Browse entries in the PDBbind-CN Database
HEADER 5TQ3_COMPLEX COMPND 5TQ3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 168 GLN PHE GLU GLU ARG HIS LEU LYS PHE LEU GLN GLN LEU SEQRES 2 A 168 GLY LYS GLY ASN PHE GLY SER VAL GLU MET CYS ARG TYR SEQRES 3 A 168 ASP PRO LEU GLN ASP ASN THR GLY GLU VAL VAL ALA VAL SEQRES 4 A 168 LYS LYS LEU GLN HIS SER THR GLU GLU HIS LEU ARG ASP SEQRES 5 A 168 PHE GLU ARG GLU ILE GLU ILE LEU LYS SER LEU GLN HIS SEQRES 6 A 168 ASP ASN ILE VAL LYS TYR LYS GLY VAL CYS TYR SER ALA SEQRES 7 A 168 GLY ARG ARG ASN LEU LYS LEU ILE MET GLU TYR LEU PRO SEQRES 8 A 168 TYR GLY SER LEU ARG ASP TYR LEU GLN LYS HIS LYS GLU SEQRES 9 A 168 ARG ILE ASP HIS ILE LYS LEU LEU GLN TYR THR SER GLN SEQRES 10 A 168 ILE CYS LYS GLY MET GLU TYR LEU GLY THR LYS ARG TYR SEQRES 11 A 168 ILE HIS ARG ASP LEU ALA THR ARG ASN ILE LEU VAL GLU SEQRES 12 A 168 ASN GLU ASN ARG VAL LYS ILE GLY ASP PHE GLY LEU THR SEQRES 13 A 168 LYS VAL LEU PRO GLN ASP LYS GLU PTR PTR LYS VAL SEQRES 1 A 55 PRO GLY GLU SER PRO ILE PHE TRP TYR ALA PRO GLU SER SEQRES 2 A 55 LEU THR GLU SER LYS PHE SER VAL ALA SER ASP VAL TRP SEQRES 3 A 55 SER PHE GLY VAL VAL LEU TYR GLU LEU PHE THR TYR ILE SEQRES 4 A 55 GLU LYS SER LYS SER PRO PRO ALA GLU PHE MET ARG MET SEQRES 5 A 55 ILE GLY ASN SEQRES 1 A 61 GLN SER ILE VAL THR HIS LEU ILE GLU LEU LEU LYS ASN SEQRES 2 A 61 ASN GLY ARG LEU PRO ARG PRO ASP GLY CYS PRO ASP GLU SEQRES 3 A 61 ILE TYR MET ILE MET THR GLU CYS TRP ASN ASN ASN VAL SEQRES 4 A 61 ASN GLN ARG PRO SER PHE ARG ASP LEU ALA LEU ARG VAL SEQRES 5 A 61 ASP GLN VAL ARG ASP ASN MET ALA GLY HET PTR A1007 17 HET PTR A1008 17 HET UNN A 311 45 ATOM 1 N GLN A 843 1.606 -18.207 2.864 1.00 49.56 N ATOM 2 CA GLN A 843 3.038 -18.604 2.732 1.00 49.14 C ATOM 3 C GLN A 843 3.769 -17.773 1.673 1.00 47.57 C ATOM 4 O GLN A 843 3.423 -17.815 0.494 1.00 48.82 O ATOM 5 CB GLN A 843 3.145 -20.095 2.407 1.00 47.18 C ATOM 6 CG GLN A 843 2.679 -20.995 3.538 1.00 49.04 C ATOM 7 CD GLN A 843 3.458 -20.779 4.842 1.00 52.19 C ATOM 8 OE1 GLN A 843 4.696 -20.694 4.843 1.00 50.17 O ATOM 9 NE2 GLN A 843 2.732 -20.694 5.956 1.00 50.89 N ATOM 10 HE22 GLN A 843 1.696 -20.771 5.909 1.00 0.00 H ATOM 11 HE21 GLN A 843 3.201 -20.551 6.873 1.00 0.00 H ATOM 12 HN3 GLN A 843 1.124 -18.345 1.953 1.00 0.00 H ATOM 13 HN2 GLN A 843 1.549 -17.206 3.140 1.00 0.00 H ATOM 14 HN1 GLN A 843 1.150 -18.795 3.591 1.00 0.00 H ATOM 15 N PHE A 844 4.790 -17.035 2.109 1.00 46.26 N ATOM 16 CA PHE A 844 5.513 -16.096 1.251 1.00 44.63 C ATOM 17 C PHE A 844 6.868 -16.653 0.857 1.00 47.09 C ATOM 18 O PHE A 844 7.631 -17.097 1.711 1.00 46.90 O ATOM 19 CB PHE A 844 5.696 -14.767 1.971 1.00 41.40 C ATOM 20 CG PHE A 844 4.419 -13.994 2.137 1.00 40.31 C ATOM 21 CD1 PHE A 844 3.478 -14.372 3.078 1.00 40.38 C ATOM 22 CD2 PHE A 844 4.160 -12.886 1.351 1.00 39.23 C ATOM 23 CE1 PHE A 844 2.294 -13.660 3.222 1.00 39.74 C ATOM 24 CE2 PHE A 844 2.987 -12.177 1.490 1.00 39.24 C ATOM 25 CZ PHE A 844 2.052 -12.563 2.427 1.00 39.28 C ATOM 26 H PHE A 844 5.085 -17.131 3.102 1.00 0.00 H ATOM 27 N GLU A 845 7.164 -16.624 -0.440 1.00 50.70 N ATOM 28 CA GLU A 845 8.423 -17.161 -0.961 1.00 50.17 C ATOM 29 C GLU A 845 9.453 -16.048 -1.188 1.00 49.14 C ATOM 30 O GLU A 845 9.184 -15.051 -1.863 1.00 43.94 O ATOM 31 CB GLU A 845 8.174 -17.974 -2.236 1.00 49.07 C ATOM 32 CG GLU A 845 7.584 -19.361 -1.946 1.00 50.59 C ATOM 33 CD GLU A 845 6.673 -19.880 -3.050 1.00 49.59 C ATOM 34 H GLU A 845 6.480 -16.207 -1.104 1.00 0.00 H ATOM 35 N GLU A 846 10.633 -16.239 -0.603 1.00 48.73 N ATOM 36 CA GLU A 846 11.702 -15.253 -0.638 1.00 48.49 C ATOM 37 C GLU A 846 11.902 -14.665 -2.035 1.00 47.75 C ATOM 38 O GLU A 846 11.958 -13.447 -2.191 1.00 46.51 O ATOM 39 CB GLU A 846 13.007 -15.879 -0.133 1.00 46.74 C ATOM 40 CG GLU A 846 14.209 -14.949 -0.166 1.00 45.99 C ATOM 41 CD GLU A 846 14.427 -14.229 1.137 1.00 49.91 C ATOM 42 OE1 GLU A 846 14.863 -14.893 2.110 1.00 59.82 O ATOM 43 OE2 GLU A 846 14.192 -13.003 1.189 1.00 48.56 O ATOM 44 H GLU A 846 10.798 -17.133 -0.098 1.00 0.00 H ATOM 45 N ARG A 847 11.995 -15.521 -3.048 1.00 48.00 N ATOM 46 CA ARG A 847 12.285 -15.046 -4.409 1.00 48.60 C ATOM 47 C ARG A 847 11.338 -13.923 -4.889 1.00 48.18 C ATOM 48 O ARG A 847 11.752 -13.066 -5.677 1.00 52.52 O ATOM 49 CB ARG A 847 12.378 -16.205 -5.422 1.00 51.16 C ATOM 50 CG ARG A 847 11.169 -17.134 -5.516 1.00 58.12 C ATOM 51 CD ARG A 847 11.509 -18.586 -5.877 1.00 63.25 C ATOM 52 NE ARG A 847 10.564 -19.533 -5.266 1.00 66.69 N ATOM 53 CZ ARG A 847 9.373 -19.880 -5.769 1.00 70.86 C ATOM 54 NH1 ARG A 847 8.931 -19.384 -6.925 1.00 72.52 N ATOM 55 NH2 ARG A 847 8.612 -20.751 -5.110 1.00 71.05 N ATOM 56 HE ARG A 847 10.845 -19.971 -4.366 1.00 0.00 H ATOM 57 HH12 ARG A 847 8.001 -19.671 -7.292 1.00 0.00 H ATOM 58 HH11 ARG A 847 9.516 -18.710 -7.459 1.00 0.00 H ATOM 59 HH22 ARG A 847 7.685 -21.026 -5.493 1.00 0.00 H ATOM 60 HH21 ARG A 847 8.944 -21.156 -4.212 1.00 0.00 H ATOM 61 H ARG A 847 11.861 -16.538 -2.876 1.00 0.00 H ATOM 62 N HIS A 848 10.110 -13.882 -4.369 1.00 45.45 N ATOM 63 CA HIS A 848 9.114 -12.895 -4.809 1.00 46.82 C ATOM 64 C HIS A 848 9.099 -11.655 -3.901 1.00 45.47 C ATOM 65 O HIS A 848 8.301 -10.736 -4.108 1.00 42.09 O ATOM 66 CB HIS A 848 7.716 -13.518 -4.836 1.00 49.63 C ATOM 67 CG HIS A 848 7.646 -14.842 -5.544 1.00 55.40 C ATOM 68 ND1 HIS A 848 6.687 -15.137 -6.488 1.00 57.07 N ATOM 69 CD2 HIS A 848 8.404 -15.955 -5.428 1.00 56.32 C ATOM 70 CE1 HIS A 848 6.861 -16.369 -6.927 1.00 54.74 C ATOM 71 NE2 HIS A 848 7.901 -16.886 -6.303 1.00 56.50 N ATOM 72 H HIS A 848 9.850 -14.568 -3.632 1.00 0.00 H ATOM 73 N LEU A 849 10.004 -11.635 -2.921 1.00 40.57 N ATOM 74 CA LEU A 849 10.031 -10.635 -1.860 1.00 38.97 C ATOM 75 C LEU A 849 11.121 -9.593 -2.149 1.00 39.43 C ATOM 76 O LEU A 849 12.274 -9.741 -1.736 1.00 38.21 O ATOM 77 CB LEU A 849 10.300 -11.345 -0.525 1.00 38.01 C ATOM 78 CG LEU A 849 9.654 -10.860 0.771 1.00 36.88 C ATOM 79 CD1 LEU A 849 8.170 -10.598 0.614 1.00 36.34 C ATOM 80 CD2 LEU A 849 9.896 -11.918 1.835 1.00 37.06 C ATOM 81 H LEU A 849 10.733 -12.376 -2.913 1.00 0.00 H ATOM 82 N LYS A 850 10.737 -8.532 -2.844 1.00 37.61 N ATOM 83 CA LYS A 850 11.691 -7.565 -3.379 1.00 38.79 C ATOM 84 C LYS A 850 11.964 -6.419 -2.408 1.00 37.06 C ATOM 85 O LYS A 850 11.033 -5.775 -1.947 1.00 36.70 O ATOM 86 CB LYS A 850 11.145 -7.003 -4.690 1.00 40.99 C ATOM 87 CG LYS A 850 10.921 -8.058 -5.755 1.00 43.56 C ATOM 88 CD LYS A 850 10.316 -7.465 -7.006 1.00 47.52 C ATOM 89 CE LYS A 850 10.659 -8.307 -8.221 1.00 50.95 C ATOM 90 NZ LYS A 850 10.027 -7.797 -9.483 1.00 54.30 N ATOM 91 HZ1 LYS A 850 8.992 -7.800 -9.377 1.00 0.00 H ATOM 92 HZ2 LYS A 850 10.355 -6.827 -9.666 1.00 0.00 H ATOM 93 HZ3 LYS A 850 10.297 -8.412 -10.277 1.00 0.00 H ATOM 94 H LYS A 850 9.722 -8.383 -3.014 1.00 0.00 H ATOM 95 N PHE A 851 13.240 -6.146 -2.131 1.00 36.79 N ATOM 96 CA PHE A 851 13.619 -5.102 -1.173 1.00 36.92 C ATOM 97 C PHE A 851 13.465 -3.680 -1.719 1.00 36.82 C ATOM 98 O PHE A 851 14.029 -3.352 -2.764 1.00 37.22 O ATOM 99 CB PHE A 851 15.059 -5.293 -0.714 1.00 35.53 C ATOM 100 CG PHE A 851 15.540 -4.208 0.193 1.00 39.22 C ATOM 101 CD1 PHE A 851 15.227 -4.230 1.545 1.00 41.97 C ATOM 102 CD2 PHE A 851 16.285 -3.139 -0.304 1.00 41.50 C ATOM 103 CE1 PHE A 851 15.660 -3.206 2.399 1.00 43.08 C ATOM 104 CE2 PHE A 851 16.724 -2.113 0.545 1.00 43.02 C ATOM 105 CZ PHE A 851 16.412 -2.152 1.897 1.00 41.96 C ATOM 106 H PHE A 851 13.988 -6.689 -2.608 1.00 0.00 H ATOM 107 N LEU A 852 12.737 -2.834 -0.986 1.00 35.25 N ATOM 108 CA LEU A 852 12.560 -1.431 -1.354 1.00 36.42 C ATOM 109 C LEU A 852 13.410 -0.491 -0.489 1.00 39.52 C ATOM 110 O LEU A 852 14.193 0.293 -1.017 1.00 44.45 O ATOM 111 CB LEU A 852 11.081 -1.055 -1.312 1.00 35.87 C ATOM 112 CG LEU A 852 10.193 -1.963 -2.180 1.00 36.94 C ATOM 113 CD1 LEU A 852 8.749 -1.470 -2.222 1.00 36.64 C ATOM 114 CD2 LEU A 852 10.749 -2.097 -3.597 1.00 36.66 C ATOM 115 H LEU A 852 12.279 -3.187 -0.121 1.00 0.00 H ATOM 116 N GLN A 853 13.267 -0.560 0.831 1.00 43.34 N ATOM 117 CA GLN A 853 14.115 0.234 1.730 1.00 41.44 C ATOM 118 C GLN A 853 13.983 -0.185 3.191 1.00 40.25 C ATOM 119 O GLN A 853 13.055 -0.900 3.558 1.00 36.56 O ATOM 120 CB GLN A 853 13.810 1.728 1.604 1.00 45.51 C ATOM 121 CG GLN A 853 12.369 2.082 1.900 1.00 49.53 C ATOM 122 CD GLN A 853 12.109 3.567 1.857 1.00 54.13 C ATOM 123 OE1 GLN A 853 10.969 4.001 1.680 1.00 56.22 O ATOM 124 NE2 GLN A 853 13.164 4.361 2.014 1.00 61.31 N ATOM 125 HE22 GLN A 853 14.108 3.949 2.161 1.00 0.00 H ATOM 126 HE21 GLN A 853 13.046 5.394 1.990 1.00 0.00 H ATOM 127 H GLN A 853 12.542 -1.187 1.234 1.00 0.00 H ATOM 128 N GLN A 854 14.923 0.285 4.009 1.00 40.80 N ATOM 129 CA GLN A 854 14.977 -0.042 5.429 1.00 43.71 C ATOM 130 C GLN A 854 13.996 0.863 6.158 1.00 40.56 C ATOM 131 O GLN A 854 13.937 2.052 5.882 1.00 41.75 O ATOM 132 CB GLN A 854 16.397 0.165 5.980 1.00 50.45 C ATOM 133 CG GLN A 854 16.835 -0.876 7.017 1.00 57.49 C ATOM 134 CD GLN A 854 17.212 -2.225 6.390 1.00 66.02 C ATOM 135 OE1 GLN A 854 17.432 -2.326 5.171 1.00 65.10 O ATOM 136 NE2 GLN A 854 17.289 -3.271 7.228 1.00 68.12 N ATOM 137 HE22 GLN A 854 17.097 -3.140 8.242 1.00 0.00 H ATOM 138 HE21 GLN A 854 17.541 -4.212 6.864 1.00 0.00 H ATOM 139 H GLN A 854 15.652 0.914 3.617 1.00 0.00 H ATOM 140 N LEU A 855 13.221 0.295 7.077 1.00 41.06 N ATOM 141 CA LEU A 855 12.167 1.029 7.770 1.00 38.79 C ATOM 142 C LEU A 855 12.540 1.346 9.211 1.00 39.21 C ATOM 143 O LEU A 855 12.194 2.405 9.726 1.00 45.21 O ATOM 144 CB LEU A 855 10.855 0.237 7.752 1.00 39.25 C ATOM 145 CG LEU A 855 9.935 0.334 6.532 1.00 38.99 C ATOM 146 CD1 LEU A 855 8.627 -0.392 6.839 1.00 39.14 C ATOM 147 CD2 LEU A 855 9.654 1.769 6.133 1.00 39.43 C ATOM 148 H LEU A 855 13.371 -0.707 7.310 1.00 0.00 H ATOM 149 N GLY A 856 13.217 0.421 9.874 1.00 40.13 N ATOM 150 CA GLY A 856 13.660 0.650 11.238 1.00 42.67 C ATOM 151 C GLY A 856 14.430 -0.548 11.741 1.00 45.91 C ATOM 152 O GLY A 856 14.199 -1.668 11.287 1.00 47.28 O ATOM 153 H GLY A 856 13.435 -0.484 9.410 1.00 0.00 H ATOM 154 N LYS A 857 15.347 -0.310 12.675 1.00 51.51 N ATOM 155 CA LYS A 857 16.266 -1.345 13.148 1.00 56.57 C ATOM 156 C LYS A 857 16.332 -1.384 14.676 1.00 59.04 C ATOM 157 O LYS A 857 15.751 -0.536 15.360 1.00 61.16 O ATOM 158 CB LYS A 857 17.669 -1.106 12.573 1.00 58.37 C ATOM 159 CG LYS A 857 18.435 -2.392 12.215 1.00 63.00 C ATOM 160 CD LYS A 857 19.944 -2.151 12.084 1.00 63.94 C ATOM 161 CE LYS A 857 20.738 -3.454 12.222 1.00 63.12 C ATOM 162 NZ LYS A 857 22.210 -3.253 12.248 1.00 60.64 N ATOM 163 HZ1 LYS A 857 22.512 -2.796 11.364 1.00 0.00 H ATOM 164 HZ2 LYS A 857 22.462 -2.648 13.055 1.00 0.00 H ATOM 165 HZ3 LYS A 857 22.683 -4.174 12.343 1.00 0.00 H ATOM 166 H LYS A 857 15.413 0.644 13.083 1.00 0.00 H ATOM 167 N GLY A 858 17.033 -2.390 15.194 1.00 65.68 N ATOM 168 CA GLY A 858 17.208 -2.590 16.633 1.00 71.65 C ATOM 169 C GLY A 858 18.337 -3.569 16.925 1.00 76.61 C ATOM 170 O GLY A 858 19.133 -3.896 16.039 1.00 83.07 O ATOM 171 H GLY A 858 17.479 -3.068 14.543 1.00 0.00 H ATOM 172 N ASN A 859 18.398 -4.057 18.161 1.00 82.31 N ATOM 173 CA ASN A 859 19.522 -4.902 18.605 1.00 85.34 C ATOM 174 C ASN A 859 19.690 -6.159 17.741 1.00 84.78 C ATOM 175 O ASN A 859 20.790 -6.449 17.263 1.00 80.15 O ATOM 176 CB ASN A 859 19.363 -5.311 20.081 1.00 85.50 C ATOM 177 CG ASN A 859 18.964 -4.140 20.977 1.00 86.69 C ATOM 178 OD1 ASN A 859 17.853 -4.113 21.534 1.00 89.07 O ATOM 179 ND2 ASN A 859 19.859 -3.159 21.103 1.00 78.80 N ATOM 180 HD22 ASN A 859 20.776 -3.226 20.617 1.00 0.00 H ATOM 181 HD21 ASN A 859 19.640 -2.327 21.687 1.00 0.00 H ATOM 182 H ASN A 859 17.634 -3.837 18.831 1.00 0.00 H ATOM 183 N PHE A 860 18.589 -6.887 17.543 1.00 84.35 N ATOM 184 CA PHE A 860 18.599 -8.152 16.783 1.00 80.73 C ATOM 185 C PHE A 860 17.466 -8.309 15.748 1.00 73.30 C ATOM 186 O PHE A 860 17.548 -9.203 14.902 1.00 73.23 O ATOM 187 CB PHE A 860 18.620 -9.359 17.741 1.00 82.01 C ATOM 188 CG PHE A 860 17.928 -9.106 19.052 1.00 86.20 C ATOM 189 CD1 PHE A 860 16.536 -9.059 19.118 1.00 91.10 C ATOM 190 CD2 PHE A 860 18.668 -8.891 20.215 1.00 87.46 C ATOM 191 CE1 PHE A 860 15.882 -8.819 20.329 1.00 91.61 C ATOM 192 CE2 PHE A 860 18.030 -8.643 21.429 1.00 90.33 C ATOM 193 CZ PHE A 860 16.630 -8.607 21.488 1.00 93.17 C ATOM 194 H PHE A 860 17.689 -6.550 17.940 1.00 0.00 H ATOM 195 N GLY A 861 16.427 -7.471 15.809 1.00 62.52 N ATOM 196 CA GLY A 861 15.402 -7.419 14.760 1.00 55.39 C ATOM 197 C GLY A 861 15.572 -6.226 13.830 1.00 49.07 C ATOM 198 O GLY A 861 16.172 -5.217 14.210 1.00 45.24 O ATOM 199 H GLY A 861 16.342 -6.834 16.627 1.00 0.00 H ATOM 200 N SER A 862 15.058 -6.344 12.605 1.00 44.88 N ATOM 201 CA SER A 862 14.976 -5.202 11.675 1.00 42.79 C ATOM 202 C SER A 862 13.703 -5.267 10.847 1.00 38.61 C ATOM 203 O SER A 862 13.093 -6.326 10.726 1.00 37.02 O ATOM 204 CB SER A 862 16.184 -5.150 10.734 1.00 45.06 C ATOM 205 OG SER A 862 16.246 -6.300 9.891 1.00 45.92 O ATOM 206 HG SER A 862 17.037 -6.232 9.299 1.00 0.00 H ATOM 207 H SER A 862 14.703 -7.271 12.295 1.00 0.00 H ATOM 208 N VAL A 863 13.317 -4.126 10.278 1.00 34.42 N ATOM 209 CA VAL A 863 12.101 -4.017 9.486 1.00 32.13 C ATOM 210 C VAL A 863 12.392 -3.396 8.122 1.00 32.08 C ATOM 211 O VAL A 863 13.075 -2.391 8.033 1.00 33.70 O ATOM 212 CB VAL A 863 11.048 -3.170 10.214 1.00 32.93 C ATOM 213 CG1 VAL A 863 9.708 -3.234 9.483 1.00 32.42 C ATOM 214 CG2 VAL A 863 10.888 -3.641 11.654 1.00 33.06 C ATOM 215 H VAL A 863 13.908 -3.280 10.405 1.00 0.00 H ATOM 216 N GLU A 864 11.861 -3.997 7.062 1.00 32.55 N ATOM 217 CA GLU A 864 12.084 -3.523 5.695 1.00 32.32 C ATOM 218 C GLU A 864 10.764 -3.366 4.963 1.00 30.36 C ATOM 219 O GLU A 864 9.843 -4.132 5.192 1.00 29.42 O ATOM 220 CB GLU A 864 12.958 -4.520 4.928 1.00 35.29 C ATOM 221 CG GLU A 864 14.349 -4.711 5.524 1.00 37.58 C ATOM 222 CD GLU A 864 15.181 -5.768 4.808 1.00 38.38 C ATOM 223 OE1 GLU A 864 14.594 -6.646 4.135 1.00 40.88 O ATOM 224 OE2 GLU A 864 16.425 -5.725 4.936 1.00 38.14 O ATOM 225 H GLU A 864 11.264 -4.836 7.209 1.00 0.00 H ATOM 226 N MET A 865 10.684 -2.358 4.098 1.00 30.88 N ATOM 227 CA MET A 865 9.561 -2.180 3.175 1.00 31.33 C ATOM 228 C MET A 865 9.843 -3.070 1.979 1.00 31.75 C ATOM 229 O MET A 865 10.947 -3.042 1.436 1.00 32.88 O ATOM 230 CB MET A 865 9.452 -0.711 2.742 1.00 32.34 C ATOM 231 CG MET A 865 8.284 -0.360 1.812 1.00 34.44 C ATOM 232 SD MET A 865 8.367 1.345 1.153 1.00 36.81 S ATOM 233 CE MET A 865 6.784 1.485 0.322 1.00 40.01 C ATOM 234 H MET A 865 11.457 -1.662 4.076 1.00 0.00 H ATOM 235 N CYS A 866 8.863 -3.879 1.587 1.00 30.23 N ATOM 236 CA CYS A 866 9.046 -4.842 0.501 1.00 30.38 C ATOM 237 C CYS A 866 7.825 -4.948 -0.390 1.00 31.80 C ATOM 238 O CYS A 866 6.704 -4.765 0.058 1.00 32.11 O ATOM 239 CB CYS A 866 9.362 -6.238 1.049 1.00 31.39 C ATOM 240 SG CYS A 866 11.026 -6.453 1.687 1.00 30.47 S ATOM 241 H CYS A 866 7.941 -3.826 2.066 1.00 0.00 H ATOM 242 N ARG A 867 8.064 -5.273 -1.655 1.00 34.68 N ATOM 243 CA ARG A 867 7.007 -5.532 -2.626 1.00 35.91 C ATOM 244 C ARG A 867 6.932 -7.029 -2.823 1.00 35.79 C ATOM 245 O ARG A 867 7.927 -7.643 -3.194 1.00 38.52 O ATOM 246 CB ARG A 867 7.350 -4.846 -3.940 1.00 37.55 C ATOM 247 CG ARG A 867 6.388 -5.084 -5.090 1.00 39.38 C ATOM 248 CD ARG A 867 6.344 -3.846 -6.002 1.00 41.24 C ATOM 249 NE ARG A 867 5.391 -2.845 -5.504 1.00 44.87 N ATOM 250 CZ ARG A 867 5.555 -1.517 -5.551 1.00 47.75 C ATOM 251 NH1 ARG A 867 6.661 -0.975 -6.056 1.00 48.66 N ATOM 252 NH2 ARG A 867 4.600 -0.716 -5.074 1.00 45.64 N ATOM 253 HE ARG A 867 4.511 -3.199 -5.077 1.00 0.00 H ATOM 254 HH12 ARG A 867 6.768 0.059 -6.083 1.00 0.00 H ATOM 255 HH11 ARG A 867 7.418 -1.586 -6.424 1.00 0.00 H ATOM 256 HH22 ARG A 867 4.722 0.316 -5.108 1.00 0.00 H ATOM 257 HH21 ARG A 867 3.734 -1.124 -4.668 1.00 0.00 H ATOM 258 H ARG A 867 9.053 -5.346 -1.969 1.00 0.00 H ATOM 259 N TYR A 868 5.782 -7.633 -2.538 1.00 37.46 N ATOM 260 CA TYR A 868 5.635 -9.069 -2.750 1.00 39.26 C ATOM 261 C TYR A 868 5.058 -9.262 -4.137 1.00 42.61 C ATOM 262 O TYR A 868 3.889 -8.953 -4.389 1.00 43.69 O ATOM 263 CB TYR A 868 4.765 -9.734 -1.681 1.00 38.87 C ATOM 264 CG TYR A 868 4.729 -11.239 -1.812 1.00 37.91 C ATOM 265 CD1 TYR A 868 5.899 -11.987 -1.739 1.00 39.80 C ATOM 266 CD2 TYR A 868 3.531 -11.919 -2.021 1.00 39.49 C ATOM 267 CE1 TYR A 868 5.881 -13.376 -1.858 1.00 39.93 C ATOM 268 CE2 TYR A 868 3.504 -13.312 -2.152 1.00 39.67 C ATOM 269 CZ TYR A 868 4.682 -14.033 -2.069 1.00 39.42 C ATOM 270 OH TYR A 868 4.665 -15.402 -2.190 1.00 39.23 O ATOM 271 HH TYR A 868 5.588 -15.751 -2.106 1.00 0.00 H ATOM 272 H TYR A 868 4.985 -7.080 -2.163 1.00 0.00 H ATOM 273 N ASP A 869 5.898 -9.782 -5.029 1.00 47.77 N ATOM 274 CA ASP A 869 5.655 -9.731 -6.468 1.00 51.52 C ATOM 275 C ASP A 869 5.698 -11.134 -7.078 1.00 49.92 C ATOM 276 O ASP A 869 6.650 -11.478 -7.768 1.00 50.81 O ATOM 277 CB ASP A 869 6.713 -8.816 -7.111 1.00 51.00 C ATOM 278 CG ASP A 869 6.334 -8.352 -8.504 1.00 51.35 C ATOM 279 OD1 ASP A 869 5.329 -8.842 -9.055 1.00 55.78 O ATOM 280 OD2 ASP A 869 7.058 -7.498 -9.066 1.00 55.87 O ATOM 281 H ASP A 869 6.764 -10.244 -4.686 1.00 0.00 H ATOM 282 N PRO A 870 4.670 -11.954 -6.816 1.00 49.89 N ATOM 283 CA PRO A 870 4.673 -13.341 -7.317 1.00 51.02 C ATOM 284 C PRO A 870 4.572 -13.540 -8.842 1.00 52.13 C ATOM 285 O PRO A 870 4.955 -14.599 -9.343 1.00 53.28 O ATOM 286 CB PRO A 870 3.485 -13.995 -6.600 1.00 51.29 C ATOM 287 CG PRO A 870 2.609 -12.875 -6.174 1.00 53.54 C ATOM 288 CD PRO A 870 3.476 -11.650 -6.012 1.00 52.57 C ATOM 289 N LEU A 871 4.079 -12.538 -9.562 1.00 52.53 N ATOM 290 CA LEU A 871 4.052 -12.580 -11.016 1.00 52.48 C ATOM 291 C LEU A 871 5.151 -11.683 -11.591 1.00 53.63 C ATOM 292 O LEU A 871 5.296 -11.579 -12.815 1.00 56.93 O ATOM 293 CB LEU A 871 2.700 -12.115 -11.561 1.00 56.35 C ATOM 294 CG LEU A 871 1.406 -12.253 -10.761 1.00 61.31 C ATOM 295 CD1 LEU A 871 1.386 -11.332 -9.535 1.00 68.47 C ATOM 296 CD2 LEU A 871 0.223 -11.922 -11.670 1.00 62.85 C ATOM 297 H LEU A 871 3.702 -11.701 -9.073 1.00 0.00 H ATOM 298 N GLN A 872 5.895 -11.007 -10.712 1.00 56.27 N ATOM 299 CA GLN A 872 7.033 -10.157 -11.108 1.00 57.63 C ATOM 300 C GLN A 872 6.595 -9.054 -12.096 1.00 58.87 C ATOM 301 O GLN A 872 7.420 -8.315 -12.636 1.00 55.56 O ATOM 302 CB GLN A 872 8.168 -11.016 -11.699 1.00 56.35 C ATOM 303 CG GLN A 872 8.484 -12.337 -10.916 1.00 57.59 C ATOM 304 CD GLN A 872 9.569 -12.206 -9.832 1.00 57.45 C ATOM 305 OE1 GLN A 872 10.241 -11.176 -9.702 1.00 55.30 O ATOM 306 NE2 GLN A 872 9.750 -13.275 -9.062 1.00 56.77 N ATOM 307 HE22 GLN A 872 9.164 -14.123 -9.203 1.00 0.00 H ATOM 308 HE21 GLN A 872 10.477 -13.263 -8.319 1.00 0.00 H ATOM 309 H GLN A 872 5.661 -11.084 -9.702 1.00 0.00 H ATOM 310 N ASP A 873 5.286 -8.933 -12.295 1.00 60.91 N ATOM 311 CA ASP A 873 4.743 -8.277 -13.469 1.00 66.09 C ATOM 312 C ASP A 873 4.108 -6.930 -13.169 1.00 68.21 C ATOM 313 O ASP A 873 3.043 -6.896 -12.544 1.00 64.40 O ATOM 314 CB ASP A 873 3.678 -9.197 -14.112 1.00 65.24 C ATOM 315 H ASP A 873 4.631 -9.321 -11.587 1.00 0.00 H ATOM 316 N ASN A 874 4.770 -5.811 -13.475 1.00 73.54 N ATOM 317 CA ASN A 874 6.088 -5.420 -12.952 1.00 72.69 C ATOM 318 C ASN A 874 6.004 -5.129 -11.433 1.00 70.03 C ATOM 319 O ASN A 874 7.029 -4.995 -10.757 1.00 68.58 O ATOM 320 CB ASN A 874 6.583 -4.172 -13.695 1.00 70.20 C ATOM 321 H ASN A 874 4.313 -5.158 -14.143 1.00 0.00 H ATOM 322 N THR A 875 4.782 -5.021 -10.910 1.00 70.02 N ATOM 323 CA THR A 875 4.551 -4.640 -9.527 1.00 68.59 C ATOM 324 C THR A 875 3.390 -5.414 -8.893 1.00 66.78 C ATOM 325 O THR A 875 2.470 -5.861 -9.584 1.00 66.04 O ATOM 326 CB THR A 875 4.221 -3.144 -9.438 1.00 72.12 C ATOM 327 OG1 THR A 875 4.086 -2.761 -8.061 1.00 73.77 O ATOM 328 CG2 THR A 875 2.918 -2.828 -10.208 1.00 73.91 C ATOM 329 HG1 THR A 875 3.356 -3.285 -7.644 1.00 0.00 H ATOM 330 H THR A 875 3.961 -5.218 -11.517 1.00 0.00 H ATOM 331 N GLY A 876 3.459 -5.547 -7.566 1.00 68.32 N ATOM 332 CA GLY A 876 2.391 -6.110 -6.727 1.00 60.40 C ATOM 333 C GLY A 876 2.239 -5.281 -5.452 1.00 56.27 C ATOM 334 O GLY A 876 2.315 -4.045 -5.502 1.00 54.44 O ATOM 335 H GLY A 876 4.329 -5.230 -7.093 1.00 0.00 H ATOM 336 N GLU A 877 2.062 -5.956 -4.312 1.00 49.20 N ATOM 337 CA GLU A 877 1.638 -5.304 -3.063 1.00 46.73 C ATOM 338 C GLU A 877 2.786 -5.061 -2.076 1.00 42.35 C ATOM 339 O GLU A 877 3.631 -5.941 -1.871 1.00 42.37 O ATOM 340 CB GLU A 877 0.521 -6.136 -2.418 1.00 49.94 C ATOM 341 CG GLU A 877 0.459 -6.129 -0.887 1.00 57.45 C ATOM 342 CD GLU A 877 -0.715 -6.965 -0.356 1.00 64.67 C ATOM 343 OE1 GLU A 877 -0.721 -8.203 -0.594 1.00 65.17 O ATOM 344 OE2 GLU A 877 -1.627 -6.390 0.288 1.00 63.42 O ATOM 345 H GLU A 877 2.231 -6.982 -4.308 1.00 0.00 H ATOM 346 N VAL A 878 2.786 -3.880 -1.454 1.00 35.40 N ATOM 347 CA VAL A 878 3.844 -3.466 -0.518 1.00 33.15 C ATOM 348 C VAL A 878 3.577 -3.956 0.927 1.00 30.54 C ATOM 349 O VAL A 878 2.479 -3.775 1.449 1.00 30.17 O ATOM 350 CB VAL A 878 4.042 -1.911 -0.560 1.00 33.37 C ATOM 351 CG1 VAL A 878 4.869 -1.419 0.597 1.00 34.58 C ATOM 352 CG2 VAL A 878 4.703 -1.501 -1.846 1.00 33.85 C ATOM 353 H VAL A 878 2.002 -3.222 -1.639 1.00 0.00 H ATOM 354 N VAL A 879 4.589 -4.574 1.555 1.00 28.37 N ATOM 355 CA VAL A 879 4.486 -5.158 2.917 1.00 26.19 C ATOM 356 C VAL A 879 5.682 -4.809 3.830 1.00 26.16 C ATOM 357 O VAL A 879 6.769 -4.492 3.357 1.00 26.73 O ATOM 358 CB VAL A 879 4.365 -6.708 2.868 1.00 24.73 C ATOM 359 CG1 VAL A 879 3.154 -7.116 2.097 1.00 25.31 C ATOM 360 CG2 VAL A 879 5.593 -7.332 2.254 1.00 25.01 C ATOM 361 H VAL A 879 5.500 -4.649 1.059 1.00 0.00 H ATOM 362 N ALA A 880 5.473 -4.882 5.144 1.00 26.30 N ATOM 363 CA ALA A 880 6.546 -4.676 6.132 1.00 24.94 C ATOM 364 C ALA A 880 7.075 -6.033 6.574 1.00 24.47 C ATOM 365 O ALA A 880 6.304 -6.911 6.931 1.00 26.73 O ATOM 366 CB ALA A 880 6.035 -3.888 7.335 1.00 24.93 C ATOM 367 H ALA A 880 4.514 -5.093 5.486 1.00 0.00 H ATOM 368 N VAL A 881 8.389 -6.201 6.552 1.00 25.19 N ATOM 369 CA VAL A 881 9.009 -7.498 6.776 1.00 26.13 C ATOM 370 C VAL A 881 9.967 -7.424 7.960 1.00 27.96 C ATOM 371 O VAL A 881 10.856 -6.572 7.974 1.00 28.16 O ATOM 372 CB VAL A 881 9.815 -7.932 5.542 1.00 24.99 C ATOM 373 CG1 VAL A 881 10.456 -9.281 5.770 1.00 25.10 C ATOM 374 CG2 VAL A 881 8.934 -7.956 4.314 1.00 25.99 C ATOM 375 H VAL A 881 8.998 -5.378 6.368 1.00 0.00 H ATOM 376 N LYS A 882 9.793 -8.311 8.941 1.00 27.44 N ATOM 377 CA LYS A 882 10.730 -8.409 10.060 1.00 28.29 C ATOM 378 C LYS A 882 11.592 -9.650 9.948 1.00 28.48 C ATOM 379 O LYS A 882 11.078 -10.742 9.773 1.00 30.08 O ATOM 380 CB LYS A 882 10.001 -8.432 11.409 1.00 29.07 C ATOM 381 CG LYS A 882 10.894 -8.873 12.565 1.00 29.64 C ATOM 382 CD LYS A 882 10.268 -8.671 13.913 1.00 29.35 C ATOM 383 CE LYS A 882 11.188 -9.195 14.997 1.00 30.80 C ATOM 384 NZ LYS A 882 10.572 -9.142 16.348 1.00 34.23 N ATOM 385 HZ1 LYS A 882 10.334 -8.157 16.581 1.00 0.00 H ATOM 386 HZ2 LYS A 882 9.708 -9.720 16.356 1.00 0.00 H ATOM 387 HZ3 LYS A 882 11.245 -9.512 17.049 1.00 0.00 H ATOM 388 H LYS A 882 8.972 -8.948 8.909 1.00 0.00 H ATOM 389 N LYS A 883 12.904 -9.476 10.056 1.00 29.46 N ATOM 390 CA LYS A 883 13.814 -10.604 10.234 1.00 30.67 C ATOM 391 C LYS A 883 14.663 -10.373 11.461 1.00 33.27 C ATOM 392 O LYS A 883 14.725 -9.256 11.985 1.00 32.99 O ATOM 393 CB LYS A 883 14.694 -10.835 9.001 1.00 30.44 C ATOM 394 CG LYS A 883 15.639 -9.693 8.640 1.00 30.98 C ATOM 395 H LYS A 883 13.293 -8.512 10.013 1.00 0.00 H ATOM 396 N LEU A 884 15.282 -11.450 11.932 1.00 37.79 N ATOM 397 CA LEU A 884 16.203 -11.379 13.061 1.00 43.67 C ATOM 398 C LEU A 884 17.631 -11.296 12.544 1.00 47.64 C ATOM 399 O LEU A 884 18.028 -12.072 11.676 1.00 51.97 O ATOM 400 CB LEU A 884 16.055 -12.590 13.996 1.00 42.49 C ATOM 401 CG LEU A 884 15.170 -12.388 15.232 1.00 43.88 C ATOM 402 CD1 LEU A 884 13.731 -12.610 14.912 1.00 46.25 C ATOM 403 CD2 LEU A 884 15.562 -13.325 16.336 1.00 48.41 C ATOM 404 H LEU A 884 15.105 -12.371 11.483 1.00 0.00 H ATOM 405 N GLN A 885 18.394 -10.348 13.075 1.00 53.04 N ATOM 406 CA GLN A 885 19.836 -10.276 12.826 1.00 59.84 C ATOM 407 C GLN A 885 20.565 -11.388 13.575 1.00 59.57 C ATOM 408 O GLN A 885 21.021 -12.354 12.948 1.00 59.47 O ATOM 409 CB GLN A 885 20.379 -8.893 13.217 1.00 65.28 C ATOM 410 CG GLN A 885 20.132 -7.778 12.171 1.00 69.58 C ATOM 411 CD GLN A 885 18.956 -8.061 11.234 1.00 67.94 C ATOM 412 OE1 GLN A 885 19.101 -8.742 10.210 1.00 61.69 O ATOM 413 NE2 GLN A 885 17.789 -7.540 11.586 1.00 67.76 N ATOM 414 HE22 GLN A 885 17.713 -6.974 12.455 1.00 0.00 H ATOM 415 HE21 GLN A 885 16.949 -7.697 10.993 1.00 0.00 H ATOM 416 H GLN A 885 17.953 -9.633 13.688 1.00 0.00 H ATOM 417 N HIS A 886 20.647 -11.268 14.904 1.00 60.27 N ATOM 418 CA HIS A 886 21.327 -12.275 15.742 1.00 63.17 C ATOM 419 C HIS A 886 20.395 -13.428 16.061 1.00 58.21 C ATOM 420 O HIS A 886 19.588 -13.340 16.989 1.00 58.90 O ATOM 421 CB HIS A 886 21.827 -11.660 17.053 1.00 67.23 C ATOM 422 CG HIS A 886 22.894 -10.631 16.864 1.00 73.86 C ATOM 423 ND1 HIS A 886 22.844 -9.387 17.456 1.00 78.09 N ATOM 424 CD2 HIS A 886 24.029 -10.654 16.126 1.00 76.51 C ATOM 425 CE1 HIS A 886 23.913 -8.693 17.104 1.00 82.31 C ATOM 426 NE2 HIS A 886 24.650 -9.440 16.300 1.00 82.17 N ATOM 427 H HIS A 886 20.218 -10.439 15.362 1.00 0.00 H ATOM 428 N SER A 887 20.532 -14.524 15.323 1.00 53.25 N ATOM 429 CA SER A 887 19.531 -15.593 15.355 1.00 53.61 C ATOM 430 C SER A 887 19.714 -16.624 16.490 1.00 50.50 C ATOM 431 O SER A 887 19.597 -17.835 16.272 1.00 47.03 O ATOM 432 CB SER A 887 19.488 -16.293 13.993 1.00 54.84 C ATOM 433 OG SER A 887 18.227 -16.893 13.782 1.00 54.53 O ATOM 434 HG SER A 887 18.219 -17.339 12.898 1.00 0.00 H ATOM 435 H SER A 887 21.366 -14.625 14.710 1.00 0.00 H ATOM 436 N THR A 888 19.995 -16.131 17.693 1.00 47.31 N ATOM 437 CA THR A 888 19.957 -16.933 18.915 1.00 48.16 C ATOM 438 C THR A 888 18.603 -17.626 19.047 1.00 48.57 C ATOM 439 O THR A 888 17.591 -17.069 18.640 1.00 46.89 O ATOM 440 CB THR A 888 20.216 -16.032 20.148 1.00 51.50 C ATOM 441 OG1 THR A 888 21.595 -16.116 20.516 1.00 54.70 O ATOM 442 CG2 THR A 888 19.355 -16.427 21.336 1.00 52.15 C ATOM 443 HG1 THR A 888 21.761 -15.540 21.304 1.00 0.00 H ATOM 444 H THR A 888 20.254 -15.127 17.768 1.00 0.00 H ATOM 445 N GLU A 889 18.576 -18.834 19.610 1.00 50.54 N ATOM 446 CA GLU A 889 17.337 -19.619 19.635 1.00 51.00 C ATOM 447 C GLU A 889 16.294 -19.118 20.630 1.00 46.56 C ATOM 448 O GLU A 889 15.108 -19.370 20.444 1.00 47.85 O ATOM 449 CB GLU A 889 17.589 -21.115 19.875 1.00 55.81 C ATOM 450 CG GLU A 889 16.269 -21.909 19.944 1.00 60.84 C ATOM 451 CD GLU A 889 16.395 -23.369 19.589 1.00 69.50 C ATOM 452 OE1 GLU A 889 17.435 -24.003 19.874 1.00 85.79 O ATOM 453 OE2 GLU A 889 15.426 -23.896 19.010 1.00 72.13 O ATOM 454 H GLU A 889 19.441 -19.224 20.035 1.00 0.00 H ATOM 455 N GLU A 890 16.708 -18.440 21.692 1.00 43.65 N ATOM 456 CA GLU A 890 15.725 -17.796 22.568 1.00 42.68 C ATOM 457 C GLU A 890 14.987 -16.691 21.814 1.00 39.65 C ATOM 458 O GLU A 890 13.765 -16.578 21.912 1.00 36.38 O ATOM 459 CB GLU A 890 16.368 -17.253 23.845 1.00 44.53 C ATOM 460 CG GLU A 890 16.414 -18.265 24.977 1.00 49.45 C ATOM 461 H GLU A 890 17.724 -18.366 21.902 1.00 0.00 H ATOM 462 N HIS A 891 15.727 -15.904 21.038 1.00 37.12 N ATOM 463 CA HIS A 891 15.123 -14.859 20.222 1.00 37.97 C ATOM 464 C HIS A 891 14.255 -15.442 19.114 1.00 36.89 C ATOM 465 O HIS A 891 13.225 -14.872 18.784 1.00 45.02 O ATOM 466 CB HIS A 891 16.181 -13.917 19.646 1.00 38.39 C ATOM 467 CG HIS A 891 16.886 -13.102 20.684 1.00 40.79 C ATOM 468 ND1 HIS A 891 18.179 -12.652 20.526 1.00 42.03 N ATOM 469 CD2 HIS A 891 16.480 -12.668 21.904 1.00 40.14 C ATOM 470 CE1 HIS A 891 18.534 -11.964 21.599 1.00 43.47 C ATOM 471 NE2 HIS A 891 17.523 -11.961 22.451 1.00 42.07 N ATOM 472 H HIS A 891 16.758 -16.037 21.013 1.00 0.00 H ATOM 473 N LEU A 892 14.653 -16.582 18.564 1.00 34.63 N ATOM 474 CA LEU A 892 13.855 -17.261 17.557 1.00 33.89 C ATOM 475 C LEU A 892 12.580 -17.783 18.180 1.00 33.59 C ATOM 476 O LEU A 892 11.505 -17.627 17.615 1.00 36.70 O ATOM 477 CB LEU A 892 14.621 -18.432 16.942 1.00 38.49 C ATOM 478 CG LEU A 892 14.323 -18.680 15.460 1.00 40.97 C ATOM 479 CD1 LEU A 892 15.324 -17.940 14.578 1.00 41.39 C ATOM 480 CD2 LEU A 892 14.359 -20.149 15.167 1.00 42.21 C ATOM 481 H LEU A 892 15.558 -17.000 18.861 1.00 0.00 H ATOM 482 N ARG A 893 12.703 -18.408 19.346 1.00 32.55 N ATOM 483 CA ARG A 893 11.549 -18.957 20.041 1.00 31.68 C ATOM 484 C ARG A 893 10.606 -17.834 20.443 1.00 32.31 C ATOM 485 O ARG A 893 9.401 -17.949 20.242 1.00 33.39 O ATOM 486 CB ARG A 893 11.972 -19.763 21.268 1.00 33.06 C ATOM 487 CG ARG A 893 10.866 -20.649 21.839 1.00 30.30 C ATOM 488 H ARG A 893 13.647 -18.507 19.772 1.00 0.00 H ATOM 489 N ASP A 894 11.155 -16.748 20.990 1.00 34.05 N ATOM 490 CA ASP A 894 10.371 -15.525 21.268 1.00 31.81 C ATOM 491 C ASP A 894 9.697 -14.984 20.014 1.00 30.84 C ATOM 492 O ASP A 894 8.542 -14.565 20.064 1.00 31.71 O ATOM 493 CB ASP A 894 11.253 -14.414 21.854 1.00 30.73 C ATOM 494 CG ASP A 894 11.575 -14.618 23.327 1.00 31.71 C ATOM 495 OD1 ASP A 894 10.820 -15.304 24.040 1.00 33.52 O ATOM 496 OD2 ASP A 894 12.596 -14.078 23.783 1.00 32.17 O ATOM 497 H ASP A 894 12.167 -16.762 21.229 1.00 0.00 H ATOM 498 N PHE A 895 10.428 -14.985 18.901 1.00 30.53 N ATOM 499 CA PHE A 895 9.907 -14.500 17.621 1.00 32.24 C ATOM 500 C PHE A 895 8.751 -15.349 17.099 1.00 33.28 C ATOM 501 O PHE A 895 7.770 -14.824 16.573 1.00 31.80 O ATOM 502 CB PHE A 895 11.031 -14.445 16.581 1.00 32.14 C ATOM 503 CG PHE A 895 10.642 -13.808 15.265 1.00 31.95 C ATOM 504 CD1 PHE A 895 9.692 -12.787 15.195 1.00 32.31 C ATOM 505 CD2 PHE A 895 11.280 -14.195 14.098 1.00 30.21 C ATOM 506 CE1 PHE A 895 9.362 -12.203 13.986 1.00 31.04 C ATOM 507 CE2 PHE A 895 10.969 -13.603 12.892 1.00 31.51 C ATOM 508 CZ PHE A 895 10.003 -12.609 12.834 1.00 31.79 C ATOM 509 H PHE A 895 11.404 -15.343 18.942 1.00 0.00 H ATOM 510 N GLU A 896 8.867 -16.662 17.248 1.00 36.69 N ATOM 511 CA GLU A 896 7.826 -17.575 16.801 1.00 37.11 C ATOM 512 C GLU A 896 6.561 -17.381 17.641 1.00 34.11 C ATOM 513 O GLU A 896 5.447 -17.511 17.139 1.00 35.24 O ATOM 514 CB GLU A 896 8.336 -19.021 16.879 1.00 42.08 C ATOM 515 CG GLU A 896 8.077 -19.871 15.623 1.00 45.72 C ATOM 516 CD GLU A 896 9.293 -20.687 15.201 1.00 48.84 C ATOM 517 OE1 GLU A 896 10.211 -20.833 16.042 1.00 46.63 O ATOM 518 OE2 GLU A 896 9.334 -21.170 14.032 1.00 49.06 O ATOM 519 H GLU A 896 9.723 -17.048 17.695 1.00 0.00 H ATOM 520 N ARG A 897 6.741 -17.055 18.920 1.00 34.06 N ATOM 521 CA ARG A 897 5.620 -16.787 19.828 1.00 34.98 C ATOM 522 C ARG A 897 4.992 -15.442 19.530 1.00 33.71 C ATOM 523 O ARG A 897 3.791 -15.289 19.664 1.00 38.75 O ATOM 524 CB ARG A 897 6.063 -16.859 21.300 1.00 36.94 C ATOM 525 CG ARG A 897 6.575 -18.242 21.701 1.00 38.93 C ATOM 526 CD ARG A 897 6.310 -18.584 23.155 1.00 41.51 C ATOM 527 NE ARG A 897 7.303 -18.015 24.067 1.00 44.94 N ATOM 528 CZ ARG A 897 7.203 -18.023 25.398 1.00 47.45 C ATOM 529 NH1 ARG A 897 6.135 -18.553 25.990 1.00 47.65 N ATOM 530 NH2 ARG A 897 8.164 -17.483 26.142 1.00 49.72 N ATOM 531 HE ARG A 897 8.146 -17.573 23.648 1.00 0.00 H ATOM 532 HH12 ARG A 897 6.063 -18.556 27.028 1.00 0.00 H ATOM 533 HH11 ARG A 897 5.372 -18.964 25.415 1.00 0.00 H ATOM 534 HH22 ARG A 897 8.085 -17.490 27.179 1.00 0.00 H ATOM 535 HH21 ARG A 897 8.995 -17.054 25.687 1.00 0.00 H ATOM 536 H ARG A 897 7.711 -16.988 19.288 1.00 0.00 H ATOM 537 N GLU A 898 5.804 -14.462 19.140 1.00 33.25 N ATOM 538 CA GLU A 898 5.286 -13.195 18.624 1.00 31.50 C ATOM 539 C GLU A 898 4.336 -13.451 17.443 1.00 32.19 C ATOM 540 O GLU A 898 3.254 -12.867 17.373 1.00 33.91 O ATOM 541 CB GLU A 898 6.444 -12.276 18.210 1.00 31.70 C ATOM 542 CG GLU A 898 6.044 -10.999 17.469 1.00 33.11 C ATOM 543 CD GLU A 898 7.248 -10.121 17.114 1.00 35.26 C ATOM 544 OE1 GLU A 898 8.368 -10.449 17.564 1.00 38.32 O ATOM 545 OE2 GLU A 898 7.082 -9.110 16.392 1.00 34.30 O ATOM 546 H GLU A 898 6.833 -14.601 19.204 1.00 0.00 H ATOM 547 N ILE A 899 4.731 -14.335 16.529 1.00 32.45 N ATOM 548 CA ILE A 899 3.936 -14.589 15.325 1.00 33.88 C ATOM 549 C ILE A 899 2.557 -15.163 15.650 1.00 34.67 C ATOM 550 O ILE A 899 1.554 -14.679 15.137 1.00 36.34 O ATOM 551 CB ILE A 899 4.662 -15.522 14.351 1.00 35.28 C ATOM 552 CG1 ILE A 899 5.895 -14.814 13.780 1.00 36.41 C ATOM 553 CG2 ILE A 899 3.717 -15.963 13.233 1.00 34.88 C ATOM 554 CD1 ILE A 899 6.978 -15.755 13.318 1.00 37.93 C ATOM 555 H ILE A 899 5.620 -14.855 16.672 1.00 0.00 H ATOM 556 N GLU A 900 2.504 -16.173 16.515 1.00 34.41 N ATOM 557 CA GLU A 900 1.222 -16.750 16.925 1.00 33.17 C ATOM 558 C GLU A 900 0.302 -15.706 17.536 1.00 31.52 C ATOM 559 O GLU A 900 -0.907 -15.753 17.318 1.00 34.84 O ATOM 560 CB GLU A 900 1.415 -17.916 17.902 1.00 33.18 C ATOM 561 CG GLU A 900 2.090 -19.138 17.282 1.00 34.93 C ATOM 562 CD GLU A 900 1.471 -19.555 15.945 1.00 36.25 C ATOM 563 OE1 GLU A 900 2.240 -19.806 14.991 1.00 37.16 O ATOM 564 OE2 GLU A 900 0.225 -19.616 15.842 1.00 35.00 O ATOM 565 H GLU A 900 3.387 -16.559 16.906 1.00 0.00 H ATOM 566 N ILE A 901 0.863 -14.761 18.288 1.00 28.10 N ATOM 567 CA ILE A 901 0.055 -13.699 18.869 1.00 27.71 C ATOM 568 C ILE A 901 -0.519 -12.837 17.750 1.00 28.18 C ATOM 569 O ILE A 901 -1.733 -12.704 17.639 1.00 29.81 O ATOM 570 CB ILE A 901 0.830 -12.868 19.930 1.00 25.17 C ATOM 571 CG1 ILE A 901 0.897 -13.665 21.241 1.00 24.39 C ATOM 572 CG2 ILE A 901 0.162 -11.517 20.159 1.00 23.68 C ATOM 573 CD1 ILE A 901 1.706 -13.028 22.342 1.00 24.76 C ATOM 574 H ILE A 901 1.888 -14.782 18.462 1.00 0.00 H ATOM 575 N LEU A 902 0.352 -12.293 16.908 1.00 28.15 N ATOM 576 CA LEU A 902 -0.070 -11.526 15.736 1.00 28.35 C ATOM 577 C LEU A 902 -1.144 -12.255 14.927 1.00 29.97 C ATOM 578 O LEU A 902 -2.170 -11.684 14.575 1.00 32.13 O ATOM 579 CB LEU A 902 1.140 -11.250 14.842 1.00 27.50 C ATOM 580 CG LEU A 902 1.890 -9.919 14.965 1.00 27.13 C ATOM 581 CD1 LEU A 902 1.588 -9.160 16.228 1.00 28.52 C ATOM 582 CD2 LEU A 902 3.380 -10.174 14.835 1.00 28.33 C ATOM 583 H LEU A 902 1.369 -12.416 17.088 1.00 0.00 H ATOM 584 N LYS A 903 -0.881 -13.524 14.648 1.00 31.81 N ATOM 585 CA LYS A 903 -1.771 -14.419 13.900 1.00 32.47 C ATOM 586 C LYS A 903 -3.202 -14.432 14.443 1.00 32.35 C ATOM 587 O LYS A 903 -4.166 -14.465 13.675 1.00 32.55 O ATOM 588 CB LYS A 903 -1.173 -15.816 14.010 1.00 33.34 C ATOM 589 CG LYS A 903 -1.508 -16.836 12.978 1.00 34.12 C ATOM 590 CD LYS A 903 -0.638 -18.061 13.286 1.00 35.35 C ATOM 591 CE LYS A 903 0.152 -18.563 12.092 1.00 37.59 C ATOM 592 NZ LYS A 903 1.437 -19.229 12.520 1.00 37.77 N ATOM 593 HZ1 LYS A 903 2.024 -18.546 13.040 1.00 0.00 H ATOM 594 HZ2 LYS A 903 1.218 -20.039 13.135 1.00 0.00 H ATOM 595 HZ3 LYS A 903 1.951 -19.560 11.679 1.00 0.00 H ATOM 596 H LYS A 903 0.023 -13.914 14.984 1.00 0.00 H ATOM 597 N SER A 904 -3.326 -14.388 15.772 1.00 31.37 N ATOM 598 CA SER A 904 -4.631 -14.444 16.453 1.00 31.18 C ATOM 599 C SER A 904 -5.363 -13.099 16.608 1.00 30.34 C ATOM 600 O SER A 904 -6.349 -13.032 17.330 1.00 29.49 O ATOM 601 CB SER A 904 -4.453 -15.045 17.851 1.00 30.72 C ATOM 602 OG SER A 904 -3.882 -14.096 18.743 1.00 30.23 O ATOM 603 HG SER A 904 -3.777 -14.507 19.638 1.00 0.00 H ATOM 604 H SER A 904 -2.465 -14.311 16.350 1.00 0.00 H ATOM 605 N LEU A 905 -4.902 -12.042 15.946 1.00 30.78 N ATOM 606 CA LEU A 905 -5.473 -10.706 16.154 1.00 33.07 C ATOM 607 C LEU A 905 -6.262 -10.189 14.955 1.00 33.40 C ATOM 608 O LEU A 905 -5.766 -10.199 13.840 1.00 38.94 O ATOM 609 CB LEU A 905 -4.370 -9.698 16.508 1.00 33.20 C ATOM 610 CG LEU A 905 -3.572 -9.945 17.803 1.00 34.30 C ATOM 611 CD1 LEU A 905 -2.557 -8.839 18.006 1.00 36.99 C ATOM 612 CD2 LEU A 905 -4.440 -10.069 19.046 1.00 34.37 C ATOM 613 H LEU A 905 -4.123 -12.164 15.268 1.00 0.00 H ATOM 614 N GLN A 906 -7.484 -9.723 15.198 1.00 35.40 N ATOM 615 CA GLN A 906 -8.303 -9.075 14.168 1.00 39.10 C ATOM 616 C GLN A 906 -9.074 -7.897 14.803 1.00 35.60 C ATOM 617 O GLN A 906 -10.078 -8.080 15.493 1.00 38.56 O ATOM 618 CB GLN A 906 -9.264 -10.088 13.485 1.00 44.83 C ATOM 619 CG GLN A 906 -8.602 -11.442 13.088 1.00 51.95 C ATOM 620 CD GLN A 906 -9.462 -12.347 12.167 1.00 59.46 C ATOM 621 OE1 GLN A 906 -8.924 -13.253 11.507 1.00 59.12 O ATOM 622 NE2 GLN A 906 -10.786 -12.109 12.129 1.00 57.30 N ATOM 623 HE22 GLN A 906 -11.193 -11.340 12.698 1.00 0.00 H ATOM 624 HE21 GLN A 906 -11.403 -12.694 11.530 1.00 0.00 H ATOM 625 H GLN A 906 -7.874 -9.822 16.157 1.00 0.00 H ATOM 626 N HIS A 907 -8.590 -6.686 14.575 1.00 32.15 N ATOM 627 CA HIS A 907 -9.192 -5.505 15.163 1.00 29.30 C ATOM 628 C HIS A 907 -8.786 -4.278 14.366 1.00 30.08 C ATOM 629 O HIS A 907 -7.622 -4.118 14.012 1.00 30.43 O ATOM 630 CB HIS A 907 -8.732 -5.363 16.614 1.00 29.09 C ATOM 631 CG HIS A 907 -9.530 -4.382 17.415 1.00 28.42 C ATOM 632 ND1 HIS A 907 -9.388 -3.018 17.284 1.00 27.22 N ATOM 633 CD2 HIS A 907 -10.468 -4.570 18.373 1.00 28.95 C ATOM 634 CE1 HIS A 907 -10.214 -2.409 18.114 1.00 27.54 C ATOM 635 NE2 HIS A 907 -10.880 -3.328 18.789 1.00 29.24 N ATOM 636 H HIS A 907 -7.758 -6.579 13.960 1.00 0.00 H ATOM 637 N ASP A 908 -9.737 -3.388 14.117 1.00 31.38 N ATOM 638 CA ASP A 908 -9.482 -2.204 13.296 1.00 33.04 C ATOM 639 C ASP A 908 -8.326 -1.359 13.785 1.00 32.40 C ATOM 640 O ASP A 908 -7.771 -0.585 13.015 1.00 36.12 O ATOM 641 CB ASP A 908 -10.737 -1.342 13.193 1.00 33.26 C ATOM 642 CG ASP A 908 -11.855 -2.030 12.412 1.00 36.26 C ATOM 643 OD1 ASP A 908 -11.641 -3.173 11.943 1.00 39.23 O ATOM 644 OD2 ASP A 908 -12.948 -1.429 12.270 1.00 37.35 O ATOM 645 H ASP A 908 -10.687 -3.535 14.515 1.00 0.00 H ATOM 646 N ASN A 909 -7.957 -1.506 15.052 1.00 32.67 N ATOM 647 CA ASN A 909 -6.915 -0.684 15.662 1.00 33.71 C ATOM 648 C ASN A 909 -5.730 -1.527 16.062 1.00 33.92 C ATOM 649 O ASN A 909 -5.008 -1.199 16.994 1.00 37.81 O ATOM 650 CB ASN A 909 -7.469 0.055 16.878 1.00 33.73 C ATOM 651 CG ASN A 909 -8.661 0.911 16.536 1.00 33.36 C ATOM 652 OD1 ASN A 909 -8.649 2.100 16.738 1.00 34.93 O ATOM 653 ND2 ASN A 909 -9.693 0.301 16.002 1.00 39.43 N ATOM 654 HD22 ASN A 909 -9.665 -0.726 15.844 1.00 0.00 H ATOM 655 HD21 ASN A 909 -10.539 0.845 15.737 1.00 0.00 H ATOM 656 H ASN A 909 -8.426 -2.232 15.630 1.00 0.00 H ATOM 657 N ILE A 910 -5.542 -2.635 15.361 1.00 34.06 N ATOM 658 CA ILE A 910 -4.387 -3.485 15.564 1.00 31.80 C ATOM 659 C ILE A 910 -3.888 -3.912 14.194 1.00 32.90 C ATOM 660 O ILE A 910 -4.657 -4.348 13.341 1.00 33.98 O ATOM 661 CB ILE A 910 -4.732 -4.674 16.478 1.00 32.33 C ATOM 662 CG1 ILE A 910 -4.995 -4.142 17.901 1.00 31.39 C ATOM 663 CG2 ILE A 910 -3.614 -5.744 16.455 1.00 30.91 C ATOM 664 CD1 ILE A 910 -5.348 -5.197 18.913 1.00 33.80 C ATOM 665 H ILE A 910 -6.245 -2.903 14.643 1.00 0.00 H ATOM 666 N VAL A 911 -2.591 -3.737 13.987 1.00 36.91 N ATOM 667 CA VAL A 911 -1.947 -3.934 12.686 1.00 38.24 C ATOM 668 C VAL A 911 -2.068 -5.393 12.194 1.00 36.87 C ATOM 669 O VAL A 911 -1.944 -6.325 12.985 1.00 34.71 O ATOM 670 CB VAL A 911 -0.470 -3.490 12.789 1.00 39.38 C ATOM 671 CG1 VAL A 911 0.335 -4.518 13.576 1.00 40.14 C ATOM 672 CG2 VAL A 911 0.122 -3.222 11.418 1.00 40.75 C ATOM 673 H VAL A 911 -1.999 -3.444 14.790 1.00 0.00 H ATOM 674 N LYS A 912 -2.314 -5.563 10.890 1.00 37.08 N ATOM 675 CA LYS A 912 -2.657 -6.866 10.268 1.00 37.19 C ATOM 676 C LYS A 912 -1.466 -7.791 9.948 1.00 34.94 C ATOM 677 O LYS A 912 -0.517 -7.407 9.271 1.00 35.01 O ATOM 678 CB LYS A 912 -3.435 -6.651 8.959 1.00 38.87 C ATOM 679 CG LYS A 912 -4.822 -6.058 9.130 1.00 42.82 C ATOM 680 CD LYS A 912 -5.526 -5.813 7.780 1.00 45.46 C ATOM 681 CE LYS A 912 -6.667 -4.783 7.894 1.00 44.93 C ATOM 682 NZ LYS A 912 -7.184 -4.332 6.567 1.00 45.96 N ATOM 683 HZ1 LYS A 912 -6.412 -3.890 6.028 1.00 0.00 H ATOM 684 HZ2 LYS A 912 -7.550 -5.152 6.042 1.00 0.00 H ATOM 685 HZ3 LYS A 912 -7.948 -3.641 6.711 1.00 0.00 H ATOM 686 H LYS A 912 -2.261 -4.728 10.272 1.00 0.00 H ATOM 687 N TYR A 913 -1.551 -9.025 10.419 1.00 33.42 N ATOM 688 CA TYR A 913 -0.611 -10.084 10.049 1.00 34.21 C ATOM 689 C TYR A 913 -0.954 -10.616 8.669 1.00 32.55 C ATOM 690 O TYR A 913 -2.120 -10.860 8.388 1.00 33.62 O ATOM 691 CB TYR A 913 -0.720 -11.207 11.077 1.00 35.36 C ATOM 692 CG TYR A 913 -0.148 -12.541 10.677 1.00 35.74 C ATOM 693 CD1 TYR A 913 1.191 -12.830 10.887 1.00 36.06 C ATOM 694 CD2 TYR A 913 -0.960 -13.538 10.147 1.00 36.42 C ATOM 695 CE1 TYR A 913 1.715 -14.061 10.551 1.00 37.46 C ATOM 696 CE2 TYR A 913 -0.442 -14.774 9.806 1.00 36.11 C ATOM 697 CZ TYR A 913 0.894 -15.029 10.016 1.00 38.15 C ATOM 698 OH TYR A 913 1.430 -16.250 9.682 1.00 43.01 O ATOM 699 HH TYR A 913 2.396 -16.256 9.900 1.00 0.00 H ATOM 700 H TYR A 913 -2.320 -9.252 11.081 1.00 0.00 H ATOM 701 N LYS A 914 0.044 -10.791 7.807 1.00 33.17 N ATOM 702 CA LYS A 914 -0.198 -11.340 6.468 1.00 33.95 C ATOM 703 C LYS A 914 0.327 -12.759 6.343 1.00 33.52 C ATOM 704 O LYS A 914 -0.368 -13.627 5.838 1.00 36.27 O ATOM 705 CB LYS A 914 0.381 -10.443 5.365 1.00 36.35 C ATOM 706 CG LYS A 914 -0.436 -9.162 5.131 1.00 38.79 C ATOM 707 CD LYS A 914 -0.487 -8.766 3.669 1.00 41.64 C ATOM 708 CE LYS A 914 -1.238 -7.448 3.462 1.00 44.07 C ATOM 709 NZ LYS A 914 -2.562 -7.334 4.168 1.00 43.80 N ATOM 710 HZ1 LYS A 914 -3.197 -8.088 3.835 1.00 0.00 H ATOM 711 HZ2 LYS A 914 -2.416 -7.429 5.193 1.00 0.00 H ATOM 712 HZ3 LYS A 914 -2.985 -6.407 3.962 1.00 0.00 H ATOM 713 H LYS A 914 1.012 -10.534 8.087 1.00 0.00 H ATOM 714 N GLY A 915 1.540 -13.009 6.815 1.00 32.03 N ATOM 715 CA GLY A 915 2.079 -14.360 6.794 1.00 29.84 C ATOM 716 C GLY A 915 3.501 -14.437 7.301 1.00 29.47 C ATOM 717 O GLY A 915 3.939 -13.574 8.063 1.00 29.12 O ATOM 718 H GLY A 915 2.112 -12.232 7.204 1.00 0.00 H ATOM 719 N VAL A 916 4.201 -15.490 6.876 1.00 29.13 N ATOM 720 CA VAL A 916 5.619 -15.701 7.189 1.00 30.45 C ATOM 721 C VAL A 916 6.353 -16.324 5.997 1.00 30.80 C ATOM 722 O VAL A 916 5.741 -16.960 5.138 1.00 31.74 O ATOM 723 CB VAL A 916 5.817 -16.633 8.422 1.00 30.02 C ATOM 724 CG1 VAL A 916 5.468 -15.913 9.712 1.00 31.33 C ATOM 725 CG2 VAL A 916 5.001 -17.913 8.274 1.00 29.55 C ATOM 726 H VAL A 916 3.715 -16.200 6.291 1.00 0.00 H ATOM 727 N CYS A 917 7.670 -16.150 5.964 1.00 32.57 N ATOM 728 CA CYS A 917 8.511 -16.741 4.923 1.00 31.83 C ATOM 729 C CYS A 917 9.531 -17.676 5.546 1.00 30.72 C ATOM 730 O CYS A 917 10.371 -17.244 6.327 1.00 29.07 O ATOM 731 CB CYS A 917 9.236 -15.651 4.135 1.00 32.14 C ATOM 732 SG CYS A 917 10.430 -16.297 2.952 1.00 32.94 S ATOM 733 H CYS A 917 8.119 -15.573 6.704 1.00 0.00 H ATOM 734 N TYR A 918 9.443 -18.954 5.195 1.00 32.21 N ATOM 735 CA TYR A 918 10.362 -19.984 5.685 1.00 34.19 C ATOM 736 C TYR A 918 11.337 -20.413 4.593 1.00 36.72 C ATOM 737 O TYR A 918 12.090 -21.364 4.782 1.00 39.25 O ATOM 738 CB TYR A 918 9.579 -21.218 6.183 1.00 34.26 C ATOM 739 CG TYR A 918 9.111 -21.113 7.618 1.00 34.73 C ATOM 740 CD1 TYR A 918 9.977 -21.392 8.663 1.00 33.86 C ATOM 741 CD2 TYR A 918 7.807 -20.729 7.929 1.00 33.69 C ATOM 742 CE1 TYR A 918 9.568 -21.290 9.982 1.00 34.87 C ATOM 743 CE2 TYR A 918 7.389 -20.622 9.251 1.00 34.56 C ATOM 744 CZ TYR A 918 8.281 -20.904 10.273 1.00 36.26 C ATOM 745 OH TYR A 918 7.912 -20.820 11.599 1.00 38.90 O ATOM 746 HH TYR A 918 8.684 -21.058 12.171 1.00 0.00 H ATOM 747 H TYR A 918 8.685 -19.237 4.541 1.00 0.00 H ATOM 748 N SER A 919 11.343 -19.703 3.466 1.00 39.63 N ATOM 749 CA SER A 919 12.093 -20.130 2.283 1.00 40.67 C ATOM 750 C SER A 919 13.525 -20.520 2.605 1.00 44.17 C ATOM 751 O SER A 919 14.030 -21.512 2.072 1.00 49.28 O ATOM 752 CB SER A 919 12.106 -19.032 1.213 1.00 40.77 C ATOM 753 OG SER A 919 10.878 -18.957 0.510 1.00 42.30 O ATOM 754 HG SER A 919 10.931 -18.238 -0.168 1.00 0.00 H ATOM 755 H SER A 919 10.798 -18.818 3.425 1.00 0.00 H ATOM 756 N ALA A 920 14.170 -19.746 3.475 1.00 44.53 N ATOM 757 CA ALA A 920 15.599 -19.882 3.715 1.00 45.05 C ATOM 758 C ALA A 920 15.957 -20.497 5.074 1.00 48.80 C ATOM 759 O ALA A 920 17.074 -20.298 5.554 1.00 49.64 O ATOM 760 CB ALA A 920 16.257 -18.520 3.568 1.00 45.79 C ATOM 761 H ALA A 920 13.637 -19.023 3.999 1.00 0.00 H ATOM 762 N GLY A 921 15.042 -21.261 5.678 1.00 47.95 N ATOM 763 CA GLY A 921 15.249 -21.784 7.030 1.00 46.83 C ATOM 764 C GLY A 921 14.155 -21.408 8.013 1.00 48.24 C ATOM 765 O GLY A 921 13.443 -20.418 7.806 1.00 54.78 O ATOM 766 H GLY A 921 14.161 -21.490 5.175 1.00 0.00 H ATOM 767 N ARG A 922 14.004 -22.221 9.065 1.00 46.68 N ATOM 768 CA ARG A 922 13.687 -21.696 10.395 1.00 47.52 C ATOM 769 C ARG A 922 14.542 -20.434 10.560 1.00 50.04 C ATOM 770 O ARG A 922 14.006 -19.414 10.999 1.00 52.73 O ATOM 771 CB ARG A 922 13.949 -22.803 11.399 1.00 47.09 C ATOM 772 CG ARG A 922 12.973 -22.720 12.555 1.00 43.95 C ATOM 773 CD ARG A 922 13.570 -23.156 13.845 1.00 43.96 C ATOM 774 NE ARG A 922 12.663 -22.859 14.955 1.00 45.46 N ATOM 775 CZ ARG A 922 13.051 -22.695 16.219 1.00 47.62 C ATOM 776 NH1 ARG A 922 14.335 -22.782 16.555 1.00 51.14 N ATOM 777 NH2 ARG A 922 12.160 -22.420 17.160 1.00 49.61 N ATOM 778 HE ARG A 922 11.649 -22.770 14.743 1.00 0.00 H ATOM 779 HH12 ARG A 922 14.623 -22.652 17.546 1.00 0.00 H ATOM 780 HH11 ARG A 922 15.051 -22.980 15.827 1.00 0.00 H ATOM 781 HH22 ARG A 922 12.467 -22.293 18.145 1.00 0.00 H ATOM 782 HH21 ARG A 922 11.154 -22.331 16.913 1.00 0.00 H ATOM 783 H ARG A 922 14.114 -23.247 8.936 1.00 0.00 H ATOM 784 N ARG A 923 15.868 -20.480 10.382 1.00 52.73 N ATOM 785 CA ARG A 923 16.830 -20.019 11.380 1.00 49.18 C ATOM 786 C ARG A 923 16.871 -18.529 10.923 1.00 48.67 C ATOM 787 O ARG A 923 17.462 -17.671 11.579 1.00 47.47 O ATOM 788 CB ARG A 923 18.232 -20.620 11.237 1.00 50.30 C ATOM 789 CG ARG A 923 19.262 -20.004 12.218 1.00 52.68 C ATOM 790 CD ARG A 923 20.671 -20.589 12.077 1.00 54.32 C ATOM 791 NE ARG A 923 21.663 -19.794 12.799 1.00 50.87 N ATOM 792 HE ARG A 923 21.368 -18.945 13.323 1.00 0.00 H ATOM 793 H ARG A 923 16.232 -20.864 9.487 1.00 0.00 H ATOM 794 N ASN A 924 16.262 -18.246 9.762 1.00 46.10 N ATOM 795 CA ASN A 924 16.002 -16.880 9.340 1.00 46.28 C ATOM 796 C ASN A 924 14.563 -16.682 8.784 1.00 43.33 C ATOM 797 O ASN A 924 14.343 -16.216 7.656 1.00 39.40 O ATOM 798 CB ASN A 924 17.112 -16.375 8.396 1.00 51.02 C ATOM 799 CG ASN A 924 17.577 -17.426 7.414 1.00 52.52 C ATOM 800 OD1 ASN A 924 18.742 -17.838 7.432 1.00 52.84 O ATOM 801 ND2 ASN A 924 16.673 -17.860 6.543 1.00 54.03 N ATOM 802 HD22 ASN A 924 15.704 -17.483 6.568 1.00 0.00 H ATOM 803 HD21 ASN A 924 16.934 -18.577 5.836 1.00 0.00 H ATOM 804 H ASN A 924 15.967 -19.029 9.144 1.00 0.00 H ATOM 805 N LEU A 925 13.604 -17.054 9.631 1.00 40.54 N ATOM 806 CA LEU A 925 12.190 -16.678 9.510 1.00 39.21 C ATOM 807 C LEU A 925 12.020 -15.199 9.164 1.00 39.39 C ATOM 808 O LEU A 925 12.783 -14.347 9.630 1.00 39.69 O ATOM 809 CB LEU A 925 11.480 -16.919 10.856 1.00 40.01 C ATOM 810 CG LEU A 925 10.162 -17.696 10.905 1.00 41.74 C ATOM 811 CD1 LEU A 925 9.643 -17.759 12.338 1.00 42.86 C ATOM 812 CD2 LEU A 925 9.126 -17.099 9.985 1.00 43.39 C ATOM 813 H LEU A 925 13.877 -17.654 10.436 1.00 0.00 H ATOM 814 N LYS A 926 11.017 -14.899 8.348 1.00 37.23 N ATOM 815 CA LYS A 926 10.578 -13.527 8.143 1.00 34.36 C ATOM 816 C LYS A 926 9.093 -13.452 8.451 1.00 30.78 C ATOM 817 O LYS A 926 8.308 -14.276 7.971 1.00 28.83 O ATOM 818 CB LYS A 926 10.796 -13.067 6.706 1.00 36.56 C ATOM 819 CG LYS A 926 12.234 -12.865 6.297 1.00 38.74 C ATOM 820 CD LYS A 926 12.312 -12.696 4.778 1.00 43.32 C ATOM 821 CE LYS A 926 13.735 -12.475 4.277 1.00 44.36 C ATOM 822 NZ LYS A 926 14.041 -11.043 4.041 1.00 46.20 N ATOM 823 HZ1 LYS A 926 13.388 -10.663 3.326 1.00 0.00 H ATOM 824 HZ2 LYS A 926 13.929 -10.515 4.930 1.00 0.00 H ATOM 825 HZ3 LYS A 926 15.020 -10.950 3.702 1.00 0.00 H ATOM 826 H LYS A 926 10.531 -15.666 7.841 1.00 0.00 H ATOM 827 N LEU A 927 8.733 -12.468 9.269 1.00 27.61 N ATOM 828 CA LEU A 927 7.351 -12.128 9.546 1.00 25.28 C ATOM 829 C LEU A 927 6.889 -11.087 8.531 1.00 25.78 C ATOM 830 O LEU A 927 7.617 -10.144 8.238 1.00 26.53 O ATOM 831 CB LEU A 927 7.238 -11.573 10.961 1.00 24.07 C ATOM 832 CG LEU A 927 5.968 -10.812 11.316 1.00 23.12 C ATOM 833 CD1 LEU A 927 4.750 -11.698 11.142 1.00 22.46 C ATOM 834 CD2 LEU A 927 6.089 -10.278 12.733 1.00 23.37 C ATOM 835 H LEU A 927 9.480 -11.914 9.734 1.00 0.00 H ATOM 836 N ILE A 928 5.678 -11.241 8.009 1.00 24.50 N ATOM 837 CA ILE A 928 5.168 -10.293 7.031 1.00 26.39 C ATOM 838 C ILE A 928 3.829 -9.676 7.431 1.00 28.25 C ATOM 839 O ILE A 928 2.835 -10.366 7.626 1.00 28.08 O ATOM 840 CB ILE A 928 5.057 -10.935 5.659 1.00 26.99 C ATOM 841 CG1 ILE A 928 6.376 -11.658 5.345 1.00 26.93 C ATOM 842 CG2 ILE A 928 4.705 -9.868 4.626 1.00 26.62 C ATOM 843 CD1 ILE A 928 6.356 -12.439 4.108 1.00 27.68 C ATOM 844 H ILE A 928 5.089 -12.046 8.302 1.00 0.00 H ATOM 845 N MET A 929 3.830 -8.353 7.536 1.00 29.12 N ATOM 846 CA MET A 929 2.702 -7.592 8.062 1.00 28.85 C ATOM 847 C MET A 929 2.314 -6.570 7.019 1.00 28.28 C ATOM 848 O MET A 929 3.075 -6.312 6.099 1.00 29.27 O ATOM 849 CB MET A 929 3.114 -6.871 9.351 1.00 27.03 C ATOM 850 CG MET A 929 3.725 -7.764 10.412 1.00 26.64 C ATOM 851 SD MET A 929 2.512 -8.672 11.367 1.00 27.11 S ATOM 852 CE MET A 929 1.793 -7.318 12.303 1.00 27.86 C ATOM 853 H MET A 929 4.677 -7.833 7.228 1.00 0.00 H ATOM 854 N GLU A 930 1.135 -5.988 7.161 1.00 27.27 N ATOM 855 CA GLU A 930 0.733 -4.894 6.294 1.00 27.40 C ATOM 856 C GLU A 930 1.686 -3.736 6.505 1.00 27.91 C ATOM 857 O GLU A 930 2.261 -3.577 7.588 1.00 25.44 O ATOM 858 CB GLU A 930 -0.698 -4.433 6.593 1.00 28.82 C ATOM 859 CG GLU A 930 -0.878 -3.798 7.971 1.00 31.05 C ATOM 860 CD GLU A 930 -2.282 -3.312 8.230 1.00 32.38 C ATOM 861 OE1 GLU A 930 -2.761 -3.509 9.366 1.00 31.79 O ATOM 862 OE2 GLU A 930 -2.901 -2.731 7.308 1.00 36.87 O ATOM 863 H GLU A 930 0.486 -6.318 7.904 1.00 0.00 H ATOM 864 N TYR A 931 1.831 -2.924 5.466 1.00 29.84 N ATOM 865 CA TYR A 931 2.662 -1.740 5.517 1.00 30.63 C ATOM 866 C TYR A 931 1.745 -0.540 5.630 1.00 30.70 C ATOM 867 O TYR A 931 0.885 -0.347 4.776 1.00 31.74 O ATOM 868 CB TYR A 931 3.530 -1.650 4.259 1.00 31.11 C ATOM 869 CG TYR A 931 4.261 -0.336 4.095 1.00 31.50 C ATOM 870 CD1 TYR A 931 5.323 0.001 4.925 1.00 31.22 C ATOM 871 CD2 TYR A 931 3.888 0.569 3.105 1.00 32.48 C ATOM 872 CE1 TYR A 931 6.002 1.207 4.767 1.00 32.41 C ATOM 873 CE2 TYR A 931 4.556 1.774 2.941 1.00 32.88 C ATOM 874 CZ TYR A 931 5.610 2.086 3.777 1.00 32.52 C ATOM 875 OH TYR A 931 6.274 3.279 3.618 1.00 32.85 O ATOM 876 HH TYR A 931 6.996 3.346 4.292 1.00 0.00 H ATOM 877 H TYR A 931 1.329 -3.146 4.583 1.00 0.00 H ATOM 878 N LEU A 932 1.923 0.249 6.693 1.00 31.60 N ATOM 879 CA LEU A 932 1.181 1.496 6.884 1.00 31.21 C ATOM 880 C LEU A 932 2.119 2.654 6.545 1.00 31.95 C ATOM 881 O LEU A 932 3.123 2.833 7.228 1.00 31.15 O ATOM 882 CB LEU A 932 0.681 1.615 8.327 1.00 29.52 C ATOM 883 CG LEU A 932 0.011 0.390 8.960 1.00 29.10 C ATOM 884 CD1 LEU A 932 -0.331 0.711 10.388 1.00 30.23 C ATOM 885 CD2 LEU A 932 -1.230 -0.043 8.225 1.00 31.03 C ATOM 886 H LEU A 932 2.617 -0.034 7.414 1.00 0.00 H ATOM 887 N PRO A 933 1.812 3.425 5.478 1.00 32.37 N ATOM 888 CA PRO A 933 2.753 4.437 4.956 1.00 31.39 C ATOM 889 C PRO A 933 3.162 5.561 5.896 1.00 30.50 C ATOM 890 O PRO A 933 4.261 6.094 5.744 1.00 29.87 O ATOM 891 CB PRO A 933 2.024 5.024 3.732 1.00 30.20 C ATOM 892 CG PRO A 933 1.036 4.019 3.350 1.00 32.27 C ATOM 893 CD PRO A 933 0.596 3.362 4.648 1.00 33.00 C ATOM 894 N TYR A 934 2.322 5.939 6.854 1.00 31.39 N ATOM 895 CA TYR A 934 2.666 7.111 7.688 1.00 31.54 C ATOM 896 C TYR A 934 3.586 6.819 8.875 1.00 28.72 C ATOM 897 O TYR A 934 3.993 7.730 9.578 1.00 30.42 O ATOM 898 CB TYR A 934 1.411 7.865 8.123 1.00 32.84 C ATOM 899 CG TYR A 934 0.635 8.398 6.939 1.00 36.45 C ATOM 900 CD1 TYR A 934 1.129 9.446 6.172 1.00 37.25 C ATOM 901 CD2 TYR A 934 -0.574 7.824 6.560 1.00 39.55 C ATOM 902 CE1 TYR A 934 0.429 9.928 5.076 1.00 37.03 C ATOM 903 CE2 TYR A 934 -1.279 8.293 5.467 1.00 40.90 C ATOM 904 CZ TYR A 934 -0.771 9.347 4.727 1.00 40.32 C ATOM 905 OH TYR A 934 -1.482 9.801 3.638 1.00 40.61 O ATOM 906 HH TYR A 934 -0.993 10.552 3.216 1.00 0.00 H ATOM 907 H TYR A 934 1.436 5.419 7.015 1.00 0.00 H ATOM 908 N GLY A 935 3.940 5.559 9.082 1.00 27.09 N ATOM 909 CA GLY A 935 4.942 5.213 10.080 1.00 26.29 C ATOM 910 C GLY A 935 4.445 5.266 11.508 1.00 23.50 C ATOM 911 O GLY A 935 3.279 5.021 11.768 1.00 23.94 O ATOM 912 H GLY A 935 3.494 4.804 8.522 1.00 0.00 H ATOM 913 N SER A 936 5.348 5.573 12.430 1.00 23.05 N ATOM 914 CA SER A 936 5.031 5.573 13.854 1.00 23.70 C ATOM 915 C SER A 936 4.414 6.897 14.290 1.00 24.45 C ATOM 916 O SER A 936 4.660 7.946 13.692 1.00 23.25 O ATOM 917 CB SER A 936 6.280 5.258 14.700 1.00 22.91 C ATOM 918 OG SER A 936 7.024 6.417 15.013 1.00 23.58 O ATOM 919 HG SER A 936 7.323 6.852 14.175 1.00 0.00 H ATOM 920 H SER A 936 6.312 5.821 12.128 1.00 0.00 H ATOM 921 N LEU A 937 3.620 6.822 15.354 1.00 26.10 N ATOM 922 CA LEU A 937 2.961 7.991 15.934 1.00 28.12 C ATOM 923 C LEU A 937 3.988 9.021 16.422 1.00 28.64 C ATOM 924 O LEU A 937 3.709 10.213 16.459 1.00 29.63 O ATOM 925 CB LEU A 937 2.064 7.567 17.105 1.00 29.74 C ATOM 926 CG LEU A 937 0.652 8.165 17.204 1.00 31.44 C ATOM 927 CD1 LEU A 937 0.106 7.918 18.608 1.00 31.31 C ATOM 928 CD2 LEU A 937 0.584 9.647 16.847 1.00 30.81 C ATOM 929 H LEU A 937 3.461 5.892 15.792 1.00 0.00 H ATOM 930 N ARG A 938 5.176 8.545 16.782 1.00 28.70 N ATOM 931 CA ARG A 938 6.232 9.381 17.337 1.00 28.08 C ATOM 932 C ARG A 938 6.782 10.333 16.311 1.00 28.07 C ATOM 933 O ARG A 938 7.024 11.486 16.617 1.00 27.88 O ATOM 934 CB ARG A 938 7.366 8.486 17.826 1.00 28.73 C ATOM 935 CG ARG A 938 8.428 9.169 18.653 1.00 28.65 C ATOM 936 CD ARG A 938 9.553 8.191 18.886 1.00 31.15 C ATOM 937 NE ARG A 938 10.368 8.638 20.040 1.00 32.07 N ATOM 938 HE ARG A 938 10.117 9.511 20.547 1.00 0.00 H ATOM 939 H ARG A 938 5.360 7.528 16.662 1.00 0.00 H ATOM 940 N ASP A 939 7.010 9.812 15.103 1.00 31.98 N ATOM 941 CA ASP A 939 7.531 10.581 13.968 1.00 31.60 C ATOM 942 C ASP A 939 6.414 11.374 13.343 1.00 29.57 C ATOM 943 O ASP A 939 6.551 12.561 13.120 1.00 31.03 O ATOM 944 CB ASP A 939 8.122 9.653 12.901 1.00 32.86 C ATOM 945 CG ASP A 939 9.274 8.823 13.422 1.00 35.31 C ATOM 946 OD1 ASP A 939 10.037 9.338 14.270 1.00 35.94 O ATOM 947 OD2 ASP A 939 9.405 7.651 12.989 1.00 40.22 O ATOM 948 H ASP A 939 6.806 8.802 14.959 1.00 0.00 H ATOM 949 N TYR A 940 5.309 10.703 13.052 1.00 28.86 N ATOM 950 CA TYR A 940 4.143 11.355 12.472 1.00 29.38 C ATOM 951 C TYR A 940 3.746 12.591 13.275 1.00 30.96 C ATOM 952 O TYR A 940 3.690 13.695 12.739 1.00 31.60 O ATOM 953 CB TYR A 940 2.981 10.372 12.392 1.00 28.37 C ATOM 954 CG TYR A 940 1.752 10.927 11.731 1.00 29.63 C ATOM 955 CD1 TYR A 940 1.602 10.887 10.342 1.00 28.47 C ATOM 956 CD2 TYR A 940 0.723 11.485 12.489 1.00 29.64 C ATOM 957 CE1 TYR A 940 0.469 11.393 9.730 1.00 26.50 C ATOM 958 CE2 TYR A 940 -0.413 11.997 11.878 1.00 28.05 C ATOM 959 CZ TYR A 940 -0.528 11.942 10.505 1.00 26.50 C ATOM 960 OH TYR A 940 -1.641 12.436 9.905 1.00 28.48 O ATOM 961 HH TYR A 940 -1.565 12.320 8.925 1.00 0.00 H ATOM 962 H TYR A 940 5.273 9.681 13.243 1.00 0.00 H ATOM 963 N LEU A 941 3.504 12.414 14.567 1.00 32.67 N ATOM 964 CA LEU A 941 3.093 13.529 15.407 1.00 33.93 C ATOM 965 C LEU A 941 4.133 14.638 15.369 1.00 35.84 C ATOM 966 O LEU A 941 3.792 15.815 15.267 1.00 34.03 O ATOM 967 CB LEU A 941 2.841 13.082 16.859 1.00 33.22 C ATOM 968 CG LEU A 941 2.377 14.154 17.863 1.00 34.44 C ATOM 969 CD1 LEU A 941 1.333 15.080 17.268 1.00 35.33 C ATOM 970 CD2 LEU A 941 1.844 13.526 19.138 1.00 34.88 C ATOM 971 H LEU A 941 3.609 11.467 14.985 1.00 0.00 H ATOM 972 N GLN A 942 5.403 14.256 15.440 1.00 39.29 N ATOM 973 CA GLN A 942 6.472 15.233 15.498 1.00 41.40 C ATOM 974 C GLN A 942 6.578 16.087 14.220 1.00 41.13 C ATOM 975 O GLN A 942 6.840 17.280 14.305 1.00 46.42 O ATOM 976 CB GLN A 942 7.796 14.557 15.826 1.00 41.69 C ATOM 977 CG GLN A 942 8.917 15.558 16.113 1.00 48.58 C ATOM 978 CD GLN A 942 9.895 15.073 17.171 1.00 50.73 C ATOM 979 OE1 GLN A 942 10.202 13.879 17.256 1.00 53.07 O ATOM 980 NE2 GLN A 942 10.386 16.002 17.991 1.00 51.49 N ATOM 981 HE22 GLN A 942 10.099 16.996 17.882 1.00 0.00 H ATOM 982 HE21 GLN A 942 11.056 15.733 18.740 1.00 0.00 H ATOM 983 H GLN A 942 5.634 13.242 15.454 1.00 0.00 H ATOM 984 N LYS A 943 6.341 15.503 13.052 1.00 41.08 N ATOM 985 CA LYS A 943 6.424 16.268 11.805 1.00 42.72 C ATOM 986 C LYS A 943 5.109 16.985 11.445 1.00 42.47 C ATOM 987 O LYS A 943 5.148 18.077 10.871 1.00 42.62 O ATOM 988 CB LYS A 943 6.945 15.396 10.638 1.00 44.62 C ATOM 989 CG LYS A 943 5.917 14.956 9.596 1.00 47.83 C ATOM 990 CD LYS A 943 6.586 14.136 8.487 1.00 48.74 C ATOM 991 CE LYS A 943 5.558 13.505 7.539 1.00 47.70 C ATOM 992 H LYS A 943 6.094 14.493 13.022 1.00 0.00 H ATOM 993 N HIS A 944 3.964 16.391 11.792 1.00 37.90 N ATOM 994 CA HIS A 944 2.648 16.956 11.436 1.00 36.95 C ATOM 995 C HIS A 944 1.942 17.779 12.546 1.00 36.99 C ATOM 996 O HIS A 944 0.798 18.205 12.371 1.00 34.42 O ATOM 997 CB HIS A 944 1.719 15.823 10.978 1.00 39.39 C ATOM 998 CG HIS A 944 1.965 15.367 9.573 1.00 42.43 C ATOM 999 ND1 HIS A 944 1.610 16.123 8.474 1.00 44.54 N ATOM 1000 CD2 HIS A 944 2.509 14.229 9.085 1.00 43.55 C ATOM 1001 CE1 HIS A 944 1.931 15.472 7.371 1.00 43.32 C ATOM 1002 NE2 HIS A 944 2.479 14.321 7.714 1.00 46.81 N ATOM 1003 H HIS A 944 4.001 15.502 12.330 1.00 0.00 H ATOM 1004 N LYS A 945 2.633 18.005 13.663 1.00 38.78 N ATOM 1005 CA LYS A 945 2.050 18.576 14.898 1.00 38.18 C ATOM 1006 C LYS A 945 1.176 19.837 14.749 1.00 39.53 C ATOM 1007 O LYS A 945 0.183 20.014 15.473 1.00 37.76 O ATOM 1008 CB LYS A 945 3.162 18.858 15.933 1.00 39.60 C ATOM 1009 CG LYS A 945 4.322 19.722 15.437 1.00 41.13 C ATOM 1010 CD LYS A 945 5.509 19.701 16.396 1.00 42.51 C ATOM 1011 CE LYS A 945 6.718 20.384 15.776 1.00 43.71 C ATOM 1012 NZ LYS A 945 7.703 20.808 16.790 1.00 47.32 N ATOM 1013 HZ1 LYS A 945 7.255 21.478 17.447 1.00 0.00 H ATOM 1014 HZ2 LYS A 945 8.037 19.976 17.316 1.00 0.00 H ATOM 1015 HZ3 LYS A 945 8.508 21.268 16.319 1.00 0.00 H ATOM 1016 H LYS A 945 3.645 17.765 13.667 1.00 0.00 H ATOM 1017 N GLU A 946 1.540 20.714 13.822 1.00 38.71 N ATOM 1018 CA GLU A 946 0.849 21.985 13.693 1.00 40.23 C ATOM 1019 C GLU A 946 -0.536 21.814 13.043 1.00 40.18 C ATOM 1020 O GLU A 946 -1.338 22.757 13.027 1.00 41.25 O ATOM 1021 CB GLU A 946 1.724 22.989 12.931 1.00 41.14 C ATOM 1022 H GLU A 946 2.328 20.489 13.182 1.00 0.00 H ATOM 1023 N ARG A 947 -0.817 20.618 12.521 1.00 37.77 N ATOM 1024 CA ARG A 947 -2.174 20.266 12.068 1.00 38.18 C ATOM 1025 C ARG A 947 -2.916 19.381 13.080 1.00 35.78 C ATOM 1026 O ARG A 947 -4.032 18.944 12.814 1.00 36.16 O ATOM 1027 CB ARG A 947 -2.134 19.564 10.695 1.00 38.68 C ATOM 1028 CG ARG A 947 -1.659 20.455 9.538 1.00 41.98 C ATOM 1029 H ARG A 947 -0.056 19.915 12.432 1.00 0.00 H ATOM 1030 N ILE A 948 -2.311 19.133 14.240 1.00 34.80 N ATOM 1031 CA ILE A 948 -2.847 18.170 15.206 1.00 34.12 C ATOM 1032 C ILE A 948 -3.126 18.806 16.566 1.00 34.43 C ATOM 1033 O ILE A 948 -2.205 19.084 17.325 1.00 33.48 O ATOM 1034 CB ILE A 948 -1.881 17.000 15.393 1.00 35.07 C ATOM 1035 CG1 ILE A 948 -1.760 16.207 14.086 1.00 35.34 C ATOM 1036 CG2 ILE A 948 -2.353 16.102 16.512 1.00 36.04 C ATOM 1037 CD1 ILE A 948 -0.799 15.039 14.161 1.00 36.38 C ATOM 1038 H ILE A 948 -1.431 19.638 14.468 1.00 0.00 H ATOM 1039 N ASP A 949 -4.407 19.020 16.864 1.00 35.63 N ATOM 1040 CA ASP A 949 -4.833 19.687 18.103 1.00 35.69 C ATOM 1041 C ASP A 949 -5.239 18.674 19.183 1.00 33.53 C ATOM 1042 O ASP A 949 -5.168 17.461 18.963 1.00 30.88 O ATOM 1043 CB ASP A 949 -5.965 20.695 17.819 1.00 37.45 C ATOM 1044 CG ASP A 949 -7.213 20.056 17.192 1.00 38.84 C ATOM 1045 OD1 ASP A 949 -7.362 18.811 17.189 1.00 38.62 O ATOM 1046 OD2 ASP A 949 -8.063 20.828 16.700 1.00 41.31 O ATOM 1047 H ASP A 949 -5.135 18.702 16.193 1.00 0.00 H ATOM 1048 N HIS A 950 -5.653 19.173 20.345 1.00 30.82 N ATOM 1049 CA HIS A 950 -6.021 18.304 21.467 1.00 31.39 C ATOM 1050 C HIS A 950 -7.121 17.296 21.104 1.00 31.89 C ATOM 1051 O HIS A 950 -7.145 16.184 21.634 1.00 31.68 O ATOM 1052 CB HIS A 950 -6.441 19.145 22.680 1.00 31.04 C ATOM 1053 CG HIS A 950 -5.300 19.819 23.382 1.00 32.07 C ATOM 1054 ND1 HIS A 950 -4.007 19.795 22.905 1.00 33.84 N ATOM 1055 CD2 HIS A 950 -5.264 20.551 24.521 1.00 33.43 C ATOM 1056 CE1 HIS A 950 -3.222 20.464 23.731 1.00 33.96 C ATOM 1057 NE2 HIS A 950 -3.960 20.935 24.719 1.00 32.90 N ATOM 1058 H HIS A 950 -5.717 20.205 20.460 1.00 0.00 H ATOM 1059 N ILE A 951 -8.019 17.676 20.199 1.00 32.69 N ATOM 1060 CA ILE A 951 -9.113 16.796 19.795 1.00 34.71 C ATOM 1061 C ILE A 951 -8.576 15.623 18.967 1.00 36.41 C ATOM 1062 O ILE A 951 -8.986 14.474 19.164 1.00 38.73 O ATOM 1063 CB ILE A 951 -10.203 17.554 18.990 1.00 35.26 C ATOM 1064 CG1 ILE A 951 -10.761 18.729 19.803 1.00 38.96 C ATOM 1065 CG2 ILE A 951 -11.341 16.625 18.613 1.00 34.96 C ATOM 1066 H ILE A 951 -7.941 18.620 19.770 1.00 0.00 H ATOM 1067 N LYS A 952 -7.663 15.913 18.038 1.00 35.82 N ATOM 1068 CA LYS A 952 -7.024 14.858 17.267 1.00 35.45 C ATOM 1069 C LYS A 952 -6.303 13.926 18.212 1.00 34.01 C ATOM 1070 O LYS A 952 -6.474 12.711 18.145 1.00 37.48 O ATOM 1071 CB LYS A 952 -6.040 15.409 16.228 1.00 37.02 C ATOM 1072 CG LYS A 952 -6.523 15.252 14.798 1.00 38.04 C ATOM 1073 CD LYS A 952 -6.592 13.786 14.385 1.00 39.81 C ATOM 1074 CE LYS A 952 -7.891 13.490 13.647 1.00 42.71 C ATOM 1075 NZ LYS A 952 -8.033 14.294 12.410 1.00 43.99 N ATOM 1076 HZ1 LYS A 952 -8.024 15.305 12.652 1.00 0.00 H ATOM 1077 HZ2 LYS A 952 -7.243 14.083 11.768 1.00 0.00 H ATOM 1078 HZ3 LYS A 952 -8.932 14.056 11.945 1.00 0.00 H ATOM 1079 H LYS A 952 -7.405 16.905 17.863 1.00 0.00 H ATOM 1080 N LEU A 953 -5.519 14.508 19.110 1.00 32.28 N ATOM 1081 CA LEU A 953 -4.755 13.732 20.088 1.00 31.24 C ATOM 1082 C LEU A 953 -5.653 12.810 20.895 1.00 29.67 C ATOM 1083 O LEU A 953 -5.259 11.701 21.233 1.00 30.37 O ATOM 1084 CB LEU A 953 -3.947 14.661 21.012 1.00 31.11 C ATOM 1085 CG LEU A 953 -2.765 15.406 20.357 1.00 30.67 C ATOM 1086 CD1 LEU A 953 -2.074 16.312 21.345 1.00 30.84 C ATOM 1087 CD2 LEU A 953 -1.746 14.444 19.750 1.00 31.43 C ATOM 1088 H LEU A 953 -5.445 15.545 19.119 1.00 0.00 H ATOM 1089 N LEU A 954 -6.866 13.263 21.189 1.00 31.18 N ATOM 1090 CA LEU A 954 -7.830 12.446 21.928 1.00 30.36 C ATOM 1091 C LEU A 954 -8.499 11.388 21.049 1.00 29.94 C ATOM 1092 O LEU A 954 -8.970 10.372 21.556 1.00 27.00 O ATOM 1093 CB LEU A 954 -8.887 13.331 22.597 1.00 29.39 C ATOM 1094 CG LEU A 954 -8.401 14.148 23.800 1.00 29.98 C ATOM 1095 CD1 LEU A 954 -9.410 15.205 24.178 1.00 30.15 C ATOM 1096 CD2 LEU A 954 -8.104 13.259 24.985 1.00 30.83 C ATOM 1097 H LEU A 954 -7.138 14.221 20.887 1.00 0.00 H ATOM 1098 N GLN A 955 -8.555 11.620 19.743 1.00 30.09 N ATOM 1099 CA GLN A 955 -9.057 10.592 18.839 1.00 33.49 C ATOM 1100 C GLN A 955 -8.094 9.422 18.813 1.00 35.59 C ATOM 1101 O GLN A 955 -8.504 8.254 18.876 1.00 35.08 O ATOM 1102 CB GLN A 955 -9.246 11.097 17.407 1.00 34.85 C ATOM 1103 CG GLN A 955 -10.043 10.088 16.587 1.00 37.14 C ATOM 1104 CD GLN A 955 -10.165 10.418 15.117 1.00 40.30 C ATOM 1105 OE1 GLN A 955 -9.953 11.545 14.694 1.00 42.64 O ATOM 1106 NE2 GLN A 955 -10.537 9.417 14.325 1.00 46.24 N ATOM 1107 HE22 GLN A 955 -10.707 8.473 14.726 1.00 0.00 H ATOM 1108 HE21 GLN A 955 -10.658 9.578 13.305 1.00 0.00 H ATOM 1109 H GLN A 955 -8.240 12.536 19.364 1.00 0.00 H ATOM 1110 N TYR A 956 -6.811 9.745 18.692 1.00 34.69 N ATOM 1111 CA TYR A 956 -5.775 8.728 18.724 1.00 35.83 C ATOM 1112 C TYR A 956 -5.855 7.943 20.013 1.00 32.77 C ATOM 1113 O TYR A 956 -5.849 6.715 19.988 1.00 35.07 O ATOM 1114 CB TYR A 956 -4.376 9.339 18.589 1.00 37.06 C ATOM 1115 CG TYR A 956 -4.129 10.055 17.283 1.00 38.63 C ATOM 1116 CD1 TYR A 956 -4.733 9.629 16.094 1.00 38.73 C ATOM 1117 CD2 TYR A 956 -3.287 11.164 17.235 1.00 39.31 C ATOM 1118 CE1 TYR A 956 -4.507 10.294 14.898 1.00 40.67 C ATOM 1119 CE2 TYR A 956 -3.043 11.829 16.037 1.00 40.62 C ATOM 1120 CZ TYR A 956 -3.661 11.393 14.876 1.00 42.33 C ATOM 1121 OH TYR A 956 -3.437 12.058 13.687 1.00 45.00 O ATOM 1122 HH TYR A 956 -3.951 11.620 12.963 1.00 0.00 H ATOM 1123 H TYR A 956 -6.544 10.743 18.572 1.00 0.00 H ATOM 1124 N THR A 957 -5.935 8.654 21.131 1.00 30.69 N ATOM 1125 CA THR A 957 -5.986 8.014 22.449 1.00 30.30 C ATOM 1126 C THR A 957 -7.117 6.991 22.573 1.00 30.94 C ATOM 1127 O THR A 957 -6.923 5.906 23.107 1.00 28.71 O ATOM 1128 CB THR A 957 -6.143 9.063 23.550 1.00 28.13 C ATOM 1129 OG1 THR A 957 -5.107 10.038 23.417 1.00 27.57 O ATOM 1130 CG2 THR A 957 -6.053 8.414 24.906 1.00 27.49 C ATOM 1131 HG1 THR A 957 -5.176 10.472 22.530 1.00 0.00 H ATOM 1132 H THR A 957 -5.962 9.692 21.070 1.00 0.00 H ATOM 1133 N SER A 958 -8.290 7.352 22.072 1.00 32.32 N ATOM 1134 CA SER A 958 -9.453 6.469 22.094 1.00 32.97 C ATOM 1135 C SER A 958 -9.176 5.151 21.381 1.00 30.47 C ATOM 1136 O SER A 958 -9.514 4.079 21.873 1.00 30.06 O ATOM 1137 CB SER A 958 -10.652 7.158 21.425 1.00 35.32 C ATOM 1138 OG SER A 958 -11.505 6.208 20.803 1.00 41.14 O ATOM 1139 HG SER A 958 -12.267 6.677 20.381 1.00 0.00 H ATOM 1140 H SER A 958 -8.385 8.297 21.648 1.00 0.00 H ATOM 1141 N GLN A 959 -8.584 5.259 20.203 1.00 28.69 N ATOM 1142 CA GLN A 959 -8.338 4.119 19.337 1.00 28.05 C ATOM 1143 C GLN A 959 -7.332 3.189 19.984 1.00 27.38 C ATOM 1144 O GLN A 959 -7.431 1.965 19.863 1.00 25.73 O ATOM 1145 CB GLN A 959 -7.840 4.602 17.974 1.00 29.10 C ATOM 1146 CG GLN A 959 -8.954 5.176 17.119 1.00 29.49 C ATOM 1147 CD GLN A 959 -8.459 5.835 15.846 1.00 33.59 C ATOM 1148 OE1 GLN A 959 -7.459 5.424 15.264 1.00 34.91 O ATOM 1149 NE2 GLN A 959 -9.172 6.869 15.403 1.00 37.38 N ATOM 1150 HE22 GLN A 959 -10.013 7.184 15.928 1.00 0.00 H ATOM 1151 HE21 GLN A 959 -8.888 7.362 14.532 1.00 0.00 H ATOM 1152 H GLN A 959 -8.282 6.201 19.883 1.00 0.00 H ATOM 1153 N ILE A 960 -6.384 3.785 20.700 1.00 27.55 N ATOM 1154 CA ILE A 960 -5.414 3.030 21.478 1.00 28.72 C ATOM 1155 C ILE A 960 -6.077 2.223 22.607 1.00 30.05 C ATOM 1156 O ILE A 960 -5.763 1.049 22.787 1.00 32.30 O ATOM 1157 CB ILE A 960 -4.319 3.952 22.019 1.00 29.43 C ATOM 1158 CG1 ILE A 960 -3.490 4.498 20.845 1.00 29.22 C ATOM 1159 CG2 ILE A 960 -3.433 3.214 23.032 1.00 31.35 C ATOM 1160 CD1 ILE A 960 -2.445 5.528 21.231 1.00 30.30 C ATOM 1161 H ILE A 960 -6.334 4.824 20.704 1.00 0.00 H ATOM 1162 N CYS A 961 -7.001 2.839 23.339 1.00 31.56 N ATOM 1163 CA CYS A 961 -7.753 2.148 24.391 1.00 32.50 C ATOM 1164 C CYS A 961 -8.622 1.027 23.871 1.00 32.20 C ATOM 1165 O CYS A 961 -8.827 0.039 24.574 1.00 33.40 O ATOM 1166 CB CYS A 961 -8.668 3.117 25.134 1.00 34.91 C ATOM 1167 SG CYS A 961 -7.803 4.184 26.257 1.00 38.37 S ATOM 1168 H CYS A 961 -7.197 3.844 23.159 1.00 0.00 H ATOM 1169 N LYS A 962 -9.185 1.198 22.678 1.00 31.26 N ATOM 1170 CA LYS A 962 -10.026 0.150 22.097 1.00 32.90 C ATOM 1171 C LYS A 962 -9.184 -1.085 21.767 1.00 34.23 C ATOM 1172 O LYS A 962 -9.645 -2.215 21.920 1.00 34.85 O ATOM 1173 CB LYS A 962 -10.758 0.645 20.849 1.00 31.80 C ATOM 1174 CG LYS A 962 -11.857 1.643 21.136 1.00 32.17 C ATOM 1175 CD LYS A 962 -12.452 2.198 19.841 1.00 32.47 C ATOM 1176 H LYS A 962 -9.027 2.082 22.154 1.00 0.00 H ATOM 1177 N GLY A 963 -7.952 -0.858 21.322 1.00 33.74 N ATOM 1178 CA GLY A 963 -7.024 -1.945 21.032 1.00 34.33 C ATOM 1179 C GLY A 963 -6.672 -2.719 22.289 1.00 34.69 C ATOM 1180 O GLY A 963 -6.770 -3.953 22.319 1.00 35.82 O ATOM 1181 H GLY A 963 -7.641 0.124 21.176 1.00 0.00 H ATOM 1182 N MET A 964 -6.287 -1.983 23.330 1.00 33.79 N ATOM 1183 CA MET A 964 -5.868 -2.582 24.597 1.00 32.80 C ATOM 1184 C MET A 964 -7.031 -3.284 25.287 1.00 33.11 C ATOM 1185 O MET A 964 -6.831 -4.282 25.982 1.00 31.47 O ATOM 1186 CB MET A 964 -5.302 -1.515 25.538 1.00 31.96 C ATOM 1187 CG MET A 964 -4.105 -0.753 25.001 1.00 31.12 C ATOM 1188 SD MET A 964 -2.763 -1.818 24.475 1.00 30.24 S ATOM 1189 CE MET A 964 -2.259 -2.583 26.017 1.00 31.11 C ATOM 1190 H MET A 964 -6.284 -0.947 23.239 1.00 0.00 H ATOM 1191 N GLU A 965 -8.237 -2.740 25.125 1.00 34.87 N ATOM 1192 CA GLU A 965 -9.436 -3.419 25.583 1.00 36.50 C ATOM 1193 C GLU A 965 -9.435 -4.799 24.944 1.00 34.95 C ATOM 1194 O GLU A 965 -9.460 -5.816 25.634 1.00 33.06 O ATOM 1195 CB GLU A 965 -10.722 -2.642 25.212 1.00 39.28 C ATOM 1196 CG GLU A 965 -11.310 -1.801 26.368 1.00 45.64 C ATOM 1197 CD GLU A 965 -12.821 -1.486 26.219 1.00 50.43 C ATOM 1198 OE1 GLU A 965 -13.178 -0.495 25.531 1.00 52.32 O ATOM 1199 OE2 GLU A 965 -13.654 -2.214 26.822 1.00 48.69 O ATOM 1200 H GLU A 965 -8.321 -1.812 24.662 1.00 0.00 H ATOM 1201 N TYR A 966 -9.363 -4.811 23.618 1.00 34.63 N ATOM 1202 CA TYR A 966 -9.485 -6.038 22.832 1.00 35.11 C ATOM 1203 C TYR A 966 -8.375 -7.054 23.145 1.00 34.32 C ATOM 1204 O TYR A 966 -8.611 -8.260 23.125 1.00 35.61 O ATOM 1205 CB TYR A 966 -9.503 -5.702 21.338 1.00 34.22 C ATOM 1206 CG TYR A 966 -9.297 -6.899 20.462 1.00 33.21 C ATOM 1207 CD1 TYR A 966 -10.327 -7.785 20.221 1.00 32.91 C ATOM 1208 CD2 TYR A 966 -8.065 -7.152 19.886 1.00 32.83 C ATOM 1209 CE1 TYR A 966 -10.140 -8.888 19.428 1.00 32.77 C ATOM 1210 CE2 TYR A 966 -7.865 -8.250 19.094 1.00 32.28 C ATOM 1211 CZ TYR A 966 -8.903 -9.121 18.870 1.00 32.00 C ATOM 1212 OH TYR A 966 -8.714 -10.227 18.081 1.00 35.09 O ATOM 1213 HH TYR A 966 -9.559 -10.741 18.027 1.00 0.00 H ATOM 1214 H TYR A 966 -9.214 -3.911 23.118 1.00 0.00 H ATOM 1215 N LEU A 967 -7.177 -6.559 23.430 1.00 32.70 N ATOM 1216 CA LEU A 967 -6.079 -7.404 23.888 1.00 32.20 C ATOM 1217 C LEU A 967 -6.386 -7.996 25.256 1.00 32.67 C ATOM 1218 O LEU A 967 -6.170 -9.188 25.489 1.00 32.16 O ATOM 1219 CB LEU A 967 -4.774 -6.611 23.956 1.00 31.91 C ATOM 1220 CG LEU A 967 -4.170 -6.192 22.613 1.00 34.08 C ATOM 1221 CD1 LEU A 967 -2.877 -5.412 22.835 1.00 33.78 C ATOM 1222 CD2 LEU A 967 -3.925 -7.408 21.731 1.00 34.35 C ATOM 1223 H LEU A 967 -7.016 -5.537 23.324 1.00 0.00 H ATOM 1224 N GLY A 968 -6.907 -7.166 26.156 1.00 33.17 N ATOM 1225 CA GLY A 968 -7.335 -7.639 27.467 1.00 34.30 C ATOM 1226 C GLY A 968 -8.283 -8.829 27.398 1.00 34.49 C ATOM 1227 O GLY A 968 -8.234 -9.722 28.241 1.00 35.14 O ATOM 1228 H GLY A 968 -7.011 -6.159 25.919 1.00 0.00 H ATOM 1229 N THR A 969 -9.145 -8.838 26.389 1.00 35.96 N ATOM 1230 CA THR A 969 -10.080 -9.925 26.177 1.00 37.67 C ATOM 1231 C THR A 969 -9.371 -11.248 25.922 1.00 40.27 C ATOM 1232 O THR A 969 -9.851 -12.298 26.355 1.00 43.30 O ATOM 1233 CB THR A 969 -11.007 -9.616 24.998 1.00 40.04 C ATOM 1234 OG1 THR A 969 -11.970 -8.631 25.398 1.00 34.41 O ATOM 1235 CG2 THR A 969 -11.729 -10.885 24.514 1.00 44.55 C ATOM 1236 HG1 THR A 969 -12.570 -8.430 24.637 1.00 0.00 H ATOM 1237 H THR A 969 -9.150 -8.036 25.727 1.00 0.00 H ATOM 1238 N LYS A 970 -8.227 -11.193 25.242 1.00 38.91 N ATOM 1239 CA LYS A 970 -7.457 -12.392 24.918 1.00 37.59 C ATOM 1240 C LYS A 970 -6.378 -12.662 25.970 1.00 36.82 C ATOM 1241 O LYS A 970 -5.549 -13.562 25.810 1.00 36.45 O ATOM 1242 CB LYS A 970 -6.807 -12.247 23.535 1.00 41.02 C ATOM 1243 CG LYS A 970 -7.759 -11.766 22.417 1.00 41.62 C ATOM 1244 CD LYS A 970 -7.689 -12.645 21.152 1.00 43.60 C ATOM 1245 CE LYS A 970 -9.020 -12.571 20.384 1.00 47.92 C ATOM 1246 NZ LYS A 970 -8.954 -13.140 19.001 1.00 52.65 N ATOM 1247 HZ1 LYS A 970 -8.248 -12.617 18.445 1.00 0.00 H ATOM 1248 HZ2 LYS A 970 -8.683 -14.143 19.053 1.00 0.00 H ATOM 1249 HZ3 LYS A 970 -9.886 -13.055 18.547 1.00 0.00 H ATOM 1250 H LYS A 970 -7.870 -10.267 24.932 1.00 0.00 H ATOM 1251 N ARG A 971 -6.392 -11.866 27.037 1.00 34.28 N ATOM 1252 CA ARG A 971 -5.439 -11.987 28.134 1.00 33.69 C ATOM 1253 C ARG A 971 -3.973 -11.786 27.713 1.00 31.37 C ATOM 1254 O ARG A 971 -3.062 -12.406 28.267 1.00 33.04 O ATOM 1255 CB ARG A 971 -5.643 -13.317 28.869 1.00 36.19 C ATOM 1256 CG ARG A 971 -7.071 -13.511 29.379 1.00 37.69 C ATOM 1257 CD ARG A 971 -7.273 -14.883 29.999 1.00 38.69 C ATOM 1258 NE ARG A 971 -6.395 -15.097 31.146 1.00 39.92 N ATOM 1259 CZ ARG A 971 -6.568 -14.552 32.347 1.00 40.40 C ATOM 1260 NH1 ARG A 971 -7.595 -13.745 32.583 1.00 40.00 N ATOM 1261 NH2 ARG A 971 -5.699 -14.813 33.317 1.00 40.78 N ATOM 1262 HE ARG A 971 -5.574 -15.722 31.014 1.00 0.00 H ATOM 1263 HH12 ARG A 971 -7.720 -13.325 33.526 1.00 0.00 H ATOM 1264 HH11 ARG A 971 -8.275 -13.533 31.825 1.00 0.00 H ATOM 1265 HH22 ARG A 971 -5.828 -14.390 34.258 1.00 0.00 H ATOM 1266 HH21 ARG A 971 -4.889 -15.440 33.135 1.00 0.00 H ATOM 1267 H ARG A 971 -7.117 -11.122 27.091 1.00 0.00 H ATOM 1268 N TYR A 972 -3.757 -10.883 26.761 1.00 29.45 N ATOM 1269 CA TYR A 972 -2.425 -10.535 26.295 1.00 29.60 C ATOM 1270 C TYR A 972 -1.963 -9.278 27.034 1.00 30.07 C ATOM 1271 O TYR A 972 -2.729 -8.332 27.191 1.00 32.89 O ATOM 1272 CB TYR A 972 -2.429 -10.288 24.772 1.00 30.17 C ATOM 1273 CG TYR A 972 -2.745 -11.494 23.882 1.00 31.40 C ATOM 1274 CD1 TYR A 972 -2.762 -12.800 24.390 1.00 31.86 C ATOM 1275 CD2 TYR A 972 -3.034 -11.324 22.524 1.00 30.47 C ATOM 1276 CE1 TYR A 972 -3.051 -13.895 23.569 1.00 31.32 C ATOM 1277 CE2 TYR A 972 -3.316 -12.412 21.701 1.00 29.85 C ATOM 1278 CZ TYR A 972 -3.325 -13.694 22.235 1.00 31.42 C ATOM 1279 OH TYR A 972 -3.594 -14.784 21.439 1.00 32.68 O ATOM 1280 HH TYR A 972 -2.921 -14.837 20.715 1.00 0.00 H ATOM 1281 H TYR A 972 -4.575 -10.406 26.332 1.00 0.00 H ATOM 1282 N ILE A 973 -0.717 -9.272 27.500 1.00 29.79 N ATOM 1283 CA ILE A 973 -0.083 -8.064 28.024 1.00 27.80 C ATOM 1284 C ILE A 973 0.932 -7.577 27.006 1.00 27.51 C ATOM 1285 O ILE A 973 1.957 -8.224 26.789 1.00 28.53 O ATOM 1286 CB ILE A 973 0.654 -8.307 29.350 1.00 28.46 C ATOM 1287 CG1 ILE A 973 -0.188 -9.158 30.309 1.00 29.98 C ATOM 1288 CG2 ILE A 973 1.039 -6.971 29.985 1.00 28.66 C ATOM 1289 CD1 ILE A 973 -1.533 -8.576 30.651 1.00 30.53 C ATOM 1290 H ILE A 973 -0.174 -10.159 27.491 1.00 0.00 H ATOM 1291 N HIS A 974 0.667 -6.424 26.406 1.00 26.70 N ATOM 1292 CA HIS A 974 1.475 -5.936 25.301 1.00 26.39 C ATOM 1293 C HIS A 974 2.935 -5.712 25.687 1.00 27.75 C ATOM 1294 O HIS A 974 3.826 -6.103 24.947 1.00 27.73 O ATOM 1295 CB HIS A 974 0.879 -4.656 24.720 1.00 24.59 C ATOM 1296 CG HIS A 974 1.572 -4.184 23.487 1.00 24.11 C ATOM 1297 ND1 HIS A 974 2.756 -3.481 23.523 1.00 25.20 N ATOM 1298 CD2 HIS A 974 1.254 -4.312 22.181 1.00 23.93 C ATOM 1299 CE1 HIS A 974 3.136 -3.193 22.293 1.00 25.27 C ATOM 1300 NE2 HIS A 974 2.242 -3.686 21.459 1.00 25.35 N ATOM 1301 H HIS A 974 -0.139 -5.855 26.735 1.00 0.00 H ATOM 1302 N ARG A 975 3.162 -5.050 26.822 1.00 29.36 N ATOM 1303 CA ARG A 975 4.511 -4.816 27.391 1.00 30.41 C ATOM 1304 C ARG A 975 5.426 -3.820 26.662 1.00 31.45 C ATOM 1305 O ARG A 975 6.567 -3.618 27.085 1.00 33.40 O ATOM 1306 CB ARG A 975 5.268 -6.135 27.577 1.00 31.02 C ATOM 1307 CG ARG A 975 4.760 -6.974 28.713 1.00 33.74 C ATOM 1308 CD ARG A 975 5.654 -8.192 28.956 1.00 34.74 C ATOM 1309 NE ARG A 975 7.049 -7.809 29.200 1.00 35.15 N ATOM 1310 CZ ARG A 975 8.118 -8.333 28.605 1.00 34.21 C ATOM 1311 NH1 ARG A 975 8.003 -9.298 27.706 1.00 32.49 N ATOM 1312 NH2 ARG A 975 9.329 -7.894 28.936 1.00 35.03 N ATOM 1313 HE ARG A 975 7.218 -7.060 29.902 1.00 0.00 H ATOM 1314 HH12 ARG A 975 8.853 -9.692 27.254 1.00 0.00 H ATOM 1315 HH11 ARG A 975 7.063 -9.662 27.451 1.00 0.00 H ATOM 1316 HH22 ARG A 975 10.171 -8.296 28.477 1.00 0.00 H ATOM 1317 HH21 ARG A 975 9.434 -7.148 29.653 1.00 0.00 H ATOM 1318 H ARG A 975 2.342 -4.675 27.340 1.00 0.00 H ATOM 1319 N ASP A 976 4.961 -3.195 25.586 1.00 30.42 N ATOM 1320 CA ASP A 976 5.780 -2.181 24.917 1.00 30.96 C ATOM 1321 C ASP A 976 4.932 -1.037 24.370 1.00 29.22 C ATOM 1322 O ASP A 976 5.208 -0.511 23.305 1.00 27.92 O ATOM 1323 CB ASP A 976 6.632 -2.821 23.820 1.00 33.39 C ATOM 1324 CG ASP A 976 7.924 -2.025 23.506 1.00 36.89 C ATOM 1325 OD1 ASP A 976 8.118 -0.914 24.064 1.00 35.91 O ATOM 1326 OD2 ASP A 976 8.745 -2.529 22.680 1.00 37.40 O ATOM 1327 H ASP A 976 4.016 -3.425 25.219 1.00 0.00 H ATOM 1328 N LEU A 977 3.904 -0.655 25.126 1.00 29.94 N ATOM 1329 CA LEU A 977 3.103 0.514 24.808 1.00 30.24 C ATOM 1330 C LEU A 977 3.963 1.772 24.932 1.00 28.20 C ATOM 1331 O LEU A 977 4.342 2.194 26.030 1.00 25.26 O ATOM 1332 CB LEU A 977 1.864 0.635 25.714 1.00 31.82 C ATOM 1333 CG LEU A 977 0.497 0.235 25.132 1.00 33.82 C ATOM 1334 CD1 LEU A 977 -0.603 0.517 26.170 1.00 35.79 C ATOM 1335 CD2 LEU A 977 0.163 0.939 23.790 1.00 33.42 C ATOM 1336 H LEU A 977 3.667 -1.212 25.972 1.00 0.00 H ATOM 1337 N ALA A 978 4.260 2.348 23.776 1.00 27.19 N ATOM 1338 CA ALA A 978 4.939 3.612 23.682 1.00 27.75 C ATOM 1339 C ALA A 978 4.579 4.222 22.337 1.00 28.14 C ATOM 1340 O ALA A 978 4.173 3.512 21.418 1.00 28.26 O ATOM 1341 CB ALA A 978 6.428 3.405 23.790 1.00 27.92 C ATOM 1342 H ALA A 978 3.990 1.864 22.896 1.00 0.00 H ATOM 1343 N THR A 979 4.756 5.531 22.217 1.00 27.62 N ATOM 1344 CA THR A 979 4.341 6.245 21.019 1.00 28.25 C ATOM 1345 C THR A 979 5.043 5.715 19.761 1.00 28.66 C ATOM 1346 O THR A 979 4.479 5.783 18.672 1.00 29.28 O ATOM 1347 CB THR A 979 4.531 7.781 21.185 1.00 27.67 C ATOM 1348 OG1 THR A 979 3.550 8.478 20.422 1.00 31.05 O ATOM 1349 CG2 THR A 979 5.889 8.229 20.758 1.00 28.18 C ATOM 1350 HG1 THR A 979 3.678 9.453 20.534 1.00 0.00 H ATOM 1351 H THR A 979 5.201 6.058 22.995 1.00 0.00 H ATOM 1352 N ARG A 980 6.250 5.164 19.928 1.00 29.99 N ATOM 1353 CA ARG A 980 7.028 4.593 18.820 1.00 29.79 C ATOM 1354 C ARG A 980 6.559 3.210 18.328 1.00 29.04 C ATOM 1355 O ARG A 980 7.104 2.697 17.355 1.00 30.20 O ATOM 1356 CB ARG A 980 8.508 4.489 19.218 1.00 31.05 C ATOM 1357 CG ARG A 980 8.859 3.229 19.983 1.00 33.45 C ATOM 1358 CD ARG A 980 10.166 3.328 20.750 1.00 39.50 C ATOM 1359 NE ARG A 980 10.297 2.142 21.610 1.00 48.75 N ATOM 1360 CZ ARG A 980 10.057 2.092 22.927 1.00 50.03 C ATOM 1361 NH1 ARG A 980 9.696 3.180 23.623 1.00 50.02 N ATOM 1362 NH2 ARG A 980 10.191 0.929 23.562 1.00 48.64 N ATOM 1363 HE ARG A 980 10.605 1.260 21.153 1.00 0.00 H ATOM 1364 HH12 ARG A 980 9.517 3.108 24.645 1.00 0.00 H ATOM 1365 HH11 ARG A 980 9.595 4.096 23.141 1.00 0.00 H ATOM 1366 HH22 ARG A 980 10.009 0.871 24.584 1.00 0.00 H ATOM 1367 HH21 ARG A 980 10.478 0.079 23.036 1.00 0.00 H ATOM 1368 H ARG A 980 6.656 5.138 20.885 1.00 0.00 H ATOM 1369 N ASN A 981 5.599 2.589 19.008 1.00 27.02 N ATOM 1370 CA ASN A 981 5.071 1.289 18.585 1.00 27.36 C ATOM 1371 C ASN A 981 3.583 1.356 18.206 1.00 27.81 C ATOM 1372 O ASN A 981 2.908 0.316 18.096 1.00 25.40 O ATOM 1373 CB ASN A 981 5.312 0.239 19.671 1.00 27.29 C ATOM 1374 CG ASN A 981 6.781 0.092 20.018 1.00 26.84 C ATOM 1375 OD1 ASN A 981 7.636 0.203 19.149 1.00 26.72 O ATOM 1376 ND2 ASN A 981 7.080 -0.149 21.292 1.00 26.44 N ATOM 1377 HD22 ASN A 981 6.320 -0.236 21.997 1.00 0.00 H ATOM 1378 HD21 ASN A 981 8.073 -0.251 21.583 1.00 0.00 H ATOM 1379 H ASN A 981 5.213 3.038 19.863 1.00 0.00 H ATOM 1380 N ILE A 982 3.094 2.585 18.018 1.00 27.90 N ATOM 1381 CA ILE A 982 1.761 2.853 17.478 1.00 27.84 C ATOM 1382 C ILE A 982 1.954 3.315 16.036 1.00 27.24 C ATOM 1383 O ILE A 982 2.713 4.254 15.777 1.00 26.82 O ATOM 1384 CB ILE A 982 1.039 3.970 18.283 1.00 28.39 C ATOM 1385 CG1 ILE A 982 0.887 3.580 19.752 1.00 28.66 C ATOM 1386 CG2 ILE A 982 -0.321 4.284 17.699 1.00 29.18 C ATOM 1387 CD1 ILE A 982 0.046 2.372 19.966 1.00 30.46 C ATOM 1388 H ILE A 982 3.694 3.396 18.269 1.00 0.00 H ATOM 1389 N LEU A 983 1.283 2.653 15.102 1.00 25.94 N ATOM 1390 CA LEU A 983 1.425 2.972 13.678 1.00 28.19 C ATOM 1391 C LEU A 983 0.222 3.722 13.151 1.00 27.68 C ATOM 1392 O LEU A 983 -0.883 3.519 13.635 1.00 28.78 O ATOM 1393 CB LEU A 983 1.614 1.691 12.856 1.00 29.04 C ATOM 1394 CG LEU A 983 2.925 0.957 13.124 1.00 28.46 C ATOM 1395 CD1 LEU A 983 2.862 -0.455 12.592 1.00 28.92 C ATOM 1396 CD2 LEU A 983 4.090 1.736 12.520 1.00 28.96 C ATOM 1397 H LEU A 983 0.639 1.888 15.388 1.00 0.00 H ATOM 1398 N VAL A 984 0.441 4.578 12.152 1.00 27.31 N ATOM 1399 CA VAL A 984 -0.629 5.399 11.579 1.00 28.05 C ATOM 1400 C VAL A 984 -1.007 4.924 10.186 1.00 29.60 C ATOM 1401 O VAL A 984 -0.199 4.973 9.282 1.00 31.88 O ATOM 1402 CB VAL A 984 -0.219 6.889 11.506 1.00 27.57 C ATOM 1403 CG1 VAL A 984 -1.387 7.741 11.030 1.00 27.10 C ATOM 1404 CG2 VAL A 984 0.283 7.378 12.861 1.00 27.61 C ATOM 1405 H VAL A 984 1.403 4.666 11.767 1.00 0.00 H ATOM 1406 N GLU A 985 -2.241 4.459 10.021 1.00 34.31 N ATOM 1407 CA GLU A 985 -2.776 4.115 8.699 1.00 36.10 C ATOM 1408 C GLU A 985 -3.207 5.375 7.947 1.00 34.26 C ATOM 1409 O GLU A 985 -2.880 5.540 6.781 1.00 35.56 O ATOM 1410 CB GLU A 985 -3.967 3.158 8.829 1.00 38.10 C ATOM 1411 CG GLU A 985 -4.466 2.565 7.503 1.00 39.79 C ATOM 1412 CD GLU A 985 -5.518 1.487 7.720 1.00 42.45 C ATOM 1413 OE1 GLU A 985 -6.167 1.496 8.787 1.00 43.43 O ATOM 1414 OE2 GLU A 985 -5.702 0.620 6.839 1.00 45.29 O ATOM 1415 H GLU A 985 -2.847 4.335 10.857 1.00 0.00 H ATOM 1416 N ASN A 986 -3.958 6.249 8.609 1.00 36.08 N ATOM 1417 CA ASN A 986 -4.328 7.540 8.019 1.00 40.09 C ATOM 1418 C ASN A 986 -4.523 8.618 9.086 1.00 40.95 C ATOM 1419 O ASN A 986 -4.309 8.360 10.273 1.00 43.72 O ATOM 1420 CB ASN A 986 -5.573 7.392 7.125 1.00 40.78 C ATOM 1421 CG ASN A 986 -6.803 6.971 7.897 1.00 39.94 C ATOM 1422 OD1 ASN A 986 -7.370 7.757 8.648 1.00 38.85 O ATOM 1423 ND2 ASN A 986 -7.228 5.724 7.708 1.00 41.15 N ATOM 1424 HD22 ASN A 986 -6.715 5.092 7.061 1.00 0.00 H ATOM 1425 HD21 ASN A 986 -8.073 5.381 8.208 1.00 0.00 H ATOM 1426 H ASN A 986 -4.290 6.013 9.566 1.00 0.00 H ATOM 1427 N GLU A 987 -4.923 9.819 8.664 1.00 42.92 N ATOM 1428 CA GLU A 987 -5.057 10.951 9.590 1.00 44.30 C ATOM 1429 C GLU A 987 -6.178 10.746 10.611 1.00 40.74 C ATOM 1430 O GLU A 987 -6.204 11.415 11.642 1.00 42.51 O ATOM 1431 CB GLU A 987 -5.229 12.284 8.829 1.00 47.94 C ATOM 1432 CG GLU A 987 -6.565 12.456 8.075 1.00 52.56 C ATOM 1433 CD GLU A 987 -6.549 13.587 7.025 1.00 55.02 C ATOM 1434 OE1 GLU A 987 -7.643 14.113 6.716 1.00 53.75 O ATOM 1435 OE2 GLU A 987 -5.463 13.938 6.500 1.00 56.35 O ATOM 1436 H GLU A 987 -5.145 9.956 7.657 1.00 0.00 H ATOM 1437 N ASN A 988 -7.092 9.823 10.326 1.00 39.21 N ATOM 1438 CA ASN A 988 -8.136 9.437 11.278 1.00 39.96 C ATOM 1439 C ASN A 988 -8.014 8.017 11.825 1.00 37.46 C ATOM 1440 O ASN A 988 -8.965 7.513 12.406 1.00 37.84 O ATOM 1441 CB ASN A 988 -9.517 9.606 10.640 1.00 43.30 C ATOM 1442 CG ASN A 988 -9.830 11.047 10.304 1.00 47.98 C ATOM 1443 OD1 ASN A 988 -9.220 11.976 10.844 1.00 52.85 O ATOM 1444 ND2 ASN A 988 -10.789 11.244 9.412 1.00 51.42 N ATOM 1445 HD22 ASN A 988 -11.275 10.431 8.983 1.00 0.00 H ATOM 1446 HD21 ASN A 988 -11.056 12.212 9.140 1.00 0.00 H ATOM 1447 H ASN A 988 -7.065 9.359 9.395 1.00 0.00 H ATOM 1448 N ARG A 989 -6.864 7.366 11.660 1.00 36.72 N ATOM 1449 CA ARG A 989 -6.698 6.018 12.230 1.00 38.12 C ATOM 1450 C ARG A 989 -5.265 5.589 12.538 1.00 35.73 C ATOM 1451 O ARG A 989 -4.386 5.642 11.679 1.00 34.15 O ATOM 1452 CB ARG A 989 -7.349 4.941 11.362 1.00 39.56 C ATOM 1453 CG ARG A 989 -7.564 3.655 12.155 1.00 44.13 C ATOM 1454 CD ARG A 989 -7.873 2.455 11.284 1.00 46.50 C ATOM 1455 NE ARG A 989 -9.286 2.373 10.932 1.00 48.11 N ATOM 1456 CZ ARG A 989 -9.812 1.423 10.163 1.00 53.20 C ATOM 1457 NH1 ARG A 989 -9.041 0.449 9.656 1.00 53.60 N ATOM 1458 NH2 ARG A 989 -11.118 1.448 9.895 1.00 53.26 N ATOM 1459 HE ARG A 989 -9.924 3.104 11.306 1.00 0.00 H ATOM 1460 HH12 ARG A 989 -9.462 -0.289 9.056 1.00 0.00 H ATOM 1461 HH11 ARG A 989 -8.022 0.432 9.863 1.00 0.00 H ATOM 1462 HH22 ARG A 989 -11.540 0.711 9.295 1.00 0.00 H ATOM 1463 HH21 ARG A 989 -11.715 2.205 10.286 1.00 0.00 H ATOM 1464 H ARG A 989 -6.086 7.808 11.130 1.00 0.00 H ATOM 1465 N VAL A 990 -5.076 5.134 13.777 1.00 33.21 N ATOM 1466 CA VAL A 990 -3.811 4.588 14.248 1.00 32.82 C ATOM 1467 C VAL A 990 -4.032 3.162 14.765 1.00 30.23 C ATOM 1468 O VAL A 990 -5.152 2.776 15.070 1.00 30.44 O ATOM 1469 CB VAL A 990 -3.165 5.484 15.337 1.00 32.42 C ATOM 1470 CG1 VAL A 990 -2.952 6.879 14.793 1.00 33.24 C ATOM 1471 CG2 VAL A 990 -4.009 5.528 16.597 1.00 33.22 C ATOM 1472 H VAL A 990 -5.874 5.171 14.442 1.00 0.00 H ATOM 1473 N LYS A 991 -2.961 2.385 14.828 1.00 28.02 N ATOM 1474 CA LYS A 991 -3.043 0.987 15.221 1.00 28.56 C ATOM 1475 C LYS A 991 -1.852 0.620 16.083 1.00 27.54 C ATOM 1476 O LYS A 991 -0.728 1.057 15.833 1.00 25.85 O ATOM 1477 CB LYS A 991 -3.023 0.052 14.001 1.00 29.27 C ATOM 1478 CG LYS A 991 -4.032 0.330 12.929 1.00 30.40 C ATOM 1479 CD LYS A 991 -4.165 -0.877 12.034 1.00 30.76 C ATOM 1480 CE LYS A 991 -5.026 -0.602 10.814 1.00 31.42 C ATOM 1481 NZ LYS A 991 -5.281 -1.842 10.028 1.00 34.35 N ATOM 1482 HZ1 LYS A 991 -4.375 -2.240 9.707 1.00 0.00 H ATOM 1483 HZ2 LYS A 991 -5.773 -2.536 10.627 1.00 0.00 H ATOM 1484 HZ3 LYS A 991 -5.872 -1.613 9.203 1.00 0.00 H ATOM 1485 H LYS A 991 -2.032 2.787 14.589 1.00 0.00 H ATOM 1486 N ILE A 992 -2.097 -0.220 17.074 1.00 26.47 N ATOM 1487 CA ILE A 992 -1.020 -0.768 17.845 1.00 27.49 C ATOM 1488 C ILE A 992 -0.344 -1.826 16.997 1.00 29.60 C ATOM 1489 O ILE A 992 -1.014 -2.666 16.384 1.00 28.69 O ATOM 1490 CB ILE A 992 -1.523 -1.437 19.151 1.00 27.02 C ATOM 1491 CG1 ILE A 992 -2.324 -0.446 19.994 1.00 25.66 C ATOM 1492 CG2 ILE A 992 -0.346 -1.946 19.977 1.00 27.79 C ATOM 1493 CD1 ILE A 992 -3.180 -1.084 21.020 1.00 25.96 C ATOM 1494 H ILE A 992 -3.078 -0.485 17.296 1.00 0.00 H ATOM 1495 N GLY A 993 0.978 -1.733 16.887 1.00 33.21 N ATOM 1496 CA GLY A 993 1.761 -2.866 17.305 1.00 36.02 C ATOM 1497 C GLY A 993 3.246 -2.974 17.100 1.00 38.42 C ATOM 1498 O GLY A 993 3.779 -2.748 16.013 1.00 46.16 O ATOM 1499 H GLY A 993 1.429 -0.874 16.513 1.00 0.00 H ATOM 1500 N ASP A 994 3.909 -3.338 18.184 1.00 38.13 N ATOM 1501 CA ASP A 994 5.186 -4.020 18.122 1.00 36.86 C ATOM 1502 C ASP A 994 4.978 -5.042 19.216 1.00 33.05 C ATOM 1503 O ASP A 994 5.062 -4.718 20.392 1.00 33.74 O ATOM 1504 CB ASP A 994 6.358 -3.080 18.421 1.00 38.54 C ATOM 1505 CG ASP A 994 7.714 -3.782 18.340 1.00 40.92 C ATOM 1506 OD1 ASP A 994 8.007 -4.456 17.332 1.00 48.26 O ATOM 1507 OD2 ASP A 994 8.522 -3.655 19.276 1.00 49.80 O ATOM 1508 H ASP A 994 3.499 -3.127 19.116 1.00 0.00 H ATOM 1509 N PHE A 995 4.616 -6.255 18.828 1.00 29.61 N ATOM 1510 CA PHE A 995 4.193 -7.254 19.787 1.00 28.15 C ATOM 1511 C PHE A 995 5.318 -8.214 20.156 1.00 29.33 C ATOM 1512 O PHE A 995 5.052 -9.359 20.543 1.00 31.96 O ATOM 1513 CB PHE A 995 3.000 -8.023 19.225 1.00 27.49 C ATOM 1514 CG PHE A 995 1.733 -7.233 19.204 1.00 26.36 C ATOM 1515 CD1 PHE A 995 1.432 -6.405 18.142 1.00 27.00 C ATOM 1516 CD2 PHE A 995 0.843 -7.319 20.251 1.00 27.60 C ATOM 1517 CE1 PHE A 995 0.272 -5.674 18.135 1.00 27.96 C ATOM 1518 CE2 PHE A 995 -0.322 -6.598 20.250 1.00 28.14 C ATOM 1519 CZ PHE A 995 -0.611 -5.770 19.194 1.00 28.98 C ATOM 1520 H PHE A 995 4.636 -6.495 17.816 1.00 0.00 H ATOM 1521 N GLY A 996 6.565 -7.750 20.061 1.00 29.58 N ATOM 1522 CA GLY A 996 7.742 -8.604 20.286 1.00 28.10 C ATOM 1523 C GLY A 996 8.097 -8.818 21.749 1.00 26.97 C ATOM 1524 O GLY A 996 8.982 -9.598 22.076 1.00 29.36 O ATOM 1525 H GLY A 996 6.711 -6.749 19.819 1.00 0.00 H ATOM 1526 N LEU A 997 7.430 -8.088 22.628 1.00 25.95 N ATOM 1527 CA LEU A 997 7.528 -8.322 24.045 1.00 25.01 C ATOM 1528 C LEU A 997 6.222 -8.895 24.583 1.00 25.33 C ATOM 1529 O LEU A 997 6.136 -9.229 25.753 1.00 27.61 O ATOM 1530 CB LEU A 997 7.851 -7.012 24.758 1.00 24.92 C ATOM 1531 CG LEU A 997 9.085 -6.259 24.250 1.00 24.47 C ATOM 1532 CD1 LEU A 997 9.309 -5.004 25.079 1.00 24.46 C ATOM 1533 CD2 LEU A 997 10.308 -7.157 24.280 1.00 24.42 C ATOM 1534 H LEU A 997 6.816 -7.322 22.285 1.00 0.00 H ATOM 1535 N THR A 998 5.208 -9.032 23.738 1.00 25.44 N ATOM 1536 CA THR A 998 3.884 -9.412 24.215 1.00 25.50 C ATOM 1537 C THR A 998 3.872 -10.848 24.776 1.00 25.86 C ATOM 1538 O THR A 998 4.441 -11.773 24.186 1.00 24.28 O ATOM 1539 CB THR A 998 2.817 -9.208 23.114 1.00 25.43 C ATOM 1540 OG1 THR A 998 2.790 -7.828 22.753 1.00 25.71 O ATOM 1541 CG2 THR A 998 1.449 -9.597 23.593 1.00 25.56 C ATOM 1542 HG1 THR A 998 2.561 -7.284 23.548 1.00 0.00 H ATOM 1543 H THR A 998 5.360 -8.866 22.723 1.00 0.00 H ATOM 1544 N LYS A 999 3.229 -11.006 25.931 1.00 26.05 N ATOM 1545 CA LYS A 999 3.178 -12.271 26.642 1.00 26.71 C ATOM 1546 C LYS A 999 1.727 -12.591 26.928 1.00 28.21 C ATOM 1547 O LYS A 999 0.946 -11.687 27.190 1.00 27.88 O ATOM 1548 CB LYS A 999 3.955 -12.167 27.955 1.00 26.63 C ATOM 1549 CG LYS A 999 5.432 -11.820 27.797 1.00 27.51 C ATOM 1550 CD LYS A 999 6.293 -13.059 27.582 1.00 27.37 C ATOM 1551 CE LYS A 999 7.573 -12.741 26.822 1.00 28.11 C ATOM 1552 NZ LYS A 999 8.532 -13.888 26.811 1.00 30.16 N ATOM 1553 HZ1 LYS A 999 8.791 -14.131 27.788 1.00 0.00 H ATOM 1554 HZ2 LYS A 999 8.084 -14.709 26.356 1.00 0.00 H ATOM 1555 HZ3 LYS A 999 9.386 -13.619 26.281 1.00 0.00 H ATOM 1556 H LYS A 999 2.741 -10.185 26.343 1.00 0.00 H ATOM 1557 N VAL A1000 1.370 -13.873 26.866 1.00 30.82 N ATOM 1558 CA VAL A1000 0.022 -14.339 27.208 1.00 29.86 C ATOM 1559 C VAL A1000 -0.045 -14.658 28.700 1.00 30.68 C ATOM 1560 O VAL A1000 0.871 -15.267 29.244 1.00 30.29 O ATOM 1561 CB VAL A1000 -0.358 -15.594 26.403 1.00 30.32 C ATOM 1562 CG1 VAL A1000 -1.750 -16.065 26.779 1.00 30.87 C ATOM 1563 CG2 VAL A1000 -0.279 -15.308 24.910 1.00 31.01 C ATOM 1564 H VAL A1000 2.077 -14.573 26.562 1.00 0.00 H ATOM 1565 N LEU A1001 -1.122 -14.230 29.360 1.00 34.32 N ATOM 1566 CA LEU A1001 -1.259 -14.428 30.802 1.00 35.67 C ATOM 1567 C LEU A1001 -1.462 -15.903 31.102 1.00 37.84 C ATOM 1568 O LEU A1001 -2.141 -16.604 30.345 1.00 41.10 O ATOM 1569 CB LEU A1001 -2.457 -13.656 31.365 1.00 36.47 C ATOM 1570 CG LEU A1001 -2.331 -12.176 31.731 1.00 37.32 C ATOM 1571 CD1 LEU A1001 -3.716 -11.592 31.959 1.00 38.75 C ATOM 1572 CD2 LEU A1001 -1.475 -11.985 32.961 1.00 36.62 C ATOM 1573 H LEU A1001 -1.880 -13.745 28.838 1.00 0.00 H ATOM 1574 N PRO A1002 -0.903 -16.383 32.218 1.00 39.42 N ATOM 1575 CA PRO A1002 -1.283 -17.722 32.595 1.00 42.28 C ATOM 1576 C PRO A1002 -2.778 -17.773 32.865 1.00 48.91 C ATOM 1577 O PRO A1002 -3.357 -16.781 33.314 1.00 49.30 O ATOM 1578 CB PRO A1002 -0.500 -17.965 33.889 1.00 40.82 C ATOM 1579 CG PRO A1002 0.600 -16.990 33.868 1.00 40.34 C ATOM 1580 CD PRO A1002 0.054 -15.799 33.168 1.00 41.25 C ATOM 1581 N GLN A1003 -3.379 -18.916 32.552 1.00 53.49 N ATOM 1582 CA GLN A1003 -4.764 -19.257 32.918 1.00 59.23 C ATOM 1583 C GLN A1003 -5.169 -18.911 34.373 1.00 56.30 C ATOM 1584 O GLN A1003 -6.264 -18.404 34.627 1.00 46.44 O ATOM 1585 CB GLN A1003 -4.903 -20.764 32.718 1.00 63.78 C ATOM 1586 CG GLN A1003 -6.292 -21.329 32.723 1.00 66.04 C ATOM 1587 CD GLN A1003 -6.241 -22.827 32.534 1.00 67.18 C ATOM 1588 OE1 GLN A1003 -5.968 -23.315 31.432 1.00 64.93 O ATOM 1589 NE2 GLN A1003 -6.465 -23.568 33.616 1.00 67.63 N ATOM 1590 HE22 GLN A1003 -6.691 -23.110 34.522 1.00 0.00 H ATOM 1591 HE21 GLN A1003 -6.414 -24.605 33.556 1.00 0.00 H ATOM 1592 H GLN A1003 -2.834 -19.618 32.012 1.00 0.00 H ATOM 1593 N ASP A1004 -4.263 -19.193 35.305 1.00 58.33 N ATOM 1594 CA ASP A1004 -4.546 -19.155 36.744 1.00 64.23 C ATOM 1595 C ASP A1004 -4.117 -17.852 37.438 1.00 64.49 C ATOM 1596 O ASP A1004 -4.614 -17.531 38.527 1.00 66.47 O ATOM 1597 CB ASP A1004 -3.863 -20.350 37.445 1.00 69.58 C ATOM 1598 CG ASP A1004 -2.479 -20.687 36.848 1.00 74.09 C ATOM 1599 OD1 ASP A1004 -2.426 -21.284 35.740 1.00 74.67 O ATOM 1600 OD2 ASP A1004 -1.449 -20.361 37.485 1.00 74.71 O ATOM 1601 H ASP A1004 -3.304 -19.454 34.998 1.00 0.00 H ATOM 1602 N LYS A1005 -3.183 -17.123 36.833 1.00 57.76 N ATOM 1603 CA LYS A1005 -2.667 -15.893 37.420 1.00 55.52 C ATOM 1604 C LYS A1005 -3.135 -14.680 36.602 1.00 54.05 C ATOM 1605 O LYS A1005 -3.607 -14.824 35.476 1.00 56.15 O ATOM 1606 CB LYS A1005 -1.138 -15.943 37.476 1.00 58.93 C ATOM 1607 CG LYS A1005 -0.553 -17.126 38.264 1.00 61.85 C ATOM 1608 CD LYS A1005 0.109 -16.698 39.582 1.00 67.92 C ATOM 1609 CE LYS A1005 0.930 -17.846 40.209 1.00 69.34 C ATOM 1610 NZ LYS A1005 1.765 -17.408 41.383 1.00 70.82 N ATOM 1611 HZ1 LYS A1005 2.435 -16.674 41.076 1.00 0.00 H ATOM 1612 HZ2 LYS A1005 1.145 -17.024 42.124 1.00 0.00 H ATOM 1613 HZ3 LYS A1005 2.290 -18.224 41.757 1.00 0.00 H ATOM 1614 H LYS A1005 -2.811 -17.440 35.915 1.00 0.00 H ATOM 1615 N GLU A1006 -3.005 -13.492 37.189 1.00 51.87 N ATOM 1616 CA GLU A1006 -3.362 -12.232 36.529 1.00 51.79 C ATOM 1617 C GLU A1006 -2.142 -11.335 36.278 1.00 48.15 C ATOM 1618 O GLU A1006 -2.291 -10.176 35.881 1.00 42.73 O ATOM 1619 CB GLU A1006 -4.408 -11.482 37.365 1.00 56.64 C ATOM 1620 CG GLU A1006 -5.770 -12.187 37.450 1.00 57.60 C ATOM 1621 CD GLU A1006 -6.573 -12.130 36.147 1.00 56.83 C ATOM 1622 OE1 GLU A1006 -6.947 -13.206 35.641 1.00 54.87 O ATOM 1623 OE2 GLU A1006 -6.832 -11.017 35.633 1.00 56.54 O ATOM 1624 H GLU A1006 -2.633 -13.456 38.160 1.00 0.00 H HETATM 1625 N PTR A1007 -0.948 -11.885 36.514 1.00 48.68 N HETATM 1626 CA PTR A1007 0.325 -11.239 36.172 1.00 48.97 C HETATM 1627 C PTR A1007 1.251 -12.278 35.512 1.00 48.59 C HETATM 1628 O PTR A1007 0.960 -13.475 35.531 1.00 43.40 O HETATM 1629 CB PTR A1007 1.008 -10.613 37.403 1.00 50.45 C HETATM 1630 CG PTR A1007 1.538 -11.628 38.393 1.00 54.23 C HETATM 1631 CD2 PTR A1007 2.864 -12.039 38.341 1.00 57.50 C HETATM 1632 CE2 PTR A1007 3.361 -12.982 39.228 1.00 58.18 C HETATM 1633 CZ PTR A1007 2.536 -13.524 40.192 1.00 56.88 C HETATM 1634 OH PTR A1007 3.033 -14.375 40.941 1.00 62.86 O HETATM 1635 P PTR A1007 2.929 -14.429 42.556 1.00 65.89 P HETATM 1636 O3P PTR A1007 3.012 -13.016 43.177 1.00 57.73 O HETATM 1637 O2P PTR A1007 4.067 -15.269 43.016 1.00 55.52 O HETATM 1638 O1P PTR A1007 1.586 -15.094 42.924 1.00 58.99 O HETATM 1639 CE1 PTR A1007 1.203 -13.146 40.259 1.00 55.26 C HETATM 1640 CD1 PTR A1007 0.710 -12.207 39.360 1.00 54.83 C HETATM 1641 H PTR A1007 -0.919 -12.822 36.965 1.00 0.00 H HETATM 1642 N PTR A1008 2.358 -11.809 34.932 1.00 47.90 N HETATM 1643 CA PTR A1008 3.346 -12.677 34.288 1.00 44.43 C HETATM 1644 C PTR A1008 4.741 -12.236 34.713 1.00 44.79 C HETATM 1645 O PTR A1008 5.086 -11.050 34.647 1.00 39.96 O HETATM 1646 CB PTR A1008 3.178 -12.606 32.771 1.00 43.87 C HETATM 1647 CG PTR A1008 3.981 -13.599 31.938 1.00 47.16 C HETATM 1648 CD2 PTR A1008 3.335 -14.600 31.223 1.00 50.32 C HETATM 1649 CE2 PTR A1008 4.041 -15.506 30.442 1.00 52.51 C HETATM 1650 CZ PTR A1008 5.419 -15.425 30.360 1.00 52.91 C HETATM 1651 OH PTR A1008 5.983 -16.232 29.606 1.00 54.91 O HETATM 1652 P PTR A1008 7.257 -17.144 29.943 1.00 59.29 P HETATM 1653 O3P PTR A1008 8.569 -16.351 29.750 1.00 56.21 O HETATM 1654 O2P PTR A1008 7.110 -17.607 31.404 1.00 68.18 O HETATM 1655 O1P PTR A1008 7.242 -18.331 29.058 1.00 56.88 O HETATM 1656 CE1 PTR A1008 6.094 -14.422 31.046 1.00 49.92 C HETATM 1657 CD1 PTR A1008 5.376 -13.519 31.829 1.00 48.86 C HETATM 1658 H PTR A1008 2.526 -10.783 34.938 1.00 0.00 H ATOM 1659 N LYS A1009 5.543 -13.205 35.139 1.00 46.01 N ATOM 1660 CA LYS A1009 6.902 -12.937 35.555 1.00 46.07 C ATOM 1661 C LYS A1009 7.831 -13.248 34.388 1.00 48.53 C ATOM 1662 O LYS A1009 7.745 -14.328 33.803 1.00 44.11 O ATOM 1663 CB LYS A1009 7.270 -13.770 36.780 1.00 44.79 C ATOM 1664 CG LYS A1009 7.998 -12.957 37.826 1.00 45.48 C ATOM 1665 CD LYS A1009 8.666 -13.817 38.893 1.00 48.02 C ATOM 1666 CE LYS A1009 10.010 -13.222 39.330 1.00 48.27 C ATOM 1667 NZ LYS A1009 11.068 -13.464 38.310 1.00 47.23 N ATOM 1668 HZ1 LYS A1009 11.188 -14.488 38.173 1.00 0.00 H ATOM 1669 HZ2 LYS A1009 10.788 -13.023 37.411 1.00 0.00 H ATOM 1670 HZ3 LYS A1009 11.964 -13.049 38.636 1.00 0.00 H ATOM 1671 H LYS A1009 5.185 -14.181 35.174 1.00 0.00 H ATOM 1672 N VAL A1010 8.687 -12.279 34.047 1.00 52.80 N ATOM 1673 CA VAL A1010 9.664 -12.419 32.968 1.00 59.17 C ATOM 1674 C VAL A1010 11.049 -12.000 33.447 1.00 59.63 C ATOM 1675 O VAL A1010 11.230 -10.871 33.911 1.00 64.89 O ATOM 1676 CB VAL A1010 9.272 -11.564 31.737 1.00 65.78 C ATOM 1677 CG1 VAL A1010 9.721 -10.121 31.902 1.00 67.99 C ATOM 1678 CG2 VAL A1010 9.880 -12.147 30.468 1.00 72.10 C ATOM 1679 H VAL A1010 8.656 -11.383 34.574 1.00 0.00 H TER 1680 VAL A1010 ATOM 1681 N PRO A1013 15.981 -9.524 31.096 1.00 90.03 N ATOM 1682 CA PRO A1013 16.197 -8.635 29.917 1.00 87.79 C ATOM 1683 C PRO A1013 15.641 -7.301 29.391 1.00 88.88 C ATOM 1684 O PRO A1013 14.562 -6.877 29.822 1.00 93.83 O ATOM 1685 CB PRO A1013 15.152 -9.263 29.019 1.00 93.28 C ATOM 1686 CG PRO A1013 15.573 -10.554 29.016 1.00 96.69 C ATOM 1687 CD PRO A1013 15.476 -10.818 30.490 1.00 89.63 C ATOM 1688 HN2 PRO A1013 15.275 -9.117 31.742 1.00 0.00 H ATOM 1689 HN1 PRO A1013 16.871 -9.679 31.611 1.00 0.00 H ATOM 1690 N GLY A1014 16.155 -6.835 28.241 1.00 84.83 N ATOM 1691 CA GLY A1014 17.458 -7.184 27.657 1.00 77.73 C ATOM 1692 C GLY A1014 17.939 -5.767 27.452 1.00 72.52 C ATOM 1693 O GLY A1014 18.961 -5.321 27.991 1.00 74.59 O ATOM 1694 H GLY A1014 15.571 -6.158 27.709 1.00 0.00 H ATOM 1695 N GLU A1015 17.143 -5.049 26.676 1.00 65.47 N ATOM 1696 CA GLU A1015 16.920 -3.642 26.915 1.00 61.16 C ATOM 1697 C GLU A1015 15.421 -3.500 27.191 1.00 54.64 C ATOM 1698 O GLU A1015 14.589 -3.901 26.365 1.00 58.55 O ATOM 1699 CB GLU A1015 17.348 -2.805 25.708 1.00 63.66 C ATOM 1700 CG GLU A1015 18.868 -2.648 25.588 1.00 64.11 C ATOM 1701 CD GLU A1015 19.292 -1.288 25.039 1.00 64.42 C ATOM 1702 OE1 GLU A1015 18.600 -0.279 25.335 1.00 58.61 O ATOM 1703 OE2 GLU A1015 20.329 -1.234 24.326 1.00 63.74 O ATOM 1704 H GLU A1015 16.666 -5.509 25.874 1.00 0.00 H ATOM 1705 N SER A1016 15.068 -2.965 28.352 1.00 44.26 N ATOM 1706 CA SER A1016 13.668 -2.723 28.648 1.00 41.22 C ATOM 1707 C SER A1016 13.386 -1.226 28.582 1.00 35.48 C ATOM 1708 O SER A1016 14.245 -0.423 28.927 1.00 36.33 O ATOM 1709 CB SER A1016 13.305 -3.313 30.013 1.00 44.76 C ATOM 1710 OG SER A1016 12.977 -4.702 29.896 1.00 45.14 O ATOM 1711 HG SER A1016 13.755 -5.194 29.532 1.00 0.00 H ATOM 1712 H SER A1016 15.796 -2.718 29.052 1.00 0.00 H ATOM 1713 N PRO A1017 12.195 -0.835 28.097 1.00 31.82 N ATOM 1714 CA PRO A1017 11.855 0.593 28.108 1.00 28.89 C ATOM 1715 C PRO A1017 11.464 1.049 29.502 1.00 25.82 C ATOM 1716 O PRO A1017 10.295 1.293 29.757 1.00 26.18 O ATOM 1717 CB PRO A1017 10.679 0.679 27.134 1.00 27.90 C ATOM 1718 CG PRO A1017 10.029 -0.647 27.223 1.00 28.91 C ATOM 1719 CD PRO A1017 11.121 -1.649 27.496 1.00 29.70 C ATOM 1720 N ILE A1018 12.461 1.168 30.375 1.00 23.75 N ATOM 1721 CA ILE A1018 12.255 1.376 31.814 1.00 23.86 C ATOM 1722 C ILE A1018 11.442 2.614 32.130 1.00 23.16 C ATOM 1723 O ILE A1018 10.620 2.611 33.037 1.00 26.26 O ATOM 1724 CB ILE A1018 13.596 1.409 32.619 1.00 23.40 C ATOM 1725 CG1 ILE A1018 14.589 2.417 32.030 1.00 23.54 C ATOM 1726 CG2 ILE A1018 14.229 0.027 32.649 1.00 23.52 C ATOM 1727 CD1 ILE A1018 15.817 2.667 32.889 1.00 23.75 C ATOM 1728 H ILE A1018 13.437 1.111 30.020 1.00 0.00 H ATOM 1729 N PHE A1019 11.637 3.667 31.360 1.00 23.36 N ATOM 1730 CA PHE A1019 10.916 4.899 31.601 1.00 23.70 C ATOM 1731 C PHE A1019 9.433 4.807 31.238 1.00 23.28 C ATOM 1732 O PHE A1019 8.690 5.752 31.476 1.00 27.21 O ATOM 1733 CB PHE A1019 11.586 6.049 30.861 1.00 24.35 C ATOM 1734 CG PHE A1019 12.976 6.315 31.317 1.00 25.70 C ATOM 1735 CD1 PHE A1019 13.232 6.651 32.647 1.00 26.48 C ATOM 1736 CD2 PHE A1019 14.044 6.209 30.437 1.00 27.14 C ATOM 1737 CE1 PHE A1019 14.533 6.902 33.092 1.00 25.24 C ATOM 1738 CE2 PHE A1019 15.348 6.454 30.870 1.00 28.00 C ATOM 1739 CZ PHE A1019 15.589 6.804 32.206 1.00 26.89 C ATOM 1740 H PHE A1019 12.315 3.612 30.573 1.00 0.00 H ATOM 1741 N TRP A1020 9.006 3.683 30.663 1.00 22.60 N ATOM 1742 CA TRP A1020 7.579 3.375 30.465 1.00 22.41 C ATOM 1743 C TRP A1020 7.092 2.241 31.383 1.00 23.54 C ATOM 1744 O TRP A1020 5.913 1.879 31.337 1.00 24.60 O ATOM 1745 CB TRP A1020 7.315 2.967 29.004 1.00 21.83 C ATOM 1746 CG TRP A1020 7.223 4.094 28.029 1.00 21.87 C ATOM 1747 CD1 TRP A1020 6.112 4.501 27.376 1.00 21.71 C ATOM 1748 CD2 TRP A1020 8.290 4.948 27.575 1.00 22.65 C ATOM 1749 NE1 TRP A1020 6.400 5.557 26.549 1.00 21.42 N ATOM 1750 CE2 TRP A1020 7.729 5.857 26.653 1.00 21.92 C ATOM 1751 CE3 TRP A1020 9.659 5.038 27.866 1.00 22.35 C ATOM 1752 CZ2 TRP A1020 8.489 6.841 26.006 1.00 23.18 C ATOM 1753 CZ3 TRP A1020 10.414 6.029 27.228 1.00 24.14 C ATOM 1754 CH2 TRP A1020 9.828 6.910 26.305 1.00 23.43 C ATOM 1755 HE1 TRP A1020 5.716 6.050 25.940 1.00 0.00 H ATOM 1756 H TRP A1020 9.712 2.992 30.339 1.00 0.00 H ATOM 1757 N TYR A1021 7.991 1.669 32.191 1.00 24.31 N ATOM 1758 CA TYR A1021 7.661 0.503 33.031 1.00 25.54 C ATOM 1759 C TYR A1021 7.069 0.904 34.384 1.00 24.48 C ATOM 1760 O TYR A1021 7.548 1.826 35.029 1.00 26.71 O ATOM 1761 CB TYR A1021 8.902 -0.354 33.283 1.00 26.15 C ATOM 1762 CG TYR A1021 9.180 -1.466 32.292 1.00 28.66 C ATOM 1763 CD1 TYR A1021 8.708 -1.425 30.989 1.00 28.65 C ATOM 1764 CD2 TYR A1021 9.972 -2.550 32.665 1.00 32.41 C ATOM 1765 CE1 TYR A1021 8.984 -2.450 30.095 1.00 31.58 C ATOM 1766 CE2 TYR A1021 10.267 -3.580 31.772 1.00 33.93 C ATOM 1767 CZ TYR A1021 9.771 -3.526 30.486 1.00 33.69 C ATOM 1768 OH TYR A1021 10.067 -4.541 29.586 1.00 34.59 O ATOM 1769 HH TYR A1021 11.048 -4.596 29.463 1.00 0.00 H ATOM 1770 H TYR A1021 8.954 2.059 32.228 1.00 0.00 H ATOM 1771 N ALA A1022 6.042 0.182 34.818 1.00 24.57 N ATOM 1772 CA ALA A1022 5.449 0.391 36.133 1.00 23.96 C ATOM 1773 C ALA A1022 6.391 -0.157 37.192 1.00 24.13 C ATOM 1774 O ALA A1022 7.153 -1.073 36.903 1.00 25.10 O ATOM 1775 CB ALA A1022 4.100 -0.303 36.213 1.00 24.35 C ATOM 1776 H ALA A1022 5.648 -0.556 34.200 1.00 0.00 H ATOM 1777 N PRO A1023 6.334 0.380 38.426 1.00 25.61 N ATOM 1778 CA PRO A1023 7.279 0.014 39.494 1.00 25.51 C ATOM 1779 C PRO A1023 7.421 -1.491 39.724 1.00 27.21 C ATOM 1780 O PRO A1023 8.539 -1.981 39.882 1.00 29.44 O ATOM 1781 CB PRO A1023 6.698 0.685 40.730 1.00 24.60 C ATOM 1782 CG PRO A1023 5.894 1.805 40.216 1.00 26.18 C ATOM 1783 CD PRO A1023 5.355 1.382 38.882 1.00 25.94 C ATOM 1784 N GLU A1024 6.313 -2.223 39.721 1.00 26.79 N ATOM 1785 CA GLU A1024 6.365 -3.663 39.983 1.00 29.26 C ATOM 1786 C GLU A1024 6.973 -4.445 38.816 1.00 31.32 C ATOM 1787 O GLU A1024 7.306 -5.632 38.954 1.00 32.54 O ATOM 1788 CB GLU A1024 4.975 -4.213 40.334 1.00 29.91 C ATOM 1789 CG GLU A1024 3.987 -4.372 39.149 1.00 31.20 C ATOM 1790 CD GLU A1024 3.312 -3.069 38.705 1.00 30.00 C ATOM 1791 OE1 GLU A1024 3.610 -1.992 39.282 1.00 26.69 O ATOM 1792 OE2 GLU A1024 2.478 -3.144 37.768 1.00 27.92 O ATOM 1793 H GLU A1024 5.397 -1.768 39.530 1.00 0.00 H ATOM 1794 N SER A1025 7.096 -3.789 37.663 1.00 31.07 N ATOM 1795 CA SER A1025 7.771 -4.383 36.522 1.00 31.82 C ATOM 1796 C SER A1025 9.280 -4.196 36.678 1.00 31.10 C ATOM 1797 O SER A1025 10.059 -5.078 36.319 1.00 30.34 O ATOM 1798 CB SER A1025 7.285 -3.750 35.217 1.00 33.31 C ATOM 1799 OG SER A1025 5.869 -3.765 35.115 1.00 32.82 O ATOM 1800 HG SER A1025 5.547 -4.701 35.145 1.00 0.00 H ATOM 1801 H SER A1025 6.700 -2.831 37.578 1.00 0.00 H ATOM 1802 N LEU A1026 9.688 -3.047 37.214 1.00 29.45 N ATOM 1803 CA LEU A1026 11.103 -2.779 37.466 1.00 27.96 C ATOM 1804 C LEU A1026 11.642 -3.670 38.589 1.00 28.65 C ATOM 1805 O LEU A1026 12.686 -4.286 38.442 1.00 28.21 O ATOM 1806 CB LEU A1026 11.331 -1.297 37.813 1.00 26.58 C ATOM 1807 CG LEU A1026 11.029 -0.266 36.717 1.00 25.79 C ATOM 1808 CD1 LEU A1026 10.915 1.141 37.274 1.00 24.97 C ATOM 1809 CD2 LEU A1026 12.086 -0.317 35.648 1.00 26.15 C ATOM 1810 H LEU A1026 8.983 -2.323 37.459 1.00 0.00 H ATOM 1811 N THR A1027 10.930 -3.741 39.707 1.00 29.32 N ATOM 1812 CA THR A1027 11.470 -4.381 40.906 1.00 29.37 C ATOM 1813 C THR A1027 11.253 -5.897 40.941 1.00 30.79 C ATOM 1814 O THR A1027 12.103 -6.627 41.438 1.00 31.22 O ATOM 1815 CB THR A1027 10.865 -3.779 42.185 1.00 28.17 C ATOM 1816 OG1 THR A1027 9.459 -4.051 42.228 1.00 28.52 O ATOM 1817 CG2 THR A1027 11.093 -2.293 42.234 1.00 27.46 C ATOM 1818 HG1 THR A1027 9.022 -3.648 41.436 1.00 0.00 H ATOM 1819 H THR A1027 9.973 -3.335 39.731 1.00 0.00 H ATOM 1820 N GLU A1028 10.108 -6.357 40.446 1.00 30.67 N ATOM 1821 CA GLU A1028 9.726 -7.765 40.559 1.00 31.67 C ATOM 1822 C GLU A1028 9.508 -8.452 39.213 1.00 34.19 C ATOM 1823 O GLU A1028 9.222 -9.655 39.173 1.00 32.96 O ATOM 1824 CB GLU A1028 8.462 -7.896 41.405 1.00 32.98 C ATOM 1825 CG GLU A1028 8.638 -7.452 42.868 1.00 35.15 C ATOM 1826 CD GLU A1028 7.349 -7.530 43.682 1.00 35.06 C ATOM 1827 H GLU A1028 9.465 -5.697 39.964 1.00 0.00 H ATOM 1828 N SER A1029 9.656 -7.700 38.119 1.00 36.57 N ATOM 1829 CA SER A1029 9.505 -8.239 36.768 1.00 39.38 C ATOM 1830 C SER A1029 8.097 -8.785 36.486 1.00 39.61 C ATOM 1831 O SER A1029 7.925 -9.736 35.716 1.00 38.47 O ATOM 1832 CB SER A1029 10.572 -9.312 36.508 1.00 41.41 C ATOM 1833 OG SER A1029 11.749 -8.727 35.988 1.00 41.68 O ATOM 1834 HG SER A1029 11.540 -8.269 35.136 1.00 0.00 H ATOM 1835 H SER A1029 9.888 -6.692 38.232 1.00 0.00 H ATOM 1836 N LYS A1030 7.097 -8.175 37.118 1.00 38.39 N ATOM 1837 CA LYS A1030 5.710 -8.571 36.918 1.00 37.33 C ATOM 1838 C LYS A1030 5.114 -7.714 35.822 1.00 34.48 C ATOM 1839 O LYS A1030 5.425 -6.517 35.713 1.00 35.72 O ATOM 1840 CB LYS A1030 4.902 -8.402 38.205 1.00 41.86 C ATOM 1841 CG LYS A1030 5.331 -9.317 39.335 1.00 44.48 C ATOM 1842 CD LYS A1030 4.300 -9.322 40.446 1.00 48.11 C ATOM 1843 CE LYS A1030 4.644 -10.340 41.540 1.00 50.80 C ATOM 1844 NZ LYS A1030 3.653 -10.290 42.668 1.00 52.81 N ATOM 1845 HZ1 LYS A1030 3.656 -9.339 43.089 1.00 0.00 H ATOM 1846 HZ2 LYS A1030 2.703 -10.506 42.303 1.00 0.00 H ATOM 1847 HZ3 LYS A1030 3.916 -10.991 43.390 1.00 0.00 H ATOM 1848 H LYS A1030 7.312 -7.395 37.772 1.00 0.00 H ATOM 1849 N PHE A1031 4.275 -8.337 35.003 1.00 31.41 N ATOM 1850 CA PHE A1031 3.583 -7.640 33.926 1.00 30.67 C ATOM 1851 C PHE A1031 2.129 -8.054 33.901 1.00 29.57 C ATOM 1852 O PHE A1031 1.807 -9.222 34.129 1.00 29.07 O ATOM 1853 CB PHE A1031 4.278 -7.904 32.588 1.00 30.84 C ATOM 1854 CG PHE A1031 5.653 -7.311 32.525 1.00 30.46 C ATOM 1855 CD1 PHE A1031 6.751 -8.032 32.980 1.00 30.42 C ATOM 1856 CD2 PHE A1031 5.841 -6.010 32.079 1.00 28.43 C ATOM 1857 CE1 PHE A1031 8.001 -7.487 32.963 1.00 29.38 C ATOM 1858 CE2 PHE A1031 7.096 -5.454 32.057 1.00 28.57 C ATOM 1859 CZ PHE A1031 8.181 -6.190 32.502 1.00 30.52 C ATOM 1860 H PHE A1031 4.106 -9.355 35.134 1.00 0.00 H ATOM 1861 N SER A1032 1.258 -7.088 33.637 1.00 28.41 N ATOM 1862 CA SER A1032 -0.182 -7.277 33.771 1.00 28.15 C ATOM 1863 C SER A1032 -0.933 -6.272 32.908 1.00 28.01 C ATOM 1864 O SER A1032 -0.324 -5.422 32.261 1.00 32.33 O ATOM 1865 CB SER A1032 -0.581 -7.088 35.243 1.00 27.81 C ATOM 1866 OG SER A1032 -0.275 -5.783 35.720 1.00 25.26 O ATOM 1867 HG SER A1032 -0.548 -5.707 36.669 1.00 0.00 H ATOM 1868 H SER A1032 1.615 -6.163 33.323 1.00 0.00 H ATOM 1869 N VAL A1033 -2.255 -6.347 32.904 1.00 27.56 N ATOM 1870 CA VAL A1033 -3.029 -5.259 32.341 1.00 27.44 C ATOM 1871 C VAL A1033 -2.683 -4.006 33.140 1.00 27.20 C ATOM 1872 O VAL A1033 -2.540 -2.931 32.572 1.00 27.84 O ATOM 1873 CB VAL A1033 -4.550 -5.518 32.378 1.00 26.88 C ATOM 1874 CG1 VAL A1033 -5.314 -4.267 31.963 1.00 25.85 C ATOM 1875 CG2 VAL A1033 -4.894 -6.674 31.480 1.00 27.55 C ATOM 1876 H VAL A1033 -2.734 -7.180 33.302 1.00 0.00 H ATOM 1877 N ALA A1034 -2.520 -4.151 34.450 1.00 26.67 N ATOM 1878 CA ALA A1034 -2.214 -2.999 35.294 1.00 28.12 C ATOM 1879 C ALA A1034 -0.965 -2.262 34.814 1.00 26.94 C ATOM 1880 O ALA A1034 -0.961 -1.030 34.771 1.00 27.57 O ATOM 1881 CB ALA A1034 -2.056 -3.421 36.773 1.00 29.18 C ATOM 1882 H ALA A1034 -2.611 -5.094 34.879 1.00 0.00 H ATOM 1883 N SER A1035 0.084 -3.014 34.468 1.00 23.43 N ATOM 1884 CA SER A1035 1.336 -2.417 34.006 1.00 22.11 C ATOM 1885 C SER A1035 1.168 -1.853 32.595 1.00 21.20 C ATOM 1886 O SER A1035 1.746 -0.821 32.267 1.00 20.04 O ATOM 1887 CB SER A1035 2.495 -3.419 34.068 1.00 21.80 C ATOM 1888 OG SER A1035 2.315 -4.502 33.181 1.00 21.79 O ATOM 1889 HG SER A1035 2.253 -4.161 32.254 1.00 0.00 H ATOM 1890 H SER A1035 0.008 -4.049 34.529 1.00 0.00 H ATOM 1891 N ASP A1036 0.357 -2.516 31.774 1.00 20.89 N ATOM 1892 CA ASP A1036 -0.011 -1.956 30.474 1.00 21.87 C ATOM 1893 C ASP A1036 -0.728 -0.612 30.625 1.00 22.35 C ATOM 1894 O ASP A1036 -0.519 0.294 29.824 1.00 23.53 O ATOM 1895 CB ASP A1036 -0.881 -2.922 29.658 1.00 21.40 C ATOM 1896 CG ASP A1036 -0.065 -3.877 28.761 1.00 20.64 C ATOM 1897 OD1 ASP A1036 1.190 -3.841 28.724 1.00 19.51 O ATOM 1898 OD2 ASP A1036 -0.722 -4.674 28.069 1.00 20.32 O ATOM 1899 H ASP A1036 -0.019 -3.442 32.060 1.00 0.00 H ATOM 1900 N VAL A1037 -1.555 -0.477 31.653 1.00 23.37 N ATOM 1901 CA VAL A1037 -2.271 0.771 31.886 1.00 24.35 C ATOM 1902 C VAL A1037 -1.314 1.883 32.310 1.00 25.44 C ATOM 1903 O VAL A1037 -1.477 3.026 31.876 1.00 25.64 O ATOM 1904 CB VAL A1037 -3.376 0.613 32.944 1.00 24.73 C ATOM 1905 CG1 VAL A1037 -4.033 1.969 33.232 1.00 26.11 C ATOM 1906 CG2 VAL A1037 -4.413 -0.390 32.469 1.00 24.24 C ATOM 1907 H VAL A1037 -1.695 -1.276 32.304 1.00 0.00 H ATOM 1908 N TRP A1038 -0.322 1.544 33.142 1.00 24.39 N ATOM 1909 CA TRP A1038 0.730 2.483 33.516 1.00 23.92 C ATOM 1910 C TRP A1038 1.438 3.025 32.292 1.00 24.26 C ATOM 1911 O TRP A1038 1.740 4.209 32.224 1.00 23.78 O ATOM 1912 CB TRP A1038 1.766 1.806 34.420 1.00 24.59 C ATOM 1913 CG TRP A1038 2.893 2.715 34.842 1.00 23.42 C ATOM 1914 CD1 TRP A1038 3.885 3.212 34.054 1.00 23.07 C ATOM 1915 CD2 TRP A1038 3.137 3.215 36.153 1.00 23.76 C ATOM 1916 NE1 TRP A1038 4.728 3.991 34.789 1.00 23.73 N ATOM 1917 CE2 TRP A1038 4.292 4.016 36.083 1.00 24.01 C ATOM 1918 CE3 TRP A1038 2.487 3.075 37.379 1.00 25.01 C ATOM 1919 CZ2 TRP A1038 4.813 4.678 37.190 1.00 24.43 C ATOM 1920 CZ3 TRP A1038 3.013 3.734 38.489 1.00 25.94 C ATOM 1921 CH2 TRP A1038 4.167 4.518 38.384 1.00 24.59 C ATOM 1922 HE1 TRP A1038 5.567 4.486 34.424 1.00 0.00 H ATOM 1923 H TRP A1038 -0.300 0.581 33.534 1.00 0.00 H ATOM 1924 N SER A1039 1.730 2.135 31.343 1.00 26.04 N ATOM 1925 CA SER A1039 2.429 2.500 30.100 1.00 24.60 C ATOM 1926 C SER A1039 1.599 3.446 29.264 1.00 23.20 C ATOM 1927 O SER A1039 2.126 4.394 28.687 1.00 21.95 O ATOM 1928 CB SER A1039 2.736 1.256 29.282 1.00 24.95 C ATOM 1929 OG SER A1039 3.560 0.387 30.026 1.00 28.43 O ATOM 1930 HG SER A1039 3.756 -0.421 29.488 1.00 0.00 H ATOM 1931 H SER A1039 1.453 1.143 31.487 1.00 0.00 H ATOM 1932 N PHE A1040 0.300 3.167 29.205 1.00 22.07 N ATOM 1933 CA PHE A1040 -0.634 4.010 28.499 1.00 23.54 C ATOM 1934 C PHE A1040 -0.688 5.403 29.131 1.00 25.79 C ATOM 1935 O PHE A1040 -0.880 6.401 28.430 1.00 28.69 O ATOM 1936 CB PHE A1040 -2.017 3.378 28.496 1.00 23.22 C ATOM 1937 CG PHE A1040 -3.101 4.283 27.975 1.00 24.16 C ATOM 1938 CD1 PHE A1040 -3.781 5.138 28.832 1.00 23.40 C ATOM 1939 CD2 PHE A1040 -3.460 4.264 26.629 1.00 25.79 C ATOM 1940 CE1 PHE A1040 -4.794 5.950 28.367 1.00 23.77 C ATOM 1941 CE2 PHE A1040 -4.474 5.094 26.160 1.00 24.96 C ATOM 1942 CZ PHE A1040 -5.138 5.933 27.034 1.00 24.11 C ATOM 1943 H PHE A1040 -0.054 2.314 29.683 1.00 0.00 H ATOM 1944 N GLY A1041 -0.521 5.480 30.448 1.00 25.36 N ATOM 1945 CA GLY A1041 -0.483 6.769 31.110 1.00 24.56 C ATOM 1946 C GLY A1041 0.622 7.628 30.538 1.00 23.86 C ATOM 1947 O GLY A1041 0.454 8.834 30.325 1.00 24.19 O ATOM 1948 H GLY A1041 -0.417 4.609 31.007 1.00 0.00 H ATOM 1949 N VAL A1042 1.754 7.001 30.274 1.00 23.30 N ATOM 1950 CA VAL A1042 2.913 7.727 29.744 1.00 23.89 C ATOM 1951 C VAL A1042 2.786 7.938 28.213 1.00 21.76 C ATOM 1952 O VAL A1042 3.280 8.915 27.685 1.00 20.70 O ATOM 1953 CB VAL A1042 4.267 7.082 30.213 1.00 23.80 C ATOM 1954 CG1 VAL A1042 4.122 5.590 30.404 1.00 24.60 C ATOM 1955 CG2 VAL A1042 5.385 7.406 29.271 1.00 24.02 C ATOM 1956 H VAL A1042 1.825 5.977 30.444 1.00 0.00 H ATOM 1957 N VAL A1043 2.069 7.065 27.516 1.00 22.42 N ATOM 1958 CA VAL A1043 1.710 7.354 26.125 1.00 22.48 C ATOM 1959 C VAL A1043 0.908 8.644 26.070 1.00 23.61 C ATOM 1960 O VAL A1043 1.169 9.520 25.236 1.00 23.70 O ATOM 1961 CB VAL A1043 0.875 6.240 25.465 1.00 21.40 C ATOM 1962 CG1 VAL A1043 0.331 6.729 24.126 1.00 20.84 C ATOM 1963 CG2 VAL A1043 1.716 4.988 25.274 1.00 21.68 C ATOM 1964 H VAL A1043 1.762 6.175 27.958 1.00 0.00 H ATOM 1965 N LEU A1044 -0.066 8.756 26.968 1.00 23.30 N ATOM 1966 CA LEU A1044 -0.873 9.962 27.071 1.00 24.06 C ATOM 1967 C LEU A1044 0.020 11.174 27.371 1.00 25.51 C ATOM 1968 O LEU A1044 -0.190 12.263 26.820 1.00 28.69 O ATOM 1969 CB LEU A1044 -1.961 9.780 28.131 1.00 24.95 C ATOM 1970 CG LEU A1044 -3.126 10.781 28.175 1.00 25.15 C ATOM 1971 CD1 LEU A1044 -3.889 10.853 26.856 1.00 25.60 C ATOM 1972 CD2 LEU A1044 -4.070 10.430 29.324 1.00 24.95 C ATOM 1973 H LEU A1044 -0.256 7.962 27.613 1.00 0.00 H ATOM 1974 N TYR A1045 1.043 10.979 28.201 1.00 25.14 N ATOM 1975 CA TYR A1045 2.023 12.037 28.442 1.00 25.85 C ATOM 1976 C TYR A1045 2.792 12.429 27.177 1.00 25.77 C ATOM 1977 O TYR A1045 3.040 13.619 26.946 1.00 24.45 O ATOM 1978 CB TYR A1045 3.017 11.618 29.534 1.00 27.02 C ATOM 1979 CG TYR A1045 4.127 12.628 29.782 1.00 27.55 C ATOM 1980 CD1 TYR A1045 3.976 13.649 30.712 1.00 28.66 C ATOM 1981 CD2 TYR A1045 5.315 12.560 29.091 1.00 27.59 C ATOM 1982 CE1 TYR A1045 4.978 14.573 30.942 1.00 28.57 C ATOM 1983 CE2 TYR A1045 6.326 13.482 29.313 1.00 28.70 C ATOM 1984 CZ TYR A1045 6.147 14.490 30.251 1.00 28.38 C ATOM 1985 OH TYR A1045 7.124 15.430 30.510 1.00 29.60 O ATOM 1986 HH TYR A1045 7.325 15.932 29.681 1.00 0.00 H ATOM 1987 H TYR A1045 1.146 10.063 28.683 1.00 0.00 H ATOM 1988 N GLU A1046 3.188 11.429 26.381 1.00 25.99 N ATOM 1989 CA GLU A1046 3.985 11.668 25.176 1.00 25.98 C ATOM 1990 C GLU A1046 3.214 12.546 24.214 1.00 27.20 C ATOM 1991 O GLU A1046 3.716 13.575 23.765 1.00 26.93 O ATOM 1992 CB GLU A1046 4.344 10.372 24.453 1.00 25.43 C ATOM 1993 CG GLU A1046 5.275 9.423 25.189 1.00 24.71 C ATOM 1994 CD GLU A1046 5.697 8.242 24.316 1.00 24.80 C ATOM 1995 OE1 GLU A1046 6.653 8.399 23.521 1.00 27.60 O ATOM 1996 OE2 GLU A1046 5.084 7.159 24.408 1.00 22.47 O ATOM 1997 H GLU A1046 2.922 10.454 26.625 1.00 0.00 H ATOM 1998 N LEU A1047 1.979 12.144 23.921 1.00 27.80 N ATOM 1999 CA LEU A1047 1.149 12.861 22.946 1.00 28.27 C ATOM 2000 C LEU A1047 0.920 14.297 23.398 1.00 28.91 C ATOM 2001 O LEU A1047 1.032 15.231 22.599 1.00 29.60 O ATOM 2002 CB LEU A1047 -0.193 12.150 22.724 1.00 27.71 C ATOM 2003 CG LEU A1047 -0.132 10.670 22.300 1.00 27.59 C ATOM 2004 CD1 LEU A1047 -1.496 10.129 21.952 1.00 27.93 C ATOM 2005 CD2 LEU A1047 0.808 10.455 21.136 1.00 28.60 C ATOM 2006 H LEU A1047 1.593 11.302 24.394 1.00 0.00 H ATOM 2007 N PHE A1048 0.645 14.491 24.684 1.00 29.31 N ATOM 2008 CA PHE A1048 0.336 15.840 25.159 1.00 29.69 C ATOM 2009 C PHE A1048 1.557 16.749 25.358 1.00 32.14 C ATOM 2010 O PHE A1048 1.392 17.949 25.571 1.00 34.34 O ATOM 2011 CB PHE A1048 -0.604 15.802 26.368 1.00 27.13 C ATOM 2012 CG PHE A1048 -2.057 15.745 25.967 1.00 26.40 C ATOM 2013 CD1 PHE A1048 -2.677 14.527 25.729 1.00 25.29 C ATOM 2014 CD2 PHE A1048 -2.774 16.912 25.742 1.00 25.37 C ATOM 2015 CE1 PHE A1048 -3.991 14.471 25.321 1.00 23.89 C ATOM 2016 CE2 PHE A1048 -4.086 16.864 25.331 1.00 24.59 C ATOM 2017 CZ PHE A1048 -4.698 15.641 25.128 1.00 24.62 C ATOM 2018 H PHE A1048 0.649 13.690 25.347 1.00 0.00 H ATOM 2019 N THR A1049 2.762 16.187 25.238 1.00 32.00 N ATOM 2020 CA THR A1049 3.985 16.982 25.134 1.00 31.50 C ATOM 2021 C THR A1049 4.401 17.184 23.673 1.00 32.21 C ATOM 2022 O THR A1049 5.404 17.837 23.407 1.00 36.58 O ATOM 2023 CB THR A1049 5.172 16.309 25.881 1.00 33.38 C ATOM 2024 OG1 THR A1049 5.416 15.006 25.334 1.00 34.45 O ATOM 2025 CG2 THR A1049 4.888 16.176 27.365 1.00 34.56 C ATOM 2026 HG1 THR A1049 4.605 14.448 25.439 1.00 0.00 H ATOM 2027 H THR A1049 2.833 15.150 25.218 1.00 0.00 H ATOM 2028 N TYR A1050 3.634 16.620 22.737 1.00 32.08 N ATOM 2029 CA TYR A1050 3.949 16.641 21.301 1.00 30.56 C ATOM 2030 C TYR A1050 5.325 16.040 20.957 1.00 32.28 C ATOM 2031 O TYR A1050 5.986 16.458 20.007 1.00 32.44 O ATOM 2032 CB TYR A1050 3.775 18.056 20.743 1.00 28.41 C ATOM 2033 CG TYR A1050 2.331 18.366 20.479 1.00 27.49 C ATOM 2034 CD1 TYR A1050 1.500 18.816 21.500 1.00 26.71 C ATOM 2035 CD2 TYR A1050 1.782 18.176 19.219 1.00 26.69 C ATOM 2036 CE1 TYR A1050 0.162 19.092 21.267 1.00 26.26 C ATOM 2037 CE2 TYR A1050 0.447 18.444 18.978 1.00 26.30 C ATOM 2038 CZ TYR A1050 -0.357 18.904 20.007 1.00 26.37 C ATOM 2039 OH TYR A1050 -1.684 19.167 19.788 1.00 25.76 O ATOM 2040 HH TYR A1050 -1.770 19.865 19.092 1.00 0.00 H ATOM 2041 H TYR A1050 2.764 16.138 23.041 1.00 0.00 H ATOM 2042 N ILE A1051 5.741 15.045 21.739 1.00 34.34 N ATOM 2043 CA ILE A1051 7.020 14.369 21.532 1.00 34.53 C ATOM 2044 C ILE A1051 8.211 15.340 21.492 1.00 36.49 C ATOM 2045 O ILE A1051 9.220 15.046 20.856 1.00 38.38 O ATOM 2046 CB ILE A1051 7.016 13.526 20.224 1.00 34.04 C ATOM 2047 CG1 ILE A1051 5.692 12.769 20.038 1.00 32.33 C ATOM 2048 CG2 ILE A1051 8.184 12.556 20.219 1.00 35.04 C ATOM 2049 CD1 ILE A1051 5.254 11.962 21.240 1.00 32.00 C ATOM 2050 H ILE A1051 5.134 14.738 22.525 1.00 0.00 H ATOM 2051 N GLU A1052 8.110 16.487 22.164 1.00 39.60 N ATOM 2052 CA GLU A1052 9.265 17.373 22.279 1.00 42.70 C ATOM 2053 C GLU A1052 10.363 16.633 23.016 1.00 40.90 C ATOM 2054 O GLU A1052 10.120 16.043 24.064 1.00 39.57 O ATOM 2055 CB GLU A1052 8.951 18.687 23.009 1.00 46.78 C ATOM 2056 CG GLU A1052 10.176 19.641 23.048 1.00 53.73 C ATOM 2057 CD GLU A1052 9.860 21.060 23.557 1.00 63.90 C ATOM 2058 OE1 GLU A1052 8.786 21.267 24.174 1.00 66.39 O ATOM 2059 OE2 GLU A1052 10.709 21.977 23.356 1.00 68.90 O ATOM 2060 H GLU A1052 7.207 16.751 22.607 1.00 0.00 H ATOM 2061 N LYS A1053 11.564 16.676 22.446 1.00 42.92 N ATOM 2062 CA LYS A1053 12.756 16.012 22.998 1.00 43.33 C ATOM 2063 C LYS A1053 12.977 16.307 24.476 1.00 42.21 C ATOM 2064 O LYS A1053 13.037 15.394 25.291 1.00 40.14 O ATOM 2065 CB LYS A1053 14.003 16.449 22.219 1.00 41.87 C ATOM 2066 H LYS A1053 11.667 17.210 21.559 1.00 0.00 H ATOM 2067 N SER A1054 13.073 17.588 24.819 1.00 41.64 N ATOM 2068 CA SER A1054 13.408 17.993 26.189 1.00 40.90 C ATOM 2069 C SER A1054 12.328 17.673 27.225 1.00 39.91 C ATOM 2070 O SER A1054 12.568 17.791 28.423 1.00 39.56 O ATOM 2071 CB SER A1054 13.726 19.493 26.240 1.00 39.99 C ATOM 2072 OG SER A1054 12.563 20.270 26.034 1.00 39.93 O ATOM 2073 HG SER A1054 12.798 21.231 26.072 1.00 0.00 H ATOM 2074 H SER A1054 12.907 18.320 24.099 1.00 0.00 H ATOM 2075 N LYS A1055 11.144 17.277 26.769 1.00 39.61 N ATOM 2076 CA LYS A1055 10.028 16.992 27.662 1.00 38.56 C ATOM 2077 C LYS A1055 9.767 15.503 27.759 1.00 36.16 C ATOM 2078 O LYS A1055 8.752 15.107 28.321 1.00 35.24 O ATOM 2079 CB LYS A1055 8.756 17.686 27.150 1.00 40.60 C ATOM 2080 CG LYS A1055 8.852 19.216 27.015 1.00 41.94 C ATOM 2081 CD LYS A1055 8.937 19.890 28.374 1.00 44.46 C ATOM 2082 CE LYS A1055 8.707 21.389 28.273 1.00 45.75 C ATOM 2083 NZ LYS A1055 8.766 22.020 29.633 1.00 47.50 N ATOM 2084 HZ1 LYS A1055 8.030 21.604 30.239 1.00 0.00 H ATOM 2085 HZ2 LYS A1055 9.702 21.848 30.053 1.00 0.00 H ATOM 2086 HZ3 LYS A1055 8.607 23.044 29.546 1.00 0.00 H ATOM 2087 H LYS A1055 11.010 17.167 25.744 1.00 0.00 H ATOM 2088 N SER A1056 10.669 14.679 27.222 1.00 33.83 N ATOM 2089 CA SER A1056 10.406 13.241 27.103 1.00 32.12 C ATOM 2090 C SER A1056 10.598 12.549 28.443 1.00 31.17 C ATOM 2091 O SER A1056 11.267 13.087 29.322 1.00 29.19 O ATOM 2092 CB SER A1056 11.308 12.596 26.059 1.00 31.56 C ATOM 2093 OG SER A1056 12.590 12.354 26.596 1.00 32.68 O ATOM 2094 HG SER A1056 13.162 11.935 25.905 1.00 0.00 H ATOM 2095 H SER A1056 11.574 15.063 26.882 1.00 0.00 H ATOM 2096 N PRO A1057 9.989 11.361 28.609 1.00 30.90 N ATOM 2097 CA PRO A1057 10.096 10.653 29.882 1.00 30.93 C ATOM 2098 C PRO A1057 11.521 10.356 30.301 1.00 30.29 C ATOM 2099 O PRO A1057 11.843 10.519 31.472 1.00 31.80 O ATOM 2100 CB PRO A1057 9.297 9.362 29.650 1.00 31.71 C ATOM 2101 CG PRO A1057 8.393 9.669 28.500 1.00 31.23 C ATOM 2102 CD PRO A1057 9.133 10.638 27.647 1.00 30.57 C ATOM 2103 N PRO A1058 12.373 9.903 29.365 1.00 30.93 N ATOM 2104 CA PRO A1058 13.778 9.799 29.713 1.00 30.54 C ATOM 2105 C PRO A1058 14.364 11.158 30.076 1.00 30.57 C ATOM 2106 O PRO A1058 15.031 11.285 31.094 1.00 32.09 O ATOM 2107 CB PRO A1058 14.403 9.241 28.434 1.00 30.74 C ATOM 2108 CG PRO A1058 13.315 8.553 27.755 1.00 31.14 C ATOM 2109 CD PRO A1058 12.134 9.407 28.001 1.00 32.04 C ATOM 2110 N ALA A1059 14.084 12.165 29.255 1.00 30.95 N ATOM 2111 CA ALA A1059 14.524 13.533 29.502 1.00 30.17 C ATOM 2112 C ALA A1059 14.118 13.990 30.878 1.00 30.59 C ATOM 2113 O ALA A1059 14.929 14.529 31.612 1.00 33.58 O ATOM 2114 CB ALA A1059 13.944 14.466 28.464 1.00 30.59 C ATOM 2115 H ALA A1059 13.527 11.969 28.399 1.00 0.00 H ATOM 2116 N GLU A1060 12.859 13.763 31.228 1.00 33.43 N ATOM 2117 CA GLU A1060 12.321 14.234 32.503 1.00 33.79 C ATOM 2118 C GLU A1060 12.775 13.420 33.695 1.00 33.48 C ATOM 2119 O GLU A1060 13.227 13.993 34.672 1.00 33.60 O ATOM 2120 CB GLU A1060 10.798 14.305 32.467 1.00 35.66 C ATOM 2121 CG GLU A1060 10.282 15.679 32.077 1.00 38.51 C ATOM 2122 CD GLU A1060 10.364 16.701 33.207 1.00 42.57 C ATOM 2123 OE1 GLU A1060 10.960 16.427 34.274 1.00 46.20 O ATOM 2124 OE2 GLU A1060 9.821 17.803 33.023 1.00 50.16 O ATOM 2125 H GLU A1060 12.239 13.237 30.579 1.00 0.00 H ATOM 2126 N PHE A1061 12.673 12.097 33.627 1.00 33.25 N ATOM 2127 CA PHE A1061 13.085 11.276 34.764 1.00 32.98 C ATOM 2128 C PHE A1061 14.550 11.495 35.109 1.00 32.74 C ATOM 2129 O PHE A1061 14.917 11.552 36.288 1.00 32.84 O ATOM 2130 CB PHE A1061 12.812 9.779 34.527 1.00 33.71 C ATOM 2131 CG PHE A1061 11.378 9.380 34.755 1.00 34.23 C ATOM 2132 CD1 PHE A1061 10.768 9.619 35.975 1.00 32.41 C ATOM 2133 CD2 PHE A1061 10.636 8.778 33.747 1.00 34.34 C ATOM 2134 CE1 PHE A1061 9.456 9.265 36.184 1.00 32.34 C ATOM 2135 CE2 PHE A1061 9.315 8.412 33.961 1.00 32.62 C ATOM 2136 CZ PHE A1061 8.728 8.655 35.176 1.00 31.28 C ATOM 2137 H PHE A1061 12.301 11.647 32.767 1.00 0.00 H ATOM 2138 N MET A1062 15.385 11.629 34.084 1.00 34.25 N ATOM 2139 CA MET A1062 16.819 11.773 34.306 1.00 35.14 C ATOM 2140 C MET A1062 17.181 13.113 34.951 1.00 33.17 C ATOM 2141 O MET A1062 18.161 13.190 35.692 1.00 32.96 O ATOM 2142 CB MET A1062 17.586 11.545 33.010 1.00 36.67 C ATOM 2143 CG MET A1062 17.612 10.069 32.598 1.00 38.82 C ATOM 2144 SD MET A1062 18.833 9.114 33.542 1.00 39.41 S ATOM 2145 CE MET A1062 20.318 9.715 32.735 1.00 38.37 C ATOM 2146 H MET A1062 15.012 11.631 33.113 1.00 0.00 H ATOM 2147 N ARG A1063 16.387 14.148 34.693 1.00 32.47 N ATOM 2148 CA ARG A1063 16.519 15.409 35.425 1.00 35.91 C ATOM 2149 C ARG A1063 16.149 15.287 36.904 1.00 36.10 C ATOM 2150 O ARG A1063 16.806 15.869 37.760 1.00 35.11 O ATOM 2151 CB ARG A1063 15.680 16.519 34.782 1.00 40.37 C ATOM 2152 CG ARG A1063 16.459 17.377 33.787 1.00 44.78 C ATOM 2153 CD ARG A1063 15.784 18.717 33.571 1.00 50.56 C ATOM 2154 NE ARG A1063 14.386 18.572 33.182 1.00 54.50 N ATOM 2155 CZ ARG A1063 13.961 18.220 31.969 1.00 56.31 C ATOM 2156 NH1 ARG A1063 14.812 17.955 30.983 1.00 55.42 N ATOM 2157 NH2 ARG A1063 12.657 18.124 31.745 1.00 61.38 N ATOM 2158 HE ARG A1063 13.665 18.758 33.908 1.00 0.00 H ATOM 2159 HH12 ARG A1063 14.453 17.682 30.046 1.00 0.00 H ATOM 2160 HH11 ARG A1063 15.837 18.020 31.149 1.00 0.00 H ATOM 2161 HH22 ARG A1063 12.310 17.850 30.804 1.00 0.00 H ATOM 2162 HH21 ARG A1063 11.982 18.322 32.511 1.00 0.00 H ATOM 2163 H ARG A1063 15.658 14.060 33.957 1.00 0.00 H ATOM 2164 N MET A1064 15.095 14.535 37.199 1.00 39.07 N ATOM 2165 CA MET A1064 14.629 14.376 38.569 1.00 41.62 C ATOM 2166 C MET A1064 15.554 13.417 39.324 1.00 45.62 C ATOM 2167 O MET A1064 15.887 13.649 40.479 1.00 51.12 O ATOM 2168 CB MET A1064 13.192 13.853 38.596 1.00 43.27 C ATOM 2169 CG MET A1064 12.202 14.665 37.765 1.00 45.36 C ATOM 2170 SD MET A1064 10.491 14.104 37.956 1.00 50.53 S ATOM 2171 CE MET A1064 10.483 12.616 36.971 1.00 52.04 C ATOM 2172 H MET A1064 14.590 14.047 36.432 1.00 0.00 H ATOM 2173 N ILE A1065 15.972 12.340 38.670 1.00 49.30 N ATOM 2174 CA ILE A1065 16.994 11.462 39.236 1.00 52.96 C ATOM 2175 C ILE A1065 18.219 12.268 39.690 1.00 59.04 C ATOM 2176 O ILE A1065 18.858 11.934 40.688 1.00 61.40 O ATOM 2177 CB ILE A1065 17.447 10.396 38.216 1.00 52.36 C ATOM 2178 CG1 ILE A1065 16.448 9.237 38.183 1.00 50.95 C ATOM 2179 CG2 ILE A1065 18.833 9.892 38.564 1.00 53.15 C ATOM 2180 CD1 ILE A1065 16.751 8.192 37.145 1.00 50.80 C ATOM 2181 H ILE A1065 15.565 12.117 37.739 1.00 0.00 H ATOM 2182 N GLY A1066 18.537 13.333 38.955 1.00 67.51 N ATOM 2183 CA GLY A1066 19.700 14.173 39.256 1.00 71.55 C ATOM 2184 C GLY A1066 21.016 13.482 38.910 1.00 76.57 C ATOM 2185 O GLY A1066 21.014 12.410 38.268 1.00 72.50 O ATOM 2186 H GLY A1066 17.939 13.577 38.140 1.00 0.00 H ATOM 2187 N ASN A1067 22.149 14.076 39.307 1.00 78.77 N ATOM 2188 CA ASN A1067 22.209 15.429 39.892 1.00 76.54 C ATOM 2189 C ASN A1067 23.409 16.202 39.346 1.00 70.46 C ATOM 2190 O ASN A1067 23.294 16.890 38.325 1.00 61.94 O ATOM 2191 CB ASN A1067 22.285 15.366 41.421 1.00 77.30 C ATOM 2192 H ASN A1067 23.040 13.552 39.196 1.00 0.00 H TER 2193 ASN A1067 ATOM 2194 N GLN A1072 25.629 3.332 42.208 1.00 56.45 N ATOM 2195 CA GLN A1072 24.830 2.954 41.026 1.00 62.05 C ATOM 2196 C GLN A1072 23.317 2.997 41.285 1.00 57.01 C ATOM 2197 O GLN A1072 22.910 3.478 42.314 1.00 59.97 O ATOM 2198 CB GLN A1072 25.262 1.572 40.536 1.00 61.59 C ATOM 2199 HN3 GLN A1072 25.423 2.676 42.988 1.00 0.00 H ATOM 2200 HN2 GLN A1072 25.385 4.301 42.495 1.00 0.00 H ATOM 2201 HN1 GLN A1072 26.640 3.284 41.971 1.00 0.00 H ATOM 2202 N SER A1073 22.472 2.387 40.468 1.00 53.88 N ATOM 2203 CA SER A1073 22.480 2.241 39.036 1.00 48.85 C ATOM 2204 C SER A1073 21.451 3.237 38.688 1.00 46.68 C ATOM 2205 O SER A1073 21.143 4.053 39.505 1.00 47.67 O ATOM 2206 CB SER A1073 21.918 0.891 38.607 1.00 47.66 C ATOM 2207 H SER A1073 21.664 1.936 40.942 1.00 0.00 H ATOM 2208 N ILE A1074 20.883 3.158 37.500 1.00 44.76 N ATOM 2209 CA ILE A1074 19.922 4.157 37.098 1.00 41.39 C ATOM 2210 C ILE A1074 18.550 3.657 37.379 1.00 40.97 C ATOM 2211 O ILE A1074 17.802 4.356 37.956 1.00 43.39 O ATOM 2212 CB ILE A1074 20.178 4.743 35.691 1.00 39.65 C ATOM 2213 CG1 ILE A1074 20.782 6.095 35.806 1.00 39.79 C ATOM 2214 CG2 ILE A1074 18.939 5.072 34.936 1.00 39.78 C ATOM 2215 CD1 ILE A1074 21.435 6.455 34.530 1.00 39.81 C ATOM 2216 H ILE A1074 21.127 2.379 36.856 1.00 0.00 H ATOM 2217 N VAL A1075 18.237 2.432 37.036 1.00 38.32 N ATOM 2218 CA VAL A1075 17.008 1.813 37.491 1.00 36.10 C ATOM 2219 C VAL A1075 16.832 2.045 38.992 1.00 33.26 C ATOM 2220 O VAL A1075 15.883 2.603 39.409 1.00 32.64 O ATOM 2221 CB VAL A1075 17.015 0.322 37.215 1.00 36.23 C ATOM 2222 CG1 VAL A1075 15.641 -0.203 37.184 1.00 37.20 C ATOM 2223 CG2 VAL A1075 17.588 0.049 35.880 1.00 39.81 C ATOM 2224 H VAL A1075 18.883 1.893 36.425 1.00 0.00 H ATOM 2225 N THR A1076 17.765 1.641 39.804 1.00 30.68 N ATOM 2226 CA THR A1076 17.631 1.779 41.269 1.00 31.10 C ATOM 2227 C THR A1076 17.201 3.193 41.694 1.00 30.14 C ATOM 2228 O THR A1076 16.401 3.347 42.611 1.00 30.14 O ATOM 2229 CB THR A1076 18.941 1.365 42.025 1.00 31.93 C ATOM 2230 OG1 THR A1076 19.290 0.017 41.683 1.00 33.54 O ATOM 2231 CG2 THR A1076 18.780 1.464 43.534 1.00 30.45 C ATOM 2232 HG1 THR A1076 20.117 -0.240 42.162 1.00 0.00 H ATOM 2233 H THR A1076 18.627 1.210 39.412 1.00 0.00 H ATOM 2234 N HIS A1077 17.729 4.207 41.011 1.00 31.20 N ATOM 2235 CA HIS A1077 17.304 5.599 41.187 1.00 31.08 C ATOM 2236 C HIS A1077 15.857 5.837 40.769 1.00 30.45 C ATOM 2237 O HIS A1077 15.151 6.648 41.371 1.00 33.18 O ATOM 2238 CB HIS A1077 18.185 6.544 40.360 1.00 34.20 C ATOM 2239 CG HIS A1077 19.500 6.863 40.990 1.00 36.94 C ATOM 2240 ND1 HIS A1077 19.632 7.762 42.025 1.00 39.42 N ATOM 2241 CD2 HIS A1077 20.747 6.417 40.719 1.00 38.31 C ATOM 2242 CE1 HIS A1077 20.904 7.847 42.373 1.00 38.72 C ATOM 2243 NE2 HIS A1077 21.602 7.037 41.598 1.00 38.92 N ATOM 2244 H HIS A1077 18.479 4.002 40.320 1.00 0.00 H ATOM 2245 N LEU A1078 15.425 5.160 39.713 1.00 28.66 N ATOM 2246 CA LEU A1078 14.071 5.321 39.207 1.00 25.81 C ATOM 2247 C LEU A1078 13.084 4.694 40.165 1.00 25.06 C ATOM 2248 O LEU A1078 12.169 5.352 40.616 1.00 26.67 O ATOM 2249 CB LEU A1078 13.940 4.694 37.820 1.00 25.55 C ATOM 2250 CG LEU A1078 12.657 4.977 37.056 1.00 26.23 C ATOM 2251 CD1 LEU A1078 12.423 6.468 36.947 1.00 26.46 C ATOM 2252 CD2 LEU A1078 12.719 4.322 35.680 1.00 26.74 C ATOM 2253 H LEU A1078 16.070 4.498 39.236 1.00 0.00 H ATOM 2254 N ILE A1079 13.296 3.426 40.487 1.00 24.62 N ATOM 2255 CA ILE A1079 12.477 2.709 41.458 1.00 25.89 C ATOM 2256 C ILE A1079 12.221 3.535 42.713 1.00 28.27 C ATOM 2257 O ILE A1079 11.087 3.589 43.194 1.00 33.18 O ATOM 2258 CB ILE A1079 13.139 1.390 41.884 1.00 25.79 C ATOM 2259 CG1 ILE A1079 13.182 0.399 40.717 1.00 24.83 C ATOM 2260 CG2 ILE A1079 12.394 0.780 43.053 1.00 25.10 C ATOM 2261 CD1 ILE A1079 14.071 -0.777 40.967 1.00 25.13 C ATOM 2262 H ILE A1079 14.080 2.920 40.028 1.00 0.00 H ATOM 2263 N GLU A1080 13.269 4.182 43.227 1.00 30.00 N ATOM 2264 CA GLU A1080 13.181 4.994 44.448 1.00 31.42 C ATOM 2265 C GLU A1080 12.462 6.321 44.213 1.00 30.33 C ATOM 2266 O GLU A1080 11.686 6.768 45.059 1.00 31.57 O ATOM 2267 CB GLU A1080 14.584 5.254 45.024 1.00 33.81 C ATOM 2268 CG GLU A1080 14.601 5.819 46.462 1.00 33.68 C ATOM 2269 H GLU A1080 14.186 4.108 42.743 1.00 0.00 H ATOM 2270 N LEU A1081 12.733 6.953 43.077 1.00 29.49 N ATOM 2271 CA LEU A1081 12.023 8.169 42.674 1.00 29.98 C ATOM 2272 C LEU A1081 10.520 7.923 42.580 1.00 29.74 C ATOM 2273 O LEU A1081 9.730 8.731 43.058 1.00 31.41 O ATOM 2274 CB LEU A1081 12.550 8.667 41.320 1.00 31.02 C ATOM 2275 CG LEU A1081 11.961 9.961 40.763 1.00 30.15 C ATOM 2276 CD1 LEU A1081 12.109 11.071 41.781 1.00 31.53 C ATOM 2277 CD2 LEU A1081 12.651 10.337 39.466 1.00 30.81 C ATOM 2278 H LEU A1081 13.473 6.572 42.453 1.00 0.00 H ATOM 2279 N LEU A1082 10.133 6.804 41.974 1.00 28.27 N ATOM 2280 CA LEU A1082 8.721 6.422 41.876 1.00 28.63 C ATOM 2281 C LEU A1082 8.113 6.113 43.250 1.00 30.80 C ATOM 2282 O LEU A1082 6.960 6.432 43.499 1.00 30.28 O ATOM 2283 CB LEU A1082 8.542 5.218 40.938 1.00 26.93 C ATOM 2284 CG LEU A1082 8.953 5.411 39.467 1.00 26.69 C ATOM 2285 CD1 LEU A1082 8.859 4.084 38.716 1.00 25.58 C ATOM 2286 CD2 LEU A1082 8.128 6.500 38.760 1.00 26.23 C ATOM 2287 H LEU A1082 10.854 6.181 41.557 1.00 0.00 H ATOM 2288 N LYS A1083 8.888 5.490 44.136 1.00 32.51 N ATOM 2289 CA LYS A1083 8.408 5.127 45.467 1.00 33.68 C ATOM 2290 C LYS A1083 8.219 6.374 46.332 1.00 33.14 C ATOM 2291 O LYS A1083 7.397 6.385 47.231 1.00 32.00 O ATOM 2292 CB LYS A1083 9.372 4.137 46.143 1.00 37.81 C ATOM 2293 CG LYS A1083 8.884 3.590 47.500 1.00 40.27 C ATOM 2294 CD LYS A1083 10.014 2.984 48.354 1.00 41.89 C ATOM 2295 CE LYS A1083 9.633 3.002 49.851 1.00 44.70 C ATOM 2296 NZ LYS A1083 10.590 2.309 50.764 1.00 44.90 N ATOM 2297 HZ1 LYS A1083 10.665 1.308 50.491 1.00 0.00 H ATOM 2298 HZ2 LYS A1083 11.524 2.760 50.692 1.00 0.00 H ATOM 2299 HZ3 LYS A1083 10.245 2.378 51.743 1.00 0.00 H ATOM 2300 H LYS A1083 9.866 5.254 43.872 1.00 0.00 H ATOM 2301 N ASN A1084 8.960 7.437 46.050 1.00 34.34 N ATOM 2302 CA ASN A1084 8.722 8.716 46.726 1.00 35.95 C ATOM 2303 C ASN A1084 7.740 9.624 45.955 1.00 33.53 C ATOM 2304 O ASN A1084 7.818 10.854 46.064 1.00 32.91 O ATOM 2305 CB ASN A1084 10.048 9.454 46.971 1.00 38.08 C ATOM 2306 CG ASN A1084 11.039 8.632 47.791 1.00 39.80 C ATOM 2307 OD1 ASN A1084 10.662 7.917 48.725 1.00 40.21 O ATOM 2308 ND2 ASN A1084 12.316 8.741 47.448 1.00 40.97 N ATOM 2309 HD22 ASN A1084 12.591 9.355 46.655 1.00 0.00 H ATOM 2310 HD21 ASN A1084 13.042 8.213 47.973 1.00 0.00 H ATOM 2311 H ASN A1084 9.718 7.363 45.342 1.00 0.00 H ATOM 2312 N ASN A1085 6.860 9.007 45.166 1.00 31.77 N ATOM 2313 CA ASN A1085 5.806 9.715 44.456 1.00 32.26 C ATOM 2314 C ASN A1085 6.333 10.788 43.494 1.00 31.02 C ATOM 2315 O ASN A1085 5.745 11.861 43.344 1.00 30.73 O ATOM 2316 CB ASN A1085 4.810 10.290 45.470 1.00 33.31 C ATOM 2317 CG ASN A1085 4.266 9.220 46.411 1.00 34.64 C ATOM 2318 OD1 ASN A1085 3.776 8.175 45.965 1.00 33.37 O ATOM 2319 ND2 ASN A1085 4.347 9.472 47.718 1.00 35.48 N ATOM 2320 HD22 ASN A1085 4.767 10.364 48.051 1.00 0.00 H ATOM 2321 HD21 ASN A1085 3.991 8.777 48.405 1.00 0.00 H ATOM 2322 H ASN A1085 6.930 7.975 45.053 1.00 0.00 H ATOM 2323 N GLY A1086 7.449 10.480 42.841 1.00 29.60 N ATOM 2324 CA GLY A1086 8.001 11.337 41.802 1.00 28.51 C ATOM 2325 C GLY A1086 7.365 10.960 40.475 1.00 27.38 C ATOM 2326 O GLY A1086 7.290 9.784 40.122 1.00 25.79 O ATOM 2327 H GLY A1086 7.944 9.597 43.080 1.00 0.00 H ATOM 2328 N ARG A1087 6.893 11.957 39.743 1.00 28.39 N ATOM 2329 CA ARG A1087 6.204 11.698 38.490 1.00 29.64 C ATOM 2330 C ARG A1087 6.436 12.743 37.400 1.00 30.14 C ATOM 2331 O ARG A1087 6.832 13.883 37.666 1.00 31.66 O ATOM 2332 CB ARG A1087 4.700 11.506 38.735 1.00 29.37 C ATOM 2333 CG ARG A1087 4.281 10.029 38.888 1.00 29.98 C ATOM 2334 CD ARG A1087 3.770 9.776 40.256 1.00 29.64 C ATOM 2335 NE ARG A1087 3.351 8.393 40.480 1.00 27.55 N ATOM 2336 CZ ARG A1087 4.139 7.439 40.951 1.00 25.58 C ATOM 2337 NH1 ARG A1087 5.406 7.688 41.205 1.00 26.42 N ATOM 2338 NH2 ARG A1087 3.662 6.227 41.165 1.00 23.74 N ATOM 2339 HE ARG A1087 2.367 8.142 40.254 1.00 0.00 H ATOM 2340 HH12 ARG A1087 6.020 6.935 41.575 1.00 0.00 H ATOM 2341 HH11 ARG A1087 5.793 8.638 41.036 1.00 0.00 H ATOM 2342 HH22 ARG A1087 4.285 5.481 41.535 1.00 0.00 H ATOM 2343 HH21 ARG A1087 2.663 6.018 40.964 1.00 0.00 H ATOM 2344 H ARG A1087 7.017 12.937 40.068 1.00 0.00 H ATOM 2345 N LEU A1088 6.198 12.318 36.165 1.00 29.57 N ATOM 2346 CA LEU A1088 6.273 13.201 35.017 1.00 29.88 C ATOM 2347 C LEU A1088 5.306 14.328 35.281 1.00 29.85 C ATOM 2348 O LEU A1088 4.214 14.074 35.764 1.00 30.67 O ATOM 2349 CB LEU A1088 5.876 12.457 33.742 1.00 29.85 C ATOM 2350 CG LEU A1088 6.867 11.367 33.325 1.00 29.01 C ATOM 2351 CD1 LEU A1088 6.250 10.345 32.381 1.00 28.23 C ATOM 2352 CD2 LEU A1088 8.063 12.035 32.705 1.00 29.37 C ATOM 2353 H LEU A1088 5.950 11.319 36.016 1.00 0.00 H ATOM 2354 N PRO A1089 5.704 15.575 34.989 1.00 31.88 N ATOM 2355 CA PRO A1089 4.842 16.719 35.261 1.00 32.92 C ATOM 2356 C PRO A1089 3.688 16.863 34.271 1.00 34.53 C ATOM 2357 O PRO A1089 3.616 16.135 33.283 1.00 34.81 O ATOM 2358 CB PRO A1089 5.791 17.900 35.128 1.00 33.40 C ATOM 2359 CG PRO A1089 6.790 17.456 34.144 1.00 33.91 C ATOM 2360 CD PRO A1089 6.976 15.989 34.379 1.00 33.86 C ATOM 2361 N ARG A1090 2.783 17.793 34.556 1.00 33.97 N ATOM 2362 CA ARG A1090 1.702 18.113 33.643 1.00 31.35 C ATOM 2363 C ARG A1090 2.320 18.781 32.434 1.00 31.77 C ATOM 2364 O ARG A1090 3.047 19.763 32.579 1.00 33.61 O ATOM 2365 CB ARG A1090 0.716 19.069 34.315 1.00 32.01 C ATOM 2366 CG ARG A1090 -0.585 19.331 33.541 1.00 32.14 C ATOM 2367 CD ARG A1090 -1.144 20.704 33.890 1.00 34.07 C ATOM 2368 NE ARG A1090 -2.601 20.724 34.065 1.00 34.15 N ATOM 2369 CZ ARG A1090 -3.240 20.348 35.176 1.00 34.23 C ATOM 2370 NH1 ARG A1090 -2.581 19.880 36.238 1.00 35.39 N ATOM 2371 NH2 ARG A1090 -4.556 20.425 35.225 1.00 33.06 N ATOM 2372 HE ARG A1090 -3.178 21.055 33.266 1.00 0.00 H ATOM 2373 HH12 ARG A1090 -3.104 19.594 37.090 1.00 0.00 H ATOM 2374 HH11 ARG A1090 -1.544 19.801 36.213 1.00 0.00 H ATOM 2375 HH22 ARG A1090 -5.062 20.134 36.086 1.00 0.00 H ATOM 2376 HH21 ARG A1090 -5.087 20.776 34.403 1.00 0.00 H ATOM 2377 H ARG A1090 2.851 18.306 35.458 1.00 0.00 H ATOM 2378 N PRO A1091 2.075 18.241 31.234 1.00 31.43 N ATOM 2379 CA PRO A1091 2.514 18.972 30.046 1.00 31.95 C ATOM 2380 C PRO A1091 1.885 20.360 29.960 1.00 32.52 C ATOM 2381 O PRO A1091 0.757 20.553 30.399 1.00 33.22 O ATOM 2382 CB PRO A1091 2.029 18.095 28.882 1.00 31.22 C ATOM 2383 CG PRO A1091 1.860 16.744 29.467 1.00 32.06 C ATOM 2384 CD PRO A1091 1.434 16.962 30.889 1.00 31.31 C ATOM 2385 N ASP A1092 2.621 21.311 29.392 1.00 35.54 N ATOM 2386 CA ASP A1092 2.106 22.661 29.164 1.00 35.49 C ATOM 2387 C ASP A1092 0.799 22.585 28.401 1.00 33.64 C ATOM 2388 O ASP A1092 0.721 21.889 27.401 1.00 35.11 O ATOM 2389 CB ASP A1092 3.097 23.479 28.341 1.00 36.25 C ATOM 2390 CG ASP A1092 4.390 23.746 29.073 1.00 36.67 C ATOM 2391 OD1 ASP A1092 4.423 23.620 30.324 1.00 32.15 O ATOM 2392 OD2 ASP A1092 5.376 24.087 28.373 1.00 40.37 O ATOM 2393 H ASP A1092 3.594 21.088 29.101 1.00 0.00 H ATOM 2394 N GLY A1093 -0.230 23.270 28.892 1.00 32.40 N ATOM 2395 CA GLY A1093 -1.503 23.371 28.179 1.00 30.97 C ATOM 2396 C GLY A1093 -2.379 22.143 28.233 1.00 31.69 C ATOM 2397 O GLY A1093 -3.409 22.090 27.551 1.00 30.34 O ATOM 2398 H GLY A1093 -0.126 23.748 29.810 1.00 0.00 H ATOM 2399 N CYS A1094 -1.985 21.159 29.042 1.00 34.32 N ATOM 2400 CA CYS A1094 -2.745 19.926 29.169 1.00 35.65 C ATOM 2401 C CYS A1094 -3.955 20.125 30.069 1.00 36.57 C ATOM 2402 O CYS A1094 -3.818 20.642 31.171 1.00 40.43 O ATOM 2403 CB CYS A1094 -1.876 18.813 29.745 1.00 36.71 C ATOM 2404 SG CYS A1094 -2.763 17.259 29.916 1.00 35.91 S ATOM 2405 H CYS A1094 -1.113 21.276 29.596 1.00 0.00 H ATOM 2406 N PRO A1095 -5.146 19.712 29.609 1.00 38.85 N ATOM 2407 CA PRO A1095 -6.365 19.830 30.405 1.00 41.03 C ATOM 2408 C PRO A1095 -6.298 19.156 31.785 1.00 42.92 C ATOM 2409 O PRO A1095 -5.509 18.224 31.984 1.00 43.13 O ATOM 2410 CB PRO A1095 -7.408 19.125 29.541 1.00 39.95 C ATOM 2411 CG PRO A1095 -6.887 19.212 28.166 1.00 39.60 C ATOM 2412 CD PRO A1095 -5.420 19.126 28.285 1.00 39.75 C ATOM 2413 N ASP A1096 -7.128 19.644 32.712 1.00 41.99 N ATOM 2414 CA ASP A1096 -7.275 19.061 34.051 1.00 40.66 C ATOM 2415 C ASP A1096 -7.673 17.594 33.992 1.00 38.04 C ATOM 2416 O ASP A1096 -7.086 16.763 34.667 1.00 34.84 O ATOM 2417 CB ASP A1096 -8.351 19.809 34.862 1.00 41.92 C ATOM 2418 CG ASP A1096 -7.883 21.159 35.391 1.00 42.77 C ATOM 2419 OD1 ASP A1096 -7.144 21.870 34.682 1.00 47.99 O ATOM 2420 OD2 ASP A1096 -8.280 21.527 36.517 1.00 42.62 O ATOM 2421 H ASP A1096 -7.699 20.480 32.472 1.00 0.00 H ATOM 2422 N GLU A1097 -8.695 17.300 33.197 1.00 38.56 N ATOM 2423 CA GLU A1097 -9.315 15.979 33.192 1.00 38.47 C ATOM 2424 C GLU A1097 -8.446 14.926 32.503 1.00 37.35 C ATOM 2425 O GLU A1097 -8.522 13.731 32.846 1.00 37.32 O ATOM 2426 CB GLU A1097 -10.726 16.025 32.579 1.00 42.09 C ATOM 2427 CG GLU A1097 -10.848 16.699 31.183 1.00 48.81 C ATOM 2428 CD GLU A1097 -11.047 18.240 31.227 1.00 50.85 C ATOM 2429 OE1 GLU A1097 -11.211 18.820 32.336 1.00 48.48 O ATOM 2430 OE2 GLU A1097 -11.034 18.860 30.131 1.00 48.32 O ATOM 2431 H GLU A1097 -9.065 18.033 32.559 1.00 0.00 H ATOM 2432 N ILE A1098 -7.624 15.362 31.545 1.00 33.37 N ATOM 2433 CA ILE A1098 -6.637 14.481 30.927 1.00 33.16 C ATOM 2434 C ILE A1098 -5.503 14.196 31.901 1.00 30.91 C ATOM 2435 O ILE A1098 -5.193 13.050 32.165 1.00 33.84 O ATOM 2436 CB ILE A1098 -6.039 15.088 29.641 1.00 34.74 C ATOM 2437 CG1 ILE A1098 -7.085 15.117 28.521 1.00 36.05 C ATOM 2438 CG2 ILE A1098 -4.810 14.291 29.196 1.00 33.43 C ATOM 2439 CD1 ILE A1098 -7.539 13.743 28.088 1.00 36.59 C ATOM 2440 H ILE A1098 -7.688 16.352 31.232 1.00 0.00 H ATOM 2441 N TYR A1099 -4.895 15.242 32.443 1.00 29.02 N ATOM 2442 CA TYR A1099 -3.822 15.081 33.419 1.00 28.60 C ATOM 2443 C TYR A1099 -4.200 14.175 34.598 1.00 28.68 C ATOM 2444 O TYR A1099 -3.361 13.438 35.114 1.00 28.52 O ATOM 2445 CB TYR A1099 -3.354 16.443 33.931 1.00 28.45 C ATOM 2446 CG TYR A1099 -2.234 16.332 34.926 1.00 28.76 C ATOM 2447 CD1 TYR A1099 -0.996 15.842 34.548 1.00 28.07 C ATOM 2448 CD2 TYR A1099 -2.425 16.681 36.265 1.00 31.33 C ATOM 2449 CE1 TYR A1099 0.044 15.726 35.465 1.00 29.13 C ATOM 2450 CE2 TYR A1099 -1.393 16.560 37.198 1.00 31.56 C ATOM 2451 CZ TYR A1099 -0.160 16.083 36.792 1.00 29.21 C ATOM 2452 OH TYR A1099 0.861 15.970 37.707 1.00 27.44 O ATOM 2453 HH TYR A1099 1.668 15.616 37.257 1.00 0.00 H ATOM 2454 H TYR A1099 -5.190 16.200 32.166 1.00 0.00 H ATOM 2455 N MET A1100 -5.454 14.240 35.031 1.00 31.12 N ATOM 2456 CA MET A1100 -5.950 13.359 36.090 1.00 32.57 C ATOM 2457 C MET A1100 -5.867 11.880 35.689 1.00 32.61 C ATOM 2458 O MET A1100 -5.444 11.040 36.487 1.00 34.01 O ATOM 2459 CB MET A1100 -7.385 13.728 36.489 1.00 37.43 C ATOM 2460 CG MET A1100 -7.499 14.361 37.866 1.00 42.89 C ATOM 2461 SD MET A1100 -7.189 13.129 39.140 1.00 52.37 S ATOM 2462 CE MET A1100 -8.867 12.664 39.612 1.00 56.06 C ATOM 2463 H MET A1100 -6.101 14.935 34.607 1.00 0.00 H ATOM 2464 N ILE A1101 -6.250 11.569 34.454 1.00 29.00 N ATOM 2465 CA ILE A1101 -6.142 10.204 33.943 1.00 28.02 C ATOM 2466 C ILE A1101 -4.690 9.684 34.007 1.00 28.08 C ATOM 2467 O ILE A1101 -4.444 8.547 34.423 1.00 24.86 O ATOM 2468 CB ILE A1101 -6.666 10.101 32.499 1.00 27.44 C ATOM 2469 CG1 ILE A1101 -8.174 10.310 32.455 1.00 28.07 C ATOM 2470 CG2 ILE A1101 -6.369 8.752 31.915 1.00 28.33 C ATOM 2471 CD1 ILE A1101 -8.676 10.574 31.056 1.00 28.08 C ATOM 2472 H ILE A1101 -6.635 12.314 33.838 1.00 0.00 H ATOM 2473 N MET A1102 -3.742 10.519 33.585 1.00 29.00 N ATOM 2474 CA MET A1102 -2.317 10.186 33.669 1.00 29.47 C ATOM 2475 C MET A1102 -1.956 9.838 35.110 1.00 29.21 C ATOM 2476 O MET A1102 -1.397 8.789 35.393 1.00 27.52 O ATOM 2477 CB MET A1102 -1.447 11.368 33.204 1.00 30.26 C ATOM 2478 CG MET A1102 -1.211 11.460 31.712 1.00 30.86 C ATOM 2479 SD MET A1102 -0.797 13.136 31.171 1.00 30.36 S ATOM 2480 CE MET A1102 0.758 13.350 31.966 1.00 32.98 C ATOM 2481 H MET A1102 -4.022 11.436 33.183 1.00 0.00 H ATOM 2482 N THR A1103 -2.293 10.739 36.021 1.00 31.54 N ATOM 2483 CA THR A1103 -1.963 10.567 37.429 1.00 32.75 C ATOM 2484 C THR A1103 -2.548 9.272 37.965 1.00 30.85 C ATOM 2485 O THR A1103 -1.906 8.582 38.750 1.00 32.73 O ATOM 2486 CB THR A1103 -2.486 11.748 38.254 1.00 33.45 C ATOM 2487 OG1 THR A1103 -1.917 12.961 37.742 1.00 35.57 O ATOM 2488 CG2 THR A1103 -2.128 11.589 39.719 1.00 35.26 C ATOM 2489 HG1 THR A1103 -2.179 13.072 36.794 1.00 0.00 H ATOM 2490 H THR A1103 -2.807 11.592 35.723 1.00 0.00 H ATOM 2491 N GLU A1104 -3.760 8.946 37.534 1.00 30.43 N ATOM 2492 CA GLU A1104 -4.420 7.719 37.972 1.00 30.71 C ATOM 2493 C GLU A1104 -3.796 6.455 37.388 1.00 28.22 C ATOM 2494 O GLU A1104 -3.774 5.435 38.052 1.00 29.31 O ATOM 2495 CB GLU A1104 -5.916 7.761 37.664 1.00 32.30 C ATOM 2496 CG GLU A1104 -6.676 8.661 38.624 1.00 36.76 C ATOM 2497 CD GLU A1104 -8.189 8.539 38.480 1.00 41.30 C ATOM 2498 OE1 GLU A1104 -8.674 7.414 38.207 1.00 42.65 O ATOM 2499 OE2 GLU A1104 -8.884 9.573 38.653 1.00 42.50 O ATOM 2500 H GLU A1104 -4.251 9.578 36.870 1.00 0.00 H ATOM 2501 N CYS A1105 -3.281 6.519 36.166 1.00 24.68 N ATOM 2502 CA CYS A1105 -2.551 5.382 35.602 1.00 24.05 C ATOM 2503 C CYS A1105 -1.261 5.109 36.363 1.00 24.57 C ATOM 2504 O CYS A1105 -0.830 3.967 36.455 1.00 26.81 O ATOM 2505 CB CYS A1105 -2.229 5.610 34.136 1.00 23.64 C ATOM 2506 SG CYS A1105 -3.690 5.621 33.120 1.00 25.63 S ATOM 2507 H CYS A1105 -3.397 7.386 35.603 1.00 0.00 H ATOM 2508 N TRP A1106 -0.650 6.155 36.911 1.00 23.13 N ATOM 2509 CA TRP A1106 0.613 6.019 37.614 1.00 21.97 C ATOM 2510 C TRP A1106 0.435 5.865 39.121 1.00 22.72 C ATOM 2511 O TRP A1106 1.219 6.385 39.893 1.00 22.54 O ATOM 2512 CB TRP A1106 1.515 7.219 37.318 1.00 21.17 C ATOM 2513 CG TRP A1106 1.698 7.487 35.872 1.00 20.32 C ATOM 2514 CD1 TRP A1106 1.731 6.573 34.866 1.00 19.17 C ATOM 2515 CD2 TRP A1106 1.897 8.761 35.262 1.00 19.91 C ATOM 2516 NE1 TRP A1106 1.932 7.193 33.668 1.00 18.67 N ATOM 2517 CE2 TRP A1106 2.041 8.540 33.880 1.00 19.02 C ATOM 2518 CE3 TRP A1106 1.970 10.067 35.749 1.00 19.83 C ATOM 2519 CZ2 TRP A1106 2.249 9.577 32.978 1.00 19.37 C ATOM 2520 CZ3 TRP A1106 2.171 11.104 34.847 1.00 20.00 C ATOM 2521 CH2 TRP A1106 2.315 10.849 33.481 1.00 19.90 C ATOM 2522 HE1 TRP A1106 1.993 6.719 32.744 1.00 0.00 H ATOM 2523 H TRP A1106 -1.088 7.095 36.834 1.00 0.00 H ATOM 2524 N ASN A1107 -0.596 5.150 39.546 1.00 24.97 N ATOM 2525 CA ASN A1107 -0.757 4.839 40.961 1.00 25.57 C ATOM 2526 C ASN A1107 0.177 3.698 41.338 1.00 25.97 C ATOM 2527 O ASN A1107 0.226 2.701 40.628 1.00 24.18 O ATOM 2528 CB ASN A1107 -2.196 4.458 41.254 1.00 27.20 C ATOM 2529 CG ASN A1107 -2.480 4.380 42.727 1.00 29.15 C ATOM 2530 OD1 ASN A1107 -1.835 3.622 43.459 1.00 33.09 O ATOM 2531 ND2 ASN A1107 -3.452 5.162 43.180 1.00 28.85 N ATOM 2532 HD22 ASN A1107 -3.967 5.784 42.525 1.00 0.00 H ATOM 2533 HD21 ASN A1107 -3.698 5.153 44.190 1.00 0.00 H ATOM 2534 H ASN A1107 -1.299 4.806 38.861 1.00 0.00 H ATOM 2535 N ASN A1108 0.922 3.842 42.438 1.00 27.23 N ATOM 2536 CA ASN A1108 1.874 2.798 42.849 1.00 27.98 C ATOM 2537 C ASN A1108 1.169 1.453 42.922 1.00 28.26 C ATOM 2538 O ASN A1108 1.706 0.440 42.498 1.00 27.90 O ATOM 2539 CB ASN A1108 2.541 3.111 44.201 1.00 28.78 C ATOM 2540 CG ASN A1108 3.728 4.068 44.073 1.00 30.27 C ATOM 2541 OD1 ASN A1108 4.649 3.826 43.296 1.00 30.46 O ATOM 2542 ND2 ASN A1108 3.717 5.147 44.863 1.00 30.91 N ATOM 2543 HD22 ASN A1108 2.916 5.313 45.506 1.00 0.00 H ATOM 2544 HD21 ASN A1108 4.509 5.820 44.834 1.00 0.00 H ATOM 2545 H ASN A1108 0.828 4.704 43.012 1.00 0.00 H ATOM 2546 N ASN A1109 -0.054 1.463 43.436 1.00 28.87 N ATOM 2547 CA ASN A1109 -0.793 0.239 43.660 1.00 31.59 C ATOM 2548 C ASN A1109 -1.522 -0.266 42.413 1.00 30.91 C ATOM 2549 O ASN A1109 -2.400 0.414 41.879 1.00 32.32 O ATOM 2550 CB ASN A1109 -1.795 0.434 44.799 1.00 33.05 C ATOM 2551 CG ASN A1109 -2.627 -0.793 45.036 1.00 34.39 C ATOM 2552 OD1 ASN A1109 -2.307 -1.880 44.548 1.00 34.25 O ATOM 2553 ND2 ASN A1109 -3.716 -0.628 45.754 1.00 36.69 N ATOM 2554 HD22 ASN A1109 -3.944 0.308 46.145 1.00 0.00 H ATOM 2555 HD21 ASN A1109 -4.349 -1.434 45.931 1.00 0.00 H ATOM 2556 H ASN A1109 -0.492 2.373 43.684 1.00 0.00 H ATOM 2557 N VAL A1110 -1.168 -1.480 41.994 1.00 30.67 N ATOM 2558 CA VAL A1110 -1.751 -2.146 40.828 1.00 31.67 C ATOM 2559 C VAL A1110 -3.270 -2.070 40.806 1.00 31.93 C ATOM 2560 O VAL A1110 -3.876 -1.731 39.785 1.00 33.43 O ATOM 2561 CB VAL A1110 -1.353 -3.657 40.804 1.00 33.08 C ATOM 2562 CG1 VAL A1110 -2.300 -4.472 39.904 1.00 34.45 C ATOM 2563 CG2 VAL A1110 0.087 -3.823 40.359 1.00 34.11 C ATOM 2564 H VAL A1110 -0.432 -1.986 42.528 1.00 0.00 H ATOM 2565 N ASN A1111 -3.869 -2.368 41.953 1.00 31.83 N ATOM 2566 CA ASN A1111 -5.317 -2.568 42.057 1.00 29.15 C ATOM 2567 C ASN A1111 -6.143 -1.306 41.994 1.00 27.95 C ATOM 2568 O ASN A1111 -7.331 -1.384 41.732 1.00 27.43 O ATOM 2569 CB ASN A1111 -5.638 -3.302 43.359 1.00 29.32 C ATOM 2570 CG ASN A1111 -4.903 -4.612 43.473 1.00 27.14 C ATOM 2571 OD1 ASN A1111 -4.277 -4.893 44.488 1.00 23.42 O ATOM 2572 ND2 ASN A1111 -4.958 -5.415 42.413 1.00 27.44 N ATOM 2573 HD22 ASN A1111 -5.503 -5.132 41.574 1.00 0.00 H ATOM 2574 HD21 ASN A1111 -4.456 -6.326 42.424 1.00 0.00 H ATOM 2575 H ASN A1111 -3.288 -2.463 42.810 1.00 0.00 H ATOM 2576 N GLN A1112 -5.522 -0.159 42.254 1.00 30.38 N ATOM 2577 CA GLN A1112 -6.211 1.130 42.204 1.00 32.81 C ATOM 2578 C GLN A1112 -6.102 1.805 40.825 1.00 32.97 C ATOM 2579 O GLN A1112 -6.564 2.928 40.660 1.00 34.77 O ATOM 2580 CB GLN A1112 -5.672 2.064 43.306 1.00 34.19 C ATOM 2581 CG GLN A1112 -5.917 1.525 44.717 1.00 36.87 C ATOM 2582 CD GLN A1112 -5.333 2.381 45.855 1.00 38.29 C ATOM 2583 OE1 GLN A1112 -4.358 3.112 45.684 1.00 38.08 O ATOM 2584 NE2 GLN A1112 -5.931 2.261 47.036 1.00 41.61 N ATOM 2585 HE22 GLN A1112 -6.753 1.633 47.141 1.00 0.00 H ATOM 2586 HE21 GLN A1112 -5.577 2.795 47.855 1.00 0.00 H ATOM 2587 H GLN A1112 -4.512 -0.179 42.501 1.00 0.00 H ATOM 2588 N ARG A1113 -5.497 1.143 39.835 1.00 32.35 N ATOM 2589 CA ARG A1113 -5.390 1.738 38.485 1.00 29.76 C ATOM 2590 C ARG A1113 -6.671 1.532 37.697 1.00 28.92 C ATOM 2591 O ARG A1113 -7.336 0.512 37.857 1.00 28.45 O ATOM 2592 CB ARG A1113 -4.224 1.147 37.689 1.00 27.86 C ATOM 2593 CG ARG A1113 -2.857 1.716 38.061 1.00 26.09 C ATOM 2594 CD ARG A1113 -1.736 0.806 37.591 1.00 24.29 C ATOM 2595 NE ARG A1113 -0.577 0.903 38.465 1.00 21.66 N ATOM 2596 CZ ARG A1113 0.480 0.102 38.421 1.00 20.88 C ATOM 2597 NH1 ARG A1113 0.557 -0.882 37.540 1.00 20.26 N ATOM 2598 NH2 ARG A1113 1.471 0.286 39.275 1.00 22.08 N ATOM 2599 HE ARG A1113 -0.577 1.659 39.180 1.00 0.00 H ATOM 2600 HH12 ARG A1113 1.394 -1.499 37.521 1.00 0.00 H ATOM 2601 HH11 ARG A1113 -0.219 -1.038 36.866 1.00 0.00 H ATOM 2602 HH22 ARG A1113 2.303 -0.337 39.248 1.00 0.00 H ATOM 2603 HH21 ARG A1113 1.419 1.054 39.975 1.00 0.00 H ATOM 2604 H ARG A1113 -5.097 0.200 40.015 1.00 0.00 H ATOM 2605 N PRO A1114 -7.011 2.495 36.827 1.00 29.29 N ATOM 2606 CA PRO A1114 -8.230 2.408 36.022 1.00 28.43 C ATOM 2607 C PRO A1114 -8.174 1.269 35.006 1.00 28.49 C ATOM 2608 O PRO A1114 -7.093 0.804 34.660 1.00 30.57 O ATOM 2609 CB PRO A1114 -8.285 3.767 35.312 1.00 28.45 C ATOM 2610 CG PRO A1114 -6.893 4.281 35.331 1.00 30.01 C ATOM 2611 CD PRO A1114 -6.233 3.716 36.541 1.00 29.85 C ATOM 2612 N SER A1115 -9.329 0.819 34.536 1.00 30.58 N ATOM 2613 CA SER A1115 -9.386 -0.248 33.534 1.00 30.09 C ATOM 2614 C SER A1115 -9.521 0.385 32.165 1.00 29.96 C ATOM 2615 O SER A1115 -9.920 1.534 32.064 1.00 32.89 O ATOM 2616 CB SER A1115 -10.576 -1.148 33.800 1.00 29.59 C ATOM 2617 OG SER A1115 -11.744 -0.556 33.278 1.00 31.15 O ATOM 2618 HG SER A1115 -12.519 -1.147 33.454 1.00 0.00 H ATOM 2619 H SER A1115 -10.216 1.233 34.887 1.00 0.00 H ATOM 2620 N PHE A1116 -9.194 -0.345 31.105 1.00 30.40 N ATOM 2621 CA PHE A1116 -9.252 0.245 29.760 1.00 30.24 C ATOM 2622 C PHE A1116 -10.680 0.620 29.304 1.00 32.18 C ATOM 2623 O PHE A1116 -10.862 1.618 28.607 1.00 35.59 O ATOM 2624 CB PHE A1116 -8.556 -0.644 28.734 1.00 29.18 C ATOM 2625 CG PHE A1116 -7.067 -0.515 28.761 1.00 29.12 C ATOM 2626 CD1 PHE A1116 -6.460 0.701 28.451 1.00 29.64 C ATOM 2627 CD2 PHE A1116 -6.262 -1.593 29.112 1.00 26.51 C ATOM 2628 CE1 PHE A1116 -5.075 0.834 28.485 1.00 29.73 C ATOM 2629 CE2 PHE A1116 -4.879 -1.468 29.146 1.00 25.71 C ATOM 2630 CZ PHE A1116 -4.287 -0.257 28.839 1.00 28.27 C ATOM 2631 H PHE A1116 -8.897 -1.334 31.227 1.00 0.00 H ATOM 2632 N ARG A1117 -11.679 -0.164 29.696 1.00 31.29 N ATOM 2633 CA ARG A1117 -13.058 0.197 29.413 1.00 31.87 C ATOM 2634 C ARG A1117 -13.322 1.600 29.964 1.00 30.93 C ATOM 2635 O ARG A1117 -13.733 2.487 29.221 1.00 27.79 O ATOM 2636 CB ARG A1117 -14.044 -0.827 30.010 1.00 30.79 C ATOM 2637 H ARG A1117 -11.472 -1.044 30.210 1.00 0.00 H ATOM 2638 N ASP A1118 -13.061 1.789 31.260 1.00 31.98 N ATOM 2639 CA ASP A1118 -13.236 3.094 31.914 1.00 32.67 C ATOM 2640 C ASP A1118 -12.472 4.207 31.210 1.00 31.89 C ATOM 2641 O ASP A1118 -12.996 5.308 31.038 1.00 31.39 O ATOM 2642 CB ASP A1118 -12.800 3.041 33.380 1.00 34.66 C ATOM 2643 CG ASP A1118 -13.819 2.353 34.278 1.00 37.62 C ATOM 2644 OD1 ASP A1118 -14.848 1.876 33.748 1.00 45.76 O ATOM 2645 OD2 ASP A1118 -13.596 2.293 35.516 1.00 36.09 O ATOM 2646 H ASP A1118 -12.722 0.985 31.826 1.00 0.00 H ATOM 2647 N LEU A1119 -11.243 3.917 30.799 1.00 31.05 N ATOM 2648 CA LEU A1119 -10.416 4.909 30.108 1.00 32.55 C ATOM 2649 C LEU A1119 -11.010 5.304 28.742 1.00 30.90 C ATOM 2650 O LEU A1119 -10.791 6.418 28.269 1.00 30.87 O ATOM 2651 CB LEU A1119 -8.976 4.400 29.949 1.00 32.06 C ATOM 2652 CG LEU A1119 -8.132 4.314 31.232 1.00 31.49 C ATOM 2653 CD1 LEU A1119 -6.922 3.394 31.039 1.00 31.01 C ATOM 2654 CD2 LEU A1119 -7.685 5.702 31.697 1.00 31.04 C ATOM 2655 H LEU A1119 -10.860 2.966 30.971 1.00 0.00 H ATOM 2656 N ALA A1120 -11.756 4.388 28.125 1.00 30.31 N ATOM 2657 CA ALA A1120 -12.392 4.632 26.837 1.00 30.32 C ATOM 2658 C ALA A1120 -13.529 5.628 27.016 1.00 31.98 C ATOM 2659 O ALA A1120 -13.585 6.656 26.323 1.00 30.76 O ATOM 2660 CB ALA A1120 -12.905 3.330 26.238 1.00 28.83 C ATOM 2661 H ALA A1120 -11.889 3.463 28.581 1.00 0.00 H ATOM 2662 N LEU A1121 -14.413 5.317 27.965 1.00 33.08 N ATOM 2663 CA LEU A1121 -15.550 6.169 28.304 1.00 34.29 C ATOM 2664 C LEU A1121 -15.101 7.573 28.684 1.00 33.25 C ATOM 2665 O LEU A1121 -15.611 8.563 28.151 1.00 33.01 O ATOM 2666 CB LEU A1121 -16.341 5.577 29.472 1.00 36.00 C ATOM 2667 CG LEU A1121 -16.954 4.182 29.304 1.00 39.22 C ATOM 2668 CD1 LEU A1121 -17.669 3.756 30.577 1.00 39.14 C ATOM 2669 CD2 LEU A1121 -17.905 4.146 28.112 1.00 40.37 C ATOM 2670 H LEU A1121 -14.287 4.427 28.488 1.00 0.00 H ATOM 2671 N ARG A1122 -14.148 7.651 29.605 1.00 33.06 N ATOM 2672 CA ARG A1122 -13.662 8.937 30.097 1.00 34.51 C ATOM 2673 C ARG A1122 -13.072 9.800 28.974 1.00 36.78 C ATOM 2674 O ARG A1122 -13.365 10.995 28.889 1.00 39.00 O ATOM 2675 CB ARG A1122 -12.646 8.740 31.232 1.00 32.44 C ATOM 2676 CG ARG A1122 -13.271 8.266 32.541 1.00 31.16 C ATOM 2677 CD ARG A1122 -12.241 7.807 33.565 1.00 30.57 C ATOM 2678 NE ARG A1122 -11.683 8.895 34.376 1.00 29.76 N ATOM 2679 CZ ARG A1122 -10.797 8.722 35.363 1.00 28.54 C ATOM 2680 NH1 ARG A1122 -10.348 7.510 35.668 1.00 27.55 N ATOM 2681 NH2 ARG A1122 -10.350 9.766 36.050 1.00 27.76 N ATOM 2682 HE ARG A1122 -11.997 9.865 34.170 1.00 0.00 H ATOM 2683 HH12 ARG A1122 -9.659 7.389 36.438 1.00 0.00 H ATOM 2684 HH11 ARG A1122 -10.685 6.682 35.137 1.00 0.00 H ATOM 2685 HH22 ARG A1122 -9.661 9.628 36.817 1.00 0.00 H ATOM 2686 HH21 ARG A1122 -10.689 10.722 35.822 1.00 0.00 H ATOM 2687 H ARG A1122 -13.737 6.774 29.985 1.00 0.00 H ATOM 2688 N VAL A1123 -12.267 9.192 28.107 1.00 38.36 N ATOM 2689 CA VAL A1123 -11.628 9.927 27.015 1.00 37.92 C ATOM 2690 C VAL A1123 -12.624 10.273 25.917 1.00 36.35 C ATOM 2691 O VAL A1123 -12.651 11.405 25.443 1.00 36.42 O ATOM 2692 CB VAL A1123 -10.421 9.163 26.426 1.00 36.32 C ATOM 2693 CG1 VAL A1123 -9.980 9.796 25.110 1.00 37.37 C ATOM 2694 CG2 VAL A1123 -9.272 9.150 27.431 1.00 34.21 C ATOM 2695 H VAL A1123 -12.088 8.172 28.207 1.00 0.00 H ATOM 2696 N ASP A1124 -13.442 9.304 25.519 1.00 39.26 N ATOM 2697 CA ASP A1124 -14.496 9.559 24.521 1.00 39.90 C ATOM 2698 C ASP A1124 -15.401 10.698 24.960 1.00 40.83 C ATOM 2699 O ASP A1124 -15.860 11.489 24.130 1.00 41.97 O ATOM 2700 CB ASP A1124 -15.338 8.311 24.259 1.00 39.18 C ATOM 2701 CG ASP A1124 -14.644 7.310 23.352 1.00 42.77 C ATOM 2702 OD1 ASP A1124 -13.494 7.559 22.924 1.00 42.00 O ATOM 2703 OD2 ASP A1124 -15.262 6.266 23.053 1.00 43.83 O ATOM 2704 H ASP A1124 -13.337 8.350 25.919 1.00 0.00 H ATOM 2705 N GLN A1125 -15.645 10.792 26.265 1.00 40.96 N ATOM 2706 CA GLN A1125 -16.480 11.863 26.803 1.00 41.51 C ATOM 2707 C GLN A1125 -15.770 13.224 26.795 1.00 40.42 C ATOM 2708 O GLN A1125 -16.385 14.241 26.463 1.00 38.35 O ATOM 2709 CB GLN A1125 -16.954 11.521 28.219 1.00 42.17 C ATOM 2710 CG GLN A1125 -18.119 12.381 28.685 1.00 44.41 C ATOM 2711 CD GLN A1125 -19.390 12.127 27.870 1.00 46.19 C ATOM 2712 OE1 GLN A1125 -20.138 11.205 28.165 1.00 46.68 O ATOM 2713 NE2 GLN A1125 -19.627 12.940 26.844 1.00 47.74 N ATOM 2714 HE22 GLN A1125 -18.964 13.712 26.628 1.00 0.00 H ATOM 2715 HE21 GLN A1125 -20.475 12.804 26.258 1.00 0.00 H ATOM 2716 H GLN A1125 -15.234 10.090 26.913 1.00 0.00 H ATOM 2717 N VAL A1126 -14.487 13.242 27.160 1.00 39.10 N ATOM 2718 CA VAL A1126 -13.720 14.487 27.179 1.00 37.51 C ATOM 2719 C VAL A1126 -13.638 15.118 25.784 1.00 40.20 C ATOM 2720 O VAL A1126 -13.695 16.335 25.653 1.00 38.72 O ATOM 2721 CB VAL A1126 -12.317 14.281 27.733 1.00 37.04 C ATOM 2722 CG1 VAL A1126 -11.476 15.529 27.518 1.00 37.59 C ATOM 2723 CG2 VAL A1126 -12.379 13.934 29.211 1.00 37.02 C ATOM 2724 H VAL A1126 -14.023 12.353 27.436 1.00 0.00 H ATOM 2725 N ARG A1127 -13.520 14.288 24.751 1.00 42.35 N ATOM 2726 CA ARG A1127 -13.566 14.760 23.367 1.00 47.50 C ATOM 2727 C ARG A1127 -14.808 15.586 23.060 1.00 50.34 C ATOM 2728 O ARG A1127 -14.714 16.675 22.488 1.00 52.81 O ATOM 2729 CB ARG A1127 -13.553 13.581 22.397 1.00 51.17 C ATOM 2730 CG ARG A1127 -12.197 12.975 22.164 1.00 52.23 C ATOM 2731 CD ARG A1127 -12.305 11.565 21.607 1.00 52.56 C ATOM 2732 NE ARG A1127 -12.680 11.533 20.195 1.00 53.26 N ATOM 2733 CZ ARG A1127 -12.982 10.415 19.531 1.00 52.17 C ATOM 2734 NH1 ARG A1127 -12.989 9.231 20.150 1.00 52.75 N ATOM 2735 NH2 ARG A1127 -13.302 10.477 18.243 1.00 48.49 N ATOM 2736 HE ARG A1127 -12.714 12.434 19.677 1.00 0.00 H ATOM 2737 HH12 ARG A1127 -13.226 8.368 19.620 1.00 0.00 H ATOM 2738 HH11 ARG A1127 -12.757 9.172 21.162 1.00 0.00 H ATOM 2739 HH22 ARG A1127 -13.538 9.608 17.723 1.00 0.00 H ATOM 2740 HH21 ARG A1127 -13.317 11.395 17.754 1.00 0.00 H ATOM 2741 H ARG A1127 -13.391 13.272 24.933 1.00 0.00 H ATOM 2742 N ASP A1128 -15.968 15.049 23.428 1.00 53.46 N ATOM 2743 CA ASP A1128 -17.254 15.662 23.091 1.00 52.97 C ATOM 2744 C ASP A1128 -17.439 16.978 23.830 1.00 53.41 C ATOM 2745 O ASP A1128 -17.896 17.968 23.257 1.00 55.37 O ATOM 2746 CB ASP A1128 -18.400 14.710 23.420 1.00 53.03 C ATOM 2747 CG ASP A1128 -18.192 13.320 22.832 1.00 55.66 C ATOM 2748 OD1 ASP A1128 -17.335 13.167 21.931 1.00 53.58 O ATOM 2749 OD2 ASP A1128 -18.876 12.376 23.280 1.00 60.98 O ATOM 2750 H ASP A1128 -15.961 14.164 23.974 1.00 0.00 H ATOM 2751 N ASN A1129 -17.065 16.993 25.103 1.00 51.32 N ATOM 2752 CA ASN A1129 -17.073 18.229 25.874 1.00 52.98 C ATOM 2753 C ASN A1129 -16.197 19.301 25.215 1.00 56.58 C ATOM 2754 O ASN A1129 -16.492 20.496 25.261 1.00 59.50 O ATOM 2755 CB ASN A1129 -16.603 17.955 27.305 1.00 51.37 C ATOM 2756 CG ASN A1129 -17.538 17.018 28.057 1.00 49.74 C ATOM 2757 OD1 ASN A1129 -18.146 16.116 27.469 1.00 48.58 O ATOM 2758 ND2 ASN A1129 -17.659 17.230 29.364 1.00 49.31 N ATOM 2759 HD22 ASN A1129 -17.128 18.001 29.817 1.00 0.00 H ATOM 2760 HD21 ASN A1129 -18.285 16.625 29.933 1.00 0.00 H ATOM 2761 H ASN A1129 -16.761 16.108 25.558 1.00 0.00 H ATOM 2762 N MET A1130 -15.122 18.848 24.583 1.00 62.75 N ATOM 2763 CA MET A1130 -14.155 19.730 23.944 1.00 62.18 C ATOM 2764 C MET A1130 -14.673 20.187 22.581 1.00 66.25 C ATOM 2765 O MET A1130 -14.563 21.364 22.240 1.00 70.02 O ATOM 2766 CB MET A1130 -12.821 18.997 23.785 1.00 63.70 C ATOM 2767 CG MET A1130 -11.665 19.655 24.495 1.00 65.06 C ATOM 2768 SD MET A1130 -10.283 18.526 24.722 1.00 67.40 S ATOM 2769 CE MET A1130 -9.031 19.693 25.265 1.00 71.27 C ATOM 2770 H MET A1130 -14.963 17.821 24.542 1.00 0.00 H ATOM 2771 N ALA A1131 -15.236 19.258 21.809 1.00 67.24 N ATOM 2772 CA ALA A1131 -15.817 19.588 20.508 1.00 70.62 C ATOM 2773 C ALA A1131 -17.144 20.348 20.488 1.00 75.50 C ATOM 2774 O ALA A1131 -17.242 21.415 19.884 1.00 78.85 O ATOM 2775 CB ALA A1131 -16.086 18.313 19.687 1.00 69.82 C ATOM 2776 H ALA A1131 -15.263 18.273 22.140 1.00 0.00 H ATOM 2777 N GLY A1132 -18.152 19.806 21.168 1.00 79.36 N ATOM 2778 CA GLY A1132 -19.502 20.387 21.161 1.00 79.86 C ATOM 2779 C GLY A1132 -19.718 21.162 22.458 1.00 78.29 C ATOM 2780 O GLY A1132 -20.833 21.183 22.999 1.00 70.85 O ATOM 2781 OXT GLY A1132 -18.803 21.793 23.001 1.00 71.20 O ATOM 2782 H GLY A1132 -17.979 18.943 21.722 1.00 0.00 H TER 2783 GLY A1132 HETATM 2784 O HOH 1 -12.646 1.794 7.875 1.00 36.60 O HETATM 2785 O HOH 2 -3.113 -5.567 28.376 1.00 20.18 O HETATM 2786 O HOH 3 5.381 -5.914 22.690 1.00 20.27 O HETATM 2787 O HOH 4 5.519 -11.694 21.804 1.00 20.22 O HETATM 2788 O HOH 5 7.834 -19.642 3.124 1.00 31.35 O HETATM 2789 O HOH 6 3.182 -3.896 30.567 1.00 26.14 O HETATM 2790 O HOH 7 9.308 -6.044 15.524 1.00 27.34 O HETATM 2791 O HOH 8 7.811 18.244 19.002 1.00 30.75 O HETATM 2792 O HOH 9 -12.259 -3.027 22.231 1.00 29.64 O HETATM 2793 O HOH 10 13.746 -1.793 24.784 1.00 34.44 O HETATM 2794 O HOH 11 7.339 5.534 33.887 1.00 25.87 O HETATM 2795 O HOH 12 -6.419 4.652 5.281 1.00 20.81 O HETATM 2796 O HOH 13 2.944 -1.684 28.270 1.00 19.07 O HETATM 2797 O HOH 14 10.095 20.460 33.903 1.00 26.48 O HETATM 2798 O HOH 15 9.246 24.823 29.220 1.00 38.22 O HETATM 2799 O HOH 16 8.270 14.013 24.979 1.00 16.73 O HETATM 2800 O HOH 17 5.639 14.379 44.895 1.00 33.16 O HETATM 2801 O HOH 18 -0.864 23.540 31.774 1.00 37.52 O HETATM 2802 O HOH 19 -1.032 -16.960 2.222 1.00 31.62 O HETATM 2803 O HOH 20 6.663 -20.976 27.677 1.00 40.97 O HETATM 2804 O HOH 21 -1.331 21.952 17.449 1.00 42.19 O HETATM 2805 O HOH 22 4.140 -16.070 35.463 1.00 29.89 O HETATM 2806 O HOH 23 12.475 -18.927 -2.733 1.00 37.13 O HETATM 2807 O HOH 24 11.956 -6.350 33.493 1.00 31.65 O HETATM 2808 O HOH 25 17.991 -14.984 24.838 1.00 36.75 O HETATM 2809 O HOH 26 13.678 -22.526 22.306 1.00 27.66 O HETATM 2810 C4 UNN A 27 6.106 -6.805 13.841 1.00 -0.03 C HETATM 2811 C3 UNN A 27 6.236 -5.763 12.925 1.00 -0.04 C HETATM 2812 C8 UNN A 27 5.315 -4.704 12.950 1.00 -0.03 C HETATM 2813 C7 UNN A 27 4.284 -4.726 13.891 1.00 -0.07 C HETATM 2814 C6 UNN A 27 4.165 -5.767 14.795 1.00 -0.04 C HETATM 2815 C5 UNN A 27 5.080 -6.807 14.772 1.00 0.08 C HETATM 2816 O27 UNN A 27 4.976 -7.833 15.666 1.00 -0.33 O HETATM 2817 H18 UNN A 27 5.676 -8.456 15.514 1.00 0.25 H HETATM 2818 H3 UNN A 27 3.358 -5.769 15.519 1.00 0.05 H HETATM 2819 H2 UNN A 27 3.565 -3.915 13.914 1.00 0.06 H HETATM 2820 C9 UNN A 27 5.400 -3.542 12.020 1.00 -0.03 C HETATM 2821 C10 UNN A 27 6.349 -2.535 12.219 1.00 -0.06 C HETATM 2822 C11 UNN A 27 6.434 -1.439 11.375 1.00 -0.05 C HETATM 2823 C12 UNN A 27 5.563 -1.319 10.296 1.00 0.03 C HETATM 2824 C13 UNN A 27 4.607 -2.331 10.095 1.00 0.02 C HETATM 2825 C14 UNN A 27 4.520 -3.432 10.941 1.00 -0.05 C HETATM 2826 H12 UNN A 27 3.775 -4.199 10.764 1.00 0.06 H HETATM 2827 N15 UNN A 27 3.896 -1.973 8.997 1.00 -0.25 N HETATM 2828 N16 UNN A 27 4.330 -0.792 8.474 1.00 -0.21 N HETATM 2829 C17 UNN A 27 5.349 -0.342 9.225 1.00 0.18 C HETATM 2830 C18 UNN A 27 6.053 0.906 8.932 1.00 0.17 C HETATM 2831 N19 UNN A 27 7.106 1.386 9.649 1.00 -0.31 N HETATM 2832 C20 UNN A 27 7.476 2.583 9.062 1.00 0.03 C HETATM 2833 C21 UNN A 27 8.471 3.505 9.357 1.00 -0.06 C HETATM 2834 C22 UNN A 27 8.580 4.631 8.554 1.00 -0.08 C HETATM 2835 C23 UNN A 27 7.712 4.827 7.482 1.00 -0.08 C HETATM 2836 C24 UNN A 27 6.719 3.901 7.193 1.00 -0.04 C HETATM 2837 C25 UNN A 27 6.601 2.765 7.993 1.00 0.08 C HETATM 2838 N26 UNN A 27 5.709 1.694 7.926 1.00 -0.25 N HETATM 2839 H17 UNN A 27 4.951 1.549 7.244 1.00 0.23 H HETATM 2840 H16 UNN A 27 6.046 4.059 6.358 1.00 0.05 H HETATM 2841 H15 UNN A 27 7.813 5.713 6.866 1.00 0.05 H HETATM 2842 H14 UNN A 27 9.349 5.366 8.763 1.00 0.05 H HETATM 2843 H4 UNN A 27 9.144 3.349 10.192 1.00 0.05 H HETATM 2844 H13 UNN A 27 3.942 -0.323 7.643 1.00 0.30 H HETATM 2845 H11 UNN A 27 7.180 -0.674 11.556 1.00 0.06 H HETATM 2846 H10 UNN A 27 7.035 -2.613 13.054 1.00 0.06 H HETATM 2847 C2 UNN A 27 7.367 -5.812 11.921 1.00 -0.02 C HETATM 2848 C1 UNN A 27 6.949 -6.241 10.534 1.00 -0.06 C HETATM 2849 H5 UNN A 27 7.828 -6.249 9.872 1.00 0.03 H HETATM 2850 H6 UNN A 27 6.201 -5.536 10.142 1.00 0.03 H HETATM 2851 H7 UNN A 27 6.514 -7.250 10.578 1.00 0.03 H HETATM 2852 H8 UNN A 27 7.810 -4.808 11.852 1.00 0.04 H HETATM 2853 H9 UNN A 27 8.123 -6.522 12.288 1.00 0.04 H HETATM 2854 H1 UNN A 27 6.816 -7.624 13.825 1.00 0.05 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 1625 1617 1626 1641 CONECT 1626 1625 1627 1629 CONECT 1627 1626 1628 1642 CONECT 1628 1627 CONECT 1629 1626 1630 CONECT 1630 1629 1631 1640 CONECT 1631 1630 1632 CONECT 1632 1631 1633 CONECT 1633 1632 1634 1639 CONECT 1634 1633 1635 CONECT 1635 1634 1636 1637 1638 CONECT 1636 1635 CONECT 1637 1635 CONECT 1638 1635 CONECT 1639 1633 1640 CONECT 1640 1630 1639 CONECT 1641 1625 CONECT 1642 1627 1643 1658 CONECT 1643 1642 1644 1646 CONECT 1644 1643 1645 1659 CONECT 1645 1644 CONECT 1646 1643 1647 CONECT 1647 1646 1648 1657 CONECT 1648 1647 1649 CONECT 1649 1648 1650 CONECT 1650 1649 1651 1656 CONECT 1651 1650 1652 CONECT 1652 1651 1653 1654 1655 CONECT 1653 1652 CONECT 1654 1652 CONECT 1655 1652 CONECT 1656 1650 1657 CONECT 1657 1647 1656 CONECT 1658 1642 CONECT 1681 1682 1687 1688 1689 CONECT 1688 1681 CONECT 1689 1681 CONECT 2194 2195 2199 2200 2201 CONECT 2199 2194 CONECT 2200 2194 CONECT 2201 2194 CONECT 2810 2811 2815 2854 CONECT 2811 2810 2812 2847 CONECT 2812 2811 2813 2820 CONECT 2813 2812 2814 2819 CONECT 2814 2813 2815 2818 CONECT 2815 2810 2814 2816 CONECT 2816 2815 2817 CONECT 2817 2816 CONECT 2818 2814 CONECT 2819 2813 CONECT 2820 2812 2821 2825 CONECT 2821 2820 2822 2846 CONECT 2822 2821 2823 2845 CONECT 2823 2822 2824 2829 CONECT 2824 2823 2825 2827 CONECT 2825 2820 2824 2826 CONECT 2826 2825 CONECT 2827 2824 2828 CONECT 2828 2827 2829 2844 CONECT 2829 2823 2828 2830 CONECT 2830 2829 2831 2838 CONECT 2831 2830 2832 CONECT 2832 2831 2833 2837 CONECT 2833 2832 2834 2843 CONECT 2834 2833 2835 2842 CONECT 2835 2834 2836 2841 CONECT 2836 2835 2837 2840 CONECT 2837 2832 2836 2838 CONECT 2838 2830 2837 2839 CONECT 2839 2838 CONECT 2840 2836 CONECT 2841 2835 CONECT 2842 2834 CONECT 2843 2833 CONECT 2844 2828 CONECT 2845 2822 CONECT 2846 2821 CONECT 2847 2811 2848 2852 2853 CONECT 2848 2847 2849 2850 2851 CONECT 2849 2848 CONECT 2850 2848 CONECT 2851 2848 CONECT 2852 2847 CONECT 2853 2847 CONECT 2854 2810 MASTER 0 0 0 0 0 0 0 0 2851 3 90 23 END
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RCSB PDB
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RCSB PDB
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RCSB PDB
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5tq3
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK2
Ligand Name
7GZ
EC.Number
E.C.-.-.-.-
Resolution
2.69(Å)
Affinity (Kd/Ki/IC50)
IC50=2.2nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 767-786
Ligand Properties
Formula
C
2
2
H
1
8
N
4
O
Molecular Weight
354.405
Exact Mass
354.148
No. of atoms
45
No. of bonds
49
Polar Surface Area
77.59
LOGP Value
4.88 (
Computed with XLOGP3
)
5.04 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 5
Canonical SMILES
CCc1cc(O)ccc1c1ccc2c(c1)n[nH]c2c1nc2c([nH]1)cccc2
InChI String
InChI=1S/C22H18N4O/c1-2-13-11-15(27)8-10-16(13)14-7-9-17-20(12-14)25-26-21(17)22-23-18-5-3-4-6-19(18)24-22/h3-12,27H,2H2,1H3,(H,23,24)(H,25,26)
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):
O60674
Entrez Gene ID
NCBI Entrez Gene ID:
3717
ASD
Information of known allosteric effects of PDB entries
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