Browse entries in the PDBbind-CN Database
HEADER 5LWN_COMPLEX COMPND 5LWN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 290 PRO THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER SEQRES 2 A 290 GLN LEU GLY LYS GLY ASN PHE GLY SER VAL GLU LEU CYS SEQRES 3 A 290 ARG TYR ASP PRO LEU GLY ASP ASN THR GLY ALA LEU VAL SEQRES 4 A 290 ALA VAL LYS GLN LEU GLN HIS SER GLY PRO ASP GLN GLN SEQRES 5 A 290 ARG ASP PHE GLN ARG GLU ILE GLN ILE LEU LYS ALA LEU SEQRES 6 A 290 HIS SER ASP PHE ILE VAL LYS TYR ARG GLY VAL SER TYR SEQRES 7 A 290 GLY PRO GLY ARG GLN SER LEU ARG LEU VAL MET GLU TYR SEQRES 8 A 290 LEU PRO SER GLY CYS LEU ARG ASP PHE LEU GLN ARG HIS SEQRES 9 A 290 ARG ALA ARG LEU ASP ALA SER ARG LEU LEU LEU TYR SER SEQRES 10 A 290 SER GLN ILE CYS LYS GLY MET GLU TYR LEU GLY SER ARG SEQRES 11 A 290 ARG CYS VAL HIS ARG ALA LEU ALA ALA ARG ASN ILE LEU SEQRES 12 A 290 VAL GLU SER GLU ALA HIS VAL LYS ILE ALA ASP PHE GLY SEQRES 13 A 290 LEU ALA LYS LEU LEU PRO LEU ASP LYS ASP TYR TYR VAL SEQRES 14 A 290 VAL ARG GLU PRO GLY GLN SER PRO ILE PHE TRP TYR ALA SEQRES 15 A 290 PRO GLU SER LEU SER ASP ASN ILE PHE SER ARG GLN SER SEQRES 16 A 290 ASP VAL TRP SER PHE GLY VAL VAL LEU TYR GLU LEU PHE SEQRES 17 A 290 THR TYR CYS ASP LYS SER CYS SER PRO SER ALA GLU PHE SEQRES 18 A 290 LEU ARG MET MET GLY SER GLU ARG ASP VAL PRO ALA LEU SEQRES 19 A 290 SER ARG LEU LEU GLU LEU LEU GLU GLU GLY GLN ARG LEU SEQRES 20 A 290 PRO ALA PRO PRO ALA CYS PRO ALA GLU VAL HIS GLU LEU SEQRES 21 A 290 MET LYS LEU CYS TRP ALA PRO SER PRO GLN ASP ARG PRO SEQRES 22 A 290 SER PHE SER ALA LEU GLY PRO GLN LEU ASP MET LEU TRP SEQRES 23 A 290 SER GLY SER ARG HET UNN A 485 59 ATOM 1 N PRO A 814 21.521 10.489 46.860 1.00 60.45 N ATOM 2 CA PRO A 814 22.081 10.809 45.517 1.00 59.38 C ATOM 3 C PRO A 814 21.263 11.843 44.699 1.00 55.31 C ATOM 4 O PRO A 814 21.844 12.680 44.005 1.00 54.92 O ATOM 5 CB PRO A 814 22.113 9.442 44.804 1.00 60.17 C ATOM 6 CG PRO A 814 21.229 8.543 45.602 1.00 61.79 C ATOM 7 CD PRO A 814 21.217 9.055 47.015 1.00 61.62 C ATOM 8 HN2 PRO A 814 20.645 11.033 46.995 1.00 0.00 H ATOM 9 HN1 PRO A 814 22.214 10.764 47.585 1.00 0.00 H ATOM 10 N THR A 815 19.935 11.771 44.794 1.00 52.40 N ATOM 11 CA THR A 815 19.063 12.738 44.167 1.00 47.30 C ATOM 12 C THR A 815 18.851 14.061 44.968 1.00 42.87 C ATOM 13 O THR A 815 18.092 14.902 44.533 1.00 38.88 O ATOM 14 CB THR A 815 17.682 12.082 43.800 1.00 49.67 C ATOM 15 OG1 THR A 815 17.048 11.579 44.981 1.00 50.85 O ATOM 16 CG2 THR A 815 17.857 10.932 42.820 1.00 50.32 C ATOM 17 HG1 THR A 815 16.180 11.169 44.739 1.00 0.00 H ATOM 18 H THR A 815 19.512 10.992 45.338 1.00 0.00 H ATOM 19 N ILE A 816 19.480 14.251 46.135 1.00 41.60 N ATOM 20 CA ILE A 816 19.360 15.536 46.863 1.00 39.85 C ATOM 21 C ILE A 816 20.675 16.277 46.731 1.00 38.26 C ATOM 22 O ILE A 816 21.675 15.863 47.283 1.00 40.68 O ATOM 23 CB ILE A 816 19.015 15.371 48.368 1.00 42.52 C ATOM 24 CG1 ILE A 816 17.703 14.607 48.535 1.00 44.08 C ATOM 25 CG2 ILE A 816 18.996 16.730 49.087 1.00 42.62 C ATOM 26 CD1 ILE A 816 16.475 15.302 47.999 1.00 43.60 C ATOM 27 H ILE A 816 20.060 13.487 46.536 1.00 0.00 H ATOM 28 N PHE A 817 20.644 17.378 46.003 1.00 34.92 N ATOM 29 CA PHE A 817 21.786 18.275 45.823 1.00 33.88 C ATOM 30 C PHE A 817 21.715 19.327 46.927 1.00 35.38 C ATOM 31 O PHE A 817 20.641 19.880 47.211 1.00 36.85 O ATOM 32 CB PHE A 817 21.694 18.886 44.427 1.00 30.88 C ATOM 33 CG PHE A 817 21.998 17.895 43.336 1.00 29.95 C ATOM 34 CD1 PHE A 817 21.069 16.948 42.944 1.00 29.67 C ATOM 35 CD2 PHE A 817 23.246 17.865 42.739 1.00 30.13 C ATOM 36 CE1 PHE A 817 21.349 16.025 41.984 1.00 29.02 C ATOM 37 CE2 PHE A 817 23.537 16.923 41.755 1.00 29.85 C ATOM 38 CZ PHE A 817 22.595 15.992 41.380 1.00 29.47 C ATOM 39 H PHE A 817 19.752 17.623 45.528 1.00 0.00 H ATOM 40 N GLU A 818 22.803 19.526 47.641 1.00 36.87 N ATOM 41 CA GLU A 818 22.859 20.568 48.647 1.00 38.83 C ATOM 42 C GLU A 818 23.001 21.900 47.921 1.00 39.41 C ATOM 43 O GLU A 818 23.916 22.082 47.101 1.00 37.73 O ATOM 44 CB GLU A 818 24.021 20.338 49.631 1.00 43.78 C ATOM 45 CG GLU A 818 24.059 18.918 50.201 1.00 46.71 C ATOM 46 CD GLU A 818 24.839 18.813 51.483 1.00 53.11 C ATOM 47 OE1 GLU A 818 24.181 18.647 52.542 1.00 60.03 O ATOM 48 OE2 GLU A 818 26.102 18.920 51.466 1.00 54.83 O ATOM 49 H GLU A 818 23.637 18.925 47.480 1.00 0.00 H ATOM 50 N GLU A 819 22.104 22.838 48.216 1.00 39.88 N ATOM 51 CA GLU A 819 22.023 24.107 47.471 1.00 43.51 C ATOM 52 C GLU A 819 23.307 24.942 47.553 1.00 43.86 C ATOM 53 O GLU A 819 23.696 25.619 46.606 1.00 44.09 O ATOM 54 CB GLU A 819 20.841 24.936 47.982 1.00 47.43 C ATOM 55 CG GLU A 819 20.397 26.053 47.043 1.00 50.85 C ATOM 56 CD GLU A 819 21.184 27.335 47.191 1.00 55.24 C ATOM 57 OE1 GLU A 819 21.403 27.999 46.145 1.00 61.21 O ATOM 58 OE2 GLU A 819 21.599 27.675 48.324 1.00 59.78 O ATOM 59 H GLU A 819 21.439 22.670 48.998 1.00 0.00 H ATOM 60 N ARG A 820 23.942 24.893 48.704 1.00 45.58 N ATOM 61 CA ARG A 820 25.133 25.687 48.946 1.00 47.08 C ATOM 62 C ARG A 820 26.275 25.198 48.112 1.00 44.76 C ATOM 63 O ARG A 820 27.220 25.925 47.972 1.00 47.72 O ATOM 64 CB ARG A 820 25.504 25.687 50.425 1.00 50.03 C ATOM 65 CG ARG A 820 25.972 24.346 50.953 1.00 52.58 C ATOM 66 CD ARG A 820 26.004 24.337 52.468 1.00 55.71 C ATOM 67 NE ARG A 820 26.603 23.087 52.932 1.00 58.83 N ATOM 68 CZ ARG A 820 25.958 21.926 53.073 1.00 59.85 C ATOM 69 NH1 ARG A 820 24.640 21.822 52.845 1.00 58.33 N ATOM 70 NH2 ARG A 820 26.635 20.860 53.501 1.00 62.06 N ATOM 71 HE ARG A 820 27.615 23.103 53.172 1.00 0.00 H ATOM 72 HH12 ARG A 820 24.163 20.905 52.962 1.00 0.00 H ATOM 73 HH11 ARG A 820 24.096 22.658 52.551 1.00 0.00 H ATOM 74 HH22 ARG A 820 26.149 19.948 53.617 1.00 0.00 H ATOM 75 HH21 ARG A 820 27.649 20.941 53.719 1.00 0.00 H ATOM 76 H ARG A 820 23.583 24.272 49.457 1.00 0.00 H ATOM 77 N HIS A 821 26.180 23.971 47.567 1.00 41.73 N ATOM 78 CA HIS A 821 27.169 23.412 46.640 1.00 40.75 C ATOM 79 C HIS A 821 26.844 23.552 45.152 1.00 37.83 C ATOM 80 O HIS A 821 27.635 23.118 44.333 1.00 36.41 O ATOM 81 CB HIS A 821 27.445 21.931 46.958 1.00 42.94 C ATOM 82 CG HIS A 821 28.024 21.702 48.319 1.00 46.96 C ATOM 83 ND1 HIS A 821 28.980 22.525 48.870 1.00 48.19 N ATOM 84 CD2 HIS A 821 27.762 20.753 49.249 1.00 48.85 C ATOM 85 CE1 HIS A 821 29.298 22.083 50.073 1.00 50.89 C ATOM 86 NE2 HIS A 821 28.567 21.013 50.329 1.00 50.84 N ATOM 87 H HIS A 821 25.358 23.386 47.818 1.00 0.00 H ATOM 88 N LEU A 822 25.751 24.216 44.792 1.00 34.54 N ATOM 89 CA LEU A 822 25.416 24.488 43.372 1.00 32.94 C ATOM 90 C LEU A 822 25.901 25.870 42.999 1.00 33.29 C ATOM 91 O LEU A 822 25.411 26.855 43.531 1.00 36.33 O ATOM 92 CB LEU A 822 23.900 24.449 43.151 1.00 32.07 C ATOM 93 CG LEU A 822 23.272 23.100 42.962 1.00 31.58 C ATOM 94 CD1 LEU A 822 21.738 23.264 43.038 1.00 31.04 C ATOM 95 CD2 LEU A 822 23.637 22.459 41.648 1.00 30.74 C ATOM 96 H LEU A 822 25.106 24.558 45.533 1.00 0.00 H ATOM 97 N LYS A 823 26.904 25.953 42.140 1.00 32.62 N ATOM 98 CA LYS A 823 27.459 27.231 41.733 1.00 32.64 C ATOM 99 C LYS A 823 26.937 27.678 40.363 1.00 31.85 C ATOM 100 O LYS A 823 27.185 27.027 39.368 1.00 29.78 O ATOM 101 CB LYS A 823 28.987 27.106 41.698 1.00 34.44 C ATOM 102 CG LYS A 823 29.586 26.857 43.068 1.00 36.54 C ATOM 103 CD LYS A 823 31.070 26.632 42.981 1.00 38.66 C ATOM 104 CE LYS A 823 31.727 26.660 44.381 1.00 40.79 C ATOM 105 NZ LYS A 823 33.190 26.413 44.277 1.00 41.48 N ATOM 106 HZ1 LYS A 823 33.353 25.481 43.846 1.00 0.00 H ATOM 107 HZ2 LYS A 823 33.624 27.150 43.686 1.00 0.00 H ATOM 108 HZ3 LYS A 823 33.613 26.436 45.227 1.00 0.00 H ATOM 109 H LYS A 823 27.306 25.079 41.746 1.00 0.00 H ATOM 110 N TYR A 824 26.269 28.828 40.348 1.00 31.82 N ATOM 111 CA TYR A 824 25.725 29.457 39.125 1.00 31.09 C ATOM 112 C TYR A 824 26.792 29.870 38.145 1.00 31.23 C ATOM 113 O TYR A 824 27.810 30.490 38.524 1.00 32.48 O ATOM 114 CB TYR A 824 24.931 30.729 39.480 1.00 31.33 C ATOM 115 CG TYR A 824 24.441 31.518 38.296 1.00 32.28 C ATOM 116 CD1 TYR A 824 23.277 31.097 37.598 1.00 32.03 C ATOM 117 CD2 TYR A 824 25.062 32.699 37.881 1.00 33.67 C ATOM 118 CE1 TYR A 824 22.800 31.811 36.504 1.00 32.85 C ATOM 119 CE2 TYR A 824 24.595 33.409 36.770 1.00 35.21 C ATOM 120 CZ TYR A 824 23.465 32.971 36.090 1.00 34.71 C ATOM 121 OH TYR A 824 22.881 33.633 35.024 1.00 36.84 O ATOM 122 HH TYR A 824 23.537 33.711 34.286 1.00 0.00 H ATOM 123 H TYR A 824 26.120 29.316 41.254 1.00 0.00 H ATOM 124 N ILE A 825 26.591 29.535 36.877 1.00 30.06 N ATOM 125 CA ILE A 825 27.483 29.948 35.826 1.00 30.73 C ATOM 126 C ILE A 825 26.764 30.885 34.885 1.00 31.82 C ATOM 127 O ILE A 825 27.246 31.970 34.609 1.00 32.68 O ATOM 128 CB ILE A 825 28.033 28.737 35.048 1.00 30.62 C ATOM 129 CG1 ILE A 825 28.895 27.861 35.970 1.00 31.02 C ATOM 130 CG2 ILE A 825 28.854 29.189 33.856 1.00 31.50 C ATOM 131 CD1 ILE A 825 29.583 26.719 35.274 1.00 31.34 C ATOM 132 H ILE A 825 25.762 28.955 36.635 1.00 0.00 H ATOM 133 N SER A 826 25.634 30.435 34.316 1.00 29.98 N ATOM 134 CA SER A 826 24.954 31.227 33.296 1.00 31.37 C ATOM 135 C SER A 826 23.531 30.725 33.051 1.00 30.72 C ATOM 136 O SER A 826 23.158 29.681 33.560 1.00 29.03 O ATOM 137 CB SER A 826 25.728 31.219 31.978 1.00 32.88 C ATOM 138 OG SER A 826 25.835 29.900 31.436 1.00 33.10 O ATOM 139 HG SER A 826 26.341 29.934 30.586 1.00 0.00 H ATOM 140 H SER A 826 25.241 29.516 34.604 1.00 0.00 H ATOM 141 N GLN A 827 22.752 31.540 32.333 1.00 31.76 N ATOM 142 CA GLN A 827 21.363 31.226 31.966 1.00 32.64 C ATOM 143 C GLN A 827 21.320 30.421 30.660 1.00 32.07 C ATOM 144 O GLN A 827 22.004 30.757 29.695 1.00 33.27 O ATOM 145 CB GLN A 827 20.556 32.532 31.824 1.00 36.20 C ATOM 146 CG GLN A 827 19.083 32.291 31.515 1.00 38.73 C ATOM 147 CD GLN A 827 18.201 33.551 31.485 1.00 43.17 C ATOM 148 OE1 GLN A 827 18.028 34.182 30.440 1.00 44.57 O ATOM 149 NE2 GLN A 827 17.547 33.848 32.616 1.00 46.21 N ATOM 150 HE22 GLN A 827 17.720 33.292 33.478 1.00 0.00 H ATOM 151 HE21 GLN A 827 16.866 34.634 32.632 1.00 0.00 H ATOM 152 H GLN A 827 23.150 32.447 32.016 1.00 0.00 H ATOM 153 N LEU A 828 20.555 29.339 30.645 1.00 30.31 N ATOM 154 CA LEU A 828 20.324 28.574 29.428 1.00 30.75 C ATOM 155 C LEU A 828 18.964 28.921 28.786 1.00 32.02 C ATOM 156 O LEU A 828 18.889 29.103 27.594 1.00 32.76 O ATOM 157 CB LEU A 828 20.401 27.064 29.746 1.00 29.84 C ATOM 158 CG LEU A 828 21.746 26.563 30.267 1.00 29.17 C ATOM 159 CD1 LEU A 828 21.654 25.193 30.912 1.00 28.47 C ATOM 160 CD2 LEU A 828 22.782 26.526 29.162 1.00 30.50 C ATOM 161 H LEU A 828 20.106 29.027 31.530 1.00 0.00 H ATOM 162 N GLY A 829 17.936 29.076 29.601 1.00 32.04 N ATOM 163 CA GLY A 829 16.574 29.372 29.133 1.00 35.65 C ATOM 164 C GLY A 829 15.821 30.241 30.120 1.00 38.65 C ATOM 165 O GLY A 829 16.058 30.216 31.329 1.00 36.14 O ATOM 166 H GLY A 829 18.098 28.984 30.624 1.00 0.00 H ATOM 167 N LYS A 830 14.898 31.026 29.586 1.00 44.61 N ATOM 168 CA LYS A 830 14.044 31.879 30.376 1.00 50.02 C ATOM 169 C LYS A 830 12.662 31.553 29.907 1.00 52.98 C ATOM 170 O LYS A 830 12.440 31.413 28.701 1.00 50.31 O ATOM 171 CB LYS A 830 14.343 33.358 30.109 1.00 54.17 C ATOM 172 CG LYS A 830 13.552 34.342 30.959 1.00 58.09 C ATOM 173 CD LYS A 830 13.814 34.118 32.446 1.00 61.20 C ATOM 174 CE LYS A 830 13.322 35.278 33.313 1.00 65.09 C ATOM 175 NZ LYS A 830 13.977 35.285 34.657 1.00 65.52 N ATOM 176 HZ1 LYS A 830 13.763 34.395 35.150 1.00 0.00 H ATOM 177 HZ2 LYS A 830 15.006 35.379 34.539 1.00 0.00 H ATOM 178 HZ3 LYS A 830 13.616 36.086 35.213 1.00 0.00 H ATOM 179 H LYS A 830 14.784 31.028 28.552 1.00 0.00 H ATOM 180 N GLY A 831 11.757 31.401 30.868 1.00 54.44 N ATOM 181 CA GLY A 831 10.372 31.138 30.597 1.00 56.48 C ATOM 182 C GLY A 831 9.594 32.280 31.192 1.00 58.99 C ATOM 183 O GLY A 831 10.159 33.287 31.654 1.00 58.08 O ATOM 184 H GLY A 831 12.065 31.476 31.858 1.00 0.00 H ATOM 185 N ASN A 832 8.284 32.107 31.197 1.00 60.75 N ATOM 186 CA ASN A 832 7.392 33.128 31.735 1.00 63.83 C ATOM 187 C ASN A 832 7.573 33.214 33.255 1.00 60.67 C ATOM 188 O ASN A 832 7.629 34.321 33.815 1.00 61.36 O ATOM 189 CB ASN A 832 5.924 32.827 31.369 1.00 66.27 C ATOM 190 CG ASN A 832 5.710 32.668 29.859 1.00 67.76 C ATOM 191 OD1 ASN A 832 6.503 32.021 29.159 1.00 66.52 O ATOM 192 ND2 ASN A 832 4.629 33.246 29.358 1.00 70.72 N ATOM 193 HD22 ASN A 832 3.989 33.780 29.980 1.00 0.00 H ATOM 194 HD21 ASN A 832 4.420 33.166 28.342 1.00 0.00 H ATOM 195 H ASN A 832 7.882 31.229 30.811 1.00 0.00 H ATOM 196 N PHE A 833 7.695 32.040 33.894 1.00 54.07 N ATOM 197 CA PHE A 833 7.752 31.920 35.360 1.00 51.91 C ATOM 198 C PHE A 833 9.008 31.221 35.901 1.00 47.54 C ATOM 199 O PHE A 833 9.096 30.946 37.109 1.00 48.02 O ATOM 200 CB PHE A 833 6.539 31.120 35.840 1.00 52.19 C ATOM 201 CG PHE A 833 5.243 31.556 35.202 1.00 55.12 C ATOM 202 CD1 PHE A 833 4.715 32.808 35.490 1.00 56.67 C ATOM 203 CD2 PHE A 833 4.570 30.719 34.293 1.00 54.91 C ATOM 204 CE1 PHE A 833 3.519 33.224 34.905 1.00 58.85 C ATOM 205 CE2 PHE A 833 3.379 31.128 33.703 1.00 57.56 C ATOM 206 CZ PHE A 833 2.857 32.383 34.010 1.00 59.15 C ATOM 207 H PHE A 833 7.752 31.171 33.325 1.00 0.00 H ATOM 208 N GLY A 834 9.960 30.901 35.035 1.00 42.26 N ATOM 209 CA GLY A 834 11.116 30.111 35.491 1.00 38.47 C ATOM 210 C GLY A 834 12.349 30.382 34.685 1.00 36.59 C ATOM 211 O GLY A 834 12.318 31.073 33.677 1.00 35.13 O ATOM 212 H GLY A 834 9.891 31.205 34.043 1.00 0.00 H ATOM 213 N SER A 835 13.465 29.816 35.146 1.00 33.75 N ATOM 214 CA SER A 835 14.638 29.785 34.307 1.00 32.24 C ATOM 215 C SER A 835 15.419 28.500 34.530 1.00 29.86 C ATOM 216 O SER A 835 15.339 27.897 35.601 1.00 27.27 O ATOM 217 CB SER A 835 15.487 31.015 34.561 1.00 34.36 C ATOM 218 OG SER A 835 16.217 30.885 35.752 1.00 36.28 O ATOM 219 HG SER A 835 16.762 31.699 35.894 1.00 0.00 H ATOM 220 H SER A 835 13.489 29.402 36.100 1.00 0.00 H ATOM 221 N VAL A 836 16.197 28.141 33.502 1.00 28.35 N ATOM 222 CA VAL A 836 17.085 27.011 33.513 1.00 26.03 C ATOM 223 C VAL A 836 18.477 27.613 33.437 1.00 25.84 C ATOM 224 O VAL A 836 18.773 28.435 32.541 1.00 25.65 O ATOM 225 CB VAL A 836 16.898 26.067 32.320 1.00 26.29 C ATOM 226 CG1 VAL A 836 17.795 24.851 32.501 1.00 25.99 C ATOM 227 CG2 VAL A 836 15.447 25.624 32.203 1.00 26.85 C ATOM 228 H VAL A 836 16.156 28.718 32.638 1.00 0.00 H ATOM 229 N GLU A 837 19.299 27.170 34.366 1.00 24.68 N ATOM 230 CA GLU A 837 20.626 27.761 34.613 1.00 25.59 C ATOM 231 C GLU A 837 21.688 26.680 34.574 1.00 24.53 C ATOM 232 O GLU A 837 21.515 25.555 35.070 1.00 23.87 O ATOM 233 CB GLU A 837 20.624 28.508 35.967 1.00 27.48 C ATOM 234 CG GLU A 837 19.592 29.668 35.932 1.00 29.97 C ATOM 235 CD GLU A 837 19.415 30.424 37.232 1.00 33.33 C ATOM 236 OE1 GLU A 837 20.027 30.037 38.238 1.00 34.80 O ATOM 237 OE2 GLU A 837 18.629 31.425 37.233 1.00 37.32 O ATOM 238 H GLU A 837 18.997 26.366 34.952 1.00 0.00 H ATOM 239 N LEU A 838 22.808 27.015 33.929 1.00 24.24 N ATOM 240 CA LEU A 838 23.977 26.137 33.948 1.00 24.41 C ATOM 241 C LEU A 838 24.693 26.375 35.313 1.00 25.25 C ATOM 242 O LEU A 838 24.926 27.532 35.653 1.00 24.80 O ATOM 243 CB LEU A 838 24.899 26.540 32.815 1.00 25.70 C ATOM 244 CG LEU A 838 26.225 25.771 32.772 1.00 26.13 C ATOM 245 CD1 LEU A 838 26.005 24.263 32.725 1.00 25.75 C ATOM 246 CD2 LEU A 838 27.108 26.239 31.602 1.00 27.45 C ATOM 247 H LEU A 838 22.849 27.913 33.406 1.00 0.00 H ATOM 248 N CYS A 839 24.846 25.305 36.108 1.00 24.53 N ATOM 249 CA CYS A 839 25.528 25.321 37.387 1.00 26.03 C ATOM 250 C CYS A 839 26.605 24.232 37.451 1.00 26.64 C ATOM 251 O CYS A 839 26.549 23.229 36.767 1.00 25.78 O ATOM 252 CB CYS A 839 24.611 25.149 38.548 1.00 25.49 C ATOM 253 SG CYS A 839 23.277 26.359 38.638 1.00 27.37 S ATOM 254 H CYS A 839 24.447 24.401 35.784 1.00 0.00 H ATOM 255 N ARG A 840 27.601 24.429 38.316 1.00 27.61 N ATOM 256 CA ARG A 840 28.428 23.323 38.690 1.00 28.98 C ATOM 257 C ARG A 840 27.984 22.790 40.040 1.00 28.79 C ATOM 258 O ARG A 840 27.825 23.586 40.964 1.00 30.02 O ATOM 259 CB ARG A 840 29.892 23.800 38.794 1.00 31.36 C ATOM 260 CG ARG A 840 30.824 22.648 38.960 1.00 33.14 C ATOM 261 CD ARG A 840 32.209 23.154 39.321 1.00 36.17 C ATOM 262 NE ARG A 840 32.731 24.121 38.377 1.00 37.15 N ATOM 263 CZ ARG A 840 33.171 23.817 37.166 1.00 41.02 C ATOM 264 NH1 ARG A 840 33.186 22.544 36.734 1.00 42.33 N ATOM 265 NH2 ARG A 840 33.663 24.791 36.390 1.00 42.83 N ATOM 266 HE ARG A 840 32.762 25.119 38.670 1.00 0.00 H ATOM 267 HH12 ARG A 840 33.535 22.323 35.780 1.00 0.00 H ATOM 268 HH11 ARG A 840 32.849 21.780 37.354 1.00 0.00 H ATOM 269 HH22 ARG A 840 34.013 24.569 35.436 1.00 0.00 H ATOM 270 HH21 ARG A 840 33.695 25.769 36.741 1.00 0.00 H ATOM 271 H ARG A 840 27.774 25.374 38.713 1.00 0.00 H ATOM 272 N TYR A 841 27.855 21.459 40.208 1.00 28.81 N ATOM 273 CA TYR A 841 27.668 20.885 41.563 1.00 29.53 C ATOM 274 C TYR A 841 29.058 20.571 42.085 1.00 30.58 C ATOM 275 O TYR A 841 29.706 19.686 41.566 1.00 30.97 O ATOM 276 CB TYR A 841 26.776 19.599 41.597 1.00 29.81 C ATOM 277 CG TYR A 841 26.433 19.128 43.009 1.00 30.91 C ATOM 278 CD1 TYR A 841 25.831 19.993 43.889 1.00 31.89 C ATOM 279 CD2 TYR A 841 26.640 17.815 43.446 1.00 32.17 C ATOM 280 CE1 TYR A 841 25.460 19.616 45.178 1.00 33.26 C ATOM 281 CE2 TYR A 841 26.299 17.426 44.750 1.00 33.79 C ATOM 282 CZ TYR A 841 25.720 18.348 45.635 1.00 33.90 C ATOM 283 OH TYR A 841 25.298 18.094 46.969 1.00 34.88 O ATOM 284 HH TYR A 841 24.926 18.924 47.360 1.00 0.00 H ATOM 285 H TYR A 841 27.887 20.829 39.381 1.00 0.00 H ATOM 286 N ASP A 842 29.461 21.301 43.098 1.00 31.67 N ATOM 287 CA ASP A 842 30.876 21.325 43.495 1.00 33.91 C ATOM 288 C ASP A 842 30.957 21.133 45.003 1.00 35.98 C ATOM 289 O ASP A 842 31.308 22.059 45.716 1.00 37.47 O ATOM 290 CB ASP A 842 31.459 22.654 43.003 1.00 33.50 C ATOM 291 CG ASP A 842 32.954 22.670 43.031 1.00 34.92 C ATOM 292 OD1 ASP A 842 33.502 21.690 42.504 1.00 34.72 O ATOM 293 OD2 ASP A 842 33.535 23.655 43.545 1.00 36.08 O ATOM 294 H ASP A 842 28.770 21.870 43.627 1.00 0.00 H ATOM 295 N PRO A 843 30.624 19.916 45.501 1.00 37.69 N ATOM 296 CA PRO A 843 30.713 19.635 46.934 1.00 39.31 C ATOM 297 C PRO A 843 32.126 19.690 47.503 1.00 40.82 C ATOM 298 O PRO A 843 32.273 19.833 48.713 1.00 42.36 O ATOM 299 CB PRO A 843 30.141 18.218 47.050 1.00 39.66 C ATOM 300 CG PRO A 843 30.400 17.601 45.745 1.00 39.11 C ATOM 301 CD PRO A 843 30.265 18.702 44.740 1.00 38.38 C ATOM 302 N LEU A 844 33.160 19.615 46.655 1.00 41.74 N ATOM 303 CA LEU A 844 34.531 19.773 47.138 1.00 42.78 C ATOM 304 C LEU A 844 35.031 21.225 47.168 1.00 42.41 C ATOM 305 O LEU A 844 36.134 21.487 47.658 1.00 44.29 O ATOM 306 CB LEU A 844 35.480 18.919 46.302 1.00 44.24 C ATOM 307 CG LEU A 844 35.110 17.440 46.189 1.00 44.93 C ATOM 308 CD1 LEU A 844 36.032 16.760 45.179 1.00 46.32 C ATOM 309 CD2 LEU A 844 35.178 16.770 47.546 1.00 46.55 C ATOM 310 H LEU A 844 32.986 19.443 45.644 1.00 0.00 H ATOM 311 N GLY A 845 34.274 22.150 46.603 1.00 40.09 N ATOM 312 CA GLY A 845 34.567 23.570 46.656 1.00 40.52 C ATOM 313 C GLY A 845 35.726 24.042 45.779 1.00 42.00 C ATOM 314 O GLY A 845 36.084 25.222 45.844 1.00 44.67 O ATOM 315 H GLY A 845 33.422 21.843 46.092 1.00 0.00 H ATOM 316 N ASP A 846 36.296 23.152 44.962 1.00 41.19 N ATOM 317 CA ASP A 846 37.553 23.432 44.216 1.00 41.91 C ATOM 318 C ASP A 846 37.312 23.610 42.731 1.00 41.73 C ATOM 319 O ASP A 846 38.219 23.535 41.946 1.00 41.85 O ATOM 320 CB ASP A 846 38.601 22.332 44.475 1.00 42.98 C ATOM 321 CG ASP A 846 38.158 20.986 43.961 1.00 43.33 C ATOM 322 OD1 ASP A 846 36.991 20.873 43.476 1.00 41.29 O ATOM 323 OD2 ASP A 846 38.936 20.026 44.063 1.00 43.70 O ATOM 324 H ASP A 846 35.842 22.224 44.842 1.00 0.00 H ATOM 325 N ASN A 847 36.042 23.816 42.353 1.00 39.36 N ATOM 326 CA ASN A 847 35.602 23.964 40.974 1.00 39.97 C ATOM 327 C ASN A 847 35.821 22.781 40.019 1.00 39.02 C ATOM 328 O ASN A 847 35.834 22.964 38.803 1.00 41.13 O ATOM 329 CB ASN A 847 36.083 25.308 40.387 1.00 41.55 C ATOM 330 CG ASN A 847 35.456 26.513 41.088 1.00 42.69 C ATOM 331 OD1 ASN A 847 34.227 26.534 41.390 1.00 42.89 O ATOM 332 ND2 ASN A 847 36.276 27.512 41.385 1.00 44.92 N ATOM 333 HD22 ASN A 847 37.280 27.457 41.120 1.00 0.00 H ATOM 334 HD21 ASN A 847 35.915 28.350 41.883 1.00 0.00 H ATOM 335 H ASN A 847 35.320 23.874 43.099 1.00 0.00 H ATOM 336 N THR A 848 35.918 21.571 40.578 1.00 39.25 N ATOM 337 CA THR A 848 36.061 20.318 39.813 1.00 40.36 C ATOM 338 C THR A 848 34.768 19.504 39.639 1.00 40.52 C ATOM 339 O THR A 848 34.777 18.464 38.977 1.00 41.73 O ATOM 340 CB THR A 848 37.095 19.394 40.479 1.00 42.02 C ATOM 341 OG1 THR A 848 36.664 19.064 41.815 1.00 42.34 O ATOM 342 CG2 THR A 848 38.427 20.095 40.553 1.00 43.19 C ATOM 343 HG1 THR A 848 36.575 19.895 42.346 1.00 0.00 H ATOM 344 H THR A 848 35.891 21.509 41.616 1.00 0.00 H ATOM 345 N GLY A 849 33.683 19.946 40.258 1.00 38.42 N ATOM 346 CA GLY A 849 32.411 19.197 40.222 1.00 38.02 C ATOM 347 C GLY A 849 31.779 19.051 38.831 1.00 37.13 C ATOM 348 O GLY A 849 32.184 19.713 37.877 1.00 36.74 O ATOM 349 H GLY A 849 33.728 20.843 40.782 1.00 0.00 H ATOM 350 N ALA A 850 30.737 18.211 38.749 1.00 37.66 N ATOM 351 CA ALA A 850 29.941 18.043 37.507 1.00 36.15 C ATOM 352 C ALA A 850 29.096 19.269 37.179 1.00 33.31 C ATOM 353 O ALA A 850 28.554 19.916 38.081 1.00 33.08 O ATOM 354 CB ALA A 850 29.028 16.827 37.620 1.00 35.93 C ATOM 355 H ALA A 850 30.476 17.655 39.588 1.00 0.00 H ATOM 356 N LEU A 851 28.945 19.540 35.886 1.00 32.67 N ATOM 357 CA LEU A 851 27.989 20.536 35.415 1.00 31.84 C ATOM 358 C LEU A 851 26.576 19.910 35.291 1.00 30.35 C ATOM 359 O LEU A 851 26.419 18.735 34.930 1.00 30.57 O ATOM 360 CB LEU A 851 28.397 21.171 34.086 1.00 32.43 C ATOM 361 CG LEU A 851 29.781 21.838 34.027 1.00 34.09 C ATOM 362 CD1 LEU A 851 29.999 22.433 32.665 1.00 34.89 C ATOM 363 CD2 LEU A 851 29.905 22.960 35.039 1.00 33.72 C ATOM 364 H LEU A 851 29.525 19.028 35.191 1.00 0.00 H ATOM 365 N VAL A 852 25.602 20.701 35.697 1.00 27.88 N ATOM 366 CA VAL A 852 24.188 20.334 35.639 1.00 25.92 C ATOM 367 C VAL A 852 23.386 21.493 35.174 1.00 24.90 C ATOM 368 O VAL A 852 23.832 22.636 35.200 1.00 25.04 O ATOM 369 CB VAL A 852 23.655 19.881 36.997 1.00 26.72 C ATOM 370 CG1 VAL A 852 24.191 18.502 37.337 1.00 28.24 C ATOM 371 CG2 VAL A 852 24.043 20.887 38.102 1.00 26.82 C ATOM 372 H VAL A 852 25.853 21.635 36.079 1.00 0.00 H ATOM 373 N ALA A 853 22.184 21.198 34.691 1.00 23.73 N ATOM 374 CA ALA A 853 21.231 22.254 34.364 1.00 23.18 C ATOM 375 C ALA A 853 20.188 22.324 35.449 1.00 23.84 C ATOM 376 O ALA A 853 19.693 21.271 35.882 1.00 25.07 O ATOM 377 CB ALA A 853 20.571 21.943 33.048 1.00 23.11 C ATOM 378 H ALA A 853 21.919 20.203 34.544 1.00 0.00 H ATOM 379 N VAL A 854 19.834 23.529 35.910 1.00 22.94 N ATOM 380 CA VAL A 854 19.018 23.648 37.096 1.00 23.58 C ATOM 381 C VAL A 854 17.883 24.589 36.812 1.00 23.91 C ATOM 382 O VAL A 854 18.117 25.723 36.437 1.00 24.51 O ATOM 383 CB VAL A 854 19.834 24.185 38.298 1.00 24.06 C ATOM 384 CG1 VAL A 854 18.999 24.238 39.567 1.00 24.84 C ATOM 385 CG2 VAL A 854 21.016 23.288 38.549 1.00 24.93 C ATOM 386 H VAL A 854 20.148 24.386 35.411 1.00 0.00 H ATOM 387 N LYS A 855 16.644 24.116 36.987 1.00 23.60 N ATOM 388 CA LYS A 855 15.479 24.971 36.867 1.00 24.83 C ATOM 389 C LYS A 855 15.023 25.502 38.232 1.00 26.52 C ATOM 390 O LYS A 855 14.989 24.745 39.215 1.00 25.52 O ATOM 391 CB LYS A 855 14.345 24.189 36.182 1.00 24.59 C ATOM 392 CG LYS A 855 13.133 25.046 35.900 1.00 25.49 C ATOM 393 CD LYS A 855 12.062 24.391 35.050 1.00 25.85 C ATOM 394 CE LYS A 855 10.839 25.284 35.066 1.00 27.60 C ATOM 395 NZ LYS A 855 9.774 24.710 34.221 1.00 27.43 N ATOM 396 HZ1 LYS A 855 10.118 24.622 33.244 1.00 0.00 H ATOM 397 HZ2 LYS A 855 9.514 23.771 34.584 1.00 0.00 H ATOM 398 HZ3 LYS A 855 8.942 25.334 34.242 1.00 0.00 H ATOM 399 H LYS A 855 16.513 23.110 37.215 1.00 0.00 H ATOM 400 N GLN A 856 14.657 26.789 38.267 1.00 29.04 N ATOM 401 CA GLN A 856 14.005 27.415 39.439 1.00 32.24 C ATOM 402 C GLN A 856 12.956 28.402 38.960 1.00 33.51 C ATOM 403 O GLN A 856 12.980 28.827 37.815 1.00 31.34 O ATOM 404 CB GLN A 856 15.022 28.156 40.314 1.00 35.38 C ATOM 405 CG GLN A 856 16.058 28.959 39.513 1.00 38.69 C ATOM 406 CD GLN A 856 17.202 28.089 38.952 1.00 41.10 C ATOM 407 OE1 GLN A 856 17.941 27.416 39.712 1.00 46.11 O ATOM 408 NE2 GLN A 856 17.384 28.115 37.612 1.00 41.28 N ATOM 409 HE22 GLN A 856 16.753 28.684 37.012 1.00 0.00 H ATOM 410 HE21 GLN A 856 18.155 27.566 37.181 1.00 0.00 H ATOM 411 H GLN A 856 14.840 27.378 37.430 1.00 0.00 H ATOM 412 N LEU A 857 12.026 28.761 39.848 1.00 37.20 N ATOM 413 CA LEU A 857 10.964 29.706 39.495 1.00 39.76 C ATOM 414 C LEU A 857 11.282 31.165 39.841 1.00 44.05 C ATOM 415 O LEU A 857 12.069 31.425 40.720 1.00 45.41 O ATOM 416 CB LEU A 857 9.672 29.299 40.196 1.00 40.25 C ATOM 417 CG LEU A 857 9.225 27.853 40.026 1.00 39.98 C ATOM 418 CD1 LEU A 857 7.845 27.691 40.626 1.00 39.69 C ATOM 419 CD2 LEU A 857 9.211 27.452 38.560 1.00 40.26 C ATOM 420 H LEU A 857 12.056 28.362 40.808 1.00 0.00 H ATOM 421 N GLN A 858 10.644 32.092 39.117 1.00 48.36 N ATOM 422 CA GLN A 858 10.618 33.525 39.434 1.00 52.38 C ATOM 423 C GLN A 858 9.232 34.033 39.093 1.00 55.49 C ATOM 424 O GLN A 858 8.581 33.501 38.190 1.00 56.61 O ATOM 425 CB GLN A 858 11.584 34.353 38.596 1.00 53.35 C ATOM 426 CG GLN A 858 13.044 33.955 38.683 1.00 52.78 C ATOM 427 CD GLN A 858 13.468 33.001 37.583 1.00 52.17 C ATOM 428 OE1 GLN A 858 12.939 33.045 36.467 1.00 52.72 O ATOM 429 NE2 GLN A 858 14.429 32.125 37.891 1.00 51.15 N ATOM 430 HE22 GLN A 858 14.846 32.124 38.844 1.00 0.00 H ATOM 431 HE21 GLN A 858 14.760 31.444 37.178 1.00 0.00 H ATOM 432 H GLN A 858 10.130 31.775 38.270 1.00 0.00 H ATOM 433 N HIS A 859 8.804 35.095 39.763 1.00 60.69 N ATOM 434 CA HIS A 859 7.442 35.643 39.569 1.00 63.04 C ATOM 435 C HIS A 859 6.364 34.535 39.737 1.00 61.72 C ATOM 436 O HIS A 859 5.364 34.516 39.003 1.00 64.63 O ATOM 437 CB HIS A 859 7.305 36.318 38.173 1.00 64.93 C ATOM 438 CG HIS A 859 8.242 37.471 37.945 1.00 68.26 C ATOM 439 ND1 HIS A 859 9.297 37.412 37.055 1.00 69.56 N ATOM 440 CD2 HIS A 859 8.272 38.716 38.479 1.00 71.18 C ATOM 441 CE1 HIS A 859 9.940 38.568 37.056 1.00 70.17 C ATOM 442 NE2 HIS A 859 9.340 39.375 37.913 1.00 71.85 N ATOM 443 H HIS A 859 9.442 35.555 40.443 1.00 0.00 H ATOM 444 N SER A 860 6.564 33.625 40.695 1.00 57.17 N ATOM 445 CA SER A 860 5.709 32.449 40.813 1.00 53.99 C ATOM 446 C SER A 860 4.694 32.616 41.929 1.00 54.23 C ATOM 447 O SER A 860 5.034 33.005 43.052 1.00 55.55 O ATOM 448 CB SER A 860 6.542 31.192 41.064 1.00 51.84 C ATOM 449 OG SER A 860 6.744 30.979 42.453 1.00 51.75 O ATOM 450 HG SER A 860 5.867 30.872 42.900 1.00 0.00 H ATOM 451 H SER A 860 7.344 33.758 41.370 1.00 0.00 H ATOM 452 N GLY A 861 3.444 32.329 41.598 1.00 52.46 N ATOM 453 CA GLY A 861 2.404 32.164 42.578 1.00 52.10 C ATOM 454 C GLY A 861 2.197 30.699 42.885 1.00 49.01 C ATOM 455 O GLY A 861 3.028 29.854 42.536 1.00 48.03 O ATOM 456 H GLY A 861 3.205 32.219 40.592 1.00 0.00 H ATOM 457 N PRO A 862 1.071 30.377 43.518 1.00 47.89 N ATOM 458 CA PRO A 862 0.746 29.011 43.904 1.00 45.90 C ATOM 459 C PRO A 862 0.632 28.089 42.749 1.00 43.16 C ATOM 460 O PRO A 862 1.139 26.973 42.809 1.00 41.05 O ATOM 461 CB PRO A 862 -0.652 29.151 44.535 1.00 48.04 C ATOM 462 CG PRO A 862 -0.685 30.542 45.019 1.00 50.58 C ATOM 463 CD PRO A 862 0.076 31.343 44.024 1.00 49.80 C ATOM 464 N ASP A 863 -0.070 28.534 41.705 1.00 43.57 N ATOM 465 CA ASP A 863 -0.313 27.699 40.537 1.00 42.12 C ATOM 466 C ASP A 863 1.024 27.288 39.921 1.00 39.04 C ATOM 467 O ASP A 863 1.207 26.141 39.546 1.00 37.28 O ATOM 468 CB ASP A 863 -1.138 28.442 39.505 1.00 44.72 C ATOM 469 CG ASP A 863 -2.577 28.625 39.945 1.00 48.50 C ATOM 470 OD1 ASP A 863 -2.939 28.192 41.066 1.00 51.04 O ATOM 471 OD2 ASP A 863 -3.353 29.220 39.182 1.00 51.70 O ATOM 472 H ASP A 863 -0.453 29.501 41.726 1.00 0.00 H ATOM 473 N GLN A 864 1.939 28.245 39.829 1.00 38.56 N ATOM 474 CA GLN A 864 3.246 27.990 39.203 1.00 37.54 C ATOM 475 C GLN A 864 4.066 27.038 40.066 1.00 34.57 C ATOM 476 O GLN A 864 4.745 26.147 39.514 1.00 32.82 O ATOM 477 CB GLN A 864 4.023 29.282 38.947 1.00 39.28 C ATOM 478 CG GLN A 864 3.427 30.091 37.801 1.00 42.06 C ATOM 479 CD GLN A 864 2.197 30.863 38.229 1.00 45.09 C ATOM 480 OE1 GLN A 864 2.176 31.438 39.334 1.00 48.88 O ATOM 481 NE2 GLN A 864 1.144 30.868 37.385 1.00 47.41 N ATOM 482 HE22 GLN A 864 1.207 30.374 36.472 1.00 0.00 H ATOM 483 HE21 GLN A 864 0.269 31.366 37.648 1.00 0.00 H ATOM 484 H GLN A 864 1.729 29.191 40.206 1.00 0.00 H ATOM 485 N GLN A 865 3.986 27.202 41.389 1.00 34.66 N ATOM 486 CA GLN A 865 4.682 26.286 42.322 1.00 34.42 C ATOM 487 C GLN A 865 4.148 24.866 42.204 1.00 32.51 C ATOM 488 O GLN A 865 4.892 23.894 42.156 1.00 30.95 O ATOM 489 CB GLN A 865 4.599 26.806 43.757 1.00 37.31 C ATOM 490 CG GLN A 865 5.399 28.098 43.927 1.00 40.80 C ATOM 491 CD GLN A 865 4.999 28.940 45.123 1.00 45.31 C ATOM 492 OE1 GLN A 865 4.058 28.620 45.830 1.00 50.52 O ATOM 493 NE2 GLN A 865 5.701 30.057 45.326 1.00 48.22 N ATOM 494 HE22 GLN A 865 6.497 30.292 44.699 1.00 0.00 H ATOM 495 HE21 GLN A 865 5.452 30.692 46.111 1.00 0.00 H ATOM 496 H GLN A 865 3.424 27.989 41.772 1.00 0.00 H ATOM 497 N ARG A 866 2.835 24.762 42.118 1.00 32.70 N ATOM 498 CA ARG A 866 2.213 23.470 42.017 1.00 32.16 C ATOM 499 C ARG A 866 2.569 22.802 40.709 1.00 30.47 C ATOM 500 O ARG A 866 2.846 21.611 40.696 1.00 28.93 O ATOM 501 CB ARG A 866 0.714 23.601 42.152 1.00 33.67 C ATOM 502 CG ARG A 866 -0.041 22.305 41.973 1.00 34.01 C ATOM 503 CD ARG A 866 0.236 21.378 43.127 1.00 33.71 C ATOM 504 NE ARG A 866 -0.434 20.097 42.934 1.00 33.96 N ATOM 505 CZ ARG A 866 0.066 19.113 42.197 1.00 32.78 C ATOM 506 NH1 ARG A 866 1.254 19.256 41.565 1.00 31.20 N ATOM 507 NH2 ARG A 866 -0.556 17.966 42.167 1.00 33.68 N ATOM 508 HE ARG A 866 -1.352 19.947 43.399 1.00 0.00 H ATOM 509 HH12 ARG A 866 1.634 18.477 40.991 1.00 0.00 H ATOM 510 HH11 ARG A 866 1.787 20.145 41.654 1.00 0.00 H ATOM 511 HH22 ARG A 866 -0.178 17.184 41.595 1.00 0.00 H ATOM 512 HH21 ARG A 866 -1.430 17.834 42.715 1.00 0.00 H ATOM 513 H ARG A 866 2.247 25.620 42.123 1.00 0.00 H ATOM 514 N ASP A 867 2.529 23.550 39.603 1.00 30.95 N ATOM 515 CA ASP A 867 2.907 22.969 38.313 1.00 30.69 C ATOM 516 C ASP A 867 4.374 22.484 38.356 1.00 28.72 C ATOM 517 O ASP A 867 4.700 21.505 37.716 1.00 28.23 O ATOM 518 CB ASP A 867 2.743 23.972 37.168 1.00 32.46 C ATOM 519 CG ASP A 867 1.273 24.291 36.837 1.00 35.90 C ATOM 520 OD1 ASP A 867 0.372 23.584 37.297 1.00 35.86 O ATOM 521 OD2 ASP A 867 1.046 25.224 36.037 1.00 39.65 O ATOM 522 H ASP A 867 2.230 24.544 39.658 1.00 0.00 H ATOM 523 N PHE A 868 5.230 23.192 39.054 1.00 27.76 N ATOM 524 CA PHE A 868 6.698 22.832 39.118 1.00 27.01 C ATOM 525 C PHE A 868 6.896 21.542 39.908 1.00 26.68 C ATOM 526 O PHE A 868 7.639 20.659 39.488 1.00 24.93 O ATOM 527 CB PHE A 868 7.478 23.965 39.727 1.00 26.89 C ATOM 528 CG PHE A 868 8.987 23.803 39.624 1.00 26.48 C ATOM 529 CD1 PHE A 868 9.595 23.266 38.491 1.00 26.02 C ATOM 530 CD2 PHE A 868 9.787 24.201 40.664 1.00 27.14 C ATOM 531 CE1 PHE A 868 10.975 23.140 38.419 1.00 25.55 C ATOM 532 CE2 PHE A 868 11.170 24.077 40.578 1.00 26.67 C ATOM 533 CZ PHE A 868 11.743 23.549 39.479 1.00 25.38 C ATOM 534 H PHE A 868 4.890 24.024 39.578 1.00 0.00 H ATOM 535 N GLN A 869 6.119 21.369 40.983 1.00 27.86 N ATOM 536 CA GLN A 869 6.126 20.082 41.719 1.00 28.70 C ATOM 537 C GLN A 869 5.746 18.900 40.817 1.00 27.25 C ATOM 538 O GLN A 869 6.388 17.836 40.805 1.00 26.31 O ATOM 539 CB GLN A 869 5.157 20.172 42.885 1.00 31.57 C ATOM 540 CG GLN A 869 5.528 21.249 43.860 1.00 35.14 C ATOM 541 CD GLN A 869 4.613 21.290 45.060 1.00 38.62 C ATOM 542 OE1 GLN A 869 3.461 20.897 45.006 1.00 41.66 O ATOM 543 NE2 GLN A 869 5.165 21.741 46.176 1.00 43.73 N ATOM 544 HE22 GLN A 869 6.153 22.066 46.173 1.00 0.00 H ATOM 545 HE21 GLN A 869 4.611 21.770 47.055 1.00 0.00 H ATOM 546 H GLN A 869 5.505 22.144 41.305 1.00 0.00 H ATOM 547 N ARG A 870 4.730 19.144 40.001 1.00 26.29 N ATOM 548 CA ARG A 870 4.257 18.191 38.986 1.00 25.97 C ATOM 549 C ARG A 870 5.374 17.857 37.993 1.00 24.71 C ATOM 550 O ARG A 870 5.611 16.685 37.698 1.00 24.96 O ATOM 551 CB ARG A 870 3.032 18.782 38.243 1.00 26.47 C ATOM 552 CG ARG A 870 2.546 18.065 36.976 1.00 26.59 C ATOM 553 CD ARG A 870 1.605 18.938 36.122 1.00 27.21 C ATOM 554 NE ARG A 870 2.253 20.074 35.435 1.00 27.20 N ATOM 555 CZ ARG A 870 1.586 21.001 34.736 1.00 27.46 C ATOM 556 NH1 ARG A 870 2.227 21.989 34.126 1.00 27.14 N ATOM 557 NH2 ARG A 870 0.289 20.941 34.668 1.00 28.72 N ATOM 558 HE ARG A 870 3.288 20.159 35.498 1.00 0.00 H ATOM 559 HH12 ARG A 870 1.693 22.701 33.587 1.00 0.00 H ATOM 560 HH11 ARG A 870 3.263 22.052 34.186 1.00 0.00 H ATOM 561 HH22 ARG A 870 -0.237 21.657 34.127 1.00 0.00 H ATOM 562 HH21 ARG A 870 -0.222 20.177 35.154 1.00 0.00 H ATOM 563 H ARG A 870 4.241 20.058 40.083 1.00 0.00 H ATOM 564 N GLU A 871 5.985 18.883 37.441 1.00 23.47 N ATOM 565 CA GLU A 871 7.106 18.709 36.465 1.00 22.84 C ATOM 566 C GLU A 871 8.218 17.792 36.986 1.00 22.66 C ATOM 567 O GLU A 871 8.662 16.852 36.300 1.00 22.57 O ATOM 568 CB GLU A 871 7.697 20.077 36.112 1.00 22.34 C ATOM 569 CG GLU A 871 8.889 20.013 35.161 1.00 22.13 C ATOM 570 CD GLU A 871 9.352 21.359 34.710 1.00 22.56 C ATOM 571 OE1 GLU A 871 8.834 22.363 35.192 1.00 24.68 O ATOM 572 OE2 GLU A 871 10.237 21.416 33.809 1.00 24.17 O ATOM 573 H GLU A 871 5.679 19.845 37.691 1.00 0.00 H ATOM 574 N ILE A 872 8.623 18.043 38.215 1.00 23.28 N ATOM 575 CA ILE A 872 9.621 17.225 38.885 1.00 23.19 C ATOM 576 C ILE A 872 9.182 15.754 38.999 1.00 23.92 C ATOM 577 O ILE A 872 9.959 14.847 38.668 1.00 23.83 O ATOM 578 CB ILE A 872 9.952 17.839 40.292 1.00 24.07 C ATOM 579 CG1 ILE A 872 10.567 19.241 40.156 1.00 23.70 C ATOM 580 CG2 ILE A 872 10.818 16.899 41.099 1.00 24.38 C ATOM 581 CD1 ILE A 872 10.527 20.037 41.436 1.00 24.40 C ATOM 582 H ILE A 872 8.215 18.854 38.723 1.00 0.00 H ATOM 583 N GLN A 873 7.967 15.494 39.460 1.00 24.39 N ATOM 584 CA GLN A 873 7.511 14.127 39.628 1.00 26.21 C ATOM 585 C GLN A 873 7.410 13.375 38.286 1.00 25.89 C ATOM 586 O GLN A 873 7.746 12.198 38.189 1.00 26.88 O ATOM 587 CB GLN A 873 6.154 14.070 40.375 1.00 28.68 C ATOM 588 CG GLN A 873 6.188 14.512 41.842 1.00 30.69 C ATOM 589 CD GLN A 873 7.268 13.820 42.657 1.00 32.17 C ATOM 590 OE1 GLN A 873 8.105 14.456 43.353 1.00 34.81 O ATOM 591 NE2 GLN A 873 7.302 12.509 42.535 1.00 34.59 N ATOM 592 HE22 GLN A 873 6.592 12.023 41.951 1.00 0.00 H ATOM 593 HE21 GLN A 873 8.039 11.960 43.023 1.00 0.00 H ATOM 594 H GLN A 873 7.332 16.280 39.705 1.00 0.00 H ATOM 595 N ILE A 874 6.942 14.064 37.261 1.00 24.29 N ATOM 596 CA ILE A 874 6.868 13.460 35.954 1.00 23.62 C ATOM 597 C ILE A 874 8.301 13.112 35.469 1.00 23.21 C ATOM 598 O ILE A 874 8.571 11.974 35.067 1.00 24.19 O ATOM 599 CB ILE A 874 6.171 14.411 34.960 1.00 23.02 C ATOM 600 CG1 ILE A 874 4.696 14.476 35.318 1.00 23.43 C ATOM 601 CG2 ILE A 874 6.348 13.874 33.544 1.00 22.89 C ATOM 602 CD1 ILE A 874 3.874 15.476 34.510 1.00 23.24 C ATOM 603 H ILE A 874 6.626 15.045 37.397 1.00 0.00 H ATOM 604 N LEU A 875 9.170 14.078 35.473 1.00 22.25 N ATOM 605 CA LEU A 875 10.514 13.862 34.845 1.00 22.50 C ATOM 606 C LEU A 875 11.316 12.807 35.594 1.00 23.30 C ATOM 607 O LEU A 875 12.031 11.977 34.969 1.00 24.18 O ATOM 608 CB LEU A 875 11.253 15.157 34.742 1.00 22.82 C ATOM 609 CG LEU A 875 12.443 15.062 33.814 1.00 23.29 C ATOM 610 CD1 LEU A 875 12.001 14.891 32.378 1.00 23.12 C ATOM 611 CD2 LEU A 875 13.301 16.314 33.970 1.00 24.31 C ATOM 612 H LEU A 875 8.935 14.993 35.908 1.00 0.00 H ATOM 613 N LYS A 876 11.205 12.813 36.918 1.00 23.34 N ATOM 614 CA LYS A 876 11.883 11.803 37.717 1.00 24.36 C ATOM 615 C LYS A 876 11.464 10.383 37.380 1.00 24.87 C ATOM 616 O LYS A 876 12.251 9.448 37.502 1.00 25.23 O ATOM 617 CB LYS A 876 11.669 12.125 39.204 1.00 25.79 C ATOM 618 CG LYS A 876 12.152 11.102 40.170 1.00 28.42 C ATOM 619 CD LYS A 876 11.849 11.547 41.593 1.00 30.25 C ATOM 620 CE LYS A 876 12.195 10.392 42.511 1.00 33.51 C ATOM 621 NZ LYS A 876 12.022 10.750 43.930 1.00 36.42 N ATOM 622 HZ1 LYS A 876 12.644 11.550 44.163 1.00 0.00 H ATOM 623 HZ2 LYS A 876 11.032 11.018 44.100 1.00 0.00 H ATOM 624 HZ3 LYS A 876 12.269 9.933 44.525 1.00 0.00 H ATOM 625 H LYS A 876 10.631 13.543 37.386 1.00 0.00 H ATOM 626 N ALA A 877 10.199 10.188 36.984 1.00 24.02 N ATOM 627 CA ALA A 877 9.722 8.859 36.658 1.00 25.38 C ATOM 628 C ALA A 877 10.074 8.332 35.276 1.00 25.69 C ATOM 629 O ALA A 877 9.848 7.168 34.996 1.00 27.77 O ATOM 630 CB ALA A 877 8.197 8.826 36.798 1.00 25.70 C ATOM 631 H ALA A 877 9.552 10.999 36.910 1.00 0.00 H ATOM 632 N LEU A 878 10.495 9.200 34.364 1.00 25.04 N ATOM 633 CA LEU A 878 10.758 8.829 32.996 1.00 25.49 C ATOM 634 C LEU A 878 12.196 8.320 32.770 1.00 26.11 C ATOM 635 O LEU A 878 13.152 8.944 33.246 1.00 26.98 O ATOM 636 CB LEU A 878 10.472 10.011 32.085 1.00 24.72 C ATOM 637 CG LEU A 878 9.069 10.628 32.208 1.00 24.69 C ATOM 638 CD1 LEU A 878 8.993 11.867 31.358 1.00 24.21 C ATOM 639 CD2 LEU A 878 7.938 9.674 31.915 1.00 25.91 C ATOM 640 H LEU A 878 10.641 10.190 34.648 1.00 0.00 H ATOM 641 N HIS A 879 12.327 7.188 32.088 1.00 27.44 N ATOM 642 CA HIS A 879 13.638 6.586 31.784 1.00 28.96 C ATOM 643 C HIS A 879 13.657 6.200 30.347 1.00 28.05 C ATOM 644 O HIS A 879 13.296 5.084 29.957 1.00 29.80 O ATOM 645 CB HIS A 879 13.973 5.398 32.719 1.00 31.70 C ATOM 646 CG HIS A 879 13.894 5.763 34.163 1.00 33.80 C ATOM 647 ND1 HIS A 879 12.763 5.543 34.923 1.00 35.95 N ATOM 648 CD2 HIS A 879 14.777 6.382 34.977 1.00 34.72 C ATOM 649 CE1 HIS A 879 12.949 6.014 36.139 1.00 35.24 C ATOM 650 NE2 HIS A 879 14.169 6.513 36.205 1.00 36.08 N ATOM 651 H HIS A 879 11.468 6.706 31.754 1.00 0.00 H ATOM 652 N SER A 880 14.004 7.167 29.525 1.00 25.91 N ATOM 653 CA SER A 880 14.109 6.955 28.094 1.00 25.60 C ATOM 654 C SER A 880 15.378 7.570 27.616 1.00 25.19 C ATOM 655 O SER A 880 15.698 8.655 28.038 1.00 23.96 O ATOM 656 CB SER A 880 12.945 7.661 27.368 1.00 24.35 C ATOM 657 OG SER A 880 13.041 7.622 25.972 1.00 24.35 O ATOM 658 HG SER A 880 13.048 6.680 25.669 1.00 0.00 H ATOM 659 H SER A 880 14.209 8.110 29.912 1.00 0.00 H ATOM 660 N ASP A 881 16.018 6.923 26.649 1.00 26.66 N ATOM 661 CA ASP A 881 17.135 7.516 25.924 1.00 27.18 C ATOM 662 C ASP A 881 16.785 8.807 25.187 1.00 24.95 C ATOM 663 O ASP A 881 17.660 9.579 24.810 1.00 23.94 O ATOM 664 CB ASP A 881 17.643 6.524 24.890 1.00 30.47 C ATOM 665 CG ASP A 881 18.488 5.452 25.481 1.00 33.90 C ATOM 666 OD1 ASP A 881 18.872 5.512 26.683 1.00 36.25 O ATOM 667 OD2 ASP A 881 18.748 4.515 24.720 1.00 37.71 O ATOM 668 H ASP A 881 15.712 5.961 26.400 1.00 0.00 H ATOM 669 N PHE A 882 15.476 9.027 24.920 1.00 23.34 N ATOM 670 CA PHE A 882 15.002 10.192 24.196 1.00 21.93 C ATOM 671 C PHE A 882 14.303 11.251 25.044 1.00 20.69 C ATOM 672 O PHE A 882 13.654 12.125 24.469 1.00 19.51 O ATOM 673 CB PHE A 882 14.121 9.679 23.057 1.00 22.32 C ATOM 674 CG PHE A 882 14.807 8.604 22.271 1.00 23.79 C ATOM 675 CD1 PHE A 882 16.033 8.896 21.611 1.00 24.40 C ATOM 676 CD2 PHE A 882 14.366 7.288 22.314 1.00 25.04 C ATOM 677 CE1 PHE A 882 16.739 7.893 20.976 1.00 26.04 C ATOM 678 CE2 PHE A 882 15.046 6.302 21.642 1.00 26.49 C ATOM 679 CZ PHE A 882 16.216 6.608 20.956 1.00 27.14 C ATOM 680 H PHE A 882 14.778 8.329 25.249 1.00 0.00 H ATOM 681 N ILE A 883 14.528 11.227 26.357 1.00 20.41 N ATOM 682 CA ILE A 883 14.014 12.231 27.271 1.00 20.15 C ATOM 683 C ILE A 883 15.135 12.695 28.184 1.00 20.18 C ATOM 684 O ILE A 883 15.864 11.871 28.789 1.00 20.56 O ATOM 685 CB ILE A 883 12.794 11.673 28.053 1.00 20.61 C ATOM 686 CG1 ILE A 883 11.645 11.385 27.081 1.00 21.37 C ATOM 687 CG2 ILE A 883 12.332 12.639 29.148 1.00 20.07 C ATOM 688 CD1 ILE A 883 10.527 10.582 27.686 1.00 21.95 C ATOM 689 H ILE A 883 15.100 10.451 26.746 1.00 0.00 H ATOM 690 N VAL A 884 15.252 13.989 28.335 1.00 19.52 N ATOM 691 CA VAL A 884 16.325 14.562 29.200 1.00 20.09 C ATOM 692 C VAL A 884 16.307 13.916 30.580 1.00 21.31 C ATOM 693 O VAL A 884 15.228 13.696 31.177 1.00 21.63 O ATOM 694 CB VAL A 884 16.202 16.087 29.274 1.00 19.76 C ATOM 695 CG1 VAL A 884 14.944 16.524 30.019 1.00 19.41 C ATOM 696 CG2 VAL A 884 17.437 16.744 29.852 1.00 19.96 C ATOM 697 H VAL A 884 14.590 14.626 27.847 1.00 0.00 H ATOM 698 N LYS A 885 17.498 13.619 31.091 1.00 22.38 N ATOM 699 CA LYS A 885 17.616 12.931 32.367 1.00 24.25 C ATOM 700 C LYS A 885 17.419 13.808 33.572 1.00 23.34 C ATOM 701 O LYS A 885 18.052 14.884 33.718 1.00 22.73 O ATOM 702 CB LYS A 885 18.992 12.283 32.493 1.00 27.24 C ATOM 703 CG LYS A 885 19.107 10.938 31.876 1.00 31.46 C ATOM 704 CD LYS A 885 20.157 10.106 32.667 1.00 35.56 C ATOM 705 CE LYS A 885 20.277 8.726 32.066 1.00 39.95 C ATOM 706 NZ LYS A 885 21.128 8.711 30.846 1.00 43.06 N ATOM 707 HZ1 LYS A 885 20.714 9.340 30.128 1.00 0.00 H ATOM 708 HZ2 LYS A 885 22.084 9.041 31.088 1.00 0.00 H ATOM 709 HZ3 LYS A 885 21.179 7.742 30.472 1.00 0.00 H ATOM 710 H LYS A 885 18.359 13.883 30.570 1.00 0.00 H ATOM 711 N TYR A 886 16.519 13.376 34.454 1.00 22.98 N ATOM 712 CA TYR A 886 16.423 13.910 35.799 1.00 22.80 C ATOM 713 C TYR A 886 17.626 13.472 36.626 1.00 23.60 C ATOM 714 O TYR A 886 18.042 12.306 36.548 1.00 23.72 O ATOM 715 CB TYR A 886 15.167 13.340 36.453 1.00 23.08 C ATOM 716 CG TYR A 886 15.009 13.560 37.930 1.00 23.23 C ATOM 717 CD1 TYR A 886 14.394 14.685 38.416 1.00 23.03 C ATOM 718 CD2 TYR A 886 15.417 12.579 38.843 1.00 24.55 C ATOM 719 CE1 TYR A 886 14.225 14.887 39.793 1.00 23.80 C ATOM 720 CE2 TYR A 886 15.246 12.759 40.219 1.00 24.61 C ATOM 721 CZ TYR A 886 14.615 13.913 40.666 1.00 24.32 C ATOM 722 OH TYR A 886 14.440 14.128 42.001 1.00 25.91 O ATOM 723 HH TYR A 886 13.977 14.992 42.137 1.00 0.00 H ATOM 724 H TYR A 886 15.859 12.626 34.167 1.00 0.00 H ATOM 725 N ARG A 887 18.156 14.390 37.419 1.00 23.82 N ATOM 726 CA ARG A 887 19.242 14.064 38.335 1.00 25.60 C ATOM 727 C ARG A 887 18.806 14.129 39.772 1.00 24.96 C ATOM 728 O ARG A 887 19.245 13.322 40.590 1.00 26.22 O ATOM 729 CB ARG A 887 20.428 14.985 38.063 1.00 27.14 C ATOM 730 CG ARG A 887 21.066 14.740 36.712 1.00 29.47 C ATOM 731 CD ARG A 887 21.852 13.445 36.622 1.00 33.78 C ATOM 732 NE ARG A 887 22.848 13.453 37.705 1.00 40.15 N ATOM 733 CZ ARG A 887 23.729 12.501 38.002 1.00 45.32 C ATOM 734 NH1 ARG A 887 23.875 11.380 37.259 1.00 49.22 N ATOM 735 NH2 ARG A 887 24.492 12.701 39.073 1.00 47.23 N ATOM 736 HE ARG A 887 22.865 14.300 38.308 1.00 0.00 H ATOM 737 HH12 ARG A 887 24.578 10.664 37.531 1.00 0.00 H ATOM 738 HH11 ARG A 887 23.284 11.235 36.415 1.00 0.00 H ATOM 739 HH22 ARG A 887 25.197 11.988 39.350 1.00 0.00 H ATOM 740 HH21 ARG A 887 24.384 13.570 39.634 1.00 0.00 H ATOM 741 H ARG A 887 17.790 15.363 37.388 1.00 0.00 H ATOM 742 N GLY A 888 18.034 15.146 40.111 1.00 23.91 N ATOM 743 CA GLY A 888 17.634 15.351 41.499 1.00 24.23 C ATOM 744 C GLY A 888 17.006 16.698 41.736 1.00 23.48 C ATOM 745 O GLY A 888 16.550 17.361 40.813 1.00 22.76 O ATOM 746 H GLY A 888 17.707 15.809 39.379 1.00 0.00 H ATOM 747 N VAL A 889 16.894 17.045 43.003 1.00 24.15 N ATOM 748 CA VAL A 889 16.340 18.303 43.393 1.00 24.67 C ATOM 749 C VAL A 889 17.261 18.975 44.405 1.00 25.97 C ATOM 750 O VAL A 889 18.095 18.303 45.050 1.00 26.77 O ATOM 751 CB VAL A 889 14.916 18.162 44.076 1.00 25.66 C ATOM 752 CG1 VAL A 889 13.895 17.702 43.088 1.00 25.69 C ATOM 753 CG2 VAL A 889 14.936 17.209 45.273 1.00 27.10 C ATOM 754 H VAL A 889 17.218 16.385 43.739 1.00 0.00 H ATOM 755 N SER A 890 17.078 20.284 44.553 1.00 26.91 N ATOM 756 CA SER A 890 17.678 21.034 45.636 1.00 29.93 C ATOM 757 C SER A 890 16.676 21.960 46.288 1.00 32.14 C ATOM 758 O SER A 890 15.660 22.272 45.711 1.00 30.93 O ATOM 759 CB SER A 890 18.881 21.856 45.132 1.00 31.26 C ATOM 760 OG SER A 890 19.582 22.449 46.218 1.00 34.37 O ATOM 761 HG SER A 890 19.913 21.739 46.823 1.00 0.00 H ATOM 762 H SER A 890 16.482 20.787 43.865 1.00 0.00 H ATOM 763 N TYR A 891 16.961 22.327 47.528 1.00 36.44 N ATOM 764 CA TYR A 891 16.125 23.254 48.294 1.00 44.17 C ATOM 765 C TYR A 891 17.082 24.213 48.973 1.00 50.10 C ATOM 766 O TYR A 891 17.987 23.765 49.655 1.00 51.43 O ATOM 767 CB TYR A 891 15.318 22.539 49.380 1.00 46.60 C ATOM 768 CG TYR A 891 14.698 21.234 48.996 1.00 48.14 C ATOM 769 CD1 TYR A 891 13.493 21.193 48.304 1.00 50.52 C ATOM 770 CD2 TYR A 891 15.299 20.026 49.344 1.00 50.48 C ATOM 771 CE1 TYR A 891 12.899 19.985 47.971 1.00 51.40 C ATOM 772 CE2 TYR A 891 14.731 18.817 49.007 1.00 50.66 C ATOM 773 CZ TYR A 891 13.530 18.797 48.322 1.00 52.64 C ATOM 774 OH TYR A 891 12.955 17.594 48.002 1.00 56.00 O ATOM 775 HH TYR A 891 12.107 17.754 47.517 1.00 0.00 H ATOM 776 H TYR A 891 17.815 21.940 47.977 1.00 0.00 H ATOM 777 N GLY A 892 16.934 25.516 48.750 1.00 57.72 N ATOM 778 CA GLY A 892 17.582 26.524 49.622 1.00 62.13 C ATOM 779 C GLY A 892 16.862 26.700 50.964 1.00 67.68 C ATOM 780 O GLY A 892 15.817 26.084 51.214 1.00 67.10 O ATOM 781 H GLY A 892 16.352 25.833 47.948 1.00 0.00 H ATOM 782 N PRO A 893 17.432 27.527 51.859 1.00 72.35 N ATOM 783 CA PRO A 893 16.629 27.984 52.992 1.00 73.14 C ATOM 784 C PRO A 893 15.538 28.934 52.517 1.00 73.06 C ATOM 785 O PRO A 893 15.679 29.554 51.456 1.00 70.51 O ATOM 786 CB PRO A 893 17.642 28.686 53.911 1.00 74.65 C ATOM 787 CG PRO A 893 18.837 28.965 53.070 1.00 75.57 C ATOM 788 CD PRO A 893 18.826 28.013 51.909 1.00 74.48 C ATOM 789 N GLY A 894 14.451 29.003 53.285 1.00 75.24 N ATOM 790 CA GLY A 894 13.313 29.869 52.977 1.00 77.02 C ATOM 791 C GLY A 894 12.191 29.219 52.178 1.00 77.85 C ATOM 792 O GLY A 894 12.352 28.133 51.599 1.00 77.63 O ATOM 793 H GLY A 894 14.410 28.415 54.142 1.00 0.00 H ATOM 794 N ARG A 895 11.044 29.902 52.166 1.00 80.60 N ATOM 795 CA ARG A 895 9.906 29.553 51.310 1.00 80.08 C ATOM 796 C ARG A 895 10.291 29.691 49.821 1.00 80.49 C ATOM 797 O ARG A 895 11.166 30.495 49.477 1.00 83.15 O ATOM 798 CB ARG A 895 8.706 30.458 51.645 1.00 77.59 C ATOM 799 H ARG A 895 10.953 30.724 52.796 1.00 0.00 H ATOM 800 N GLN A 896 9.649 28.895 48.956 1.00 79.75 N ATOM 801 CA GLN A 896 9.908 28.893 47.488 1.00 76.83 C ATOM 802 C GLN A 896 11.360 28.475 47.111 1.00 74.39 C ATOM 803 O GLN A 896 11.970 29.045 46.200 1.00 78.17 O ATOM 804 CB GLN A 896 9.550 30.258 46.869 1.00 74.99 C ATOM 805 H GLN A 896 8.930 28.242 49.329 1.00 0.00 H ATOM 806 N SER A 897 11.876 27.455 47.794 1.00 67.50 N ATOM 807 CA SER A 897 13.285 27.043 47.690 1.00 63.07 C ATOM 808 C SER A 897 13.621 25.998 46.585 1.00 55.53 C ATOM 809 O SER A 897 14.788 25.807 46.248 1.00 56.10 O ATOM 810 CB SER A 897 13.745 26.523 49.063 1.00 65.98 C ATOM 811 OG SER A 897 12.734 25.764 49.732 1.00 68.10 O ATOM 812 HG SER A 897 11.936 26.332 49.874 1.00 0.00 H ATOM 813 H SER A 897 11.252 26.923 48.433 1.00 0.00 H ATOM 814 N LEU A 898 12.604 25.376 46.000 1.00 48.81 N ATOM 815 CA LEU A 898 12.751 24.151 45.170 1.00 43.65 C ATOM 816 C LEU A 898 13.542 24.338 43.824 1.00 37.33 C ATOM 817 O LEU A 898 13.357 25.319 43.080 1.00 34.57 O ATOM 818 CB LEU A 898 11.341 23.621 44.924 1.00 45.32 C ATOM 819 CG LEU A 898 11.058 22.267 44.300 1.00 46.10 C ATOM 820 CD1 LEU A 898 11.802 21.204 45.068 1.00 45.76 C ATOM 821 CD2 LEU A 898 9.554 22.009 44.309 1.00 44.95 C ATOM 822 H LEU A 898 11.650 25.768 46.130 1.00 0.00 H ATOM 823 N ARG A 899 14.459 23.420 43.542 1.00 33.01 N ATOM 824 CA ARG A 899 15.165 23.435 42.257 1.00 31.50 C ATOM 825 C ARG A 899 15.169 22.041 41.670 1.00 27.49 C ATOM 826 O ARG A 899 15.346 21.086 42.384 1.00 27.22 O ATOM 827 CB ARG A 899 16.603 23.896 42.463 1.00 34.26 C ATOM 828 CG ARG A 899 16.709 25.330 42.950 1.00 39.17 C ATOM 829 CD ARG A 899 18.168 25.763 42.944 1.00 45.08 C ATOM 830 NE ARG A 899 18.370 27.126 43.406 1.00 53.35 N ATOM 831 CZ ARG A 899 19.559 27.731 43.482 1.00 61.00 C ATOM 832 NH1 ARG A 899 20.690 27.099 43.115 1.00 63.46 N ATOM 833 NH2 ARG A 899 19.623 28.988 43.923 1.00 64.64 N ATOM 834 HE ARG A 899 17.531 27.668 43.698 1.00 0.00 H ATOM 835 HH12 ARG A 899 21.605 27.589 43.182 1.00 0.00 H ATOM 836 HH11 ARG A 899 20.649 26.121 42.764 1.00 0.00 H ATOM 837 HH22 ARG A 899 20.542 29.470 43.987 1.00 0.00 H ATOM 838 HH21 ARG A 899 18.754 29.486 44.203 1.00 0.00 H ATOM 839 H ARG A 899 14.679 22.682 44.241 1.00 0.00 H ATOM 840 N LEU A 900 15.011 21.955 40.357 1.00 24.65 N ATOM 841 CA LEU A 900 15.089 20.715 39.608 1.00 22.61 C ATOM 842 C LEU A 900 16.449 20.633 38.911 1.00 22.16 C ATOM 843 O LEU A 900 16.752 21.485 38.104 1.00 21.74 O ATOM 844 CB LEU A 900 14.028 20.722 38.529 1.00 21.81 C ATOM 845 CG LEU A 900 14.031 19.724 37.377 1.00 21.39 C ATOM 846 CD1 LEU A 900 14.046 18.315 37.943 1.00 21.44 C ATOM 847 CD2 LEU A 900 12.852 19.970 36.441 1.00 21.94 C ATOM 848 H LEU A 900 14.819 22.831 39.831 1.00 0.00 H ATOM 849 N VAL A 901 17.170 19.583 39.194 1.00 21.73 N ATOM 850 CA VAL A 901 18.504 19.346 38.632 1.00 22.60 C ATOM 851 C VAL A 901 18.391 18.286 37.534 1.00 22.09 C ATOM 852 O VAL A 901 17.851 17.176 37.761 1.00 22.01 O ATOM 853 CB VAL A 901 19.509 18.885 39.688 1.00 23.60 C ATOM 854 CG1 VAL A 901 20.921 18.828 39.122 1.00 23.97 C ATOM 855 CG2 VAL A 901 19.510 19.775 40.940 1.00 24.21 C ATOM 856 H VAL A 901 16.779 18.878 39.851 1.00 0.00 H ATOM 857 N MET A 902 18.925 18.619 36.357 1.00 22.48 N ATOM 858 CA MET A 902 18.892 17.764 35.165 1.00 22.12 C ATOM 859 C MET A 902 20.336 17.683 34.602 1.00 21.54 C ATOM 860 O MET A 902 21.191 18.524 34.897 1.00 20.94 O ATOM 861 CB MET A 902 18.000 18.369 34.097 1.00 23.04 C ATOM 862 CG MET A 902 16.511 18.476 34.479 1.00 23.63 C ATOM 863 SD MET A 902 15.534 19.501 33.423 1.00 25.37 S ATOM 864 CE MET A 902 16.003 21.131 33.998 1.00 26.71 C ATOM 865 H MET A 902 19.395 19.544 36.280 1.00 0.00 H ATOM 866 N GLU A 903 20.532 16.668 33.782 1.00 20.70 N ATOM 867 CA GLU A 903 21.724 16.602 32.994 1.00 20.82 C ATOM 868 C GLU A 903 21.878 17.869 32.125 1.00 20.53 C ATOM 869 O GLU A 903 20.912 18.448 31.639 1.00 20.33 O ATOM 870 CB GLU A 903 21.746 15.317 32.180 1.00 21.39 C ATOM 871 CG GLU A 903 20.836 15.320 30.984 1.00 21.80 C ATOM 872 CD GLU A 903 20.959 14.066 30.123 1.00 22.58 C ATOM 873 OE1 GLU A 903 22.056 13.495 29.980 1.00 25.41 O ATOM 874 OE2 GLU A 903 19.900 13.650 29.558 1.00 22.83 O ATOM 875 H GLU A 903 19.819 15.915 33.708 1.00 0.00 H ATOM 876 N TYR A 904 23.128 18.234 31.856 1.00 20.73 N ATOM 877 CA TYR A 904 23.423 19.382 31.009 1.00 20.75 C ATOM 878 C TYR A 904 23.918 18.802 29.687 1.00 20.78 C ATOM 879 O TYR A 904 24.919 18.000 29.664 1.00 20.41 O ATOM 880 CB TYR A 904 24.580 20.196 31.646 1.00 21.95 C ATOM 881 CG TYR A 904 25.140 21.276 30.743 1.00 22.59 C ATOM 882 CD1 TYR A 904 24.340 22.236 30.104 1.00 23.05 C ATOM 883 CD2 TYR A 904 26.546 21.350 30.554 1.00 23.45 C ATOM 884 CE1 TYR A 904 24.898 23.200 29.247 1.00 24.17 C ATOM 885 CE2 TYR A 904 27.083 22.314 29.744 1.00 24.72 C ATOM 886 CZ TYR A 904 26.310 23.238 29.129 1.00 25.06 C ATOM 887 OH TYR A 904 26.930 24.178 28.326 1.00 27.94 O ATOM 888 HH TYR A 904 26.248 24.785 27.944 1.00 0.00 H ATOM 889 H TYR A 904 23.914 17.686 32.260 1.00 0.00 H ATOM 890 N LEU A 905 23.352 19.276 28.599 1.00 20.15 N ATOM 891 CA LEU A 905 23.776 18.843 27.261 1.00 20.67 C ATOM 892 C LEU A 905 24.359 20.047 26.521 1.00 20.86 C ATOM 893 O LEU A 905 23.632 20.888 26.020 1.00 20.45 O ATOM 894 CB LEU A 905 22.594 18.199 26.529 1.00 20.44 C ATOM 895 CG LEU A 905 22.233 16.855 27.163 1.00 20.39 C ATOM 896 CD1 LEU A 905 20.943 16.258 26.634 1.00 20.22 C ATOM 897 CD2 LEU A 905 23.383 15.861 27.060 1.00 20.82 C ATOM 898 H LEU A 905 22.586 19.974 28.688 1.00 0.00 H ATOM 899 N PRO A 906 25.736 20.150 26.472 1.00 21.19 N ATOM 900 CA PRO A 906 26.336 21.405 25.979 1.00 21.77 C ATOM 901 C PRO A 906 26.119 21.718 24.506 1.00 22.25 C ATOM 902 O PRO A 906 26.278 22.865 24.094 1.00 23.78 O ATOM 903 CB PRO A 906 27.832 21.246 26.316 1.00 22.12 C ATOM 904 CG PRO A 906 28.037 19.808 26.363 1.00 22.05 C ATOM 905 CD PRO A 906 26.783 19.243 26.950 1.00 21.50 C ATOM 906 N SER A 907 25.697 20.756 23.740 1.00 22.27 N ATOM 907 CA SER A 907 25.412 21.017 22.321 1.00 22.46 C ATOM 908 C SER A 907 24.128 21.830 22.147 1.00 22.42 C ATOM 909 O SER A 907 23.909 22.342 21.058 1.00 23.94 O ATOM 910 CB SER A 907 25.341 19.715 21.534 1.00 22.55 C ATOM 911 OG SER A 907 26.635 19.126 21.447 1.00 24.35 O ATOM 912 HG SER A 907 27.251 19.751 20.988 1.00 0.00 H ATOM 913 H SER A 907 25.561 19.802 24.131 1.00 0.00 H ATOM 914 N GLY A 908 23.314 21.964 23.200 1.00 21.63 N ATOM 915 CA GLY A 908 22.188 22.881 23.200 1.00 21.50 C ATOM 916 C GLY A 908 20.989 22.362 22.441 1.00 21.26 C ATOM 917 O GLY A 908 20.824 21.152 22.250 1.00 20.25 O ATOM 918 H GLY A 908 23.494 21.391 24.049 1.00 0.00 H ATOM 919 N CYS A 909 20.117 23.282 22.029 1.00 21.49 N ATOM 920 CA CYS A 909 18.869 22.864 21.449 1.00 21.08 C ATOM 921 C CYS A 909 18.972 22.561 19.966 1.00 21.45 C ATOM 922 O CYS A 909 19.843 23.062 19.257 1.00 21.06 O ATOM 923 CB CYS A 909 17.791 23.913 21.715 1.00 20.83 C ATOM 924 SG CYS A 909 17.888 25.306 20.616 1.00 21.21 S ATOM 925 H CYS A 909 20.337 24.294 22.126 1.00 0.00 H ATOM 926 N LEU A 910 18.017 21.764 19.508 1.00 20.55 N ATOM 927 CA LEU A 910 17.984 21.324 18.137 1.00 20.62 C ATOM 928 C LEU A 910 17.758 22.506 17.189 1.00 20.44 C ATOM 929 O LEU A 910 18.293 22.537 16.118 1.00 20.14 O ATOM 930 CB LEU A 910 16.892 20.274 18.014 1.00 21.30 C ATOM 931 CG LEU A 910 16.672 19.694 16.619 1.00 22.90 C ATOM 932 CD1 LEU A 910 17.907 18.999 16.110 1.00 24.49 C ATOM 933 CD2 LEU A 910 15.486 18.766 16.751 1.00 24.52 C ATOM 934 H LEU A 910 17.269 21.447 20.158 1.00 0.00 H ATOM 935 N ARG A 911 16.922 23.451 17.590 1.00 20.59 N ATOM 936 CA ARG A 911 16.637 24.610 16.768 1.00 21.74 C ATOM 937 C ARG A 911 17.933 25.330 16.380 1.00 22.08 C ATOM 938 O ARG A 911 18.139 25.595 15.218 1.00 22.26 O ATOM 939 CB ARG A 911 15.689 25.592 17.434 1.00 23.18 C ATOM 940 CG ARG A 911 15.431 26.857 16.602 1.00 25.79 C ATOM 941 CD ARG A 911 14.131 27.576 16.978 1.00 29.07 C ATOM 942 NE ARG A 911 13.903 28.724 16.084 1.00 33.38 N ATOM 943 CZ ARG A 911 14.405 29.939 16.286 1.00 37.19 C ATOM 944 NH1 ARG A 911 15.162 30.195 17.347 1.00 39.29 N ATOM 945 NH2 ARG A 911 14.159 30.924 15.424 1.00 40.61 N ATOM 946 HE ARG A 911 13.312 28.575 15.241 1.00 0.00 H ATOM 947 HH12 ARG A 911 15.548 31.150 17.492 1.00 0.00 H ATOM 948 HH11 ARG A 911 15.369 29.441 18.032 1.00 0.00 H ATOM 949 HH22 ARG A 911 14.556 31.871 15.590 1.00 0.00 H ATOM 950 HH21 ARG A 911 13.570 30.746 14.585 1.00 0.00 H ATOM 951 H ARG A 911 16.459 23.359 18.517 1.00 0.00 H ATOM 952 N ASP A 912 18.764 25.630 17.381 1.00 22.60 N ATOM 953 CA ASP A 912 20.045 26.328 17.145 1.00 23.96 C ATOM 954 C ASP A 912 21.018 25.431 16.379 1.00 23.41 C ATOM 955 O ASP A 912 21.710 25.913 15.491 1.00 23.27 O ATOM 956 CB ASP A 912 20.675 26.768 18.443 1.00 26.08 C ATOM 957 CG ASP A 912 19.964 27.908 19.124 1.00 28.47 C ATOM 958 OD1 ASP A 912 19.120 28.626 18.552 1.00 33.42 O ATOM 959 OD2 ASP A 912 20.248 28.058 20.348 1.00 32.78 O ATOM 960 H ASP A 912 18.503 25.366 18.352 1.00 0.00 H ATOM 961 N PHE A 913 21.038 24.141 16.695 1.00 22.98 N ATOM 962 CA PHE A 913 21.915 23.160 16.049 1.00 22.53 C ATOM 963 C PHE A 913 21.631 23.009 14.558 1.00 22.05 C ATOM 964 O PHE A 913 22.517 23.003 13.723 1.00 21.57 O ATOM 965 CB PHE A 913 21.796 21.826 16.763 1.00 23.05 C ATOM 966 CG PHE A 913 22.860 20.858 16.403 1.00 24.57 C ATOM 967 CD1 PHE A 913 24.030 20.841 17.124 1.00 25.48 C ATOM 968 CD2 PHE A 913 22.658 19.909 15.396 1.00 25.23 C ATOM 969 CE1 PHE A 913 25.024 19.909 16.814 1.00 25.92 C ATOM 970 CE2 PHE A 913 23.640 18.981 15.088 1.00 26.29 C ATOM 971 CZ PHE A 913 24.799 18.974 15.815 1.00 25.60 C ATOM 972 H PHE A 913 20.396 23.808 17.442 1.00 0.00 H ATOM 973 N LEU A 914 20.349 22.943 14.196 1.00 20.79 N ATOM 974 CA LEU A 914 19.987 22.878 12.822 1.00 21.15 C ATOM 975 C LEU A 914 20.366 24.109 12.016 1.00 22.00 C ATOM 976 O LEU A 914 20.801 23.979 10.883 1.00 23.32 O ATOM 977 CB LEU A 914 18.454 22.680 12.677 1.00 20.45 C ATOM 978 CG LEU A 914 17.934 21.347 13.101 1.00 20.52 C ATOM 979 CD1 LEU A 914 16.387 21.442 13.178 1.00 20.37 C ATOM 980 CD2 LEU A 914 18.328 20.212 12.208 1.00 21.41 C ATOM 981 H LEU A 914 19.607 22.939 14.925 1.00 0.00 H ATOM 982 N GLN A 915 20.204 25.293 12.590 1.00 22.92 N ATOM 983 CA GLN A 915 20.528 26.504 11.866 1.00 23.87 C ATOM 984 C GLN A 915 22.063 26.617 11.697 1.00 25.04 C ATOM 985 O GLN A 915 22.509 27.028 10.648 1.00 25.80 O ATOM 986 CB GLN A 915 20.065 27.723 12.593 1.00 25.59 C ATOM 987 CG GLN A 915 18.543 27.860 12.518 1.00 26.92 C ATOM 988 CD GLN A 915 18.087 29.016 13.311 1.00 30.97 C ATOM 989 OE1 GLN A 915 17.781 30.078 12.771 1.00 36.14 O ATOM 990 NE2 GLN A 915 18.088 28.862 14.603 1.00 34.07 N ATOM 991 HE22 GLN A 915 18.354 27.946 15.017 1.00 0.00 H ATOM 992 HE21 GLN A 915 17.823 29.655 15.221 1.00 0.00 H ATOM 993 H GLN A 915 19.843 25.352 13.564 1.00 0.00 H ATOM 994 N ARG A 916 22.777 26.303 12.752 1.00 25.19 N ATOM 995 CA ARG A 916 24.280 26.379 12.686 1.00 28.46 C ATOM 996 C ARG A 916 24.852 25.368 11.676 1.00 28.74 C ATOM 997 O ARG A 916 25.742 25.740 10.870 1.00 28.89 O ATOM 998 CB ARG A 916 24.848 26.192 14.066 1.00 31.02 C ATOM 999 CG ARG A 916 26.376 26.371 14.127 1.00 35.16 C ATOM 1000 CD ARG A 916 26.804 26.830 15.518 1.00 40.51 C ATOM 1001 NE ARG A 916 26.790 25.731 16.492 1.00 46.00 N ATOM 1002 CZ ARG A 916 27.144 25.820 17.787 1.00 50.71 C ATOM 1003 NH1 ARG A 916 27.504 26.976 18.350 1.00 51.65 N ATOM 1004 NH2 ARG A 916 27.060 24.734 18.547 1.00 53.30 N ATOM 1005 HE ARG A 916 26.478 24.800 16.150 1.00 0.00 H ATOM 1006 HH12 ARG A 916 27.771 27.004 19.355 1.00 0.00 H ATOM 1007 HH11 ARG A 916 27.517 27.848 17.784 1.00 0.00 H ATOM 1008 HH22 ARG A 916 27.328 24.780 19.551 1.00 0.00 H ATOM 1009 HH21 ARG A 916 26.726 23.838 18.138 1.00 0.00 H ATOM 1010 H ARG A 916 22.307 26.003 13.630 1.00 0.00 H ATOM 1011 N HIS A 917 24.393 24.112 11.695 1.00 27.46 N ATOM 1012 CA HIS A 917 25.010 23.015 10.905 1.00 27.71 C ATOM 1013 C HIS A 917 24.265 22.498 9.696 1.00 29.63 C ATOM 1014 O HIS A 917 24.589 21.430 9.167 1.00 30.38 O ATOM 1015 CB HIS A 917 25.261 21.854 11.840 1.00 27.28 C ATOM 1016 CG HIS A 917 26.095 22.231 13.020 1.00 28.44 C ATOM 1017 ND1 HIS A 917 27.371 22.744 12.881 1.00 29.30 N ATOM 1018 CD2 HIS A 917 25.850 22.196 14.349 1.00 28.29 C ATOM 1019 CE1 HIS A 917 27.871 23.006 14.073 1.00 30.02 C ATOM 1020 NE2 HIS A 917 26.978 22.662 14.981 1.00 29.81 N ATOM 1021 H HIS A 917 23.568 23.893 12.289 1.00 0.00 H ATOM 1022 N ARG A 918 23.260 23.229 9.269 1.00 31.07 N ATOM 1023 CA ARG A 918 22.418 22.813 8.148 1.00 34.21 C ATOM 1024 C ARG A 918 23.187 22.184 6.979 1.00 35.85 C ATOM 1025 O ARG A 918 22.837 21.094 6.490 1.00 36.03 O ATOM 1026 CB ARG A 918 21.761 24.049 7.636 1.00 36.45 C ATOM 1027 CG ARG A 918 21.119 23.830 6.311 1.00 42.02 C ATOM 1028 CD ARG A 918 20.321 25.020 5.971 1.00 44.01 C ATOM 1029 NE ARG A 918 19.660 24.746 4.716 1.00 48.55 N ATOM 1030 CZ ARG A 918 18.567 25.357 4.312 1.00 51.93 C ATOM 1031 NH1 ARG A 918 17.982 26.283 5.065 1.00 56.33 N ATOM 1032 NH2 ARG A 918 18.051 25.031 3.138 1.00 57.73 N ATOM 1033 HE ARG A 918 20.073 24.022 4.094 1.00 0.00 H ATOM 1034 HH12 ARG A 918 17.118 26.756 4.730 1.00 0.00 H ATOM 1035 HH11 ARG A 918 18.388 26.534 5.989 1.00 0.00 H ATOM 1036 HH22 ARG A 918 17.188 25.502 2.801 1.00 0.00 H ATOM 1037 HH21 ARG A 918 18.509 24.303 2.553 1.00 0.00 H ATOM 1038 H ARG A 918 23.057 24.132 9.743 1.00 0.00 H ATOM 1039 N ALA A 919 24.230 22.887 6.519 1.00 35.30 N ATOM 1040 CA ALA A 919 24.925 22.488 5.290 1.00 36.78 C ATOM 1041 C ALA A 919 25.519 21.080 5.377 1.00 36.51 C ATOM 1042 O ALA A 919 25.794 20.496 4.330 1.00 39.92 O ATOM 1043 CB ALA A 919 26.023 23.515 4.900 1.00 37.63 C ATOM 1044 H ALA A 919 24.552 23.727 7.040 1.00 0.00 H ATOM 1045 N ARG A 920 25.692 20.530 6.589 1.00 33.92 N ATOM 1046 CA ARG A 920 26.201 19.179 6.757 1.00 33.57 C ATOM 1047 C ARG A 920 25.277 18.144 7.412 1.00 32.52 C ATOM 1048 O ARG A 920 25.700 17.054 7.786 1.00 32.91 O ATOM 1049 CB ARG A 920 27.546 19.241 7.504 1.00 33.80 C ATOM 1050 CG ARG A 920 27.536 19.810 8.917 1.00 32.80 C ATOM 1051 CD ARG A 920 28.975 19.911 9.403 1.00 32.81 C ATOM 1052 NE ARG A 920 29.099 20.317 10.815 1.00 31.71 N ATOM 1053 CZ ARG A 920 28.916 19.491 11.846 1.00 31.61 C ATOM 1054 NH1 ARG A 920 28.534 18.227 11.635 1.00 31.72 N ATOM 1055 NH2 ARG A 920 29.074 19.930 13.100 1.00 31.00 N ATOM 1056 HE ARG A 920 29.344 21.307 11.019 1.00 0.00 H ATOM 1057 HH12 ARG A 920 28.392 17.585 12.441 1.00 0.00 H ATOM 1058 HH11 ARG A 920 28.379 17.886 10.665 1.00 0.00 H ATOM 1059 HH22 ARG A 920 28.930 19.281 13.900 1.00 0.00 H ATOM 1060 HH21 ARG A 920 29.341 20.920 13.275 1.00 0.00 H ATOM 1061 H ARG A 920 25.455 21.088 7.434 1.00 0.00 H ATOM 1062 N LEU A 921 24.006 18.460 7.551 1.00 30.99 N ATOM 1063 CA LEU A 921 23.082 17.517 8.145 1.00 30.34 C ATOM 1064 C LEU A 921 22.127 17.094 7.027 1.00 30.10 C ATOM 1065 O LEU A 921 21.285 17.903 6.590 1.00 31.36 O ATOM 1066 CB LEU A 921 22.320 18.196 9.272 1.00 29.54 C ATOM 1067 CG LEU A 921 23.072 18.706 10.480 1.00 29.21 C ATOM 1068 CD1 LEU A 921 22.121 19.497 11.345 1.00 28.56 C ATOM 1069 CD2 LEU A 921 23.696 17.552 11.260 1.00 29.42 C ATOM 1070 H LEU A 921 23.665 19.390 7.233 1.00 0.00 H ATOM 1071 N ASP A 922 22.195 15.833 6.625 1.00 29.59 N ATOM 1072 CA ASP A 922 21.453 15.376 5.456 1.00 30.00 C ATOM 1073 C ASP A 922 20.088 14.849 5.842 1.00 28.75 C ATOM 1074 O ASP A 922 19.751 14.778 7.043 1.00 26.27 O ATOM 1075 CB ASP A 922 22.271 14.368 4.623 1.00 31.69 C ATOM 1076 CG ASP A 922 22.538 13.073 5.336 1.00 32.60 C ATOM 1077 OD1 ASP A 922 22.008 12.846 6.438 1.00 31.47 O ATOM 1078 OD2 ASP A 922 23.329 12.256 4.775 1.00 34.46 O ATOM 1079 H ASP A 922 22.787 15.159 7.151 1.00 0.00 H ATOM 1080 N ALA A 923 19.280 14.490 4.826 1.00 28.09 N ATOM 1081 CA ALA A 923 17.928 14.000 5.074 1.00 28.13 C ATOM 1082 C ALA A 923 17.888 12.765 5.971 1.00 27.33 C ATOM 1083 O ALA A 923 16.980 12.662 6.797 1.00 27.31 O ATOM 1084 CB ALA A 923 17.205 13.718 3.766 1.00 28.97 C ATOM 1085 H ALA A 923 19.626 14.563 3.848 1.00 0.00 H ATOM 1086 N SER A 924 18.863 11.871 5.822 1.00 27.34 N ATOM 1087 CA SER A 924 18.961 10.673 6.671 1.00 27.35 C ATOM 1088 C SER A 924 19.065 11.078 8.143 1.00 26.01 C ATOM 1089 O SER A 924 18.336 10.538 9.006 1.00 24.93 O ATOM 1090 CB SER A 924 20.161 9.838 6.274 1.00 28.74 C ATOM 1091 OG SER A 924 20.227 8.611 6.991 1.00 29.93 O ATOM 1092 HG SER A 924 19.411 8.080 6.811 1.00 0.00 H ATOM 1093 H SER A 924 19.578 12.024 5.082 1.00 0.00 H ATOM 1094 N ARG A 925 19.907 12.066 8.418 1.00 24.78 N ATOM 1095 CA ARG A 925 20.078 12.535 9.791 1.00 24.85 C ATOM 1096 C ARG A 925 18.781 13.185 10.337 1.00 23.06 C ATOM 1097 O ARG A 925 18.435 12.958 11.470 1.00 22.51 O ATOM 1098 CB ARG A 925 21.213 13.539 9.881 1.00 26.26 C ATOM 1099 CG ARG A 925 21.475 14.047 11.267 1.00 26.81 C ATOM 1100 CD ARG A 925 21.783 12.928 12.250 1.00 28.79 C ATOM 1101 NE ARG A 925 22.915 12.134 11.766 1.00 31.93 N ATOM 1102 CZ ARG A 925 24.214 12.455 11.912 1.00 33.29 C ATOM 1103 NH1 ARG A 925 24.602 13.559 12.543 1.00 34.42 N ATOM 1104 NH2 ARG A 925 25.143 11.669 11.386 1.00 36.37 N ATOM 1105 HE ARG A 925 22.697 11.248 11.268 1.00 0.00 H ATOM 1106 HH12 ARG A 925 25.615 13.775 12.637 1.00 0.00 H ATOM 1107 HH11 ARG A 925 23.893 14.206 12.942 1.00 0.00 H ATOM 1108 HH22 ARG A 925 26.149 11.909 11.494 1.00 0.00 H ATOM 1109 HH21 ARG A 925 24.866 10.812 10.866 1.00 0.00 H ATOM 1110 H ARG A 925 20.450 12.510 7.650 1.00 0.00 H ATOM 1111 N LEU A 926 18.120 13.979 9.524 1.00 22.53 N ATOM 1112 CA LEU A 926 16.838 14.581 9.966 1.00 21.72 C ATOM 1113 C LEU A 926 15.812 13.466 10.217 1.00 21.77 C ATOM 1114 O LEU A 926 15.057 13.563 11.177 1.00 20.48 O ATOM 1115 CB LEU A 926 16.327 15.557 8.951 1.00 22.62 C ATOM 1116 CG LEU A 926 17.220 16.758 8.588 1.00 23.06 C ATOM 1117 CD1 LEU A 926 16.502 17.548 7.495 1.00 23.80 C ATOM 1118 CD2 LEU A 926 17.490 17.625 9.807 1.00 23.41 C ATOM 1119 H LEU A 926 18.494 14.184 8.575 1.00 0.00 H ATOM 1120 N LEU A 927 15.796 12.413 9.393 1.00 21.86 N ATOM 1121 CA LEU A 927 14.952 11.260 9.651 1.00 21.79 C ATOM 1122 C LEU A 927 15.267 10.545 10.976 1.00 21.22 C ATOM 1123 O LEU A 927 14.362 10.095 11.715 1.00 21.14 O ATOM 1124 CB LEU A 927 14.966 10.282 8.465 1.00 22.90 C ATOM 1125 CG LEU A 927 14.230 10.759 7.225 1.00 23.84 C ATOM 1126 CD1 LEU A 927 14.647 9.932 6.012 1.00 25.05 C ATOM 1127 CD2 LEU A 927 12.759 10.696 7.434 1.00 24.11 C ATOM 1128 H LEU A 927 16.402 12.420 8.548 1.00 0.00 H ATOM 1129 N LEU A 928 16.555 10.430 11.293 1.00 20.77 N ATOM 1130 CA LEU A 928 16.961 9.889 12.553 1.00 21.23 C ATOM 1131 C LEU A 928 16.434 10.701 13.683 1.00 20.27 C ATOM 1132 O LEU A 928 15.861 10.146 14.645 1.00 19.74 O ATOM 1133 CB LEU A 928 18.497 9.803 12.605 1.00 22.50 C ATOM 1134 CG LEU A 928 19.096 9.268 13.887 1.00 24.11 C ATOM 1135 CD1 LEU A 928 18.494 7.906 14.197 1.00 25.47 C ATOM 1136 CD2 LEU A 928 20.604 9.166 13.775 1.00 25.97 C ATOM 1137 H LEU A 928 17.278 10.739 10.613 1.00 0.00 H ATOM 1138 N TYR A 929 16.603 12.015 13.637 1.00 19.91 N ATOM 1139 CA TYR A 929 16.087 12.828 14.751 1.00 19.68 C ATOM 1140 C TYR A 929 14.578 12.658 14.879 1.00 19.44 C ATOM 1141 O TYR A 929 14.062 12.555 15.958 1.00 19.78 O ATOM 1142 CB TYR A 929 16.346 14.317 14.516 1.00 20.14 C ATOM 1143 CG TYR A 929 17.802 14.743 14.455 1.00 21.14 C ATOM 1144 CD1 TYR A 929 18.773 14.094 15.192 1.00 21.85 C ATOM 1145 CD2 TYR A 929 18.180 15.828 13.672 1.00 22.22 C ATOM 1146 CE1 TYR A 929 20.124 14.495 15.123 1.00 22.81 C ATOM 1147 CE2 TYR A 929 19.497 16.238 13.609 1.00 22.92 C ATOM 1148 CZ TYR A 929 20.441 15.583 14.360 1.00 23.49 C ATOM 1149 OH TYR A 929 21.765 15.989 14.251 1.00 25.30 O ATOM 1150 HH TYR A 929 22.329 15.433 14.844 1.00 0.00 H ATOM 1151 H TYR A 929 17.089 12.461 12.833 1.00 0.00 H ATOM 1152 N SER A 930 13.906 12.629 13.741 1.00 18.76 N ATOM 1153 CA SER A 930 12.414 12.431 13.692 1.00 18.94 C ATOM 1154 C SER A 930 11.988 11.167 14.400 1.00 18.59 C ATOM 1155 O SER A 930 11.038 11.187 15.179 1.00 18.05 O ATOM 1156 CB SER A 930 11.915 12.364 12.237 1.00 19.63 C ATOM 1157 OG SER A 930 12.178 13.572 11.578 1.00 21.13 O ATOM 1158 HG SER A 930 13.153 13.741 11.579 1.00 0.00 H ATOM 1159 H SER A 930 14.426 12.747 12.848 1.00 0.00 H ATOM 1160 N SER A 931 12.642 10.066 14.073 1.00 19.40 N ATOM 1161 CA SER A 931 12.380 8.765 14.665 1.00 20.09 C ATOM 1162 C SER A 931 12.632 8.812 16.177 1.00 19.43 C ATOM 1163 O SER A 931 11.833 8.271 16.923 1.00 19.18 O ATOM 1164 CB SER A 931 13.279 7.717 14.012 1.00 21.62 C ATOM 1165 OG SER A 931 13.242 6.470 14.683 1.00 24.40 O ATOM 1166 HG SER A 931 12.316 6.121 14.678 1.00 0.00 H ATOM 1167 H SER A 931 13.387 10.135 13.351 1.00 0.00 H ATOM 1168 N GLN A 932 13.742 9.434 16.613 1.00 18.60 N ATOM 1169 CA GLN A 932 14.064 9.516 18.052 1.00 18.38 C ATOM 1170 C GLN A 932 13.041 10.337 18.835 1.00 18.19 C ATOM 1171 O GLN A 932 12.595 9.926 19.917 1.00 18.15 O ATOM 1172 CB GLN A 932 15.457 10.047 18.266 1.00 18.74 C ATOM 1173 CG GLN A 932 16.515 9.124 17.726 1.00 19.42 C ATOM 1174 CD GLN A 932 17.897 9.710 17.862 1.00 20.02 C ATOM 1175 OE1 GLN A 932 18.078 10.937 18.045 1.00 21.03 O ATOM 1176 NE2 GLN A 932 18.915 8.837 17.701 1.00 20.22 N ATOM 1177 HE22 GLN A 932 18.715 7.827 17.552 1.00 0.00 H ATOM 1178 HE21 GLN A 932 19.898 9.175 17.726 1.00 0.00 H ATOM 1179 H GLN A 932 14.388 9.867 15.922 1.00 0.00 H ATOM 1180 N ILE A 933 12.612 11.446 18.258 1.00 17.86 N ATOM 1181 CA ILE A 933 11.620 12.284 18.929 1.00 17.22 C ATOM 1182 C ILE A 933 10.289 11.497 19.023 1.00 17.35 C ATOM 1183 O ILE A 933 9.650 11.528 20.050 1.00 17.15 O ATOM 1184 CB ILE A 933 11.435 13.606 18.175 1.00 17.29 C ATOM 1185 CG1 ILE A 933 12.749 14.437 18.215 1.00 17.60 C ATOM 1186 CG2 ILE A 933 10.302 14.505 18.764 1.00 17.22 C ATOM 1187 CD1 ILE A 933 12.800 15.497 17.190 1.00 17.71 C ATOM 1188 H ILE A 933 12.981 11.723 17.326 1.00 0.00 H ATOM 1189 N CYS A 934 9.884 10.849 17.919 1.00 17.47 N ATOM 1190 CA CYS A 934 8.705 9.983 17.950 1.00 17.94 C ATOM 1191 C CYS A 934 8.769 8.917 19.025 1.00 18.15 C ATOM 1192 O CYS A 934 7.801 8.713 19.774 1.00 17.91 O ATOM 1193 CB CYS A 934 8.507 9.344 16.566 1.00 18.71 C ATOM 1194 SG CYS A 934 6.843 8.612 16.441 1.00 19.33 S ATOM 1195 H CYS A 934 10.414 10.964 17.032 1.00 0.00 H ATOM 1196 N LYS A 935 9.942 8.284 19.189 1.00 18.32 N ATOM 1197 CA LYS A 935 10.071 7.242 20.213 1.00 19.33 C ATOM 1198 C LYS A 935 9.925 7.806 21.648 1.00 18.58 C ATOM 1199 O LYS A 935 9.314 7.220 22.533 1.00 18.46 O ATOM 1200 CB LYS A 935 11.427 6.525 20.068 1.00 20.59 C ATOM 1201 CG LYS A 935 11.382 5.534 18.918 1.00 22.49 C ATOM 1202 CD LYS A 935 12.699 4.802 18.720 1.00 24.14 C ATOM 1203 CE LYS A 935 12.685 4.041 17.440 1.00 26.63 C ATOM 1204 NZ LYS A 935 11.577 3.062 17.310 1.00 27.97 N ATOM 1205 HZ1 LYS A 935 11.644 2.361 18.075 1.00 0.00 H ATOM 1206 HZ2 LYS A 935 10.666 3.560 17.373 1.00 0.00 H ATOM 1207 HZ3 LYS A 935 11.647 2.581 16.391 1.00 0.00 H ATOM 1208 H LYS A 935 10.756 8.532 18.592 1.00 0.00 H ATOM 1209 N GLY A 936 10.472 9.000 21.862 1.00 18.16 N ATOM 1210 CA GLY A 936 10.278 9.668 23.123 1.00 17.69 C ATOM 1211 C GLY A 936 8.827 10.002 23.374 1.00 17.32 C ATOM 1212 O GLY A 936 8.354 9.831 24.492 1.00 17.20 O ATOM 1213 H GLY A 936 11.041 9.452 21.117 1.00 0.00 H ATOM 1214 N MET A 937 8.125 10.442 22.331 1.00 17.15 N ATOM 1215 CA MET A 937 6.658 10.776 22.470 1.00 17.44 C ATOM 1216 C MET A 937 5.866 9.506 22.681 1.00 17.91 C ATOM 1217 O MET A 937 4.836 9.498 23.425 1.00 18.13 O ATOM 1218 CB MET A 937 6.236 11.557 21.246 1.00 17.71 C ATOM 1219 CG MET A 937 6.779 12.975 21.153 1.00 17.89 C ATOM 1220 SD MET A 937 6.569 13.989 22.632 1.00 18.68 S ATOM 1221 CE MET A 937 4.811 14.191 22.609 1.00 18.56 C ATOM 1222 H MET A 937 8.593 10.557 21.409 1.00 0.00 H ATOM 1223 N GLU A 938 6.281 8.405 22.075 1.00 18.49 N ATOM 1224 CA GLU A 938 5.596 7.138 22.324 1.00 19.62 C ATOM 1225 C GLU A 938 5.717 6.742 23.796 1.00 19.81 C ATOM 1226 O GLU A 938 4.732 6.274 24.415 1.00 19.85 O ATOM 1227 CB GLU A 938 6.161 5.994 21.467 1.00 21.33 C ATOM 1228 CG GLU A 938 5.800 6.096 20.007 1.00 23.02 C ATOM 1229 CD GLU A 938 6.533 5.047 19.151 1.00 25.67 C ATOM 1230 OE1 GLU A 938 6.216 3.842 19.325 1.00 29.94 O ATOM 1231 OE2 GLU A 938 7.382 5.440 18.317 1.00 27.37 O ATOM 1232 H GLU A 938 7.091 8.441 21.424 1.00 0.00 H ATOM 1233 N TYR A 939 6.944 6.950 24.332 1.00 19.52 N ATOM 1234 CA TYR A 939 7.210 6.663 25.731 1.00 20.05 C ATOM 1235 C TYR A 939 6.312 7.500 26.648 1.00 19.56 C ATOM 1236 O TYR A 939 5.652 6.957 27.560 1.00 19.49 O ATOM 1237 CB TYR A 939 8.687 6.859 26.035 1.00 20.74 C ATOM 1238 CG TYR A 939 9.084 6.437 27.430 1.00 22.73 C ATOM 1239 CD1 TYR A 939 9.431 5.097 27.702 1.00 24.54 C ATOM 1240 CD2 TYR A 939 9.112 7.355 28.458 1.00 23.59 C ATOM 1241 CE1 TYR A 939 9.781 4.699 29.001 1.00 25.92 C ATOM 1242 CE2 TYR A 939 9.459 6.959 29.745 1.00 24.89 C ATOM 1243 CZ TYR A 939 9.806 5.643 29.989 1.00 25.73 C ATOM 1244 OH TYR A 939 10.183 5.292 31.272 1.00 26.79 O ATOM 1245 HH TYR A 939 10.402 4.327 31.298 1.00 0.00 H ATOM 1246 H TYR A 939 7.708 7.321 23.732 1.00 0.00 H ATOM 1247 N LEU A 940 6.228 8.790 26.350 1.00 18.59 N ATOM 1248 CA LEU A 940 5.319 9.691 27.100 1.00 18.98 C ATOM 1249 C LEU A 940 3.897 9.214 27.032 1.00 18.93 C ATOM 1250 O LEU A 940 3.195 9.248 28.019 1.00 19.23 O ATOM 1251 CB LEU A 940 5.386 11.153 26.600 1.00 18.79 C ATOM 1252 CG LEU A 940 6.748 11.806 26.836 1.00 19.14 C ATOM 1253 CD1 LEU A 940 6.723 13.258 26.415 1.00 19.62 C ATOM 1254 CD2 LEU A 940 7.054 11.687 28.319 1.00 19.23 C ATOM 1255 H LEU A 940 6.809 9.176 25.578 1.00 0.00 H ATOM 1256 N GLY A 941 3.455 8.893 25.824 1.00 19.68 N ATOM 1257 CA GLY A 941 2.090 8.422 25.644 1.00 20.05 C ATOM 1258 C GLY A 941 1.733 7.196 26.447 1.00 20.61 C ATOM 1259 O GLY A 941 0.590 7.100 26.984 1.00 20.33 O ATOM 1260 H GLY A 941 4.086 8.978 25.002 1.00 0.00 H ATOM 1261 N SER A 942 2.662 6.242 26.583 1.00 21.75 N ATOM 1262 CA SER A 942 2.433 5.070 27.383 1.00 22.93 C ATOM 1263 C SER A 942 2.284 5.369 28.878 1.00 22.66 C ATOM 1264 O SER A 942 1.721 4.547 29.585 1.00 23.60 O ATOM 1265 CB SER A 942 3.509 4.005 27.178 1.00 24.52 C ATOM 1266 OG SER A 942 4.731 4.401 27.786 1.00 27.44 O ATOM 1267 HG SER A 942 5.040 5.250 27.381 1.00 0.00 H ATOM 1268 H SER A 942 3.575 6.352 26.096 1.00 0.00 H ATOM 1269 N ARG A 943 2.724 6.542 29.324 1.00 21.87 N ATOM 1270 CA ARG A 943 2.617 6.995 30.669 1.00 22.08 C ATOM 1271 C ARG A 943 1.500 8.040 30.821 1.00 21.90 C ATOM 1272 O ARG A 943 1.414 8.732 31.853 1.00 21.73 O ATOM 1273 CB ARG A 943 3.984 7.585 31.092 1.00 24.11 C ATOM 1274 CG ARG A 943 4.877 6.619 31.779 1.00 26.91 C ATOM 1275 CD ARG A 943 5.514 5.706 30.835 1.00 29.49 C ATOM 1276 NE ARG A 943 6.338 4.723 31.559 1.00 32.37 N ATOM 1277 CZ ARG A 943 6.780 3.599 31.015 1.00 37.07 C ATOM 1278 NH1 ARG A 943 6.490 3.307 29.746 1.00 39.98 N ATOM 1279 NH2 ARG A 943 7.488 2.740 31.741 1.00 38.34 N ATOM 1280 HE ARG A 943 6.586 4.922 32.549 1.00 0.00 H ATOM 1281 HH12 ARG A 943 6.839 2.423 29.323 1.00 0.00 H ATOM 1282 HH11 ARG A 943 5.915 3.963 29.180 1.00 0.00 H ATOM 1283 HH22 ARG A 943 7.834 1.858 31.312 1.00 0.00 H ATOM 1284 HH21 ARG A 943 7.696 2.950 32.738 1.00 0.00 H ATOM 1285 H ARG A 943 3.181 7.176 28.638 1.00 0.00 H ATOM 1286 N ARG A 944 0.704 8.185 29.769 1.00 20.79 N ATOM 1287 CA ARG A 944 -0.459 9.124 29.723 1.00 21.48 C ATOM 1288 C ARG A 944 -0.031 10.557 29.923 1.00 20.34 C ATOM 1289 O ARG A 944 -0.731 11.353 30.515 1.00 20.09 O ATOM 1290 CB ARG A 944 -1.548 8.749 30.731 1.00 22.72 C ATOM 1291 CG ARG A 944 -1.992 7.326 30.610 1.00 24.26 C ATOM 1292 CD ARG A 944 -3.152 7.041 31.571 1.00 26.36 C ATOM 1293 NE ARG A 944 -4.360 7.800 31.179 1.00 26.06 N ATOM 1294 CZ ARG A 944 -5.199 7.537 30.153 1.00 27.82 C ATOM 1295 NH1 ARG A 944 -5.030 6.526 29.314 1.00 29.17 N ATOM 1296 NH2 ARG A 944 -6.224 8.347 29.915 1.00 27.06 N ATOM 1297 HE ARG A 944 -4.590 8.631 31.760 1.00 0.00 H ATOM 1298 HH12 ARG A 944 -5.709 6.372 28.542 1.00 0.00 H ATOM 1299 HH11 ARG A 944 -4.218 5.886 29.428 1.00 0.00 H ATOM 1300 HH22 ARG A 944 -6.872 8.148 29.126 1.00 0.00 H ATOM 1301 HH21 ARG A 944 -6.379 9.181 30.517 1.00 0.00 H ATOM 1302 H ARG A 944 0.901 7.610 28.925 1.00 0.00 H ATOM 1303 N CYS A 945 1.174 10.867 29.459 1.00 19.36 N ATOM 1304 CA CYS A 945 1.689 12.215 29.607 1.00 19.74 C ATOM 1305 C CYS A 945 1.525 13.010 28.317 1.00 19.10 C ATOM 1306 O CYS A 945 1.985 12.567 27.264 1.00 19.99 O ATOM 1307 CB CYS A 945 3.174 12.155 29.997 1.00 20.17 C ATOM 1308 SG CYS A 945 4.025 13.746 30.213 1.00 22.17 S ATOM 1309 H CYS A 945 1.750 10.141 28.988 1.00 0.00 H ATOM 1310 N VAL A 946 0.909 14.189 28.436 1.00 18.53 N ATOM 1311 CA VAL A 946 0.816 15.156 27.394 1.00 18.10 C ATOM 1312 C VAL A 946 1.970 16.186 27.596 1.00 17.91 C ATOM 1313 O VAL A 946 2.110 16.787 28.646 1.00 18.01 O ATOM 1314 CB VAL A 946 -0.559 15.841 27.397 1.00 18.35 C ATOM 1315 CG1 VAL A 946 -0.609 16.927 26.361 1.00 18.23 C ATOM 1316 CG2 VAL A 946 -1.681 14.827 27.168 1.00 18.96 C ATOM 1317 H VAL A 946 0.468 14.416 29.350 1.00 0.00 H ATOM 1318 N HIS A 947 2.795 16.367 26.587 1.00 17.65 N ATOM 1319 CA HIS A 947 3.961 17.246 26.720 1.00 17.39 C ATOM 1320 C HIS A 947 3.628 18.702 26.468 1.00 17.21 C ATOM 1321 O HIS A 947 4.098 19.568 27.192 1.00 16.72 O ATOM 1322 CB HIS A 947 5.052 16.770 25.752 1.00 17.83 C ATOM 1323 CG HIS A 947 6.330 17.519 25.887 1.00 18.10 C ATOM 1324 ND1 HIS A 947 6.552 18.703 25.232 1.00 18.32 N ATOM 1325 CD2 HIS A 947 7.407 17.330 26.683 1.00 18.45 C ATOM 1326 CE1 HIS A 947 7.747 19.178 25.554 1.00 18.52 C ATOM 1327 NE2 HIS A 947 8.271 18.389 26.467 1.00 17.93 N ATOM 1328 H HIS A 947 2.618 15.881 25.685 1.00 0.00 H ATOM 1329 N ARG A 948 2.839 18.956 25.403 1.00 17.35 N ATOM 1330 CA ARG A 948 2.277 20.264 25.042 1.00 18.35 C ATOM 1331 C ARG A 948 3.256 21.251 24.414 1.00 18.91 C ATOM 1332 O ARG A 948 2.943 21.846 23.352 1.00 19.89 O ATOM 1333 CB ARG A 948 1.486 20.907 26.217 1.00 19.41 C ATOM 1334 CG ARG A 948 1.007 22.289 25.946 1.00 20.33 C ATOM 1335 CD ARG A 948 0.030 22.751 27.029 1.00 21.73 C ATOM 1336 NE ARG A 948 -0.149 24.193 26.984 1.00 22.74 N ATOM 1337 CZ ARG A 948 -0.700 24.910 27.959 1.00 24.53 C ATOM 1338 NH1 ARG A 948 -1.180 24.321 29.014 1.00 24.92 N ATOM 1339 NH2 ARG A 948 -0.749 26.230 27.859 1.00 26.14 N ATOM 1340 HE ARG A 948 0.175 24.697 26.134 1.00 0.00 H ATOM 1341 HH12 ARG A 948 -1.610 24.885 29.774 1.00 0.00 H ATOM 1342 HH11 ARG A 948 -1.134 23.285 29.098 1.00 0.00 H ATOM 1343 HH22 ARG A 948 -1.179 26.794 28.620 1.00 0.00 H ATOM 1344 HH21 ARG A 948 -0.357 26.703 27.020 1.00 0.00 H ATOM 1345 H ARG A 948 2.608 18.154 24.782 1.00 0.00 H ATOM 1346 N ALA A 949 4.439 21.377 25.015 1.00 18.30 N ATOM 1347 CA ALA A 949 5.460 22.362 24.604 1.00 18.35 C ATOM 1348 C ALA A 949 6.301 21.975 23.436 1.00 18.83 C ATOM 1349 O ALA A 949 6.987 22.865 22.871 1.00 20.53 O ATOM 1350 CB ALA A 949 6.322 22.759 25.782 1.00 18.49 C ATOM 1351 H ALA A 949 4.654 20.749 25.815 1.00 0.00 H ATOM 1352 N LEU A 950 6.252 20.707 23.019 1.00 18.92 N ATOM 1353 CA LEU A 950 7.133 20.148 22.001 1.00 19.03 C ATOM 1354 C LEU A 950 7.399 21.075 20.826 1.00 18.64 C ATOM 1355 O LEU A 950 6.493 21.455 20.077 1.00 18.57 O ATOM 1356 CB LEU A 950 6.603 18.827 21.451 1.00 20.16 C ATOM 1357 CG LEU A 950 7.613 17.993 20.627 1.00 21.91 C ATOM 1358 CD1 LEU A 950 8.640 17.367 21.513 1.00 22.49 C ATOM 1359 CD2 LEU A 950 6.808 16.931 19.924 1.00 22.57 C ATOM 1360 H LEU A 950 5.541 20.080 23.447 1.00 0.00 H ATOM 1361 N ALA A 951 8.684 21.400 20.647 1.00 18.13 N ATOM 1362 CA ALA A 951 9.138 22.271 19.572 1.00 18.14 C ATOM 1363 C ALA A 951 10.670 22.128 19.467 1.00 18.28 C ATOM 1364 O ALA A 951 11.329 21.691 20.422 1.00 18.65 O ATOM 1365 CB ALA A 951 8.798 23.699 19.904 1.00 18.25 C ATOM 1366 H ALA A 951 9.391 21.013 21.305 1.00 0.00 H ATOM 1367 N ALA A 952 11.215 22.404 18.294 1.00 18.40 N ATOM 1368 CA ALA A 952 12.708 22.305 18.135 1.00 18.65 C ATOM 1369 C ALA A 952 13.498 23.130 19.176 1.00 19.70 C ATOM 1370 O ALA A 952 14.578 22.710 19.601 1.00 19.32 O ATOM 1371 CB ALA A 952 13.127 22.608 16.703 1.00 18.68 C ATOM 1372 H ALA A 952 10.618 22.686 17.490 1.00 0.00 H ATOM 1373 N ARG A 953 12.919 24.215 19.686 1.00 20.87 N ATOM 1374 CA ARG A 953 13.590 25.028 20.701 1.00 21.64 C ATOM 1375 C ARG A 953 13.716 24.361 22.049 1.00 21.47 C ATOM 1376 O ARG A 953 14.501 24.818 22.893 1.00 20.83 O ATOM 1377 CB ARG A 953 12.939 26.403 20.852 1.00 23.19 C ATOM 1378 CG ARG A 953 11.588 26.419 21.576 1.00 24.10 C ATOM 1379 CD ARG A 953 11.223 27.861 21.918 1.00 26.02 C ATOM 1380 NE ARG A 953 11.333 28.708 20.728 1.00 27.62 N ATOM 1381 CZ ARG A 953 12.283 29.632 20.539 1.00 29.83 C ATOM 1382 NH1 ARG A 953 12.295 30.346 19.423 1.00 30.82 N ATOM 1383 NH2 ARG A 953 13.227 29.851 21.451 1.00 30.30 N ATOM 1384 HE ARG A 953 10.624 28.583 19.978 1.00 0.00 H ATOM 1385 HH12 ARG A 953 13.032 31.065 19.273 1.00 0.00 H ATOM 1386 HH11 ARG A 953 11.568 30.188 18.697 1.00 0.00 H ATOM 1387 HH22 ARG A 953 13.955 30.574 21.282 1.00 0.00 H ATOM 1388 HH21 ARG A 953 13.237 29.299 22.332 1.00 0.00 H ATOM 1389 H ARG A 953 11.972 24.490 19.357 1.00 0.00 H ATOM 1390 N ASN A 954 12.964 23.270 22.271 1.00 20.30 N ATOM 1391 CA ASN A 954 13.065 22.551 23.523 1.00 20.26 C ATOM 1392 C ASN A 954 13.469 21.101 23.409 1.00 20.08 C ATOM 1393 O ASN A 954 13.376 20.382 24.390 1.00 21.29 O ATOM 1394 CB ASN A 954 11.858 22.755 24.409 1.00 21.27 C ATOM 1395 CG ASN A 954 10.606 22.435 23.731 1.00 21.23 C ATOM 1396 OD1 ASN A 954 10.410 21.306 23.236 1.00 22.40 O ATOM 1397 ND2 ASN A 954 9.673 23.432 23.721 1.00 20.77 N ATOM 1398 HD22 ASN A 954 9.893 24.354 24.149 1.00 0.00 H ATOM 1399 HD21 ASN A 954 8.743 23.269 23.285 1.00 0.00 H ATOM 1400 H ASN A 954 12.304 22.940 21.538 1.00 0.00 H ATOM 1401 N ILE A 955 14.047 20.706 22.260 1.00 18.89 N ATOM 1402 CA ILE A 955 14.588 19.379 22.066 1.00 18.76 C ATOM 1403 C ILE A 955 16.109 19.605 22.139 1.00 18.57 C ATOM 1404 O ILE A 955 16.591 20.595 21.602 1.00 18.51 O ATOM 1405 CB ILE A 955 14.152 18.779 20.701 1.00 19.23 C ATOM 1406 CG1 ILE A 955 12.655 18.502 20.752 1.00 19.58 C ATOM 1407 CG2 ILE A 955 14.956 17.521 20.388 1.00 19.74 C ATOM 1408 CD1 ILE A 955 12.033 18.320 19.380 1.00 20.58 C ATOM 1409 H ILE A 955 14.107 21.386 21.476 1.00 0.00 H ATOM 1410 N LEU A 956 16.788 18.762 22.877 1.00 18.15 N ATOM 1411 CA LEU A 956 18.264 18.885 23.121 1.00 18.85 C ATOM 1412 C LEU A 956 19.038 17.946 22.259 1.00 19.27 C ATOM 1413 O LEU A 956 18.536 16.871 21.890 1.00 18.86 O ATOM 1414 CB LEU A 956 18.557 18.584 24.580 1.00 19.13 C ATOM 1415 CG LEU A 956 18.162 19.649 25.600 1.00 19.61 C ATOM 1416 CD1 LEU A 956 18.307 19.149 27.051 1.00 19.63 C ATOM 1417 CD2 LEU A 956 19.017 20.905 25.364 1.00 20.54 C ATOM 1418 H LEU A 956 16.279 17.968 23.316 1.00 0.00 H ATOM 1419 N VAL A 957 20.273 18.352 21.941 1.00 19.66 N ATOM 1420 CA VAL A 957 21.186 17.542 21.151 1.00 20.62 C ATOM 1421 C VAL A 957 22.186 16.950 22.144 1.00 21.74 C ATOM 1422 O VAL A 957 22.991 17.654 22.750 1.00 21.28 O ATOM 1423 CB VAL A 957 21.914 18.441 20.115 1.00 21.03 C ATOM 1424 CG1 VAL A 957 22.994 17.672 19.350 1.00 21.69 C ATOM 1425 CG2 VAL A 957 20.900 19.049 19.166 1.00 21.00 C ATOM 1426 H VAL A 957 20.593 19.285 22.272 1.00 0.00 H ATOM 1427 N GLU A 958 22.122 15.647 22.298 1.00 23.16 N ATOM 1428 CA GLU A 958 23.079 14.922 23.132 1.00 25.56 C ATOM 1429 C GLU A 958 24.365 14.635 22.379 1.00 24.92 C ATOM 1430 O GLU A 958 25.477 14.697 22.930 1.00 26.03 O ATOM 1431 CB GLU A 958 22.485 13.623 23.596 1.00 28.13 C ATOM 1432 CG GLU A 958 23.216 13.154 24.849 1.00 32.84 C ATOM 1433 CD GLU A 958 23.465 11.728 24.843 1.00 38.58 C ATOM 1434 OE1 GLU A 958 23.928 11.261 23.728 1.00 45.69 O ATOM 1435 OE2 GLU A 958 23.265 11.116 25.957 1.00 43.97 O ATOM 1436 H GLU A 958 21.370 15.117 21.813 1.00 0.00 H ATOM 1437 N SER A 959 24.245 14.303 21.109 1.00 24.34 N ATOM 1438 CA SER A 959 25.382 14.222 20.240 1.00 26.60 C ATOM 1439 C SER A 959 24.805 14.437 18.855 1.00 26.32 C ATOM 1440 O SER A 959 23.580 14.526 18.682 1.00 23.31 O ATOM 1441 CB SER A 959 26.007 12.842 20.395 1.00 27.91 C ATOM 1442 OG SER A 959 25.192 11.798 19.842 1.00 30.26 O ATOM 1443 HG SER A 959 25.643 10.926 19.969 1.00 0.00 H ATOM 1444 H SER A 959 23.300 14.094 20.727 1.00 0.00 H ATOM 1445 N GLU A 960 25.679 14.441 17.850 1.00 27.23 N ATOM 1446 CA GLU A 960 25.199 14.756 16.496 1.00 27.52 C ATOM 1447 C GLU A 960 24.161 13.750 15.999 1.00 26.46 C ATOM 1448 O GLU A 960 23.414 14.052 15.069 1.00 27.10 O ATOM 1449 CB GLU A 960 26.406 14.874 15.518 1.00 30.27 C ATOM 1450 CG GLU A 960 27.420 15.936 15.975 1.00 31.51 C ATOM 1451 CD GLU A 960 27.999 16.801 14.865 1.00 33.82 C ATOM 1452 OE1 GLU A 960 27.690 16.568 13.657 1.00 35.53 O ATOM 1453 OE2 GLU A 960 28.713 17.789 15.223 1.00 33.33 O ATOM 1454 H GLU A 960 26.682 14.225 18.020 1.00 0.00 H ATOM 1455 N ALA A 961 24.129 12.546 16.559 1.00 25.40 N ATOM 1456 CA ALA A 961 23.187 11.521 16.116 1.00 24.74 C ATOM 1457 C ALA A 961 22.180 11.110 17.241 1.00 23.93 C ATOM 1458 O ALA A 961 21.681 9.979 17.270 1.00 22.73 O ATOM 1459 CB ALA A 961 23.916 10.303 15.591 1.00 26.17 C ATOM 1460 H ALA A 961 24.790 12.328 17.331 1.00 0.00 H ATOM 1461 N HIS A 962 21.901 12.022 18.160 1.00 22.73 N ATOM 1462 CA HIS A 962 21.076 11.668 19.323 1.00 22.89 C ATOM 1463 C HIS A 962 20.448 12.903 19.910 1.00 21.84 C ATOM 1464 O HIS A 962 21.122 13.811 20.404 1.00 21.26 O ATOM 1465 CB HIS A 962 21.920 10.972 20.372 1.00 24.57 C ATOM 1466 CG HIS A 962 21.174 10.385 21.527 1.00 26.08 C ATOM 1467 ND1 HIS A 962 21.822 9.661 22.507 1.00 29.24 N ATOM 1468 CD2 HIS A 962 19.874 10.440 21.900 1.00 27.51 C ATOM 1469 CE1 HIS A 962 20.944 9.306 23.433 1.00 28.63 C ATOM 1470 NE2 HIS A 962 19.759 9.752 23.073 1.00 27.43 N ATOM 1471 H HIS A 962 22.267 12.990 18.058 1.00 0.00 H ATOM 1472 N VAL A 963 19.117 12.907 19.902 1.00 20.94 N ATOM 1473 CA VAL A 963 18.359 14.026 20.488 1.00 20.49 C ATOM 1474 C VAL A 963 17.464 13.549 21.617 1.00 19.74 C ATOM 1475 O VAL A 963 17.163 12.352 21.711 1.00 19.24 O ATOM 1476 CB VAL A 963 17.505 14.770 19.421 1.00 20.03 C ATOM 1477 CG1 VAL A 963 18.425 15.495 18.437 1.00 20.61 C ATOM 1478 CG2 VAL A 963 16.526 13.827 18.694 1.00 20.59 C ATOM 1479 H VAL A 963 18.605 12.109 19.476 1.00 0.00 H ATOM 1480 N LYS A 964 17.047 14.498 22.454 1.00 19.11 N ATOM 1481 CA LYS A 964 16.262 14.207 23.661 1.00 19.52 C ATOM 1482 C LYS A 964 15.223 15.285 23.861 1.00 18.59 C ATOM 1483 O LYS A 964 15.501 16.474 23.721 1.00 18.50 O ATOM 1484 CB LYS A 964 17.136 14.139 24.938 1.00 20.52 C ATOM 1485 CG LYS A 964 18.140 13.010 24.940 1.00 22.47 C ATOM 1486 CD LYS A 964 18.710 12.845 26.324 1.00 23.48 C ATOM 1487 CE LYS A 964 19.777 11.778 26.356 1.00 25.39 C ATOM 1488 NZ LYS A 964 20.131 11.556 27.771 1.00 25.72 N ATOM 1489 HZ1 LYS A 964 20.488 12.443 28.181 1.00 0.00 H ATOM 1490 HZ2 LYS A 964 19.287 11.246 28.294 1.00 0.00 H ATOM 1491 HZ3 LYS A 964 20.867 10.824 27.832 1.00 0.00 H ATOM 1492 H LYS A 964 17.288 15.488 22.244 1.00 0.00 H ATOM 1493 N ILE A 965 14.037 14.882 24.255 1.00 18.13 N ATOM 1494 CA ILE A 965 12.991 15.847 24.565 1.00 18.15 C ATOM 1495 C ILE A 965 13.189 16.486 25.933 1.00 18.21 C ATOM 1496 O ILE A 965 13.453 15.785 26.939 1.00 18.94 O ATOM 1497 CB ILE A 965 11.623 15.106 24.572 1.00 18.20 C ATOM 1498 CG1 ILE A 965 11.329 14.487 23.180 1.00 18.52 C ATOM 1499 CG2 ILE A 965 10.465 16.016 25.031 1.00 19.09 C ATOM 1500 CD1 ILE A 965 10.189 13.483 23.235 1.00 18.58 C ATOM 1501 H ILE A 965 13.843 13.864 24.347 1.00 0.00 H ATOM 1502 N ALA A 966 13.055 17.827 25.998 1.00 18.64 N ATOM 1503 CA ALA A 966 13.204 18.572 27.233 1.00 18.83 C ATOM 1504 C ALA A 966 12.010 19.529 27.478 1.00 19.38 C ATOM 1505 O ALA A 966 10.960 19.356 26.829 1.00 19.12 O ATOM 1506 CB ALA A 966 14.585 19.288 27.260 1.00 19.12 C ATOM 1507 H ALA A 966 12.836 18.348 25.125 1.00 0.00 H ATOM 1508 N ASP A 967 12.159 20.516 28.353 1.00 19.47 N ATOM 1509 CA ASP A 967 11.109 21.458 28.719 1.00 19.92 C ATOM 1510 C ASP A 967 9.738 20.776 29.063 1.00 18.94 C ATOM 1511 O ASP A 967 8.777 20.823 28.288 1.00 18.75 O ATOM 1512 CB ASP A 967 10.851 22.587 27.733 1.00 21.04 C ATOM 1513 CG ASP A 967 9.999 23.676 28.352 1.00 23.46 C ATOM 1514 OD1 ASP A 967 9.583 23.563 29.554 1.00 22.99 O ATOM 1515 OD2 ASP A 967 9.590 24.574 27.574 1.00 27.71 O ATOM 1516 H ASP A 967 13.088 20.624 28.808 1.00 0.00 H ATOM 1517 N PHE A 968 9.693 20.156 30.221 1.00 18.50 N ATOM 1518 CA PHE A 968 8.478 19.562 30.761 1.00 18.24 C ATOM 1519 C PHE A 968 7.624 20.524 31.586 1.00 18.34 C ATOM 1520 O PHE A 968 6.775 20.107 32.358 1.00 19.11 O ATOM 1521 CB PHE A 968 8.786 18.260 31.532 1.00 18.76 C ATOM 1522 CG PHE A 968 9.018 17.095 30.623 1.00 18.68 C ATOM 1523 CD1 PHE A 968 10.217 17.015 29.879 1.00 18.97 C ATOM 1524 CD2 PHE A 968 8.094 16.092 30.501 1.00 18.79 C ATOM 1525 CE1 PHE A 968 10.455 15.962 29.027 1.00 18.93 C ATOM 1526 CE2 PHE A 968 8.318 15.020 29.637 1.00 18.76 C ATOM 1527 CZ PHE A 968 9.494 14.962 28.885 1.00 18.90 C ATOM 1528 H PHE A 968 10.568 20.086 30.779 1.00 0.00 H ATOM 1529 N GLY A 969 7.821 21.823 31.396 1.00 18.17 N ATOM 1530 CA GLY A 969 7.121 22.836 32.145 1.00 18.80 C ATOM 1531 C GLY A 969 5.614 22.898 32.023 1.00 19.00 C ATOM 1532 O GLY A 969 4.948 23.390 32.933 1.00 19.26 O ATOM 1533 H GLY A 969 8.510 22.122 30.676 1.00 0.00 H ATOM 1534 N LEU A 970 5.116 22.402 30.901 1.00 18.79 N ATOM 1535 CA LEU A 970 3.677 22.400 30.657 1.00 18.90 C ATOM 1536 C LEU A 970 3.140 20.995 30.633 1.00 19.10 C ATOM 1537 O LEU A 970 1.905 20.804 30.372 1.00 18.84 O ATOM 1538 CB LEU A 970 3.359 23.098 29.320 1.00 20.08 C ATOM 1539 CG LEU A 970 3.657 24.618 29.221 1.00 20.97 C ATOM 1540 CD1 LEU A 970 3.436 25.169 27.814 1.00 21.62 C ATOM 1541 CD2 LEU A 970 2.846 25.335 30.241 1.00 22.48 C ATOM 1542 H LEU A 970 5.759 22.009 30.184 1.00 0.00 H ATOM 1543 N ALA A 971 3.955 20.008 30.924 1.00 18.64 N ATOM 1544 CA ALA A 971 3.564 18.594 30.834 1.00 19.17 C ATOM 1545 C ALA A 971 2.544 18.255 31.902 1.00 19.88 C ATOM 1546 O ALA A 971 2.638 18.758 33.023 1.00 20.24 O ATOM 1547 CB ALA A 971 4.760 17.656 30.988 1.00 19.57 C ATOM 1548 H ALA A 971 4.921 20.237 31.232 1.00 0.00 H ATOM 1549 N LYS A 972 1.635 17.352 31.575 1.00 20.04 N ATOM 1550 CA LYS A 972 0.548 16.964 32.455 1.00 21.20 C ATOM 1551 C LYS A 972 0.167 15.502 32.205 1.00 21.56 C ATOM 1552 O LYS A 972 0.214 15.011 31.048 1.00 22.01 O ATOM 1553 CB LYS A 972 -0.650 17.885 32.247 1.00 22.72 C ATOM 1554 CG LYS A 972 -1.841 17.620 33.139 1.00 25.12 C ATOM 1555 CD LYS A 972 -2.726 18.867 33.127 1.00 27.20 C ATOM 1556 CE LYS A 972 -4.163 18.556 33.576 1.00 29.55 C ATOM 1557 NZ LYS A 972 -4.212 18.448 35.035 1.00 32.30 N ATOM 1558 HZ1 LYS A 972 -3.580 17.683 35.346 1.00 0.00 H ATOM 1559 HZ2 LYS A 972 -3.905 19.347 35.458 1.00 0.00 H ATOM 1560 HZ3 LYS A 972 -5.186 18.238 35.333 1.00 0.00 H ATOM 1561 H LYS A 972 1.702 16.898 30.642 1.00 0.00 H ATOM 1562 N LEU A 973 -0.200 14.813 33.265 1.00 20.98 N ATOM 1563 CA LEU A 973 -0.697 13.441 33.140 1.00 21.56 C ATOM 1564 C LEU A 973 -2.208 13.463 32.963 1.00 21.90 C ATOM 1565 O LEU A 973 -2.915 14.158 33.692 1.00 21.77 O ATOM 1566 CB LEU A 973 -0.390 12.617 34.381 1.00 22.46 C ATOM 1567 CG LEU A 973 1.130 12.515 34.668 1.00 23.21 C ATOM 1568 CD1 LEU A 973 1.477 11.715 35.943 1.00 24.69 C ATOM 1569 CD2 LEU A 973 1.937 11.975 33.509 1.00 22.98 C ATOM 1570 H LEU A 973 -0.136 15.250 34.207 1.00 0.00 H ATOM 1571 N LEU A 974 -2.685 12.661 32.026 1.00 21.21 N ATOM 1572 CA LEU A 974 -4.105 12.466 31.879 1.00 22.40 C ATOM 1573 C LEU A 974 -4.632 11.603 33.020 1.00 23.89 C ATOM 1574 O LEU A 974 -4.012 10.614 33.399 1.00 24.63 O ATOM 1575 CB LEU A 974 -4.397 11.770 30.595 1.00 22.16 C ATOM 1576 CG LEU A 974 -3.978 12.528 29.371 1.00 22.04 C ATOM 1577 CD1 LEU A 974 -4.109 11.629 28.183 1.00 22.81 C ATOM 1578 CD2 LEU A 974 -4.787 13.791 29.194 1.00 22.74 C ATOM 1579 H LEU A 974 -2.029 12.166 31.389 1.00 0.00 H ATOM 1580 N PRO A 975 -5.823 11.928 33.529 1.00 26.39 N ATOM 1581 CA PRO A 975 -6.446 11.012 34.469 1.00 27.33 C ATOM 1582 C PRO A 975 -6.598 9.623 33.867 1.00 27.10 C ATOM 1583 O PRO A 975 -6.623 9.504 32.679 1.00 26.88 O ATOM 1584 CB PRO A 975 -7.857 11.612 34.690 1.00 28.54 C ATOM 1585 CG PRO A 975 -7.817 13.030 34.179 1.00 28.81 C ATOM 1586 CD PRO A 975 -6.610 13.140 33.249 1.00 27.28 C ATOM 1587 N LEU A 976 -6.743 8.585 34.688 1.00 28.18 N ATOM 1588 CA LEU A 976 -6.820 7.204 34.183 1.00 29.36 C ATOM 1589 C LEU A 976 -8.016 6.940 33.289 1.00 32.53 C ATOM 1590 O LEU A 976 -7.914 6.103 32.408 1.00 34.79 O ATOM 1591 CB LEU A 976 -6.828 6.196 35.323 1.00 30.32 C ATOM 1592 CG LEU A 976 -5.573 6.102 36.182 1.00 30.05 C ATOM 1593 CD1 LEU A 976 -5.849 5.309 37.455 1.00 31.04 C ATOM 1594 CD2 LEU A 976 -4.458 5.490 35.339 1.00 29.89 C ATOM 1595 H LEU A 976 -6.803 8.754 35.712 1.00 0.00 H ATOM 1596 N ASP A 977 -9.084 7.703 33.480 1.00 33.18 N ATOM 1597 CA ASP A 977 -10.353 7.537 32.743 1.00 35.06 C ATOM 1598 C ASP A 977 -10.714 8.662 31.748 1.00 33.95 C ATOM 1599 O ASP A 977 -11.865 8.760 31.303 1.00 34.02 O ATOM 1600 CB ASP A 977 -11.489 7.373 33.767 1.00 37.64 C ATOM 1601 CG ASP A 977 -11.696 8.600 34.652 1.00 39.64 C ATOM 1602 OD1 ASP A 977 -10.868 9.553 34.673 1.00 42.16 O ATOM 1603 OD2 ASP A 977 -12.700 8.609 35.396 1.00 43.89 O ATOM 1604 H ASP A 977 -9.024 8.461 34.189 1.00 0.00 H ATOM 1605 N LYS A 978 -9.744 9.505 31.370 1.00 31.13 N ATOM 1606 CA LYS A 978 -10.037 10.630 30.497 1.00 31.17 C ATOM 1607 C LYS A 978 -8.860 10.803 29.560 1.00 27.17 C ATOM 1608 O LYS A 978 -7.745 10.716 30.025 1.00 26.99 O ATOM 1609 CB LYS A 978 -10.224 11.890 31.338 1.00 33.94 C ATOM 1610 CG LYS A 978 -11.247 12.839 30.792 1.00 36.77 C ATOM 1611 CD LYS A 978 -11.552 13.870 31.872 1.00 40.47 C ATOM 1612 CE LYS A 978 -12.482 14.945 31.362 1.00 41.27 C ATOM 1613 NZ LYS A 978 -13.796 14.305 31.140 1.00 43.07 N ATOM 1614 HZ1 LYS A 978 -13.695 13.542 30.441 1.00 0.00 H ATOM 1615 HZ2 LYS A 978 -14.144 13.911 32.037 1.00 0.00 H ATOM 1616 HZ3 LYS A 978 -14.470 15.014 30.787 1.00 0.00 H ATOM 1617 H LYS A 978 -8.771 9.353 31.705 1.00 0.00 H ATOM 1618 N ASP A 979 -9.133 11.039 28.280 1.00 25.97 N ATOM 1619 CA ASP A 979 -8.018 11.094 27.304 1.00 24.77 C ATOM 1620 C ASP A 979 -7.677 12.523 26.859 1.00 23.59 C ATOM 1621 O ASP A 979 -6.871 12.717 25.954 1.00 22.21 O ATOM 1622 CB ASP A 979 -8.258 10.179 26.108 1.00 25.28 C ATOM 1623 CG ASP A 979 -8.325 8.683 26.482 1.00 26.01 C ATOM 1624 OD1 ASP A 979 -7.730 8.203 27.493 1.00 25.69 O ATOM 1625 OD2 ASP A 979 -9.004 7.977 25.713 1.00 27.68 O ATOM 1626 H ASP A 979 -10.115 11.183 27.968 1.00 0.00 H ATOM 1627 N TYR A 980 -8.179 13.529 27.574 1.00 22.40 N ATOM 1628 CA TYR A 980 -7.791 14.923 27.347 1.00 22.16 C ATOM 1629 C TYR A 980 -7.916 15.701 28.633 1.00 21.74 C ATOM 1630 O TYR A 980 -8.500 15.208 29.603 1.00 22.86 O ATOM 1631 CB TYR A 980 -8.660 15.596 26.262 1.00 22.54 C ATOM 1632 CG TYR A 980 -10.105 15.740 26.702 1.00 23.02 C ATOM 1633 CD1 TYR A 980 -10.967 14.686 26.577 1.00 24.35 C ATOM 1634 CD2 TYR A 980 -10.510 16.866 27.375 1.00 23.62 C ATOM 1635 CE1 TYR A 980 -12.288 14.787 27.036 1.00 25.52 C ATOM 1636 CE2 TYR A 980 -11.838 16.985 27.846 1.00 25.01 C ATOM 1637 CZ TYR A 980 -12.682 15.929 27.697 1.00 26.26 C ATOM 1638 OH TYR A 980 -14.046 16.062 28.138 1.00 28.99 O ATOM 1639 HH TYR A 980 -14.060 16.259 29.108 1.00 0.00 H ATOM 1640 H TYR A 980 -8.871 13.317 28.320 1.00 0.00 H ATOM 1641 N TYR A 981 -7.421 16.933 28.620 1.00 21.19 N ATOM 1642 CA TYR A 981 -7.677 17.898 29.683 1.00 21.50 C ATOM 1643 C TYR A 981 -7.927 19.257 29.094 1.00 21.29 C ATOM 1644 O TYR A 981 -7.631 19.515 27.921 1.00 20.35 O ATOM 1645 CB TYR A 981 -6.572 17.935 30.765 1.00 21.70 C ATOM 1646 CG TYR A 981 -5.248 18.521 30.277 1.00 21.97 C ATOM 1647 CD1 TYR A 981 -4.996 19.893 30.305 1.00 22.22 C ATOM 1648 CD2 TYR A 981 -4.267 17.713 29.771 1.00 22.44 C ATOM 1649 CE1 TYR A 981 -3.790 20.425 29.831 1.00 22.47 C ATOM 1650 CE2 TYR A 981 -3.086 18.258 29.293 1.00 22.22 C ATOM 1651 CZ TYR A 981 -2.867 19.607 29.343 1.00 22.22 C ATOM 1652 OH TYR A 981 -1.696 20.119 28.855 1.00 24.29 O ATOM 1653 HH TYR A 981 -0.934 19.730 29.353 1.00 0.00 H ATOM 1654 H TYR A 981 -6.826 17.222 27.818 1.00 0.00 H ATOM 1655 N VAL A 982 -8.540 20.107 29.904 1.00 21.79 N ATOM 1656 CA VAL A 982 -8.854 21.454 29.513 1.00 23.04 C ATOM 1657 C VAL A 982 -8.265 22.390 30.520 1.00 25.11 C ATOM 1658 O VAL A 982 -8.416 22.167 31.722 1.00 25.50 O ATOM 1659 CB VAL A 982 -10.383 21.665 29.498 1.00 23.18 C ATOM 1660 CG1 VAL A 982 -10.736 23.082 29.086 1.00 23.40 C ATOM 1661 CG2 VAL A 982 -11.007 20.663 28.535 1.00 23.34 C ATOM 1662 H VAL A 982 -8.804 19.788 30.858 1.00 0.00 H ATOM 1663 N VAL A 983 -7.652 23.456 30.031 1.00 27.21 N ATOM 1664 CA VAL A 983 -7.140 24.533 30.887 1.00 30.58 C ATOM 1665 C VAL A 983 -7.965 25.839 30.794 1.00 32.28 C ATOM 1666 O VAL A 983 -8.767 26.019 29.861 1.00 31.49 O ATOM 1667 CB VAL A 983 -5.714 24.883 30.457 1.00 30.47 C ATOM 1668 CG1 VAL A 983 -4.788 23.690 30.521 1.00 31.33 C ATOM 1669 CG2 VAL A 983 -5.660 25.434 29.042 1.00 30.64 C ATOM 1670 H VAL A 983 -7.528 23.534 29.001 1.00 0.00 H ATOM 1671 N ARG A 984 -7.750 26.767 31.731 1.00 35.70 N ATOM 1672 CA ARG A 984 -8.159 28.205 31.499 1.00 40.15 C ATOM 1673 C ARG A 984 -7.317 28.819 30.329 1.00 42.47 C ATOM 1674 O ARG A 984 -6.211 28.402 30.093 1.00 42.36 O ATOM 1675 CB ARG A 984 -7.943 29.059 32.774 1.00 41.63 C ATOM 1676 CG ARG A 984 -9.169 29.334 33.624 1.00 41.57 C ATOM 1677 CD ARG A 984 -8.772 30.158 34.847 1.00 42.79 C ATOM 1678 NE ARG A 984 -9.897 30.440 35.747 1.00 43.86 N ATOM 1679 CZ ARG A 984 -10.610 31.579 35.820 1.00 45.41 C ATOM 1680 NH1 ARG A 984 -11.621 31.668 36.721 1.00 46.31 N ATOM 1681 NH2 ARG A 984 -10.355 32.634 35.031 1.00 45.36 N ATOM 1682 HE ARG A 984 -10.173 29.677 36.398 1.00 0.00 H ATOM 1683 HH12 ARG A 984 -12.181 32.542 36.789 1.00 0.00 H ATOM 1684 HH11 ARG A 984 -11.836 30.863 37.343 1.00 0.00 H ATOM 1685 HH22 ARG A 984 -10.928 33.498 35.116 1.00 0.00 H ATOM 1686 HH21 ARG A 984 -9.584 32.588 34.334 1.00 0.00 H ATOM 1687 H ARG A 984 -7.297 26.498 32.628 1.00 0.00 H ATOM 1688 N GLU A 985 -7.854 29.818 29.619 1.00 48.00 N ATOM 1689 CA GLU A 985 -7.165 30.485 28.460 1.00 51.00 C ATOM 1690 C GLU A 985 -5.735 30.905 28.858 1.00 52.83 C ATOM 1691 O GLU A 985 -5.583 31.671 29.809 1.00 50.77 O ATOM 1692 CB GLU A 985 -7.986 31.736 27.977 1.00 54.70 C ATOM 1693 CG GLU A 985 -7.522 32.479 26.691 1.00 55.75 C ATOM 1694 CD GLU A 985 -8.494 33.619 26.213 1.00 59.77 C ATOM 1695 OE1 GLU A 985 -9.290 34.181 27.028 1.00 62.98 O ATOM 1696 OE2 GLU A 985 -8.490 33.973 24.996 1.00 57.95 O ATOM 1697 H GLU A 985 -8.802 30.153 29.884 1.00 0.00 H ATOM 1698 N PRO A 986 -4.682 30.353 28.184 1.00 54.62 N ATOM 1699 CA PRO A 986 -3.324 30.864 28.486 1.00 56.11 C ATOM 1700 C PRO A 986 -3.120 32.333 28.037 1.00 59.80 C ATOM 1701 O PRO A 986 -3.775 32.814 27.076 1.00 59.59 O ATOM 1702 CB PRO A 986 -2.384 29.904 27.723 1.00 52.72 C ATOM 1703 CG PRO A 986 -3.229 28.728 27.359 1.00 52.95 C ATOM 1704 CD PRO A 986 -4.634 29.251 27.204 1.00 53.77 C ATOM 1705 N GLY A 987 -2.251 33.033 28.763 1.00 61.95 N ATOM 1706 CA GLY A 987 -1.860 34.398 28.401 1.00 64.99 C ATOM 1707 C GLY A 987 -0.929 34.476 27.186 1.00 65.06 C ATOM 1708 O GLY A 987 -1.079 35.385 26.347 1.00 67.28 O ATOM 1709 H GLY A 987 -1.837 32.598 29.612 1.00 0.00 H ATOM 1710 N GLN A 988 0.014 33.521 27.096 1.00 61.56 N ATOM 1711 CA GLN A 988 1.104 33.547 26.110 1.00 58.73 C ATOM 1712 C GLN A 988 1.398 32.147 25.566 1.00 53.40 C ATOM 1713 O GLN A 988 2.081 31.374 26.201 1.00 57.46 O ATOM 1714 CB GLN A 988 2.347 34.145 26.760 1.00 58.68 C ATOM 1715 CG GLN A 988 2.436 35.651 26.630 1.00 60.70 C ATOM 1716 CD GLN A 988 2.950 36.093 25.262 1.00 61.49 C ATOM 1717 OE1 GLN A 988 2.207 36.115 24.293 1.00 62.64 O ATOM 1718 NE2 GLN A 988 4.218 36.477 25.195 1.00 61.64 N ATOM 1719 HE22 GLN A 988 4.817 36.443 26.044 1.00 0.00 H ATOM 1720 HE21 GLN A 988 4.613 36.812 24.293 1.00 0.00 H ATOM 1721 H GLN A 988 -0.030 32.721 27.760 1.00 0.00 H ATOM 1722 N SER A 989 0.845 31.838 24.390 1.00 48.78 N ATOM 1723 CA SER A 989 1.027 30.534 23.712 1.00 42.93 C ATOM 1724 C SER A 989 1.809 30.735 22.422 1.00 38.27 C ATOM 1725 O SER A 989 1.558 31.694 21.710 1.00 35.21 O ATOM 1726 CB SER A 989 -0.332 29.879 23.349 1.00 42.35 C ATOM 1727 OG SER A 989 -1.124 29.561 24.508 1.00 42.74 O ATOM 1728 HG SER A 989 -0.626 28.927 25.083 1.00 0.00 H ATOM 1729 H SER A 989 0.253 32.554 23.924 1.00 0.00 H ATOM 1730 N PRO A 990 2.729 29.802 22.099 1.00 33.29 N ATOM 1731 CA PRO A 990 3.299 29.714 20.758 1.00 30.66 C ATOM 1732 C PRO A 990 2.272 29.137 19.762 1.00 27.16 C ATOM 1733 O PRO A 990 2.184 27.842 19.484 1.00 27.92 O ATOM 1734 CB PRO A 990 4.461 28.761 20.927 1.00 32.38 C ATOM 1735 CG PRO A 990 4.033 27.875 22.050 1.00 34.33 C ATOM 1736 CD PRO A 990 3.298 28.768 22.995 1.00 34.48 C ATOM 1737 N ILE A 991 1.491 30.070 19.234 1.00 24.19 N ATOM 1738 CA ILE A 991 0.242 29.678 18.553 1.00 21.89 C ATOM 1739 C ILE A 991 0.489 28.802 17.358 1.00 20.96 C ATOM 1740 O ILE A 991 -0.289 27.917 17.096 1.00 20.95 O ATOM 1741 CB ILE A 991 -0.695 30.866 18.172 1.00 22.11 C ATOM 1742 CG1 ILE A 991 -0.047 31.802 17.189 1.00 22.57 C ATOM 1743 CG2 ILE A 991 -1.124 31.608 19.439 1.00 22.49 C ATOM 1744 CD1 ILE A 991 -0.933 32.885 16.655 1.00 23.18 C ATOM 1745 H ILE A 991 1.758 31.073 19.300 1.00 0.00 H ATOM 1746 N PHE A 992 1.664 28.930 16.715 1.00 19.63 N ATOM 1747 CA PHE A 992 1.892 28.168 15.478 1.00 18.77 C ATOM 1748 C PHE A 992 2.234 26.705 15.666 1.00 17.94 C ATOM 1749 O PHE A 992 2.361 26.009 14.653 1.00 17.87 O ATOM 1750 CB PHE A 992 2.941 28.854 14.600 1.00 19.34 C ATOM 1751 CG PHE A 992 2.570 30.255 14.263 1.00 19.98 C ATOM 1752 CD1 PHE A 992 1.370 30.533 13.585 1.00 20.72 C ATOM 1753 CD2 PHE A 992 3.343 31.327 14.706 1.00 21.01 C ATOM 1754 CE1 PHE A 992 1.024 31.824 13.284 1.00 21.13 C ATOM 1755 CE2 PHE A 992 2.958 32.630 14.418 1.00 22.13 C ATOM 1756 CZ PHE A 992 1.796 32.876 13.728 1.00 21.31 C ATOM 1757 H PHE A 992 2.402 29.560 17.088 1.00 0.00 H ATOM 1758 N TRP A 993 2.358 26.254 16.916 1.00 16.95 N ATOM 1759 CA TRP A 993 2.584 24.857 17.232 1.00 17.72 C ATOM 1760 C TRP A 993 1.369 24.111 17.759 1.00 17.81 C ATOM 1761 O TRP A 993 1.352 22.892 17.765 1.00 18.35 O ATOM 1762 CB TRP A 993 3.769 24.733 18.267 1.00 17.91 C ATOM 1763 CG TRP A 993 5.120 24.801 17.613 1.00 18.17 C ATOM 1764 CD1 TRP A 993 5.995 23.762 17.392 1.00 18.06 C ATOM 1765 CD2 TRP A 993 5.766 25.971 17.092 1.00 18.16 C ATOM 1766 NE1 TRP A 993 7.104 24.218 16.756 1.00 17.92 N ATOM 1767 CE2 TRP A 993 7.018 25.567 16.575 1.00 18.14 C ATOM 1768 CE3 TRP A 993 5.439 27.336 17.057 1.00 18.86 C ATOM 1769 CZ2 TRP A 993 7.854 26.442 15.929 1.00 19.00 C ATOM 1770 CZ3 TRP A 993 6.270 28.194 16.436 1.00 19.51 C ATOM 1771 CH2 TRP A 993 7.483 27.767 15.903 1.00 19.57 C ATOM 1772 HE1 TRP A 993 7.902 23.625 16.451 1.00 0.00 H ATOM 1773 H TRP A 993 2.289 26.935 17.699 1.00 0.00 H ATOM 1774 N TYR A 994 0.315 24.839 18.095 1.00 18.03 N ATOM 1775 CA TYR A 994 -0.845 24.217 18.750 1.00 18.38 C ATOM 1776 C TYR A 994 -1.926 23.722 17.827 1.00 18.11 C ATOM 1777 O TYR A 994 -2.199 24.317 16.810 1.00 18.35 O ATOM 1778 CB TYR A 994 -1.430 25.200 19.747 1.00 18.77 C ATOM 1779 CG TYR A 994 -0.706 25.323 21.089 1.00 20.33 C ATOM 1780 CD1 TYR A 994 0.541 24.696 21.313 1.00 19.90 C ATOM 1781 CD2 TYR A 994 -1.268 26.069 22.119 1.00 21.53 C ATOM 1782 CE1 TYR A 994 1.181 24.801 22.544 1.00 20.68 C ATOM 1783 CE2 TYR A 994 -0.615 26.203 23.358 1.00 21.71 C ATOM 1784 CZ TYR A 994 0.575 25.574 23.573 1.00 21.41 C ATOM 1785 OH TYR A 994 1.202 25.694 24.805 1.00 23.57 O ATOM 1786 HH TYR A 994 2.048 25.181 24.795 1.00 0.00 H ATOM 1787 H TYR A 994 0.308 25.859 17.894 1.00 0.00 H ATOM 1788 N ALA A 995 -2.542 22.622 18.226 1.00 18.21 N ATOM 1789 CA ALA A 995 -3.685 22.079 17.523 1.00 18.08 C ATOM 1790 C ALA A 995 -4.862 23.072 17.590 1.00 18.35 C ATOM 1791 O ALA A 995 -4.991 23.843 18.540 1.00 18.37 O ATOM 1792 CB ALA A 995 -4.088 20.745 18.099 1.00 18.36 C ATOM 1793 H ALA A 995 -2.193 22.130 19.074 1.00 0.00 H ATOM 1794 N PRO A 996 -5.736 23.045 16.576 1.00 18.74 N ATOM 1795 CA PRO A 996 -6.876 23.984 16.574 1.00 19.23 C ATOM 1796 C PRO A 996 -7.780 23.868 17.773 1.00 18.92 C ATOM 1797 O PRO A 996 -8.248 24.906 18.232 1.00 19.65 O ATOM 1798 CB PRO A 996 -7.616 23.685 15.272 1.00 19.70 C ATOM 1799 CG PRO A 996 -6.955 22.524 14.665 1.00 20.21 C ATOM 1800 CD PRO A 996 -5.662 22.267 15.346 1.00 19.50 C ATOM 1801 N GLU A 997 -8.020 22.659 18.276 1.00 18.46 N ATOM 1802 CA GLU A 997 -8.871 22.468 19.470 1.00 18.50 C ATOM 1803 C GLU A 997 -8.204 23.050 20.703 1.00 18.35 C ATOM 1804 O GLU A 997 -8.871 23.479 21.663 1.00 18.51 O ATOM 1805 CB GLU A 997 -9.283 21.004 19.683 1.00 18.90 C ATOM 1806 CG GLU A 997 -8.149 20.036 20.070 1.00 19.45 C ATOM 1807 CD GLU A 997 -7.345 19.500 18.898 1.00 19.52 C ATOM 1808 OE1 GLU A 997 -7.481 19.991 17.719 1.00 20.03 O ATOM 1809 OE2 GLU A 997 -6.583 18.523 19.175 1.00 19.95 O ATOM 1810 H GLU A 997 -7.598 21.827 17.817 1.00 0.00 H ATOM 1811 N SER A 998 -6.880 23.119 20.686 1.00 17.77 N ATOM 1812 CA SER A 998 -6.185 23.736 21.808 1.00 18.10 C ATOM 1813 C SER A 998 -6.335 25.208 21.729 1.00 19.21 C ATOM 1814 O SER A 998 -6.629 25.842 22.739 1.00 20.77 O ATOM 1815 CB SER A 998 -4.682 23.371 21.808 1.00 17.38 C ATOM 1816 OG SER A 998 -4.548 21.955 21.744 1.00 16.95 O ATOM 1817 HG SER A 998 -4.991 21.547 22.530 1.00 0.00 H ATOM 1818 H SER A 998 -6.344 22.737 19.881 1.00 0.00 H ATOM 1819 N LEU A 999 -6.168 25.766 20.533 1.00 20.20 N ATOM 1820 CA LEU A 999 -6.254 27.224 20.309 1.00 21.25 C ATOM 1821 C LEU A 999 -7.666 27.755 20.584 1.00 22.44 C ATOM 1822 O LEU A 999 -7.815 28.808 21.185 1.00 22.98 O ATOM 1823 CB LEU A 999 -5.880 27.559 18.902 1.00 22.05 C ATOM 1824 CG LEU A 999 -4.408 27.371 18.476 1.00 22.75 C ATOM 1825 CD1 LEU A 999 -4.280 27.570 16.978 1.00 23.62 C ATOM 1826 CD2 LEU A 999 -3.560 28.301 19.329 1.00 23.74 C ATOM 1827 H LEU A 999 -5.968 25.149 19.720 1.00 0.00 H ATOM 1828 N SER A1000 -8.683 27.018 20.139 1.00 22.17 N ATOM 1829 CA SER A1000 -10.032 27.481 20.240 1.00 23.88 C ATOM 1830 C SER A1000 -10.724 27.126 21.561 1.00 24.82 C ATOM 1831 O SER A1000 -11.559 27.915 22.047 1.00 26.76 O ATOM 1832 CB SER A1000 -10.824 26.930 19.025 1.00 24.04 C ATOM 1833 OG SER A1000 -10.955 25.530 19.118 1.00 25.51 O ATOM 1834 HG SER A1000 -10.056 25.116 19.132 1.00 0.00 H ATOM 1835 H SER A1000 -8.492 26.090 19.711 1.00 0.00 H ATOM 1836 N ASP A1001 -10.506 25.914 22.064 1.00 25.01 N ATOM 1837 CA ASP A1001 -11.283 25.371 23.212 1.00 25.88 C ATOM 1838 C ASP A1001 -10.379 24.996 24.423 1.00 25.57 C ATOM 1839 O ASP A1001 -10.883 24.449 25.420 1.00 25.38 O ATOM 1840 CB ASP A1001 -12.092 24.150 22.791 1.00 28.10 C ATOM 1841 CG ASP A1001 -13.078 24.438 21.616 1.00 32.21 C ATOM 1842 OD1 ASP A1001 -13.517 25.567 21.533 1.00 34.88 O ATOM 1843 OD2 ASP A1001 -13.446 23.517 20.824 1.00 38.58 O ATOM 1844 H ASP A1001 -9.764 25.323 21.639 1.00 0.00 H ATOM 1845 N ASN A1002 -9.077 25.240 24.326 1.00 24.55 N ATOM 1846 CA ASN A1002 -8.124 24.957 25.432 1.00 24.39 C ATOM 1847 C ASN A1002 -8.057 23.479 25.790 1.00 22.57 C ATOM 1848 O ASN A1002 -7.718 23.120 26.911 1.00 21.62 O ATOM 1849 CB ASN A1002 -8.461 25.782 26.708 1.00 26.33 C ATOM 1850 CG ASN A1002 -8.545 27.264 26.443 1.00 27.23 C ATOM 1851 OD1 ASN A1002 -9.573 27.925 26.776 1.00 33.42 O ATOM 1852 ND2 ASN A1002 -7.543 27.793 25.821 1.00 26.94 N ATOM 1853 HD22 ASN A1002 -6.720 27.209 25.569 1.00 0.00 H ATOM 1854 HD21 ASN A1002 -7.559 28.803 25.573 1.00 0.00 H ATOM 1855 H ASN A1002 -8.709 25.645 23.441 1.00 0.00 H ATOM 1856 N ILE A1003 -8.308 22.636 24.793 1.00 20.67 N ATOM 1857 CA ILE A1003 -8.268 21.197 24.926 1.00 19.68 C ATOM 1858 C ILE A1003 -6.874 20.687 24.517 1.00 19.18 C ATOM 1859 O ILE A1003 -6.429 20.939 23.395 1.00 18.23 O ATOM 1860 CB ILE A1003 -9.312 20.508 24.019 1.00 19.86 C ATOM 1861 CG1 ILE A1003 -10.748 20.872 24.441 1.00 20.76 C ATOM 1862 CG2 ILE A1003 -9.141 19.006 24.064 1.00 20.04 C ATOM 1863 CD1 ILE A1003 -11.744 20.502 23.365 1.00 21.24 C ATOM 1864 H ILE A1003 -8.547 23.035 23.863 1.00 0.00 H ATOM 1865 N PHE A1004 -6.281 19.864 25.389 1.00 18.37 N ATOM 1866 CA PHE A1004 -4.976 19.241 25.085 1.00 18.07 C ATOM 1867 C PHE A1004 -5.071 17.725 25.302 1.00 17.73 C ATOM 1868 O PHE A1004 -5.765 17.247 26.181 1.00 17.88 O ATOM 1869 CB PHE A1004 -3.893 19.846 26.002 1.00 18.00 C ATOM 1870 CG PHE A1004 -3.601 21.272 25.713 1.00 18.17 C ATOM 1871 CD1 PHE A1004 -4.353 22.290 26.314 1.00 18.75 C ATOM 1872 CD2 PHE A1004 -2.609 21.601 24.800 1.00 17.98 C ATOM 1873 CE1 PHE A1004 -4.073 23.615 26.024 1.00 19.50 C ATOM 1874 CE2 PHE A1004 -2.385 22.918 24.478 1.00 18.24 C ATOM 1875 CZ PHE A1004 -3.093 23.913 25.111 1.00 19.14 C ATOM 1876 H PHE A1004 -6.746 19.659 26.296 1.00 0.00 H ATOM 1877 N SER A1005 -4.283 16.985 24.547 1.00 16.85 N ATOM 1878 CA SER A1005 -4.350 15.531 24.535 1.00 16.99 C ATOM 1879 C SER A1005 -3.085 14.975 23.908 1.00 16.75 C ATOM 1880 O SER A1005 -2.251 15.740 23.342 1.00 16.66 O ATOM 1881 CB SER A1005 -5.562 15.053 23.724 1.00 17.33 C ATOM 1882 OG SER A1005 -5.399 15.407 22.337 1.00 17.31 O ATOM 1883 HG SER A1005 -5.320 16.390 22.256 1.00 0.00 H ATOM 1884 H SER A1005 -3.587 17.458 23.937 1.00 0.00 H ATOM 1885 N ARG A1006 -2.961 13.656 23.876 1.00 16.98 N ATOM 1886 CA ARG A1006 -1.852 13.067 23.121 1.00 17.78 C ATOM 1887 C ARG A1006 -2.029 13.322 21.603 1.00 17.79 C ATOM 1888 O ARG A1006 -1.059 13.397 20.854 1.00 17.91 O ATOM 1889 CB ARG A1006 -1.734 11.591 23.408 1.00 18.67 C ATOM 1890 CG ARG A1006 -1.353 11.364 24.859 1.00 19.73 C ATOM 1891 CD ARG A1006 -1.442 9.905 25.254 1.00 20.92 C ATOM 1892 NE ARG A1006 -2.833 9.479 25.362 1.00 22.43 N ATOM 1893 CZ ARG A1006 -3.259 8.313 25.849 1.00 24.31 C ATOM 1894 NH1 ARG A1006 -2.420 7.448 26.406 1.00 24.84 N ATOM 1895 NH2 ARG A1006 -4.591 8.062 25.843 1.00 24.80 N ATOM 1896 HE ARG A1006 -3.559 10.145 25.029 1.00 0.00 H ATOM 1897 HH12 ARG A1006 -2.776 6.545 26.779 1.00 0.00 H ATOM 1898 HH11 ARG A1006 -1.407 7.674 26.469 1.00 0.00 H ATOM 1899 HH22 ARG A1006 -4.952 7.161 26.216 1.00 0.00 H ATOM 1900 HH21 ARG A1006 -5.252 8.770 25.465 1.00 0.00 H ATOM 1901 H ARG A1006 -3.640 13.049 24.378 1.00 0.00 H ATOM 1902 N GLN A1007 -3.275 13.497 21.178 1.00 18.13 N ATOM 1903 CA GLN A1007 -3.567 13.869 19.787 1.00 18.13 C ATOM 1904 C GLN A1007 -3.185 15.317 19.435 1.00 17.52 C ATOM 1905 O GLN A1007 -2.863 15.613 18.274 1.00 17.95 O ATOM 1906 CB GLN A1007 -5.038 13.606 19.453 1.00 19.03 C ATOM 1907 CG GLN A1007 -5.414 12.143 19.510 1.00 19.96 C ATOM 1908 CD GLN A1007 -5.805 11.643 20.885 1.00 20.97 C ATOM 1909 OE1 GLN A1007 -5.553 12.273 21.901 1.00 21.20 O ATOM 1910 NE2 GLN A1007 -6.481 10.522 20.910 1.00 22.39 N ATOM 1911 HE22 GLN A1007 -6.677 10.013 20.024 1.00 0.00 H ATOM 1912 HE21 GLN A1007 -6.822 10.141 21.815 1.00 0.00 H ATOM 1913 H GLN A1007 -4.062 13.368 21.845 1.00 0.00 H ATOM 1914 N SER A1008 -3.248 16.227 20.390 1.00 16.90 N ATOM 1915 CA SER A1008 -2.804 17.610 20.135 1.00 16.71 C ATOM 1916 C SER A1008 -1.240 17.574 20.091 1.00 16.47 C ATOM 1917 O SER A1008 -0.633 18.315 19.306 1.00 16.20 O ATOM 1918 CB SER A1008 -3.357 18.651 21.100 1.00 17.06 C ATOM 1919 OG SER A1008 -3.020 18.489 22.435 1.00 16.85 O ATOM 1920 HG SER A1008 -2.035 18.522 22.532 1.00 0.00 H ATOM 1921 H SER A1008 -3.613 15.967 21.328 1.00 0.00 H ATOM 1922 N ASP A1009 -0.635 16.717 20.903 1.00 16.17 N ATOM 1923 CA ASP A1009 0.802 16.498 20.771 1.00 16.22 C ATOM 1924 C ASP A1009 1.232 16.008 19.382 1.00 16.17 C ATOM 1925 O ASP A1009 2.282 16.440 18.883 1.00 15.91 O ATOM 1926 CB ASP A1009 1.375 15.519 21.832 1.00 16.43 C ATOM 1927 CG ASP A1009 1.648 16.170 23.184 1.00 16.79 C ATOM 1928 OD1 ASP A1009 1.567 17.413 23.392 1.00 16.80 O ATOM 1929 OD2 ASP A1009 2.077 15.370 24.050 1.00 17.98 O ATOM 1930 H ASP A1009 -1.180 16.206 21.627 1.00 0.00 H ATOM 1931 N VAL A1010 0.456 15.145 18.750 1.00 15.66 N ATOM 1932 CA VAL A1010 0.737 14.695 17.395 1.00 15.98 C ATOM 1933 C VAL A1010 0.734 15.912 16.427 1.00 15.96 C ATOM 1934 O VAL A1010 1.608 16.015 15.570 1.00 15.89 O ATOM 1935 CB VAL A1010 -0.238 13.598 16.933 1.00 16.52 C ATOM 1936 CG1 VAL A1010 -0.192 13.349 15.447 1.00 17.07 C ATOM 1937 CG2 VAL A1010 0.051 12.318 17.685 1.00 16.81 C ATOM 1938 H VAL A1010 -0.385 14.775 19.238 1.00 0.00 H ATOM 1939 N TRP A1011 -0.232 16.825 16.552 1.00 16.03 N ATOM 1940 CA TRP A1011 -0.235 18.043 15.739 1.00 15.75 C ATOM 1941 C TRP A1011 1.081 18.800 15.884 1.00 15.60 C ATOM 1942 O TRP A1011 1.686 19.156 14.906 1.00 15.30 O ATOM 1943 CB TRP A1011 -1.434 18.947 16.117 1.00 15.94 C ATOM 1944 CG TRP A1011 -1.533 20.190 15.339 1.00 16.36 C ATOM 1945 CD1 TRP A1011 -0.716 21.299 15.434 1.00 16.51 C ATOM 1946 CD2 TRP A1011 -2.491 20.492 14.302 1.00 16.85 C ATOM 1947 NE1 TRP A1011 -1.082 22.240 14.496 1.00 16.91 N ATOM 1948 CE2 TRP A1011 -2.208 21.802 13.849 1.00 16.72 C ATOM 1949 CE3 TRP A1011 -3.635 19.820 13.807 1.00 17.24 C ATOM 1950 CZ2 TRP A1011 -2.927 22.404 12.802 1.00 17.13 C ATOM 1951 CZ3 TRP A1011 -4.377 20.434 12.779 1.00 17.36 C ATOM 1952 CH2 TRP A1011 -4.017 21.718 12.302 1.00 17.19 C ATOM 1953 HE1 TRP A1011 -0.586 23.135 14.310 1.00 0.00 H ATOM 1954 H TRP A1011 -0.997 16.668 17.239 1.00 0.00 H ATOM 1955 N SER A1012 1.466 19.076 17.138 1.00 15.06 N ATOM 1956 CA SER A1012 2.727 19.750 17.384 1.00 15.48 C ATOM 1957 C SER A1012 3.908 19.018 16.794 1.00 15.67 C ATOM 1958 O SER A1012 4.792 19.654 16.219 1.00 15.55 O ATOM 1959 CB SER A1012 2.921 19.977 18.877 1.00 15.54 C ATOM 1960 OG SER A1012 1.787 20.643 19.422 1.00 16.48 O ATOM 1961 HG SER A1012 1.924 20.785 20.392 1.00 0.00 H ATOM 1962 H SER A1012 0.858 18.806 17.938 1.00 0.00 H ATOM 1963 N PHE A1013 3.917 17.683 16.873 1.00 15.67 N ATOM 1964 CA PHE A1013 4.987 16.905 16.280 1.00 15.82 C ATOM 1965 C PHE A1013 5.085 17.127 14.781 1.00 16.00 C ATOM 1966 O PHE A1013 6.192 17.199 14.212 1.00 15.69 O ATOM 1967 CB PHE A1013 4.801 15.430 16.576 1.00 16.13 C ATOM 1968 CG PHE A1013 5.881 14.521 15.982 1.00 16.81 C ATOM 1969 CD1 PHE A1013 7.176 14.529 16.434 1.00 17.19 C ATOM 1970 CD2 PHE A1013 5.576 13.696 14.922 1.00 17.42 C ATOM 1971 CE1 PHE A1013 8.123 13.702 15.852 1.00 17.88 C ATOM 1972 CE2 PHE A1013 6.516 12.922 14.322 1.00 17.94 C ATOM 1973 CZ PHE A1013 7.803 12.913 14.777 1.00 17.96 C ATOM 1974 H PHE A1013 3.144 17.195 17.368 1.00 0.00 H ATOM 1975 N GLY A1014 3.942 17.247 14.121 1.00 16.24 N ATOM 1976 CA GLY A1014 3.926 17.644 12.749 1.00 16.43 C ATOM 1977 C GLY A1014 4.676 18.944 12.484 1.00 16.89 C ATOM 1978 O GLY A1014 5.419 19.052 11.480 1.00 17.32 O ATOM 1979 H GLY A1014 3.045 17.049 14.609 1.00 0.00 H ATOM 1980 N VAL A1015 4.463 19.938 13.337 1.00 17.07 N ATOM 1981 CA VAL A1015 5.171 21.210 13.204 1.00 17.08 C ATOM 1982 C VAL A1015 6.692 21.017 13.476 1.00 17.47 C ATOM 1983 O VAL A1015 7.516 21.634 12.812 1.00 17.57 O ATOM 1984 CB VAL A1015 4.564 22.312 14.074 1.00 16.99 C ATOM 1985 CG1 VAL A1015 5.240 23.641 13.799 1.00 17.44 C ATOM 1986 CG2 VAL A1015 3.073 22.449 13.797 1.00 17.25 C ATOM 1987 H VAL A1015 3.782 19.810 14.112 1.00 0.00 H ATOM 1988 N VAL A1016 7.027 20.135 14.408 1.00 17.20 N ATOM 1989 CA VAL A1016 8.445 19.757 14.591 1.00 17.64 C ATOM 1990 C VAL A1016 9.070 19.141 13.348 1.00 18.16 C ATOM 1991 O VAL A1016 10.210 19.505 12.966 1.00 17.46 O ATOM 1992 CB VAL A1016 8.644 18.827 15.800 1.00 17.69 C ATOM 1993 CG1 VAL A1016 10.085 18.276 15.891 1.00 17.86 C ATOM 1994 CG2 VAL A1016 8.268 19.571 17.060 1.00 17.79 C ATOM 1995 H VAL A1016 6.293 19.710 15.010 1.00 0.00 H ATOM 1996 N LEU A1017 8.366 18.227 12.681 1.00 18.25 N ATOM 1997 CA LEU A1017 8.850 17.699 11.445 1.00 18.73 C ATOM 1998 C LEU A1017 9.110 18.845 10.429 1.00 18.92 C ATOM 1999 O LEU A1017 10.108 18.863 9.689 1.00 18.58 O ATOM 2000 CB LEU A1017 7.855 16.694 10.881 1.00 19.57 C ATOM 2001 CG LEU A1017 7.734 15.361 11.603 1.00 20.15 C ATOM 2002 CD1 LEU A1017 6.607 14.624 10.876 1.00 20.80 C ATOM 2003 CD2 LEU A1017 9.032 14.598 11.636 1.00 21.06 C ATOM 2004 H LEU A1017 7.457 17.896 13.063 1.00 0.00 H ATOM 2005 N TYR A1018 8.197 19.819 10.357 1.00 18.61 N ATOM 2006 CA TYR A1018 8.372 21.015 9.511 1.00 18.81 C ATOM 2007 C TYR A1018 9.663 21.826 9.889 1.00 18.82 C ATOM 2008 O TYR A1018 10.441 22.212 9.028 1.00 19.00 O ATOM 2009 CB TYR A1018 7.117 21.899 9.567 1.00 19.49 C ATOM 2010 CG TYR A1018 7.226 23.092 8.684 1.00 20.08 C ATOM 2011 CD1 TYR A1018 6.867 23.016 7.337 1.00 20.05 C ATOM 2012 CD2 TYR A1018 7.770 24.299 9.162 1.00 20.43 C ATOM 2013 CE1 TYR A1018 7.018 24.109 6.522 1.00 20.79 C ATOM 2014 CE2 TYR A1018 7.930 25.389 8.320 1.00 20.92 C ATOM 2015 CZ TYR A1018 7.531 25.285 7.006 1.00 21.20 C ATOM 2016 OH TYR A1018 7.745 26.351 6.163 1.00 22.74 O ATOM 2017 HH TYR A1018 7.408 26.128 5.259 1.00 0.00 H ATOM 2018 H TYR A1018 7.328 19.730 10.921 1.00 0.00 H ATOM 2019 N GLU A1019 9.848 22.050 11.159 1.00 18.51 N ATOM 2020 CA GLU A1019 11.065 22.690 11.682 1.00 19.16 C ATOM 2021 C GLU A1019 12.313 21.901 11.240 1.00 19.49 C ATOM 2022 O GLU A1019 13.298 22.513 10.756 1.00 19.72 O ATOM 2023 CB GLU A1019 11.034 22.775 13.204 1.00 19.00 C ATOM 2024 CG GLU A1019 10.019 23.783 13.747 1.00 19.35 C ATOM 2025 CD GLU A1019 10.208 23.981 15.227 1.00 19.72 C ATOM 2026 OE1 GLU A1019 9.658 23.127 15.994 1.00 19.12 O ATOM 2027 OE2 GLU A1019 10.908 24.981 15.655 1.00 21.19 O ATOM 2028 H GLU A1019 9.106 21.765 11.830 1.00 0.00 H ATOM 2029 N LEU A1020 12.299 20.588 11.422 1.00 19.73 N ATOM 2030 CA LEU A1020 13.458 19.749 11.042 1.00 19.87 C ATOM 2031 C LEU A1020 13.773 19.878 9.557 1.00 20.29 C ATOM 2032 O LEU A1020 14.897 20.215 9.167 1.00 19.84 O ATOM 2033 CB LEU A1020 13.238 18.279 11.408 1.00 20.05 C ATOM 2034 CG LEU A1020 13.842 17.869 12.775 1.00 20.33 C ATOM 2035 CD1 LEU A1020 13.552 18.897 13.850 1.00 20.05 C ATOM 2036 CD2 LEU A1020 13.371 16.482 13.200 1.00 20.35 C ATOM 2037 H LEU A1020 11.459 20.139 11.839 1.00 0.00 H ATOM 2038 N PHE A1021 12.762 19.673 8.729 1.00 20.27 N ATOM 2039 CA PHE A1021 12.968 19.675 7.308 1.00 21.21 C ATOM 2040 C PHE A1021 13.125 21.028 6.612 1.00 21.45 C ATOM 2041 O PHE A1021 13.495 21.086 5.447 1.00 22.67 O ATOM 2042 CB PHE A1021 11.988 18.720 6.651 1.00 22.00 C ATOM 2043 CG PHE A1021 12.295 17.280 6.943 1.00 22.31 C ATOM 2044 CD1 PHE A1021 11.820 16.639 8.082 1.00 21.90 C ATOM 2045 CD2 PHE A1021 13.153 16.561 6.086 1.00 23.78 C ATOM 2046 CE1 PHE A1021 12.173 15.340 8.366 1.00 22.01 C ATOM 2047 CE2 PHE A1021 13.467 15.254 6.350 1.00 23.42 C ATOM 2048 CZ PHE A1021 12.973 14.647 7.480 1.00 23.09 C ATOM 2049 H PHE A1021 11.809 19.509 9.111 1.00 0.00 H ATOM 2050 N THR A1022 13.005 22.101 7.349 1.00 21.45 N ATOM 2051 CA THR A1022 13.393 23.418 6.930 1.00 21.88 C ATOM 2052 C THR A1022 14.671 23.902 7.650 1.00 22.19 C ATOM 2053 O THR A1022 15.050 25.064 7.494 1.00 22.42 O ATOM 2054 CB THR A1022 12.309 24.472 7.250 1.00 21.85 C ATOM 2055 OG1 THR A1022 11.966 24.449 8.652 1.00 20.78 O ATOM 2056 CG2 THR A1022 11.067 24.213 6.442 1.00 22.10 C ATOM 2057 HG1 THR A1022 11.620 23.553 8.891 1.00 0.00 H ATOM 2058 H THR A1022 12.602 21.993 8.302 1.00 0.00 H ATOM 2059 N TYR A1023 15.287 23.047 8.467 1.00 22.29 N ATOM 2060 CA TYR A1023 16.458 23.437 9.276 1.00 22.27 C ATOM 2061 C TYR A1023 16.195 24.670 10.109 1.00 22.45 C ATOM 2062 O TYR A1023 17.095 25.425 10.417 1.00 22.26 O ATOM 2063 CB TYR A1023 17.649 23.623 8.389 1.00 23.30 C ATOM 2064 CG TYR A1023 18.039 22.380 7.656 1.00 23.78 C ATOM 2065 CD1 TYR A1023 18.917 21.454 8.208 1.00 24.02 C ATOM 2066 CD2 TYR A1023 17.607 22.149 6.379 1.00 24.72 C ATOM 2067 CE1 TYR A1023 19.297 20.316 7.529 1.00 24.29 C ATOM 2068 CE2 TYR A1023 17.948 20.985 5.704 1.00 25.16 C ATOM 2069 CZ TYR A1023 18.862 20.103 6.251 1.00 25.79 C ATOM 2070 OH TYR A1023 19.220 18.949 5.547 1.00 27.05 O ATOM 2071 HH TYR A1023 19.878 18.432 6.076 1.00 0.00 H ATOM 2072 H TYR A1023 14.930 22.073 8.536 1.00 0.00 H ATOM 2073 N CYS A1024 14.939 24.855 10.546 1.00 21.30 N ATOM 2074 CA CYS A1024 14.569 26.018 11.295 1.00 22.02 C ATOM 2075 C CYS A1024 14.983 27.336 10.657 1.00 23.67 C ATOM 2076 O CYS A1024 15.151 28.298 11.379 1.00 24.34 O ATOM 2077 CB CYS A1024 15.070 25.940 12.755 1.00 21.48 C ATOM 2078 SG CYS A1024 14.284 24.664 13.743 1.00 21.96 S ATOM 2079 H CYS A1024 14.217 24.136 10.335 1.00 0.00 H ATOM 2080 N ASP A1025 15.017 27.396 9.324 1.00 25.67 N ATOM 2081 CA ASP A1025 15.343 28.618 8.626 1.00 28.66 C ATOM 2082 C ASP A1025 14.306 29.673 8.946 1.00 29.24 C ATOM 2083 O ASP A1025 13.068 29.421 8.844 1.00 28.27 O ATOM 2084 CB ASP A1025 15.363 28.418 7.108 1.00 31.31 C ATOM 2085 CG ASP A1025 16.014 29.597 6.394 1.00 34.10 C ATOM 2086 OD1 ASP A1025 15.518 30.699 6.459 1.00 37.80 O ATOM 2087 OD2 ASP A1025 17.092 29.442 5.829 1.00 39.30 O ATOM 2088 H ASP A1025 14.803 26.540 8.773 1.00 0.00 H ATOM 2089 N LYS A1026 14.789 30.842 9.357 1.00 31.41 N ATOM 2090 CA LYS A1026 13.880 31.941 9.732 1.00 34.39 C ATOM 2091 C LYS A1026 13.061 32.459 8.537 1.00 33.42 C ATOM 2092 O LYS A1026 11.923 32.917 8.726 1.00 34.75 O ATOM 2093 CB LYS A1026 14.642 33.073 10.401 1.00 37.74 C ATOM 2094 CG LYS A1026 15.216 32.645 11.757 1.00 41.86 C ATOM 2095 CD LYS A1026 16.015 33.757 12.437 1.00 46.38 C ATOM 2096 CE LYS A1026 16.537 33.290 13.790 1.00 49.48 C ATOM 2097 NZ LYS A1026 17.653 34.166 14.269 1.00 51.92 N ATOM 2098 HZ1 LYS A1026 18.434 34.137 13.583 1.00 0.00 H ATOM 2099 HZ2 LYS A1026 17.309 35.143 14.364 1.00 0.00 H ATOM 2100 HZ3 LYS A1026 17.989 33.824 15.192 1.00 0.00 H ATOM 2101 H LYS A1026 15.818 30.982 9.414 1.00 0.00 H ATOM 2102 N SER A1027 13.586 32.306 7.319 1.00 32.84 N ATOM 2103 CA SER A1027 12.850 32.718 6.116 1.00 33.01 C ATOM 2104 C SER A1027 11.577 31.897 5.884 1.00 31.48 C ATOM 2105 O SER A1027 10.669 32.354 5.171 1.00 30.97 O ATOM 2106 CB SER A1027 13.729 32.656 4.860 1.00 34.15 C ATOM 2107 OG SER A1027 13.999 31.310 4.455 1.00 35.62 O ATOM 2108 HG SER A1027 14.470 30.835 5.185 1.00 0.00 H ATOM 2109 H SER A1027 14.533 31.888 7.220 1.00 0.00 H ATOM 2110 N CYS A1028 11.521 30.667 6.391 1.00 29.39 N ATOM 2111 CA CYS A1028 10.283 29.877 6.199 1.00 29.37 C ATOM 2112 C CYS A1028 9.730 29.279 7.480 1.00 26.04 C ATOM 2113 O CYS A1028 9.084 28.225 7.463 1.00 25.63 O ATOM 2114 CB CYS A1028 10.437 28.841 5.129 1.00 31.46 C ATOM 2115 SG CYS A1028 11.823 27.778 5.407 1.00 34.10 S ATOM 2116 H CYS A1028 12.329 30.270 6.911 1.00 0.00 H ATOM 2117 N SER A1029 9.952 29.992 8.564 1.00 24.86 N ATOM 2118 CA SER A1029 9.415 29.600 9.862 1.00 23.69 C ATOM 2119 C SER A1029 7.881 29.613 9.819 1.00 23.11 C ATOM 2120 O SER A1029 7.282 30.199 8.901 1.00 22.63 O ATOM 2121 CB SER A1029 9.876 30.545 10.933 1.00 24.42 C ATOM 2122 OG SER A1029 9.295 31.826 10.736 1.00 25.50 O ATOM 2123 HG SER A1029 9.605 32.441 11.447 1.00 0.00 H ATOM 2124 H SER A1029 10.525 30.857 8.493 1.00 0.00 H ATOM 2125 N PRO A1030 7.280 28.940 10.775 1.00 22.06 N ATOM 2126 CA PRO A1030 5.802 28.998 10.801 1.00 22.17 C ATOM 2127 C PRO A1030 5.241 30.416 10.852 1.00 23.07 C ATOM 2128 O PRO A1030 4.279 30.722 10.135 1.00 22.93 O ATOM 2129 CB PRO A1030 5.472 28.133 12.008 1.00 21.75 C ATOM 2130 CG PRO A1030 6.529 27.101 12.017 1.00 22.08 C ATOM 2131 CD PRO A1030 7.772 27.902 11.700 1.00 21.96 C ATOM 2132 N SER A1031 5.850 31.297 11.651 1.00 24.23 N ATOM 2133 CA SER A1031 5.432 32.698 11.681 1.00 24.40 C ATOM 2134 C SER A1031 5.660 33.395 10.355 1.00 24.94 C ATOM 2135 O SER A1031 4.796 34.171 9.903 1.00 24.82 O ATOM 2136 CB SER A1031 6.070 33.473 12.848 1.00 25.27 C ATOM 2137 OG SER A1031 7.448 33.628 12.655 1.00 27.39 O ATOM 2138 HG SER A1031 7.874 32.736 12.595 1.00 0.00 H ATOM 2139 H SER A1031 6.632 30.982 12.260 1.00 0.00 H ATOM 2140 N ALA A1032 6.769 33.127 9.672 1.00 23.87 N ATOM 2141 CA ALA A1032 6.960 33.750 8.377 1.00 25.30 C ATOM 2142 C ALA A1032 5.935 33.264 7.346 1.00 25.07 C ATOM 2143 O ALA A1032 5.448 34.036 6.521 1.00 27.06 O ATOM 2144 CB ALA A1032 8.365 33.522 7.886 1.00 25.44 C ATOM 2145 H ALA A1032 7.487 32.482 10.060 1.00 0.00 H ATOM 2146 N GLU A1033 5.635 31.977 7.349 1.00 25.14 N ATOM 2147 CA GLU A1033 4.686 31.408 6.395 1.00 25.48 C ATOM 2148 C GLU A1033 3.269 31.968 6.637 1.00 25.44 C ATOM 2149 O GLU A1033 2.515 32.281 5.701 1.00 26.45 O ATOM 2150 CB GLU A1033 4.651 29.898 6.494 1.00 26.24 C ATOM 2151 CG GLU A1033 5.930 29.183 6.016 1.00 27.63 C ATOM 2152 CD GLU A1033 6.284 29.493 4.573 1.00 30.02 C ATOM 2153 OE1 GLU A1033 5.409 29.726 3.772 1.00 30.99 O ATOM 2154 OE2 GLU A1033 7.503 29.516 4.219 1.00 32.38 O ATOM 2155 H GLU A1033 6.086 31.353 8.048 1.00 0.00 H ATOM 2156 N PHE A1034 2.929 32.093 7.904 1.00 24.89 N ATOM 2157 CA PHE A1034 1.691 32.724 8.308 1.00 25.21 C ATOM 2158 C PHE A1034 1.611 34.153 7.727 1.00 26.46 C ATOM 2159 O PHE A1034 0.602 34.510 7.149 1.00 26.50 O ATOM 2160 CB PHE A1034 1.493 32.743 9.830 1.00 24.17 C ATOM 2161 CG PHE A1034 0.321 33.579 10.260 1.00 23.46 C ATOM 2162 CD1 PHE A1034 -0.959 33.082 10.182 1.00 23.27 C ATOM 2163 CD2 PHE A1034 0.501 34.872 10.708 1.00 23.78 C ATOM 2164 CE1 PHE A1034 -2.030 33.868 10.540 1.00 23.14 C ATOM 2165 CE2 PHE A1034 -0.588 35.653 11.070 1.00 23.66 C ATOM 2166 CZ PHE A1034 -1.834 35.138 10.989 1.00 23.45 C ATOM 2167 H PHE A1034 3.570 31.727 8.636 1.00 0.00 H ATOM 2168 N LEU A1035 2.657 34.948 7.907 1.00 27.63 N ATOM 2169 CA LEU A1035 2.648 36.352 7.481 1.00 29.09 C ATOM 2170 C LEU A1035 2.536 36.450 5.968 1.00 30.68 C ATOM 2171 O LEU A1035 1.933 37.386 5.451 1.00 31.05 O ATOM 2172 CB LEU A1035 3.888 37.130 7.969 1.00 30.38 C ATOM 2173 CG LEU A1035 4.006 37.362 9.486 1.00 31.26 C ATOM 2174 CD1 LEU A1035 5.338 37.961 9.889 1.00 32.97 C ATOM 2175 CD2 LEU A1035 2.914 38.263 9.981 1.00 31.81 C ATOM 2176 H LEU A1035 3.509 34.565 8.364 1.00 0.00 H ATOM 2177 N ARG A1036 3.087 35.478 5.270 1.00 31.98 N ATOM 2178 CA ARG A1036 2.916 35.367 3.822 1.00 36.44 C ATOM 2179 C ARG A1036 1.498 34.920 3.418 1.00 37.10 C ATOM 2180 O ARG A1036 0.935 35.439 2.457 1.00 38.52 O ATOM 2181 CB ARG A1036 3.994 34.407 3.276 1.00 39.36 C ATOM 2182 CG ARG A1036 3.828 33.935 1.831 1.00 42.83 C ATOM 2183 CD ARG A1036 4.857 32.853 1.535 1.00 45.76 C ATOM 2184 NE ARG A1036 6.185 33.445 1.611 1.00 50.14 N ATOM 2185 CZ ARG A1036 7.151 33.160 2.490 1.00 54.24 C ATOM 2186 NH1 ARG A1036 7.017 32.230 3.430 1.00 56.56 N ATOM 2187 NH2 ARG A1036 8.301 33.816 2.404 1.00 56.95 N ATOM 2188 HE ARG A1036 6.407 34.172 0.901 1.00 0.00 H ATOM 2189 HH12 ARG A1036 7.797 32.044 4.092 1.00 0.00 H ATOM 2190 HH11 ARG A1036 6.132 31.689 3.504 1.00 0.00 H ATOM 2191 HH22 ARG A1036 9.068 33.612 3.076 1.00 0.00 H ATOM 2192 HH21 ARG A1036 8.436 34.534 1.664 1.00 0.00 H ATOM 2193 H ARG A1036 3.662 34.767 5.765 1.00 0.00 H ATOM 2194 N MET A1037 0.927 33.954 4.127 1.00 37.44 N ATOM 2195 CA MET A1037 -0.354 33.352 3.722 1.00 39.18 C ATOM 2196 C MET A1037 -1.574 34.023 4.305 1.00 39.52 C ATOM 2197 O MET A1037 -2.717 33.741 3.860 1.00 39.30 O ATOM 2198 CB MET A1037 -0.355 31.828 3.939 1.00 41.09 C ATOM 2199 CG MET A1037 -0.867 31.253 5.233 1.00 42.04 C ATOM 2200 SD MET A1037 -1.073 29.459 5.054 1.00 50.78 S ATOM 2201 CE MET A1037 0.656 29.049 4.788 1.00 39.79 C ATOM 2202 H MET A1037 1.396 33.614 4.990 1.00 0.00 H ATOM 2203 N MET A1038 -1.360 34.960 5.226 1.00 39.58 N ATOM 2204 CA MET A1038 -2.506 35.559 5.951 1.00 43.02 C ATOM 2205 C MET A1038 -3.318 36.446 5.021 1.00 43.97 C ATOM 2206 O MET A1038 -4.499 36.697 5.278 1.00 45.14 O ATOM 2207 CB MET A1038 -2.075 36.335 7.201 1.00 43.04 C ATOM 2208 CG MET A1038 -1.312 37.637 6.959 1.00 43.25 C ATOM 2209 SD MET A1038 -1.059 38.431 8.558 1.00 46.73 S ATOM 2210 CE MET A1038 -2.769 38.602 9.112 1.00 45.02 C ATOM 2211 H MET A1038 -0.390 35.271 5.437 1.00 0.00 H ATOM 2212 N GLY A1039 -2.680 36.896 3.944 1.00 45.85 N ATOM 2213 CA GLY A1039 -3.339 37.679 2.923 1.00 48.33 C ATOM 2214 C GLY A1039 -2.932 39.118 3.015 1.00 49.22 C ATOM 2215 O GLY A1039 -2.041 39.503 3.773 1.00 47.81 O ATOM 2216 H GLY A1039 -1.670 36.676 3.832 1.00 0.00 H ATOM 2217 N SER A1040 -3.620 39.915 2.211 1.00 52.12 N ATOM 2218 CA SER A1040 -3.289 41.326 2.033 1.00 53.32 C ATOM 2219 C SER A1040 -3.784 42.203 3.199 1.00 52.94 C ATOM 2220 O SER A1040 -3.228 43.286 3.433 1.00 53.26 O ATOM 2221 CB SER A1040 -3.854 41.803 0.689 1.00 53.07 C ATOM 2222 OG SER A1040 -3.331 41.003 -0.371 1.00 52.82 O ATOM 2223 HG SER A1040 -3.701 41.318 -1.234 1.00 0.00 H ATOM 2224 H SER A1040 -4.427 39.521 1.686 1.00 0.00 H ATOM 2225 N GLU A1041 -4.794 41.710 3.926 1.00 51.58 N ATOM 2226 CA GLU A1041 -5.341 42.372 5.111 1.00 52.37 C ATOM 2227 C GLU A1041 -4.382 42.145 6.281 1.00 53.59 C ATOM 2228 O GLU A1041 -4.273 41.023 6.795 1.00 53.31 O ATOM 2229 CB GLU A1041 -6.743 41.808 5.425 1.00 53.35 C ATOM 2230 CG GLU A1041 -7.674 42.788 6.123 1.00 56.57 C ATOM 2231 CD GLU A1041 -8.223 43.892 5.210 1.00 59.10 C ATOM 2232 OE1 GLU A1041 -9.311 43.716 4.595 1.00 61.77 O ATOM 2233 OE2 GLU A1041 -7.588 44.967 5.133 1.00 59.40 O ATOM 2234 H GLU A1041 -5.214 40.805 3.632 1.00 0.00 H ATOM 2235 N ARG A1042 -3.702 43.214 6.703 1.00 55.53 N ATOM 2236 CA ARG A1042 -2.570 43.126 7.648 1.00 55.72 C ATOM 2237 C ARG A1042 -2.855 43.250 9.174 1.00 51.26 C ATOM 2238 O ARG A1042 -2.259 42.475 9.946 1.00 51.06 O ATOM 2239 CB ARG A1042 -1.527 44.167 7.255 1.00 61.46 C ATOM 2240 CG ARG A1042 -0.939 43.956 5.862 1.00 64.41 C ATOM 2241 CD ARG A1042 -0.177 45.192 5.399 1.00 68.63 C ATOM 2242 NE ARG A1042 1.098 44.858 4.752 1.00 71.38 N ATOM 2243 CZ ARG A1042 2.178 44.368 5.376 1.00 70.71 C ATOM 2244 NH1 ARG A1042 3.283 44.115 4.672 1.00 71.91 N ATOM 2245 NH2 ARG A1042 2.172 44.117 6.693 1.00 69.91 N ATOM 2246 HE ARG A1042 1.169 45.014 3.726 1.00 0.00 H ATOM 2247 HH12 ARG A1042 4.126 43.735 5.147 1.00 0.00 H ATOM 2248 HH11 ARG A1042 3.301 44.298 3.648 1.00 0.00 H ATOM 2249 HH22 ARG A1042 3.023 43.737 7.154 1.00 0.00 H ATOM 2250 HH21 ARG A1042 1.316 44.303 7.254 1.00 0.00 H ATOM 2251 H ARG A1042 -3.982 44.151 6.350 1.00 0.00 H ATOM 2252 N ASP A1043 -3.727 44.194 9.597 1.00 45.81 N ATOM 2253 CA ASP A1043 -4.031 44.497 11.052 1.00 41.79 C ATOM 2254 C ASP A1043 -5.036 43.523 11.697 1.00 36.20 C ATOM 2255 O ASP A1043 -5.820 43.915 12.571 1.00 34.08 O ATOM 2256 CB ASP A1043 -4.647 45.921 11.213 1.00 44.28 C ATOM 2257 CG ASP A1043 -3.617 47.050 11.118 1.00 45.46 C ATOM 2258 OD1 ASP A1043 -2.772 47.247 12.055 1.00 48.15 O ATOM 2259 OD2 ASP A1043 -3.710 47.786 10.142 1.00 45.87 O ATOM 2260 H ASP A1043 -4.224 44.751 8.873 1.00 0.00 H ATOM 2261 N VAL A1044 -5.063 42.284 11.221 1.00 32.99 N ATOM 2262 CA VAL A1044 -5.943 41.273 11.739 1.00 30.55 C ATOM 2263 C VAL A1044 -5.189 40.493 12.808 1.00 26.92 C ATOM 2264 O VAL A1044 -4.030 40.108 12.608 1.00 26.22 O ATOM 2265 CB VAL A1044 -6.392 40.284 10.655 1.00 31.13 C ATOM 2266 CG1 VAL A1044 -7.246 39.211 11.279 1.00 31.70 C ATOM 2267 CG2 VAL A1044 -7.197 41.033 9.547 1.00 33.17 C ATOM 2268 H VAL A1044 -4.421 42.035 10.442 1.00 0.00 H ATOM 2269 N PRO A1045 -5.820 40.262 13.959 1.00 25.29 N ATOM 2270 CA PRO A1045 -5.201 39.505 15.001 1.00 24.44 C ATOM 2271 C PRO A1045 -4.747 38.132 14.477 1.00 24.18 C ATOM 2272 O PRO A1045 -5.496 37.432 13.791 1.00 23.77 O ATOM 2273 CB PRO A1045 -6.309 39.350 16.042 1.00 24.74 C ATOM 2274 CG PRO A1045 -7.048 40.578 15.916 1.00 25.35 C ATOM 2275 CD PRO A1045 -7.031 40.946 14.455 1.00 25.73 C ATOM 2276 N ALA A1046 -3.541 37.751 14.859 1.00 22.91 N ATOM 2277 CA ALA A1046 -2.937 36.583 14.273 1.00 23.06 C ATOM 2278 C ALA A1046 -3.711 35.335 14.683 1.00 22.51 C ATOM 2279 O ALA A1046 -3.948 34.489 13.874 1.00 22.47 O ATOM 2280 CB ALA A1046 -1.467 36.456 14.686 1.00 23.27 C ATOM 2281 H ALA A1046 -3.028 38.294 15.583 1.00 0.00 H ATOM 2282 N LEU A1047 -4.074 35.196 15.949 1.00 22.41 N ATOM 2283 CA LEU A1047 -4.724 33.992 16.393 1.00 22.76 C ATOM 2284 C LEU A1047 -6.050 33.797 15.682 1.00 23.37 C ATOM 2285 O LEU A1047 -6.359 32.667 15.301 1.00 22.63 O ATOM 2286 CB LEU A1047 -4.946 33.998 17.905 1.00 23.85 C ATOM 2287 CG LEU A1047 -5.759 32.869 18.486 1.00 24.97 C ATOM 2288 CD1 LEU A1047 -5.150 31.555 18.106 1.00 24.85 C ATOM 2289 CD2 LEU A1047 -5.811 32.987 20.001 1.00 26.70 C ATOM 2290 H LEU A1047 -3.888 35.963 16.627 1.00 0.00 H ATOM 2291 N SER A1048 -6.782 34.895 15.529 1.00 23.84 N ATOM 2292 CA SER A1048 -8.101 34.878 14.822 1.00 25.19 C ATOM 2293 C SER A1048 -7.932 34.384 13.388 1.00 24.23 C ATOM 2294 O SER A1048 -8.598 33.470 12.924 1.00 24.71 O ATOM 2295 CB SER A1048 -8.669 36.289 14.731 1.00 26.50 C ATOM 2296 OG SER A1048 -8.730 36.811 15.977 1.00 30.28 O ATOM 2297 HG SER A1048 -9.098 37.729 15.931 1.00 0.00 H ATOM 2298 H SER A1048 -6.427 35.794 15.912 1.00 0.00 H ATOM 2299 N ARG A1049 -7.004 34.983 12.705 1.00 23.86 N ATOM 2300 CA ARG A1049 -6.738 34.650 11.333 1.00 23.89 C ATOM 2301 C ARG A1049 -6.190 33.249 11.134 1.00 22.41 C ATOM 2302 O ARG A1049 -6.573 32.532 10.195 1.00 21.93 O ATOM 2303 CB ARG A1049 -5.786 35.680 10.735 1.00 25.79 C ATOM 2304 CG ARG A1049 -5.544 35.504 9.246 1.00 28.09 C ATOM 2305 CD ARG A1049 -6.845 35.482 8.488 1.00 30.81 C ATOM 2306 NE ARG A1049 -6.573 35.419 7.062 1.00 34.05 N ATOM 2307 CZ ARG A1049 -7.376 34.861 6.174 1.00 37.44 C ATOM 2308 NH1 ARG A1049 -8.553 34.346 6.543 1.00 38.45 N ATOM 2309 NH2 ARG A1049 -7.010 34.852 4.895 1.00 39.43 N ATOM 2310 HE ARG A1049 -5.687 35.841 6.718 1.00 0.00 H ATOM 2311 HH12 ARG A1049 -9.175 33.910 5.833 1.00 0.00 H ATOM 2312 HH11 ARG A1049 -8.847 34.382 7.540 1.00 0.00 H ATOM 2313 HH22 ARG A1049 -7.628 34.418 4.180 1.00 0.00 H ATOM 2314 HH21 ARG A1049 -6.106 35.279 4.610 1.00 0.00 H ATOM 2315 H ARG A1049 -6.437 35.725 13.164 1.00 0.00 H ATOM 2316 N LEU A1050 -5.274 32.825 12.007 1.00 20.79 N ATOM 2317 CA LEU A1050 -4.784 31.459 11.954 1.00 20.21 C ATOM 2318 C LEU A1050 -5.896 30.440 12.090 1.00 20.71 C ATOM 2319 O LEU A1050 -5.900 29.443 11.381 1.00 20.29 O ATOM 2320 CB LEU A1050 -3.709 31.205 13.042 1.00 19.85 C ATOM 2321 CG LEU A1050 -3.058 29.836 13.145 1.00 19.43 C ATOM 2322 CD1 LEU A1050 -2.342 29.447 11.866 1.00 19.44 C ATOM 2323 CD2 LEU A1050 -2.149 29.744 14.394 1.00 19.59 C ATOM 2324 H LEU A1050 -4.909 33.477 12.730 1.00 0.00 H ATOM 2325 N LEU A1051 -6.807 30.646 13.042 1.00 21.25 N ATOM 2326 CA LEU A1051 -7.874 29.698 13.211 1.00 21.94 C ATOM 2327 C LEU A1051 -8.732 29.622 11.923 1.00 22.50 C ATOM 2328 O LEU A1051 -9.067 28.534 11.522 1.00 21.87 O ATOM 2329 CB LEU A1051 -8.698 29.995 14.438 1.00 23.24 C ATOM 2330 CG LEU A1051 -8.038 29.516 15.717 1.00 23.91 C ATOM 2331 CD1 LEU A1051 -8.740 30.096 16.912 1.00 24.76 C ATOM 2332 CD2 LEU A1051 -8.060 27.989 15.768 1.00 24.60 C ATOM 2333 H LEU A1051 -6.746 31.484 13.655 1.00 0.00 H ATOM 2334 N GLU A1052 -8.999 30.750 11.276 1.00 22.95 N ATOM 2335 CA GLU A1052 -9.716 30.735 9.984 1.00 24.25 C ATOM 2336 C GLU A1052 -8.954 29.955 8.882 1.00 23.91 C ATOM 2337 O GLU A1052 -9.549 29.178 8.142 1.00 24.42 O ATOM 2338 CB GLU A1052 -9.953 32.143 9.515 1.00 26.17 C ATOM 2339 CG GLU A1052 -10.881 32.971 10.353 1.00 28.94 C ATOM 2340 CD GLU A1052 -10.938 34.434 9.895 1.00 32.89 C ATOM 2341 OE1 GLU A1052 -9.986 34.951 9.231 1.00 35.27 O ATOM 2342 OE2 GLU A1052 -11.981 35.064 10.147 1.00 37.56 O ATOM 2343 H GLU A1052 -8.699 31.658 11.685 1.00 0.00 H ATOM 2344 N LEU A1053 -7.648 30.168 8.764 1.00 23.03 N ATOM 2345 CA LEU A1053 -6.855 29.514 7.731 1.00 22.89 C ATOM 2346 C LEU A1053 -6.868 28.036 7.969 1.00 21.59 C ATOM 2347 O LEU A1053 -6.971 27.273 7.035 1.00 21.63 O ATOM 2348 CB LEU A1053 -5.407 30.004 7.731 1.00 24.31 C ATOM 2349 CG LEU A1053 -5.176 31.470 7.344 1.00 26.25 C ATOM 2350 CD1 LEU A1053 -3.761 31.914 7.701 1.00 27.35 C ATOM 2351 CD2 LEU A1053 -5.400 31.586 5.849 1.00 27.95 C ATOM 2352 H LEU A1053 -7.179 30.819 9.426 1.00 0.00 H ATOM 2353 N LEU A1054 -6.761 27.611 9.237 1.00 20.65 N ATOM 2354 CA LEU A1054 -6.724 26.196 9.533 1.00 20.38 C ATOM 2355 C LEU A1054 -8.072 25.587 9.256 1.00 21.62 C ATOM 2356 O LEU A1054 -8.162 24.489 8.717 1.00 21.38 O ATOM 2357 CB LEU A1054 -6.273 25.935 11.004 1.00 20.35 C ATOM 2358 CG LEU A1054 -4.835 26.327 11.324 1.00 19.80 C ATOM 2359 CD1 LEU A1054 -4.613 26.228 12.848 1.00 19.67 C ATOM 2360 CD2 LEU A1054 -3.814 25.525 10.527 1.00 18.95 C ATOM 2361 H LEU A1054 -6.704 28.303 10.011 1.00 0.00 H ATOM 2362 N GLU A1055 -9.119 26.343 9.564 1.00 22.22 N ATOM 2363 CA GLU A1055 -10.460 25.794 9.333 1.00 24.26 C ATOM 2364 C GLU A1055 -10.698 25.592 7.849 1.00 25.16 C ATOM 2365 O GLU A1055 -11.365 24.611 7.481 1.00 25.49 O ATOM 2366 CB GLU A1055 -11.506 26.677 9.957 1.00 26.07 C ATOM 2367 CG GLU A1055 -12.884 26.013 9.997 1.00 28.01 C ATOM 2368 CD GLU A1055 -12.964 24.740 10.850 1.00 30.02 C ATOM 2369 OE1 GLU A1055 -13.607 23.776 10.385 1.00 33.09 O ATOM 2370 OE2 GLU A1055 -12.412 24.696 11.989 1.00 30.59 O ATOM 2371 H GLU A1055 -8.992 27.297 9.958 1.00 0.00 H ATOM 2372 N GLU A1056 -10.189 26.492 7.013 1.00 25.84 N ATOM 2373 CA GLU A1056 -10.288 26.393 5.535 1.00 28.07 C ATOM 2374 C GLU A1056 -9.450 25.269 4.949 1.00 27.61 C ATOM 2375 O GLU A1056 -9.519 25.049 3.746 1.00 28.42 O ATOM 2376 CB GLU A1056 -9.841 27.686 4.857 1.00 30.50 C ATOM 2377 CG GLU A1056 -10.756 28.836 5.154 1.00 34.19 C ATOM 2378 CD GLU A1056 -10.229 30.198 4.734 1.00 38.81 C ATOM 2379 OE1 GLU A1056 -9.087 30.304 4.197 1.00 41.79 O ATOM 2380 OE2 GLU A1056 -11.001 31.174 4.961 1.00 42.57 O ATOM 2381 H GLU A1056 -9.693 27.312 7.417 1.00 0.00 H ATOM 2382 N GLY A1057 -8.603 24.616 5.773 1.00 24.98 N ATOM 2383 CA GLY A1057 -7.771 23.519 5.341 1.00 24.71 C ATOM 2384 C GLY A1057 -6.360 23.931 4.928 1.00 24.15 C ATOM 2385 O GLY A1057 -5.612 23.108 4.405 1.00 25.08 O ATOM 2386 H GLY A1057 -8.548 24.918 6.767 1.00 0.00 H ATOM 2387 N GLN A1058 -6.001 25.197 5.085 1.00 23.77 N ATOM 2388 CA GLN A1058 -4.681 25.617 4.718 1.00 23.92 C ATOM 2389 C GLN A1058 -3.665 25.086 5.735 1.00 22.80 C ATOM 2390 O GLN A1058 -3.981 24.998 6.916 1.00 22.04 O ATOM 2391 CB GLN A1058 -4.547 27.119 4.666 1.00 26.16 C ATOM 2392 CG GLN A1058 -5.570 27.743 3.716 1.00 29.42 C ATOM 2393 CD GLN A1058 -5.089 28.958 2.961 1.00 33.24 C ATOM 2394 OE1 GLN A1058 -3.912 29.109 2.674 1.00 36.67 O ATOM 2395 NE2 GLN A1058 -6.037 29.814 2.574 1.00 36.84 N ATOM 2396 HE22 GLN A1058 -7.028 29.647 2.841 1.00 0.00 H ATOM 2397 HE21 GLN A1058 -5.784 30.648 2.006 1.00 0.00 H ATOM 2398 H GLN A1058 -6.677 25.885 5.474 1.00 0.00 H ATOM 2399 N ARG A1059 -2.473 24.776 5.244 1.00 21.97 N ATOM 2400 CA ARG A1059 -1.422 24.205 6.091 1.00 21.23 C ATOM 2401 C ARG A1059 -0.049 24.723 5.602 1.00 22.04 C ATOM 2402 O ARG A1059 0.102 25.348 4.545 1.00 22.14 O ATOM 2403 CB ARG A1059 -1.400 22.672 6.032 1.00 21.01 C ATOM 2404 CG ARG A1059 -2.639 21.910 6.477 1.00 20.69 C ATOM 2405 CD ARG A1059 -2.889 22.051 7.965 1.00 20.15 C ATOM 2406 NE ARG A1059 -4.062 21.301 8.486 1.00 20.45 N ATOM 2407 CZ ARG A1059 -5.294 21.796 8.632 1.00 20.12 C ATOM 2408 NH1 ARG A1059 -5.545 23.052 8.332 1.00 19.53 N ATOM 2409 NH2 ARG A1059 -6.252 21.036 9.196 1.00 20.76 N ATOM 2410 HE ARG A1059 -3.911 20.309 8.759 1.00 0.00 H ATOM 2411 HH12 ARG A1059 -6.506 23.432 8.448 1.00 0.00 H ATOM 2412 HH11 ARG A1059 -4.782 23.665 7.979 1.00 0.00 H ATOM 2413 HH22 ARG A1059 -7.214 21.414 9.313 1.00 0.00 H ATOM 2414 HH21 ARG A1059 -6.030 20.071 9.514 1.00 0.00 H ATOM 2415 H ARG A1059 -2.280 24.942 4.236 1.00 0.00 H ATOM 2416 N LEU A1060 0.931 24.546 6.462 1.00 21.66 N ATOM 2417 CA LEU A1060 2.283 24.876 6.095 1.00 22.86 C ATOM 2418 C LEU A1060 2.682 24.118 4.815 1.00 24.40 C ATOM 2419 O LEU A1060 2.371 22.915 4.649 1.00 24.69 O ATOM 2420 CB LEU A1060 3.202 24.459 7.228 1.00 22.12 C ATOM 2421 CG LEU A1060 3.130 25.331 8.472 1.00 21.67 C ATOM 2422 CD1 LEU A1060 3.766 24.621 9.626 1.00 21.83 C ATOM 2423 CD2 LEU A1060 3.729 26.700 8.288 1.00 22.43 C ATOM 2424 H LEU A1060 0.728 24.167 7.409 1.00 0.00 H ATOM 2425 N PRO A1061 3.412 24.801 3.932 1.00 25.67 N ATOM 2426 CA PRO A1061 3.824 24.174 2.665 1.00 27.30 C ATOM 2427 C PRO A1061 4.904 23.112 2.824 1.00 27.90 C ATOM 2428 O PRO A1061 5.597 23.074 3.846 1.00 27.96 O ATOM 2429 CB PRO A1061 4.315 25.379 1.844 1.00 27.65 C ATOM 2430 CG PRO A1061 4.813 26.335 2.840 1.00 27.58 C ATOM 2431 CD PRO A1061 3.801 26.213 3.998 1.00 26.39 C ATOM 2432 N ALA A1062 5.026 22.202 1.865 1.00 28.53 N ATOM 2433 CA ALA A1062 6.045 21.167 1.933 1.00 29.17 C ATOM 2434 C ALA A1062 7.388 21.869 1.726 1.00 29.52 C ATOM 2435 O ALA A1062 7.562 22.617 0.765 1.00 29.08 O ATOM 2436 CB ALA A1062 5.829 20.103 0.873 1.00 30.07 C ATOM 2437 H ALA A1062 4.381 22.230 1.050 1.00 0.00 H ATOM 2438 N PRO A1063 8.296 21.698 2.657 1.00 29.62 N ATOM 2439 CA PRO A1063 9.651 22.214 2.383 1.00 31.13 C ATOM 2440 C PRO A1063 10.245 21.560 1.100 1.00 32.80 C ATOM 2441 O PRO A1063 10.095 20.355 0.886 1.00 30.27 O ATOM 2442 CB PRO A1063 10.440 21.808 3.640 1.00 30.82 C ATOM 2443 CG PRO A1063 9.402 21.661 4.704 1.00 29.69 C ATOM 2444 CD PRO A1063 8.181 21.125 4.007 1.00 29.49 C ATOM 2445 N PRO A1064 10.969 22.338 0.290 1.00 37.44 N ATOM 2446 CA PRO A1064 11.427 21.792 -1.008 1.00 39.03 C ATOM 2447 C PRO A1064 12.236 20.522 -0.858 1.00 38.72 C ATOM 2448 O PRO A1064 12.064 19.593 -1.640 1.00 41.28 O ATOM 2449 CB PRO A1064 12.308 22.918 -1.566 1.00 41.26 C ATOM 2450 CG PRO A1064 12.864 23.591 -0.338 1.00 41.24 C ATOM 2451 CD PRO A1064 11.757 23.519 0.696 1.00 40.05 C ATOM 2452 N ALA A1065 13.058 20.461 0.173 1.00 37.60 N ATOM 2453 CA ALA A1065 13.941 19.344 0.396 1.00 38.61 C ATOM 2454 C ALA A1065 13.308 18.183 1.162 1.00 37.84 C ATOM 2455 O ALA A1065 13.934 17.144 1.329 1.00 39.44 O ATOM 2456 CB ALA A1065 15.194 19.838 1.110 1.00 39.34 C ATOM 2457 H ALA A1065 13.069 21.250 0.851 1.00 0.00 H ATOM 2458 N CYS A1066 12.050 18.324 1.582 1.00 35.28 N ATOM 2459 CA CYS A1066 11.422 17.335 2.418 1.00 33.77 C ATOM 2460 C CYS A1066 10.966 16.158 1.564 1.00 32.05 C ATOM 2461 O CYS A1066 10.285 16.373 0.572 1.00 31.65 O ATOM 2462 CB CYS A1066 10.225 17.995 3.069 1.00 34.24 C ATOM 2463 SG CYS A1066 9.302 16.975 4.179 1.00 34.65 S ATOM 2464 H CYS A1066 11.511 19.167 1.299 1.00 0.00 H ATOM 2465 N PRO A1067 11.306 14.923 1.952 1.00 31.92 N ATOM 2466 CA PRO A1067 10.773 13.780 1.237 1.00 31.06 C ATOM 2467 C PRO A1067 9.249 13.785 1.212 1.00 30.22 C ATOM 2468 O PRO A1067 8.626 14.190 2.185 1.00 28.86 O ATOM 2469 CB PRO A1067 11.286 12.577 2.045 1.00 31.24 C ATOM 2470 CG PRO A1067 12.469 13.057 2.786 1.00 31.61 C ATOM 2471 CD PRO A1067 12.223 14.524 3.039 1.00 31.86 C ATOM 2472 N ALA A1068 8.662 13.374 0.097 1.00 29.89 N ATOM 2473 CA ALA A1068 7.201 13.381 -0.039 1.00 29.39 C ATOM 2474 C ALA A1068 6.564 12.557 1.044 1.00 29.21 C ATOM 2475 O ALA A1068 5.476 12.906 1.488 1.00 28.92 O ATOM 2476 CB ALA A1068 6.764 12.866 -1.406 1.00 31.15 C ATOM 2477 H ALA A1068 9.247 13.041 -0.695 1.00 0.00 H ATOM 2478 N GLU A1069 7.202 11.461 1.464 1.00 28.40 N ATOM 2479 CA GLU A1069 6.557 10.586 2.450 1.00 29.52 C ATOM 2480 C GLU A1069 6.468 11.289 3.812 1.00 27.65 C ATOM 2481 O GLU A1069 5.495 11.111 4.536 1.00 27.44 O ATOM 2482 CB GLU A1069 7.251 9.244 2.564 1.00 32.69 C ATOM 2483 CG GLU A1069 7.273 8.403 1.292 1.00 36.00 C ATOM 2484 CD GLU A1069 8.492 8.667 0.376 1.00 40.84 C ATOM 2485 OE1 GLU A1069 8.990 9.848 0.243 1.00 43.12 O ATOM 2486 OE2 GLU A1069 8.932 7.671 -0.256 1.00 44.64 O ATOM 2487 H GLU A1069 8.147 11.230 1.096 1.00 0.00 H ATOM 2488 N VAL A1070 7.449 12.145 4.112 1.00 26.69 N ATOM 2489 CA VAL A1070 7.483 12.909 5.354 1.00 26.14 C ATOM 2490 C VAL A1070 6.440 14.031 5.315 1.00 25.78 C ATOM 2491 O VAL A1070 5.722 14.276 6.306 1.00 25.44 O ATOM 2492 CB VAL A1070 8.897 13.503 5.638 1.00 26.30 C ATOM 2493 CG1 VAL A1070 8.855 14.370 6.890 1.00 26.07 C ATOM 2494 CG2 VAL A1070 9.925 12.388 5.786 1.00 26.79 C ATOM 2495 H VAL A1070 8.223 12.272 3.429 1.00 0.00 H ATOM 2496 N HIS A1071 6.304 14.681 4.172 1.00 25.90 N ATOM 2497 CA HIS A1071 5.241 15.674 4.047 1.00 26.46 C ATOM 2498 C HIS A1071 3.829 15.062 4.245 1.00 25.21 C ATOM 2499 O HIS A1071 2.928 15.671 4.914 1.00 25.16 O ATOM 2500 CB HIS A1071 5.341 16.354 2.718 1.00 28.05 C ATOM 2501 CG HIS A1071 4.301 17.385 2.505 1.00 29.74 C ATOM 2502 ND1 HIS A1071 3.503 17.407 1.383 1.00 31.11 N ATOM 2503 CD2 HIS A1071 3.897 18.419 3.286 1.00 29.92 C ATOM 2504 CE1 HIS A1071 2.685 18.443 1.460 1.00 31.00 C ATOM 2505 NE2 HIS A1071 2.900 19.067 2.610 1.00 29.68 N ATOM 2506 H HIS A1071 6.944 14.488 3.375 1.00 0.00 H ATOM 2507 N GLU A1072 3.638 13.855 3.735 1.00 24.91 N ATOM 2508 CA GLU A1072 2.374 13.185 3.895 1.00 25.13 C ATOM 2509 C GLU A1072 2.118 12.863 5.363 1.00 24.60 C ATOM 2510 O GLU A1072 0.959 12.974 5.818 1.00 24.17 O ATOM 2511 CB GLU A1072 2.311 11.929 3.042 1.00 26.18 C ATOM 2512 CG GLU A1072 2.108 12.200 1.540 1.00 27.22 C ATOM 2513 CD GLU A1072 0.949 13.117 1.216 1.00 27.94 C ATOM 2514 OE1 GLU A1072 -0.136 13.014 1.840 1.00 28.45 O ATOM 2515 OE2 GLU A1072 1.122 13.958 0.319 1.00 28.21 O ATOM 2516 H GLU A1072 4.407 13.387 3.215 1.00 0.00 H ATOM 2517 N LEU A1073 3.173 12.481 6.087 1.00 23.08 N ATOM 2518 CA LEU A1073 3.025 12.271 7.543 1.00 23.46 C ATOM 2519 C LEU A1073 2.641 13.592 8.221 1.00 22.67 C ATOM 2520 O LEU A1073 1.762 13.588 9.117 1.00 22.65 O ATOM 2521 CB LEU A1073 4.270 11.676 8.188 1.00 24.18 C ATOM 2522 CG LEU A1073 4.666 10.260 7.730 1.00 25.61 C ATOM 2523 CD1 LEU A1073 5.970 9.792 8.376 1.00 26.07 C ATOM 2524 CD2 LEU A1073 3.524 9.257 7.920 1.00 26.55 C ATOM 2525 H LEU A1073 4.095 12.332 5.629 1.00 0.00 H ATOM 2526 N MET A1074 3.256 14.705 7.835 1.00 22.33 N ATOM 2527 CA MET A1074 2.875 16.015 8.399 1.00 23.14 C ATOM 2528 C MET A1074 1.412 16.307 8.227 1.00 23.00 C ATOM 2529 O MET A1074 0.738 16.701 9.142 1.00 21.36 O ATOM 2530 CB MET A1074 3.649 17.197 7.773 1.00 24.90 C ATOM 2531 CG MET A1074 5.069 17.311 8.219 1.00 26.50 C ATOM 2532 SD MET A1074 5.833 18.707 7.256 1.00 30.13 S ATOM 2533 CE MET A1074 7.513 18.140 7.105 1.00 31.15 C ATOM 2534 H MET A1074 4.015 14.652 7.126 1.00 0.00 H ATOM 2535 N LYS A1075 0.947 16.128 7.004 1.00 22.59 N ATOM 2536 CA LYS A1075 -0.485 16.342 6.676 1.00 23.37 C ATOM 2537 C LYS A1075 -1.400 15.504 7.527 1.00 22.71 C ATOM 2538 O LYS A1075 -2.436 16.021 7.990 1.00 23.58 O ATOM 2539 CB LYS A1075 -0.759 16.218 5.180 1.00 25.42 C ATOM 2540 CG LYS A1075 -0.152 17.420 4.458 1.00 27.41 C ATOM 2541 CD LYS A1075 -0.409 17.485 2.972 1.00 30.07 C ATOM 2542 CE LYS A1075 -0.205 16.177 2.266 1.00 32.15 C ATOM 2543 NZ LYS A1075 -0.679 16.311 0.837 1.00 35.80 N ATOM 2544 HZ1 LYS A1075 -1.689 16.561 0.830 1.00 0.00 H ATOM 2545 HZ2 LYS A1075 -0.133 17.057 0.360 1.00 0.00 H ATOM 2546 HZ3 LYS A1075 -0.541 15.407 0.341 1.00 0.00 H ATOM 2547 H LYS A1075 1.600 15.830 6.252 1.00 0.00 H ATOM 2548 N LEU A1076 -1.044 14.249 7.768 1.00 22.02 N ATOM 2549 CA LEU A1076 -1.869 13.380 8.616 1.00 22.27 C ATOM 2550 C LEU A1076 -1.837 13.858 10.093 1.00 20.95 C ATOM 2551 O LEU A1076 -2.872 13.879 10.745 1.00 19.88 O ATOM 2552 CB LEU A1076 -1.393 11.945 8.553 1.00 23.49 C ATOM 2553 CG LEU A1076 -1.504 11.248 7.194 1.00 24.48 C ATOM 2554 CD1 LEU A1076 -0.937 9.853 7.387 1.00 25.35 C ATOM 2555 CD2 LEU A1076 -2.929 11.235 6.619 1.00 25.95 C ATOM 2556 H LEU A1076 -0.168 13.875 7.350 1.00 0.00 H ATOM 2557 N CYS A1077 -0.677 14.284 10.579 1.00 20.20 N ATOM 2558 CA CYS A1077 -0.576 14.924 11.910 1.00 20.12 C ATOM 2559 C CYS A1077 -1.472 16.159 12.063 1.00 19.47 C ATOM 2560 O CYS A1077 -1.914 16.502 13.194 1.00 19.43 O ATOM 2561 CB CYS A1077 0.855 15.384 12.241 1.00 19.98 C ATOM 2562 SG CYS A1077 2.042 14.003 12.439 1.00 20.42 S ATOM 2563 H CYS A1077 0.184 14.165 10.009 1.00 0.00 H ATOM 2564 N TRP A1078 -1.727 16.830 10.945 1.00 19.12 N ATOM 2565 CA TRP A1078 -2.561 18.007 10.953 1.00 18.48 C ATOM 2566 C TRP A1078 -3.988 17.752 10.508 1.00 18.91 C ATOM 2567 O TRP A1078 -4.669 18.715 10.114 1.00 18.87 O ATOM 2568 CB TRP A1078 -1.920 19.098 10.133 1.00 18.48 C ATOM 2569 CG TRP A1078 -0.515 19.474 10.540 1.00 18.23 C ATOM 2570 CD1 TRP A1078 0.006 19.477 11.808 1.00 18.17 C ATOM 2571 CD2 TRP A1078 0.531 19.934 9.686 1.00 18.26 C ATOM 2572 NE1 TRP A1078 1.346 19.869 11.772 1.00 17.85 N ATOM 2573 CE2 TRP A1078 1.677 20.200 10.495 1.00 17.98 C ATOM 2574 CE3 TRP A1078 0.620 20.151 8.316 1.00 18.70 C ATOM 2575 CZ2 TRP A1078 2.886 20.638 9.960 1.00 18.50 C ATOM 2576 CZ3 TRP A1078 1.809 20.608 7.792 1.00 19.03 C ATOM 2577 CH2 TRP A1078 2.934 20.839 8.609 1.00 18.82 C ATOM 2578 HE1 TRP A1078 1.987 19.902 12.590 1.00 0.00 H ATOM 2579 H TRP A1078 -1.318 16.501 10.047 1.00 0.00 H ATOM 2580 N ALA A1079 -4.462 16.516 10.620 1.00 18.75 N ATOM 2581 CA ALA A1079 -5.928 16.279 10.396 1.00 19.39 C ATOM 2582 C ALA A1079 -6.751 17.160 11.342 1.00 19.65 C ATOM 2583 O ALA A1079 -6.393 17.367 12.502 1.00 18.82 O ATOM 2584 CB ALA A1079 -6.293 14.845 10.656 1.00 19.82 C ATOM 2585 H ALA A1079 -3.829 15.726 10.859 1.00 0.00 H ATOM 2586 N PRO A1080 -7.869 17.687 10.827 1.00 19.75 N ATOM 2587 CA PRO A1080 -8.733 18.555 11.613 1.00 20.93 C ATOM 2588 C PRO A1080 -9.268 17.918 12.866 1.00 21.58 C ATOM 2589 O PRO A1080 -9.184 18.523 13.933 1.00 21.99 O ATOM 2590 CB PRO A1080 -9.846 18.885 10.646 1.00 20.87 C ATOM 2591 CG PRO A1080 -9.344 18.644 9.337 1.00 21.11 C ATOM 2592 CD PRO A1080 -8.205 17.738 9.383 1.00 20.61 C ATOM 2593 N SER A1081 -9.686 16.671 12.753 1.00 22.59 N ATOM 2594 CA SER A1081 -10.281 15.966 13.864 1.00 24.09 C ATOM 2595 C SER A1081 -9.155 15.253 14.616 1.00 23.83 C ATOM 2596 O SER A1081 -8.394 14.500 14.017 1.00 22.86 O ATOM 2597 CB SER A1081 -11.241 14.924 13.368 1.00 26.18 C ATOM 2598 OG SER A1081 -11.643 14.122 14.468 1.00 28.90 O ATOM 2599 HG SER A1081 -12.277 13.429 14.155 1.00 0.00 H ATOM 2600 H SER A1081 -9.584 16.184 11.840 1.00 0.00 H ATOM 2601 N PRO A1082 -9.080 15.431 15.936 1.00 23.81 N ATOM 2602 CA PRO A1082 -7.977 14.767 16.672 1.00 23.60 C ATOM 2603 C PRO A1082 -7.974 13.255 16.517 1.00 24.44 C ATOM 2604 O PRO A1082 -6.934 12.617 16.498 1.00 23.10 O ATOM 2605 CB PRO A1082 -8.279 15.123 18.128 1.00 23.69 C ATOM 2606 CG PRO A1082 -9.006 16.412 18.014 1.00 24.03 C ATOM 2607 CD PRO A1082 -9.824 16.364 16.769 1.00 24.04 C ATOM 2608 N GLN A1083 -9.177 12.677 16.404 1.00 25.23 N ATOM 2609 CA GLN A1083 -9.305 11.249 16.268 1.00 27.99 C ATOM 2610 C GLN A1083 -8.874 10.732 14.916 1.00 27.04 C ATOM 2611 O GLN A1083 -8.739 9.507 14.749 1.00 30.25 O ATOM 2612 CB GLN A1083 -10.755 10.799 16.483 1.00 30.68 C ATOM 2613 CG GLN A1083 -11.114 10.660 17.939 1.00 33.77 C ATOM 2614 CD GLN A1083 -11.129 11.974 18.684 1.00 37.32 C ATOM 2615 OE1 GLN A1083 -10.597 12.053 19.799 1.00 43.08 O ATOM 2616 NE2 GLN A1083 -11.723 13.042 18.064 1.00 39.62 N ATOM 2617 HE22 GLN A1083 -12.157 12.924 17.126 1.00 0.00 H ATOM 2618 HE21 GLN A1083 -11.740 13.971 18.531 1.00 0.00 H ATOM 2619 H GLN A1083 -10.032 13.269 16.415 1.00 0.00 H ATOM 2620 N ASP A1084 -8.666 11.593 13.944 1.00 25.38 N ATOM 2621 CA ASP A1084 -8.189 11.162 12.642 1.00 25.66 C ATOM 2622 C ASP A1084 -6.677 11.252 12.482 1.00 24.68 C ATOM 2623 O ASP A1084 -6.135 10.917 11.436 1.00 26.63 O ATOM 2624 CB ASP A1084 -8.834 12.004 11.549 1.00 26.84 C ATOM 2625 CG ASP A1084 -10.324 11.666 11.377 1.00 29.50 C ATOM 2626 OD1 ASP A1084 -10.726 10.543 11.783 1.00 32.20 O ATOM 2627 OD2 ASP A1084 -11.102 12.515 10.886 1.00 29.80 O ATOM 2628 H ASP A1084 -8.847 12.603 14.111 1.00 0.00 H ATOM 2629 N ARG A1085 -6.028 11.821 13.467 1.00 22.63 N ATOM 2630 CA ARG A1085 -4.587 11.935 13.427 1.00 21.38 C ATOM 2631 C ARG A1085 -4.007 10.586 13.833 1.00 21.91 C ATOM 2632 O ARG A1085 -4.549 9.894 14.674 1.00 23.31 O ATOM 2633 CB ARG A1085 -4.143 13.013 14.395 1.00 20.05 C ATOM 2634 CG ARG A1085 -4.602 14.389 14.040 1.00 19.44 C ATOM 2635 CD ARG A1085 -4.290 15.423 15.122 1.00 18.88 C ATOM 2636 NE ARG A1085 -5.115 16.578 14.929 1.00 18.39 N ATOM 2637 CZ ARG A1085 -5.547 17.398 15.880 1.00 18.34 C ATOM 2638 NH1 ARG A1085 -5.122 17.290 17.119 1.00 17.69 N ATOM 2639 NH2 ARG A1085 -6.468 18.317 15.606 1.00 18.49 N ATOM 2640 HE ARG A1085 -5.402 16.795 13.953 1.00 0.00 H ATOM 2641 HH12 ARG A1085 -5.474 17.943 17.848 1.00 0.00 H ATOM 2642 HH11 ARG A1085 -4.434 16.552 17.370 1.00 0.00 H ATOM 2643 HH22 ARG A1085 -6.803 18.957 16.354 1.00 0.00 H ATOM 2644 HH21 ARG A1085 -6.853 18.396 14.643 1.00 0.00 H ATOM 2645 H ARG A1085 -6.553 12.194 14.284 1.00 0.00 H ATOM 2646 N PRO A1086 -2.874 10.199 13.243 1.00 21.33 N ATOM 2647 CA PRO A1086 -2.234 8.955 13.637 1.00 21.83 C ATOM 2648 C PRO A1086 -1.695 9.042 15.070 1.00 22.17 C ATOM 2649 O PRO A1086 -1.413 10.125 15.512 1.00 23.44 O ATOM 2650 CB PRO A1086 -1.073 8.851 12.656 1.00 21.47 C ATOM 2651 CG PRO A1086 -0.796 10.269 12.253 1.00 21.34 C ATOM 2652 CD PRO A1086 -2.098 10.970 12.266 1.00 21.48 C ATOM 2653 N SER A1087 -1.612 7.937 15.792 1.00 22.43 N ATOM 2654 CA SER A1087 -0.903 7.943 17.081 1.00 22.68 C ATOM 2655 C SER A1087 0.611 8.006 16.800 1.00 21.67 C ATOM 2656 O SER A1087 1.087 7.682 15.701 1.00 20.97 O ATOM 2657 CB SER A1087 -1.191 6.713 17.918 1.00 23.77 C ATOM 2658 OG SER A1087 -0.793 5.577 17.226 1.00 26.03 O ATOM 2659 HG SER A1087 -1.292 5.520 16.373 1.00 0.00 H ATOM 2660 H SER A1087 -2.050 7.059 15.447 1.00 0.00 H ATOM 2661 N PHE A1088 1.386 8.309 17.838 1.00 20.95 N ATOM 2662 CA PHE A1088 2.832 8.176 17.740 1.00 21.04 C ATOM 2663 C PHE A1088 3.252 6.718 17.472 1.00 22.78 C ATOM 2664 O PHE A1088 4.209 6.491 16.734 1.00 21.81 O ATOM 2665 CB PHE A1088 3.464 8.736 19.016 1.00 19.74 C ATOM 2666 CG PHE A1088 3.401 10.211 19.112 1.00 18.27 C ATOM 2667 CD1 PHE A1088 4.185 11.014 18.271 1.00 18.09 C ATOM 2668 CD2 PHE A1088 2.601 10.828 20.050 1.00 18.18 C ATOM 2669 CE1 PHE A1088 4.130 12.415 18.358 1.00 17.52 C ATOM 2670 CE2 PHE A1088 2.576 12.223 20.154 1.00 17.50 C ATOM 2671 CZ PHE A1088 3.330 13.004 19.339 1.00 17.28 C ATOM 2672 H PHE A1088 0.956 8.643 18.724 1.00 0.00 H ATOM 2673 N SER A1089 2.485 5.751 18.025 1.00 25.20 N ATOM 2674 CA SER A1089 2.713 4.313 17.783 1.00 27.04 C ATOM 2675 C SER A1089 2.536 3.969 16.321 1.00 26.90 C ATOM 2676 O SER A1089 3.174 3.068 15.847 1.00 28.42 O ATOM 2677 CB SER A1089 1.733 3.447 18.587 1.00 29.52 C ATOM 2678 OG SER A1089 1.847 3.723 19.963 1.00 33.77 O ATOM 2679 HG SER A1089 2.770 3.528 20.262 1.00 0.00 H ATOM 2680 H SER A1089 1.701 6.033 18.647 1.00 0.00 H ATOM 2681 N ALA A1090 1.691 4.688 15.602 1.00 25.23 N ATOM 2682 CA ALA A1090 1.496 4.464 14.148 1.00 24.70 C ATOM 2683 C ALA A1090 2.506 5.215 13.306 1.00 23.64 C ATOM 2684 O ALA A1090 2.949 4.709 12.317 1.00 24.46 O ATOM 2685 CB ALA A1090 0.063 4.820 13.725 1.00 24.39 C ATOM 2686 H ALA A1090 1.144 5.437 16.072 1.00 0.00 H ATOM 2687 N LEU A1091 2.900 6.417 13.725 1.00 22.41 N ATOM 2688 CA LEU A1091 3.959 7.174 13.077 1.00 21.90 C ATOM 2689 C LEU A1091 5.343 6.539 13.168 1.00 22.17 C ATOM 2690 O LEU A1091 6.128 6.606 12.194 1.00 22.28 O ATOM 2691 CB LEU A1091 4.054 8.571 13.682 1.00 21.55 C ATOM 2692 CG LEU A1091 2.909 9.538 13.426 1.00 21.70 C ATOM 2693 CD1 LEU A1091 3.005 10.782 14.285 1.00 21.51 C ATOM 2694 CD2 LEU A1091 2.897 10.003 11.984 1.00 21.98 C ATOM 2695 H LEU A1091 2.428 6.833 14.553 1.00 0.00 H ATOM 2696 N GLY A1092 5.651 5.989 14.338 1.00 22.08 N ATOM 2697 CA GLY A1092 7.021 5.454 14.623 1.00 23.29 C ATOM 2698 C GLY A1092 7.524 4.479 13.554 1.00 24.00 C ATOM 2699 O GLY A1092 8.577 4.698 12.964 1.00 24.71 O ATOM 2700 H GLY A1092 4.921 5.928 15.076 1.00 0.00 H ATOM 2701 N PRO A1093 6.732 3.441 13.235 1.00 25.54 N ATOM 2702 CA PRO A1093 7.103 2.447 12.216 1.00 26.79 C ATOM 2703 C PRO A1093 7.383 3.096 10.848 1.00 27.06 C ATOM 2704 O PRO A1093 8.301 2.695 10.125 1.00 26.84 O ATOM 2705 CB PRO A1093 5.875 1.496 12.169 1.00 27.51 C ATOM 2706 CG PRO A1093 5.207 1.682 13.507 1.00 27.77 C ATOM 2707 CD PRO A1093 5.447 3.116 13.869 1.00 26.43 C ATOM 2708 N GLN A1094 6.591 4.108 10.503 1.00 27.49 N ATOM 2709 CA GLN A1094 6.727 4.769 9.224 1.00 28.05 C ATOM 2710 C GLN A1094 8.018 5.547 9.200 1.00 27.10 C ATOM 2711 O GLN A1094 8.746 5.464 8.236 1.00 26.31 O ATOM 2712 CB GLN A1094 5.542 5.706 8.947 1.00 30.20 C ATOM 2713 CG GLN A1094 4.248 4.978 8.866 1.00 32.44 C ATOM 2714 CD GLN A1094 4.258 3.951 7.752 1.00 36.75 C ATOM 2715 OE1 GLN A1094 4.809 4.175 6.652 1.00 39.65 O ATOM 2716 NE2 GLN A1094 3.670 2.808 8.026 1.00 40.00 N ATOM 2717 HE22 GLN A1094 3.223 2.662 8.954 1.00 0.00 H ATOM 2718 HE21 GLN A1094 3.651 2.049 7.315 1.00 0.00 H ATOM 2719 H GLN A1094 5.859 4.430 11.167 1.00 0.00 H ATOM 2720 N LEU A1095 8.302 6.317 10.250 1.00 25.62 N ATOM 2721 CA LEU A1095 9.574 7.041 10.293 1.00 25.63 C ATOM 2722 C LEU A1095 10.779 6.087 10.367 1.00 26.56 C ATOM 2723 O LEU A1095 11.857 6.406 9.856 1.00 27.39 O ATOM 2724 CB LEU A1095 9.622 7.967 11.514 1.00 24.72 C ATOM 2725 CG LEU A1095 8.632 9.120 11.483 1.00 24.70 C ATOM 2726 CD1 LEU A1095 8.480 9.800 12.817 1.00 24.45 C ATOM 2727 CD2 LEU A1095 9.024 10.109 10.382 1.00 24.60 C ATOM 2728 H LEU A1095 7.624 6.403 11.034 1.00 0.00 H ATOM 2729 N ASP A1096 10.616 4.984 11.100 1.00 27.18 N ATOM 2730 CA ASP A1096 11.681 3.984 11.243 1.00 28.16 C ATOM 2731 C ASP A1096 11.994 3.363 9.868 1.00 29.80 C ATOM 2732 O ASP A1096 13.147 3.121 9.521 1.00 30.08 O ATOM 2733 CB ASP A1096 11.251 2.893 12.240 1.00 29.12 C ATOM 2734 CG ASP A1096 11.291 3.359 13.703 1.00 29.90 C ATOM 2735 OD1 ASP A1096 11.715 4.482 13.961 1.00 30.41 O ATOM 2736 OD2 ASP A1096 10.778 2.640 14.588 1.00 31.26 O ATOM 2737 H ASP A1096 9.709 4.828 11.584 1.00 0.00 H ATOM 2738 N MET A1097 10.958 3.063 9.102 1.00 31.01 N ATOM 2739 CA MET A1097 11.118 2.515 7.751 1.00 33.82 C ATOM 2740 C MET A1097 11.793 3.545 6.820 1.00 32.75 C ATOM 2741 O MET A1097 12.769 3.226 6.118 1.00 32.94 O ATOM 2742 CB MET A1097 9.756 2.103 7.210 1.00 38.71 C ATOM 2743 CG MET A1097 9.796 1.282 5.954 1.00 44.65 C ATOM 2744 SD MET A1097 8.662 1.987 4.750 1.00 56.98 S ATOM 2745 CE MET A1097 9.602 3.464 4.303 1.00 51.81 C ATOM 2746 H MET A1097 9.998 3.221 9.470 1.00 0.00 H ATOM 2747 N LEU A1098 11.347 4.803 6.870 1.00 31.10 N ATOM 2748 CA LEU A1098 12.014 5.863 6.116 1.00 30.06 C ATOM 2749 C LEU A1098 13.457 6.092 6.523 1.00 29.28 C ATOM 2750 O LEU A1098 14.326 6.133 5.679 1.00 29.50 O ATOM 2751 CB LEU A1098 11.258 7.172 6.234 1.00 29.86 C ATOM 2752 CG LEU A1098 9.880 7.180 5.591 1.00 30.55 C ATOM 2753 CD1 LEU A1098 9.181 8.460 6.002 1.00 30.20 C ATOM 2754 CD2 LEU A1098 9.949 7.074 4.066 1.00 31.60 C ATOM 2755 H LEU A1098 10.516 5.031 7.452 1.00 0.00 H ATOM 2756 N TRP A1099 13.738 6.193 7.816 1.00 28.39 N ATOM 2757 CA TRP A1099 15.117 6.333 8.262 1.00 28.78 C ATOM 2758 C TRP A1099 15.986 5.138 7.807 1.00 30.47 C ATOM 2759 O TRP A1099 17.088 5.327 7.282 1.00 30.33 O ATOM 2760 CB TRP A1099 15.216 6.484 9.779 1.00 28.25 C ATOM 2761 CG TRP A1099 16.615 6.430 10.202 1.00 28.20 C ATOM 2762 CD1 TRP A1099 17.596 7.353 9.934 1.00 28.01 C ATOM 2763 CD2 TRP A1099 17.236 5.371 10.926 1.00 28.49 C ATOM 2764 NE1 TRP A1099 18.793 6.915 10.445 1.00 28.62 N ATOM 2765 CE2 TRP A1099 18.609 5.698 11.052 1.00 29.08 C ATOM 2766 CE3 TRP A1099 16.777 4.156 11.435 1.00 28.79 C ATOM 2767 CZ2 TRP A1099 19.532 4.873 11.757 1.00 29.68 C ATOM 2768 CZ3 TRP A1099 17.688 3.332 12.139 1.00 30.07 C ATOM 2769 CH2 TRP A1099 19.055 3.685 12.260 1.00 29.71 C ATOM 2770 HE1 TRP A1099 19.697 7.425 10.382 1.00 0.00 H ATOM 2771 H TRP A1099 12.968 6.172 8.515 1.00 0.00 H ATOM 2772 N SER A1100 15.502 3.917 8.028 1.00 32.20 N ATOM 2773 CA SER A1100 16.346 2.765 7.741 1.00 35.15 C ATOM 2774 C SER A1100 16.566 2.620 6.242 1.00 35.56 C ATOM 2775 O SER A1100 17.634 2.203 5.820 1.00 36.71 O ATOM 2776 CB SER A1100 15.846 1.483 8.420 1.00 36.20 C ATOM 2777 OG SER A1100 14.558 1.164 8.009 1.00 38.66 O ATOM 2778 HG SER A1100 14.264 0.335 8.463 1.00 0.00 H ATOM 2779 H SER A1100 14.539 3.788 8.399 1.00 0.00 H ATOM 2780 N GLY A1101 15.596 3.024 5.436 1.00 36.92 N ATOM 2781 CA GLY A1101 15.752 3.030 3.980 1.00 37.47 C ATOM 2782 C GLY A1101 16.705 4.104 3.470 1.00 38.33 C ATOM 2783 O GLY A1101 17.066 4.070 2.304 1.00 39.12 O ATOM 2784 H GLY A1101 14.698 3.346 5.849 1.00 0.00 H ATOM 2785 N SER A1102 17.076 5.072 4.320 1.00 37.24 N ATOM 2786 CA SER A1102 17.951 6.211 3.952 1.00 37.67 C ATOM 2787 C SER A1102 19.394 6.027 4.406 1.00 39.74 C ATOM 2788 O SER A1102 20.224 6.874 4.124 1.00 39.81 O ATOM 2789 CB SER A1102 17.438 7.510 4.599 1.00 36.25 C ATOM 2790 OG SER A1102 17.791 7.529 5.979 1.00 34.70 O ATOM 2791 HG SER A1102 17.382 6.751 6.434 1.00 0.00 H ATOM 2792 H SER A1102 16.728 5.021 5.299 1.00 0.00 H ATOM 2793 N ARG A1103 19.684 4.967 5.158 1.00 41.95 N ATOM 2794 CA ARG A1103 21.042 4.689 5.613 1.00 44.39 C ATOM 2795 C ARG A1103 21.871 4.134 4.474 1.00 47.11 C ATOM 2796 O ARG A1103 23.088 4.111 4.591 1.00 49.81 O ATOM 2797 CB ARG A1103 21.056 3.627 6.714 1.00 45.12 C ATOM 2798 CG ARG A1103 20.416 4.061 8.003 1.00 44.94 C ATOM 2799 CD ARG A1103 20.993 3.258 9.155 1.00 46.32 C ATOM 2800 NE ARG A1103 20.229 2.047 9.409 1.00 47.08 N ATOM 2801 CZ ARG A1103 20.462 1.220 10.433 1.00 45.41 C ATOM 2802 NH1 ARG A1103 19.681 0.165 10.615 1.00 43.94 N ATOM 2803 NH2 ARG A1103 21.467 1.447 11.272 1.00 45.90 N ATOM 2804 OXT ARG A1103 21.349 3.643 3.467 1.00 47.99 O ATOM 2805 HE ARG A1103 19.456 1.810 8.755 1.00 0.00 H ATOM 2806 HH12 ARG A1103 19.858 -0.482 11.410 1.00 0.00 H ATOM 2807 HH11 ARG A1103 18.891 -0.016 9.963 1.00 0.00 H ATOM 2808 HH22 ARG A1103 21.639 0.797 12.065 1.00 0.00 H ATOM 2809 HH21 ARG A1103 22.082 2.275 11.135 1.00 0.00 H ATOM 2810 H ARG A1103 18.919 4.317 5.429 1.00 0.00 H TER 2811 ARG A1103 HETATM 2812 O HOH 1 13.457 -0.914 8.225 1.00 44.08 O HETATM 2813 O HOH 2 25.589 25.531 26.905 1.00 36.56 O HETATM 2814 O HOH 3 -6.944 16.993 21.443 1.00 33.01 O HETATM 2815 O HOH 4 0.451 19.051 28.957 1.00 26.77 O HETATM 2816 O HOH 5 -14.323 23.146 8.117 1.00 39.85 O HETATM 2817 O HOH 6 13.321 29.603 13.209 1.00 51.02 O HETATM 2818 O HOH 7 3.971 3.123 21.114 1.00 49.64 O HETATM 2819 O HOH 8 -14.395 17.554 30.112 1.00 38.16 O HETATM 2820 O HOH 9 11.650 27.130 9.754 1.00 25.40 O HETATM 2821 O HOH 10 11.105 25.785 18.046 1.00 20.29 O HETATM 2822 O HOH 11 -4.259 28.125 31.682 1.00 41.71 O HETATM 2823 O HOH 12 -13.493 12.832 10.053 1.00 47.63 O HETATM 2824 O HOH 13 -13.297 12.246 13.926 1.00 42.17 O HETATM 2825 O HOH 14 32.290 26.689 39.696 1.00 41.45 O HETATM 2826 O HOH 15 10.736 23.414 32.210 1.00 31.93 O HETATM 2827 O HOH 16 0.664 25.827 2.072 1.00 38.47 O HETATM 2828 O HOH 17 -8.657 9.807 19.715 1.00 47.60 O HETATM 2829 O HOH 18 11.255 2.963 31.662 1.00 37.50 O HETATM 2830 O HOH 19 0.724 21.116 21.741 1.00 18.97 O HETATM 2831 O HOH 20 1.043 21.000 3.500 1.00 37.21 O HETATM 2832 O HOH 21 10.296 25.747 25.362 1.00 29.68 O HETATM 2833 O HOH 22 -13.449 14.734 19.033 1.00 35.99 O HETATM 2834 O HOH 23 10.835 28.972 17.756 1.00 37.42 O HETATM 2835 O HOH 24 9.372 4.639 22.955 1.00 42.52 O HETATM 2836 O HOH 25 2.125 2.580 11.036 1.00 36.65 O HETATM 2837 O HOH 26 8.254 29.652 32.960 1.00 59.29 O HETATM 2838 O HOH 27 10.752 30.427 26.942 1.00 55.19 O HETATM 2839 O HOH 28 -4.287 31.013 32.006 1.00 46.77 O HETATM 2840 O HOH 29 12.367 5.257 25.021 1.00 35.59 O HETATM 2841 O HOH 30 -0.582 19.160 23.186 1.00 17.22 O HETATM 2842 O HOH 31 23.723 11.181 8.014 1.00 40.60 O HETATM 2843 O HOH 32 -8.291 33.123 33.456 1.00 42.68 O HETATM 2844 O HOH 33 0.638 27.888 26.338 1.00 42.34 O HETATM 2845 O HOH 34 8.233 10.616 40.256 1.00 30.05 O HETATM 2846 O HOH 35 -4.931 11.550 24.578 1.00 18.18 O HETATM 2847 O HOH 36 15.570 5.439 15.414 1.00 41.19 O HETATM 2848 O HOH 37 25.045 15.291 38.937 1.00 50.58 O HETATM 2849 O HOH 38 11.061 18.813 23.869 1.00 32.48 O HETATM 2850 O HOH 39 1.775 12.774 24.510 1.00 20.38 O HETATM 2851 O HOH 40 -1.474 26.246 15.133 1.00 19.80 O HETATM 2852 O HOH 41 9.062 3.999 16.844 1.00 29.60 O HETATM 2853 O HOH 42 23.547 35.606 33.341 1.00 44.10 O HETATM 2854 O HOH 43 -0.537 22.034 30.333 1.00 28.13 O HETATM 2855 O HOH 44 13.960 6.550 3.050 1.00 42.43 O HETATM 2856 O HOH 45 12.993 24.114 30.769 1.00 45.80 O HETATM 2857 O HOH 46 22.368 24.097 19.711 1.00 29.69 O HETATM 2858 O HOH 47 29.437 18.964 17.542 1.00 41.80 O HETATM 2859 O HOH 48 2.736 5.148 22.989 1.00 30.51 O HETATM 2860 O HOH 49 15.386 26.022 4.367 1.00 49.12 O HETATM 2861 O HOH 50 22.933 23.462 51.543 1.00 48.46 O HETATM 2862 O HOH 51 1.480 25.967 45.295 1.00 46.40 O HETATM 2863 O HOH 52 0.181 24.723 13.693 1.00 18.00 O HETATM 2864 O HOH 53 12.114 28.193 28.091 1.00 56.21 O HETATM 2865 O HOH 54 11.853 27.500 42.507 1.00 36.98 O HETATM 2866 O HOH 55 22.345 10.913 29.200 1.00 40.94 O HETATM 2867 O HOH 56 11.913 20.038 32.181 1.00 29.39 O HETATM 2868 O HOH 57 3.890 25.517 24.418 1.00 22.84 O HETATM 2869 O HOH 58 -9.832 20.089 16.063 1.00 26.54 O HETATM 2870 O HOH 59 29.191 25.197 27.200 1.00 36.72 O HETATM 2871 O HOH 60 6.602 36.385 5.764 1.00 38.55 O HETATM 2872 O HOH 61 39.324 17.340 43.794 1.00 38.54 O HETATM 2873 O HOH 62 28.505 20.588 20.104 1.00 46.79 O HETATM 2874 O HOH 63 4.757 19.901 34.312 1.00 26.39 O HETATM 2875 O HOH 64 8.706 2.261 34.138 1.00 41.79 O HETATM 2876 O HOH 65 -2.456 8.789 34.712 1.00 33.04 O HETATM 2877 O HOH 66 24.523 9.024 22.262 1.00 38.98 O HETATM 2878 O HOH 67 14.281 11.834 32.955 1.00 24.27 O HETATM 2879 O HOH 68 22.658 28.259 41.596 1.00 57.54 O HETATM 2880 O HOH 69 -1.573 37.976 27.104 1.00 42.75 O HETATM 2881 O HOH 70 6.077 20.720 28.785 1.00 18.58 O HETATM 2882 O HOH 71 27.538 16.342 9.703 1.00 41.16 O HETATM 2883 O HOH 72 -11.078 32.873 13.960 1.00 37.30 O HETATM 2884 O HOH 73 25.233 17.900 24.330 1.00 22.56 O HETATM 2885 O HOH 74 -3.046 15.918 35.808 1.00 44.01 O HETATM 2886 O HOH 75 8.944 25.796 31.055 1.00 36.54 O HETATM 2887 O HOH 76 25.227 16.810 33.342 1.00 26.06 O HETATM 2888 O HOH 77 27.161 14.479 11.921 1.00 41.88 O HETATM 2889 O HOH 78 14.278 18.971 3.834 1.00 44.90 O HETATM 2890 O HOH 79 7.088 25.589 28.213 1.00 31.49 O HETATM 2891 O HOH 80 4.199 22.709 21.015 1.00 20.22 O HETATM 2892 O HOH 81 18.169 9.913 28.856 1.00 27.87 O HETATM 2893 O HOH 82 3.648 14.989 -0.248 1.00 49.58 O HETATM 2894 O HOH 83 17.098 9.759 35.925 1.00 41.37 O HETATM 2895 O HOH 84 -10.322 43.660 1.998 1.00 43.32 O HETATM 2896 O HOH 85 0.716 24.186 33.300 1.00 46.38 O HETATM 2897 O HOH 86 -0.220 15.838 35.863 1.00 30.49 O HETATM 2898 O HOH 87 8.528 -0.089 10.194 1.00 37.16 O HETATM 2899 O HOH 88 -5.994 20.339 4.245 1.00 36.06 O HETATM 2900 O HOH 89 1.445 6.389 20.724 1.00 32.12 O HETATM 2901 O HOH 90 -6.165 38.193 7.052 1.00 50.77 O HETATM 2902 O HOH 91 -6.079 8.525 22.854 1.00 45.95 O HETATM 2903 O HOH 92 22.114 20.102 3.954 1.00 46.60 O HETATM 2904 O HOH 93 -10.655 22.039 8.530 1.00 41.34 O HETATM 2905 O HOH 94 -2.969 36.845 17.950 1.00 22.38 O HETATM 2906 O HOH 95 -10.126 15.063 10.166 1.00 24.53 O HETATM 2907 O HOH 96 -3.436 18.471 7.007 1.00 26.98 O HETATM 2908 O HOH 97 33.301 19.209 43.863 1.00 31.42 O HETATM 2909 O HOH 98 14.381 9.835 35.631 1.00 38.39 O HETATM 2910 O HOH 99 30.846 24.395 47.241 1.00 53.60 O HETATM 2911 O HOH 100 -2.369 24.332 2.452 1.00 44.54 O HETATM 2912 O HOH 101 -0.585 9.686 19.952 1.00 27.30 O HETATM 2913 O HOH 102 -0.045 8.128 34.203 1.00 21.32 O HETATM 2914 O HOH 103 15.158 4.344 25.853 1.00 34.48 O HETATM 2915 O HOH 104 -11.354 26.707 28.901 1.00 34.59 O HETATM 2916 O HOH 105 3.717 0.423 16.745 1.00 49.24 O HETATM 2917 O HOH 106 5.323 25.004 21.990 1.00 41.15 O HETATM 2918 O HOH 107 13.863 27.144 24.423 1.00 36.95 O HETATM 2919 O HOH 108 2.911 30.018 2.418 1.00 51.14 O HETATM 2920 O HOH 109 22.890 25.391 25.492 1.00 35.22 O HETATM 2921 O HOH 110 21.430 25.957 21.890 1.00 28.17 O HETATM 2922 O HOH 111 -1.807 21.856 20.922 1.00 19.33 O HETATM 2923 O HOH 112 2.152 10.505 23.235 1.00 19.33 O HETATM 2924 O HOH 113 7.730 17.305 43.332 1.00 33.97 O HETATM 2925 O HOH 114 -12.381 29.608 7.903 1.00 37.42 O HETATM 2926 O HOH 115 0.737 35.685 21.860 1.00 46.55 O HETATM 2927 O HOH 116 5.743 26.090 36.818 1.00 41.95 O HETATM 2928 O HOH 117 -6.167 25.813 33.944 1.00 42.22 O HETATM 2929 O HOH 118 -4.919 14.869 7.075 1.00 31.03 O HETATM 2930 O HOH 119 13.979 21.311 30.448 1.00 25.54 O HETATM 2931 O HOH 120 20.024 15.185 2.123 1.00 30.06 O HETATM 2932 O HOH 121 -1.597 22.269 32.928 1.00 40.93 O HETATM 2933 O HOH 122 21.275 30.015 26.243 1.00 41.44 O HETATM 2934 O HOH 123 21.509 23.302 3.027 1.00 58.60 O HETATM 2935 O HOH 124 8.556 25.428 3.544 1.00 39.22 O HETATM 2936 O HOH 125 -1.530 32.347 31.485 1.00 52.88 O HETATM 2937 O HOH 126 6.258 23.591 35.703 1.00 31.70 O HETATM 2938 O HOH 127 17.634 31.086 9.904 1.00 41.12 O HETATM 2939 O HOH 128 20.347 11.485 3.350 1.00 35.70 O HETATM 2940 O HOH 129 3.948 8.673 4.178 1.00 37.54 O HETATM 2941 O HOH 130 -8.702 15.688 32.471 1.00 40.35 O HETATM 2942 O HOH 131 24.201 24.874 17.995 1.00 36.54 O HETATM 2943 O HOH 132 10.052 6.283 15.539 1.00 28.19 O HETATM 2944 O HOH 133 29.409 16.799 41.240 1.00 47.70 O HETATM 2945 O HOH 134 14.160 22.671 3.084 1.00 47.76 O HETATM 2946 O HOH 135 20.018 33.070 35.220 1.00 40.77 O HETATM 2947 O HOH 136 8.548 2.763 20.726 1.00 48.61 O HETATM 2948 O HOH 137 24.477 14.396 7.856 1.00 38.46 O HETATM 2949 O HOH 138 -6.695 9.304 37.528 1.00 40.12 O HETATM 2950 O HOH 139 18.589 27.337 8.774 1.00 32.64 O HETATM 2951 O HOH 140 -9.541 26.086 13.064 1.00 36.73 O HETATM 2952 O HOH 141 24.654 14.856 30.053 1.00 39.54 O HETATM 2953 O HOH 142 0.713 39.980 4.819 1.00 53.11 O HETATM 2954 O HOH 143 22.594 28.721 15.647 1.00 48.57 O HETATM 2955 O HOH 144 -3.151 5.641 14.754 1.00 32.72 O HETATM 2956 O HOH 145 9.860 5.118 37.122 1.00 45.61 O HETATM 2957 O HOH 146 14.846 9.854 30.694 1.00 24.56 O HETATM 2958 O HOH 147 -2.445 25.987 42.972 1.00 45.01 O HETATM 2959 O HOH 148 25.476 25.249 22.528 1.00 47.05 O HETATM 2960 O HOH 149 28.438 31.190 41.338 1.00 44.84 O HETATM 2961 O HOH 150 26.226 15.807 25.582 1.00 41.92 O HETATM 2962 O HOH 151 -11.956 10.930 27.355 1.00 34.51 O HETATM 2963 O HOH 152 25.867 24.944 7.936 1.00 32.39 O HETATM 2964 O HOH 153 18.482 5.874 17.799 1.00 44.37 O HETATM 2965 O HOH 154 -0.676 4.081 31.352 1.00 28.81 O HETATM 2966 O HOH 155 -2.052 26.896 30.529 1.00 39.69 O HETATM 2967 O HOH 156 -9.172 27.952 37.353 1.00 50.23 O HETATM 2968 O HOH 157 4.085 30.767 17.732 1.00 26.87 O HETATM 2969 O HOH 158 7.997 30.915 14.001 1.00 17.59 O HETATM 2970 O HOH 159 23.992 34.136 31.231 1.00 34.85 O HETATM 2971 O HOH 160 -13.219 10.489 20.467 1.00 53.45 O HETATM 2972 O HOH 161 -10.115 18.772 32.270 1.00 29.64 O HETATM 2973 O HOH 162 2.871 32.941 19.021 1.00 40.78 O HETATM 2974 O HOH 163 23.235 5.463 8.532 1.00 51.47 O HETATM 2975 O HOH 164 1.663 29.120 28.575 1.00 51.29 O HETATM 2976 O HOH 165 19.527 1.497 23.538 1.00 48.63 O HETATM 2977 O HOH 166 23.430 11.999 33.946 1.00 47.47 O HETATM 2978 O HOH 167 28.082 16.879 23.563 1.00 52.77 O HETATM 2979 O HOH 168 16.892 7.954 31.276 1.00 37.10 O HETATM 2980 O HOH 169 -6.180 18.492 6.751 1.00 38.38 O HETATM 2981 O HOH 170 8.406 27.410 19.242 1.00 37.17 O HETATM 2982 O HOH 171 24.371 14.478 34.689 1.00 38.07 O HETATM 2983 O HOH 172 23.773 17.581 3.767 1.00 49.68 O HETATM 2984 O HOH 173 17.152 5.379 30.036 1.00 51.75 O HETATM 2985 O HOH 174 33.162 29.979 42.377 1.00 46.67 O HETATM 2986 O HOH 175 -11.227 22.654 16.243 1.00 44.97 O HETATM 2987 O HOH 176 9.470 27.009 44.155 1.00 44.84 O HETATM 2988 O HOH 177 -8.670 13.928 8.101 1.00 37.53 O HETATM 2989 O HOH 178 -6.239 12.602 7.716 1.00 36.25 O HETATM 2990 O HOH 179 8.023 27.150 24.186 1.00 31.11 O HETATM 2991 O HOH 180 30.144 16.272 8.354 1.00 38.77 O HETATM 2992 O HOH 181 7.435 26.723 21.420 1.00 42.64 O HETATM 2993 O HOH 182 -9.757 16.518 21.606 1.00 32.98 O HETATM 2994 O HOH 183 6.628 31.854 16.403 1.00 34.42 O HETATM 2995 O HOH 184 -11.230 39.233 10.397 1.00 43.08 O HETATM 2996 O HOH 185 -12.753 18.417 31.645 1.00 48.83 O HETATM 2997 O HOH 186 -10.428 20.573 6.147 1.00 37.11 O HETATM 2998 O HOH 187 6.625 26.879 30.584 1.00 53.72 O HETATM 2999 O HOH 188 -13.489 30.054 10.215 1.00 40.58 O HETATM 3000 O HOH 189 0.476 8.663 22.292 1.00 25.04 O HETATM 3001 O HOH 190 5.848 26.757 25.896 1.00 28.02 O HETATM 3002 O HOH 191 -3.433 18.874 4.280 1.00 32.62 O HETATM 3003 O HOH 192 -1.684 20.585 2.971 1.00 33.71 O HETATM 3004 O HOH 193 -2.881 5.110 11.948 1.00 46.25 O HETATM 3005 O HOH 194 28.517 17.842 57.257 1.00 43.06 O HETATM 3006 C1 UNN A 195 16.181 23.356 26.925 1.00 -0.01 C HETATM 3007 C2 UNN A 195 14.709 23.507 27.296 1.00 -0.05 C HETATM 3008 C3 UNN A 195 14.214 24.934 27.113 1.00 -0.05 C HETATM 3009 C4 UNN A 195 15.087 25.930 27.855 1.00 -0.05 C HETATM 3010 C5 UNN A 195 16.547 25.810 27.420 1.00 -0.02 C HETATM 3011 C6 UNN A 195 17.011 24.388 27.683 1.00 0.07 C HETATM 3012 N UNN A 195 18.447 24.137 27.464 1.00 -0.23 N HETATM 3013 C7 UNN A 195 19.142 23.144 28.124 1.00 0.10 C HETATM 3014 C8 UNN A 195 18.855 22.141 29.066 1.00 0.02 C HETATM 3015 C9 UNN A 195 17.722 21.682 29.828 1.00 -0.06 C HETATM 3016 C10 UNN A 195 18.142 20.603 30.530 1.00 0.02 C HETATM 3017 N1 UNN A 195 19.471 20.362 30.266 1.00 -0.27 N HETATM 3018 C11 UNN A 195 19.943 21.278 29.374 1.00 0.12 C HETATM 3019 N2 UNN A 195 21.198 21.342 28.865 1.00 -0.30 N HETATM 3020 C12 UNN A 195 21.426 22.320 27.991 1.00 -0.00 C HETATM 3021 C13 UNN A 195 20.434 23.202 27.600 1.00 0.05 C HETATM 3022 N3 UNN A 195 20.538 24.188 26.640 1.00 -0.30 N HETATM 3023 C14 UNN A 195 19.331 24.721 26.585 1.00 0.18 C HETATM 3024 C15 UNN A 195 19.127 25.841 25.696 1.00 0.19 C HETATM 3025 C16 UNN A 195 19.731 27.052 25.608 1.00 -0.02 C HETATM 3026 C17 UNN A 195 19.130 27.737 24.537 1.00 -0.02 C HETATM 3027 C18 UNN A 195 18.204 26.906 23.997 1.00 0.15 C HETATM 3028 C19 UNN A 195 17.272 27.101 22.951 1.00 0.03 C HETATM 3029 C20 UNN A 195 16.718 28.208 22.422 1.00 0.15 C HETATM 3030 C22 UNN A 195 16.709 29.474 23.223 1.00 0.21 C HETATM 3031 O UNN A 195 16.352 29.434 24.392 1.00 -0.40 O HETATM 3032 N5 UNN A 195 17.027 30.626 22.636 1.00 -0.28 N HETATM 3033 C24 UNN A 195 17.522 30.747 21.269 1.00 0.02 C HETATM 3034 H13 UNN A 195 17.705 31.807 21.038 1.00 0.05 H HETATM 3035 H14 UNN A 195 16.774 30.344 20.571 1.00 0.05 H HETATM 3036 H15 UNN A 195 18.460 30.182 21.167 1.00 0.05 H HETATM 3037 C23 UNN A 195 16.902 31.875 23.382 1.00 0.02 C HETATM 3038 H16 UNN A 195 16.523 31.662 24.392 1.00 0.05 H HETATM 3039 H17 UNN A 195 16.202 32.545 22.861 1.00 0.05 H HETATM 3040 H18 UNN A 195 17.887 32.359 23.455 1.00 0.05 H HETATM 3041 C21 UNN A 195 16.237 28.230 21.075 1.00 0.07 C HETATM 3042 N4 UNN A 195 15.880 28.284 19.991 1.00 -0.36 N HETATM 3043 H19 UNN A 195 16.938 26.176 22.483 1.00 0.10 H HETATM 3044 O1 UNN A 195 18.174 25.726 24.700 1.00 -0.23 O HETATM 3045 H20 UNN A 195 19.364 28.747 24.203 1.00 0.06 H HETATM 3046 H21 UNN A 195 20.531 27.424 26.247 1.00 0.05 H HETATM 3047 H12 UNN A 195 22.420 22.429 27.573 1.00 0.07 H HETATM 3048 H25 UNN A 195 20.027 19.601 30.681 1.00 0.23 H HETATM 3049 H26 UNN A 195 17.521 20.014 31.203 1.00 0.09 H HETATM 3050 H11 UNN A 195 16.724 22.117 29.838 1.00 0.03 H HETATM 3051 H10 UNN A 195 16.832 24.212 28.754 1.00 0.06 H HETATM 3052 H8 UNN A 195 17.165 26.515 27.995 1.00 0.03 H HETATM 3053 H9 UNN A 195 16.635 26.037 26.347 1.00 0.03 H HETATM 3054 H6 UNN A 195 15.017 25.735 28.935 1.00 0.03 H HETATM 3055 H7 UNN A 195 14.731 26.949 27.642 1.00 0.03 H HETATM 3056 H4 UNN A 195 13.185 25.007 27.496 1.00 0.03 H HETATM 3057 H5 UNN A 195 14.224 25.180 26.041 1.00 0.03 H HETATM 3058 H2 UNN A 195 14.578 23.219 28.349 1.00 0.03 H HETATM 3059 H3 UNN A 195 14.112 22.840 26.656 1.00 0.03 H HETATM 3060 C UNN A 195 16.368 23.421 25.416 1.00 -0.06 C HETATM 3061 H22 UNN A 195 15.743 22.653 24.936 1.00 0.02 H HETATM 3062 H23 UNN A 195 17.425 23.241 25.169 1.00 0.02 H HETATM 3063 H24 UNN A 195 16.071 24.416 25.052 1.00 0.02 H HETATM 3064 H1 UNN A 195 16.513 22.360 27.252 1.00 0.03 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 3006 3007 3011 3060 3064 CONECT 3007 3006 3008 3058 3059 CONECT 3008 3007 3009 3056 3057 CONECT 3009 3008 3010 3054 3055 CONECT 3010 3009 3011 3052 3053 CONECT 3011 3006 3010 3012 3051 CONECT 3012 3011 3013 3023 CONECT 3013 3012 3014 3021 CONECT 3014 3013 3015 3018 CONECT 3015 3014 3016 3050 CONECT 3016 3015 3017 3049 CONECT 3017 3016 3018 3048 CONECT 3018 3014 3017 3019 CONECT 3019 3018 3020 CONECT 3020 3019 3021 3047 CONECT 3021 3013 3020 3022 CONECT 3022 3021 3023 CONECT 3023 3012 3022 3024 CONECT 3024 3023 3025 3044 CONECT 3025 3024 3026 3046 CONECT 3026 3025 3027 3045 CONECT 3027 3026 3028 3044 CONECT 3028 3027 3029 3043 CONECT 3029 3028 3030 3041 CONECT 3030 3029 3031 3032 CONECT 3031 3030 CONECT 3032 3030 3033 3037 CONECT 3033 3032 3034 3035 3036 CONECT 3034 3033 CONECT 3035 3033 CONECT 3036 3033 CONECT 3037 3032 3038 3039 3040 CONECT 3038 3037 CONECT 3039 3037 CONECT 3040 3037 CONECT 3041 3029 3042 CONECT 3042 3041 CONECT 3043 3028 CONECT 3044 3024 3027 CONECT 3045 3026 CONECT 3046 3025 CONECT 3047 3020 CONECT 3048 3017 CONECT 3049 3016 CONECT 3050 3015 CONECT 3051 3011 CONECT 3052 3010 CONECT 3053 3010 CONECT 3054 3009 CONECT 3055 3009 CONECT 3056 3008 CONECT 3057 3008 CONECT 3058 3007 CONECT 3059 3007 CONECT 3060 3006 3061 3062 3063 CONECT 3061 3060 CONECT 3062 3060 CONECT 3063 3060 CONECT 3064 3006 MASTER 0 0 0 0 0 0 0 0 3063 1 62 23 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5lwn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3lxk
RCSB PDB
PDBbind
327aa, >3LXK_1|Chain... *
3lxl
RCSB PDB
PDBbind
327aa, >3LXL_1|Chain... at 100%
3pjc
RCSB PDB
PDBbind
315aa, >3PJC_1|Chain... at 99%
3zc6
RCSB PDB
PDBbind
288aa, >3ZC6_1|Chains... at 99%
3zep
RCSB PDB
PDBbind
288aa, >3ZEP_1|Chains... at 99%
4hvd
RCSB PDB
PDBbind
314aa, >4HVD_1|Chain... at 99%
4hvg
RCSB PDB
PDBbind
314aa, >4HVG_1|Chain... at 99%
4hvh
RCSB PDB
PDBbind
314aa, >4HVH_1|Chain... at 99%
4hvi
RCSB PDB
PDBbind
314aa, >4HVI_1|Chain... at 99%
4i6q
RCSB PDB
PDBbind
314aa, >4I6Q_1|Chain... at 99%
4qps
RCSB PDB
PDBbind
293aa, >4QPS_1|Chains... at 99%
4qt1
RCSB PDB
PDBbind
314aa, >4QT1_1|Chain... at 99%
4rio
RCSB PDB
PDBbind
293aa, >4RIO_1|Chain... at 98%
4z16
RCSB PDB
PDBbind
316aa, >4Z16_1|Chains... at 98%
5lwm
RCSB PDB
PDBbind
294aa, >5LWM_1|Chain... at 98%
5toz
RCSB PDB
PDBbind
321aa, >5TOZ_1|Chain... at 100%
5tts
RCSB PDB
PDBbind
321aa, >5TTS_1|Chain... at 100%
5ttu
RCSB PDB
PDBbind
321aa, >5TTU_1|Chain... at 100%
5ttv
RCSB PDB
PDBbind
321aa, >5TTV_1|Chain... at 100%
5vo6
RCSB PDB
PDBbind
293aa, >5VO6_1|Chain... at 98%
5w86
RCSB PDB
PDBbind
287aa, >5W86_1|Chains... at 99%
5wfj
RCSB PDB
PDBbind
293aa, >5WFJ_1|Chain... at 98%
6aak
RCSB PDB
PDBbind
287aa, >6AAK_1|Chains... at 99%
6da4
RCSB PDB
PDBbind
321aa, >6DA4_1|Chain... at 100%
6db3
RCSB PDB
PDBbind
321aa, >6DB3_1|Chain... at 100%
6db4
RCSB PDB
PDBbind
321aa, >6DB4_1|Chain... at 100%
6dud
RCSB PDB
PDBbind
321aa, >6DUD_1|Chain... at 100%
6gl9
RCSB PDB
PDBbind
294aa, >6GL9_1|Chains... at 98%
6gla
RCSB PDB
PDBbind
294aa, >6GLA_1|Chains... at 98%
6glb
RCSB PDB
PDBbind
294aa, >6GLB_1|Chains... at 98%
6ny4
RCSB PDB
PDBbind
293aa, >6NY4_1|Chain... at 98%
6hzv
RCSB PDB
PDBbind
285aa, >6HZV_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5lwn
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK3
Ligand Name
79R
EC.Number
E.C. 2.7.10.2
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
IC50=17nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Cell Chem Biol Vol. 23: pp. 1335-1340
Ligand Properties
Formula
C
2
5
H
2
6
N
6
O
2
Molecular Weight
442.513
Exact Mass
442.212
No. of atoms
59
No. of bonds
63
Polar Surface Area
103.74
LOGP Value
3.59 (
Computed with XLOGP3
)
4.92 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 5
Canonical SMILES
N#C/C(=C/c1ccc(o1)c1nc2c(n1[C@H]1CCCC[C@H]1C)c1cc[nH]c1nc2)/C(=O)N(C)C
InChI String
InChI=1S/C25H26N6O2/c1-15-6-4-5-7-20(15)31-22-18-10-11-27-23(18)28-14-19(22)29-24(31)21-9-8-17(33-21)12-16(13-26)25(32)30(2)3/h8-12,14-15,20H,4-7H2,1-3H3,(H,27,28)/b16-12-/t15-,20+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P52333
Entrez Gene ID
NCBI Entrez Gene ID:
3718
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com