Browse entries in the PDBbind-CN Database
HEADER 4KII_COMPLEX COMPND 4KII_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 108 ILE VAL THR GLN THR MET LYS GLY LEU ASP ILE GLN LYS SEQRES 2 A 108 VAL ALA GLY THR TRP TYR SER LEU ALA MET ALA ALA SER SEQRES 3 A 108 ASP ILE SER LEU LEU ASP ALA GLN SER ALA PRO LEU ARG SEQRES 4 A 108 VAL TYR VAL GLU GLU LEU LYS PRO THR PRO GLU GLY ASP SEQRES 5 A 108 LEU GLU ILE LEU LEU GLN LYS TRP GLU ASN ASP GLU CYS SEQRES 6 A 108 ALA GLN LYS LYS ILE ILE ALA GLU LYS THR LYS ILE PRO SEQRES 7 A 108 ALA VAL PHE LYS ILE ASP ALA LEU ASN GLU ASN LYS VAL SEQRES 8 A 108 LEU VAL LEU ASP THR ASP TYR LYS LYS TYR LEU LEU PHE SEQRES 9 A 108 CYS MET GLU ASN SEQRES 1 A 48 GLN SER LEU VAL CYS GLN CYS LEU VAL ARG THR PRO GLU SEQRES 2 A 48 VAL ASP ASP GLU ALA LEU GLU LYS PHE ASP LYS ALA LEU SEQRES 3 A 48 LYS ALA LEU PRO MET HIS ILE ARG LEU SER PHE ASN PRO SEQRES 4 A 48 THR GLN LEU GLU GLU GLN CYS HIS ILE HET RHL A 249 58 SSBOND 1 CYS A 106 CYS A 119 SSBOND 2 CYS A 66 CYS A 160 ATOM 1 N ILE A 2 46.814 56.608 112.435 1.00 72.92 N ATOM 2 CA ILE A 2 47.629 56.731 113.639 1.00 75.55 C ATOM 3 C ILE A 2 48.514 55.496 113.840 1.00 68.88 C ATOM 4 O ILE A 2 49.593 55.577 114.440 1.00 70.32 O ATOM 5 CB ILE A 2 46.751 57.006 114.885 1.00 82.95 C ATOM 6 CG1 ILE A 2 47.621 57.270 116.119 1.00 87.90 C ATOM 7 CG2 ILE A 2 45.768 55.867 115.120 1.00 74.74 C ATOM 8 CD1 ILE A 2 46.864 57.839 117.298 1.00 89.76 C ATOM 9 HA ILE A 2 48.289 57.589 113.506 1.00 0.00 H ATOM 10 HB ILE A 2 46.166 57.907 114.700 1.00 0.00 H ATOM 11 HG12 ILE A 2 48.075 56.328 116.426 1.00 0.00 H ATOM 12 HG13 ILE A 2 48.404 57.976 115.842 1.00 0.00 H ATOM 13 HD11 ILE A 2 46.412 58.790 117.014 1.00 0.00 H ATOM 14 HD12 ILE A 2 46.083 57.140 117.599 1.00 0.00 H ATOM 15 HD13 ILE A 2 47.552 57.996 118.128 1.00 0.00 H ATOM 16 HG21 ILE A 2 45.120 55.763 114.250 1.00 0.00 H ATOM 17 HG22 ILE A 2 46.319 54.940 115.277 1.00 0.00 H ATOM 18 HG23 ILE A 2 45.164 56.086 116.001 1.00 0.00 H ATOM 19 HN3 ILE A 2 46.202 55.771 112.516 1.00 0.00 H ATOM 20 HN2 ILE A 2 47.435 56.506 111.607 1.00 0.00 H ATOM 21 HN1 ILE A 2 46.227 57.459 112.327 1.00 0.00 H ATOM 22 N VAL A 3 48.050 54.357 113.333 1.00 58.17 N ATOM 23 CA VAL A 3 48.849 53.136 113.320 1.00 53.47 C ATOM 24 C VAL A 3 49.962 53.274 112.282 1.00 57.51 C ATOM 25 O VAL A 3 49.707 53.552 111.107 1.00 62.03 O ATOM 26 CB VAL A 3 47.968 51.915 113.034 1.00 52.71 C ATOM 27 CG1 VAL A 3 48.799 50.637 112.949 1.00 41.62 C ATOM 28 CG2 VAL A 3 46.927 51.794 114.125 1.00 50.12 C ATOM 29 HA VAL A 3 49.300 52.987 114.301 1.00 0.00 H ATOM 30 HB VAL A 3 47.480 52.051 112.069 1.00 0.00 H ATOM 31 HG11 VAL A 3 49.530 50.733 112.146 1.00 0.00 H ATOM 32 HG12 VAL A 3 49.316 50.478 113.895 1.00 0.00 H ATOM 33 HG13 VAL A 3 48.142 49.791 112.745 1.00 0.00 H ATOM 34 HG21 VAL A 3 47.424 51.673 115.088 1.00 0.00 H ATOM 35 HG22 VAL A 3 46.314 52.695 114.142 1.00 0.00 H ATOM 36 HG23 VAL A 3 46.296 50.927 113.929 1.00 0.00 H ATOM 37 H VAL A 3 47.090 54.336 112.934 1.00 0.00 H ATOM 38 N THR A 4 51.199 53.097 112.731 1.00 48.89 N ATOM 39 CA THR A 4 52.370 53.322 111.891 1.00 54.64 C ATOM 40 C THR A 4 53.243 52.088 111.963 1.00 57.47 C ATOM 41 O THR A 4 54.472 52.149 111.848 1.00 53.49 O ATOM 42 CB THR A 4 53.172 54.515 112.390 1.00 59.85 C ATOM 43 OG1 THR A 4 53.425 54.355 113.793 1.00 59.60 O ATOM 44 CG2 THR A 4 52.403 55.809 112.160 1.00 61.71 C ATOM 45 HA THR A 4 52.047 53.521 110.869 1.00 0.00 H ATOM 46 HB THR A 4 54.113 54.565 111.841 1.00 0.00 H ATOM 47 HG1 THR A 4 52.564 54.305 114.279 1.00 0.00 H ATOM 48 HG23 THR A 4 52.210 55.931 111.094 1.00 0.00 H ATOM 49 HG21 THR A 4 51.457 55.768 112.699 1.00 0.00 H ATOM 50 HG22 THR A 4 52.993 56.650 112.523 1.00 0.00 H ATOM 51 H THR A 4 51.338 52.788 113.714 1.00 0.00 H ATOM 52 N GLN A 5 52.585 50.963 112.192 1.00 43.11 N ATOM 53 CA GLN A 5 53.253 49.687 112.187 1.00 41.06 C ATOM 54 C GLN A 5 52.516 48.827 111.174 1.00 40.90 C ATOM 55 O GLN A 5 51.331 48.537 111.340 1.00 50.15 O ATOM 56 CB GLN A 5 53.188 49.054 113.574 1.00 56.58 C ATOM 57 CG GLN A 5 54.404 48.210 113.908 1.00 67.31 C ATOM 58 CD GLN A 5 54.114 47.129 114.938 1.00 68.40 C ATOM 59 OE1 GLN A 5 53.597 47.410 116.017 1.00 70.49 O ATOM 60 NE2 GLN A 5 54.450 45.885 114.606 1.00 57.36 N ATOM 61 HA GLN A 5 54.306 49.788 111.926 1.00 0.00 H ATOM 62 HB2 GLN A 5 53.106 49.850 114.314 1.00 0.00 H ATOM 63 HB3 GLN A 5 52.303 48.420 113.624 1.00 0.00 H ATOM 64 HG2 GLN A 5 54.758 47.733 112.994 1.00 0.00 H ATOM 65 HG3 GLN A 5 55.183 48.863 114.300 1.00 0.00 H ATOM 66 HE22 GLN A 5 54.886 45.693 113.681 1.00 0.00 H ATOM 67 HE21 GLN A 5 54.277 45.105 115.271 1.00 0.00 H ATOM 68 H GLN A 5 51.563 51.001 112.380 1.00 0.00 H ATOM 69 N THR A 6 53.192 48.468 110.092 1.00 43.62 N ATOM 70 CA THR A 6 52.598 47.569 109.115 1.00 39.02 C ATOM 71 C THR A 6 53.572 46.466 108.791 1.00 38.60 C ATOM 72 O THR A 6 54.784 46.613 108.937 1.00 47.78 O ATOM 73 CB THR A 6 52.165 48.279 107.826 1.00 52.22 C ATOM 74 OG1 THR A 6 53.228 49.119 107.367 1.00 54.18 O ATOM 75 CG2 THR A 6 50.927 49.124 108.073 1.00 51.35 C ATOM 76 HA THR A 6 51.693 47.160 109.564 1.00 0.00 H ATOM 77 HB THR A 6 51.932 47.527 107.072 1.00 0.00 H ATOM 78 HG1 THR A 6 53.438 49.792 108.062 1.00 0.00 H ATOM 79 HG23 THR A 6 50.116 48.485 108.423 1.00 0.00 H ATOM 80 HG21 THR A 6 51.148 49.878 108.828 1.00 0.00 H ATOM 81 HG22 THR A 6 50.631 49.613 107.145 1.00 0.00 H ATOM 82 H THR A 6 54.154 48.832 109.940 1.00 0.00 H ATOM 83 N MET A 7 53.019 45.349 108.360 1.00 37.80 N ATOM 84 CA MET A 7 53.808 44.185 107.991 1.00 39.57 C ATOM 85 C MET A 7 54.450 44.418 106.624 1.00 51.36 C ATOM 86 O MET A 7 53.745 44.609 105.632 1.00 46.22 O ATOM 87 CB MET A 7 52.890 42.967 107.936 1.00 37.68 C ATOM 88 CG MET A 7 53.533 41.688 107.434 1.00 41.65 C ATOM 89 SD MET A 7 54.672 40.971 108.632 1.00 45.73 S ATOM 90 CE MET A 7 55.146 39.479 107.740 1.00 42.83 C ATOM 91 HA MET A 7 54.595 44.017 108.726 1.00 0.00 H ATOM 92 HB2 MET A 7 52.515 42.782 108.943 1.00 0.00 H ATOM 93 HB3 MET A 7 52.055 43.205 107.277 1.00 0.00 H ATOM 94 HG2 MET A 7 54.082 41.908 106.518 1.00 0.00 H ATOM 95 HG3 MET A 7 52.748 40.963 107.220 1.00 0.00 H ATOM 96 HE1 MET A 7 54.259 38.874 107.549 1.00 0.00 H ATOM 97 HE2 MET A 7 55.610 39.755 106.793 1.00 0.00 H ATOM 98 HE3 MET A 7 55.855 38.908 108.340 1.00 0.00 H ATOM 99 H MET A 7 51.983 45.299 108.281 1.00 0.00 H ATOM 100 N LYS A 8 55.784 44.419 106.572 1.00 39.46 N ATOM 101 CA LYS A 8 56.487 44.558 105.299 1.00 40.77 C ATOM 102 C LYS A 8 56.492 43.195 104.617 1.00 45.73 C ATOM 103 O LYS A 8 56.686 42.168 105.277 1.00 43.78 O ATOM 104 CB LYS A 8 57.932 45.056 105.492 1.00 41.86 C ATOM 105 CG LYS A 8 58.090 46.196 106.491 1.00 58.70 C ATOM 106 CD LYS A 8 59.526 46.756 106.508 1.00 54.01 C ATOM 107 CE LYS A 8 59.777 47.672 105.327 1.00 44.90 C ATOM 108 NZ LYS A 8 61.115 48.340 105.339 1.00 46.58 N ATOM 109 HA LYS A 8 55.974 45.300 104.687 1.00 0.00 H ATOM 110 HB2 LYS A 8 58.536 44.217 105.837 1.00 0.00 H ATOM 111 HB3 LYS A 8 58.304 45.398 104.526 1.00 0.00 H ATOM 112 HG2 LYS A 8 57.403 46.998 106.221 1.00 0.00 H ATOM 113 HG3 LYS A 8 57.844 45.828 107.487 1.00 0.00 H ATOM 114 HD2 LYS A 8 59.677 47.317 107.430 1.00 0.00 H ATOM 115 HD3 LYS A 8 60.231 45.926 106.469 1.00 0.00 H ATOM 116 HE2 LYS A 8 59.009 48.446 105.325 1.00 0.00 H ATOM 117 HE3 LYS A 8 59.698 47.082 104.414 1.00 0.00 H ATOM 118 HZ1 LYS A 8 61.204 48.919 106.198 1.00 0.00 H ATOM 119 HZ2 LYS A 8 61.862 47.617 105.328 1.00 0.00 H ATOM 120 HZ3 LYS A 8 61.206 48.947 104.499 1.00 0.00 H ATOM 121 H LYS A 8 56.331 44.319 107.451 1.00 0.00 H ATOM 122 N GLY A 9 56.240 43.177 103.312 1.00 43.02 N ATOM 123 CA GLY A 9 56.350 41.953 102.532 1.00 52.33 C ATOM 124 C GLY A 9 55.246 40.947 102.798 1.00 45.61 C ATOM 125 O GLY A 9 55.418 39.752 102.527 1.00 45.24 O ATOM 126 HA3 GLY A 9 57.305 41.483 102.765 1.00 0.00 H ATOM 127 HA2 GLY A 9 56.325 42.217 101.475 1.00 0.00 H ATOM 128 H GLY A 9 55.958 44.058 102.837 1.00 0.00 H ATOM 129 N LEU A 10 54.116 41.423 103.320 1.00 40.26 N ATOM 130 CA LEU A 10 52.956 40.561 103.580 1.00 39.42 C ATOM 131 C LEU A 10 52.535 39.774 102.351 1.00 46.52 C ATOM 132 O LEU A 10 52.396 40.349 101.264 1.00 44.27 O ATOM 133 CB LEU A 10 51.760 41.408 104.045 1.00 38.66 C ATOM 134 CG LEU A 10 50.437 40.673 104.282 1.00 38.03 C ATOM 135 CD1 LEU A 10 50.584 39.712 105.452 1.00 36.95 C ATOM 136 CD2 LEU A 10 49.306 41.668 104.555 1.00 37.78 C ATOM 137 HA LEU A 10 53.257 39.857 104.356 1.00 0.00 H ATOM 138 HB2 LEU A 10 52.042 41.889 104.982 1.00 0.00 H ATOM 139 HB3 LEU A 10 51.582 42.170 103.286 1.00 0.00 H ATOM 140 HG LEU A 10 50.186 40.109 103.384 1.00 0.00 H ATOM 141 HD21 LEU A 10 49.547 42.256 105.441 1.00 0.00 H ATOM 142 HD22 LEU A 10 49.192 42.331 103.697 1.00 0.00 H ATOM 143 HD23 LEU A 10 48.377 41.123 104.720 1.00 0.00 H ATOM 144 HD11 LEU A 10 51.365 38.986 105.228 1.00 0.00 H ATOM 145 HD12 LEU A 10 50.852 40.271 106.348 1.00 0.00 H ATOM 146 HD13 LEU A 10 49.640 39.193 105.615 1.00 0.00 H ATOM 147 H LEU A 10 54.054 42.435 103.550 1.00 0.00 H ATOM 148 N ASP A 11 52.349 38.466 102.520 1.00 44.70 N ATOM 149 CA ASP A 11 51.707 37.638 101.497 1.00 50.98 C ATOM 150 C ASP A 11 50.315 37.287 101.987 1.00 44.37 C ATOM 151 O ASP A 11 50.161 36.397 102.832 1.00 42.16 O ATOM 152 CB ASP A 11 52.485 36.345 101.246 1.00 44.97 C ATOM 153 CG ASP A 11 51.903 35.525 100.098 1.00 58.73 C ATOM 154 OD1 ASP A 11 50.788 35.838 99.617 1.00 62.38 O ATOM 155 OD2 ASP A 11 52.563 34.560 99.668 1.00 60.90 O ATOM 156 HA ASP A 11 51.675 38.196 100.561 1.00 0.00 H ATOM 157 HB2 ASP A 11 53.517 36.599 101.006 1.00 0.00 H ATOM 158 HB3 ASP A 11 52.462 35.742 102.153 1.00 0.00 H ATOM 159 H ASP A 11 52.669 38.020 103.403 1.00 0.00 H ATOM 160 N ILE A 12 49.298 37.962 101.455 1.00 41.01 N ATOM 161 CA ILE A 12 47.942 37.800 101.996 1.00 41.34 C ATOM 162 C ILE A 12 47.391 36.383 101.812 1.00 45.76 C ATOM 163 O ILE A 12 46.505 35.963 102.555 1.00 50.12 O ATOM 164 CB ILE A 12 46.963 38.878 101.442 1.00 52.57 C ATOM 165 CG1 ILE A 12 45.726 39.022 102.339 1.00 49.88 C ATOM 166 CG2 ILE A 12 46.562 38.567 100.018 1.00 43.41 C ATOM 167 CD1 ILE A 12 46.042 39.438 103.761 1.00 43.55 C ATOM 168 HA ILE A 12 48.025 37.957 103.071 1.00 0.00 H ATOM 169 HB ILE A 12 47.489 39.833 101.444 1.00 0.00 H ATOM 170 HG12 ILE A 12 45.069 39.773 101.900 1.00 0.00 H ATOM 171 HG13 ILE A 12 45.210 38.062 102.369 1.00 0.00 H ATOM 172 HD11 ILE A 12 46.689 38.691 104.221 1.00 0.00 H ATOM 173 HD12 ILE A 12 46.548 40.403 103.752 1.00 0.00 H ATOM 174 HD13 ILE A 12 45.115 39.517 104.329 1.00 0.00 H ATOM 175 HG21 ILE A 12 47.451 38.545 99.388 1.00 0.00 H ATOM 176 HG22 ILE A 12 46.068 37.596 99.985 1.00 0.00 H ATOM 177 HG23 ILE A 12 45.879 39.336 99.658 1.00 0.00 H ATOM 178 H ILE A 12 49.464 38.605 100.655 1.00 0.00 H ATOM 179 N GLN A 13 47.930 35.641 100.843 1.00 46.21 N ATOM 180 CA GLN A 13 47.511 34.252 100.622 1.00 45.43 C ATOM 181 C GLN A 13 47.757 33.384 101.826 1.00 45.63 C ATOM 182 O GLN A 13 46.999 32.445 102.100 1.00 44.85 O ATOM 183 CB GLN A 13 48.263 33.629 99.443 1.00 52.51 C ATOM 184 CG GLN A 13 47.926 34.229 98.102 1.00 53.80 C ATOM 185 CD GLN A 13 46.450 34.520 97.948 1.00 49.10 C ATOM 186 OE1 GLN A 13 45.589 33.671 98.212 1.00 49.98 O ATOM 187 NE2 GLN A 13 46.147 35.732 97.517 1.00 50.95 N ATOM 188 HA GLN A 13 46.441 34.295 100.416 1.00 0.00 H ATOM 189 HB2 GLN A 13 49.332 33.756 99.615 1.00 0.00 H ATOM 190 HB3 GLN A 13 48.025 32.566 99.410 1.00 0.00 H ATOM 191 HG2 GLN A 13 48.479 35.161 97.987 1.00 0.00 H ATOM 192 HG3 GLN A 13 48.228 33.531 97.321 1.00 0.00 H ATOM 193 HE22 GLN A 13 46.904 36.414 97.307 1.00 0.00 H ATOM 194 HE21 GLN A 13 45.152 36.004 97.387 1.00 0.00 H ATOM 195 H GLN A 13 48.662 36.055 100.232 1.00 0.00 H ATOM 196 N LYS A 14 48.838 33.693 102.530 1.00 42.71 N ATOM 197 CA LYS A 14 49.307 32.863 103.625 1.00 42.31 C ATOM 198 C LYS A 14 48.598 33.117 104.942 1.00 42.65 C ATOM 199 O LYS A 14 48.875 32.428 105.917 1.00 41.28 O ATOM 200 CB LYS A 14 50.811 33.052 103.812 1.00 40.16 C ATOM 201 CG LYS A 14 51.619 32.653 102.599 1.00 47.46 C ATOM 202 CD LYS A 14 53.093 32.923 102.815 1.00 57.15 C ATOM 203 CE LYS A 14 53.630 32.167 104.013 1.00 70.41 C ATOM 204 NZ LYS A 14 55.121 32.213 104.100 1.00 76.50 N ATOM 205 HA LYS A 14 49.076 31.836 103.344 1.00 0.00 H ATOM 206 HB2 LYS A 14 51.004 34.103 104.026 1.00 0.00 H ATOM 207 HB3 LYS A 14 51.134 32.445 104.658 1.00 0.00 H ATOM 208 HG2 LYS A 14 51.475 31.589 102.409 1.00 0.00 H ATOM 209 HG3 LYS A 14 51.274 33.224 101.737 1.00 0.00 H ATOM 210 HD2 LYS A 14 53.643 32.614 101.926 1.00 0.00 H ATOM 211 HD3 LYS A 14 53.237 33.991 102.977 1.00 0.00 H ATOM 212 HE2 LYS A 14 53.316 31.126 103.938 1.00 0.00 H ATOM 213 HE3 LYS A 14 53.213 32.607 104.919 1.00 0.00 H ATOM 214 HZ1 LYS A 14 55.530 31.788 103.244 1.00 0.00 H ATOM 215 HZ2 LYS A 14 55.432 33.202 104.180 1.00 0.00 H ATOM 216 HZ3 LYS A 14 55.435 31.681 104.937 1.00 0.00 H ATOM 217 H LYS A 14 49.366 34.556 102.290 1.00 0.00 H ATOM 218 N VAL A 15 47.702 34.104 104.999 1.00 37.87 N ATOM 219 CA VAL A 15 46.931 34.310 106.236 1.00 36.54 C ATOM 220 C VAL A 15 45.603 33.560 106.177 1.00 36.97 C ATOM 221 O VAL A 15 44.802 33.598 107.118 1.00 36.96 O ATOM 222 CB VAL A 15 46.688 35.797 106.562 1.00 40.51 C ATOM 223 CG1 VAL A 15 47.997 36.573 106.482 1.00 39.93 C ATOM 224 CG2 VAL A 15 45.642 36.399 105.617 1.00 43.09 C ATOM 225 HA VAL A 15 47.541 33.907 107.044 1.00 0.00 H ATOM 226 HB VAL A 15 46.302 35.869 107.579 1.00 0.00 H ATOM 227 HG11 VAL A 15 48.707 36.161 107.199 1.00 0.00 H ATOM 228 HG12 VAL A 15 48.406 36.490 105.475 1.00 0.00 H ATOM 229 HG13 VAL A 15 47.811 37.622 106.714 1.00 0.00 H ATOM 230 HG21 VAL A 15 45.994 36.318 104.589 1.00 0.00 H ATOM 231 HG22 VAL A 15 44.702 35.857 105.725 1.00 0.00 H ATOM 232 HG23 VAL A 15 45.489 37.449 105.868 1.00 0.00 H ATOM 233 H VAL A 15 47.550 34.722 104.177 1.00 0.00 H ATOM 234 N ALA A 16 45.385 32.865 105.065 1.00 38.46 N ATOM 235 CA ALA A 16 44.170 32.093 104.866 1.00 39.30 C ATOM 236 C ALA A 16 44.028 31.063 105.979 1.00 48.96 C ATOM 237 O ALA A 16 45.029 30.496 106.433 1.00 40.07 O ATOM 238 CB ALA A 16 44.208 31.398 103.528 1.00 41.32 C ATOM 239 HA ALA A 16 43.314 32.768 104.888 1.00 0.00 H ATOM 240 HB1 ALA A 16 44.293 32.142 102.736 1.00 0.00 H ATOM 241 HB2 ALA A 16 45.067 30.728 103.492 1.00 0.00 H ATOM 242 HB3 ALA A 16 43.292 30.823 103.392 1.00 0.00 H ATOM 243 H ALA A 16 46.105 32.874 104.315 1.00 0.00 H ATOM 244 N GLY A 17 42.796 30.822 106.419 1.00 40.73 N ATOM 245 CA GLY A 17 42.552 29.736 107.349 1.00 41.25 C ATOM 246 C GLY A 17 41.949 30.147 108.676 1.00 38.13 C ATOM 247 O GLY A 17 41.422 31.247 108.826 1.00 36.67 O ATOM 248 HA3 GLY A 17 43.503 29.243 107.549 1.00 0.00 H ATOM 249 HA2 GLY A 17 41.871 29.030 106.873 1.00 0.00 H ATOM 250 H GLY A 17 42.005 31.414 106.095 1.00 0.00 H ATOM 251 N THR A 18 42.040 29.251 109.648 1.00 36.62 N ATOM 252 CA THR A 18 41.434 29.446 110.969 1.00 35.72 C ATOM 253 C THR A 18 42.233 30.415 111.824 1.00 34.39 C ATOM 254 O THR A 18 43.469 30.367 111.830 1.00 34.78 O ATOM 255 CB THR A 18 41.399 28.122 111.720 1.00 35.84 C ATOM 256 OG1 THR A 18 40.673 27.177 110.938 1.00 40.15 O ATOM 257 CG2 THR A 18 40.727 28.280 113.085 1.00 36.17 C ATOM 258 HA THR A 18 40.434 29.844 110.800 1.00 0.00 H ATOM 259 HB THR A 18 42.421 27.780 111.885 1.00 0.00 H ATOM 260 HG1 THR A 18 40.642 26.310 111.415 1.00 0.00 H ATOM 261 HG23 THR A 18 41.284 29.003 113.681 1.00 0.00 H ATOM 262 HG21 THR A 18 39.705 28.632 112.947 1.00 0.00 H ATOM 263 HG22 THR A 18 40.715 27.318 113.596 1.00 0.00 H ATOM 264 H THR A 18 42.564 28.371 109.466 1.00 0.00 H ATOM 265 N TRP A 19 41.529 31.275 112.555 1.00 34.01 N ATOM 266 CA TRP A 19 42.165 32.157 113.504 1.00 33.08 C ATOM 267 C TRP A 19 41.288 32.280 114.748 1.00 33.02 C ATOM 268 O TRP A 19 40.070 32.058 114.694 1.00 33.74 O ATOM 269 CB TRP A 19 42.376 33.543 112.877 1.00 33.11 C ATOM 270 CG TRP A 19 43.435 33.587 111.800 1.00 35.02 C ATOM 271 CD1 TRP A 19 43.244 33.574 110.443 1.00 34.06 C ATOM 272 CD2 TRP A 19 44.855 33.693 112.001 1.00 33.90 C ATOM 273 NE1 TRP A 19 44.458 33.651 109.797 1.00 34.11 N ATOM 274 CE2 TRP A 19 45.455 33.736 110.729 1.00 33.27 C ATOM 275 CE3 TRP A 19 45.665 33.764 113.139 1.00 33.19 C ATOM 276 CZ2 TRP A 19 46.844 33.835 110.568 1.00 40.58 C ATOM 277 CZ3 TRP A 19 47.029 33.852 112.976 1.00 33.30 C ATOM 278 CH2 TRP A 19 47.609 33.897 111.703 1.00 35.44 C ATOM 279 HA TRP A 19 43.135 31.746 113.782 1.00 0.00 H ATOM 280 HB2 TRP A 19 41.431 33.867 112.440 1.00 0.00 H ATOM 281 HB3 TRP A 19 42.665 34.235 113.668 1.00 0.00 H ATOM 282 HE1 TRP A 19 44.594 33.645 108.766 1.00 0.00 H ATOM 283 HD1 TRP A 19 42.275 33.512 109.948 1.00 0.00 H ATOM 284 HZ2 TRP A 19 47.298 33.862 109.578 1.00 0.00 H ATOM 285 HH2 TRP A 19 48.692 33.983 111.613 1.00 0.00 H ATOM 286 HZ3 TRP A 19 47.671 33.887 113.856 1.00 0.00 H ATOM 287 HE3 TRP A 19 45.225 33.750 114.136 1.00 0.00 H ATOM 288 H TRP A 19 40.496 31.313 112.440 1.00 0.00 H ATOM 289 N TYR A 20 41.916 32.650 115.865 1.00 31.86 N ATOM 290 CA TYR A 20 41.207 32.852 117.127 1.00 31.21 C ATOM 291 C TYR A 20 41.511 34.249 117.624 1.00 33.71 C ATOM 292 O TYR A 20 42.677 34.645 117.632 1.00 28.48 O ATOM 293 CB TYR A 20 41.723 31.869 118.178 1.00 30.64 C ATOM 294 CG TYR A 20 41.255 30.443 117.986 1.00 32.98 C ATOM 295 CD1 TYR A 20 40.218 29.928 118.749 1.00 33.67 C ATOM 296 CD2 TYR A 20 41.855 29.617 117.051 1.00 31.75 C ATOM 297 CE1 TYR A 20 39.790 28.620 118.591 1.00 36.53 C ATOM 298 CE2 TYR A 20 41.427 28.313 116.876 1.00 34.43 C ATOM 299 CZ TYR A 20 40.398 27.822 117.649 1.00 35.74 C ATOM 300 OH TYR A 20 39.970 26.535 117.485 1.00 39.96 O ATOM 301 HA TYR A 20 40.139 32.704 116.968 1.00 0.00 H ATOM 302 HB3 TYR A 20 41.386 32.209 119.157 1.00 0.00 H ATOM 303 HB2 TYR A 20 42.813 31.877 118.147 1.00 0.00 H ATOM 304 HD2 TYR A 20 42.676 29.999 116.444 1.00 0.00 H ATOM 305 HE2 TYR A 20 41.902 27.677 116.129 1.00 0.00 H ATOM 306 HE1 TYR A 20 38.980 28.227 119.206 1.00 0.00 H ATOM 307 HD1 TYR A 20 39.730 30.565 119.487 1.00 0.00 H ATOM 308 HH TYR A 20 39.230 26.351 118.117 1.00 0.00 H ATOM 309 H TYR A 20 42.945 32.800 115.837 1.00 0.00 H ATOM 310 N SER A 21 40.487 34.988 118.053 1.00 33.94 N ATOM 311 CA SER A 21 40.689 36.320 118.625 1.00 31.84 C ATOM 312 C SER A 21 41.146 36.213 120.081 1.00 33.81 C ATOM 313 O SER A 21 40.326 36.256 121.011 1.00 32.83 O ATOM 314 CB SER A 21 39.390 37.121 118.545 1.00 29.26 C ATOM 315 OG SER A 21 39.101 37.464 117.198 1.00 31.82 O ATOM 316 HA SER A 21 41.463 36.832 118.054 1.00 0.00 H ATOM 317 HB2 SER A 21 39.493 38.033 119.134 1.00 0.00 H ATOM 318 HB3 SER A 21 38.573 36.521 118.946 1.00 0.00 H ATOM 319 HG SER A 21 39.840 38.011 116.832 1.00 0.00 H ATOM 320 H SER A 21 39.521 34.609 117.979 1.00 0.00 H ATOM 321 N LEU A 22 42.456 36.078 120.284 1.00 25.63 N ATOM 322 CA LEU A 22 42.981 35.807 121.624 1.00 24.23 C ATOM 323 C LEU A 22 42.870 37.048 122.522 1.00 30.01 C ATOM 324 O LEU A 22 42.568 36.931 123.697 1.00 29.34 O ATOM 325 CB LEU A 22 44.432 35.304 121.540 1.00 30.17 C ATOM 326 CG LEU A 22 45.213 35.149 122.860 1.00 31.58 C ATOM 327 CD1 LEU A 22 44.588 34.098 123.762 1.00 31.56 C ATOM 328 CD2 LEU A 22 46.684 34.796 122.578 1.00 33.75 C ATOM 329 HA LEU A 22 42.377 35.022 122.078 1.00 0.00 H ATOM 330 HB2 LEU A 22 44.411 34.327 121.057 1.00 0.00 H ATOM 331 HB3 LEU A 22 44.985 36.005 120.915 1.00 0.00 H ATOM 332 HG LEU A 22 45.169 36.106 123.380 1.00 0.00 H ATOM 333 HD21 LEU A 22 46.732 33.858 122.026 1.00 0.00 H ATOM 334 HD22 LEU A 22 47.140 35.590 121.987 1.00 0.00 H ATOM 335 HD23 LEU A 22 47.219 34.691 123.522 1.00 0.00 H ATOM 336 HD11 LEU A 22 43.564 34.387 124.000 1.00 0.00 H ATOM 337 HD12 LEU A 22 44.585 33.136 123.249 1.00 0.00 H ATOM 338 HD13 LEU A 22 45.168 34.019 124.682 1.00 0.00 H ATOM 339 H LEU A 22 43.113 36.166 119.482 1.00 0.00 H ATOM 340 N ALA A 23 43.090 38.226 121.946 1.00 29.23 N ATOM 341 CA ALA A 23 42.983 39.489 122.680 1.00 29.55 C ATOM 342 C ALA A 23 42.457 40.588 121.757 1.00 27.60 C ATOM 343 O ALA A 23 42.693 40.552 120.541 1.00 29.58 O ATOM 344 CB ALA A 23 44.348 39.891 123.247 1.00 32.49 C ATOM 345 HA ALA A 23 42.285 39.355 123.507 1.00 0.00 H ATOM 346 HB1 ALA A 23 44.702 39.114 123.924 1.00 0.00 H ATOM 347 HB2 ALA A 23 45.058 40.013 122.429 1.00 0.00 H ATOM 348 HB3 ALA A 23 44.252 40.831 123.790 1.00 0.00 H ATOM 349 H ALA A 23 43.347 38.252 120.939 1.00 0.00 H ATOM 350 N MET A 24 41.747 41.552 122.336 1.00 25.99 N ATOM 351 CA MET A 24 41.329 42.742 121.598 1.00 29.05 C ATOM 352 C MET A 24 41.510 43.990 122.449 1.00 28.49 C ATOM 353 O MET A 24 41.483 43.927 123.686 1.00 29.89 O ATOM 354 CB MET A 24 39.870 42.620 121.118 1.00 36.82 C ATOM 355 CG MET A 24 38.893 42.148 122.178 1.00 44.22 C ATOM 356 SD MET A 24 37.297 41.601 121.500 1.00 38.48 S ATOM 357 CE MET A 24 37.724 40.021 120.783 1.00 38.80 C ATOM 358 HA MET A 24 41.964 42.828 120.716 1.00 0.00 H ATOM 359 HB2 MET A 24 39.544 43.599 120.767 1.00 0.00 H ATOM 360 HB3 MET A 24 39.842 41.911 120.290 1.00 0.00 H ATOM 361 HG2 MET A 24 38.711 42.970 122.870 1.00 0.00 H ATOM 362 HG3 MET A 24 39.344 41.314 122.716 1.00 0.00 H ATOM 363 HE1 MET A 24 38.488 40.165 120.019 1.00 0.00 H ATOM 364 HE2 MET A 24 38.107 39.362 121.562 1.00 0.00 H ATOM 365 HE3 MET A 24 36.837 39.576 120.333 1.00 0.00 H ATOM 366 H MET A 24 41.483 41.457 123.337 1.00 0.00 H ATOM 367 N ALA A 25 41.696 45.128 121.791 1.00 28.64 N ATOM 368 CA ALA A 25 41.831 46.385 122.515 1.00 30.00 C ATOM 369 C ALA A 25 41.169 47.476 121.721 1.00 30.43 C ATOM 370 O ALA A 25 41.034 47.365 120.506 1.00 31.04 O ATOM 371 CB ALA A 25 43.277 46.715 122.739 1.00 32.19 C ATOM 372 HA ALA A 25 41.352 46.293 123.490 1.00 0.00 H ATOM 373 HB1 ALA A 25 43.744 45.920 123.321 1.00 0.00 H ATOM 374 HB2 ALA A 25 43.781 46.806 121.777 1.00 0.00 H ATOM 375 HB3 ALA A 25 43.353 47.657 123.281 1.00 0.00 H ATOM 376 H ALA A 25 41.746 45.122 120.752 1.00 0.00 H ATOM 377 N ALA A 26 40.771 48.544 122.395 1.00 26.80 N ATOM 378 CA ALA A 26 40.188 49.666 121.669 1.00 29.77 C ATOM 379 C ALA A 26 40.573 50.998 122.281 1.00 35.81 C ATOM 380 O ALA A 26 40.974 51.076 123.452 1.00 34.46 O ATOM 381 CB ALA A 26 38.664 49.527 121.561 1.00 29.65 C ATOM 382 HA ALA A 26 40.600 49.643 120.660 1.00 0.00 H ATOM 383 HB1 ALA A 26 38.421 48.606 121.031 1.00 0.00 H ATOM 384 HB2 ALA A 26 38.231 49.497 122.561 1.00 0.00 H ATOM 385 HB3 ALA A 26 38.261 50.379 121.014 1.00 0.00 H ATOM 386 H ALA A 26 40.873 48.582 123.429 1.00 0.00 H ATOM 387 N SER A 27 40.423 52.047 121.481 1.00 33.88 N ATOM 388 CA SER A 27 40.831 53.379 121.879 1.00 33.07 C ATOM 389 C SER A 27 39.809 53.965 122.832 1.00 40.06 C ATOM 390 O SER A 27 40.095 54.908 123.577 1.00 50.72 O ATOM 391 CB SER A 27 40.935 54.268 120.642 1.00 39.34 C ATOM 392 OG SER A 27 39.768 54.152 119.839 1.00 36.08 O ATOM 393 HA SER A 27 41.799 53.325 122.376 1.00 0.00 H ATOM 394 HB2 SER A 27 41.804 53.967 120.057 1.00 0.00 H ATOM 395 HB3 SER A 27 41.052 55.305 120.956 1.00 0.00 H ATOM 396 HG SER A 27 39.660 53.212 119.549 1.00 0.00 H ATOM 397 H SER A 27 40.000 51.908 120.541 1.00 0.00 H ATOM 398 N ASP A 28 38.610 53.397 122.807 1.00 38.72 N ATOM 399 CA ASP A 28 37.519 53.882 123.639 1.00 42.79 C ATOM 400 C ASP A 28 36.794 52.696 124.249 1.00 43.52 C ATOM 401 O ASP A 28 36.525 51.707 123.562 1.00 38.67 O ATOM 402 CB ASP A 28 36.565 54.732 122.798 1.00 58.96 C ATOM 403 CG ASP A 28 37.260 55.916 122.144 1.00 78.70 C ATOM 404 OD1 ASP A 28 37.196 56.022 120.900 1.00 87.56 O ATOM 405 OD2 ASP A 28 37.869 56.732 122.870 1.00 82.36 O ATOM 406 HA ASP A 28 37.911 54.506 124.442 1.00 0.00 H ATOM 407 HB2 ASP A 28 36.134 54.105 122.018 1.00 0.00 H ATOM 408 HB3 ASP A 28 35.770 55.106 123.443 1.00 0.00 H ATOM 409 H ASP A 28 38.446 52.586 122.178 1.00 0.00 H ATOM 410 N ILE A 29 36.499 52.792 125.545 1.00 37.86 N ATOM 411 CA ILE A 29 35.894 51.694 126.289 1.00 35.84 C ATOM 412 C ILE A 29 34.596 51.240 125.636 1.00 37.25 C ATOM 413 O ILE A 29 34.359 50.044 125.487 1.00 39.76 O ATOM 414 CB ILE A 29 35.676 52.102 127.778 1.00 41.61 C ATOM 415 CG1 ILE A 29 37.026 52.131 128.504 1.00 42.83 C ATOM 416 CG2 ILE A 29 34.748 51.146 128.486 1.00 45.40 C ATOM 417 CD1 ILE A 29 37.032 52.943 129.781 1.00 42.72 C ATOM 418 HA ILE A 29 36.578 50.845 126.270 1.00 0.00 H ATOM 419 HB ILE A 29 35.218 53.091 127.792 1.00 0.00 H ATOM 420 HG12 ILE A 29 37.303 51.106 128.750 1.00 0.00 H ATOM 421 HG13 ILE A 29 37.768 52.554 127.827 1.00 0.00 H ATOM 422 HD11 ILE A 29 36.770 53.976 129.554 1.00 0.00 H ATOM 423 HD12 ILE A 29 36.304 52.527 130.478 1.00 0.00 H ATOM 424 HD13 ILE A 29 38.026 52.908 130.227 1.00 0.00 H ATOM 425 HG21 ILE A 29 33.780 51.143 127.984 1.00 0.00 H ATOM 426 HG22 ILE A 29 35.174 50.143 128.462 1.00 0.00 H ATOM 427 HG23 ILE A 29 34.621 51.464 129.521 1.00 0.00 H ATOM 428 H ILE A 29 36.708 53.681 126.043 1.00 0.00 H ATOM 429 N SER A 30 33.792 52.205 125.199 1.00 38.99 N ATOM 430 CA SER A 30 32.489 51.938 124.606 1.00 46.01 C ATOM 431 C SER A 30 32.536 51.032 123.373 1.00 44.82 C ATOM 432 O SER A 30 31.517 50.460 122.991 1.00 49.98 O ATOM 433 CB SER A 30 31.812 53.261 124.244 1.00 54.54 C ATOM 434 OG SER A 30 32.615 54.017 123.347 1.00 54.71 O ATOM 435 HA SER A 30 31.916 51.397 125.359 1.00 0.00 H ATOM 436 HB2 SER A 30 31.652 53.840 125.153 1.00 0.00 H ATOM 437 HB3 SER A 30 30.851 53.053 123.773 1.00 0.00 H ATOM 438 HG SER A 30 32.155 54.866 123.130 1.00 0.00 H ATOM 439 H SER A 30 34.107 53.192 125.284 1.00 0.00 H ATOM 440 N LEU A 31 33.708 50.897 122.754 1.00 42.06 N ATOM 441 CA LEU A 31 33.817 50.116 121.520 1.00 44.49 C ATOM 442 C LEU A 31 33.816 48.613 121.796 1.00 45.31 C ATOM 443 O LEU A 31 33.499 47.819 120.912 1.00 41.56 O ATOM 444 CB LEU A 31 35.074 50.511 120.732 1.00 36.52 C ATOM 445 CG LEU A 31 35.113 51.885 120.057 1.00 39.65 C ATOM 446 CD1 LEU A 31 36.489 52.186 119.472 1.00 45.30 C ATOM 447 CD2 LEU A 31 34.061 51.949 118.963 1.00 43.74 C ATOM 448 HA LEU A 31 32.938 50.344 120.917 1.00 0.00 H ATOM 449 HB2 LEU A 31 35.915 50.469 121.425 1.00 0.00 H ATOM 450 HB3 LEU A 31 35.211 49.764 119.950 1.00 0.00 H ATOM 451 HG LEU A 31 34.902 52.638 120.816 1.00 0.00 H ATOM 452 HD21 LEU A 31 34.262 51.176 118.221 1.00 0.00 H ATOM 453 HD22 LEU A 31 33.075 51.788 119.399 1.00 0.00 H ATOM 454 HD23 LEU A 31 34.093 52.929 118.486 1.00 0.00 H ATOM 455 HD11 LEU A 31 37.232 52.173 120.269 1.00 0.00 H ATOM 456 HD12 LEU A 31 36.739 51.430 118.728 1.00 0.00 H ATOM 457 HD13 LEU A 31 36.475 53.169 119.002 1.00 0.00 H ATOM 458 H LEU A 31 34.555 51.351 123.152 1.00 0.00 H ATOM 459 N LEU A 32 34.164 48.228 123.023 1.00 37.82 N ATOM 460 CA LEU A 32 34.255 46.822 123.379 1.00 31.05 C ATOM 461 C LEU A 32 33.533 46.503 124.675 1.00 37.45 C ATOM 462 O LEU A 32 33.494 45.344 125.084 1.00 39.84 O ATOM 463 CB LEU A 32 35.728 46.407 123.527 1.00 31.22 C ATOM 464 CG LEU A 32 36.600 46.415 122.277 1.00 33.43 C ATOM 465 CD1 LEU A 32 38.031 45.986 122.629 1.00 36.33 C ATOM 466 CD2 LEU A 32 36.009 45.466 121.244 1.00 32.96 C ATOM 467 HA LEU A 32 33.776 46.265 122.574 1.00 0.00 H ATOM 468 HB2 LEU A 32 36.186 47.085 124.247 1.00 0.00 H ATOM 469 HB3 LEU A 32 35.741 45.393 123.926 1.00 0.00 H ATOM 470 HG LEU A 32 36.631 47.424 121.865 1.00 0.00 H ATOM 471 HD21 LEU A 32 35.973 44.458 121.657 1.00 0.00 H ATOM 472 HD22 LEU A 32 35.001 45.792 120.988 1.00 0.00 H ATOM 473 HD23 LEU A 32 36.632 45.471 120.350 1.00 0.00 H ATOM 474 HD11 LEU A 32 38.447 46.679 123.360 1.00 0.00 H ATOM 475 HD12 LEU A 32 38.015 44.980 123.048 1.00 0.00 H ATOM 476 HD13 LEU A 32 38.644 45.996 121.728 1.00 0.00 H ATOM 477 H LEU A 32 34.375 48.949 123.742 1.00 0.00 H ATOM 478 N ASP A 33 32.963 47.526 125.311 1.00 46.09 N ATOM 479 CA ASP A 33 32.390 47.428 126.663 1.00 47.59 C ATOM 480 C ASP A 33 31.187 46.478 126.747 1.00 46.75 C ATOM 481 O ASP A 33 31.190 45.490 127.471 1.00 49.52 O ATOM 482 CB ASP A 33 31.976 48.828 127.141 1.00 45.66 C ATOM 483 CG ASP A 33 31.999 48.973 128.657 1.00 50.18 C ATOM 484 OD1 ASP A 33 32.502 48.063 129.348 1.00 43.08 O ATOM 485 OD2 ASP A 33 31.526 50.013 129.166 1.00 51.13 O ATOM 486 HA ASP A 33 33.163 47.010 127.307 1.00 0.00 H ATOM 487 HB2 ASP A 33 32.662 49.558 126.712 1.00 0.00 H ATOM 488 HB3 ASP A 33 30.965 49.030 126.788 1.00 0.00 H ATOM 489 H ASP A 33 32.921 48.444 124.825 1.00 0.00 H ATOM 490 N ALA A 34 30.135 46.798 125.998 1.00 60.92 N ATOM 491 CA ALA A 34 28.977 45.901 125.974 1.00 68.02 C ATOM 492 C ALA A 34 29.306 44.628 125.179 1.00 67.70 C ATOM 493 O ALA A 34 30.174 44.640 124.304 1.00 59.75 O ATOM 494 CB ALA A 34 27.777 46.597 125.388 1.00 75.47 C ATOM 495 HA ALA A 34 28.738 45.618 126.999 1.00 0.00 H ATOM 496 HB1 ALA A 34 27.534 47.471 125.993 1.00 0.00 H ATOM 497 HB2 ALA A 34 28.002 46.910 124.369 1.00 0.00 H ATOM 498 HB3 ALA A 34 26.929 45.912 125.380 1.00 0.00 H ATOM 499 H ALA A 34 30.135 47.674 125.437 1.00 0.00 H ATOM 500 N GLN A 35 28.631 43.527 125.482 1.00 63.83 N ATOM 501 CA GLN A 35 28.839 42.292 124.734 1.00 61.43 C ATOM 502 C GLN A 35 28.393 42.502 123.288 1.00 56.52 C ATOM 503 O GLN A 35 28.956 41.937 122.344 1.00 55.45 O ATOM 504 CB GLN A 35 28.046 41.166 125.394 1.00 65.12 C ATOM 505 CG GLN A 35 28.078 39.836 124.676 1.00 66.02 C ATOM 506 CD GLN A 35 27.255 38.784 125.390 1.00 82.39 C ATOM 507 OE1 GLN A 35 26.394 39.104 126.213 1.00 82.26 O ATOM 508 NE2 GLN A 35 27.518 37.520 125.083 1.00 89.16 N ATOM 509 HA GLN A 35 29.894 42.019 124.736 1.00 0.00 H ATOM 510 HB2 GLN A 35 28.447 41.016 126.396 1.00 0.00 H ATOM 511 HB3 GLN A 35 27.006 41.485 125.464 1.00 0.00 H ATOM 512 HG2 GLN A 35 27.681 39.970 123.670 1.00 0.00 H ATOM 513 HG3 GLN A 35 29.111 39.493 124.616 1.00 0.00 H ATOM 514 HE22 GLN A 35 28.254 37.297 124.382 1.00 0.00 H ATOM 515 HE21 GLN A 35 26.989 36.752 125.543 1.00 0.00 H ATOM 516 H GLN A 35 27.945 43.545 126.263 1.00 0.00 H ATOM 517 N SER A 36 27.384 43.349 123.121 1.00 41.57 N ATOM 518 CA SER A 36 26.864 43.663 121.803 1.00 49.01 C ATOM 519 C SER A 36 27.544 44.889 121.198 1.00 54.39 C ATOM 520 O SER A 36 27.066 45.434 120.202 1.00 57.80 O ATOM 521 CB SER A 36 25.361 43.894 121.891 1.00 58.85 C ATOM 522 OG SER A 36 25.047 44.716 123.001 1.00 68.31 O ATOM 523 HA SER A 36 27.074 42.816 121.150 1.00 0.00 H ATOM 524 HB2 SER A 36 24.857 42.934 122.002 1.00 0.00 H ATOM 525 HB3 SER A 36 25.019 44.380 120.977 1.00 0.00 H ATOM 526 HG SER A 36 24.068 44.854 123.041 1.00 0.00 H ATOM 527 H SER A 36 26.956 43.798 123.955 1.00 0.00 H ATOM 528 N ALA A 37 28.656 45.318 121.795 1.00 54.02 N ATOM 529 CA ALA A 37 29.424 46.444 121.256 1.00 51.11 C ATOM 530 C ALA A 37 29.732 46.237 119.774 1.00 49.27 C ATOM 531 O ALA A 37 30.009 45.116 119.342 1.00 44.95 O ATOM 532 CB ALA A 37 30.700 46.662 122.053 1.00 53.00 C ATOM 533 HA ALA A 37 28.813 47.342 121.348 1.00 0.00 H ATOM 534 HB1 ALA A 37 30.446 46.875 123.091 1.00 0.00 H ATOM 535 HB2 ALA A 37 31.315 45.763 122.005 1.00 0.00 H ATOM 536 HB3 ALA A 37 31.251 47.503 121.632 1.00 0.00 H ATOM 537 H ALA A 37 28.985 44.844 122.660 1.00 0.00 H ATOM 538 N PRO A 38 29.672 47.319 118.986 1.00 56.99 N ATOM 539 CA PRO A 38 29.768 47.203 117.526 1.00 55.23 C ATOM 540 C PRO A 38 31.082 46.596 117.036 1.00 53.44 C ATOM 541 O PRO A 38 31.083 45.920 116.003 1.00 49.34 O ATOM 542 CB PRO A 38 29.644 48.659 117.044 1.00 60.68 C ATOM 543 CG PRO A 38 30.011 49.499 118.224 1.00 63.55 C ATOM 544 CD PRO A 38 29.544 48.721 119.426 1.00 66.78 C ATOM 545 HA PRO A 38 29.003 46.530 117.139 1.00 0.00 H ATOM 546 HD3 PRO A 38 30.177 48.919 120.291 1.00 0.00 H ATOM 547 HD2 PRO A 38 28.510 48.962 119.671 1.00 0.00 H ATOM 548 HG3 PRO A 38 29.509 50.466 118.176 1.00 0.00 H ATOM 549 HG2 PRO A 38 31.089 49.652 118.263 1.00 0.00 H ATOM 550 HB2 PRO A 38 30.326 48.846 116.215 1.00 0.00 H ATOM 551 HB3 PRO A 38 28.623 48.871 116.727 1.00 0.00 H ATOM 552 N LEU A 39 32.176 46.829 117.758 1.00 52.75 N ATOM 553 CA LEU A 39 33.486 46.369 117.299 1.00 47.23 C ATOM 554 C LEU A 39 33.984 45.176 118.080 1.00 39.89 C ATOM 555 O LEU A 39 35.155 44.777 117.947 1.00 37.49 O ATOM 556 CB LEU A 39 34.523 47.491 117.349 1.00 44.20 C ATOM 557 CG LEU A 39 34.549 48.423 116.137 1.00 50.21 C ATOM 558 CD1 LEU A 39 34.654 47.614 114.870 1.00 51.75 C ATOM 559 CD2 LEU A 39 33.309 49.290 116.095 1.00 65.99 C ATOM 560 HA LEU A 39 33.351 46.059 116.263 1.00 0.00 H ATOM 561 HB2 LEU A 39 34.320 48.096 118.233 1.00 0.00 H ATOM 562 HB3 LEU A 39 35.508 47.033 117.441 1.00 0.00 H ATOM 563 HG LEU A 39 35.419 49.074 116.223 1.00 0.00 H ATOM 564 HD21 LEU A 39 32.425 48.655 116.030 1.00 0.00 H ATOM 565 HD22 LEU A 39 33.259 49.894 117.001 1.00 0.00 H ATOM 566 HD23 LEU A 39 33.353 49.943 115.223 1.00 0.00 H ATOM 567 HD11 LEU A 39 35.571 47.025 114.891 1.00 0.00 H ATOM 568 HD12 LEU A 39 33.795 46.948 114.794 1.00 0.00 H ATOM 569 HD13 LEU A 39 34.672 48.286 114.012 1.00 0.00 H ATOM 570 H LEU A 39 32.098 47.344 118.658 1.00 0.00 H ATOM 571 N ARG A 40 33.106 44.599 118.896 1.00 35.87 N ATOM 572 CA ARG A 40 33.461 43.376 119.617 1.00 35.91 C ATOM 573 C ARG A 40 33.120 42.210 118.698 1.00 38.10 C ATOM 574 O ARG A 40 31.954 41.803 118.578 1.00 41.90 O ATOM 575 CB ARG A 40 32.725 43.277 120.954 1.00 37.35 C ATOM 576 CG ARG A 40 33.248 42.167 121.870 1.00 48.57 C ATOM 577 CD ARG A 40 33.059 42.477 123.359 1.00 43.56 C ATOM 578 NE ARG A 40 33.071 41.256 124.156 1.00 44.68 N ATOM 579 CZ ARG A 40 32.918 41.201 125.473 1.00 52.84 C ATOM 580 NH1 ARG A 40 32.739 42.303 126.172 1.00 44.89 N ATOM 581 NH2 ARG A 40 32.936 40.037 126.093 1.00 64.66 N ATOM 582 HA ARG A 40 34.522 43.370 119.865 1.00 0.00 H ATOM 583 HB2 ARG A 40 32.829 44.229 121.474 1.00 0.00 H ATOM 584 HB3 ARG A 40 31.671 43.088 120.752 1.00 0.00 H ATOM 585 HG2 ARG A 40 32.715 41.245 121.637 1.00 0.00 H ATOM 586 HG3 ARG A 40 34.312 42.030 121.676 1.00 0.00 H ATOM 587 HD2 ARG A 40 32.104 42.984 123.499 1.00 0.00 H ATOM 588 HD3 ARG A 40 33.867 43.128 123.693 1.00 0.00 H ATOM 589 HE ARG A 40 33.211 40.357 123.652 1.00 0.00 H ATOM 590 HH12 ARG A 40 32.620 42.251 127.204 1.00 0.00 H ATOM 591 HH11 ARG A 40 32.717 43.225 125.692 1.00 0.00 H ATOM 592 HH22 ARG A 40 32.816 39.996 127.125 1.00 0.00 H ATOM 593 HH21 ARG A 40 33.070 39.160 125.550 1.00 0.00 H ATOM 594 H ARG A 40 32.163 45.019 119.022 1.00 0.00 H ATOM 595 N VAL A 41 34.134 41.718 117.994 1.00 35.60 N ATOM 596 CA VAL A 41 33.920 40.675 116.998 1.00 30.48 C ATOM 597 C VAL A 41 34.934 39.570 117.196 1.00 35.11 C ATOM 598 O VAL A 41 36.051 39.807 117.660 1.00 33.35 O ATOM 599 CB VAL A 41 34.002 41.226 115.561 1.00 32.70 C ATOM 600 CG1 VAL A 41 32.861 42.208 115.302 1.00 35.25 C ATOM 601 CG2 VAL A 41 35.351 41.903 115.324 1.00 34.44 C ATOM 602 HA VAL A 41 32.914 40.279 117.135 1.00 0.00 H ATOM 603 HB VAL A 41 33.907 40.392 114.865 1.00 0.00 H ATOM 604 HG11 VAL A 41 31.907 41.697 115.433 1.00 0.00 H ATOM 605 HG12 VAL A 41 32.931 43.038 116.006 1.00 0.00 H ATOM 606 HG13 VAL A 41 32.934 42.587 114.283 1.00 0.00 H ATOM 607 HG21 VAL A 41 35.471 42.727 116.027 1.00 0.00 H ATOM 608 HG22 VAL A 41 36.151 41.178 115.472 1.00 0.00 H ATOM 609 HG23 VAL A 41 35.390 42.286 114.304 1.00 0.00 H ATOM 610 H VAL A 41 35.095 42.082 118.156 1.00 0.00 H ATOM 611 N TYR A 42 34.534 38.355 116.856 1.00 28.27 N ATOM 612 CA TYR A 42 35.386 37.201 117.064 1.00 28.98 C ATOM 613 C TYR A 42 35.691 36.598 115.717 1.00 30.35 C ATOM 614 O TYR A 42 34.798 36.078 115.048 1.00 33.91 O ATOM 615 CB TYR A 42 34.666 36.193 117.976 1.00 35.19 C ATOM 616 CG TYR A 42 34.180 36.854 119.247 1.00 32.06 C ATOM 617 CD1 TYR A 42 35.037 37.042 120.324 1.00 32.98 C ATOM 618 CD2 TYR A 42 32.880 37.319 119.358 1.00 33.50 C ATOM 619 CE1 TYR A 42 34.606 37.661 121.484 1.00 38.61 C ATOM 620 CE2 TYR A 42 32.442 37.945 120.516 1.00 45.81 C ATOM 621 CZ TYR A 42 33.313 38.110 121.572 1.00 42.82 C ATOM 622 OH TYR A 42 32.889 38.728 122.724 1.00 41.33 O ATOM 623 HA TYR A 42 36.319 37.485 117.550 1.00 0.00 H ATOM 624 HB3 TYR A 42 35.357 35.390 118.234 1.00 0.00 H ATOM 625 HB2 TYR A 42 33.811 35.777 117.442 1.00 0.00 H ATOM 626 HD2 TYR A 42 32.191 37.191 118.523 1.00 0.00 H ATOM 627 HE2 TYR A 42 31.416 38.304 120.591 1.00 0.00 H ATOM 628 HE1 TYR A 42 35.290 37.791 122.323 1.00 0.00 H ATOM 629 HD1 TYR A 42 36.068 36.695 120.254 1.00 0.00 H ATOM 630 HH TYR A 42 32.135 38.217 123.113 1.00 0.00 H ATOM 631 H TYR A 42 33.593 38.226 116.433 1.00 0.00 H ATOM 632 N VAL A 43 36.959 36.657 115.324 1.00 31.54 N ATOM 633 CA VAL A 43 37.342 36.202 113.995 1.00 31.54 C ATOM 634 C VAL A 43 37.306 34.683 113.926 1.00 32.13 C ATOM 635 O VAL A 43 37.704 34.005 114.890 1.00 36.56 O ATOM 636 CB VAL A 43 38.734 36.715 113.609 1.00 33.07 C ATOM 637 CG1 VAL A 43 39.166 36.130 112.265 1.00 37.09 C ATOM 638 CG2 VAL A 43 38.716 38.233 113.530 1.00 30.05 C ATOM 639 HA VAL A 43 36.624 36.608 113.283 1.00 0.00 H ATOM 640 HB VAL A 43 39.448 36.400 114.370 1.00 0.00 H ATOM 641 HG11 VAL A 43 39.196 35.043 112.336 1.00 0.00 H ATOM 642 HG12 VAL A 43 38.453 36.426 111.495 1.00 0.00 H ATOM 643 HG13 VAL A 43 40.156 36.506 112.008 1.00 0.00 H ATOM 644 HG21 VAL A 43 37.993 38.548 112.778 1.00 0.00 H ATOM 645 HG22 VAL A 43 38.435 38.643 114.500 1.00 0.00 H ATOM 646 HG23 VAL A 43 39.707 38.593 113.255 1.00 0.00 H ATOM 647 H VAL A 43 37.683 37.031 115.970 1.00 0.00 H ATOM 648 N GLU A 44 36.807 34.147 112.802 1.00 32.55 N ATOM 649 CA GLU A 44 36.730 32.700 112.611 1.00 36.15 C ATOM 650 C GLU A 44 37.717 32.226 111.552 1.00 38.99 C ATOM 651 O GLU A 44 38.420 31.238 111.741 1.00 34.82 O ATOM 652 CB GLU A 44 35.312 32.285 112.188 1.00 34.32 C ATOM 653 CG GLU A 44 35.175 30.818 111.796 1.00 45.74 C ATOM 654 CD GLU A 44 33.808 30.487 111.207 1.00 55.32 C ATOM 655 OE1 GLU A 44 32.822 31.175 111.540 1.00 60.98 O ATOM 656 OE2 GLU A 44 33.716 29.536 110.404 1.00 51.50 O ATOM 657 HA GLU A 44 36.982 32.236 113.564 1.00 0.00 H ATOM 658 HB2 GLU A 44 34.637 32.480 113.021 1.00 0.00 H ATOM 659 HB3 GLU A 44 35.019 32.895 111.334 1.00 0.00 H ATOM 660 HG2 GLU A 44 35.939 30.583 111.056 1.00 0.00 H ATOM 661 HG3 GLU A 44 35.330 30.204 112.684 1.00 0.00 H ATOM 662 H GLU A 44 36.466 34.777 112.048 1.00 0.00 H ATOM 663 N GLU A 45 37.735 32.927 110.428 1.00 32.34 N ATOM 664 CA GLU A 45 38.481 32.433 109.285 1.00 33.61 C ATOM 665 C GLU A 45 38.791 33.583 108.352 1.00 41.26 C ATOM 666 O GLU A 45 37.975 34.512 108.206 1.00 38.73 O ATOM 667 CB GLU A 45 37.658 31.378 108.547 1.00 37.28 C ATOM 668 CG GLU A 45 38.344 30.793 107.321 1.00 41.40 C ATOM 669 CD GLU A 45 37.552 29.667 106.692 1.00 58.35 C ATOM 670 OE1 GLU A 45 36.580 29.198 107.329 1.00 59.18 O ATOM 671 OE2 GLU A 45 37.910 29.254 105.565 1.00 55.98 O ATOM 672 HA GLU A 45 39.412 31.982 109.628 1.00 0.00 H ATOM 673 HB2 GLU A 45 37.445 30.564 109.240 1.00 0.00 H ATOM 674 HB3 GLU A 45 36.722 31.836 108.228 1.00 0.00 H ATOM 675 HG2 GLU A 45 38.473 31.584 106.582 1.00 0.00 H ATOM 676 HG3 GLU A 45 39.321 30.410 107.617 1.00 0.00 H ATOM 677 H GLU A 45 37.217 33.827 110.365 1.00 0.00 H ATOM 678 N LEU A 46 39.969 33.536 107.739 1.00 38.77 N ATOM 679 CA LEU A 46 40.318 34.525 106.727 1.00 40.91 C ATOM 680 C LEU A 46 40.401 33.821 105.389 1.00 42.17 C ATOM 681 O LEU A 46 40.992 32.736 105.272 1.00 38.67 O ATOM 682 CB LEU A 46 41.629 35.236 107.066 1.00 32.52 C ATOM 683 CG LEU A 46 41.652 36.017 108.378 1.00 33.96 C ATOM 684 CD1 LEU A 46 43.005 36.706 108.578 1.00 33.71 C ATOM 685 CD2 LEU A 46 40.528 37.044 108.397 1.00 36.38 C ATOM 686 HA LEU A 46 39.551 35.299 106.690 1.00 0.00 H ATOM 687 HB2 LEU A 46 42.414 34.482 107.114 1.00 0.00 H ATOM 688 HB3 LEU A 46 41.847 35.935 106.259 1.00 0.00 H ATOM 689 HG LEU A 46 41.503 35.315 109.198 1.00 0.00 H ATOM 690 HD21 LEU A 46 40.657 37.737 107.566 1.00 0.00 H ATOM 691 HD22 LEU A 46 39.570 36.534 108.301 1.00 0.00 H ATOM 692 HD23 LEU A 46 40.556 37.594 109.338 1.00 0.00 H ATOM 693 HD11 LEU A 46 43.794 35.954 108.602 1.00 0.00 H ATOM 694 HD12 LEU A 46 43.185 37.397 107.754 1.00 0.00 H ATOM 695 HD13 LEU A 46 42.996 37.256 109.519 1.00 0.00 H ATOM 696 H LEU A 46 40.648 32.787 107.983 1.00 0.00 H ATOM 697 N LYS A 47 39.768 34.411 104.382 1.00 38.43 N ATOM 698 CA LYS A 47 39.704 33.783 103.069 1.00 41.61 C ATOM 699 C LYS A 47 40.091 34.797 102.013 1.00 47.84 C ATOM 700 O LYS A 47 39.224 35.395 101.378 1.00 47.15 O ATOM 701 CB LYS A 47 38.297 33.267 102.771 1.00 49.93 C ATOM 702 CG LYS A 47 37.747 32.249 103.755 1.00 58.09 C ATOM 703 CD LYS A 47 36.302 31.899 103.395 1.00 68.80 C ATOM 704 CE LYS A 47 36.041 30.395 103.429 1.00 79.74 C ATOM 705 NZ LYS A 47 34.589 30.045 103.374 1.00 76.46 N ATOM 706 HA LYS A 47 40.392 32.938 103.059 1.00 0.00 H ATOM 707 HB2 LYS A 47 37.621 34.122 102.761 1.00 0.00 H ATOM 708 HB3 LYS A 47 38.311 32.805 101.784 1.00 0.00 H ATOM 709 HG2 LYS A 47 38.357 31.346 103.719 1.00 0.00 H ATOM 710 HG3 LYS A 47 37.777 32.667 104.761 1.00 0.00 H ATOM 711 HD2 LYS A 47 35.636 32.386 104.107 1.00 0.00 H ATOM 712 HD3 LYS A 47 36.092 32.268 102.391 1.00 0.00 H ATOM 713 HE2 LYS A 47 36.460 29.992 104.351 1.00 0.00 H ATOM 714 HE3 LYS A 47 36.540 29.938 102.575 1.00 0.00 H ATOM 715 HZ1 LYS A 47 34.101 30.467 104.190 1.00 0.00 H ATOM 716 HZ2 LYS A 47 34.178 30.415 102.493 1.00 0.00 H ATOM 717 HZ3 LYS A 47 34.482 29.011 103.401 1.00 0.00 H ATOM 718 H LYS A 47 39.312 35.333 104.532 1.00 0.00 H ATOM 719 N PRO A 48 41.398 34.992 101.816 1.00 49.18 N ATOM 720 CA PRO A 48 41.843 35.886 100.743 1.00 48.67 C ATOM 721 C PRO A 48 41.336 35.399 99.386 1.00 55.84 C ATOM 722 O PRO A 48 41.259 34.188 99.161 1.00 50.27 O ATOM 723 CB PRO A 48 43.375 35.799 100.820 1.00 52.43 C ATOM 724 CG PRO A 48 43.669 34.523 101.573 1.00 55.70 C ATOM 725 CD PRO A 48 42.521 34.363 102.533 1.00 50.48 C ATOM 726 HA PRO A 48 41.469 36.904 100.852 1.00 0.00 H ATOM 727 HD3 PRO A 48 42.319 33.310 102.731 1.00 0.00 H ATOM 728 HD2 PRO A 48 42.722 34.876 103.473 1.00 0.00 H ATOM 729 HG3 PRO A 48 44.612 34.605 102.113 1.00 0.00 H ATOM 730 HG2 PRO A 48 43.717 33.676 100.888 1.00 0.00 H ATOM 731 HB2 PRO A 48 43.805 35.759 99.819 1.00 0.00 H ATOM 732 HB3 PRO A 48 43.779 36.659 101.354 1.00 0.00 H ATOM 733 N THR A 49 40.973 36.329 98.505 1.00 57.20 N ATOM 734 CA THR A 49 40.427 35.977 97.198 1.00 59.70 C ATOM 735 C THR A 49 41.545 36.082 96.184 1.00 63.10 C ATOM 736 O THR A 49 42.521 36.792 96.439 1.00 60.01 O ATOM 737 CB THR A 49 39.311 36.944 96.785 1.00 61.05 C ATOM 738 OG1 THR A 49 39.886 38.146 96.252 1.00 63.81 O ATOM 739 CG2 THR A 49 38.425 37.274 97.972 1.00 60.79 C ATOM 740 HA THR A 49 40.015 34.969 97.245 1.00 0.00 H ATOM 741 HB THR A 49 38.698 36.467 96.020 1.00 0.00 H ATOM 742 HG1 THR A 49 39.162 38.767 95.987 1.00 0.00 H ATOM 743 HG23 THR A 49 37.994 36.355 98.369 1.00 0.00 H ATOM 744 HG21 THR A 49 39.021 37.760 98.744 1.00 0.00 H ATOM 745 HG22 THR A 49 37.626 37.943 97.653 1.00 0.00 H ATOM 746 H THR A 49 41.081 37.333 98.755 1.00 0.00 H ATOM 747 N PRO A 50 41.420 35.386 95.036 1.00 68.55 N ATOM 748 CA PRO A 50 42.487 35.439 94.028 1.00 74.47 C ATOM 749 C PRO A 50 42.927 36.865 93.670 1.00 73.19 C ATOM 750 O PRO A 50 44.131 37.111 93.558 1.00 70.42 O ATOM 751 CB PRO A 50 41.846 34.769 92.815 1.00 79.86 C ATOM 752 CG PRO A 50 40.868 33.817 93.393 1.00 77.66 C ATOM 753 CD PRO A 50 40.316 34.501 94.613 1.00 74.06 C ATOM 754 HA PRO A 50 43.396 34.958 94.389 1.00 0.00 H ATOM 755 HD3 PRO A 50 39.425 35.078 94.368 1.00 0.00 H ATOM 756 HD2 PRO A 50 40.075 33.777 95.392 1.00 0.00 H ATOM 757 HG3 PRO A 50 41.360 32.884 93.669 1.00 0.00 H ATOM 758 HG2 PRO A 50 40.071 33.608 92.679 1.00 0.00 H ATOM 759 HB2 PRO A 50 41.343 35.505 92.188 1.00 0.00 H ATOM 760 HB3 PRO A 50 42.595 34.242 92.225 1.00 0.00 H ATOM 761 N GLU A 51 41.979 37.789 93.511 1.00 72.11 N ATOM 762 CA GLU A 51 42.324 39.181 93.212 1.00 72.44 C ATOM 763 C GLU A 51 43.046 39.872 94.376 1.00 71.75 C ATOM 764 O GLU A 51 43.560 40.980 94.219 1.00 67.73 O ATOM 765 CB GLU A 51 41.081 39.988 92.820 1.00 68.40 C ATOM 766 CG GLU A 51 40.423 39.555 91.509 1.00 74.64 C ATOM 767 CD GLU A 51 39.391 38.461 91.710 1.00 83.84 C ATOM 768 OE1 GLU A 51 38.685 38.484 92.744 1.00 84.05 O ATOM 769 OE2 GLU A 51 39.287 37.573 90.839 1.00 87.62 O ATOM 770 HA GLU A 51 43.012 39.149 92.367 1.00 0.00 H ATOM 771 HB2 GLU A 51 40.346 39.888 93.618 1.00 0.00 H ATOM 772 HB3 GLU A 51 41.372 41.034 92.725 1.00 0.00 H ATOM 773 HG2 GLU A 51 39.933 40.420 91.061 1.00 0.00 H ATOM 774 HG3 GLU A 51 41.196 39.187 90.834 1.00 0.00 H ATOM 775 H GLU A 51 40.979 37.517 93.601 1.00 0.00 H ATOM 776 N GLY A 52 43.075 39.230 95.541 1.00 52.94 N ATOM 777 CA GLY A 52 43.825 39.760 96.671 1.00 49.78 C ATOM 778 C GLY A 52 43.000 40.544 97.670 1.00 49.13 C ATOM 779 O GLY A 52 43.556 41.240 98.528 1.00 47.67 O ATOM 780 HA3 GLY A 52 44.603 40.418 96.283 1.00 0.00 H ATOM 781 HA2 GLY A 52 44.286 38.923 97.195 1.00 0.00 H ATOM 782 H GLY A 52 42.554 38.336 95.646 1.00 0.00 H ATOM 783 N ASP A 53 41.678 40.458 97.565 1.00 56.24 N ATOM 784 CA ASP A 53 40.823 40.997 98.617 1.00 48.54 C ATOM 785 C ASP A 53 40.798 40.000 99.760 1.00 48.19 C ATOM 786 O ASP A 53 41.302 38.883 99.622 1.00 47.32 O ATOM 787 CB ASP A 53 39.402 41.237 98.108 1.00 47.41 C ATOM 788 CG ASP A 53 39.341 42.302 97.036 1.00 55.80 C ATOM 789 OD1 ASP A 53 40.082 43.307 97.130 1.00 51.36 O ATOM 790 OD2 ASP A 53 38.548 42.130 96.093 1.00 55.91 O ATOM 791 HA ASP A 53 41.220 41.956 98.949 1.00 0.00 H ATOM 792 HB2 ASP A 53 39.016 40.304 97.697 1.00 0.00 H ATOM 793 HB3 ASP A 53 38.779 41.549 98.946 1.00 0.00 H ATOM 794 H ASP A 53 41.252 40.005 96.731 1.00 0.00 H ATOM 795 N LEU A 54 40.214 40.394 100.886 1.00 48.22 N ATOM 796 CA LEU A 54 40.198 39.529 102.052 1.00 42.14 C ATOM 797 C LEU A 54 38.788 39.385 102.610 1.00 42.79 C ATOM 798 O LEU A 54 38.283 40.307 103.254 1.00 47.06 O ATOM 799 CB LEU A 54 41.113 40.118 103.131 1.00 40.00 C ATOM 800 CG LEU A 54 41.304 39.346 104.428 1.00 45.23 C ATOM 801 CD1 LEU A 54 41.924 37.994 104.146 1.00 40.54 C ATOM 802 CD2 LEU A 54 42.161 40.160 105.382 1.00 44.00 C ATOM 803 HA LEU A 54 40.552 38.542 101.754 1.00 0.00 H ATOM 804 HB2 LEU A 54 42.099 40.242 102.683 1.00 0.00 H ATOM 805 HB3 LEU A 54 40.710 41.095 103.396 1.00 0.00 H ATOM 806 HG LEU A 54 40.335 39.174 104.897 1.00 0.00 H ATOM 807 HD21 LEU A 54 43.132 40.349 104.925 1.00 0.00 H ATOM 808 HD22 LEU A 54 41.667 41.108 105.593 1.00 0.00 H ATOM 809 HD23 LEU A 54 42.296 39.605 106.310 1.00 0.00 H ATOM 810 HD11 LEU A 54 41.269 37.426 103.485 1.00 0.00 H ATOM 811 HD12 LEU A 54 42.893 38.133 103.667 1.00 0.00 H ATOM 812 HD13 LEU A 54 42.055 37.453 105.083 1.00 0.00 H ATOM 813 H LEU A 54 39.764 41.331 100.933 1.00 0.00 H ATOM 814 N GLU A 55 38.133 38.249 102.377 1.00 48.92 N ATOM 815 CA GLU A 55 36.850 38.064 103.050 1.00 50.32 C ATOM 816 C GLU A 55 37.076 37.489 104.441 1.00 47.60 C ATOM 817 O GLU A 55 37.986 36.681 104.666 1.00 46.95 O ATOM 818 CB GLU A 55 35.826 37.272 102.222 1.00 58.29 C ATOM 819 CG GLU A 55 36.133 35.825 101.956 1.00 69.32 C ATOM 820 CD GLU A 55 35.030 35.151 101.147 1.00 92.29 C ATOM 821 OE1 GLU A 55 34.558 35.752 100.156 1.00 98.48 O ATOM 822 OE2 GLU A 55 34.632 34.020 101.503 1.00 96.73 O ATOM 823 HA GLU A 55 36.388 39.045 103.160 1.00 0.00 H ATOM 824 HB2 GLU A 55 34.873 37.314 102.750 1.00 0.00 H ATOM 825 HB3 GLU A 55 35.728 37.770 101.257 1.00 0.00 H ATOM 826 HG2 GLU A 55 37.069 35.759 101.401 1.00 0.00 H ATOM 827 HG3 GLU A 55 36.240 35.306 102.908 1.00 0.00 H ATOM 828 H GLU A 55 38.520 37.523 101.741 1.00 0.00 H ATOM 829 N ILE A 56 36.276 37.959 105.387 1.00 40.70 N ATOM 830 CA ILE A 56 36.488 37.627 106.779 1.00 36.89 C ATOM 831 C ILE A 56 35.217 36.981 107.302 1.00 46.65 C ATOM 832 O ILE A 56 34.116 37.518 107.119 1.00 43.43 O ATOM 833 CB ILE A 56 36.772 38.891 107.584 1.00 41.08 C ATOM 834 CG1 ILE A 56 38.007 39.607 107.016 1.00 43.22 C ATOM 835 CG2 ILE A 56 36.966 38.546 109.057 1.00 35.91 C ATOM 836 CD1 ILE A 56 37.914 41.115 107.036 1.00 45.75 C ATOM 837 HA ILE A 56 37.338 36.952 106.875 1.00 0.00 H ATOM 838 HB ILE A 56 35.919 39.565 107.506 1.00 0.00 H ATOM 839 HG12 ILE A 56 38.875 39.310 107.605 1.00 0.00 H ATOM 840 HG13 ILE A 56 38.143 39.287 105.983 1.00 0.00 H ATOM 841 HD11 ILE A 56 37.058 41.433 106.441 1.00 0.00 H ATOM 842 HD12 ILE A 56 37.791 41.457 108.064 1.00 0.00 H ATOM 843 HD13 ILE A 56 38.827 41.540 106.618 1.00 0.00 H ATOM 844 HG21 ILE A 56 36.061 38.074 109.441 1.00 0.00 H ATOM 845 HG22 ILE A 56 37.807 37.860 109.161 1.00 0.00 H ATOM 846 HG23 ILE A 56 37.168 39.458 109.619 1.00 0.00 H ATOM 847 H ILE A 56 35.482 38.577 105.124 1.00 0.00 H ATOM 848 N LEU A 57 35.357 35.812 107.912 1.00 39.55 N ATOM 849 CA LEU A 57 34.227 35.182 108.589 1.00 40.77 C ATOM 850 C LEU A 57 34.402 35.453 110.083 1.00 37.85 C ATOM 851 O LEU A 57 35.493 35.271 110.620 1.00 38.41 O ATOM 852 CB LEU A 57 34.183 33.680 108.298 1.00 43.55 C ATOM 853 CG LEU A 57 33.402 33.242 107.055 1.00 51.62 C ATOM 854 CD1 LEU A 57 33.941 33.896 105.798 1.00 60.32 C ATOM 855 CD2 LEU A 57 33.408 31.726 106.904 1.00 52.68 C ATOM 856 HA LEU A 57 33.282 35.592 108.233 1.00 0.00 H ATOM 857 HB2 LEU A 57 35.211 33.336 108.181 1.00 0.00 H ATOM 858 HB3 LEU A 57 33.733 33.189 109.161 1.00 0.00 H ATOM 859 HG LEU A 57 32.372 33.571 107.193 1.00 0.00 H ATOM 860 HD21 LEU A 57 34.436 31.376 106.810 1.00 0.00 H ATOM 861 HD22 LEU A 57 32.947 31.273 107.782 1.00 0.00 H ATOM 862 HD23 LEU A 57 32.845 31.449 106.013 1.00 0.00 H ATOM 863 HD11 LEU A 57 33.862 34.979 105.891 1.00 0.00 H ATOM 864 HD12 LEU A 57 34.986 33.617 105.664 1.00 0.00 H ATOM 865 HD13 LEU A 57 33.361 33.560 104.938 1.00 0.00 H ATOM 866 H LEU A 57 36.283 35.338 107.908 1.00 0.00 H ATOM 867 N LEU A 58 33.351 35.932 110.742 1.00 42.43 N ATOM 868 CA LEU A 58 33.437 36.258 112.166 1.00 34.39 C ATOM 869 C LEU A 58 32.092 36.029 112.847 1.00 37.16 C ATOM 870 O LEU A 58 31.082 35.796 112.174 1.00 41.81 O ATOM 871 CB LEU A 58 33.899 37.708 112.369 1.00 39.12 C ATOM 872 CG LEU A 58 33.055 38.859 111.802 1.00 43.38 C ATOM 873 CD1 LEU A 58 31.996 39.303 112.795 1.00 52.61 C ATOM 874 CD2 LEU A 58 33.930 40.035 111.423 1.00 48.64 C ATOM 875 HA LEU A 58 34.176 35.598 112.621 1.00 0.00 H ATOM 876 HB2 LEU A 58 33.973 37.869 113.444 1.00 0.00 H ATOM 877 HB3 LEU A 58 34.889 37.791 111.921 1.00 0.00 H ATOM 878 HG LEU A 58 32.557 38.488 110.906 1.00 0.00 H ATOM 879 HD21 LEU A 58 34.461 40.391 112.306 1.00 0.00 H ATOM 880 HD22 LEU A 58 34.650 39.722 110.667 1.00 0.00 H ATOM 881 HD23 LEU A 58 33.307 40.836 111.024 1.00 0.00 H ATOM 882 HD11 LEU A 58 31.336 38.465 113.020 1.00 0.00 H ATOM 883 HD12 LEU A 58 32.479 39.643 113.711 1.00 0.00 H ATOM 884 HD13 LEU A 58 31.415 40.119 112.364 1.00 0.00 H ATOM 885 H LEU A 58 32.453 36.077 110.237 1.00 0.00 H ATOM 886 N GLN A 59 32.080 36.094 114.177 1.00 34.86 N ATOM 887 CA GLN A 59 30.813 36.131 114.912 1.00 38.27 C ATOM 888 C GLN A 59 30.704 37.401 115.705 1.00 45.98 C ATOM 889 O GLN A 59 31.715 37.978 116.128 1.00 40.65 O ATOM 890 CB GLN A 59 30.655 34.982 115.906 1.00 43.46 C ATOM 891 CG GLN A 59 30.373 33.658 115.300 1.00 60.53 C ATOM 892 CD GLN A 59 31.628 33.065 114.823 1.00 75.82 C ATOM 893 OE1 GLN A 59 32.702 33.575 115.149 1.00 74.65 O ATOM 894 NE2 GLN A 59 31.533 31.996 114.037 1.00 84.30 N ATOM 895 HA GLN A 59 30.038 36.054 114.150 1.00 0.00 H ATOM 896 HB2 GLN A 59 31.579 34.901 116.479 1.00 0.00 H ATOM 897 HB3 GLN A 59 29.833 35.228 116.578 1.00 0.00 H ATOM 898 HG2 GLN A 59 29.922 33.004 116.046 1.00 0.00 H ATOM 899 HG3 GLN A 59 29.686 33.780 114.463 1.00 0.00 H ATOM 900 HE22 GLN A 59 30.598 31.609 113.796 1.00 0.00 H ATOM 901 HE21 GLN A 59 32.394 31.547 113.664 1.00 0.00 H ATOM 902 H GLN A 59 32.979 36.119 114.699 1.00 0.00 H ATOM 903 N LYS A 60 29.462 37.806 115.942 1.00 42.87 N ATOM 904 CA LYS A 60 29.200 38.984 116.737 1.00 47.08 C ATOM 905 C LYS A 60 27.963 38.718 117.569 1.00 49.91 C ATOM 906 O LYS A 60 27.028 38.063 117.099 1.00 52.37 O ATOM 907 CB LYS A 60 28.960 40.185 115.820 1.00 49.95 C ATOM 908 CG LYS A 60 29.069 41.487 116.550 1.00 52.25 C ATOM 909 CD LYS A 60 28.637 42.658 115.718 1.00 59.27 C ATOM 910 CE LYS A 60 28.580 43.870 116.621 1.00 64.86 C ATOM 911 NZ LYS A 60 28.222 43.448 118.008 1.00 53.25 N ATOM 912 HA LYS A 60 30.051 39.205 117.381 1.00 0.00 H ATOM 913 HB2 LYS A 60 29.699 40.169 115.019 1.00 0.00 H ATOM 914 HB3 LYS A 60 27.961 40.105 115.392 1.00 0.00 H ATOM 915 HG2 LYS A 60 28.441 41.441 117.440 1.00 0.00 H ATOM 916 HG3 LYS A 60 30.107 41.634 116.847 1.00 0.00 H ATOM 917 HD2 LYS A 60 29.354 42.827 114.914 1.00 0.00 H ATOM 918 HD3 LYS A 60 27.653 42.467 115.291 1.00 0.00 H ATOM 919 HE2 LYS A 60 27.828 44.565 116.248 1.00 0.00 H ATOM 920 HE3 LYS A 60 29.553 44.361 116.631 1.00 0.00 H ATOM 921 HZ1 LYS A 60 27.293 42.981 117.998 1.00 0.00 H ATOM 922 HZ2 LYS A 60 28.941 42.786 118.364 1.00 0.00 H ATOM 923 HZ3 LYS A 60 28.184 44.285 118.625 1.00 0.00 H ATOM 924 H LYS A 60 28.664 37.267 115.549 1.00 0.00 H ATOM 925 N TRP A 61 27.953 39.200 118.806 1.00 53.18 N ATOM 926 CA TRP A 61 26.732 39.154 119.592 1.00 49.40 C ATOM 927 C TRP A 61 25.829 40.273 119.105 1.00 56.10 C ATOM 928 O TRP A 61 26.218 41.446 119.117 1.00 55.87 O ATOM 929 CB TRP A 61 27.018 39.320 121.079 1.00 53.74 C ATOM 930 CG TRP A 61 25.841 38.936 121.898 1.00 58.36 C ATOM 931 CD1 TRP A 61 24.872 39.766 122.388 1.00 66.74 C ATOM 932 CD2 TRP A 61 25.478 37.614 122.293 1.00 53.93 C ATOM 933 NE1 TRP A 61 23.933 39.037 123.080 1.00 66.56 N ATOM 934 CE2 TRP A 61 24.283 37.710 123.036 1.00 63.79 C ATOM 935 CE3 TRP A 61 26.052 36.354 122.103 1.00 50.31 C ATOM 936 CZ2 TRP A 61 23.656 36.594 123.585 1.00 64.51 C ATOM 937 CZ3 TRP A 61 25.429 35.254 122.642 1.00 58.01 C ATOM 938 CH2 TRP A 61 24.244 35.377 123.376 1.00 69.12 C ATOM 939 HA TRP A 61 26.253 38.183 119.466 1.00 0.00 H ATOM 940 HB2 TRP A 61 27.863 38.688 121.352 1.00 0.00 H ATOM 941 HB3 TRP A 61 27.266 40.362 121.279 1.00 0.00 H ATOM 942 HE1 TRP A 61 23.096 39.427 123.558 1.00 0.00 H ATOM 943 HD1 TRP A 61 24.847 40.847 122.251 1.00 0.00 H ATOM 944 HZ2 TRP A 61 22.734 36.687 124.158 1.00 0.00 H ATOM 945 HH2 TRP A 61 23.779 34.483 123.791 1.00 0.00 H ATOM 946 HZ3 TRP A 61 25.866 34.267 122.495 1.00 0.00 H ATOM 947 HE3 TRP A 61 26.977 36.246 121.537 1.00 0.00 H ATOM 948 H TRP A 61 28.818 39.610 119.212 1.00 0.00 H ATOM 949 N GLU A 62 24.641 39.899 118.644 1.00 63.65 N ATOM 950 CA GLU A 62 23.671 40.850 118.121 1.00 64.57 C ATOM 951 C GLU A 62 22.277 40.403 118.507 1.00 73.27 C ATOM 952 O GLU A 62 21.856 39.313 118.122 1.00 65.26 O ATOM 953 CB GLU A 62 23.747 40.924 116.594 1.00 68.37 C ATOM 954 CG GLU A 62 24.752 41.919 116.057 1.00 76.88 C ATOM 955 CD GLU A 62 24.584 42.154 114.572 1.00 88.17 C ATOM 956 OE1 GLU A 62 23.617 41.615 113.989 1.00 96.74 O ATOM 957 OE2 GLU A 62 25.413 42.883 113.991 1.00 91.20 O ATOM 958 HA GLU A 62 23.894 41.832 118.539 1.00 0.00 H ATOM 959 HB2 GLU A 62 24.014 39.936 116.219 1.00 0.00 H ATOM 960 HB3 GLU A 62 22.762 41.200 116.218 1.00 0.00 H ATOM 961 HG2 GLU A 62 24.622 42.867 116.580 1.00 0.00 H ATOM 962 HG3 GLU A 62 25.757 41.538 116.241 1.00 0.00 H ATOM 963 H GLU A 62 24.394 38.889 118.657 1.00 0.00 H ATOM 964 N ASN A 63 21.563 41.252 119.242 1.00 71.45 N ATOM 965 CA ASN A 63 20.190 40.960 119.651 1.00 72.17 C ATOM 966 C ASN A 63 20.063 39.606 120.341 1.00 75.89 C ATOM 967 O ASN A 63 19.479 38.673 119.788 1.00 80.82 O ATOM 968 CB ASN A 63 19.244 41.045 118.449 1.00 87.60 C ATOM 969 CG ASN A 63 19.322 42.386 117.741 1.00 96.07 C ATOM 970 OD1 ASN A 63 19.610 42.454 116.544 1.00102.27 O ATOM 971 ND2 ASN A 63 19.072 43.463 118.481 1.00 92.88 N ATOM 972 HA ASN A 63 19.905 41.716 120.382 1.00 0.00 H ATOM 973 HB2 ASN A 63 19.507 40.260 117.741 1.00 0.00 H ATOM 974 HB3 ASN A 63 18.222 40.892 118.796 1.00 0.00 H ATOM 975 HD22 ASN A 63 18.833 43.358 119.488 1.00 0.00 H ATOM 976 HD21 ASN A 63 19.116 44.410 118.053 1.00 0.00 H ATOM 977 H ASN A 63 21.995 42.152 119.535 1.00 0.00 H ATOM 978 N ASP A 64 20.643 39.514 121.537 1.00 75.92 N ATOM 979 CA ASP A 64 20.636 38.303 122.365 1.00 78.37 C ATOM 980 C ASP A 64 20.931 37.005 121.604 1.00 72.25 C ATOM 981 O ASP A 64 20.311 35.971 121.867 1.00 79.09 O ATOM 982 CB ASP A 64 19.315 38.175 123.135 1.00 95.47 C ATOM 983 CG ASP A 64 18.933 39.453 123.858 1.00105.53 C ATOM 984 OD1 ASP A 64 19.579 39.780 124.876 1.00105.89 O ATOM 985 OD2 ASP A 64 17.979 40.126 123.411 1.00113.29 O ATOM 986 HA ASP A 64 21.464 38.433 123.062 1.00 0.00 H ATOM 987 HB2 ASP A 64 18.523 37.923 122.430 1.00 0.00 H ATOM 988 HB3 ASP A 64 19.415 37.375 123.869 1.00 0.00 H ATOM 989 H ASP A 64 21.132 40.354 121.907 1.00 0.00 H ATOM 990 N GLU A 65 21.875 37.060 120.666 1.00 65.36 N ATOM 991 CA GLU A 65 22.268 35.873 119.908 1.00 62.94 C ATOM 992 C GLU A 65 23.673 36.048 119.358 1.00 57.25 C ATOM 993 O GLU A 65 24.151 37.175 119.216 1.00 54.52 O ATOM 994 CB GLU A 65 21.295 35.603 118.753 1.00 76.64 C ATOM 995 CG GLU A 65 21.694 36.268 117.439 1.00 87.18 C ATOM 996 CD GLU A 65 20.777 35.904 116.287 1.00100.18 C ATOM 997 OE1 GLU A 65 21.120 36.228 115.128 1.00 99.82 O ATOM 998 OE2 GLU A 65 19.712 35.300 116.542 1.00109.14 O ATOM 999 HA GLU A 65 22.243 35.020 120.586 1.00 0.00 H ATOM 1000 HB2 GLU A 65 21.244 34.526 118.591 1.00 0.00 H ATOM 1001 HB3 GLU A 65 20.311 35.973 119.040 1.00 0.00 H ATOM 1002 HG2 GLU A 65 21.669 37.349 117.575 1.00 0.00 H ATOM 1003 HG3 GLU A 65 22.708 35.958 117.187 1.00 0.00 H ATOM 1004 H GLU A 65 22.343 37.967 120.468 1.00 0.00 H ATOM 1005 N CYS A 66 24.333 34.935 119.053 1.00 58.78 N ATOM 1006 CA CYS A 66 25.659 34.989 118.447 1.00 50.10 C ATOM 1007 C CYS A 66 25.496 34.762 116.958 1.00 55.92 C ATOM 1008 O CYS A 66 25.187 33.651 116.526 1.00 63.24 O ATOM 1009 CB CYS A 66 26.563 33.912 119.040 1.00 59.76 C ATOM 1010 SG CYS A 66 28.294 34.046 118.547 1.00 60.29 S ATOM 1011 HA CYS A 66 26.119 35.958 118.641 1.00 0.00 H ATOM 1012 HB2 CYS A 66 26.191 32.939 118.721 1.00 0.00 H ATOM 1013 HB3 CYS A 66 26.510 33.981 120.127 1.00 0.00 H ATOM 1014 HG CYS A 66 27.719 34.450 117.360 1.00 0.00 H ATOM 1015 H CYS A 66 23.897 34.011 119.249 1.00 0.00 H ATOM 1016 N ALA A 67 25.696 35.817 116.176 1.00 46.69 N ATOM 1017 CA ALA A 67 25.436 35.760 114.743 1.00 54.41 C ATOM 1018 C ALA A 67 26.714 35.570 113.943 1.00 55.56 C ATOM 1019 O ALA A 67 27.772 36.067 114.331 1.00 50.81 O ATOM 1020 CB ALA A 67 24.722 37.026 114.289 1.00 58.12 C ATOM 1021 HA ALA A 67 24.798 34.896 114.559 1.00 0.00 H ATOM 1022 HB1 ALA A 67 23.775 37.118 114.821 1.00 0.00 H ATOM 1023 HB2 ALA A 67 25.348 37.892 114.505 1.00 0.00 H ATOM 1024 HB3 ALA A 67 24.534 36.971 113.217 1.00 0.00 H ATOM 1025 H ALA A 67 26.045 36.702 116.595 1.00 0.00 H ATOM 1026 N GLN A 68 26.610 34.861 112.820 1.00 55.09 N ATOM 1027 CA GLN A 68 27.712 34.778 111.861 1.00 53.01 C ATOM 1028 C GLN A 68 27.666 35.976 110.934 1.00 57.99 C ATOM 1029 O GLN A 68 26.622 36.279 110.352 1.00 64.68 O ATOM 1030 CB GLN A 68 27.593 33.520 111.000 1.00 60.61 C ATOM 1031 CG GLN A 68 27.433 32.223 111.780 1.00 72.74 C ATOM 1032 CD GLN A 68 28.747 31.694 112.311 1.00 82.81 C ATOM 1033 OE1 GLN A 68 28.918 31.531 113.518 1.00 87.45 O ATOM 1034 NE2 GLN A 68 29.681 31.409 111.409 1.00 86.23 N ATOM 1035 HA GLN A 68 28.645 34.751 112.424 1.00 0.00 H ATOM 1036 HB2 GLN A 68 26.725 33.634 110.351 1.00 0.00 H ATOM 1037 HB3 GLN A 68 28.493 33.440 110.390 1.00 0.00 H ATOM 1038 HG2 GLN A 68 26.764 32.402 112.621 1.00 0.00 H ATOM 1039 HG3 GLN A 68 26.995 31.472 111.122 1.00 0.00 H ATOM 1040 HE22 GLN A 68 29.492 31.563 110.398 1.00 0.00 H ATOM 1041 HE21 GLN A 68 30.601 31.032 111.714 1.00 0.00 H ATOM 1042 H GLN A 68 25.724 34.354 112.620 1.00 0.00 H ATOM 1043 N LYS A 69 28.796 36.652 110.784 1.00 51.16 N ATOM 1044 CA LYS A 69 28.901 37.717 109.803 1.00 48.86 C ATOM 1045 C LYS A 69 29.980 37.327 108.806 1.00 44.35 C ATOM 1046 O LYS A 69 30.930 36.613 109.144 1.00 46.13 O ATOM 1047 CB LYS A 69 29.261 39.054 110.466 1.00 56.05 C ATOM 1048 CG LYS A 69 28.323 39.499 111.590 1.00 68.19 C ATOM 1049 CD LYS A 69 26.948 39.875 111.068 1.00 76.08 C ATOM 1050 CE LYS A 69 27.031 41.062 110.124 1.00 90.70 C ATOM 1051 NZ LYS A 69 25.754 41.285 109.380 1.00100.89 N ATOM 1052 HA LYS A 69 27.940 37.848 109.305 1.00 0.00 H ATOM 1053 HB2 LYS A 69 30.265 38.965 110.880 1.00 0.00 H ATOM 1054 HB3 LYS A 69 29.254 39.825 109.696 1.00 0.00 H ATOM 1055 HG2 LYS A 69 28.217 38.683 112.304 1.00 0.00 H ATOM 1056 HG3 LYS A 69 28.758 40.364 112.090 1.00 0.00 H ATOM 1057 HD2 LYS A 69 26.524 39.024 110.535 1.00 0.00 H ATOM 1058 HD3 LYS A 69 26.305 40.133 111.910 1.00 0.00 H ATOM 1059 HE2 LYS A 69 27.830 40.883 109.404 1.00 0.00 H ATOM 1060 HE3 LYS A 69 27.260 41.956 110.704 1.00 0.00 H ATOM 1061 HZ1 LYS A 69 25.530 40.440 108.817 1.00 0.00 H ATOM 1062 HZ2 LYS A 69 24.986 41.465 110.058 1.00 0.00 H ATOM 1063 HZ3 LYS A 69 25.860 42.105 108.749 1.00 0.00 H ATOM 1064 H LYS A 69 29.618 36.417 111.376 1.00 0.00 H ATOM 1065 N LYS A 70 29.818 37.781 107.576 1.00 46.94 N ATOM 1066 CA LYS A 70 30.820 37.573 106.550 1.00 50.23 C ATOM 1067 C LYS A 70 31.024 38.916 105.869 1.00 48.32 C ATOM 1068 O LYS A 70 30.085 39.485 105.312 1.00 61.54 O ATOM 1069 CB LYS A 70 30.328 36.526 105.546 1.00 55.54 C ATOM 1070 CG LYS A 70 31.239 36.316 104.348 1.00 65.92 C ATOM 1071 CD LYS A 70 30.441 35.732 103.178 1.00 83.35 C ATOM 1072 CE LYS A 70 31.350 35.230 102.071 1.00 93.82 C ATOM 1073 NZ LYS A 70 31.970 33.927 102.428 1.00101.81 N ATOM 1074 HA LYS A 70 31.756 37.207 106.972 1.00 0.00 H ATOM 1075 HB2 LYS A 70 30.229 35.575 106.069 1.00 0.00 H ATOM 1076 HB3 LYS A 70 29.351 36.840 105.179 1.00 0.00 H ATOM 1077 HG2 LYS A 70 31.670 37.272 104.050 1.00 0.00 H ATOM 1078 HG3 LYS A 70 32.039 35.627 104.619 1.00 0.00 H ATOM 1079 HD2 LYS A 70 29.836 34.901 103.542 1.00 0.00 H ATOM 1080 HD3 LYS A 70 29.788 36.506 102.775 1.00 0.00 H ATOM 1081 HE2 LYS A 70 32.138 35.963 101.899 1.00 0.00 H ATOM 1082 HE3 LYS A 70 30.765 35.107 101.160 1.00 0.00 H ATOM 1083 HZ1 LYS A 70 32.534 34.039 103.294 1.00 0.00 H ATOM 1084 HZ2 LYS A 70 31.223 33.221 102.588 1.00 0.00 H ATOM 1085 HZ3 LYS A 70 32.585 33.612 101.650 1.00 0.00 H ATOM 1086 H LYS A 70 28.949 38.301 107.338 1.00 0.00 H ATOM 1087 N ILE A 71 32.240 39.444 105.943 1.00 46.71 N ATOM 1088 CA ILE A 71 32.518 40.752 105.363 1.00 53.85 C ATOM 1089 C ILE A 71 33.745 40.711 104.462 1.00 44.77 C ATOM 1090 O ILE A 71 34.573 39.804 104.562 1.00 49.82 O ATOM 1091 CB ILE A 71 32.751 41.798 106.449 1.00 53.59 C ATOM 1092 CG1 ILE A 71 33.929 41.376 107.316 1.00 52.27 C ATOM 1093 CG2 ILE A 71 31.492 41.988 107.300 1.00 56.85 C ATOM 1094 CD1 ILE A 71 34.168 42.292 108.464 1.00 54.79 C ATOM 1095 HA ILE A 71 31.643 41.024 104.773 1.00 0.00 H ATOM 1096 HB ILE A 71 32.980 42.754 105.978 1.00 0.00 H ATOM 1097 HG12 ILE A 71 33.733 40.377 107.704 1.00 0.00 H ATOM 1098 HG13 ILE A 71 34.826 41.355 106.697 1.00 0.00 H ATOM 1099 HD11 ILE A 71 34.375 43.295 108.090 1.00 0.00 H ATOM 1100 HD12 ILE A 71 33.282 42.316 109.099 1.00 0.00 H ATOM 1101 HD13 ILE A 71 35.021 41.934 109.041 1.00 0.00 H ATOM 1102 HG21 ILE A 71 30.671 42.318 106.663 1.00 0.00 H ATOM 1103 HG22 ILE A 71 31.229 41.042 107.773 1.00 0.00 H ATOM 1104 HG23 ILE A 71 31.683 42.738 108.067 1.00 0.00 H ATOM 1105 H ILE A 71 33.001 38.919 106.419 1.00 0.00 H ATOM 1106 N ILE A 72 33.866 41.707 103.596 1.00 43.41 N ATOM 1107 CA ILE A 72 34.961 41.744 102.639 1.00 45.65 C ATOM 1108 C ILE A 72 35.773 43.010 102.838 1.00 46.89 C ATOM 1109 O ILE A 72 35.236 44.125 102.825 1.00 44.69 O ATOM 1110 CB ILE A 72 34.438 41.670 101.187 1.00 51.48 C ATOM 1111 CG1 ILE A 72 33.716 40.339 100.958 1.00 60.02 C ATOM 1112 CG2 ILE A 72 35.570 41.846 100.189 1.00 54.40 C ATOM 1113 CD1 ILE A 72 33.041 40.219 99.596 1.00 71.48 C ATOM 1114 HA ILE A 72 35.596 40.875 102.811 1.00 0.00 H ATOM 1115 HB ILE A 72 33.731 42.485 101.033 1.00 0.00 H ATOM 1116 HG12 ILE A 72 34.445 39.534 101.050 1.00 0.00 H ATOM 1117 HG13 ILE A 72 32.953 40.227 101.729 1.00 0.00 H ATOM 1118 HD11 ILE A 72 32.297 41.009 99.490 1.00 0.00 H ATOM 1119 HD12 ILE A 72 33.791 40.316 98.811 1.00 0.00 H ATOM 1120 HD13 ILE A 72 32.554 39.247 99.518 1.00 0.00 H ATOM 1121 HG21 ILE A 72 36.040 42.818 100.342 1.00 0.00 H ATOM 1122 HG22 ILE A 72 36.308 41.057 100.335 1.00 0.00 H ATOM 1123 HG23 ILE A 72 35.172 41.789 99.176 1.00 0.00 H ATOM 1124 H ILE A 72 33.166 42.476 103.601 1.00 0.00 H ATOM 1125 N ALA A 73 37.068 42.837 103.055 1.00 40.07 N ATOM 1126 CA ALA A 73 37.959 43.983 103.103 1.00 38.49 C ATOM 1127 C ALA A 73 38.647 44.047 101.751 1.00 42.66 C ATOM 1128 O ALA A 73 39.239 43.066 101.289 1.00 43.93 O ATOM 1129 CB ALA A 73 38.963 43.851 104.233 1.00 34.59 C ATOM 1130 HA ALA A 73 37.407 44.902 103.300 1.00 0.00 H ATOM 1131 HB1 ALA A 73 38.432 43.783 105.183 1.00 0.00 H ATOM 1132 HB2 ALA A 73 39.560 42.952 104.083 1.00 0.00 H ATOM 1133 HB3 ALA A 73 39.615 44.724 104.242 1.00 0.00 H ATOM 1134 H ALA A 73 37.448 41.878 103.191 1.00 0.00 H ATOM 1135 N GLU A 74 38.534 45.199 101.104 1.00 37.34 N ATOM 1136 CA GLU A 74 39.038 45.355 99.755 1.00 46.05 C ATOM 1137 C GLU A 74 40.508 45.743 99.794 1.00 45.32 C ATOM 1138 O GLU A 74 40.940 46.501 100.670 1.00 36.09 O ATOM 1139 CB GLU A 74 38.201 46.389 99.001 1.00 47.61 C ATOM 1140 CG GLU A 74 36.709 46.046 98.987 1.00 63.24 C ATOM 1141 CD GLU A 74 35.867 47.058 98.231 1.00 83.99 C ATOM 1142 OE1 GLU A 74 36.166 48.269 98.300 1.00 88.01 O ATOM 1143 OE2 GLU A 74 34.897 46.638 97.566 1.00 97.96 O ATOM 1144 HA GLU A 74 38.956 44.408 99.222 1.00 0.00 H ATOM 1145 HB2 GLU A 74 38.331 47.360 99.480 1.00 0.00 H ATOM 1146 HB3 GLU A 74 38.556 46.442 97.972 1.00 0.00 H ATOM 1147 HG2 GLU A 74 36.582 45.071 98.517 1.00 0.00 H ATOM 1148 HG3 GLU A 74 36.354 46.001 100.017 1.00 0.00 H ATOM 1149 H GLU A 74 38.075 46.005 101.574 1.00 0.00 H ATOM 1150 N LYS A 75 41.282 45.211 98.856 1.00 38.00 N ATOM 1151 CA LYS A 75 42.697 45.531 98.807 1.00 40.32 C ATOM 1152 C LYS A 75 42.926 46.989 98.429 1.00 46.70 C ATOM 1153 O LYS A 75 42.035 47.660 97.884 1.00 38.45 O ATOM 1154 CB LYS A 75 43.430 44.618 97.836 1.00 45.40 C ATOM 1155 CG LYS A 75 43.091 44.859 96.390 1.00 45.74 C ATOM 1156 CD LYS A 75 43.950 43.980 95.497 1.00 57.10 C ATOM 1157 CE LYS A 75 43.644 44.248 94.027 1.00 64.27 C ATOM 1158 NZ LYS A 75 44.349 43.288 93.129 1.00 67.87 N ATOM 1159 HA LYS A 75 43.099 45.371 99.807 1.00 0.00 H ATOM 1160 HB2 LYS A 75 44.502 44.769 97.966 1.00 0.00 H ATOM 1161 HB3 LYS A 75 43.178 43.586 98.079 1.00 0.00 H ATOM 1162 HG2 LYS A 75 42.040 44.625 96.222 1.00 0.00 H ATOM 1163 HG3 LYS A 75 43.272 45.906 96.147 1.00 0.00 H ATOM 1164 HD2 LYS A 75 45.002 44.193 95.689 1.00 0.00 H ATOM 1165 HD3 LYS A 75 43.746 42.933 95.721 1.00 0.00 H ATOM 1166 HE2 LYS A 75 43.961 45.261 93.779 1.00 0.00 H ATOM 1167 HE3 LYS A 75 42.570 44.156 93.868 1.00 0.00 H ATOM 1168 HZ1 LYS A 75 45.376 43.374 93.270 1.00 0.00 H ATOM 1169 HZ2 LYS A 75 44.047 42.319 93.354 1.00 0.00 H ATOM 1170 HZ3 LYS A 75 44.114 43.505 92.139 1.00 0.00 H ATOM 1171 H LYS A 75 40.873 44.562 98.153 1.00 0.00 H ATOM 1172 N THR A 76 44.109 47.488 98.776 1.00 42.83 N ATOM 1173 CA THR A 76 44.557 48.791 98.310 1.00 48.44 C ATOM 1174 C THR A 76 45.946 48.615 97.695 1.00 57.08 C ATOM 1175 O THR A 76 46.463 47.495 97.627 1.00 49.04 O ATOM 1176 CB THR A 76 44.643 49.804 99.464 1.00 44.46 C ATOM 1177 OG1 THR A 76 45.782 49.504 100.274 1.00 40.76 O ATOM 1178 CG2 THR A 76 43.391 49.747 100.343 1.00 41.27 C ATOM 1179 HA THR A 76 43.842 49.175 97.582 1.00 0.00 H ATOM 1180 HB THR A 76 44.728 50.802 99.034 1.00 0.00 H ATOM 1181 HG1 THR A 76 45.838 50.156 101.017 1.00 0.00 H ATOM 1182 HG23 THR A 76 42.513 49.974 99.738 1.00 0.00 H ATOM 1183 HG21 THR A 76 43.292 48.748 100.768 1.00 0.00 H ATOM 1184 HG22 THR A 76 43.479 50.478 101.146 1.00 0.00 H ATOM 1185 H THR A 76 44.730 46.932 99.397 1.00 0.00 H ATOM 1186 N LYS A 77 46.560 49.716 97.272 1.00 52.48 N ATOM 1187 CA LYS A 77 47.913 49.666 96.719 1.00 44.42 C ATOM 1188 C LYS A 77 48.963 49.263 97.761 1.00 51.25 C ATOM 1189 O LYS A 77 50.089 48.905 97.414 1.00 47.81 O ATOM 1190 CB LYS A 77 48.281 51.007 96.093 1.00 46.05 C ATOM 1191 CG LYS A 77 47.380 51.404 94.931 1.00 60.47 C ATOM 1192 CD LYS A 77 48.198 51.824 93.718 1.00 73.19 C ATOM 1193 CE LYS A 77 47.313 52.372 92.610 1.00 82.29 C ATOM 1194 NZ LYS A 77 46.686 53.664 93.001 1.00 88.30 N ATOM 1195 HA LYS A 77 47.912 48.893 95.950 1.00 0.00 H ATOM 1196 HB2 LYS A 77 48.213 51.777 96.861 1.00 0.00 H ATOM 1197 HB3 LYS A 77 49.307 50.948 95.730 1.00 0.00 H ATOM 1198 HG2 LYS A 77 46.753 50.554 94.660 1.00 0.00 H ATOM 1199 HG3 LYS A 77 46.748 52.237 95.239 1.00 0.00 H ATOM 1200 HD2 LYS A 77 48.907 52.595 94.019 1.00 0.00 H ATOM 1201 HD3 LYS A 77 48.743 50.958 93.341 1.00 0.00 H ATOM 1202 HE2 LYS A 77 46.527 51.648 92.393 1.00 0.00 H ATOM 1203 HE3 LYS A 77 47.918 52.528 91.717 1.00 0.00 H ATOM 1204 HZ1 LYS A 77 46.102 53.522 93.850 1.00 0.00 H ATOM 1205 HZ2 LYS A 77 47.430 54.362 93.204 1.00 0.00 H ATOM 1206 HZ3 LYS A 77 46.090 54.008 92.222 1.00 0.00 H ATOM 1207 H LYS A 77 46.069 50.630 97.336 1.00 0.00 H ATOM 1208 N ILE A 78 48.603 49.329 99.036 1.00 41.76 N ATOM 1209 CA ILE A 78 49.509 48.881 100.086 1.00 38.11 C ATOM 1210 C ILE A 78 49.089 47.484 100.489 1.00 42.33 C ATOM 1211 O ILE A 78 47.945 47.280 100.905 1.00 47.35 O ATOM 1212 CB ILE A 78 49.441 49.783 101.320 1.00 43.58 C ATOM 1213 CG1 ILE A 78 49.738 51.228 100.937 1.00 51.27 C ATOM 1214 CG2 ILE A 78 50.412 49.304 102.391 1.00 44.60 C ATOM 1215 CD1 ILE A 78 49.555 52.185 102.092 1.00 53.11 C ATOM 1216 HA ILE A 78 50.530 48.909 99.705 1.00 0.00 H ATOM 1217 HB ILE A 78 48.432 49.732 101.728 1.00 0.00 H ATOM 1218 HG12 ILE A 78 50.769 51.293 100.590 1.00 0.00 H ATOM 1219 HG13 ILE A 78 49.066 51.521 100.131 1.00 0.00 H ATOM 1220 HD11 ILE A 78 48.524 52.136 102.443 1.00 0.00 H ATOM 1221 HD12 ILE A 78 50.229 51.908 102.902 1.00 0.00 H ATOM 1222 HD13 ILE A 78 49.780 53.199 101.761 1.00 0.00 H ATOM 1223 HG21 ILE A 78 50.155 48.286 102.683 1.00 0.00 H ATOM 1224 HG22 ILE A 78 51.427 49.324 101.995 1.00 0.00 H ATOM 1225 HG23 ILE A 78 50.346 49.960 103.259 1.00 0.00 H ATOM 1226 H ILE A 78 47.666 49.704 99.289 1.00 0.00 H ATOM 1227 N PRO A 79 50.008 46.511 100.367 1.00 46.82 N ATOM 1228 CA PRO A 79 49.628 45.115 100.625 1.00 42.90 C ATOM 1229 C PRO A 79 49.087 44.868 102.044 1.00 36.98 C ATOM 1230 O PRO A 79 48.254 43.973 102.209 1.00 42.62 O ATOM 1231 CB PRO A 79 50.944 44.354 100.423 1.00 42.81 C ATOM 1232 CG PRO A 79 51.748 45.213 99.486 1.00 43.15 C ATOM 1233 CD PRO A 79 51.412 46.629 99.914 1.00 40.11 C ATOM 1234 HA PRO A 79 48.814 44.803 99.971 1.00 0.00 H ATOM 1235 HD3 PRO A 79 52.060 46.958 100.726 1.00 0.00 H ATOM 1236 HD2 PRO A 79 51.498 47.323 99.078 1.00 0.00 H ATOM 1237 HG3 PRO A 79 51.454 45.040 98.451 1.00 0.00 H ATOM 1238 HG2 PRO A 79 52.814 45.016 99.597 1.00 0.00 H ATOM 1239 HB2 PRO A 79 51.465 44.230 101.372 1.00 0.00 H ATOM 1240 HB3 PRO A 79 50.757 43.375 99.982 1.00 0.00 H ATOM 1241 N ALA A 80 49.539 45.636 103.035 1.00 36.66 N ATOM 1242 CA ALA A 80 49.115 45.389 104.412 1.00 37.50 C ATOM 1243 C ALA A 80 47.881 46.188 104.816 1.00 37.40 C ATOM 1244 O ALA A 80 47.482 46.152 105.981 1.00 35.56 O ATOM 1245 CB ALA A 80 50.256 45.663 105.382 1.00 34.67 C ATOM 1246 HA ALA A 80 48.837 44.336 104.460 1.00 0.00 H ATOM 1247 HB1 ALA A 80 51.095 45.008 105.148 1.00 0.00 H ATOM 1248 HB2 ALA A 80 50.568 46.703 105.289 1.00 0.00 H ATOM 1249 HB3 ALA A 80 49.919 45.473 106.401 1.00 0.00 H ATOM 1250 H ALA A 80 50.196 46.415 102.828 1.00 0.00 H ATOM 1251 N VAL A 81 47.287 46.911 103.870 1.00 37.23 N ATOM 1252 CA VAL A 81 46.180 47.815 104.187 1.00 37.57 C ATOM 1253 C VAL A 81 44.947 47.522 103.330 1.00 32.27 C ATOM 1254 O VAL A 81 45.048 47.423 102.102 1.00 37.66 O ATOM 1255 CB VAL A 81 46.596 49.283 104.014 1.00 37.48 C ATOM 1256 CG1 VAL A 81 45.397 50.196 104.204 1.00 39.22 C ATOM 1257 CG2 VAL A 81 47.686 49.638 105.024 1.00 43.90 C ATOM 1258 HA VAL A 81 45.920 47.642 105.231 1.00 0.00 H ATOM 1259 HB VAL A 81 46.985 49.421 103.005 1.00 0.00 H ATOM 1260 HG11 VAL A 81 44.635 49.952 103.464 1.00 0.00 H ATOM 1261 HG12 VAL A 81 44.991 50.056 105.206 1.00 0.00 H ATOM 1262 HG13 VAL A 81 45.708 51.233 104.078 1.00 0.00 H ATOM 1263 HG21 VAL A 81 47.306 49.488 106.035 1.00 0.00 H ATOM 1264 HG22 VAL A 81 48.553 48.997 104.862 1.00 0.00 H ATOM 1265 HG23 VAL A 81 47.975 50.681 104.894 1.00 0.00 H ATOM 1266 H VAL A 81 47.615 46.832 102.886 1.00 0.00 H ATOM 1267 N PHE A 82 43.802 47.351 103.993 1.00 36.38 N ATOM 1268 CA PHE A 82 42.554 47.017 103.313 1.00 39.67 C ATOM 1269 C PHE A 82 41.461 47.993 103.704 1.00 44.35 C ATOM 1270 O PHE A 82 41.567 48.677 104.721 1.00 40.13 O ATOM 1271 CB PHE A 82 42.127 45.587 103.672 1.00 42.26 C ATOM 1272 CG PHE A 82 43.072 44.546 103.165 1.00 40.79 C ATOM 1273 CD1 PHE A 82 42.829 43.904 101.962 1.00 49.45 C ATOM 1274 CD2 PHE A 82 44.226 44.233 103.874 1.00 42.55 C ATOM 1275 CE1 PHE A 82 43.712 42.951 101.470 1.00 46.63 C ATOM 1276 CE2 PHE A 82 45.120 43.286 103.388 1.00 43.57 C ATOM 1277 CZ PHE A 82 44.857 42.639 102.186 1.00 44.88 C ATOM 1278 HA PHE A 82 42.716 47.084 102.237 1.00 0.00 H ATOM 1279 HB2 PHE A 82 42.070 45.504 104.757 1.00 0.00 H ATOM 1280 HB3 PHE A 82 41.143 45.401 103.242 1.00 0.00 H ATOM 1281 HD2 PHE A 82 44.432 44.735 104.820 1.00 0.00 H ATOM 1282 HE2 PHE A 82 46.025 43.051 103.948 1.00 0.00 H ATOM 1283 HZ PHE A 82 45.550 41.888 101.807 1.00 0.00 H ATOM 1284 HE1 PHE A 82 43.505 42.450 100.524 1.00 0.00 H ATOM 1285 HD1 PHE A 82 41.932 44.150 101.393 1.00 0.00 H ATOM 1286 H PHE A 82 43.798 47.459 105.027 1.00 0.00 H ATOM 1287 N LYS A 83 40.408 48.052 102.899 1.00 39.78 N ATOM 1288 CA LYS A 83 39.319 48.978 103.151 1.00 44.90 C ATOM 1289 C LYS A 83 38.019 48.230 103.337 1.00 48.10 C ATOM 1290 O LYS A 83 37.680 47.353 102.541 1.00 49.82 O ATOM 1291 CB LYS A 83 39.161 49.949 101.978 1.00 51.38 C ATOM 1292 CG LYS A 83 40.258 50.988 101.871 1.00 62.57 C ATOM 1293 CD LYS A 83 39.773 52.200 101.082 1.00 75.28 C ATOM 1294 CE LYS A 83 40.741 53.373 101.204 1.00 75.67 C ATOM 1295 NZ LYS A 83 40.128 54.644 100.719 1.00 73.58 N ATOM 1296 HA LYS A 83 39.556 49.532 104.059 1.00 0.00 H ATOM 1297 HB2 LYS A 83 39.149 49.369 101.055 1.00 0.00 H ATOM 1298 HB3 LYS A 83 38.209 50.468 102.091 1.00 0.00 H ATOM 1299 HG2 LYS A 83 40.551 51.305 102.872 1.00 0.00 H ATOM 1300 HG3 LYS A 83 41.118 50.551 101.364 1.00 0.00 H ATOM 1301 HD2 LYS A 83 39.681 51.925 100.031 1.00 0.00 H ATOM 1302 HD3 LYS A 83 38.798 52.504 101.464 1.00 0.00 H ATOM 1303 HE2 LYS A 83 41.631 53.161 100.612 1.00 0.00 H ATOM 1304 HE3 LYS A 83 41.022 53.492 102.250 1.00 0.00 H ATOM 1305 HZ1 LYS A 83 39.862 54.540 99.719 1.00 0.00 H ATOM 1306 HZ2 LYS A 83 39.281 54.857 101.284 1.00 0.00 H ATOM 1307 HZ3 LYS A 83 40.815 55.418 100.817 1.00 0.00 H ATOM 1308 H LYS A 83 40.362 47.423 102.072 1.00 0.00 H ATOM 1309 N ILE A 84 37.286 48.584 104.383 1.00 47.30 N ATOM 1310 CA ILE A 84 35.932 48.079 104.528 1.00 59.86 C ATOM 1311 C ILE A 84 34.936 49.176 104.155 1.00 65.41 C ATOM 1312 O ILE A 84 34.897 50.238 104.782 1.00 68.14 O ATOM 1313 CB ILE A 84 35.675 47.545 105.944 1.00 57.48 C ATOM 1314 CG1 ILE A 84 36.538 46.307 106.191 1.00 47.18 C ATOM 1315 CG2 ILE A 84 34.212 47.193 106.130 1.00 63.35 C ATOM 1316 CD1 ILE A 84 36.205 45.579 107.474 1.00 52.79 C ATOM 1317 HA ILE A 84 35.799 47.237 103.849 1.00 0.00 H ATOM 1318 HB ILE A 84 35.937 48.324 106.660 1.00 0.00 H ATOM 1319 HG12 ILE A 84 36.398 45.618 105.358 1.00 0.00 H ATOM 1320 HG13 ILE A 84 37.582 46.618 106.232 1.00 0.00 H ATOM 1321 HD11 ILE A 84 36.351 46.251 108.320 1.00 0.00 H ATOM 1322 HD12 ILE A 84 35.166 45.250 107.445 1.00 0.00 H ATOM 1323 HD13 ILE A 84 36.859 44.713 107.579 1.00 0.00 H ATOM 1324 HG21 ILE A 84 33.603 48.083 105.974 1.00 0.00 H ATOM 1325 HG22 ILE A 84 33.929 46.427 105.408 1.00 0.00 H ATOM 1326 HG23 ILE A 84 34.056 46.817 107.141 1.00 0.00 H ATOM 1327 H ILE A 84 37.681 49.224 105.101 1.00 0.00 H ATOM 1328 N ASP A 85 34.145 48.921 103.120 1.00 73.76 N ATOM 1329 CA ASP A 85 33.142 49.885 102.679 1.00 89.04 C ATOM 1330 C ASP A 85 32.071 50.049 103.752 1.00 86.47 C ATOM 1331 O ASP A 85 31.441 49.078 104.167 1.00 86.92 O ATOM 1332 CB ASP A 85 32.510 49.445 101.354 1.00101.54 C ATOM 1333 CG ASP A 85 31.716 50.559 100.678 1.00116.16 C ATOM 1334 OD1 ASP A 85 31.989 51.751 100.946 1.00120.48 O ATOM 1335 OD2 ASP A 85 30.820 50.242 99.866 1.00123.03 O ATOM 1336 HA ASP A 85 33.631 50.846 102.517 1.00 0.00 H ATOM 1337 HB2 ASP A 85 33.303 49.124 100.679 1.00 0.00 H ATOM 1338 HB3 ASP A 85 31.839 48.608 101.549 1.00 0.00 H ATOM 1339 H ASP A 85 34.242 48.018 102.614 1.00 0.00 H ATOM 1340 N ALA A 86 31.889 51.283 104.212 1.00 86.31 N ATOM 1341 CA ALA A 86 30.866 51.597 105.206 1.00 89.51 C ATOM 1342 C ALA A 86 30.415 53.046 105.059 1.00 92.54 C ATOM 1343 O ALA A 86 30.759 53.706 104.079 1.00 98.68 O ATOM 1344 CB ALA A 86 31.393 51.339 106.609 1.00 83.41 C ATOM 1345 HA ALA A 86 30.006 50.949 105.039 1.00 0.00 H ATOM 1346 HB1 ALA A 86 31.671 50.289 106.704 1.00 0.00 H ATOM 1347 HB2 ALA A 86 32.267 51.965 106.788 1.00 0.00 H ATOM 1348 HB3 ALA A 86 30.618 51.578 107.337 1.00 0.00 H ATOM 1349 H ALA A 86 32.494 52.049 103.853 1.00 0.00 H ATOM 1350 N LEU A 87 29.654 53.538 106.036 1.00 84.70 N ATOM 1351 CA LEU A 87 29.235 54.942 106.075 1.00 88.46 C ATOM 1352 C LEU A 87 30.441 55.869 106.076 1.00 91.16 C ATOM 1353 O LEU A 87 30.396 56.987 105.556 1.00 95.83 O ATOM 1354 CB LEU A 87 28.389 55.210 107.320 1.00 91.86 C ATOM 1355 CG LEU A 87 27.811 56.614 107.483 1.00102.52 C ATOM 1356 CD1 LEU A 87 26.921 56.960 106.309 1.00110.03 C ATOM 1357 CD2 LEU A 87 27.032 56.712 108.776 1.00103.63 C ATOM 1358 HA LEU A 87 28.640 55.138 105.183 1.00 0.00 H ATOM 1359 HB2 LEU A 87 27.553 54.511 107.305 1.00 0.00 H ATOM 1360 HB3 LEU A 87 29.014 55.009 108.190 1.00 0.00 H ATOM 1361 HG LEU A 87 28.635 57.326 107.515 1.00 0.00 H ATOM 1362 HD21 LEU A 87 26.216 55.989 108.763 1.00 0.00 H ATOM 1363 HD22 LEU A 87 27.695 56.499 109.615 1.00 0.00 H ATOM 1364 HD23 LEU A 87 26.626 57.718 108.879 1.00 0.00 H ATOM 1365 HD11 LEU A 87 27.504 56.921 105.389 1.00 0.00 H ATOM 1366 HD12 LEU A 87 26.102 56.243 106.252 1.00 0.00 H ATOM 1367 HD13 LEU A 87 26.519 57.964 106.443 1.00 0.00 H ATOM 1368 H LEU A 87 29.346 52.902 106.799 1.00 0.00 H ATOM 1369 N ASN A 88 31.517 55.378 106.675 1.00 88.14 N ATOM 1370 CA ASN A 88 32.787 56.075 106.720 1.00 92.29 C ATOM 1371 C ASN A 88 33.862 55.145 106.188 1.00 79.10 C ATOM 1372 O ASN A 88 33.711 53.922 106.244 1.00 75.98 O ATOM 1373 CB ASN A 88 33.106 56.445 108.164 1.00103.47 C ATOM 1374 CG ASN A 88 32.784 55.316 109.132 1.00112.27 C ATOM 1375 OD1 ASN A 88 31.790 54.604 108.963 1.00111.95 O ATOM 1376 ND2 ASN A 88 33.624 55.144 110.147 1.00117.33 N ATOM 1377 HA ASN A 88 32.743 56.982 106.117 1.00 0.00 H ATOM 1378 HB2 ASN A 88 34.168 56.681 108.240 1.00 0.00 H ATOM 1379 HB3 ASN A 88 32.520 57.322 108.440 1.00 0.00 H ATOM 1380 HD22 ASN A 88 34.449 55.768 110.250 1.00 0.00 H ATOM 1381 HD21 ASN A 88 33.456 54.385 110.838 1.00 0.00 H ATOM 1382 H ASN A 88 31.446 54.448 107.135 1.00 0.00 H ATOM 1383 N GLU A 89 34.945 55.710 105.667 1.00 78.95 N ATOM 1384 CA GLU A 89 36.057 54.883 105.221 1.00 77.73 C ATOM 1385 C GLU A 89 36.821 54.382 106.435 1.00 71.41 C ATOM 1386 O GLU A 89 37.282 55.175 107.259 1.00 72.23 O ATOM 1387 CB GLU A 89 36.980 55.659 104.279 1.00 89.00 C ATOM 1388 CG GLU A 89 36.299 56.096 102.985 1.00104.60 C ATOM 1389 CD GLU A 89 37.195 55.953 101.765 1.00109.76 C ATOM 1390 OE1 GLU A 89 38.201 56.688 101.667 1.00113.52 O ATOM 1391 OE2 GLU A 89 36.891 55.098 100.905 1.00107.58 O ATOM 1392 HA GLU A 89 35.667 54.032 104.662 1.00 0.00 H ATOM 1393 HB2 GLU A 89 37.336 56.548 104.799 1.00 0.00 H ATOM 1394 HB3 GLU A 89 37.828 55.023 104.025 1.00 0.00 H ATOM 1395 HG2 GLU A 89 35.409 55.484 102.837 1.00 0.00 H ATOM 1396 HG3 GLU A 89 36.007 57.142 103.082 1.00 0.00 H ATOM 1397 H GLU A 89 34.999 56.745 105.577 1.00 0.00 H ATOM 1398 N ASN A 90 36.921 53.063 106.561 1.00 50.04 N ATOM 1399 CA ASN A 90 37.671 52.457 107.649 1.00 56.87 C ATOM 1400 C ASN A 90 38.752 51.562 107.083 1.00 56.53 C ATOM 1401 O ASN A 90 38.491 50.773 106.174 1.00 54.60 O ATOM 1402 CB ASN A 90 36.746 51.642 108.550 1.00 64.61 C ATOM 1403 CG ASN A 90 35.713 52.501 109.261 1.00 78.94 C ATOM 1404 OD1 ASN A 90 36.046 53.515 109.879 1.00 81.92 O ATOM 1405 ND2 ASN A 90 34.450 52.100 109.173 1.00 80.36 N ATOM 1406 HA ASN A 90 38.126 53.249 108.244 1.00 0.00 H ATOM 1407 HB2 ASN A 90 36.226 50.904 107.940 1.00 0.00 H ATOM 1408 HB3 ASN A 90 37.350 51.131 109.299 1.00 0.00 H ATOM 1409 HD22 ASN A 90 34.214 51.238 108.641 1.00 0.00 H ATOM 1410 HD21 ASN A 90 33.697 52.648 109.636 1.00 0.00 H ATOM 1411 H ASN A 90 36.452 52.450 105.865 1.00 0.00 H ATOM 1412 N LYS A 91 39.964 51.686 107.619 1.00 39.51 N ATOM 1413 CA LYS A 91 41.085 50.895 107.141 1.00 39.31 C ATOM 1414 C LYS A 91 41.374 49.732 108.071 1.00 41.13 C ATOM 1415 O LYS A 91 41.296 49.861 109.300 1.00 38.58 O ATOM 1416 CB LYS A 91 42.341 51.758 107.008 1.00 54.30 C ATOM 1417 CG LYS A 91 42.377 52.618 105.753 1.00 65.08 C ATOM 1418 CD LYS A 91 43.455 53.687 105.860 1.00 77.69 C ATOM 1419 CE LYS A 91 44.596 53.228 106.766 1.00 81.64 C ATOM 1420 NZ LYS A 91 45.766 54.153 106.753 1.00 86.64 N ATOM 1421 HA LYS A 91 40.810 50.503 106.162 1.00 0.00 H ATOM 1422 HB2 LYS A 91 42.398 52.416 107.875 1.00 0.00 H ATOM 1423 HB3 LYS A 91 43.209 51.099 106.996 1.00 0.00 H ATOM 1424 HG2 LYS A 91 42.586 51.984 104.891 1.00 0.00 H ATOM 1425 HG3 LYS A 91 41.408 53.099 105.622 1.00 0.00 H ATOM 1426 HD2 LYS A 91 43.851 53.895 104.866 1.00 0.00 H ATOM 1427 HD3 LYS A 91 43.016 54.596 106.272 1.00 0.00 H ATOM 1428 HE2 LYS A 91 44.928 52.244 106.434 1.00 0.00 H ATOM 1429 HE3 LYS A 91 44.221 53.158 107.787 1.00 0.00 H ATOM 1430 HZ1 LYS A 91 46.141 54.222 105.785 1.00 0.00 H ATOM 1431 HZ2 LYS A 91 45.466 55.094 107.078 1.00 0.00 H ATOM 1432 HZ3 LYS A 91 46.504 53.785 107.387 1.00 0.00 H ATOM 1433 H LYS A 91 40.111 52.362 108.395 1.00 0.00 H ATOM 1434 N VAL A 92 41.709 48.597 107.469 1.00 31.91 N ATOM 1435 CA VAL A 92 42.188 47.446 108.211 1.00 32.26 C ATOM 1436 C VAL A 92 43.676 47.341 107.904 1.00 29.28 C ATOM 1437 O VAL A 92 44.073 47.332 106.744 1.00 31.97 O ATOM 1438 CB VAL A 92 41.469 46.168 107.756 1.00 39.91 C ATOM 1439 CG1 VAL A 92 42.132 44.934 108.364 1.00 38.38 C ATOM 1440 CG2 VAL A 92 40.009 46.236 108.146 1.00 40.13 C ATOM 1441 HA VAL A 92 41.999 47.560 109.278 1.00 0.00 H ATOM 1442 HB VAL A 92 41.540 46.089 106.671 1.00 0.00 H ATOM 1443 HG11 VAL A 92 43.173 44.888 108.044 1.00 0.00 H ATOM 1444 HG12 VAL A 92 42.087 44.998 109.451 1.00 0.00 H ATOM 1445 HG13 VAL A 92 41.607 44.039 108.029 1.00 0.00 H ATOM 1446 HG21 VAL A 92 39.928 46.330 109.229 1.00 0.00 H ATOM 1447 HG22 VAL A 92 39.547 47.100 107.669 1.00 0.00 H ATOM 1448 HG23 VAL A 92 39.505 45.326 107.820 1.00 0.00 H ATOM 1449 H VAL A 92 41.626 48.531 106.434 1.00 0.00 H ATOM 1450 N LEU A 93 44.502 47.279 108.942 1.00 30.24 N ATOM 1451 CA LEU A 93 45.948 47.194 108.746 1.00 30.23 C ATOM 1452 C LEU A 93 46.480 45.915 109.360 1.00 31.11 C ATOM 1453 O LEU A 93 46.177 45.624 110.523 1.00 31.62 O ATOM 1454 CB LEU A 93 46.657 48.366 109.438 1.00 37.04 C ATOM 1455 CG LEU A 93 46.311 49.784 108.990 1.00 49.52 C ATOM 1456 CD1 LEU A 93 45.195 50.377 109.846 1.00 48.25 C ATOM 1457 CD2 LEU A 93 47.551 50.650 109.054 1.00 55.68 C ATOM 1458 HA LEU A 93 46.139 47.218 107.673 1.00 0.00 H ATOM 1459 HB2 LEU A 93 46.430 48.299 110.502 1.00 0.00 H ATOM 1460 HB3 LEU A 93 47.728 48.231 109.287 1.00 0.00 H ATOM 1461 HG LEU A 93 45.950 49.748 107.962 1.00 0.00 H ATOM 1462 HD21 LEU A 93 47.924 50.673 110.078 1.00 0.00 H ATOM 1463 HD22 LEU A 93 48.316 50.237 108.396 1.00 0.00 H ATOM 1464 HD23 LEU A 93 47.303 51.662 108.734 1.00 0.00 H ATOM 1465 HD11 LEU A 93 44.303 49.757 109.758 1.00 0.00 H ATOM 1466 HD12 LEU A 93 45.516 50.409 110.887 1.00 0.00 H ATOM 1467 HD13 LEU A 93 44.972 51.387 109.502 1.00 0.00 H ATOM 1468 H LEU A 93 44.115 47.291 109.907 1.00 0.00 H ATOM 1469 N VAL A 94 47.286 45.166 108.609 1.00 30.03 N ATOM 1470 CA VAL A 94 48.030 44.053 109.206 1.00 31.16 C ATOM 1471 C VAL A 94 49.336 44.602 109.768 1.00 33.98 C ATOM 1472 O VAL A 94 50.173 45.092 109.027 1.00 28.65 O ATOM 1473 CB VAL A 94 48.329 42.948 108.189 1.00 37.02 C ATOM 1474 CG1 VAL A 94 49.028 41.769 108.877 1.00 37.18 C ATOM 1475 CG2 VAL A 94 47.042 42.487 107.558 1.00 35.94 C ATOM 1476 HA VAL A 94 47.421 43.608 109.992 1.00 0.00 H ATOM 1477 HB VAL A 94 48.990 43.341 107.417 1.00 0.00 H ATOM 1478 HG11 VAL A 94 49.964 42.111 109.319 1.00 0.00 H ATOM 1479 HG12 VAL A 94 48.381 41.370 109.658 1.00 0.00 H ATOM 1480 HG13 VAL A 94 49.234 40.991 108.142 1.00 0.00 H ATOM 1481 HG21 VAL A 94 46.378 42.101 108.331 1.00 0.00 H ATOM 1482 HG22 VAL A 94 46.565 43.327 107.054 1.00 0.00 H ATOM 1483 HG23 VAL A 94 47.255 41.700 106.834 1.00 0.00 H ATOM 1484 H VAL A 94 47.388 45.372 107.595 1.00 0.00 H ATOM 1485 N LEU A 95 49.502 44.522 111.083 1.00 30.97 N ATOM 1486 CA LEU A 95 50.692 45.076 111.732 1.00 28.76 C ATOM 1487 C LEU A 95 51.858 44.101 111.657 1.00 38.44 C ATOM 1488 O LEU A 95 53.020 44.494 111.491 1.00 33.50 O ATOM 1489 CB LEU A 95 50.397 45.352 113.214 1.00 34.18 C ATOM 1490 CG LEU A 95 49.756 46.687 113.601 1.00 42.50 C ATOM 1491 CD1 LEU A 95 48.382 46.832 112.983 1.00 38.23 C ATOM 1492 CD2 LEU A 95 49.678 46.804 115.126 1.00 44.82 C ATOM 1493 HA LEU A 95 50.954 45.998 111.213 1.00 0.00 H ATOM 1494 HB2 LEU A 95 49.729 44.563 113.561 1.00 0.00 H ATOM 1495 HB3 LEU A 95 51.345 45.285 113.748 1.00 0.00 H ATOM 1496 HG LEU A 95 50.379 47.494 113.215 1.00 0.00 H ATOM 1497 HD21 LEU A 95 49.075 45.987 115.521 1.00 0.00 H ATOM 1498 HD22 LEU A 95 50.683 46.752 115.545 1.00 0.00 H ATOM 1499 HD23 LEU A 95 49.221 47.757 115.393 1.00 0.00 H ATOM 1500 HD11 LEU A 95 48.467 46.787 111.897 1.00 0.00 H ATOM 1501 HD12 LEU A 95 47.741 46.023 113.332 1.00 0.00 H ATOM 1502 HD13 LEU A 95 47.952 47.790 113.276 1.00 0.00 H ATOM 1503 H LEU A 95 48.774 44.058 111.662 1.00 0.00 H ATOM 1504 N ASP A 96 51.550 42.820 111.815 1.00 32.40 N ATOM 1505 CA ASP A 96 52.603 41.822 111.927 1.00 32.62 C ATOM 1506 C ASP A 96 51.986 40.450 111.897 1.00 37.81 C ATOM 1507 O ASP A 96 50.885 40.253 112.431 1.00 38.87 O ATOM 1508 CB ASP A 96 53.376 42.004 113.242 1.00 40.59 C ATOM 1509 CG ASP A 96 54.600 41.112 113.325 1.00 44.14 C ATOM 1510 OD1 ASP A 96 55.144 40.741 112.259 1.00 45.60 O ATOM 1511 OD2 ASP A 96 55.026 40.780 114.452 1.00 43.46 O ATOM 1512 HA ASP A 96 53.295 41.940 111.093 1.00 0.00 H ATOM 1513 HB2 ASP A 96 53.695 43.043 113.319 1.00 0.00 H ATOM 1514 HB3 ASP A 96 52.713 41.766 114.074 1.00 0.00 H ATOM 1515 H ASP A 96 50.553 42.528 111.859 1.00 0.00 H ATOM 1516 N THR A 97 52.668 39.505 111.254 1.00 34.06 N ATOM 1517 CA THR A 97 52.252 38.098 111.339 1.00 33.77 C ATOM 1518 C THR A 97 53.430 37.184 111.046 1.00 39.75 C ATOM 1519 O THR A 97 54.407 37.615 110.437 1.00 41.19 O ATOM 1520 CB THR A 97 51.102 37.764 110.356 1.00 32.29 C ATOM 1521 OG1 THR A 97 50.676 36.408 110.561 1.00 35.04 O ATOM 1522 CG2 THR A 97 51.567 37.922 108.906 1.00 37.89 C ATOM 1523 HA THR A 97 51.889 37.937 112.354 1.00 0.00 H ATOM 1524 HB THR A 97 50.278 38.452 110.543 1.00 0.00 H ATOM 1525 HG1 THR A 97 50.357 36.301 111.492 1.00 0.00 H ATOM 1526 HG23 THR A 97 51.893 38.949 108.740 1.00 0.00 H ATOM 1527 HG21 THR A 97 52.397 37.241 108.716 1.00 0.00 H ATOM 1528 HG22 THR A 97 50.742 37.688 108.234 1.00 0.00 H ATOM 1529 H THR A 97 53.501 39.764 110.688 1.00 0.00 H ATOM 1530 N ASP A 98 53.351 35.934 111.493 1.00 35.26 N ATOM 1531 CA ASP A 98 54.322 34.931 111.070 1.00 38.85 C ATOM 1532 C ASP A 98 53.582 33.813 110.349 1.00 38.81 C ATOM 1533 O ASP A 98 54.133 32.737 110.105 1.00 41.37 O ATOM 1534 CB ASP A 98 55.127 34.391 112.260 1.00 40.80 C ATOM 1535 CG ASP A 98 54.289 33.547 113.211 1.00 40.61 C ATOM 1536 OD1 ASP A 98 53.044 33.597 113.151 1.00 37.51 O ATOM 1537 OD2 ASP A 98 54.880 32.823 114.038 1.00 41.68 O ATOM 1538 HA ASP A 98 55.042 35.388 110.391 1.00 0.00 H ATOM 1539 HB2 ASP A 98 55.943 33.778 111.878 1.00 0.00 H ATOM 1540 HB3 ASP A 98 55.537 35.235 112.814 1.00 0.00 H ATOM 1541 H ASP A 98 52.590 35.669 112.150 1.00 0.00 H ATOM 1542 N TYR A 99 52.311 34.088 110.046 1.00 34.28 N ATOM 1543 CA TYR A 99 51.436 33.198 109.281 1.00 33.89 C ATOM 1544 C TYR A 99 51.041 31.911 109.979 1.00 40.35 C ATOM 1545 O TYR A 99 49.899 31.460 109.844 1.00 39.25 O ATOM 1546 CB TYR A 99 52.063 32.858 107.917 1.00 39.14 C ATOM 1547 CG TYR A 99 52.445 34.074 107.122 1.00 37.84 C ATOM 1548 CD1 TYR A 99 51.470 34.917 106.604 1.00 41.67 C ATOM 1549 CD2 TYR A 99 53.782 34.391 106.888 1.00 39.37 C ATOM 1550 CE1 TYR A 99 51.818 36.044 105.861 1.00 40.83 C ATOM 1551 CE2 TYR A 99 54.135 35.518 106.147 1.00 45.39 C ATOM 1552 CZ TYR A 99 53.143 36.336 105.640 1.00 42.30 C ATOM 1553 OH TYR A 99 53.476 37.459 104.901 1.00 38.83 O ATOM 1554 HA TYR A 99 50.515 33.769 109.161 1.00 0.00 H ATOM 1555 HB3 TYR A 99 51.343 32.278 107.339 1.00 0.00 H ATOM 1556 HB2 TYR A 99 52.958 32.259 108.086 1.00 0.00 H ATOM 1557 HD2 TYR A 99 54.564 33.747 107.291 1.00 0.00 H ATOM 1558 HE2 TYR A 99 55.185 35.752 105.969 1.00 0.00 H ATOM 1559 HE1 TYR A 99 51.041 36.692 105.456 1.00 0.00 H ATOM 1560 HD1 TYR A 99 50.418 34.694 106.781 1.00 0.00 H ATOM 1561 HH TYR A 99 53.991 37.185 104.101 1.00 0.00 H ATOM 1562 H TYR A 99 51.917 34.993 110.375 1.00 0.00 H ATOM 1563 N LYS A 100 51.980 31.295 110.689 1.00 39.05 N ATOM 1564 CA LYS A 100 51.735 29.969 111.248 1.00 38.40 C ATOM 1565 C LYS A 100 51.265 30.005 112.703 1.00 38.29 C ATOM 1566 O LYS A 100 50.772 28.993 113.219 1.00 40.67 O ATOM 1567 CB LYS A 100 53.009 29.138 111.163 1.00 56.45 C ATOM 1568 CG LYS A 100 54.165 29.796 111.887 1.00 59.39 C ATOM 1569 CD LYS A 100 55.269 28.804 112.225 1.00 78.70 C ATOM 1570 CE LYS A 100 56.434 29.545 112.862 1.00 82.66 C ATOM 1571 NZ LYS A 100 55.955 30.631 113.764 1.00 74.33 N ATOM 1572 HA LYS A 100 50.933 29.524 110.658 1.00 0.00 H ATOM 1573 HB2 LYS A 100 52.823 28.162 111.610 1.00 0.00 H ATOM 1574 HB3 LYS A 100 53.277 29.011 110.114 1.00 0.00 H ATOM 1575 HG2 LYS A 100 54.578 30.579 111.251 1.00 0.00 H ATOM 1576 HG3 LYS A 100 53.795 30.239 112.812 1.00 0.00 H ATOM 1577 HD2 LYS A 100 54.887 28.058 112.922 1.00 0.00 H ATOM 1578 HD3 LYS A 100 55.606 28.310 111.314 1.00 0.00 H ATOM 1579 HE2 LYS A 100 57.050 29.981 112.076 1.00 0.00 H ATOM 1580 HE3 LYS A 100 57.031 28.840 113.440 1.00 0.00 H ATOM 1581 HZ1 LYS A 100 55.389 31.310 113.216 1.00 0.00 H ATOM 1582 HZ2 LYS A 100 55.370 30.220 114.519 1.00 0.00 H ATOM 1583 HZ3 LYS A 100 56.773 31.118 114.183 1.00 0.00 H ATOM 1584 H LYS A 100 52.896 31.761 110.848 1.00 0.00 H ATOM 1585 N LYS A 101 51.448 31.146 113.373 1.00 43.11 N ATOM 1586 CA LYS A 101 51.103 31.238 114.798 1.00 42.60 C ATOM 1587 C LYS A 101 50.234 32.436 115.160 1.00 38.42 C ATOM 1588 O LYS A 101 49.243 32.273 115.871 1.00 40.74 O ATOM 1589 CB LYS A 101 52.359 31.247 115.683 1.00 44.75 C ATOM 1590 CG LYS A 101 52.981 29.876 115.942 1.00 58.52 C ATOM 1591 CD LYS A 101 54.085 29.986 116.996 1.00 63.71 C ATOM 1592 CE LYS A 101 55.060 28.815 116.943 1.00 76.29 C ATOM 1593 NZ LYS A 101 54.452 27.531 117.380 1.00 81.81 N ATOM 1594 HA LYS A 101 50.512 30.343 114.990 1.00 0.00 H ATOM 1595 HB2 LYS A 101 53.109 31.872 115.198 1.00 0.00 H ATOM 1596 HB3 LYS A 101 52.091 31.683 116.645 1.00 0.00 H ATOM 1597 HG2 LYS A 101 52.210 29.192 116.298 1.00 0.00 H ATOM 1598 HG3 LYS A 101 53.406 29.492 115.014 1.00 0.00 H ATOM 1599 HD2 LYS A 101 54.638 30.910 116.828 1.00 0.00 H ATOM 1600 HD3 LYS A 101 53.625 30.014 117.984 1.00 0.00 H ATOM 1601 HE2 LYS A 101 55.906 29.038 117.593 1.00 0.00 H ATOM 1602 HE3 LYS A 101 55.411 28.702 115.917 1.00 0.00 H ATOM 1603 HZ1 LYS A 101 54.121 27.622 118.362 1.00 0.00 H ATOM 1604 HZ2 LYS A 101 53.648 27.301 116.761 1.00 0.00 H ATOM 1605 HZ3 LYS A 101 55.163 26.774 117.322 1.00 0.00 H ATOM 1606 H LYS A 101 51.838 31.976 112.882 1.00 0.00 H ATOM 1607 N TYR A 102 50.609 33.631 114.700 1.00 36.30 N ATOM 1608 CA TYR A 102 49.884 34.837 115.109 1.00 31.88 C ATOM 1609 C TYR A 102 49.723 35.884 113.997 1.00 29.08 C ATOM 1610 O TYR A 102 50.470 35.931 113.013 1.00 31.82 O ATOM 1611 CB TYR A 102 50.564 35.490 116.325 1.00 32.94 C ATOM 1612 CG TYR A 102 51.833 36.224 115.945 1.00 35.17 C ATOM 1613 CD1 TYR A 102 53.042 35.553 115.863 1.00 37.43 C ATOM 1614 CD2 TYR A 102 51.817 37.578 115.649 1.00 37.60 C ATOM 1615 CE1 TYR A 102 54.205 36.215 115.499 1.00 41.91 C ATOM 1616 CE2 TYR A 102 52.977 38.248 115.279 1.00 40.30 C ATOM 1617 CZ TYR A 102 54.165 37.558 115.210 1.00 45.08 C ATOM 1618 OH TYR A 102 55.328 38.213 114.854 1.00 44.95 O ATOM 1619 HA TYR A 102 48.881 34.496 115.366 1.00 0.00 H ATOM 1620 HB3 TYR A 102 50.811 34.713 117.049 1.00 0.00 H ATOM 1621 HB2 TYR A 102 49.870 36.199 116.777 1.00 0.00 H ATOM 1622 HD2 TYR A 102 50.877 38.127 115.708 1.00 0.00 H ATOM 1623 HE2 TYR A 102 52.946 39.312 115.045 1.00 0.00 H ATOM 1624 HE1 TYR A 102 55.148 35.672 115.442 1.00 0.00 H ATOM 1625 HD1 TYR A 102 53.080 34.487 116.088 1.00 0.00 H ATOM 1626 HH TYR A 102 55.510 38.937 115.504 1.00 0.00 H ATOM 1627 H TYR A 102 51.417 33.707 114.050 1.00 0.00 H ATOM 1628 N LEU A 103 48.727 36.741 114.181 1.00 28.95 N ATOM 1629 CA LEU A 103 48.537 37.871 113.298 1.00 27.53 C ATOM 1630 C LEU A 103 47.972 39.016 114.111 1.00 25.33 C ATOM 1631 O LEU A 103 47.035 38.846 114.898 1.00 29.02 O ATOM 1632 CB LEU A 103 47.595 37.500 112.137 1.00 28.15 C ATOM 1633 CG LEU A 103 47.487 38.580 111.047 1.00 32.34 C ATOM 1634 CD1 LEU A 103 47.229 37.929 109.682 1.00 33.94 C ATOM 1635 CD2 LEU A 103 46.370 39.599 111.370 1.00 25.99 C ATOM 1636 HA LEU A 103 49.489 38.167 112.859 1.00 0.00 H ATOM 1637 HB2 LEU A 103 47.964 36.584 111.676 1.00 0.00 H ATOM 1638 HB3 LEU A 103 46.600 37.325 112.546 1.00 0.00 H ATOM 1639 HG LEU A 103 48.434 39.119 111.015 1.00 0.00 H ATOM 1640 HD21 LEU A 103 45.414 39.079 111.438 1.00 0.00 H ATOM 1641 HD22 LEU A 103 46.588 40.087 112.320 1.00 0.00 H ATOM 1642 HD23 LEU A 103 46.322 40.347 110.579 1.00 0.00 H ATOM 1643 HD11 LEU A 103 48.052 37.257 109.440 1.00 0.00 H ATOM 1644 HD12 LEU A 103 46.297 37.365 109.720 1.00 0.00 H ATOM 1645 HD13 LEU A 103 47.155 38.704 108.919 1.00 0.00 H ATOM 1646 H LEU A 103 48.071 36.598 114.975 1.00 0.00 H ATOM 1647 N LEU A 104 48.585 40.189 113.950 1.00 28.15 N ATOM 1648 CA LEU A 104 48.117 41.374 114.658 1.00 29.87 C ATOM 1649 C LEU A 104 47.496 42.310 113.636 1.00 29.33 C ATOM 1650 O LEU A 104 48.084 42.562 112.587 1.00 28.74 O ATOM 1651 CB LEU A 104 49.280 42.090 115.366 1.00 30.28 C ATOM 1652 CG LEU A 104 50.190 41.260 116.273 1.00 30.26 C ATOM 1653 CD1 LEU A 104 51.278 42.158 116.858 1.00 32.16 C ATOM 1654 CD2 LEU A 104 49.421 40.570 117.411 1.00 27.82 C ATOM 1655 HA LEU A 104 47.391 41.082 115.417 1.00 0.00 H ATOM 1656 HB2 LEU A 104 49.908 42.531 114.592 1.00 0.00 H ATOM 1657 HB3 LEU A 104 48.849 42.883 115.977 1.00 0.00 H ATOM 1658 HG LEU A 104 50.632 40.474 115.661 1.00 0.00 H ATOM 1659 HD21 LEU A 104 48.932 41.325 118.027 1.00 0.00 H ATOM 1660 HD22 LEU A 104 48.670 39.902 116.988 1.00 0.00 H ATOM 1661 HD23 LEU A 104 50.117 39.996 118.022 1.00 0.00 H ATOM 1662 HD11 LEU A 104 51.866 42.589 116.048 1.00 0.00 H ATOM 1663 HD12 LEU A 104 50.815 42.957 117.438 1.00 0.00 H ATOM 1664 HD13 LEU A 104 51.927 41.567 117.504 1.00 0.00 H ATOM 1665 H LEU A 104 49.404 40.259 113.313 1.00 0.00 H ATOM 1666 N PHE A 105 46.293 42.801 113.909 1.00 27.10 N ATOM 1667 CA PHE A 105 45.689 43.764 112.992 1.00 26.34 C ATOM 1668 C PHE A 105 44.962 44.829 113.768 1.00 30.62 C ATOM 1669 O PHE A 105 44.586 44.641 114.929 1.00 30.97 O ATOM 1670 CB PHE A 105 44.704 43.096 112.030 1.00 27.11 C ATOM 1671 CG PHE A 105 43.375 42.758 112.662 1.00 31.84 C ATOM 1672 CD1 PHE A 105 43.155 41.503 113.226 1.00 31.05 C ATOM 1673 CD2 PHE A 105 42.339 43.688 112.693 1.00 31.87 C ATOM 1674 CE1 PHE A 105 41.933 41.178 113.796 1.00 31.38 C ATOM 1675 CE2 PHE A 105 41.116 43.378 113.290 1.00 37.04 C ATOM 1676 CZ PHE A 105 40.910 42.119 113.846 1.00 35.61 C ATOM 1677 HA PHE A 105 46.498 44.204 112.408 1.00 0.00 H ATOM 1678 HB2 PHE A 105 44.526 43.773 111.194 1.00 0.00 H ATOM 1679 HB3 PHE A 105 45.154 42.175 111.661 1.00 0.00 H ATOM 1680 HD2 PHE A 105 42.485 44.671 112.245 1.00 0.00 H ATOM 1681 HE2 PHE A 105 40.321 44.123 113.321 1.00 0.00 H ATOM 1682 HZ PHE A 105 39.958 41.873 114.315 1.00 0.00 H ATOM 1683 HE1 PHE A 105 41.774 40.181 114.207 1.00 0.00 H ATOM 1684 HD1 PHE A 105 43.957 40.764 113.219 1.00 0.00 H ATOM 1685 H PHE A 105 45.786 42.503 114.767 1.00 0.00 H ATOM 1686 N CYS A 106 44.709 45.941 113.092 1.00 28.46 N ATOM 1687 CA CYS A 106 43.980 47.053 113.698 1.00 25.88 C ATOM 1688 C CYS A 106 42.953 47.538 112.681 1.00 25.96 C ATOM 1689 O CYS A 106 43.185 47.457 111.469 1.00 33.36 O ATOM 1690 CB CYS A 106 44.945 48.200 114.030 1.00 32.50 C ATOM 1691 SG CYS A 106 45.895 48.014 115.556 1.00 43.93 S ATOM 1692 HA CYS A 106 43.497 46.729 114.620 1.00 0.00 H ATOM 1693 HB2 CYS A 106 44.360 49.116 114.110 1.00 0.00 H ATOM 1694 HB3 CYS A 106 45.652 48.292 113.205 1.00 0.00 H ATOM 1695 HG CYS A 106 46.240 49.266 115.089 1.00 0.00 H ATOM 1696 H CYS A 106 45.037 46.024 112.108 1.00 0.00 H ATOM 1697 N MET A 107 41.820 48.039 113.162 1.00 31.44 N ATOM 1698 CA MET A 107 40.883 48.720 112.272 1.00 36.65 C ATOM 1699 C MET A 107 40.722 50.152 112.762 1.00 30.97 C ATOM 1700 O MET A 107 40.459 50.387 113.943 1.00 31.89 O ATOM 1701 CB MET A 107 39.524 48.020 112.253 1.00 39.16 C ATOM 1702 CG MET A 107 38.691 48.387 111.028 1.00 53.94 C ATOM 1703 SD MET A 107 36.974 47.898 111.229 1.00 64.53 S ATOM 1704 CE MET A 107 36.255 48.415 109.670 1.00100.26 C ATOM 1705 HA MET A 107 41.274 48.701 111.255 1.00 0.00 H ATOM 1706 HB2 MET A 107 39.686 46.942 112.255 1.00 0.00 H ATOM 1707 HB3 MET A 107 38.972 48.305 113.149 1.00 0.00 H ATOM 1708 HG2 MET A 107 39.104 47.882 110.155 1.00 0.00 H ATOM 1709 HG3 MET A 107 38.737 49.466 110.878 1.00 0.00 H ATOM 1710 HE1 MET A 107 36.382 49.491 109.552 1.00 0.00 H ATOM 1711 HE2 MET A 107 36.754 47.897 108.851 1.00 0.00 H ATOM 1712 HE3 MET A 107 35.193 48.170 109.662 1.00 0.00 H ATOM 1713 H MET A 107 41.600 47.946 114.174 1.00 0.00 H ATOM 1714 N GLU A 108 40.878 51.116 111.861 1.00 32.40 N ATOM 1715 CA GLU A 108 40.858 52.510 112.273 1.00 40.59 C ATOM 1716 C GLU A 108 39.964 53.352 111.378 1.00 51.09 C ATOM 1717 O GLU A 108 39.798 53.036 110.198 1.00 41.44 O ATOM 1718 CB GLU A 108 42.279 53.089 112.282 1.00 48.58 C ATOM 1719 CG GLU A 108 42.868 53.389 110.919 1.00 62.53 C ATOM 1720 CD GLU A 108 44.126 54.238 111.012 1.00 75.58 C ATOM 1721 OE1 GLU A 108 45.021 53.888 111.811 1.00 77.02 O ATOM 1722 OE2 GLU A 108 44.221 55.252 110.286 1.00 84.00 O ATOM 1723 HA GLU A 108 40.448 52.542 113.283 1.00 0.00 H ATOM 1724 HB2 GLU A 108 42.260 54.018 112.852 1.00 0.00 H ATOM 1725 HB3 GLU A 108 42.931 52.372 112.780 1.00 0.00 H ATOM 1726 HG2 GLU A 108 43.115 52.448 110.428 1.00 0.00 H ATOM 1727 HG3 GLU A 108 42.126 53.924 110.326 1.00 0.00 H ATOM 1728 H GLU A 108 41.015 50.873 110.859 1.00 0.00 H ATOM 1729 N ASN A 109 39.386 54.410 111.942 1.00 60.20 N ATOM 1730 CA ASN A 109 38.645 55.385 111.145 1.00 69.68 C ATOM 1731 C ASN A 109 39.578 56.436 110.557 1.00 67.90 C ATOM 1732 O ASN A 109 40.675 56.655 111.067 1.00 72.21 O ATOM 1733 CB ASN A 109 37.565 56.068 111.987 1.00 75.12 C ATOM 1734 CG ASN A 109 36.603 56.897 111.140 1.00 86.16 C ATOM 1735 OD1 ASN A 109 36.951 57.369 110.053 1.00 84.15 O ATOM 1736 ND2 ASN A 109 35.384 57.074 111.640 1.00 93.41 N ATOM 1737 HA ASN A 109 38.168 54.845 110.327 1.00 0.00 H ATOM 1738 HB2 ASN A 109 36.996 55.302 112.515 1.00 0.00 H ATOM 1739 HB3 ASN A 109 38.048 56.724 112.711 1.00 0.00 H ATOM 1740 HD22 ASN A 109 35.134 56.658 112.560 1.00 0.00 H ATOM 1741 HD21 ASN A 109 34.681 57.628 111.111 1.00 0.00 H ATOM 1742 H ASN A 109 39.463 54.545 112.970 1.00 0.00 H TER 1743 ASN A 109 ATOM 1744 N GLN A 115 39.407 60.026 116.143 1.00 80.76 N ATOM 1745 CA GLN A 115 40.181 58.901 115.628 1.00 87.12 C ATOM 1746 C GLN A 115 40.006 57.687 116.528 1.00 77.45 C ATOM 1747 O GLN A 115 40.587 57.623 117.612 1.00 69.94 O ATOM 1748 CB GLN A 115 41.665 59.269 115.525 1.00100.18 C ATOM 1749 CG GLN A 115 41.983 60.308 114.454 1.00110.13 C ATOM 1750 CD GLN A 115 43.348 60.951 114.647 1.00119.14 C ATOM 1751 OE1 GLN A 115 43.871 61.003 115.762 1.00120.81 O ATOM 1752 NE2 GLN A 115 43.929 61.445 113.561 1.00123.80 N ATOM 1753 HA GLN A 115 39.814 58.659 114.631 1.00 0.00 H ATOM 1754 HB2 GLN A 115 41.987 59.663 116.489 1.00 0.00 H ATOM 1755 HB3 GLN A 115 42.227 58.363 115.299 1.00 0.00 H ATOM 1756 HG2 GLN A 115 41.961 59.822 113.479 1.00 0.00 H ATOM 1757 HG3 GLN A 115 41.222 61.088 114.487 1.00 0.00 H ATOM 1758 HE22 GLN A 115 43.451 61.379 112.640 1.00 0.00 H ATOM 1759 HE21 GLN A 115 44.862 61.898 113.631 1.00 0.00 H ATOM 1760 HN3 GLN A 115 39.736 60.262 117.101 1.00 0.00 H ATOM 1761 HN2 GLN A 115 38.400 59.767 116.174 1.00 0.00 H ATOM 1762 HN1 GLN A 115 39.535 60.848 115.519 1.00 0.00 H ATOM 1763 N SER A 116 39.199 56.728 116.083 1.00 61.73 N ATOM 1764 CA SER A 116 38.923 55.539 116.892 1.00 59.16 C ATOM 1765 C SER A 116 39.585 54.309 116.286 1.00 62.27 C ATOM 1766 O SER A 116 39.841 54.253 115.081 1.00 58.99 O ATOM 1767 CB SER A 116 37.420 55.305 117.044 1.00 59.37 C ATOM 1768 OG SER A 116 36.874 54.736 115.871 1.00 70.15 O ATOM 1769 HA SER A 116 39.342 55.712 117.883 1.00 0.00 H ATOM 1770 HB2 SER A 116 36.929 56.258 117.240 1.00 0.00 H ATOM 1771 HB3 SER A 116 37.247 54.629 117.882 1.00 0.00 H ATOM 1772 HG SER A 116 35.902 54.595 115.996 1.00 0.00 H ATOM 1773 H SER A 116 38.757 56.824 115.146 1.00 0.00 H ATOM 1774 N LEU A 117 39.839 53.316 117.130 1.00 38.98 N ATOM 1775 CA LEU A 117 40.760 52.240 116.787 1.00 41.16 C ATOM 1776 C LEU A 117 40.414 50.975 117.565 1.00 30.54 C ATOM 1777 O LEU A 117 40.136 51.053 118.751 1.00 31.49 O ATOM 1778 CB LEU A 117 42.160 52.710 117.187 1.00 48.49 C ATOM 1779 CG LEU A 117 43.405 51.929 116.795 1.00 51.54 C ATOM 1780 CD1 LEU A 117 43.501 51.835 115.296 1.00 62.49 C ATOM 1781 CD2 LEU A 117 44.633 52.626 117.356 1.00 52.01 C ATOM 1782 HA LEU A 117 40.701 52.012 115.723 1.00 0.00 H ATOM 1783 HB2 LEU A 117 42.280 53.709 116.769 1.00 0.00 H ATOM 1784 HB3 LEU A 117 42.165 52.770 118.275 1.00 0.00 H ATOM 1785 HG LEU A 117 43.346 50.920 117.204 1.00 0.00 H ATOM 1786 HD21 LEU A 117 44.693 53.636 116.951 1.00 0.00 H ATOM 1787 HD22 LEU A 117 44.558 52.673 118.442 1.00 0.00 H ATOM 1788 HD23 LEU A 117 45.526 52.067 117.076 1.00 0.00 H ATOM 1789 HD11 LEU A 117 42.619 51.325 114.908 1.00 0.00 H ATOM 1790 HD12 LEU A 117 43.558 52.838 114.873 1.00 0.00 H ATOM 1791 HD13 LEU A 117 44.395 51.274 115.025 1.00 0.00 H ATOM 1792 H LEU A 117 39.370 53.306 118.058 1.00 0.00 H ATOM 1793 N VAL A 118 40.391 49.834 116.874 1.00 33.98 N ATOM 1794 CA VAL A 118 40.250 48.537 117.528 1.00 32.15 C ATOM 1795 C VAL A 118 41.297 47.597 116.955 1.00 32.50 C ATOM 1796 O VAL A 118 41.513 47.554 115.749 1.00 34.49 O ATOM 1797 CB VAL A 118 38.830 47.940 117.366 1.00 34.59 C ATOM 1798 CG1 VAL A 118 38.468 47.763 115.900 1.00 35.43 C ATOM 1799 CG2 VAL A 118 38.714 46.620 118.118 1.00 36.40 C ATOM 1800 HA VAL A 118 40.401 48.670 118.599 1.00 0.00 H ATOM 1801 HB VAL A 118 38.119 48.645 117.798 1.00 0.00 H ATOM 1802 HG11 VAL A 118 38.496 48.731 115.401 1.00 0.00 H ATOM 1803 HG12 VAL A 118 39.184 47.089 115.429 1.00 0.00 H ATOM 1804 HG13 VAL A 118 37.465 47.342 115.823 1.00 0.00 H ATOM 1805 HG21 VAL A 118 39.442 45.912 117.722 1.00 0.00 H ATOM 1806 HG22 VAL A 118 38.908 46.788 119.177 1.00 0.00 H ATOM 1807 HG23 VAL A 118 37.709 46.218 117.991 1.00 0.00 H ATOM 1808 H VAL A 118 40.476 49.870 115.838 1.00 0.00 H ATOM 1809 N CYS A 119 41.987 46.869 117.828 1.00 24.43 N ATOM 1810 CA CYS A 119 43.023 45.963 117.339 1.00 26.63 C ATOM 1811 C CYS A 119 42.864 44.604 117.986 1.00 24.93 C ATOM 1812 O CYS A 119 42.310 44.501 119.088 1.00 27.45 O ATOM 1813 CB CYS A 119 44.419 46.489 117.695 1.00 29.63 C ATOM 1814 SG CYS A 119 44.765 48.208 117.245 1.00 38.62 S ATOM 1815 HA CYS A 119 42.919 45.892 116.256 1.00 0.00 H ATOM 1816 HB2 CYS A 119 45.151 45.859 117.189 1.00 0.00 H ATOM 1817 HB3 CYS A 119 44.545 46.396 118.774 1.00 0.00 H ATOM 1818 HG CYS A 119 45.570 48.052 118.355 1.00 0.00 H ATOM 1819 H CYS A 119 41.791 46.944 118.847 1.00 0.00 H ATOM 1820 N GLN A 120 43.389 43.582 117.323 1.00 26.40 N ATOM 1821 CA GLN A 120 43.345 42.247 117.893 1.00 23.68 C ATOM 1822 C GLN A 120 44.635 41.485 117.718 1.00 28.52 C ATOM 1823 O GLN A 120 45.408 41.734 116.805 1.00 29.25 O ATOM 1824 CB GLN A 120 42.207 41.418 117.272 1.00 24.91 C ATOM 1825 CG GLN A 120 40.821 41.967 117.493 1.00 32.39 C ATOM 1826 CD GLN A 120 39.766 40.963 117.112 1.00 36.32 C ATOM 1827 OE1 GLN A 120 40.088 39.890 116.595 1.00 30.37 O ATOM 1828 NE2 GLN A 120 38.497 41.290 117.381 1.00 33.71 N ATOM 1829 HA GLN A 120 43.174 42.393 118.960 1.00 0.00 H ATOM 1830 HB2 GLN A 120 42.380 41.359 116.197 1.00 0.00 H ATOM 1831 HB3 GLN A 120 42.246 40.417 117.700 1.00 0.00 H ATOM 1832 HG2 GLN A 120 40.704 42.223 118.546 1.00 0.00 H ATOM 1833 HG3 GLN A 120 40.693 42.864 116.886 1.00 0.00 H ATOM 1834 HE22 GLN A 120 38.278 42.208 117.818 1.00 0.00 H ATOM 1835 HE21 GLN A 120 37.729 40.626 117.153 1.00 0.00 H ATOM 1836 H GLN A 120 43.832 43.737 116.395 1.00 0.00 H ATOM 1837 N CYS A 121 44.825 40.514 118.605 1.00 27.16 N ATOM 1838 CA CYS A 121 45.874 39.536 118.464 1.00 26.20 C ATOM 1839 C CYS A 121 45.182 38.255 118.065 1.00 28.27 C ATOM 1840 O CYS A 121 44.444 37.692 118.872 1.00 28.47 O ATOM 1841 CB CYS A 121 46.548 39.325 119.818 1.00 25.68 C ATOM 1842 SG CYS A 121 47.877 38.103 119.740 1.00 33.25 S ATOM 1843 HA CYS A 121 46.625 39.847 117.738 1.00 0.00 H ATOM 1844 HB2 CYS A 121 45.799 38.984 120.533 1.00 0.00 H ATOM 1845 HB3 CYS A 121 46.964 40.275 120.155 1.00 0.00 H ATOM 1846 HG CYS A 121 48.442 37.960 120.991 1.00 0.00 H ATOM 1847 H CYS A 121 44.194 40.458 119.430 1.00 0.00 H ATOM 1848 N LEU A 122 45.385 37.816 116.822 1.00 27.65 N ATOM 1849 CA LEU A 122 44.855 36.534 116.354 1.00 27.22 C ATOM 1850 C LEU A 122 45.902 35.438 116.509 1.00 33.22 C ATOM 1851 O LEU A 122 47.085 35.687 116.304 1.00 31.06 O ATOM 1852 CB LEU A 122 44.485 36.623 114.870 1.00 27.91 C ATOM 1853 CG LEU A 122 43.479 37.712 114.503 1.00 33.40 C ATOM 1854 CD1 LEU A 122 43.143 37.615 113.014 1.00 33.72 C ATOM 1855 CD2 LEU A 122 42.223 37.592 115.354 1.00 32.00 C ATOM 1856 HA LEU A 122 43.974 36.300 116.951 1.00 0.00 H ATOM 1857 HB2 LEU A 122 45.400 36.808 114.307 1.00 0.00 H ATOM 1858 HB3 LEU A 122 44.064 35.663 114.571 1.00 0.00 H ATOM 1859 HG LEU A 122 43.920 38.689 114.702 1.00 0.00 H ATOM 1860 HD21 LEU A 122 41.765 36.617 115.188 1.00 0.00 H ATOM 1861 HD22 LEU A 122 42.487 37.696 116.406 1.00 0.00 H ATOM 1862 HD23 LEU A 122 41.521 38.378 115.075 1.00 0.00 H ATOM 1863 HD11 LEU A 122 44.053 37.747 112.428 1.00 0.00 H ATOM 1864 HD12 LEU A 122 42.713 36.636 112.803 1.00 0.00 H ATOM 1865 HD13 LEU A 122 42.425 38.393 112.753 1.00 0.00 H ATOM 1866 H LEU A 122 45.937 38.403 116.165 1.00 0.00 H ATOM 1867 N VAL A 123 45.467 34.231 116.874 1.00 30.37 N ATOM 1868 CA VAL A 123 46.366 33.076 116.928 1.00 32.69 C ATOM 1869 C VAL A 123 45.731 31.889 116.194 1.00 35.39 C ATOM 1870 O VAL A 123 44.514 31.865 115.992 1.00 31.65 O ATOM 1871 CB VAL A 123 46.751 32.700 118.376 1.00 39.56 C ATOM 1872 CG1 VAL A 123 47.548 33.843 119.032 1.00 31.76 C ATOM 1873 CG2 VAL A 123 45.502 32.366 119.199 1.00 35.29 C ATOM 1874 HA VAL A 123 47.294 33.349 116.425 1.00 0.00 H ATOM 1875 HB VAL A 123 47.383 31.812 118.346 1.00 0.00 H ATOM 1876 HG11 VAL A 123 48.456 34.027 118.458 1.00 0.00 H ATOM 1877 HG12 VAL A 123 46.938 34.746 119.049 1.00 0.00 H ATOM 1878 HG13 VAL A 123 47.811 33.562 120.052 1.00 0.00 H ATOM 1879 HG21 VAL A 123 44.842 33.233 119.223 1.00 0.00 H ATOM 1880 HG22 VAL A 123 44.982 31.524 118.742 1.00 0.00 H ATOM 1881 HG23 VAL A 123 45.797 32.104 120.215 1.00 0.00 H ATOM 1882 H VAL A 123 44.466 34.107 117.126 1.00 0.00 H ATOM 1883 N ARG A 124 46.548 30.925 115.773 1.00 34.10 N ATOM 1884 CA ARG A 124 46.044 29.801 114.973 1.00 31.92 C ATOM 1885 C ARG A 124 45.327 28.744 115.802 1.00 38.78 C ATOM 1886 O ARG A 124 44.519 27.975 115.271 1.00 36.47 O ATOM 1887 CB ARG A 124 47.170 29.147 114.158 1.00 34.57 C ATOM 1888 CG ARG A 124 47.714 30.041 113.025 1.00 43.40 C ATOM 1889 CD ARG A 124 46.695 30.231 111.914 1.00 42.79 C ATOM 1890 NE ARG A 124 47.297 30.659 110.646 1.00 37.70 N ATOM 1891 CZ ARG A 124 46.622 30.752 109.502 1.00 47.53 C ATOM 1892 NH1 ARG A 124 45.329 30.451 109.475 1.00 43.63 N ATOM 1893 NH2 ARG A 124 47.235 31.143 108.387 1.00 42.72 N ATOM 1894 HA ARG A 124 45.308 30.232 114.294 1.00 0.00 H ATOM 1895 HB2 ARG A 124 47.991 28.909 114.834 1.00 0.00 H ATOM 1896 HB3 ARG A 124 46.786 28.227 113.717 1.00 0.00 H ATOM 1897 HG2 ARG A 124 47.971 31.016 113.438 1.00 0.00 H ATOM 1898 HG3 ARG A 124 48.608 29.577 112.608 1.00 0.00 H ATOM 1899 HD2 ARG A 124 45.975 30.987 112.229 1.00 0.00 H ATOM 1900 HD3 ARG A 124 46.179 29.285 111.751 1.00 0.00 H ATOM 1901 HE ARG A 124 48.308 30.903 110.641 1.00 0.00 H ATOM 1902 HH12 ARG A 124 44.797 30.522 108.584 1.00 0.00 H ATOM 1903 HH11 ARG A 124 44.848 30.144 110.345 1.00 0.00 H ATOM 1904 HH22 ARG A 124 46.701 31.213 107.497 1.00 0.00 H ATOM 1905 HH21 ARG A 124 48.248 31.378 108.406 1.00 0.00 H ATOM 1906 H ARG A 124 47.559 30.969 116.015 1.00 0.00 H ATOM 1907 N THR A 125 45.616 28.709 117.101 1.00 34.71 N ATOM 1908 CA THR A 125 45.149 27.621 117.962 1.00 35.30 C ATOM 1909 C THR A 125 44.568 28.188 119.251 1.00 31.41 C ATOM 1910 O THR A 125 44.950 29.275 119.660 1.00 35.78 O ATOM 1911 CB THR A 125 46.315 26.686 118.334 1.00 36.66 C ATOM 1912 OG1 THR A 125 47.334 27.445 118.998 1.00 44.05 O ATOM 1913 CG2 THR A 125 46.893 26.040 117.082 1.00 46.28 C ATOM 1914 HA THR A 125 44.388 27.064 117.415 1.00 0.00 H ATOM 1915 HB THR A 125 45.948 25.901 118.996 1.00 0.00 H ATOM 1916 HG1 THR A 125 47.659 28.158 118.394 1.00 0.00 H ATOM 1917 HG23 THR A 125 46.116 25.464 116.580 1.00 0.00 H ATOM 1918 HG21 THR A 125 47.262 26.816 116.412 1.00 0.00 H ATOM 1919 HG22 THR A 125 47.714 25.379 117.361 1.00 0.00 H ATOM 1920 H THR A 125 46.188 29.473 117.514 1.00 0.00 H ATOM 1921 N PRO A 126 43.667 27.433 119.907 1.00 38.68 N ATOM 1922 CA PRO A 126 43.059 27.905 121.156 1.00 33.72 C ATOM 1923 C PRO A 126 44.007 27.693 122.333 1.00 43.26 C ATOM 1924 O PRO A 126 43.729 26.875 123.218 1.00 41.70 O ATOM 1925 CB PRO A 126 41.828 26.995 121.302 1.00 40.44 C ATOM 1926 CG PRO A 126 42.216 25.736 120.622 1.00 45.49 C ATOM 1927 CD PRO A 126 43.109 26.133 119.474 1.00 41.58 C ATOM 1928 HA PRO A 126 42.821 28.969 121.141 1.00 0.00 H ATOM 1929 HD3 PRO A 126 43.901 25.399 119.323 1.00 0.00 H ATOM 1930 HD2 PRO A 126 42.536 26.241 118.553 1.00 0.00 H ATOM 1931 HG3 PRO A 126 41.331 25.219 120.251 1.00 0.00 H ATOM 1932 HG2 PRO A 126 42.754 25.085 121.311 1.00 0.00 H ATOM 1933 HB2 PRO A 126 41.605 26.813 122.353 1.00 0.00 H ATOM 1934 HB3 PRO A 126 40.959 27.442 120.820 1.00 0.00 H ATOM 1935 N GLU A 127 45.119 28.422 122.327 1.00 34.98 N ATOM 1936 CA GLU A 127 46.116 28.357 123.384 1.00 33.39 C ATOM 1937 C GLU A 127 46.520 29.783 123.670 1.00 37.47 C ATOM 1938 O GLU A 127 46.499 30.621 122.774 1.00 38.46 O ATOM 1939 CB GLU A 127 47.362 27.612 122.904 1.00 40.84 C ATOM 1940 CG GLU A 127 47.133 26.183 122.464 1.00 52.02 C ATOM 1941 CD GLU A 127 48.423 25.508 122.033 1.00 60.12 C ATOM 1942 OE1 GLU A 127 48.865 25.749 120.883 1.00 59.93 O ATOM 1943 OE2 GLU A 127 48.992 24.746 122.845 1.00 59.01 O ATOM 1944 HA GLU A 127 45.710 27.843 124.255 1.00 0.00 H ATOM 1945 HB2 GLU A 127 47.779 28.162 122.060 1.00 0.00 H ATOM 1946 HB3 GLU A 127 48.084 27.601 123.721 1.00 0.00 H ATOM 1947 HG2 GLU A 127 46.703 25.623 123.294 1.00 0.00 H ATOM 1948 HG3 GLU A 127 46.436 26.180 121.626 1.00 0.00 H ATOM 1949 H GLU A 127 45.284 29.069 121.529 1.00 0.00 H ATOM 1950 N VAL A 128 46.896 30.066 124.906 1.00 41.95 N ATOM 1951 CA VAL A 128 47.394 31.399 125.213 1.00 46.33 C ATOM 1952 C VAL A 128 48.856 31.476 124.779 1.00 48.44 C ATOM 1953 O VAL A 128 49.711 30.759 125.310 1.00 46.23 O ATOM 1954 CB VAL A 128 47.215 31.737 126.701 1.00 53.41 C ATOM 1955 CG1 VAL A 128 47.551 33.194 126.956 1.00 50.57 C ATOM 1956 CG2 VAL A 128 45.772 31.471 127.107 1.00 46.92 C ATOM 1957 HA VAL A 128 46.817 32.145 124.666 1.00 0.00 H ATOM 1958 HB VAL A 128 47.887 31.113 127.290 1.00 0.00 H ATOM 1959 HG11 VAL A 128 48.586 33.382 126.670 1.00 0.00 H ATOM 1960 HG12 VAL A 128 46.889 33.827 126.365 1.00 0.00 H ATOM 1961 HG13 VAL A 128 47.419 33.416 128.015 1.00 0.00 H ATOM 1962 HG21 VAL A 128 45.107 32.093 126.508 1.00 0.00 H ATOM 1963 HG22 VAL A 128 45.537 30.420 126.940 1.00 0.00 H ATOM 1964 HG23 VAL A 128 45.643 31.710 128.163 1.00 0.00 H ATOM 1965 H VAL A 128 46.836 29.343 125.651 1.00 0.00 H ATOM 1966 N ASP A 129 49.127 32.319 123.785 1.00 43.27 N ATOM 1967 CA ASP A 129 50.474 32.482 123.257 1.00 42.25 C ATOM 1968 C ASP A 129 51.059 33.742 123.891 1.00 40.56 C ATOM 1969 O ASP A 129 50.760 34.863 123.450 1.00 39.87 O ATOM 1970 CB ASP A 129 50.411 32.621 121.729 1.00 47.82 C ATOM 1971 CG ASP A 129 51.772 32.548 121.066 1.00 52.98 C ATOM 1972 OD1 ASP A 129 52.779 32.971 121.678 1.00 58.68 O ATOM 1973 OD2 ASP A 129 51.832 32.074 119.912 1.00 57.26 O ATOM 1974 HA ASP A 129 51.099 31.620 123.490 1.00 0.00 H ATOM 1975 HB2 ASP A 129 49.789 31.818 121.333 1.00 0.00 H ATOM 1976 HB3 ASP A 129 49.958 33.583 121.487 1.00 0.00 H ATOM 1977 H ASP A 129 48.353 32.878 123.373 1.00 0.00 H ATOM 1978 N ASP A 130 51.861 33.559 124.940 1.00 43.82 N ATOM 1979 CA ASP A 130 52.468 34.688 125.645 1.00 47.81 C ATOM 1980 C ASP A 130 53.330 35.537 124.707 1.00 46.75 C ATOM 1981 O ASP A 130 53.438 36.753 124.877 1.00 46.04 O ATOM 1982 CB ASP A 130 53.300 34.207 126.834 1.00 62.58 C ATOM 1983 CG ASP A 130 52.445 33.818 128.029 1.00 69.87 C ATOM 1984 OD1 ASP A 130 51.249 34.181 128.055 1.00 66.39 O ATOM 1985 OD2 ASP A 130 52.979 33.164 128.952 1.00 77.82 O ATOM 1986 HA ASP A 130 51.655 35.312 126.017 1.00 0.00 H ATOM 1987 HB2 ASP A 130 53.882 33.339 126.524 1.00 0.00 H ATOM 1988 HB3 ASP A 130 53.976 35.008 127.134 1.00 0.00 H ATOM 1989 H ASP A 130 52.060 32.591 125.265 1.00 0.00 H ATOM 1990 N GLU A 131 53.933 34.892 123.713 1.00 48.51 N ATOM 1991 CA GLU A 131 54.778 35.593 122.749 1.00 51.16 C ATOM 1992 C GLU A 131 53.976 36.459 121.782 1.00 43.46 C ATOM 1993 O GLU A 131 54.379 37.571 121.447 1.00 50.94 O ATOM 1994 CB GLU A 131 55.636 34.601 121.971 1.00 57.25 C ATOM 1995 CG GLU A 131 56.612 33.833 122.843 1.00 78.84 C ATOM 1996 CD GLU A 131 57.867 33.440 122.088 1.00 96.52 C ATOM 1997 OE1 GLU A 131 57.837 33.436 120.835 1.00104.49 O ATOM 1998 OE2 GLU A 131 58.886 33.146 122.750 1.00101.53 O ATOM 1999 HA GLU A 131 55.420 36.261 123.323 1.00 0.00 H ATOM 2000 HB2 GLU A 131 54.977 33.886 121.478 1.00 0.00 H ATOM 2001 HB3 GLU A 131 56.203 35.150 121.219 1.00 0.00 H ATOM 2002 HG2 GLU A 131 56.893 34.458 123.691 1.00 0.00 H ATOM 2003 HG3 GLU A 131 56.123 32.929 123.206 1.00 0.00 H ATOM 2004 H GLU A 131 53.800 33.865 123.619 1.00 0.00 H ATOM 2005 N ALA A 132 52.852 35.942 121.307 1.00 40.26 N ATOM 2006 CA ALA A 132 51.951 36.732 120.481 1.00 47.44 C ATOM 2007 C ALA A 132 51.428 37.914 121.297 1.00 37.78 C ATOM 2008 O ALA A 132 51.388 39.046 120.816 1.00 35.59 O ATOM 2009 CB ALA A 132 50.804 35.854 119.985 1.00 39.49 C ATOM 2010 HA ALA A 132 52.482 37.118 119.611 1.00 0.00 H ATOM 2011 HB1 ALA A 132 51.207 35.031 119.395 1.00 0.00 H ATOM 2012 HB2 ALA A 132 50.257 35.457 120.840 1.00 0.00 H ATOM 2013 HB3 ALA A 132 50.133 36.450 119.367 1.00 0.00 H ATOM 2014 H ALA A 132 52.610 34.955 121.528 1.00 0.00 H ATOM 2015 N LEU A 133 51.052 37.646 122.546 1.00 38.35 N ATOM 2016 CA LEU A 133 50.536 38.698 123.415 1.00 37.41 C ATOM 2017 C LEU A 133 51.558 39.797 123.729 1.00 39.48 C ATOM 2018 O LEU A 133 51.192 40.972 123.791 1.00 39.28 O ATOM 2019 CB LEU A 133 49.970 38.101 124.706 1.00 36.77 C ATOM 2020 CG LEU A 133 48.671 37.314 124.512 1.00 35.55 C ATOM 2021 CD1 LEU A 133 48.188 36.783 125.853 1.00 46.37 C ATOM 2022 CD2 LEU A 133 47.602 38.180 123.873 1.00 42.22 C ATOM 2023 HA LEU A 133 49.735 39.184 122.858 1.00 0.00 H ATOM 2024 HB2 LEU A 133 50.717 37.430 125.130 1.00 0.00 H ATOM 2025 HB3 LEU A 133 49.777 38.915 125.404 1.00 0.00 H ATOM 2026 HG LEU A 133 48.869 36.476 123.843 1.00 0.00 H ATOM 2027 HD21 LEU A 133 47.400 39.038 124.514 1.00 0.00 H ATOM 2028 HD22 LEU A 133 47.951 38.526 122.900 1.00 0.00 H ATOM 2029 HD23 LEU A 133 46.690 37.596 123.747 1.00 0.00 H ATOM 2030 HD11 LEU A 133 48.948 36.128 126.278 1.00 0.00 H ATOM 2031 HD12 LEU A 133 48.007 37.618 126.529 1.00 0.00 H ATOM 2032 HD13 LEU A 133 47.263 36.224 125.709 1.00 0.00 H ATOM 2033 H LEU A 133 51.127 36.674 122.907 1.00 0.00 H ATOM 2034 N GLU A 134 52.826 39.433 123.925 1.00 41.53 N ATOM 2035 CA GLU A 134 53.879 40.437 124.146 1.00 44.46 C ATOM 2036 C GLU A 134 54.027 41.327 122.916 1.00 45.70 C ATOM 2037 O GLU A 134 54.225 42.538 123.036 1.00 45.17 O ATOM 2038 CB GLU A 134 55.237 39.804 124.535 1.00 61.06 C ATOM 2039 CG GLU A 134 55.808 38.891 123.455 1.00 79.87 C ATOM 2040 CD GLU A 134 57.318 38.755 123.453 1.00 97.17 C ATOM 2041 OE1 GLU A 134 57.947 39.010 124.507 1.00104.49 O ATOM 2042 OE2 GLU A 134 57.876 38.384 122.391 1.00102.32 O ATOM 2043 HA GLU A 134 53.568 41.047 124.994 1.00 0.00 H ATOM 2044 HB2 GLU A 134 55.951 40.605 124.724 1.00 0.00 H ATOM 2045 HB3 GLU A 134 55.099 39.220 125.445 1.00 0.00 H ATOM 2046 HG2 GLU A 134 55.380 37.898 123.593 1.00 0.00 H ATOM 2047 HG3 GLU A 134 55.504 39.285 122.485 1.00 0.00 H ATOM 2048 H GLU A 134 53.075 38.423 123.922 1.00 0.00 H ATOM 2049 N LYS A 135 53.926 40.727 121.736 1.00 47.40 N ATOM 2050 CA LYS A 135 54.050 41.497 120.507 1.00 42.15 C ATOM 2051 C LYS A 135 52.862 42.441 120.360 1.00 39.24 C ATOM 2052 O LYS A 135 53.026 43.618 120.038 1.00 39.95 O ATOM 2053 CB LYS A 135 54.213 40.565 119.301 1.00 41.82 C ATOM 2054 CG LYS A 135 55.615 39.935 119.248 1.00 45.67 C ATOM 2055 CD LYS A 135 55.843 39.120 117.980 1.00 50.06 C ATOM 2056 CE LYS A 135 57.315 38.721 117.866 1.00 59.88 C ATOM 2057 NZ LYS A 135 57.593 37.857 116.683 1.00 60.05 N ATOM 2058 HA LYS A 135 54.949 42.111 120.553 1.00 0.00 H ATOM 2059 HB2 LYS A 135 53.471 39.769 119.368 1.00 0.00 H ATOM 2060 HB3 LYS A 135 54.049 41.138 118.388 1.00 0.00 H ATOM 2061 HG2 LYS A 135 56.358 40.731 119.290 1.00 0.00 H ATOM 2062 HG3 LYS A 135 55.737 39.280 120.111 1.00 0.00 H ATOM 2063 HD2 LYS A 135 55.228 38.221 118.014 1.00 0.00 H ATOM 2064 HD3 LYS A 135 55.563 39.718 117.112 1.00 0.00 H ATOM 2065 HE2 LYS A 135 57.599 38.178 118.768 1.00 0.00 H ATOM 2066 HE3 LYS A 135 57.916 39.627 117.784 1.00 0.00 H ATOM 2067 HZ1 LYS A 135 57.032 36.984 116.754 1.00 0.00 H ATOM 2068 HZ2 LYS A 135 57.335 38.367 115.814 1.00 0.00 H ATOM 2069 HZ3 LYS A 135 58.605 37.620 116.659 1.00 0.00 H ATOM 2070 H LYS A 135 53.757 39.702 121.690 1.00 0.00 H ATOM 2071 N PHE A 136 51.671 41.924 120.647 1.00 36.35 N ATOM 2072 CA PHE A 136 50.456 42.731 120.697 1.00 34.93 C ATOM 2073 C PHE A 136 50.627 43.910 121.657 1.00 35.37 C ATOM 2074 O PHE A 136 50.396 45.069 121.289 1.00 35.23 O ATOM 2075 CB PHE A 136 49.292 41.842 121.142 1.00 31.45 C ATOM 2076 CG PHE A 136 47.941 42.490 121.043 1.00 35.07 C ATOM 2077 CD1 PHE A 136 47.499 43.032 119.849 1.00 32.42 C ATOM 2078 CD2 PHE A 136 47.093 42.515 122.140 1.00 37.61 C ATOM 2079 CE1 PHE A 136 46.231 43.608 119.756 1.00 28.74 C ATOM 2080 CE2 PHE A 136 45.834 43.087 122.052 1.00 34.67 C ATOM 2081 CZ PHE A 136 45.400 43.621 120.859 1.00 27.37 C ATOM 2082 HA PHE A 136 50.250 43.138 119.707 1.00 0.00 H ATOM 2083 HB2 PHE A 136 49.288 40.948 120.518 1.00 0.00 H ATOM 2084 HB3 PHE A 136 49.458 41.558 122.181 1.00 0.00 H ATOM 2085 HD2 PHE A 136 47.421 42.079 123.084 1.00 0.00 H ATOM 2086 HE2 PHE A 136 45.186 43.114 122.928 1.00 0.00 H ATOM 2087 HZ PHE A 136 44.402 44.053 120.785 1.00 0.00 H ATOM 2088 HE1 PHE A 136 45.898 44.046 118.815 1.00 0.00 H ATOM 2089 HD1 PHE A 136 48.147 43.009 118.973 1.00 0.00 H ATOM 2090 H PHE A 136 51.603 40.905 120.843 1.00 0.00 H ATOM 2091 N ASP A 137 51.049 43.634 122.886 1.00 39.89 N ATOM 2092 CA ASP A 137 51.177 44.715 123.850 1.00 38.94 C ATOM 2093 C ASP A 137 52.240 45.721 123.419 1.00 41.69 C ATOM 2094 O ASP A 137 52.019 46.926 123.518 1.00 42.20 O ATOM 2095 CB ASP A 137 51.406 44.184 125.275 1.00 46.37 C ATOM 2096 CG ASP A 137 50.174 43.485 125.835 1.00 54.22 C ATOM 2097 OD1 ASP A 137 49.051 43.797 125.377 1.00 49.99 O ATOM 2098 OD2 ASP A 137 50.322 42.625 126.727 1.00 61.95 O ATOM 2099 HA ASP A 137 50.229 45.252 123.874 1.00 0.00 H ATOM 2100 HB2 ASP A 137 52.234 43.475 125.257 1.00 0.00 H ATOM 2101 HB3 ASP A 137 51.660 45.021 125.925 1.00 0.00 H ATOM 2102 H ASP A 137 51.285 42.657 123.155 1.00 0.00 H ATOM 2103 N LYS A 138 53.370 45.232 122.911 1.00 43.76 N ATOM 2104 CA LYS A 138 54.426 46.118 122.401 1.00 46.82 C ATOM 2105 C LYS A 138 53.891 47.015 121.290 1.00 45.29 C ATOM 2106 O LYS A 138 54.159 48.213 121.265 1.00 47.16 O ATOM 2107 CB LYS A 138 55.608 45.314 121.855 1.00 58.57 C ATOM 2108 CG LYS A 138 56.522 44.713 122.913 1.00 71.95 C ATOM 2109 CD LYS A 138 57.847 44.242 122.300 1.00 82.83 C ATOM 2110 CE LYS A 138 57.664 43.069 121.339 1.00 83.33 C ATOM 2111 NZ LYS A 138 57.510 41.765 122.052 1.00 78.80 N ATOM 2112 HA LYS A 138 54.763 46.730 123.238 1.00 0.00 H ATOM 2113 HB2 LYS A 138 55.212 44.500 121.248 1.00 0.00 H ATOM 2114 HB3 LYS A 138 56.206 45.975 121.228 1.00 0.00 H ATOM 2115 HG2 LYS A 138 56.730 45.466 123.673 1.00 0.00 H ATOM 2116 HG3 LYS A 138 56.021 43.862 123.374 1.00 0.00 H ATOM 2117 HD2 LYS A 138 58.295 45.073 121.756 1.00 0.00 H ATOM 2118 HD3 LYS A 138 58.515 43.934 123.105 1.00 0.00 H ATOM 2119 HE2 LYS A 138 58.536 43.011 120.688 1.00 0.00 H ATOM 2120 HE3 LYS A 138 56.773 43.246 120.736 1.00 0.00 H ATOM 2121 HZ1 LYS A 138 58.359 41.582 122.624 1.00 0.00 H ATOM 2122 HZ2 LYS A 138 56.675 41.806 122.671 1.00 0.00 H ATOM 2123 HZ3 LYS A 138 57.389 41.002 121.355 1.00 0.00 H ATOM 2124 H LYS A 138 53.508 44.202 122.874 1.00 0.00 H ATOM 2125 N ALA A 139 53.131 46.425 120.372 1.00 42.20 N ATOM 2126 CA ALA A 139 52.576 47.168 119.246 1.00 42.78 C ATOM 2127 C ALA A 139 51.653 48.270 119.737 1.00 40.83 C ATOM 2128 O ALA A 139 51.596 49.342 119.156 1.00 40.61 O ATOM 2129 CB ALA A 139 51.808 46.233 118.334 1.00 37.82 C ATOM 2130 HA ALA A 139 53.400 47.618 118.692 1.00 0.00 H ATOM 2131 HB1 ALA A 139 52.480 45.461 117.958 1.00 0.00 H ATOM 2132 HB2 ALA A 139 50.995 45.769 118.893 1.00 0.00 H ATOM 2133 HB3 ALA A 139 51.398 46.799 117.497 1.00 0.00 H ATOM 2134 H ALA A 139 52.927 45.409 120.459 1.00 0.00 H ATOM 2135 N LEU A 140 50.917 47.987 120.807 1.00 38.42 N ATOM 2136 CA LEU A 140 49.877 48.903 121.275 1.00 37.34 C ATOM 2137 C LEU A 140 50.357 49.977 122.237 1.00 45.90 C ATOM 2138 O LEU A 140 49.615 50.917 122.531 1.00 46.74 O ATOM 2139 CB LEU A 140 48.740 48.121 121.932 1.00 42.19 C ATOM 2140 CG LEU A 140 47.552 47.845 121.008 1.00 46.11 C ATOM 2141 CD1 LEU A 140 47.999 47.190 119.728 1.00 49.56 C ATOM 2142 CD2 LEU A 140 46.593 46.957 121.722 1.00 46.36 C ATOM 2143 HA LEU A 140 49.536 49.423 120.380 1.00 0.00 H ATOM 2144 HB2 LEU A 140 49.136 47.165 122.275 1.00 0.00 H ATOM 2145 HB3 LEU A 140 48.382 48.693 122.788 1.00 0.00 H ATOM 2146 HG LEU A 140 47.075 48.790 120.749 1.00 0.00 H ATOM 2147 HD21 LEU A 140 47.089 46.021 121.980 1.00 0.00 H ATOM 2148 HD22 LEU A 140 46.250 47.451 122.631 1.00 0.00 H ATOM 2149 HD23 LEU A 140 45.740 46.751 121.075 1.00 0.00 H ATOM 2150 HD11 LEU A 140 48.698 47.847 119.210 1.00 0.00 H ATOM 2151 HD12 LEU A 140 48.489 46.244 119.957 1.00 0.00 H ATOM 2152 HD13 LEU A 140 47.132 47.007 119.093 1.00 0.00 H ATOM 2153 H LEU A 140 51.084 47.098 121.321 1.00 0.00 H ATOM 2154 N LYS A 141 51.582 49.860 122.733 1.00 43.47 N ATOM 2155 CA LYS A 141 52.051 50.856 123.704 1.00 46.77 C ATOM 2156 C LYS A 141 52.185 52.221 123.043 1.00 63.17 C ATOM 2157 O LYS A 141 52.105 53.251 123.705 1.00 74.70 O ATOM 2158 CB LYS A 141 53.342 50.428 124.407 1.00 75.26 C ATOM 2159 CG LYS A 141 54.587 50.454 123.552 1.00 79.89 C ATOM 2160 CD LYS A 141 55.828 50.548 124.431 1.00 86.95 C ATOM 2161 CE LYS A 141 57.065 50.136 123.657 1.00 90.43 C ATOM 2162 NZ LYS A 141 56.905 48.757 123.118 1.00 86.69 N ATOM 2163 HA LYS A 141 51.297 50.932 124.488 1.00 0.00 H ATOM 2164 HB2 LYS A 141 53.501 51.096 125.253 1.00 0.00 H ATOM 2165 HB3 LYS A 141 53.205 49.410 124.771 1.00 0.00 H ATOM 2166 HG2 LYS A 141 54.635 49.542 122.958 1.00 0.00 H ATOM 2167 HG3 LYS A 141 54.550 51.317 122.888 1.00 0.00 H ATOM 2168 HD2 LYS A 141 55.946 51.576 124.775 1.00 0.00 H ATOM 2169 HD3 LYS A 141 55.708 49.890 125.291 1.00 0.00 H ATOM 2170 HE2 LYS A 141 57.930 50.165 124.320 1.00 0.00 H ATOM 2171 HE3 LYS A 141 57.219 50.829 122.830 1.00 0.00 H ATOM 2172 HZ1 LYS A 141 56.761 48.093 123.905 1.00 0.00 H ATOM 2173 HZ2 LYS A 141 56.082 48.728 122.483 1.00 0.00 H ATOM 2174 HZ3 LYS A 141 57.761 48.491 122.591 1.00 0.00 H ATOM 2175 H LYS A 141 52.199 49.076 122.439 1.00 0.00 H ATOM 2176 N ALA A 142 52.354 52.213 121.726 1.00 69.36 N ATOM 2177 CA ALA A 142 52.297 53.440 120.941 1.00 80.05 C ATOM 2178 C ALA A 142 50.899 54.047 121.051 1.00 74.05 C ATOM 2179 O ALA A 142 50.732 55.228 121.366 1.00 85.67 O ATOM 2180 CB ALA A 142 52.628 53.138 119.482 1.00 77.88 C ATOM 2181 HA ALA A 142 53.028 54.152 121.324 1.00 0.00 H ATOM 2182 HB1 ALA A 142 53.631 52.716 119.418 1.00 0.00 H ATOM 2183 HB2 ALA A 142 51.906 52.424 119.087 1.00 0.00 H ATOM 2184 HB3 ALA A 142 52.583 54.060 118.902 1.00 0.00 H ATOM 2185 H ALA A 142 52.531 51.309 121.243 1.00 0.00 H ATOM 2186 N LEU A 143 49.903 53.199 120.818 1.00 53.80 N ATOM 2187 CA LEU A 143 48.520 53.609 120.598 1.00 51.67 C ATOM 2188 C LEU A 143 47.773 53.992 121.887 1.00 60.37 C ATOM 2189 O LEU A 143 48.072 53.474 122.964 1.00 59.23 O ATOM 2190 CB LEU A 143 47.796 52.477 119.860 1.00 46.04 C ATOM 2191 CG LEU A 143 48.635 52.005 118.667 1.00 53.45 C ATOM 2192 CD1 LEU A 143 48.126 50.697 118.056 1.00 50.72 C ATOM 2193 CD2 LEU A 143 48.687 53.096 117.618 1.00 53.84 C ATOM 2194 HA LEU A 143 48.532 54.519 119.999 1.00 0.00 H ATOM 2195 HB2 LEU A 143 47.639 51.643 120.544 1.00 0.00 H ATOM 2196 HB3 LEU A 143 46.832 52.838 119.503 1.00 0.00 H ATOM 2197 HG LEU A 143 49.638 51.799 119.039 1.00 0.00 H ATOM 2198 HD21 LEU A 143 47.675 53.324 117.282 1.00 0.00 H ATOM 2199 HD22 LEU A 143 49.139 53.990 118.048 1.00 0.00 H ATOM 2200 HD23 LEU A 143 49.284 52.756 116.772 1.00 0.00 H ATOM 2201 HD11 LEU A 143 48.152 49.911 118.811 1.00 0.00 H ATOM 2202 HD12 LEU A 143 47.102 50.834 117.707 1.00 0.00 H ATOM 2203 HD13 LEU A 143 48.763 50.418 117.217 1.00 0.00 H ATOM 2204 H LEU A 143 50.122 52.183 120.791 1.00 0.00 H ATOM 2205 N PRO A 144 46.796 54.911 121.778 1.00 63.45 N ATOM 2206 CA PRO A 144 46.009 55.331 122.946 1.00 57.26 C ATOM 2207 C PRO A 144 44.825 54.402 123.198 1.00 47.91 C ATOM 2208 O PRO A 144 43.671 54.778 122.975 1.00 43.68 O ATOM 2209 CB PRO A 144 45.516 56.722 122.546 1.00 58.88 C ATOM 2210 CG PRO A 144 45.373 56.639 121.050 1.00 63.13 C ATOM 2211 CD PRO A 144 46.446 55.680 120.567 1.00 64.49 C ATOM 2212 HA PRO A 144 46.591 55.315 123.867 1.00 0.00 H ATOM 2213 HD3 PRO A 144 46.059 55.024 119.787 1.00 0.00 H ATOM 2214 HD2 PRO A 144 47.311 56.223 120.187 1.00 0.00 H ATOM 2215 HG3 PRO A 144 45.517 57.622 120.602 1.00 0.00 H ATOM 2216 HG2 PRO A 144 44.385 56.263 120.786 1.00 0.00 H ATOM 2217 HB2 PRO A 144 44.558 56.944 123.016 1.00 0.00 H ATOM 2218 HB3 PRO A 144 46.242 57.486 122.825 1.00 0.00 H ATOM 2219 N MET A 145 45.112 53.193 123.669 1.00 41.20 N ATOM 2220 CA MET A 145 44.063 52.223 123.960 1.00 40.14 C ATOM 2221 C MET A 145 43.574 52.441 125.379 1.00 43.53 C ATOM 2222 O MET A 145 44.338 52.908 126.228 1.00 46.01 O ATOM 2223 CB MET A 145 44.603 50.811 123.825 1.00 39.78 C ATOM 2224 CG MET A 145 45.179 50.519 122.456 1.00 56.32 C ATOM 2225 SD MET A 145 44.097 51.122 121.137 1.00 50.55 S ATOM 2226 CE MET A 145 43.628 49.568 120.413 1.00 41.81 C ATOM 2227 HA MET A 145 43.243 52.355 123.255 1.00 0.00 H ATOM 2228 HB2 MET A 145 45.387 50.668 124.568 1.00 0.00 H ATOM 2229 HB3 MET A 145 43.791 50.110 124.016 1.00 0.00 H ATOM 2230 HG2 MET A 145 45.304 49.442 122.347 1.00 0.00 H ATOM 2231 HG3 MET A 145 46.150 51.007 122.369 1.00 0.00 H ATOM 2232 HE1 MET A 145 44.519 49.050 120.059 1.00 0.00 H ATOM 2233 HE2 MET A 145 43.124 48.957 121.162 1.00 0.00 H ATOM 2234 HE3 MET A 145 42.954 49.748 119.575 1.00 0.00 H ATOM 2235 H MET A 145 46.106 52.933 123.833 1.00 0.00 H ATOM 2236 N HIS A 146 42.304 52.128 125.628 1.00 38.34 N ATOM 2237 CA HIS A 146 41.723 52.334 126.958 1.00 45.15 C ATOM 2238 C HIS A 146 40.884 51.151 127.451 1.00 37.39 C ATOM 2239 O HIS A 146 40.378 51.166 128.577 1.00 43.81 O ATOM 2240 CB HIS A 146 40.917 53.632 127.002 1.00 39.26 C ATOM 2241 CG HIS A 146 41.762 54.850 126.961 1.00 41.84 C ATOM 2242 ND1 HIS A 146 42.160 55.463 125.775 1.00 56.21 N ATOM 2243 CD2 HIS A 146 42.345 55.584 127.942 1.00 45.21 C ATOM 2244 CE1 HIS A 146 42.909 56.499 126.036 1.00 54.68 C ATOM 2245 NE2 HIS A 146 43.042 56.602 127.361 1.00 56.69 N ATOM 2246 HA HIS A 146 42.564 52.413 127.647 1.00 0.00 H ATOM 2247 HB2 HIS A 146 40.243 53.650 126.146 1.00 0.00 H ATOM 2248 HB3 HIS A 146 40.334 53.646 127.923 1.00 0.00 H ATOM 2249 HD2 HIS A 146 42.269 55.393 129.012 1.00 0.00 H ATOM 2250 HE1 HIS A 146 43.351 57.168 125.297 1.00 0.00 H ATOM 2251 H HIS A 146 41.716 51.732 124.868 1.00 0.00 H ATOM 2252 N ILE A 147 40.747 50.135 126.607 1.00 34.83 N ATOM 2253 CA ILE A 147 40.165 48.867 127.046 1.00 34.21 C ATOM 2254 C ILE A 147 40.892 47.735 126.352 1.00 33.62 C ATOM 2255 O ILE A 147 41.183 47.831 125.170 1.00 32.85 O ATOM 2256 CB ILE A 147 38.645 48.795 126.769 1.00 32.07 C ATOM 2257 CG1 ILE A 147 38.077 47.416 127.125 1.00 41.17 C ATOM 2258 CG2 ILE A 147 38.335 49.109 125.299 1.00 31.32 C ATOM 2259 CD1 ILE A 147 36.564 47.429 127.349 1.00 38.02 C ATOM 2260 HA ILE A 147 40.285 48.783 128.126 1.00 0.00 H ATOM 2261 HB ILE A 147 38.170 49.545 127.401 1.00 0.00 H ATOM 2262 HG12 ILE A 147 38.301 46.727 126.310 1.00 0.00 H ATOM 2263 HG13 ILE A 147 38.560 47.067 128.038 1.00 0.00 H ATOM 2264 HD11 ILE A 147 36.325 48.107 128.169 1.00 0.00 H ATOM 2265 HD12 ILE A 147 36.066 47.767 126.440 1.00 0.00 H ATOM 2266 HD13 ILE A 147 36.226 46.423 127.597 1.00 0.00 H ATOM 2267 HG21 ILE A 147 38.686 50.113 125.062 1.00 0.00 H ATOM 2268 HG22 ILE A 147 38.841 48.385 124.660 1.00 0.00 H ATOM 2269 HG23 ILE A 147 37.259 49.050 125.135 1.00 0.00 H ATOM 2270 H ILE A 147 41.058 50.242 125.620 1.00 0.00 H ATOM 2271 N ARG A 148 41.186 46.662 127.083 1.00 33.32 N ATOM 2272 CA ARG A 148 41.861 45.499 126.517 1.00 32.42 C ATOM 2273 C ARG A 148 41.199 44.273 127.113 1.00 32.33 C ATOM 2274 O ARG A 148 41.033 44.199 128.349 1.00 34.45 O ATOM 2275 CB ARG A 148 43.341 45.496 126.927 1.00 36.98 C ATOM 2276 CG ARG A 148 44.126 44.263 126.387 1.00 35.02 C ATOM 2277 CD ARG A 148 45.521 44.241 127.014 1.00 38.77 C ATOM 2278 NE ARG A 148 46.402 43.193 126.494 1.00 43.57 N ATOM 2279 CZ ARG A 148 46.397 41.934 126.921 1.00 51.25 C ATOM 2280 NH1 ARG A 148 45.529 41.545 127.853 1.00 44.79 N ATOM 2281 NH2 ARG A 148 47.252 41.059 126.410 1.00 51.84 N ATOM 2282 HA ARG A 148 41.794 45.513 125.429 1.00 0.00 H ATOM 2283 HB2 ARG A 148 43.809 46.401 126.541 1.00 0.00 H ATOM 2284 HB3 ARG A 148 43.399 45.494 128.015 1.00 0.00 H ATOM 2285 HG2 ARG A 148 43.594 43.348 126.649 1.00 0.00 H ATOM 2286 HG3 ARG A 148 44.214 44.333 125.303 1.00 0.00 H ATOM 2287 HD2 ARG A 148 45.410 44.091 128.088 1.00 0.00 H ATOM 2288 HD3 ARG A 148 45.993 45.206 126.830 1.00 0.00 H ATOM 2289 HE ARG A 148 47.074 43.450 125.743 1.00 0.00 H ATOM 2290 HH12 ARG A 148 45.529 40.559 128.184 1.00 0.00 H ATOM 2291 HH11 ARG A 148 44.852 42.227 128.250 1.00 0.00 H ATOM 2292 HH22 ARG A 148 47.249 40.074 126.743 1.00 0.00 H ATOM 2293 HH21 ARG A 148 47.926 41.358 125.676 1.00 0.00 H ATOM 2294 H ARG A 148 40.926 46.652 128.090 1.00 0.00 H ATOM 2295 N LEU A 149 40.841 43.331 126.252 1.00 29.28 N ATOM 2296 CA LEU A 149 40.228 42.073 126.678 1.00 38.51 C ATOM 2297 C LEU A 149 41.096 40.915 126.222 1.00 31.38 C ATOM 2298 O LEU A 149 41.617 40.933 125.105 1.00 31.40 O ATOM 2299 CB LEU A 149 38.862 41.901 126.005 1.00 36.52 C ATOM 2300 CG LEU A 149 37.798 42.965 126.255 1.00 38.99 C ATOM 2301 CD1 LEU A 149 36.489 42.573 125.595 1.00 46.91 C ATOM 2302 CD2 LEU A 149 37.621 43.149 127.739 1.00 42.02 C ATOM 2303 HA LEU A 149 40.123 42.089 127.763 1.00 0.00 H ATOM 2304 HB2 LEU A 149 39.034 41.861 124.929 1.00 0.00 H ATOM 2305 HB3 LEU A 149 38.453 40.949 126.342 1.00 0.00 H ATOM 2306 HG LEU A 149 38.118 43.910 125.817 1.00 0.00 H ATOM 2307 HD21 LEU A 149 37.308 42.205 128.186 1.00 0.00 H ATOM 2308 HD22 LEU A 149 38.566 43.465 128.180 1.00 0.00 H ATOM 2309 HD23 LEU A 149 36.861 43.909 127.922 1.00 0.00 H ATOM 2310 HD11 LEU A 149 36.642 42.470 124.521 1.00 0.00 H ATOM 2311 HD12 LEU A 149 36.146 41.624 126.007 1.00 0.00 H ATOM 2312 HD13 LEU A 149 35.743 43.344 125.785 1.00 0.00 H ATOM 2313 H LEU A 149 41.002 43.492 125.237 1.00 0.00 H ATOM 2314 N SER A 150 41.210 39.876 127.044 1.00 32.89 N ATOM 2315 CA SER A 150 41.801 38.645 126.526 1.00 33.22 C ATOM 2316 C SER A 150 41.025 37.428 126.993 1.00 31.10 C ATOM 2317 O SER A 150 40.287 37.477 127.984 1.00 37.33 O ATOM 2318 CB SER A 150 43.284 38.527 126.879 1.00 38.45 C ATOM 2319 OG SER A 150 43.458 38.317 128.259 1.00 51.49 O ATOM 2320 HA SER A 150 41.736 38.689 125.439 1.00 0.00 H ATOM 2321 HB2 SER A 150 43.794 39.446 126.591 1.00 0.00 H ATOM 2322 HB3 SER A 150 43.715 37.688 126.333 1.00 0.00 H ATOM 2323 HG SER A 150 44.424 38.244 128.461 1.00 0.00 H ATOM 2324 H SER A 150 40.887 39.938 128.030 1.00 0.00 H ATOM 2325 N PHE A 151 41.208 36.323 126.273 1.00 31.77 N ATOM 2326 CA PHE A 151 40.344 35.163 126.455 1.00 30.19 C ATOM 2327 C PHE A 151 41.117 33.897 126.788 1.00 31.61 C ATOM 2328 O PHE A 151 42.269 33.745 126.375 1.00 37.06 O ATOM 2329 CB PHE A 151 39.504 34.981 125.181 1.00 29.90 C ATOM 2330 CG PHE A 151 38.647 36.168 124.884 1.00 32.94 C ATOM 2331 CD1 PHE A 151 39.060 37.132 123.988 1.00 36.25 C ATOM 2332 CD2 PHE A 151 37.460 36.364 125.575 1.00 39.55 C ATOM 2333 CE1 PHE A 151 38.280 38.254 123.753 1.00 31.87 C ATOM 2334 CE2 PHE A 151 36.678 37.484 125.329 1.00 41.50 C ATOM 2335 CZ PHE A 151 37.095 38.423 124.418 1.00 30.45 C ATOM 2336 HA PHE A 151 39.697 35.345 127.313 1.00 0.00 H ATOM 2337 HB2 PHE A 151 40.177 34.816 124.339 1.00 0.00 H ATOM 2338 HB3 PHE A 151 38.862 34.109 125.307 1.00 0.00 H ATOM 2339 HD2 PHE A 151 37.139 35.633 126.317 1.00 0.00 H ATOM 2340 HE2 PHE A 151 35.734 37.618 125.858 1.00 0.00 H ATOM 2341 HZ PHE A 151 36.482 39.303 124.224 1.00 0.00 H ATOM 2342 HE1 PHE A 151 38.612 39.005 123.036 1.00 0.00 H ATOM 2343 HD1 PHE A 151 40.006 37.011 123.461 1.00 0.00 H ATOM 2344 H PHE A 151 41.976 36.287 125.573 1.00 0.00 H ATOM 2345 N ASN A 152 40.488 33.020 127.572 1.00 33.62 N ATOM 2346 CA ASN A 152 41.111 31.754 127.980 1.00 32.55 C ATOM 2347 C ASN A 152 40.804 30.676 126.943 1.00 36.22 C ATOM 2348 O ASN A 152 39.961 30.896 126.059 1.00 32.55 O ATOM 2349 CB ASN A 152 40.694 31.371 129.421 1.00 40.84 C ATOM 2350 CG ASN A 152 39.212 30.992 129.547 1.00 44.86 C ATOM 2351 OD1 ASN A 152 38.667 30.244 128.730 1.00 46.92 O ATOM 2352 ND2 ASN A 152 38.568 31.491 130.601 1.00 43.85 N ATOM 2353 HA ASN A 152 42.195 31.865 128.012 1.00 0.00 H ATOM 2354 HB2 ASN A 152 41.297 30.521 129.741 1.00 0.00 H ATOM 2355 HB3 ASN A 152 40.890 32.221 130.075 1.00 0.00 H ATOM 2356 HD22 ASN A 152 39.065 32.118 131.265 1.00 0.00 H ATOM 2357 HD21 ASN A 152 37.568 31.254 130.760 1.00 0.00 H ATOM 2358 H ASN A 152 39.527 33.239 127.904 1.00 0.00 H ATOM 2359 N PRO A 153 41.521 29.532 126.992 1.00 35.04 N ATOM 2360 CA PRO A 153 41.297 28.573 125.904 1.00 32.24 C ATOM 2361 C PRO A 153 39.898 27.955 125.912 1.00 39.15 C ATOM 2362 O PRO A 153 39.442 27.451 124.869 1.00 36.10 O ATOM 2363 CB PRO A 153 42.342 27.478 126.179 1.00 37.82 C ATOM 2364 CG PRO A 153 43.423 28.171 126.951 1.00 39.37 C ATOM 2365 CD PRO A 153 42.681 29.163 127.824 1.00 38.49 C ATOM 2366 HA PRO A 153 41.384 29.059 124.932 1.00 0.00 H ATOM 2367 HD3 PRO A 153 42.362 28.702 128.759 1.00 0.00 H ATOM 2368 HD2 PRO A 153 43.300 30.033 128.042 1.00 0.00 H ATOM 2369 HG3 PRO A 153 44.109 28.686 126.278 1.00 0.00 H ATOM 2370 HG2 PRO A 153 43.979 27.459 127.561 1.00 0.00 H ATOM 2371 HB2 PRO A 153 41.907 26.670 126.767 1.00 0.00 H ATOM 2372 HB3 PRO A 153 42.733 27.076 125.244 1.00 0.00 H ATOM 2373 N THR A 154 39.237 27.959 127.063 1.00 40.07 N ATOM 2374 CA THR A 154 37.883 27.421 127.131 1.00 40.45 C ATOM 2375 C THR A 154 36.969 28.358 126.342 1.00 43.39 C ATOM 2376 O THR A 154 36.159 27.906 125.525 1.00 37.17 O ATOM 2377 CB THR A 154 37.399 27.274 128.576 1.00 42.50 C ATOM 2378 OG1 THR A 154 38.191 26.284 129.244 1.00 43.48 O ATOM 2379 CG2 THR A 154 35.946 26.816 128.619 1.00 51.97 C ATOM 2380 HA THR A 154 37.867 26.420 126.700 1.00 0.00 H ATOM 2381 HB THR A 154 37.491 28.245 129.063 1.00 0.00 H ATOM 2382 HG1 THR A 154 39.140 26.564 129.239 1.00 0.00 H ATOM 2383 HG23 THR A 154 35.319 27.553 128.116 1.00 0.00 H ATOM 2384 HG21 THR A 154 35.854 25.854 128.114 1.00 0.00 H ATOM 2385 HG22 THR A 154 35.629 26.715 129.657 1.00 0.00 H ATOM 2386 H THR A 154 39.685 28.346 127.918 1.00 0.00 H ATOM 2387 N GLN A 155 37.122 29.662 126.571 1.00 35.45 N ATOM 2388 CA GLN A 155 36.331 30.666 125.869 1.00 36.91 C ATOM 2389 C GLN A 155 36.573 30.657 124.372 1.00 36.03 C ATOM 2390 O GLN A 155 35.640 30.859 123.594 1.00 33.84 O ATOM 2391 CB GLN A 155 36.635 32.056 126.435 1.00 33.32 C ATOM 2392 CG GLN A 155 36.126 32.249 127.837 1.00 38.59 C ATOM 2393 CD GLN A 155 36.739 33.464 128.501 1.00 42.01 C ATOM 2394 OE1 GLN A 155 37.850 33.870 128.161 1.00 34.51 O ATOM 2395 NE2 GLN A 155 36.021 34.046 129.447 1.00 46.49 N ATOM 2396 HA GLN A 155 35.282 30.417 126.028 1.00 0.00 H ATOM 2397 HB2 GLN A 155 37.715 32.202 126.435 1.00 0.00 H ATOM 2398 HB3 GLN A 155 36.169 32.802 125.791 1.00 0.00 H ATOM 2399 HG2 GLN A 155 35.044 32.374 127.805 1.00 0.00 H ATOM 2400 HG3 GLN A 155 36.371 31.365 128.425 1.00 0.00 H ATOM 2401 HE22 GLN A 155 35.087 33.665 129.699 1.00 0.00 H ATOM 2402 HE21 GLN A 155 36.391 34.884 129.939 1.00 0.00 H ATOM 2403 H GLN A 155 37.826 29.973 127.271 1.00 0.00 H ATOM 2404 N LEU A 156 37.819 30.417 123.967 1.00 29.99 N ATOM 2405 CA LEU A 156 38.185 30.476 122.557 1.00 31.24 C ATOM 2406 C LEU A 156 37.480 29.392 121.758 1.00 33.99 C ATOM 2407 O LEU A 156 37.334 29.498 120.543 1.00 35.17 O ATOM 2408 CB LEU A 156 39.703 30.343 122.383 1.00 34.11 C ATOM 2409 CG LEU A 156 40.567 31.486 122.920 1.00 36.41 C ATOM 2410 CD1 LEU A 156 42.045 31.160 122.730 1.00 36.29 C ATOM 2411 CD2 LEU A 156 40.218 32.787 122.216 1.00 35.74 C ATOM 2412 HA LEU A 156 37.867 31.447 122.178 1.00 0.00 H ATOM 2413 HB2 LEU A 156 40.014 29.430 122.890 1.00 0.00 H ATOM 2414 HB3 LEU A 156 39.905 30.251 121.316 1.00 0.00 H ATOM 2415 HG LEU A 156 40.369 31.605 123.985 1.00 0.00 H ATOM 2416 HD21 LEU A 156 40.395 32.679 121.146 1.00 0.00 H ATOM 2417 HD22 LEU A 156 39.168 33.022 122.390 1.00 0.00 H ATOM 2418 HD23 LEU A 156 40.841 33.590 122.609 1.00 0.00 H ATOM 2419 HD11 LEU A 156 42.286 30.244 123.270 1.00 0.00 H ATOM 2420 HD12 LEU A 156 42.252 31.023 121.669 1.00 0.00 H ATOM 2421 HD13 LEU A 156 42.649 31.981 123.116 1.00 0.00 H ATOM 2422 H LEU A 156 38.547 30.182 124.672 1.00 0.00 H ATOM 2423 N GLU A 157 37.034 28.349 122.445 1.00 33.46 N ATOM 2424 CA GLU A 157 36.355 27.251 121.768 1.00 35.85 C ATOM 2425 C GLU A 157 34.837 27.389 121.814 1.00 38.95 C ATOM 2426 O GLU A 157 34.123 26.496 121.367 1.00 41.30 O ATOM 2427 CB GLU A 157 36.806 25.910 122.355 1.00 39.75 C ATOM 2428 CG GLU A 157 38.139 25.433 121.798 1.00 44.47 C ATOM 2429 CD GLU A 157 38.047 25.002 120.342 1.00 50.32 C ATOM 2430 OE1 GLU A 157 37.572 23.883 120.088 1.00 46.33 O ATOM 2431 OE2 GLU A 157 38.446 25.767 119.441 1.00 49.53 O ATOM 2432 HA GLU A 157 36.637 27.289 120.716 1.00 0.00 H ATOM 2433 HB2 GLU A 157 36.900 26.018 123.436 1.00 0.00 H ATOM 2434 HB3 GLU A 157 36.048 25.160 122.131 1.00 0.00 H ATOM 2435 HG2 GLU A 157 38.861 26.246 121.876 1.00 0.00 H ATOM 2436 HG3 GLU A 157 38.482 24.586 122.392 1.00 0.00 H ATOM 2437 H GLU A 157 37.170 28.314 123.476 1.00 0.00 H ATOM 2438 N GLU A 158 34.346 28.508 122.341 1.00 38.60 N ATOM 2439 CA GLU A 158 32.901 28.743 122.405 1.00 44.88 C ATOM 2440 C GLU A 158 32.447 29.839 121.443 1.00 41.01 C ATOM 2441 O GLU A 158 33.204 30.765 121.148 1.00 38.84 O ATOM 2442 CB GLU A 158 32.478 29.129 123.827 1.00 49.78 C ATOM 2443 CG GLU A 158 32.906 28.153 124.902 1.00 49.54 C ATOM 2444 CD GLU A 158 32.064 26.897 124.926 1.00 69.36 C ATOM 2445 OE1 GLU A 158 31.016 26.856 124.241 1.00 67.61 O ATOM 2446 OE2 GLU A 158 32.452 25.947 125.638 1.00 73.01 O ATOM 2447 HA GLU A 158 32.424 27.808 122.111 1.00 0.00 H ATOM 2448 HB2 GLU A 158 32.913 30.101 124.059 1.00 0.00 H ATOM 2449 HB3 GLU A 158 31.391 29.204 123.849 1.00 0.00 H ATOM 2450 HG2 GLU A 158 33.944 27.873 124.724 1.00 0.00 H ATOM 2451 HG3 GLU A 158 32.825 28.645 125.871 1.00 0.00 H ATOM 2452 H GLU A 158 34.998 29.227 122.713 1.00 0.00 H ATOM 2453 N GLN A 159 31.208 29.733 120.974 1.00 41.96 N ATOM 2454 CA GLN A 159 30.595 30.770 120.148 1.00 51.05 C ATOM 2455 C GLN A 159 30.557 32.106 120.882 1.00 43.70 C ATOM 2456 O GLN A 159 29.958 32.203 121.962 1.00 46.46 O ATOM 2457 CB GLN A 159 29.165 30.371 119.787 1.00 52.93 C ATOM 2458 CG GLN A 159 29.065 29.148 118.903 1.00 69.83 C ATOM 2459 CD GLN A 159 29.733 29.358 117.571 1.00 74.63 C ATOM 2460 OE1 GLN A 159 30.882 28.967 117.375 1.00 84.19 O ATOM 2461 NE2 GLN A 159 29.021 29.985 116.643 1.00 84.49 N ATOM 2462 HA GLN A 159 31.197 30.876 119.246 1.00 0.00 H ATOM 2463 HB2 GLN A 159 28.623 30.170 120.711 1.00 0.00 H ATOM 2464 HB3 GLN A 159 28.698 31.207 119.267 1.00 0.00 H ATOM 2465 HG2 GLN A 159 29.543 28.309 119.408 1.00 0.00 H ATOM 2466 HG3 GLN A 159 28.012 28.919 118.737 1.00 0.00 H ATOM 2467 HE22 GLN A 159 28.052 30.298 116.854 1.00 0.00 H ATOM 2468 HE21 GLN A 159 29.432 30.163 115.705 1.00 0.00 H ATOM 2469 H GLN A 159 30.656 28.882 121.203 1.00 0.00 H ATOM 2470 N CYS A 160 31.166 33.130 120.281 1.00 39.71 N ATOM 2471 CA CYS A 160 31.239 34.464 120.887 1.00 42.15 C ATOM 2472 C CYS A 160 31.988 34.465 122.222 1.00 43.17 C ATOM 2473 O CYS A 160 31.782 35.356 123.050 1.00 40.08 O ATOM 2474 CB CYS A 160 29.848 35.097 121.046 1.00 41.86 C ATOM 2475 SG CYS A 160 29.100 35.658 119.491 1.00 45.08 S ATOM 2476 HA CYS A 160 31.814 35.077 120.193 1.00 0.00 H ATOM 2477 HB2 CYS A 160 29.938 35.956 121.711 1.00 0.00 H ATOM 2478 HB3 CYS A 160 29.186 34.358 121.496 1.00 0.00 H ATOM 2479 HG CYS A 160 30.426 35.784 119.131 1.00 0.00 H ATOM 2480 H CYS A 160 31.604 32.977 119.350 1.00 0.00 H ATOM 2481 N HIS A 161 32.862 33.476 122.412 1.00 34.50 N ATOM 2482 CA HIS A 161 33.755 33.428 123.578 1.00 37.10 C ATOM 2483 C HIS A 161 33.032 33.452 124.926 1.00 43.07 C ATOM 2484 O HIS A 161 33.559 33.947 125.929 1.00 39.98 O ATOM 2485 CB HIS A 161 34.790 34.556 123.506 1.00 34.74 C ATOM 2486 CG HIS A 161 35.752 34.421 122.363 1.00 37.99 C ATOM 2487 ND1 HIS A 161 36.888 35.186 122.255 1.00 32.97 N ATOM 2488 CD2 HIS A 161 35.730 33.601 121.287 1.00 37.34 C ATOM 2489 CE1 HIS A 161 37.533 34.844 121.154 1.00 36.35 C ATOM 2490 NE2 HIS A 161 36.860 33.898 120.544 1.00 34.75 N ATOM 2491 HA HIS A 161 34.255 32.460 123.528 1.00 0.00 H ATOM 2492 HB2 HIS A 161 34.260 35.503 123.400 1.00 0.00 H ATOM 2493 HB3 HIS A 161 35.359 34.561 124.436 1.00 0.00 H ATOM 2494 HD2 HIS A 161 34.972 32.854 121.051 1.00 0.00 H ATOM 2495 HE1 HIS A 161 38.472 35.277 120.809 1.00 0.00 H ATOM 2496 H HIS A 161 32.914 32.711 121.709 1.00 0.00 H ATOM 2497 N ILE A 162 31.825 32.905 124.961 1.00 47.52 N ATOM 2498 CA ILE A 162 31.066 32.916 126.205 1.00 52.67 C ATOM 2499 C ILE A 162 31.707 32.015 127.264 1.00 66.84 C ATOM 2500 O ILE A 162 32.312 30.991 126.928 1.00 67.81 O ATOM 2501 CB ILE A 162 29.597 32.540 125.984 1.00 62.20 C ATOM 2502 CG1 ILE A 162 29.483 31.219 125.227 1.00 72.31 C ATOM 2503 CG2 ILE A 162 28.882 33.640 125.214 1.00 63.63 C ATOM 2504 CD1 ILE A 162 29.232 30.010 126.115 1.00 77.94 C ATOM 2505 HA ILE A 162 31.089 33.940 126.578 1.00 0.00 H ATOM 2506 OXT ILE A 162 31.645 32.299 128.470 1.00 61.88 O ATOM 2507 HB ILE A 162 29.126 32.423 126.960 1.00 0.00 H ATOM 2508 HG12 ILE A 162 28.658 31.301 124.519 1.00 0.00 H ATOM 2509 HG13 ILE A 162 30.413 31.056 124.682 1.00 0.00 H ATOM 2510 HD11 ILE A 162 30.054 29.904 126.823 1.00 0.00 H ATOM 2511 HD12 ILE A 162 28.298 30.148 126.660 1.00 0.00 H ATOM 2512 HD13 ILE A 162 29.164 29.115 125.497 1.00 0.00 H ATOM 2513 HG21 ILE A 162 28.931 34.570 125.781 1.00 0.00 H ATOM 2514 HG22 ILE A 162 29.365 33.777 124.246 1.00 0.00 H ATOM 2515 HG23 ILE A 162 27.840 33.359 125.065 1.00 0.00 H ATOM 2516 H ILE A 162 31.422 32.471 124.106 1.00 0.00 H TER 2517 ILE A 162 HETATM 2518 O HOH 1 37.912 34.275 117.558 1.00 29.55 O HETATM 2519 O HOH 2 45.933 45.549 100.043 1.00 34.79 O HETATM 2520 O HOH 3 37.093 31.786 118.858 1.00 37.26 O HETATM 2521 O HOH 4 37.106 43.220 118.679 1.00 36.80 O HETATM 2522 O HOH 5 46.253 51.970 101.071 1.00 43.49 O HETATM 2523 O HOH 6 34.997 25.492 125.461 1.00 46.10 O HETATM 2524 O HOH 7 49.936 40.450 99.985 1.00 42.89 O HETATM 2525 O HOH 8 43.439 42.485 129.320 1.00 41.70 O HETATM 2526 O HOH 9 36.274 22.096 121.255 1.00 40.23 O HETATM 2527 O HOH 10 57.432 44.384 109.269 1.00 53.16 O HETATM 2528 O HOH 11 50.535 47.992 125.607 1.00 44.86 O HETATM 2529 O HOH 12 48.047 41.894 100.503 1.00 39.56 O HETATM 2530 O HOH 13 33.193 45.856 129.127 1.00 47.25 O HETATM 2531 O HOH 14 34.709 30.387 118.886 1.00 45.83 O HETATM 2532 O HOH 15 41.610 24.515 116.665 1.00 38.23 O HETATM 2533 O HOH 16 30.427 38.955 122.803 1.00 55.41 O HETATM 2534 O HOH 17 40.673 27.575 129.871 1.00 46.25 O HETATM 2535 O HOH 18 40.168 30.212 104.278 1.00 48.37 O HETATM 2536 O HOH 19 29.680 40.859 119.843 1.00 53.13 O HETATM 2537 O HOH 20 53.615 51.446 108.344 1.00 55.46 O HETATM 2538 O HOH 21 47.421 47.009 128.322 1.00 46.55 O HETATM 2539 O HOH 22 55.338 44.064 118.800 1.00 46.25 O HETATM 2540 O HOH 23 47.013 37.938 96.157 1.00 49.13 O HETATM 2541 O HOH 24 48.184 46.407 125.880 1.00 50.68 O HETATM 2542 O HOH 25 29.893 49.539 124.321 1.00 49.46 O HETATM 2543 O HOH 26 31.667 52.504 127.764 1.00 46.90 O HETATM 2544 O HOH 27 49.314 43.205 128.947 1.00 55.68 O HETATM 2545 O HOH 28 37.118 55.467 126.860 1.00 40.13 O HETATM 2546 O HOH 29 30.074 37.016 124.296 1.00 46.40 O HETATM 2547 O HOH 30 48.761 29.081 117.191 1.00 45.72 O HETATM 2548 O HOH 31 33.575 28.851 117.302 1.00 50.21 O HETATM 2549 O HOH 32 42.561 25.946 129.623 1.00 57.43 O HETATM 2550 O HOH 33 56.155 37.568 104.440 1.00 59.73 O HETATM 2551 O HOH 34 52.286 46.732 103.080 1.00 44.87 O HETATM 2552 O HOH 35 44.507 35.025 127.345 1.00 48.16 O HETATM 2553 O HOH 36 47.906 30.176 120.316 1.00 45.14 O HETATM 2554 O HOH 37 33.887 36.337 127.337 1.00 52.56 O HETATM 2555 O HOH 38 39.919 24.778 124.832 1.00 52.09 O HETATM 2556 O HOH 39 50.156 53.374 125.013 1.00 89.71 O HETATM 2557 O HOH 40 20.593 43.283 114.114 1.00 55.27 O HETATM 2558 O HOH 41 55.893 46.471 117.740 1.00 49.37 O HETATM 2559 O HOH 42 50.101 30.581 118.839 1.00 53.94 O HETATM 2560 O HOH 43 41.300 31.865 100.329 1.00 53.77 O HETATM 2561 O HOH 44 39.980 30.491 101.449 1.00 61.32 O HETATM 2562 O HOH 45 57.068 42.407 110.902 1.00 63.56 O HETATM 2563 O HOH 46 33.267 23.783 122.610 1.00 64.65 O HETATM 2564 O HOH 47 46.401 48.277 124.918 1.00 59.94 O HETATM 2565 O HOH 48 52.727 38.089 127.089 1.00 50.83 O HETATM 2566 O HOH 49 38.023 42.013 92.130 1.00 67.22 O HETATM 2567 O HOH 50 56.980 37.124 109.495 1.00 59.12 O HETATM 2568 O HOH 51 33.190 36.700 129.900 1.00 46.41 O HETATM 2569 O HOH 52 44.115 31.125 130.226 1.00 49.23 O HETATM 2570 O HOH 53 50.418 46.536 95.810 1.00 62.98 O HETATM 2571 O HOH 54 47.756 39.214 128.619 1.00 55.47 O HETATM 2572 O HOH 55 46.477 54.756 126.427 1.00 50.82 O HETATM 2573 O HOH 56 38.898 56.016 128.687 1.00 44.09 O HETATM 2574 O HOH 57 55.932 44.268 111.502 1.00 53.31 O HETATM 2575 O HOH 58 54.722 45.785 112.196 1.00 51.37 O HETATM 2576 O HOH 59 45.384 43.076 131.105 1.00 48.03 O HETATM 2577 O HOH 60 35.550 30.312 131.018 1.00 48.31 O HETATM 2578 O HOH 61 36.849 57.280 125.330 1.00 57.58 O HETATM 2579 O HOH 62 40.056 57.700 123.761 1.00 63.09 O HETATM 2580 O HOH 63 54.929 50.961 116.546 1.00 52.44 O HETATM 2581 O HOH 64 46.878 28.153 126.761 1.00 43.42 O HETATM 2582 O HOH 65 53.280 44.628 103.300 1.00 41.83 O HETATM 2583 O HOH 66 44.816 52.183 96.859 1.00 52.97 O HETATM 2584 O HOH 67 33.295 38.091 125.125 1.00 60.44 O HETATM 2585 O HOH 68 40.251 33.736 131.782 1.00 44.18 O HETATM 2586 O HOH 69 46.174 42.064 98.194 1.00 53.88 O HETATM 2587 O HOH 70 52.511 49.817 116.603 1.00 50.19 O HETATM 2588 O HOH 71 33.566 29.526 128.352 1.00 57.05 O HETATM 2589 O HOH 72 43.577 24.551 124.481 1.00 58.96 O HETATM 2590 O HOH 73 33.977 55.441 126.118 1.00 61.73 O HETATM 2591 O HOH 74 51.617 52.123 114.980 1.00 61.89 O HETATM 2592 O HOH 75 49.036 56.854 110.707 1.00 72.70 O HETATM 2593 O HOH 76 41.758 57.220 122.457 1.00 57.56 O HETATM 2594 O HOH 77 32.369 26.634 128.120 1.00 63.08 O HETATM 2595 O HOH 78 45.695 27.797 105.621 1.00 82.97 O HETATM 2596 O HOH 79 44.333 35.994 96.623 1.00 68.13 O HETATM 2597 O HOH 80 30.712 34.579 129.099 1.00 67.07 O HETATM 2598 O HOH 81 37.859 39.860 95.242 1.00 61.85 O HETATM 2599 O HOH 82 34.067 27.799 106.206 1.00 60.63 O HETATM 2600 O HOH 83 53.247 30.747 125.192 1.00 63.77 O HETATM 2601 O HOH 84 46.075 47.312 94.471 1.00 65.47 O HETATM 2602 O HOH 85 32.002 44.046 125.715 1.00 89.61 O HETATM 2603 O HOH 86 51.893 41.017 127.469 1.00 52.84 O HETATM 2604 O HOH 87 53.883 33.227 118.466 1.00 52.61 O HETATM 2605 O HOH 88 48.236 50.627 125.008 1.00 57.31 O HETATM 2606 O HOH 89 44.843 58.137 128.396 1.00 56.11 O HETATM 2607 O HOH 90 47.620 44.810 97.401 1.00 51.80 O HETATM 2608 O HOH 91 33.443 33.054 130.195 1.00 59.47 O HETATM 2609 O HOH 92 55.951 32.815 116.467 1.00 58.29 O HETATM 2610 C1 RHL A 93 32.755 45.446 111.598 1.00 0.24 C HETATM 2611 O1 RHL A 93 32.849 45.192 112.782 1.00 -0.37 O HETATM 2612 C2 RHL A 93 33.943 45.168 110.703 1.00 0.05 C HETATM 2613 C3 RHL A 93 35.164 44.926 111.570 1.00 -0.04 C HETATM 2614 C4 RHL A 93 35.779 43.577 111.281 1.00 -0.05 C HETATM 2615 C5 RHL A 93 37.203 43.747 110.809 1.00 -0.05 C HETATM 2616 C6 RHL A 93 37.960 42.443 110.942 1.00 -0.05 C HETATM 2617 C7 RHL A 93 39.226 42.559 110.128 1.00 -0.05 C HETATM 2618 C8 RHL A 93 40.128 41.361 110.313 1.00 -0.05 C HETATM 2619 C9 RHL A 93 41.288 41.576 109.379 1.00 -0.05 C HETATM 2620 CA RHL A 93 42.291 40.461 109.486 1.00 -0.05 C HETATM 2621 CB RHL A 93 43.647 41.074 109.233 1.00 -0.06 C HETATM 2622 C01 RHL A 93 44.434 40.196 108.296 1.00 -0.07 C HETATM 2623 H29 RHL A 93 45.421 40.646 108.114 1.00 0.02 H HETATM 2624 H30 RHL A 93 43.894 40.100 107.343 1.00 0.02 H HETATM 2625 H31 RHL A 93 44.562 39.201 108.747 1.00 0.02 H HETATM 2626 H19 RHL A 93 44.188 41.170 110.186 1.00 0.03 H HETATM 2627 H20 RHL A 93 43.520 42.069 108.782 1.00 0.03 H HETATM 2628 H17 RHL A 93 42.079 39.686 108.734 1.00 0.03 H HETATM 2629 H18 RHL A 93 42.258 40.016 110.491 1.00 0.03 H HETATM 2630 H15 RHL A 93 41.781 42.526 109.633 1.00 0.03 H HETATM 2631 H16 RHL A 93 40.912 41.622 108.346 1.00 0.03 H HETATM 2632 H13 RHL A 93 39.594 40.435 110.054 1.00 0.03 H HETATM 2633 H14 RHL A 93 40.479 41.303 111.354 1.00 0.03 H HETATM 2634 H11 RHL A 93 39.768 43.464 110.441 1.00 0.03 H HETATM 2635 H12 RHL A 93 38.958 42.641 109.064 1.00 0.03 H HETATM 2636 H9 RHL A 93 37.346 41.613 110.562 1.00 0.03 H HETATM 2637 H10 RHL A 93 38.209 42.261 111.998 1.00 0.03 H HETATM 2638 H7 RHL A 93 37.698 44.517 111.418 1.00 0.03 H HETATM 2639 H8 RHL A 93 37.201 44.059 109.754 1.00 0.03 H HETATM 2640 H5 RHL A 93 35.194 43.071 110.499 1.00 0.03 H HETATM 2641 H6 RHL A 93 35.770 42.969 112.198 1.00 0.03 H HETATM 2642 H3 RHL A 93 34.867 44.966 112.628 1.00 0.03 H HETATM 2643 H4 RHL A 93 35.908 45.710 111.369 1.00 0.03 H HETATM 2644 H1 RHL A 93 34.121 46.032 110.047 1.00 0.05 H HETATM 2645 H2 RHL A 93 33.743 44.277 110.090 1.00 0.05 H HETATM 2646 N5 RHL A 93 31.543 45.988 111.088 1.00 -0.14 N HETATM 2647 C15 RHL A 93 30.437 46.240 111.935 1.00 0.17 C HETATM 2648 N4 RHL A 93 30.101 47.527 112.229 1.00 -0.28 N HETATM 2649 C11 RHL A 93 29.028 47.783 113.027 1.00 -0.00 C HETATM 2650 C12 RHL A 93 28.278 46.731 113.531 1.00 -0.05 C HETATM 2651 C13 RHL A 93 28.610 45.441 113.230 1.00 -0.05 C HETATM 2652 C14 RHL A 93 29.684 45.188 112.427 1.00 -0.01 C HETATM 2653 H24 RHL A 93 29.947 44.167 112.175 1.00 0.06 H HETATM 2654 H23 RHL A 93 28.023 44.621 113.627 1.00 0.07 H HETATM 2655 H22 RHL A 93 27.424 46.934 114.167 1.00 0.06 H HETATM 2656 H21 RHL A 93 28.761 48.806 113.268 1.00 0.08 H HETATM 2657 N6 RHL A 93 31.580 47.581 109.297 1.00 -0.28 N HETATM 2658 C16 RHL A 93 31.354 46.308 109.722 1.00 0.17 C HETATM 2659 C17 RHL A 93 30.896 45.345 108.838 1.00 -0.01 C HETATM 2660 C18 RHL A 93 30.694 45.664 107.528 1.00 -0.05 C HETATM 2661 C19 RHL A 93 30.930 46.939 107.100 1.00 -0.05 C HETATM 2662 C20 RHL A 93 31.377 47.904 107.991 1.00 -0.00 C HETATM 2663 H28 RHL A 93 31.564 48.915 107.647 1.00 0.08 H HETATM 2664 H27 RHL A 93 30.767 47.198 106.060 1.00 0.06 H HETATM 2665 H26 RHL A 93 30.348 44.910 106.830 1.00 0.07 H HETATM 2666 H25 RHL A 93 30.698 44.338 109.188 1.00 0.06 H CONECT 1 2 19 20 21 CONECT 19 1 CONECT 20 1 CONECT 21 1 CONECT 1010 1009 1014 2475 CONECT 1691 1690 1695 1814 CONECT 1744 1745 1760 1761 1762 CONECT 1760 1744 CONECT 1761 1744 CONECT 1762 1744 CONECT 1814 1691 1813 1818 CONECT 2475 1010 2474 2479 CONECT 2610 2611 2612 2646 CONECT 2611 2610 CONECT 2612 2610 2613 2644 2645 CONECT 2613 2612 2614 2642 2643 CONECT 2614 2613 2615 2640 2641 CONECT 2615 2614 2616 2638 2639 CONECT 2616 2615 2617 2636 2637 CONECT 2617 2616 2618 2634 2635 CONECT 2618 2617 2619 2632 2633 CONECT 2619 2618 2620 2630 2631 CONECT 2620 2619 2621 2628 2629 CONECT 2621 2620 2622 2626 2627 CONECT 2622 2621 2623 2624 2625 CONECT 2623 2622 CONECT 2624 2622 CONECT 2625 2622 CONECT 2626 2621 CONECT 2627 2621 CONECT 2628 2620 CONECT 2629 2620 CONECT 2630 2619 CONECT 2631 2619 CONECT 2632 2618 CONECT 2633 2618 CONECT 2634 2617 CONECT 2635 2617 CONECT 2636 2616 CONECT 2637 2616 CONECT 2638 2615 CONECT 2639 2615 CONECT 2640 2614 CONECT 2641 2614 CONECT 2642 2613 CONECT 2643 2613 CONECT 2644 2612 CONECT 2645 2612 CONECT 2646 0 2610 2647 2658 CONECT 2647 2646 2648 2652 CONECT 2648 0 2647 2649 CONECT 2649 2648 2650 2656 CONECT 2650 2649 2651 2655 CONECT 2651 2650 2652 2654 CONECT 2652 2647 2651 2653 CONECT 2653 2652 CONECT 2654 2651 CONECT 2655 2650 CONECT 2656 2649 CONECT 2657 0 2658 2662 CONECT 2658 2646 2657 2659 CONECT 2659 2658 2660 2666 CONECT 2660 2659 2661 2665 CONECT 2661 2660 2662 2664 CONECT 2662 2657 2661 2663 CONECT 2663 2662 CONECT 2664 2661 CONECT 2665 2660 CONECT 2666 2659 MASTER 0 0 0 0 0 0 0 0 2664 2 69 13 END
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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
4kii
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Beta-lactoglobulin
Ligand Name
RHL
EC.Number
E.C.-.-.-.-
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
Kd=0.59uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Eur.J.Inorg.Chem. Vol. 21: pp. 3596-3600
Ligand Properties
Formula
C
2
2
H
3
1
N
3
ORh
Molecular Weight
456.407
Exact Mass
456.152
No. of atoms
58
No. of bonds
61
Polar Surface Area
46.09
LOGP Value
-2.99 (
Computed with XLOGP3
)
4.54 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 4
Canonical SMILES
CCCCCCCCCCCC(=O)[N]12c3cccc[n+]3[Rh]2[n+]2c1cccc2
InChI String
-
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
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times since Nov 2007.
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