Browse entries in the PDBbind-CN Database
HEADER 6DB3_COMPLEX COMPND 6DB3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 45 PRO THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER SEQRES 2 A 45 GLN LEU GLY LYS GLY ASN PHE GLY SER VAL GLU LEU CYS SEQRES 3 A 45 ARG TYR ASP PRO LEU GLY ASP ASN THR GLY ALA LEU VAL SEQRES 4 A 45 ALA VAL LYS GLN LEU GLN SEQRES 1 A 30 ASP GLN GLN ARG ASP PHE GLN ARG GLU ILE GLN ILE LEU SEQRES 2 A 30 LYS ALA LEU HIS SER ASP PHE ILE VAL LYS TYR ARG GLY SEQRES 3 A 30 VAL SER TYR GLY SEQRES 1 A 142 SER LEU ARG LEU VAL MET GLU TYR LEU PRO SER GLY CYS SEQRES 2 A 142 LEU ARG ASP PHE LEU GLN ARG HIS ARG ALA ARG LEU ASP SEQRES 3 A 142 ALA SER ARG LEU LEU LEU TYR SER SER GLN ILE CYS LYS SEQRES 4 A 142 GLY MET GLU TYR LEU GLY SER ARG ARG CYS VAL HIS ARG SEQRES 5 A 142 ASP LEU ALA ALA ARG ASN ILE LEU VAL GLU SER GLU ALA SEQRES 6 A 142 HIS VAL LYS ILE ALA ASP PHE GLY LEU ALA LYS LEU LEU SEQRES 7 A 142 PRO LEU ASP LYS ASP TYR TYR VAL VAL ARG GLU PRO GLY SEQRES 8 A 142 GLN SER PRO ILE PHE TRP TYR ALA PRO GLU SER LEU SER SEQRES 9 A 142 ASP ASN ILE PHE SER ARG GLN SER ASP VAL TRP SER PHE SEQRES 10 A 142 GLY VAL VAL LEU TYR GLU LEU PHE THR TYR CYS ASP LYS SEQRES 11 A 142 SER CYS SER PRO SER ALA GLU PHE LEU ARG MET MET SEQRES 1 A 58 ASP VAL PRO ALA LEU SER ARG LEU LEU GLU LEU LEU GLU SEQRES 2 A 58 GLU GLY GLN ARG LEU PRO ALA PRO PRO ALA CYS PRO ALA SEQRES 3 A 58 GLU VAL HIS GLU LEU MET LYS LEU CYS TRP ALA PRO SER SEQRES 4 A 58 PRO GLN ASP ARG PRO SER PHE SER ALA LEU GLY PRO GLN SEQRES 5 A 58 LEU ASP MET LEU TRP SER HET G A 54 37 ATOM 1 N PRO A 814 1.973 -4.115 6.107 1.00 64.28 N ATOM 2 CA PRO A 814 2.676 -2.908 5.639 1.00 63.77 C ATOM 3 C PRO A 814 1.791 -1.948 4.832 1.00 64.64 C ATOM 4 O PRO A 814 2.095 -0.757 4.761 1.00 63.76 O ATOM 5 CB PRO A 814 3.827 -3.471 4.798 1.00 65.79 C ATOM 6 CG PRO A 814 3.327 -4.803 4.309 1.00 70.48 C ATOM 7 CD PRO A 814 2.302 -5.306 5.298 1.00 66.03 C ATOM 8 HN2 PRO A 814 0.948 -3.947 6.054 1.00 0.00 H ATOM 9 HN1 PRO A 814 2.242 -4.297 7.095 1.00 0.00 H ATOM 10 N THR A 815 0.718 -2.480 4.209 1.00 58.64 N ATOM 11 CA THR A 815 -0.243 -1.730 3.397 1.00 57.25 C ATOM 12 C THR A 815 -1.512 -1.350 4.205 1.00 57.62 C ATOM 13 O THR A 815 -2.452 -0.774 3.649 1.00 55.87 O ATOM 14 CB THR A 815 -0.511 -2.446 2.061 1.00 67.00 C ATOM 15 OG1 THR A 815 -1.120 -3.710 2.313 1.00 68.91 O ATOM 16 CG2 THR A 815 0.757 -2.620 1.214 1.00 65.09 C ATOM 17 HG1 THR A 815 -0.514 -4.262 2.868 1.00 0.00 H ATOM 18 H THR A 815 0.561 -3.503 4.314 1.00 0.00 H ATOM 19 N ILE A 816 -1.522 -1.665 5.524 1.00 51.76 N ATOM 20 CA ILE A 816 -2.622 -1.307 6.413 1.00 50.55 C ATOM 21 C ILE A 816 -2.106 -0.269 7.399 1.00 49.12 C ATOM 22 O ILE A 816 -1.180 -0.536 8.165 1.00 48.54 O ATOM 23 CB ILE A 816 -3.407 -2.495 7.051 1.00 54.54 C ATOM 24 CG1 ILE A 816 -3.681 -3.608 6.023 1.00 55.04 C ATOM 25 CG2 ILE A 816 -4.740 -1.999 7.639 1.00 55.96 C ATOM 26 H ILE A 816 -0.711 -2.184 5.918 1.00 0.00 H ATOM 27 N PHE A 817 -2.627 0.959 7.264 1.00 40.50 N ATOM 28 CA PHE A 817 -2.240 2.114 8.058 1.00 38.26 C ATOM 29 C PHE A 817 -3.312 2.329 9.121 1.00 42.77 C ATOM 30 O PHE A 817 -4.498 2.373 8.795 1.00 42.60 O ATOM 31 CB PHE A 817 -2.071 3.364 7.154 1.00 38.37 C ATOM 32 CG PHE A 817 -0.837 3.315 6.284 1.00 37.88 C ATOM 33 CD1 PHE A 817 -0.831 2.591 5.094 1.00 39.02 C ATOM 34 CD2 PHE A 817 0.327 3.967 6.665 1.00 38.65 C ATOM 35 CE1 PHE A 817 0.322 2.499 4.316 1.00 39.06 C ATOM 36 CE2 PHE A 817 1.485 3.876 5.881 1.00 41.65 C ATOM 37 CZ PHE A 817 1.469 3.148 4.706 1.00 39.29 C ATOM 38 H PHE A 817 -3.361 1.095 6.539 1.00 0.00 H ATOM 39 N GLU A 818 -2.907 2.368 10.395 1.00 38.27 N ATOM 40 CA GLU A 818 -3.853 2.580 11.485 1.00 37.31 C ATOM 41 C GLU A 818 -4.132 4.061 11.605 1.00 39.93 C ATOM 42 O GLU A 818 -3.196 4.862 11.666 1.00 38.08 O ATOM 43 CB GLU A 818 -3.333 1.996 12.819 1.00 38.57 C ATOM 44 CG GLU A 818 -3.103 0.495 12.750 1.00 48.30 C ATOM 45 CD GLU A 818 -3.598 -0.297 13.942 1.00 80.52 C ATOM 46 OE1 GLU A 818 -2.751 -0.704 14.771 1.00 80.65 O ATOM 47 OE2 GLU A 818 -4.830 -0.490 14.064 1.00 74.78 O ATOM 48 H GLU A 818 -1.898 2.245 10.613 1.00 0.00 H ATOM 49 N GLU A 819 -5.435 4.421 11.646 1.00 38.07 N ATOM 50 CA GLU A 819 -5.956 5.779 11.797 1.00 37.73 C ATOM 51 C GLU A 819 -5.259 6.598 12.876 1.00 38.15 C ATOM 52 O GLU A 819 -4.855 7.735 12.621 1.00 36.29 O ATOM 53 CB GLU A 819 -7.463 5.707 12.113 1.00 39.82 C ATOM 54 CG GLU A 819 -8.351 5.729 10.888 1.00 48.41 C ATOM 55 CD GLU A 819 -8.331 7.072 10.191 1.00 71.68 C ATOM 56 OE1 GLU A 819 -7.618 7.187 9.168 1.00 66.14 O ATOM 57 OE2 GLU A 819 -8.954 8.027 10.712 1.00 65.02 O ATOM 58 H GLU A 819 -6.135 3.657 11.562 1.00 0.00 H ATOM 59 N ARG A 820 -5.131 6.025 14.090 1.00 34.55 N ATOM 60 CA ARG A 820 -4.529 6.701 15.247 1.00 34.66 C ATOM 61 C ARG A 820 -3.050 7.073 15.051 1.00 40.42 C ATOM 62 O ARG A 820 -2.564 7.990 15.719 1.00 40.93 O ATOM 63 CB ARG A 820 -4.737 5.880 16.538 1.00 35.52 C ATOM 64 CG ARG A 820 -4.075 4.509 16.525 1.00 42.16 C ATOM 65 CD ARG A 820 -4.521 3.670 17.708 1.00 43.65 C ATOM 66 NE ARG A 820 -3.471 2.745 18.124 1.00 53.94 N ATOM 67 CZ ARG A 820 -3.291 1.534 17.609 1.00 66.42 C ATOM 68 NH1 ARG A 820 -2.304 0.761 18.045 1.00 52.50 N ATOM 69 NH2 ARG A 820 -4.094 1.085 16.654 1.00 54.22 N ATOM 70 HE ARG A 820 -2.820 3.055 18.874 1.00 0.00 H ATOM 71 HH12 ARG A 820 -2.167 -0.186 17.639 1.00 0.00 H ATOM 72 HH11 ARG A 820 -1.667 1.103 18.793 1.00 0.00 H ATOM 73 HH22 ARG A 820 -3.948 0.136 16.255 1.00 0.00 H ATOM 74 HH21 ARG A 820 -4.870 1.682 16.304 1.00 0.00 H ATOM 75 H ARG A 820 -5.477 5.052 14.214 1.00 0.00 H ATOM 76 N HIS A 821 -2.342 6.369 14.140 1.00 36.12 N ATOM 77 CA HIS A 821 -0.933 6.642 13.883 1.00 35.92 C ATOM 78 C HIS A 821 -0.669 7.665 12.777 1.00 39.76 C ATOM 79 O HIS A 821 0.461 8.153 12.661 1.00 39.03 O ATOM 80 CB HIS A 821 -0.157 5.340 13.663 1.00 36.50 C ATOM 81 CG HIS A 821 -0.150 4.428 14.851 1.00 39.85 C ATOM 82 ND1 HIS A 821 -0.087 4.920 16.142 1.00 41.60 N ATOM 83 CD2 HIS A 821 -0.123 3.078 14.894 1.00 41.60 C ATOM 84 CE1 HIS A 821 -0.040 3.854 16.924 1.00 41.22 C ATOM 85 NE2 HIS A 821 -0.054 2.726 16.215 1.00 41.55 N ATOM 86 H HIS A 821 -2.815 5.611 13.607 1.00 0.00 H ATOM 87 N LEU A 822 -1.698 7.998 11.974 1.00 36.06 N ATOM 88 CA LEU A 822 -1.574 8.993 10.914 1.00 34.93 C ATOM 89 C LEU A 822 -1.748 10.356 11.528 1.00 37.11 C ATOM 90 O LEU A 822 -2.848 10.694 11.968 1.00 37.36 O ATOM 91 CB LEU A 822 -2.634 8.768 9.807 1.00 35.37 C ATOM 92 CG LEU A 822 -2.283 7.835 8.649 1.00 39.98 C ATOM 93 CD1 LEU A 822 -3.448 7.732 7.692 1.00 40.44 C ATOM 94 CD2 LEU A 822 -1.058 8.328 7.870 1.00 40.87 C ATOM 95 H LEU A 822 -2.615 7.528 12.115 1.00 0.00 H ATOM 96 N LYS A 823 -0.679 11.158 11.551 1.00 31.26 N ATOM 97 CA LYS A 823 -0.703 12.482 12.166 1.00 30.21 C ATOM 98 C LYS A 823 -0.835 13.566 11.128 1.00 35.17 C ATOM 99 O LYS A 823 0.052 13.722 10.284 1.00 35.16 O ATOM 100 CB LYS A 823 0.553 12.715 13.054 1.00 32.34 C ATOM 101 CG LYS A 823 0.905 11.550 14.006 1.00 42.25 C ATOM 102 CD LYS A 823 -0.195 11.238 15.056 1.00 53.36 C ATOM 103 CE LYS A 823 0.250 10.381 16.223 1.00 64.66 C ATOM 104 NZ LYS A 823 0.753 9.043 15.818 1.00 73.55 N ATOM 105 HZ1 LYS A 823 -0.001 8.526 15.321 1.00 0.00 H ATOM 106 HZ2 LYS A 823 1.571 9.158 15.186 1.00 0.00 H ATOM 107 HZ3 LYS A 823 1.040 8.511 16.664 1.00 0.00 H ATOM 108 H LYS A 823 0.204 10.826 11.114 1.00 0.00 H ATOM 109 N TYR A 824 -1.920 14.350 11.211 1.00 31.49 N ATOM 110 CA TYR A 824 -2.192 15.420 10.253 1.00 31.98 C ATOM 111 C TYR A 824 -1.167 16.553 10.346 1.00 36.98 C ATOM 112 O TYR A 824 -0.847 17.002 11.443 1.00 36.50 O ATOM 113 CB TYR A 824 -3.626 15.959 10.426 1.00 33.01 C ATOM 114 CG TYR A 824 -3.882 17.213 9.622 1.00 34.80 C ATOM 115 CD1 TYR A 824 -4.108 17.150 8.250 1.00 35.36 C ATOM 116 CD2 TYR A 824 -3.844 18.470 10.221 1.00 35.70 C ATOM 117 CE1 TYR A 824 -4.352 18.301 7.506 1.00 36.40 C ATOM 118 CE2 TYR A 824 -4.063 19.630 9.481 1.00 36.92 C ATOM 119 CZ TYR A 824 -4.343 19.538 8.126 1.00 41.05 C ATOM 120 OH TYR A 824 -4.573 20.672 7.380 1.00 38.25 O ATOM 121 HH TYR A 824 -4.755 20.417 6.441 1.00 0.00 H ATOM 122 H TYR A 824 -2.594 14.190 11.987 1.00 0.00 H ATOM 123 N ILE A 825 -0.673 17.030 9.194 1.00 33.75 N ATOM 124 CA ILE A 825 0.285 18.134 9.174 1.00 33.35 C ATOM 125 C ILE A 825 -0.308 19.343 8.470 1.00 37.25 C ATOM 126 O ILE A 825 -0.422 20.403 9.078 1.00 38.50 O ATOM 127 CB ILE A 825 1.689 17.704 8.635 1.00 36.38 C ATOM 128 CG1 ILE A 825 2.392 16.790 9.657 1.00 36.01 C ATOM 129 CG2 ILE A 825 2.565 18.941 8.279 1.00 37.63 C ATOM 130 CD1 ILE A 825 3.298 15.844 9.069 1.00 47.33 C ATOM 131 H ILE A 825 -0.978 16.605 8.295 1.00 0.00 H ATOM 132 N SER A 826 -0.689 19.195 7.192 1.00 32.54 N ATOM 133 CA SER A 826 -1.236 20.308 6.423 1.00 31.37 C ATOM 134 C SER A 826 -2.063 19.834 5.257 1.00 34.10 C ATOM 135 O SER A 826 -2.072 18.635 4.945 1.00 31.80 O ATOM 136 CB SER A 826 -0.102 21.187 5.897 1.00 33.68 C ATOM 137 OG SER A 826 0.775 20.422 5.087 1.00 39.57 O ATOM 138 HG SER A 826 1.504 21.002 4.753 1.00 0.00 H ATOM 139 H SER A 826 -0.592 18.264 6.738 1.00 0.00 H ATOM 140 N GLN A 827 -2.731 20.790 4.571 1.00 31.12 N ATOM 141 CA GLN A 827 -3.478 20.491 3.354 1.00 31.76 C ATOM 142 C GLN A 827 -2.485 20.510 2.192 1.00 35.99 C ATOM 143 O GLN A 827 -1.617 21.392 2.156 1.00 37.09 O ATOM 144 CB GLN A 827 -4.570 21.551 3.109 1.00 33.76 C ATOM 145 CG GLN A 827 -5.674 21.607 4.171 1.00 45.51 C ATOM 146 CD GLN A 827 -6.403 20.291 4.313 1.00 64.83 C ATOM 147 OE1 GLN A 827 -6.858 19.692 3.330 1.00 62.26 O ATOM 148 NE2 GLN A 827 -6.533 19.817 5.548 1.00 50.95 N ATOM 149 HE22 GLN A 827 -6.139 20.346 6.352 1.00 0.00 H ATOM 150 HE21 GLN A 827 -7.029 18.917 5.710 1.00 0.00 H ATOM 151 H GLN A 827 -2.711 21.769 4.922 1.00 0.00 H ATOM 152 N LEU A 828 -2.601 19.567 1.237 1.00 29.88 N ATOM 153 CA LEU A 828 -1.745 19.624 0.037 1.00 29.68 C ATOM 154 C LEU A 828 -2.512 20.173 -1.160 1.00 34.34 C ATOM 155 O LEU A 828 -1.960 20.895 -1.977 1.00 32.98 O ATOM 156 CB LEU A 828 -1.090 18.282 -0.310 1.00 29.22 C ATOM 157 CG LEU A 828 -0.034 17.773 0.671 1.00 31.06 C ATOM 158 CD1 LEU A 828 0.306 16.328 0.376 1.00 29.59 C ATOM 159 CD2 LEU A 828 1.237 18.653 0.645 1.00 32.31 C ATOM 160 H LEU A 828 -3.294 18.799 1.346 1.00 0.00 H ATOM 161 N GLY A 829 -3.783 19.844 -1.241 1.00 34.00 N ATOM 162 CA GLY A 829 -4.631 20.321 -2.317 1.00 35.43 C ATOM 163 C GLY A 829 -5.986 19.663 -2.326 1.00 42.72 C ATOM 164 O GLY A 829 -6.314 18.859 -1.447 1.00 41.59 O ATOM 165 H GLY A 829 -4.192 19.224 -0.513 1.00 0.00 H ATOM 166 N LYS A 830 -6.766 20.003 -3.343 1.00 43.38 N ATOM 167 CA LYS A 830 -8.103 19.468 -3.582 1.00 45.36 C ATOM 168 C LYS A 830 -8.313 19.190 -5.064 1.00 53.26 C ATOM 169 O LYS A 830 -7.430 19.460 -5.888 1.00 52.42 O ATOM 170 CB LYS A 830 -9.197 20.367 -2.977 1.00 48.13 C ATOM 171 CG LYS A 830 -9.108 21.837 -3.363 1.00 68.51 C ATOM 172 CD LYS A 830 -9.922 22.696 -2.407 1.00 80.70 C ATOM 173 CE LYS A 830 -10.820 23.679 -3.122 1.00 94.08 C ATOM 174 NZ LYS A 830 -10.061 24.766 -3.799 1.00104.36 N ATOM 175 HZ1 LYS A 830 -9.510 25.294 -3.093 1.00 0.00 H ATOM 176 HZ2 LYS A 830 -9.418 24.351 -4.503 1.00 0.00 H ATOM 177 HZ3 LYS A 830 -10.727 25.410 -4.272 1.00 0.00 H ATOM 178 H LYS A 830 -6.398 20.702 -4.020 1.00 0.00 H ATOM 179 N GLY A 831 -9.470 18.635 -5.387 1.00 52.84 N ATOM 180 CA GLY A 831 -9.815 18.267 -6.755 1.00 52.97 C ATOM 181 C GLY A 831 -10.751 17.083 -6.753 1.00 57.94 C ATOM 182 O GLY A 831 -10.561 16.150 -5.964 1.00 56.87 O ATOM 183 H GLY A 831 -10.163 18.454 -4.633 1.00 0.00 H ATOM 184 N ASN A 832 -11.786 17.136 -7.632 1.00 55.62 N ATOM 185 CA ASN A 832 -12.832 16.120 -7.791 1.00 55.18 C ATOM 186 C ASN A 832 -13.479 15.721 -6.441 1.00 56.30 C ATOM 187 O ASN A 832 -13.401 14.560 -6.017 1.00 55.17 O ATOM 188 CB ASN A 832 -12.346 14.918 -8.628 1.00 56.40 C ATOM 189 H ASN A 832 -11.841 17.972 -8.248 1.00 0.00 H ATOM 190 N PHE A 833 -14.077 16.731 -5.761 1.00 51.35 N ATOM 191 CA PHE A 833 -14.794 16.637 -4.476 1.00 50.97 C ATOM 192 C PHE A 833 -14.084 15.844 -3.334 1.00 51.90 C ATOM 193 O PHE A 833 -14.735 15.161 -2.529 1.00 51.11 O ATOM 194 CB PHE A 833 -16.258 16.202 -4.695 1.00 53.01 C ATOM 195 H PHE A 833 -14.024 17.675 -6.193 1.00 0.00 H ATOM 196 N GLY A 834 -12.754 15.960 -3.289 1.00 45.87 N ATOM 197 CA GLY A 834 -11.915 15.322 -2.281 1.00 44.29 C ATOM 198 C GLY A 834 -10.735 16.194 -1.901 1.00 43.25 C ATOM 199 O GLY A 834 -10.603 17.314 -2.406 1.00 41.80 O ATOM 200 H GLY A 834 -12.289 16.540 -4.016 1.00 0.00 H ATOM 201 N SER A 835 -9.858 15.693 -1.007 1.00 35.53 N ATOM 202 CA SER A 835 -8.680 16.471 -0.597 1.00 32.40 C ATOM 203 C SER A 835 -7.466 15.565 -0.408 1.00 31.36 C ATOM 204 O SER A 835 -7.614 14.366 -0.191 1.00 27.69 O ATOM 205 CB SER A 835 -8.969 17.245 0.692 1.00 34.20 C ATOM 206 OG SER A 835 -9.184 16.359 1.779 1.00 41.14 O ATOM 207 HG SER A 835 -9.368 16.883 2.599 1.00 0.00 H ATOM 208 H SER A 835 -10.017 14.747 -0.604 1.00 0.00 H ATOM 209 N VAL A 836 -6.268 16.160 -0.486 1.00 28.77 N ATOM 210 CA VAL A 836 -4.990 15.470 -0.280 1.00 28.05 C ATOM 211 C VAL A 836 -4.319 16.186 0.895 1.00 28.92 C ATOM 212 O VAL A 836 -4.195 17.403 0.884 1.00 27.92 O ATOM 213 CB VAL A 836 -4.083 15.445 -1.548 1.00 32.19 C ATOM 214 CG1 VAL A 836 -2.801 14.636 -1.289 1.00 31.80 C ATOM 215 CG2 VAL A 836 -4.833 14.879 -2.765 1.00 31.74 C ATOM 216 H VAL A 836 -6.243 17.176 -0.707 1.00 0.00 H ATOM 217 N GLU A 837 -3.932 15.431 1.915 1.00 24.92 N ATOM 218 CA GLU A 837 -3.286 15.972 3.098 1.00 24.45 C ATOM 219 C GLU A 837 -1.911 15.397 3.273 1.00 27.80 C ATOM 220 O GLU A 837 -1.661 14.244 2.917 1.00 25.14 O ATOM 221 CB GLU A 837 -4.117 15.664 4.372 1.00 25.82 C ATOM 222 CG GLU A 837 -5.478 16.355 4.343 1.00 32.11 C ATOM 223 CD GLU A 837 -6.379 16.206 5.554 1.00 46.75 C ATOM 224 OE1 GLU A 837 -6.269 15.196 6.289 1.00 39.39 O ATOM 225 OE2 GLU A 837 -7.234 17.102 5.742 1.00 47.55 O ATOM 226 H GLU A 837 -4.099 14.406 1.865 1.00 0.00 H ATOM 227 N LEU A 838 -1.028 16.195 3.867 1.00 26.81 N ATOM 228 CA LEU A 838 0.288 15.713 4.246 1.00 25.93 C ATOM 229 C LEU A 838 0.131 15.249 5.699 1.00 30.19 C ATOM 230 O LEU A 838 -0.334 16.029 6.548 1.00 28.21 O ATOM 231 CB LEU A 838 1.349 16.822 4.111 1.00 25.35 C ATOM 232 CG LEU A 838 2.734 16.487 4.691 1.00 28.41 C ATOM 233 CD1 LEU A 838 3.383 15.296 3.957 1.00 27.35 C ATOM 234 CD2 LEU A 838 3.652 17.710 4.635 1.00 33.13 C ATOM 235 H LEU A 838 -1.285 17.183 4.064 1.00 0.00 H ATOM 236 N CYS A 839 0.441 13.954 5.945 1.00 28.59 N ATOM 237 CA CYS A 839 0.426 13.294 7.249 1.00 29.80 C ATOM 238 C CYS A 839 1.788 12.655 7.513 1.00 34.53 C ATOM 239 O CYS A 839 2.492 12.277 6.578 1.00 32.53 O ATOM 240 CB CYS A 839 -0.676 12.231 7.333 1.00 30.16 C ATOM 241 SG CYS A 839 -2.354 12.860 7.064 1.00 34.39 S ATOM 242 H CYS A 839 0.716 13.373 5.127 1.00 0.00 H ATOM 243 N ARG A 840 2.107 12.450 8.792 1.00 31.34 N ATOM 244 CA ARG A 840 3.269 11.671 9.163 1.00 30.76 C ATOM 245 C ARG A 840 2.695 10.376 9.683 1.00 34.52 C ATOM 246 O ARG A 840 1.808 10.417 10.539 1.00 34.39 O ATOM 247 CB ARG A 840 4.105 12.369 10.260 1.00 28.41 C ATOM 248 CG ARG A 840 5.423 11.637 10.529 1.00 34.02 C ATOM 249 CD ARG A 840 6.300 12.260 11.612 1.00 31.68 C ATOM 250 NE ARG A 840 6.578 13.685 11.398 1.00 32.08 N ATOM 251 CZ ARG A 840 7.538 14.176 10.616 1.00 46.09 C ATOM 252 NH1 ARG A 840 8.304 13.364 9.898 1.00 34.43 N ATOM 253 NH2 ARG A 840 7.715 15.485 10.519 1.00 37.97 N ATOM 254 HE ARG A 840 5.975 14.369 11.899 1.00 0.00 H ATOM 255 HH12 ARG A 840 9.051 13.756 9.290 1.00 0.00 H ATOM 256 HH11 ARG A 840 8.157 12.335 9.943 1.00 0.00 H ATOM 257 HH22 ARG A 840 8.466 15.864 9.907 1.00 0.00 H ATOM 258 HH21 ARG A 840 7.103 16.134 11.055 1.00 0.00 H ATOM 259 H ARG A 840 1.508 12.858 9.538 1.00 0.00 H ATOM 260 N TYR A 841 3.172 9.228 9.188 1.00 31.25 N ATOM 261 CA TYR A 841 2.744 7.962 9.772 1.00 31.73 C ATOM 262 C TYR A 841 3.730 7.759 10.928 1.00 37.75 C ATOM 263 O TYR A 841 4.896 7.406 10.704 1.00 36.05 O ATOM 264 CB TYR A 841 2.762 6.785 8.783 1.00 32.51 C ATOM 265 CG TYR A 841 2.013 5.588 9.349 1.00 35.72 C ATOM 266 CD1 TYR A 841 0.703 5.715 9.811 1.00 37.19 C ATOM 267 CD2 TYR A 841 2.619 4.337 9.438 1.00 36.80 C ATOM 268 CE1 TYR A 841 0.004 4.619 10.319 1.00 39.74 C ATOM 269 CE2 TYR A 841 1.948 3.245 10.002 1.00 38.24 C ATOM 270 CZ TYR A 841 0.639 3.390 10.439 1.00 47.50 C ATOM 271 OH TYR A 841 -0.059 2.311 10.952 1.00 50.53 O ATOM 272 HH TYR A 841 -0.970 2.601 11.210 1.00 0.00 H ATOM 273 H TYR A 841 3.843 9.238 8.393 1.00 0.00 H ATOM 274 N ASP A 842 3.280 8.111 12.148 1.00 33.82 N ATOM 275 CA ASP A 842 4.113 8.156 13.343 1.00 33.49 C ATOM 276 C ASP A 842 3.696 7.233 14.488 1.00 36.31 C ATOM 277 O ASP A 842 3.387 7.753 15.555 1.00 34.54 O ATOM 278 CB ASP A 842 4.219 9.616 13.825 1.00 34.47 C ATOM 279 CG ASP A 842 5.469 9.920 14.622 1.00 38.17 C ATOM 280 OD1 ASP A 842 5.397 10.783 15.524 1.00 36.50 O ATOM 281 OD2 ASP A 842 6.539 9.336 14.303 1.00 42.44 O ATOM 282 H ASP A 842 2.276 8.366 12.243 1.00 0.00 H ATOM 283 N PRO A 843 3.744 5.881 14.328 1.00 36.10 N ATOM 284 CA PRO A 843 3.372 4.994 15.450 1.00 37.52 C ATOM 285 C PRO A 843 4.220 5.172 16.715 1.00 43.48 C ATOM 286 O PRO A 843 3.719 4.890 17.804 1.00 43.70 O ATOM 287 CB PRO A 843 3.524 3.588 14.862 1.00 39.35 C ATOM 288 CG PRO A 843 4.480 3.750 13.698 1.00 43.40 C ATOM 289 CD PRO A 843 4.112 5.090 13.134 1.00 38.44 C ATOM 290 N LEU A 844 5.473 5.681 16.592 1.00 40.82 N ATOM 291 CA LEU A 844 6.317 5.907 17.781 1.00 40.54 C ATOM 292 C LEU A 844 5.900 7.171 18.544 1.00 42.52 C ATOM 293 O LEU A 844 6.218 7.293 19.722 1.00 43.40 O ATOM 294 CB LEU A 844 7.828 5.971 17.435 1.00 41.49 C ATOM 295 CG LEU A 844 8.506 4.711 16.859 1.00 47.23 C ATOM 296 CD1 LEU A 844 9.995 4.949 16.661 1.00 47.76 C ATOM 297 CD2 LEU A 844 8.327 3.495 17.765 1.00 50.76 C ATOM 298 H LEU A 844 5.842 5.914 15.648 1.00 0.00 H ATOM 299 N GLY A 845 5.209 8.094 17.872 1.00 34.90 N ATOM 300 CA GLY A 845 4.759 9.352 18.460 1.00 34.34 C ATOM 301 C GLY A 845 5.873 10.342 18.752 1.00 38.76 C ATOM 302 O GLY A 845 5.691 11.252 19.565 1.00 38.86 O ATOM 303 H GLY A 845 4.979 7.907 16.875 1.00 0.00 H ATOM 304 N ASP A 846 7.031 10.208 18.078 1.00 34.73 N ATOM 305 CA ASP A 846 8.178 11.082 18.390 1.00 34.01 C ATOM 306 C ASP A 846 8.622 12.006 17.237 1.00 38.44 C ATOM 307 O ASP A 846 9.699 12.616 17.321 1.00 36.96 O ATOM 308 CB ASP A 846 9.350 10.205 18.869 1.00 35.01 C ATOM 309 CG ASP A 846 9.789 9.160 17.853 1.00 44.29 C ATOM 310 OD1 ASP A 846 9.221 9.137 16.727 1.00 45.03 O ATOM 311 OD2 ASP A 846 10.671 8.350 18.188 1.00 48.58 O ATOM 312 H ASP A 846 7.117 9.486 17.335 1.00 0.00 H ATOM 313 N ASN A 847 7.785 12.093 16.164 1.00 34.50 N ATOM 314 CA ASN A 847 7.994 12.895 14.940 1.00 33.95 C ATOM 315 C ASN A 847 9.062 12.355 14.018 1.00 38.22 C ATOM 316 O ASN A 847 9.500 13.092 13.125 1.00 39.08 O ATOM 317 CB ASN A 847 8.250 14.382 15.231 1.00 32.83 C ATOM 318 CG ASN A 847 7.120 15.090 15.923 1.00 46.84 C ATOM 319 OD1 ASN A 847 5.940 14.810 15.686 1.00 42.85 O ATOM 320 ND2 ASN A 847 7.464 16.043 16.784 1.00 33.73 N ATOM 321 HD22 ASN A 847 8.468 16.250 16.957 1.00 0.00 H ATOM 322 HD21 ASN A 847 6.729 16.582 17.285 1.00 0.00 H ATOM 323 H ASN A 847 6.908 11.537 16.212 1.00 0.00 H ATOM 324 N THR A 848 9.440 11.072 14.176 1.00 33.50 N ATOM 325 CA THR A 848 10.487 10.453 13.345 1.00 34.47 C ATOM 326 C THR A 848 9.926 9.604 12.187 1.00 39.58 C ATOM 327 O THR A 848 10.686 9.205 11.299 1.00 39.50 O ATOM 328 CB THR A 848 11.535 9.692 14.211 1.00 39.05 C ATOM 329 OG1 THR A 848 10.958 8.500 14.754 1.00 41.91 O ATOM 330 CG2 THR A 848 12.139 10.558 15.328 1.00 36.11 C ATOM 331 HG1 THR A 848 10.182 8.739 15.320 1.00 0.00 H ATOM 332 H THR A 848 8.977 10.499 14.910 1.00 0.00 H ATOM 333 N GLY A 849 8.615 9.326 12.209 1.00 34.10 N ATOM 334 CA GLY A 849 7.961 8.535 11.167 1.00 32.84 C ATOM 335 C GLY A 849 7.976 9.209 9.802 1.00 35.51 C ATOM 336 O GLY A 849 8.272 10.409 9.692 1.00 33.54 O ATOM 337 H GLY A 849 8.041 9.687 12.997 1.00 0.00 H ATOM 338 N ALA A 850 7.699 8.423 8.752 1.00 33.40 N ATOM 339 CA ALA A 850 7.706 8.899 7.361 1.00 33.85 C ATOM 340 C ALA A 850 6.502 9.763 7.003 1.00 36.18 C ATOM 341 O ALA A 850 5.390 9.533 7.486 1.00 35.06 O ATOM 342 CB ALA A 850 7.789 7.724 6.401 1.00 34.50 C ATOM 343 H ALA A 850 7.467 7.425 8.931 1.00 0.00 H ATOM 344 N LEU A 851 6.746 10.758 6.153 1.00 31.91 N ATOM 345 CA LEU A 851 5.732 11.623 5.565 1.00 30.99 C ATOM 346 C LEU A 851 5.026 10.846 4.434 1.00 32.72 C ATOM 347 O LEU A 851 5.681 10.115 3.677 1.00 31.21 O ATOM 348 CB LEU A 851 6.360 12.917 5.020 1.00 30.64 C ATOM 349 CG LEU A 851 7.006 13.854 6.038 1.00 35.29 C ATOM 350 CD1 LEU A 851 7.514 15.103 5.364 1.00 34.34 C ATOM 351 CD2 LEU A 851 6.006 14.257 7.177 1.00 36.93 C ATOM 352 H LEU A 851 7.737 10.931 5.888 1.00 0.00 H ATOM 353 N VAL A 852 3.681 10.959 4.363 1.00 26.91 N ATOM 354 CA VAL A 852 2.859 10.301 3.332 1.00 26.84 C ATOM 355 C VAL A 852 1.818 11.306 2.845 1.00 30.91 C ATOM 356 O VAL A 852 1.476 12.238 3.595 1.00 29.02 O ATOM 357 CB VAL A 852 2.154 8.993 3.829 1.00 31.59 C ATOM 358 CG1 VAL A 852 3.116 7.797 3.879 1.00 31.28 C ATOM 359 CG2 VAL A 852 1.445 9.194 5.179 1.00 31.49 C ATOM 360 H VAL A 852 3.199 11.543 5.076 1.00 0.00 H ATOM 361 N ALA A 853 1.326 11.126 1.592 1.00 27.18 N ATOM 362 CA ALA A 853 0.242 11.954 1.045 1.00 27.28 C ATOM 363 C ALA A 853 -1.031 11.119 1.212 1.00 29.49 C ATOM 364 O ALA A 853 -1.061 9.912 0.909 1.00 27.61 O ATOM 365 CB ALA A 853 0.477 12.298 -0.416 1.00 27.19 C ATOM 366 H ALA A 853 1.731 10.375 0.998 1.00 0.00 H ATOM 367 N VAL A 854 -2.044 11.727 1.816 1.00 26.35 N ATOM 368 CA VAL A 854 -3.258 10.991 2.160 1.00 25.08 C ATOM 369 C VAL A 854 -4.480 11.651 1.531 1.00 29.40 C ATOM 370 O VAL A 854 -4.766 12.825 1.785 1.00 27.89 O ATOM 371 CB VAL A 854 -3.372 10.791 3.702 1.00 27.79 C ATOM 372 CG1 VAL A 854 -4.589 9.934 4.056 1.00 27.15 C ATOM 373 CG2 VAL A 854 -2.096 10.144 4.272 1.00 26.86 C ATOM 374 H VAL A 854 -1.973 12.739 2.047 1.00 0.00 H ATOM 375 N LYS A 855 -5.192 10.876 0.714 1.00 27.54 N ATOM 376 CA LYS A 855 -6.374 11.318 -0.014 1.00 27.64 C ATOM 377 C LYS A 855 -7.634 10.753 0.614 1.00 31.69 C ATOM 378 O LYS A 855 -7.699 9.577 0.957 1.00 29.15 O ATOM 379 CB LYS A 855 -6.249 10.904 -1.491 1.00 30.31 C ATOM 380 CG LYS A 855 -7.207 11.575 -2.477 1.00 39.28 C ATOM 381 CD LYS A 855 -6.744 11.273 -3.896 1.00 47.39 C ATOM 382 CE LYS A 855 -7.351 12.158 -4.956 1.00 53.39 C ATOM 383 NZ LYS A 855 -8.547 11.542 -5.588 1.00 44.00 N ATOM 384 HZ1 LYS A 855 -8.277 10.642 -6.034 1.00 0.00 H ATOM 385 HZ2 LYS A 855 -9.270 11.367 -4.861 1.00 0.00 H ATOM 386 HZ3 LYS A 855 -8.928 12.188 -6.309 1.00 0.00 H ATOM 387 H LYS A 855 -4.884 9.891 0.588 1.00 0.00 H ATOM 388 N GLN A 856 -8.618 11.621 0.826 1.00 31.10 N ATOM 389 CA GLN A 856 -9.910 11.223 1.393 1.00 32.06 C ATOM 390 C GLN A 856 -11.048 11.980 0.704 1.00 39.02 C ATOM 391 O GLN A 856 -10.804 12.969 0.010 1.00 36.56 O ATOM 392 CB GLN A 856 -9.971 11.363 2.927 1.00 33.18 C ATOM 393 CG GLN A 856 -9.487 12.707 3.506 1.00 45.13 C ATOM 394 CD GLN A 856 -7.974 12.757 3.621 1.00 50.55 C ATOM 395 OE1 GLN A 856 -7.298 13.598 3.019 1.00 41.56 O ATOM 396 NE2 GLN A 856 -7.403 11.816 4.337 1.00 35.47 N ATOM 397 HE22 GLN A 856 -7.988 11.116 4.837 1.00 0.00 H ATOM 398 HE21 GLN A 856 -6.366 11.770 4.404 1.00 0.00 H ATOM 399 H GLN A 856 -8.466 12.620 0.580 1.00 0.00 H ATOM 400 N LEU A 857 -12.274 11.459 0.833 1.00 40.43 N ATOM 401 CA LEU A 857 -13.467 12.115 0.296 1.00 42.32 C ATOM 402 C LEU A 857 -13.867 13.247 1.235 1.00 49.75 C ATOM 403 O LEU A 857 -13.473 13.244 2.414 1.00 50.48 O ATOM 404 CB LEU A 857 -14.621 11.118 0.169 1.00 42.68 C ATOM 405 CG LEU A 857 -14.686 10.303 -1.110 1.00 47.57 C ATOM 406 CD1 LEU A 857 -15.871 9.348 -1.055 1.00 49.07 C ATOM 407 CD2 LEU A 857 -14.809 11.191 -2.357 1.00 48.82 C ATOM 408 H LEU A 857 -12.383 10.554 1.334 1.00 0.00 H ATOM 409 N GLN A 858 -14.621 14.236 0.699 1.00 46.92 N ATOM 410 CA GLN A 858 -15.117 15.392 1.439 1.00 50.40 C ATOM 411 C GLN A 858 -16.574 15.702 1.068 1.00 90.86 C ATOM 412 O GLN A 858 -17.068 15.307 0.010 1.00 57.16 O ATOM 413 CB GLN A 858 -14.241 16.612 1.170 1.00 51.62 C ATOM 414 CG GLN A 858 -13.021 16.727 2.072 1.00 62.34 C ATOM 415 CD GLN A 858 -12.452 18.122 1.991 1.00 81.15 C ATOM 416 OE1 GLN A 858 -11.989 18.580 0.938 1.00 77.55 O ATOM 417 NE2 GLN A 858 -12.528 18.852 3.087 1.00 72.54 N ATOM 418 HE22 GLN A 858 -12.921 18.443 3.958 1.00 0.00 H ATOM 419 HE21 GLN A 858 -12.195 19.837 3.080 1.00 0.00 H ATOM 420 H GLN A 858 -14.863 14.167 -0.310 1.00 0.00 H TER 421 GLN A 858 ATOM 422 N ASP A 863 -22.965 7.307 -3.310 1.00 82.91 N ATOM 423 CA ASP A 863 -22.386 7.013 -4.623 1.00 82.80 C ATOM 424 C ASP A 863 -20.929 7.463 -4.772 1.00 84.49 C ATOM 425 O ASP A 863 -20.193 6.869 -5.564 1.00 83.83 O ATOM 426 CB ASP A 863 -23.267 7.537 -5.781 1.00 85.22 C ATOM 427 CG ASP A 863 -23.972 8.859 -5.526 1.00100.02 C ATOM 428 OD1 ASP A 863 -24.829 8.911 -4.609 1.00101.04 O ATOM 429 OD2 ASP A 863 -23.721 9.822 -6.285 1.00106.99 O ATOM 430 HN3 ASP A 863 -22.940 8.333 -3.143 1.00 0.00 H ATOM 431 HN2 ASP A 863 -22.415 6.821 -2.573 1.00 0.00 H ATOM 432 HN1 ASP A 863 -23.950 6.974 -3.285 1.00 0.00 H ATOM 433 N GLN A 864 -20.515 8.504 -4.007 1.00 79.02 N ATOM 434 CA GLN A 864 -19.145 9.041 -4.009 1.00 77.21 C ATOM 435 C GLN A 864 -18.145 8.015 -3.468 1.00 76.29 C ATOM 436 O GLN A 864 -17.021 7.946 -3.974 1.00 75.69 O ATOM 437 CB GLN A 864 -19.059 10.358 -3.217 1.00 78.55 C ATOM 438 CG GLN A 864 -19.196 11.612 -4.081 1.00 94.20 C ATOM 439 CD GLN A 864 -20.618 12.115 -4.181 1.00113.38 C ATOM 440 OE1 GLN A 864 -21.197 12.628 -3.214 1.00107.95 O ATOM 441 NE2 GLN A 864 -21.192 12.027 -5.372 1.00104.53 N ATOM 442 HE22 GLN A 864 -20.680 11.591 -6.165 1.00 0.00 H ATOM 443 HE21 GLN A 864 -22.155 12.394 -5.514 1.00 0.00 H ATOM 444 H GLN A 864 -21.212 8.952 -3.378 1.00 0.00 H ATOM 445 N GLN A 865 -18.576 7.209 -2.455 1.00 68.88 N ATOM 446 CA GLN A 865 -17.807 6.135 -1.810 1.00 67.06 C ATOM 447 C GLN A 865 -17.440 5.036 -2.828 1.00 67.98 C ATOM 448 O GLN A 865 -16.353 4.457 -2.738 1.00 67.38 O ATOM 449 CB GLN A 865 -18.599 5.560 -0.614 1.00 67.95 C ATOM 450 CG GLN A 865 -17.892 4.467 0.215 1.00 80.33 C ATOM 451 CD GLN A 865 -16.847 4.959 1.201 1.00 95.30 C ATOM 452 OE1 GLN A 865 -15.708 4.479 1.227 1.00 87.26 O ATOM 453 NE2 GLN A 865 -17.228 5.860 2.094 1.00 88.82 N ATOM 454 HE22 GLN A 865 -18.190 6.254 2.058 1.00 0.00 H ATOM 455 HE21 GLN A 865 -16.565 6.174 2.831 1.00 0.00 H ATOM 456 H GLN A 865 -19.542 7.370 -2.105 1.00 0.00 H ATOM 457 N ARG A 866 -18.351 4.760 -3.795 1.00 62.00 N ATOM 458 CA ARG A 866 -18.170 3.761 -4.854 1.00 59.80 C ATOM 459 C ARG A 866 -17.031 4.182 -5.800 1.00 57.46 C ATOM 460 O ARG A 866 -16.165 3.363 -6.106 1.00 55.69 O ATOM 461 CB ARG A 866 -19.491 3.531 -5.618 1.00 60.09 C ATOM 462 CG ARG A 866 -19.410 2.490 -6.734 1.00 71.60 C ATOM 463 CD ARG A 866 -19.610 3.108 -8.106 1.00 81.37 C ATOM 464 H ARG A 866 -19.242 5.296 -3.785 1.00 0.00 H ATOM 465 N ASP A 867 -17.029 5.458 -6.229 1.00 51.96 N ATOM 466 CA ASP A 867 -16.008 6.029 -7.123 1.00 50.77 C ATOM 467 C ASP A 867 -14.637 6.162 -6.430 1.00 48.65 C ATOM 468 O ASP A 867 -13.598 6.073 -7.089 1.00 46.63 O ATOM 469 CB ASP A 867 -16.467 7.375 -7.680 1.00 53.59 C ATOM 470 CG ASP A 867 -17.587 7.244 -8.689 1.00 69.66 C ATOM 471 OD1 ASP A 867 -17.292 7.260 -9.913 1.00 71.07 O ATOM 472 OD2 ASP A 867 -18.755 7.102 -8.260 1.00 74.83 O ATOM 473 H ASP A 867 -17.798 6.080 -5.908 1.00 0.00 H ATOM 474 N PHE A 868 -14.647 6.336 -5.103 1.00 42.47 N ATOM 475 CA PHE A 868 -13.426 6.421 -4.313 1.00 40.21 C ATOM 476 C PHE A 868 -12.804 5.027 -4.186 1.00 39.33 C ATOM 477 O PHE A 868 -11.603 4.892 -4.369 1.00 36.10 O ATOM 478 CB PHE A 868 -13.685 7.048 -2.932 1.00 41.55 C ATOM 479 CG PHE A 868 -12.442 7.231 -2.086 1.00 41.78 C ATOM 480 CD1 PHE A 868 -11.352 7.954 -2.565 1.00 44.23 C ATOM 481 CD2 PHE A 868 -12.370 6.698 -0.810 1.00 42.37 C ATOM 482 CE1 PHE A 868 -10.211 8.138 -1.774 1.00 44.40 C ATOM 483 CE2 PHE A 868 -11.231 6.889 -0.020 1.00 44.99 C ATOM 484 CZ PHE A 868 -10.160 7.605 -0.511 1.00 42.39 C ATOM 485 H PHE A 868 -15.563 6.414 -4.616 1.00 0.00 H ATOM 486 N GLN A 869 -13.632 3.995 -3.922 1.00 36.20 N ATOM 487 CA GLN A 869 -13.204 2.597 -3.828 1.00 35.81 C ATOM 488 C GLN A 869 -12.608 2.119 -5.167 1.00 37.79 C ATOM 489 O GLN A 869 -11.584 1.435 -5.166 1.00 35.41 O ATOM 490 CB GLN A 869 -14.372 1.699 -3.363 1.00 37.88 C ATOM 491 CG GLN A 869 -13.974 0.256 -3.026 1.00 62.51 C ATOM 492 CD GLN A 869 -12.851 0.187 -2.017 1.00 85.88 C ATOM 493 OE1 GLN A 869 -12.942 0.740 -0.915 1.00 82.51 O ATOM 494 NE2 GLN A 869 -11.746 -0.450 -2.395 1.00 74.06 N ATOM 495 HE22 GLN A 869 -11.702 -0.905 -3.329 1.00 0.00 H ATOM 496 HE21 GLN A 869 -10.926 -0.493 -1.756 1.00 0.00 H ATOM 497 H GLN A 869 -14.640 4.206 -3.776 1.00 0.00 H ATOM 498 N ARG A 870 -13.234 2.515 -6.301 1.00 34.35 N ATOM 499 CA ARG A 870 -12.748 2.200 -7.652 1.00 34.29 C ATOM 500 C ARG A 870 -11.374 2.822 -7.877 1.00 34.25 C ATOM 501 O ARG A 870 -10.486 2.160 -8.403 1.00 32.57 O ATOM 502 CB ARG A 870 -13.717 2.713 -8.741 1.00 36.49 C ATOM 503 CG ARG A 870 -14.771 1.685 -9.150 1.00 53.77 C ATOM 504 CD ARG A 870 -16.106 2.334 -9.489 1.00 68.11 C ATOM 505 NE ARG A 870 -16.003 3.312 -10.573 1.00 79.77 N ATOM 506 HE ARG A 870 -15.083 3.496 -11.021 1.00 0.00 H ATOM 507 H ARG A 870 -14.107 3.073 -6.211 1.00 0.00 H ATOM 508 N GLU A 871 -11.201 4.088 -7.473 1.00 30.44 N ATOM 509 CA GLU A 871 -9.932 4.808 -7.627 1.00 29.96 C ATOM 510 C GLU A 871 -8.789 4.068 -6.915 1.00 32.33 C ATOM 511 O GLU A 871 -7.705 3.907 -7.494 1.00 32.02 O ATOM 512 CB GLU A 871 -10.074 6.250 -7.104 1.00 31.28 C ATOM 513 CG GLU A 871 -8.757 7.013 -7.038 1.00 33.98 C ATOM 514 CD GLU A 871 -8.858 8.395 -6.425 1.00 44.68 C ATOM 515 OE1 GLU A 871 -9.976 8.815 -6.049 1.00 42.46 O ATOM 516 OE2 GLU A 871 -7.807 9.063 -6.322 1.00 32.61 O ATOM 517 H GLU A 871 -12.002 4.582 -7.031 1.00 0.00 H ATOM 518 N ILE A 872 -9.040 3.617 -5.664 1.00 28.28 N ATOM 519 CA ILE A 872 -8.078 2.862 -4.842 1.00 26.99 C ATOM 520 C ILE A 872 -7.712 1.536 -5.549 1.00 32.22 C ATOM 521 O ILE A 872 -6.533 1.204 -5.644 1.00 30.88 O ATOM 522 CB ILE A 872 -8.640 2.632 -3.414 1.00 29.60 C ATOM 523 CG1 ILE A 872 -8.744 3.978 -2.610 1.00 29.26 C ATOM 524 CG2 ILE A 872 -7.833 1.562 -2.642 1.00 30.91 C ATOM 525 CD1 ILE A 872 -9.493 3.845 -1.249 1.00 31.28 C ATOM 526 H ILE A 872 -9.975 3.817 -5.255 1.00 0.00 H ATOM 527 N GLN A 873 -8.722 0.792 -6.034 1.00 31.97 N ATOM 528 CA GLN A 873 -8.500 -0.480 -6.739 1.00 32.68 C ATOM 529 C GLN A 873 -7.677 -0.274 -8.009 1.00 34.82 C ATOM 530 O GLN A 873 -6.808 -1.085 -8.297 1.00 33.51 O ATOM 531 CB GLN A 873 -9.837 -1.181 -7.072 1.00 34.06 C ATOM 532 CG GLN A 873 -10.592 -1.745 -5.854 1.00 47.78 C ATOM 533 CD GLN A 873 -9.714 -2.471 -4.859 1.00 66.45 C ATOM 534 OE1 GLN A 873 -9.553 -2.040 -3.709 1.00 61.19 O ATOM 535 NE2 GLN A 873 -9.096 -3.565 -5.285 1.00 63.88 N ATOM 536 HE22 GLN A 873 -9.250 -3.904 -6.256 1.00 0.00 H ATOM 537 HE21 GLN A 873 -8.458 -4.083 -4.648 1.00 0.00 H ATOM 538 H GLN A 873 -9.698 1.129 -5.906 1.00 0.00 H ATOM 539 N ILE A 874 -7.896 0.851 -8.724 1.00 30.93 N ATOM 540 CA ILE A 874 -7.128 1.154 -9.943 1.00 29.70 C ATOM 541 C ILE A 874 -5.671 1.424 -9.588 1.00 31.74 C ATOM 542 O ILE A 874 -4.783 0.773 -10.147 1.00 31.37 O ATOM 543 CB ILE A 874 -7.775 2.310 -10.780 1.00 32.15 C ATOM 544 CG1 ILE A 874 -9.071 1.803 -11.484 1.00 32.80 C ATOM 545 CG2 ILE A 874 -6.782 2.899 -11.807 1.00 33.06 C ATOM 546 CD1 ILE A 874 -10.014 2.925 -12.076 1.00 36.00 C ATOM 547 H ILE A 874 -8.626 1.520 -8.405 1.00 0.00 H ATOM 548 N LEU A 875 -5.420 2.379 -8.658 1.00 27.36 N ATOM 549 CA LEU A 875 -4.055 2.757 -8.283 1.00 25.98 C ATOM 550 C LEU A 875 -3.252 1.612 -7.671 1.00 30.10 C ATOM 551 O LEU A 875 -2.066 1.477 -7.985 1.00 30.47 O ATOM 552 CB LEU A 875 -4.024 3.997 -7.374 1.00 25.59 C ATOM 553 CG LEU A 875 -2.652 4.646 -7.192 1.00 28.04 C ATOM 554 CD1 LEU A 875 -2.185 5.322 -8.505 1.00 28.82 C ATOM 555 CD2 LEU A 875 -2.681 5.678 -6.061 1.00 28.55 C ATOM 556 H LEU A 875 -6.220 2.857 -8.197 1.00 0.00 H ATOM 557 N LYS A 876 -3.896 0.796 -6.808 1.00 29.29 N ATOM 558 CA LYS A 876 -3.286 -0.375 -6.157 1.00 30.32 C ATOM 559 C LYS A 876 -2.689 -1.391 -7.185 1.00 34.96 C ATOM 560 O LYS A 876 -1.637 -1.980 -6.925 1.00 34.36 O ATOM 561 CB LYS A 876 -4.314 -1.053 -5.223 1.00 32.33 C ATOM 562 CG LYS A 876 -3.852 -2.359 -4.564 1.00 53.47 C ATOM 563 CD LYS A 876 -4.705 -2.779 -3.356 1.00 64.28 C ATOM 564 CE LYS A 876 -5.991 -3.478 -3.726 1.00 80.67 C ATOM 565 NZ LYS A 876 -6.622 -4.123 -2.545 1.00 91.05 N ATOM 566 HZ1 LYS A 876 -5.968 -4.826 -2.145 1.00 0.00 H ATOM 567 HZ2 LYS A 876 -6.835 -3.399 -1.829 1.00 0.00 H ATOM 568 HZ3 LYS A 876 -7.503 -4.593 -2.837 1.00 0.00 H ATOM 569 H LYS A 876 -4.890 1.010 -6.589 1.00 0.00 H ATOM 570 N ALA A 877 -3.330 -1.532 -8.355 1.00 32.26 N ATOM 571 CA ALA A 877 -2.914 -2.450 -9.431 1.00 32.01 C ATOM 572 C ALA A 877 -1.984 -1.821 -10.476 1.00 34.40 C ATOM 573 O ALA A 877 -1.637 -2.494 -11.446 1.00 32.96 O ATOM 574 CB ALA A 877 -4.142 -3.059 -10.101 1.00 33.30 C ATOM 575 H ALA A 877 -4.179 -0.953 -8.514 1.00 0.00 H ATOM 576 N LEU A 878 -1.544 -0.544 -10.276 1.00 30.74 N ATOM 577 CA LEU A 878 -0.610 0.110 -11.203 1.00 28.88 C ATOM 578 C LEU A 878 0.786 0.086 -10.632 1.00 31.48 C ATOM 579 O LEU A 878 0.982 0.473 -9.490 1.00 30.63 O ATOM 580 CB LEU A 878 -1.022 1.545 -11.567 1.00 29.04 C ATOM 581 CG LEU A 878 -2.399 1.681 -12.205 1.00 33.98 C ATOM 582 CD1 LEU A 878 -2.833 3.110 -12.245 1.00 33.60 C ATOM 583 CD2 LEU A 878 -2.460 0.996 -13.580 1.00 36.07 C ATOM 584 H LEU A 878 -1.880 -0.019 -9.443 1.00 0.00 H ATOM 585 N HIS A 879 1.768 -0.376 -11.429 1.00 30.38 N ATOM 586 CA HIS A 879 3.159 -0.511 -10.990 1.00 30.56 C ATOM 587 C HIS A 879 4.071 0.071 -12.043 1.00 33.98 C ATOM 588 O HIS A 879 4.462 -0.603 -12.989 1.00 33.49 O ATOM 589 CB HIS A 879 3.487 -1.990 -10.698 1.00 31.74 C ATOM 590 CG HIS A 879 2.542 -2.621 -9.715 1.00 35.53 C ATOM 591 ND1 HIS A 879 2.673 -2.411 -8.347 1.00 37.10 N ATOM 592 CD2 HIS A 879 1.495 -3.454 -9.932 1.00 37.38 C ATOM 593 CE1 HIS A 879 1.721 -3.138 -7.779 1.00 36.56 C ATOM 594 NE2 HIS A 879 0.977 -3.771 -8.692 1.00 37.32 N ATOM 595 H HIS A 879 1.527 -0.650 -12.403 1.00 0.00 H ATOM 596 N SER A 880 4.373 1.350 -11.903 1.00 29.75 N ATOM 597 CA SER A 880 5.199 2.035 -12.875 1.00 28.26 C ATOM 598 C SER A 880 6.001 3.107 -12.206 1.00 31.27 C ATOM 599 O SER A 880 5.473 3.805 -11.331 1.00 28.77 O ATOM 600 CB SER A 880 4.315 2.656 -13.951 1.00 27.82 C ATOM 601 OG SER A 880 5.047 3.501 -14.823 1.00 28.90 O ATOM 602 HG SER A 880 5.756 2.976 -15.272 1.00 0.00 H ATOM 603 H SER A 880 4.011 1.873 -11.080 1.00 0.00 H ATOM 604 N ASP A 881 7.237 3.330 -12.707 1.00 28.03 N ATOM 605 CA ASP A 881 8.099 4.418 -12.249 1.00 28.33 C ATOM 606 C ASP A 881 7.450 5.775 -12.578 1.00 29.73 C ATOM 607 O ASP A 881 7.853 6.781 -11.999 1.00 27.05 O ATOM 608 CB ASP A 881 9.476 4.359 -12.947 1.00 31.15 C ATOM 609 CG ASP A 881 10.338 3.188 -12.494 1.00 48.76 C ATOM 610 OD1 ASP A 881 10.121 2.690 -11.362 1.00 51.08 O ATOM 611 OD2 ASP A 881 11.217 2.759 -13.276 1.00 53.43 O ATOM 612 H ASP A 881 7.591 2.698 -13.453 1.00 0.00 H ATOM 613 N PHE A 882 6.449 5.793 -13.505 1.00 26.93 N ATOM 614 CA PHE A 882 5.793 7.035 -13.962 1.00 27.35 C ATOM 615 C PHE A 882 4.348 7.231 -13.481 1.00 28.89 C ATOM 616 O PHE A 882 3.623 8.102 -13.973 1.00 27.16 O ATOM 617 CB PHE A 882 5.965 7.186 -15.485 1.00 29.53 C ATOM 618 CG PHE A 882 7.402 6.992 -15.922 1.00 31.66 C ATOM 619 CD1 PHE A 882 7.765 5.904 -16.711 1.00 36.41 C ATOM 620 CD2 PHE A 882 8.403 7.843 -15.472 1.00 33.43 C ATOM 621 CE1 PHE A 882 9.101 5.703 -17.084 1.00 37.22 C ATOM 622 CE2 PHE A 882 9.739 7.618 -15.810 1.00 36.45 C ATOM 623 CZ PHE A 882 10.076 6.571 -16.647 1.00 34.76 C ATOM 624 H PHE A 882 6.133 4.889 -13.909 1.00 0.00 H ATOM 625 N ILE A 883 3.949 6.444 -12.491 1.00 24.08 N ATOM 626 CA ILE A 883 2.623 6.552 -11.869 1.00 24.52 C ATOM 627 C ILE A 883 2.894 6.650 -10.378 1.00 28.48 C ATOM 628 O ILE A 883 3.656 5.833 -9.837 1.00 27.98 O ATOM 629 CB ILE A 883 1.648 5.360 -12.183 1.00 27.18 C ATOM 630 CG1 ILE A 883 1.468 5.047 -13.707 1.00 28.55 C ATOM 631 CG2 ILE A 883 0.293 5.502 -11.454 1.00 25.34 C ATOM 632 CD1 ILE A 883 0.956 6.108 -14.620 1.00 33.04 C ATOM 633 H ILE A 883 4.605 5.717 -12.139 1.00 0.00 H ATOM 634 N VAL A 884 2.239 7.614 -9.704 1.00 24.95 N ATOM 635 CA VAL A 884 2.390 7.781 -8.253 1.00 24.50 C ATOM 636 C VAL A 884 2.152 6.432 -7.503 1.00 27.95 C ATOM 637 O VAL A 884 1.211 5.675 -7.819 1.00 25.44 O ATOM 638 CB VAL A 884 1.566 8.983 -7.697 1.00 27.98 C ATOM 639 CG1 VAL A 884 0.062 8.691 -7.720 1.00 28.05 C ATOM 640 CG2 VAL A 884 2.028 9.361 -6.277 1.00 27.36 C ATOM 641 H VAL A 884 1.609 8.257 -10.225 1.00 0.00 H ATOM 642 N LYS A 885 3.059 6.118 -6.560 1.00 26.50 N ATOM 643 CA LYS A 885 2.986 4.850 -5.830 1.00 26.74 C ATOM 644 C LYS A 885 1.921 4.822 -4.761 1.00 29.39 C ATOM 645 O LYS A 885 1.913 5.668 -3.856 1.00 27.89 O ATOM 646 CB LYS A 885 4.332 4.511 -5.199 1.00 30.31 C ATOM 647 CG LYS A 885 5.132 3.519 -6.014 1.00 54.05 C ATOM 648 CD LYS A 885 6.469 3.208 -5.356 1.00 59.75 C ATOM 649 CE LYS A 885 7.467 2.637 -6.337 1.00 64.46 C ATOM 650 NZ LYS A 885 8.174 3.697 -7.103 1.00 69.39 N ATOM 651 HZ1 LYS A 885 7.480 4.258 -7.638 1.00 0.00 H ATOM 652 HZ2 LYS A 885 8.687 4.316 -6.443 1.00 0.00 H ATOM 653 HZ3 LYS A 885 8.847 3.256 -7.762 1.00 0.00 H ATOM 654 H LYS A 885 3.826 6.787 -6.346 1.00 0.00 H ATOM 655 N TYR A 886 1.062 3.800 -4.841 1.00 26.96 N ATOM 656 CA TYR A 886 0.051 3.442 -3.851 1.00 28.25 C ATOM 657 C TYR A 886 0.852 2.860 -2.650 1.00 30.48 C ATOM 658 O TYR A 886 1.722 2.026 -2.871 1.00 28.41 O ATOM 659 CB TYR A 886 -0.852 2.319 -4.436 1.00 29.36 C ATOM 660 CG TYR A 886 -1.722 1.584 -3.429 1.00 30.91 C ATOM 661 CD1 TYR A 886 -2.970 2.079 -3.066 1.00 33.53 C ATOM 662 CD2 TYR A 886 -1.331 0.348 -2.901 1.00 31.03 C ATOM 663 CE1 TYR A 886 -3.789 1.399 -2.157 1.00 33.79 C ATOM 664 CE2 TYR A 886 -2.134 -0.332 -1.974 1.00 31.29 C ATOM 665 CZ TYR A 886 -3.371 0.189 -1.626 1.00 36.68 C ATOM 666 OH TYR A 886 -4.194 -0.471 -0.755 1.00 42.59 O ATOM 667 HH TYR A 886 -3.735 -0.576 0.116 1.00 0.00 H ATOM 668 H TYR A 886 1.120 3.203 -5.690 1.00 0.00 H ATOM 669 N ARG A 887 0.575 3.307 -1.414 1.00 27.44 N ATOM 670 CA ARG A 887 1.206 2.749 -0.208 1.00 28.72 C ATOM 671 C ARG A 887 0.260 1.825 0.532 1.00 34.72 C ATOM 672 O ARG A 887 0.681 0.796 1.040 1.00 36.31 O ATOM 673 CB ARG A 887 1.736 3.835 0.756 1.00 31.64 C ATOM 674 CG ARG A 887 2.960 4.607 0.261 1.00 39.68 C ATOM 675 CD ARG A 887 4.177 3.736 0.020 1.00 50.76 C ATOM 676 NE ARG A 887 5.341 4.538 -0.365 1.00 62.95 N ATOM 677 CZ ARG A 887 6.361 4.081 -1.084 1.00 79.93 C ATOM 678 NH1 ARG A 887 6.371 2.823 -1.514 1.00 64.70 N ATOM 679 NH2 ARG A 887 7.375 4.882 -1.390 1.00 71.73 N ATOM 680 HE ARG A 887 5.371 5.530 -0.055 1.00 0.00 H ATOM 681 HH12 ARG A 887 7.172 2.472 -2.076 1.00 0.00 H ATOM 682 HH11 ARG A 887 5.577 2.190 -1.288 1.00 0.00 H ATOM 683 HH22 ARG A 887 8.171 4.521 -1.953 1.00 0.00 H ATOM 684 HH21 ARG A 887 7.373 5.871 -1.067 1.00 0.00 H ATOM 685 H ARG A 887 -0.113 4.079 -1.305 1.00 0.00 H ATOM 686 N GLY A 888 -0.995 2.220 0.643 1.00 30.65 N ATOM 687 CA GLY A 888 -2.000 1.431 1.332 1.00 30.33 C ATOM 688 C GLY A 888 -3.259 2.223 1.613 1.00 34.27 C ATOM 689 O GLY A 888 -3.493 3.255 0.992 1.00 31.52 O ATOM 690 H GLY A 888 -1.274 3.129 0.222 1.00 0.00 H ATOM 691 N VAL A 889 -4.066 1.741 2.561 1.00 32.74 N ATOM 692 CA VAL A 889 -5.344 2.349 2.952 1.00 33.35 C ATOM 693 C VAL A 889 -5.472 2.311 4.478 1.00 40.62 C ATOM 694 O VAL A 889 -4.936 1.398 5.113 1.00 40.61 O ATOM 695 CB VAL A 889 -6.514 1.574 2.243 1.00 36.56 C ATOM 696 CG1 VAL A 889 -7.885 1.914 2.812 1.00 37.08 C ATOM 697 CG2 VAL A 889 -6.506 1.817 0.744 1.00 35.84 C ATOM 698 H VAL A 889 -3.769 0.876 3.056 1.00 0.00 H ATOM 699 N SER A 890 -6.180 3.300 5.054 1.00 38.74 N ATOM 700 CA SER A 890 -6.575 3.332 6.460 1.00 40.29 C ATOM 701 C SER A 890 -8.100 3.130 6.462 1.00 47.71 C ATOM 702 O SER A 890 -8.785 3.702 5.608 1.00 48.19 O ATOM 703 CB SER A 890 -6.183 4.647 7.128 1.00 44.58 C ATOM 704 OG SER A 890 -6.915 5.742 6.605 1.00 58.45 O ATOM 705 HG SER A 890 -7.882 5.593 6.755 1.00 0.00 H ATOM 706 H SER A 890 -6.467 4.100 4.454 1.00 0.00 H ATOM 707 N TYR A 891 -8.629 2.268 7.355 1.00 45.75 N ATOM 708 CA TYR A 891 -10.080 2.001 7.419 1.00 46.31 C ATOM 709 C TYR A 891 -10.773 2.734 8.571 1.00 54.36 C ATOM 710 O TYR A 891 -10.127 3.099 9.565 1.00 54.81 O ATOM 711 CB TYR A 891 -10.373 0.495 7.509 1.00 46.96 C ATOM 712 CG TYR A 891 -9.958 -0.283 6.284 1.00 48.22 C ATOM 713 CD1 TYR A 891 -8.682 -0.833 6.182 1.00 50.09 C ATOM 714 CD2 TYR A 891 -10.838 -0.470 5.220 1.00 48.47 C ATOM 715 CE1 TYR A 891 -8.290 -1.545 5.048 1.00 51.50 C ATOM 716 CE2 TYR A 891 -10.453 -1.175 4.080 1.00 49.23 C ATOM 717 CZ TYR A 891 -9.182 -1.720 4.003 1.00 56.51 C ATOM 718 OH TYR A 891 -8.793 -2.412 2.878 1.00 59.38 O ATOM 719 HH TYR A 891 -7.862 -2.730 2.993 1.00 0.00 H ATOM 720 H TYR A 891 -7.996 1.777 8.018 1.00 0.00 H ATOM 721 N GLY A 892 -12.087 2.910 8.426 1.00 52.37 N ATOM 722 CA GLY A 892 -12.949 3.549 9.414 1.00 92.16 C ATOM 723 C GLY A 892 -14.246 2.795 9.623 1.00136.05 C ATOM 724 O GLY A 892 -14.241 1.609 9.964 1.00103.01 O ATOM 725 H GLY A 892 -12.527 2.568 7.548 1.00 0.00 H TER 726 GLY A 892 ATOM 727 N SER A 897 -13.275 1.521 3.308 1.00 51.23 N ATOM 728 CA SER A 897 -12.043 2.283 3.080 1.00 51.07 C ATOM 729 C SER A 897 -12.213 3.740 3.486 1.00 51.74 C ATOM 730 O SER A 897 -13.121 4.424 3.010 1.00 51.22 O ATOM 731 CB SER A 897 -11.603 2.205 1.619 1.00 54.93 C ATOM 732 OG SER A 897 -10.848 1.033 1.362 1.00 63.77 O ATOM 733 HG SER A 897 -10.581 1.016 0.409 1.00 0.00 H ATOM 734 HN3 SER A 897 -14.046 1.935 2.746 1.00 0.00 H ATOM 735 HN2 SER A 897 -13.522 1.558 4.318 1.00 0.00 H ATOM 736 HN1 SER A 897 -13.128 0.532 3.022 1.00 0.00 H ATOM 737 N LEU A 898 -11.351 4.217 4.361 1.00 45.47 N ATOM 738 CA LEU A 898 -11.472 5.607 4.743 1.00 43.92 C ATOM 739 C LEU A 898 -10.512 6.490 3.931 1.00 42.44 C ATOM 740 O LEU A 898 -10.946 7.495 3.356 1.00 41.53 O ATOM 741 CB LEU A 898 -11.302 5.775 6.276 1.00 44.06 C ATOM 742 CG LEU A 898 -11.449 7.174 6.891 1.00 48.50 C ATOM 743 CD1 LEU A 898 -12.736 7.863 6.458 1.00 48.56 C ATOM 744 CD2 LEU A 898 -11.409 7.097 8.398 1.00 50.44 C ATOM 745 H LEU A 898 -10.607 3.613 4.764 1.00 0.00 H ATOM 746 N ARG A 899 -9.219 6.132 3.891 1.00 33.39 N ATOM 747 CA ARG A 899 -8.242 7.005 3.234 1.00 31.17 C ATOM 748 C ARG A 899 -7.299 6.245 2.313 1.00 32.03 C ATOM 749 O ARG A 899 -6.943 5.107 2.610 1.00 30.32 O ATOM 750 CB ARG A 899 -7.415 7.757 4.303 1.00 30.54 C ATOM 751 CG ARG A 899 -8.197 8.618 5.321 1.00 39.62 C ATOM 752 CD ARG A 899 -7.282 9.148 6.421 1.00 46.77 C ATOM 753 NE ARG A 899 -7.978 9.421 7.681 1.00 52.95 N ATOM 754 CZ ARG A 899 -8.629 10.547 7.962 1.00 63.99 C ATOM 755 NH1 ARG A 899 -8.707 11.521 7.062 1.00 53.11 N ATOM 756 NH2 ARG A 899 -9.213 10.706 9.142 1.00 42.74 N ATOM 757 HE ARG A 899 -7.962 8.680 8.410 1.00 0.00 H ATOM 758 HH12 ARG A 899 -9.217 12.398 7.288 1.00 0.00 H ATOM 759 HH11 ARG A 899 -8.258 11.406 6.131 1.00 0.00 H ATOM 760 HH22 ARG A 899 -9.721 11.588 9.356 1.00 0.00 H ATOM 761 HH21 ARG A 899 -9.163 9.949 9.853 1.00 0.00 H ATOM 762 H ARG A 899 -8.911 5.238 4.325 1.00 0.00 H ATOM 763 N LEU A 900 -6.878 6.884 1.215 1.00 27.34 N ATOM 764 CA LEU A 900 -5.904 6.322 0.281 1.00 25.91 C ATOM 765 C LEU A 900 -4.521 6.882 0.673 1.00 29.05 C ATOM 766 O LEU A 900 -4.330 8.095 0.669 1.00 27.99 O ATOM 767 CB LEU A 900 -6.275 6.709 -1.173 1.00 25.30 C ATOM 768 CG LEU A 900 -5.239 6.434 -2.297 1.00 28.34 C ATOM 769 CD1 LEU A 900 -4.913 4.922 -2.387 1.00 27.44 C ATOM 770 CD2 LEU A 900 -5.797 6.913 -3.659 1.00 28.52 C ATOM 771 H LEU A 900 -7.264 7.829 1.016 1.00 0.00 H ATOM 772 N VAL A 901 -3.548 5.992 0.974 1.00 24.96 N ATOM 773 CA VAL A 901 -2.213 6.442 1.383 1.00 23.85 C ATOM 774 C VAL A 901 -1.231 6.244 0.219 1.00 27.45 C ATOM 775 O VAL A 901 -1.114 5.130 -0.320 1.00 25.84 O ATOM 776 CB VAL A 901 -1.735 5.748 2.695 1.00 26.59 C ATOM 777 CG1 VAL A 901 -0.370 6.279 3.130 1.00 25.48 C ATOM 778 CG2 VAL A 901 -2.772 5.891 3.820 1.00 26.50 C ATOM 779 H VAL A 901 -3.749 4.973 0.915 1.00 0.00 H ATOM 780 N MET A 902 -0.523 7.328 -0.158 1.00 24.50 N ATOM 781 CA MET A 902 0.444 7.300 -1.264 1.00 23.50 C ATOM 782 C MET A 902 1.749 7.885 -0.818 1.00 29.08 C ATOM 783 O MET A 902 1.809 8.552 0.221 1.00 28.19 O ATOM 784 CB MET A 902 -0.083 8.101 -2.487 1.00 24.77 C ATOM 785 CG MET A 902 -1.461 7.639 -2.965 1.00 26.44 C ATOM 786 SD MET A 902 -2.245 8.815 -4.093 1.00 28.79 S ATOM 787 CE MET A 902 -2.970 9.938 -2.933 1.00 23.81 C ATOM 788 H MET A 902 -0.667 8.221 0.355 1.00 0.00 H ATOM 789 N GLU A 903 2.808 7.646 -1.613 1.00 25.11 N ATOM 790 CA GLU A 903 4.116 8.253 -1.388 1.00 24.58 C ATOM 791 C GLU A 903 3.977 9.790 -1.500 1.00 28.40 C ATOM 792 O GLU A 903 3.163 10.296 -2.284 1.00 27.29 O ATOM 793 CB GLU A 903 5.136 7.738 -2.428 1.00 25.73 C ATOM 794 CG GLU A 903 4.756 8.025 -3.887 1.00 31.33 C ATOM 795 CD GLU A 903 5.831 7.729 -4.921 1.00 45.94 C ATOM 796 OE1 GLU A 903 7.007 7.575 -4.520 1.00 35.20 O ATOM 797 OE2 GLU A 903 5.512 7.717 -6.133 1.00 30.17 O ATOM 798 H GLU A 903 2.690 7.002 -2.421 1.00 0.00 H ATOM 799 N TYR A 904 4.724 10.516 -0.676 1.00 25.15 N ATOM 800 CA TYR A 904 4.680 11.968 -0.654 1.00 24.61 C ATOM 801 C TYR A 904 5.777 12.483 -1.555 1.00 29.88 C ATOM 802 O TYR A 904 6.938 12.082 -1.405 1.00 29.18 O ATOM 803 CB TYR A 904 4.863 12.501 0.800 1.00 25.72 C ATOM 804 CG TYR A 904 5.023 14.005 0.892 1.00 28.22 C ATOM 805 CD1 TYR A 904 4.097 14.862 0.306 1.00 30.48 C ATOM 806 CD2 TYR A 904 6.084 14.573 1.599 1.00 29.36 C ATOM 807 CE1 TYR A 904 4.255 16.248 0.361 1.00 32.21 C ATOM 808 CE2 TYR A 904 6.237 15.955 1.686 1.00 30.49 C ATOM 809 CZ TYR A 904 5.312 16.790 1.073 1.00 37.81 C ATOM 810 OH TYR A 904 5.434 18.155 1.153 1.00 35.48 O ATOM 811 HH TYR A 904 6.297 18.432 0.754 1.00 0.00 H ATOM 812 H TYR A 904 5.366 10.026 -0.021 1.00 0.00 H ATOM 813 N LEU A 905 5.424 13.374 -2.499 1.00 25.97 N ATOM 814 CA LEU A 905 6.430 13.947 -3.387 1.00 26.45 C ATOM 815 C LEU A 905 6.492 15.442 -3.031 1.00 31.19 C ATOM 816 O LEU A 905 5.617 16.187 -3.483 1.00 30.50 O ATOM 817 CB LEU A 905 6.042 13.713 -4.869 1.00 26.89 C ATOM 818 CG LEU A 905 6.540 12.419 -5.542 1.00 30.97 C ATOM 819 CD1 LEU A 905 6.124 11.178 -4.777 1.00 30.34 C ATOM 820 CD2 LEU A 905 5.977 12.278 -6.955 1.00 31.26 C ATOM 821 H LEU A 905 4.428 13.656 -2.596 1.00 0.00 H ATOM 822 N PRO A 906 7.465 15.881 -2.171 1.00 30.39 N ATOM 823 CA PRO A 906 7.503 17.297 -1.741 1.00 30.24 C ATOM 824 C PRO A 906 7.537 18.356 -2.841 1.00 33.13 C ATOM 825 O PRO A 906 6.996 19.442 -2.637 1.00 30.83 O ATOM 826 CB PRO A 906 8.734 17.386 -0.817 1.00 32.15 C ATOM 827 CG PRO A 906 9.500 16.151 -1.045 1.00 36.51 C ATOM 828 CD PRO A 906 8.545 15.100 -1.527 1.00 32.21 C ATOM 829 N SER A 907 8.110 18.033 -4.018 1.00 30.49 N ATOM 830 CA SER A 907 8.153 19.007 -5.113 1.00 29.30 C ATOM 831 C SER A 907 6.772 19.340 -5.668 1.00 32.69 C ATOM 832 O SER A 907 6.639 20.358 -6.324 1.00 33.25 O ATOM 833 CB SER A 907 9.100 18.563 -6.220 1.00 30.33 C ATOM 834 OG SER A 907 10.436 18.616 -5.764 1.00 34.33 O ATOM 835 HG SER A 907 11.043 18.326 -6.490 1.00 0.00 H ATOM 836 H SER A 907 8.524 17.088 -4.150 1.00 0.00 H ATOM 837 N GLY A 908 5.765 18.511 -5.369 1.00 28.62 N ATOM 838 CA GLY A 908 4.383 18.772 -5.751 1.00 28.09 C ATOM 839 C GLY A 908 4.063 18.712 -7.235 1.00 31.08 C ATOM 840 O GLY A 908 4.765 18.051 -8.010 1.00 28.66 O ATOM 841 H GLY A 908 5.978 17.641 -4.840 1.00 0.00 H ATOM 842 N CYS A 909 2.976 19.403 -7.635 1.00 28.75 N ATOM 843 CA CYS A 909 2.493 19.377 -9.013 1.00 29.67 C ATOM 844 C CYS A 909 3.414 20.059 -10.016 1.00 30.99 C ATOM 845 O CYS A 909 4.005 21.104 -9.726 1.00 30.08 O ATOM 846 CB CYS A 909 1.054 19.875 -9.126 1.00 31.80 C ATOM 847 SG CYS A 909 0.892 21.676 -9.154 1.00 37.13 S ATOM 848 H CYS A 909 2.462 19.976 -6.936 1.00 0.00 H ATOM 849 N LEU A 910 3.503 19.466 -11.206 1.00 25.88 N ATOM 850 CA LEU A 910 4.308 19.944 -12.321 1.00 26.04 C ATOM 851 C LEU A 910 3.967 21.362 -12.753 1.00 28.99 C ATOM 852 O LEU A 910 4.876 22.113 -13.118 1.00 27.59 O ATOM 853 CB LEU A 910 4.166 18.968 -13.508 1.00 26.48 C ATOM 854 CG LEU A 910 4.937 19.275 -14.787 1.00 30.23 C ATOM 855 CD1 LEU A 910 6.450 19.170 -14.570 1.00 29.94 C ATOM 856 CD2 LEU A 910 4.465 18.371 -15.916 1.00 33.12 C ATOM 857 H LEU A 910 2.955 18.594 -11.349 1.00 0.00 H ATOM 858 N ARG A 911 2.678 21.720 -12.728 1.00 26.87 N ATOM 859 CA ARG A 911 2.206 23.039 -13.142 1.00 28.19 C ATOM 860 C ARG A 911 2.878 24.142 -12.329 1.00 32.17 C ATOM 861 O ARG A 911 3.408 25.087 -12.916 1.00 31.90 O ATOM 862 CB ARG A 911 0.670 23.115 -13.036 1.00 30.82 C ATOM 863 CG ARG A 911 0.115 24.546 -13.145 1.00 43.22 C ATOM 864 CD ARG A 911 -1.391 24.585 -13.112 1.00 42.92 C ATOM 865 NE ARG A 911 -1.913 24.196 -11.805 1.00 65.45 N ATOM 866 CZ ARG A 911 -2.317 25.042 -10.868 1.00 86.06 C ATOM 867 NH1 ARG A 911 -2.271 26.352 -11.081 1.00 84.38 N ATOM 868 NH2 ARG A 911 -2.773 24.588 -9.708 1.00 71.53 N ATOM 869 HE ARG A 911 -1.972 23.179 -11.594 1.00 0.00 H ATOM 870 HH12 ARG A 911 -2.589 27.011 -10.342 1.00 0.00 H ATOM 871 HH11 ARG A 911 -1.917 26.719 -11.987 1.00 0.00 H ATOM 872 HH22 ARG A 911 -3.089 25.256 -8.976 1.00 0.00 H ATOM 873 HH21 ARG A 911 -2.815 23.564 -9.530 1.00 0.00 H ATOM 874 H ARG A 911 1.978 21.025 -12.398 1.00 0.00 H ATOM 875 N ASP A 912 2.894 23.995 -10.992 1.00 28.91 N ATOM 876 CA ASP A 912 3.511 24.979 -10.110 1.00 29.49 C ATOM 877 C ASP A 912 5.020 24.899 -10.193 1.00 32.15 C ATOM 878 O ASP A 912 5.676 25.930 -10.106 1.00 30.18 O ATOM 879 CB ASP A 912 3.044 24.807 -8.648 1.00 31.41 C ATOM 880 CG ASP A 912 1.564 25.069 -8.387 1.00 46.64 C ATOM 881 OD1 ASP A 912 0.868 25.536 -9.309 1.00 48.59 O ATOM 882 OD2 ASP A 912 1.105 24.793 -7.265 1.00 57.11 O ATOM 883 H ASP A 912 2.452 23.152 -10.573 1.00 0.00 H ATOM 884 N PHE A 913 5.572 23.670 -10.340 1.00 28.27 N ATOM 885 CA PHE A 913 7.018 23.455 -10.430 1.00 27.48 C ATOM 886 C PHE A 913 7.602 24.173 -11.654 1.00 31.64 C ATOM 887 O PHE A 913 8.657 24.817 -11.536 1.00 30.37 O ATOM 888 CB PHE A 913 7.316 21.961 -10.504 1.00 28.82 C ATOM 889 CG PHE A 913 8.778 21.603 -10.424 1.00 30.71 C ATOM 890 CD1 PHE A 913 9.410 21.469 -9.193 1.00 33.40 C ATOM 891 CD2 PHE A 913 9.510 21.340 -11.580 1.00 31.95 C ATOM 892 CE1 PHE A 913 10.764 21.110 -9.119 1.00 35.10 C ATOM 893 CE2 PHE A 913 10.861 20.998 -11.507 1.00 34.94 C ATOM 894 CZ PHE A 913 11.480 20.878 -10.278 1.00 32.85 C ATOM 895 H PHE A 913 4.942 22.844 -10.391 1.00 0.00 H ATOM 896 N LEU A 914 6.930 24.034 -12.828 1.00 28.80 N ATOM 897 CA LEU A 914 7.358 24.667 -14.090 1.00 28.63 C ATOM 898 C LEU A 914 7.405 26.181 -13.981 1.00 31.62 C ATOM 899 O LEU A 914 8.308 26.804 -14.524 1.00 31.21 O ATOM 900 CB LEU A 914 6.442 24.279 -15.258 1.00 28.61 C ATOM 901 CG LEU A 914 6.556 22.830 -15.770 1.00 33.12 C ATOM 902 CD1 LEU A 914 5.470 22.532 -16.767 1.00 33.06 C ATOM 903 CD2 LEU A 914 7.935 22.534 -16.333 1.00 35.95 C ATOM 904 H LEU A 914 6.069 23.451 -12.837 1.00 0.00 H ATOM 905 N GLN A 915 6.425 26.766 -13.307 1.00 30.09 N ATOM 906 CA GLN A 915 6.343 28.221 -13.136 1.00 31.36 C ATOM 907 C GLN A 915 7.508 28.722 -12.295 1.00 36.80 C ATOM 908 O GLN A 915 8.112 29.730 -12.653 1.00 36.22 O ATOM 909 CB GLN A 915 5.009 28.624 -12.494 1.00 32.47 C ATOM 910 CG GLN A 915 3.771 28.440 -13.386 1.00 42.01 C ATOM 911 CD GLN A 915 2.468 28.322 -12.601 1.00 53.76 C ATOM 912 OE1 GLN A 915 1.385 28.172 -13.162 1.00 51.95 O ATOM 913 NE2 GLN A 915 2.533 28.308 -11.283 1.00 49.71 N ATOM 914 HE22 GLN A 915 3.448 28.435 -10.806 1.00 0.00 H ATOM 915 HE21 GLN A 915 1.669 28.170 -10.721 1.00 0.00 H ATOM 916 H GLN A 915 5.685 26.171 -12.883 1.00 0.00 H ATOM 917 N ARG A 916 7.859 27.988 -11.213 1.00 35.08 N ATOM 918 CA ARG A 916 8.940 28.368 -10.302 1.00 34.99 C ATOM 919 C ARG A 916 10.324 28.153 -10.875 1.00 39.08 C ATOM 920 O ARG A 916 11.213 28.968 -10.619 1.00 37.15 O ATOM 921 CB ARG A 916 8.819 27.653 -8.942 1.00 36.60 C ATOM 922 CG ARG A 916 7.747 28.232 -8.029 1.00 54.77 C ATOM 923 CD ARG A 916 7.480 27.366 -6.808 1.00 70.71 C ATOM 924 NE ARG A 916 8.539 27.460 -5.801 1.00 85.51 N ATOM 925 CZ ARG A 916 9.453 26.520 -5.576 1.00103.47 C ATOM 926 NH1 ARG A 916 9.441 25.391 -6.275 1.00 93.93 N ATOM 927 NH2 ARG A 916 10.380 26.699 -4.644 1.00 88.37 N ATOM 928 HE ARG A 916 8.579 28.322 -5.221 1.00 0.00 H ATOM 929 HH12 ARG A 916 10.158 24.660 -6.094 1.00 0.00 H ATOM 930 HH11 ARG A 916 8.714 25.238 -7.003 1.00 0.00 H ATOM 931 HH22 ARG A 916 11.093 25.962 -4.471 1.00 0.00 H ATOM 932 HH21 ARG A 916 10.394 27.577 -4.086 1.00 0.00 H ATOM 933 H ARG A 916 7.335 27.111 -11.019 1.00 0.00 H ATOM 934 N HIS A 917 10.525 27.057 -11.629 1.00 36.22 N ATOM 935 CA HIS A 917 11.855 26.720 -12.140 1.00 36.14 C ATOM 936 C HIS A 917 12.074 26.958 -13.607 1.00 37.64 C ATOM 937 O HIS A 917 13.082 26.481 -14.142 1.00 36.46 O ATOM 938 CB HIS A 917 12.233 25.280 -11.732 1.00 38.22 C ATOM 939 CG HIS A 917 12.067 25.027 -10.267 1.00 42.56 C ATOM 940 ND1 HIS A 917 12.912 25.600 -9.333 1.00 45.27 N ATOM 941 CD2 HIS A 917 11.114 24.330 -9.617 1.00 45.28 C ATOM 942 CE1 HIS A 917 12.485 25.179 -8.156 1.00 45.04 C ATOM 943 NE2 HIS A 917 11.417 24.393 -8.277 1.00 45.41 N ATOM 944 H HIS A 917 9.720 26.437 -11.853 1.00 0.00 H ATOM 945 N ARG A 918 11.191 27.760 -14.254 1.00 35.02 N ATOM 946 CA ARG A 918 11.275 28.037 -15.700 1.00 36.20 C ATOM 947 C ARG A 918 12.638 28.493 -16.233 1.00 41.22 C ATOM 948 O ARG A 918 13.028 28.084 -17.324 1.00 41.09 O ATOM 949 CB ARG A 918 10.128 28.947 -16.215 1.00 35.56 C ATOM 950 CG ARG A 918 10.109 30.385 -15.689 1.00 45.04 C ATOM 951 CD ARG A 918 9.195 31.265 -16.545 1.00 50.64 C ATOM 952 NE ARG A 918 9.616 31.278 -17.951 1.00 54.76 N ATOM 953 CZ ARG A 918 8.803 31.148 -18.999 1.00 62.78 C ATOM 954 NH1 ARG A 918 7.492 31.021 -18.823 1.00 48.29 N ATOM 955 NH2 ARG A 918 9.292 31.178 -20.230 1.00 45.50 N ATOM 956 HE ARG A 918 10.631 31.398 -18.145 1.00 0.00 H ATOM 957 HH12 ARG A 918 6.864 30.920 -19.646 1.00 0.00 H ATOM 958 HH11 ARG A 918 7.094 31.023 -17.862 1.00 0.00 H ATOM 959 HH22 ARG A 918 8.655 31.076 -21.045 1.00 0.00 H ATOM 960 HH21 ARG A 918 10.313 31.303 -20.381 1.00 0.00 H ATOM 961 H ARG A 918 10.422 28.198 -13.707 1.00 0.00 H ATOM 962 N ALA A 919 13.368 29.303 -15.455 1.00 37.94 N ATOM 963 CA ALA A 919 14.677 29.818 -15.844 1.00 38.10 C ATOM 964 C ALA A 919 15.811 28.790 -15.700 1.00 45.22 C ATOM 965 O ALA A 919 16.919 29.031 -16.181 1.00 47.19 O ATOM 966 CB ALA A 919 14.977 31.089 -15.064 1.00 38.73 C ATOM 967 H ALA A 919 12.983 29.578 -14.529 1.00 0.00 H ATOM 968 N ARG A 920 15.513 27.618 -15.106 1.00 41.61 N ATOM 969 CA ARG A 920 16.460 26.523 -14.905 1.00 41.50 C ATOM 970 C ARG A 920 16.199 25.298 -15.820 1.00 46.01 C ATOM 971 O ARG A 920 17.124 24.531 -16.084 1.00 48.56 O ATOM 972 CB ARG A 920 16.464 26.110 -13.424 1.00 41.88 C ATOM 973 CG ARG A 920 17.410 24.957 -13.085 1.00 54.74 C ATOM 974 CD ARG A 920 17.286 24.517 -11.646 1.00 53.29 C ATOM 975 NE ARG A 920 17.978 25.436 -10.746 1.00 52.80 N ATOM 976 CZ ARG A 920 18.240 25.177 -9.468 1.00 60.64 C ATOM 977 NH1 ARG A 920 17.871 24.020 -8.929 1.00 42.40 N ATOM 978 NH2 ARG A 920 18.867 26.075 -8.718 1.00 42.06 N ATOM 979 HE ARG A 920 18.286 26.352 -11.129 1.00 0.00 H ATOM 980 HH12 ARG A 920 18.078 23.823 -7.929 1.00 0.00 H ATOM 981 HH11 ARG A 920 17.375 23.312 -9.507 1.00 0.00 H ATOM 982 HH22 ARG A 920 19.070 25.868 -7.719 1.00 0.00 H ATOM 983 HH21 ARG A 920 19.156 26.986 -9.129 1.00 0.00 H ATOM 984 H ARG A 920 14.539 27.483 -14.766 1.00 0.00 H ATOM 985 N LEU A 921 14.971 25.116 -16.307 1.00 39.42 N ATOM 986 CA LEU A 921 14.624 23.955 -17.141 1.00 38.01 C ATOM 987 C LEU A 921 14.621 24.286 -18.630 1.00 43.30 C ATOM 988 O LEU A 921 13.876 25.159 -19.054 1.00 43.88 O ATOM 989 CB LEU A 921 13.252 23.392 -16.724 1.00 37.14 C ATOM 990 CG LEU A 921 12.964 23.266 -15.224 1.00 40.19 C ATOM 991 CD1 LEU A 921 11.466 23.142 -14.974 1.00 39.98 C ATOM 992 CD2 LEU A 921 13.732 22.111 -14.595 1.00 40.42 C ATOM 993 H LEU A 921 14.235 25.818 -16.090 1.00 0.00 H ATOM 994 N ASP A 922 15.429 23.575 -19.425 1.00 40.12 N ATOM 995 CA ASP A 922 15.534 23.797 -20.872 1.00 39.29 C ATOM 996 C ASP A 922 14.626 22.850 -21.657 1.00 41.23 C ATOM 997 O ASP A 922 14.001 21.968 -21.059 1.00 39.51 O ATOM 998 CB ASP A 922 17.005 23.666 -21.328 1.00 41.62 C ATOM 999 CG ASP A 922 17.678 22.319 -21.071 1.00 51.94 C ATOM 1000 OD1 ASP A 922 18.921 22.252 -21.147 1.00 52.76 O ATOM 1001 OD2 ASP A 922 16.961 21.333 -20.796 1.00 57.20 O ATOM 1002 H ASP A 922 16.012 22.828 -18.996 1.00 0.00 H ATOM 1003 N ALA A 923 14.591 23.004 -23.000 1.00 37.06 N ATOM 1004 CA ALA A 923 13.790 22.182 -23.905 1.00 36.19 C ATOM 1005 C ALA A 923 14.063 20.683 -23.706 1.00 37.98 C ATOM 1006 O ALA A 923 13.106 19.901 -23.674 1.00 38.11 O ATOM 1007 CB ALA A 923 14.040 22.592 -25.350 1.00 36.40 C ATOM 1008 H ALA A 923 15.173 23.758 -23.417 1.00 0.00 H ATOM 1009 N SER A 924 15.342 20.292 -23.481 1.00 33.82 N ATOM 1010 CA SER A 924 15.728 18.894 -23.237 1.00 33.57 C ATOM 1011 C SER A 924 14.995 18.327 -22.014 1.00 35.85 C ATOM 1012 O SER A 924 14.458 17.228 -22.070 1.00 34.71 O ATOM 1013 CB SER A 924 17.235 18.761 -23.050 1.00 38.14 C ATOM 1014 OG SER A 924 17.919 19.002 -24.264 1.00 50.14 O ATOM 1015 HG SER A 924 17.624 18.346 -24.944 1.00 0.00 H ATOM 1016 H SER A 924 16.087 21.017 -23.481 1.00 0.00 H ATOM 1017 N ARG A 925 14.967 19.082 -20.920 1.00 32.48 N ATOM 1018 CA ARG A 925 14.259 18.667 -19.721 1.00 31.80 C ATOM 1019 C ARG A 925 12.733 18.535 -19.972 1.00 32.29 C ATOM 1020 O ARG A 925 12.119 17.613 -19.441 1.00 30.90 O ATOM 1021 CB ARG A 925 14.555 19.655 -18.583 1.00 32.46 C ATOM 1022 CG ARG A 925 14.195 19.165 -17.196 1.00 37.82 C ATOM 1023 CD ARG A 925 14.614 17.725 -16.898 1.00 41.67 C ATOM 1024 NE ARG A 925 16.064 17.530 -16.826 1.00 44.94 N ATOM 1025 CZ ARG A 925 16.843 17.921 -15.821 1.00 64.93 C ATOM 1026 NH1 ARG A 925 16.334 18.599 -14.801 1.00 55.18 N ATOM 1027 NH2 ARG A 925 18.144 17.668 -15.846 1.00 60.94 N ATOM 1028 HE ARG A 925 16.522 17.047 -17.625 1.00 0.00 H ATOM 1029 HH12 ARG A 925 16.949 18.901 -14.019 1.00 0.00 H ATOM 1030 HH11 ARG A 925 15.320 18.828 -14.783 1.00 0.00 H ATOM 1031 HH22 ARG A 925 18.749 17.976 -15.058 1.00 0.00 H ATOM 1032 HH21 ARG A 925 18.560 17.162 -16.654 1.00 0.00 H ATOM 1033 H ARG A 925 15.466 19.995 -20.923 1.00 0.00 H ATOM 1034 N LEU A 926 12.124 19.470 -20.746 1.00 29.08 N ATOM 1035 CA LEU A 926 10.681 19.409 -21.044 1.00 27.78 C ATOM 1036 C LEU A 926 10.364 18.163 -21.859 1.00 30.63 C ATOM 1037 O LEU A 926 9.329 17.520 -21.638 1.00 28.79 O ATOM 1038 CB LEU A 926 10.175 20.672 -21.768 1.00 27.04 C ATOM 1039 CG LEU A 926 10.363 22.019 -21.060 1.00 31.76 C ATOM 1040 CD1 LEU A 926 9.797 23.143 -21.908 1.00 31.38 C ATOM 1041 CD2 LEU A 926 9.711 22.022 -19.653 1.00 32.16 C ATOM 1042 H LEU A 926 12.690 20.249 -21.139 1.00 0.00 H ATOM 1043 N LEU A 927 11.267 17.817 -22.797 1.00 28.57 N ATOM 1044 CA LEU A 927 11.160 16.630 -23.660 1.00 29.84 C ATOM 1045 C LEU A 927 11.297 15.361 -22.810 1.00 31.92 C ATOM 1046 O LEU A 927 10.620 14.375 -23.094 1.00 30.92 O ATOM 1047 CB LEU A 927 12.267 16.657 -24.723 1.00 31.23 C ATOM 1048 CG LEU A 927 11.950 16.999 -26.198 1.00 36.51 C ATOM 1049 CD1 LEU A 927 10.469 17.231 -26.495 1.00 35.44 C ATOM 1050 CD2 LEU A 927 12.905 18.041 -26.753 1.00 38.46 C ATOM 1051 H LEU A 927 12.097 18.431 -22.920 1.00 0.00 H ATOM 1052 N LEU A 928 12.156 15.394 -21.755 1.00 28.79 N ATOM 1053 CA LEU A 928 12.329 14.261 -20.832 1.00 28.83 C ATOM 1054 C LEU A 928 11.028 14.035 -20.084 1.00 30.66 C ATOM 1055 O LEU A 928 10.543 12.899 -20.038 1.00 29.66 O ATOM 1056 CB LEU A 928 13.495 14.492 -19.848 1.00 29.50 C ATOM 1057 CG LEU A 928 13.769 13.397 -18.777 1.00 36.17 C ATOM 1058 CD1 LEU A 928 14.115 12.039 -19.409 1.00 37.23 C ATOM 1059 CD2 LEU A 928 14.887 13.825 -17.817 1.00 37.34 C ATOM 1060 H LEU A 928 12.714 16.257 -21.594 1.00 0.00 H ATOM 1061 N TYR A 929 10.402 15.127 -19.581 1.00 26.39 N ATOM 1062 CA TYR A 929 9.125 15.004 -18.866 1.00 25.88 C ATOM 1063 C TYR A 929 8.040 14.460 -19.797 1.00 28.91 C ATOM 1064 O TYR A 929 7.305 13.552 -19.406 1.00 28.25 O ATOM 1065 CB TYR A 929 8.672 16.354 -18.278 1.00 26.79 C ATOM 1066 CG TYR A 929 9.608 17.008 -17.282 1.00 27.69 C ATOM 1067 CD1 TYR A 929 10.397 16.244 -16.421 1.00 28.13 C ATOM 1068 CD2 TYR A 929 9.627 18.386 -17.126 1.00 30.04 C ATOM 1069 CE1 TYR A 929 11.239 16.847 -15.481 1.00 29.39 C ATOM 1070 CE2 TYR A 929 10.474 19.002 -16.206 1.00 32.00 C ATOM 1071 CZ TYR A 929 11.267 18.232 -15.371 1.00 36.48 C ATOM 1072 OH TYR A 929 12.069 18.882 -14.453 1.00 32.80 O ATOM 1073 HH TYR A 929 12.576 18.213 -13.928 1.00 0.00 H ATOM 1074 H TYR A 929 10.832 16.066 -19.703 1.00 0.00 H ATOM 1075 N SER A 930 7.965 15.001 -21.041 1.00 25.04 N ATOM 1076 CA SER A 930 6.978 14.581 -22.058 1.00 24.81 C ATOM 1077 C SER A 930 7.067 13.068 -22.318 1.00 27.36 C ATOM 1078 O SER A 930 6.047 12.392 -22.387 1.00 26.18 O ATOM 1079 CB SER A 930 7.189 15.345 -23.366 1.00 26.67 C ATOM 1080 OG SER A 930 7.233 16.744 -23.141 1.00 36.08 O ATOM 1081 HG SER A 930 7.981 16.955 -22.527 1.00 0.00 H ATOM 1082 H SER A 930 8.639 15.752 -21.292 1.00 0.00 H ATOM 1083 N SER A 931 8.287 12.558 -22.441 1.00 25.93 N ATOM 1084 CA SER A 931 8.589 11.140 -22.679 1.00 26.41 C ATOM 1085 C SER A 931 8.186 10.268 -21.489 1.00 29.11 C ATOM 1086 O SER A 931 7.654 9.178 -21.686 1.00 28.73 O ATOM 1087 CB SER A 931 10.079 10.982 -22.975 1.00 29.65 C ATOM 1088 OG SER A 931 10.448 9.615 -23.000 1.00 41.60 O ATOM 1089 HG SER A 931 11.416 9.539 -23.193 1.00 0.00 H ATOM 1090 H SER A 931 9.091 13.213 -22.363 1.00 0.00 H ATOM 1091 N GLN A 932 8.423 10.755 -20.250 1.00 26.89 N ATOM 1092 CA GLN A 932 8.037 10.036 -19.029 1.00 26.33 C ATOM 1093 C GLN A 932 6.513 9.999 -18.887 1.00 27.10 C ATOM 1094 O GLN A 932 5.962 8.952 -18.576 1.00 26.42 O ATOM 1095 CB GLN A 932 8.707 10.649 -17.791 1.00 27.56 C ATOM 1096 CG GLN A 932 10.224 10.522 -17.831 1.00 29.19 C ATOM 1097 CD GLN A 932 10.867 11.292 -16.701 1.00 41.13 C ATOM 1098 OE1 GLN A 932 10.290 12.223 -16.150 1.00 29.89 O ATOM 1099 NE2 GLN A 932 12.103 10.947 -16.359 1.00 27.89 N ATOM 1100 HE22 GLN A 932 12.573 10.154 -16.840 1.00 0.00 H ATOM 1101 HE21 GLN A 932 12.601 11.470 -15.610 1.00 0.00 H ATOM 1102 H GLN A 932 8.898 11.676 -20.158 1.00 0.00 H ATOM 1103 N ILE A 933 5.823 11.123 -19.149 1.00 23.61 N ATOM 1104 CA ILE A 933 4.353 11.126 -19.099 1.00 22.82 C ATOM 1105 C ILE A 933 3.808 10.159 -20.187 1.00 27.57 C ATOM 1106 O ILE A 933 2.921 9.359 -19.915 1.00 26.54 O ATOM 1107 CB ILE A 933 3.770 12.559 -19.264 1.00 24.27 C ATOM 1108 CG1 ILE A 933 4.242 13.483 -18.100 1.00 22.69 C ATOM 1109 CG2 ILE A 933 2.195 12.501 -19.351 1.00 21.73 C ATOM 1110 CD1 ILE A 933 4.371 14.954 -18.503 1.00 23.03 C ATOM 1111 H ILE A 933 6.333 11.997 -19.389 1.00 0.00 H ATOM 1112 N CYS A 934 4.346 10.238 -21.403 1.00 27.34 N ATOM 1113 CA CYS A 934 3.937 9.349 -22.496 1.00 29.01 C ATOM 1114 C CYS A 934 4.120 7.855 -22.114 1.00 32.29 C ATOM 1115 O CYS A 934 3.225 7.037 -22.375 1.00 31.83 O ATOM 1116 CB CYS A 934 4.691 9.698 -23.774 1.00 30.65 C ATOM 1117 SG CYS A 934 4.144 8.748 -25.198 1.00 35.67 S ATOM 1118 H CYS A 934 5.080 10.953 -21.583 1.00 0.00 H ATOM 1119 N LYS A 935 5.250 7.519 -21.469 1.00 28.44 N ATOM 1120 CA LYS A 935 5.523 6.141 -20.994 1.00 28.53 C ATOM 1121 C LYS A 935 4.510 5.706 -19.951 1.00 29.27 C ATOM 1122 O LYS A 935 3.990 4.599 -20.035 1.00 28.12 O ATOM 1123 CB LYS A 935 6.962 5.999 -20.453 1.00 31.58 C ATOM 1124 CG LYS A 935 7.973 5.784 -21.572 1.00 47.27 C ATOM 1125 CD LYS A 935 9.414 5.828 -21.071 1.00 57.62 C ATOM 1126 CE LYS A 935 10.401 5.918 -22.211 1.00 69.07 C ATOM 1127 H LYS A 935 5.963 8.256 -21.296 1.00 0.00 H ATOM 1128 N GLY A 936 4.192 6.583 -19.004 1.00 24.70 N ATOM 1129 CA GLY A 936 3.166 6.274 -18.015 1.00 24.55 C ATOM 1130 C GLY A 936 1.805 6.073 -18.658 1.00 26.95 C ATOM 1131 O GLY A 936 1.057 5.185 -18.258 1.00 25.39 O ATOM 1132 H GLY A 936 4.681 7.500 -18.968 1.00 0.00 H ATOM 1133 N MET A 937 1.489 6.886 -19.685 1.00 24.89 N ATOM 1134 CA MET A 937 0.219 6.810 -20.427 1.00 23.98 C ATOM 1135 C MET A 937 0.135 5.546 -21.306 1.00 26.86 C ATOM 1136 O MET A 937 -0.936 4.942 -21.446 1.00 25.25 O ATOM 1137 CB MET A 937 0.012 8.076 -21.272 1.00 25.04 C ATOM 1138 CG MET A 937 -0.431 9.326 -20.433 1.00 27.12 C ATOM 1139 SD MET A 937 -1.709 9.047 -19.178 1.00 28.61 S ATOM 1140 CE MET A 937 -3.178 8.850 -20.167 1.00 26.64 C ATOM 1141 H MET A 937 2.181 7.608 -19.970 1.00 0.00 H ATOM 1142 N GLU A 938 1.264 5.154 -21.889 1.00 25.77 N ATOM 1143 CA GLU A 938 1.348 3.919 -22.673 1.00 27.00 C ATOM 1144 C GLU A 938 1.064 2.738 -21.731 1.00 30.18 C ATOM 1145 O GLU A 938 0.310 1.840 -22.092 1.00 29.54 O ATOM 1146 CB GLU A 938 2.727 3.789 -23.349 1.00 28.84 C ATOM 1147 CG GLU A 938 2.780 2.609 -24.311 1.00 46.33 C ATOM 1148 CD GLU A 938 4.119 2.275 -24.941 1.00 76.81 C ATOM 1149 OE1 GLU A 938 5.037 3.127 -24.909 1.00 64.72 O ATOM 1150 OE2 GLU A 938 4.238 1.160 -25.498 1.00 75.46 O ATOM 1151 H GLU A 938 2.115 5.743 -21.785 1.00 0.00 H ATOM 1152 N TYR A 939 1.620 2.770 -20.503 1.00 27.70 N ATOM 1153 CA TYR A 939 1.356 1.730 -19.511 1.00 26.10 C ATOM 1154 C TYR A 939 -0.118 1.736 -19.055 1.00 27.65 C ATOM 1155 O TYR A 939 -0.718 0.669 -18.987 1.00 25.78 O ATOM 1156 CB TYR A 939 2.316 1.843 -18.337 1.00 26.20 C ATOM 1157 CG TYR A 939 1.928 0.967 -17.168 1.00 27.39 C ATOM 1158 CD1 TYR A 939 2.036 -0.423 -17.244 1.00 29.34 C ATOM 1159 CD2 TYR A 939 1.469 1.524 -15.980 1.00 26.77 C ATOM 1160 CE1 TYR A 939 1.746 -1.231 -16.149 1.00 30.46 C ATOM 1161 CE2 TYR A 939 1.148 0.726 -14.885 1.00 29.00 C ATOM 1162 CZ TYR A 939 1.300 -0.653 -14.970 1.00 36.82 C ATOM 1163 OH TYR A 939 0.966 -1.443 -13.905 1.00 34.73 O ATOM 1164 HH TYR A 939 1.135 -2.391 -14.133 1.00 0.00 H ATOM 1165 H TYR A 939 2.254 3.556 -20.255 1.00 0.00 H ATOM 1166 N LEU A 940 -0.719 2.928 -18.795 1.00 24.84 N ATOM 1167 CA LEU A 940 -2.150 2.994 -18.425 1.00 26.19 C ATOM 1168 C LEU A 940 -3.054 2.386 -19.509 1.00 29.89 C ATOM 1169 O LEU A 940 -4.021 1.703 -19.196 1.00 28.82 O ATOM 1170 CB LEU A 940 -2.611 4.449 -18.197 1.00 26.24 C ATOM 1171 CG LEU A 940 -2.209 5.141 -16.922 1.00 31.21 C ATOM 1172 CD1 LEU A 940 -3.027 6.459 -16.770 1.00 31.54 C ATOM 1173 CD2 LEU A 940 -2.411 4.225 -15.699 1.00 30.61 C ATOM 1174 H LEU A 940 -0.165 3.806 -18.857 1.00 0.00 H ATOM 1175 N GLY A 941 -2.747 2.689 -20.769 1.00 28.20 N ATOM 1176 CA GLY A 941 -3.487 2.153 -21.902 1.00 28.27 C ATOM 1177 C GLY A 941 -3.410 0.640 -21.972 1.00 29.30 C ATOM 1178 O GLY A 941 -4.415 -0.009 -22.270 1.00 27.26 O ATOM 1179 H GLY A 941 -1.950 3.332 -20.950 1.00 0.00 H ATOM 1180 N SER A 942 -2.217 0.070 -21.642 1.00 25.65 N ATOM 1181 CA SER A 942 -1.977 -1.383 -21.607 1.00 24.66 C ATOM 1182 C SER A 942 -2.830 -2.039 -20.505 1.00 30.91 C ATOM 1183 O SER A 942 -3.212 -3.214 -20.608 1.00 32.24 O ATOM 1184 CB SER A 942 -0.489 -1.681 -21.435 1.00 23.12 C ATOM 1185 OG SER A 942 -0.096 -1.709 -20.072 1.00 29.47 O ATOM 1186 HG SER A 942 -0.282 -0.829 -19.658 1.00 0.00 H ATOM 1187 H SER A 942 -1.426 0.700 -21.400 1.00 0.00 H ATOM 1188 N ARG A 943 -3.203 -1.247 -19.485 1.00 26.74 N ATOM 1189 CA ARG A 943 -4.043 -1.704 -18.375 1.00 25.55 C ATOM 1190 C ARG A 943 -5.532 -1.470 -18.659 1.00 30.36 C ATOM 1191 O ARG A 943 -6.349 -1.726 -17.772 1.00 30.46 O ATOM 1192 CB ARG A 943 -3.650 -0.960 -17.065 1.00 26.34 C ATOM 1193 CG ARG A 943 -2.235 -1.226 -16.592 1.00 29.51 C ATOM 1194 CD ARG A 943 -2.244 -2.557 -15.894 1.00 43.51 C ATOM 1195 NE ARG A 943 -1.623 -3.554 -16.715 1.00 43.15 N ATOM 1196 CZ ARG A 943 -1.842 -4.863 -16.663 1.00 53.44 C ATOM 1197 NH1 ARG A 943 -2.756 -5.366 -15.835 1.00 35.70 N ATOM 1198 NH2 ARG A 943 -1.179 -5.675 -17.460 1.00 41.22 N ATOM 1199 HE ARG A 943 -0.934 -3.220 -17.419 1.00 0.00 H ATOM 1200 HH12 ARG A 943 -2.919 -6.393 -15.802 1.00 0.00 H ATOM 1201 HH11 ARG A 943 -3.306 -4.732 -15.221 1.00 0.00 H ATOM 1202 HH22 ARG A 943 -1.351 -6.700 -17.418 1.00 0.00 H ATOM 1203 HH21 ARG A 943 -0.483 -5.292 -18.131 1.00 0.00 H ATOM 1204 H ARG A 943 -2.879 -0.259 -19.484 1.00 0.00 H ATOM 1205 N ARG A 944 -5.879 -0.965 -19.881 1.00 27.11 N ATOM 1206 CA ARG A 944 -7.248 -0.623 -20.325 1.00 27.11 C ATOM 1207 C ARG A 944 -7.794 0.522 -19.455 1.00 29.34 C ATOM 1208 O ARG A 944 -9.010 0.649 -19.265 1.00 28.71 O ATOM 1209 CB ARG A 944 -8.203 -1.848 -20.253 1.00 26.45 C ATOM 1210 CG ARG A 944 -7.867 -3.021 -21.182 1.00 34.31 C ATOM 1211 CD ARG A 944 -9.162 -3.619 -21.779 1.00 35.03 C ATOM 1212 NE ARG A 944 -9.045 -3.631 -23.237 1.00 49.49 N ATOM 1213 CZ ARG A 944 -9.910 -3.095 -24.084 1.00 56.50 C ATOM 1214 NH1 ARG A 944 -9.686 -3.148 -25.384 1.00 66.20 N ATOM 1215 NH2 ARG A 944 -11.034 -2.558 -23.645 1.00 42.26 N ATOM 1216 HE ARG A 944 -8.211 -4.101 -23.643 1.00 0.00 H ATOM 1217 HH12 ARG A 944 -10.367 -2.726 -26.047 1.00 0.00 H ATOM 1218 HH11 ARG A 944 -8.828 -3.612 -25.745 1.00 0.00 H ATOM 1219 HH22 ARG A 944 -11.708 -2.139 -24.318 1.00 0.00 H ATOM 1220 HH21 ARG A 944 -11.245 -2.554 -22.627 1.00 0.00 H ATOM 1221 H ARG A 944 -5.109 -0.807 -20.562 1.00 0.00 H ATOM 1222 N CYS A 945 -6.895 1.352 -18.926 1.00 26.04 N ATOM 1223 CA CYS A 945 -7.287 2.450 -18.040 1.00 26.16 C ATOM 1224 C CYS A 945 -7.310 3.765 -18.795 1.00 29.81 C ATOM 1225 O CYS A 945 -6.335 4.125 -19.445 1.00 28.13 O ATOM 1226 CB CYS A 945 -6.374 2.515 -16.816 1.00 26.91 C ATOM 1227 SG CYS A 945 -6.737 3.895 -15.681 1.00 31.15 S ATOM 1228 H CYS A 945 -5.888 1.216 -19.149 1.00 0.00 H ATOM 1229 N VAL A 946 -8.431 4.485 -18.702 1.00 28.62 N ATOM 1230 CA VAL A 946 -8.592 5.823 -19.286 1.00 27.88 C ATOM 1231 C VAL A 946 -8.458 6.783 -18.086 1.00 30.05 C ATOM 1232 O VAL A 946 -9.186 6.620 -17.113 1.00 29.41 O ATOM 1233 CB VAL A 946 -9.942 5.954 -20.038 1.00 32.33 C ATOM 1234 CG1 VAL A 946 -10.271 7.412 -20.351 1.00 32.45 C ATOM 1235 CG2 VAL A 946 -9.894 5.160 -21.339 1.00 32.60 C ATOM 1236 H VAL A 946 -9.236 4.075 -18.187 1.00 0.00 H ATOM 1237 N HIS A 947 -7.473 7.692 -18.116 1.00 26.35 N ATOM 1238 CA HIS A 947 -7.233 8.633 -17.004 1.00 26.86 C ATOM 1239 C HIS A 947 -8.346 9.673 -16.881 1.00 28.86 C ATOM 1240 O HIS A 947 -8.801 9.933 -15.768 1.00 27.90 O ATOM 1241 CB HIS A 947 -5.868 9.338 -17.150 1.00 27.27 C ATOM 1242 CG HIS A 947 -5.479 10.135 -15.930 1.00 30.14 C ATOM 1243 ND1 HIS A 947 -6.011 11.383 -15.690 1.00 31.34 N ATOM 1244 CD2 HIS A 947 -4.604 9.840 -14.943 1.00 30.88 C ATOM 1245 CE1 HIS A 947 -5.468 11.798 -14.558 1.00 30.53 C ATOM 1246 NE2 HIS A 947 -4.604 10.909 -14.079 1.00 30.47 N ATOM 1247 H HIS A 947 -6.856 7.736 -18.952 1.00 0.00 H ATOM 1248 N ARG A 948 -8.776 10.255 -18.024 1.00 27.28 N ATOM 1249 CA ARG A 948 -9.880 11.230 -18.138 1.00 29.27 C ATOM 1250 C ARG A 948 -9.547 12.645 -17.590 1.00 34.66 C ATOM 1251 O ARG A 948 -10.316 13.585 -17.831 1.00 37.55 O ATOM 1252 CB ARG A 948 -11.174 10.653 -17.499 1.00 31.25 C ATOM 1253 CG ARG A 948 -12.454 11.459 -17.725 1.00 49.34 C ATOM 1254 CD ARG A 948 -13.662 10.566 -17.927 1.00 61.24 C ATOM 1255 NE ARG A 948 -14.128 9.931 -16.694 1.00 68.55 N ATOM 1256 CZ ARG A 948 -15.008 10.471 -15.856 1.00 80.78 C ATOM 1257 NH1 ARG A 948 -15.489 11.688 -16.080 1.00 64.84 N ATOM 1258 NH2 ARG A 948 -15.396 9.808 -14.774 1.00 68.77 N ATOM 1259 HE ARG A 948 -13.745 8.994 -16.457 1.00 0.00 H ATOM 1260 HH12 ARG A 948 -16.177 12.105 -15.421 1.00 0.00 H ATOM 1261 HH11 ARG A 948 -15.178 12.225 -16.915 1.00 0.00 H ATOM 1262 HH22 ARG A 948 -16.084 10.235 -14.122 1.00 0.00 H ATOM 1263 HH21 ARG A 948 -15.012 8.862 -14.578 1.00 0.00 H ATOM 1264 H ARG A 948 -8.285 9.992 -18.902 1.00 0.00 H ATOM 1265 N ASP A 949 -8.405 12.817 -16.911 1.00 28.24 N ATOM 1266 CA ASP A 949 -8.076 14.141 -16.354 1.00 28.03 C ATOM 1267 C ASP A 949 -6.594 14.489 -16.468 1.00 29.75 C ATOM 1268 O ASP A 949 -5.998 15.048 -15.545 1.00 29.63 O ATOM 1269 CB ASP A 949 -8.575 14.234 -14.897 1.00 29.05 C ATOM 1270 CG ASP A 949 -8.862 15.647 -14.397 1.00 38.88 C ATOM 1271 OD1 ASP A 949 -9.120 16.544 -15.238 1.00 42.83 O ATOM 1272 OD2 ASP A 949 -8.854 15.849 -13.176 1.00 39.89 O ATOM 1273 H ASP A 949 -7.752 12.018 -16.777 1.00 0.00 H ATOM 1274 N LEU A 950 -5.994 14.140 -17.597 1.00 26.75 N ATOM 1275 CA LEU A 950 -4.578 14.387 -17.801 1.00 26.76 C ATOM 1276 C LEU A 950 -4.342 15.870 -18.048 1.00 30.60 C ATOM 1277 O LEU A 950 -4.915 16.453 -18.973 1.00 31.35 O ATOM 1278 CB LEU A 950 -4.030 13.516 -18.930 1.00 27.29 C ATOM 1279 CG LEU A 950 -2.521 13.472 -19.099 1.00 33.25 C ATOM 1280 CD1 LEU A 950 -1.843 12.829 -17.870 1.00 34.17 C ATOM 1281 CD2 LEU A 950 -2.157 12.754 -20.411 1.00 37.67 C ATOM 1282 H LEU A 950 -6.547 13.682 -18.349 1.00 0.00 H ATOM 1283 N ALA A 951 -3.576 16.492 -17.146 1.00 26.14 N ATOM 1284 CA ALA A 951 -3.261 17.931 -17.147 1.00 25.74 C ATOM 1285 C ALA A 951 -2.042 18.094 -16.240 1.00 30.50 C ATOM 1286 O ALA A 951 -1.826 17.253 -15.367 1.00 29.16 O ATOM 1287 CB ALA A 951 -4.448 18.725 -16.586 1.00 26.72 C ATOM 1288 H ALA A 951 -3.170 15.914 -16.383 1.00 0.00 H ATOM 1289 N ALA A 952 -1.240 19.151 -16.442 1.00 28.91 N ATOM 1290 CA ALA A 952 -0.026 19.393 -15.648 1.00 27.54 C ATOM 1291 C ALA A 952 -0.300 19.529 -14.155 1.00 28.91 C ATOM 1292 O ALA A 952 0.580 19.210 -13.358 1.00 27.99 O ATOM 1293 CB ALA A 952 0.728 20.608 -16.183 1.00 28.36 C ATOM 1294 H ALA A 952 -1.488 19.828 -17.192 1.00 0.00 H ATOM 1295 N ARG A 953 -1.541 19.923 -13.765 1.00 25.86 N ATOM 1296 CA ARG A 953 -1.961 20.045 -12.363 1.00 26.35 C ATOM 1297 C ARG A 953 -2.034 18.657 -11.702 1.00 29.47 C ATOM 1298 O ARG A 953 -1.951 18.564 -10.471 1.00 28.01 O ATOM 1299 CB ARG A 953 -3.328 20.766 -12.258 1.00 29.81 C ATOM 1300 CG ARG A 953 -4.539 19.905 -12.646 1.00 34.67 C ATOM 1301 CD ARG A 953 -5.870 20.623 -12.483 1.00 38.95 C ATOM 1302 NE ARG A 953 -6.155 21.360 -13.701 1.00 45.74 N ATOM 1303 CZ ARG A 953 -6.874 20.891 -14.713 1.00 55.59 C ATOM 1304 NH1 ARG A 953 -7.500 19.723 -14.608 1.00 35.48 N ATOM 1305 NH2 ARG A 953 -7.021 21.611 -15.817 1.00 36.27 N ATOM 1306 HE ARG A 953 -5.769 22.322 -13.786 1.00 0.00 H ATOM 1307 HH12 ARG A 953 -8.062 19.361 -15.405 1.00 0.00 H ATOM 1308 HH11 ARG A 953 -7.428 19.171 -13.729 1.00 0.00 H ATOM 1309 HH22 ARG A 953 -7.585 21.240 -16.608 1.00 0.00 H ATOM 1310 HH21 ARG A 953 -6.572 22.546 -15.892 1.00 0.00 H ATOM 1311 H ARG A 953 -2.235 20.152 -14.504 1.00 0.00 H ATOM 1312 N ASN A 954 -2.181 17.583 -12.528 1.00 26.94 N ATOM 1313 CA ASN A 954 -2.284 16.187 -12.063 1.00 27.17 C ATOM 1314 C ASN A 954 -1.030 15.383 -12.288 1.00 30.19 C ATOM 1315 O ASN A 954 -1.058 14.154 -12.198 1.00 30.04 O ATOM 1316 CB ASN A 954 -3.522 15.480 -12.666 1.00 29.94 C ATOM 1317 CG ASN A 954 -4.803 16.069 -12.197 1.00 39.99 C ATOM 1318 OD1 ASN A 954 -4.875 16.611 -11.081 1.00 28.43 O ATOM 1319 ND2 ASN A 954 -5.828 16.027 -13.064 1.00 29.34 N ATOM 1320 HD22 ASN A 954 -5.711 15.559 -13.985 1.00 0.00 H ATOM 1321 HD21 ASN A 954 -6.739 16.462 -12.814 1.00 0.00 H ATOM 1322 H ASN A 954 -2.223 17.759 -13.552 1.00 0.00 H ATOM 1323 N ILE A 955 0.069 16.063 -12.616 1.00 26.61 N ATOM 1324 CA ILE A 955 1.367 15.399 -12.775 1.00 25.29 C ATOM 1325 C ILE A 955 2.223 15.859 -11.606 1.00 26.20 C ATOM 1326 O ILE A 955 2.236 17.050 -11.306 1.00 23.96 O ATOM 1327 CB ILE A 955 2.001 15.625 -14.182 1.00 28.60 C ATOM 1328 CG1 ILE A 955 1.124 14.898 -15.263 1.00 29.42 C ATOM 1329 CG2 ILE A 955 3.481 15.091 -14.233 1.00 26.83 C ATOM 1330 CD1 ILE A 955 1.111 15.573 -16.589 1.00 37.56 C ATOM 1331 H ILE A 955 0.004 17.091 -12.763 1.00 0.00 H ATOM 1332 N LEU A 956 2.890 14.916 -10.917 1.00 22.52 N ATOM 1333 CA LEU A 956 3.767 15.208 -9.781 1.00 22.42 C ATOM 1334 C LEU A 956 5.257 15.114 -10.116 1.00 27.70 C ATOM 1335 O LEU A 956 5.647 14.386 -11.019 1.00 25.40 O ATOM 1336 CB LEU A 956 3.435 14.280 -8.630 1.00 22.04 C ATOM 1337 CG LEU A 956 2.057 14.405 -8.019 1.00 26.78 C ATOM 1338 CD1 LEU A 956 1.861 13.283 -7.059 1.00 26.88 C ATOM 1339 CD2 LEU A 956 1.875 15.778 -7.305 1.00 29.07 C ATOM 1340 H LEU A 956 2.777 13.924 -11.207 1.00 0.00 H ATOM 1341 N VAL A 957 6.077 15.877 -9.386 1.00 25.85 N ATOM 1342 CA VAL A 957 7.522 15.942 -9.605 1.00 25.40 C ATOM 1343 C VAL A 957 8.229 15.121 -8.510 1.00 28.73 C ATOM 1344 O VAL A 957 8.196 15.492 -7.337 1.00 28.86 O ATOM 1345 CB VAL A 957 8.013 17.411 -9.670 1.00 28.13 C ATOM 1346 CG1 VAL A 957 9.527 17.495 -9.796 1.00 28.11 C ATOM 1347 CG2 VAL A 957 7.330 18.181 -10.806 1.00 27.42 C ATOM 1348 H VAL A 957 5.667 16.454 -8.624 1.00 0.00 H ATOM 1349 N GLU A 958 8.846 14.009 -8.904 1.00 25.78 N ATOM 1350 CA GLU A 958 9.621 13.131 -8.013 1.00 25.30 C ATOM 1351 C GLU A 958 10.982 13.810 -7.782 1.00 32.30 C ATOM 1352 O GLU A 958 11.442 13.898 -6.642 1.00 32.36 O ATOM 1353 CB GLU A 958 9.777 11.728 -8.641 1.00 26.21 C ATOM 1354 CG GLU A 958 10.765 10.799 -7.931 1.00 34.07 C ATOM 1355 CD GLU A 958 10.390 10.384 -6.518 1.00 55.22 C ATOM 1356 OE1 GLU A 958 9.237 9.947 -6.302 1.00 49.63 O ATOM 1357 OE2 GLU A 958 11.257 10.493 -5.623 1.00 66.93 O ATOM 1358 H GLU A 958 8.776 13.744 -9.907 1.00 0.00 H ATOM 1359 N SER A 959 11.598 14.316 -8.863 1.00 29.31 N ATOM 1360 CA SER A 959 12.883 15.031 -8.844 1.00 30.22 C ATOM 1361 C SER A 959 12.961 15.912 -10.089 1.00 33.58 C ATOM 1362 O SER A 959 12.085 15.800 -10.951 1.00 33.54 O ATOM 1363 CB SER A 959 14.046 14.031 -8.858 1.00 33.03 C ATOM 1364 OG SER A 959 14.315 13.591 -10.180 1.00 38.73 O ATOM 1365 HG SER A 959 15.067 12.948 -10.166 1.00 0.00 H ATOM 1366 H SER A 959 11.131 14.193 -9.784 1.00 0.00 H ATOM 1367 N GLU A 960 14.026 16.754 -10.207 1.00 30.40 N ATOM 1368 CA GLU A 960 14.303 17.611 -11.361 1.00 30.06 C ATOM 1369 C GLU A 960 14.251 16.857 -12.721 1.00 33.48 C ATOM 1370 O GLU A 960 13.997 17.463 -13.751 1.00 33.41 O ATOM 1371 CB GLU A 960 15.677 18.313 -11.177 1.00 31.58 C ATOM 1372 CG GLU A 960 16.916 17.446 -11.423 1.00 40.33 C ATOM 1373 CD GLU A 960 17.243 16.324 -10.451 1.00 56.30 C ATOM 1374 OE1 GLU A 960 17.728 15.260 -10.902 1.00 44.06 O ATOM 1375 OE2 GLU A 960 17.080 16.531 -9.229 1.00 49.51 O ATOM 1376 H GLU A 960 14.696 16.791 -9.413 1.00 0.00 H ATOM 1377 N ALA A 961 14.508 15.522 -12.712 1.00 30.60 N ATOM 1378 CA ALA A 961 14.543 14.681 -13.924 1.00 30.48 C ATOM 1379 C ALA A 961 13.518 13.513 -13.881 1.00 31.22 C ATOM 1380 O ALA A 961 13.690 12.506 -14.566 1.00 29.28 O ATOM 1381 CB ALA A 961 15.961 14.141 -14.132 1.00 31.84 C ATOM 1382 H ALA A 961 14.691 15.066 -11.795 1.00 0.00 H ATOM 1383 N HIS A 962 12.433 13.649 -13.092 1.00 28.29 N ATOM 1384 CA HIS A 962 11.468 12.536 -12.961 1.00 27.23 C ATOM 1385 C HIS A 962 10.098 13.041 -12.554 1.00 30.82 C ATOM 1386 O HIS A 962 9.935 13.629 -11.481 1.00 28.35 O ATOM 1387 CB HIS A 962 11.992 11.495 -11.930 1.00 27.21 C ATOM 1388 CG HIS A 962 11.261 10.173 -11.863 1.00 30.73 C ATOM 1389 ND1 HIS A 962 11.717 9.151 -11.045 1.00 32.99 N ATOM 1390 CD2 HIS A 962 10.104 9.768 -12.442 1.00 32.35 C ATOM 1391 CE1 HIS A 962 10.856 8.152 -11.188 1.00 32.04 C ATOM 1392 NE2 HIS A 962 9.872 8.476 -12.021 1.00 31.79 N ATOM 1393 H HIS A 962 12.275 14.537 -12.575 1.00 0.00 H ATOM 1394 N VAL A 963 9.104 12.747 -13.401 1.00 28.07 N ATOM 1395 CA VAL A 963 7.701 13.109 -13.193 1.00 25.90 C ATOM 1396 C VAL A 963 6.836 11.865 -13.116 1.00 27.20 C ATOM 1397 O VAL A 963 7.219 10.810 -13.627 1.00 25.81 O ATOM 1398 CB VAL A 963 7.151 14.194 -14.178 1.00 29.02 C ATOM 1399 CG1 VAL A 963 7.863 15.532 -13.993 1.00 28.64 C ATOM 1400 CG2 VAL A 963 7.168 13.736 -15.646 1.00 28.09 C ATOM 1401 H VAL A 963 9.345 12.225 -14.267 1.00 0.00 H ATOM 1402 N LYS A 964 5.692 11.976 -12.441 1.00 23.99 N ATOM 1403 CA LYS A 964 4.750 10.865 -12.266 1.00 24.07 C ATOM 1404 C LYS A 964 3.315 11.354 -12.438 1.00 28.99 C ATOM 1405 O LYS A 964 2.958 12.427 -11.963 1.00 29.34 O ATOM 1406 CB LYS A 964 4.893 10.203 -10.869 1.00 24.68 C ATOM 1407 CG LYS A 964 6.267 9.576 -10.586 1.00 28.12 C ATOM 1408 CD LYS A 964 6.270 8.775 -9.294 1.00 29.85 C ATOM 1409 CE LYS A 964 7.678 8.343 -8.917 1.00 33.61 C ATOM 1410 NZ LYS A 964 7.662 7.269 -7.886 1.00 32.45 N ATOM 1411 HZ1 LYS A 964 7.184 7.618 -7.031 1.00 0.00 H ATOM 1412 HZ2 LYS A 964 7.152 6.442 -8.256 1.00 0.00 H ATOM 1413 HZ3 LYS A 964 8.639 6.999 -7.653 1.00 0.00 H ATOM 1414 H LYS A 964 5.455 12.896 -12.017 1.00 0.00 H ATOM 1415 N ILE A 965 2.488 10.534 -13.066 1.00 25.40 N ATOM 1416 CA ILE A 965 1.067 10.831 -13.238 1.00 25.45 C ATOM 1417 C ILE A 965 0.340 10.489 -11.926 1.00 26.94 C ATOM 1418 O ILE A 965 0.605 9.445 -11.315 1.00 24.54 O ATOM 1419 CB ILE A 965 0.511 10.003 -14.439 1.00 27.90 C ATOM 1420 CG1 ILE A 965 1.265 10.341 -15.749 1.00 27.56 C ATOM 1421 CG2 ILE A 965 -1.035 10.125 -14.575 1.00 26.10 C ATOM 1422 CD1 ILE A 965 1.250 9.183 -16.826 1.00 29.21 C ATOM 1423 H ILE A 965 2.863 9.644 -13.452 1.00 0.00 H ATOM 1424 N ALA A 966 -0.561 11.380 -11.490 1.00 23.02 N ATOM 1425 CA ALA A 966 -1.361 11.158 -10.282 1.00 22.36 C ATOM 1426 C ALA A 966 -2.841 11.447 -10.560 1.00 28.47 C ATOM 1427 O ALA A 966 -3.213 11.782 -11.700 1.00 25.88 O ATOM 1428 CB ALA A 966 -0.859 12.051 -9.155 1.00 22.63 C ATOM 1429 H ALA A 966 -0.697 12.260 -12.028 1.00 0.00 H ATOM 1430 N ASP A 967 -3.670 11.334 -9.497 1.00 27.23 N ATOM 1431 CA ASP A 967 -5.121 11.574 -9.467 1.00 27.69 C ATOM 1432 C ASP A 967 -5.924 10.700 -10.427 1.00 29.41 C ATOM 1433 O ASP A 967 -6.251 11.102 -11.546 1.00 29.38 O ATOM 1434 CB ASP A 967 -5.479 13.062 -9.610 1.00 29.84 C ATOM 1435 CG ASP A 967 -6.831 13.394 -8.981 1.00 42.49 C ATOM 1436 OD1 ASP A 967 -7.695 12.487 -8.899 1.00 40.73 O ATOM 1437 OD2 ASP A 967 -7.020 14.547 -8.560 1.00 52.00 O ATOM 1438 H ASP A 967 -3.232 11.045 -8.599 1.00 0.00 H ATOM 1439 N PHE A 968 -6.304 9.536 -9.942 1.00 26.06 N ATOM 1440 CA PHE A 968 -7.111 8.559 -10.674 1.00 25.95 C ATOM 1441 C PHE A 968 -8.583 8.640 -10.272 1.00 29.95 C ATOM 1442 O PHE A 968 -9.357 7.717 -10.546 1.00 29.52 O ATOM 1443 CB PHE A 968 -6.509 7.149 -10.515 1.00 27.52 C ATOM 1444 CG PHE A 968 -5.205 7.052 -11.273 1.00 27.89 C ATOM 1445 CD1 PHE A 968 -5.163 6.476 -12.537 1.00 28.69 C ATOM 1446 CD2 PHE A 968 -4.037 7.621 -10.762 1.00 29.41 C ATOM 1447 CE1 PHE A 968 -3.976 6.441 -13.264 1.00 29.47 C ATOM 1448 CE2 PHE A 968 -2.850 7.608 -11.505 1.00 31.14 C ATOM 1449 CZ PHE A 968 -2.827 7.010 -12.746 1.00 28.12 C ATOM 1450 H PHE A 968 -6.011 9.295 -8.974 1.00 0.00 H ATOM 1451 N GLY A 969 -8.969 9.792 -9.710 1.00 28.71 N ATOM 1452 CA GLY A 969 -10.344 10.074 -9.284 1.00 29.31 C ATOM 1453 C GLY A 969 -11.408 9.959 -10.368 1.00 33.71 C ATOM 1454 O GLY A 969 -12.535 9.565 -10.076 1.00 34.55 O ATOM 1455 H GLY A 969 -8.251 10.531 -9.567 1.00 0.00 H ATOM 1456 N LEU A 970 -11.062 10.275 -11.627 1.00 30.54 N ATOM 1457 CA LEU A 970 -11.978 10.213 -12.783 1.00 30.38 C ATOM 1458 C LEU A 970 -11.678 9.054 -13.740 1.00 33.70 C ATOM 1459 O LEU A 970 -12.381 8.868 -14.738 1.00 33.15 O ATOM 1460 CB LEU A 970 -11.970 11.548 -13.553 1.00 30.01 C ATOM 1461 CG LEU A 970 -12.384 12.809 -12.729 1.00 34.79 C ATOM 1462 CD1 LEU A 970 -12.103 14.083 -13.501 1.00 35.49 C ATOM 1463 CD2 LEU A 970 -13.839 12.759 -12.338 1.00 35.43 C ATOM 1464 H LEU A 970 -10.084 10.584 -11.799 1.00 0.00 H ATOM 1465 N ALA A 971 -10.626 8.291 -13.441 1.00 30.33 N ATOM 1466 CA ALA A 971 -10.168 7.170 -14.255 1.00 29.90 C ATOM 1467 C ALA A 971 -11.225 6.062 -14.419 1.00 35.38 C ATOM 1468 O ALA A 971 -11.953 5.755 -13.472 1.00 34.19 O ATOM 1469 CB ALA A 971 -8.882 6.595 -13.678 1.00 29.68 C ATOM 1470 H ALA A 971 -10.098 8.509 -12.572 1.00 0.00 H ATOM 1471 N LYS A 972 -11.273 5.457 -15.619 1.00 33.86 N ATOM 1472 CA LYS A 972 -12.197 4.366 -15.948 1.00 34.23 C ATOM 1473 C LYS A 972 -11.457 3.175 -16.558 1.00 36.32 C ATOM 1474 O LYS A 972 -10.533 3.369 -17.333 1.00 35.71 O ATOM 1475 CB LYS A 972 -13.270 4.842 -16.949 1.00 36.51 C ATOM 1476 CG LYS A 972 -14.266 5.856 -16.382 1.00 51.69 C ATOM 1477 CD LYS A 972 -15.315 5.209 -15.485 1.00 60.99 C ATOM 1478 CE LYS A 972 -16.032 6.235 -14.639 1.00 76.39 C ATOM 1479 NZ LYS A 972 -16.200 5.767 -13.233 1.00 87.48 N ATOM 1480 HZ1 LYS A 972 -16.756 4.888 -13.226 1.00 0.00 H ATOM 1481 HZ2 LYS A 972 -15.265 5.591 -12.814 1.00 0.00 H ATOM 1482 HZ3 LYS A 972 -16.696 6.497 -12.683 1.00 0.00 H ATOM 1483 H LYS A 972 -10.616 5.782 -16.357 1.00 0.00 H ATOM 1484 N LEU A 973 -11.893 1.961 -16.238 1.00 32.49 N ATOM 1485 CA LEU A 973 -11.332 0.732 -16.799 1.00 33.75 C ATOM 1486 C LEU A 973 -12.257 0.321 -17.955 1.00 38.17 C ATOM 1487 O LEU A 973 -13.470 0.215 -17.756 1.00 38.94 O ATOM 1488 CB LEU A 973 -11.293 -0.365 -15.722 1.00 34.10 C ATOM 1489 CG LEU A 973 -9.928 -0.791 -15.119 1.00 38.53 C ATOM 1490 CD1 LEU A 973 -8.881 0.337 -15.111 1.00 37.66 C ATOM 1491 CD2 LEU A 973 -10.122 -1.400 -13.742 1.00 38.49 C ATOM 1492 H LEU A 973 -12.672 1.881 -15.554 1.00 0.00 H ATOM 1493 N LEU A 974 -11.706 0.164 -19.162 1.00 32.49 N ATOM 1494 CA LEU A 974 -12.514 -0.199 -20.323 1.00 32.39 C ATOM 1495 C LEU A 974 -12.826 -1.681 -20.325 1.00 37.89 C ATOM 1496 O LEU A 974 -11.899 -2.490 -20.237 1.00 37.33 O ATOM 1497 CB LEU A 974 -11.807 0.164 -21.630 1.00 32.59 C ATOM 1498 CG LEU A 974 -11.423 1.629 -21.833 1.00 35.74 C ATOM 1499 CD1 LEU A 974 -10.399 1.752 -22.921 1.00 33.54 C ATOM 1500 CD2 LEU A 974 -12.672 2.498 -22.094 1.00 38.36 C ATOM 1501 H LEU A 974 -10.682 0.303 -19.277 1.00 0.00 H ATOM 1502 N PRO A 975 -14.116 -2.074 -20.473 1.00 36.32 N ATOM 1503 CA PRO A 975 -14.440 -3.515 -20.585 1.00 35.27 C ATOM 1504 C PRO A 975 -13.684 -4.143 -21.756 1.00 36.77 C ATOM 1505 O PRO A 975 -13.224 -3.439 -22.668 1.00 32.82 O ATOM 1506 CB PRO A 975 -15.956 -3.525 -20.809 1.00 37.51 C ATOM 1507 CG PRO A 975 -16.436 -2.206 -20.272 1.00 41.92 C ATOM 1508 CD PRO A 975 -15.326 -1.238 -20.610 1.00 37.15 C ATOM 1509 N LEU A 976 -13.500 -5.464 -21.718 1.00 35.37 N ATOM 1510 CA LEU A 976 -12.725 -6.145 -22.755 1.00 34.90 C ATOM 1511 C LEU A 976 -13.220 -5.997 -24.206 1.00 37.71 C ATOM 1512 O LEU A 976 -12.403 -6.030 -25.128 1.00 37.06 O ATOM 1513 CB LEU A 976 -12.478 -7.620 -22.382 1.00 35.71 C ATOM 1514 CG LEU A 976 -11.636 -7.874 -21.115 1.00 41.09 C ATOM 1515 CD1 LEU A 976 -11.573 -9.355 -20.785 1.00 44.58 C ATOM 1516 CD2 LEU A 976 -10.211 -7.309 -21.253 1.00 40.85 C ATOM 1517 H LEU A 976 -13.913 -6.017 -20.940 1.00 0.00 H ATOM 1518 N ASP A 977 -14.526 -5.791 -24.408 1.00 34.01 N ATOM 1519 CA ASP A 977 -15.121 -5.745 -25.747 1.00 34.75 C ATOM 1520 C ASP A 977 -15.527 -4.338 -26.230 1.00 41.58 C ATOM 1521 O ASP A 977 -16.231 -4.214 -27.236 1.00 40.30 O ATOM 1522 CB ASP A 977 -16.339 -6.684 -25.759 1.00 36.12 C ATOM 1523 CG ASP A 977 -17.499 -6.264 -24.846 1.00 44.83 C ATOM 1524 OD1 ASP A 977 -17.342 -5.265 -24.085 1.00 45.99 O ATOM 1525 OD2 ASP A 977 -18.552 -6.930 -24.885 1.00 49.31 O ATOM 1526 H ASP A 977 -15.144 -5.658 -23.582 1.00 0.00 H ATOM 1527 N LYS A 978 -15.138 -3.291 -25.473 1.00 40.47 N ATOM 1528 CA LYS A 978 -15.518 -1.904 -25.746 1.00 39.80 C ATOM 1529 C LYS A 978 -14.313 -1.009 -25.494 1.00 42.70 C ATOM 1530 O LYS A 978 -13.763 -1.031 -24.392 1.00 42.12 O ATOM 1531 CB LYS A 978 -16.695 -1.524 -24.837 1.00 42.15 C ATOM 1532 CG LYS A 978 -17.516 -0.329 -25.315 1.00 55.59 C ATOM 1533 CD LYS A 978 -18.756 -0.180 -24.443 1.00 67.45 C ATOM 1534 CE LYS A 978 -19.293 1.228 -24.423 1.00 83.89 C ATOM 1535 NZ LYS A 978 -20.244 1.486 -25.530 1.00 97.64 N ATOM 1536 HZ1 LYS A 978 -19.763 1.338 -26.440 1.00 0.00 H ATOM 1537 HZ2 LYS A 978 -21.050 0.833 -25.452 1.00 0.00 H ATOM 1538 HZ3 LYS A 978 -20.584 2.467 -25.472 1.00 0.00 H ATOM 1539 H LYS A 978 -14.533 -3.480 -24.648 1.00 0.00 H ATOM 1540 N ASP A 979 -13.868 -0.278 -26.531 1.00 39.47 N ATOM 1541 CA ASP A 979 -12.684 0.592 -26.472 1.00 39.55 C ATOM 1542 C ASP A 979 -12.949 2.062 -26.110 1.00 41.99 C ATOM 1543 O ASP A 979 -12.042 2.888 -26.191 1.00 40.36 O ATOM 1544 CB ASP A 979 -11.840 0.466 -27.753 1.00 41.68 C ATOM 1545 CG ASP A 979 -11.335 -0.936 -28.053 1.00 54.63 C ATOM 1546 OD1 ASP A 979 -11.218 -1.747 -27.101 1.00 54.60 O ATOM 1547 OD2 ASP A 979 -11.082 -1.231 -29.240 1.00 61.55 O ATOM 1548 H ASP A 979 -14.392 -0.331 -27.428 1.00 0.00 H ATOM 1549 N TYR A 980 -14.173 2.383 -25.689 1.00 39.25 N ATOM 1550 CA TYR A 980 -14.525 3.738 -25.280 1.00 39.25 C ATOM 1551 C TYR A 980 -15.530 3.646 -24.174 1.00 43.11 C ATOM 1552 O TYR A 980 -16.071 2.567 -23.910 1.00 41.96 O ATOM 1553 CB TYR A 980 -15.063 4.591 -26.458 1.00 41.58 C ATOM 1554 CG TYR A 980 -16.353 4.063 -27.047 1.00 44.82 C ATOM 1555 CD1 TYR A 980 -16.341 3.078 -28.030 1.00 47.22 C ATOM 1556 CD2 TYR A 980 -17.588 4.534 -26.607 1.00 45.99 C ATOM 1557 CE1 TYR A 980 -17.527 2.556 -28.547 1.00 49.21 C ATOM 1558 CE2 TYR A 980 -18.780 4.028 -27.123 1.00 47.35 C ATOM 1559 CZ TYR A 980 -18.744 3.042 -28.097 1.00 56.26 C ATOM 1560 OH TYR A 980 -19.912 2.547 -28.619 1.00 56.55 O ATOM 1561 HH TYR A 980 -19.703 1.856 -29.296 1.00 0.00 H ATOM 1562 H TYR A 980 -14.901 1.642 -25.651 1.00 0.00 H ATOM 1563 N TYR A 981 -15.815 4.784 -23.556 1.00 40.84 N ATOM 1564 CA TYR A 981 -16.724 4.901 -22.439 1.00 43.18 C ATOM 1565 C TYR A 981 -17.576 6.162 -22.606 1.00 48.17 C ATOM 1566 O TYR A 981 -17.057 7.217 -22.986 1.00 48.39 O ATOM 1567 CB TYR A 981 -15.899 4.930 -21.129 1.00 46.78 C ATOM 1568 CG TYR A 981 -16.675 5.331 -19.898 1.00 53.28 C ATOM 1569 CD1 TYR A 981 -17.538 4.435 -19.272 1.00 56.74 C ATOM 1570 CD2 TYR A 981 -16.521 6.592 -19.333 1.00 55.50 C ATOM 1571 CE1 TYR A 981 -18.243 4.791 -18.122 1.00 60.19 C ATOM 1572 CE2 TYR A 981 -17.216 6.957 -18.183 1.00 57.82 C ATOM 1573 CZ TYR A 981 -18.094 6.062 -17.592 1.00 70.50 C ATOM 1574 OH TYR A 981 -18.794 6.430 -16.464 1.00 76.82 O ATOM 1575 HH TYR A 981 -19.371 5.679 -16.175 1.00 0.00 H ATOM 1576 H TYR A 981 -15.353 5.651 -23.898 1.00 0.00 H ATOM 1577 N VAL A 982 -18.873 6.045 -22.313 1.00 44.26 N ATOM 1578 CA VAL A 982 -19.819 7.162 -22.392 1.00 45.04 C ATOM 1579 C VAL A 982 -20.276 7.577 -20.984 1.00 52.05 C ATOM 1580 O VAL A 982 -20.865 6.768 -20.264 1.00 51.34 O ATOM 1581 CB VAL A 982 -21.024 6.879 -23.336 1.00 47.99 C ATOM 1582 CG1 VAL A 982 -21.864 8.137 -23.530 1.00 47.81 C ATOM 1583 CG2 VAL A 982 -20.561 6.340 -24.690 1.00 47.78 C ATOM 1584 H VAL A 982 -19.230 5.115 -22.014 1.00 0.00 H ATOM 1585 N VAL A 983 -19.998 8.834 -20.596 1.00 52.56 N ATOM 1586 CA VAL A 983 -20.397 9.374 -19.286 1.00 54.53 C ATOM 1587 C VAL A 983 -21.840 9.870 -19.382 1.00 62.37 C ATOM 1588 O VAL A 983 -22.211 10.496 -20.379 1.00 61.93 O ATOM 1589 CB VAL A 983 -19.444 10.488 -18.746 1.00 59.09 C ATOM 1590 CG1 VAL A 983 -19.725 10.795 -17.276 1.00 59.06 C ATOM 1591 CG2 VAL A 983 -17.980 10.116 -18.925 1.00 58.92 C ATOM 1592 H VAL A 983 -19.478 9.452 -21.251 1.00 0.00 H ATOM 1593 N ARG A 984 -22.646 9.590 -18.341 1.00 62.70 N ATOM 1594 CA ARG A 984 -24.057 9.976 -18.242 1.00 63.86 C ATOM 1595 C ARG A 984 -24.265 11.500 -18.180 1.00 69.61 C ATOM 1596 O ARG A 984 -25.127 12.026 -18.892 1.00 69.82 O ATOM 1597 CB ARG A 984 -24.709 9.293 -17.030 1.00 65.85 C ATOM 1598 H ARG A 984 -22.237 9.059 -17.546 1.00 0.00 H ATOM 1599 N GLU A 985 -23.482 12.201 -17.335 1.00 66.51 N ATOM 1600 CA GLU A 985 -23.574 13.653 -17.159 1.00 66.48 C ATOM 1601 C GLU A 985 -22.275 14.373 -17.579 1.00 69.64 C ATOM 1602 O GLU A 985 -21.194 13.821 -17.349 1.00 69.03 O ATOM 1603 CB GLU A 985 -23.904 13.984 -15.692 1.00 68.04 C ATOM 1604 H GLU A 985 -22.774 11.683 -16.777 1.00 0.00 H ATOM 1605 N PRO A 986 -22.342 15.615 -18.148 1.00 65.32 N ATOM 1606 CA PRO A 986 -21.095 16.327 -18.515 1.00 64.17 C ATOM 1607 C PRO A 986 -20.153 16.565 -17.327 1.00 63.95 C ATOM 1608 O PRO A 986 -20.595 16.677 -16.173 1.00 63.76 O ATOM 1609 CB PRO A 986 -21.592 17.637 -19.144 1.00 66.07 C ATOM 1610 CG PRO A 986 -23.018 17.361 -19.540 1.00 70.95 C ATOM 1611 CD PRO A 986 -23.534 16.423 -18.491 1.00 66.62 C ATOM 1612 N GLY A 987 -18.859 16.578 -17.621 1.00 56.41 N ATOM 1613 CA GLY A 987 -17.809 16.729 -16.622 1.00 54.28 C ATOM 1614 C GLY A 987 -17.797 18.033 -15.851 1.00 53.14 C ATOM 1615 O GLY A 987 -18.384 19.034 -16.266 1.00 52.16 O ATOM 1616 H GLY A 987 -18.579 16.475 -18.617 1.00 0.00 H ATOM 1617 N GLN A 988 -17.102 18.014 -14.721 1.00 46.24 N ATOM 1618 CA GLN A 988 -16.930 19.154 -13.850 1.00 44.71 C ATOM 1619 C GLN A 988 -15.499 19.721 -13.909 1.00 44.25 C ATOM 1620 O GLN A 988 -15.151 20.579 -13.094 1.00 43.32 O ATOM 1621 CB GLN A 988 -17.367 18.797 -12.414 1.00 46.43 C ATOM 1622 CG GLN A 988 -18.872 19.023 -12.170 1.00 59.61 C ATOM 1623 CD GLN A 988 -19.311 20.451 -12.442 1.00 70.06 C ATOM 1624 OE1 GLN A 988 -18.693 21.422 -11.996 1.00 60.55 O ATOM 1625 NE2 GLN A 988 -20.366 20.607 -13.227 1.00 67.54 N ATOM 1626 HE22 GLN A 988 -20.871 19.774 -13.591 1.00 0.00 H ATOM 1627 HE21 GLN A 988 -20.689 21.563 -13.480 1.00 0.00 H ATOM 1628 H GLN A 988 -16.651 17.119 -14.444 1.00 0.00 H ATOM 1629 N SER A 989 -14.684 19.263 -14.879 1.00 38.17 N ATOM 1630 CA SER A 989 -13.298 19.745 -15.039 1.00 38.23 C ATOM 1631 C SER A 989 -13.214 20.941 -16.006 1.00 40.26 C ATOM 1632 O SER A 989 -14.004 20.998 -16.951 1.00 37.01 O ATOM 1633 CB SER A 989 -12.388 18.631 -15.566 1.00 40.56 C ATOM 1634 OG SER A 989 -12.607 17.407 -14.887 1.00 52.13 O ATOM 1635 HG SER A 989 -12.423 17.529 -13.922 1.00 0.00 H ATOM 1636 H SER A 989 -15.044 18.544 -15.539 1.00 0.00 H ATOM 1637 N PRO A 990 -12.203 21.844 -15.871 1.00 39.02 N ATOM 1638 CA PRO A 990 -12.038 22.912 -16.885 1.00 38.10 C ATOM 1639 C PRO A 990 -12.072 22.308 -18.294 1.00 38.47 C ATOM 1640 O PRO A 990 -11.402 21.317 -18.560 1.00 38.16 O ATOM 1641 CB PRO A 990 -10.676 23.521 -16.527 1.00 40.01 C ATOM 1642 CG PRO A 990 -10.601 23.321 -15.017 1.00 44.72 C ATOM 1643 CD PRO A 990 -11.157 21.937 -14.828 1.00 40.36 C ATOM 1644 N ILE A 991 -12.978 22.821 -19.142 1.00 33.23 N ATOM 1645 CA ILE A 991 -13.276 22.325 -20.504 1.00 32.17 C ATOM 1646 C ILE A 991 -12.132 22.337 -21.525 1.00 32.31 C ATOM 1647 O ILE A 991 -12.236 21.713 -22.578 1.00 31.22 O ATOM 1648 CB ILE A 991 -14.544 23.040 -21.073 1.00 35.49 C ATOM 1649 CG1 ILE A 991 -14.328 24.571 -21.192 1.00 35.69 C ATOM 1650 CG2 ILE A 991 -15.797 22.669 -20.248 1.00 35.74 C ATOM 1651 CD1 ILE A 991 -15.342 25.350 -22.049 1.00 40.94 C ATOM 1652 H ILE A 991 -13.521 23.644 -18.811 1.00 0.00 H ATOM 1653 N PHE A 992 -11.059 23.081 -21.228 1.00 27.98 N ATOM 1654 CA PHE A 992 -9.947 23.310 -22.141 1.00 26.62 C ATOM 1655 C PHE A 992 -9.013 22.143 -22.433 1.00 29.33 C ATOM 1656 O PHE A 992 -8.159 22.254 -23.307 1.00 28.72 O ATOM 1657 CB PHE A 992 -9.231 24.603 -21.788 1.00 27.61 C ATOM 1658 CG PHE A 992 -10.188 25.745 -21.533 1.00 29.28 C ATOM 1659 CD1 PHE A 992 -10.461 26.169 -20.236 1.00 31.67 C ATOM 1660 CD2 PHE A 992 -10.834 26.382 -22.588 1.00 31.39 C ATOM 1661 CE1 PHE A 992 -11.337 27.238 -20.002 1.00 32.96 C ATOM 1662 CE2 PHE A 992 -11.726 27.433 -22.351 1.00 34.49 C ATOM 1663 CZ PHE A 992 -11.971 27.851 -21.065 1.00 32.70 C ATOM 1664 H PHE A 992 -11.017 23.523 -20.287 1.00 0.00 H ATOM 1665 N TRP A 993 -9.190 21.023 -21.741 1.00 27.35 N ATOM 1666 CA TRP A 993 -8.376 19.825 -21.974 1.00 28.27 C ATOM 1667 C TRP A 993 -9.218 18.733 -22.681 1.00 32.11 C ATOM 1668 O TRP A 993 -8.643 17.752 -23.145 1.00 31.79 O ATOM 1669 CB TRP A 993 -7.799 19.286 -20.622 1.00 27.63 C ATOM 1670 CG TRP A 993 -6.606 20.059 -20.096 1.00 27.93 C ATOM 1671 CD1 TRP A 993 -5.298 19.657 -20.107 1.00 30.67 C ATOM 1672 CD2 TRP A 993 -6.623 21.353 -19.470 1.00 27.56 C ATOM 1673 NE1 TRP A 993 -4.495 20.629 -19.542 1.00 29.24 N ATOM 1674 CE2 TRP A 993 -5.281 21.690 -19.160 1.00 31.05 C ATOM 1675 CE3 TRP A 993 -7.640 22.278 -19.163 1.00 29.03 C ATOM 1676 CZ2 TRP A 993 -4.934 22.909 -18.563 1.00 30.14 C ATOM 1677 CZ3 TRP A 993 -7.293 23.485 -18.569 1.00 30.66 C ATOM 1678 CH2 TRP A 993 -5.953 23.789 -18.272 1.00 31.05 C ATOM 1679 HE1 TRP A 993 -3.463 20.568 -19.425 1.00 0.00 H ATOM 1680 H TRP A 993 -9.930 20.995 -21.010 1.00 0.00 H ATOM 1681 N TYR A 994 -10.568 18.882 -22.710 1.00 29.89 N ATOM 1682 CA TYR A 994 -11.483 17.885 -23.294 1.00 31.79 C ATOM 1683 C TYR A 994 -11.393 17.793 -24.803 1.00 37.00 C ATOM 1684 O TYR A 994 -11.414 18.821 -25.493 1.00 37.08 O ATOM 1685 CB TYR A 994 -12.951 18.158 -22.934 1.00 34.46 C ATOM 1686 CG TYR A 994 -13.368 17.988 -21.484 1.00 37.90 C ATOM 1687 CD1 TYR A 994 -14.108 18.968 -20.838 1.00 40.02 C ATOM 1688 CD2 TYR A 994 -13.114 16.802 -20.796 1.00 39.15 C ATOM 1689 CE1 TYR A 994 -14.545 18.801 -19.524 1.00 42.94 C ATOM 1690 CE2 TYR A 994 -13.565 16.613 -19.490 1.00 39.80 C ATOM 1691 CZ TYR A 994 -14.280 17.617 -18.857 1.00 48.84 C ATOM 1692 OH TYR A 994 -14.723 17.462 -17.569 1.00 49.43 O ATOM 1693 HH TYR A 994 -15.329 16.681 -17.522 1.00 0.00 H ATOM 1694 H TYR A 994 -10.977 19.745 -22.298 1.00 0.00 H ATOM 1695 N ALA A 995 -11.376 16.551 -25.322 1.00 33.83 N ATOM 1696 CA ALA A 995 -11.390 16.260 -26.752 1.00 34.30 C ATOM 1697 C ALA A 995 -12.761 16.677 -27.356 1.00 38.26 C ATOM 1698 O ALA A 995 -13.727 16.795 -26.594 1.00 38.00 O ATOM 1699 CB ALA A 995 -11.143 14.762 -26.974 1.00 35.39 C ATOM 1700 H ALA A 995 -11.351 15.748 -24.662 1.00 0.00 H ATOM 1701 N PRO A 996 -12.878 16.935 -28.690 1.00 36.76 N ATOM 1702 CA PRO A 996 -14.193 17.317 -29.263 1.00 36.64 C ATOM 1703 C PRO A 996 -15.296 16.292 -29.004 1.00 39.74 C ATOM 1704 O PRO A 996 -16.408 16.681 -28.623 1.00 38.12 O ATOM 1705 CB PRO A 996 -13.910 17.451 -30.761 1.00 38.28 C ATOM 1706 CG PRO A 996 -12.464 17.627 -30.873 1.00 42.72 C ATOM 1707 CD PRO A 996 -11.844 16.883 -29.738 1.00 38.01 C ATOM 1708 N GLU A 997 -14.974 14.976 -29.128 1.00 37.70 N ATOM 1709 CA GLU A 997 -15.955 13.906 -28.863 1.00 37.66 C ATOM 1710 C GLU A 997 -16.366 13.843 -27.405 1.00 41.28 C ATOM 1711 O GLU A 997 -17.490 13.440 -27.099 1.00 41.28 O ATOM 1712 CB GLU A 997 -15.547 12.538 -29.456 1.00 39.22 C ATOM 1713 CG GLU A 997 -14.381 11.842 -28.764 1.00 43.36 C ATOM 1714 CD GLU A 997 -12.979 12.322 -29.080 1.00 47.66 C ATOM 1715 OE1 GLU A 997 -12.029 11.725 -28.525 1.00 41.96 O ATOM 1716 OE2 GLU A 997 -12.818 13.267 -29.889 1.00 39.84 O ATOM 1717 H GLU A 997 -14.009 14.717 -29.418 1.00 0.00 H ATOM 1718 N SER A 998 -15.488 14.324 -26.501 1.00 35.53 N ATOM 1719 CA SER A 998 -15.837 14.400 -25.088 1.00 34.53 C ATOM 1720 C SER A 998 -16.749 15.601 -24.873 1.00 38.72 C ATOM 1721 O SER A 998 -17.738 15.492 -24.140 1.00 37.71 O ATOM 1722 CB SER A 998 -14.582 14.498 -24.221 1.00 36.20 C ATOM 1723 OG SER A 998 -13.671 13.457 -24.555 1.00 39.08 O ATOM 1724 HG SER A 998 -12.864 13.532 -23.987 1.00 0.00 H ATOM 1725 H SER A 998 -14.550 14.645 -26.816 1.00 0.00 H ATOM 1726 N LEU A 999 -16.432 16.744 -25.533 1.00 35.88 N ATOM 1727 CA LEU A 999 -17.251 17.964 -25.442 1.00 35.77 C ATOM 1728 C LEU A 999 -18.642 17.745 -26.082 1.00 41.31 C ATOM 1729 O LEU A 999 -19.648 18.185 -25.527 1.00 41.37 O ATOM 1730 CB LEU A 999 -16.558 19.157 -26.142 1.00 34.85 C ATOM 1731 CG LEU A 999 -15.270 19.740 -25.529 1.00 37.56 C ATOM 1732 CD1 LEU A 999 -14.664 20.743 -26.455 1.00 37.42 C ATOM 1733 CD2 LEU A 999 -15.538 20.443 -24.210 1.00 36.57 C ATOM 1734 H LEU A 999 -15.578 16.758 -26.126 1.00 0.00 H ATOM 1735 N SER A1000 -18.698 17.055 -27.220 1.00 40.00 N ATOM 1736 CA SER A1000 -19.978 16.839 -27.902 1.00 41.60 C ATOM 1737 C SER A1000 -20.820 15.684 -27.391 1.00 49.13 C ATOM 1738 O SER A1000 -22.015 15.878 -27.153 1.00 50.55 O ATOM 1739 CB SER A1000 -19.802 16.761 -29.414 1.00 44.43 C ATOM 1740 OG SER A1000 -19.038 15.638 -29.817 1.00 56.10 O ATOM 1741 HG SER A1000 -19.490 14.809 -29.520 1.00 0.00 H ATOM 1742 H SER A1000 -17.825 16.665 -27.629 1.00 0.00 H ATOM 1743 N ASP A1001 -20.222 14.492 -27.220 1.00 46.43 N ATOM 1744 CA ASP A1001 -20.960 13.278 -26.852 1.00 46.56 C ATOM 1745 C ASP A1001 -20.606 12.601 -25.519 1.00 49.15 C ATOM 1746 O ASP A1001 -21.077 11.484 -25.282 1.00 48.26 O ATOM 1747 CB ASP A1001 -20.832 12.258 -27.991 1.00 49.20 C ATOM 1748 CG ASP A1001 -21.441 12.701 -29.302 1.00 64.54 C ATOM 1749 OD1 ASP A1001 -22.669 12.530 -29.470 1.00 67.72 O ATOM 1750 OD2 ASP A1001 -20.681 13.169 -30.184 1.00 68.57 O ATOM 1751 H ASP A1001 -19.193 14.428 -27.354 1.00 0.00 H ATOM 1752 N ASN A1002 -19.782 13.254 -24.653 1.00 43.47 N ATOM 1753 CA ASN A1002 -19.317 12.704 -23.362 1.00 41.14 C ATOM 1754 C ASN A1002 -18.628 11.336 -23.536 1.00 38.77 C ATOM 1755 O ASN A1002 -18.718 10.474 -22.668 1.00 38.07 O ATOM 1756 CB ASN A1002 -20.422 12.672 -22.294 1.00 45.05 C ATOM 1757 CG ASN A1002 -21.185 13.964 -22.144 1.00 75.70 C ATOM 1758 OD1 ASN A1002 -20.685 14.961 -21.609 1.00 70.24 O ATOM 1759 ND2 ASN A1002 -22.430 13.963 -22.600 1.00 69.55 N ATOM 1760 HD22 ASN A1002 -22.820 13.108 -23.045 1.00 0.00 H ATOM 1761 HD21 ASN A1002 -23.016 14.818 -22.513 1.00 0.00 H ATOM 1762 H ASN A1002 -19.457 14.206 -24.918 1.00 0.00 H ATOM 1763 N ILE A1003 -17.959 11.156 -24.678 1.00 34.57 N ATOM 1764 CA ILE A1003 -17.204 9.963 -25.056 1.00 34.50 C ATOM 1765 C ILE A1003 -15.746 10.113 -24.612 1.00 37.79 C ATOM 1766 O ILE A1003 -15.112 11.134 -24.896 1.00 37.18 O ATOM 1767 CB ILE A1003 -17.308 9.671 -26.587 1.00 37.00 C ATOM 1768 CG1 ILE A1003 -18.755 9.244 -26.987 1.00 37.26 C ATOM 1769 CG2 ILE A1003 -16.272 8.607 -27.043 1.00 36.22 C ATOM 1770 CD1 ILE A1003 -18.976 9.124 -28.510 1.00 47.63 C ATOM 1771 H ILE A1003 -17.977 11.939 -25.363 1.00 0.00 H ATOM 1772 N PHE A1004 -15.212 9.076 -23.949 1.00 34.64 N ATOM 1773 CA PHE A1004 -13.841 9.045 -23.461 1.00 33.04 C ATOM 1774 C PHE A1004 -13.219 7.724 -23.806 1.00 38.00 C ATOM 1775 O PHE A1004 -13.878 6.678 -23.736 1.00 37.02 O ATOM 1776 CB PHE A1004 -13.795 9.293 -21.953 1.00 34.45 C ATOM 1777 CG PHE A1004 -14.182 10.699 -21.549 1.00 35.75 C ATOM 1778 CD1 PHE A1004 -15.517 11.042 -21.347 1.00 37.61 C ATOM 1779 CD2 PHE A1004 -13.209 11.675 -21.343 1.00 36.80 C ATOM 1780 CE1 PHE A1004 -15.874 12.335 -20.955 1.00 38.41 C ATOM 1781 CE2 PHE A1004 -13.567 12.968 -20.929 1.00 38.65 C ATOM 1782 CZ PHE A1004 -14.892 13.287 -20.736 1.00 37.10 C ATOM 1783 H PHE A1004 -15.813 8.246 -23.773 1.00 0.00 H ATOM 1784 N SER A1005 -11.953 7.776 -24.188 1.00 33.62 N ATOM 1785 CA SER A1005 -11.168 6.610 -24.576 1.00 34.07 C ATOM 1786 C SER A1005 -9.679 6.940 -24.400 1.00 36.09 C ATOM 1787 O SER A1005 -9.340 8.046 -23.975 1.00 33.82 O ATOM 1788 CB SER A1005 -11.440 6.280 -26.044 1.00 37.07 C ATOM 1789 OG SER A1005 -11.003 7.356 -26.856 1.00 41.06 O ATOM 1790 HG SER A1005 -11.494 8.178 -26.605 1.00 0.00 H ATOM 1791 H SER A1005 -11.489 8.706 -24.213 1.00 0.00 H ATOM 1792 N ARG A1006 -8.802 6.003 -24.776 1.00 32.26 N ATOM 1793 CA ARG A1006 -7.352 6.210 -24.731 1.00 32.91 C ATOM 1794 C ARG A1006 -6.918 7.279 -25.751 1.00 35.72 C ATOM 1795 O ARG A1006 -5.907 7.950 -25.539 1.00 34.36 O ATOM 1796 CB ARG A1006 -6.602 4.874 -24.912 1.00 34.02 C ATOM 1797 CG ARG A1006 -6.905 3.935 -23.719 1.00 37.82 C ATOM 1798 CD ARG A1006 -6.482 2.499 -23.950 1.00 44.50 C ATOM 1799 NE ARG A1006 -7.225 1.869 -25.041 1.00 45.48 N ATOM 1800 CZ ARG A1006 -7.210 0.572 -25.306 1.00 43.85 C ATOM 1801 NH1 ARG A1006 -6.525 -0.258 -24.537 1.00 29.91 N ATOM 1802 NH2 ARG A1006 -7.907 0.090 -26.318 1.00 38.72 N ATOM 1803 HE ARG A1006 -7.804 2.481 -25.650 1.00 0.00 H ATOM 1804 HH12 ARG A1006 -6.516 -1.276 -24.749 1.00 0.00 H ATOM 1805 HH11 ARG A1006 -5.995 0.107 -23.720 1.00 0.00 H ATOM 1806 HH22 ARG A1006 -7.891 -0.930 -26.521 1.00 0.00 H ATOM 1807 HH21 ARG A1006 -8.472 0.730 -26.912 1.00 0.00 H ATOM 1808 H ARG A1006 -9.164 5.089 -25.115 1.00 0.00 H ATOM 1809 N GLN A1007 -7.729 7.468 -26.819 1.00 32.41 N ATOM 1810 CA GLN A1007 -7.543 8.472 -27.877 1.00 32.40 C ATOM 1811 C GLN A1007 -7.907 9.901 -27.385 1.00 33.19 C ATOM 1812 O GLN A1007 -7.288 10.855 -27.838 1.00 35.38 O ATOM 1813 CB GLN A1007 -8.349 8.092 -29.140 1.00 34.57 C ATOM 1814 CG GLN A1007 -7.923 6.778 -29.824 1.00 38.98 C ATOM 1815 CD GLN A1007 -8.244 5.521 -29.044 1.00 55.82 C ATOM 1816 OE1 GLN A1007 -9.323 5.369 -28.458 1.00 55.19 O ATOM 1817 NE2 GLN A1007 -7.289 4.599 -28.987 1.00 49.02 N ATOM 1818 HE22 GLN A1007 -6.390 4.750 -29.488 1.00 0.00 H ATOM 1819 HE21 GLN A1007 -7.440 3.727 -28.441 1.00 0.00 H ATOM 1820 H GLN A1007 -8.559 6.846 -26.898 1.00 0.00 H ATOM 1821 N SER A1008 -8.898 10.054 -26.492 1.00 28.02 N ATOM 1822 CA SER A1008 -9.217 11.361 -25.876 1.00 27.76 C ATOM 1823 C SER A1008 -8.126 11.701 -24.837 1.00 32.79 C ATOM 1824 O SER A1008 -7.817 12.881 -24.649 1.00 30.25 O ATOM 1825 CB SER A1008 -10.615 11.390 -25.262 1.00 27.86 C ATOM 1826 OG SER A1008 -10.773 10.466 -24.202 1.00 33.20 O ATOM 1827 HG SER A1008 -10.124 10.675 -23.484 1.00 0.00 H ATOM 1828 H SER A1008 -9.462 9.223 -26.223 1.00 0.00 H ATOM 1829 N ASP A1009 -7.478 10.650 -24.222 1.00 28.02 N ATOM 1830 CA ASP A1009 -6.331 10.843 -23.332 1.00 26.63 C ATOM 1831 C ASP A1009 -5.171 11.385 -24.170 1.00 28.91 C ATOM 1832 O ASP A1009 -4.459 12.256 -23.687 1.00 26.21 O ATOM 1833 CB ASP A1009 -5.933 9.538 -22.584 1.00 27.88 C ATOM 1834 CG ASP A1009 -6.583 9.342 -21.202 1.00 32.76 C ATOM 1835 OD1 ASP A1009 -6.359 8.276 -20.583 1.00 31.71 O ATOM 1836 OD2 ASP A1009 -7.330 10.247 -20.753 1.00 34.06 O ATOM 1837 H ASP A1009 -7.817 9.683 -24.397 1.00 0.00 H ATOM 1838 N VAL A1010 -5.028 10.933 -25.447 1.00 27.32 N ATOM 1839 CA VAL A1010 -4.001 11.423 -26.387 1.00 27.47 C ATOM 1840 C VAL A1010 -4.243 12.926 -26.668 1.00 30.84 C ATOM 1841 O VAL A1010 -3.283 13.690 -26.721 1.00 28.36 O ATOM 1842 CB VAL A1010 -3.900 10.603 -27.709 1.00 30.65 C ATOM 1843 CG1 VAL A1010 -2.956 11.282 -28.713 1.00 29.38 C ATOM 1844 CG2 VAL A1010 -3.421 9.171 -27.437 1.00 30.81 C ATOM 1845 H VAL A1010 -5.683 10.197 -25.780 1.00 0.00 H ATOM 1846 N TRP A1011 -5.511 13.324 -26.868 1.00 29.45 N ATOM 1847 CA TRP A1011 -5.862 14.739 -27.096 1.00 30.59 C ATOM 1848 C TRP A1011 -5.384 15.567 -25.874 1.00 33.06 C ATOM 1849 O TRP A1011 -4.693 16.575 -26.045 1.00 32.27 O ATOM 1850 CB TRP A1011 -7.383 14.909 -27.289 1.00 29.81 C ATOM 1851 CG TRP A1011 -7.816 16.349 -27.417 1.00 31.62 C ATOM 1852 CD1 TRP A1011 -7.954 17.259 -26.406 1.00 34.48 C ATOM 1853 CD2 TRP A1011 -8.183 17.031 -28.623 1.00 31.74 C ATOM 1854 NE1 TRP A1011 -8.395 18.459 -26.907 1.00 34.37 N ATOM 1855 CE2 TRP A1011 -8.523 18.355 -28.269 1.00 35.61 C ATOM 1856 CE3 TRP A1011 -8.276 16.645 -29.973 1.00 33.78 C ATOM 1857 CZ2 TRP A1011 -8.939 19.299 -29.213 1.00 35.19 C ATOM 1858 CZ3 TRP A1011 -8.664 17.591 -30.914 1.00 35.93 C ATOM 1859 CH2 TRP A1011 -8.976 18.902 -30.536 1.00 36.52 C ATOM 1860 HE1 TRP A1011 -8.599 19.310 -26.345 1.00 0.00 H ATOM 1861 H TRP A1011 -6.269 12.612 -26.862 1.00 0.00 H ATOM 1862 N SER A1012 -5.766 15.128 -24.658 1.00 28.43 N ATOM 1863 CA SER A1012 -5.381 15.783 -23.408 1.00 27.95 C ATOM 1864 C SER A1012 -3.856 15.891 -23.270 1.00 30.00 C ATOM 1865 O SER A1012 -3.375 16.921 -22.823 1.00 29.27 O ATOM 1866 CB SER A1012 -6.020 15.095 -22.208 1.00 29.30 C ATOM 1867 OG SER A1012 -7.428 15.150 -22.361 1.00 35.89 O ATOM 1868 HG SER A1012 -7.860 14.707 -21.589 1.00 0.00 H ATOM 1869 H SER A1012 -6.365 14.280 -24.606 1.00 0.00 H ATOM 1870 N PHE A1013 -3.111 14.871 -23.727 1.00 25.69 N ATOM 1871 CA PHE A1013 -1.630 14.870 -23.739 1.00 25.83 C ATOM 1872 C PHE A1013 -1.082 15.978 -24.641 1.00 30.23 C ATOM 1873 O PHE A1013 -0.046 16.584 -24.323 1.00 28.13 O ATOM 1874 CB PHE A1013 -1.071 13.495 -24.145 1.00 26.65 C ATOM 1875 CG PHE A1013 0.440 13.426 -24.163 1.00 26.94 C ATOM 1876 CD1 PHE A1013 1.163 13.341 -22.979 1.00 29.28 C ATOM 1877 CD2 PHE A1013 1.140 13.432 -25.367 1.00 27.00 C ATOM 1878 CE1 PHE A1013 2.564 13.231 -22.997 1.00 30.02 C ATOM 1879 CE2 PHE A1013 2.545 13.355 -25.383 1.00 30.78 C ATOM 1880 CZ PHE A1013 3.247 13.269 -24.194 1.00 29.08 C ATOM 1881 H PHE A1013 -3.604 14.032 -24.094 1.00 0.00 H ATOM 1882 N GLY A1014 -1.761 16.226 -25.766 1.00 28.78 N ATOM 1883 CA GLY A1014 -1.422 17.348 -26.635 1.00 27.39 C ATOM 1884 C GLY A1014 -1.480 18.653 -25.847 1.00 28.90 C ATOM 1885 O GLY A1014 -0.574 19.476 -25.959 1.00 28.71 O ATOM 1886 H GLY A1014 -2.551 15.603 -26.028 1.00 0.00 H ATOM 1887 N VAL A1015 -2.516 18.824 -24.994 1.00 26.71 N ATOM 1888 CA VAL A1015 -2.677 20.031 -24.132 1.00 26.13 C ATOM 1889 C VAL A1015 -1.566 20.023 -23.048 1.00 29.46 C ATOM 1890 O VAL A1015 -0.983 21.071 -22.743 1.00 28.58 O ATOM 1891 CB VAL A1015 -4.106 20.186 -23.556 1.00 29.74 C ATOM 1892 CG1 VAL A1015 -4.281 21.535 -22.851 1.00 30.38 C ATOM 1893 CG2 VAL A1015 -5.162 20.022 -24.640 1.00 29.27 C ATOM 1894 H VAL A1015 -3.237 18.076 -24.936 1.00 0.00 H ATOM 1895 N VAL A1016 -1.201 18.825 -22.552 1.00 26.05 N ATOM 1896 CA VAL A1016 -0.078 18.695 -21.609 1.00 25.99 C ATOM 1897 C VAL A1016 1.240 19.158 -22.246 1.00 29.10 C ATOM 1898 O VAL A1016 2.002 19.867 -21.591 1.00 29.33 O ATOM 1899 CB VAL A1016 0.033 17.292 -20.945 1.00 27.80 C ATOM 1900 CG1 VAL A1016 1.317 17.179 -20.112 1.00 27.49 C ATOM 1901 CG2 VAL A1016 -1.189 17.032 -20.066 1.00 26.86 C ATOM 1902 H VAL A1016 -1.724 17.974 -22.841 1.00 0.00 H ATOM 1903 N LEU A1017 1.503 18.776 -23.512 1.00 27.52 N ATOM 1904 CA LEU A1017 2.703 19.207 -24.244 1.00 27.96 C ATOM 1905 C LEU A1017 2.719 20.748 -24.360 1.00 30.03 C ATOM 1906 O LEU A1017 3.758 21.379 -24.150 1.00 28.22 O ATOM 1907 CB LEU A1017 2.719 18.609 -25.660 1.00 28.90 C ATOM 1908 CG LEU A1017 3.072 17.138 -25.835 1.00 34.98 C ATOM 1909 CD1 LEU A1017 2.779 16.698 -27.259 1.00 35.73 C ATOM 1910 CD2 LEU A1017 4.541 16.895 -25.538 1.00 40.35 C ATOM 1911 H LEU A1017 0.827 18.148 -23.992 1.00 0.00 H ATOM 1912 N TYR A1018 1.555 21.339 -24.689 1.00 27.21 N ATOM 1913 CA TYR A1018 1.399 22.802 -24.767 1.00 25.68 C ATOM 1914 C TYR A1018 1.736 23.427 -23.366 1.00 30.19 C ATOM 1915 O TYR A1018 2.443 24.439 -23.296 1.00 31.09 O ATOM 1916 CB TYR A1018 -0.032 23.141 -25.181 1.00 25.76 C ATOM 1917 CG TYR A1018 -0.286 24.633 -25.246 1.00 26.91 C ATOM 1918 CD1 TYR A1018 -0.117 25.338 -26.436 1.00 27.79 C ATOM 1919 CD2 TYR A1018 -0.721 25.336 -24.122 1.00 27.06 C ATOM 1920 CE1 TYR A1018 -0.353 26.716 -26.501 1.00 25.61 C ATOM 1921 CE2 TYR A1018 -0.940 26.713 -24.171 1.00 27.60 C ATOM 1922 CZ TYR A1018 -0.727 27.402 -25.357 1.00 32.86 C ATOM 1923 OH TYR A1018 -0.977 28.751 -25.409 1.00 31.00 O ATOM 1924 HH TYR A1018 -0.405 29.217 -24.749 1.00 0.00 H ATOM 1925 H TYR A1018 0.732 20.738 -24.897 1.00 0.00 H ATOM 1926 N GLU A1019 1.212 22.824 -22.275 1.00 27.40 N ATOM 1927 CA GLU A1019 1.449 23.272 -20.893 1.00 27.53 C ATOM 1928 C GLU A1019 2.937 23.258 -20.558 1.00 27.86 C ATOM 1929 O GLU A1019 3.449 24.251 -20.038 1.00 25.39 O ATOM 1930 CB GLU A1019 0.679 22.433 -19.880 1.00 29.21 C ATOM 1931 CG GLU A1019 -0.800 22.736 -19.816 1.00 31.38 C ATOM 1932 CD GLU A1019 -1.449 22.096 -18.610 1.00 37.91 C ATOM 1933 OE1 GLU A1019 -1.569 22.779 -17.566 1.00 30.65 O ATOM 1934 OE2 GLU A1019 -1.772 20.889 -18.682 1.00 29.44 O ATOM 1935 H GLU A1019 0.604 21.993 -22.421 1.00 0.00 H ATOM 1936 N LEU A1020 3.632 22.170 -20.893 1.00 25.71 N ATOM 1937 CA LEU A1020 5.081 22.050 -20.641 1.00 26.62 C ATOM 1938 C LEU A1020 5.870 23.147 -21.385 1.00 30.28 C ATOM 1939 O LEU A1020 6.693 23.838 -20.779 1.00 28.90 O ATOM 1940 CB LEU A1020 5.597 20.668 -21.074 1.00 27.42 C ATOM 1941 CG LEU A1020 5.421 19.522 -20.071 1.00 34.46 C ATOM 1942 CD1 LEU A1020 5.433 18.185 -20.790 1.00 35.47 C ATOM 1943 CD2 LEU A1020 6.588 19.484 -19.097 1.00 39.03 C ATOM 1944 H LEU A1020 3.135 21.378 -21.348 1.00 0.00 H ATOM 1945 N PHE A1021 5.577 23.319 -22.699 1.00 26.78 N ATOM 1946 CA PHE A1021 6.287 24.267 -23.550 1.00 26.59 C ATOM 1947 C PHE A1021 5.988 25.755 -23.315 1.00 31.29 C ATOM 1948 O PHE A1021 6.734 26.600 -23.806 1.00 31.11 O ATOM 1949 CB PHE A1021 6.353 23.796 -25.032 1.00 28.40 C ATOM 1950 CG PHE A1021 7.368 22.666 -25.150 1.00 30.64 C ATOM 1951 CD1 PHE A1021 7.026 21.358 -24.806 1.00 33.16 C ATOM 1952 CD2 PHE A1021 8.690 22.930 -25.494 1.00 32.45 C ATOM 1953 CE1 PHE A1021 7.979 20.332 -24.841 1.00 33.89 C ATOM 1954 CE2 PHE A1021 9.647 21.903 -25.518 1.00 34.21 C ATOM 1955 CZ PHE A1021 9.279 20.611 -25.211 1.00 31.72 C ATOM 1956 H PHE A1021 4.813 22.750 -23.117 1.00 0.00 H ATOM 1957 N THR A1022 4.962 26.065 -22.494 1.00 29.61 N ATOM 1958 CA THR A1022 4.633 27.435 -22.047 1.00 29.52 C ATOM 1959 C THR A1022 5.057 27.585 -20.575 1.00 33.80 C ATOM 1960 O THR A1022 4.844 28.650 -19.986 1.00 32.51 O ATOM 1961 CB THR A1022 3.133 27.726 -22.143 1.00 31.68 C ATOM 1962 OG1 THR A1022 2.391 26.784 -21.356 1.00 28.07 O ATOM 1963 CG2 THR A1022 2.618 27.774 -23.578 1.00 29.19 C ATOM 1964 HG1 THR A1022 2.565 25.868 -21.689 1.00 0.00 H ATOM 1965 H THR A1022 4.362 25.287 -22.153 1.00 0.00 H ATOM 1966 N TYR A1023 5.652 26.511 -19.979 1.00 31.18 N ATOM 1967 CA TYR A1023 6.042 26.408 -18.548 1.00 29.82 C ATOM 1968 C TYR A1023 4.856 26.739 -17.663 1.00 30.61 C ATOM 1969 O TYR A1023 5.013 27.376 -16.610 1.00 28.56 O ATOM 1970 CB TYR A1023 7.239 27.328 -18.197 1.00 31.37 C ATOM 1971 CG TYR A1023 8.520 26.924 -18.873 1.00 31.83 C ATOM 1972 CD1 TYR A1023 8.854 27.422 -20.133 1.00 34.02 C ATOM 1973 CD2 TYR A1023 9.403 26.043 -18.261 1.00 32.26 C ATOM 1974 CE1 TYR A1023 10.036 27.044 -20.767 1.00 34.62 C ATOM 1975 CE2 TYR A1023 10.603 25.681 -18.873 1.00 32.83 C ATOM 1976 CZ TYR A1023 10.902 26.168 -20.134 1.00 38.16 C ATOM 1977 OH TYR A1023 12.042 25.764 -20.762 1.00 38.10 O ATOM 1978 HH TYR A1023 12.827 26.015 -20.213 1.00 0.00 H ATOM 1979 H TYR A1023 5.851 25.688 -20.582 1.00 0.00 H ATOM 1980 N CYS A1024 3.648 26.361 -18.118 1.00 26.09 N ATOM 1981 CA CYS A1024 2.404 26.650 -17.411 1.00 26.27 C ATOM 1982 C CYS A1024 2.176 28.124 -17.102 1.00 30.77 C ATOM 1983 O CYS A1024 1.562 28.469 -16.083 1.00 28.50 O ATOM 1984 CB CYS A1024 2.250 25.761 -16.180 1.00 27.18 C ATOM 1985 SG CYS A1024 1.970 24.025 -16.603 1.00 30.57 S ATOM 1986 H CYS A1024 3.598 25.838 -19.016 1.00 0.00 H ATOM 1987 N ASP A1025 2.650 28.990 -18.018 1.00 28.04 N ATOM 1988 CA ASP A1025 2.444 30.428 -17.909 1.00 28.94 C ATOM 1989 C ASP A1025 0.958 30.723 -17.977 1.00 32.74 C ATOM 1990 O ASP A1025 0.286 30.301 -18.925 1.00 34.11 O ATOM 1991 CB ASP A1025 3.227 31.201 -18.990 1.00 31.61 C ATOM 1992 CG ASP A1025 2.993 32.700 -18.894 1.00 42.77 C ATOM 1993 OD1 ASP A1025 3.249 33.268 -17.828 1.00 43.90 O ATOM 1994 OD2 ASP A1025 2.445 33.267 -19.840 1.00 49.93 O ATOM 1995 H ASP A1025 3.182 28.619 -18.831 1.00 0.00 H ATOM 1996 N LYS A1026 0.432 31.420 -16.945 1.00 29.45 N ATOM 1997 CA LYS A1026 -0.986 31.800 -16.844 1.00 29.65 C ATOM 1998 C LYS A1026 -1.466 32.660 -18.001 1.00 34.45 C ATOM 1999 O LYS A1026 -2.594 32.466 -18.471 1.00 35.24 O ATOM 2000 CB LYS A1026 -1.255 32.534 -15.515 1.00 33.22 C ATOM 2001 CG LYS A1026 -2.511 32.062 -14.814 1.00 57.43 C ATOM 2002 H LYS A1026 1.069 31.705 -16.174 1.00 0.00 H ATOM 2003 N SER A1027 -0.619 33.587 -18.494 1.00 31.26 N ATOM 2004 CA SER A1027 -0.997 34.504 -19.591 1.00 31.01 C ATOM 2005 C SER A1027 -1.284 33.824 -20.935 1.00 35.29 C ATOM 2006 O SER A1027 -2.106 34.326 -21.712 1.00 34.72 O ATOM 2007 CB SER A1027 0.032 35.620 -19.753 1.00 31.43 C ATOM 2008 OG SER A1027 1.227 35.115 -20.324 1.00 32.02 O ATOM 2009 HG SER A1027 1.602 34.414 -19.734 1.00 0.00 H ATOM 2010 H SER A1027 0.335 33.660 -18.087 1.00 0.00 H ATOM 2011 N CYS A1028 -0.623 32.694 -21.213 1.00 31.80 N ATOM 2012 CA CYS A1028 -0.893 31.930 -22.447 1.00 31.20 C ATOM 2013 C CYS A1028 -1.397 30.503 -22.137 1.00 33.18 C ATOM 2014 O CYS A1028 -1.235 29.609 -22.961 1.00 31.42 O ATOM 2015 CB CYS A1028 0.318 31.907 -23.375 1.00 31.50 C ATOM 2016 SG CYS A1028 1.808 31.202 -22.635 1.00 35.43 S ATOM 2017 H CYS A1028 0.096 32.347 -20.546 1.00 0.00 H ATOM 2018 N SER A1029 -2.032 30.313 -20.972 1.00 29.23 N ATOM 2019 CA SER A1029 -2.573 29.015 -20.531 1.00 29.19 C ATOM 2020 C SER A1029 -3.678 28.516 -21.489 1.00 31.61 C ATOM 2021 O SER A1029 -4.271 29.341 -22.193 1.00 29.57 O ATOM 2022 CB SER A1029 -3.153 29.144 -19.120 1.00 31.49 C ATOM 2023 OG SER A1029 -4.288 29.996 -19.102 1.00 36.04 O ATOM 2024 HG SER A1029 -4.638 30.058 -18.178 1.00 0.00 H ATOM 2025 H SER A1029 -2.150 31.131 -20.341 1.00 0.00 H ATOM 2026 N PRO A1030 -4.023 27.207 -21.505 1.00 29.27 N ATOM 2027 CA PRO A1030 -5.135 26.763 -22.370 1.00 29.83 C ATOM 2028 C PRO A1030 -6.413 27.570 -22.169 1.00 34.12 C ATOM 2029 O PRO A1030 -7.032 27.946 -23.157 1.00 34.37 O ATOM 2030 CB PRO A1030 -5.305 25.292 -21.985 1.00 31.78 C ATOM 2031 CG PRO A1030 -3.910 24.880 -21.581 1.00 35.44 C ATOM 2032 CD PRO A1030 -3.423 26.059 -20.787 1.00 30.98 C ATOM 2033 N SER A1031 -6.759 27.917 -20.909 1.00 32.28 N ATOM 2034 CA SER A1031 -7.961 28.700 -20.608 1.00 32.76 C ATOM 2035 C SER A1031 -7.865 30.163 -21.093 1.00 37.56 C ATOM 2036 O SER A1031 -8.825 30.667 -21.678 1.00 36.61 O ATOM 2037 CB SER A1031 -8.285 28.653 -19.115 1.00 36.82 C ATOM 2038 OG SER A1031 -7.422 29.455 -18.323 1.00 40.88 O ATOM 2039 HG SER A1031 -6.489 29.143 -18.434 1.00 0.00 H ATOM 2040 H SER A1031 -6.148 27.617 -20.123 1.00 0.00 H ATOM 2041 N ALA A1032 -6.720 30.841 -20.833 1.00 34.32 N ATOM 2042 CA ALA A1032 -6.539 32.250 -21.230 1.00 34.33 C ATOM 2043 C ALA A1032 -6.489 32.362 -22.736 1.00 35.78 C ATOM 2044 O ALA A1032 -7.167 33.205 -23.303 1.00 33.83 O ATOM 2045 CB ALA A1032 -5.262 32.830 -20.622 1.00 35.04 C ATOM 2046 H ALA A1032 -5.946 30.353 -20.339 1.00 0.00 H ATOM 2047 N GLU A1033 -5.721 31.481 -23.388 1.00 32.77 N ATOM 2048 CA GLU A1033 -5.579 31.517 -24.832 1.00 32.33 C ATOM 2049 C GLU A1033 -6.832 31.093 -25.573 1.00 36.10 C ATOM 2050 O GLU A1033 -7.224 31.774 -26.519 1.00 34.77 O ATOM 2051 CB GLU A1033 -4.306 30.785 -25.270 1.00 33.24 C ATOM 2052 CG GLU A1033 -3.930 30.992 -26.721 1.00 35.49 C ATOM 2053 CD GLU A1033 -3.801 32.414 -27.242 1.00 45.46 C ATOM 2054 OE1 GLU A1033 -3.942 32.582 -28.469 1.00 37.18 O ATOM 2055 OE2 GLU A1033 -3.547 33.349 -26.449 1.00 35.81 O ATOM 2056 H GLU A1033 -5.213 30.753 -22.847 1.00 0.00 H ATOM 2057 N PHE A1034 -7.512 30.013 -25.125 1.00 33.89 N ATOM 2058 CA PHE A1034 -8.784 29.651 -25.765 1.00 32.93 C ATOM 2059 C PHE A1034 -9.860 30.747 -25.565 1.00 37.20 C ATOM 2060 O PHE A1034 -10.514 31.104 -26.550 1.00 36.46 O ATOM 2061 CB PHE A1034 -9.291 28.273 -25.321 1.00 34.39 C ATOM 2062 CG PHE A1034 -8.824 27.080 -26.135 1.00 34.44 C ATOM 2063 CD1 PHE A1034 -8.891 27.093 -27.522 1.00 35.41 C ATOM 2064 CD2 PHE A1034 -8.362 25.926 -25.504 1.00 35.48 C ATOM 2065 CE1 PHE A1034 -8.508 25.969 -28.269 1.00 37.07 C ATOM 2066 CE2 PHE A1034 -7.986 24.804 -26.251 1.00 37.88 C ATOM 2067 CZ PHE A1034 -8.059 24.833 -27.628 1.00 35.48 C ATOM 2068 H PHE A1034 -7.139 29.446 -24.337 1.00 0.00 H ATOM 2069 N LEU A1035 -10.010 31.326 -24.339 1.00 36.37 N ATOM 2070 CA LEU A1035 -10.983 32.444 -24.135 1.00 38.49 C ATOM 2071 C LEU A1035 -10.696 33.578 -25.125 1.00 42.04 C ATOM 2072 O LEU A1035 -11.629 34.112 -25.733 1.00 41.82 O ATOM 2073 CB LEU A1035 -10.962 33.025 -22.695 1.00 39.97 C ATOM 2074 CG LEU A1035 -11.945 34.234 -22.377 1.00 47.99 C ATOM 2075 CD1 LEU A1035 -12.409 34.255 -20.924 1.00 49.51 C ATOM 2076 CD2 LEU A1035 -11.307 35.605 -22.659 1.00 53.98 C ATOM 2077 H LEU A1035 -9.442 30.986 -23.537 1.00 0.00 H ATOM 2078 N ARG A1036 -9.405 33.965 -25.241 1.00 39.10 N ATOM 2079 CA ARG A1036 -8.914 35.042 -26.116 1.00 38.67 C ATOM 2080 C ARG A1036 -9.309 34.771 -27.579 1.00 39.45 C ATOM 2081 O ARG A1036 -9.910 35.630 -28.223 1.00 37.98 O ATOM 2082 CB ARG A1036 -7.385 35.184 -25.928 1.00 39.40 C ATOM 2083 CG ARG A1036 -6.742 36.479 -26.431 1.00 47.03 C ATOM 2084 CD ARG A1036 -5.221 36.407 -26.226 1.00 54.04 C ATOM 2085 NE ARG A1036 -4.818 36.890 -24.895 1.00 70.09 N ATOM 2086 CZ ARG A1036 -4.134 36.195 -23.979 1.00 81.07 C ATOM 2087 NH1 ARG A1036 -3.830 36.746 -22.809 1.00 71.78 N ATOM 2088 NH2 ARG A1036 -3.746 34.943 -24.231 1.00 49.81 N ATOM 2089 HE ARG A1036 -5.090 37.862 -24.643 1.00 0.00 H ATOM 2090 HH12 ARG A1036 -3.298 36.201 -22.100 1.00 0.00 H ATOM 2091 HH11 ARG A1036 -4.124 37.722 -22.602 1.00 0.00 H ATOM 2092 HH22 ARG A1036 -3.215 34.409 -23.514 1.00 0.00 H ATOM 2093 HH21 ARG A1036 -3.975 34.501 -25.144 1.00 0.00 H ATOM 2094 H ARG A1036 -8.702 33.460 -24.665 1.00 0.00 H ATOM 2095 N MET A1037 -9.083 33.541 -28.062 1.00 35.67 N ATOM 2096 CA MET A1037 -9.460 33.135 -29.421 1.00 35.49 C ATOM 2097 C MET A1037 -10.993 33.056 -29.639 1.00 39.25 C ATOM 2098 O MET A1037 -11.445 33.272 -30.758 1.00 39.68 O ATOM 2099 CB MET A1037 -8.835 31.767 -29.777 1.00 37.79 C ATOM 2100 CG MET A1037 -7.315 31.771 -29.868 1.00 41.33 C ATOM 2101 SD MET A1037 -6.631 30.076 -29.809 1.00 46.28 S ATOM 2102 CE MET A1037 -7.276 29.416 -31.354 1.00 43.14 C ATOM 2103 H MET A1037 -8.620 32.843 -27.446 1.00 0.00 H ATOM 2104 N MET A1038 -11.772 32.688 -28.592 1.00 35.26 N ATOM 2105 CA MET A1038 -13.232 32.512 -28.642 1.00 48.04 C ATOM 2106 C MET A1038 -14.021 33.801 -28.890 1.00 86.36 C ATOM 2107 O MET A1038 -13.626 34.877 -28.445 1.00 61.08 O ATOM 2108 CB MET A1038 -13.742 31.779 -27.384 1.00 50.19 C ATOM 2109 CG MET A1038 -13.601 30.252 -27.459 1.00 53.85 C ATOM 2110 SD MET A1038 -13.506 29.397 -25.847 1.00 57.91 S ATOM 2111 CE MET A1038 -15.102 29.807 -25.162 1.00 54.62 C ATOM 2112 H MET A1038 -11.300 32.517 -27.681 1.00 0.00 H TER 2113 MET A1038 ATOM 2114 N ASP A1043 -25.974 34.850 -27.877 1.00 76.23 N ATOM 2115 CA ASP A1043 -25.797 34.220 -26.568 1.00 76.02 C ATOM 2116 C ASP A1043 -25.592 32.697 -26.713 1.00 79.09 C ATOM 2117 O ASP A1043 -26.559 31.927 -26.819 1.00 78.90 O ATOM 2118 CB ASP A1043 -26.967 34.563 -25.626 1.00 77.83 C ATOM 2119 HN3 ASP A1043 -26.808 34.443 -28.346 1.00 0.00 H ATOM 2120 HN2 ASP A1043 -25.129 34.680 -28.459 1.00 0.00 H ATOM 2121 HN1 ASP A1043 -26.110 35.874 -27.752 1.00 0.00 H ATOM 2122 N VAL A1044 -24.311 32.283 -26.765 1.00 73.84 N ATOM 2123 CA VAL A1044 -23.896 30.888 -26.945 1.00 72.54 C ATOM 2124 C VAL A1044 -23.040 30.448 -25.731 1.00 72.71 C ATOM 2125 O VAL A1044 -22.153 31.209 -25.319 1.00 71.82 O ATOM 2126 CB VAL A1044 -23.159 30.698 -28.314 1.00 76.72 C ATOM 2127 CG1 VAL A1044 -22.642 29.269 -28.506 1.00 76.56 C ATOM 2128 CG2 VAL A1044 -24.051 31.097 -29.491 1.00 76.50 C ATOM 2129 H VAL A1044 -23.565 33.002 -26.671 1.00 0.00 H ATOM 2130 N PRO A1045 -23.296 29.243 -25.139 1.00 66.60 N ATOM 2131 CA PRO A1045 -22.462 28.785 -24.008 1.00 64.83 C ATOM 2132 C PRO A1045 -20.996 28.570 -24.420 1.00 63.76 C ATOM 2133 O PRO A1045 -20.729 28.209 -25.577 1.00 63.59 O ATOM 2134 CB PRO A1045 -23.114 27.453 -23.589 1.00 66.67 C ATOM 2135 CG PRO A1045 -24.434 27.416 -24.257 1.00 71.74 C ATOM 2136 CD PRO A1045 -24.301 28.222 -25.505 1.00 67.74 C ATOM 2137 N ALA A1046 -20.053 28.806 -23.477 1.00 55.66 N ATOM 2138 CA ALA A1046 -18.611 28.662 -23.679 1.00 54.21 C ATOM 2139 C ALA A1046 -18.196 27.295 -24.234 1.00 55.13 C ATOM 2140 O ALA A1046 -17.319 27.243 -25.100 1.00 52.57 O ATOM 2141 CB ALA A1046 -17.866 28.946 -22.390 1.00 54.78 C ATOM 2142 H ALA A1046 -20.378 29.113 -22.538 1.00 0.00 H ATOM 2143 N LEU A1047 -18.847 26.201 -23.754 1.00 50.14 N ATOM 2144 CA LEU A1047 -18.575 24.831 -24.186 1.00 49.56 C ATOM 2145 C LEU A1047 -18.864 24.687 -25.676 1.00 50.43 C ATOM 2146 O LEU A1047 -18.041 24.121 -26.395 1.00 48.32 O ATOM 2147 CB LEU A1047 -19.416 23.826 -23.364 1.00 50.08 C ATOM 2148 CG LEU A1047 -19.146 22.338 -23.608 1.00 55.29 C ATOM 2149 CD1 LEU A1047 -19.276 21.562 -22.333 1.00 55.78 C ATOM 2150 CD2 LEU A1047 -20.074 21.763 -24.669 1.00 59.21 C ATOM 2151 H LEU A1047 -19.584 26.348 -23.035 1.00 0.00 H ATOM 2152 N SER A1048 -20.049 25.185 -26.127 1.00 46.60 N ATOM 2153 CA SER A1048 -20.475 25.165 -27.531 1.00 45.83 C ATOM 2154 C SER A1048 -19.581 26.067 -28.388 1.00 46.70 C ATOM 2155 O SER A1048 -19.216 25.677 -29.495 1.00 47.01 O ATOM 2156 CB SER A1048 -21.955 25.518 -27.658 1.00 49.74 C ATOM 2157 OG SER A1048 -22.745 24.522 -27.019 1.00 53.04 O ATOM 2158 HG SER A1048 -23.703 24.757 -27.105 1.00 0.00 H ATOM 2159 H SER A1048 -20.695 25.608 -25.430 1.00 0.00 H ATOM 2160 N ARG A1049 -19.153 27.220 -27.838 1.00 41.80 N ATOM 2161 CA ARG A1049 -18.228 28.150 -28.499 1.00 41.07 C ATOM 2162 C ARG A1049 -16.825 27.495 -28.694 1.00 40.41 C ATOM 2163 O ARG A1049 -16.206 27.679 -29.743 1.00 37.21 O ATOM 2164 CB ARG A1049 -18.143 29.470 -27.699 1.00 42.02 C ATOM 2165 CG ARG A1049 -17.301 30.568 -28.346 1.00 57.57 C ATOM 2166 CD ARG A1049 -17.999 31.267 -29.507 1.00 71.55 C ATOM 2167 NE ARG A1049 -17.054 31.988 -30.365 1.00 79.42 N ATOM 2168 CZ ARG A1049 -16.427 31.454 -31.410 1.00 92.11 C ATOM 2169 NH1 ARG A1049 -16.631 30.182 -31.738 1.00 77.68 N ATOM 2170 NH2 ARG A1049 -15.588 32.185 -32.133 1.00 77.17 N ATOM 2171 HE ARG A1049 -16.860 32.985 -30.142 1.00 0.00 H ATOM 2172 HH12 ARG A1049 -16.138 29.770 -32.556 1.00 0.00 H ATOM 2173 HH11 ARG A1049 -17.284 29.598 -31.177 1.00 0.00 H ATOM 2174 HH22 ARG A1049 -15.101 31.763 -32.949 1.00 0.00 H ATOM 2175 HH21 ARG A1049 -15.418 33.180 -31.884 1.00 0.00 H ATOM 2176 H ARG A1049 -19.498 27.466 -26.888 1.00 0.00 H ATOM 2177 N LEU A1050 -16.362 26.696 -27.701 1.00 35.27 N ATOM 2178 CA LEU A1050 -15.077 25.995 -27.796 1.00 34.22 C ATOM 2179 C LEU A1050 -15.182 24.888 -28.840 1.00 36.94 C ATOM 2180 O LEU A1050 -14.298 24.769 -29.689 1.00 35.98 O ATOM 2181 CB LEU A1050 -14.618 25.451 -26.415 1.00 33.79 C ATOM 2182 CG LEU A1050 -13.273 24.666 -26.342 1.00 36.90 C ATOM 2183 CD1 LEU A1050 -12.087 25.528 -26.776 1.00 37.25 C ATOM 2184 CD2 LEU A1050 -13.005 24.217 -24.929 1.00 33.46 C ATOM 2185 H LEU A1050 -16.937 26.576 -26.843 1.00 0.00 H ATOM 2186 N LEU A1051 -16.282 24.114 -28.814 1.00 36.56 N ATOM 2187 CA LEU A1051 -16.530 23.044 -29.790 1.00 38.03 C ATOM 2188 C LEU A1051 -16.531 23.622 -31.213 1.00 42.82 C ATOM 2189 O LEU A1051 -15.875 23.061 -32.092 1.00 40.83 O ATOM 2190 CB LEU A1051 -17.875 22.361 -29.512 1.00 38.64 C ATOM 2191 CG LEU A1051 -17.956 20.845 -29.496 1.00 44.57 C ATOM 2192 CD1 LEU A1051 -19.379 20.414 -29.677 1.00 45.18 C ATOM 2193 CD2 LEU A1051 -17.068 20.173 -30.557 1.00 46.75 C ATOM 2194 H LEU A1051 -16.989 24.281 -28.069 1.00 0.00 H ATOM 2195 N GLU A1052 -17.224 24.771 -31.415 1.00 41.62 N ATOM 2196 CA GLU A1052 -17.288 25.503 -32.697 1.00 41.69 C ATOM 2197 C GLU A1052 -15.880 25.839 -33.181 1.00 44.77 C ATOM 2198 O GLU A1052 -15.538 25.564 -34.331 1.00 44.31 O ATOM 2199 CB GLU A1052 -18.033 26.831 -32.499 1.00 43.53 C ATOM 2200 CG GLU A1052 -19.543 26.785 -32.599 1.00 59.45 C ATOM 2201 CD GLU A1052 -20.177 28.150 -32.379 1.00 83.98 C ATOM 2202 OE1 GLU A1052 -21.169 28.229 -31.618 1.00 69.74 O ATOM 2203 OE2 GLU A1052 -19.656 29.147 -32.934 1.00 79.02 O ATOM 2204 H GLU A1052 -17.749 25.165 -30.608 1.00 0.00 H ATOM 2205 N LEU A1053 -15.074 26.452 -32.284 1.00 41.52 N ATOM 2206 CA LEU A1053 -13.678 26.845 -32.476 1.00 42.29 C ATOM 2207 C LEU A1053 -12.901 25.599 -32.972 1.00 40.90 C ATOM 2208 O LEU A1053 -12.302 25.627 -34.040 1.00 39.29 O ATOM 2209 CB LEU A1053 -13.127 27.293 -31.091 1.00 43.87 C ATOM 2210 CG LEU A1053 -12.361 28.609 -30.874 1.00 52.05 C ATOM 2211 CD1 LEU A1053 -11.008 28.576 -31.483 1.00 53.87 C ATOM 2212 CD2 LEU A1053 -13.145 29.827 -31.301 1.00 58.08 C ATOM 2213 H LEU A1053 -15.492 26.667 -31.357 1.00 0.00 H ATOM 2214 N LEU A1054 -12.966 24.500 -32.205 1.00 35.57 N ATOM 2215 CA LEU A1054 -12.264 23.258 -32.523 1.00 35.03 C ATOM 2216 C LEU A1054 -12.744 22.593 -33.819 1.00 39.86 C ATOM 2217 O LEU A1054 -11.900 22.177 -34.613 1.00 37.81 O ATOM 2218 CB LEU A1054 -12.298 22.273 -31.339 1.00 34.91 C ATOM 2219 CG LEU A1054 -11.567 22.723 -30.044 1.00 39.06 C ATOM 2220 CD1 LEU A1054 -11.946 21.826 -28.870 1.00 38.77 C ATOM 2221 CD2 LEU A1054 -10.048 22.775 -30.228 1.00 39.00 C ATOM 2222 H LEU A1054 -13.545 24.534 -31.341 1.00 0.00 H ATOM 2223 N GLU A1055 -14.084 22.517 -34.043 1.00 39.39 N ATOM 2224 CA GLU A1055 -14.661 21.932 -35.266 1.00 41.42 C ATOM 2225 C GLU A1055 -14.198 22.672 -36.540 1.00 46.54 C ATOM 2226 O GLU A1055 -13.987 22.036 -37.572 1.00 46.03 O ATOM 2227 CB GLU A1055 -16.196 21.823 -35.166 1.00 43.51 C ATOM 2228 CG GLU A1055 -16.638 20.634 -34.318 1.00 55.02 C ATOM 2229 CD GLU A1055 -18.131 20.510 -34.087 1.00 72.04 C ATOM 2230 H GLU A1055 -14.730 22.889 -33.318 1.00 0.00 H ATOM 2231 N GLU A1056 -13.937 23.997 -36.427 1.00 44.57 N ATOM 2232 CA GLU A1056 -13.416 24.837 -37.516 1.00 44.93 C ATOM 2233 C GLU A1056 -11.948 24.549 -37.821 1.00 47.37 C ATOM 2234 O GLU A1056 -11.416 25.072 -38.800 1.00 47.42 O ATOM 2235 CB GLU A1056 -13.555 26.323 -37.159 1.00 46.60 C ATOM 2236 CG GLU A1056 -14.943 26.893 -37.389 1.00 56.68 C ATOM 2237 CD GLU A1056 -15.206 28.209 -36.680 1.00 79.29 C ATOM 2238 OE1 GLU A1056 -16.396 28.516 -36.439 1.00 79.35 O ATOM 2239 OE2 GLU A1056 -14.228 28.917 -36.339 1.00 65.17 O ATOM 2240 H GLU A1056 -14.117 24.450 -35.508 1.00 0.00 H ATOM 2241 N GLY A1057 -11.286 23.776 -36.958 1.00 42.13 N ATOM 2242 CA GLY A1057 -9.876 23.447 -37.121 1.00 40.02 C ATOM 2243 C GLY A1057 -8.940 24.379 -36.384 1.00 40.76 C ATOM 2244 O GLY A1057 -7.718 24.233 -36.488 1.00 39.43 O ATOM 2245 H GLY A1057 -11.797 23.393 -36.137 1.00 0.00 H ATOM 2246 N GLN A1058 -9.492 25.333 -35.617 1.00 37.16 N ATOM 2247 CA GLN A1058 -8.656 26.254 -34.841 1.00 37.12 C ATOM 2248 C GLN A1058 -8.043 25.517 -33.650 1.00 37.68 C ATOM 2249 O GLN A1058 -8.706 24.692 -33.024 1.00 36.09 O ATOM 2250 CB GLN A1058 -9.452 27.459 -34.362 1.00 39.11 C ATOM 2251 CG GLN A1058 -9.858 28.417 -35.482 1.00 54.41 C ATOM 2252 CD GLN A1058 -10.516 29.647 -34.910 1.00 67.14 C ATOM 2253 OE1 GLN A1058 -9.856 30.531 -34.358 1.00 61.88 O ATOM 2254 NE2 GLN A1058 -11.835 29.707 -34.989 1.00 57.79 N ATOM 2255 HE22 GLN A1058 -12.363 28.945 -35.461 1.00 0.00 H ATOM 2256 HE21 GLN A1058 -12.344 30.516 -34.579 1.00 0.00 H ATOM 2257 H GLN A1058 -10.527 25.420 -35.573 1.00 0.00 H ATOM 2258 N ARG A1059 -6.778 25.805 -33.366 1.00 33.28 N ATOM 2259 CA ARG A1059 -6.016 25.144 -32.299 1.00 32.58 C ATOM 2260 C ARG A1059 -5.206 26.163 -31.525 1.00 36.18 C ATOM 2261 O ARG A1059 -4.916 27.241 -32.048 1.00 35.56 O ATOM 2262 CB ARG A1059 -5.029 24.113 -32.920 1.00 29.54 C ATOM 2263 CG ARG A1059 -5.656 22.936 -33.695 1.00 34.71 C ATOM 2264 CD ARG A1059 -6.525 22.064 -32.806 1.00 34.86 C ATOM 2265 NE ARG A1059 -7.075 20.891 -33.492 1.00 36.89 N ATOM 2266 CZ ARG A1059 -8.330 20.785 -33.918 1.00 42.48 C ATOM 2267 NH1 ARG A1059 -8.757 19.657 -34.462 1.00 33.58 N ATOM 2268 NH2 ARG A1059 -9.170 21.803 -33.793 1.00 31.75 N ATOM 2269 HE ARG A1059 -6.439 20.085 -33.657 1.00 0.00 H ATOM 2270 HH12 ARG A1059 -9.740 19.579 -34.794 1.00 0.00 H ATOM 2271 HH11 ARG A1059 -8.110 18.848 -34.558 1.00 0.00 H ATOM 2272 HH22 ARG A1059 -10.150 21.713 -34.129 1.00 0.00 H ATOM 2273 HH21 ARG A1059 -8.849 22.692 -33.359 1.00 0.00 H ATOM 2274 H ARG A1059 -6.302 26.538 -33.929 1.00 0.00 H ATOM 2275 N LEU A1060 -4.777 25.802 -30.301 1.00 30.43 N ATOM 2276 CA LEU A1060 -3.875 26.653 -29.514 1.00 29.22 C ATOM 2277 C LEU A1060 -2.610 26.911 -30.353 1.00 33.86 C ATOM 2278 O LEU A1060 -2.194 26.028 -31.112 1.00 31.30 O ATOM 2279 CB LEU A1060 -3.493 25.972 -28.183 1.00 27.92 C ATOM 2280 CG LEU A1060 -4.572 25.901 -27.129 1.00 29.09 C ATOM 2281 CD1 LEU A1060 -4.252 24.838 -26.098 1.00 29.62 C ATOM 2282 CD2 LEU A1060 -4.747 27.245 -26.445 1.00 28.77 C ATOM 2283 H LEU A1060 -5.093 24.895 -29.902 1.00 0.00 H ATOM 2284 N PRO A1061 -2.025 28.129 -30.279 1.00 34.12 N ATOM 2285 CA PRO A1061 -0.857 28.439 -31.127 1.00 33.69 C ATOM 2286 C PRO A1061 0.410 27.807 -30.583 1.00 35.89 C ATOM 2287 O PRO A1061 0.462 27.454 -29.407 1.00 34.78 O ATOM 2288 CB PRO A1061 -0.755 29.963 -31.026 1.00 35.68 C ATOM 2289 CG PRO A1061 -1.270 30.270 -29.637 1.00 40.25 C ATOM 2290 CD PRO A1061 -2.426 29.298 -29.463 1.00 35.64 C ATOM 2291 N ALA A1062 1.447 27.712 -31.418 1.00 31.50 N ATOM 2292 CA ALA A1062 2.738 27.202 -30.975 1.00 31.06 C ATOM 2293 C ALA A1062 3.229 28.068 -29.790 1.00 33.57 C ATOM 2294 O ALA A1062 3.230 29.295 -29.919 1.00 29.53 O ATOM 2295 CB ALA A1062 3.744 27.275 -32.114 1.00 31.80 C ATOM 2296 H ALA A1062 1.331 28.009 -32.408 1.00 0.00 H ATOM 2297 N PRO A1063 3.613 27.468 -28.626 1.00 31.35 N ATOM 2298 CA PRO A1063 4.131 28.291 -27.515 1.00 30.64 C ATOM 2299 C PRO A1063 5.350 29.143 -27.921 1.00 33.71 C ATOM 2300 O PRO A1063 6.091 28.761 -28.820 1.00 31.76 O ATOM 2301 CB PRO A1063 4.568 27.242 -26.484 1.00 31.80 C ATOM 2302 CG PRO A1063 3.688 26.058 -26.755 1.00 35.33 C ATOM 2303 CD PRO A1063 3.598 26.031 -28.257 1.00 31.64 C ATOM 2304 N PRO A1064 5.631 30.264 -27.230 1.00 32.41 N ATOM 2305 CA PRO A1064 6.839 31.047 -27.568 1.00 33.15 C ATOM 2306 C PRO A1064 8.109 30.191 -27.480 1.00 38.30 C ATOM 2307 O PRO A1064 8.297 29.449 -26.503 1.00 35.79 O ATOM 2308 CB PRO A1064 6.827 32.160 -26.508 1.00 34.53 C ATOM 2309 CG PRO A1064 5.366 32.349 -26.218 1.00 37.80 C ATOM 2310 CD PRO A1064 4.859 30.926 -26.154 1.00 33.45 C ATOM 2311 N ALA A1065 8.948 30.258 -28.539 1.00 36.05 N ATOM 2312 CA ALA A1065 10.208 29.514 -28.697 1.00 37.05 C ATOM 2313 C ALA A1065 10.072 27.975 -28.763 1.00 40.70 C ATOM 2314 O ALA A1065 11.078 27.268 -28.670 1.00 41.37 O ATOM 2315 CB ALA A1065 11.232 29.943 -27.639 1.00 38.06 C ATOM 2316 H ALA A1065 8.677 30.895 -29.315 1.00 0.00 H ATOM 2317 N CYS A1066 8.848 27.459 -29.009 1.00 36.45 N ATOM 2318 CA CYS A1066 8.603 26.023 -29.113 1.00 36.34 C ATOM 2319 C CYS A1066 9.355 25.440 -30.314 1.00 42.81 C ATOM 2320 O CYS A1066 9.236 26.005 -31.400 1.00 43.48 O ATOM 2321 CB CYS A1066 7.103 25.737 -29.216 1.00 36.24 C ATOM 2322 SG CYS A1066 6.669 23.971 -29.156 1.00 39.73 S ATOM 2323 H CYS A1066 8.047 28.111 -29.129 1.00 0.00 H ATOM 2324 N PRO A1067 10.088 24.298 -30.172 1.00 39.45 N ATOM 2325 CA PRO A1067 10.704 23.676 -31.363 1.00 39.35 C ATOM 2326 C PRO A1067 9.579 23.269 -32.319 1.00 44.04 C ATOM 2327 O PRO A1067 8.508 22.850 -31.850 1.00 42.38 O ATOM 2328 CB PRO A1067 11.432 22.447 -30.790 1.00 40.61 C ATOM 2329 CG PRO A1067 11.562 22.723 -29.317 1.00 44.29 C ATOM 2330 CD PRO A1067 10.328 23.484 -28.961 1.00 39.76 C ATOM 2331 N ALA A1068 9.772 23.476 -33.643 1.00 41.80 N ATOM 2332 CA ALA A1068 8.737 23.172 -34.647 1.00 41.25 C ATOM 2333 C ALA A1068 8.194 21.739 -34.565 1.00 43.45 C ATOM 2334 O ALA A1068 6.983 21.550 -34.646 1.00 43.56 O ATOM 2335 CB ALA A1068 9.228 23.491 -36.063 1.00 41.76 C ATOM 2336 H ALA A1068 10.683 23.863 -33.963 1.00 0.00 H ATOM 2337 N GLU A1069 9.070 20.753 -34.349 1.00 39.94 N ATOM 2338 CA GLU A1069 8.698 19.336 -34.254 1.00 39.80 C ATOM 2339 C GLU A1069 7.762 19.009 -33.085 1.00 40.38 C ATOM 2340 O GLU A1069 6.871 18.178 -33.231 1.00 38.30 O ATOM 2341 CB GLU A1069 9.949 18.453 -34.220 1.00 41.76 C ATOM 2342 CG GLU A1069 10.585 18.257 -35.589 1.00 57.64 C ATOM 2343 CD GLU A1069 11.970 18.851 -35.778 1.00 88.12 C ATOM 2344 OE1 GLU A1069 12.915 18.427 -35.072 1.00 87.80 O ATOM 2345 H GLU A1069 10.074 21.004 -34.242 1.00 0.00 H ATOM 2346 N VAL A1070 7.947 19.686 -31.934 1.00 36.78 N ATOM 2347 CA VAL A1070 7.117 19.502 -30.736 1.00 34.79 C ATOM 2348 C VAL A1070 5.703 19.991 -31.058 1.00 35.94 C ATOM 2349 O VAL A1070 4.738 19.291 -30.797 1.00 34.95 O ATOM 2350 CB VAL A1070 7.732 20.217 -29.493 1.00 38.17 C ATOM 2351 CG1 VAL A1070 6.805 20.126 -28.290 1.00 37.59 C ATOM 2352 CG2 VAL A1070 9.112 19.649 -29.153 1.00 38.13 C ATOM 2353 H VAL A1070 8.722 20.378 -31.892 1.00 0.00 H ATOM 2354 N HIS A1071 5.596 21.176 -31.669 1.00 34.18 N ATOM 2355 CA HIS A1071 4.320 21.752 -32.082 1.00 33.88 C ATOM 2356 C HIS A1071 3.591 20.828 -33.088 1.00 35.95 C ATOM 2357 O HIS A1071 2.378 20.659 -32.979 1.00 35.53 O ATOM 2358 CB HIS A1071 4.537 23.168 -32.665 1.00 34.90 C ATOM 2359 CG HIS A1071 3.281 23.811 -33.158 1.00 38.38 C ATOM 2360 ND1 HIS A1071 3.247 24.492 -34.362 1.00 40.52 N ATOM 2361 CD2 HIS A1071 2.041 23.833 -32.607 1.00 39.88 C ATOM 2362 CE1 HIS A1071 2.000 24.917 -34.492 1.00 39.74 C ATOM 2363 NE2 HIS A1071 1.238 24.532 -33.465 1.00 39.54 N ATOM 2364 H HIS A1071 6.465 21.714 -31.859 1.00 0.00 H ATOM 2365 N GLU A1072 4.324 20.220 -34.040 1.00 33.21 N ATOM 2366 CA GLU A1072 3.730 19.288 -35.028 1.00 32.95 C ATOM 2367 C GLU A1072 3.085 18.076 -34.329 1.00 37.40 C ATOM 2368 O GLU A1072 1.989 17.663 -34.719 1.00 37.81 O ATOM 2369 CB GLU A1072 4.767 18.845 -36.069 1.00 34.95 C ATOM 2370 CG GLU A1072 5.200 19.961 -37.018 1.00 48.34 C ATOM 2371 CD GLU A1072 4.101 20.621 -37.835 1.00 62.67 C ATOM 2372 OE1 GLU A1072 3.231 19.897 -38.371 1.00 55.96 O ATOM 2373 OE2 GLU A1072 4.091 21.871 -37.909 1.00 57.13 O ATOM 2374 H GLU A1072 5.345 20.411 -34.084 1.00 0.00 H ATOM 2375 N LEU A1073 3.708 17.585 -33.230 1.00 35.03 N ATOM 2376 CA LEU A1073 3.180 16.469 -32.413 1.00 33.79 C ATOM 2377 C LEU A1073 1.911 16.845 -31.708 1.00 35.32 C ATOM 2378 O LEU A1073 0.942 16.069 -31.742 1.00 34.49 O ATOM 2379 CB LEU A1073 4.236 15.935 -31.418 1.00 34.46 C ATOM 2380 CG LEU A1073 5.389 15.122 -32.034 1.00 40.03 C ATOM 2381 CD1 LEU A1073 6.384 14.684 -30.956 1.00 41.10 C ATOM 2382 CD2 LEU A1073 4.871 13.885 -32.794 1.00 41.08 C ATOM 2383 H LEU A1073 4.610 18.017 -32.944 1.00 0.00 H ATOM 2384 N MET A1074 1.868 18.079 -31.129 1.00 30.91 N ATOM 2385 CA MET A1074 0.657 18.592 -30.478 1.00 30.36 C ATOM 2386 C MET A1074 -0.497 18.530 -31.468 1.00 33.07 C ATOM 2387 O MET A1074 -1.539 18.004 -31.134 1.00 32.56 O ATOM 2388 CB MET A1074 0.829 20.062 -30.018 1.00 31.85 C ATOM 2389 CG MET A1074 1.783 20.273 -28.886 1.00 34.57 C ATOM 2390 SD MET A1074 1.921 22.065 -28.542 1.00 37.27 S ATOM 2391 CE MET A1074 3.571 22.151 -27.966 1.00 33.72 C ATOM 2392 H MET A1074 2.720 18.675 -31.149 1.00 0.00 H ATOM 2393 N LYS A1075 -0.287 19.048 -32.694 1.00 31.78 N ATOM 2394 CA LYS A1075 -1.277 19.092 -33.786 1.00 31.18 C ATOM 2395 C LYS A1075 -1.742 17.710 -34.186 1.00 33.40 C ATOM 2396 O LYS A1075 -2.924 17.543 -34.459 1.00 32.63 O ATOM 2397 CB LYS A1075 -0.754 19.876 -35.001 1.00 33.91 C ATOM 2398 CG LYS A1075 -0.613 21.382 -34.726 1.00 42.50 C ATOM 2399 CD LYS A1075 -0.273 22.186 -35.966 1.00 43.16 C ATOM 2400 CE LYS A1075 1.141 21.994 -36.430 1.00 50.72 C ATOM 2401 NZ LYS A1075 1.343 22.563 -37.791 1.00 63.55 N ATOM 2402 HZ1 LYS A1075 0.706 22.088 -38.462 1.00 0.00 H ATOM 2403 HZ2 LYS A1075 1.134 23.582 -37.774 1.00 0.00 H ATOM 2404 HZ3 LYS A1075 2.330 22.415 -38.084 1.00 0.00 H ATOM 2405 H LYS A1075 0.652 19.451 -32.886 1.00 0.00 H ATOM 2406 N LEU A1076 -0.847 16.711 -34.153 1.00 31.00 N ATOM 2407 CA LEU A1076 -1.227 15.304 -34.399 1.00 31.67 C ATOM 2408 C LEU A1076 -2.136 14.782 -33.275 1.00 35.14 C ATOM 2409 O LEU A1076 -3.136 14.123 -33.563 1.00 33.86 O ATOM 2410 CB LEU A1076 0.015 14.411 -34.518 1.00 31.93 C ATOM 2411 CG LEU A1076 0.958 14.666 -35.698 1.00 37.89 C ATOM 2412 CD1 LEU A1076 2.053 13.654 -35.710 1.00 38.24 C ATOM 2413 CD2 LEU A1076 0.214 14.659 -37.047 1.00 41.88 C ATOM 2414 H LEU A1076 0.148 16.934 -33.947 1.00 0.00 H ATOM 2415 N CYS A1077 -1.814 15.126 -31.986 1.00 32.10 N ATOM 2416 CA CYS A1077 -2.615 14.740 -30.807 1.00 31.67 C ATOM 2417 C CYS A1077 -3.972 15.371 -30.903 1.00 31.99 C ATOM 2418 O CYS A1077 -4.950 14.817 -30.393 1.00 30.98 O ATOM 2419 CB CYS A1077 -1.923 15.162 -29.513 1.00 32.19 C ATOM 2420 SG CYS A1077 -0.430 14.229 -29.130 1.00 36.74 S ATOM 2421 H CYS A1077 -0.955 15.692 -31.830 1.00 0.00 H ATOM 2422 N TRP A1078 -4.034 16.542 -31.553 1.00 29.26 N ATOM 2423 CA TRP A1078 -5.295 17.256 -31.754 1.00 30.66 C ATOM 2424 C TRP A1078 -6.052 16.949 -33.066 1.00 38.51 C ATOM 2425 O TRP A1078 -6.883 17.766 -33.506 1.00 36.87 O ATOM 2426 CB TRP A1078 -5.129 18.774 -31.552 1.00 28.54 C ATOM 2427 CG TRP A1078 -4.508 19.167 -30.246 1.00 29.07 C ATOM 2428 CD1 TRP A1078 -4.752 18.630 -29.011 1.00 31.81 C ATOM 2429 CD2 TRP A1078 -3.630 20.286 -30.036 1.00 28.13 C ATOM 2430 NE1 TRP A1078 -4.000 19.287 -28.055 1.00 31.63 N ATOM 2431 CE2 TRP A1078 -3.313 20.318 -28.657 1.00 32.50 C ATOM 2432 CE3 TRP A1078 -3.048 21.243 -30.890 1.00 28.50 C ATOM 2433 CZ2 TRP A1078 -2.443 21.278 -28.113 1.00 30.58 C ATOM 2434 CZ3 TRP A1078 -2.202 22.201 -30.348 1.00 29.21 C ATOM 2435 CH2 TRP A1078 -1.927 22.225 -28.969 1.00 29.77 C ATOM 2436 HE1 TRP A1078 -3.960 19.042 -27.045 1.00 0.00 H ATOM 2437 H TRP A1078 -3.156 16.957 -31.927 1.00 0.00 H ATOM 2438 N ALA A1079 -5.841 15.744 -33.649 1.00 37.24 N ATOM 2439 CA ALA A1079 -6.564 15.355 -34.864 1.00 36.54 C ATOM 2440 C ALA A1079 -8.073 15.365 -34.558 1.00 39.76 C ATOM 2441 O ALA A1079 -8.472 14.948 -33.461 1.00 39.61 O ATOM 2442 CB ALA A1079 -6.119 13.964 -35.332 1.00 37.13 C ATOM 2443 H ALA A1079 -5.156 15.085 -33.228 1.00 0.00 H ATOM 2444 N PRO A1080 -8.928 15.892 -35.469 1.00 34.57 N ATOM 2445 CA PRO A1080 -10.378 15.939 -35.182 1.00 34.76 C ATOM 2446 C PRO A1080 -10.999 14.593 -34.790 1.00 41.42 C ATOM 2447 O PRO A1080 -11.833 14.539 -33.872 1.00 41.71 O ATOM 2448 CB PRO A1080 -10.977 16.466 -36.497 1.00 36.09 C ATOM 2449 CG PRO A1080 -9.867 17.223 -37.142 1.00 39.91 C ATOM 2450 CD PRO A1080 -8.624 16.464 -36.797 1.00 35.91 C ATOM 2451 N SER A1081 -10.590 13.510 -35.477 1.00 38.91 N ATOM 2452 CA SER A1081 -11.128 12.170 -35.238 1.00 39.86 C ATOM 2453 C SER A1081 -10.213 11.336 -34.323 1.00 40.60 C ATOM 2454 O SER A1081 -8.995 11.286 -34.557 1.00 39.12 O ATOM 2455 CB SER A1081 -11.388 11.450 -36.558 1.00 45.62 C ATOM 2456 OG SER A1081 -12.120 10.258 -36.325 1.00 62.18 O ATOM 2457 HG SER A1081 -12.283 9.799 -37.187 1.00 0.00 H ATOM 2458 H SER A1081 -9.861 13.631 -36.209 1.00 0.00 H ATOM 2459 N PRO A1082 -10.784 10.681 -33.280 1.00 37.61 N ATOM 2460 CA PRO A1082 -9.938 9.896 -32.343 1.00 37.86 C ATOM 2461 C PRO A1082 -9.040 8.857 -33.003 1.00 42.86 C ATOM 2462 O PRO A1082 -7.880 8.713 -32.617 1.00 41.07 O ATOM 2463 CB PRO A1082 -10.942 9.277 -31.362 1.00 39.22 C ATOM 2464 CG PRO A1082 -12.287 9.506 -31.942 1.00 42.98 C ATOM 2465 CD PRO A1082 -12.202 10.665 -32.866 1.00 38.70 C ATOM 2466 N GLN A1083 -9.545 8.216 -34.073 1.00 42.79 N ATOM 2467 CA GLN A1083 -8.840 7.185 -34.848 1.00 43.44 C ATOM 2468 C GLN A1083 -7.575 7.677 -35.580 1.00 44.69 C ATOM 2469 O GLN A1083 -6.686 6.870 -35.839 1.00 44.29 O ATOM 2470 CB GLN A1083 -9.822 6.453 -35.804 1.00 45.71 C ATOM 2471 CG GLN A1083 -10.548 7.364 -36.795 1.00 69.00 C ATOM 2472 CD GLN A1083 -11.997 6.969 -36.966 1.00103.26 C ATOM 2473 OE1 GLN A1083 -12.347 6.128 -37.808 1.00103.70 O ATOM 2474 NE2 GLN A1083 -12.877 7.573 -36.174 1.00 94.81 N ATOM 2475 HE22 GLN A1083 -12.554 8.274 -35.477 1.00 0.00 H ATOM 2476 HE21 GLN A1083 -13.889 7.344 -36.251 1.00 0.00 H ATOM 2477 H GLN A1083 -10.508 8.469 -34.375 1.00 0.00 H ATOM 2478 N ASP A1084 -7.481 8.991 -35.887 1.00 40.18 N ATOM 2479 CA ASP A1084 -6.333 9.581 -36.593 1.00 39.85 C ATOM 2480 C ASP A1084 -5.202 10.097 -35.701 1.00 43.50 C ATOM 2481 O ASP A1084 -4.090 10.346 -36.191 1.00 44.13 O ATOM 2482 CB ASP A1084 -6.794 10.660 -37.583 1.00 42.93 C ATOM 2483 CG ASP A1084 -7.731 10.133 -38.656 1.00 58.29 C ATOM 2484 OD1 ASP A1084 -8.767 10.785 -38.912 1.00 59.07 O ATOM 2485 OD2 ASP A1084 -7.452 9.037 -39.207 1.00 65.78 O ATOM 2486 H ASP A1084 -8.263 9.618 -35.609 1.00 0.00 H ATOM 2487 N ARG A1085 -5.477 10.225 -34.389 1.00 39.48 N ATOM 2488 CA ARG A1085 -4.523 10.671 -33.370 1.00 38.16 C ATOM 2489 C ARG A1085 -3.469 9.568 -33.211 1.00 42.38 C ATOM 2490 O ARG A1085 -3.846 8.388 -33.228 1.00 42.46 O ATOM 2491 CB ARG A1085 -5.257 10.908 -32.015 1.00 37.55 C ATOM 2492 CG ARG A1085 -6.273 12.052 -32.066 1.00 31.84 C ATOM 2493 CD ARG A1085 -7.090 12.274 -30.823 1.00 36.79 C ATOM 2494 NE ARG A1085 -8.261 13.083 -31.183 1.00 31.20 N ATOM 2495 CZ ARG A1085 -9.431 13.042 -30.569 1.00 39.36 C ATOM 2496 NH1 ARG A1085 -10.446 13.760 -31.020 1.00 31.52 N ATOM 2497 NH2 ARG A1085 -9.601 12.272 -29.499 1.00 33.07 N ATOM 2498 HE ARG A1085 -8.162 13.740 -31.984 1.00 0.00 H ATOM 2499 HH12 ARG A1085 -11.365 13.725 -30.534 1.00 0.00 H ATOM 2500 HH11 ARG A1085 -10.326 14.360 -31.861 1.00 0.00 H ATOM 2501 HH22 ARG A1085 -10.524 12.244 -29.020 1.00 0.00 H ATOM 2502 HH21 ARG A1085 -8.811 11.698 -29.141 1.00 0.00 H ATOM 2503 H ARG A1085 -6.440 9.989 -34.075 1.00 0.00 H ATOM 2504 N PRO A1086 -2.160 9.892 -33.068 1.00 38.19 N ATOM 2505 CA PRO A1086 -1.173 8.823 -32.866 1.00 38.12 C ATOM 2506 C PRO A1086 -1.421 8.091 -31.546 1.00 41.07 C ATOM 2507 O PRO A1086 -2.159 8.584 -30.696 1.00 39.98 O ATOM 2508 CB PRO A1086 0.173 9.563 -32.860 1.00 39.94 C ATOM 2509 CG PRO A1086 -0.157 10.978 -32.508 1.00 44.26 C ATOM 2510 CD PRO A1086 -1.529 11.232 -33.037 1.00 39.94 C ATOM 2511 N SER A1087 -0.875 6.883 -31.408 1.00 37.26 N ATOM 2512 CA SER A1087 -1.018 6.127 -30.164 1.00 36.24 C ATOM 2513 C SER A1087 0.084 6.608 -29.234 1.00 37.26 C ATOM 2514 O SER A1087 1.070 7.163 -29.717 1.00 37.51 O ATOM 2515 CB SER A1087 -0.843 4.630 -30.438 1.00 38.46 C ATOM 2516 OG SER A1087 0.515 4.325 -30.724 1.00 45.04 O ATOM 2517 HG SER A1087 0.605 3.354 -30.897 1.00 0.00 H ATOM 2518 H SER A1087 -0.338 6.471 -32.198 1.00 0.00 H ATOM 2519 N PHE A1088 -0.020 6.328 -27.914 1.00 34.94 N ATOM 2520 CA PHE A1088 1.067 6.661 -26.981 1.00 33.01 C ATOM 2521 C PHE A1088 2.323 5.838 -27.330 1.00 37.55 C ATOM 2522 O PHE A1088 3.438 6.341 -27.177 1.00 35.64 O ATOM 2523 CB PHE A1088 0.635 6.487 -25.499 1.00 33.41 C ATOM 2524 CG PHE A1088 -0.299 7.560 -24.969 1.00 32.36 C ATOM 2525 CD1 PHE A1088 0.138 8.873 -24.809 1.00 32.93 C ATOM 2526 CD2 PHE A1088 -1.604 7.253 -24.612 1.00 31.90 C ATOM 2527 CE1 PHE A1088 -0.722 9.858 -24.314 1.00 32.62 C ATOM 2528 CE2 PHE A1088 -2.459 8.237 -24.103 1.00 34.26 C ATOM 2529 CZ PHE A1088 -2.014 9.537 -23.973 1.00 32.32 C ATOM 2530 H PHE A1088 -0.882 5.870 -27.554 1.00 0.00 H ATOM 2531 N SER A1089 2.153 4.594 -27.861 1.00 37.74 N ATOM 2532 CA SER A1089 3.312 3.781 -28.289 1.00 39.45 C ATOM 2533 C SER A1089 4.004 4.382 -29.517 1.00 45.38 C ATOM 2534 O SER A1089 5.224 4.344 -29.593 1.00 46.51 O ATOM 2535 CB SER A1089 2.956 2.308 -28.497 1.00 45.50 C ATOM 2536 OG SER A1089 1.737 2.137 -29.201 1.00 59.18 O ATOM 2537 HG SER A1089 1.001 2.560 -28.691 1.00 0.00 H ATOM 2538 H SER A1089 1.192 4.210 -27.967 1.00 0.00 H ATOM 2539 N ALA A1090 3.250 5.021 -30.418 1.00 43.18 N ATOM 2540 CA ALA A1090 3.843 5.705 -31.570 1.00 43.69 C ATOM 2541 C ALA A1090 4.491 7.028 -31.124 1.00 46.88 C ATOM 2542 O ALA A1090 5.572 7.365 -31.613 1.00 45.94 O ATOM 2543 CB ALA A1090 2.786 5.960 -32.634 1.00 44.78 C ATOM 2544 H ALA A1090 2.217 5.033 -30.298 1.00 0.00 H ATOM 2545 N LEU A1091 3.864 7.753 -30.157 1.00 42.16 N ATOM 2546 CA LEU A1091 4.436 9.023 -29.658 1.00 40.31 C ATOM 2547 C LEU A1091 5.770 8.895 -28.915 1.00 43.63 C ATOM 2548 O LEU A1091 6.658 9.738 -29.102 1.00 43.02 O ATOM 2549 CB LEU A1091 3.424 9.801 -28.802 1.00 39.53 C ATOM 2550 CG LEU A1091 2.307 10.521 -29.553 1.00 42.83 C ATOM 2551 CD1 LEU A1091 1.149 10.838 -28.625 1.00 42.30 C ATOM 2552 CD2 LEU A1091 2.835 11.787 -30.290 1.00 41.43 C ATOM 2553 H LEU A1091 2.966 7.408 -29.762 1.00 0.00 H ATOM 2554 N GLY A1092 5.875 7.870 -28.062 1.00 40.17 N ATOM 2555 CA GLY A1092 7.036 7.583 -27.221 1.00 39.94 C ATOM 2556 C GLY A1092 8.391 7.628 -27.900 1.00 44.26 C ATOM 2557 O GLY A1092 9.224 8.458 -27.528 1.00 42.80 O ATOM 2558 H GLY A1092 5.063 7.224 -27.991 1.00 0.00 H ATOM 2559 N PRO A1093 8.634 6.787 -28.944 1.00 43.15 N ATOM 2560 CA PRO A1093 9.938 6.831 -29.642 1.00 42.80 C ATOM 2561 C PRO A1093 10.212 8.172 -30.322 1.00 43.56 C ATOM 2562 O PRO A1093 11.367 8.581 -30.395 1.00 43.29 O ATOM 2563 CB PRO A1093 9.832 5.695 -30.665 1.00 44.70 C ATOM 2564 CG PRO A1093 8.767 4.777 -30.102 1.00 49.76 C ATOM 2565 CD PRO A1093 7.773 5.733 -29.514 1.00 44.95 C ATOM 2566 N GLN A1094 9.159 8.871 -30.783 1.00 39.61 N ATOM 2567 CA GLN A1094 9.318 10.198 -31.405 1.00 39.32 C ATOM 2568 C GLN A1094 9.806 11.248 -30.373 1.00 42.32 C ATOM 2569 O GLN A1094 10.693 12.044 -30.676 1.00 40.72 O ATOM 2570 CB GLN A1094 8.020 10.644 -32.093 1.00 41.04 C ATOM 2571 CG GLN A1094 7.571 9.725 -33.235 1.00 45.05 C ATOM 2572 CD GLN A1094 6.390 10.310 -33.964 1.00 60.36 C ATOM 2573 OE1 GLN A1094 5.234 9.888 -33.781 1.00 55.58 O ATOM 2574 NE2 GLN A1094 6.649 11.322 -34.784 1.00 47.08 N ATOM 2575 HE22 GLN A1094 7.628 11.649 -34.913 1.00 0.00 H ATOM 2576 HE21 GLN A1094 5.873 11.787 -35.297 1.00 0.00 H ATOM 2577 H GLN A1094 8.206 8.464 -30.698 1.00 0.00 H ATOM 2578 N LEU A1095 9.257 11.213 -29.147 1.00 39.51 N ATOM 2579 CA LEU A1095 9.680 12.125 -28.068 1.00 39.54 C ATOM 2580 C LEU A1095 11.091 11.760 -27.610 1.00 46.18 C ATOM 2581 O LEU A1095 11.919 12.657 -27.440 1.00 46.05 O ATOM 2582 CB LEU A1095 8.675 12.122 -26.889 1.00 38.67 C ATOM 2583 CG LEU A1095 7.305 12.751 -27.182 1.00 42.61 C ATOM 2584 CD1 LEU A1095 6.228 12.258 -26.205 1.00 41.91 C ATOM 2585 CD2 LEU A1095 7.383 14.270 -27.238 1.00 42.49 C ATOM 2586 H LEU A1095 8.508 10.519 -28.952 1.00 0.00 H ATOM 2587 N ASP A1096 11.388 10.433 -27.499 1.00 45.32 N ATOM 2588 CA ASP A1096 12.723 9.911 -27.160 1.00 45.90 C ATOM 2589 C ASP A1096 13.757 10.383 -28.183 1.00 51.53 C ATOM 2590 O ASP A1096 14.845 10.795 -27.785 1.00 51.79 O ATOM 2591 CB ASP A1096 12.715 8.366 -27.077 1.00 48.38 C ATOM 2592 CG ASP A1096 11.924 7.777 -25.908 1.00 60.50 C ATOM 2593 OD1 ASP A1096 11.844 8.438 -24.847 1.00 59.45 O ATOM 2594 OD2 ASP A1096 11.393 6.648 -26.055 1.00 67.72 O ATOM 2595 H ASP A1096 10.624 9.747 -27.664 1.00 0.00 H ATOM 2596 N MET A1097 13.393 10.384 -29.492 1.00 49.09 N ATOM 2597 CA MET A1097 14.274 10.859 -30.569 1.00 49.46 C ATOM 2598 C MET A1097 14.493 12.367 -30.494 1.00 52.74 C ATOM 2599 O MET A1097 15.616 12.830 -30.711 1.00 52.55 O ATOM 2600 CB MET A1097 13.751 10.458 -31.959 1.00 51.89 C ATOM 2601 CG MET A1097 14.108 9.033 -32.348 1.00 56.04 C ATOM 2602 H MET A1097 12.447 10.032 -29.744 1.00 0.00 H ATOM 2603 N LEU A1098 13.431 13.137 -30.187 1.00 48.54 N ATOM 2604 CA LEU A1098 13.560 14.590 -30.059 1.00 48.16 C ATOM 2605 C LEU A1098 14.405 14.958 -28.855 1.00 52.36 C ATOM 2606 O LEU A1098 15.205 15.880 -28.951 1.00 50.88 O ATOM 2607 CB LEU A1098 12.199 15.305 -30.018 1.00 48.04 C ATOM 2608 CG LEU A1098 11.417 15.351 -31.326 1.00 52.34 C ATOM 2609 CD1 LEU A1098 10.029 15.904 -31.106 1.00 52.20 C ATOM 2610 CD2 LEU A1098 12.145 16.158 -32.388 1.00 54.65 C ATOM 2611 H LEU A1098 12.503 12.692 -30.038 1.00 0.00 H ATOM 2612 N TRP A1099 14.265 14.206 -27.738 1.00 52.01 N ATOM 2613 CA TRP A1099 15.033 14.419 -26.505 1.00 52.45 C ATOM 2614 C TRP A1099 16.539 14.271 -26.764 1.00 56.39 C ATOM 2615 O TRP A1099 17.313 15.125 -26.329 1.00 55.04 O ATOM 2616 CB TRP A1099 14.560 13.484 -25.375 1.00 51.61 C ATOM 2617 CG TRP A1099 15.361 13.646 -24.113 1.00 53.21 C ATOM 2618 CD1 TRP A1099 15.264 14.660 -23.210 1.00 56.12 C ATOM 2619 CD2 TRP A1099 16.456 12.828 -23.680 1.00 53.38 C ATOM 2620 NE1 TRP A1099 16.214 14.516 -22.229 1.00 55.45 N ATOM 2621 CE2 TRP A1099 16.947 13.388 -22.479 1.00 57.13 C ATOM 2622 CE3 TRP A1099 17.052 11.649 -24.172 1.00 54.92 C ATOM 2623 CZ2 TRP A1099 18.001 12.812 -21.757 1.00 56.87 C ATOM 2624 CZ3 TRP A1099 18.106 11.087 -23.463 1.00 56.63 C ATOM 2625 CH2 TRP A1099 18.572 11.668 -22.273 1.00 57.36 C ATOM 2626 HE1 TRP A1099 16.354 15.161 -21.425 1.00 0.00 H ATOM 2627 H TRP A1099 13.572 13.431 -27.754 1.00 0.00 H ATOM 2628 N SER A1100 16.938 13.205 -27.501 1.00 53.95 N ATOM 2629 CA SER A1100 18.330 12.940 -27.871 1.00 75.89 C ATOM 2630 C SER A1100 18.646 13.489 -29.264 1.00 95.08 C ATOM 2631 O SER A1100 18.298 14.623 -29.590 1.00 54.90 O ATOM 2632 CB SER A1100 18.615 11.444 -27.831 1.00 79.35 C ATOM 2633 OG SER A1100 20.012 11.203 -27.773 1.00 88.58 O ATOM 2634 HG SER A1100 20.177 10.227 -27.748 1.00 0.00 H ATOM 2635 H SER A1100 16.211 12.535 -27.823 1.00 0.00 H TER 2636 SER A1100 HETATM 2637 O HOH 1 15.665 17.384 -7.767 1.00 44.38 O HETATM 2638 O HOH 2 -8.050 -2.711 -27.057 1.00 42.46 O HETATM 2639 O HOH 3 5.519 5.530 -24.872 1.00 46.94 O HETATM 2640 O HOH 4 -1.111 -8.091 -18.027 1.00 35.31 O HETATM 2641 O HOH 5 12.508 7.128 16.922 1.00 51.12 O HETATM 2642 O HOH 6 -9.521 3.384 -26.058 1.00 31.60 O HETATM 2643 O HOH 7 -11.318 21.380 -25.179 1.00 32.82 O HETATM 2644 O HOH 8 -10.959 37.840 -27.402 1.00 50.66 O HETATM 2645 O HOH 9 -21.123 6.082 -15.397 1.00 67.51 O HETATM 2646 O HOH 10 1.967 35.199 -16.664 1.00 52.82 O HETATM 2647 O HOH 11 -10.791 18.858 -19.119 1.00 72.35 O HETATM 2648 O HOH 12 -12.138 15.193 -16.918 1.00 40.15 O HETATM 2649 O HOH 13 12.580 25.246 -23.250 1.00 48.51 O HETATM 2650 O HOH 14 -20.374 17.426 -23.149 1.00 63.04 O HETATM 2651 O HOH 15 -13.931 13.687 -32.593 1.00 48.17 O HETATM 2652 O HOH 16 -8.132 17.725 -17.334 1.00 51.76 O HETATM 2653 O HOH 17 7.555 19.281 2.172 1.00 48.75 O HETATM 2654 O HOH 18 18.163 14.454 -8.073 1.00 79.85 O HETATM 2655 O HOH 19 12.978 26.349 -27.127 1.00 43.80 O HETATM 2656 O HOH 20 -17.780 2.407 -12.271 1.00 59.03 O HETATM 2657 O HOH 21 0.599 21.427 -2.174 1.00 49.36 O HETATM 2658 O HOH 22 -12.586 9.324 -27.557 1.00 48.60 O HETATM 2659 O HOH 23 -7.533 16.322 -19.018 1.00 44.75 O HETATM 2660 O HOH 24 -3.783 -1.763 1.613 1.00 78.43 O HETATM 2661 O HOH 25 -6.326 22.215 -37.443 1.00 50.92 O HETATM 2662 O HOH 26 4.845 12.281 -36.445 1.00 51.80 O HETATM 2663 O HOH 27 -2.901 21.922 -15.462 1.00 26.43 O HETATM 2664 O HOH 28 -1.406 24.237 -6.689 1.00 60.18 O HETATM 2665 O HOH 29 -0.928 -4.815 -12.477 1.00 30.64 O HETATM 2666 O HOH 30 -1.329 25.160 -33.486 1.00 49.50 O HETATM 2667 O HOH 31 8.741 5.722 -5.271 1.00 55.05 O HETATM 2668 O HOH 32 -0.957 27.844 -15.546 1.00 51.08 O HETATM 2669 O HOH 33 -14.735 15.065 -16.420 1.00 41.64 O HETATM 2670 O HOH 34 5.019 22.143 -7.445 1.00 33.17 O HETATM 2671 O HOH 35 8.629 29.968 -4.921 1.00 66.93 O HETATM 2672 O HOH 36 5.331 -0.663 -15.503 1.00 41.01 O HETATM 2673 O HOH 37 -9.594 13.836 -21.548 1.00 32.95 O HETATM 2674 O HOH 38 -7.768 17.937 8.212 1.00 42.53 O HETATM 2675 O HOH 39 -5.910 6.847 -32.553 1.00 65.43 O HETATM 2676 O HOH 40 -5.405 5.899 -21.313 1.00 30.84 O HETATM 2677 O HOH 41 -11.548 14.446 -23.284 1.00 31.32 O HETATM 2678 O HOH 42 15.733 10.865 -15.056 1.00 45.27 O HETATM 2679 O HOH 43 -3.226 10.343 -6.738 1.00 34.96 O HETATM 2680 O HOH 44 14.658 28.128 -19.434 1.00 53.51 O HETATM 2681 O HOH 45 5.220 25.871 -35.517 1.00 58.38 O HETATM 2682 O HOH 46 17.571 17.123 -28.950 1.00 59.82 O HETATM 2683 O HOH 47 -8.400 10.584 -13.053 1.00 27.67 O HETATM 2684 O HOH 48 -8.653 21.221 -25.725 1.00 31.56 O HETATM 2685 O HOH 49 -6.638 -1.551 -0.603 1.00 38.99 O HETATM 2686 O HOH 50 -13.261 3.973 -11.956 1.00 60.46 O HETATM 2687 O HOH 51 -0.882 -5.556 4.244 1.00 62.21 O HETATM 2688 O HOH 52 -9.793 17.172 4.265 1.00 59.08 O HETATM 2689 O HOH 53 6.963 6.683 14.312 1.00 37.06 O HETATM 2690 O HOH 54 -8.208 35.184 -21.813 1.00 45.36 O HETATM 2691 O HOH 55 -15.120 29.928 -33.949 1.00 63.12 O HETATM 2692 O HOH 56 -4.148 10.558 14.320 1.00 57.22 O HETATM 2693 O HOH 57 -4.670 34.912 -29.607 1.00 38.39 O HETATM 2694 O HOH 58 0.866 -4.111 -14.269 1.00 35.69 O HETATM 2695 O HOH 59 6.072 9.068 1.156 1.00 34.91 O HETATM 2696 O HOH 60 8.640 26.770 -25.711 1.00 31.74 O HETATM 2697 O HOH 61 -5.309 8.683 -7.275 1.00 30.75 O HETATM 2698 O HOH 62 11.213 6.224 13.318 1.00 58.97 O HETATM 2699 O HOH 63 0.723 -0.192 -6.882 1.00 57.03 O HETATM 2700 O HOH 64 -17.109 1.191 -21.826 1.00 71.55 O HETATM 2701 O HOH 65 -7.215 17.453 -10.013 1.00 52.67 O HETATM 2702 O HOH 66 6.754 5.707 -33.398 1.00 54.91 O HETATM 2703 O HOH 67 6.461 5.970 9.024 1.00 53.26 O HETATM 2704 O HOH 68 -11.522 6.096 -10.399 1.00 35.97 O HETATM 2705 O HOH 69 6.136 1.762 -16.592 1.00 38.92 O HETATM 2706 O HOH 70 -2.528 20.470 -8.629 1.00 34.63 O HETATM 2707 O HOH 71 7.053 29.284 -24.037 1.00 32.48 O HETATM 2708 O HOH 72 -7.110 12.846 -20.002 1.00 28.10 O HETATM 2709 O HOH 73 -0.058 27.843 -10.401 1.00 54.10 O HETATM 2710 O HOH 74 -13.286 22.329 -12.179 1.00 59.04 O HETATM 2711 O HOH 75 9.250 15.427 -4.834 1.00 25.31 O HETATM 2712 O HOH 76 -3.785 32.384 -31.174 1.00 49.32 O HETATM 2713 O HOH 77 0.877 -3.982 -18.946 1.00 29.68 O HETATM 2714 O HOH 78 15.178 17.384 -31.214 1.00 60.96 O HETATM 2715 O HOH 79 -6.874 1.138 9.270 1.00 52.71 O HETATM 2716 O HOH 80 -9.841 11.181 -21.749 1.00 33.81 O HETATM 2717 O HOH 81 -8.447 18.372 -12.244 1.00 47.17 O HETATM 2718 O HOH 82 3.096 11.929 16.424 1.00 48.90 O HETATM 2719 O HOH 83 -6.778 -3.714 -7.580 1.00 38.81 O HETATM 2720 O HOH 84 -8.435 1.332 -28.687 1.00 51.46 O HETATM 2721 O HOH 85 -12.848 9.198 2.397 1.00 37.85 O HETATM 2722 O HOH 86 -3.697 16.691 -36.932 1.00 43.92 O HETATM 2723 O HOH 87 -6.127 -2.737 2.396 1.00 71.58 O HETATM 2724 O HOH 88 -5.376 23.238 -29.580 1.00 31.77 O HETATM 2725 O HOH 89 -5.267 12.667 6.028 1.00 46.75 O HETATM 2726 O HOH 90 19.544 16.087 -12.774 1.00 59.09 O HETATM 2727 O HOH 91 -9.432 14.013 -7.372 1.00 55.79 O HETATM 2728 O HOH 92 -4.997 30.609 -16.525 1.00 48.29 O HETATM 2729 O HOH 93 -6.096 9.476 10.903 1.00 45.14 O HETATM 2730 O HOH 94 -11.115 7.853 12.401 1.00 37.21 O HETATM 2731 O HOH 95 3.194 0.367 2.071 1.00 64.03 O HETATM 2732 O HOH 96 -2.978 23.354 5.536 1.00 39.06 O HETATM 2733 O HOH 97 5.776 30.012 -16.410 1.00 35.46 O HETATM 2734 O HOH 98 0.256 27.575 -19.811 1.00 30.49 O HETATM 2735 O HOH 99 -11.962 -4.388 -27.309 1.00 54.42 O HETATM 2736 O HOH 100 -7.944 21.013 1.172 1.00 64.30 O HETATM 2737 O HOH 101 -10.064 33.178 -33.141 1.00 53.26 O HETATM 2738 O HOH 102 -8.897 14.269 6.916 1.00 46.20 O HETATM 2739 O HOH 103 -6.952 19.386 -36.532 1.00 74.14 O HETATM 2740 O HOH 104 7.138 16.283 -35.221 1.00 40.15 O HETATM 2741 O HOH 105 6.313 4.903 -8.939 1.00 37.89 O HETATM 2742 O HOH 106 -4.648 -4.361 -22.673 1.00 48.30 O HETATM 2743 O HOH 107 -8.880 13.432 -38.112 1.00 42.94 O HETATM 2744 O HOH 108 11.750 21.353 -33.964 1.00 63.18 O HETATM 2745 O HOH 109 -2.498 5.275 -27.241 1.00 49.49 O HETATM 2746 O HOH 110 1.916 18.870 -3.415 1.00 31.83 O HETATM 2747 O HOH 111 4.385 19.328 -1.693 1.00 54.30 O HETATM 2748 O HOH 112 5.849 6.044 1.918 1.00 48.19 O HETATM 2749 O HOH 113 -9.423 19.972 -17.129 1.00 48.13 O HETATM 2750 O HOH 114 -11.002 17.796 -12.638 1.00 52.81 O HETATM 2751 O HOH 115 -11.540 5.906 -30.069 1.00 58.43 O HETATM 2752 O HOH 116 -10.973 -4.001 -18.074 1.00 38.65 O HETATM 2753 O HOH 117 -0.572 1.450 -24.718 1.00 33.27 O HETATM 2754 O HOH 118 -11.422 0.013 -9.937 1.00 47.38 O HETATM 2755 O HOH 119 1.006 28.560 -34.052 1.00 38.39 O HETATM 2756 O HOH 120 -3.364 5.251 -22.816 1.00 29.25 O HETATM 2757 O HOH 121 -13.540 2.466 6.067 1.00 86.88 O HETATM 2758 O HOH 122 4.439 0.823 -1.890 1.00 51.73 O HETATM 2759 O HOH 123 0.622 2.932 -7.881 1.00 33.56 O HETATM 2760 O HOH 124 1.246 17.879 -37.417 1.00 37.42 O HETATM 2761 O HOH 125 -2.755 22.046 -4.417 1.00 53.29 O HETATM 2762 O HOH 126 -2.411 28.470 -12.927 1.00 67.69 O HETATM 2763 O HOH 127 -18.891 13.240 -0.557 1.00 69.67 O HETATM 2764 O HOH 128 -14.061 7.310 -12.232 1.00 40.25 O HETATM 2765 O HOH 129 -10.124 15.737 -19.645 1.00 59.43 O HETATM 2766 O HOH 130 -0.075 3.226 -26.801 1.00 49.40 O HETATM 2767 O HOH 131 8.958 7.135 -2.020 1.00 73.87 O HETATM 2768 O HOH 132 4.423 28.219 -9.024 1.00 42.38 O HETATM 2769 O HOH 133 -5.289 -0.609 -12.561 1.00 40.47 O HETATM 2770 O HOH 134 -19.016 -8.981 -26.776 1.00 45.35 O HETATM 2771 O HOH 135 -4.692 7.404 -30.249 1.00 48.40 O HETATM 2772 O HOH 136 -7.285 -3.311 -15.616 1.00 53.59 O HETATM 2773 O HOH 137 -1.177 -5.586 -8.354 1.00 55.13 O HETATM 2774 O HOH 138 4.017 35.662 -20.226 1.00 52.29 O HETATM 2775 O HOH 139 -3.723 29.767 -32.603 1.00 52.73 O HETATM 2776 O HOH 140 -14.994 -1.896 -16.589 1.00 61.59 O HETATM 2777 O HOH 141 -6.463 -3.539 -24.449 1.00 89.88 O HETATM 2778 O HOH 142 -5.834 27.121 -17.877 1.00 37.21 O HETATM 2779 O HOH 143 -5.227 25.632 -36.674 1.00 55.63 O HETATM 2780 O HOH 144 -4.653 19.807 -34.792 1.00 41.79 O HETATM 2781 O HOH 145 10.698 13.390 -3.918 1.00 38.35 O HETATM 2782 O HOH 146 -3.661 -2.557 -13.479 1.00 31.58 O HETATM 2783 O HOH 147 -15.009 -0.153 -29.166 1.00 37.45 O HETATM 2784 O HOH 148 -10.017 10.480 -41.490 1.00 63.64 O HETATM 2785 O HOH 149 11.878 8.550 -20.734 1.00 56.94 O HETATM 2786 O HOH 150 8.739 32.327 -30.565 1.00 51.04 O HETATM 2787 O HOH 151 -14.381 34.514 -24.899 1.00 56.05 O HETATM 2788 O HOH 152 -11.089 31.539 -20.078 1.00 56.82 O HETATM 2789 O HOH 153 -17.179 15.227 -32.027 1.00 61.53 O HETATM 2790 O HOH 154 2.203 32.019 -14.699 1.00 40.54 O HETATM 2791 O HOH 155 18.187 19.049 -19.445 1.00 49.84 O HETATM 2792 O HOH 156 -3.076 -3.147 -0.381 1.00 56.41 O HETATM 2793 O HOH 157 6.630 29.427 -31.617 1.00 45.69 O HETATM 2794 O HOH 158 8.402 22.715 -5.699 1.00 62.51 O HETATM 2795 O HOH 159 1.873 0.436 7.434 1.00 61.19 O HETATM 2796 O HOH 160 -15.458 15.744 -13.841 1.00 55.00 O HETATM 2797 O HOH 161 -20.855 15.519 -2.811 1.00 81.15 O HETATM 2798 O HOH 162 -12.975 8.931 -6.719 1.00 71.46 O HETATM 2799 O HOH 163 -17.806 15.237 -21.029 1.00 49.43 O HETATM 2800 O HOH 164 5.607 2.139 -19.839 1.00 46.61 O HETATM 2801 O HOH 165 3.176 2.926 -9.682 1.00 29.85 O HETATM 2802 O HOH 166 -5.038 -4.665 -14.098 1.00 43.46 O HETATM 2803 O HOH 167 17.630 22.111 -17.702 1.00 56.90 O HETATM 2804 O HOH 168 1.353 20.662 -5.505 1.00 37.45 O HETATM 2805 O HOH 169 -0.429 5.884 -34.161 1.00 53.43 O HETATM 2806 O HOH 170 -20.068 3.341 -22.073 1.00 55.49 O HETATM 2807 O HOH 171 2.316 -0.192 -4.750 1.00 46.08 O HETATM 2808 O HOH 172 9.897 31.989 -11.926 1.00 53.81 O HETATM 2809 O HOH 173 -13.759 1.252 -14.037 1.00 54.30 O HETATM 2810 O HOH 174 -6.635 3.525 14.671 1.00 47.85 O HETATM 2811 O HOH 175 -11.311 12.483 -6.447 1.00 63.53 O HETATM 2812 O HOH 176 -3.555 14.102 13.693 1.00 39.75 O HETATM 2813 O HOH 177 -7.997 32.331 -17.781 1.00 53.32 O HETATM 2814 O HOH 178 -5.476 21.863 -5.290 1.00 42.50 O HETATM 2815 O HOH 179 -5.372 27.829 -35.058 1.00 45.35 O HETATM 2816 O HOH 180 -15.505 2.585 12.492 1.00107.60 O HETATM 2817 O HOH 181 -7.651 2.414 11.468 1.00 49.97 O HETATM 2818 O HOH 182 9.611 11.068 5.309 1.00 49.39 O HETATM 2819 O HOH 183 -12.377 19.204 -4.856 1.00 53.04 O HETATM 2820 O HOH 184 -0.658 -5.399 6.874 1.00 94.63 O HETATM 2821 O HOH 185 8.589 10.367 2.833 1.00 49.44 O HETATM 2822 O HOH 186 11.098 22.944 -5.562 1.00 60.79 O HETATM 2823 O HOH 187 2.588 30.767 -32.503 1.00 40.63 O HETATM 2824 O HOH 188 -14.868 -0.702 4.648 1.00 68.64 O HETATM 2825 O HOH 189 -14.873 -6.955 -19.424 1.00 46.25 O HETATM 2826 O HOH 190 6.904 31.147 -22.184 1.00 53.09 O HETATM 2827 O HOH 191 12.609 24.604 -34.099 1.00 52.62 O HETATM 2828 O HOH 192 8.889 12.208 0.984 1.00 47.47 O HETATM 2829 O HOH 193 9.468 11.022 -2.833 1.00 53.28 O HETATM 2830 O HOH 194 6.667 24.313 -7.140 1.00 44.40 O HETATM 2831 O HOH 195 -7.178 24.470 -14.625 1.00 49.89 O HETATM 2832 O HOH 196 13.258 8.741 -18.217 1.00 46.51 O HETATM 2833 O HOH 197 -9.296 -1.071 -0.586 1.00 65.68 O HETATM 2834 O HOH 198 -1.287 25.867 -17.782 1.00 42.74 O HETATM 2835 O HOH 199 8.223 1.500 -15.023 1.00 36.94 O HETATM 2836 O HOH 200 -9.144 36.861 -30.984 1.00 45.94 O HETATM 2837 O HOH 201 10.239 5.501 -8.608 1.00 61.18 O HETATM 2838 O HOH 202 7.673 1.177 -10.114 1.00 59.81 O HETATM 2839 O HOH 203 2.651 37.809 -19.537 1.00 46.51 O HETATM 2840 O HOH 204 -16.274 -0.679 9.183 1.00 62.78 O HETATM 2841 O HOH 205 -3.534 6.692 -36.143 1.00 71.30 O HETATM 2842 O HOH 206 16.278 18.527 -26.950 1.00 62.44 O HETATM 2843 O HOH 207 -18.920 20.347 -19.118 1.00 47.56 O HETATM 2844 O HOH 208 8.803 1.801 -3.336 1.00 57.50 O HETATM 2845 O HOH 209 -10.283 2.933 12.770 1.00 55.46 O HETATM 2846 O HOH 210 18.964 18.406 -27.244 1.00 61.01 O HETATM 2847 O HOH 211 12.157 27.767 -31.679 1.00 74.41 O HETATM 2848 O HOH 212 -22.357 3.766 -26.448 1.00 61.11 O HETATM 2849 O HOH 213 17.316 16.436 -19.624 1.00 33.14 O HETATM 2850 O HOH 214 3.021 22.692 -5.674 1.00 57.16 O HETATM 2851 O HOH 215 13.138 10.314 -2.960 1.00 60.21 O HETATM 2852 O HOH 216 -18.884 10.189 -7.167 1.00116.42 O HETATM 2853 O HOH 217 -16.271 1.918 -17.698 1.00 62.78 O HETATM 2854 O HOH 218 2.678 25.546 -38.322 1.00 77.57 O HETATM 2855 O HOH 219 -22.433 10.453 -1.034 1.00 67.84 O HETATM 2856 O HOH 220 -3.301 23.526 0.234 1.00 54.65 O HETATM 2857 O HOH 221 7.291 -2.343 -12.756 1.00 54.50 O HETATM 2858 O HOH 222 -11.447 8.974 -39.728 1.00 65.17 O HETATM 2859 O HOH 223 0.324 25.704 -37.135 1.00 51.88 O HETATM 2860 O HOH 224 5.155 1.453 -8.625 1.00 41.23 O HETATM 2861 O HOH 225 -6.693 21.376 -27.618 1.00 31.41 O HETATM 2862 O HOH 226 -17.289 24.396 -37.187 1.00 70.84 O HETATM 2863 O HOH 227 -11.561 -4.591 3.128 1.00 70.60 O HETATM 2864 O HOH 228 -7.776 -2.401 -11.457 1.00 47.70 O HETATM 2865 O HOH 229 -1.417 1.346 -31.012 1.00 62.95 O HETATM 2866 O HOH 230 -5.186 21.054 -8.152 1.00 46.03 O HETATM 2867 O HOH 231 -13.796 7.478 -29.129 1.00 62.97 O HETATM 2868 O HOH 232 -4.449 24.413 -14.571 1.00 32.18 O HETATM 2869 O HOH 233 -6.266 23.683 -9.755 1.00 60.56 O HETATM 2870 O HOH 234 8.152 5.439 -24.933 1.00 47.63 O HETATM 2871 O HOH 235 8.477 19.932 -37.842 1.00 63.73 O HETATM 2872 O HOH 236 -16.120 1.618 5.637 1.00 65.66 O HETATM 2873 O HOH 237 -13.598 24.359 -4.740 1.00 55.62 O HETATM 2874 O HOH 238 11.228 25.302 -25.537 1.00 39.71 O HETATM 2875 O HOH 239 -17.566 14.496 3.649 1.00 70.23 O HETATM 2876 O HOH 240 4.827 31.959 -14.632 1.00 58.94 O HETATM 2877 O HOH 241 -18.058 31.911 -24.607 1.00 62.74 O HETATM 2878 O HOH 242 21.089 17.708 -26.075 1.00 70.54 O HETATM 2879 O HOH 243 -1.492 1.246 21.846 1.00 67.14 O HETATM 2880 O HOH 244 -8.274 26.068 -16.480 1.00 37.73 O HETATM 2881 O HOH 245 -0.662 31.447 -12.005 1.00 53.05 O HETATM 2882 O HOH 246 -3.422 28.739 -15.352 1.00 67.34 O HETATM 2883 O HOH 247 -17.935 18.736 -20.924 1.00 66.21 O HETATM 2884 O HOH 248 -1.392 17.935 -38.219 1.00 49.77 O HETATM 2885 O HOH 249 2.510 -7.929 7.451 1.00 62.53 O HETATM 2886 O HOH 250 3.282 28.440 -35.481 1.00 63.86 O HETATM 2887 O HOH 251 10.790 6.567 21.898 1.00 56.85 O HETATM 2888 O HOH 252 -4.506 -5.197 -6.815 1.00 44.61 O HETATM 2889 O HOH 253 -10.773 14.392 -39.762 1.00 47.94 O HETATM 2890 O HOH 254 -3.675 26.306 -16.471 1.00 43.12 O HETATM 2891 O HOH 255 4.173 22.630 -3.163 1.00 66.83 O HETATM 2892 O HOH 256 -1.190 20.950 -6.220 1.00 47.41 O HETATM 2893 O HOH 257 6.532 3.033 -33.530 1.00 63.90 O HETATM 2894 O HOH 258 -3.089 3.973 -25.128 1.00 33.85 O HETATM 2895 O HOH 259 -3.940 21.697 -36.786 1.00 40.92 O HETATM 2896 O HOH 260 -2.852 24.379 -35.705 1.00 48.52 O HETATM 2897 O HOH 261 5.820 4.580 6.814 1.00 51.51 O HETATM 2898 O HOH 262 9.854 7.947 3.330 1.00 65.25 O HETATM 2899 O HOH 263 -5.902 18.009 -38.458 1.00 57.11 O HETATM 2900 N3 G A 54 1.454 12.112 -3.575 1.00 -0.26 N HETATM 2901 C13 G A 54 1.574 13.463 -3.457 1.00 0.15 C HETATM 2902 N2 G A 54 2.650 14.149 -3.012 1.00 -0.26 N HETATM 2903 C12 G A 54 2.459 15.469 -3.049 1.00 0.07 C HETATM 2904 N1 G A 54 1.383 16.145 -3.469 1.00 -0.28 N HETATM 2905 C11 G A 54 0.319 15.445 -3.897 1.00 0.06 C HETATM 2906 C1 G A 54 -0.823 16.230 -4.439 1.00 0.03 C HETATM 2907 C6 G A 54 -1.613 15.712 -5.468 1.00 -0.03 C HETATM 2908 C5 G A 54 -2.697 16.419 -5.988 1.00 -0.02 C HETATM 2909 C4 G A 54 -3.002 17.671 -5.466 1.00 -0.01 C HETATM 2910 C7 G A 54 -4.174 18.284 -6.194 1.00 -0.01 C HETATM 2911 C8 G A 54 -4.332 17.404 -7.457 1.00 -0.04 C HETATM 2912 C9 G A 54 -3.628 16.035 -7.128 1.00 0.06 C HETATM 2913 C10 G A 54 -2.843 15.518 -8.338 1.00 -0.06 C HETATM 2914 H10 G A 54 -2.362 14.562 -8.082 1.00 0.01 H HETATM 2915 H11 G A 54 -2.073 16.253 -8.617 1.00 0.01 H HETATM 2916 H12 G A 54 -3.530 15.367 -9.184 1.00 0.01 H HETATM 2917 N4 G A 54 -4.670 15.075 -6.660 1.00 -0.25 N HETATM 2918 C17 G A 54 -4.360 13.812 -6.244 1.00 0.18 C HETATM 2919 N5 G A 54 -4.012 12.755 -5.918 1.00 -0.36 N HETATM 2920 H15 G A 54 -5.655 15.375 -6.650 1.00 0.20 H HETATM 2921 H5 G A 54 -3.848 17.884 -8.320 1.00 0.02 H HETATM 2922 H6 G A 54 -5.397 17.242 -7.678 1.00 0.02 H HETATM 2923 H2 G A 54 -3.961 19.328 -6.469 1.00 0.05 H HETATM 2924 H3 G A 54 -5.082 18.246 -5.575 1.00 0.05 H HETATM 2925 C3 G A 54 -2.221 18.200 -4.440 1.00 -0.03 C HETATM 2926 C2 G A 54 -1.147 17.488 -3.936 1.00 -0.03 C HETATM 2927 H8 G A 54 -0.549 17.915 -3.139 1.00 0.09 H HETATM 2928 H9 G A 54 -2.457 19.177 -4.034 1.00 0.06 H HETATM 2929 H4 G A 54 -1.377 14.735 -5.873 1.00 0.09 H HETATM 2930 C14 G A 54 0.325 14.047 -3.900 1.00 0.03 C HETATM 2931 C16 G A 54 -0.507 12.938 -4.259 1.00 -0.05 C HETATM 2932 C15 G A 54 0.210 11.804 -4.053 1.00 0.03 C HETATM 2933 H14 G A 54 -0.153 10.795 -4.241 1.00 0.10 H HETATM 2934 H7 G A 54 -1.529 12.994 -4.630 1.00 0.03 H HETATM 2935 H13 G A 54 3.284 16.074 -2.692 1.00 0.10 H HETATM 2936 H1 G A 54 2.187 11.427 -3.341 1.00 0.23 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 422 423 430 431 432 CONECT 430 422 CONECT 431 422 CONECT 432 422 CONECT 727 728 734 735 736 CONECT 734 727 CONECT 735 727 CONECT 736 727 CONECT 2114 2115 2119 2120 2121 CONECT 2119 2114 CONECT 2120 2114 CONECT 2121 2114 CONECT 2900 2901 2932 2936 CONECT 2901 2900 2902 2930 CONECT 2902 2901 2903 CONECT 2903 2902 2904 2935 CONECT 2904 2903 2905 CONECT 2905 2904 2906 2930 CONECT 2906 2905 2907 2926 CONECT 2907 2906 2908 2929 CONECT 2908 2907 2909 2912 CONECT 2909 2908 2910 2925 CONECT 2910 2909 2911 2923 2924 CONECT 2911 2910 2912 2921 2922 CONECT 2912 2908 2911 2913 2917 CONECT 2913 2912 2914 2915 2916 CONECT 2914 2913 CONECT 2915 2913 CONECT 2916 2913 CONECT 2917 2912 2918 2920 CONECT 2918 2917 2919 CONECT 2919 2918 CONECT 2920 2917 CONECT 2921 2911 CONECT 2922 2911 CONECT 2923 2910 CONECT 2924 2910 CONECT 2925 2909 2926 2928 CONECT 2926 2906 2925 2927 CONECT 2927 2926 CONECT 2928 2925 CONECT 2929 2907 CONECT 2930 2901 2905 2931 CONECT 2931 2930 2932 2934 CONECT 2932 2900 2931 2933 CONECT 2933 2932 CONECT 2934 2931 CONECT 2935 2903 CONECT 2936 2900 MASTER 0 0 0 0 0 0 0 0 2932 4 52 23 END
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Structure:
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Related entries of code: 6db3
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%
5lwn
RCSB PDB
PDBbind
294aa, >5LWN_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%
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
6db3
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK3
Ligand Name
G54
EC.Number
E.C.2.7.10.2
Resolution
1.97(Å)
Affinity (Kd/Ki/IC50)
IC50=56nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 10665-10699
Ligand Properties
Formula
C
1
7
H
1
5
N
5
Molecular Weight
289.335
Exact Mass
289.133
No. of atoms
37
No. of bonds
40
Polar Surface Area
77.39
LOGP Value
2.91 (
Computed with XLOGP3
)
3.25 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
N#CN[C@@]1(C)CCc2c1cc(cc2)c1ncnc2c1cc[nH]2
InChI String
InChI=1S/C17H15N5/c1-17(22-9-18)6-4-11-2-3-12(8-14(11)17)15-13-5-7-19-16(13)21-10-20-15/h2-3,5,7-8,10,22H,4,6H2,1H3,(H,19,20,21)/t17-/m0/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
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