107 -7.871 9.888 19.815 1.00 84.59 C ATOM 1696 SD MET A 107 -8.838 8.402 19.518 1.00 94.92 S ATOM 1697 CE MET A 107 -8.488 7.468 21.003 1.00 91.06 C ATOM 1698 HA MET A 107 -9.651 11.732 19.383 1.00 0.00 H ATOM 1699 HB2 MET A 107 -7.703 11.554 21.129 1.00 0.00 H ATOM 1700 HB3 MET A 107 -8.697 10.215 21.749 1.00 0.00 H ATOM 1701 HG2 MET A 107 -6.875 9.589 20.141 1.00 0.00 H ATOM 1702 HG3 MET A 107 -7.795 10.440 18.878 1.00 0.00 H ATOM 1703 HE1 MET A 107 -7.416 7.284 21.071 1.00 0.00 H ATOM 1704 HE2 MET A 107 -8.817 8.036 21.874 1.00 0.00 H ATOM 1705 HE3 MET A 107 -9.019 6.517 20.966 1.00 0.00 H ATOM 1706 H MET A 107 -9.881 12.706 22.280 1.00 0.00 H ATOM 1707 N GLU A 108 -11.777 10.434 19.823 1.00 37.43 N ATOM 1708 CA GLU A 108 -13.030 9.748 20.060 1.00 43.87 C ATOM 1709 C GLU A 108 -13.120 8.461 19.261 1.00 47.51 C ATOM 1710 O GLU A 108 -12.613 8.376 18.145 1.00 51.74 O ATOM 1711 CB GLU A 108 -14.159 10.699 19.677 1.00 60.09 C ATOM 1712 CG GLU A 108 -15.557 10.240 19.966 1.00 63.22 C ATOM 1713 CD GLU A 108 -16.565 11.287 19.547 1.00 63.82 C ATOM 1714 OE1 GLU A 108 -16.478 12.427 20.053 1.00 61.80 O ATOM 1715 OE2 GLU A 108 -17.436 10.974 18.707 1.00 68.20 O ATOM 1716 HA GLU A 108 -13.103 9.470 21.111 1.00 0.00 H ATOM 1717 HB2 GLU A 108 -14.000 11.633 20.215 1.00 0.00 H ATOM 1718 HB3 GLU A 108 -14.087 10.882 18.605 1.00 0.00 H ATOM 1719 HG2 GLU A 108 -15.751 9.318 19.418 1.00 0.00 H ATOM 1720 HG3 GLU A 108 -15.658 10.054 21.035 1.00 0.00 H ATOM 1721 H GLU A 108 -11.487 10.650 18.848 1.00 0.00 H ATOM 1722 N ASN A 109 -13.755 7.455 19.847 1.00 56.36 N ATOM 1723 CA ASN A 109 -13.938 6.172 19.181 1.00 64.57 C ATOM 1724 C ASN A 109 -15.341 6.133 18.579 1.00 68.67 C ATOM 1725 O ASN A 109 -16.332 6.287 19.289 1.00 69.61 O ATOM 1726 CB ASN A 109 -13.763 5.025 20.177 1.00 93.85 C ATOM 1727 CG ASN A 109 -14.278 3.709 19.639 1.00 97.44 C ATOM 1728 OD1 ASN A 109 -13.948 3.310 18.522 1.00 96.96 O ATOM 1729 ND2 ASN A 109 -15.090 3.023 20.434 1.00 96.44 N ATOM 1730 HA ASN A 109 -13.191 6.057 18.395 1.00 0.00 H ATOM 1731 HB2 ASN A 109 -12.703 4.919 20.406 1.00 0.00 H ATOM 1732 HB3 ASN A 109 -14.308 5.267 21.089 1.00 0.00 H ATOM 1733 HD22 ASN A 109 -15.342 3.400 21.370 1.00 0.00 H ATOM 1734 HD21 ASN A 109 -15.475 2.109 20.121 1.00 0.00 H ATOM 1735 H ASN A 109 -14.132 7.585 20.807 1.00 0.00 H ATOM 1736 N SER A 110 -15.423 5.935 17.267 1.00 93.24 N ATOM 1737 CA SER A 110 -16.714 5.894 16.588 1.00 98.08 C ATOM 1738 C SER A 110 -17.481 4.600 16.864 1.00100.13 C ATOM 1739 O SER A 110 -17.866 3.889 15.936 1.00101.97 O ATOM 1740 CB SER A 110 -16.513 6.069 15.080 1.00113.54 C ATOM 1741 OG SER A 110 -15.859 7.293 14.793 1.00116.08 O ATOM 1742 HA SER A 110 -17.314 6.714 16.983 1.00 0.00 H ATOM 1743 HB2 SER A 110 -17.485 6.060 14.587 1.00 0.00 H ATOM 1744 HB3 SER A 110 -15.908 5.244 14.703 1.00 0.00 H ATOM 1745 HG SER A 110 -15.742 7.381 13.814 1.00 0.00 H ATOM 1746 H SER A 110 -14.551 5.807 16.715 1.00 0.00 H ATOM 1747 N ALA A 111 -17.708 4.308 18.143 1.00 98.01 N ATOM 1748 CA ALA A 111 -18.427 3.102 18.543 1.00 99.24 C ATOM 1749 C ALA A 111 -19.475 3.394 19.616 1.00100.52 C ATOM 1750 O ALA A 111 -19.941 4.526 19.746 1.00101.62 O ATOM 1751 CB ALA A 111 -17.442 2.052 19.044 1.00 86.78 C ATOM 1752 HA ALA A 111 -18.951 2.722 17.666 1.00 0.00 H ATOM 1753 HB1 ALA A 111 -16.740 1.805 18.248 1.00 0.00 H ATOM 1754 HB2 ALA A 111 -16.897 2.447 19.901 1.00 0.00 H ATOM 1755 HB3 ALA A 111 -17.987 1.156 19.340 1.00 0.00 H ATOM 1756 H ALA A 111 -17.363 4.958 18.878 1.00 0.00 H ATOM 1757 N GLU A 112 -19.841 2.362 20.376 1.00175.50 N ATOM 1758 CA GLU A 112 -20.840 2.474 21.441 1.00174.68 C ATOM 1759 C GLU A 112 -20.683 1.286 22.405 1.00175.75 C ATOM 1760 O GLU A 112 -19.752 0.492 22.259 1.00172.84 O ATOM 1761 CB GLU A 112 -22.248 2.475 20.834 1.00137.87 C ATOM 1762 CG GLU A 112 -22.695 1.122 20.306 1.00138.32 C ATOM 1763 CD GLU A 112 -24.128 1.131 19.814 1.00139.85 C ATOM 1764 OE1 GLU A 112 -24.412 1.839 18.827 1.00141.91 O ATOM 1765 OE2 GLU A 112 -24.972 0.432 20.417 1.00139.29 O ATOM 1766 HA GLU A 112 -20.693 3.406 21.986 1.00 0.00 H ATOM 1767 HB2 GLU A 112 -22.953 2.793 21.602 1.00 0.00 H ATOM 1768 HB3 GLU A 112 -22.265 3.188 20.009 1.00 0.00 H ATOM 1769 HG2 GLU A 112 -22.044 0.837 19.479 1.00 0.00 H ATOM 1770 HG3 GLU A 112 -22.605 0.388 21.107 1.00 0.00 H ATOM 1771 H GLU A 112 -19.398 1.437 20.205 1.00 0.00 H ATOM 1772 N PRO A 113 -21.576 1.151 23.409 1.00172.10 N ATOM 1773 CA PRO A 113 -22.733 1.985 23.765 1.00173.21 C ATOM 1774 C PRO A 113 -22.279 3.418 23.985 1.00173.45 C ATOM 1775 O PRO A 113 -22.849 4.365 23.441 1.00172.67 O ATOM 1776 CB PRO A 113 -23.237 1.343 25.056 1.00147.99 C ATOM 1777 CG PRO A 113 -22.876 -0.094 24.876 1.00147.74 C ATOM 1778 CD PRO A 113 -21.474 0.002 24.327 1.00147.06 C ATOM 1779 HA PRO A 113 -23.507 2.030 22.999 1.00 0.00 H ATOM 1780 HD3 PRO A 113 -20.751 0.193 25.120 1.00 0.00 H ATOM 1781 HD2 PRO A 113 -21.195 -0.907 23.794 1.00 0.00 H ATOM 1782 HG3 PRO A 113 -23.545 -0.586 24.170 1.00 0.00 H ATOM 1783 HG2 PRO A 113 -22.894 -0.629 25.825 1.00 0.00 H ATOM 1784 HB2 PRO A 113 -22.737 1.767 25.927 1.00 0.00 H ATOM 1785 HB3 PRO A 113 -24.315 1.467 25.161 1.00 0.00 H ATOM 1786 N GLU A 114 -21.236 3.548 24.795 1.00164.22 N ATOM 1787 CA GLU A 114 -20.639 4.833 25.113 1.00162.01 C ATOM 1788 C GLU A 114 -19.158 4.714 24.779 1.00161.69 C ATOM 1789 O GLU A 114 -18.364 4.195 25.567 1.00162.34 O ATOM 1790 CB GLU A 114 -20.837 5.151 26.595 1.00158.72 C ATOM 1791 CG GLU A 114 -20.468 4.006 27.522 1.00157.52 C ATOM 1792 CD GLU A 114 -20.791 4.306 28.966 1.00157.72 C ATOM 1793 OE1 GLU A 114 -20.256 5.303 29.497 1.00156.49 O ATOM 1794 OE2 GLU A 114 -21.582 3.545 29.567 1.00158.99 O ATOM 1795 HA GLU A 114 -21.101 5.640 24.545 1.00 0.00 H ATOM 1796 HB2 GLU A 114 -20.218 6.012 26.848 1.00 0.00 H ATOM 1797 HB3 GLU A 114 -21.886 5.400 26.756 1.00 0.00 H ATOM 1798 HG2 GLU A 114 -21.020 3.117 27.217 1.00 0.00 H ATOM 1799 HG3 GLU A 114 -19.398 3.816 27.435 1.00 0.00 H ATOM 1800 H GLU A 114 -20.828 2.691 25.221 1.00 0.00 H ATOM 1801 N GLN A 115 -18.800 5.179 23.590 1.00128.88 N ATOM 1802 CA GLN A 115 -17.425 5.123 23.125 1.00128.66 C ATOM 1803 C GLN A 115 -16.445 5.777 24.089 1.00123.24 C ATOM 1804 O GLN A 115 -16.837 6.543 24.970 1.00124.15 O ATOM 1805 CB GLN A 115 -17.316 5.786 21.753 1.00 94.11 C ATOM 1806 CG GLN A 115 -18.537 6.604 21.334 1.00101.65 C ATOM 1807 CD GLN A 115 -18.783 7.819 22.210 1.00106.96 C ATOM 1808 OE1 GLN A 115 -19.735 8.568 21.993 1.00109.68 O ATOM 1809 NE2 GLN A 115 -17.926 8.022 23.203 1.00109.55 N ATOM 1810 HA GLN A 115 -17.155 4.069 23.060 1.00 0.00 H ATOM 1811 HB2 GLN A 115 -16.452 6.450 21.765 1.00 0.00 H ATOM 1812 HB3 GLN A 115 -17.161 5.004 21.010 1.00 0.00 H ATOM 1813 HG2 GLN A 115 -18.390 6.942 20.308 1.00 0.00 H ATOM 1814 HG3 GLN A 115 -19.416 5.961 21.381 1.00 0.00 H ATOM 1815 HE22 GLN A 115 -17.135 7.363 23.350 1.00 0.00 H ATOM 1816 HE21 GLN A 115 -18.046 8.840 23.834 1.00 0.00 H ATOM 1817 H GLN A 115 -19.525 5.596 22.972 1.00 0.00 H ATOM 1818 N SER A 116 -15.167 5.459 23.916 1.00 68.55 N ATOM 1819 CA SER A 116 -14.117 6.018 24.753 1.00 63.46 C ATOM 1820 C SER A 116 -13.764 7.437 24.296 1.00 55.59 C ATOM 1821 O SER A 116 -13.798 7.751 23.103 1.00 58.41 O ATOM 1822 CB SER A 116 -12.875 5.121 24.705 1.00 79.05 C ATOM 1823 OG SER A 116 -12.469 4.875 23.371 1.00 84.22 O ATOM 1824 HA SER A 116 -14.479 6.067 25.780 1.00 0.00 H ATOM 1825 HB2 SER A 116 -13.104 4.171 25.188 1.00 0.00 H ATOM 1826 HB3 SER A 116 -12.061 5.612 25.239 1.00 0.00 H ATOM 1827 HG SER A 116 -12.255 5.734 22.929 1.00 0.00 H ATOM 1828 H SER A 116 -14.910 4.792 23.161 1.00 0.00 H ATOM 1829 N LEU A 117 -13.441 8.298 25.254 1.00 45.38 N ATOM 1830 CA LEU A 117 -13.087 9.677 24.948 1.00 35.13 C ATOM 1831 C LEU A 117 -11.854 10.101 25.732 1.00 30.07 C ATOM 1832 O LEU A 117 -11.719 9.783 26.918 1.00 32.11 O ATOM 1833 CB LEU A 117 -14.252 10.609 25.280 1.00 52.02 C ATOM 1834 CG LEU A 117 -14.022 12.077 24.926 1.00 51.29 C ATOM 1835 CD1 LEU A 117 -13.669 12.200 23.459 1.00 48.91 C ATOM 1836 CD2 LEU A 117 -15.266 12.880 25.236 1.00 51.69 C ATOM 1837 HA LEU A 117 -12.867 9.743 23.883 1.00 0.00 H ATOM 1838 HB2 LEU A 117 -15.130 10.262 24.734 1.00 0.00 H ATOM 1839 HB3 LEU A 117 -14.443 10.545 26.351 1.00 0.00 H ATOM 1840 HG LEU A 117 -13.196 12.467 25.521 1.00 0.00 H ATOM 1841 HD21 LEU A 117 -16.101 12.494 24.651 1.00 0.00 H ATOM 1842 HD22 LEU A 117 -15.495 12.797 26.298 1.00 0.00 H ATOM 1843 HD23 LEU A 117 -15.095 13.926 24.981 1.00 0.00 H ATOM 1844 HD11 LEU A 117 -12.761 11.633 23.256 1.00 0.00 H ATOM 1845 HD12 LEU A 117 -14.487 11.806 22.856 1.00 0.00 H ATOM 1846 HD13 LEU A 117 -13.506 13.249 23.213 1.00 0.00 H ATOM 1847 H LEU A 117 -13.441 7.981 26.244 1.00 0.00 H ATOM 1848 N ALA A 118 -10.957 10.806 25.046 1.00 37.96 N ATOM 1849 CA ALA A 118 -9.710 11.316 25.623 1.00 31.69 C ATOM 1850 C ALA A 118 -9.411 12.659 24.975 1.00 29.77 C ATOM 1851 O ALA A 118 -9.435 12.778 23.752 1.00 32.32 O ATOM 1852 CB ALA A 118 -8.555 10.348 25.353 1.00 38.63 C ATOM 1853 HA ALA A 118 -9.819 11.421 26.702 1.00 0.00 H ATOM 1854 HB1 ALA A 118 -8.782 9.380 25.800 1.00 0.00 H ATOM 1855 HB2 ALA A 118 -8.425 10.231 24.277 1.00 0.00 H ATOM 1856 HB3 ALA A 118 -7.639 10.746 25.790 1.00 0.00 H ATOM 1857 H ALA A 118 -11.152 11.006 24.044 1.00 0.00 H ATOM 1858 N CYS A 119 -9.134 13.662 25.801 1.00 28.13 N ATOM 1859 CA CYS A 119 -8.825 14.995 25.320 1.00 27.34 C ATOM 1860 C CYS A 119 -7.544 15.499 25.975 1.00 24.29 C ATOM 1861 O CYS A 119 -7.142 15.041 27.046 1.00 28.14 O ATOM 1862 CB CYS A 119 -9.958 15.955 25.662 1.00 33.02 C ATOM 1863 SG CYS A 119 -11.607 15.417 25.133 1.00 35.96 S ATOM 1864 HA CYS A 119 -8.697 14.949 24.238 1.00 0.00 H ATOM 1865 HB2 CYS A 119 -9.746 16.912 25.186 1.00 0.00 H ATOM 1866 HB3 CYS A 119 -9.976 16.085 26.744 1.00 0.00 H ATOM 1867 H CYS A 119 -9.139 13.486 26.826 1.00 0.00 H ATOM 1868 N GLN A 120 -6.911 16.466 25.335 1.00 24.89 N ATOM 1869 CA GLN A 120 -5.685 16.997 25.885 1.00 25.91 C ATOM 1870 C GLN A 120 -5.595 18.494 25.724 1.00 24.57 C ATOM 1871 O GLN A 120 -6.213 19.082 24.838 1.00 28.68 O ATOM 1872 CB GLN A 120 -4.457 16.365 25.207 1.00 25.40 C ATOM 1873 CG GLN A 120 -4.289 14.878 25.409 1.00 29.91 C ATOM 1874 CD GLN A 120 -2.902 14.388 25.009 1.00 32.08 C ATOM 1875 OE1 GLN A 120 -2.586 13.206 25.169 1.00 37.51 O ATOM 1876 NE2 GLN A 120 -2.068 15.290 24.495 1.00 29.25 N ATOM 1877 HA GLN A 120 -5.696 16.752 26.947 1.00 0.00 H ATOM 1878 HB2 GLN A 120 -4.533 16.551 24.136 1.00 0.00 H ATOM 1879 HB3 GLN A 120 -3.567 16.859 25.598 1.00 0.00 H ATOM 1880 HG2 GLN A 120 -4.451 14.647 26.462 1.00 0.00 H ATOM 1881 HG3 GLN A 120 -5.032 14.357 24.805 1.00 0.00 H ATOM 1882 HE22 GLN A 120 -2.377 16.276 24.378 1.00 0.00 H ATOM 1883 HE21 GLN A 120 -1.108 15.008 24.211 1.00 0.00 H ATOM 1884 H GLN A 120 -7.292 16.842 24.443 1.00 0.00 H ATOM 1885 N CYS A 121 -4.806 19.089 26.607 1.00 21.85 N ATOM 1886 CA CYS A 121 -4.537 20.505 26.556 1.00 22.33 C ATOM 1887 C CYS A 121 -3.061 20.635 26.193 1.00 24.55 C ATOM 1888 O CYS A 121 -2.181 20.380 27.025 1.00 27.19 O ATOM 1889 CB CYS A 121 -4.789 21.178 27.900 1.00 26.56 C ATOM 1890 SG CYS A 121 -4.334 22.916 27.824 1.00 32.42 S ATOM 1891 HA CYS A 121 -5.193 20.990 25.833 1.00 0.00 H ATOM 1892 HB2 CYS A 121 -4.193 20.683 28.667 1.00 0.00 H ATOM 1893 HB3 CYS A 121 -5.846 21.094 28.152 1.00 0.00 H ATOM 1894 HG CYS A 121 -4.570 23.506 29.049 1.00 0.00 H ATOM 1895 H CYS A 121 -4.368 18.518 27.358 1.00 0.00 H ATOM 1896 N LEU A 122 -2.811 21.020 24.941 1.00 38.03 N ATOM 1897 CA LEU A 122 -1.466 21.199 24.424 1.00 35.12 C ATOM 1898 C LEU A 122 -1.035 22.640 24.484 1.00 37.12 C ATOM 1899 O LEU A 122 -1.808 23.556 24.178 1.00 37.29 O ATOM 1900 CB LEU A 122 -1.384 20.757 22.966 1.00 22.07 C ATOM 1901 CG LEU A 122 -1.790 19.328 22.621 1.00 29.02 C ATOM 1902 CD1 LEU A 122 -1.728 19.180 21.106 1.00 30.25 C ATOM 1903 CD2 LEU A 122 -0.892 18.317 23.316 1.00 28.81 C ATOM 1904 HA LEU A 122 -0.812 20.591 25.049 1.00 0.00 H ATOM 1905 HB2 LEU A 122 -2.026 21.423 22.390 1.00 0.00 H ATOM 1906 HB3 LEU A 122 -0.350 20.885 22.647 1.00 0.00 H ATOM 1907 HG LEU A 122 -2.803 19.131 22.972 1.00 0.00 H ATOM 1908 HD21 LEU A 122 0.140 18.472 23.000 1.00 0.00 H ATOM 1909 HD22 LEU A 122 -0.966 18.449 24.395 1.00 0.00 H ATOM 1910 HD23 LEU A 122 -1.208 17.308 23.049 1.00 0.00 H ATOM 1911 HD11 LEU A 122 -2.413 19.891 20.644 1.00 0.00 H ATOM 1912 HD12 LEU A 122 -0.712 19.378 20.764 1.00 0.00 H ATOM 1913 HD13 LEU A 122 -2.014 18.165 20.829 1.00 0.00 H ATOM 1914 H LEU A 122 -3.615 21.200 24.307 1.00 0.00 H ATOM 1915 N VAL A 123 0.213 22.844 24.867 1.00 30.35 N ATOM 1916 CA VAL A 123 0.758 24.189 24.913 1.00 34.44 C ATOM 1917 C VAL A 123 2.114 24.218 24.195 1.00 33.81 C ATOM 1918 O VAL A 123 2.815 23.211 24.103 1.00 32.09 O ATOM 1919 CB VAL A 123 0.891 24.688 26.369 1.00 27.07 C ATOM 1920 CG1 VAL A 123 -0.512 24.851 26.978 1.00 26.77 C ATOM 1921 CG2 VAL A 123 1.741 23.716 27.194 1.00 26.61 C ATOM 1922 HA VAL A 123 0.072 24.864 24.402 1.00 0.00 H ATOM 1923 HB VAL A 123 1.395 25.655 26.378 1.00 0.00 H ATOM 1924 HG11 VAL A 123 -1.079 25.575 26.393 1.00 0.00 H ATOM 1925 HG12 VAL A 123 -1.026 23.890 26.966 1.00 0.00 H ATOM 1926 HG13 VAL A 123 -0.422 25.203 28.006 1.00 0.00 H ATOM 1927 HG21 VAL A 123 1.268 22.734 27.197 1.00 0.00 H ATOM 1928 HG22 VAL A 123 2.735 23.640 26.753 1.00 0.00 H ATOM 1929 HG23 VAL A 123 1.823 24.085 28.216 1.00 0.00 H ATOM 1930 H VAL A 123 0.809 22.036 25.137 1.00 0.00 H ATOM 1931 N ARG A 124 2.462 25.380 23.671 1.00 34.30 N ATOM 1932 CA ARG A 124 3.706 25.561 22.940 1.00 43.11 C ATOM 1933 C ARG A 124 4.985 25.539 23.789 1.00 46.83 C ATOM 1934 O ARG A 124 6.024 25.099 23.311 1.00 47.39 O ATOM 1935 CB ARG A 124 3.633 26.868 22.150 1.00 31.63 C ATOM 1936 CG ARG A 124 2.595 26.869 21.035 1.00 31.26 C ATOM 1937 CD ARG A 124 2.960 25.872 19.954 1.00 31.36 C ATOM 1938 NE ARG A 124 2.414 26.272 18.663 1.00 34.73 N ATOM 1939 CZ ARG A 124 2.677 25.656 17.517 1.00 33.42 C ATOM 1940 NH1 ARG A 124 3.486 24.599 17.497 1.00 34.68 N ATOM 1941 NH2 ARG A 124 2.126 26.098 16.391 1.00 31.95 N ATOM 1942 HA ARG A 124 3.791 24.693 22.286 1.00 0.00 H ATOM 1943 HB2 ARG A 124 3.391 27.673 22.843 1.00 0.00 H ATOM 1944 HB3 ARG A 124 4.611 27.054 21.706 1.00 0.00 H ATOM 1945 HG2 ARG A 124 1.623 26.604 21.452 1.00 0.00 H ATOM 1946 HG3 ARG A 124 2.542 27.866 20.598 1.00 0.00 H ATOM 1947 HD2 ARG A 124 2.560 24.894 20.222 1.00 0.00 H ATOM 1948 HD3 ARG A 124 4.046 25.811 19.878 1.00 0.00 H ATOM 1949 HE ARG A 124 1.777 27.094 18.638 1.00 0.00 H ATOM 1950 HH12 ARG A 124 3.691 24.118 16.598 1.00 0.00 H ATOM 1951 HH11 ARG A 124 3.913 24.254 18.380 1.00 0.00 H ATOM 1952 HH22 ARG A 124 2.328 25.619 15.490 1.00 0.00 H ATOM 1953 HH21 ARG A 124 1.492 26.923 16.411 1.00 0.00 H ATOM 1954 H ARG A 124 1.824 26.193 23.785 1.00 0.00 H ATOM 1955 N THR A 125 4.911 26.014 25.033 1.00 45.47 N ATOM 1956 CA THR A 125 6.085 26.038 25.907 1.00 47.34 C ATOM 1957 C THR A 125 5.964 25.171 27.162 1.00 49.29 C ATOM 1958 O THR A 125 4.861 24.883 27.635 1.00 54.62 O ATOM 1959 CB THR A 125 6.442 27.485 26.360 1.00 46.46 C ATOM 1960 OG1 THR A 125 5.418 27.997 27.212 1.00 48.14 O ATOM 1961 CG2 THR A 125 6.594 28.416 25.149 1.00 47.87 C ATOM 1962 HA THR A 125 6.875 25.619 25.284 1.00 0.00 H ATOM 1963 HB THR A 125 7.389 27.444 26.899 1.00 0.00 H ATOM 1964 HG1 THR A 125 5.654 28.916 27.494 1.00 0.00 H ATOM 1965 HG23 THR A 125 7.375 28.032 24.493 1.00 0.00 H ATOM 1966 HG21 THR A 125 5.650 28.460 24.606 1.00 0.00 H ATOM 1967 HG22 THR A 125 6.865 29.415 25.492 1.00 0.00 H ATOM 1968 H THR A 125 4.002 26.374 25.389 1.00 0.00 H ATOM 1969 N PRO A 126 7.115 24.738 27.714 1.00 52.49 N ATOM 1970 CA PRO A 126 7.146 23.904 28.919 1.00 46.77 C ATOM 1971 C PRO A 126 6.793 24.741 30.144 1.00 44.61 C ATOM 1972 O PRO A 126 7.561 24.834 31.101 1.00 47.13 O ATOM 1973 CB PRO A 126 8.578 23.394 28.942 1.00 50.28 C ATOM 1974 CG PRO A 126 9.340 24.563 28.374 1.00 53.43 C ATOM 1975 CD PRO A 126 8.481 24.981 27.208 1.00 57.32 C ATOM 1976 HA PRO A 126 6.425 23.086 28.923 1.00 0.00 H ATOM 1977 HD3 PRO A 126 8.630 26.033 26.966 1.00 0.00 H ATOM 1978 HD2 PRO A 126 8.689 24.373 26.327 1.00 0.00 H ATOM 1979 HG3 PRO A 126 10.334 24.262 28.043 1.00 0.00 H ATOM 1980 HG2 PRO A 126 9.430 25.367 29.105 1.00 0.00 H ATOM 1981 HB2 PRO A 126 8.901 23.167 29.958 1.00 0.00 H ATOM 1982 HB3 PRO A 126 8.692 22.507 28.319 1.00 0.00 H ATOM 1983 N GLU A 127 5.614 25.351 30.089 1.00 34.63 N ATOM 1984 CA GLU A 127 5.108 26.191 31.163 1.00 38.34 C ATOM 1985 C GLU A 127 3.670 25.828 31.469 1.00 41.40 C ATOM 1986 O GLU A 127 2.936 25.397 30.585 1.00 47.41 O ATOM 1987 CB GLU A 127 5.160 27.653 30.743 1.00 38.81 C ATOM 1988 CG GLU A 127 6.563 28.200 30.572 1.00 44.00 C ATOM 1989 CD GLU A 127 6.559 29.633 30.102 1.00 48.42 C ATOM 1990 OE1 GLU A 127 6.141 29.856 28.946 1.00 48.43 O ATOM 1991 OE2 GLU A 127 6.961 30.528 30.877 1.00 51.59 O ATOM 1992 HA GLU A 127 5.726 26.035 32.047 1.00 0.00 H ATOM 1993 HB2 GLU A 127 4.635 27.755 29.793 1.00 0.00 H ATOM 1994 HB3 GLU A 127 4.652 28.246 31.504 1.00 0.00 H ATOM 1995 HG2 GLU A 127 7.081 28.145 31.529 1.00 0.00 H ATOM 1996 HG3 GLU A 127 7.091 27.591 29.839 1.00 0.00 H ATOM 1997 H GLU A 127 5.027 25.222 29.240 1.00 0.00 H ATOM 1998 N VAL A 128 3.273 25.993 32.726 1.00 41.62 N ATOM 1999 CA VAL A 128 1.908 25.711 33.132 1.00 38.74 C ATOM 2000 C VAL A 128 1.084 26.938 32.745 1.00 40.92 C ATOM 2001 O VAL A 128 1.131 27.961 33.422 1.00 44.33 O ATOM 2002 CB VAL A 128 1.814 25.468 34.659 1.00 39.55 C ATOM 2003 CG1 VAL A 128 0.375 25.277 35.071 1.00 36.84 C ATOM 2004 CG2 VAL A 128 2.625 24.235 35.040 1.00 37.81 C ATOM 2005 HA VAL A 128 1.542 24.807 32.645 1.00 0.00 H ATOM 2006 HB VAL A 128 2.217 26.338 35.176 1.00 0.00 H ATOM 2007 HG11 VAL A 128 -0.196 26.170 34.816 1.00 0.00 H ATOM 2008 HG12 VAL A 128 -0.041 24.416 34.547 1.00 0.00 H ATOM 2009 HG13 VAL A 128 0.326 25.107 36.147 1.00 0.00 H ATOM 2010 HG21 VAL A 128 2.232 23.366 34.513 1.00 0.00 H ATOM 2011 HG22 VAL A 128 3.668 24.388 34.764 1.00 0.00 H ATOM 2012 HG23 VAL A 128 2.553 24.072 36.115 1.00 0.00 H ATOM 2013 H VAL A 128 3.955 26.332 33.435 1.00 0.00 H ATOM 2014 N ASP A 129 0.353 26.838 31.638 1.00 32.77 N ATOM 2015 CA ASP A 129 -0.470 27.945 31.151 1.00 34.77 C ATOM 2016 C ASP A 129 -1.842 27.899 31.815 1.00 34.60 C ATOM 2017 O ASP A 129 -2.669 27.034 31.486 1.00 35.24 O ATOM 2018 CB ASP A 129 -0.644 27.846 29.634 1.00 39.16 C ATOM 2019 CG ASP A 129 -1.366 29.052 29.051 1.00 44.35 C ATOM 2020 OD1 ASP A 129 -2.344 29.522 29.670 1.00 48.61 O ATOM 2021 OD2 ASP A 129 -0.955 29.523 27.971 1.00 46.69 O ATOM 2022 HA ASP A 129 0.027 28.884 31.397 1.00 0.00 H ATOM 2023 HB2 ASP A 129 0.341 27.771 29.173 1.00 0.00 H ATOM 2024 HB3 ASP A 129 -1.220 26.949 29.406 1.00 0.00 H ATOM 2025 H ASP A 129 0.367 25.946 31.103 1.00 0.00 H ATOM 2026 N ASP A 130 -2.089 28.828 32.733 1.00 38.57 N ATOM 2027 CA ASP A 130 -3.357 28.853 33.451 1.00 44.42 C ATOM 2028 C ASP A 130 -4.602 29.090 32.605 1.00 44.89 C ATOM 2029 O ASP A 130 -5.605 28.388 32.775 1.00 43.90 O ATOM 2030 CB ASP A 130 -3.317 29.877 34.585 1.00 61.10 C ATOM 2031 CG ASP A 130 -2.572 29.366 35.809 1.00 64.07 C ATOM 2032 OD1 ASP A 130 -2.701 28.165 36.142 1.00 68.09 O ATOM 2033 OD2 ASP A 130 -1.868 30.178 36.449 1.00 65.79 O ATOM 2034 HA ASP A 130 -3.456 27.838 33.835 1.00 0.00 H ATOM 2035 HB2 ASP A 130 -2.821 30.778 34.225 1.00 0.00 H ATOM 2036 HB3 ASP A 130 -4.340 30.118 34.874 1.00 0.00 H ATOM 2037 H ASP A 130 -1.367 29.547 32.942 1.00 0.00 H ATOM 2038 N GLU A 131 -4.547 30.061 31.698 1.00 43.00 N ATOM 2039 CA GLU A 131 -5.703 30.358 30.860 1.00 43.02 C ATOM 2040 C GLU A 131 -6.081 29.152 30.001 1.00 41.29 C ATOM 2041 O GLU A 131 -7.252 28.781 29.923 1.00 44.36 O ATOM 2042 CB GLU A 131 -5.424 31.564 29.960 1.00 82.34 C ATOM 2043 CG GLU A 131 -6.625 31.988 29.128 1.00 92.78 C ATOM 2044 CD GLU A 131 -6.335 33.179 28.236 1.00 98.78 C ATOM 2045 OE1 GLU A 131 -5.488 33.051 27.326 1.00101.56 O ATOM 2046 OE2 GLU A 131 -6.956 34.244 28.446 1.00102.94 O ATOM 2047 HA GLU A 131 -6.538 30.593 31.520 1.00 0.00 H ATOM 2048 HB2 GLU A 131 -5.125 32.403 30.589 1.00 0.00 H ATOM 2049 HB3 GLU A 131 -4.608 31.310 29.284 1.00 0.00 H ATOM 2050 HG2 GLU A 131 -6.928 31.149 28.501 1.00 0.00 H ATOM 2051 HG3 GLU A 131 -7.441 32.249 29.802 1.00 0.00 H ATOM 2052 H GLU A 131 -3.673 30.613 31.585 1.00 0.00 H ATOM 2053 N ALA A 132 -5.084 28.548 29.360 1.00 38.97 N ATOM 2054 CA ALA A 132 -5.318 27.382 28.518 1.00 33.39 C ATOM 2055 C ALA A 132 -6.023 26.286 29.323 1.00 34.37 C ATOM 2056 O ALA A 132 -6.960 25.656 28.839 1.00 34.20 O ATOM 2057 CB ALA A 132 -3.989 26.850 27.955 1.00 24.23 C ATOM 2058 HA ALA A 132 -5.956 27.677 27.685 1.00 0.00 H ATOM 2059 HB1 ALA A 132 -3.511 27.628 27.360 1.00 0.00 H ATOM 2060 HB2 ALA A 132 -3.334 26.567 28.779 1.00 0.00 H ATOM 2061 HB3 ALA A 132 -4.184 25.979 27.329 1.00 0.00 H ATOM 2062 H ALA A 132 -4.117 28.916 29.462 1.00 0.00 H ATOM 2063 N LEU A 133 -5.559 26.065 30.548 1.00 40.96 N ATOM 2064 CA LEU A 133 -6.148 25.055 31.410 1.00 34.91 C ATOM 2065 C LEU A 133 -7.555 25.468 31.794 1.00 33.11 C ATOM 2066 O LEU A 133 -8.433 24.628 31.977 1.00 32.69 O ATOM 2067 CB LEU A 133 -5.298 24.861 32.667 1.00 34.81 C ATOM 2068 CG LEU A 133 -3.991 24.089 32.474 1.00 33.10 C ATOM 2069 CD1 LEU A 133 -3.223 24.030 33.788 1.00 36.66 C ATOM 2070 CD2 LEU A 133 -4.297 22.676 31.988 1.00 32.21 C ATOM 2071 HA LEU A 133 -6.185 24.110 30.869 1.00 0.00 H ATOM 2072 HB2 LEU A 133 -5.050 25.847 33.059 1.00 0.00 H ATOM 2073 HB3 LEU A 133 -5.900 24.322 33.399 1.00 0.00 H ATOM 2074 HG LEU A 133 -3.380 24.600 31.730 1.00 0.00 H ATOM 2075 HD21 LEU A 133 -4.914 22.165 32.727 1.00 0.00 H ATOM 2076 HD22 LEU A 133 -4.831 22.727 31.039 1.00 0.00 H ATOM 2077 HD23 LEU A 133 -3.364 22.130 31.852 1.00 0.00 H ATOM 2078 HD11 LEU A 133 -2.997 25.043 34.121 1.00 0.00 H ATOM 2079 HD12 LEU A 133 -3.830 23.526 34.540 1.00 0.00 H ATOM 2080 HD13 LEU A 133 -2.294 23.479 33.640 1.00 0.00 H ATOM 2081 H LEU A 133 -4.757 26.627 30.897 1.00 0.00 H ATOM 2082 N GLU A 134 -7.764 26.773 31.917 1.00 29.41 N ATOM 2083 CA GLU A 134 -9.077 27.303 32.264 1.00 32.64 C ATOM 2084 C GLU A 134 -10.025 26.868 31.141 1.00 33.64 C ATOM 2085 O GLU A 134 -11.072 26.280 31.388 1.00 36.15 O ATOM 2086 CB GLU A 134 -9.008 28.833 32.347 1.00 98.28 C ATOM 2087 CG GLU A 134 -9.838 29.449 33.461 1.00108.51 C ATOM 2088 CD GLU A 134 -11.326 29.379 33.198 1.00115.69 C ATOM 2089 OE1 GLU A 134 -12.106 29.675 34.127 1.00119.34 O ATOM 2090 OE2 GLU A 134 -11.716 29.039 32.062 1.00118.30 O ATOM 2091 HA GLU A 134 -9.422 26.934 33.230 1.00 0.00 H ATOM 2092 HB2 GLU A 134 -7.967 29.118 32.502 1.00 0.00 H ATOM 2093 HB3 GLU A 134 -9.358 29.240 31.398 1.00 0.00 H ATOM 2094 HG2 GLU A 134 -9.624 28.918 34.388 1.00 0.00 H ATOM 2095 HG3 GLU A 134 -9.553 30.496 33.569 1.00 0.00 H ATOM 2096 H GLU A 134 -6.974 27.432 31.762 1.00 0.00 H ATOM 2097 N LYS A 135 -9.630 27.159 29.908 1.00 43.53 N ATOM 2098 CA LYS A 135 -10.407 26.807 28.731 1.00 38.03 C ATOM 2099 C LYS A 135 -10.582 25.301 28.610 1.00 34.61 C ATOM 2100 O LYS A 135 -11.629 24.824 28.187 1.00 34.98 O ATOM 2101 CB LYS A 135 -9.714 27.321 27.477 1.00 31.59 C ATOM 2102 CG LYS A 135 -9.782 28.806 27.278 1.00 36.26 C ATOM 2103 CD LYS A 135 -8.937 29.193 26.081 1.00 38.12 C ATOM 2104 CE LYS A 135 -9.314 30.554 25.531 1.00 38.72 C ATOM 2105 NZ LYS A 135 -9.201 31.602 26.559 1.00 44.11 N ATOM 2106 HA LYS A 135 -11.389 27.268 28.836 1.00 0.00 H ATOM 2107 HB2 LYS A 135 -8.664 27.034 27.529 1.00 0.00 H ATOM 2108 HB3 LYS A 135 -10.177 26.842 26.614 1.00 0.00 H ATOM 2109 HG2 LYS A 135 -10.816 29.103 27.105 1.00 0.00 H ATOM 2110 HG3 LYS A 135 -9.405 29.310 28.168 1.00 0.00 H ATOM 2111 HD2 LYS A 135 -7.890 29.213 26.382 1.00 0.00 H ATOM 2112 HD3 LYS A 135 -9.074 28.447 25.298 1.00 0.00 H ATOM 2113 HE2 LYS A 135 -10.343 30.519 25.172 1.00 0.00 H ATOM 2114 HE3 LYS A 135 -8.650 30.798 24.702 1.00 0.00 H ATOM 2115 HZ1 LYS A 135 -9.837 31.379 27.351 1.00 0.00 H ATOM 2116 HZ2 LYS A 135 -8.220 31.645 26.902 1.00 0.00 H ATOM 2117 HZ3 LYS A 135 -9.466 32.520 26.148 1.00 0.00 H ATOM 2118 H LYS A 135 -8.728 27.659 29.778 1.00 0.00 H ATOM 2119 N PHE A 136 -9.541 24.555 28.966 1.00 31.06 N ATOM 2120 CA PHE A 136 -9.589 23.104 28.894 1.00 31.66 C ATOM 2121 C PHE A 136 -10.662 22.611 29.858 1.00 38.97 C ATOM 2122 O PHE A 136 -11.430 21.707 29.534 1.00 45.32 O ATOM 2123 CB PHE A 136 -8.223 22.505 29.257 1.00 31.51 C ATOM 2124 CG PHE A 136 -8.152 21.014 29.110 1.00 28.29 C ATOM 2125 CD1 PHE A 136 -8.489 20.400 27.906 1.00 26.37 C ATOM 2126 CD2 PHE A 136 -7.733 20.223 30.167 1.00 26.15 C ATOM 2127 CE1 PHE A 136 -8.407 19.014 27.764 1.00 25.87 C ATOM 2128 CE2 PHE A 136 -7.643 18.842 30.041 1.00 25.24 C ATOM 2129 CZ PHE A 136 -7.979 18.233 28.842 1.00 24.91 C ATOM 2130 HA PHE A 136 -9.831 22.789 27.879 1.00 0.00 H ATOM 2131 HB2 PHE A 136 -7.470 22.950 28.607 1.00 0.00 H ATOM 2132 HB3 PHE A 136 -8.002 22.758 30.294 1.00 0.00 H ATOM 2133 HD2 PHE A 136 -7.469 20.692 31.115 1.00 0.00 H ATOM 2134 HE2 PHE A 136 -7.308 18.238 30.884 1.00 0.00 H ATOM 2135 HZ PHE A 136 -7.910 17.150 28.740 1.00 0.00 H ATOM 2136 HE1 PHE A 136 -8.675 18.543 26.818 1.00 0.00 H ATOM 2137 HD1 PHE A 136 -8.821 21.009 27.065 1.00 0.00 H ATOM 2138 H PHE A 136 -8.674 25.019 29.303 1.00 0.00 H ATOM 2139 N ASP A 137 -10.711 23.220 31.040 1.00 36.80 N ATOM 2140 CA ASP A 137 -11.707 22.845 32.040 1.00 40.29 C ATOM 2141 C ASP A 137 -13.117 23.130 31.537 1.00 38.68 C ATOM 2142 O ASP A 137 -13.982 22.280 31.619 1.00 37.41 O ATOM 2143 CB ASP A 137 -11.486 23.596 33.353 1.00 64.86 C ATOM 2144 CG ASP A 137 -10.304 23.071 34.131 1.00 71.24 C ATOM 2145 OD1 ASP A 137 -10.178 21.835 34.256 1.00 74.83 O ATOM 2146 OD2 ASP A 137 -9.507 23.894 34.628 1.00 76.57 O ATOM 2147 HA ASP A 137 -11.594 21.776 32.218 1.00 0.00 H ATOM 2148 HB2 ASP A 137 -11.317 24.649 33.129 1.00 0.00 H ATOM 2149 HB3 ASP A 137 -12.381 23.496 33.967 1.00 0.00 H ATOM 2150 H ASP A 137 -10.029 23.975 31.255 1.00 0.00 H ATOM 2151 N LYS A 138 -13.346 24.326 31.014 1.00 38.66 N ATOM 2152 CA LYS A 138 -14.662 24.665 30.520 1.00 39.36 C ATOM 2153 C LYS A 138 -15.109 23.655 29.477 1.00 37.37 C ATOM 2154 O LYS A 138 -16.179 23.064 29.594 1.00 39.69 O ATOM 2155 CB LYS A 138 -14.666 26.073 29.921 1.00 54.55 C ATOM 2156 CG LYS A 138 -14.316 27.153 30.922 1.00 63.18 C ATOM 2157 CD LYS A 138 -15.086 26.959 32.224 1.00 71.61 C ATOM 2158 CE LYS A 138 -14.551 27.844 33.344 1.00 77.60 C ATOM 2159 NZ LYS A 138 -15.207 27.531 34.648 1.00 84.23 N ATOM 2160 HA LYS A 138 -15.359 24.641 31.357 1.00 0.00 H ATOM 2161 HB2 LYS A 138 -13.940 26.105 29.109 1.00 0.00 H ATOM 2162 HB3 LYS A 138 -15.661 26.278 29.525 1.00 0.00 H ATOM 2163 HG2 LYS A 138 -13.247 27.114 31.130 1.00 0.00 H ATOM 2164 HG3 LYS A 138 -14.567 28.126 30.500 1.00 0.00 H ATOM 2165 HD2 LYS A 138 -16.134 27.204 32.053 1.00 0.00 H ATOM 2166 HD3 LYS A 138 -15.003 25.916 32.530 1.00 0.00 H ATOM 2167 HE2 LYS A 138 -14.741 28.888 33.093 1.00 0.00 H ATOM 2168 HE3 LYS A 138 -13.477 27.684 33.440 1.00 0.00 H ATOM 2169 HZ1 LYS A 138 -16.232 27.687 34.565 1.00 0.00 H ATOM 2170 HZ2 LYS A 138 -15.025 26.538 34.897 1.00 0.00 H ATOM 2171 HZ3 LYS A 138 -14.819 28.151 35.387 1.00 0.00 H ATOM 2172 H LYS A 138 -12.576 25.023 30.959 1.00 0.00 H ATOM 2173 N ALA A 139 -14.278 23.447 28.464 1.00 36.23 N ATOM 2174 CA ALA A 139 -14.608 22.513 27.402 1.00 32.07 C ATOM 2175 C ALA A 139 -14.927 21.124 27.957 1.00 33.83 C ATOM 2176 O ALA A 139 -15.710 20.381 27.372 1.00 39.25 O ATOM 2177 CB ALA A 139 -13.459 22.437 26.406 1.00 17.25 C ATOM 2178 HA ALA A 139 -15.501 22.877 26.894 1.00 0.00 H ATOM 2179 HB1 ALA A 139 -13.285 23.424 25.977 1.00 0.00 H ATOM 2180 HB2 ALA A 139 -12.558 22.098 26.918 1.00 0.00 H ATOM 2181 HB3 ALA A 139 -13.714 21.735 25.612 1.00 0.00 H ATOM 2182 H ALA A 139 -13.375 23.962 28.430 1.00 0.00 H ATOM 2183 N LEU A 140 -14.340 20.785 29.099 1.00 29.92 N ATOM 2184 CA LEU A 140 -14.567 19.470 29.705 1.00 33.09 C ATOM 2185 C LEU A 140 -15.868 19.365 30.492 1.00 37.00 C ATOM 2186 O LEU A 140 -16.370 18.271 30.704 1.00 41.07 O ATOM 2187 CB LEU A 140 -13.395 19.101 30.628 1.00 41.64 C ATOM 2188 CG LEU A 140 -12.302 18.125 30.168 1.00 39.72 C ATOM 2189 CD1 LEU A 140 -11.998 18.290 28.684 1.00 39.66 C ATOM 2190 CD2 LEU A 140 -11.054 18.352 31.023 1.00 40.60 C ATOM 2191 HA LEU A 140 -14.643 18.772 28.871 1.00 0.00 H ATOM 2192 HB2 LEU A 140 -12.892 20.035 30.878 1.00 0.00 H ATOM 2193 HB3 LEU A 140 -13.833 18.673 31.530 1.00 0.00 H ATOM 2194 HG LEU A 140 -12.651 17.101 30.301 1.00 0.00 H ATOM 2195 HD21 LEU A 140 -10.712 19.379 30.898 1.00 0.00 H ATOM 2196 HD22 LEU A 140 -11.295 18.173 32.071 1.00 0.00 H ATOM 2197 HD23 LEU A 140 -10.269 17.665 30.707 1.00 0.00 H ATOM 2198 HD11 LEU A 140 -12.901 18.096 28.106 1.00 0.00 H ATOM 2199 HD12 LEU A 140 -11.656 19.308 28.496 1.00 0.00 H ATOM 2200 HD13 LEU A 140 -11.220 17.584 28.393 1.00 0.00 H ATOM 2201 H LEU A 140 -13.709 21.464 29.571 1.00 0.00 H ATOM 2202 N LYS A 141 -16.404 20.496 30.929 1.00 35.03 N ATOM 2203 CA LYS A 141 -17.650 20.514 31.701 1.00 39.73 C ATOM 2204 C LYS A 141 -18.750 19.610 31.132 1.00 39.48 C ATOM 2205 O LYS A 141 -19.346 18.804 31.848 1.00 42.71 O ATOM 2206 CB LYS A 141 -18.201 21.938 31.794 1.00 76.09 C ATOM 2207 CG LYS A 141 -17.350 22.894 32.601 1.00 85.75 C ATOM 2208 CD LYS A 141 -17.948 24.302 32.612 1.00 93.21 C ATOM 2209 CE LYS A 141 -18.023 24.896 31.211 1.00 98.21 C ATOM 2210 NZ LYS A 141 -18.606 26.264 31.205 1.00102.40 N ATOM 2211 HA LYS A 141 -17.383 20.127 32.684 1.00 0.00 H ATOM 2212 HB2 LYS A 141 -18.291 22.334 30.783 1.00 0.00 H ATOM 2213 HB3 LYS A 141 -19.188 21.891 32.254 1.00 0.00 H ATOM 2214 HG2 LYS A 141 -17.282 22.530 33.626 1.00 0.00 H ATOM 2215 HG3 LYS A 141 -16.352 22.936 32.164 1.00 0.00 H ATOM 2216 HD2 LYS A 141 -18.954 24.255 33.030 1.00 0.00 H ATOM 2217 HD3 LYS A 141 -17.326 24.945 33.235 1.00 0.00 H ATOM 2218 HE2 LYS A 141 -18.641 24.249 30.589 1.00 0.00 H ATOM 2219 HE3 LYS A 141 -17.016 24.943 30.796 1.00 0.00 H ATOM 2220 HZ1 LYS A 141 -19.571 26.230 31.592 1.00 0.00 H ATOM 2221 HZ2 LYS A 141 -18.019 26.892 31.790 1.00 0.00 H ATOM 2222 HZ3 LYS A 141 -18.635 26.623 30.229 1.00 0.00 H ATOM 2223 H LYS A 141 -15.927 21.396 30.718 1.00 0.00 H ATOM 2224 N ALA A 142 -19.010 19.743 29.840 1.00 63.65 N ATOM 2225 CA ALA A 142 -20.053 18.959 29.204 1.00 63.24 C ATOM 2226 C ALA A 142 -19.648 17.551 28.791 1.00 60.02 C ATOM 2227 O ALA A 142 -20.412 16.873 28.106 1.00 61.58 O ATOM 2228 CB ALA A 142 -20.590 19.714 27.995 1.00128.09 C ATOM 2229 HA ALA A 142 -20.821 18.824 29.966 1.00 0.00 H ATOM 2230 HB1 ALA A 142 -21.000 20.671 28.318 1.00 0.00 H ATOM 2231 HB2 ALA A 142 -19.780 19.885 27.286 1.00 0.00 H ATOM 2232 HB3 ALA A 142 -21.373 19.124 27.518 1.00 0.00 H ATOM 2233 H ALA A 142 -18.459 20.419 29.273 1.00 0.00 H ATOM 2234 N LEU A 143 -18.467 17.095 29.197 1.00 36.13 N ATOM 2235 CA LEU A 143 -18.047 15.758 28.802 1.00 32.07 C ATOM 2236 C LEU A 143 -17.959 14.810 29.991 1.00 34.54 C ATOM 2237 O LEU A 143 -17.686 15.230 31.107 1.00 37.47 O ATOM 2238 CB LEU A 143 -16.703 15.814 28.065 1.00 36.03 C ATOM 2239 CG LEU A 143 -16.599 16.768 26.864 1.00 33.86 C ATOM 2240 CD1 LEU A 143 -15.234 16.614 26.212 1.00 34.00 C ATOM 2241 CD2 LEU A 143 -17.698 16.476 25.854 1.00 33.29 C ATOM 2242 HA LEU A 143 -18.809 15.366 28.128 1.00 0.00 H ATOM 2243 HB2 LEU A 143 -15.944 16.113 28.788 1.00 0.00 H ATOM 2244 HB3 LEU A 143 -16.484 14.809 27.705 1.00 0.00 H ATOM 2245 HG LEU A 143 -16.720 17.793 27.214 1.00 0.00 H ATOM 2246 HD21 LEU A 143 -17.601 15.449 25.501 1.00 0.00 H ATOM 2247 HD22 LEU A 143 -18.670 16.608 26.329 1.00 0.00 H ATOM 2248 HD23 LEU A 143 -17.607 17.162 25.012 1.00 0.00 H ATOM 2249 HD11 LEU A 143 -14.457 16.855 26.937 1.00 0.00 H ATOM 2250 HD12 LEU A 143 -15.109 15.586 25.872 1.00 0.00 H ATOM 2251 HD13 LEU A 143 -15.161 17.291 25.361 1.00 0.00 H ATOM 2252 H LEU A 143 -17.850 17.686 29.790 1.00 0.00 H ATOM 2253 N PRO A 144 -18.186 13.507 29.753 1.00 41.23 N ATOM 2254 CA PRO A 144 -18.150 12.443 30.766 1.00 39.32 C ATOM 2255 C PRO A 144 -16.740 11.967 31.142 1.00 38.02 C ATOM 2256 O PRO A 144 -16.368 10.816 30.886 1.00 38.82 O ATOM 2257 CB PRO A 144 -18.962 11.339 30.110 1.00 38.08 C ATOM 2258 CG PRO A 144 -18.515 11.474 28.655 1.00 36.57 C ATOM 2259 CD PRO A 144 -18.594 12.968 28.437 1.00 39.88 C ATOM 2260 HA PRO A 144 -18.543 12.785 31.724 1.00 0.00 H ATOM 2261 HD3 PRO A 144 -17.910 13.288 27.651 1.00 0.00 H ATOM 2262 HD2 PRO A 144 -19.608 13.276 28.182 1.00 0.00 H ATOM 2263 HG3 PRO A 144 -19.187 10.940 27.983 1.00 0.00 H ATOM 2264 HG2 PRO A 144 -17.498 11.107 28.517 1.00 0.00 H ATOM 2265 HB2 PRO A 144 -18.710 10.360 30.517 1.00 0.00 H ATOM 2266 HB3 PRO A 144 -20.033 11.511 30.218 1.00 0.00 H ATOM 2267 N MET A 145 -15.951 12.838 31.750 1.00 33.22 N ATOM 2268 CA MET A 145 -14.605 12.439 32.123 1.00 32.06 C ATOM 2269 C MET A 145 -14.575 11.834 33.526 1.00 31.09 C ATOM 2270 O MET A 145 -15.388 12.184 34.387 1.00 36.25 O ATOM 2271 CB MET A 145 -13.661 13.638 32.020 1.00 32.79 C ATOM 2272 CG MET A 145 -13.639 14.277 30.640 1.00 29.98 C ATOM 2273 SD MET A 145 -13.462 13.062 29.294 1.00 34.59 S ATOM 2274 CE MET A 145 -12.027 13.725 28.382 1.00 32.82 C ATOM 2275 HA MET A 145 -14.268 11.667 31.431 1.00 0.00 H ATOM 2276 HB2 MET A 145 -13.977 14.390 32.743 1.00 0.00 H ATOM 2277 HB3 MET A 145 -12.652 13.305 32.262 1.00 0.00 H ATOM 2278 HG2 MET A 145 -12.801 14.973 30.593 1.00 0.00 H ATOM 2279 HG3 MET A 145 -14.571 14.823 30.495 1.00 0.00 H ATOM 2280 HE1 MET A 145 -12.257 14.730 28.027 1.00 0.00 H ATOM 2281 HE2 MET A 145 -11.162 13.761 29.045 1.00 0.00 H ATOM 2282 HE3 MET A 145 -11.808 13.079 27.532 1.00 0.00 H ATOM 2283 H MET A 145 -16.291 13.798 31.959 1.00 0.00 H ATOM 2284 N HIS A 146 -13.661 10.901 33.754 1.00 31.12 N ATOM 2285 CA HIS A 146 -13.558 10.286 35.067 1.00 31.12 C ATOM 2286 C HIS A 146 -12.135 10.258 35.573 1.00 31.85 C ATOM 2287 O HIS A 146 -11.872 9.853 36.705 1.00 29.85 O ATOM 2288 CB HIS A 146 -14.202 8.900 35.052 1.00 34.67 C ATOM 2289 CG HIS A 146 -15.691 8.968 34.957 1.00 38.55 C ATOM 2290 ND1 HIS A 146 -16.361 8.944 33.753 1.00 41.85 N ATOM 2291 CD2 HIS A 146 -16.626 9.238 35.900 1.00 39.75 C ATOM 2292 CE1 HIS A 146 -17.640 9.202 33.957 1.00 45.76 C ATOM 2293 NE2 HIS A 146 -17.826 9.387 35.251 1.00 43.65 N ATOM 2294 HA HIS A 146 -14.110 10.902 35.777 1.00 0.00 H ATOM 2295 HB2 HIS A 146 -13.821 8.345 34.195 1.00 0.00 H ATOM 2296 HB3 HIS A 146 -13.932 8.378 35.970 1.00 0.00 H ATOM 2297 HD2 HIS A 146 -16.457 9.321 36.974 1.00 0.00 H ATOM 2298 HE1 HIS A 146 -18.411 9.253 33.188 1.00 0.00 H ATOM 2299 H HIS A 146 -13.017 10.609 32.992 1.00 0.00 H ATOM 2300 N ILE A 147 -11.234 10.721 34.713 1.00 30.23 N ATOM 2301 CA ILE A 147 -9.815 10.850 35.020 1.00 26.91 C ATOM 2302 C ILE A 147 -9.243 12.086 34.313 1.00 30.02 C ATOM 2303 O ILE A 147 -9.502 12.322 33.129 1.00 39.56 O ATOM 2304 CB ILE A 147 -8.986 9.608 34.599 1.00 25.43 C ATOM 2305 CG1 ILE A 147 -7.522 9.829 35.007 1.00 24.03 C ATOM 2306 CG2 ILE A 147 -9.106 9.358 33.087 1.00 25.04 C ATOM 2307 CD1 ILE A 147 -6.699 8.549 35.062 1.00 38.20 C ATOM 2308 HA ILE A 147 -9.739 10.946 36.103 1.00 0.00 H ATOM 2309 HB ILE A 147 -9.372 8.723 35.105 1.00 0.00 H ATOM 2310 HG12 ILE A 147 -7.062 10.503 34.285 1.00 0.00 H ATOM 2311 HG13 ILE A 147 -7.506 10.291 35.994 1.00 0.00 H ATOM 2312 HD11 ILE A 147 -7.139 7.867 35.790 1.00 0.00 H ATOM 2313 HD12 ILE A 147 -6.694 8.079 34.078 1.00 0.00 H ATOM 2314 HD13 ILE A 147 -5.677 8.788 35.357 1.00 0.00 H ATOM 2315 HG21 ILE A 147 -10.151 9.187 32.830 1.00 0.00 H ATOM 2316 HG22 ILE A 147 -8.735 10.228 32.546 1.00 0.00 H ATOM 2317 HG23 ILE A 147 -8.516 8.482 32.817 1.00 0.00 H ATOM 2318 H ILE A 147 -11.560 11.007 33.768 1.00 0.00 H ATOM 2319 N ARG A 148 -8.470 12.866 35.062 1.00 30.04 N ATOM 2320 CA ARG A 148 -7.841 14.087 34.566 1.00 29.13 C ATOM 2321 C ARG A 148 -6.419 14.169 35.134 1.00 28.56 C ATOM 2322 O ARG A 148 -6.229 14.096 36.357 1.00 29.73 O ATOM 2323 CB ARG A 148 -8.677 15.296 35.013 1.00 50.40 C ATOM 2324 CG ARG A 148 -8.029 16.659 34.881 1.00 61.32 C ATOM 2325 CD ARG A 148 -8.166 17.286 33.499 1.00 68.84 C ATOM 2326 NE ARG A 148 -7.589 18.632 33.452 1.00 74.40 N ATOM 2327 CZ ARG A 148 -7.965 19.648 34.229 1.00 78.56 C ATOM 2328 NH1 ARG A 148 -8.930 19.487 35.123 1.00 79.39 N ATOM 2329 NH2 ARG A 148 -7.353 20.823 34.134 1.00 79.17 N ATOM 2330 HA ARG A 148 -7.789 14.082 33.477 1.00 0.00 H ATOM 2331 HB2 ARG A 148 -9.590 15.305 34.417 1.00 0.00 H ATOM 2332 HB3 ARG A 148 -8.932 15.152 36.063 1.00 0.00 H ATOM 2333 HG2 ARG A 148 -8.490 17.328 35.607 1.00 0.00 H ATOM 2334 HG3 ARG A 148 -6.967 16.556 35.106 1.00 0.00 H ATOM 2335 HD2 ARG A 148 -9.224 17.346 33.242 1.00 0.00 H ATOM 2336 HD3 ARG A 148 -7.652 16.656 32.773 1.00 0.00 H ATOM 2337 HE ARG A 148 -6.831 18.808 32.762 1.00 0.00 H ATOM 2338 HH12 ARG A 148 -9.218 20.284 35.726 1.00 0.00 H ATOM 2339 HH11 ARG A 148 -9.399 18.564 35.222 1.00 0.00 H ATOM 2340 HH22 ARG A 148 -7.648 21.614 34.741 1.00 0.00 H ATOM 2341 HH21 ARG A 148 -6.578 20.952 33.452 1.00 0.00 H ATOM 2342 H ARG A 148 -8.305 12.593 36.052 1.00 0.00 H ATOM 2343 N LEU A 149 -5.429 14.303 34.248 1.00 29.80 N ATOM 2344 CA LEU A 149 -4.021 14.400 34.658 1.00 27.55 C ATOM 2345 C LEU A 149 -3.386 15.746 34.284 1.00 27.42 C ATOM 2346 O LEU A 149 -3.796 16.382 33.312 1.00 33.25 O ATOM 2347 CB LEU A 149 -3.190 13.285 34.012 1.00 28.81 C ATOM 2348 CG LEU A 149 -3.545 11.808 34.233 1.00 29.15 C ATOM 2349 CD1 LEU A 149 -2.630 10.953 33.386 1.00 33.35 C ATOM 2350 CD2 LEU A 149 -3.396 11.424 35.694 1.00 31.41 C ATOM 2351 HA LEU A 149 -4.018 14.303 35.744 1.00 0.00 H ATOM 2352 HB2 LEU A 149 -3.225 13.455 32.936 1.00 0.00 H ATOM 2353 HB3 LEU A 149 -2.167 13.415 34.366 1.00 0.00 H ATOM 2354 HG LEU A 149 -4.584 11.648 33.946 1.00 0.00 H ATOM 2355 HD21 LEU A 149 -2.365 11.587 36.008 1.00 0.00 H ATOM 2356 HD22 LEU A 149 -4.062 12.038 36.300 1.00 0.00 H ATOM 2357 HD23 LEU A 149 -3.654 10.373 35.820 1.00 0.00 H ATOM 2358 HD11 LEU A 149 -2.763 11.211 32.335 1.00 0.00 H ATOM 2359 HD12 LEU A 149 -1.595 11.132 33.678 1.00 0.00 H ATOM 2360 HD13 LEU A 149 -2.875 9.902 33.537 1.00 0.00 H ATOM 2361 H LEU A 149 -5.662 14.340 33.235 1.00 0.00 H ATOM 2362 N SER A 150 -2.378 16.157 35.056 1.00 32.14 N ATOM 2363 CA SER A 150 -1.643 17.399 34.811 1.00 30.64 C ATOM 2364 C SER A 150 -0.160 17.207 35.058 1.00 33.61 C ATOM 2365 O SER A 150 0.238 16.484 35.965 1.00 40.58 O ATOM 2366 CB SER A 150 -2.116 18.517 35.720 1.00 39.60 C ATOM 2367 OG SER A 150 -2.475 19.633 34.936 1.00 52.43 O ATOM 2368 HA SER A 150 -1.827 17.665 33.770 1.00 0.00 H ATOM 2369 HB2 SER A 150 -1.314 18.795 36.404 1.00 0.00 H ATOM 2370 HB3 SER A 150 -2.980 18.180 36.293 1.00 0.00 H ATOM 2371 HG SER A 150 -2.784 20.364 35.527 1.00 0.00 H ATOM 2372 H SER A 150 -2.102 15.569 35.868 1.00 0.00 H ATOM 2373 N PHE A 151 0.661 17.888 34.270 1.00 34.50 N ATOM 2374 CA PHE A 151 2.109 17.755 34.407 1.00 33.57 C ATOM 2375 C PHE A 151 2.819 19.062 34.715 1.00 35.11 C ATOM 2376 O PHE A 151 2.363 20.144 34.312 1.00 36.68 O ATOM 2377 CB PHE A 151 2.662 17.123 33.131 1.00 37.32 C ATOM 2378 CG PHE A 151 2.084 15.775 32.852 1.00 34.66 C ATOM 2379 CD1 PHE A 151 2.656 14.633 33.395 1.00 30.88 C ATOM 2380 CD2 PHE A 151 0.930 15.648 32.094 1.00 33.09 C ATOM 2381 CE1 PHE A 151 2.077 13.372 33.181 1.00 30.16 C ATOM 2382 CE2 PHE A 151 0.351 14.406 31.880 1.00 30.11 C ATOM 2383 CZ PHE A 151 0.928 13.266 32.426 1.00 31.59 C ATOM 2384 HA PHE A 151 2.301 17.117 35.269 1.00 0.00 H ATOM 2385 HB2 PHE A 151 2.435 17.780 32.291 1.00 0.00 H ATOM 2386 HB3 PHE A 151 3.743 17.024 33.232 1.00 0.00 H ATOM 2387 HD2 PHE A 151 0.471 16.537 31.660 1.00 0.00 H ATOM 2388 HE2 PHE A 151 -0.557 14.324 31.283 1.00 0.00 H ATOM 2389 HZ PHE A 151 0.473 12.290 32.258 1.00 0.00 H ATOM 2390 HE1 PHE A 151 2.534 12.480 33.610 1.00 0.00 H ATOM 2391 HD1 PHE A 151 3.563 14.716 33.993 1.00 0.00 H ATOM 2392 H PHE A 151 0.269 18.524 33.546 1.00 0.00 H ATOM 2393 N ASN A 152 3.933 18.957 35.440 1.00 25.14 N ATOM 2394 CA ASN A 152 4.706 20.138 35.804 1.00 30.19 C ATOM 2395 C ASN A 152 5.786 20.419 34.766 1.00 27.41 C ATOM 2396 O ASN A 152 6.128 19.539 33.975 1.00 24.29 O ATOM 2397 CB ASN A 152 5.305 19.970 37.213 1.00 34.71 C ATOM 2398 CG ASN A 152 6.414 18.933 37.283 1.00 37.55 C ATOM 2399 OD1 ASN A 152 6.538 18.225 38.279 1.00 43.15 O ATOM 2400 ND2 ASN A 152 7.240 18.859 36.249 1.00 42.49 N ATOM 2401 HA ASN A 152 4.040 21.001 35.823 1.00 0.00 H ATOM 2402 HB2 ASN A 152 5.710 20.930 37.532 1.00 0.00 H ATOM 2403 HB3 ASN A 152 4.508 19.669 37.893 1.00 0.00 H ATOM 2404 HD22 ASN A 152 7.098 19.478 35.425 1.00 0.00 H ATOM 2405 HD21 ASN A 152 8.030 18.182 36.262 1.00 0.00 H ATOM 2406 H ASN A 152 4.255 18.018 35.751 1.00 0.00 H ATOM 2407 N PRO A 153 6.335 21.652 34.752 1.00 32.68 N ATOM 2408 CA PRO A 153 7.380 22.042 33.797 1.00 32.36 C ATOM 2409 C PRO A 153 8.557 21.068 33.719 1.00 35.61 C ATOM 2410 O PRO A 153 9.092 20.808 32.644 1.00 42.87 O ATOM 2411 CB PRO A 153 7.785 23.431 34.285 1.00 28.42 C ATOM 2412 CG PRO A 153 6.494 24.001 34.770 1.00 29.66 C ATOM 2413 CD PRO A 153 5.923 22.815 35.568 1.00 30.15 C ATOM 2414 HA PRO A 153 7.019 22.034 32.769 1.00 0.00 H ATOM 2415 HD3 PRO A 153 6.355 22.768 36.568 1.00 0.00 H ATOM 2416 HD2 PRO A 153 4.838 22.878 35.645 1.00 0.00 H ATOM 2417 HG3 PRO A 153 5.842 24.276 33.941 1.00 0.00 H ATOM 2418 HG2 PRO A 153 6.655 24.871 35.407 1.00 0.00 H ATOM 2419 HB2 PRO A 153 8.514 23.367 35.093 1.00 0.00 H ATOM 2420 HB3 PRO A 153 8.197 24.028 33.472 1.00 0.00 H ATOM 2421 N THR A 154 8.949 20.522 34.862 1.00 35.02 N ATOM 2422 CA THR A 154 10.053 19.575 34.927 1.00 34.27 C ATOM 2423 C THR A 154 9.695 18.275 34.232 1.00 34.58 C ATOM 2424 O THR A 154 10.536 17.664 33.575 1.00 38.06 O ATOM 2425 CB THR A 154 10.439 19.288 36.388 1.00 32.72 C ATOM 2426 OG1 THR A 154 10.989 20.476 36.968 1.00 36.73 O ATOM 2427 CG2 THR A 154 11.451 18.166 36.472 1.00 29.54 C ATOM 2428 HA THR A 154 10.904 20.025 34.415 1.00 0.00 H ATOM 2429 HB THR A 154 9.546 18.982 36.933 1.00 0.00 H ATOM 2430 HG1 THR A 154 11.239 20.297 37.909 1.00 0.00 H ATOM 2431 HG23 THR A 154 11.029 17.264 36.030 1.00 0.00 H ATOM 2432 HG21 THR A 154 12.353 18.450 35.930 1.00 0.00 H ATOM 2433 HG22 THR A 154 11.698 17.979 37.517 1.00 0.00 H ATOM 2434 H THR A 154 8.453 20.778 35.739 1.00 0.00 H ATOM 2435 N GLN A 155 8.445 17.847 34.373 1.00 42.84 N ATOM 2436 CA GLN A 155 8.000 16.617 33.728 1.00 43.30 C ATOM 2437 C GLN A 155 7.885 16.830 32.224 1.00 41.05 C ATOM 2438 O GLN A 155 8.187 15.929 31.430 1.00 41.39 O ATOM 2439 CB GLN A 155 6.648 16.188 34.287 1.00 28.82 C ATOM 2440 CG GLN A 155 6.729 15.461 35.622 1.00 34.46 C ATOM 2441 CD GLN A 155 5.370 15.357 36.313 1.00 39.96 C ATOM 2442 OE1 GLN A 155 5.167 14.510 37.185 1.00 44.99 O ATOM 2443 NE2 GLN A 155 4.441 16.230 35.931 1.00 41.14 N ATOM 2444 HA GLN A 155 8.733 15.835 33.927 1.00 0.00 H ATOM 2445 HB2 GLN A 155 6.034 17.079 34.419 1.00 0.00 H ATOM 2446 HB3 GLN A 155 6.173 15.525 33.564 1.00 0.00 H ATOM 2447 HG2 GLN A 155 7.112 14.455 35.450 1.00 0.00 H ATOM 2448 HG3 GLN A 155 7.413 16.003 36.275 1.00 0.00 H ATOM 2449 HE22 GLN A 155 4.656 16.928 35.191 1.00 0.00 H ATOM 2450 HE21 GLN A 155 3.500 16.214 36.373 1.00 0.00 H ATOM 2451 H GLN A 155 7.776 18.396 34.950 1.00 0.00 H ATOM 2452 N LEU A 156 7.446 18.025 31.834 1.00 29.11 N ATOM 2453 CA LEU A 156 7.298 18.351 30.418 1.00 29.50 C ATOM 2454 C LEU A 156 8.614 18.294 29.622 1.00 34.47 C ATOM 2455 O LEU A 156 8.597 18.090 28.409 1.00 36.76 O ATOM 2456 CB LEU A 156 6.657 19.736 30.267 1.00 34.09 C ATOM 2457 CG LEU A 156 5.211 19.798 30.790 1.00 32.61 C ATOM 2458 CD1 LEU A 156 4.767 21.254 30.947 1.00 28.98 C ATOM 2459 CD2 LEU A 156 4.303 19.022 29.857 1.00 29.13 C ATOM 2460 HA LEU A 156 6.653 17.581 29.994 1.00 0.00 H ATOM 2461 HB2 LEU A 156 7.257 20.458 30.822 1.00 0.00 H ATOM 2462 HB3 LEU A 156 6.655 20.003 29.210 1.00 0.00 H ATOM 2463 HG LEU A 156 5.153 19.337 31.776 1.00 0.00 H ATOM 2464 HD21 LEU A 156 4.349 19.460 28.860 1.00 0.00 H ATOM 2465 HD22 LEU A 156 4.630 17.983 29.814 1.00 0.00 H ATOM 2466 HD23 LEU A 156 3.279 19.067 30.228 1.00 0.00 H ATOM 2467 HD11 LEU A 156 5.425 21.759 31.655 1.00 0.00 H ATOM 2468 HD12 LEU A 156 4.819 21.755 29.980 1.00 0.00 H ATOM 2469 HD13 LEU A 156 3.742 21.282 31.318 1.00 0.00 H ATOM 2470 H LEU A 156 7.204 18.739 32.550 1.00 0.00 H ATOM 2471 N GLU A 157 9.752 18.467 30.292 1.00 39.98 N ATOM 2472 CA GLU A 157 11.024 18.424 29.578 1.00 39.48 C ATOM 2473 C GLU A 157 11.676 17.051 29.553 1.00 41.23 C ATOM 2474 O GLU A 157 12.734 16.875 28.951 1.00 47.52 O ATOM 2475 CB GLU A 157 11.996 19.471 30.133 1.00 31.33 C ATOM 2476 CG GLU A 157 11.798 20.839 29.500 1.00 35.44 C ATOM 2477 CD GLU A 157 12.084 20.823 28.007 1.00 38.87 C ATOM 2478 OE1 GLU A 157 13.261 20.655 27.613 1.00 44.26 O ATOM 2479 OE2 GLU A 157 11.126 20.964 27.222 1.00 41.71 O ATOM 2480 HA GLU A 157 10.786 18.661 28.541 1.00 0.00 H ATOM 2481 HB2 GLU A 157 11.842 19.557 31.209 1.00 0.00 H ATOM 2482 HB3 GLU A 157 13.016 19.140 29.939 1.00 0.00 H ATOM 2483 HG2 GLU A 157 10.766 21.154 29.658 1.00 0.00 H ATOM 2484 HG3 GLU A 157 12.471 21.550 29.980 1.00 0.00 H ATOM 2485 H GLU A 157 9.734 18.632 31.319 1.00 0.00 H ATOM 2486 N GLU A 158 11.051 16.079 30.207 1.00 34.71 N ATOM 2487 CA GLU A 158 11.565 14.711 30.204 1.00 36.71 C ATOM 2488 C GLU A 158 10.687 13.887 29.269 1.00 36.00 C ATOM 2489 O GLU A 158 9.520 14.226 29.057 1.00 35.39 O ATOM 2490 CB GLU A 158 11.526 14.098 31.604 1.00 62.56 C ATOM 2491 CG GLU A 158 12.757 14.363 32.457 1.00 69.04 C ATOM 2492 CD GLU A 158 12.741 15.726 33.117 1.00 73.55 C ATOM 2493 OE1 GLU A 158 13.206 16.711 32.505 1.00 74.37 O ATOM 2494 OE2 GLU A 158 12.248 15.810 34.258 1.00 77.63 O ATOM 2495 HA GLU A 158 12.603 14.717 29.872 1.00 0.00 H ATOM 2496 HB2 GLU A 158 10.659 14.502 32.126 1.00 0.00 H ATOM 2497 HB3 GLU A 158 11.414 13.019 31.498 1.00 0.00 H ATOM 2498 HG2 GLU A 158 12.811 13.601 33.235 1.00 0.00 H ATOM 2499 HG3 GLU A 158 13.640 14.295 31.822 1.00 0.00 H ATOM 2500 H GLU A 158 10.179 16.295 30.731 1.00 0.00 H ATOM 2501 N GLN A 159 11.232 12.814 28.706 1.00 47.48 N ATOM 2502 CA GLN A 159 10.447 11.976 27.807 1.00 53.40 C ATOM 2503 C GLN A 159 9.375 11.220 28.579 1.00 53.61 C ATOM 2504 O GLN A 159 9.584 10.836 29.726 1.00 56.70 O ATOM 2505 CB GLN A 159 11.352 11.000 27.057 1.00 61.88 C ATOM 2506 CG GLN A 159 12.325 11.696 26.126 1.00 68.84 C ATOM 2507 CD GLN A 159 12.823 10.792 25.028 1.00 73.49 C ATOM 2508 OE1 GLN A 159 13.432 9.755 25.290 1.00 76.83 O ATOM 2509 NE2 GLN A 159 12.565 11.177 23.783 1.00 76.09 N ATOM 2510 HA GLN A 159 9.956 12.622 27.079 1.00 0.00 H ATOM 2511 HB2 GLN A 159 11.920 10.422 27.786 1.00 0.00 H ATOM 2512 HB3 GLN A 159 10.727 10.328 26.469 1.00 0.00 H ATOM 2513 HG2 GLN A 159 11.824 12.552 25.674 1.00 0.00 H ATOM 2514 HG3 GLN A 159 13.179 12.042 26.708 1.00 0.00 H ATOM 2515 HE22 GLN A 159 12.047 12.062 23.609 1.00 0.00 H ATOM 2516 HE21 GLN A 159 12.881 10.594 22.982 1.00 0.00 H ATOM 2517 H GLN A 159 12.223 12.571 28.907 1.00 0.00 H ATOM 2518 N CYS A 160 8.229 11.005 27.942 1.00 42.74 N ATOM 2519 CA CYS A 160 7.107 10.335 28.586 1.00 40.32 C ATOM 2520 C CYS A 160 6.802 11.003 29.914 1.00 39.37 C ATOM 2521 O CYS A 160 6.247 10.391 30.817 1.00 38.73 O ATOM 2522 CB CYS A 160 7.393 8.842 28.785 1.00 56.46 C ATOM 2523 SG CYS A 160 7.111 7.841 27.280 1.00 58.92 S ATOM 2524 HA CYS A 160 6.236 10.420 27.937 1.00 0.00 H ATOM 2525 HB2 CYS A 160 6.743 8.468 29.576 1.00 0.00 H ATOM 2526 HB3 CYS A 160 8.434 8.727 29.087 1.00 0.00 H ATOM 2527 H CYS A 160 8.130 11.324 26.957 1.00 0.00 H ATOM 2528 N HIS A 161 7.176 12.275 30.019 1.00 33.12 N ATOM 2529 CA HIS A 161 6.931 13.060 31.224 1.00 36.75 C ATOM 2530 C HIS A 161 7.461 12.386 32.490 1.00 41.55 C ATOM 2531 O HIS A 161 6.859 12.501 33.557 1.00 43.46 O ATOM 2532 CB HIS A 161 5.430 13.339 31.354 1.00 36.93 C ATOM 2533 CG HIS A 161 4.890 14.236 30.280 1.00 31.79 C ATOM 2534 ND1 HIS A 161 5.653 14.659 29.211 1.00 32.24 N ATOM 2535 CD2 HIS A 161 3.675 14.816 30.126 1.00 30.28 C ATOM 2536 CE1 HIS A 161 4.932 15.463 28.448 1.00 28.22 C ATOM 2537 NE2 HIS A 161 3.729 15.574 28.980 1.00 26.21 N ATOM 2538 HA HIS A 161 7.478 13.997 31.122 1.00 0.00 H ATOM 2539 HB2 HIS A 161 4.898 12.389 31.310 1.00 0.00 H ATOM 2540 HB3 HIS A 161 5.249 13.810 32.320 1.00 0.00 H ATOM 2541 HD2 HIS A 161 2.816 14.703 30.787 1.00 0.00 H ATOM 2542 HE1 HIS A 161 5.273 15.951 27.535 1.00 0.00 H ATOM 2543 H HIS A 161 7.659 12.725 29.215 1.00 0.00 H ATOM 2544 N ILE A 162 8.597 11.700 32.345 1.00 58.40 N ATOM 2545 CA ILE A 162 9.288 10.989 33.426 1.00 61.25 C ATOM 2546 C ILE A 162 8.843 9.528 33.546 1.00 64.00 C ATOM 2547 O ILE A 162 8.006 9.097 32.726 1.00 61.01 O ATOM 2548 CB ILE A 162 9.133 11.743 34.789 1.00 72.21 C ATOM 2549 CG1 ILE A 162 9.843 13.100 34.694 1.00 71.57 C ATOM 2550 CG2 ILE A 162 9.723 10.936 35.931 1.00 75.41 C ATOM 2551 CD1 ILE A 162 9.962 13.859 36.002 1.00 59.16 C ATOM 2552 HA ILE A 162 10.346 10.973 33.165 1.00 0.00 H ATOM 2553 OXT ILE A 162 9.351 8.809 34.434 1.00 75.36 O ATOM 2554 HB ILE A 162 8.071 11.887 34.990 1.00 0.00 H ATOM 2555 HG12 ILE A 162 10.849 12.929 34.310 1.00 0.00 H ATOM 2556 HG13 ILE A 162 9.289 13.723 33.992 1.00 0.00 H ATOM 2557 HD11 ILE A 162 8.966 14.056 36.398 1.00 0.00 H ATOM 2558 HD12 ILE A 162 10.527 13.261 36.717 1.00 0.00 H ATOM 2559 HD13 ILE A 162 10.478 14.803 35.827 1.00 0.00 H ATOM 2560 HG21 ILE A 162 9.208 9.978 36.002 1.00 0.00 H ATOM 2561 HG22 ILE A 162 10.783 10.767 35.745 1.00 0.00 H ATOM 2562 HG23 ILE A 162 9.600 11.486 36.864 1.00 0.00 H ATOM 2563 H ILE A 162 9.023 11.667 31.397 1.00 0.00 H TER 2564 ILE A 162 HETATM 2565 O HOH 1 5.097 8.056 31.928 1.00 47.53 O HETATM 2566 O HOH 2 -12.473 21.166 4.173 1.00 46.41 O HETATM 2567 O HOH 3 2.182 16.175 37.566 1.00 30.55 O HETATM 2568 O HOH 4 4.280 10.692 34.335 1.00 66.52 O HETATM 2569 O HOH 5 -11.727 30.730 22.966 1.00 48.97 O HETATM 2570 O HOH 6 -7.310 23.879 8.107 1.00 47.91 O HETATM 2571 O HOH 7 -15.214 12.617 5.392 1.00 51.85 O HETATM 2572 O HOH 8 -13.662 4.599 34.929 1.00 42.14 O HETATM 2573 O HOH 9 -15.965 25.985 26.268 1.00 59.97 O HETATM 2574 O HOH 10 -9.566 16.602 -0.832 1.00 58.75 O HETATM 2575 O HOH 11 7.432 12.408 37.394 1.00 50.32 O HETATM 2576 O HOH 12 10.673 23.758 31.994 1.00 49.50 O HETATM 2577 O HOH 13 -28.913 17.519 -1.777 1.00 65.38 O HETATM 2578 O HOH 14 -10.894 9.911 0.508 1.00 51.59 O HETATM 2579 O HOH 15 1.008 -0.479 39.705 1.00 51.50 O HETATM 2580 O HOH 16 5.333 -4.938 39.985 1.00 71.52 O HETATM 2581 O HOH 17 -19.320 19.185 2.513 1.00 37.48 O HETATM 2582 O HOH 18 9.095 16.616 39.203 1.00 56.77 O HETATM 2583 O HOH 19 -7.172 35.015 15.987 1.00 61.84 O HETATM 2584 O HOH 20 -9.559 24.443 5.222 1.00 44.78 O HETATM 2585 O HOH 21 -12.038 14.641 2.411 1.00 55.69 O HETATM 2586 O HOH 22 11.071 24.519 39.517 1.00 59.59 O HETATM 2587 O HOH 23 7.007 15.147 40.459 1.00 47.31 O HETATM 2588 O HOH 24 -4.760 38.056 31.353 1.00 58.30 O HETATM 2589 O HOH 25 -4.901 10.188 0.891 1.00 53.21 O HETATM 2590 O HOH 26 15.327 8.460 21.211 1.00 53.49 O HETATM 2591 O HOH 27 -15.368 3.829 33.514 1.00 50.44 O HETATM 2592 O HOH 28 -27.429 16.383 35.997 1.00 62.54 O HETATM 2593 O HOH 29 -16.614 33.043 33.723 1.00 55.72 O HETATM 2594 O HOH 30 -20.511 14.738 36.071 1.00 54.34 O HETATM 2595 O HOH 31 -7.084 11.622 -1.312 1.00 55.77 O HETATM 2596 O HOH 32 5.086 -4.519 22.440 1.00 57.75 O HETATM 2597 O HOH 33 3.368 25.174 6.550 1.00 51.07 O HETATM 2598 O HOH 34 -21.935 16.658 22.749 1.00 53.49 O HETATM 2599 O HOH 35 -15.143 27.009 16.991 1.00 50.00 O HETATM 2600 O HOH 36 -19.831 23.372 25.181 1.00 48.23 O HETATM 2601 O HOH 37 -14.875 25.031 20.605 1.00 38.81 O HETATM 2602 O HOH 38 -7.772 6.675 1.509 1.00 46.73 O HETATM 2603 O VD A 3 -0.376 0.172 24.587 1.00 -0.39 O HETATM 2604 C3 VD A 3 -0.832 1.015 23.511 1.00 0.06 C HETATM 2605 C2 VD A 3 0.435 1.696 22.814 1.00 -0.01 C HETATM 2606 C1 VD A 3 0.710 1.328 21.403 1.00 -0.02 C HETATM 2607 C6 VD A 3 -0.557 1.574 20.556 1.00 -0.07 C HETATM 2608 C5 VD A 3 -1.827 0.832 21.041 1.00 -0.00 C HETATM 2609 C4 VD A 3 -1.635 0.166 22.490 1.00 -0.01 C HETATM 2610 H7 VD A 3 -2.633 -0.019 22.913 1.00 0.03 H HETATM 2611 H8 VD A 3 -1.110 -0.791 22.357 1.00 0.03 H HETATM 2612 C7 VD A 3 -3.017 0.723 20.376 1.00 -0.04 C HETATM 2613 C8 VD A 3 -4.406 1.332 20.316 1.00 -0.05 C HETATM 2614 C9 VD A 3 -4.677 2.637 19.889 1.00 -0.04 C HETATM 2615 C10 VD A 3 -4.659 2.175 18.335 1.00 -0.05 C HETATM 2616 C11 VD A 3 -4.355 3.220 17.323 1.00 -0.05 C HETATM 2617 C12 VD A 3 -4.690 4.722 17.671 1.00 -0.05 C HETATM 2618 C13 VD A 3 -4.377 5.152 19.111 1.00 -0.03 C HETATM 2619 C14 VD A 3 -3.762 3.974 19.960 1.00 -0.03 C HETATM 2620 C15 VD A 3 -3.568 4.712 21.380 1.00 -0.05 C HETATM 2621 C16 VD A 3 -3.228 6.269 21.010 1.00 -0.05 C HETATM 2622 C17 VD A 3 -3.209 6.267 19.435 1.00 -0.03 C HETATM 2623 C20 VD A 3 -3.562 7.722 18.724 1.00 -0.04 C HETATM 2624 C21 VD A 3 -2.898 7.744 17.366 1.00 -0.06 C HETATM 2625 H33 VD A 3 -3.115 8.700 16.867 1.00 0.02 H HETATM 2626 H34 VD A 3 -3.286 6.916 16.755 1.00 0.02 H HETATM 2627 H35 VD A 3 -1.810 7.632 17.488 1.00 0.02 H HETATM 2628 C22 VD A 3 -3.040 9.081 19.321 1.00 -0.05 C HETATM 2629 C23 VD A 3 -4.181 10.268 18.958 1.00 -0.05 C HETATM 2630 C24 VD A 3 -3.203 11.400 18.567 1.00 -0.05 C HETATM 2631 C25 VD A 3 -3.418 12.864 19.018 1.00 -0.05 C HETATM 2632 C26 VD A 3 -2.179 12.860 19.703 1.00 -0.06 C HETATM 2633 H43 VD A 3 -2.018 13.841 20.174 1.00 0.02 H HETATM 2634 H44 VD A 3 -1.366 12.658 18.990 1.00 0.02 H HETATM 2635 H45 VD A 3 -2.191 12.079 20.477 1.00 0.02 H HETATM 2636 C27 VD A 3 -3.082 14.105 18.363 1.00 -0.06 C HETATM 2637 H46 VD A 3 -3.909 14.407 17.703 1.00 0.02 H HETATM 2638 H47 VD A 3 -2.168 13.969 17.766 1.00 0.02 H HETATM 2639 H48 VD A 3 -2.913 14.885 19.120 1.00 0.02 H HETATM 2640 H42 VD A 3 -4.358 12.964 19.581 1.00 0.03 H HETATM 2641 H40 VD A 3 -3.177 11.418 17.468 1.00 0.03 H HETATM 2642 H41 VD A 3 -2.217 11.101 18.952 1.00 0.03 H HETATM 2643 H38 VD A 3 -4.797 10.533 19.830 1.00 0.03 H HETATM 2644 H39 VD A 3 -4.834 9.976 18.123 1.00 0.03 H HETATM 2645 H36 VD A 3 -2.071 9.341 18.870 1.00 0.03 H HETATM 2646 H37 VD A 3 -2.925 8.992 20.411 1.00 0.03 H HETATM 2647 H32 VD A 3 -4.657 7.780 18.635 1.00 0.03 H HETATM 2648 H26 VD A 3 -2.228 5.932 19.067 1.00 0.03 H HETATM 2649 H24 VD A 3 -2.250 6.567 21.416 1.00 0.03 H HETATM 2650 H25 VD A 3 -4.006 6.945 21.395 1.00 0.03 H HETATM 2651 H22 VD A 3 -2.737 4.258 21.940 1.00 0.03 H HETATM 2652 H23 VD A 3 -4.490 4.650 21.977 1.00 0.03 H HETATM 2653 H21 VD A 3 -2.772 3.698 19.567 1.00 0.03 H HETATM 2654 C18 VD A 3 -5.817 5.636 19.623 1.00 -0.06 C HETATM 2655 H27 VD A 3 -6.567 4.866 19.389 1.00 0.02 H HETATM 2656 H28 VD A 3 -6.088 6.577 19.121 1.00 0.02 H HETATM 2657 H29 VD A 3 -5.784 5.797 20.711 1.00 0.02 H HETATM 2658 H19 VD A 3 -5.765 4.879 17.497 1.00 0.03 H HETATM 2659 H20 VD A 3 -4.111 5.365 16.992 1.00 0.03 H HETATM 2660 H17 VD A 3 -4.917 2.964 16.413 1.00 0.03 H HETATM 2661 H18 VD A 3 -3.276 3.167 17.115 1.00 0.03 H HETATM 2662 H15 VD A 3 -5.652 1.764 18.100 1.00 0.03 H HETATM 2663 H16 VD A 3 -3.901 1.384 18.233 1.00 0.03 H HETATM 2664 H14 VD A 3 -5.671 2.927 20.261 1.00 0.03 H HETATM 2665 H12 VD A 3 -4.803 1.266 21.340 1.00 0.03 H HETATM 2666 H13 VD A 3 -4.989 0.676 19.653 1.00 0.03 H HETATM 2667 H10 VD A 3 -3.260 -0.335 20.555 1.00 0.03 H HETATM 2668 H11 VD A 3 -2.687 0.852 19.335 1.00 0.03 H HETATM 2669 H9 VD A 3 -1.490 -0.087 20.539 1.00 0.05 H HETATM 2670 C19 VD A 3 -0.515 2.331 19.534 1.00 -0.13 C HETATM 2671 H30 VD A 3 0.418 2.819 19.256 1.00 0.01 H HETATM 2672 H31 VD A 3 -1.412 2.491 18.938 1.00 0.01 H HETATM 2673 H2 VD A 3 0.988 0.265 21.348 1.00 0.05 H HETATM 2674 H3 VD A 3 1.536 1.944 21.017 1.00 0.05 H HETATM 2675 H4 VD A 3 0.287 2.785 22.849 1.00 0.03 H HETATM 2676 H5 VD A 3 1.323 1.427 23.405 1.00 0.03 H HETATM 2677 H6 VD A 3 -1.486 1.801 23.916 1.00 0.06 H HETATM 2678 H1 VD A 3 -1.124 -0.237 25.006 1.00 0.21 H CONECT 1 2 19 20 21 CONECT 19 1 CONECT 20 1 CONECT 21 1 CONECT 1005 1004 2523 CONECT 1685 1684 1863 CONECT 1863 1685 1862 CONECT 2523 1005 2522 CONECT 2603 2604 2678 CONECT 2604 2603 2605 2609 2677 CONECT 2605 2604 2606 2675 2676 CONECT 2606 2605 2607 2673 2674 CONECT 2607 2606 2608 2670 CONECT 2608 2607 2609 2612 2669 CONECT 2609 2604 2608 2610 2611 CONECT 2610 2609 CONECT 2611 2609 CONECT 2612 2608 2613 2667 2668 CONECT 2613 2612 2614 2665 2666 CONECT 2614 2613 2615 2619 2664 CONECT 2615 2614 2616 2662 2663 CONECT 2616 2615 2617 2660 2661 CONECT 2617 2616 2618 2658 2659 CONECT 2618 2617 2619 2622 2654 CONECT 2619 2614 2618 2620 2653 CONECT 2620 2619 2621 2651 2652 CONECT 2621 2620 2622 2649 2650 CONECT 2622 2618 2621 2623 2648 CONECT 2623 2622 2624 2628 2647 CONECT 2624 2623 2625 2626 2627 CONECT 2625 2624 CONECT 2626 2624 CONECT 2627 2624 CONECT 2628 2623 2629 2645 2646 CONECT 2629 2628 2630 2643 2644 CONECT 2630 2629 2631 2641 2642 CONECT 2631 2630 2632 2636 2640 CONECT 2632 2631 2633 2634 2635 CONECT 2633 2632 CONECT 2634 2632 CONECT 2635 2632 CONECT 2636 2631 2637 2638 2639 CONECT 2637 2636 CONECT 2638 2636 CONECT 2639 2636 CONECT 2640 2631 CONECT 2641 2630 CONECT 2642 2630 CONECT 2643 2629 CONECT 2644 2629 CONECT 2645 2628 CONECT 2646 2628 CONECT 2647 2623 CONECT 2648 2622 CONECT 2649 2621 CONECT 2650 2621 CONECT 2651 2620 CONECT 2652 2620 CONECT 2653 2619 CONECT 2654 2618 2655 2656 2657 CONECT 2655 2654 CONECT 2656 2654 CONECT 2657 2654 CONECT 2658 2617 CONECT 2659 2617 CONECT 2660 2616 CONECT 2661 2616 CONECT 2662 2615 CONECT 2663 2615 CONECT 2664 2614 CONECT 2665 2613 CONECT 2666 2613 CONECT 2667 2612 CONECT 2668 2612 CONECT 2669 2608 CONECT 2670 2607 2671 2672 CONECT 2671 2670 CONECT 2672 2670 CONECT 2673 2606 CONECT 2674 2606 CONECT 2675 2605 CONECT 2676 2605 CONECT 2677 2604 CONECT 2678 2603 MASTER 0 0 0 0 0 0 0 0 2677 1 84 13 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 2gj5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1gx8
RCSB PDB
PDBbind
162aa, >1GX8_1|Chain... *
2r56
RCSB PDB
PDBbind
162aa, >2R56_1|Chains... at 100%
3nq3
RCSB PDB
PDBbind
162aa, >3NQ3_1|Chain... at 100%
3nq9
RCSB PDB
PDBbind
162aa, >3NQ9_1|Chain... at 100%
3ueu
RCSB PDB
PDBbind
162aa, >3UEU_1|Chain... at 100%
3uev
RCSB PDB
PDBbind
162aa, >3UEV_1|Chain... at 100%
3uew
RCSB PDB
PDBbind
162aa, >3UEW_1|Chain... at 100%
3uex
RCSB PDB
PDBbind
162aa, >3UEX_1|Chain... at 100%
4gny
RCSB PDB
PDBbind
162aa, >4GNY_1|Chain... at 100%
4kii
RCSB PDB
PDBbind
162aa, >4KII_1|Chain... at 98%
6ge7
RCSB PDB
PDBbind
162aa, >6GE7_1|Chain... at 100%
6gf9
RCSB PDB
PDBbind
162aa, >6GF9_1|Chain... at 100%
6gfs
RCSB PDB
PDBbind
162aa, >6GFS_1|Chain... at 100%
6ghh
RCSB PDB
PDBbind
162aa, >6GHH_1|Chain... at 100%
6qi7
RCSB PDB
PDBbind
162aa, >6QI7_1|Chain... at 99%
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
2gj5
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
milk beta-lactoglobulin
Ligand Name
VD3
EC.Number
E.C.-.-.-.-
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Kd=4.74nM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) Proteins Vol. 71: pp. 1197-1210
Ligand Properties
Formula
C
2
7
H
4
8
O
Molecular Weight
388.669
Exact Mass
388.371
No. of atoms
76
No. of bonds
78
Polar Surface Area
20.23
LOGP Value
9.39 (
Computed with XLOGP3
)
7.78 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 1
No. of Rings: 3
Canonical SMILES
CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CCC[C@H]2CC[C@@H]1C[C@@H](O)CCC1=C)C)C
InChI String
InChI=1S/C27H48O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h19,21-26,28H,3,6-18H2,1-2,4-5H3/t21-,22+,23-,24+,25-,26+,27-/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):
P02754
Entrez Gene ID
NCBI Entrez Gene ID:
280838
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓