Browse entries in the PDBbind-CN Database
HEADER 5TIG_COMPLEX COMPND 5TIG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 62 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 A 62 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 A 62 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 A 62 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 A 62 GLY GLY GLU LEU ALA SER LYS VAL ARG ARG SEQRES 1 B 58 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 B 58 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 B 58 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 B 58 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 B 58 GLY GLY GLU LEU ALA SER SEQRES 1 C 59 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 C 59 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 C 59 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 C 59 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 C 59 GLY GLY GLU LEU ALA SER LYS SEQRES 1 D 60 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 D 60 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 D 60 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 D 60 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 D 60 GLY GLY GLU LEU ALA SER LYS VAL SEQRES 1 E 60 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 E 60 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 E 60 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 E 60 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 E 60 GLY GLY GLU LEU ALA SER LYS VAL SEQRES 1 F 60 PRO ILE ALA GLN ILE HIS ILE LEU GLU GLY ARG SER ASP SEQRES 2 F 60 GLU GLN LYS GLU THR LEU ILE ARG GLU VAL SER GLU ALA SEQRES 3 F 60 ILE SER ARG SER LEU ASP ALA PRO LEU THR SER VAL ARG SEQRES 4 F 60 VAL ILE ILE THR GLU MET ALA LYS GLY HIS PHE GLY ILE SEQRES 5 F 60 GLY GLY GLU LEU ALA SER LYS VAL HET UNN A 393 15 ATOM 1 N PRO A 1 62.170 13.358 41.596 1.00 52.78 N ATOM 2 CA PRO A 1 61.870 11.937 41.916 1.00 39.50 C ATOM 3 C PRO A 1 61.298 11.272 40.687 1.00 38.08 C ATOM 4 O PRO A 1 60.329 11.775 40.124 1.00 41.39 O ATOM 5 CB PRO A 1 60.825 11.996 43.041 1.00 37.10 C ATOM 6 CG PRO A 1 60.536 13.433 43.324 1.00 41.95 C ATOM 7 CD PRO A 1 61.159 14.266 42.209 1.00 48.34 C ATOM 8 HN2 PRO A 1 62.160 13.484 40.564 1.00 0.00 H ATOM 9 HN1 PRO A 1 63.112 13.599 41.965 1.00 0.00 H ATOM 10 N ILE A 2 61.960 10.210 40.257 1.00 35.03 N ATOM 11 CA ILE A 2 61.702 9.576 39.005 1.00 36.54 C ATOM 12 C ILE A 2 61.523 8.098 39.247 1.00 37.11 C ATOM 13 O ILE A 2 62.448 7.451 39.710 1.00 35.40 O ATOM 14 CB ILE A 2 62.887 9.749 38.046 1.00 37.85 C ATOM 15 CG1 ILE A 2 63.090 11.234 37.746 1.00 42.12 C ATOM 16 CG2 ILE A 2 62.648 8.964 36.761 1.00 36.23 C ATOM 17 CD1 ILE A 2 64.321 11.548 36.920 1.00 42.07 C ATOM 18 H ILE A 2 62.708 9.817 40.864 1.00 0.00 H ATOM 19 N ALA A 3 60.354 7.557 38.897 1.00 34.36 N ATOM 20 CA ALA A 3 60.080 6.148 39.144 1.00 33.29 C ATOM 21 C ALA A 3 59.929 5.388 37.861 1.00 33.44 C ATOM 22 O ALA A 3 59.269 5.859 36.947 1.00 37.19 O ATOM 23 CB ALA A 3 58.836 6.018 39.971 1.00 32.34 C ATOM 24 H ALA A 3 59.630 8.149 38.442 1.00 0.00 H ATOM 25 N GLN A 4 60.557 4.218 37.780 1.00 35.83 N ATOM 26 CA GLN A 4 60.390 3.327 36.632 1.00 36.30 C ATOM 27 C GLN A 4 59.803 2.052 37.141 1.00 36.05 C ATOM 28 O GLN A 4 60.305 1.457 38.086 1.00 31.37 O ATOM 29 CB GLN A 4 61.708 3.035 35.903 1.00 36.63 C ATOM 30 CG GLN A 4 61.556 2.064 34.740 1.00 39.45 C ATOM 31 CD GLN A 4 62.838 1.861 33.946 1.00 46.06 C ATOM 32 OE1 GLN A 4 63.911 2.280 34.364 1.00 48.16 O ATOM 33 NE2 GLN A 4 62.731 1.208 32.783 1.00 53.92 N ATOM 34 HE22 GLN A 4 61.802 0.867 32.461 1.00 0.00 H ATOM 35 HE21 GLN A 4 63.576 1.041 32.201 1.00 0.00 H ATOM 36 H GLN A 4 61.186 3.928 38.556 1.00 0.00 H ATOM 37 N ILE A 5 58.719 1.621 36.509 1.00 39.47 N ATOM 38 CA ILE A 5 58.001 0.441 36.979 1.00 38.10 C ATOM 39 C ILE A 5 57.949 -0.583 35.889 1.00 36.57 C ATOM 40 O ILE A 5 57.373 -0.340 34.825 1.00 41.24 O ATOM 41 CB ILE A 5 56.567 0.825 37.425 1.00 36.12 C ATOM 42 CG1 ILE A 5 56.612 2.069 38.308 1.00 36.03 C ATOM 43 CG2 ILE A 5 55.933 -0.320 38.177 1.00 37.74 C ATOM 44 CD1 ILE A 5 55.268 2.541 38.800 1.00 39.12 C ATOM 45 H ILE A 5 58.377 2.130 35.669 1.00 0.00 H ATOM 46 N HIS A 6 58.501 -1.755 36.155 1.00 39.58 N ATOM 47 CA HIS A 6 58.409 -2.852 35.191 1.00 40.21 C ATOM 48 C HIS A 6 57.222 -3.707 35.533 1.00 40.18 C ATOM 49 O HIS A 6 57.107 -4.192 36.666 1.00 41.16 O ATOM 50 CB HIS A 6 59.652 -3.765 35.158 1.00 41.85 C ATOM 51 CG HIS A 6 60.860 -3.141 34.539 1.00 42.90 C ATOM 52 ND1 HIS A 6 61.604 -2.204 35.221 1.00 46.19 N ATOM 53 CD2 HIS A 6 61.460 -3.312 33.331 1.00 37.40 C ATOM 54 CE1 HIS A 6 62.610 -1.818 34.461 1.00 46.40 C ATOM 55 NE2 HIS A 6 62.551 -2.485 33.314 1.00 41.04 N ATOM 56 H HIS A 6 59.003 -1.898 37.054 1.00 0.00 H ATOM 57 N ILE A 7 56.346 -3.914 34.557 1.00 39.58 N ATOM 58 CA ILE A 7 55.164 -4.762 34.757 1.00 35.99 C ATOM 59 C ILE A 7 54.977 -5.706 33.594 1.00 36.41 C ATOM 60 O ILE A 7 55.406 -5.417 32.485 1.00 28.66 O ATOM 61 CB ILE A 7 53.902 -3.911 34.927 1.00 34.69 C ATOM 62 CG1 ILE A 7 53.552 -3.200 33.610 1.00 34.83 C ATOM 63 CG2 ILE A 7 54.090 -2.907 36.069 1.00 33.98 C ATOM 64 CD1 ILE A 7 52.360 -2.274 33.709 1.00 34.74 C ATOM 65 H ILE A 7 56.500 -3.466 33.631 1.00 0.00 H ATOM 66 N LEU A 8 54.301 -6.822 33.848 1.00 43.29 N ATOM 67 CA LEU A 8 53.910 -7.706 32.758 1.00 45.44 C ATOM 68 C LEU A 8 52.939 -7.038 31.817 1.00 48.73 C ATOM 69 O LEU A 8 52.057 -6.287 32.241 1.00 47.50 O ATOM 70 CB LEU A 8 53.283 -8.973 33.274 1.00 44.66 C ATOM 71 CG LEU A 8 54.327 -9.941 33.808 1.00 45.55 C ATOM 72 CD1 LEU A 8 53.647 -11.076 34.543 1.00 46.90 C ATOM 73 CD2 LEU A 8 55.186 -10.476 32.666 1.00 50.30 C ATOM 74 H LEU A 8 54.050 -7.065 34.828 1.00 0.00 H ATOM 75 N GLU A 9 53.131 -7.277 30.524 1.00 53.67 N ATOM 76 CA GLU A 9 52.216 -6.764 29.520 1.00 60.13 C ATOM 77 C GLU A 9 50.834 -7.387 29.746 1.00 62.36 C ATOM 78 O GLU A 9 50.713 -8.453 30.330 1.00 50.88 O ATOM 79 CB GLU A 9 52.717 -7.083 28.105 1.00 63.45 C ATOM 80 CG GLU A 9 52.553 -8.550 27.720 1.00 62.88 C ATOM 81 CD GLU A 9 53.194 -8.899 26.383 1.00 68.64 C ATOM 82 OE1 GLU A 9 53.607 -7.970 25.622 1.00 67.90 O ATOM 83 OE2 GLU A 9 53.325 -10.112 26.110 1.00 62.37 O ATOM 84 H GLU A 9 53.952 -7.842 30.226 1.00 0.00 H ATOM 85 N GLY A 10 49.799 -6.686 29.300 1.00 65.61 N ATOM 86 CA GLY A 10 48.455 -7.226 29.328 1.00 70.19 C ATOM 87 C GLY A 10 47.386 -6.358 29.953 1.00 70.19 C ATOM 88 O GLY A 10 46.214 -6.684 29.852 1.00 83.14 O ATOM 89 H GLY A 10 49.956 -5.730 28.923 1.00 0.00 H ATOM 90 N ARG A 11 47.771 -5.234 30.536 1.00 65.59 N ATOM 91 CA ARG A 11 46.847 -4.380 31.254 1.00 56.47 C ATOM 92 C ARG A 11 46.304 -3.302 30.348 1.00 60.31 C ATOM 93 O ARG A 11 46.835 -3.037 29.259 1.00 60.16 O ATOM 94 CB ARG A 11 47.562 -3.742 32.432 1.00 60.87 C ATOM 95 CG ARG A 11 48.262 -4.752 33.321 1.00 57.97 C ATOM 96 CD ARG A 11 47.915 -4.667 34.775 1.00 63.41 C ATOM 97 NE ARG A 11 48.538 -5.767 35.521 1.00 73.65 N ATOM 98 CZ ARG A 11 47.806 -6.731 36.058 1.00 83.30 C ATOM 99 NH1 ARG A 11 46.489 -6.723 35.872 1.00 78.72 N ATOM 100 NH2 ARG A 11 48.373 -7.692 36.764 1.00 89.21 N ATOM 101 HE ARG A 11 49.572 -5.790 35.630 1.00 0.00 H ATOM 102 HH12 ARG A 11 45.901 -7.473 36.287 1.00 0.00 H ATOM 103 HH11 ARG A 11 46.048 -5.966 35.311 1.00 0.00 H ATOM 104 HH22 ARG A 11 47.789 -8.444 37.181 1.00 0.00 H ATOM 105 HH21 ARG A 11 49.404 -7.697 36.903 1.00 0.00 H ATOM 106 H ARG A 11 48.771 -4.954 30.477 1.00 0.00 H ATOM 107 N SER A 12 45.185 -2.714 30.756 1.00 63.28 N ATOM 108 CA SER A 12 44.493 -1.726 29.928 1.00 55.02 C ATOM 109 C SER A 12 45.143 -0.372 30.098 1.00 52.03 C ATOM 110 O SER A 12 45.806 -0.124 31.089 1.00 48.19 O ATOM 111 CB SER A 12 43.047 -1.616 30.348 1.00 55.93 C ATOM 112 OG SER A 12 42.960 -1.101 31.673 1.00 59.18 O ATOM 113 HG SER A 12 43.377 -0.204 31.705 1.00 0.00 H ATOM 114 H SER A 12 44.791 -2.962 31.686 1.00 0.00 H ATOM 115 N ASP A 13 44.913 0.510 29.141 1.00 48.93 N ATOM 116 CA ASP A 13 45.384 1.863 29.249 1.00 53.15 C ATOM 117 C ASP A 13 44.876 2.564 30.509 1.00 57.76 C ATOM 118 O ASP A 13 45.563 3.412 31.066 1.00 62.62 O ATOM 119 CB ASP A 13 44.987 2.653 27.995 1.00 59.40 C ATOM 120 CG ASP A 13 45.825 2.279 26.775 1.00 64.56 C ATOM 121 OD1 ASP A 13 46.687 1.376 26.887 1.00 67.79 O ATOM 122 OD2 ASP A 13 45.686 2.957 25.725 1.00 75.21 O ATOM 123 H ASP A 13 44.382 0.220 28.295 1.00 0.00 H ATOM 124 N GLU A 14 43.671 2.225 30.953 1.00 63.75 N ATOM 125 CA GLU A 14 43.065 2.903 32.093 1.00 62.08 C ATOM 126 C GLU A 14 43.818 2.497 33.345 1.00 55.95 C ATOM 127 O GLU A 14 44.131 3.337 34.178 1.00 48.17 O ATOM 128 CB GLU A 14 41.562 2.562 32.243 1.00 69.61 C ATOM 129 CG GLU A 14 40.655 3.091 31.129 1.00 76.78 C ATOM 130 CD GLU A 14 40.799 2.314 29.822 1.00 83.00 C ATOM 131 OE1 GLU A 14 40.793 1.053 29.856 1.00 89.91 O ATOM 132 OE2 GLU A 14 40.947 2.957 28.758 1.00 77.14 O ATOM 133 H GLU A 14 43.149 1.461 30.478 1.00 0.00 H ATOM 134 N GLN A 15 44.037 1.194 33.501 1.00 53.28 N ATOM 135 CA GLN A 15 44.756 0.672 34.661 1.00 52.27 C ATOM 136 C GLN A 15 46.126 1.308 34.806 1.00 52.86 C ATOM 137 O GLN A 15 46.550 1.658 35.894 1.00 51.14 O ATOM 138 CB GLN A 15 44.966 -0.810 34.517 1.00 54.49 C ATOM 139 CG GLN A 15 43.940 -1.642 35.208 1.00 55.75 C ATOM 140 CD GLN A 15 44.209 -3.122 35.000 1.00 57.00 C ATOM 141 OE1 GLN A 15 44.397 -3.628 33.852 1.00 61.40 O ATOM 142 NE2 GLN A 15 44.224 -3.838 36.108 1.00 52.33 N ATOM 143 HE22 GLN A 15 44.064 -3.378 37.027 1.00 0.00 H ATOM 144 HE21 GLN A 15 44.395 -4.863 36.063 1.00 0.00 H ATOM 145 H GLN A 15 43.688 0.531 32.780 1.00 0.00 H ATOM 146 N LYS A 16 46.788 1.501 33.675 1.00 51.11 N ATOM 147 CA LYS A 16 48.088 2.128 33.656 1.00 49.99 C ATOM 148 C LYS A 16 48.033 3.603 33.986 1.00 52.03 C ATOM 149 O LYS A 16 48.911 4.120 34.675 1.00 65.51 O ATOM 150 CB LYS A 16 48.751 1.886 32.303 1.00 51.42 C ATOM 151 CG LYS A 16 49.140 0.424 32.155 1.00 53.32 C ATOM 152 CD LYS A 16 49.998 0.160 30.950 1.00 52.44 C ATOM 153 CE LYS A 16 49.190 0.160 29.674 1.00 55.33 C ATOM 154 NZ LYS A 16 49.837 -0.751 28.690 1.00 53.92 N ATOM 155 HZ1 LYS A 16 50.803 -0.418 28.494 1.00 0.00 H ATOM 156 HZ2 LYS A 16 49.874 -1.713 29.082 1.00 0.00 H ATOM 157 HZ3 LYS A 16 49.285 -0.755 27.809 1.00 0.00 H ATOM 158 H LYS A 16 46.360 1.193 32.778 1.00 0.00 H ATOM 159 N GLU A 17 47.027 4.294 33.478 1.00 55.83 N ATOM 160 CA GLU A 17 46.815 5.694 33.822 1.00 63.45 C ATOM 161 C GLU A 17 46.622 5.828 35.344 1.00 58.46 C ATOM 162 O GLU A 17 47.129 6.742 35.981 1.00 54.41 O ATOM 163 CB GLU A 17 45.595 6.212 33.082 1.00 68.02 C ATOM 164 CG GLU A 17 45.308 7.679 33.325 1.00 81.98 C ATOM 165 CD GLU A 17 44.289 8.260 32.355 1.00 93.89 C ATOM 166 OE1 GLU A 17 43.688 7.494 31.566 1.00 98.16 O ATOM 167 OE2 GLU A 17 44.068 9.492 32.404 1.00102.86 O ATOM 168 H GLU A 17 46.372 3.828 32.818 1.00 0.00 H ATOM 169 N THR A 18 45.885 4.891 35.912 1.00 54.59 N ATOM 170 CA THR A 18 45.630 4.886 37.342 1.00 52.97 C ATOM 171 C THR A 18 46.932 4.641 38.086 1.00 49.10 C ATOM 172 O THR A 18 47.225 5.310 39.067 1.00 37.87 O ATOM 173 CB THR A 18 44.572 3.794 37.683 1.00 53.81 C ATOM 174 OG1 THR A 18 43.333 4.123 37.049 1.00 56.02 O ATOM 175 CG2 THR A 18 44.339 3.634 39.183 1.00 52.00 C ATOM 176 HG1 THR A 18 43.466 4.163 36.069 1.00 0.00 H ATOM 177 H THR A 18 45.477 4.138 35.321 1.00 0.00 H ATOM 178 N LEU A 19 47.688 3.643 37.628 1.00 46.81 N ATOM 179 CA LEU A 19 48.977 3.331 38.225 1.00 46.66 C ATOM 180 C LEU A 19 49.852 4.566 38.303 1.00 48.73 C ATOM 181 O LEU A 19 50.425 4.870 39.342 1.00 45.64 O ATOM 182 CB LEU A 19 49.687 2.286 37.389 1.00 48.70 C ATOM 183 CG LEU A 19 51.095 1.874 37.837 1.00 46.81 C ATOM 184 CD1 LEU A 19 51.041 1.206 39.184 1.00 48.01 C ATOM 185 CD2 LEU A 19 51.690 0.931 36.813 1.00 44.75 C ATOM 186 H LEU A 19 47.348 3.075 36.826 1.00 0.00 H ATOM 187 N ILE A 20 49.931 5.291 37.195 1.00 46.98 N ATOM 188 CA ILE A 20 50.750 6.483 37.153 1.00 49.44 C ATOM 189 C ILE A 20 50.297 7.501 38.184 1.00 52.29 C ATOM 190 O ILE A 20 51.118 8.045 38.917 1.00 50.25 O ATOM 191 CB ILE A 20 50.767 7.106 35.750 1.00 48.86 C ATOM 192 CG1 ILE A 20 51.650 6.234 34.845 1.00 52.59 C ATOM 193 CG2 ILE A 20 51.277 8.541 35.783 1.00 40.10 C ATOM 194 CD1 ILE A 20 51.673 6.633 33.379 1.00 51.89 C ATOM 195 H ILE A 20 49.400 5.000 36.349 1.00 0.00 H ATOM 196 N ARG A 21 48.994 7.727 38.255 1.00 55.36 N ATOM 197 CA ARG A 21 48.469 8.724 39.167 1.00 59.84 C ATOM 198 C ARG A 21 48.693 8.339 40.617 1.00 52.97 C ATOM 199 O ARG A 21 49.265 9.109 41.383 1.00 55.84 O ATOM 200 CB ARG A 21 46.989 8.928 38.925 1.00 64.55 C ATOM 201 CG ARG A 21 46.418 10.096 39.707 1.00 71.36 C ATOM 202 CD ARG A 21 44.994 10.373 39.301 1.00 73.02 C ATOM 203 NE ARG A 21 44.860 10.803 37.892 1.00 75.07 N ATOM 204 CZ ARG A 21 44.315 10.128 36.862 1.00 68.88 C ATOM 205 NH1 ARG A 21 43.738 8.925 36.959 1.00 59.57 N ATOM 206 NH2 ARG A 21 44.356 10.728 35.672 1.00 71.81 N ATOM 207 HE ARG A 21 45.234 11.747 37.668 1.00 0.00 H ATOM 208 HH12 ARG A 21 43.340 8.470 36.113 1.00 0.00 H ATOM 209 HH11 ARG A 21 43.688 8.445 37.880 1.00 0.00 H ATOM 210 HH22 ARG A 21 43.951 10.257 34.838 1.00 0.00 H ATOM 211 HH21 ARG A 21 44.793 11.667 35.578 1.00 0.00 H ATOM 212 H ARG A 21 48.343 7.185 37.652 1.00 0.00 H ATOM 213 N GLU A 22 48.283 7.131 40.971 1.00 51.33 N ATOM 214 CA GLU A 22 48.337 6.663 42.359 1.00 53.93 C ATOM 215 C GLU A 22 49.770 6.603 42.895 1.00 47.32 C ATOM 216 O GLU A 22 50.035 6.975 44.028 1.00 42.98 O ATOM 217 CB GLU A 22 47.667 5.288 42.489 1.00 59.96 C ATOM 218 CG GLU A 22 46.186 5.286 42.072 1.00 76.97 C ATOM 219 CD GLU A 22 45.194 5.155 43.229 1.00 88.65 C ATOM 220 OE1 GLU A 22 44.067 4.419 43.262 1.00 99.85 O ATOM 221 OE2 GLU A 22 45.621 5.940 44.080 1.00 89.26 O ATOM 222 H GLU A 22 47.910 6.493 40.240 1.00 0.00 H ATOM 223 N VAL A 23 50.691 6.145 42.057 1.00 47.58 N ATOM 224 CA VAL A 23 52.099 6.099 42.418 1.00 42.15 C ATOM 225 C VAL A 23 52.670 7.507 42.531 1.00 39.32 C ATOM 226 O VAL A 23 53.340 7.814 43.510 1.00 37.84 O ATOM 227 CB VAL A 23 52.913 5.279 41.413 1.00 38.01 C ATOM 228 CG1 VAL A 23 54.382 5.484 41.648 1.00 38.77 C ATOM 229 CG2 VAL A 23 52.575 3.795 41.550 1.00 41.84 C ATOM 230 H VAL A 23 50.398 5.810 41.117 1.00 0.00 H ATOM 231 N SER A 24 52.369 8.371 41.578 1.00 40.12 N ATOM 232 CA SER A 24 52.886 9.732 41.703 1.00 44.34 C ATOM 233 C SER A 24 52.430 10.381 42.965 1.00 43.71 C ATOM 234 O SER A 24 53.170 11.090 43.592 1.00 39.63 O ATOM 235 CB SER A 24 52.493 10.633 40.624 1.00 46.74 C ATOM 236 OG SER A 24 53.056 11.919 40.623 1.00 68.28 O ATOM 237 HG SER A 24 52.810 12.386 41.460 1.00 0.00 H ATOM 238 H SER A 24 51.783 8.092 40.765 1.00 0.00 H ATOM 239 N GLU A 25 51.175 10.163 43.313 1.00 42.76 N ATOM 240 CA GLU A 25 50.643 10.759 44.517 1.00 40.69 C ATOM 241 C GLU A 25 51.326 10.199 45.737 1.00 36.84 C ATOM 242 O GLU A 25 51.720 10.940 46.596 1.00 34.17 O ATOM 243 CB GLU A 25 49.189 10.445 44.554 1.00 44.88 C ATOM 244 CG GLU A 25 48.338 11.045 45.749 1.00 44.00 C ATOM 245 CD GLU A 25 48.264 10.273 47.062 1.00 49.46 C ATOM 246 OE1 GLU A 25 48.230 9.038 47.052 1.00 53.01 O ATOM 247 OE2 GLU A 25 48.212 10.917 48.176 1.00 57.60 O ATOM 248 H GLU A 25 50.569 9.561 42.720 1.00 0.00 H ATOM 249 N ALA A 26 51.458 8.876 45.806 1.00 35.57 N ATOM 250 CA ALA A 26 52.124 8.247 46.935 1.00 36.11 C ATOM 251 C ALA A 26 53.557 8.785 47.138 1.00 35.33 C ATOM 252 O ALA A 26 54.015 8.947 48.255 1.00 30.50 O ATOM 253 CB ALA A 26 52.147 6.742 46.747 1.00 36.65 C ATOM 254 H ALA A 26 51.079 8.283 45.040 1.00 0.00 H ATOM 255 N ILE A 27 54.251 9.043 46.036 1.00 38.84 N ATOM 256 CA ILE A 27 55.590 9.619 46.091 1.00 40.27 C ATOM 257 C ILE A 27 55.521 11.028 46.662 1.00 39.52 C ATOM 258 O ILE A 27 56.228 11.355 47.620 1.00 41.69 O ATOM 259 CB ILE A 27 56.254 9.614 44.708 1.00 40.20 C ATOM 260 CG1 ILE A 27 56.614 8.178 44.313 1.00 41.16 C ATOM 261 CG2 ILE A 27 57.503 10.477 44.714 1.00 43.62 C ATOM 262 CD1 ILE A 27 57.020 7.998 42.872 1.00 43.57 C ATOM 263 H ILE A 27 53.829 8.829 45.110 1.00 0.00 H ATOM 264 N SER A 28 54.636 11.840 46.113 1.00 40.66 N ATOM 265 CA SER A 28 54.462 13.222 46.597 1.00 45.70 C ATOM 266 C SER A 28 54.135 13.294 48.095 1.00 42.20 C ATOM 267 O SER A 28 54.727 14.083 48.828 1.00 43.22 O ATOM 268 CB SER A 28 53.362 13.928 45.802 1.00 42.14 C ATOM 269 OG SER A 28 53.353 15.303 46.103 1.00 46.03 O ATOM 270 HG SER A 28 54.230 15.697 45.866 1.00 0.00 H ATOM 271 H SER A 28 54.051 11.498 45.324 1.00 0.00 H ATOM 272 N ARG A 29 53.212 12.449 48.519 1.00 42.84 N ATOM 273 CA ARG A 29 52.802 12.394 49.910 1.00 45.13 C ATOM 274 C ARG A 29 53.982 12.010 50.768 1.00 46.19 C ATOM 275 O ARG A 29 54.322 12.709 51.695 1.00 46.36 O ATOM 276 CB ARG A 29 51.686 11.338 50.134 1.00 49.54 C ATOM 277 CG ARG A 29 50.493 11.774 50.957 1.00 46.28 C ATOM 278 CD ARG A 29 49.218 10.964 50.666 1.00 49.85 C ATOM 279 NE ARG A 29 49.466 9.516 50.773 1.00 47.94 N ATOM 280 CZ ARG A 29 49.442 8.471 49.980 1.00 53.14 C ATOM 281 NH1 ARG A 29 49.888 7.397 50.592 1.00 57.11 N ATOM 282 NH2 ARG A 29 49.107 8.389 48.733 1.00 56.84 N ATOM 283 HE ARG A 29 49.733 9.249 51.742 1.00 0.00 H ATOM 284 HH12 ARG A 29 49.928 6.489 50.086 1.00 0.00 H ATOM 285 HH11 ARG A 29 50.201 7.455 51.582 1.00 0.00 H ATOM 286 HH22 ARG A 29 49.144 7.472 48.244 1.00 0.00 H ATOM 287 HH21 ARG A 29 48.801 9.240 48.220 1.00 0.00 H ATOM 288 H ARG A 29 52.766 11.804 47.836 1.00 0.00 H ATOM 289 N SER A 30 54.615 10.891 50.419 1.00 44.91 N ATOM 290 CA SER A 30 55.646 10.299 51.248 1.00 45.50 C ATOM 291 C SER A 30 56.860 11.196 51.470 1.00 43.89 C ATOM 292 O SER A 30 57.509 11.107 52.504 1.00 40.43 O ATOM 293 CB SER A 30 56.118 8.986 50.614 1.00 46.75 C ATOM 294 OG SER A 30 55.142 7.997 50.713 1.00 48.05 O ATOM 295 HG SER A 30 54.322 8.296 50.246 1.00 0.00 H ATOM 296 H SER A 30 54.361 10.427 49.523 1.00 0.00 H ATOM 297 N LEU A 31 57.220 11.978 50.461 1.00 43.82 N ATOM 298 CA LEU A 31 58.445 12.755 50.510 1.00 46.85 C ATOM 299 C LEU A 31 58.173 14.227 50.672 1.00 49.45 C ATOM 300 O LEU A 31 59.098 15.040 50.559 1.00 44.95 O ATOM 301 CB LEU A 31 59.238 12.582 49.214 1.00 47.66 C ATOM 302 CG LEU A 31 59.599 11.178 48.790 1.00 47.51 C ATOM 303 CD1 LEU A 31 60.449 11.255 47.526 1.00 49.80 C ATOM 304 CD2 LEU A 31 60.317 10.422 49.899 1.00 49.65 C ATOM 305 H LEU A 31 56.613 12.036 49.619 1.00 0.00 H ATOM 306 N ASP A 32 56.904 14.585 50.863 1.00 50.98 N ATOM 307 CA ASP A 32 56.515 15.986 50.913 1.00 53.89 C ATOM 308 C ASP A 32 57.097 16.764 49.726 1.00 49.91 C ATOM 309 O ASP A 32 57.649 17.840 49.898 1.00 53.66 O ATOM 310 CB ASP A 32 56.979 16.590 52.242 1.00 59.68 C ATOM 311 CG ASP A 32 55.985 17.553 52.818 1.00 66.57 C ATOM 312 OD1 ASP A 32 55.313 18.257 52.045 1.00 64.34 O ATOM 313 OD2 ASP A 32 55.841 17.561 54.058 1.00 81.25 O ATOM 314 H ASP A 32 56.178 13.849 50.978 1.00 0.00 H ATOM 315 N ALA A 33 57.029 16.176 48.539 1.00 44.44 N ATOM 316 CA ALA A 33 57.589 16.793 47.358 1.00 48.52 C ATOM 317 C ALA A 33 56.452 17.217 46.463 1.00 52.66 C ATOM 318 O ALA A 33 55.397 16.584 46.452 1.00 49.06 O ATOM 319 CB ALA A 33 58.490 15.814 46.614 1.00 49.89 C ATOM 320 H ALA A 33 56.562 15.250 48.456 1.00 0.00 H ATOM 321 N PRO A 34 56.668 18.273 45.679 1.00 57.80 N ATOM 322 CA PRO A 34 55.584 18.764 44.831 1.00 57.77 C ATOM 323 C PRO A 34 55.210 17.764 43.746 1.00 55.08 C ATOM 324 O PRO A 34 56.074 17.269 43.026 1.00 58.73 O ATOM 325 CB PRO A 34 56.149 20.060 44.224 1.00 61.05 C ATOM 326 CG PRO A 34 57.625 20.014 44.444 1.00 60.85 C ATOM 327 CD PRO A 34 57.892 19.093 45.593 1.00 59.60 C ATOM 328 N LEU A 35 53.915 17.470 43.647 1.00 58.13 N ATOM 329 CA LEU A 35 53.401 16.489 42.692 1.00 50.66 C ATOM 330 C LEU A 35 53.881 16.724 41.284 1.00 46.67 C ATOM 331 O LEU A 35 54.185 15.775 40.580 1.00 52.07 O ATOM 332 CB LEU A 35 51.877 16.462 42.703 1.00 51.66 C ATOM 333 CG LEU A 35 51.217 15.422 41.790 1.00 55.33 C ATOM 334 CD1 LEU A 35 51.607 13.995 42.199 1.00 62.96 C ATOM 335 CD2 LEU A 35 49.711 15.557 41.794 1.00 50.17 C ATOM 336 H LEU A 35 53.243 17.957 44.273 1.00 0.00 H ATOM 337 N THR A 36 54.016 17.971 40.883 1.00 46.19 N ATOM 338 CA THR A 36 54.370 18.287 39.483 1.00 44.71 C ATOM 339 C THR A 36 55.817 17.986 39.104 1.00 43.99 C ATOM 340 O THR A 36 56.141 17.954 37.927 1.00 50.28 O ATOM 341 CB THR A 36 54.137 19.780 39.181 1.00 44.67 C ATOM 342 OG1 THR A 36 54.957 20.550 40.063 1.00 42.97 O ATOM 343 CG2 THR A 36 52.663 20.141 39.394 1.00 42.94 C ATOM 344 HG1 THR A 36 54.820 21.514 39.882 1.00 0.00 H ATOM 345 H THR A 36 53.871 18.746 41.562 1.00 0.00 H ATOM 346 N SER A 37 56.681 17.736 40.083 1.00 45.67 N ATOM 347 CA SER A 37 58.064 17.319 39.801 1.00 44.37 C ATOM 348 C SER A 37 58.206 15.808 39.542 1.00 44.23 C ATOM 349 O SER A 37 59.237 15.340 39.031 1.00 49.46 O ATOM 350 CB SER A 37 58.975 17.747 40.961 1.00 45.53 C ATOM 351 OG SER A 37 58.546 17.199 42.197 1.00 43.21 O ATOM 352 HG SER A 37 57.626 17.509 42.393 1.00 0.00 H ATOM 353 H SER A 37 56.372 17.837 41.071 1.00 0.00 H ATOM 354 N VAL A 38 57.190 15.041 39.929 1.00 43.31 N ATOM 355 CA VAL A 38 57.259 13.571 39.889 1.00 42.54 C ATOM 356 C VAL A 38 57.088 13.022 38.489 1.00 40.22 C ATOM 357 O VAL A 38 56.120 13.328 37.797 1.00 44.70 O ATOM 358 CB VAL A 38 56.181 12.920 40.792 1.00 43.44 C ATOM 359 CG1 VAL A 38 56.271 11.411 40.727 1.00 43.26 C ATOM 360 CG2 VAL A 38 56.336 13.368 42.232 1.00 44.25 C ATOM 361 H VAL A 38 56.319 15.495 40.271 1.00 0.00 H ATOM 362 N ARG A 39 58.029 12.188 38.095 1.00 37.54 N ATOM 363 CA ARG A 39 57.994 11.518 36.818 1.00 39.42 C ATOM 364 C ARG A 39 57.816 10.030 37.020 1.00 37.92 C ATOM 365 O ARG A 39 58.436 9.451 37.905 1.00 42.23 O ATOM 366 CB ARG A 39 59.296 11.722 36.065 1.00 42.31 C ATOM 367 CG ARG A 39 59.252 12.832 35.055 1.00 48.02 C ATOM 368 CD ARG A 39 59.666 14.146 35.646 1.00 55.44 C ATOM 369 NE ARG A 39 59.691 15.155 34.598 1.00 63.80 N ATOM 370 CZ ARG A 39 59.318 16.416 34.748 1.00 71.68 C ATOM 371 NH1 ARG A 39 58.840 16.853 35.910 1.00 81.39 N ATOM 372 NH2 ARG A 39 59.408 17.247 33.717 1.00 78.15 N ATOM 373 HE ARG A 39 60.028 14.863 33.659 1.00 0.00 H ATOM 374 HH12 ARG A 39 58.551 17.847 36.013 1.00 0.00 H ATOM 375 HH11 ARG A 39 58.755 16.201 36.716 1.00 0.00 H ATOM 376 HH22 ARG A 39 59.118 18.240 33.823 1.00 0.00 H ATOM 377 HH21 ARG A 39 59.769 16.905 32.803 1.00 0.00 H ATOM 378 H ARG A 39 58.831 12.005 38.732 1.00 0.00 H ATOM 379 N VAL A 40 57.028 9.402 36.159 1.00 34.24 N ATOM 380 CA VAL A 40 56.873 7.977 36.194 1.00 31.55 C ATOM 381 C VAL A 40 57.019 7.394 34.811 1.00 33.12 C ATOM 382 O VAL A 40 56.405 7.863 33.850 1.00 34.26 O ATOM 383 CB VAL A 40 55.502 7.577 36.755 1.00 32.90 C ATOM 384 CG1 VAL A 40 55.356 6.062 36.753 1.00 33.09 C ATOM 385 CG2 VAL A 40 55.327 8.103 38.167 1.00 34.65 C ATOM 386 H VAL A 40 56.512 9.954 35.444 1.00 0.00 H ATOM 387 N ILE A 41 57.770 6.310 34.727 1.00 33.04 N ATOM 388 CA ILE A 41 57.927 5.579 33.496 1.00 32.15 C ATOM 389 C ILE A 41 57.432 4.172 33.696 1.00 35.86 C ATOM 390 O ILE A 41 57.817 3.489 34.663 1.00 35.80 O ATOM 391 CB ILE A 41 59.400 5.458 33.130 1.00 34.29 C ATOM 392 CG1 ILE A 41 59.966 6.850 32.914 1.00 35.93 C ATOM 393 CG2 ILE A 41 59.585 4.596 31.892 1.00 32.81 C ATOM 394 CD1 ILE A 41 61.467 6.867 32.815 1.00 39.03 C ATOM 395 H ILE A 41 58.264 5.974 35.578 1.00 0.00 H ATOM 396 N ILE A 42 56.565 3.732 32.795 1.00 35.10 N ATOM 397 CA ILE A 42 56.109 2.372 32.819 1.00 34.02 C ATOM 398 C ILE A 42 56.815 1.632 31.734 1.00 34.54 C ATOM 399 O ILE A 42 56.836 2.074 30.592 1.00 35.44 O ATOM 400 CB ILE A 42 54.585 2.293 32.605 1.00 34.00 C ATOM 401 CG1 ILE A 42 53.897 2.960 33.764 1.00 36.85 C ATOM 402 CG2 ILE A 42 54.123 0.841 32.510 1.00 32.73 C ATOM 403 CD1 ILE A 42 52.404 3.068 33.589 1.00 41.56 C ATOM 404 H ILE A 42 56.211 4.380 32.062 1.00 0.00 H ATOM 405 N THR A 43 57.303 0.448 32.070 1.00 34.79 N ATOM 406 CA THR A 43 57.985 -0.395 31.104 1.00 35.12 C ATOM 407 C THR A 43 57.310 -1.752 31.117 1.00 37.78 C ATOM 408 O THR A 43 57.334 -2.451 32.134 1.00 37.97 O ATOM 409 CB THR A 43 59.478 -0.539 31.477 1.00 34.25 C ATOM 410 OG1 THR A 43 60.095 0.753 31.476 1.00 32.78 O ATOM 411 CG2 THR A 43 60.190 -1.422 30.480 1.00 35.50 C ATOM 412 HG1 THR A 43 61.051 0.661 31.715 1.00 0.00 H ATOM 413 H THR A 43 57.195 0.114 33.049 1.00 0.00 H ATOM 414 N GLU A 44 56.698 -2.107 29.997 1.00 39.68 N ATOM 415 CA GLU A 44 55.972 -3.358 29.907 1.00 43.01 C ATOM 416 C GLU A 44 56.898 -4.462 29.515 1.00 42.23 C ATOM 417 O GLU A 44 57.725 -4.283 28.640 1.00 46.15 O ATOM 418 CB GLU A 44 54.860 -3.243 28.878 1.00 52.03 C ATOM 419 CG GLU A 44 53.575 -2.639 29.390 1.00 57.01 C ATOM 420 CD GLU A 44 52.409 -2.874 28.431 1.00 63.94 C ATOM 421 OE1 GLU A 44 52.617 -2.832 27.192 1.00 54.13 O ATOM 422 OE2 GLU A 44 51.280 -3.069 28.947 1.00 66.54 O ATOM 423 H GLU A 44 56.739 -1.478 29.170 1.00 0.00 H ATOM 424 N MET A 45 56.803 -5.596 30.180 1.00 40.29 N ATOM 425 CA MET A 45 57.619 -6.739 29.804 1.00 39.40 C ATOM 426 C MET A 45 56.779 -7.778 29.111 1.00 42.48 C ATOM 427 O MET A 45 55.683 -8.096 29.576 1.00 44.80 O ATOM 428 CB MET A 45 58.266 -7.409 31.031 1.00 41.32 C ATOM 429 CG MET A 45 59.004 -6.509 32.009 1.00 41.25 C ATOM 430 SD MET A 45 59.613 -7.474 33.402 1.00 51.70 S ATOM 431 CE MET A 45 58.259 -7.376 34.586 1.00 50.23 C ATOM 432 H MET A 45 56.141 -5.674 30.978 1.00 0.00 H ATOM 433 N ALA A 46 57.314 -8.335 28.025 1.00 44.56 N ATOM 434 CA ALA A 46 56.721 -9.514 27.396 1.00 44.31 C ATOM 435 C ALA A 46 56.827 -10.696 28.346 1.00 49.90 C ATOM 436 O ALA A 46 57.764 -10.788 29.129 1.00 52.80 O ATOM 437 CB ALA A 46 57.424 -9.827 26.093 1.00 44.63 C ATOM 438 H ALA A 46 58.175 -7.921 27.615 1.00 0.00 H ATOM 439 N LYS A 47 55.878 -11.622 28.263 1.00 58.93 N ATOM 440 CA LYS A 47 55.798 -12.731 29.226 1.00 53.31 C ATOM 441 C LYS A 47 56.979 -13.679 29.043 1.00 52.36 C ATOM 442 O LYS A 47 57.452 -14.298 29.989 1.00 44.77 O ATOM 443 CB LYS A 47 54.460 -13.461 29.099 1.00 68.11 C ATOM 444 CG LYS A 47 53.295 -12.536 28.750 1.00 81.31 C ATOM 445 CD LYS A 47 51.974 -12.942 29.376 1.00 90.26 C ATOM 446 CE LYS A 47 50.937 -11.903 28.994 1.00 94.82 C ATOM 447 NZ LYS A 47 49.556 -12.215 29.438 1.00 99.34 N ATOM 448 HZ1 LYS A 47 49.252 -13.115 29.014 1.00 0.00 H ATOM 449 HZ2 LYS A 47 49.536 -12.294 30.475 1.00 0.00 H ATOM 450 HZ3 LYS A 47 48.915 -11.454 29.135 1.00 0.00 H ATOM 451 H LYS A 47 55.175 -11.561 27.499 1.00 0.00 H ATOM 452 N GLY A 48 57.475 -13.774 27.807 1.00 55.12 N ATOM 453 CA GLY A 48 58.700 -14.535 27.512 1.00 53.96 C ATOM 454 C GLY A 48 60.019 -13.878 27.920 1.00 48.58 C ATOM 455 O GLY A 48 61.087 -14.398 27.607 1.00 43.78 O ATOM 456 H GLY A 48 56.980 -13.295 27.028 1.00 0.00 H ATOM 457 N HIS A 49 59.946 -12.692 28.517 1.00 45.16 N ATOM 458 CA HIS A 49 61.136 -11.932 28.867 1.00 45.87 C ATOM 459 C HIS A 49 61.327 -11.780 30.360 1.00 44.53 C ATOM 460 O HIS A 49 62.253 -11.089 30.786 1.00 47.79 O ATOM 461 CB HIS A 49 61.087 -10.541 28.247 1.00 46.81 C ATOM 462 CG HIS A 49 61.313 -10.535 26.779 1.00 43.36 C ATOM 463 ND1 HIS A 49 61.115 -9.408 26.006 1.00 45.40 N ATOM 464 CD2 HIS A 49 61.687 -11.522 25.933 1.00 42.55 C ATOM 465 CE1 HIS A 49 61.381 -9.702 24.742 1.00 50.00 C ATOM 466 NE2 HIS A 49 61.731 -10.979 24.672 1.00 47.13 N ATOM 467 H HIS A 49 59.011 -12.296 28.740 1.00 0.00 H ATOM 468 N PHE A 50 60.491 -12.439 31.145 1.00 43.76 N ATOM 469 CA PHE A 50 60.545 -12.313 32.579 1.00 45.46 C ATOM 470 C PHE A 50 60.637 -13.661 33.238 1.00 46.16 C ATOM 471 O PHE A 50 59.792 -14.509 33.028 1.00 47.72 O ATOM 472 CB PHE A 50 59.305 -11.604 33.081 1.00 45.81 C ATOM 473 CG PHE A 50 59.317 -11.350 34.550 1.00 50.95 C ATOM 474 CD1 PHE A 50 60.354 -10.638 35.140 1.00 51.11 C ATOM 475 CD2 PHE A 50 58.271 -11.777 35.342 1.00 54.22 C ATOM 476 CE1 PHE A 50 60.358 -10.398 36.502 1.00 53.64 C ATOM 477 CE2 PHE A 50 58.265 -11.530 36.705 1.00 55.91 C ATOM 478 CZ PHE A 50 59.311 -10.840 37.285 1.00 52.94 C ATOM 479 H PHE A 50 59.778 -13.063 30.717 1.00 0.00 H ATOM 480 N GLY A 51 61.674 -13.846 34.055 1.00 51.24 N ATOM 481 CA GLY A 51 61.949 -15.129 34.702 1.00 45.40 C ATOM 482 C GLY A 51 61.760 -15.065 36.189 1.00 43.27 C ATOM 483 O GLY A 51 62.141 -14.089 36.815 1.00 38.80 O ATOM 484 H GLY A 51 62.313 -13.046 34.240 1.00 0.00 H ATOM 485 N ILE A 52 61.202 -16.139 36.746 1.00 48.30 N ATOM 486 CA ILE A 52 61.194 -16.370 38.187 1.00 53.05 C ATOM 487 C ILE A 52 61.682 -17.776 38.465 1.00 53.03 C ATOM 488 O ILE A 52 61.253 -18.724 37.826 1.00 60.88 O ATOM 489 CB ILE A 52 59.801 -16.267 38.772 1.00 63.61 C ATOM 490 CG1 ILE A 52 59.153 -14.944 38.362 1.00 73.48 C ATOM 491 CG2 ILE A 52 59.885 -16.369 40.290 1.00 73.24 C ATOM 492 CD1 ILE A 52 57.674 -14.857 38.663 1.00 73.85 C ATOM 493 H ILE A 52 60.753 -16.843 36.127 1.00 0.00 H ATOM 494 N GLY A 53 62.640 -17.915 39.372 1.00 49.22 N ATOM 495 CA GLY A 53 63.261 -19.199 39.595 1.00 44.48 C ATOM 496 C GLY A 53 63.777 -19.854 38.331 1.00 48.72 C ATOM 497 O GLY A 53 63.852 -21.089 38.253 1.00 58.40 O ATOM 498 H GLY A 53 62.947 -17.091 39.928 1.00 0.00 H ATOM 499 N GLY A 54 64.198 -19.057 37.352 1.00 48.80 N ATOM 500 CA GLY A 54 64.820 -19.605 36.134 1.00 58.74 C ATOM 501 C GLY A 54 63.842 -20.067 35.082 1.00 54.05 C ATOM 502 O GLY A 54 64.254 -20.622 34.047 1.00 60.12 O ATOM 503 H GLY A 54 64.086 -18.028 37.449 1.00 0.00 H ATOM 504 N GLU A 55 62.560 -19.827 35.335 1.00 56.01 N ATOM 505 CA GLU A 55 61.483 -20.297 34.462 1.00 57.61 C ATOM 506 C GLU A 55 60.615 -19.118 34.074 1.00 48.06 C ATOM 507 O GLU A 55 60.409 -18.187 34.865 1.00 50.67 O ATOM 508 CB GLU A 55 60.650 -21.361 35.190 1.00 63.78 C ATOM 509 CG GLU A 55 61.405 -22.612 35.804 1.00 75.90 C ATOM 510 CD GLU A 55 60.484 -23.833 35.918 1.00 88.98 C ATOM 511 OE1 GLU A 55 59.273 -23.573 36.217 1.00 73.44 O ATOM 512 OE2 GLU A 55 60.982 -25.024 35.712 1.00106.26 O ATOM 513 H GLU A 55 62.312 -19.284 36.187 1.00 0.00 H ATOM 514 N LEU A 56 60.096 -19.131 32.860 1.00 47.86 N ATOM 515 CA LEU A 56 59.298 -17.993 32.362 1.00 53.86 C ATOM 516 C LEU A 56 58.043 -17.780 33.183 1.00 54.60 C ATOM 517 O LEU A 56 57.557 -18.703 33.831 1.00 61.69 O ATOM 518 CB LEU A 56 58.873 -18.195 30.917 1.00 56.33 C ATOM 519 CG LEU A 56 59.993 -18.418 29.874 1.00 58.78 C ATOM 520 CD1 LEU A 56 59.441 -18.648 28.472 1.00 59.25 C ATOM 521 CD2 LEU A 56 60.934 -17.232 29.854 1.00 57.41 C ATOM 522 H LEU A 56 60.252 -19.955 32.245 1.00 0.00 H ATOM 523 N ALA A 57 57.560 -16.547 33.236 1.00 59.85 N ATOM 524 CA ALA A 57 56.315 -16.270 33.947 1.00 68.18 C ATOM 525 C ALA A 57 55.130 -16.695 33.083 1.00 63.38 C ATOM 526 O ALA A 57 54.001 -16.813 33.600 1.00 64.48 O ATOM 527 CB ALA A 57 56.219 -14.789 34.294 1.00 72.97 C ATOM 528 H ALA A 57 58.071 -15.772 32.768 1.00 0.00 H ATOM 529 N SER A 58 55.401 -16.871 31.789 1.00 53.06 N ATOM 530 CA SER A 58 54.449 -17.400 30.835 1.00 56.82 C ATOM 531 C SER A 58 54.317 -18.969 30.853 1.00 57.49 C ATOM 532 O SER A 58 53.644 -19.542 29.995 1.00 48.05 O ATOM 533 CB SER A 58 54.789 -16.920 29.420 1.00 50.34 C ATOM 534 OG SER A 58 55.777 -17.729 28.818 1.00 49.19 O ATOM 535 HG SER A 58 55.449 -18.661 28.761 1.00 0.00 H ATOM 536 H SER A 58 56.349 -16.614 31.446 1.00 0.00 H ATOM 537 N LYS A 59 54.862 -19.622 31.878 1.00 55.77 N ATOM 538 CA LYS A 59 54.599 -21.037 32.168 1.00 54.21 C ATOM 539 C LYS A 59 54.509 -21.225 33.650 1.00 57.12 C ATOM 540 O LYS A 59 54.768 -22.316 34.219 1.00 77.28 O ATOM 541 CB LYS A 59 55.735 -21.858 31.664 1.00 55.16 C ATOM 542 CG LYS A 59 56.370 -21.330 30.398 1.00 59.55 C ATOM 543 CD LYS A 59 57.432 -22.287 29.885 1.00 61.59 C ATOM 544 CE LYS A 59 57.760 -22.024 28.421 1.00 68.93 C ATOM 545 NZ LYS A 59 58.366 -23.197 27.728 1.00 72.59 N ATOM 546 HZ1 LYS A 59 59.252 -23.460 28.204 1.00 0.00 H ATOM 547 HZ2 LYS A 59 57.703 -23.998 27.761 1.00 0.00 H ATOM 548 HZ3 LYS A 59 58.564 -22.949 26.738 1.00 0.00 H ATOM 549 H LYS A 59 55.508 -19.102 32.506 1.00 0.00 H ATOM 550 N VAL A 60 54.194 -20.125 34.306 1.00 56.03 N ATOM 551 CA VAL A 60 53.919 -20.148 35.708 1.00 58.54 C ATOM 552 C VAL A 60 52.820 -19.121 35.950 1.00 59.86 C ATOM 553 O VAL A 60 52.495 -18.805 37.088 1.00 71.07 O ATOM 554 CB VAL A 60 55.216 -19.811 36.475 1.00 61.70 C ATOM 555 CG1 VAL A 60 55.042 -19.998 37.985 1.00 71.67 C ATOM 556 CG2 VAL A 60 56.369 -20.674 35.980 1.00 56.88 C ATOM 557 H VAL A 60 54.145 -19.222 33.792 1.00 0.00 H ATOM 558 N ARG A 61 52.244 -18.609 34.864 1.00 55.40 N ATOM 559 CA ARG A 61 51.396 -17.435 34.910 1.00 55.38 C ATOM 560 C ARG A 61 50.722 -17.333 33.555 1.00 54.89 C ATOM 561 O ARG A 61 51.166 -17.943 32.584 1.00 49.01 O ATOM 562 CB ARG A 61 52.202 -16.156 35.213 1.00 59.28 C ATOM 563 CG ARG A 61 51.507 -15.169 36.129 1.00 67.65 C ATOM 564 CD ARG A 61 52.362 -14.793 37.327 1.00 67.91 C ATOM 565 NE ARG A 61 52.798 -15.989 38.047 1.00 67.13 N ATOM 566 CZ ARG A 61 53.681 -15.999 39.049 1.00 70.12 C ATOM 567 NH1 ARG A 61 54.237 -14.868 39.495 1.00 67.04 N ATOM 568 NH2 ARG A 61 54.006 -17.155 39.620 1.00 72.55 N ATOM 569 HE ARG A 61 52.390 -16.900 37.757 1.00 0.00 H ATOM 570 HH12 ARG A 61 54.922 -14.899 40.277 1.00 0.00 H ATOM 571 HH11 ARG A 61 53.984 -13.958 39.060 1.00 0.00 H ATOM 572 HH22 ARG A 61 54.692 -17.174 40.401 1.00 0.00 H ATOM 573 HH21 ARG A 61 53.574 -18.040 39.286 1.00 0.00 H ATOM 574 H ARG A 61 52.409 -19.070 33.947 1.00 0.00 H ATOM 575 N ARG A 62 49.669 -16.525 33.513 1.00 55.10 N ATOM 576 CA ARG A 62 48.694 -16.513 32.428 1.00 55.46 C ATOM 577 C ARG A 62 49.231 -15.908 31.134 1.00 56.10 C ATOM 578 O ARG A 62 50.111 -15.049 31.157 1.00 63.10 O ATOM 579 CB ARG A 62 47.425 -15.789 32.928 1.00 52.82 C ATOM 580 CG ARG A 62 46.475 -15.265 31.871 1.00 53.88 C ATOM 581 CD ARG A 62 45.061 -15.171 32.424 1.00 55.94 C ATOM 582 NE ARG A 62 44.135 -14.404 31.584 1.00 56.55 N ATOM 583 CZ ARG A 62 43.609 -14.804 30.422 1.00 62.71 C ATOM 584 NH1 ARG A 62 43.912 -15.981 29.867 1.00 68.62 N ATOM 585 NH2 ARG A 62 42.762 -14.005 29.792 1.00 63.42 N ATOM 586 HE ARG A 62 43.862 -13.460 31.925 1.00 0.00 H ATOM 587 HH12 ARG A 62 43.481 -16.255 28.961 1.00 0.00 H ATOM 588 HH11 ARG A 62 44.579 -16.623 30.341 1.00 0.00 H ATOM 589 HH22 ARG A 62 42.344 -14.301 28.887 1.00 0.00 H ATOM 590 HH21 ARG A 62 42.515 -13.082 30.202 1.00 0.00 H ATOM 591 H ARG A 62 49.531 -15.861 34.301 1.00 0.00 H TER 592 ARG A 62 ATOM 593 N PRO B 1 55.727 -7.035 39.591 1.00 53.54 N ATOM 594 CA PRO B 1 55.881 -5.549 39.475 1.00 47.93 C ATOM 595 C PRO B 1 57.013 -5.035 40.341 1.00 42.26 C ATOM 596 O PRO B 1 57.023 -5.276 41.556 1.00 37.70 O ATOM 597 CB PRO B 1 54.534 -4.973 39.982 1.00 46.19 C ATOM 598 CG PRO B 1 53.711 -6.131 40.438 1.00 47.97 C ATOM 599 CD PRO B 1 54.604 -7.362 40.503 1.00 50.08 C ATOM 600 HN2 PRO B 1 56.606 -7.444 39.967 1.00 0.00 H ATOM 601 HN1 PRO B 1 55.535 -7.436 38.651 1.00 0.00 H ATOM 602 N ILE B 2 57.967 -4.375 39.690 1.00 38.35 N ATOM 603 CA ILE B 2 59.214 -3.977 40.303 1.00 37.44 C ATOM 604 C ILE B 2 59.418 -2.510 40.038 1.00 34.26 C ATOM 605 O ILE B 2 59.508 -2.114 38.904 1.00 33.74 O ATOM 606 CB ILE B 2 60.378 -4.743 39.690 1.00 39.41 C ATOM 607 CG1 ILE B 2 60.214 -6.235 39.977 1.00 43.64 C ATOM 608 CG2 ILE B 2 61.690 -4.235 40.254 1.00 39.23 C ATOM 609 CD1 ILE B 2 61.233 -7.116 39.288 1.00 44.53 C ATOM 610 H ILE B 2 57.808 -4.134 38.691 1.00 0.00 H ATOM 611 N ALA B 3 59.503 -1.707 41.091 1.00 33.89 N ATOM 612 CA ALA B 3 59.657 -0.266 40.928 1.00 35.58 C ATOM 613 C ALA B 3 61.006 0.202 41.426 1.00 34.55 C ATOM 614 O ALA B 3 61.442 -0.217 42.501 1.00 39.70 O ATOM 615 CB ALA B 3 58.572 0.447 41.680 1.00 36.82 C ATOM 616 H ALA B 3 59.459 -2.112 42.048 1.00 0.00 H ATOM 617 N GLN B 4 61.672 1.039 40.643 1.00 31.70 N ATOM 618 CA GLN B 4 62.913 1.653 41.069 1.00 31.78 C ATOM 619 C GLN B 4 62.672 3.139 41.103 1.00 30.61 C ATOM 620 O GLN B 4 62.205 3.710 40.133 1.00 32.40 O ATOM 621 CB GLN B 4 64.068 1.317 40.129 1.00 34.93 C ATOM 622 CG GLN B 4 65.378 2.010 40.518 1.00 40.08 C ATOM 623 CD GLN B 4 66.561 1.589 39.663 1.00 44.48 C ATOM 624 OE1 GLN B 4 66.398 0.909 38.640 1.00 52.44 O ATOM 625 NE2 GLN B 4 67.764 1.976 40.077 1.00 47.02 N ATOM 626 HE22 GLN B 4 67.858 2.546 40.942 1.00 0.00 H ATOM 627 HE21 GLN B 4 68.611 1.708 39.536 1.00 0.00 H ATOM 628 H GLN B 4 61.294 1.260 39.700 1.00 0.00 H ATOM 629 N ILE B 5 62.989 3.763 42.221 1.00 26.03 N ATOM 630 CA ILE B 5 62.750 5.162 42.383 1.00 25.32 C ATOM 631 C ILE B 5 64.054 5.901 42.646 1.00 26.53 C ATOM 632 O ILE B 5 64.743 5.627 43.637 1.00 24.95 O ATOM 633 CB ILE B 5 61.804 5.403 43.561 1.00 26.58 C ATOM 634 CG1 ILE B 5 60.620 4.449 43.451 1.00 29.86 C ATOM 635 CG2 ILE B 5 61.313 6.839 43.566 1.00 25.81 C ATOM 636 CD1 ILE B 5 59.586 4.569 44.552 1.00 31.23 C ATOM 637 H ILE B 5 63.421 3.226 43.000 1.00 0.00 H ATOM 638 N HIS B 6 64.395 6.840 41.768 1.00 27.67 N ATOM 639 CA HIS B 6 65.575 7.649 41.970 1.00 28.68 C ATOM 640 C HIS B 6 65.176 8.919 42.682 1.00 29.53 C ATOM 641 O HIS B 6 64.299 9.637 42.231 1.00 28.65 O ATOM 642 CB HIS B 6 66.279 8.042 40.676 1.00 30.36 C ATOM 643 CG HIS B 6 66.999 6.925 40.000 1.00 35.50 C ATOM 644 ND1 HIS B 6 66.336 5.994 39.237 1.00 37.26 N ATOM 645 CD2 HIS B 6 68.321 6.608 39.930 1.00 37.01 C ATOM 646 CE1 HIS B 6 67.202 5.125 38.755 1.00 40.73 C ATOM 647 NE2 HIS B 6 68.414 5.473 39.162 1.00 40.79 N ATOM 648 H HIS B 6 63.805 6.994 40.926 1.00 0.00 H ATOM 649 N ILE B 7 65.826 9.191 43.810 1.00 30.69 N ATOM 650 CA ILE B 7 65.539 10.398 44.594 1.00 31.80 C ATOM 651 C ILE B 7 66.825 11.066 45.056 1.00 30.80 C ATOM 652 O ILE B 7 67.864 10.418 45.141 1.00 31.32 O ATOM 653 CB ILE B 7 64.697 10.099 45.845 1.00 31.52 C ATOM 654 CG1 ILE B 7 65.506 9.285 46.845 1.00 31.86 C ATOM 655 CG2 ILE B 7 63.434 9.376 45.454 1.00 34.83 C ATOM 656 CD1 ILE B 7 64.749 8.858 48.084 1.00 32.10 C ATOM 657 H ILE B 7 66.557 8.531 44.145 1.00 0.00 H ATOM 658 N LEU B 8 66.759 12.366 45.292 1.00 29.80 N ATOM 659 CA LEU B 8 67.899 13.060 45.819 1.00 33.93 C ATOM 660 C LEU B 8 68.195 12.565 47.205 1.00 35.24 C ATOM 661 O LEU B 8 67.289 12.313 47.999 1.00 34.15 O ATOM 662 CB LEU B 8 67.672 14.570 45.838 1.00 36.19 C ATOM 663 CG LEU B 8 67.852 15.195 44.468 1.00 39.75 C ATOM 664 CD1 LEU B 8 67.346 16.625 44.470 1.00 39.48 C ATOM 665 CD2 LEU B 8 69.312 15.133 44.027 1.00 43.88 C ATOM 666 H LEU B 8 65.880 12.886 45.095 1.00 0.00 H ATOM 667 N GLU B 9 69.480 12.452 47.501 1.00 39.97 N ATOM 668 CA GLU B 9 69.913 12.084 48.853 1.00 43.35 C ATOM 669 C GLU B 9 69.496 13.164 49.836 1.00 38.83 C ATOM 670 O GLU B 9 69.255 14.323 49.449 1.00 35.52 O ATOM 671 CB GLU B 9 71.436 11.895 48.899 1.00 46.17 C ATOM 672 CG GLU B 9 72.207 13.216 48.850 1.00 54.65 C ATOM 673 CD GLU B 9 73.725 13.043 48.755 1.00 58.47 C ATOM 674 OE1 GLU B 9 74.217 11.893 48.928 1.00 58.68 O ATOM 675 OE2 GLU B 9 74.391 14.071 48.472 1.00 52.38 O ATOM 676 H GLU B 9 70.193 12.627 46.764 1.00 0.00 H ATOM 677 N GLY B 10 69.389 12.775 51.100 1.00 35.02 N ATOM 678 CA GLY B 10 69.103 13.724 52.164 1.00 37.86 C ATOM 679 C GLY B 10 67.943 13.386 53.100 1.00 38.62 C ATOM 680 O GLY B 10 67.717 14.081 54.077 1.00 37.97 O ATOM 681 H GLY B 10 69.512 11.769 51.335 1.00 0.00 H ATOM 682 N ARG B 11 67.151 12.378 52.760 1.00 36.05 N ATOM 683 CA ARG B 11 65.931 12.082 53.490 1.00 35.01 C ATOM 684 C ARG B 11 66.232 11.115 54.635 1.00 36.64 C ATOM 685 O ARG B 11 67.229 10.407 54.605 1.00 33.58 O ATOM 686 CB ARG B 11 64.876 11.505 52.521 1.00 32.68 C ATOM 687 CG ARG B 11 64.610 12.388 51.307 1.00 30.06 C ATOM 688 CD ARG B 11 63.155 12.746 51.051 1.00 27.59 C ATOM 689 NE ARG B 11 62.940 13.544 49.838 1.00 25.62 N ATOM 690 CZ ARG B 11 62.256 14.674 49.786 1.00 24.96 C ATOM 691 NH1 ARG B 11 62.101 15.234 48.593 1.00 23.74 N ATOM 692 NH2 ARG B 11 61.769 15.272 50.876 1.00 24.64 N ATOM 693 HE ARG B 11 63.357 13.194 48.952 1.00 0.00 H ATOM 694 HH12 ARG B 11 61.570 16.124 48.501 1.00 0.00 H ATOM 695 HH11 ARG B 11 62.510 14.783 47.750 1.00 0.00 H ATOM 696 HH22 ARG B 11 61.236 16.161 50.787 1.00 0.00 H ATOM 697 HH21 ARG B 11 61.922 14.849 51.814 1.00 0.00 H ATOM 698 H ARG B 11 67.411 11.783 51.948 1.00 0.00 H ATOM 699 N SER B 12 65.325 11.048 55.599 1.00 38.84 N ATOM 700 CA SER B 12 65.489 10.138 56.739 1.00 38.78 C ATOM 701 C SER B 12 65.107 8.703 56.378 1.00 39.28 C ATOM 702 O SER B 12 64.315 8.472 55.442 1.00 44.06 O ATOM 703 CB SER B 12 64.593 10.588 57.876 1.00 39.44 C ATOM 704 OG SER B 12 63.213 10.441 57.516 1.00 43.09 O ATOM 705 HG SER B 12 63.025 9.490 57.315 1.00 0.00 H ATOM 706 H SER B 12 64.480 11.652 55.547 1.00 0.00 H ATOM 707 N ASP B 13 65.584 7.754 57.160 1.00 35.03 N ATOM 708 CA ASP B 13 65.171 6.382 57.013 1.00 37.40 C ATOM 709 C ASP B 13 63.658 6.180 57.134 1.00 41.19 C ATOM 710 O ASP B 13 63.093 5.304 56.464 1.00 41.91 O ATOM 711 CB ASP B 13 65.886 5.510 58.031 1.00 37.41 C ATOM 712 CG ASP B 13 67.344 5.280 57.674 1.00 40.26 C ATOM 713 OD1 ASP B 13 67.829 5.861 56.676 1.00 48.57 O ATOM 714 OD2 ASP B 13 68.022 4.484 58.377 1.00 49.06 O ATOM 715 H ASP B 13 66.273 8.002 57.899 1.00 0.00 H ATOM 716 N GLU B 14 62.992 6.989 57.961 1.00 48.26 N ATOM 717 CA GLU B 14 61.541 6.834 58.189 1.00 48.97 C ATOM 718 C GLU B 14 60.780 7.245 56.943 1.00 47.14 C ATOM 719 O GLU B 14 59.894 6.528 56.477 1.00 45.07 O ATOM 720 CB GLU B 14 61.053 7.670 59.367 1.00 54.27 C ATOM 721 CG GLU B 14 61.587 7.249 60.728 1.00 63.27 C ATOM 722 CD GLU B 14 63.055 7.631 60.942 1.00 75.35 C ATOM 723 OE1 GLU B 14 63.436 8.787 60.653 1.00 79.50 O ATOM 724 OE2 GLU B 14 63.839 6.763 61.388 1.00 83.98 O ATOM 725 H GLU B 14 63.506 7.745 58.456 1.00 0.00 H ATOM 726 N GLN B 15 61.140 8.400 56.388 1.00 45.71 N ATOM 727 CA GLN B 15 60.530 8.872 55.140 1.00 44.62 C ATOM 728 C GLN B 15 60.620 7.831 54.034 1.00 40.67 C ATOM 729 O GLN B 15 59.682 7.638 53.264 1.00 45.59 O ATOM 730 CB GLN B 15 61.208 10.128 54.660 1.00 47.11 C ATOM 731 CG GLN B 15 60.555 11.380 55.110 1.00 54.28 C ATOM 732 CD GLN B 15 61.308 12.596 54.598 1.00 65.42 C ATOM 733 OE1 GLN B 15 62.559 12.761 54.793 1.00 72.15 O ATOM 734 NE2 GLN B 15 60.553 13.479 53.947 1.00 58.50 N ATOM 735 HE22 GLN B 15 59.538 13.297 53.815 1.00 0.00 H ATOM 736 HE21 GLN B 15 60.979 14.350 53.571 1.00 0.00 H ATOM 737 H GLN B 15 61.869 8.980 56.849 1.00 0.00 H ATOM 738 N LYS B 16 61.767 7.191 53.945 1.00 37.36 N ATOM 739 CA LYS B 16 62.001 6.205 52.920 1.00 38.50 C ATOM 740 C LYS B 16 61.213 4.929 53.160 1.00 37.93 C ATOM 741 O LYS B 16 60.712 4.328 52.210 1.00 40.95 O ATOM 742 CB LYS B 16 63.496 5.928 52.796 1.00 35.41 C ATOM 743 CG LYS B 16 64.219 7.119 52.166 1.00 32.46 C ATOM 744 CD LYS B 16 65.670 6.800 51.830 1.00 32.46 C ATOM 745 CE LYS B 16 66.567 6.780 53.066 1.00 33.32 C ATOM 746 NZ LYS B 16 67.928 7.195 52.696 1.00 34.87 N ATOM 747 HZ1 LYS B 16 68.307 6.540 51.983 1.00 0.00 H ATOM 748 HZ2 LYS B 16 67.901 8.158 52.304 1.00 0.00 H ATOM 749 HZ3 LYS B 16 68.535 7.180 53.540 1.00 0.00 H ATOM 750 H LYS B 16 62.521 7.402 54.630 1.00 0.00 H ATOM 751 N GLU B 17 61.111 4.525 54.413 1.00 36.99 N ATOM 752 CA GLU B 17 60.286 3.397 54.775 1.00 41.98 C ATOM 753 C GLU B 17 58.821 3.665 54.381 1.00 38.66 C ATOM 754 O GLU B 17 58.131 2.792 53.856 1.00 35.21 O ATOM 755 CB GLU B 17 60.386 3.167 56.261 1.00 49.68 C ATOM 756 CG GLU B 17 59.591 1.964 56.754 1.00 63.42 C ATOM 757 CD GLU B 17 59.936 1.563 58.184 1.00 75.71 C ATOM 758 OE1 GLU B 17 60.709 2.291 58.858 1.00 84.90 O ATOM 759 OE2 GLU B 17 59.424 0.519 58.638 1.00 81.87 O ATOM 760 H GLU B 17 61.636 5.030 55.155 1.00 0.00 H ATOM 761 N THR B 18 58.379 4.896 54.607 1.00 35.43 N ATOM 762 CA THR B 18 57.050 5.305 54.243 1.00 32.46 C ATOM 763 C THR B 18 56.873 5.282 52.724 1.00 31.48 C ATOM 764 O THR B 18 55.879 4.741 52.211 1.00 32.72 O ATOM 765 CB THR B 18 56.773 6.714 54.790 1.00 35.44 C ATOM 766 OG1 THR B 18 56.828 6.691 56.207 1.00 34.23 O ATOM 767 CG2 THR B 18 55.399 7.253 54.356 1.00 37.57 C ATOM 768 HG1 THR B 18 57.727 6.395 56.496 1.00 0.00 H ATOM 769 H THR B 18 59.013 5.585 55.061 1.00 0.00 H ATOM 770 N LEU B 19 57.833 5.839 52.003 1.00 29.28 N ATOM 771 CA LEU B 19 57.814 5.816 50.541 1.00 28.71 C ATOM 772 C LEU B 19 57.630 4.409 50.024 1.00 28.75 C ATOM 773 O LEU B 19 56.799 4.157 49.159 1.00 28.55 O ATOM 774 CB LEU B 19 59.132 6.367 50.024 1.00 32.30 C ATOM 775 CG LEU B 19 59.326 6.386 48.514 1.00 34.20 C ATOM 776 CD1 LEU B 19 58.328 7.300 47.865 1.00 35.12 C ATOM 777 CD2 LEU B 19 60.738 6.817 48.178 1.00 33.71 C ATOM 778 H LEU B 19 58.624 6.307 52.490 1.00 0.00 H ATOM 779 N ILE B 20 58.397 3.476 50.576 1.00 28.98 N ATOM 780 CA ILE B 20 58.333 2.105 50.122 1.00 33.11 C ATOM 781 C ILE B 20 56.943 1.517 50.338 1.00 34.45 C ATOM 782 O ILE B 20 56.364 0.916 49.414 1.00 35.19 O ATOM 783 CB ILE B 20 59.389 1.223 50.807 1.00 33.88 C ATOM 784 CG1 ILE B 20 60.746 1.526 50.181 1.00 36.66 C ATOM 785 CG2 ILE B 20 59.063 -0.251 50.659 1.00 31.37 C ATOM 786 CD1 ILE B 20 61.927 0.829 50.838 1.00 36.73 C ATOM 787 H ILE B 20 59.050 3.734 51.343 1.00 0.00 H ATOM 788 N ARG B 21 56.384 1.744 51.512 1.00 36.61 N ATOM 789 CA ARG B 21 55.075 1.199 51.837 1.00 41.67 C ATOM 790 C ARG B 21 53.963 1.802 50.979 1.00 42.09 C ATOM 791 O ARG B 21 53.235 1.072 50.302 1.00 41.86 O ATOM 792 CB ARG B 21 54.754 1.442 53.287 1.00 46.52 C ATOM 793 CG ARG B 21 53.499 0.719 53.735 1.00 53.11 C ATOM 794 CD ARG B 21 53.301 0.853 55.222 1.00 54.63 C ATOM 795 NE ARG B 21 54.370 0.205 55.998 1.00 61.26 N ATOM 796 CZ ARG B 21 55.329 0.786 56.747 1.00 63.16 C ATOM 797 NH1 ARG B 21 55.430 2.103 56.966 1.00 60.03 N ATOM 798 NH2 ARG B 21 56.209 -0.028 57.338 1.00 65.31 N ATOM 799 HE ARG B 21 54.388 -0.834 55.965 1.00 0.00 H ATOM 800 HH12 ARG B 21 56.201 2.474 57.557 1.00 0.00 H ATOM 801 HH11 ARG B 21 54.738 2.755 56.545 1.00 0.00 H ATOM 802 HH22 ARG B 21 56.969 0.368 57.927 1.00 0.00 H ATOM 803 HH21 ARG B 21 56.134 -1.057 57.209 1.00 0.00 H ATOM 804 H ARG B 21 56.887 2.321 52.216 1.00 0.00 H ATOM 805 N GLU B 22 53.915 3.122 50.926 1.00 41.17 N ATOM 806 CA GLU B 22 52.865 3.814 50.202 1.00 45.24 C ATOM 807 C GLU B 22 52.875 3.537 48.700 1.00 47.48 C ATOM 808 O GLU B 22 51.819 3.370 48.085 1.00 43.49 O ATOM 809 CB GLU B 22 52.973 5.311 50.440 1.00 49.30 C ATOM 810 CG GLU B 22 52.840 5.653 51.918 1.00 57.20 C ATOM 811 CD GLU B 22 51.476 6.132 52.355 1.00 67.68 C ATOM 812 OE1 GLU B 22 51.248 6.081 53.563 1.00 76.20 O ATOM 813 OE2 GLU B 22 50.703 6.707 51.530 1.00 96.63 O ATOM 814 H GLU B 22 54.646 3.677 51.414 1.00 0.00 H ATOM 815 N VAL B 23 54.068 3.492 48.111 1.00 42.42 N ATOM 816 CA VAL B 23 54.193 3.168 46.712 1.00 36.52 C ATOM 817 C VAL B 23 53.820 1.727 46.467 1.00 34.30 C ATOM 818 O VAL B 23 53.072 1.414 45.536 1.00 35.75 O ATOM 819 CB VAL B 23 55.617 3.444 46.207 1.00 39.43 C ATOM 820 CG1 VAL B 23 55.831 2.799 44.838 1.00 38.10 C ATOM 821 CG2 VAL B 23 55.881 4.948 46.131 1.00 36.05 C ATOM 822 H VAL B 23 54.922 3.694 48.668 1.00 0.00 H ATOM 823 N SER B 24 54.311 0.831 47.309 1.00 35.93 N ATOM 824 CA SER B 24 53.954 -0.589 47.156 1.00 39.41 C ATOM 825 C SER B 24 52.417 -0.788 47.179 1.00 39.74 C ATOM 826 O SER B 24 51.856 -1.520 46.359 1.00 41.49 O ATOM 827 CB SER B 24 54.619 -1.444 48.253 1.00 38.60 C ATOM 828 OG SER B 24 56.009 -1.582 48.031 1.00 36.33 O ATOM 829 HG SER B 24 56.404 -2.135 48.751 1.00 0.00 H ATOM 830 H SER B 24 54.947 1.129 48.076 1.00 0.00 H ATOM 831 N GLU B 25 51.755 -0.085 48.090 1.00 41.76 N ATOM 832 CA GLU B 25 50.317 -0.150 48.222 1.00 46.63 C ATOM 833 C GLU B 25 49.661 0.396 46.955 1.00 45.68 C ATOM 834 O GLU B 25 48.776 -0.245 46.376 1.00 49.49 O ATOM 835 CB GLU B 25 49.869 0.597 49.490 1.00 58.18 C ATOM 836 CG GLU B 25 49.759 -0.328 50.699 1.00 66.84 C ATOM 837 CD GLU B 25 49.805 0.433 52.048 1.00 89.69 C ATOM 838 OE1 GLU B 25 49.768 -0.041 53.266 1.00 94.45 O ATOM 839 OE2 GLU B 25 49.849 1.631 51.828 1.00 92.11 O ATOM 840 H GLU B 25 52.290 0.535 48.732 1.00 0.00 H ATOM 841 N ALA B 26 50.107 1.562 46.498 1.00 42.68 N ATOM 842 CA ALA B 26 49.524 2.176 45.313 1.00 41.88 C ATOM 843 C ALA B 26 49.613 1.256 44.100 1.00 43.43 C ATOM 844 O ALA B 26 48.719 1.228 43.248 1.00 45.51 O ATOM 845 CB ALA B 26 50.179 3.515 45.030 1.00 41.13 C ATOM 846 H ALA B 26 50.884 2.043 46.994 1.00 0.00 H ATOM 847 N ILE B 27 50.711 0.520 44.003 1.00 44.87 N ATOM 848 CA ILE B 27 50.920 -0.393 42.880 1.00 41.91 C ATOM 849 C ILE B 27 49.926 -1.531 43.000 1.00 43.21 C ATOM 850 O ILE B 27 49.205 -1.842 42.042 1.00 41.78 O ATOM 851 CB ILE B 27 52.371 -0.912 42.841 1.00 38.82 C ATOM 852 CG1 ILE B 27 53.304 0.203 42.390 1.00 37.54 C ATOM 853 CG2 ILE B 27 52.503 -2.103 41.909 1.00 37.54 C ATOM 854 CD1 ILE B 27 54.772 -0.098 42.576 1.00 37.39 C ATOM 855 H ILE B 27 51.440 0.593 44.741 1.00 0.00 H ATOM 856 N SER B 28 49.860 -2.130 44.182 1.00 42.76 N ATOM 857 CA SER B 28 48.928 -3.240 44.423 1.00 46.78 C ATOM 858 C SER B 28 47.464 -2.850 44.121 1.00 47.17 C ATOM 859 O SER B 28 46.741 -3.589 43.454 1.00 45.50 O ATOM 860 CB SER B 28 49.031 -3.706 45.867 1.00 45.80 C ATOM 861 OG SER B 28 48.294 -4.889 46.047 1.00 47.76 O ATOM 862 HG SER B 28 48.653 -5.594 45.451 1.00 0.00 H ATOM 863 H SER B 28 50.480 -1.808 44.953 1.00 0.00 H ATOM 864 N ARG B 29 47.068 -1.677 44.598 1.00 46.25 N ATOM 865 CA ARG B 29 45.737 -1.171 44.366 1.00 49.57 C ATOM 866 C ARG B 29 45.512 -1.034 42.877 1.00 49.45 C ATOM 867 O ARG B 29 44.536 -1.540 42.353 1.00 55.85 O ATOM 868 CB ARG B 29 45.519 0.206 45.045 1.00 54.33 C ATOM 869 CG ARG B 29 44.263 0.335 45.886 1.00 62.76 C ATOM 870 CD ARG B 29 44.353 1.352 47.027 1.00 66.47 C ATOM 871 NE ARG B 29 45.163 2.504 46.623 1.00 72.44 N ATOM 872 CZ ARG B 29 46.239 2.990 47.258 1.00 68.21 C ATOM 873 NH1 ARG B 29 46.715 2.466 48.387 1.00 69.17 N ATOM 874 NH2 ARG B 29 46.848 4.050 46.765 1.00 60.40 N ATOM 875 HE ARG B 29 44.873 2.996 45.754 1.00 0.00 H ATOM 876 HH12 ARG B 29 47.554 2.882 48.840 1.00 0.00 H ATOM 877 HH11 ARG B 29 46.248 1.641 48.815 1.00 0.00 H ATOM 878 HH22 ARG B 29 47.684 4.440 47.245 1.00 0.00 H ATOM 879 HH21 ARG B 29 46.492 4.497 45.896 1.00 0.00 H ATOM 880 H ARG B 29 47.736 -1.106 45.155 1.00 0.00 H ATOM 881 N SER B 30 46.389 -0.293 42.224 1.00 48.15 N ATOM 882 CA SER B 30 46.176 0.128 40.847 1.00 48.90 C ATOM 883 C SER B 30 46.091 -1.008 39.862 1.00 49.47 C ATOM 884 O SER B 30 45.401 -0.906 38.855 1.00 51.70 O ATOM 885 CB SER B 30 47.313 1.060 40.420 1.00 52.63 C ATOM 886 OG SER B 30 47.222 2.325 41.062 1.00 56.42 O ATOM 887 HG SER B 30 47.271 2.200 42.043 1.00 0.00 H ATOM 888 H SER B 30 47.261 -0.001 42.710 1.00 0.00 H ATOM 889 N LEU B 31 46.826 -2.079 40.128 1.00 54.70 N ATOM 890 CA LEU B 31 46.931 -3.181 39.190 1.00 56.64 C ATOM 891 C LEU B 31 46.224 -4.410 39.688 1.00 66.65 C ATOM 892 O LEU B 31 46.324 -5.484 39.067 1.00 72.74 O ATOM 893 CB LEU B 31 48.387 -3.572 38.977 1.00 55.40 C ATOM 894 CG LEU B 31 49.360 -2.490 38.533 1.00 55.80 C ATOM 895 CD1 LEU B 31 50.715 -3.129 38.302 1.00 52.65 C ATOM 896 CD2 LEU B 31 48.868 -1.777 37.284 1.00 57.60 C ATOM 897 H LEU B 31 47.340 -2.130 41.031 1.00 0.00 H ATOM 898 N ASP B 32 45.520 -4.279 40.802 1.00 68.03 N ATOM 899 CA ASP B 32 44.860 -5.427 41.392 1.00 77.30 C ATOM 900 C ASP B 32 45.840 -6.600 41.490 1.00 68.18 C ATOM 901 O ASP B 32 45.489 -7.737 41.208 1.00 67.98 O ATOM 902 CB ASP B 32 43.626 -5.822 40.560 1.00 81.98 C ATOM 903 CG ASP B 32 42.460 -6.235 41.421 1.00 96.96 C ATOM 904 OD1 ASP B 32 42.682 -6.857 42.486 1.00106.84 O ATOM 905 OD2 ASP B 32 41.316 -5.915 41.046 1.00107.95 O ATOM 906 H ASP B 32 45.440 -3.347 41.256 1.00 0.00 H ATOM 907 N ALA B 33 47.062 -6.307 41.915 1.00 60.27 N ATOM 908 CA ALA B 33 48.087 -7.329 42.069 1.00 55.21 C ATOM 909 C ALA B 33 48.362 -7.563 43.544 1.00 46.63 C ATOM 910 O ALA B 33 48.222 -6.642 44.363 1.00 44.37 O ATOM 911 CB ALA B 33 49.364 -6.903 41.378 1.00 53.37 C ATOM 912 H ALA B 33 47.294 -5.320 42.145 1.00 0.00 H ATOM 913 N PRO B 34 48.752 -8.796 43.894 1.00 41.58 N ATOM 914 CA PRO B 34 48.969 -9.090 45.324 1.00 44.40 C ATOM 915 C PRO B 34 50.143 -8.269 45.890 1.00 45.20 C ATOM 916 O PRO B 34 51.236 -8.272 45.311 1.00 45.40 O ATOM 917 CB PRO B 34 49.250 -10.595 45.353 1.00 39.56 C ATOM 918 CG PRO B 34 49.559 -10.975 43.930 1.00 39.76 C ATOM 919 CD PRO B 34 48.953 -9.966 43.026 1.00 38.95 C ATOM 920 N LEU B 35 49.899 -7.576 47.001 1.00 41.70 N ATOM 921 CA LEU B 35 50.898 -6.754 47.630 1.00 41.96 C ATOM 922 C LEU B 35 52.237 -7.470 47.815 1.00 45.91 C ATOM 923 O LEU B 35 53.280 -6.845 47.670 1.00 45.44 O ATOM 924 CB LEU B 35 50.416 -6.237 48.986 1.00 44.72 C ATOM 925 CG LEU B 35 51.357 -5.276 49.739 1.00 49.92 C ATOM 926 CD1 LEU B 35 51.598 -3.994 48.921 1.00 53.10 C ATOM 927 CD2 LEU B 35 50.820 -4.920 51.116 1.00 48.78 C ATOM 928 H LEU B 35 48.953 -7.631 47.429 1.00 0.00 H ATOM 929 N THR B 36 52.223 -8.759 48.138 1.00 48.61 N ATOM 930 CA THR B 36 53.464 -9.476 48.476 1.00 50.83 C ATOM 931 C THR B 36 54.381 -9.757 47.286 1.00 47.84 C ATOM 932 O THR B 36 55.532 -10.089 47.482 1.00 49.47 O ATOM 933 CB THR B 36 53.159 -10.823 49.133 1.00 54.65 C ATOM 934 OG1 THR B 36 52.388 -11.595 48.209 1.00 53.58 O ATOM 935 CG2 THR B 36 52.376 -10.624 50.441 1.00 54.69 C ATOM 936 HG1 THR B 36 52.177 -12.475 48.611 1.00 0.00 H ATOM 937 H THR B 36 51.318 -9.271 48.152 1.00 0.00 H ATOM 938 N SER B 37 53.883 -9.584 46.072 1.00 45.17 N ATOM 939 CA SER B 37 54.710 -9.707 44.875 1.00 44.27 C ATOM 940 C SER B 37 55.467 -8.407 44.509 1.00 48.88 C ATOM 941 O SER B 37 56.444 -8.434 43.730 1.00 47.84 O ATOM 942 CB SER B 37 53.851 -10.130 43.684 1.00 45.95 C ATOM 943 OG SER B 37 52.799 -9.199 43.446 1.00 47.42 O ATOM 944 HG SER B 37 52.221 -9.144 44.248 1.00 0.00 H ATOM 945 H SER B 37 52.874 -9.354 45.968 1.00 0.00 H ATOM 946 N VAL B 38 55.048 -7.279 45.095 1.00 48.86 N ATOM 947 CA VAL B 38 55.618 -5.973 44.758 1.00 44.20 C ATOM 948 C VAL B 38 56.998 -5.748 45.370 1.00 41.83 C ATOM 949 O VAL B 38 57.192 -5.849 46.577 1.00 38.56 O ATOM 950 CB VAL B 38 54.714 -4.827 45.216 1.00 49.33 C ATOM 951 CG1 VAL B 38 55.305 -3.475 44.840 1.00 47.86 C ATOM 952 CG2 VAL B 38 53.327 -4.956 44.584 1.00 54.01 C ATOM 953 H VAL B 38 54.295 -7.332 45.811 1.00 0.00 H ATOM 954 N ARG B 39 57.941 -5.393 44.508 1.00 39.14 N ATOM 955 CA ARG B 39 59.273 -5.029 44.918 1.00 38.01 C ATOM 956 C ARG B 39 59.506 -3.560 44.680 1.00 33.12 C ATOM 957 O ARG B 39 59.143 -3.024 43.638 1.00 28.35 O ATOM 958 CB ARG B 39 60.295 -5.811 44.110 1.00 45.54 C ATOM 959 CG ARG B 39 60.800 -7.054 44.788 1.00 53.70 C ATOM 960 CD ARG B 39 59.980 -8.264 44.449 1.00 65.23 C ATOM 961 NE ARG B 39 60.569 -9.476 44.991 1.00 82.69 N ATOM 962 CZ ARG B 39 59.888 -10.470 45.549 1.00 95.29 C ATOM 963 NH1 ARG B 39 58.569 -10.413 45.674 1.00 97.12 N ATOM 964 NH2 ARG B 39 60.547 -11.524 46.006 1.00110.67 N ATOM 965 HE ARG B 39 61.603 -9.573 44.938 1.00 0.00 H ATOM 966 HH12 ARG B 39 58.054 -11.202 46.114 1.00 0.00 H ATOM 967 HH11 ARG B 39 58.050 -9.579 45.332 1.00 0.00 H ATOM 968 HH22 ARG B 39 60.028 -12.311 46.446 1.00 0.00 H ATOM 969 HH21 ARG B 39 61.583 -11.565 45.925 1.00 0.00 H ATOM 970 H ARG B 39 57.709 -5.377 43.494 1.00 0.00 H ATOM 971 N VAL B 40 60.193 -2.915 45.611 1.00 31.22 N ATOM 972 CA VAL B 40 60.606 -1.526 45.413 1.00 30.98 C ATOM 973 C VAL B 40 62.067 -1.317 45.723 1.00 33.36 C ATOM 974 O VAL B 40 62.596 -1.786 46.747 1.00 39.54 O ATOM 975 CB VAL B 40 59.814 -0.572 46.303 1.00 30.84 C ATOM 976 CG1 VAL B 40 60.272 0.858 46.097 1.00 29.35 C ATOM 977 CG2 VAL B 40 58.334 -0.706 45.990 1.00 31.30 C ATOM 978 H VAL B 40 60.442 -3.403 46.495 1.00 0.00 H ATOM 979 N ILE B 41 62.735 -0.591 44.841 1.00 32.77 N ATOM 980 CA ILE B 41 64.121 -0.236 45.040 1.00 30.50 C ATOM 981 C ILE B 41 64.204 1.254 45.106 1.00 27.28 C ATOM 982 O ILE B 41 63.777 1.934 44.182 1.00 26.12 O ATOM 983 CB ILE B 41 64.984 -0.728 43.852 1.00 30.72 C ATOM 984 CG1 ILE B 41 64.905 -2.246 43.747 1.00 31.76 C ATOM 985 CG2 ILE B 41 66.429 -0.282 44.010 1.00 29.19 C ATOM 986 CD1 ILE B 41 65.473 -2.792 42.456 1.00 33.26 C ATOM 987 H ILE B 41 62.249 -0.267 43.981 1.00 0.00 H ATOM 988 N ILE B 42 64.862 1.749 46.143 1.00 29.60 N ATOM 989 CA ILE B 42 65.201 3.154 46.218 1.00 32.22 C ATOM 990 C ILE B 42 66.658 3.378 45.889 1.00 31.86 C ATOM 991 O ILE B 42 67.537 2.673 46.384 1.00 41.99 O ATOM 992 CB ILE B 42 64.946 3.685 47.601 1.00 35.32 C ATOM 993 CG1 ILE B 42 63.470 3.558 47.886 1.00 38.56 C ATOM 994 CG2 ILE B 42 65.362 5.142 47.704 1.00 35.12 C ATOM 995 CD1 ILE B 42 63.127 3.917 49.307 1.00 41.82 C ATOM 996 H ILE B 42 65.141 1.115 46.919 1.00 0.00 H ATOM 997 N THR B 43 66.914 4.341 45.021 1.00 29.28 N ATOM 998 CA THR B 43 68.259 4.659 44.600 1.00 26.89 C ATOM 999 C THR B 43 68.456 6.118 44.891 1.00 27.48 C ATOM 1000 O THR B 43 67.819 6.975 44.270 1.00 25.79 O ATOM 1001 CB THR B 43 68.458 4.368 43.105 1.00 26.35 C ATOM 1002 OG1 THR B 43 68.232 2.972 42.839 1.00 28.44 O ATOM 1003 CG2 THR B 43 69.848 4.702 42.662 1.00 26.41 C ATOM 1004 HG1 THR B 43 68.363 2.796 41.874 1.00 0.00 H ATOM 1005 H THR B 43 66.121 4.888 44.628 1.00 0.00 H ATOM 1006 N GLU B 44 69.347 6.400 45.834 1.00 30.10 N ATOM 1007 CA GLU B 44 69.632 7.774 46.190 1.00 32.90 C ATOM 1008 C GLU B 44 70.652 8.372 45.229 1.00 33.85 C ATOM 1009 O GLU B 44 71.650 7.753 44.917 1.00 33.96 O ATOM 1010 CB GLU B 44 70.166 7.837 47.597 1.00 37.38 C ATOM 1011 CG GLU B 44 69.105 7.832 48.664 1.00 40.91 C ATOM 1012 CD GLU B 44 69.658 8.217 50.032 1.00 42.50 C ATOM 1013 OE1 GLU B 44 70.823 7.854 50.348 1.00 48.11 O ATOM 1014 OE2 GLU B 44 68.922 8.893 50.773 1.00 41.97 O ATOM 1015 H GLU B 44 69.844 5.627 46.321 1.00 0.00 H ATOM 1016 N MET B 45 70.408 9.580 44.753 1.00 35.34 N ATOM 1017 CA MET B 45 71.384 10.274 43.938 1.00 34.24 C ATOM 1018 C MET B 45 72.078 11.377 44.722 1.00 36.82 C ATOM 1019 O MET B 45 71.418 12.142 45.450 1.00 37.27 O ATOM 1020 CB MET B 45 70.729 10.935 42.752 1.00 36.95 C ATOM 1021 CG MET B 45 69.808 10.063 41.918 1.00 43.63 C ATOM 1022 SD MET B 45 69.077 11.036 40.578 1.00 52.41 S ATOM 1023 CE MET B 45 67.560 11.672 41.295 1.00 48.67 C ATOM 1024 H MET B 45 69.500 10.040 44.967 1.00 0.00 H ATOM 1025 N ALA B 46 73.396 11.480 44.561 1.00 36.60 N ATOM 1026 CA ALA B 46 74.156 12.626 45.101 1.00 37.66 C ATOM 1027 C ALA B 46 73.765 13.863 44.341 1.00 40.43 C ATOM 1028 O ALA B 46 73.381 13.782 43.163 1.00 39.45 O ATOM 1029 CB ALA B 46 75.638 12.384 44.952 1.00 40.75 C ATOM 1030 H ALA B 46 73.903 10.735 44.042 1.00 0.00 H ATOM 1031 N LYS B 47 73.852 15.015 44.984 1.00 42.26 N ATOM 1032 CA LYS B 47 73.311 16.257 44.383 1.00 48.72 C ATOM 1033 C LYS B 47 74.154 16.677 43.184 1.00 41.31 C ATOM 1034 O LYS B 47 73.655 17.278 42.235 1.00 42.80 O ATOM 1035 CB LYS B 47 73.199 17.378 45.439 1.00 58.61 C ATOM 1036 CG LYS B 47 72.834 16.861 46.831 1.00 70.91 C ATOM 1037 CD LYS B 47 71.968 17.808 47.643 1.00 81.75 C ATOM 1038 CE LYS B 47 71.635 17.133 48.968 1.00 91.38 C ATOM 1039 NZ LYS B 47 70.887 17.982 49.930 1.00 99.58 N ATOM 1040 HZ1 LYS B 47 71.451 18.826 50.157 1.00 0.00 H ATOM 1041 HZ2 LYS B 47 69.983 18.271 49.505 1.00 0.00 H ATOM 1042 HZ3 LYS B 47 70.705 17.441 50.800 1.00 0.00 H ATOM 1043 H LYS B 47 74.304 15.050 45.920 1.00 0.00 H ATOM 1044 N GLY B 48 75.429 16.322 43.231 1.00 37.21 N ATOM 1045 CA GLY B 48 76.348 16.540 42.125 1.00 34.86 C ATOM 1046 C GLY B 48 76.236 15.543 40.978 1.00 37.37 C ATOM 1047 O GLY B 48 77.027 15.602 40.039 1.00 35.20 O ATOM 1048 H GLY B 48 75.788 15.868 44.095 1.00 0.00 H ATOM 1049 N HIS B 49 75.285 14.609 41.061 1.00 36.21 N ATOM 1050 CA HIS B 49 75.109 13.576 40.048 1.00 35.06 C ATOM 1051 C HIS B 49 73.816 13.683 39.270 1.00 34.24 C ATOM 1052 O HIS B 49 73.515 12.817 38.468 1.00 31.24 O ATOM 1053 CB HIS B 49 75.176 12.185 40.696 1.00 35.71 C ATOM 1054 CG HIS B 49 76.552 11.786 41.121 1.00 38.72 C ATOM 1055 ND1 HIS B 49 76.804 10.657 41.866 1.00 39.03 N ATOM 1056 CD2 HIS B 49 77.757 12.371 40.900 1.00 38.72 C ATOM 1057 CE1 HIS B 49 78.104 10.552 42.076 1.00 39.20 C ATOM 1058 NE2 HIS B 49 78.699 11.594 41.522 1.00 40.44 N ATOM 1059 H HIS B 49 74.645 14.619 41.881 1.00 0.00 H ATOM 1060 N PHE B 50 73.049 14.725 39.529 1.00 36.87 N ATOM 1061 CA PHE B 50 71.756 14.876 38.904 1.00 38.16 C ATOM 1062 C PHE B 50 71.677 16.214 38.212 1.00 40.28 C ATOM 1063 O PHE B 50 71.828 17.258 38.851 1.00 35.66 O ATOM 1064 CB PHE B 50 70.657 14.790 39.944 1.00 39.68 C ATOM 1065 CG PHE B 50 69.278 14.862 39.368 1.00 42.41 C ATOM 1066 CD1 PHE B 50 68.882 13.989 38.363 1.00 47.27 C ATOM 1067 CD2 PHE B 50 68.372 15.781 39.830 1.00 44.09 C ATOM 1068 CE1 PHE B 50 67.607 14.050 37.831 1.00 47.06 C ATOM 1069 CE2 PHE B 50 67.089 15.841 39.302 1.00 45.21 C ATOM 1070 CZ PHE B 50 66.707 14.979 38.305 1.00 42.61 C ATOM 1071 H PHE B 50 73.382 15.451 40.195 1.00 0.00 H ATOM 1072 N GLY B 51 71.426 16.171 36.908 1.00 39.62 N ATOM 1073 CA GLY B 51 71.376 17.368 36.080 1.00 45.28 C ATOM 1074 C GLY B 51 69.993 17.682 35.525 1.00 47.68 C ATOM 1075 O GLY B 51 69.216 16.782 35.215 1.00 40.51 O ATOM 1076 H GLY B 51 71.259 15.247 36.461 1.00 0.00 H ATOM 1077 N ILE B 52 69.659 18.965 35.514 1.00 50.11 N ATOM 1078 CA ILE B 52 68.447 19.451 34.871 1.00 54.26 C ATOM 1079 C ILE B 52 68.870 20.588 33.988 1.00 51.45 C ATOM 1080 O ILE B 52 69.555 21.502 34.419 1.00 48.49 O ATOM 1081 CB ILE B 52 67.398 19.977 35.871 1.00 60.88 C ATOM 1082 CG1 ILE B 52 67.091 18.924 36.946 1.00 68.33 C ATOM 1083 CG2 ILE B 52 66.126 20.343 35.128 1.00 56.96 C ATOM 1084 CD1 ILE B 52 66.284 19.448 38.118 1.00 72.09 C ATOM 1085 H ILE B 52 70.286 19.650 35.982 1.00 0.00 H ATOM 1086 N GLY B 53 68.469 20.529 32.739 1.00 52.15 N ATOM 1087 CA GLY B 53 68.905 21.531 31.783 1.00 48.79 C ATOM 1088 C GLY B 53 70.402 21.688 31.690 1.00 49.38 C ATOM 1089 O GLY B 53 70.883 22.760 31.383 1.00 47.33 O ATOM 1090 H GLY B 53 67.837 19.762 32.433 1.00 0.00 H ATOM 1091 N GLY B 54 71.139 20.609 31.937 1.00 58.92 N ATOM 1092 CA GLY B 54 72.602 20.639 31.846 1.00 58.00 C ATOM 1093 C GLY B 54 73.330 21.213 33.065 1.00 57.65 C ATOM 1094 O GLY B 54 74.560 21.317 33.054 1.00 50.56 O ATOM 1095 H GLY B 54 70.666 19.721 32.201 1.00 0.00 H ATOM 1096 N GLU B 55 72.577 21.529 34.121 1.00 55.36 N ATOM 1097 CA GLU B 55 73.108 22.139 35.326 1.00 57.14 C ATOM 1098 C GLU B 55 72.738 21.315 36.535 1.00 54.28 C ATOM 1099 O GLU B 55 71.666 20.739 36.593 1.00 57.15 O ATOM 1100 CB GLU B 55 72.533 23.538 35.495 1.00 64.48 C ATOM 1101 CG GLU B 55 72.880 24.446 34.349 1.00 71.39 C ATOM 1102 CD GLU B 55 74.365 24.779 34.269 1.00 79.44 C ATOM 1103 OE1 GLU B 55 74.962 25.217 35.270 1.00 92.97 O ATOM 1104 OE2 GLU B 55 74.950 24.627 33.194 1.00 73.59 O ATOM 1105 H GLU B 55 71.558 21.328 34.078 1.00 0.00 H ATOM 1106 N LEU B 56 73.599 21.307 37.534 1.00 57.18 N ATOM 1107 CA LEU B 56 73.366 20.474 38.697 1.00 59.39 C ATOM 1108 C LEU B 56 72.113 20.887 39.431 1.00 64.25 C ATOM 1109 O LEU B 56 71.712 22.029 39.386 1.00 66.93 O ATOM 1110 CB LEU B 56 74.563 20.530 39.655 1.00 63.11 C ATOM 1111 CG LEU B 56 75.945 20.136 39.093 1.00 65.39 C ATOM 1112 CD1 LEU B 56 77.062 20.261 40.126 1.00 65.08 C ATOM 1113 CD2 LEU B 56 75.913 18.717 38.562 1.00 62.03 C ATOM 1114 H LEU B 56 74.451 21.902 37.487 1.00 0.00 H ATOM 1115 N ALA B 57 71.494 19.960 40.139 1.00 80.58 N ATOM 1116 CA ALA B 57 70.383 20.318 41.008 1.00 88.86 C ATOM 1117 C ALA B 57 70.881 21.157 42.218 1.00101.86 C ATOM 1118 O ALA B 57 70.083 21.536 43.061 1.00109.48 O ATOM 1119 CB ALA B 57 69.578 19.057 41.370 1.00 89.25 C ATOM 1120 H ALA B 57 71.802 18.969 40.075 1.00 0.00 H ATOM 1121 N SER B 58 72.176 21.531 42.209 1.00107.96 N ATOM 1122 CA SER B 58 72.835 22.410 43.203 1.00106.60 C ATOM 1123 C SER B 58 73.549 23.620 42.540 1.00 97.76 C ATOM 1124 O SER B 58 72.995 24.716 42.382 1.00 88.74 O ATOM 1125 CB SER B 58 73.893 21.602 43.962 1.00104.43 C ATOM 1126 OG SER B 58 73.389 20.346 44.356 1.00105.45 O ATOM 1127 HG SER B 58 74.092 19.847 44.843 1.00 0.00 H ATOM 1128 H SER B 58 72.767 21.169 41.433 1.00 0.00 H TER 1129 SER B 58 ATOM 1130 N PRO C 1 81.955 2.886 30.118 1.00 43.44 N ATOM 1131 CA PRO C 1 80.875 3.908 30.256 1.00 40.18 C ATOM 1132 C PRO C 1 79.680 3.586 29.373 1.00 36.78 C ATOM 1133 O PRO C 1 79.855 3.356 28.192 1.00 32.30 O ATOM 1134 CB PRO C 1 81.516 5.225 29.789 1.00 37.48 C ATOM 1135 CG PRO C 1 82.893 4.904 29.338 1.00 38.83 C ATOM 1136 CD PRO C 1 83.042 3.404 29.252 1.00 40.69 C ATOM 1137 HN2 PRO C 1 81.559 2.023 29.694 1.00 0.00 H ATOM 1138 HN1 PRO C 1 82.340 2.664 31.058 1.00 0.00 H ATOM 1139 N ILE C 2 78.522 3.446 30.014 1.00 36.04 N ATOM 1140 CA ILE C 2 77.339 2.880 29.409 1.00 34.74 C ATOM 1141 C ILE C 2 76.209 3.814 29.692 1.00 34.14 C ATOM 1142 O ILE C 2 75.870 4.019 30.833 1.00 41.88 O ATOM 1143 CB ILE C 2 76.992 1.514 30.028 1.00 35.55 C ATOM 1144 CG1 ILE C 2 78.113 0.505 29.739 1.00 36.63 C ATOM 1145 CG2 ILE C 2 75.683 1.007 29.464 1.00 38.54 C ATOM 1146 CD1 ILE C 2 77.939 -0.846 30.403 1.00 39.42 C ATOM 1147 H ILE C 2 78.466 3.761 31.004 1.00 0.00 H ATOM 1148 N ALA C 3 75.613 4.361 28.655 1.00 33.26 N ATOM 1149 CA ALA C 3 74.542 5.320 28.817 1.00 35.07 C ATOM 1150 C ALA C 3 73.215 4.764 28.287 1.00 34.51 C ATOM 1151 O ALA C 3 73.180 4.163 27.221 1.00 33.10 O ATOM 1152 CB ALA C 3 74.875 6.591 28.081 1.00 35.23 C ATOM 1153 H ALA C 3 75.919 4.098 27.696 1.00 0.00 H ATOM 1154 N GLN C 4 72.143 4.909 29.075 1.00 35.19 N ATOM 1155 CA GLN C 4 70.800 4.531 28.651 1.00 35.02 C ATOM 1156 C GLN C 4 69.985 5.790 28.616 1.00 33.18 C ATOM 1157 O GLN C 4 69.939 6.520 29.589 1.00 36.01 O ATOM 1158 CB GLN C 4 70.166 3.503 29.567 1.00 36.41 C ATOM 1159 CG GLN C 4 68.744 3.133 29.150 1.00 43.45 C ATOM 1160 CD GLN C 4 68.137 2.011 29.990 1.00 50.19 C ATOM 1161 OE1 GLN C 4 68.703 1.610 31.007 1.00 57.01 O ATOM 1162 NE2 GLN C 4 66.991 1.488 29.557 1.00 55.47 N ATOM 1163 HE22 GLN C 4 66.545 1.856 28.692 1.00 0.00 H ATOM 1164 HE21 GLN C 4 66.542 0.712 30.083 1.00 0.00 H ATOM 1165 H GLN C 4 72.273 5.307 30.027 1.00 0.00 H ATOM 1166 N ILE C 5 69.359 6.054 27.479 1.00 31.92 N ATOM 1167 CA ILE C 5 68.580 7.260 27.307 1.00 32.48 C ATOM 1168 C ILE C 5 67.116 6.936 27.033 1.00 31.76 C ATOM 1169 O ILE C 5 66.808 6.268 26.053 1.00 29.47 O ATOM 1170 CB ILE C 5 69.145 8.087 26.154 1.00 33.72 C ATOM 1171 CG1 ILE C 5 70.663 8.163 26.291 1.00 34.60 C ATOM 1172 CG2 ILE C 5 68.543 9.474 26.174 1.00 32.65 C ATOM 1173 CD1 ILE C 5 71.347 8.967 25.222 1.00 36.30 C ATOM 1174 H ILE C 5 69.429 5.378 26.692 1.00 0.00 H ATOM 1175 N HIS C 6 66.223 7.373 27.921 1.00 34.80 N ATOM 1176 CA HIS C 6 64.795 7.184 27.692 1.00 38.81 C ATOM 1177 C HIS C 6 64.257 8.395 26.995 1.00 38.64 C ATOM 1178 O HIS C 6 64.409 9.511 27.483 1.00 36.16 O ATOM 1179 CB HIS C 6 63.979 6.954 28.963 1.00 41.22 C ATOM 1180 CG HIS C 6 64.360 5.713 29.695 1.00 43.72 C ATOM 1181 ND1 HIS C 6 63.632 4.526 29.741 1.00 41.25 N ATOM 1182 CD2 HIS C 6 65.470 5.508 30.423 1.00 46.92 C ATOM 1183 CE1 HIS C 6 64.293 3.657 30.489 1.00 45.39 C ATOM 1184 NE2 HIS C 6 65.406 4.233 30.915 1.00 49.88 N ATOM 1185 H HIS C 6 66.547 7.853 28.785 1.00 0.00 H ATOM 1186 N ILE C 7 63.615 8.176 25.856 1.00 41.77 N ATOM 1187 CA ILE C 7 63.014 9.274 25.101 1.00 40.91 C ATOM 1188 C ILE C 7 61.624 8.914 24.652 1.00 43.57 C ATOM 1189 O ILE C 7 61.287 7.732 24.505 1.00 44.05 O ATOM 1190 CB ILE C 7 63.851 9.619 23.875 1.00 42.70 C ATOM 1191 CG1 ILE C 7 63.814 8.473 22.849 1.00 42.79 C ATOM 1192 CG2 ILE C 7 65.285 9.938 24.289 1.00 42.66 C ATOM 1193 CD1 ILE C 7 64.678 8.710 21.621 1.00 44.32 C ATOM 1194 H ILE C 7 63.537 7.205 25.493 1.00 0.00 H ATOM 1195 N LEU C 8 60.797 9.928 24.430 1.00 49.38 N ATOM 1196 CA LEU C 8 59.480 9.677 23.852 1.00 49.49 C ATOM 1197 C LEU C 8 59.622 9.126 22.450 1.00 47.51 C ATOM 1198 O LEU C 8 60.480 9.572 21.678 1.00 44.68 O ATOM 1199 CB LEU C 8 58.647 10.947 23.830 1.00 55.22 C ATOM 1200 CG LEU C 8 58.059 11.261 25.189 1.00 57.24 C ATOM 1201 CD1 LEU C 8 57.472 12.661 25.192 1.00 59.54 C ATOM 1202 CD2 LEU C 8 57.010 10.221 25.572 1.00 59.60 C ATOM 1203 H LEU C 8 61.086 10.898 24.667 1.00 0.00 H ATOM 1204 N GLU C 9 58.762 8.171 22.116 1.00 44.01 N ATOM 1205 CA GLU C 9 58.702 7.658 20.755 1.00 44.79 C ATOM 1206 C GLU C 9 58.312 8.791 19.796 1.00 41.47 C ATOM 1207 O GLU C 9 57.686 9.772 20.189 1.00 37.31 O ATOM 1208 CB GLU C 9 57.710 6.501 20.651 1.00 47.85 C ATOM 1209 CG GLU C 9 56.252 6.946 20.687 1.00 56.54 C ATOM 1210 CD GLU C 9 55.251 5.796 20.753 1.00 59.42 C ATOM 1211 OE1 GLU C 9 55.656 4.622 20.555 1.00 65.93 O ATOM 1212 OE2 GLU C 9 54.061 6.087 21.017 1.00 57.69 O ATOM 1213 H GLU C 9 58.121 7.784 22.838 1.00 0.00 H ATOM 1214 N GLY C 10 58.713 8.658 18.545 1.00 44.16 N ATOM 1215 CA GLY C 10 58.295 9.600 17.531 1.00 49.46 C ATOM 1216 C GLY C 10 59.378 10.225 16.689 1.00 51.48 C ATOM 1217 O GLY C 10 59.074 10.836 15.664 1.00 60.40 O ATOM 1218 H GLY C 10 59.336 7.867 18.286 1.00 0.00 H ATOM 1219 N ARG C 11 60.625 9.937 17.003 1.00 53.15 N ATOM 1220 CA ARG C 11 61.748 10.513 16.277 1.00 52.87 C ATOM 1221 C ARG C 11 62.207 9.607 15.135 1.00 48.56 C ATOM 1222 O ARG C 11 61.876 8.398 15.077 1.00 43.87 O ATOM 1223 CB ARG C 11 62.902 10.749 17.245 1.00 58.88 C ATOM 1224 CG ARG C 11 62.495 11.537 18.481 1.00 58.59 C ATOM 1225 CD ARG C 11 62.872 12.995 18.688 1.00 60.49 C ATOM 1226 NE ARG C 11 61.517 13.618 18.729 1.00 62.58 N ATOM 1227 CZ ARG C 11 60.962 14.061 17.615 1.00 63.55 C ATOM 1228 NH1 ARG C 11 61.706 14.096 16.511 1.00 62.81 N ATOM 1229 NH2 ARG C 11 59.722 14.516 17.592 1.00 66.07 N ATOM 1230 HE ARG C 11 61.010 13.703 19.633 1.00 0.00 H ATOM 1231 HH12 ARG C 11 61.297 14.440 15.619 1.00 0.00 H ATOM 1232 HH11 ARG C 11 62.696 13.780 16.541 1.00 0.00 H ATOM 1233 HH22 ARG C 11 59.310 14.859 16.701 1.00 0.00 H ATOM 1234 HH21 ARG C 11 59.157 14.531 18.465 1.00 0.00 H ATOM 1235 H ARG C 11 60.812 9.282 17.789 1.00 0.00 H ATOM 1236 N SER C 12 62.946 10.191 14.198 1.00 46.62 N ATOM 1237 CA SER C 12 63.402 9.449 13.014 1.00 52.45 C ATOM 1238 C SER C 12 64.636 8.626 13.333 1.00 49.94 C ATOM 1239 O SER C 12 65.338 8.919 14.275 1.00 52.11 O ATOM 1240 CB SER C 12 63.752 10.403 11.887 1.00 53.17 C ATOM 1241 OG SER C 12 64.866 11.185 12.256 1.00 53.23 O ATOM 1242 HG SER C 12 65.638 10.593 12.437 1.00 0.00 H ATOM 1243 H SER C 12 63.207 11.192 14.304 1.00 0.00 H ATOM 1244 N ASP C 13 64.899 7.610 12.523 1.00 51.88 N ATOM 1245 CA ASP C 13 66.109 6.831 12.657 1.00 54.09 C ATOM 1246 C ASP C 13 67.370 7.691 12.584 1.00 54.99 C ATOM 1247 O ASP C 13 68.357 7.383 13.235 1.00 60.79 O ATOM 1248 CB ASP C 13 66.135 5.737 11.597 1.00 53.34 C ATOM 1249 CG ASP C 13 65.156 4.604 11.897 1.00 60.91 C ATOM 1250 OD1 ASP C 13 64.428 4.684 12.915 1.00 66.49 O ATOM 1251 OD2 ASP C 13 65.191 3.574 11.175 1.00 75.59 O ATOM 1252 H ASP C 13 64.219 7.368 11.774 1.00 0.00 H ATOM 1253 N GLU C 14 67.332 8.770 11.805 1.00 56.66 N ATOM 1254 CA GLU C 14 68.516 9.611 11.593 1.00 54.90 C ATOM 1255 C GLU C 14 68.800 10.381 12.843 1.00 46.97 C ATOM 1256 O GLU C 14 69.931 10.421 13.313 1.00 47.21 O ATOM 1257 CB GLU C 14 68.332 10.608 10.426 1.00 59.41 C ATOM 1258 CG GLU C 14 68.234 9.971 9.040 1.00 64.24 C ATOM 1259 CD GLU C 14 66.893 9.293 8.786 1.00 67.77 C ATOM 1260 OE1 GLU C 14 65.826 9.892 9.092 1.00 66.16 O ATOM 1261 OE2 GLU C 14 66.880 8.122 8.315 1.00 68.26 O ATOM 1262 H GLU C 14 66.440 9.024 11.334 1.00 0.00 H ATOM 1263 N GLN C 15 67.767 10.991 13.392 1.00 48.18 N ATOM 1264 CA GLN C 15 67.891 11.722 14.663 1.00 47.46 C ATOM 1265 C GLN C 15 68.504 10.861 15.762 1.00 50.00 C ATOM 1266 O GLN C 15 69.325 11.321 16.535 1.00 48.07 O ATOM 1267 CB GLN C 15 66.529 12.189 15.144 1.00 43.19 C ATOM 1268 CG GLN C 15 66.181 13.588 14.712 1.00 44.22 C ATOM 1269 CD GLN C 15 64.805 14.005 15.177 1.00 45.28 C ATOM 1270 OE1 GLN C 15 63.790 13.279 15.024 1.00 49.80 O ATOM 1271 NE2 GLN C 15 64.772 15.146 15.842 1.00 50.93 N ATOM 1272 HE22 GLN C 15 65.637 15.714 15.943 1.00 0.00 H ATOM 1273 HE21 GLN C 15 63.881 15.476 16.264 1.00 0.00 H ATOM 1274 H GLN C 15 66.843 10.954 12.915 1.00 0.00 H ATOM 1275 N LYS C 16 68.073 9.606 15.823 1.00 48.34 N ATOM 1276 CA LYS C 16 68.543 8.688 16.828 1.00 46.57 C ATOM 1277 C LYS C 16 69.988 8.263 16.600 1.00 47.86 C ATOM 1278 O LYS C 16 70.756 8.148 17.542 1.00 44.55 O ATOM 1279 CB LYS C 16 67.615 7.481 16.902 1.00 42.26 C ATOM 1280 CG LYS C 16 66.295 7.863 17.516 1.00 42.84 C ATOM 1281 CD LYS C 16 65.424 6.659 17.814 1.00 44.97 C ATOM 1282 CE LYS C 16 64.792 6.087 16.566 1.00 41.91 C ATOM 1283 NZ LYS C 16 63.502 5.456 16.934 1.00 41.39 N ATOM 1284 HZ1 LYS C 16 63.673 4.697 17.624 1.00 0.00 H ATOM 1285 HZ2 LYS C 16 62.874 6.172 17.353 1.00 0.00 H ATOM 1286 HZ3 LYS C 16 63.057 5.058 16.083 1.00 0.00 H ATOM 1287 H LYS C 16 67.376 9.277 15.125 1.00 0.00 H ATOM 1288 N GLU C 17 70.341 8.029 15.349 1.00 48.35 N ATOM 1289 CA GLU C 17 71.718 7.764 14.986 1.00 47.26 C ATOM 1290 C GLU C 17 72.612 8.938 15.413 1.00 44.82 C ATOM 1291 O GLU C 17 73.712 8.758 15.926 1.00 45.04 O ATOM 1292 CB GLU C 17 71.798 7.577 13.476 1.00 52.08 C ATOM 1293 CG GLU C 17 73.184 7.231 12.973 1.00 59.36 C ATOM 1294 CD GLU C 17 73.201 6.741 11.535 1.00 67.78 C ATOM 1295 OE1 GLU C 17 72.149 6.769 10.868 1.00 80.58 O ATOM 1296 OE2 GLU C 17 74.279 6.303 11.075 1.00 73.08 O ATOM 1297 H GLU C 17 69.613 8.035 14.607 1.00 0.00 H ATOM 1298 N THR C 18 72.123 10.151 15.198 1.00 43.92 N ATOM 1299 CA THR C 18 72.841 11.336 15.583 1.00 46.33 C ATOM 1300 C THR C 18 72.989 11.397 17.112 1.00 48.67 C ATOM 1301 O THR C 18 74.069 11.690 17.624 1.00 48.33 O ATOM 1302 CB THR C 18 72.113 12.600 15.046 1.00 43.30 C ATOM 1303 OG1 THR C 18 72.105 12.565 13.617 1.00 46.71 O ATOM 1304 CG2 THR C 18 72.766 13.914 15.507 1.00 41.10 C ATOM 1305 HG1 THR C 18 71.631 11.752 13.311 1.00 0.00 H ATOM 1306 H THR C 18 71.195 10.248 14.739 1.00 0.00 H ATOM 1307 N LEU C 19 71.889 11.173 17.818 1.00 49.64 N ATOM 1308 CA LEU C 19 71.889 11.154 19.278 1.00 47.81 C ATOM 1309 C LEU C 19 72.962 10.217 19.804 1.00 46.38 C ATOM 1310 O LEU C 19 73.749 10.594 20.659 1.00 44.35 O ATOM 1311 CB LEU C 19 70.542 10.660 19.779 1.00 46.60 C ATOM 1312 CG LEU C 19 70.379 10.508 21.276 1.00 44.74 C ATOM 1313 CD1 LEU C 19 70.497 11.872 21.947 1.00 47.86 C ATOM 1314 CD2 LEU C 19 69.037 9.894 21.593 1.00 44.34 C ATOM 1315 H LEU C 19 70.995 11.005 17.314 1.00 0.00 H ATOM 1316 N ILE C 20 73.020 9.020 19.245 1.00 43.38 N ATOM 1317 CA ILE C 20 73.996 8.050 19.676 1.00 45.86 C ATOM 1318 C ILE C 20 75.418 8.562 19.474 1.00 49.96 C ATOM 1319 O ILE C 20 76.240 8.485 20.389 1.00 54.02 O ATOM 1320 CB ILE C 20 73.815 6.705 18.956 1.00 44.92 C ATOM 1321 CG1 ILE C 20 72.597 6.012 19.546 1.00 47.29 C ATOM 1322 CG2 ILE C 20 75.056 5.826 19.108 1.00 42.61 C ATOM 1323 CD1 ILE C 20 72.197 4.716 18.878 1.00 50.22 C ATOM 1324 H ILE C 20 72.353 8.775 18.485 1.00 0.00 H ATOM 1325 N ARG C 21 75.689 9.127 18.307 1.00 49.36 N ATOM 1326 CA ARG C 21 77.034 9.592 17.995 1.00 51.53 C ATOM 1327 C ARG C 21 77.434 10.755 18.885 1.00 49.38 C ATOM 1328 O ARG C 21 78.467 10.709 19.544 1.00 49.84 O ATOM 1329 CB ARG C 21 77.132 10.005 16.538 1.00 55.78 C ATOM 1330 CG ARG C 21 78.557 10.305 16.075 1.00 61.15 C ATOM 1331 CD ARG C 21 78.692 10.607 14.555 1.00 60.20 C ATOM 1332 NE ARG C 21 77.571 11.429 14.139 1.00 63.62 N ATOM 1333 CZ ARG C 21 76.523 11.147 13.356 1.00 67.45 C ATOM 1334 NH1 ARG C 21 76.312 9.973 12.761 1.00 55.94 N ATOM 1335 NH2 ARG C 21 75.651 12.140 13.180 1.00 75.26 N ATOM 1336 HE ARG C 21 77.584 12.400 14.512 1.00 0.00 H ATOM 1337 HH12 ARG C 21 75.470 9.835 12.167 1.00 0.00 H ATOM 1338 HH11 ARG C 21 76.990 9.195 12.891 1.00 0.00 H ATOM 1339 HH22 ARG C 21 74.811 11.995 12.584 1.00 0.00 H ATOM 1340 HH21 ARG C 21 75.811 13.060 13.639 1.00 0.00 H ATOM 1341 H ARG C 21 74.931 9.240 17.604 1.00 0.00 H ATOM 1342 N GLU C 22 76.591 11.774 18.946 1.00 47.02 N ATOM 1343 CA GLU C 22 76.914 12.995 19.679 1.00 48.92 C ATOM 1344 C GLU C 22 77.089 12.766 21.167 1.00 43.64 C ATOM 1345 O GLU C 22 77.966 13.333 21.793 1.00 47.16 O ATOM 1346 CB GLU C 22 75.827 14.040 19.448 1.00 59.77 C ATOM 1347 CG GLU C 22 75.686 14.408 17.977 1.00 65.93 C ATOM 1348 CD GLU C 22 76.312 15.735 17.597 1.00 73.32 C ATOM 1349 OE1 GLU C 22 76.566 15.865 16.386 1.00 88.01 O ATOM 1350 OE2 GLU C 22 76.522 16.632 18.450 1.00 70.31 O ATOM 1351 H GLU C 22 75.675 11.703 18.459 1.00 0.00 H ATOM 1352 N VAL C 23 76.228 11.941 21.738 1.00 43.16 N ATOM 1353 CA VAL C 23 76.332 11.594 23.138 1.00 37.87 C ATOM 1354 C VAL C 23 77.587 10.753 23.375 1.00 38.62 C ATOM 1355 O VAL C 23 78.334 11.012 24.313 1.00 38.45 O ATOM 1356 CB VAL C 23 75.095 10.829 23.620 1.00 37.77 C ATOM 1357 CG1 VAL C 23 75.353 10.189 24.981 1.00 40.36 C ATOM 1358 CG2 VAL C 23 73.899 11.755 23.710 1.00 37.85 C ATOM 1359 H VAL C 23 75.460 11.533 21.168 1.00 0.00 H ATOM 1360 N SER C 24 77.829 9.761 22.530 1.00 33.95 N ATOM 1361 CA SER C 24 79.040 8.950 22.680 1.00 39.68 C ATOM 1362 C SER C 24 80.296 9.833 22.679 1.00 45.32 C ATOM 1363 O SER C 24 81.204 9.654 23.475 1.00 54.67 O ATOM 1364 CB SER C 24 79.123 7.879 21.571 1.00 38.25 C ATOM 1365 OG SER C 24 78.171 6.847 21.760 1.00 32.07 O ATOM 1366 HG SER C 24 78.257 6.183 21.031 1.00 0.00 H ATOM 1367 H SER C 24 77.159 9.558 21.761 1.00 0.00 H ATOM 1368 N GLU C 25 80.313 10.812 21.788 1.00 51.47 N ATOM 1369 CA GLU C 25 81.429 11.737 21.665 1.00 54.05 C ATOM 1370 C GLU C 25 81.559 12.570 22.925 1.00 48.97 C ATOM 1371 O GLU C 25 82.641 12.663 23.497 1.00 50.49 O ATOM 1372 CB GLU C 25 81.267 12.624 20.389 1.00 58.98 C ATOM 1373 CG GLU C 25 81.978 12.019 19.163 1.00 59.22 C ATOM 1374 CD GLU C 25 81.449 12.564 17.819 1.00 63.29 C ATOM 1375 OE1 GLU C 25 81.798 12.245 16.607 1.00 58.23 O ATOM 1376 OE2 GLU C 25 80.610 13.414 18.053 1.00 71.53 O ATOM 1377 H GLU C 25 79.498 10.924 21.152 1.00 0.00 H ATOM 1378 N ALA C 26 80.454 13.158 23.368 1.00 46.50 N ATOM 1379 CA ALA C 26 80.463 13.978 24.566 1.00 43.37 C ATOM 1380 C ALA C 26 80.988 13.204 25.785 1.00 40.10 C ATOM 1381 O ALA C 26 81.695 13.755 26.636 1.00 40.32 O ATOM 1382 CB ALA C 26 79.078 14.523 24.852 1.00 45.43 C ATOM 1383 H ALA C 26 79.564 13.028 22.846 1.00 0.00 H ATOM 1384 N ILE C 27 80.643 11.929 25.873 1.00 39.68 N ATOM 1385 CA ILE C 27 81.144 11.089 26.960 1.00 40.19 C ATOM 1386 C ILE C 27 82.668 10.922 26.838 1.00 41.09 C ATOM 1387 O ILE C 27 83.389 11.135 27.807 1.00 43.69 O ATOM 1388 CB ILE C 27 80.425 9.731 26.988 1.00 38.35 C ATOM 1389 CG1 ILE C 27 78.972 9.926 27.458 1.00 37.67 C ATOM 1390 CG2 ILE C 27 81.128 8.735 27.905 1.00 38.44 C ATOM 1391 CD1 ILE C 27 78.087 8.713 27.248 1.00 38.48 C ATOM 1392 H ILE C 27 80.007 11.519 25.159 1.00 0.00 H ATOM 1393 N SER C 28 83.137 10.533 25.666 1.00 39.77 N ATOM 1394 CA SER C 28 84.548 10.320 25.430 1.00 42.26 C ATOM 1395 C SER C 28 85.359 11.567 25.728 1.00 46.65 C ATOM 1396 O SER C 28 86.391 11.501 26.398 1.00 53.26 O ATOM 1397 CB SER C 28 84.771 9.924 23.989 1.00 47.47 C ATOM 1398 OG SER C 28 86.106 9.527 23.785 1.00 58.22 O ATOM 1399 HG SER C 28 86.311 8.752 24.366 1.00 0.00 H ATOM 1400 H SER C 28 82.468 10.374 24.886 1.00 0.00 H ATOM 1401 N ARG C 29 84.866 12.709 25.269 1.00 47.01 N ATOM 1402 CA ARG C 29 85.522 13.988 25.505 1.00 47.02 C ATOM 1403 C ARG C 29 85.590 14.274 26.993 1.00 49.41 C ATOM 1404 O ARG C 29 86.659 14.488 27.538 1.00 51.13 O ATOM 1405 CB ARG C 29 84.770 15.151 24.834 1.00 49.77 C ATOM 1406 CG ARG C 29 85.615 16.105 24.012 1.00 56.42 C ATOM 1407 CD ARG C 29 84.856 16.834 22.894 1.00 57.99 C ATOM 1408 NE ARG C 29 83.477 17.166 23.295 1.00 58.61 N ATOM 1409 CZ ARG C 29 82.353 16.802 22.666 1.00 58.43 C ATOM 1410 NH1 ARG C 29 82.348 16.074 21.547 1.00 58.86 N ATOM 1411 NH2 ARG C 29 81.192 17.184 23.159 1.00 61.90 N ATOM 1412 HE ARG C 29 83.366 17.742 24.154 1.00 0.00 H ATOM 1413 HH12 ARG C 29 81.446 15.818 21.097 1.00 0.00 H ATOM 1414 HH11 ARG C 29 83.246 15.763 21.125 1.00 0.00 H ATOM 1415 HH22 ARG C 29 80.309 16.910 22.683 1.00 0.00 H ATOM 1416 HH21 ARG C 29 81.159 17.760 24.024 1.00 0.00 H ATOM 1417 H ARG C 29 83.981 12.691 24.722 1.00 0.00 H ATOM 1418 N SER C 30 84.431 14.247 27.646 1.00 53.83 N ATOM 1419 CA SER C 30 84.295 14.645 29.051 1.00 47.68 C ATOM 1420 C SER C 30 85.124 13.814 30.034 1.00 46.94 C ATOM 1421 O SER C 30 85.591 14.336 31.035 1.00 43.02 O ATOM 1422 CB SER C 30 82.839 14.546 29.470 1.00 47.61 C ATOM 1423 OG SER C 30 82.077 15.547 28.843 1.00 44.02 O ATOM 1424 HG SER C 30 82.138 15.440 27.861 1.00 0.00 H ATOM 1425 H SER C 30 83.582 13.929 27.136 1.00 0.00 H ATOM 1426 N LEU C 31 85.299 12.519 29.750 1.00 46.28 N ATOM 1427 CA LEU C 31 85.986 11.609 30.679 1.00 46.98 C ATOM 1428 C LEU C 31 87.345 11.179 30.173 1.00 50.13 C ATOM 1429 O LEU C 31 87.969 10.314 30.766 1.00 52.25 O ATOM 1430 CB LEU C 31 85.166 10.346 30.876 1.00 46.45 C ATOM 1431 CG LEU C 31 83.720 10.492 31.316 1.00 45.87 C ATOM 1432 CD1 LEU C 31 83.131 9.115 31.519 1.00 44.56 C ATOM 1433 CD2 LEU C 31 83.609 11.340 32.563 1.00 43.82 C ATOM 1434 H LEU C 31 84.940 12.145 28.848 1.00 0.00 H ATOM 1435 N ASP C 32 87.784 11.760 29.060 1.00 55.27 N ATOM 1436 CA ASP C 32 89.030 11.365 28.444 1.00 55.17 C ATOM 1437 C ASP C 32 89.085 9.858 28.306 1.00 56.18 C ATOM 1438 O ASP C 32 90.095 9.227 28.600 1.00 65.99 O ATOM 1439 CB ASP C 32 90.197 11.888 29.272 1.00 59.61 C ATOM 1440 CG ASP C 32 91.326 12.382 28.420 1.00 69.69 C ATOM 1441 OD1 ASP C 32 91.583 11.780 27.351 1.00 72.62 O ATOM 1442 OD2 ASP C 32 91.971 13.379 28.823 1.00 80.78 O ATOM 1443 H ASP C 32 87.218 12.515 28.623 1.00 0.00 H ATOM 1444 N ALA C 33 87.978 9.265 27.878 1.00 49.18 N ATOM 1445 CA ALA C 33 87.915 7.811 27.718 1.00 46.63 C ATOM 1446 C ALA C 33 87.900 7.488 26.247 1.00 44.00 C ATOM 1447 O ALA C 33 87.335 8.250 25.448 1.00 41.32 O ATOM 1448 CB ALA C 33 86.678 7.252 28.396 1.00 45.68 C ATOM 1449 H ALA C 33 87.142 9.842 27.653 1.00 0.00 H ATOM 1450 N PRO C 34 88.477 6.344 25.887 1.00 41.90 N ATOM 1451 CA PRO C 34 88.423 5.956 24.473 1.00 46.46 C ATOM 1452 C PRO C 34 86.991 5.779 23.903 1.00 53.45 C ATOM 1453 O PRO C 34 86.174 5.032 24.464 1.00 53.17 O ATOM 1454 CB PRO C 34 89.188 4.618 24.434 1.00 45.40 C ATOM 1455 CG PRO C 34 89.221 4.111 25.843 1.00 41.14 C ATOM 1456 CD PRO C 34 89.012 5.283 26.759 1.00 38.61 C ATOM 1457 N LEU C 35 86.712 6.453 22.784 1.00 54.38 N ATOM 1458 CA LEU C 35 85.400 6.404 22.138 1.00 48.31 C ATOM 1459 C LEU C 35 84.883 4.999 21.923 1.00 45.85 C ATOM 1460 O LEU C 35 83.700 4.765 22.099 1.00 56.19 O ATOM 1461 CB LEU C 35 85.421 7.132 20.807 1.00 48.61 C ATOM 1462 CG LEU C 35 84.083 7.231 20.072 1.00 51.30 C ATOM 1463 CD1 LEU C 35 83.055 8.016 20.885 1.00 54.99 C ATOM 1464 CD2 LEU C 35 84.250 7.887 18.711 1.00 53.15 C ATOM 1465 H LEU C 35 87.458 7.037 22.354 1.00 0.00 H ATOM 1466 N THR C 36 85.750 4.053 21.612 1.00 43.96 N ATOM 1467 CA THR C 36 85.298 2.707 21.267 1.00 41.69 C ATOM 1468 C THR C 36 84.784 1.906 22.438 1.00 42.42 C ATOM 1469 O THR C 36 84.178 0.846 22.239 1.00 45.99 O ATOM 1470 CB THR C 36 86.425 1.897 20.614 1.00 44.47 C ATOM 1471 OG1 THR C 36 87.525 1.823 21.523 1.00 52.93 O ATOM 1472 CG2 THR C 36 86.877 2.583 19.322 1.00 53.13 C ATOM 1473 HG1 THR C 36 88.258 1.302 21.110 1.00 0.00 H ATOM 1474 H THR C 36 86.767 4.269 21.613 1.00 0.00 H ATOM 1475 N SER C 37 85.053 2.354 23.659 1.00 44.51 N ATOM 1476 CA SER C 37 84.544 1.654 24.865 1.00 48.80 C ATOM 1477 C SER C 37 83.105 2.112 25.252 1.00 48.14 C ATOM 1478 O SER C 37 82.402 1.415 25.999 1.00 40.70 O ATOM 1479 CB SER C 37 85.476 1.887 26.058 1.00 47.63 C ATOM 1480 OG SER C 37 85.628 3.279 26.309 1.00 45.27 O ATOM 1481 HG SER C 37 86.013 3.717 25.509 1.00 0.00 H ATOM 1482 H SER C 37 85.631 3.211 23.772 1.00 0.00 H ATOM 1483 N VAL C 38 82.677 3.246 24.694 1.00 44.45 N ATOM 1484 CA VAL C 38 81.386 3.819 25.018 1.00 47.93 C ATOM 1485 C VAL C 38 80.203 3.065 24.390 1.00 50.26 C ATOM 1486 O VAL C 38 80.130 2.873 23.169 1.00 53.01 O ATOM 1487 CB VAL C 38 81.298 5.280 24.575 1.00 51.21 C ATOM 1488 CG1 VAL C 38 79.949 5.875 24.958 1.00 49.40 C ATOM 1489 CG2 VAL C 38 82.412 6.098 25.210 1.00 50.83 C ATOM 1490 H VAL C 38 83.287 3.733 24.007 1.00 0.00 H ATOM 1491 N ARG C 39 79.262 2.683 25.241 1.00 46.96 N ATOM 1492 CA ARG C 39 78.031 2.061 24.821 1.00 44.64 C ATOM 1493 C ARG C 39 76.852 2.994 25.072 1.00 42.73 C ATOM 1494 O ARG C 39 76.778 3.635 26.103 1.00 37.29 O ATOM 1495 CB ARG C 39 77.795 0.804 25.605 1.00 46.52 C ATOM 1496 CG ARG C 39 78.240 -0.436 24.899 1.00 51.65 C ATOM 1497 CD ARG C 39 79.646 -0.790 25.202 1.00 59.12 C ATOM 1498 NE ARG C 39 79.944 -2.018 24.469 1.00 63.27 N ATOM 1499 CZ ARG C 39 81.111 -2.294 23.904 1.00 59.76 C ATOM 1500 NH1 ARG C 39 82.121 -1.438 23.961 1.00 56.62 N ATOM 1501 NH2 ARG C 39 81.264 -3.451 23.287 1.00 64.84 N ATOM 1502 HE ARG C 39 79.187 -2.726 24.384 1.00 0.00 H ATOM 1503 HH12 ARG C 39 83.029 -1.674 23.511 1.00 0.00 H ATOM 1504 HH11 ARG C 39 82.006 -0.530 24.456 1.00 0.00 H ATOM 1505 HH22 ARG C 39 82.173 -3.685 22.838 1.00 0.00 H ATOM 1506 HH21 ARG C 39 80.476 -4.129 23.250 1.00 0.00 H ATOM 1507 H ARG C 39 79.418 2.839 26.257 1.00 0.00 H ATOM 1508 N VAL C 40 75.916 3.037 24.127 1.00 41.72 N ATOM 1509 CA VAL C 40 74.682 3.790 24.305 1.00 41.07 C ATOM 1510 C VAL C 40 73.463 2.953 23.971 1.00 37.26 C ATOM 1511 O VAL C 40 73.411 2.271 22.957 1.00 36.10 O ATOM 1512 CB VAL C 40 74.649 5.039 23.434 1.00 43.27 C ATOM 1513 CG1 VAL C 40 73.348 5.789 23.650 1.00 38.78 C ATOM 1514 CG2 VAL C 40 75.842 5.929 23.767 1.00 42.52 C ATOM 1515 H VAL C 40 76.070 2.519 23.238 1.00 0.00 H ATOM 1516 N ILE C 41 72.483 3.016 24.855 1.00 36.97 N ATOM 1517 CA ILE C 41 71.228 2.343 24.653 1.00 35.94 C ATOM 1518 C ILE C 41 70.158 3.390 24.594 1.00 36.66 C ATOM 1519 O ILE C 41 70.018 4.203 25.510 1.00 33.32 O ATOM 1520 CB ILE C 41 70.908 1.420 25.820 1.00 38.53 C ATOM 1521 CG1 ILE C 41 71.984 0.351 25.932 1.00 39.87 C ATOM 1522 CG2 ILE C 41 69.540 0.778 25.640 1.00 37.92 C ATOM 1523 CD1 ILE C 41 71.905 -0.450 27.207 1.00 39.22 C ATOM 1524 H ILE C 41 72.623 3.570 25.724 1.00 0.00 H ATOM 1525 N ILE C 42 69.359 3.337 23.534 1.00 37.94 N ATOM 1526 CA ILE C 42 68.161 4.148 23.452 1.00 40.11 C ATOM 1527 C ILE C 42 66.950 3.316 23.793 1.00 36.11 C ATOM 1528 O ILE C 42 66.761 2.246 23.248 1.00 38.87 O ATOM 1529 CB ILE C 42 67.995 4.731 22.062 1.00 40.37 C ATOM 1530 CG1 ILE C 42 69.186 5.644 21.800 1.00 45.20 C ATOM 1531 CG2 ILE C 42 66.710 5.532 21.960 1.00 38.05 C ATOM 1532 CD1 ILE C 42 69.215 6.175 20.387 1.00 46.34 C ATOM 1533 H ILE C 42 69.598 2.701 22.747 1.00 0.00 H ATOM 1534 N THR C 43 66.119 3.843 24.678 1.00 35.61 N ATOM 1535 CA THR C 43 64.889 3.188 25.044 1.00 38.33 C ATOM 1536 C THR C 43 63.756 4.153 24.732 1.00 37.64 C ATOM 1537 O THR C 43 63.630 5.207 25.362 1.00 33.64 O ATOM 1538 CB THR C 43 64.907 2.824 26.536 1.00 39.89 C ATOM 1539 OG1 THR C 43 66.003 1.951 26.782 1.00 42.09 O ATOM 1540 CG2 THR C 43 63.641 2.123 26.943 1.00 41.60 C ATOM 1541 HG1 THR C 43 66.023 1.711 27.742 1.00 0.00 H ATOM 1542 H THR C 43 66.360 4.753 25.120 1.00 0.00 H ATOM 1543 N GLU C 44 62.913 3.775 23.776 1.00 41.46 N ATOM 1544 CA GLU C 44 61.769 4.607 23.406 1.00 43.98 C ATOM 1545 C GLU C 44 60.602 4.354 24.330 1.00 41.67 C ATOM 1546 O GLU C 44 60.283 3.210 24.630 1.00 36.13 O ATOM 1547 CB GLU C 44 61.343 4.312 21.984 1.00 51.89 C ATOM 1548 CG GLU C 44 62.146 5.048 20.936 1.00 57.79 C ATOM 1549 CD GLU C 44 61.489 4.997 19.562 1.00 58.13 C ATOM 1550 OE1 GLU C 44 60.891 3.942 19.216 1.00 57.12 O ATOM 1551 OE2 GLU C 44 61.604 6.019 18.846 1.00 51.63 O ATOM 1552 H GLU C 44 63.070 2.873 23.283 1.00 0.00 H ATOM 1553 N MET C 45 59.977 5.413 24.812 1.00 39.39 N ATOM 1554 CA MET C 45 58.766 5.247 25.608 1.00 43.90 C ATOM 1555 C MET C 45 57.531 5.586 24.795 1.00 46.01 C ATOM 1556 O MET C 45 57.504 6.618 24.110 1.00 45.70 O ATOM 1557 CB MET C 45 58.771 6.146 26.842 1.00 42.87 C ATOM 1558 CG MET C 45 60.018 6.109 27.695 1.00 46.50 C ATOM 1559 SD MET C 45 59.885 7.286 29.044 1.00 51.20 S ATOM 1560 CE MET C 45 60.590 8.790 28.352 1.00 49.98 C ATOM 1561 H MET C 45 60.349 6.366 24.624 1.00 0.00 H ATOM 1562 N ALA C 46 56.490 4.751 24.918 1.00 50.30 N ATOM 1563 CA ALA C 46 55.160 5.094 24.387 1.00 50.29 C ATOM 1564 C ALA C 46 54.607 6.291 25.162 1.00 50.96 C ATOM 1565 O ALA C 46 54.906 6.464 26.346 1.00 53.42 O ATOM 1566 CB ALA C 46 54.227 3.912 24.498 1.00 47.66 C ATOM 1567 H ALA C 46 56.625 3.839 25.400 1.00 0.00 H ATOM 1568 N LYS C 47 53.789 7.106 24.508 1.00 52.64 N ATOM 1569 CA LYS C 47 53.314 8.356 25.115 1.00 59.99 C ATOM 1570 C LYS C 47 52.369 8.067 26.294 1.00 53.80 C ATOM 1571 O LYS C 47 52.313 8.834 27.258 1.00 49.98 O ATOM 1572 CB LYS C 47 52.648 9.264 24.065 1.00 68.90 C ATOM 1573 CG LYS C 47 53.295 9.154 22.688 1.00 75.23 C ATOM 1574 CD LYS C 47 53.296 10.456 21.905 1.00 82.08 C ATOM 1575 CE LYS C 47 54.030 10.216 20.592 1.00 82.35 C ATOM 1576 NZ LYS C 47 54.028 11.365 19.658 1.00 81.34 N ATOM 1577 HZ1 LYS C 47 53.047 11.609 19.413 1.00 0.00 H ATOM 1578 HZ2 LYS C 47 54.486 12.181 20.113 1.00 0.00 H ATOM 1579 HZ3 LYS C 47 54.549 11.110 18.795 1.00 0.00 H ATOM 1580 H LYS C 47 53.479 6.855 23.548 1.00 0.00 H ATOM 1581 N GLY C 48 51.677 6.932 26.214 1.00 50.95 N ATOM 1582 CA GLY C 48 50.842 6.448 27.299 1.00 50.55 C ATOM 1583 C GLY C 48 51.577 5.771 28.443 1.00 49.09 C ATOM 1584 O GLY C 48 50.940 5.295 29.384 1.00 46.80 O ATOM 1585 H GLY C 48 51.737 6.371 25.341 1.00 0.00 H ATOM 1586 N HIS C 49 52.908 5.734 28.383 1.00 50.88 N ATOM 1587 CA HIS C 49 53.721 5.092 29.419 1.00 45.86 C ATOM 1588 C HIS C 49 54.591 6.039 30.202 1.00 42.37 C ATOM 1589 O HIS C 49 55.376 5.607 31.038 1.00 45.46 O ATOM 1590 CB HIS C 49 54.605 4.043 28.790 1.00 44.12 C ATOM 1591 CG HIS C 49 53.872 2.822 28.356 1.00 43.40 C ATOM 1592 ND1 HIS C 49 54.465 1.833 27.598 1.00 45.62 N ATOM 1593 CD2 HIS C 49 52.593 2.430 28.558 1.00 43.27 C ATOM 1594 CE1 HIS C 49 53.577 0.886 27.350 1.00 46.69 C ATOM 1595 NE2 HIS C 49 52.440 1.217 27.938 1.00 46.18 N ATOM 1596 H HIS C 49 53.386 6.176 27.572 1.00 0.00 H ATOM 1597 N PHE C 50 54.432 7.329 29.970 1.00 42.84 N ATOM 1598 CA PHE C 50 55.254 8.309 30.633 1.00 46.16 C ATOM 1599 C PHE C 50 54.375 9.326 31.320 1.00 45.56 C ATOM 1600 O PHE C 50 53.604 10.019 30.679 1.00 40.55 O ATOM 1601 CB PHE C 50 56.162 8.999 29.613 1.00 48.00 C ATOM 1602 CG PHE C 50 57.116 9.976 30.212 1.00 47.25 C ATOM 1603 CD1 PHE C 50 57.997 9.586 31.203 1.00 47.54 C ATOM 1604 CD2 PHE C 50 57.162 11.295 29.759 1.00 50.97 C ATOM 1605 CE1 PHE C 50 58.879 10.501 31.769 1.00 50.89 C ATOM 1606 CE2 PHE C 50 58.062 12.209 30.300 1.00 49.36 C ATOM 1607 CZ PHE C 50 58.917 11.813 31.311 1.00 48.22 C ATOM 1608 H PHE C 50 53.702 7.642 29.298 1.00 0.00 H ATOM 1609 N GLY C 51 54.579 9.469 32.622 1.00 49.34 N ATOM 1610 CA GLY C 51 53.817 10.408 33.433 1.00 51.11 C ATOM 1611 C GLY C 51 54.620 11.585 33.959 1.00 51.28 C ATOM 1612 O GLY C 51 55.779 11.439 34.351 1.00 49.25 O ATOM 1613 H GLY C 51 55.310 8.889 33.081 1.00 0.00 H ATOM 1614 N ILE C 52 53.991 12.755 33.972 1.00 52.52 N ATOM 1615 CA ILE C 52 54.513 13.930 34.656 1.00 52.11 C ATOM 1616 C ILE C 52 53.404 14.512 35.525 1.00 49.11 C ATOM 1617 O ILE C 52 52.302 14.695 35.077 1.00 49.28 O ATOM 1618 CB ILE C 52 54.957 15.020 33.678 1.00 53.42 C ATOM 1619 CG1 ILE C 52 55.918 14.450 32.631 1.00 55.49 C ATOM 1620 CG2 ILE C 52 55.621 16.157 34.451 1.00 57.56 C ATOM 1621 CD1 ILE C 52 56.185 15.383 31.472 1.00 57.38 C ATOM 1622 H ILE C 52 53.084 12.836 33.470 1.00 0.00 H ATOM 1623 N GLY C 53 53.706 14.782 36.778 1.00 49.48 N ATOM 1624 CA GLY C 53 52.703 15.222 37.698 1.00 50.52 C ATOM 1625 C GLY C 53 51.481 14.317 37.752 1.00 52.29 C ATOM 1626 O GLY C 53 50.389 14.780 38.052 1.00 60.50 O ATOM 1627 H GLY C 53 54.688 14.674 37.103 1.00 0.00 H ATOM 1628 N GLY C 54 51.664 13.021 37.545 1.00 52.51 N ATOM 1629 CA GLY C 54 50.556 12.064 37.654 1.00 53.89 C ATOM 1630 C GLY C 54 49.645 12.002 36.444 1.00 52.85 C ATOM 1631 O GLY C 54 48.681 11.233 36.434 1.00 51.46 O ATOM 1632 H GLY C 54 52.613 12.674 37.300 1.00 0.00 H ATOM 1633 N GLU C 55 50.027 12.707 35.380 1.00 59.99 N ATOM 1634 CA GLU C 55 49.243 12.783 34.162 1.00 61.75 C ATOM 1635 C GLU C 55 50.114 12.399 32.946 1.00 64.84 C ATOM 1636 O GLU C 55 51.316 12.686 32.903 1.00 76.88 O ATOM 1637 CB GLU C 55 48.706 14.206 34.008 1.00 67.80 C ATOM 1638 CG GLU C 55 47.908 14.836 35.218 1.00 77.43 C ATOM 1639 CD GLU C 55 46.918 15.915 34.753 1.00 87.82 C ATOM 1640 OE1 GLU C 55 47.315 16.638 33.778 1.00 85.71 O ATOM 1641 OE2 GLU C 55 45.774 16.030 35.356 1.00 94.20 O ATOM 1642 H GLU C 55 50.927 13.226 35.425 1.00 0.00 H ATOM 1643 N LEU C 56 49.515 11.778 31.937 1.00 62.18 N ATOM 1644 CA LEU C 56 50.276 11.329 30.783 1.00 66.71 C ATOM 1645 C LEU C 56 50.930 12.489 30.041 1.00 74.36 C ATOM 1646 O LEU C 56 50.455 13.609 30.099 1.00 89.77 O ATOM 1647 CB LEU C 56 49.386 10.567 29.809 1.00 73.01 C ATOM 1648 CG LEU C 56 48.631 9.339 30.349 1.00 77.84 C ATOM 1649 CD1 LEU C 56 47.752 8.679 29.294 1.00 79.95 C ATOM 1650 CD2 LEU C 56 49.612 8.319 30.876 1.00 79.30 C ATOM 1651 H LEU C 56 48.489 11.611 31.973 1.00 0.00 H ATOM 1652 N ALA C 57 52.036 12.233 29.354 1.00 85.99 N ATOM 1653 CA ALA C 57 52.666 13.253 28.507 1.00 93.03 C ATOM 1654 C ALA C 57 51.897 13.401 27.201 1.00 98.88 C ATOM 1655 O ALA C 57 52.069 14.390 26.475 1.00 91.96 O ATOM 1656 CB ALA C 57 54.107 12.883 28.217 1.00 94.97 C ATOM 1657 H ALA C 57 52.466 11.288 29.417 1.00 0.00 H ATOM 1658 N SER C 58 51.074 12.398 26.894 1.00101.95 N ATOM 1659 CA SER C 58 50.189 12.430 25.724 1.00108.04 C ATOM 1660 C SER C 58 48.938 13.351 25.878 1.00107.61 C ATOM 1661 O SER C 58 47.960 13.165 25.160 1.00108.05 O ATOM 1662 CB SER C 58 49.840 10.977 25.293 1.00106.42 C ATOM 1663 OG SER C 58 48.818 10.382 26.077 1.00 93.46 O ATOM 1664 HG SER C 58 47.990 10.920 26.002 1.00 0.00 H ATOM 1665 H SER C 58 51.059 11.559 27.509 1.00 0.00 H ATOM 1666 N LYS C 59 49.012 14.360 26.765 1.00104.36 N ATOM 1667 CA LYS C 59 47.893 15.281 27.072 1.00 91.14 C ATOM 1668 C LYS C 59 48.330 16.731 27.245 1.00 83.44 C ATOM 1669 O LYS C 59 49.149 17.037 28.106 1.00 78.46 O ATOM 1670 CB LYS C 59 47.151 14.790 28.321 1.00 83.32 C ATOM 1671 CG LYS C 59 46.688 13.359 28.129 1.00 82.56 C ATOM 1672 CD LYS C 59 45.654 12.850 29.113 1.00 80.00 C ATOM 1673 CE LYS C 59 45.102 11.527 28.587 1.00 79.85 C ATOM 1674 NZ LYS C 59 44.104 10.897 29.485 1.00 80.41 N ATOM 1675 HZ1 LYS C 59 44.543 10.705 30.408 1.00 0.00 H ATOM 1676 HZ2 LYS C 59 43.297 11.541 29.611 1.00 0.00 H ATOM 1677 HZ3 LYS C 59 43.775 10.005 29.064 1.00 0.00 H ATOM 1678 H LYS C 59 49.912 14.502 27.267 1.00 0.00 H TER 1679 LYS C 59 ATOM 1680 N PRO D 1 63.318 13.612 27.669 1.00 44.37 N ATOM 1681 CA PRO D 1 64.540 12.799 27.528 1.00 42.54 C ATOM 1682 C PRO D 1 65.381 12.707 28.796 1.00 37.66 C ATOM 1683 O PRO D 1 65.809 13.717 29.346 1.00 34.54 O ATOM 1684 CB PRO D 1 65.334 13.532 26.429 1.00 45.63 C ATOM 1685 CG PRO D 1 64.575 14.789 26.127 1.00 44.06 C ATOM 1686 CD PRO D 1 63.535 14.982 27.188 1.00 45.29 C ATOM 1687 HN2 PRO D 1 63.045 13.643 28.672 1.00 0.00 H ATOM 1688 HN1 PRO D 1 62.553 13.175 27.116 1.00 0.00 H ATOM 1689 N ILE D 2 65.629 11.481 29.222 1.00 41.06 N ATOM 1690 CA ILE D 2 66.268 11.191 30.494 1.00 43.04 C ATOM 1691 C ILE D 2 67.431 10.242 30.246 1.00 39.69 C ATOM 1692 O ILE D 2 67.216 9.126 29.800 1.00 37.56 O ATOM 1693 CB ILE D 2 65.279 10.502 31.433 1.00 40.02 C ATOM 1694 CG1 ILE D 2 64.128 11.454 31.711 1.00 43.24 C ATOM 1695 CG2 ILE D 2 65.970 10.102 32.720 1.00 41.21 C ATOM 1696 CD1 ILE D 2 62.997 10.841 32.523 1.00 42.81 C ATOM 1697 H ILE D 2 65.353 10.683 28.616 1.00 0.00 H ATOM 1698 N ALA D 3 68.640 10.660 30.597 1.00 38.85 N ATOM 1699 CA ALA D 3 69.821 9.813 30.396 1.00 39.54 C ATOM 1700 C ALA D 3 70.428 9.358 31.705 1.00 37.80 C ATOM 1701 O ALA D 3 70.577 10.150 32.617 1.00 33.32 O ATOM 1702 CB ALA D 3 70.841 10.564 29.603 1.00 38.73 C ATOM 1703 H ALA D 3 68.752 11.603 31.021 1.00 0.00 H ATOM 1704 N GLN D 4 70.725 8.066 31.810 1.00 35.79 N ATOM 1705 CA GLN D 4 71.455 7.545 32.943 1.00 36.06 C ATOM 1706 C GLN D 4 72.792 7.052 32.419 1.00 33.50 C ATOM 1707 O GLN D 4 72.854 6.248 31.501 1.00 30.34 O ATOM 1708 CB GLN D 4 70.701 6.421 33.647 1.00 38.68 C ATOM 1709 CG GLN D 4 71.478 5.819 34.832 1.00 42.86 C ATOM 1710 CD GLN D 4 70.668 4.792 35.615 1.00 45.79 C ATOM 1711 OE1 GLN D 4 69.599 4.368 35.173 1.00 63.18 O ATOM 1712 NE2 GLN D 4 71.171 4.380 36.770 1.00 42.70 N ATOM 1713 HE22 GLN D 4 72.077 4.762 37.109 1.00 0.00 H ATOM 1714 HE21 GLN D 4 70.660 3.674 37.338 1.00 0.00 H ATOM 1715 H GLN D 4 70.424 7.414 31.058 1.00 0.00 H ATOM 1716 N ILE D 5 73.869 7.503 33.044 1.00 32.88 N ATOM 1717 CA ILE D 5 75.209 7.111 32.621 1.00 32.34 C ATOM 1718 C ILE D 5 75.947 6.373 33.729 1.00 30.14 C ATOM 1719 O ILE D 5 76.170 6.934 34.813 1.00 32.12 O ATOM 1720 CB ILE D 5 75.998 8.357 32.218 1.00 33.09 C ATOM 1721 CG1 ILE D 5 75.122 9.230 31.328 1.00 33.05 C ATOM 1722 CG2 ILE D 5 77.265 7.949 31.500 1.00 34.42 C ATOM 1723 CD1 ILE D 5 75.799 10.477 30.844 1.00 34.31 C ATOM 1724 H ILE D 5 73.757 8.149 33.852 1.00 0.00 H ATOM 1725 N HIS D 6 76.319 5.121 33.479 1.00 28.28 N ATOM 1726 CA HIS D 6 77.122 4.399 34.439 1.00 29.54 C ATOM 1727 C HIS D 6 78.594 4.601 34.111 1.00 28.46 C ATOM 1728 O HIS D 6 79.025 4.321 32.999 1.00 27.92 O ATOM 1729 CB HIS D 6 76.844 2.896 34.457 1.00 31.89 C ATOM 1730 CG HIS D 6 75.528 2.536 35.053 1.00 34.36 C ATOM 1731 ND1 HIS D 6 74.357 2.705 34.357 1.00 34.78 N ATOM 1732 CD2 HIS D 6 75.193 1.993 36.249 1.00 34.29 C ATOM 1733 CE1 HIS D 6 73.354 2.284 35.092 1.00 39.01 C ATOM 1734 NE2 HIS D 6 73.830 1.857 36.250 1.00 37.06 N ATOM 1735 H HIS D 6 76.032 4.661 32.592 1.00 0.00 H ATOM 1736 N ILE D 7 79.360 5.021 35.095 1.00 27.01 N ATOM 1737 CA ILE D 7 80.796 5.209 34.923 1.00 29.09 C ATOM 1738 C ILE D 7 81.564 4.666 36.079 1.00 29.09 C ATOM 1739 O ILE D 7 81.037 4.572 37.203 1.00 29.45 O ATOM 1740 CB ILE D 7 81.160 6.717 34.786 1.00 27.85 C ATOM 1741 CG1 ILE D 7 80.926 7.458 36.094 1.00 24.24 C ATOM 1742 CG2 ILE D 7 80.350 7.325 33.636 1.00 27.24 C ATOM 1743 CD1 ILE D 7 81.162 8.951 36.015 1.00 25.50 C ATOM 1744 H ILE D 7 78.930 5.224 36.020 1.00 0.00 H ATOM 1745 N LEU D 8 82.827 4.363 35.835 1.00 29.19 N ATOM 1746 CA LEU D 8 83.694 3.966 36.944 1.00 32.71 C ATOM 1747 C LEU D 8 83.931 5.100 37.899 1.00 30.60 C ATOM 1748 O LEU D 8 84.081 6.242 37.494 1.00 27.26 O ATOM 1749 CB LEU D 8 85.025 3.451 36.441 1.00 35.41 C ATOM 1750 CG LEU D 8 84.917 2.018 35.904 1.00 37.81 C ATOM 1751 CD1 LEU D 8 86.181 1.650 35.159 1.00 40.02 C ATOM 1752 CD2 LEU D 8 84.643 1.029 37.024 1.00 39.33 C ATOM 1753 H LEU D 8 83.200 4.406 34.865 1.00 0.00 H ATOM 1754 N GLU D 9 83.935 4.780 39.182 1.00 31.49 N ATOM 1755 CA GLU D 9 84.237 5.786 40.194 1.00 32.35 C ATOM 1756 C GLU D 9 85.648 6.292 39.969 1.00 31.74 C ATOM 1757 O GLU D 9 86.506 5.580 39.416 1.00 34.62 O ATOM 1758 CB GLU D 9 84.079 5.191 41.608 1.00 34.27 C ATOM 1759 CG GLU D 9 85.183 4.225 41.998 1.00 39.92 C ATOM 1760 CD GLU D 9 84.958 3.510 43.330 1.00 46.35 C ATOM 1761 OE1 GLU D 9 84.027 3.905 44.093 1.00 45.96 O ATOM 1762 OE2 GLU D 9 85.729 2.538 43.596 1.00 48.62 O ATOM 1763 H GLU D 9 83.721 3.804 39.472 1.00 0.00 H ATOM 1764 N GLY D 10 85.923 7.488 40.449 1.00 29.74 N ATOM 1765 CA GLY D 10 87.292 7.994 40.474 1.00 30.29 C ATOM 1766 C GLY D 10 87.479 9.386 39.894 1.00 34.44 C ATOM 1767 O GLY D 10 88.553 9.962 40.036 1.00 34.87 O ATOM 1768 H GLY D 10 85.152 8.081 40.816 1.00 0.00 H ATOM 1769 N ARG D 11 86.431 9.952 39.297 1.00 33.98 N ATOM 1770 CA ARG D 11 86.531 11.217 38.611 1.00 33.41 C ATOM 1771 C ARG D 11 86.172 12.368 39.547 1.00 32.81 C ATOM 1772 O ARG D 11 85.575 12.172 40.596 1.00 28.27 O ATOM 1773 CB ARG D 11 85.611 11.208 37.408 1.00 38.00 C ATOM 1774 CG ARG D 11 85.821 10.011 36.513 1.00 43.30 C ATOM 1775 CD ARG D 11 86.036 10.333 35.063 1.00 48.20 C ATOM 1776 NE ARG D 11 86.513 9.200 34.283 1.00 59.18 N ATOM 1777 CZ ARG D 11 86.086 7.917 34.148 1.00 69.30 C ATOM 1778 NH1 ARG D 11 85.037 7.363 34.763 1.00 62.81 N ATOM 1779 NH2 ARG D 11 86.793 7.149 33.314 1.00 80.31 N ATOM 1780 HE ARG D 11 87.354 9.417 33.711 1.00 0.00 H ATOM 1781 HH12 ARG D 11 84.797 6.366 34.586 1.00 0.00 H ATOM 1782 HH11 ARG D 11 84.460 7.928 35.418 1.00 0.00 H ATOM 1783 HH22 ARG D 11 86.521 6.157 33.164 1.00 0.00 H ATOM 1784 HH21 ARG D 11 87.616 7.544 32.815 1.00 0.00 H ATOM 1785 H ARG D 11 85.512 9.466 39.326 1.00 0.00 H ATOM 1786 N SER D 12 86.572 13.578 39.168 1.00 32.66 N ATOM 1787 CA SER D 12 86.351 14.746 39.998 1.00 30.89 C ATOM 1788 C SER D 12 84.945 15.250 39.800 1.00 34.56 C ATOM 1789 O SER D 12 84.340 15.018 38.771 1.00 36.19 O ATOM 1790 CB SER D 12 87.326 15.845 39.604 1.00 31.93 C ATOM 1791 OG SER D 12 87.086 16.282 38.277 1.00 35.28 O ATOM 1792 HG SER D 12 86.163 16.635 38.209 1.00 0.00 H ATOM 1793 H SER D 12 87.055 13.689 38.254 1.00 0.00 H ATOM 1794 N ASP D 13 84.464 16.042 40.751 1.00 38.87 N ATOM 1795 CA ASP D 13 83.197 16.738 40.605 1.00 36.65 C ATOM 1796 C ASP D 13 83.133 17.631 39.350 1.00 40.01 C ATOM 1797 O ASP D 13 82.074 17.747 38.751 1.00 38.05 O ATOM 1798 CB ASP D 13 82.902 17.574 41.843 1.00 35.59 C ATOM 1799 CG ASP D 13 82.482 16.732 43.022 1.00 42.50 C ATOM 1800 OD1 ASP D 13 82.530 15.470 42.925 1.00 57.68 O ATOM 1801 OD2 ASP D 13 82.125 17.303 44.084 1.00 45.75 O ATOM 1802 H ASP D 13 85.011 16.168 41.627 1.00 0.00 H ATOM 1803 N GLU D 14 84.260 18.221 38.945 1.00 42.98 N ATOM 1804 CA GLU D 14 84.278 19.120 37.809 1.00 46.42 C ATOM 1805 C GLU D 14 84.053 18.317 36.546 1.00 45.19 C ATOM 1806 O GLU D 14 83.247 18.707 35.678 1.00 44.76 O ATOM 1807 CB GLU D 14 85.592 19.899 37.691 1.00 51.65 C ATOM 1808 CG GLU D 14 85.845 20.893 38.818 1.00 63.16 C ATOM 1809 CD GLU D 14 86.238 20.213 40.136 1.00 76.55 C ATOM 1810 OE1 GLU D 14 87.117 19.317 40.121 1.00 94.36 O ATOM 1811 OE2 GLU D 14 85.671 20.573 41.190 1.00 69.08 O ATOM 1812 H GLU D 14 85.145 18.031 39.457 1.00 0.00 H ATOM 1813 N GLN D 15 84.782 17.216 36.411 1.00 42.78 N ATOM 1814 CA GLN D 15 84.637 16.365 35.232 1.00 38.92 C ATOM 1815 C GLN D 15 83.206 15.913 35.048 1.00 36.89 C ATOM 1816 O GLN D 15 82.692 15.835 33.925 1.00 35.73 O ATOM 1817 CB GLN D 15 85.499 15.153 35.380 1.00 43.39 C ATOM 1818 CG GLN D 15 86.853 15.270 34.734 1.00 50.36 C ATOM 1819 CD GLN D 15 87.677 14.014 34.940 1.00 54.26 C ATOM 1820 OE1 GLN D 15 87.852 13.491 36.081 1.00 64.69 O ATOM 1821 NE2 GLN D 15 88.150 13.475 33.819 1.00 52.02 N ATOM 1822 HE22 GLN D 15 87.980 13.942 32.905 1.00 0.00 H ATOM 1823 HE21 GLN D 15 88.689 12.587 33.856 1.00 0.00 H ATOM 1824 H GLN D 15 85.464 16.956 37.152 1.00 0.00 H ATOM 1825 N LYS D 16 82.572 15.590 36.163 1.00 33.43 N ATOM 1826 CA LYS D 16 81.210 15.108 36.147 1.00 36.22 C ATOM 1827 C LYS D 16 80.205 16.206 35.811 1.00 38.40 C ATOM 1828 O LYS D 16 79.257 15.979 35.064 1.00 33.26 O ATOM 1829 CB LYS D 16 80.869 14.441 37.472 1.00 32.74 C ATOM 1830 CG LYS D 16 81.596 13.121 37.605 1.00 30.25 C ATOM 1831 CD LYS D 16 81.127 12.332 38.797 1.00 31.73 C ATOM 1832 CE LYS D 16 81.669 12.866 40.100 1.00 30.14 C ATOM 1833 NZ LYS D 16 81.806 11.769 41.061 1.00 27.10 N ATOM 1834 HZ1 LYS D 16 80.875 11.335 41.225 1.00 0.00 H ATOM 1835 HZ2 LYS D 16 82.460 11.056 40.680 1.00 0.00 H ATOM 1836 HZ3 LYS D 16 82.180 12.140 41.958 1.00 0.00 H ATOM 1837 H LYS D 16 83.066 15.685 37.073 1.00 0.00 H ATOM 1838 N GLU D 17 80.444 17.396 36.336 1.00 42.50 N ATOM 1839 CA GLU D 17 79.664 18.564 35.956 1.00 48.13 C ATOM 1840 C GLU D 17 79.753 18.800 34.421 1.00 47.46 C ATOM 1841 O GLU D 17 78.765 19.111 33.767 1.00 46.23 O ATOM 1842 CB GLU D 17 80.178 19.781 36.700 1.00 54.22 C ATOM 1843 CG GLU D 17 79.381 21.042 36.447 1.00 68.81 C ATOM 1844 CD GLU D 17 79.694 22.156 37.429 1.00 82.41 C ATOM 1845 OE1 GLU D 17 80.634 22.007 38.242 1.00 92.93 O ATOM 1846 OE2 GLU D 17 79.000 23.195 37.378 1.00 90.53 O ATOM 1847 H GLU D 17 81.206 17.499 37.036 1.00 0.00 H ATOM 1848 N THR D 18 80.944 18.637 33.874 1.00 41.25 N ATOM 1849 CA THR D 18 81.163 18.805 32.462 1.00 40.18 C ATOM 1850 C THR D 18 80.420 17.728 31.680 1.00 41.08 C ATOM 1851 O THR D 18 79.749 18.021 30.697 1.00 38.87 O ATOM 1852 CB THR D 18 82.685 18.750 32.158 1.00 38.20 C ATOM 1853 OG1 THR D 18 83.337 19.841 32.808 1.00 41.96 O ATOM 1854 CG2 THR D 18 82.988 18.803 30.680 1.00 41.72 C ATOM 1855 HG1 THR D 18 83.192 19.776 33.785 1.00 0.00 H ATOM 1856 H THR D 18 81.747 18.380 34.482 1.00 0.00 H ATOM 1857 N LEU D 19 80.566 16.480 32.111 1.00 42.75 N ATOM 1858 CA LEU D 19 79.857 15.370 31.496 1.00 38.94 C ATOM 1859 C LEU D 19 78.360 15.695 31.390 1.00 37.72 C ATOM 1860 O LEU D 19 77.742 15.497 30.364 1.00 38.06 O ATOM 1861 CB LEU D 19 80.040 14.118 32.343 1.00 36.82 C ATOM 1862 CG LEU D 19 79.318 12.867 31.913 1.00 34.13 C ATOM 1863 CD1 LEU D 19 79.836 12.420 30.561 1.00 39.15 C ATOM 1864 CD2 LEU D 19 79.504 11.763 32.926 1.00 32.63 C ATOM 1865 H LEU D 19 81.205 16.292 32.910 1.00 0.00 H ATOM 1866 N ILE D 20 77.777 16.161 32.482 1.00 34.34 N ATOM 1867 CA ILE D 20 76.355 16.415 32.504 1.00 35.53 C ATOM 1868 C ILE D 20 76.010 17.456 31.463 1.00 37.63 C ATOM 1869 O ILE D 20 75.044 17.313 30.743 1.00 37.53 O ATOM 1870 CB ILE D 20 75.890 16.846 33.925 1.00 36.80 C ATOM 1871 CG1 ILE D 20 75.826 15.607 34.819 1.00 35.06 C ATOM 1872 CG2 ILE D 20 74.530 17.547 33.883 1.00 36.73 C ATOM 1873 CD1 ILE D 20 75.511 15.873 36.276 1.00 36.77 C ATOM 1874 H ILE D 20 78.347 16.346 33.332 1.00 0.00 H ATOM 1875 N ARG D 21 76.784 18.536 31.423 1.00 45.26 N ATOM 1876 CA ARG D 21 76.481 19.638 30.537 1.00 50.00 C ATOM 1877 C ARG D 21 76.608 19.169 29.095 1.00 50.12 C ATOM 1878 O ARG D 21 75.698 19.366 28.293 1.00 53.92 O ATOM 1879 CB ARG D 21 77.404 20.831 30.801 1.00 60.28 C ATOM 1880 CG ARG D 21 77.042 22.110 30.027 1.00 66.13 C ATOM 1881 CD ARG D 21 77.840 23.396 30.423 1.00 72.30 C ATOM 1882 NE ARG D 21 78.939 23.076 31.312 1.00 77.80 N ATOM 1883 CZ ARG D 21 80.156 22.816 30.894 1.00 82.09 C ATOM 1884 NH1 ARG D 21 81.061 22.501 31.791 1.00 82.67 N ATOM 1885 NH2 ARG D 21 80.445 22.864 29.592 1.00 76.78 N ATOM 1886 HE ARG D 21 78.754 23.051 32.335 1.00 0.00 H ATOM 1887 HH12 ARG D 21 82.035 22.289 31.495 1.00 0.00 H ATOM 1888 HH11 ARG D 21 80.804 22.463 32.798 1.00 0.00 H ATOM 1889 HH22 ARG D 21 81.411 22.657 29.266 1.00 0.00 H ATOM 1890 HH21 ARG D 21 79.705 23.108 28.904 1.00 0.00 H ATOM 1891 H ARG D 21 77.621 18.589 32.039 1.00 0.00 H ATOM 1892 N GLU D 22 77.737 18.562 28.763 1.00 46.51 N ATOM 1893 CA GLU D 22 78.051 18.222 27.378 1.00 47.12 C ATOM 1894 C GLU D 22 77.098 17.191 26.817 1.00 42.77 C ATOM 1895 O GLU D 22 76.676 17.290 25.659 1.00 46.65 O ATOM 1896 CB GLU D 22 79.489 17.708 27.275 1.00 52.59 C ATOM 1897 CG GLU D 22 80.526 18.744 27.691 1.00 57.29 C ATOM 1898 CD GLU D 22 81.269 19.343 26.519 1.00 63.43 C ATOM 1899 OE1 GLU D 22 81.880 18.551 25.768 1.00 57.44 O ATOM 1900 OE2 GLU D 22 81.220 20.594 26.351 1.00 70.35 O ATOM 1901 H GLU D 22 78.419 18.321 29.510 1.00 0.00 H ATOM 1902 N VAL D 23 76.741 16.222 27.640 1.00 39.64 N ATOM 1903 CA VAL D 23 75.759 15.227 27.244 1.00 38.49 C ATOM 1904 C VAL D 23 74.370 15.851 27.104 1.00 35.55 C ATOM 1905 O VAL D 23 73.685 15.627 26.109 1.00 30.90 O ATOM 1906 CB VAL D 23 75.703 14.072 28.230 1.00 39.54 C ATOM 1907 CG1 VAL D 23 74.488 13.202 27.978 1.00 42.27 C ATOM 1908 CG2 VAL D 23 76.960 13.235 28.119 1.00 40.89 C ATOM 1909 H VAL D 23 77.169 16.170 28.586 1.00 0.00 H ATOM 1910 N SER D 24 73.976 16.657 28.064 1.00 34.93 N ATOM 1911 CA SER D 24 72.706 17.331 27.953 1.00 42.05 C ATOM 1912 C SER D 24 72.606 18.118 26.625 1.00 46.92 C ATOM 1913 O SER D 24 71.561 18.119 25.969 1.00 46.31 O ATOM 1914 CB SER D 24 72.469 18.264 29.170 1.00 49.02 C ATOM 1915 OG SER D 24 72.203 17.516 30.364 1.00 55.18 O ATOM 1916 HG SER D 24 72.976 16.930 30.564 1.00 0.00 H ATOM 1917 H SER D 24 74.577 16.808 28.899 1.00 0.00 H ATOM 1918 N GLU D 25 73.678 18.821 26.273 1.00 46.76 N ATOM 1919 CA GLU D 25 73.721 19.633 25.079 1.00 45.66 C ATOM 1920 C GLU D 25 73.593 18.742 23.872 1.00 47.02 C ATOM 1921 O GLU D 25 72.768 18.982 22.985 1.00 49.86 O ATOM 1922 CB GLU D 25 75.009 20.466 25.056 1.00 52.17 C ATOM 1923 CG GLU D 25 74.802 21.871 25.653 1.00 64.47 C ATOM 1924 CD GLU D 25 76.113 22.572 26.094 1.00 66.58 C ATOM 1925 OE1 GLU D 25 76.287 23.734 26.663 1.00 61.86 O ATOM 1926 OE2 GLU D 25 77.039 21.848 25.808 1.00 75.34 O ATOM 1927 H GLU D 25 74.520 18.785 26.882 1.00 0.00 H ATOM 1928 N ALA D 26 74.382 17.683 23.837 1.00 46.57 N ATOM 1929 CA ALA D 26 74.341 16.755 22.708 1.00 46.44 C ATOM 1930 C ALA D 26 72.932 16.166 22.477 1.00 45.50 C ATOM 1931 O ALA D 26 72.519 15.948 21.342 1.00 54.28 O ATOM 1932 CB ALA D 26 75.354 15.633 22.895 1.00 41.88 C ATOM 1933 H ALA D 26 75.041 17.507 24.622 1.00 0.00 H ATOM 1934 N ILE D 27 72.222 15.901 23.552 1.00 42.85 N ATOM 1935 CA ILE D 27 70.875 15.380 23.459 1.00 49.17 C ATOM 1936 C ILE D 27 69.951 16.443 22.857 1.00 51.68 C ATOM 1937 O ILE D 27 69.239 16.170 21.903 1.00 53.90 O ATOM 1938 CB ILE D 27 70.349 14.914 24.845 1.00 48.63 C ATOM 1939 CG1 ILE D 27 71.073 13.627 25.262 1.00 49.49 C ATOM 1940 CG2 ILE D 27 68.845 14.678 24.820 1.00 47.08 C ATOM 1941 CD1 ILE D 27 70.868 13.229 26.709 1.00 50.89 C ATOM 1942 H ILE D 27 72.638 16.070 24.490 1.00 0.00 H ATOM 1943 N SER D 28 70.001 17.648 23.408 1.00 51.44 N ATOM 1944 CA SER D 28 69.193 18.743 22.909 1.00 53.46 C ATOM 1945 C SER D 28 69.427 19.004 21.429 1.00 57.46 C ATOM 1946 O SER D 28 68.478 19.168 20.659 1.00 65.36 O ATOM 1947 CB SER D 28 69.497 20.008 23.692 1.00 57.39 C ATOM 1948 OG SER D 28 68.571 21.024 23.373 1.00 61.80 O ATOM 1949 HG SER D 28 67.657 20.718 23.599 1.00 0.00 H ATOM 1950 H SER D 28 70.634 17.811 24.217 1.00 0.00 H ATOM 1951 N ARG D 29 70.694 19.040 21.038 1.00 60.24 N ATOM 1952 CA ARG D 29 71.066 19.259 19.658 1.00 57.98 C ATOM 1953 C ARG D 29 70.478 18.151 18.803 1.00 59.02 C ATOM 1954 O ARG D 29 69.784 18.423 17.826 1.00 71.47 O ATOM 1955 CB ARG D 29 72.597 19.271 19.466 1.00 64.15 C ATOM 1956 CG ARG D 29 73.162 20.429 18.657 1.00 71.18 C ATOM 1957 CD ARG D 29 74.612 20.807 18.995 1.00 71.45 C ATOM 1958 NE ARG D 29 75.407 19.619 19.316 1.00 75.37 N ATOM 1959 CZ ARG D 29 76.102 19.392 20.441 1.00 66.32 C ATOM 1960 NH1 ARG D 29 76.175 20.268 21.430 1.00 66.42 N ATOM 1961 NH2 ARG D 29 76.765 18.259 20.568 1.00 62.59 N ATOM 1962 HE ARG D 29 75.436 18.871 18.594 1.00 0.00 H ATOM 1963 HH12 ARG D 29 76.727 20.045 22.283 1.00 0.00 H ATOM 1964 HH11 ARG D 29 75.680 21.180 21.355 1.00 0.00 H ATOM 1965 HH22 ARG D 29 77.308 18.069 21.434 1.00 0.00 H ATOM 1966 HH21 ARG D 29 76.745 17.556 19.802 1.00 0.00 H ATOM 1967 H ARG D 29 71.444 18.906 21.746 1.00 0.00 H ATOM 1968 N SER D 30 70.778 16.909 19.160 1.00 57.17 N ATOM 1969 CA SER D 30 70.462 15.747 18.318 1.00 57.56 C ATOM 1970 C SER D 30 68.973 15.524 18.073 1.00 54.61 C ATOM 1971 O SER D 30 68.590 15.060 17.016 1.00 55.22 O ATOM 1972 CB SER D 30 71.022 14.483 18.956 1.00 58.03 C ATOM 1973 OG SER D 30 72.429 14.465 18.888 1.00 59.07 O ATOM 1974 HG SER D 30 72.792 15.251 19.368 1.00 0.00 H ATOM 1975 H SER D 30 71.255 16.752 20.071 1.00 0.00 H ATOM 1976 N LEU D 31 68.150 15.857 19.055 1.00 50.22 N ATOM 1977 CA LEU D 31 66.720 15.609 18.979 1.00 50.29 C ATOM 1978 C LEU D 31 65.920 16.876 18.810 1.00 55.02 C ATOM 1979 O LEU D 31 64.685 16.846 18.868 1.00 56.11 O ATOM 1980 CB LEU D 31 66.232 14.966 20.269 1.00 45.76 C ATOM 1981 CG LEU D 31 66.936 13.709 20.705 1.00 42.84 C ATOM 1982 CD1 LEU D 31 66.240 13.190 21.944 1.00 45.13 C ATOM 1983 CD2 LEU D 31 66.963 12.659 19.611 1.00 43.33 C ATOM 1984 H LEU D 31 68.539 16.310 19.907 1.00 0.00 H ATOM 1985 N ASP D 32 66.602 18.001 18.624 1.00 62.75 N ATOM 1986 CA ASP D 32 65.924 19.284 18.525 1.00 69.61 C ATOM 1987 C ASP D 32 64.927 19.446 19.678 1.00 67.91 C ATOM 1988 O ASP D 32 63.804 19.884 19.480 1.00 66.56 O ATOM 1989 CB ASP D 32 65.213 19.399 17.167 1.00 74.26 C ATOM 1990 CG ASP D 32 65.317 20.777 16.575 1.00 77.43 C ATOM 1991 OD1 ASP D 32 65.284 21.764 17.339 1.00 76.94 O ATOM 1992 OD2 ASP D 32 65.421 20.869 15.336 1.00 86.50 O ATOM 1993 H ASP D 32 67.639 17.964 18.548 1.00 0.00 H ATOM 1994 N ALA D 33 65.352 19.069 20.875 1.00 71.67 N ATOM 1995 CA ALA D 33 64.510 19.171 22.049 1.00 69.58 C ATOM 1996 C ALA D 33 65.018 20.301 22.924 1.00 68.43 C ATOM 1997 O ALA D 33 66.222 20.551 22.973 1.00 64.19 O ATOM 1998 CB ALA D 33 64.509 17.861 22.813 1.00 69.63 C ATOM 1999 H ALA D 33 66.315 18.690 20.974 1.00 0.00 H ATOM 2000 N PRO D 34 64.100 20.989 23.631 1.00 68.00 N ATOM 2001 CA PRO D 34 64.537 22.060 24.531 1.00 69.68 C ATOM 2002 C PRO D 34 65.498 21.576 25.647 1.00 76.29 C ATOM 2003 O PRO D 34 65.189 20.610 26.380 1.00 72.82 O ATOM 2004 CB PRO D 34 63.231 22.597 25.124 1.00 67.30 C ATOM 2005 CG PRO D 34 62.206 21.538 24.901 1.00 68.17 C ATOM 2006 CD PRO D 34 62.665 20.680 23.761 1.00 67.36 C ATOM 2007 N LEU D 35 66.654 22.236 25.754 1.00 71.87 N ATOM 2008 CA LEU D 35 67.678 21.878 26.737 1.00 68.38 C ATOM 2009 C LEU D 35 67.119 21.723 28.151 1.00 64.42 C ATOM 2010 O LEU D 35 67.537 20.841 28.872 1.00 63.95 O ATOM 2011 CB LEU D 35 68.796 22.911 26.750 1.00 64.69 C ATOM 2012 CG LEU D 35 69.971 22.611 27.689 1.00 69.59 C ATOM 2013 CD1 LEU D 35 70.673 21.316 27.306 1.00 69.02 C ATOM 2014 CD2 LEU D 35 70.969 23.760 27.700 1.00 69.38 C ATOM 2015 H LEU D 35 66.834 23.036 25.114 1.00 0.00 H ATOM 2016 N THR D 36 66.149 22.543 28.531 1.00 61.41 N ATOM 2017 CA THR D 36 65.652 22.535 29.907 1.00 58.70 C ATOM 2018 C THR D 36 64.822 21.318 30.283 1.00 51.73 C ATOM 2019 O THR D 36 64.571 21.097 31.467 1.00 48.83 O ATOM 2020 CB THR D 36 64.793 23.787 30.189 1.00 61.80 C ATOM 2021 OG1 THR D 36 63.684 23.778 29.291 1.00 61.14 O ATOM 2022 CG2 THR D 36 65.617 25.062 29.995 1.00 59.47 C ATOM 2023 HG1 THR D 36 63.120 24.575 29.457 1.00 0.00 H ATOM 2024 H THR D 36 65.735 23.202 27.841 1.00 0.00 H ATOM 2025 N SER D 37 64.382 20.544 29.298 1.00 49.41 N ATOM 2026 CA SER D 37 63.640 19.301 29.568 1.00 52.41 C ATOM 2027 C SER D 37 64.567 18.095 29.824 1.00 52.08 C ATOM 2028 O SER D 37 64.136 17.060 30.381 1.00 52.71 O ATOM 2029 CB SER D 37 62.701 18.977 28.406 1.00 51.53 C ATOM 2030 OG SER D 37 63.426 18.871 27.188 1.00 50.32 O ATOM 2031 HG SER D 37 63.882 19.729 27.001 1.00 0.00 H ATOM 2032 H SER D 37 64.566 20.822 28.313 1.00 0.00 H ATOM 2033 N VAL D 38 65.840 18.241 29.456 1.00 48.76 N ATOM 2034 CA VAL D 38 66.817 17.149 29.560 1.00 52.09 C ATOM 2035 C VAL D 38 67.294 16.866 30.996 1.00 49.02 C ATOM 2036 O VAL D 38 67.762 17.750 31.689 1.00 46.01 O ATOM 2037 CB VAL D 38 68.057 17.412 28.705 1.00 49.33 C ATOM 2038 CG1 VAL D 38 69.012 16.242 28.804 1.00 52.11 C ATOM 2039 CG2 VAL D 38 67.668 17.612 27.248 1.00 55.23 C ATOM 2040 H VAL D 38 66.152 19.160 29.082 1.00 0.00 H ATOM 2041 N ARG D 39 67.149 15.612 31.402 1.00 45.27 N ATOM 2042 CA ARG D 39 67.604 15.145 32.689 1.00 50.69 C ATOM 2043 C ARG D 39 68.750 14.168 32.517 1.00 48.31 C ATOM 2044 O ARG D 39 68.735 13.332 31.621 1.00 42.11 O ATOM 2045 CB ARG D 39 66.499 14.403 33.422 1.00 57.04 C ATOM 2046 CG ARG D 39 65.753 15.250 34.409 1.00 58.93 C ATOM 2047 CD ARG D 39 64.566 15.918 33.791 1.00 67.62 C ATOM 2048 NE ARG D 39 63.852 16.649 34.825 1.00 67.67 N ATOM 2049 CZ ARG D 39 63.287 17.833 34.662 1.00 74.60 C ATOM 2050 NH1 ARG D 39 63.342 18.463 33.487 1.00 80.85 N ATOM 2051 NH2 ARG D 39 62.666 18.397 35.689 1.00 76.75 N ATOM 2052 HE ARG D 39 63.780 16.207 35.764 1.00 0.00 H ATOM 2053 HH12 ARG D 39 62.893 19.394 33.375 1.00 0.00 H ATOM 2054 HH11 ARG D 39 63.834 18.023 32.684 1.00 0.00 H ATOM 2055 HH22 ARG D 39 62.216 19.328 35.577 1.00 0.00 H ATOM 2056 HH21 ARG D 39 62.629 17.908 36.606 1.00 0.00 H ATOM 2057 H ARG D 39 66.686 14.934 30.763 1.00 0.00 H ATOM 2058 N VAL D 40 69.744 14.273 33.392 1.00 44.76 N ATOM 2059 CA VAL D 40 70.859 13.337 33.379 1.00 40.89 C ATOM 2060 C VAL D 40 71.141 12.810 34.760 1.00 35.42 C ATOM 2061 O VAL D 40 71.233 13.566 35.726 1.00 41.00 O ATOM 2062 CB VAL D 40 72.137 13.988 32.835 1.00 39.96 C ATOM 2063 CG1 VAL D 40 73.282 12.982 32.856 1.00 38.08 C ATOM 2064 CG2 VAL D 40 71.913 14.486 31.412 1.00 37.90 C ATOM 2065 H VAL D 40 69.725 15.036 34.098 1.00 0.00 H ATOM 2066 N ILE D 41 71.301 11.508 34.837 1.00 33.15 N ATOM 2067 CA ILE D 41 71.688 10.860 36.068 1.00 32.43 C ATOM 2068 C ILE D 41 73.037 10.202 35.871 1.00 30.75 C ATOM 2069 O ILE D 41 73.220 9.415 34.942 1.00 31.86 O ATOM 2070 CB ILE D 41 70.696 9.768 36.423 1.00 31.79 C ATOM 2071 CG1 ILE D 41 69.331 10.387 36.624 1.00 31.58 C ATOM 2072 CG2 ILE D 41 71.134 9.021 37.672 1.00 33.38 C ATOM 2073 CD1 ILE D 41 68.221 9.364 36.702 1.00 32.86 C ATOM 2074 H ILE D 41 71.145 10.928 33.988 1.00 0.00 H ATOM 2075 N ILE D 42 73.959 10.492 36.770 1.00 30.76 N ATOM 2076 CA ILE D 42 75.210 9.783 36.810 1.00 34.30 C ATOM 2077 C ILE D 42 75.166 8.743 37.907 1.00 30.39 C ATOM 2078 O ILE D 42 74.841 9.040 39.036 1.00 33.79 O ATOM 2079 CB ILE D 42 76.370 10.749 37.055 1.00 38.72 C ATOM 2080 CG1 ILE D 42 76.428 11.710 35.888 1.00 44.81 C ATOM 2081 CG2 ILE D 42 77.689 9.995 37.162 1.00 37.71 C ATOM 2082 CD1 ILE D 42 77.432 12.806 36.097 1.00 54.04 C ATOM 2083 H ILE D 42 73.778 11.247 37.462 1.00 0.00 H ATOM 2084 N THR D 43 75.574 7.536 37.566 1.00 29.33 N ATOM 2085 CA THR D 43 75.670 6.461 38.524 1.00 27.81 C ATOM 2086 C THR D 43 77.109 5.959 38.515 1.00 26.01 C ATOM 2087 O THR D 43 77.597 5.408 37.517 1.00 21.52 O ATOM 2088 CB THR D 43 74.708 5.335 38.138 1.00 28.09 C ATOM 2089 OG1 THR D 43 73.385 5.854 38.119 1.00 33.78 O ATOM 2090 CG2 THR D 43 74.773 4.214 39.121 1.00 27.78 C ATOM 2091 HG1 THR D 43 72.753 5.134 37.870 1.00 0.00 H ATOM 2092 H THR D 43 75.835 7.353 36.576 1.00 0.00 H ATOM 2093 N GLU D 44 77.797 6.150 39.634 1.00 27.18 N ATOM 2094 CA GLU D 44 79.186 5.691 39.759 1.00 27.26 C ATOM 2095 C GLU D 44 79.237 4.212 40.137 1.00 27.19 C ATOM 2096 O GLU D 44 78.523 3.778 41.013 1.00 25.01 O ATOM 2097 CB GLU D 44 79.905 6.510 40.810 1.00 29.53 C ATOM 2098 CG GLU D 44 80.431 7.841 40.313 1.00 31.51 C ATOM 2099 CD GLU D 44 81.388 8.488 41.280 1.00 32.31 C ATOM 2100 OE1 GLU D 44 81.215 8.326 42.527 1.00 32.14 O ATOM 2101 OE2 GLU D 44 82.376 9.089 40.794 1.00 33.70 O ATOM 2102 H GLU D 44 77.344 6.633 40.436 1.00 0.00 H ATOM 2103 N MET D 45 80.073 3.449 39.460 1.00 29.21 N ATOM 2104 CA MET D 45 80.293 2.070 39.846 1.00 29.69 C ATOM 2105 C MET D 45 81.619 1.897 40.558 1.00 28.70 C ATOM 2106 O MET D 45 82.641 2.417 40.112 1.00 29.44 O ATOM 2107 CB MET D 45 80.318 1.150 38.623 1.00 29.44 C ATOM 2108 CG MET D 45 79.178 1.312 37.646 1.00 31.75 C ATOM 2109 SD MET D 45 79.376 0.198 36.249 1.00 33.31 S ATOM 2110 CE MET D 45 80.304 1.197 35.075 1.00 30.32 C ATOM 2111 H MET D 45 80.579 3.841 38.641 1.00 0.00 H ATOM 2112 N ALA D 46 81.602 1.116 41.630 1.00 30.21 N ATOM 2113 CA ALA D 46 82.840 0.668 42.261 1.00 31.66 C ATOM 2114 C ALA D 46 83.583 -0.250 41.313 1.00 32.67 C ATOM 2115 O ALA D 46 82.973 -0.971 40.540 1.00 33.15 O ATOM 2116 CB ALA D 46 82.541 -0.039 43.568 1.00 31.52 C ATOM 2117 H ALA D 46 80.689 0.817 42.029 1.00 0.00 H ATOM 2118 N LYS D 47 84.900 -0.272 41.417 1.00 40.40 N ATOM 2119 CA LYS D 47 85.728 -1.029 40.462 1.00 47.78 C ATOM 2120 C LYS D 47 85.521 -2.538 40.640 1.00 41.81 C ATOM 2121 O LYS D 47 85.609 -3.303 39.657 1.00 42.03 O ATOM 2122 CB LYS D 47 87.219 -0.648 40.576 1.00 56.94 C ATOM 2123 CG LYS D 47 87.429 0.815 40.944 1.00 72.86 C ATOM 2124 CD LYS D 47 88.667 1.438 40.324 1.00 84.78 C ATOM 2125 CE LYS D 47 88.703 2.904 40.729 1.00 91.27 C ATOM 2126 NZ LYS D 47 89.918 3.633 40.292 1.00102.99 N ATOM 2127 HZ1 LYS D 47 90.759 3.183 40.707 1.00 0.00 H ATOM 2128 HZ2 LYS D 47 89.984 3.603 39.255 1.00 0.00 H ATOM 2129 HZ3 LYS D 47 89.860 4.622 40.609 1.00 0.00 H ATOM 2130 H LYS D 47 85.360 0.254 42.187 1.00 0.00 H ATOM 2131 N GLY D 48 85.207 -2.949 41.872 1.00 33.41 N ATOM 2132 CA GLY D 48 84.860 -4.335 42.158 1.00 32.58 C ATOM 2133 C GLY D 48 83.431 -4.750 41.786 1.00 32.59 C ATOM 2134 O GLY D 48 83.043 -5.881 42.044 1.00 27.95 O ATOM 2135 H GLY D 48 85.210 -2.259 42.650 1.00 0.00 H ATOM 2136 N HIS D 49 82.668 -3.838 41.183 1.00 31.50 N ATOM 2137 CA HIS D 49 81.300 -4.105 40.816 1.00 32.39 C ATOM 2138 C HIS D 49 81.052 -4.131 39.314 1.00 34.24 C ATOM 2139 O HIS D 49 79.899 -4.257 38.886 1.00 31.36 O ATOM 2140 CB HIS D 49 80.378 -3.046 41.434 1.00 31.34 C ATOM 2141 CG HIS D 49 80.216 -3.194 42.914 1.00 29.66 C ATOM 2142 ND1 HIS D 49 79.565 -2.264 43.691 1.00 28.84 N ATOM 2143 CD2 HIS D 49 80.611 -4.177 43.756 1.00 28.03 C ATOM 2144 CE1 HIS D 49 79.568 -2.662 44.948 1.00 27.33 C ATOM 2145 NE2 HIS D 49 80.192 -3.821 45.013 1.00 26.60 N ATOM 2146 H HIS D 49 83.073 -2.904 40.971 1.00 0.00 H ATOM 2147 N PHE D 50 82.107 -4.003 38.521 1.00 33.56 N ATOM 2148 CA PHE D 50 81.966 -3.951 37.070 1.00 35.05 C ATOM 2149 C PHE D 50 82.832 -5.006 36.399 1.00 34.57 C ATOM 2150 O PHE D 50 84.022 -5.047 36.621 1.00 33.74 O ATOM 2151 CB PHE D 50 82.386 -2.594 36.567 1.00 36.32 C ATOM 2152 CG PHE D 50 82.199 -2.414 35.103 1.00 38.66 C ATOM 2153 CD1 PHE D 50 80.954 -2.630 34.521 1.00 38.36 C ATOM 2154 CD2 PHE D 50 83.241 -1.996 34.308 1.00 39.71 C ATOM 2155 CE1 PHE D 50 80.777 -2.453 33.161 1.00 40.44 C ATOM 2156 CE2 PHE D 50 83.066 -1.805 32.944 1.00 44.57 C ATOM 2157 CZ PHE D 50 81.831 -2.038 32.364 1.00 42.04 C ATOM 2158 H PHE D 50 83.055 -3.938 38.943 1.00 0.00 H ATOM 2159 N GLY D 51 82.189 -5.875 35.630 1.00 35.27 N ATOM 2160 CA GLY D 51 82.832 -6.990 35.003 1.00 36.78 C ATOM 2161 C GLY D 51 82.890 -6.851 33.497 1.00 38.03 C ATOM 2162 O GLY D 51 81.945 -6.387 32.875 1.00 38.99 O ATOM 2163 H GLY D 51 81.169 -5.740 35.475 1.00 0.00 H ATOM 2164 N ILE D 52 84.024 -7.253 32.918 1.00 38.09 N ATOM 2165 CA ILE D 52 84.158 -7.409 31.478 1.00 37.20 C ATOM 2166 C ILE D 52 84.736 -8.780 31.232 1.00 35.15 C ATOM 2167 O ILE D 52 85.725 -9.165 31.829 1.00 35.00 O ATOM 2168 CB ILE D 52 85.101 -6.381 30.864 1.00 41.37 C ATOM 2169 CG1 ILE D 52 84.679 -4.956 31.274 1.00 48.31 C ATOM 2170 CG2 ILE D 52 85.084 -6.518 29.353 1.00 42.94 C ATOM 2171 CD1 ILE D 52 85.709 -3.887 30.947 1.00 48.69 C ATOM 2172 H ILE D 52 84.845 -7.463 33.521 1.00 0.00 H ATOM 2173 N GLY D 53 84.104 -9.534 30.358 1.00 36.15 N ATOM 2174 CA GLY D 53 84.506 -10.911 30.132 1.00 38.65 C ATOM 2175 C GLY D 53 84.589 -11.755 31.391 1.00 37.58 C ATOM 2176 O GLY D 53 85.386 -12.674 31.453 1.00 41.97 O ATOM 2177 H GLY D 53 83.306 -9.138 29.822 1.00 0.00 H ATOM 2178 N GLY D 54 83.770 -11.446 32.384 1.00 37.79 N ATOM 2179 CA GLY D 54 83.730 -12.219 33.627 1.00 40.58 C ATOM 2180 C GLY D 54 84.784 -11.844 34.661 1.00 44.30 C ATOM 2181 O GLY D 54 84.879 -12.505 35.706 1.00 37.16 O ATOM 2182 H GLY D 54 83.135 -10.629 32.278 1.00 0.00 H ATOM 2183 N GLU D 55 85.570 -10.806 34.364 1.00 44.69 N ATOM 2184 CA GLU D 55 86.690 -10.392 35.197 1.00 55.67 C ATOM 2185 C GLU D 55 86.553 -8.942 35.555 1.00 52.30 C ATOM 2186 O GLU D 55 86.058 -8.156 34.769 1.00 42.15 O ATOM 2187 CB GLU D 55 88.016 -10.580 34.456 1.00 69.30 C ATOM 2188 CG GLU D 55 88.285 -12.019 34.078 1.00 78.77 C ATOM 2189 CD GLU D 55 88.533 -12.934 35.271 1.00 88.48 C ATOM 2190 OE1 GLU D 55 89.366 -12.615 36.139 1.00 98.77 O ATOM 2191 OE2 GLU D 55 87.865 -13.976 35.369 1.00 84.95 O ATOM 2192 H GLU D 55 85.373 -10.268 33.496 1.00 0.00 H ATOM 2193 N LEU D 56 86.993 -8.588 36.752 1.00 54.50 N ATOM 2194 CA LEU D 56 86.778 -7.232 37.238 1.00 57.04 C ATOM 2195 C LEU D 56 87.511 -6.222 36.366 1.00 56.31 C ATOM 2196 O LEU D 56 88.498 -6.564 35.741 1.00 54.74 O ATOM 2197 CB LEU D 56 87.242 -7.095 38.683 1.00 56.88 C ATOM 2198 CG LEU D 56 86.611 -8.020 39.729 1.00 60.62 C ATOM 2199 CD1 LEU D 56 87.185 -7.804 41.126 1.00 68.20 C ATOM 2200 CD2 LEU D 56 85.114 -7.814 39.781 1.00 62.64 C ATOM 2201 H LEU D 56 87.493 -9.279 37.347 1.00 0.00 H ATOM 2202 N ALA D 57 87.026 -4.986 36.322 1.00 59.21 N ATOM 2203 CA ALA D 57 87.733 -3.917 35.621 1.00 67.76 C ATOM 2204 C ALA D 57 88.889 -3.398 36.477 1.00 74.72 C ATOM 2205 O ALA D 57 89.799 -2.738 35.969 1.00 84.79 O ATOM 2206 CB ALA D 57 86.794 -2.787 35.306 1.00 65.58 C ATOM 2207 H ALA D 57 86.125 -4.775 36.796 1.00 0.00 H ATOM 2208 N SER D 58 88.850 -3.722 37.770 1.00 74.58 N ATOM 2209 CA SER D 58 89.941 -3.439 38.708 1.00 75.15 C ATOM 2210 C SER D 58 91.161 -4.407 38.595 1.00 87.79 C ATOM 2211 O SER D 58 91.990 -4.468 39.488 1.00 83.29 O ATOM 2212 CB SER D 58 89.390 -3.371 40.150 1.00 65.65 C ATOM 2213 OG SER D 58 89.215 -4.635 40.757 1.00 52.83 O ATOM 2214 HG SER D 58 90.086 -5.104 40.798 1.00 0.00 H ATOM 2215 H SER D 58 88.001 -4.201 38.132 1.00 0.00 H ATOM 2216 N LYS D 59 91.220 -5.204 37.529 1.00 97.87 N ATOM 2217 CA LYS D 59 92.491 -5.833 37.079 1.00100.06 C ATOM 2218 C LYS D 59 92.489 -6.090 35.533 1.00113.00 C ATOM 2219 O LYS D 59 92.857 -7.163 35.016 1.00121.72 O ATOM 2220 CB LYS D 59 92.865 -7.060 37.931 1.00 95.67 C ATOM 2221 CG LYS D 59 91.632 -7.708 38.495 1.00 89.15 C ATOM 2222 CD LYS D 59 91.943 -8.910 39.350 1.00 88.28 C ATOM 2223 CE LYS D 59 90.757 -9.285 40.214 1.00 86.02 C ATOM 2224 NZ LYS D 59 91.137 -10.084 41.412 1.00 84.00 N ATOM 2225 HZ1 LYS D 59 91.597 -10.966 41.108 1.00 0.00 H ATOM 2226 HZ2 LYS D 59 91.795 -9.533 42.000 1.00 0.00 H ATOM 2227 HZ3 LYS D 59 90.284 -10.309 41.962 1.00 0.00 H ATOM 2228 H LYS D 59 90.349 -5.393 36.994 1.00 0.00 H ATOM 2229 N VAL D 60 92.002 -5.083 34.814 1.00119.09 N ATOM 2230 CA VAL D 60 92.141 -4.962 33.346 1.00127.83 C ATOM 2231 C VAL D 60 92.485 -3.512 32.964 1.00113.69 C ATOM 2232 O VAL D 60 93.445 -2.932 33.464 1.00 98.97 O ATOM 2233 CB VAL D 60 90.832 -5.338 32.556 1.00133.70 C ATOM 2234 CG1 VAL D 60 91.095 -5.302 31.054 1.00133.28 C ATOM 2235 CG2 VAL D 60 90.208 -6.684 32.955 1.00126.47 C ATOM 2236 H VAL D 60 91.489 -4.331 35.317 1.00 0.00 H TER 2237 VAL D 60 ATOM 2238 N PRO E 1 67.285 -10.603 44.857 1.00 38.61 N ATOM 2239 CA PRO E 1 68.171 -10.387 43.701 1.00 35.12 C ATOM 2240 C PRO E 1 67.458 -10.327 42.363 1.00 34.90 C ATOM 2241 O PRO E 1 66.754 -11.256 41.991 1.00 37.03 O ATOM 2242 CB PRO E 1 69.118 -11.594 43.740 1.00 33.60 C ATOM 2243 CG PRO E 1 68.624 -12.480 44.814 1.00 34.66 C ATOM 2244 CD PRO E 1 67.258 -12.020 45.235 1.00 37.95 C ATOM 2245 HN2 PRO E 1 66.322 -10.297 44.611 1.00 0.00 H ATOM 2246 HN1 PRO E 1 67.631 -10.042 45.661 1.00 0.00 H ATOM 2247 N ILE E 2 67.660 -9.219 41.652 1.00 34.98 N ATOM 2248 CA ILE E 2 66.940 -8.906 40.464 1.00 37.03 C ATOM 2249 C ILE E 2 67.934 -8.539 39.370 1.00 38.93 C ATOM 2250 O ILE E 2 68.628 -7.570 39.495 1.00 39.23 O ATOM 2251 CB ILE E 2 66.026 -7.698 40.706 1.00 38.18 C ATOM 2252 CG1 ILE E 2 64.988 -8.038 41.773 1.00 41.09 C ATOM 2253 CG2 ILE E 2 65.331 -7.293 39.408 1.00 41.80 C ATOM 2254 CD1 ILE E 2 64.123 -6.874 42.204 1.00 41.99 C ATOM 2255 H ILE E 2 68.382 -8.547 41.982 1.00 0.00 H ATOM 2256 N ALA E 3 67.916 -9.267 38.262 1.00 37.23 N ATOM 2257 CA ALA E 3 68.820 -9.003 37.176 1.00 35.86 C ATOM 2258 C ALA E 3 68.091 -8.540 35.928 1.00 37.74 C ATOM 2259 O ALA E 3 67.072 -9.121 35.553 1.00 40.00 O ATOM 2260 CB ALA E 3 69.580 -10.265 36.868 1.00 38.66 C ATOM 2261 H ALA E 3 67.233 -10.046 38.177 1.00 0.00 H ATOM 2262 N GLN E 4 68.605 -7.495 35.291 1.00 37.03 N ATOM 2263 CA GLN E 4 68.086 -7.034 34.006 1.00 38.62 C ATOM 2264 C GLN E 4 69.190 -7.161 32.968 1.00 38.14 C ATOM 2265 O GLN E 4 70.293 -6.710 33.202 1.00 37.42 O ATOM 2266 CB GLN E 4 67.611 -5.590 34.063 1.00 38.41 C ATOM 2267 CG GLN E 4 67.109 -5.073 32.711 1.00 39.17 C ATOM 2268 CD GLN E 4 66.543 -3.655 32.777 1.00 39.34 C ATOM 2269 OE1 GLN E 4 66.643 -2.983 33.804 1.00 43.65 O ATOM 2270 NE2 GLN E 4 65.888 -3.221 31.703 1.00 42.21 N ATOM 2271 HE22 GLN E 4 65.826 -3.819 30.855 1.00 0.00 H ATOM 2272 HE21 GLN E 4 65.438 -2.284 31.712 1.00 0.00 H ATOM 2273 H GLN E 4 69.404 -6.987 35.721 1.00 0.00 H ATOM 2274 N ILE E 5 68.888 -7.815 31.855 1.00 36.10 N ATOM 2275 CA ILE E 5 69.881 -8.102 30.851 1.00 32.48 C ATOM 2276 C ILE E 5 69.474 -7.498 29.536 1.00 34.17 C ATOM 2277 O ILE E 5 68.424 -7.840 29.001 1.00 36.48 O ATOM 2278 CB ILE E 5 70.059 -9.609 30.688 1.00 32.93 C ATOM 2279 CG1 ILE E 5 70.185 -10.278 32.071 1.00 34.19 C ATOM 2280 CG2 ILE E 5 71.301 -9.898 29.869 1.00 32.57 C ATOM 2281 CD1 ILE E 5 70.392 -11.782 32.041 1.00 34.39 C ATOM 2282 H ILE E 5 67.908 -8.129 31.702 1.00 0.00 H ATOM 2283 N HIS E 6 70.279 -6.561 29.032 1.00 35.23 N ATOM 2284 CA HIS E 6 70.008 -5.970 27.733 1.00 32.87 C ATOM 2285 C HIS E 6 70.752 -6.747 26.687 1.00 34.01 C ATOM 2286 O HIS E 6 71.963 -6.931 26.792 1.00 38.75 O ATOM 2287 CB HIS E 6 70.434 -4.518 27.613 1.00 31.92 C ATOM 2288 CG HIS E 6 69.585 -3.566 28.368 1.00 31.46 C ATOM 2289 ND1 HIS E 6 69.707 -3.415 29.732 1.00 34.89 N ATOM 2290 CD2 HIS E 6 68.625 -2.692 27.972 1.00 31.36 C ATOM 2291 CE1 HIS E 6 68.853 -2.498 30.153 1.00 34.63 C ATOM 2292 NE2 HIS E 6 68.184 -2.044 29.107 1.00 34.69 N ATOM 2293 H HIS E 6 71.110 -6.250 29.575 1.00 0.00 H ATOM 2294 N ILE E 7 70.028 -7.245 25.698 1.00 37.03 N ATOM 2295 CA ILE E 7 70.628 -8.001 24.604 1.00 39.25 C ATOM 2296 C ILE E 7 70.090 -7.553 23.258 1.00 39.65 C ATOM 2297 O ILE E 7 69.006 -6.998 23.175 1.00 35.48 O ATOM 2298 CB ILE E 7 70.361 -9.501 24.737 1.00 41.14 C ATOM 2299 CG1 ILE E 7 68.883 -9.802 24.509 1.00 40.55 C ATOM 2300 CG2 ILE E 7 70.829 -9.993 26.102 1.00 43.32 C ATOM 2301 CD1 ILE E 7 68.512 -11.257 24.703 1.00 40.06 C ATOM 2302 H ILE E 7 68.999 -7.093 25.701 1.00 0.00 H ATOM 2303 N LEU E 8 70.879 -7.762 22.211 1.00 46.97 N ATOM 2304 CA LEU E 8 70.414 -7.459 20.869 1.00 51.09 C ATOM 2305 C LEU E 8 69.292 -8.380 20.490 1.00 53.28 C ATOM 2306 O LEU E 8 69.296 -9.559 20.850 1.00 46.20 O ATOM 2307 CB LEU E 8 71.526 -7.596 19.856 1.00 49.84 C ATOM 2308 CG LEU E 8 72.443 -6.383 19.859 1.00 50.92 C ATOM 2309 CD1 LEU E 8 73.680 -6.686 19.023 1.00 56.21 C ATOM 2310 CD2 LEU E 8 71.717 -5.157 19.336 1.00 50.86 C ATOM 2311 H LEU E 8 71.836 -8.145 22.353 1.00 0.00 H ATOM 2312 N GLU E 9 68.297 -7.819 19.812 1.00 59.87 N ATOM 2313 CA GLU E 9 67.184 -8.623 19.320 1.00 70.40 C ATOM 2314 C GLU E 9 67.727 -9.643 18.322 1.00 70.40 C ATOM 2315 O GLU E 9 68.776 -9.436 17.714 1.00 63.35 O ATOM 2316 CB GLU E 9 66.115 -7.734 18.666 1.00 73.45 C ATOM 2317 CG GLU E 9 66.531 -7.185 17.306 1.00 75.56 C ATOM 2318 CD GLU E 9 65.554 -6.170 16.727 1.00 82.92 C ATOM 2319 OE1 GLU E 9 64.422 -6.026 17.262 1.00 87.21 O ATOM 2320 OE2 GLU E 9 65.938 -5.509 15.732 1.00 83.83 O ATOM 2321 H GLU E 9 68.312 -6.795 19.630 1.00 0.00 H ATOM 2322 N GLY E 10 67.006 -10.740 18.157 1.00 72.28 N ATOM 2323 CA GLY E 10 67.347 -11.711 17.132 1.00 73.57 C ATOM 2324 C GLY E 10 67.492 -13.147 17.589 1.00 75.84 C ATOM 2325 O GLY E 10 67.565 -14.038 16.752 1.00 94.15 O ATOM 2326 H GLY E 10 66.183 -10.910 18.770 1.00 0.00 H ATOM 2327 N ARG E 11 67.414 -13.391 18.892 1.00 65.02 N ATOM 2328 CA ARG E 11 67.583 -14.724 19.442 1.00 58.32 C ATOM 2329 C ARG E 11 66.254 -15.452 19.587 1.00 55.30 C ATOM 2330 O ARG E 11 65.174 -14.843 19.525 1.00 59.66 O ATOM 2331 CB ARG E 11 68.249 -14.624 20.799 1.00 61.82 C ATOM 2332 CG ARG E 11 69.511 -13.798 20.761 1.00 65.77 C ATOM 2333 CD ARG E 11 70.727 -14.467 21.329 1.00 71.29 C ATOM 2334 NE ARG E 11 71.923 -13.641 21.111 1.00 81.11 N ATOM 2335 CZ ARG E 11 72.883 -14.021 20.281 1.00 82.14 C ATOM 2336 NH1 ARG E 11 72.718 -15.135 19.588 1.00 74.50 N ATOM 2337 NH2 ARG E 11 73.978 -13.292 20.145 1.00 83.59 N ATOM 2338 HE ARG E 11 72.018 -12.739 21.619 1.00 0.00 H ATOM 2339 HH12 ARG E 11 73.458 -15.453 18.930 1.00 0.00 H ATOM 2340 HH11 ARG E 11 71.848 -15.693 19.701 1.00 0.00 H ATOM 2341 HH22 ARG E 11 74.728 -13.596 19.492 1.00 0.00 H ATOM 2342 HH21 ARG E 11 74.090 -12.414 20.692 1.00 0.00 H ATOM 2343 H ARG E 11 67.225 -12.600 19.541 1.00 0.00 H ATOM 2344 N SER E 12 66.328 -16.770 19.726 1.00 54.92 N ATOM 2345 CA SER E 12 65.137 -17.602 19.760 1.00 54.37 C ATOM 2346 C SER E 12 64.581 -17.638 21.143 1.00 53.78 C ATOM 2347 O SER E 12 65.269 -17.342 22.099 1.00 49.66 O ATOM 2348 CB SER E 12 65.469 -19.027 19.362 1.00 55.44 C ATOM 2349 OG SER E 12 66.328 -19.601 20.318 1.00 47.69 O ATOM 2350 HG SER E 12 65.882 -19.603 21.202 1.00 0.00 H ATOM 2351 H SER E 12 67.262 -17.219 19.813 1.00 0.00 H ATOM 2352 N ASP E 13 63.307 -17.989 21.246 1.00 57.94 N ATOM 2353 CA ASP E 13 62.679 -18.121 22.543 1.00 63.22 C ATOM 2354 C ASP E 13 63.418 -19.124 23.422 1.00 60.32 C ATOM 2355 O ASP E 13 63.427 -18.977 24.644 1.00 57.49 O ATOM 2356 CB ASP E 13 61.197 -18.502 22.380 1.00 64.23 C ATOM 2357 CG ASP E 13 60.330 -17.325 21.927 1.00 69.37 C ATOM 2358 OD1 ASP E 13 60.879 -16.222 21.686 1.00 67.61 O ATOM 2359 OD2 ASP E 13 59.086 -17.491 21.879 1.00 76.27 O ATOM 2360 H ASP E 13 62.753 -18.172 20.385 1.00 0.00 H ATOM 2361 N GLU E 14 63.999 -20.154 22.815 1.00 63.36 N ATOM 2362 CA GLU E 14 64.637 -21.247 23.580 1.00 72.53 C ATOM 2363 C GLU E 14 65.927 -20.747 24.195 1.00 67.96 C ATOM 2364 O GLU E 14 66.149 -20.920 25.375 1.00 61.20 O ATOM 2365 CB GLU E 14 64.956 -22.464 22.705 1.00 84.89 C ATOM 2366 CG GLU E 14 63.743 -23.220 22.168 1.00 98.50 C ATOM 2367 CD GLU E 14 63.024 -22.477 21.037 1.00110.26 C ATOM 2368 OE1 GLU E 14 63.700 -21.985 20.096 1.00104.13 O ATOM 2369 OE2 GLU E 14 61.775 -22.371 21.089 1.00122.12 O ATOM 2370 H GLU E 14 64.005 -20.192 21.776 1.00 0.00 H ATOM 2371 N GLN E 15 66.726 -20.056 23.391 1.00 62.21 N ATOM 2372 CA GLN E 15 67.936 -19.427 23.881 1.00 55.83 C ATOM 2373 C GLN E 15 67.676 -18.510 25.064 1.00 62.06 C ATOM 2374 O GLN E 15 68.443 -18.491 26.020 1.00 66.12 O ATOM 2375 CB GLN E 15 68.576 -18.589 22.797 1.00 57.16 C ATOM 2376 CG GLN E 15 69.629 -19.316 22.004 1.00 55.77 C ATOM 2377 CD GLN E 15 70.202 -18.429 20.896 1.00 58.08 C ATOM 2378 OE1 GLN E 15 69.466 -17.792 20.084 1.00 62.14 O ATOM 2379 NE2 GLN E 15 71.513 -18.371 20.865 1.00 54.03 N ATOM 2380 HE22 GLN E 15 72.074 -18.913 21.553 1.00 0.00 H ATOM 2381 HE21 GLN E 15 71.991 -17.784 20.152 1.00 0.00 H ATOM 2382 H GLN E 15 66.478 -19.964 22.385 1.00 0.00 H ATOM 2383 N LYS E 16 66.601 -17.729 24.986 1.00 57.31 N ATOM 2384 CA LYS E 16 66.246 -16.799 26.042 1.00 49.86 C ATOM 2385 C LYS E 16 65.753 -17.496 27.285 1.00 50.72 C ATOM 2386 O LYS E 16 66.092 -17.101 28.407 1.00 56.52 O ATOM 2387 CB LYS E 16 65.220 -15.811 25.537 1.00 51.61 C ATOM 2388 CG LYS E 16 65.842 -14.856 24.543 1.00 51.74 C ATOM 2389 CD LYS E 16 64.920 -13.710 24.188 1.00 52.43 C ATOM 2390 CE LYS E 16 63.842 -14.133 23.225 1.00 54.27 C ATOM 2391 NZ LYS E 16 63.464 -12.968 22.387 1.00 52.74 N ATOM 2392 HZ1 LYS E 16 63.111 -12.203 22.997 1.00 0.00 H ATOM 2393 HZ2 LYS E 16 64.297 -12.637 21.860 1.00 0.00 H ATOM 2394 HZ3 LYS E 16 62.719 -13.251 21.718 1.00 0.00 H ATOM 2395 H LYS E 16 65.996 -17.787 24.142 1.00 0.00 H ATOM 2396 N GLU E 17 65.000 -18.574 27.106 1.00 54.59 N ATOM 2397 CA GLU E 17 64.579 -19.423 28.239 1.00 52.09 C ATOM 2398 C GLU E 17 65.792 -20.010 28.950 1.00 45.57 C ATOM 2399 O GLU E 17 65.875 -20.031 30.170 1.00 45.63 O ATOM 2400 CB GLU E 17 63.703 -20.547 27.714 1.00 52.94 C ATOM 2401 CG GLU E 17 63.160 -21.454 28.800 1.00 57.57 C ATOM 2402 CD GLU E 17 62.072 -22.387 28.314 1.00 61.11 C ATOM 2403 OE1 GLU E 17 61.783 -22.411 27.094 1.00 67.13 O ATOM 2404 OE2 GLU E 17 61.462 -23.067 29.167 1.00 80.31 O ATOM 2405 H GLU E 17 64.699 -18.827 26.143 1.00 0.00 H ATOM 2406 N THR E 18 66.771 -20.416 28.160 1.00 44.01 N ATOM 2407 CA THR E 18 68.007 -20.935 28.695 1.00 48.31 C ATOM 2408 C THR E 18 68.759 -19.839 29.467 1.00 41.97 C ATOM 2409 O THR E 18 69.253 -20.083 30.567 1.00 39.31 O ATOM 2410 CB THR E 18 68.882 -21.510 27.542 1.00 51.74 C ATOM 2411 OG1 THR E 18 68.187 -22.606 26.940 1.00 56.92 O ATOM 2412 CG2 THR E 18 70.254 -21.995 28.021 1.00 48.83 C ATOM 2413 HG1 THR E 18 67.322 -22.288 26.579 1.00 0.00 H ATOM 2414 H THR E 18 66.648 -20.360 27.129 1.00 0.00 H ATOM 2415 N LEU E 19 68.880 -18.666 28.854 1.00 36.70 N ATOM 2416 CA LEU E 19 69.544 -17.549 29.484 1.00 37.62 C ATOM 2417 C LEU E 19 68.961 -17.309 30.857 1.00 41.80 C ATOM 2418 O LEU E 19 69.690 -17.133 31.829 1.00 41.00 O ATOM 2419 CB LEU E 19 69.361 -16.310 28.636 1.00 39.22 C ATOM 2420 CG LEU E 19 69.924 -14.996 29.177 1.00 39.50 C ATOM 2421 CD1 LEU E 19 71.436 -15.087 29.262 1.00 41.43 C ATOM 2422 CD2 LEU E 19 69.532 -13.849 28.256 1.00 40.92 C ATOM 2423 H LEU E 19 68.487 -18.550 27.898 1.00 0.00 H ATOM 2424 N ILE E 20 67.633 -17.273 30.931 1.00 41.51 N ATOM 2425 CA ILE E 20 66.971 -16.983 32.185 1.00 41.97 C ATOM 2426 C ILE E 20 67.327 -18.023 33.228 1.00 42.51 C ATOM 2427 O ILE E 20 67.681 -17.676 34.354 1.00 40.41 O ATOM 2428 CB ILE E 20 65.456 -16.875 32.011 1.00 43.15 C ATOM 2429 CG1 ILE E 20 65.133 -15.542 31.357 1.00 49.06 C ATOM 2430 CG2 ILE E 20 64.739 -16.992 33.344 1.00 41.56 C ATOM 2431 CD1 ILE E 20 63.671 -15.344 30.993 1.00 54.51 C ATOM 2432 H ILE E 20 67.065 -17.455 30.079 1.00 0.00 H ATOM 2433 N ARG E 21 67.273 -19.286 32.837 1.00 43.57 N ATOM 2434 CA ARG E 21 67.533 -20.355 33.776 1.00 45.89 C ATOM 2435 C ARG E 21 68.987 -20.321 34.255 1.00 43.21 C ATOM 2436 O ARG E 21 69.242 -20.313 35.457 1.00 43.34 O ATOM 2437 CB ARG E 21 67.233 -21.708 33.142 1.00 48.37 C ATOM 2438 CG ARG E 21 67.288 -22.886 34.121 1.00 53.09 C ATOM 2439 CD ARG E 21 66.828 -24.238 33.507 1.00 58.17 C ATOM 2440 NE ARG E 21 66.553 -24.187 32.065 1.00 65.32 N ATOM 2441 CZ ARG E 21 67.406 -24.442 31.077 1.00 63.16 C ATOM 2442 NH1 ARG E 21 68.668 -24.736 31.307 1.00 61.57 N ATOM 2443 NH2 ARG E 21 66.962 -24.359 29.824 1.00 67.42 N ATOM 2444 HE ARG E 21 65.586 -23.923 31.786 1.00 0.00 H ATOM 2445 HH12 ARG E 21 69.310 -24.930 30.512 1.00 0.00 H ATOM 2446 HH11 ARG E 21 69.023 -24.774 32.284 1.00 0.00 H ATOM 2447 HH22 ARG E 21 67.606 -24.553 29.030 1.00 0.00 H ATOM 2448 HH21 ARG E 21 65.972 -24.100 29.639 1.00 0.00 H ATOM 2449 H ARG E 21 67.042 -19.511 31.848 1.00 0.00 H ATOM 2450 N GLU E 22 69.922 -20.293 33.311 1.00 40.13 N ATOM 2451 CA GLU E 22 71.347 -20.395 33.626 1.00 44.99 C ATOM 2452 C GLU E 22 71.835 -19.224 34.492 1.00 39.25 C ATOM 2453 O GLU E 22 72.611 -19.410 35.419 1.00 35.55 O ATOM 2454 CB GLU E 22 72.175 -20.490 32.339 1.00 50.06 C ATOM 2455 CG GLU E 22 71.822 -21.719 31.464 1.00 59.57 C ATOM 2456 CD GLU E 22 72.843 -22.848 31.476 1.00 63.74 C ATOM 2457 OE1 GLU E 22 73.285 -23.559 30.423 1.00 68.77 O ATOM 2458 OE2 GLU E 22 73.154 -22.955 32.671 1.00 63.21 O ATOM 2459 H GLU E 22 69.632 -20.196 32.317 1.00 0.00 H ATOM 2460 N VAL E 23 71.353 -18.031 34.181 1.00 36.50 N ATOM 2461 CA VAL E 23 71.694 -16.871 34.947 1.00 33.46 C ATOM 2462 C VAL E 23 71.069 -16.970 36.328 1.00 35.82 C ATOM 2463 O VAL E 23 71.722 -16.684 37.327 1.00 36.23 O ATOM 2464 CB VAL E 23 71.251 -15.579 34.238 1.00 31.81 C ATOM 2465 CG1 VAL E 23 71.328 -14.389 35.178 1.00 31.55 C ATOM 2466 CG2 VAL E 23 72.114 -15.319 33.017 1.00 33.05 C ATOM 2467 H VAL E 23 70.715 -17.935 33.365 1.00 0.00 H ATOM 2468 N SER E 24 69.800 -17.355 36.397 1.00 36.21 N ATOM 2469 CA SER E 24 69.119 -17.462 37.700 1.00 36.69 C ATOM 2470 C SER E 24 69.872 -18.433 38.611 1.00 38.46 C ATOM 2471 O SER E 24 70.100 -18.158 39.776 1.00 32.69 O ATOM 2472 CB SER E 24 67.670 -17.909 37.508 1.00 38.06 C ATOM 2473 OG SER E 24 66.857 -16.866 36.986 1.00 39.03 O ATOM 2474 HG SER E 24 65.930 -17.195 36.877 1.00 0.00 H ATOM 2475 H SER E 24 69.282 -17.583 35.524 1.00 0.00 H ATOM 2476 N GLU E 25 70.329 -19.534 38.022 1.00 43.55 N ATOM 2477 CA GLU E 25 71.088 -20.541 38.740 1.00 48.68 C ATOM 2478 C GLU E 25 72.413 -19.967 39.220 1.00 46.22 C ATOM 2479 O GLU E 25 72.754 -20.080 40.395 1.00 42.15 O ATOM 2480 CB GLU E 25 71.288 -21.795 37.858 1.00 57.04 C ATOM 2481 CG GLU E 25 70.207 -22.843 38.088 1.00 66.90 C ATOM 2482 CD GLU E 25 70.088 -23.872 36.943 1.00 76.58 C ATOM 2483 OE1 GLU E 25 70.851 -23.635 36.020 1.00 90.99 O ATOM 2484 OE2 GLU E 25 69.274 -24.863 36.882 1.00 83.33 O ATOM 2485 H GLU E 25 70.136 -19.679 37.010 1.00 0.00 H ATOM 2486 N ALA E 26 73.141 -19.311 38.318 1.00 42.98 N ATOM 2487 CA ALA E 26 74.425 -18.717 38.669 1.00 41.07 C ATOM 2488 C ALA E 26 74.315 -17.719 39.819 1.00 37.21 C ATOM 2489 O ALA E 26 75.193 -17.653 40.688 1.00 38.28 O ATOM 2490 CB ALA E 26 75.056 -18.052 37.458 1.00 40.09 C ATOM 2491 H ALA E 26 72.786 -19.221 37.344 1.00 0.00 H ATOM 2492 N ILE E 27 73.231 -16.967 39.837 1.00 33.07 N ATOM 2493 CA ILE E 27 72.989 -16.030 40.922 1.00 33.64 C ATOM 2494 C ILE E 27 72.757 -16.767 42.227 1.00 34.69 C ATOM 2495 O ILE E 27 73.401 -16.483 43.237 1.00 37.53 O ATOM 2496 CB ILE E 27 71.793 -15.101 40.594 1.00 32.37 C ATOM 2497 CG1 ILE E 27 72.190 -14.125 39.478 1.00 34.11 C ATOM 2498 CG2 ILE E 27 71.348 -14.317 41.818 1.00 30.41 C ATOM 2499 CD1 ILE E 27 71.048 -13.342 38.864 1.00 33.08 C ATOM 2500 H ILE E 27 72.540 -17.046 39.064 1.00 0.00 H ATOM 2501 N SER E 28 71.851 -17.732 42.201 1.00 37.56 N ATOM 2502 CA SER E 28 71.548 -18.523 43.390 1.00 40.22 C ATOM 2503 C SER E 28 72.804 -19.197 43.964 1.00 38.33 C ATOM 2504 O SER E 28 73.028 -19.172 45.180 1.00 36.08 O ATOM 2505 CB SER E 28 70.514 -19.589 43.059 1.00 43.48 C ATOM 2506 OG SER E 28 70.066 -20.232 44.225 1.00 44.53 O ATOM 2507 HG SER E 28 69.654 -19.566 44.831 1.00 0.00 H ATOM 2508 H SER E 28 71.344 -17.931 41.315 1.00 0.00 H ATOM 2509 N ARG E 29 73.594 -19.807 43.088 1.00 36.66 N ATOM 2510 CA ARG E 29 74.822 -20.481 43.496 1.00 42.90 C ATOM 2511 C ARG E 29 75.764 -19.486 44.144 1.00 45.98 C ATOM 2512 O ARG E 29 76.193 -19.666 45.269 1.00 42.14 O ATOM 2513 CB ARG E 29 75.556 -21.103 42.299 1.00 47.90 C ATOM 2514 CG ARG E 29 76.016 -22.541 42.484 1.00 53.57 C ATOM 2515 CD ARG E 29 76.151 -23.341 41.181 1.00 56.36 C ATOM 2516 NE ARG E 29 76.640 -22.497 40.085 1.00 55.45 N ATOM 2517 CZ ARG E 29 76.037 -22.297 38.903 1.00 57.35 C ATOM 2518 NH1 ARG E 29 74.880 -22.869 38.561 1.00 62.41 N ATOM 2519 NH2 ARG E 29 76.595 -21.486 38.022 1.00 56.32 N ATOM 2520 HE ARG E 29 77.543 -22.005 40.239 1.00 0.00 H ATOM 2521 HH12 ARG E 29 74.460 -22.676 37.629 1.00 0.00 H ATOM 2522 HH11 ARG E 29 74.399 -23.507 39.226 1.00 0.00 H ATOM 2523 HH22 ARG E 29 76.137 -21.323 37.102 1.00 0.00 H ATOM 2524 HH21 ARG E 29 77.492 -21.011 38.248 1.00 0.00 H ATOM 2525 H ARG E 29 73.330 -19.804 42.082 1.00 0.00 H ATOM 2526 N SER E 30 76.061 -18.410 43.418 1.00 47.72 N ATOM 2527 CA SER E 30 77.070 -17.447 43.838 1.00 40.66 C ATOM 2528 C SER E 30 76.784 -16.785 45.167 1.00 41.06 C ATOM 2529 O SER E 30 77.709 -16.398 45.882 1.00 47.31 O ATOM 2530 CB SER E 30 77.198 -16.356 42.767 1.00 40.55 C ATOM 2531 OG SER E 30 77.797 -16.869 41.600 1.00 40.83 O ATOM 2532 HG SER E 30 77.241 -17.605 41.241 1.00 0.00 H ATOM 2533 H SER E 30 75.556 -18.252 42.522 1.00 0.00 H ATOM 2534 N LEU E 31 75.511 -16.523 45.456 1.00 41.31 N ATOM 2535 CA LEU E 31 75.136 -15.746 46.644 1.00 43.18 C ATOM 2536 C LEU E 31 74.533 -16.602 47.723 1.00 44.89 C ATOM 2537 O LEU E 31 74.000 -16.075 48.706 1.00 49.83 O ATOM 2538 CB LEU E 31 74.117 -14.665 46.281 1.00 41.05 C ATOM 2539 CG LEU E 31 74.473 -13.690 45.178 1.00 41.56 C ATOM 2540 CD1 LEU E 31 73.365 -12.664 45.045 1.00 37.99 C ATOM 2541 CD2 LEU E 31 75.812 -13.019 45.453 1.00 44.77 C ATOM 2542 H LEU E 31 74.764 -16.877 44.825 1.00 0.00 H ATOM 2543 N ASP E 32 74.524 -17.909 47.505 1.00 54.58 N ATOM 2544 CA ASP E 32 73.842 -18.815 48.410 1.00 63.53 C ATOM 2545 C ASP E 32 72.424 -18.311 48.725 1.00 60.35 C ATOM 2546 O ASP E 32 71.995 -18.312 49.867 1.00 66.60 O ATOM 2547 CB ASP E 32 74.668 -18.958 49.684 1.00 72.24 C ATOM 2548 CG ASP E 32 74.681 -20.364 50.199 1.00 89.15 C ATOM 2549 OD1 ASP E 32 73.644 -21.058 50.085 1.00100.68 O ATOM 2550 OD2 ASP E 32 75.731 -20.779 50.724 1.00105.90 O ATOM 2551 H ASP E 32 75.014 -18.292 46.671 1.00 0.00 H ATOM 2552 N ALA E 33 71.710 -17.860 47.702 1.00 57.27 N ATOM 2553 CA ALA E 33 70.354 -17.340 47.874 1.00 56.31 C ATOM 2554 C ALA E 33 69.355 -18.316 47.248 1.00 56.45 C ATOM 2555 O ALA E 33 69.696 -19.012 46.291 1.00 49.88 O ATOM 2556 CB ALA E 33 70.213 -15.985 47.205 1.00 57.97 C ATOM 2557 H ALA E 33 72.127 -17.877 46.749 1.00 0.00 H ATOM 2558 N PRO E 34 68.124 -18.361 47.782 1.00 51.28 N ATOM 2559 CA PRO E 34 67.169 -19.335 47.291 1.00 50.35 C ATOM 2560 C PRO E 34 66.762 -19.022 45.850 1.00 48.43 C ATOM 2561 O PRO E 34 66.403 -17.883 45.540 1.00 45.23 O ATOM 2562 CB PRO E 34 65.989 -19.194 48.254 1.00 52.55 C ATOM 2563 CG PRO E 34 66.185 -17.913 48.993 1.00 50.78 C ATOM 2564 CD PRO E 34 67.633 -17.589 48.941 1.00 53.48 C ATOM 2565 N LEU E 35 66.853 -20.030 44.982 1.00 47.90 N ATOM 2566 CA LEU E 35 66.544 -19.860 43.564 1.00 46.31 C ATOM 2567 C LEU E 35 65.213 -19.191 43.307 1.00 49.70 C ATOM 2568 O LEU E 35 65.099 -18.401 42.409 1.00 57.87 O ATOM 2569 CB LEU E 35 66.569 -21.204 42.856 1.00 46.76 C ATOM 2570 CG LEU E 35 66.334 -21.167 41.338 1.00 46.66 C ATOM 2571 CD1 LEU E 35 67.411 -20.365 40.628 1.00 46.92 C ATOM 2572 CD2 LEU E 35 66.277 -22.583 40.757 1.00 46.04 C ATOM 2573 H LEU E 35 67.153 -20.965 45.324 1.00 0.00 H ATOM 2574 N THR E 36 64.210 -19.474 44.125 1.00 54.16 N ATOM 2575 CA THR E 36 62.866 -18.957 43.878 1.00 50.20 C ATOM 2576 C THR E 36 62.700 -17.472 44.110 1.00 47.22 C ATOM 2577 O THR E 36 61.691 -16.895 43.715 1.00 53.25 O ATOM 2578 CB THR E 36 61.831 -19.674 44.764 1.00 52.72 C ATOM 2579 OG1 THR E 36 62.171 -19.467 46.136 1.00 49.47 O ATOM 2580 CG2 THR E 36 61.827 -21.165 44.450 1.00 53.80 C ATOM 2581 HG1 THR E 36 61.509 -19.926 46.712 1.00 0.00 H ATOM 2582 H THR E 36 64.382 -20.074 44.957 1.00 0.00 H ATOM 2583 N SER E 37 63.656 -16.842 44.785 1.00 46.37 N ATOM 2584 CA SER E 37 63.612 -15.380 44.998 1.00 43.35 C ATOM 2585 C SER E 37 64.160 -14.595 43.787 1.00 43.62 C ATOM 2586 O SER E 37 63.975 -13.369 43.686 1.00 44.15 O ATOM 2587 CB SER E 37 64.370 -15.008 46.282 1.00 40.81 C ATOM 2588 OG SER E 37 65.717 -15.464 46.240 1.00 46.29 O ATOM 2589 HG SER E 37 65.728 -16.449 46.142 1.00 0.00 H ATOM 2590 H SER E 37 64.452 -17.389 45.171 1.00 0.00 H ATOM 2591 N VAL E 38 64.874 -15.300 42.904 1.00 41.52 N ATOM 2592 CA VAL E 38 65.609 -14.653 41.827 1.00 41.05 C ATOM 2593 C VAL E 38 64.687 -14.247 40.699 1.00 38.51 C ATOM 2594 O VAL E 38 63.969 -15.067 40.164 1.00 39.81 O ATOM 2595 CB VAL E 38 66.733 -15.556 41.262 1.00 40.68 C ATOM 2596 CG1 VAL E 38 67.460 -14.854 40.119 1.00 39.88 C ATOM 2597 CG2 VAL E 38 67.744 -15.923 42.338 1.00 37.20 C ATOM 2598 H VAL E 38 64.905 -16.336 42.989 1.00 0.00 H ATOM 2599 N ARG E 39 64.774 -12.984 40.327 1.00 35.50 N ATOM 2600 CA ARG E 39 64.013 -12.452 39.238 1.00 37.45 C ATOM 2601 C ARG E 39 64.959 -12.027 38.103 1.00 36.72 C ATOM 2602 O ARG E 39 66.051 -11.499 38.338 1.00 39.17 O ATOM 2603 CB ARG E 39 63.230 -11.229 39.722 1.00 44.82 C ATOM 2604 CG ARG E 39 62.013 -11.453 40.744 1.00 47.06 C ATOM 2605 CD ARG E 39 60.734 -12.115 40.137 1.00 55.23 C ATOM 2606 NE ARG E 39 60.461 -13.240 40.994 1.00 62.75 N ATOM 2607 CZ ARG E 39 59.708 -13.109 42.067 1.00 67.51 C ATOM 2608 NH1 ARG E 39 59.174 -11.918 42.376 1.00 76.53 N ATOM 2609 NH2 ARG E 39 59.521 -14.149 42.827 1.00 63.28 N ATOM 2610 HE ARG E 39 60.865 -14.170 40.762 1.00 0.00 H ATOM 2611 HH12 ARG E 39 58.580 -11.819 43.224 1.00 0.00 H ATOM 2612 HH11 ARG E 39 59.354 -11.094 41.768 1.00 0.00 H ATOM 2613 HH22 ARG E 39 58.931 -14.071 43.680 1.00 0.00 H ATOM 2614 HH21 ARG E 39 59.962 -15.058 42.582 1.00 0.00 H ATOM 2615 H ARG E 39 65.419 -12.352 40.844 1.00 0.00 H ATOM 2616 N VAL E 40 64.567 -12.300 36.871 1.00 33.55 N ATOM 2617 CA VAL E 40 65.348 -11.910 35.729 1.00 33.85 C ATOM 2618 C VAL E 40 64.482 -11.247 34.703 1.00 34.46 C ATOM 2619 O VAL E 40 63.401 -11.746 34.344 1.00 39.17 O ATOM 2620 CB VAL E 40 66.033 -13.109 35.041 1.00 35.95 C ATOM 2621 CG1 VAL E 40 66.809 -12.641 33.817 1.00 34.96 C ATOM 2622 CG2 VAL E 40 66.977 -13.800 36.010 1.00 37.94 C ATOM 2623 H VAL E 40 63.672 -12.809 36.724 1.00 0.00 H ATOM 2624 N ILE E 41 64.969 -10.133 34.195 1.00 32.47 N ATOM 2625 CA ILE E 41 64.282 -9.400 33.144 1.00 30.91 C ATOM 2626 C ILE E 41 65.174 -9.323 31.921 1.00 32.05 C ATOM 2627 O ILE E 41 66.328 -8.941 32.037 1.00 31.32 O ATOM 2628 CB ILE E 41 64.019 -7.964 33.571 1.00 29.22 C ATOM 2629 CG1 ILE E 41 63.129 -7.964 34.805 1.00 31.00 C ATOM 2630 CG2 ILE E 41 63.386 -7.179 32.426 1.00 28.53 C ATOM 2631 CD1 ILE E 41 63.021 -6.609 35.466 1.00 31.98 C ATOM 2632 H ILE E 41 65.873 -9.767 34.557 1.00 0.00 H ATOM 2633 N ILE E 42 64.640 -9.729 30.774 1.00 32.30 N ATOM 2634 CA ILE E 42 65.346 -9.601 29.526 1.00 33.06 C ATOM 2635 C ILE E 42 64.764 -8.436 28.788 1.00 34.41 C ATOM 2636 O ILE E 42 63.555 -8.322 28.653 1.00 39.61 O ATOM 2637 CB ILE E 42 65.210 -10.859 28.687 1.00 34.46 C ATOM 2638 CG1 ILE E 42 65.867 -12.011 29.414 1.00 36.56 C ATOM 2639 CG2 ILE E 42 65.864 -10.661 27.335 1.00 35.46 C ATOM 2640 CD1 ILE E 42 65.673 -13.336 28.713 1.00 39.22 C ATOM 2641 H ILE E 42 63.689 -10.149 30.778 1.00 0.00 H ATOM 2642 N THR E 43 65.629 -7.575 28.314 1.00 36.68 N ATOM 2643 CA THR E 43 65.218 -6.412 27.562 1.00 34.77 C ATOM 2644 C THR E 43 65.934 -6.472 26.213 1.00 37.23 C ATOM 2645 O THR E 43 67.171 -6.412 26.158 1.00 35.08 O ATOM 2646 CB THR E 43 65.613 -5.141 28.298 1.00 35.02 C ATOM 2647 OG1 THR E 43 64.974 -5.109 29.564 1.00 31.63 O ATOM 2648 CG2 THR E 43 65.196 -3.914 27.508 1.00 35.86 C ATOM 2649 HG1 THR E 43 65.232 -4.281 30.042 1.00 0.00 H ATOM 2650 H THR E 43 66.643 -7.733 28.484 1.00 0.00 H ATOM 2651 N GLU E 44 65.157 -6.636 25.139 1.00 41.64 N ATOM 2652 CA GLU E 44 65.711 -6.764 23.795 1.00 40.12 C ATOM 2653 C GLU E 44 65.918 -5.392 23.227 1.00 40.26 C ATOM 2654 O GLU E 44 65.080 -4.540 23.358 1.00 40.41 O ATOM 2655 CB GLU E 44 64.795 -7.548 22.904 1.00 41.25 C ATOM 2656 CG GLU E 44 64.957 -9.033 22.997 1.00 48.92 C ATOM 2657 CD GLU E 44 64.285 -9.762 21.835 1.00 51.50 C ATOM 2658 OE1 GLU E 44 63.180 -9.329 21.419 1.00 53.23 O ATOM 2659 OE2 GLU E 44 64.838 -10.812 21.421 1.00 47.23 O ATOM 2660 H GLU E 44 64.125 -6.674 25.264 1.00 0.00 H ATOM 2661 N MET E 45 67.078 -5.151 22.648 1.00 45.13 N ATOM 2662 CA MET E 45 67.320 -3.873 21.983 1.00 42.42 C ATOM 2663 C MET E 45 67.259 -4.053 20.492 1.00 42.42 C ATOM 2664 O MET E 45 67.845 -5.015 19.946 1.00 39.81 O ATOM 2665 CB MET E 45 68.699 -3.313 22.321 1.00 42.85 C ATOM 2666 CG MET E 45 69.071 -3.259 23.796 1.00 45.26 C ATOM 2667 SD MET E 45 70.751 -2.630 23.993 1.00 43.92 S ATOM 2668 CE MET E 45 71.743 -4.142 23.975 1.00 42.43 C ATOM 2669 H MET E 45 67.825 -5.875 22.665 1.00 0.00 H ATOM 2670 N ALA E 46 66.605 -3.105 19.827 1.00 41.94 N ATOM 2671 CA ALA E 46 66.660 -3.013 18.359 1.00 45.36 C ATOM 2672 C ALA E 46 68.072 -2.650 17.937 1.00 48.14 C ATOM 2673 O ALA E 46 68.788 -1.971 18.668 1.00 48.40 O ATOM 2674 CB ALA E 46 65.676 -1.981 17.844 1.00 39.28 C ATOM 2675 H ALA E 46 66.040 -2.411 20.358 1.00 0.00 H ATOM 2676 N LYS E 47 68.478 -3.102 16.761 1.00 56.23 N ATOM 2677 CA LYS E 47 69.881 -2.937 16.328 1.00 67.84 C ATOM 2678 C LYS E 47 70.191 -1.452 16.082 1.00 56.89 C ATOM 2679 O LYS E 47 71.329 -1.007 16.269 1.00 57.27 O ATOM 2680 CB LYS E 47 70.196 -3.807 15.091 1.00 78.34 C ATOM 2681 CG LYS E 47 69.452 -5.133 15.092 1.00 92.84 C ATOM 2682 CD LYS E 47 70.223 -6.275 14.467 1.00104.30 C ATOM 2683 CE LYS E 47 69.384 -7.540 14.595 1.00112.61 C ATOM 2684 NZ LYS E 47 69.953 -8.738 13.927 1.00114.38 N ATOM 2685 HZ1 LYS E 47 70.057 -8.549 12.910 1.00 0.00 H ATOM 2686 HZ2 LYS E 47 70.884 -8.953 14.338 1.00 0.00 H ATOM 2687 HZ3 LYS E 47 69.315 -9.547 14.067 1.00 0.00 H ATOM 2688 H LYS E 47 67.800 -3.580 16.133 1.00 0.00 H ATOM 2689 N GLY E 48 69.165 -0.698 15.684 1.00 47.89 N ATOM 2690 CA GLY E 48 69.263 0.755 15.519 1.00 44.49 C ATOM 2691 C GLY E 48 69.198 1.556 16.809 1.00 46.01 C ATOM 2692 O GLY E 48 69.248 2.782 16.774 1.00 47.34 O ATOM 2693 H GLY E 48 68.256 -1.161 15.482 1.00 0.00 H ATOM 2694 N HIS E 49 69.116 0.872 17.951 1.00 45.67 N ATOM 2695 CA HIS E 49 69.042 1.532 19.251 1.00 45.35 C ATOM 2696 C HIS E 49 70.258 1.299 20.161 1.00 47.40 C ATOM 2697 O HIS E 49 70.259 1.754 21.299 1.00 45.74 O ATOM 2698 CB HIS E 49 67.813 1.058 19.995 1.00 42.51 C ATOM 2699 CG HIS E 49 66.539 1.600 19.450 1.00 43.57 C ATOM 2700 ND1 HIS E 49 65.303 1.145 19.861 1.00 43.69 N ATOM 2701 CD2 HIS E 49 66.305 2.565 18.532 1.00 41.74 C ATOM 2702 CE1 HIS E 49 64.364 1.812 19.219 1.00 44.11 C ATOM 2703 NE2 HIS E 49 64.946 2.681 18.411 1.00 43.13 N ATOM 2704 H HIS E 49 69.104 -0.167 17.914 1.00 0.00 H ATOM 2705 N PHE E 50 71.299 0.649 19.642 1.00 49.53 N ATOM 2706 CA PHE E 50 72.480 0.334 20.436 1.00 44.37 C ATOM 2707 C PHE E 50 73.710 0.841 19.753 1.00 42.02 C ATOM 2708 O PHE E 50 73.991 0.483 18.606 1.00 47.78 O ATOM 2709 CB PHE E 50 72.572 -1.161 20.617 1.00 46.21 C ATOM 2710 CG PHE E 50 73.678 -1.592 21.498 1.00 49.12 C ATOM 2711 CD1 PHE E 50 73.812 -1.072 22.773 1.00 49.90 C ATOM 2712 CD2 PHE E 50 74.599 -2.526 21.057 1.00 55.57 C ATOM 2713 CE1 PHE E 50 74.857 -1.466 23.588 1.00 49.23 C ATOM 2714 CE2 PHE E 50 75.656 -2.912 21.860 1.00 57.06 C ATOM 2715 CZ PHE E 50 75.781 -2.382 23.131 1.00 52.82 C ATOM 2716 H PHE E 50 71.268 0.359 18.644 1.00 0.00 H ATOM 2717 N GLY E 51 74.437 1.704 20.443 1.00 45.14 N ATOM 2718 CA GLY E 51 75.650 2.309 19.907 1.00 47.05 C ATOM 2719 C GLY E 51 76.915 1.768 20.565 1.00 47.41 C ATOM 2720 O GLY E 51 76.959 1.583 21.770 1.00 45.01 O ATOM 2721 H GLY E 51 74.132 1.960 21.404 1.00 0.00 H ATOM 2722 N ILE E 52 77.963 1.583 19.759 1.00 50.72 N ATOM 2723 CA ILE E 52 79.324 1.375 20.241 1.00 48.00 C ATOM 2724 C ILE E 52 80.236 2.352 19.541 1.00 46.84 C ATOM 2725 O ILE E 52 80.220 2.472 18.330 1.00 55.93 O ATOM 2726 CB ILE E 52 79.816 -0.028 19.944 1.00 49.08 C ATOM 2727 CG1 ILE E 52 78.809 -1.050 20.467 1.00 53.17 C ATOM 2728 CG2 ILE E 52 81.162 -0.240 20.617 1.00 55.49 C ATOM 2729 CD1 ILE E 52 79.069 -2.463 19.993 1.00 55.79 C ATOM 2730 H ILE E 52 77.800 1.587 18.732 1.00 0.00 H ATOM 2731 N GLY E 53 81.053 3.065 20.300 1.00 48.93 N ATOM 2732 CA GLY E 53 81.912 4.083 19.722 1.00 46.70 C ATOM 2733 C GLY E 53 81.157 5.087 18.885 1.00 47.05 C ATOM 2734 O GLY E 53 81.718 5.650 17.940 1.00 58.21 O ATOM 2735 H GLY E 53 81.080 2.894 21.325 1.00 0.00 H ATOM 2736 N GLY E 54 79.896 5.348 19.229 1.00 45.42 N ATOM 2737 CA GLY E 54 79.099 6.371 18.519 1.00 49.50 C ATOM 2738 C GLY E 54 78.442 5.907 17.222 1.00 46.68 C ATOM 2739 O GLY E 54 77.820 6.708 16.529 1.00 44.88 O ATOM 2740 H GLY E 54 79.463 4.821 20.014 1.00 0.00 H ATOM 2741 N GLU E 55 78.594 4.625 16.913 1.00 44.82 N ATOM 2742 CA GLU E 55 78.155 4.088 15.658 1.00 51.84 C ATOM 2743 C GLU E 55 77.261 2.839 15.958 1.00 52.20 C ATOM 2744 O GLU E 55 77.432 2.136 16.966 1.00 54.19 O ATOM 2745 CB GLU E 55 79.343 3.920 14.657 1.00 63.63 C ATOM 2746 CG GLU E 55 80.464 3.030 15.252 1.00 76.33 C ATOM 2747 CD GLU E 55 81.761 3.044 14.436 1.00 87.50 C ATOM 2748 OE1 GLU E 55 81.633 3.154 13.191 1.00 85.92 O ATOM 2749 OE2 GLU E 55 82.883 2.983 15.056 1.00 86.50 O ATOM 2750 H GLU E 55 79.045 3.991 17.602 1.00 0.00 H ATOM 2751 N LEU E 56 76.215 2.636 15.155 1.00 51.27 N ATOM 2752 CA LEU E 56 75.225 1.601 15.439 1.00 49.54 C ATOM 2753 C LEU E 56 75.857 0.226 15.415 1.00 57.22 C ATOM 2754 O LEU E 56 76.894 0.034 14.792 1.00 73.62 O ATOM 2755 CB LEU E 56 74.105 1.630 14.424 1.00 49.34 C ATOM 2756 CG LEU E 56 73.295 2.932 14.269 1.00 49.87 C ATOM 2757 CD1 LEU E 56 72.222 2.837 13.192 1.00 46.56 C ATOM 2758 CD2 LEU E 56 72.638 3.301 15.587 1.00 52.04 C ATOM 2759 H LEU E 56 76.102 3.228 14.308 1.00 0.00 H ATOM 2760 N ALA E 57 75.291 -0.718 16.152 1.00 62.52 N ATOM 2761 CA ALA E 57 75.781 -2.099 16.120 1.00 77.61 C ATOM 2762 C ALA E 57 75.275 -2.807 14.866 1.00 80.06 C ATOM 2763 O ALA E 57 75.816 -3.852 14.475 1.00 78.85 O ATOM 2764 CB ALA E 57 75.321 -2.852 17.344 1.00 83.38 C ATOM 2765 H ALA E 57 74.486 -0.475 16.763 1.00 0.00 H ATOM 2766 N SER E 58 74.259 -2.209 14.235 1.00 77.79 N ATOM 2767 CA SER E 58 73.733 -2.644 12.931 1.00 73.86 C ATOM 2768 C SER E 58 74.571 -2.177 11.708 1.00 76.37 C ATOM 2769 O SER E 58 74.152 -2.296 10.572 1.00 69.64 O ATOM 2770 CB SER E 58 72.271 -2.205 12.779 1.00 68.76 C ATOM 2771 OG SER E 58 72.145 -0.858 12.359 1.00 51.49 O ATOM 2772 HG SER E 58 72.589 -0.744 11.481 1.00 0.00 H ATOM 2773 H SER E 58 73.814 -1.388 14.693 1.00 0.00 H ATOM 2774 N LYS E 59 75.763 -1.661 11.966 1.00 86.87 N ATOM 2775 CA LYS E 59 76.797 -1.493 10.978 1.00 89.86 C ATOM 2776 C LYS E 59 77.907 -2.437 11.411 1.00 93.40 C ATOM 2777 O LYS E 59 78.393 -3.153 10.566 1.00103.77 O ATOM 2778 CB LYS E 59 77.159 -0.032 10.883 1.00 87.73 C ATOM 2779 CG LYS E 59 78.257 0.358 9.924 1.00 86.21 C ATOM 2780 CD LYS E 59 78.527 1.850 10.003 1.00 87.24 C ATOM 2781 CE LYS E 59 79.882 2.205 9.411 1.00 89.03 C ATOM 2782 NZ LYS E 59 80.429 3.496 9.914 1.00 83.84 N ATOM 2783 HZ1 LYS E 59 79.772 4.266 9.675 1.00 0.00 H ATOM 2784 HZ2 LYS E 59 80.543 3.444 10.946 1.00 0.00 H ATOM 2785 HZ3 LYS E 59 81.352 3.676 9.471 1.00 0.00 H ATOM 2786 H LYS E 59 75.964 -1.359 12.941 1.00 0.00 H ATOM 2787 N VAL E 60 78.169 -2.558 12.723 1.00 96.21 N ATOM 2788 CA VAL E 60 79.375 -3.232 13.273 1.00 90.94 C ATOM 2789 C VAL E 60 79.064 -4.340 14.287 1.00 80.94 C ATOM 2790 O VAL E 60 78.211 -5.174 14.051 1.00 63.45 O ATOM 2791 CB VAL E 60 80.379 -2.244 13.888 1.00 92.21 C ATOM 2792 CG1 VAL E 60 80.905 -1.209 12.885 1.00 90.94 C ATOM 2793 CG2 VAL E 60 79.728 -1.592 15.072 1.00 94.73 C ATOM 2794 H VAL E 60 77.486 -2.155 13.396 1.00 0.00 H TER 2795 VAL E 60 ATOM 2796 N PRO F 1 75.771 -7.785 25.194 1.00 45.71 N ATOM 2797 CA PRO F 1 74.937 -8.198 26.335 1.00 40.24 C ATOM 2798 C PRO F 1 75.456 -7.583 27.612 1.00 37.57 C ATOM 2799 O PRO F 1 76.606 -7.808 27.992 1.00 36.10 O ATOM 2800 CB PRO F 1 75.068 -9.750 26.376 1.00 41.33 C ATOM 2801 CG PRO F 1 76.017 -10.138 25.295 1.00 40.37 C ATOM 2802 CD PRO F 1 76.691 -8.881 24.801 1.00 44.51 C ATOM 2803 HN2 PRO F 1 76.329 -6.949 25.462 1.00 0.00 H ATOM 2804 HN1 PRO F 1 75.157 -7.547 24.389 1.00 0.00 H ATOM 2805 N ILE F 2 74.580 -6.831 28.275 1.00 36.15 N ATOM 2806 CA ILE F 2 74.919 -6.048 29.449 1.00 33.03 C ATOM 2807 C ILE F 2 73.944 -6.395 30.569 1.00 34.64 C ATOM 2808 O ILE F 2 72.757 -6.218 30.431 1.00 31.98 O ATOM 2809 CB ILE F 2 74.778 -4.581 29.146 1.00 32.58 C ATOM 2810 CG1 ILE F 2 75.759 -4.210 28.049 1.00 34.44 C ATOM 2811 CG2 ILE F 2 75.019 -3.776 30.389 1.00 33.19 C ATOM 2812 CD1 ILE F 2 75.621 -2.796 27.556 1.00 34.46 C ATOM 2813 H ILE F 2 73.598 -6.803 27.933 1.00 0.00 H ATOM 2814 N ALA F 3 74.451 -6.917 31.681 1.00 35.02 N ATOM 2815 CA ALA F 3 73.603 -7.308 32.786 1.00 31.94 C ATOM 2816 C ALA F 3 73.822 -6.403 33.985 1.00 29.90 C ATOM 2817 O ALA F 3 74.953 -6.129 34.361 1.00 30.53 O ATOM 2818 CB ALA F 3 73.883 -8.744 33.164 1.00 32.78 C ATOM 2819 H ALA F 3 75.480 -7.047 31.759 1.00 0.00 H ATOM 2820 N GLN F 4 72.732 -5.965 34.608 1.00 29.84 N ATOM 2821 CA GLN F 4 72.795 -5.218 35.864 1.00 28.17 C ATOM 2822 C GLN F 4 72.103 -6.064 36.910 1.00 26.67 C ATOM 2823 O GLN F 4 70.963 -6.464 36.732 1.00 31.29 O ATOM 2824 CB GLN F 4 72.139 -3.836 35.741 1.00 26.38 C ATOM 2825 CG GLN F 4 72.163 -3.057 37.060 1.00 30.34 C ATOM 2826 CD GLN F 4 71.627 -1.645 36.922 1.00 31.72 C ATOM 2827 OE1 GLN F 4 71.065 -1.283 35.890 1.00 38.94 O ATOM 2828 NE2 GLN F 4 71.807 -0.839 37.946 1.00 32.95 N ATOM 2829 HE22 GLN F 4 72.287 -1.184 38.801 1.00 0.00 H ATOM 2830 HE21 GLN F 4 71.469 0.143 37.900 1.00 0.00 H ATOM 2831 H GLN F 4 71.801 -6.161 34.187 1.00 0.00 H ATOM 2832 N ILE F 5 72.769 -6.285 38.023 1.00 25.91 N ATOM 2833 CA ILE F 5 72.219 -7.096 39.086 1.00 26.01 C ATOM 2834 C ILE F 5 72.088 -6.303 40.373 1.00 26.62 C ATOM 2835 O ILE F 5 73.098 -5.814 40.909 1.00 28.34 O ATOM 2836 CB ILE F 5 73.109 -8.305 39.327 1.00 26.38 C ATOM 2837 CG1 ILE F 5 73.476 -8.930 37.998 1.00 28.15 C ATOM 2838 CG2 ILE F 5 72.391 -9.317 40.201 1.00 26.77 C ATOM 2839 CD1 ILE F 5 74.355 -10.157 38.096 1.00 30.77 C ATOM 2840 H ILE F 5 73.714 -5.866 38.141 1.00 0.00 H ATOM 2841 N HIS F 6 70.859 -6.175 40.884 1.00 27.44 N ATOM 2842 CA HIS F 6 70.665 -5.505 42.161 1.00 27.87 C ATOM 2843 C HIS F 6 70.668 -6.535 43.251 1.00 28.63 C ATOM 2844 O HIS F 6 69.918 -7.504 43.197 1.00 31.79 O ATOM 2845 CB HIS F 6 69.384 -4.724 42.251 1.00 30.29 C ATOM 2846 CG HIS F 6 69.364 -3.474 41.429 1.00 31.65 C ATOM 2847 ND1 HIS F 6 69.155 -3.512 40.070 1.00 32.06 N ATOM 2848 CD2 HIS F 6 69.422 -2.160 41.774 1.00 31.39 C ATOM 2849 CE1 HIS F 6 69.145 -2.281 39.598 1.00 35.13 C ATOM 2850 NE2 HIS F 6 69.303 -1.440 40.611 1.00 34.24 N ATOM 2851 H HIS F 6 70.040 -6.555 40.368 1.00 0.00 H ATOM 2852 N ILE F 7 71.525 -6.338 44.249 1.00 28.64 N ATOM 2853 CA ILE F 7 71.610 -7.259 45.383 1.00 26.55 C ATOM 2854 C ILE F 7 71.688 -6.493 46.668 1.00 26.83 C ATOM 2855 O ILE F 7 72.108 -5.349 46.716 1.00 24.68 O ATOM 2856 CB ILE F 7 72.845 -8.175 45.294 1.00 25.63 C ATOM 2857 CG1 ILE F 7 74.133 -7.356 45.479 1.00 23.11 C ATOM 2858 CG2 ILE F 7 72.834 -8.915 43.963 1.00 25.36 C ATOM 2859 CD1 ILE F 7 75.395 -8.138 45.323 1.00 22.71 C ATOM 2860 H ILE F 7 72.151 -5.508 44.223 1.00 0.00 H ATOM 2861 N LEU F 8 71.281 -7.150 47.739 1.00 32.00 N ATOM 2862 CA LEU F 8 71.448 -6.552 49.050 1.00 33.29 C ATOM 2863 C LEU F 8 72.904 -6.386 49.383 1.00 30.31 C ATOM 2864 O LEU F 8 73.704 -7.275 49.133 1.00 33.21 O ATOM 2865 CB LEU F 8 70.764 -7.400 50.116 1.00 36.07 C ATOM 2866 CG LEU F 8 69.257 -7.171 50.108 1.00 38.34 C ATOM 2867 CD1 LEU F 8 68.585 -8.238 50.986 1.00 38.28 C ATOM 2868 CD2 LEU F 8 68.887 -5.765 50.566 1.00 35.79 C ATOM 2869 H LEU F 8 70.844 -8.089 47.643 1.00 0.00 H ATOM 2870 N GLU F 9 73.223 -5.275 50.019 1.00 30.87 N ATOM 2871 CA GLU F 9 74.565 -5.065 50.549 1.00 32.04 C ATOM 2872 C GLU F 9 74.895 -6.117 51.610 1.00 32.66 C ATOM 2873 O GLU F 9 74.005 -6.703 52.238 1.00 34.72 O ATOM 2874 CB GLU F 9 74.700 -3.676 51.139 1.00 33.27 C ATOM 2875 CG GLU F 9 74.014 -3.528 52.498 1.00 42.01 C ATOM 2876 CD GLU F 9 73.993 -2.086 53.035 1.00 52.17 C ATOM 2877 OE1 GLU F 9 74.710 -1.202 52.456 1.00 59.21 O ATOM 2878 OE2 GLU F 9 73.260 -1.851 54.033 1.00 39.26 O ATOM 2879 H GLU F 9 72.503 -4.535 50.145 1.00 0.00 H ATOM 2880 N GLY F 10 76.176 -6.377 51.790 1.00 31.51 N ATOM 2881 CA GLY F 10 76.631 -7.240 52.870 1.00 31.87 C ATOM 2882 C GLY F 10 77.581 -8.348 52.469 1.00 31.52 C ATOM 2883 O GLY F 10 78.128 -9.034 53.327 1.00 33.74 O ATOM 2884 H GLY F 10 76.876 -5.956 51.146 1.00 0.00 H ATOM 2885 N ARG F 11 77.786 -8.539 51.178 1.00 31.69 N ATOM 2886 CA ARG F 11 78.572 -9.660 50.689 1.00 36.39 C ATOM 2887 C ARG F 11 80.032 -9.263 50.536 1.00 35.28 C ATOM 2888 O ARG F 11 80.365 -8.098 50.471 1.00 35.56 O ATOM 2889 CB ARG F 11 78.002 -10.146 49.350 1.00 39.54 C ATOM 2890 CG ARG F 11 76.517 -10.436 49.413 1.00 46.26 C ATOM 2891 CD ARG F 11 76.103 -11.781 48.913 1.00 58.18 C ATOM 2892 NE ARG F 11 74.676 -12.057 49.060 1.00 71.46 N ATOM 2893 CZ ARG F 11 74.276 -12.990 49.910 1.00 79.84 C ATOM 2894 NH1 ARG F 11 75.161 -13.563 50.735 1.00 86.57 N ATOM 2895 NH2 ARG F 11 73.007 -13.295 49.982 1.00 83.23 N ATOM 2896 HE ARG F 11 73.979 -11.524 48.501 1.00 0.00 H ATOM 2897 HH12 ARG F 11 74.850 -14.296 51.404 1.00 0.00 H ATOM 2898 HH11 ARG F 11 76.160 -13.275 50.707 1.00 0.00 H ATOM 2899 HH22 ARG F 11 72.685 -14.027 50.647 1.00 0.00 H ATOM 2900 HH21 ARG F 11 72.319 -12.806 49.374 1.00 0.00 H ATOM 2901 H ARG F 11 77.375 -7.871 50.495 1.00 0.00 H ATOM 2902 N SER F 12 80.902 -10.251 50.462 1.00 39.32 N ATOM 2903 CA SER F 12 82.341 -10.001 50.340 1.00 36.14 C ATOM 2904 C SER F 12 82.698 -9.697 48.909 1.00 33.19 C ATOM 2905 O SER F 12 82.010 -10.104 47.980 1.00 33.22 O ATOM 2906 CB SER F 12 83.110 -11.246 50.783 1.00 35.41 C ATOM 2907 OG SER F 12 82.864 -12.334 49.901 1.00 40.80 O ATOM 2908 HG SER F 12 83.154 -12.088 48.987 1.00 0.00 H ATOM 2909 H SER F 12 80.559 -11.232 50.491 1.00 0.00 H ATOM 2910 N ASP F 13 83.837 -9.064 48.718 1.00 35.26 N ATOM 2911 CA ASP F 13 84.391 -8.868 47.374 1.00 34.47 C ATOM 2912 C ASP F 13 84.590 -10.174 46.592 1.00 34.30 C ATOM 2913 O ASP F 13 84.422 -10.182 45.379 1.00 32.15 O ATOM 2914 CB ASP F 13 85.722 -8.122 47.447 1.00 38.01 C ATOM 2915 CG ASP F 13 85.546 -6.643 47.782 1.00 42.70 C ATOM 2916 OD1 ASP F 13 84.396 -6.224 48.069 1.00 51.12 O ATOM 2917 OD2 ASP F 13 86.559 -5.905 47.789 1.00 42.03 O ATOM 2918 H ASP F 13 84.356 -8.694 49.540 1.00 0.00 H ATOM 2919 N GLU F 14 84.898 -11.274 47.281 1.00 35.01 N ATOM 2920 CA GLU F 14 85.157 -12.538 46.608 1.00 40.66 C ATOM 2921 C GLU F 14 83.849 -13.086 46.045 1.00 44.14 C ATOM 2922 O GLU F 14 83.791 -13.520 44.887 1.00 42.72 O ATOM 2923 CB GLU F 14 85.787 -13.581 47.539 1.00 46.30 C ATOM 2924 CG GLU F 14 87.186 -13.252 48.027 1.00 53.02 C ATOM 2925 CD GLU F 14 87.200 -12.129 49.070 1.00 63.26 C ATOM 2926 OE1 GLU F 14 86.411 -12.197 50.040 1.00 65.47 O ATOM 2927 OE2 GLU F 14 88.035 -11.208 48.939 1.00 70.72 O ATOM 2928 H GLU F 14 84.954 -11.227 48.318 1.00 0.00 H ATOM 2929 N GLN F 15 82.802 -13.081 46.874 1.00 39.91 N ATOM 2930 CA GLN F 15 81.491 -13.533 46.435 1.00 36.16 C ATOM 2931 C GLN F 15 80.995 -12.795 45.215 1.00 31.89 C ATOM 2932 O GLN F 15 80.431 -13.382 44.283 1.00 30.03 O ATOM 2933 CB GLN F 15 80.496 -13.312 47.529 1.00 42.48 C ATOM 2934 CG GLN F 15 80.299 -14.497 48.406 1.00 49.19 C ATOM 2935 CD GLN F 15 79.215 -14.305 49.418 1.00 54.73 C ATOM 2936 OE1 GLN F 15 78.303 -15.037 49.253 1.00 55.98 O ATOM 2937 NE2 GLN F 15 79.272 -13.382 50.460 1.00 53.49 N ATOM 2938 HE22 GLN F 15 80.100 -12.760 50.559 1.00 0.00 H ATOM 2939 HE21 GLN F 15 78.487 -13.315 51.138 1.00 0.00 H ATOM 2940 H GLN F 15 82.926 -12.748 47.851 1.00 0.00 H ATOM 2941 N LYS F 16 81.240 -11.498 45.208 1.00 29.87 N ATOM 2942 CA LYS F 16 80.842 -10.673 44.091 1.00 32.21 C ATOM 2943 C LYS F 16 81.659 -10.962 42.841 1.00 31.93 C ATOM 2944 O LYS F 16 81.145 -10.913 41.728 1.00 30.84 O ATOM 2945 CB LYS F 16 80.914 -9.204 44.495 1.00 31.03 C ATOM 2946 CG LYS F 16 79.817 -8.882 45.487 1.00 29.52 C ATOM 2947 CD LYS F 16 79.685 -7.409 45.774 1.00 27.46 C ATOM 2948 CE LYS F 16 80.770 -6.908 46.684 1.00 26.68 C ATOM 2949 NZ LYS F 16 80.263 -5.761 47.467 1.00 27.71 N ATOM 2950 HZ1 LYS F 16 79.974 -5.001 46.819 1.00 0.00 H ATOM 2951 HZ2 LYS F 16 79.446 -6.064 48.034 1.00 0.00 H ATOM 2952 HZ3 LYS F 16 81.014 -5.414 48.097 1.00 0.00 H ATOM 2953 H LYS F 16 81.726 -11.064 46.018 1.00 0.00 H ATOM 2954 N GLU F 17 82.953 -11.189 43.022 1.00 34.95 N ATOM 2955 CA GLU F 17 83.819 -11.540 41.911 1.00 40.33 C ATOM 2956 C GLU F 17 83.310 -12.850 41.279 1.00 35.78 C ATOM 2957 O GLU F 17 83.286 -12.995 40.053 1.00 35.43 O ATOM 2958 CB GLU F 17 85.249 -11.712 42.404 1.00 49.13 C ATOM 2959 CG GLU F 17 86.252 -12.063 41.313 1.00 59.29 C ATOM 2960 CD GLU F 17 87.697 -11.946 41.761 1.00 66.07 C ATOM 2961 OE1 GLU F 17 87.947 -11.708 42.965 1.00 71.54 O ATOM 2962 OE2 GLU F 17 88.592 -12.099 40.901 1.00 77.19 O ATOM 2963 H GLU F 17 83.355 -11.114 43.978 1.00 0.00 H ATOM 2964 N THR F 18 82.911 -13.781 42.126 1.00 29.78 N ATOM 2965 CA THR F 18 82.354 -15.050 41.684 1.00 27.81 C ATOM 2966 C THR F 18 81.034 -14.851 40.938 1.00 29.55 C ATOM 2967 O THR F 18 80.859 -15.364 39.826 1.00 30.34 O ATOM 2968 CB THR F 18 82.132 -15.972 42.888 1.00 26.37 C ATOM 2969 OG1 THR F 18 83.392 -16.249 43.489 1.00 25.57 O ATOM 2970 CG2 THR F 18 81.457 -17.279 42.497 1.00 28.80 C ATOM 2971 HG1 THR F 18 83.808 -15.401 43.786 1.00 0.00 H ATOM 2972 H THR F 18 82.998 -13.600 43.146 1.00 0.00 H ATOM 2973 N LEU F 19 80.144 -14.033 41.510 1.00 29.86 N ATOM 2974 CA LEU F 19 78.911 -13.665 40.848 1.00 29.29 C ATOM 2975 C LEU F 19 79.147 -13.126 39.450 1.00 29.28 C ATOM 2976 O LEU F 19 78.514 -13.580 38.474 1.00 28.52 O ATOM 2977 CB LEU F 19 78.221 -12.600 41.640 1.00 33.71 C ATOM 2978 CG LEU F 19 76.895 -12.070 41.077 1.00 35.91 C ATOM 2979 CD1 LEU F 19 75.855 -13.163 41.045 1.00 37.38 C ATOM 2980 CD2 LEU F 19 76.412 -10.904 41.933 1.00 35.80 C ATOM 2981 H LEU F 19 80.343 -13.651 42.456 1.00 0.00 H ATOM 2982 N ILE F 20 80.082 -12.187 39.323 1.00 27.60 N ATOM 2983 CA ILE F 20 80.366 -11.614 38.017 1.00 29.83 C ATOM 2984 C ILE F 20 80.796 -12.712 37.026 1.00 31.73 C ATOM 2985 O ILE F 20 80.329 -12.742 35.883 1.00 32.62 O ATOM 2986 CB ILE F 20 81.416 -10.507 38.112 1.00 29.14 C ATOM 2987 CG1 ILE F 20 80.748 -9.282 38.713 1.00 32.70 C ATOM 2988 CG2 ILE F 20 82.023 -10.183 36.751 1.00 27.63 C ATOM 2989 CD1 ILE F 20 81.680 -8.118 39.015 1.00 36.16 C ATOM 2990 H ILE F 20 80.610 -11.863 40.158 1.00 0.00 H ATOM 2991 N ARG F 21 81.690 -13.597 37.458 1.00 32.88 N ATOM 2992 CA ARG F 21 82.241 -14.598 36.557 1.00 37.15 C ATOM 2993 C ARG F 21 81.169 -15.587 36.129 1.00 32.52 C ATOM 2994 O ARG F 21 80.971 -15.797 34.941 1.00 29.34 O ATOM 2995 CB ARG F 21 83.407 -15.338 37.207 1.00 42.96 C ATOM 2996 CG ARG F 21 84.161 -16.265 36.257 1.00 48.90 C ATOM 2997 CD ARG F 21 85.400 -16.926 36.888 1.00 61.58 C ATOM 2998 NE ARG F 21 85.078 -17.299 38.261 1.00 70.38 N ATOM 2999 CZ ARG F 21 85.530 -16.815 39.427 1.00 76.27 C ATOM 3000 NH1 ARG F 21 86.426 -15.817 39.546 1.00 73.77 N ATOM 3001 NH2 ARG F 21 85.037 -17.381 40.520 1.00 76.14 N ATOM 3002 HE ARG F 21 84.383 -18.067 38.350 1.00 0.00 H ATOM 3003 HH12 ARG F 21 86.727 -15.498 40.489 1.00 0.00 H ATOM 3004 HH11 ARG F 21 86.817 -15.365 38.695 1.00 0.00 H ATOM 3005 HH22 ARG F 21 85.344 -17.054 41.458 1.00 0.00 H ATOM 3006 HH21 ARG F 21 84.343 -18.151 40.439 1.00 0.00 H ATOM 3007 H ARG F 21 81.999 -13.573 38.451 1.00 0.00 H ATOM 3008 N GLU F 22 80.475 -16.155 37.105 1.00 31.71 N ATOM 3009 CA GLU F 22 79.506 -17.207 36.863 1.00 32.03 C ATOM 3010 C GLU F 22 78.336 -16.714 36.011 1.00 31.97 C ATOM 3011 O GLU F 22 77.885 -17.421 35.102 1.00 33.62 O ATOM 3012 CB GLU F 22 78.973 -17.744 38.166 1.00 37.76 C ATOM 3013 CG GLU F 22 80.061 -18.350 39.022 1.00 47.59 C ATOM 3014 CD GLU F 22 80.119 -19.861 39.014 1.00 50.18 C ATOM 3015 OE1 GLU F 22 81.211 -20.345 39.357 1.00 64.86 O ATOM 3016 OE2 GLU F 22 79.127 -20.547 38.700 1.00 57.93 O ATOM 3017 H GLU F 22 80.631 -15.834 38.082 1.00 0.00 H ATOM 3018 N VAL F 23 77.875 -15.501 36.273 1.00 28.79 N ATOM 3019 CA VAL F 23 76.844 -14.917 35.459 1.00 31.68 C ATOM 3020 C VAL F 23 77.351 -14.623 34.041 1.00 32.50 C ATOM 3021 O VAL F 23 76.672 -14.925 33.052 1.00 37.00 O ATOM 3022 CB VAL F 23 76.273 -13.625 36.089 1.00 31.02 C ATOM 3023 CG1 VAL F 23 75.405 -12.862 35.099 1.00 29.33 C ATOM 3024 CG2 VAL F 23 75.473 -13.975 37.323 1.00 29.87 C ATOM 3025 H VAL F 23 78.263 -14.965 37.076 1.00 0.00 H ATOM 3026 N SER F 24 78.526 -14.034 33.934 1.00 30.03 N ATOM 3027 CA SER F 24 79.084 -13.750 32.626 1.00 31.12 C ATOM 3028 C SER F 24 79.169 -15.041 31.773 1.00 31.30 C ATOM 3029 O SER F 24 78.836 -15.036 30.589 1.00 30.62 O ATOM 3030 CB SER F 24 80.474 -13.082 32.763 1.00 29.11 C ATOM 3031 OG SER F 24 80.363 -11.732 33.193 1.00 24.26 O ATOM 3032 HG SER F 24 81.267 -11.336 33.270 1.00 0.00 H ATOM 3033 H SER F 24 79.054 -13.772 34.791 1.00 0.00 H ATOM 3034 N GLU F 25 79.576 -16.119 32.411 1.00 32.68 N ATOM 3035 CA GLU F 25 79.716 -17.389 31.759 1.00 37.76 C ATOM 3036 C GLU F 25 78.357 -17.895 31.315 1.00 36.35 C ATOM 3037 O GLU F 25 78.179 -18.273 30.152 1.00 36.75 O ATOM 3038 CB GLU F 25 80.439 -18.393 32.700 1.00 42.63 C ATOM 3039 CG GLU F 25 81.955 -18.422 32.464 1.00 49.59 C ATOM 3040 CD GLU F 25 82.750 -19.007 33.656 1.00 56.09 C ATOM 3041 OE1 GLU F 25 84.041 -19.163 33.789 1.00 57.22 O ATOM 3042 OE2 GLU F 25 81.965 -19.391 34.483 1.00 49.96 O ATOM 3043 H GLU F 25 79.804 -16.047 33.423 1.00 0.00 H ATOM 3044 N ALA F 26 77.385 -17.859 32.218 1.00 35.19 N ATOM 3045 CA ALA F 26 76.026 -18.324 31.904 1.00 30.94 C ATOM 3046 C ALA F 26 75.422 -17.564 30.714 1.00 33.26 C ATOM 3047 O ALA F 26 74.735 -18.153 29.883 1.00 33.35 O ATOM 3048 CB ALA F 26 75.141 -18.201 33.100 1.00 28.60 C ATOM 3049 H ALA F 26 77.589 -17.493 33.170 1.00 0.00 H ATOM 3050 N ILE F 27 75.718 -16.274 30.617 1.00 30.93 N ATOM 3051 CA ILE F 27 75.252 -15.487 29.508 1.00 31.68 C ATOM 3052 C ILE F 27 75.914 -15.955 28.224 1.00 35.45 C ATOM 3053 O ILE F 27 75.233 -16.216 27.219 1.00 39.28 O ATOM 3054 CB ILE F 27 75.507 -13.982 29.743 1.00 30.80 C ATOM 3055 CG1 ILE F 27 74.580 -13.467 30.837 1.00 32.40 C ATOM 3056 CG2 ILE F 27 75.283 -13.165 28.472 1.00 31.13 C ATOM 3057 CD1 ILE F 27 74.893 -12.088 31.367 1.00 30.70 C ATOM 3058 H ILE F 27 76.297 -15.825 31.355 1.00 0.00 H ATOM 3059 N SER F 28 77.238 -16.045 28.240 1.00 35.55 N ATOM 3060 CA SER F 28 77.991 -16.484 27.054 1.00 37.65 C ATOM 3061 C SER F 28 77.527 -17.854 26.545 1.00 38.17 C ATOM 3062 O SER F 28 77.307 -18.041 25.350 1.00 36.42 O ATOM 3063 CB SER F 28 79.472 -16.559 27.381 1.00 37.45 C ATOM 3064 OG SER F 28 80.217 -16.775 26.211 1.00 42.37 O ATOM 3065 HG SER F 28 80.062 -16.028 25.580 1.00 0.00 H ATOM 3066 H SER F 28 77.754 -15.800 29.109 1.00 0.00 H ATOM 3067 N ARG F 29 77.351 -18.793 27.478 1.00 39.10 N ATOM 3068 CA ARG F 29 76.892 -20.128 27.154 1.00 38.80 C ATOM 3069 C ARG F 29 75.516 -20.045 26.517 1.00 40.97 C ATOM 3070 O ARG F 29 75.309 -20.545 25.418 1.00 43.75 O ATOM 3071 CB ARG F 29 76.792 -21.011 28.398 1.00 44.38 C ATOM 3072 CG ARG F 29 77.423 -22.380 28.286 1.00 49.69 C ATOM 3073 CD ARG F 29 77.882 -22.978 29.619 1.00 52.99 C ATOM 3074 NE ARG F 29 76.959 -22.620 30.705 1.00 51.58 N ATOM 3075 CZ ARG F 29 77.276 -22.022 31.858 1.00 55.72 C ATOM 3076 NH1 ARG F 29 78.526 -21.654 32.159 1.00 58.12 N ATOM 3077 NH2 ARG F 29 76.324 -21.784 32.749 1.00 49.44 N ATOM 3078 HE ARG F 29 75.956 -22.856 30.562 1.00 0.00 H ATOM 3079 HH12 ARG F 29 78.727 -21.191 33.068 1.00 0.00 H ATOM 3080 HH11 ARG F 29 79.297 -21.831 31.484 1.00 0.00 H ATOM 3081 HH22 ARG F 29 76.559 -21.319 33.649 1.00 0.00 H ATOM 3082 HH21 ARG F 29 75.342 -22.062 32.548 1.00 0.00 H ATOM 3083 H ARG F 29 77.550 -18.558 28.471 1.00 0.00 H ATOM 3084 N SER F 30 74.585 -19.417 27.221 1.00 41.23 N ATOM 3085 CA SER F 30 73.181 -19.404 26.829 1.00 42.53 C ATOM 3086 C SER F 30 72.894 -18.765 25.465 1.00 45.84 C ATOM 3087 O SER F 30 71.971 -19.194 24.768 1.00 49.31 O ATOM 3088 CB SER F 30 72.364 -18.655 27.873 1.00 40.93 C ATOM 3089 OG SER F 30 72.283 -19.394 29.074 1.00 40.79 O ATOM 3090 HG SER F 30 73.195 -19.544 29.430 1.00 0.00 H ATOM 3091 H SER F 30 74.867 -18.914 28.087 1.00 0.00 H ATOM 3092 N LEU F 31 73.666 -17.747 25.096 1.00 47.30 N ATOM 3093 CA LEU F 31 73.409 -16.999 23.870 1.00 46.56 C ATOM 3094 C LEU F 31 74.448 -17.262 22.815 1.00 51.08 C ATOM 3095 O LEU F 31 74.455 -16.606 21.772 1.00 49.45 O ATOM 3096 CB LEU F 31 73.443 -15.510 24.152 1.00 46.34 C ATOM 3097 CG LEU F 31 72.523 -14.989 25.242 1.00 45.16 C ATOM 3098 CD1 LEU F 31 72.658 -13.475 25.279 1.00 44.73 C ATOM 3099 CD2 LEU F 31 71.080 -15.413 25.021 1.00 43.10 C ATOM 3100 H LEU F 31 74.472 -17.478 25.696 1.00 0.00 H ATOM 3101 N ASP F 32 75.336 -18.212 23.076 1.00 54.63 N ATOM 3102 CA ASP F 32 76.416 -18.474 22.158 1.00 58.41 C ATOM 3103 C ASP F 32 77.082 -17.157 21.749 1.00 51.62 C ATOM 3104 O ASP F 32 77.430 -16.961 20.595 1.00 60.31 O ATOM 3105 CB ASP F 32 75.895 -19.217 20.928 1.00 66.46 C ATOM 3106 CG ASP F 32 76.849 -20.294 20.451 1.00 81.45 C ATOM 3107 OD1 ASP F 32 78.079 -20.103 20.539 1.00 83.20 O ATOM 3108 OD2 ASP F 32 76.355 -21.345 19.991 1.00101.49 O ATOM 3109 H ASP F 32 75.253 -18.772 23.949 1.00 0.00 H ATOM 3110 N ALA F 33 77.315 -16.290 22.721 1.00 46.57 N ATOM 3111 CA ALA F 33 77.993 -15.023 22.481 1.00 43.26 C ATOM 3112 C ALA F 33 79.394 -15.055 23.088 1.00 41.69 C ATOM 3113 O ALA F 33 79.636 -15.734 24.090 1.00 36.10 O ATOM 3114 CB ALA F 33 77.204 -13.892 23.103 1.00 43.81 C ATOM 3115 H ALA F 33 77.004 -16.520 23.686 1.00 0.00 H ATOM 3116 N PRO F 34 80.329 -14.322 22.479 1.00 43.45 N ATOM 3117 CA PRO F 34 81.710 -14.344 22.979 1.00 44.52 C ATOM 3118 C PRO F 34 81.806 -13.759 24.391 1.00 48.11 C ATOM 3119 O PRO F 34 81.305 -12.647 24.653 1.00 50.93 O ATOM 3120 CB PRO F 34 82.480 -13.488 21.968 1.00 43.26 C ATOM 3121 CG PRO F 34 81.454 -12.716 21.197 1.00 42.21 C ATOM 3122 CD PRO F 34 80.154 -13.449 21.304 1.00 42.87 C ATOM 3123 N LEU F 35 82.422 -14.515 25.298 1.00 46.52 N ATOM 3124 CA LEU F 35 82.562 -14.101 26.699 1.00 41.59 C ATOM 3125 C LEU F 35 83.094 -12.692 26.861 1.00 40.00 C ATOM 3126 O LEU F 35 82.650 -11.974 27.738 1.00 41.88 O ATOM 3127 CB LEU F 35 83.466 -15.068 27.462 1.00 40.31 C ATOM 3128 CG LEU F 35 83.635 -14.800 28.965 1.00 40.51 C ATOM 3129 CD1 LEU F 35 82.299 -14.893 29.692 1.00 41.67 C ATOM 3130 CD2 LEU F 35 84.633 -15.746 29.596 1.00 38.60 C ATOM 3131 H LEU F 35 82.818 -15.431 25.003 1.00 0.00 H ATOM 3132 N THR F 36 84.008 -12.273 26.002 1.00 42.35 N ATOM 3133 CA THR F 36 84.656 -10.959 26.165 1.00 43.93 C ATOM 3134 C THR F 36 83.770 -9.754 25.856 1.00 40.01 C ATOM 3135 O THR F 36 84.127 -8.641 26.211 1.00 45.18 O ATOM 3136 CB THR F 36 85.900 -10.843 25.274 1.00 46.23 C ATOM 3137 OG1 THR F 36 85.489 -11.000 23.915 1.00 48.55 O ATOM 3138 CG2 THR F 36 86.928 -11.918 25.636 1.00 47.99 C ATOM 3139 HG1 THR F 36 86.279 -10.928 23.322 1.00 0.00 H ATOM 3140 H THR F 36 84.273 -12.879 25.200 1.00 0.00 H ATOM 3141 N SER F 37 82.630 -9.972 25.217 1.00 38.13 N ATOM 3142 CA SER F 37 81.662 -8.899 24.975 1.00 40.93 C ATOM 3143 C SER F 37 80.688 -8.660 26.163 1.00 38.35 C ATOM 3144 O SER F 37 80.063 -7.591 26.248 1.00 36.65 O ATOM 3145 CB SER F 37 80.843 -9.205 23.721 1.00 45.34 C ATOM 3146 OG SER F 37 80.166 -10.446 23.846 1.00 55.13 O ATOM 3147 HG SER F 37 80.828 -11.170 23.978 1.00 0.00 H ATOM 3148 H SER F 37 82.416 -10.932 24.878 1.00 0.00 H ATOM 3149 N VAL F 38 80.626 -9.621 27.091 1.00 34.39 N ATOM 3150 CA VAL F 38 79.707 -9.559 28.202 1.00 34.27 C ATOM 3151 C VAL F 38 80.128 -8.583 29.303 1.00 35.52 C ATOM 3152 O VAL F 38 81.243 -8.637 29.828 1.00 43.44 O ATOM 3153 CB VAL F 38 79.525 -10.934 28.853 1.00 35.79 C ATOM 3154 CG1 VAL F 38 78.534 -10.842 30.011 1.00 35.53 C ATOM 3155 CG2 VAL F 38 79.025 -11.953 27.841 1.00 33.50 C ATOM 3156 H VAL F 38 81.261 -10.440 27.009 1.00 0.00 H ATOM 3157 N ARG F 39 79.219 -7.687 29.645 1.00 32.66 N ATOM 3158 CA ARG F 39 79.421 -6.733 30.706 1.00 32.99 C ATOM 3159 C ARG F 39 78.478 -7.044 31.847 1.00 28.18 C ATOM 3160 O ARG F 39 77.312 -7.323 31.622 1.00 27.77 O ATOM 3161 CB ARG F 39 79.125 -5.312 30.214 1.00 39.57 C ATOM 3162 CG ARG F 39 80.339 -4.536 29.790 1.00 44.77 C ATOM 3163 CD ARG F 39 80.637 -4.692 28.329 1.00 52.71 C ATOM 3164 NE ARG F 39 81.728 -3.815 27.926 1.00 60.58 N ATOM 3165 CZ ARG F 39 82.711 -4.162 27.108 1.00 72.24 C ATOM 3166 NH1 ARG F 39 82.751 -5.374 26.554 1.00 81.06 N ATOM 3167 NH2 ARG F 39 83.673 -3.294 26.845 1.00 76.80 N ATOM 3168 HE ARG F 39 81.736 -2.848 28.307 1.00 0.00 H ATOM 3169 HH12 ARG F 39 83.531 -5.628 25.914 1.00 0.00 H ATOM 3170 HH11 ARG F 39 82.002 -6.066 26.761 1.00 0.00 H ATOM 3171 HH22 ARG F 39 84.449 -3.556 26.204 1.00 0.00 H ATOM 3172 HH21 ARG F 39 83.654 -2.349 27.279 1.00 0.00 H ATOM 3173 H ARG F 39 78.318 -7.670 29.126 1.00 0.00 H ATOM 3174 N VAL F 40 78.967 -6.916 33.071 1.00 24.89 N ATOM 3175 CA VAL F 40 78.139 -7.050 34.232 1.00 24.74 C ATOM 3176 C VAL F 40 78.316 -5.898 35.203 1.00 24.50 C ATOM 3177 O VAL F 40 79.429 -5.489 35.525 1.00 24.02 O ATOM 3178 CB VAL F 40 78.436 -8.329 34.970 1.00 26.30 C ATOM 3179 CG1 VAL F 40 77.549 -8.445 36.195 1.00 27.67 C ATOM 3180 CG2 VAL F 40 78.197 -9.522 34.054 1.00 27.03 C ATOM 3181 H VAL F 40 79.980 -6.713 33.193 1.00 0.00 H ATOM 3182 N ILE F 41 77.194 -5.375 35.674 1.00 24.74 N ATOM 3183 CA ILE F 41 77.193 -4.334 36.663 1.00 26.19 C ATOM 3184 C ILE F 41 76.510 -4.895 37.898 1.00 27.82 C ATOM 3185 O ILE F 41 75.376 -5.323 37.838 1.00 27.19 O ATOM 3186 CB ILE F 41 76.424 -3.100 36.188 1.00 24.16 C ATOM 3187 CG1 ILE F 41 77.076 -2.544 34.972 1.00 25.59 C ATOM 3188 CG2 ILE F 41 76.361 -2.046 37.271 1.00 25.07 C ATOM 3189 CD1 ILE F 41 76.234 -1.511 34.252 1.00 28.45 C ATOM 3190 H ILE F 41 76.284 -5.730 35.316 1.00 0.00 H ATOM 3191 N ILE F 42 77.169 -4.744 39.041 1.00 30.79 N ATOM 3192 CA ILE F 42 76.548 -5.027 40.331 1.00 29.35 C ATOM 3193 C ILE F 42 76.162 -3.722 41.015 1.00 25.99 C ATOM 3194 O ILE F 42 76.962 -2.806 41.109 1.00 25.69 O ATOM 3195 CB ILE F 42 77.503 -5.796 41.218 1.00 30.88 C ATOM 3196 CG1 ILE F 42 77.793 -7.118 40.547 1.00 35.86 C ATOM 3197 CG2 ILE F 42 76.895 -6.021 42.575 1.00 31.06 C ATOM 3198 CD1 ILE F 42 78.844 -7.909 41.272 1.00 42.81 C ATOM 3199 H ILE F 42 78.155 -4.415 39.016 1.00 0.00 H ATOM 3200 N THR F 43 74.924 -3.670 41.487 1.00 25.69 N ATOM 3201 CA THR F 43 74.413 -2.511 42.199 1.00 23.93 C ATOM 3202 C THR F 43 73.958 -2.994 43.550 1.00 26.40 C ATOM 3203 O THR F 43 73.021 -3.790 43.662 1.00 28.99 O ATOM 3204 CB THR F 43 73.262 -1.875 41.428 1.00 22.06 C ATOM 3205 OG1 THR F 43 73.731 -1.467 40.142 1.00 20.56 O ATOM 3206 CG2 THR F 43 72.745 -0.701 42.146 1.00 23.62 C ATOM 3207 HG1 THR F 43 72.987 -1.053 39.637 1.00 0.00 H ATOM 3208 H THR F 43 74.297 -4.487 41.343 1.00 0.00 H ATOM 3209 N GLU F 44 74.650 -2.547 44.592 1.00 27.69 N ATOM 3210 CA GLU F 44 74.308 -2.946 45.951 1.00 27.85 C ATOM 3211 C GLU F 44 73.195 -2.076 46.492 1.00 27.93 C ATOM 3212 O GLU F 44 73.218 -0.870 46.345 1.00 27.71 O ATOM 3213 CB GLU F 44 75.519 -2.832 46.851 1.00 31.69 C ATOM 3214 CG GLU F 44 76.449 -4.020 46.796 1.00 33.03 C ATOM 3215 CD GLU F 44 77.463 -4.004 47.922 1.00 34.08 C ATOM 3216 OE1 GLU F 44 77.925 -2.901 48.333 1.00 40.75 O ATOM 3217 OE2 GLU F 44 77.773 -5.104 48.438 1.00 33.69 O ATOM 3218 H GLU F 44 75.450 -1.901 44.435 1.00 0.00 H ATOM 3219 N MET F 45 72.198 -2.688 47.114 1.00 32.33 N ATOM 3220 CA MET F 45 71.143 -1.930 47.779 1.00 30.05 C ATOM 3221 C MET F 45 71.300 -1.943 49.270 1.00 27.35 C ATOM 3222 O MET F 45 71.557 -2.994 49.856 1.00 24.70 O ATOM 3223 CB MET F 45 69.769 -2.503 47.466 1.00 30.73 C ATOM 3224 CG MET F 45 69.461 -2.759 46.001 1.00 34.28 C ATOM 3225 SD MET F 45 67.828 -3.490 45.825 1.00 32.69 S ATOM 3226 CE MET F 45 68.161 -5.239 45.916 1.00 32.08 C ATOM 3227 H MET F 45 72.167 -3.727 47.129 1.00 0.00 H ATOM 3228 N ALA F 46 71.095 -0.777 49.893 1.00 27.67 N ATOM 3229 CA ALA F 46 70.997 -0.700 51.369 1.00 29.27 C ATOM 3230 C ALA F 46 69.732 -1.408 51.821 1.00 32.66 C ATOM 3231 O ALA F 46 68.746 -1.448 51.086 1.00 29.45 O ATOM 3232 CB ALA F 46 70.978 0.737 51.832 1.00 27.99 C ATOM 3233 H ALA F 46 71.003 0.092 49.330 1.00 0.00 H ATOM 3234 N LYS F 47 69.746 -1.962 53.024 1.00 38.55 N ATOM 3235 CA LYS F 47 68.634 -2.823 53.490 1.00 41.11 C ATOM 3236 C LYS F 47 67.380 -1.994 53.721 1.00 35.44 C ATOM 3237 O LYS F 47 66.259 -2.482 53.519 1.00 37.20 O ATOM 3238 CB LYS F 47 69.026 -3.621 54.744 1.00 46.28 C ATOM 3239 CG LYS F 47 70.491 -4.033 54.759 1.00 58.33 C ATOM 3240 CD LYS F 47 70.754 -5.366 55.435 1.00 67.97 C ATOM 3241 CE LYS F 47 72.242 -5.669 55.321 1.00 78.80 C ATOM 3242 NZ LYS F 47 72.686 -6.891 56.036 1.00 87.00 N ATOM 3243 HZ1 LYS F 47 72.477 -6.793 57.050 1.00 0.00 H ATOM 3244 HZ2 LYS F 47 72.182 -7.717 55.655 1.00 0.00 H ATOM 3245 HZ3 LYS F 47 73.710 -7.017 55.903 1.00 0.00 H ATOM 3246 H LYS F 47 70.555 -1.789 53.655 1.00 0.00 H ATOM 3247 N GLY F 48 67.580 -0.719 54.066 1.00 29.95 N ATOM 3248 CA GLY F 48 66.484 0.236 54.188 1.00 26.41 C ATOM 3249 C GLY F 48 65.970 0.824 52.878 1.00 28.95 C ATOM 3250 O GLY F 48 65.070 1.660 52.900 1.00 27.98 O ATOM 3251 H GLY F 48 68.551 -0.396 54.254 1.00 0.00 H ATOM 3252 N HIS F 49 66.508 0.372 51.739 1.00 30.15 N ATOM 3253 CA HIS F 49 66.109 0.852 50.429 1.00 30.00 C ATOM 3254 C HIS F 49 65.426 -0.184 49.567 1.00 29.45 C ATOM 3255 O HIS F 49 65.084 0.109 48.414 1.00 30.62 O ATOM 3256 CB HIS F 49 67.319 1.348 49.663 1.00 31.09 C ATOM 3257 CG HIS F 49 67.865 2.639 50.179 1.00 35.14 C ATOM 3258 ND1 HIS F 49 69.058 3.179 49.736 1.00 38.19 N ATOM 3259 CD2 HIS F 49 67.400 3.483 51.128 1.00 35.30 C ATOM 3260 CE1 HIS F 49 69.287 4.311 50.378 1.00 37.20 C ATOM 3261 NE2 HIS F 49 68.294 4.520 51.219 1.00 36.48 N ATOM 3262 H HIS F 49 67.247 -0.358 51.795 1.00 0.00 H ATOM 3263 N PHE F 50 65.169 -1.368 50.112 1.00 27.02 N ATOM 3264 CA PHE F 50 64.540 -2.425 49.339 1.00 28.71 C ATOM 3265 C PHE F 50 63.282 -2.935 50.025 1.00 36.28 C ATOM 3266 O PHE F 50 63.322 -3.354 51.197 1.00 33.90 O ATOM 3267 CB PHE F 50 65.491 -3.562 49.181 1.00 28.94 C ATOM 3268 CG PHE F 50 64.981 -4.671 48.327 1.00 29.25 C ATOM 3269 CD1 PHE F 50 64.553 -4.437 47.037 1.00 29.00 C ATOM 3270 CD2 PHE F 50 64.963 -5.985 48.816 1.00 30.70 C ATOM 3271 CE1 PHE F 50 64.080 -5.481 46.246 1.00 30.57 C ATOM 3272 CE2 PHE F 50 64.514 -7.029 48.023 1.00 30.70 C ATOM 3273 CZ PHE F 50 64.054 -6.772 46.736 1.00 29.51 C ATOM 3274 H PHE F 50 65.422 -1.541 51.106 1.00 0.00 H ATOM 3275 N GLY F 51 62.156 -2.869 49.312 1.00 36.59 N ATOM 3276 CA GLY F 51 60.878 -3.275 49.873 1.00 41.45 C ATOM 3277 C GLY F 51 60.371 -4.552 49.242 1.00 42.54 C ATOM 3278 O GLY F 51 60.450 -4.716 48.039 1.00 36.61 O ATOM 3279 H GLY F 51 62.194 -2.519 48.333 1.00 0.00 H ATOM 3280 N ILE F 52 59.730 -5.388 50.056 1.00 47.87 N ATOM 3281 CA ILE F 52 58.898 -6.488 49.566 1.00 48.73 C ATOM 3282 C ILE F 52 57.558 -6.423 50.266 1.00 47.57 C ATOM 3283 O ILE F 52 57.471 -6.278 51.488 1.00 47.92 O ATOM 3284 CB ILE F 52 59.509 -7.828 49.895 1.00 57.73 C ATOM 3285 CG1 ILE F 52 60.954 -7.871 49.407 1.00 60.94 C ATOM 3286 CG2 ILE F 52 58.690 -8.932 49.240 1.00 65.00 C ATOM 3287 CD1 ILE F 52 61.757 -9.045 49.921 1.00 60.30 C ATOM 3288 H ILE F 52 59.824 -5.254 51.083 1.00 0.00 H ATOM 3289 N GLY F 53 56.493 -6.485 49.495 1.00 48.55 N ATOM 3290 CA GLY F 53 55.163 -6.303 50.064 1.00 49.78 C ATOM 3291 C GLY F 53 54.989 -5.031 50.875 1.00 46.13 C ATOM 3292 O GLY F 53 54.181 -5.007 51.808 1.00 51.87 O ATOM 3293 H GLY F 53 56.601 -6.664 48.476 1.00 0.00 H ATOM 3294 N GLY F 54 55.721 -3.974 50.524 1.00 41.42 N ATOM 3295 CA GLY F 54 55.608 -2.694 51.208 1.00 42.18 C ATOM 3296 C GLY F 54 56.406 -2.559 52.504 1.00 43.66 C ATOM 3297 O GLY F 54 56.285 -1.533 53.196 1.00 44.75 O ATOM 3298 H GLY F 54 56.394 -4.067 49.737 1.00 0.00 H ATOM 3299 N GLU F 55 57.166 -3.595 52.843 1.00 47.61 N ATOM 3300 CA GLU F 55 57.904 -3.659 54.091 1.00 56.29 C ATOM 3301 C GLU F 55 59.373 -3.870 53.794 1.00 57.47 C ATOM 3302 O GLU F 55 59.710 -4.563 52.845 1.00 58.43 O ATOM 3303 CB GLU F 55 57.406 -4.808 54.950 1.00 63.45 C ATOM 3304 CG GLU F 55 55.963 -4.658 55.336 1.00 71.56 C ATOM 3305 CD GLU F 55 55.694 -3.492 56.280 1.00 78.80 C ATOM 3306 OE1 GLU F 55 56.363 -3.360 57.321 1.00 87.07 O ATOM 3307 OE2 GLU F 55 54.804 -2.673 55.976 1.00 78.83 O ATOM 3308 H GLU F 55 57.235 -4.397 52.184 1.00 0.00 H ATOM 3309 N LEU F 56 60.236 -3.284 54.613 1.00 53.51 N ATOM 3310 CA LEU F 56 61.662 -3.356 54.360 1.00 57.86 C ATOM 3311 C LEU F 56 62.153 -4.793 54.408 1.00 66.16 C ATOM 3312 O LEU F 56 61.562 -5.631 55.063 1.00 82.41 O ATOM 3313 CB LEU F 56 62.449 -2.531 55.369 1.00 53.74 C ATOM 3314 CG LEU F 56 62.108 -1.037 55.480 1.00 57.14 C ATOM 3315 CD1 LEU F 56 62.931 -0.318 56.544 1.00 56.25 C ATOM 3316 CD2 LEU F 56 62.313 -0.344 54.150 1.00 56.05 C ATOM 3317 H LEU F 56 59.886 -2.768 55.445 1.00 0.00 H ATOM 3318 N ALA F 57 63.217 -5.088 53.676 1.00 81.23 N ATOM 3319 CA ALA F 57 63.842 -6.404 53.750 1.00 91.42 C ATOM 3320 C ALA F 57 64.707 -6.513 55.016 1.00 89.93 C ATOM 3321 O ALA F 57 65.058 -7.620 55.437 1.00 90.03 O ATOM 3322 CB ALA F 57 64.698 -6.633 52.536 1.00 95.55 C ATOM 3323 H ALA F 57 63.614 -4.369 53.038 1.00 0.00 H ATOM 3324 N SER F 58 65.018 -5.363 55.617 1.00 87.58 N ATOM 3325 CA SER F 58 65.698 -5.275 56.918 1.00 86.60 C ATOM 3326 C SER F 58 64.780 -5.542 58.158 1.00 96.17 C ATOM 3327 O SER F 58 65.169 -5.260 59.283 1.00 82.68 O ATOM 3328 CB SER F 58 66.420 -3.918 57.046 1.00 79.45 C ATOM 3329 OG SER F 58 65.567 -2.863 57.439 1.00 74.79 O ATOM 3330 HG SER F 58 65.169 -3.073 58.321 1.00 0.00 H ATOM 3331 H SER F 58 64.764 -4.476 55.137 1.00 0.00 H ATOM 3332 N LYS F 59 63.566 -6.054 57.929 1.00105.20 N ATOM 3333 CA LYS F 59 62.792 -6.795 58.965 1.00108.39 C ATOM 3334 C LYS F 59 62.407 -8.164 58.338 1.00109.37 C ATOM 3335 O LYS F 59 61.460 -8.781 58.768 1.00112.31 O ATOM 3336 CB LYS F 59 61.594 -6.002 59.599 1.00116.49 C ATOM 3337 CG LYS F 59 61.026 -5.076 58.572 1.00122.27 C ATOM 3338 CD LYS F 59 59.883 -4.234 59.072 1.00124.62 C ATOM 3339 CE LYS F 59 59.643 -3.052 58.146 1.00132.10 C ATOM 3340 NZ LYS F 59 58.925 -1.931 58.808 1.00142.43 N ATOM 3341 HZ1 LYS F 59 57.998 -2.264 59.143 1.00 0.00 H ATOM 3342 HZ2 LYS F 59 59.485 -1.591 59.616 1.00 0.00 H ATOM 3343 HZ3 LYS F 59 58.791 -1.156 58.127 1.00 0.00 H ATOM 3344 H LYS F 59 63.144 -5.930 56.987 1.00 0.00 H ATOM 3345 N VAL F 60 63.134 -8.599 57.296 1.00112.33 N ATOM 3346 CA VAL F 60 63.004 -9.938 56.679 1.00108.71 C ATOM 3347 C VAL F 60 64.382 -10.477 56.245 1.00100.77 C ATOM 3348 O VAL F 60 65.317 -10.615 57.035 1.00 87.28 O ATOM 3349 CB VAL F 60 62.128 -9.931 55.372 1.00114.00 C ATOM 3350 CG1 VAL F 60 61.906 -11.358 54.874 1.00115.52 C ATOM 3351 CG2 VAL F 60 60.791 -9.198 55.516 1.00110.82 C ATOM 3352 H VAL F 60 63.839 -7.948 56.894 1.00 0.00 H TER 3353 VAL F 60 HETATM 3354 O HOH 1 50.525 -4.351 31.005 1.00 39.05 O HETATM 3355 O HOH 2 59.969 -7.153 26.772 1.00 27.40 O HETATM 3356 O HOH 3 51.231 -17.654 29.869 1.00 30.51 O HETATM 3357 O HOH 4 54.149 11.231 37.300 1.00 41.64 O HETATM 3358 O HOH 5 53.931 -7.353 36.886 1.00 47.23 O HETATM 3359 O HOH 6 66.307 0.764 32.937 1.00 40.14 O HETATM 3360 O HOH 7 44.065 8.420 42.006 1.00 33.16 O HETATM 3361 O HOH 8 57.529 -3.634 48.637 1.00 34.17 O HETATM 3362 O HOH 9 68.683 8.392 55.515 1.00 26.31 O HETATM 3363 O HOH 10 66.994 10.713 50.205 1.00 19.24 O HETATM 3364 O HOH 11 74.428 9.269 42.962 1.00 16.96 O HETATM 3365 O HOH 12 62.800 15.550 45.768 1.00 37.02 O HETATM 3366 O HOH 13 71.001 3.855 46.998 1.00 18.06 O HETATM 3367 O HOH 14 71.184 7.875 54.836 1.00 29.08 O HETATM 3368 O HOH 15 78.286 4.180 21.459 1.00 31.45 O HETATM 3369 O HOH 16 57.048 0.039 27.446 1.00 35.80 O HETATM 3370 O HOH 17 71.916 0.446 31.603 1.00 29.78 O HETATM 3371 O HOH 18 83.678 8.593 38.428 1.00 19.24 O HETATM 3372 O HOH 19 78.810 0.273 42.441 1.00 23.23 O HETATM 3373 O HOH 20 76.269 7.358 42.091 1.00 28.72 O HETATM 3374 O HOH 21 84.530 4.432 32.711 1.00 40.38 O HETATM 3375 O HOH 22 67.571 -11.280 21.232 1.00 36.25 O HETATM 3376 O HOH 23 64.429 -15.947 37.341 1.00 33.46 O HETATM 3377 O HOH 24 63.496 0.514 22.461 1.00 36.44 O HETATM 3378 O HOH 25 61.639 -6.838 22.811 1.00 37.34 O HETATM 3379 O HOH 26 61.695 -5.869 25.272 1.00 28.00 O HETATM 3380 O HOH 27 76.170 -7.220 48.703 1.00 23.06 O HETATM 3381 O HOH 28 81.727 -9.493 32.549 1.00 29.71 O HETATM 3382 O HOH 29 77.972 -0.618 46.566 1.00 21.26 O HETATM 3383 O HOH 30 71.252 1.965 48.070 1.00 23.94 O HETATM 3384 O HOH 31 70.177 1.757 38.068 1.00 33.97 O HETATM 3385 O HOH 32 74.253 -8.501 21.659 1.00 43.24 O HETATM 3386 O HOH 33 76.922 -0.244 44.116 1.00 20.71 O HETATM 3387 C01 UNN A 34 63.065 13.817 40.746 1.00 -0.06 C HETATM 3388 C02 UNN A 34 62.637 14.905 39.770 1.00 -0.04 C HETATM 3389 C03 UNN A 34 63.231 16.122 39.744 1.00 0.03 C HETATM 3390 C04 UNN A 34 63.355 16.987 40.993 1.00 0.17 C HETATM 3391 C05 UNN A 34 63.341 18.488 40.843 1.00 0.12 C HETATM 3392 O06 UNN A 34 62.450 19.019 40.124 1.00 -0.55 O HETATM 3393 O07 UNN A 34 64.224 19.179 41.432 1.00 -0.55 O HETATM 3394 O08 UNN A 34 63.486 16.513 42.110 1.00 -0.36 O HETATM 3395 H6 UNN A 34 62.674 16.721 39.009 1.00 0.05 H HETATM 3396 H7 UNN A 34 64.256 15.957 39.381 1.00 0.05 H HETATM 3397 H4 UNN A 34 61.569 15.088 39.962 1.00 0.03 H HETATM 3398 H5 UNN A 34 62.761 14.481 38.763 1.00 0.03 H HETATM 3399 H1 UNN A 34 62.449 12.920 40.588 1.00 0.02 H HETATM 3400 H2 UNN A 34 62.932 14.176 41.777 1.00 0.02 H HETATM 3401 H3 UNN A 34 64.123 13.569 40.578 1.00 0.02 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 593 594 599 600 601 CONECT 600 593 CONECT 601 593 CONECT 1130 1131 1136 1137 1138 CONECT 1137 1130 CONECT 1138 1130 CONECT 1680 1681 1686 1687 1688 CONECT 1687 1680 CONECT 1688 1680 CONECT 2238 2239 2244 2245 2246 CONECT 2245 2238 CONECT 2246 2238 CONECT 2796 2797 2802 2803 2804 CONECT 2803 2796 CONECT 2804 2796 CONECT 3387 3388 3399 3400 3401 CONECT 3388 3387 3389 3397 3398 CONECT 3389 3388 3390 3395 3396 CONECT 3390 3389 3391 3394 CONECT 3391 3390 3392 3393 CONECT 3392 3391 CONECT 3393 3391 CONECT 3394 3390 CONECT 3395 3389 CONECT 3396 3389 CONECT 3397 3388 CONECT 3398 3388 CONECT 3399 3387 CONECT 3400 3387 CONECT 3401 3387 MASTER 0 0 0 0 0 0 0 0 3395 6 33 30 END
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Related entries of code: 5tig
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5tig
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
2-hydroxymuconate tautomerase
Ligand Name
7DH
EC.Number
E.C.5.3.2.6
Resolution
2.7(Å)
Affinity (Kd/Ki/IC50)
Ki=60uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Biochemistry Vol. 57: pp. 1012-1021
Ligand Properties
Formula
C
5
H
8
O
3
Molecular Weight
116.115
Exact Mass
116.047
No. of atoms
16
No. of bonds
15
Polar Surface Area
54.37
LOGP Value
1.38 (
Computed with XLOGP3
)
0.44 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 0
Canonical SMILES
CCCC(=O)C(=O)O
InChI String
InChI=1S/C5H8O3/c1-2-3-4(6)5(7)8/h2-3H2,1H3,(H,7,8)
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):
Q01468
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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