Browse entries in the PDBbind-CN Database
HEADER 6HZV_COMPLEX COMPND 6HZV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 THR ILE PHE GLU GLU ARG HIS LEU LYS TYR ILE SER GLN SEQRES 2 A 44 LEU GLY LYS GLY ASN PHE GLY SER VAL GLU LEU CYS ARG SEQRES 3 A 44 TYR ASP PRO LEU GLY ASP ASN THR GLY ALA LEU VAL ALA SEQRES 4 A 44 VAL LYS GLN LEU GLN SEQRES 1 A 31 GLY PRO ASP GLN GLN ARG ASP PHE GLN ARG GLU ILE GLN SEQRES 2 A 31 ILE LEU LYS ALA LEU HIS SER ASP PHE ILE VAL LYS TYR SEQRES 3 A 31 ARG GLY VAL SER TYR SEQRES 1 A 89 GLN SER LEU ARG LEU VAL MET GLU TYR LEU PRO SER GLY SEQRES 2 A 89 CYS LEU ARG ASP PHE LEU GLN ARG HIS ARG ALA ARG LEU SEQRES 3 A 89 ASP ALA SER ARG LEU LEU LEU TYR SER SER GLN ILE CYS SEQRES 4 A 89 LYS GLY MET GLU TYR LEU GLY SER ARG ARG CYS VAL HIS SEQRES 5 A 89 ARG ASP LEU ALA ALA ARG ASN ILE LEU VAL GLU SER GLU SEQRES 6 A 89 ALA HIS VAL LYS ILE ALA ASP PHE GLY LEU ALA LYS LEU SEQRES 7 A 89 LEU PRO LEU ASP LYS ASP PTR PTR VAL VAL ARG SEQRES 1 A 48 PRO ILE PHE TRP TYR ALA PRO GLU SER LEU SER ASP ASN SEQRES 2 A 48 ILE PHE SER ARG GLN SER ASP VAL TRP SER PHE GLY VAL SEQRES 3 A 48 VAL LEU TYR GLU LEU PHE THR TYR CYS ASP LYS SER CYS SEQRES 4 A 48 SER PRO SER ALA GLU PHE LEU ARG MET SEQRES 1 A 54 PRO ALA LEU SER ARG LEU LEU GLU LEU LEU GLU GLU GLY SEQRES 2 A 54 GLN ARG LEU PRO ALA PRO PRO ALA CYS PRO ALA GLU VAL SEQRES 3 A 54 HIS GLU LEU MET LYS LEU CYS TRP ALA PRO SER PRO GLN SEQRES 4 A 54 ASP ARG PRO SER PHE SER ALA LEU GLY PRO GLN LEU ASP SEQRES 5 A 54 MET LEU HET PTR A 980 17 HET PTR A 981 17 HET GYW A 296 49 ATOM 1 N THR A 815 3.953 29.103 -15.906 1.00 58.73 N ATOM 2 CA THR A 815 3.177 30.061 -15.052 1.00 57.18 C ATOM 3 C THR A 815 1.788 29.564 -14.630 1.00 57.25 C ATOM 4 O THR A 815 1.275 29.984 -13.596 1.00 55.94 O ATOM 5 CB THR A 815 3.025 31.446 -15.731 1.00 58.97 C ATOM 6 OG1 THR A 815 3.474 31.377 -17.092 1.00 64.03 O ATOM 7 CG2 THR A 815 3.833 32.498 -14.977 1.00 57.00 C ATOM 8 HG1 THR A 815 3.373 32.265 -17.517 1.00 0.00 H ATOM 9 HN3 THR A 815 3.423 28.912 -16.780 1.00 0.00 H ATOM 10 HN2 THR A 815 4.097 28.214 -15.385 1.00 0.00 H ATOM 11 HN1 THR A 815 4.876 29.520 -16.143 1.00 0.00 H ATOM 12 N ILE A 816 1.175 28.697 -15.432 1.00 59.12 N ATOM 13 CA ILE A 816 -0.063 28.024 -15.033 1.00 59.38 C ATOM 14 C ILE A 816 0.175 26.516 -14.921 1.00 58.67 C ATOM 15 O ILE A 816 0.310 25.819 -15.924 1.00 61.84 O ATOM 16 CB ILE A 816 -1.221 28.343 -15.999 1.00 62.87 C ATOM 17 CG1 ILE A 816 -1.501 29.855 -15.960 1.00 62.48 C ATOM 18 CG2 ILE A 816 -2.465 27.505 -15.650 1.00 65.23 C ATOM 19 CD1 ILE A 816 -2.830 30.287 -16.542 1.00 65.70 C ATOM 20 H ILE A 816 1.585 28.492 -16.365 1.00 0.00 H ATOM 21 N PHE A 817 0.224 26.031 -13.683 1.00 55.07 N ATOM 22 CA PHE A 817 0.495 24.626 -13.399 1.00 54.70 C ATOM 23 C PHE A 817 -0.816 23.864 -13.292 1.00 56.72 C ATOM 24 O PHE A 817 -1.695 24.236 -12.515 1.00 56.12 O ATOM 25 CB PHE A 817 1.293 24.488 -12.098 1.00 49.97 C ATOM 26 CG PHE A 817 2.681 25.049 -12.183 1.00 46.96 C ATOM 27 CD1 PHE A 817 2.899 26.417 -12.118 1.00 43.14 C ATOM 28 CD2 PHE A 817 3.771 24.210 -12.346 1.00 46.12 C ATOM 29 CE1 PHE A 817 4.180 26.934 -12.205 1.00 43.35 C ATOM 30 CE2 PHE A 817 5.057 24.719 -12.433 1.00 45.42 C ATOM 31 CZ PHE A 817 5.263 26.085 -12.359 1.00 43.49 C ATOM 32 H PHE A 817 0.063 26.679 -12.886 1.00 0.00 H ATOM 33 N GLU A 818 -0.942 22.800 -14.077 1.00 59.15 N ATOM 34 CA GLU A 818 -2.156 22.000 -14.085 1.00 62.67 C ATOM 35 C GLU A 818 -2.229 21.131 -12.831 1.00 60.68 C ATOM 36 O GLU A 818 -1.253 20.483 -12.455 1.00 59.30 O ATOM 37 CB GLU A 818 -2.226 21.152 -15.358 1.00 66.35 C ATOM 38 CG GLU A 818 -2.311 22.004 -16.625 1.00 69.87 C ATOM 39 CD GLU A 818 -2.504 21.189 -17.889 1.00 75.51 C ATOM 40 OE1 GLU A 818 -2.811 21.793 -18.938 1.00 83.22 O ATOM 41 OE2 GLU A 818 -2.351 19.953 -17.840 1.00 80.05 O ATOM 42 H GLU A 818 -0.154 22.533 -14.701 1.00 0.00 H ATOM 43 N GLU A 819 -3.393 21.142 -12.187 1.00 61.64 N ATOM 44 CA GLU A 819 -3.623 20.407 -10.944 1.00 61.05 C ATOM 45 C GLU A 819 -3.280 18.914 -11.050 1.00 61.77 C ATOM 46 O GLU A 819 -2.599 18.360 -10.182 1.00 59.60 O ATOM 47 CB GLU A 819 -5.086 20.596 -10.503 1.00 63.69 C ATOM 48 CG GLU A 819 -5.591 19.647 -9.410 1.00 66.46 C ATOM 49 CD GLU A 819 -4.698 19.609 -8.181 1.00 66.76 C ATOM 50 OE1 GLU A 819 -4.078 20.647 -7.863 1.00 65.72 O ATOM 51 OE2 GLU A 819 -4.620 18.537 -7.539 1.00 68.83 O ATOM 52 H GLU A 819 -4.175 21.699 -12.586 1.00 0.00 H ATOM 53 N ARG A 820 -3.743 18.275 -12.119 1.00 64.54 N ATOM 54 CA ARG A 820 -3.564 16.833 -12.299 1.00 66.73 C ATOM 55 C ARG A 820 -2.101 16.402 -12.488 1.00 63.64 C ATOM 56 O ARG A 820 -1.786 15.218 -12.366 1.00 63.94 O ATOM 57 CB ARG A 820 -4.400 16.345 -13.485 1.00 71.53 C ATOM 58 CG ARG A 820 -3.889 16.816 -14.839 1.00 74.37 C ATOM 59 CD ARG A 820 -4.931 16.650 -15.920 1.00 80.96 C ATOM 60 NE ARG A 820 -4.306 16.398 -17.217 1.00 85.98 N ATOM 61 CZ ARG A 820 -4.149 17.283 -18.202 1.00 89.48 C ATOM 62 NH1 ARG A 820 -4.576 18.538 -18.096 1.00 88.52 N ATOM 63 NH2 ARG A 820 -3.556 16.893 -19.324 1.00 93.45 N ATOM 64 HE ARG A 820 -3.950 15.436 -17.388 1.00 0.00 H ATOM 65 HH12 ARG A 820 -4.437 19.203 -18.884 1.00 0.00 H ATOM 66 HH11 ARG A 820 -5.049 18.855 -17.225 1.00 0.00 H ATOM 67 HH22 ARG A 820 -3.424 17.568 -20.104 1.00 0.00 H ATOM 68 HH21 ARG A 820 -3.224 15.913 -19.423 1.00 0.00 H ATOM 69 H ARG A 820 -4.248 18.816 -12.850 1.00 0.00 H ATOM 70 N HIS A 821 -1.222 17.355 -12.794 1.00 60.51 N ATOM 71 CA HIS A 821 0.200 17.067 -12.981 1.00 58.30 C ATOM 72 C HIS A 821 1.045 17.336 -11.737 1.00 54.32 C ATOM 73 O HIS A 821 2.196 16.902 -11.672 1.00 54.47 O ATOM 74 CB HIS A 821 0.743 17.854 -14.174 1.00 58.26 C ATOM 75 CG HIS A 821 0.222 17.373 -15.492 1.00 62.25 C ATOM 76 ND1 HIS A 821 -0.177 18.228 -16.496 1.00 61.53 N ATOM 77 CD2 HIS A 821 0.021 16.120 -15.962 1.00 63.86 C ATOM 78 CE1 HIS A 821 -0.590 17.522 -17.533 1.00 68.17 C ATOM 79 NE2 HIS A 821 -0.482 16.240 -17.234 1.00 70.04 N ATOM 80 H HIS A 821 -1.557 18.334 -12.903 1.00 0.00 H ATOM 81 N LEU A 822 0.483 18.047 -10.761 1.00 51.95 N ATOM 82 CA LEU A 822 1.147 18.259 -9.475 1.00 48.27 C ATOM 83 C LEU A 822 0.983 17.024 -8.600 1.00 48.39 C ATOM 84 O LEU A 822 -0.105 16.766 -8.096 1.00 51.18 O ATOM 85 CB LEU A 822 0.556 19.472 -8.746 1.00 47.22 C ATOM 86 CG LEU A 822 0.961 20.860 -9.239 1.00 45.37 C ATOM 87 CD1 LEU A 822 0.050 21.911 -8.637 1.00 45.05 C ATOM 88 CD2 LEU A 822 2.415 21.153 -8.898 1.00 45.07 C ATOM 89 H LEU A 822 -0.457 18.464 -10.918 1.00 0.00 H ATOM 90 N LYS A 823 2.061 16.268 -8.417 1.00 47.17 N ATOM 91 CA LYS A 823 2.022 15.054 -7.597 1.00 47.55 C ATOM 92 C LYS A 823 2.347 15.390 -6.142 1.00 44.02 C ATOM 93 O LYS A 823 3.455 15.818 -5.833 1.00 42.41 O ATOM 94 CB LYS A 823 3.003 14.001 -8.132 1.00 49.20 C ATOM 95 CG LYS A 823 2.870 13.692 -9.633 1.00 55.31 C ATOM 96 CD LYS A 823 1.515 13.084 -9.997 1.00 59.89 C ATOM 97 CE LYS A 823 1.366 12.929 -11.502 1.00 63.17 C ATOM 98 NZ LYS A 823 -0.028 12.568 -11.893 1.00 66.90 N ATOM 99 HZ1 LYS A 823 -0.290 11.666 -11.446 1.00 0.00 H ATOM 100 HZ2 LYS A 823 -0.680 13.315 -11.577 1.00 0.00 H ATOM 101 HZ3 LYS A 823 -0.083 12.473 -12.927 1.00 0.00 H ATOM 102 H LYS A 823 2.956 16.546 -8.868 1.00 0.00 H ATOM 103 N TYR A 824 1.372 15.201 -5.257 1.00 43.43 N ATOM 104 CA TYR A 824 1.556 15.458 -3.833 1.00 41.76 C ATOM 105 C TYR A 824 2.577 14.482 -3.251 1.00 41.03 C ATOM 106 O TYR A 824 2.483 13.275 -3.480 1.00 43.03 O ATOM 107 CB TYR A 824 0.221 15.328 -3.081 1.00 42.83 C ATOM 108 CG TYR A 824 0.379 15.331 -1.578 1.00 43.27 C ATOM 109 CD1 TYR A 824 0.163 14.178 -0.829 1.00 42.55 C ATOM 110 CD2 TYR A 824 0.779 16.485 -0.906 1.00 42.15 C ATOM 111 CE1 TYR A 824 0.326 14.179 0.554 1.00 43.30 C ATOM 112 CE2 TYR A 824 0.945 16.496 0.472 1.00 41.37 C ATOM 113 CZ TYR A 824 0.718 15.343 1.195 1.00 42.99 C ATOM 114 OH TYR A 824 0.887 15.362 2.560 1.00 44.64 O ATOM 115 HH TYR A 824 0.272 16.028 2.958 1.00 0.00 H ATOM 116 H TYR A 824 0.449 14.859 -5.591 1.00 0.00 H ATOM 117 N ILE A 825 3.549 15.009 -2.507 1.00 38.82 N ATOM 118 CA ILE A 825 4.564 14.181 -1.857 1.00 38.69 C ATOM 119 C ILE A 825 4.371 14.202 -0.341 1.00 38.26 C ATOM 120 O ILE A 825 4.104 13.168 0.266 1.00 39.26 O ATOM 121 CB ILE A 825 5.999 14.634 -2.236 1.00 36.80 C ATOM 122 CG1 ILE A 825 6.301 14.249 -3.687 1.00 37.62 C ATOM 123 CG2 ILE A 825 7.042 13.996 -1.309 1.00 36.64 C ATOM 124 CD1 ILE A 825 7.574 14.877 -4.257 1.00 36.80 C ATOM 125 H ILE A 825 3.587 16.041 -2.385 1.00 0.00 H ATOM 126 N SER A 826 4.518 15.375 0.266 1.00 37.33 N ATOM 127 CA SER A 826 4.370 15.505 1.714 1.00 38.85 C ATOM 128 C SER A 826 4.100 16.948 2.126 1.00 38.40 C ATOM 129 O SER A 826 4.054 17.849 1.287 1.00 36.12 O ATOM 130 CB SER A 826 5.619 14.981 2.427 1.00 37.37 C ATOM 131 OG SER A 826 6.694 15.894 2.287 1.00 40.46 O ATOM 132 HG SER A 826 7.491 15.538 2.754 1.00 0.00 H ATOM 133 H SER A 826 4.743 16.217 -0.301 1.00 0.00 H ATOM 134 N GLN A 827 3.931 17.150 3.431 1.00 40.77 N ATOM 135 CA GLN A 827 3.595 18.454 3.994 1.00 42.31 C ATOM 136 C GLN A 827 4.877 19.180 4.407 1.00 40.90 C ATOM 137 O GLN A 827 5.686 18.625 5.147 1.00 42.23 O ATOM 138 CB GLN A 827 2.676 18.263 5.213 1.00 45.79 C ATOM 139 CG GLN A 827 1.549 19.282 5.332 1.00 52.47 C ATOM 140 CD GLN A 827 0.475 19.111 4.265 1.00 56.37 C ATOM 141 OE1 GLN A 827 0.311 18.031 3.690 1.00 56.53 O ATOM 142 NE2 GLN A 827 -0.260 20.184 3.991 1.00 57.33 N ATOM 143 HE22 GLN A 827 -0.089 21.075 4.499 1.00 0.00 H ATOM 144 HE21 GLN A 827 -1.006 20.132 3.268 1.00 0.00 H ATOM 145 H GLN A 827 4.043 16.343 4.078 1.00 0.00 H ATOM 146 N LEU A 828 5.066 20.410 3.936 1.00 39.51 N ATOM 147 CA LEU A 828 6.234 21.210 4.331 1.00 40.33 C ATOM 148 C LEU A 828 5.974 22.070 5.568 1.00 43.32 C ATOM 149 O LEU A 828 6.901 22.374 6.315 1.00 44.55 O ATOM 150 CB LEU A 828 6.720 22.085 3.173 1.00 37.23 C ATOM 151 CG LEU A 828 7.318 21.299 2.001 1.00 35.00 C ATOM 152 CD1 LEU A 828 7.513 22.204 0.797 1.00 32.72 C ATOM 153 CD2 LEU A 828 8.633 20.614 2.395 1.00 31.34 C ATOM 154 H LEU A 828 4.373 20.814 3.274 1.00 0.00 H ATOM 155 N GLY A 829 4.722 22.465 5.776 1.00 46.34 N ATOM 156 CA GLY A 829 4.339 23.176 6.989 1.00 50.10 C ATOM 157 C GLY A 829 3.309 24.257 6.747 1.00 52.40 C ATOM 158 O GLY A 829 2.891 24.492 5.612 1.00 51.98 O ATOM 159 H GLY A 829 3.999 22.262 5.056 1.00 0.00 H ATOM 160 N LYS A 830 2.913 24.918 7.830 1.00 56.65 N ATOM 161 CA LYS A 830 1.940 26.002 7.782 1.00 58.83 C ATOM 162 C LYS A 830 2.623 27.336 8.053 1.00 59.08 C ATOM 163 O LYS A 830 3.401 27.456 8.999 1.00 60.39 O ATOM 164 CB LYS A 830 0.837 25.765 8.818 1.00 62.82 C ATOM 165 CG LYS A 830 0.204 24.390 8.715 1.00 64.93 C ATOM 166 CD LYS A 830 -1.095 24.301 9.484 1.00 69.71 C ATOM 167 CE LYS A 830 -1.742 22.939 9.289 1.00 71.55 C ATOM 168 NZ LYS A 830 -3.026 22.815 10.033 1.00 76.36 N ATOM 169 HZ1 LYS A 830 -2.850 22.948 11.049 1.00 0.00 H ATOM 170 HZ2 LYS A 830 -3.691 23.541 9.697 1.00 0.00 H ATOM 171 HZ3 LYS A 830 -3.430 21.871 9.870 1.00 0.00 H ATOM 172 H LYS A 830 3.315 24.650 8.751 1.00 0.00 H ATOM 173 N GLY A 831 2.329 28.334 7.225 1.00 58.62 N ATOM 174 CA GLY A 831 2.825 29.690 7.441 1.00 59.67 C ATOM 175 C GLY A 831 2.020 30.426 8.503 1.00 64.02 C ATOM 176 O GLY A 831 1.678 29.859 9.544 1.00 66.32 O ATOM 177 H GLY A 831 1.727 28.143 6.398 1.00 0.00 H ATOM 178 N ASN A 832 1.715 31.693 8.235 1.00 65.05 N ATOM 179 CA ASN A 832 0.914 32.518 9.146 1.00 69.84 C ATOM 180 C ASN A 832 -0.544 32.515 8.708 1.00 71.93 C ATOM 181 O ASN A 832 -1.332 33.366 9.126 1.00 75.50 O ATOM 182 CB ASN A 832 1.429 33.963 9.131 1.00 69.86 C ATOM 183 CG ASN A 832 2.933 34.048 9.284 1.00 68.85 C ATOM 184 OD1 ASN A 832 3.498 33.536 10.251 1.00 70.27 O ATOM 185 ND2 ASN A 832 3.593 34.688 8.323 1.00 63.56 N ATOM 186 HD22 ASN A 832 3.074 35.105 7.524 1.00 0.00 H ATOM 187 HD21 ASN A 832 4.629 34.771 8.370 1.00 0.00 H ATOM 188 H ASN A 832 2.057 32.114 7.347 1.00 0.00 H ATOM 189 N PHE A 833 -0.907 31.534 7.891 1.00 70.87 N ATOM 190 CA PHE A 833 -1.869 31.779 6.840 1.00 70.45 C ATOM 191 C PHE A 833 -2.537 30.498 6.341 1.00 69.81 C ATOM 192 O PHE A 833 -3.733 30.299 6.550 1.00 73.75 O ATOM 193 CB PHE A 833 -1.102 32.464 5.704 1.00 69.03 C ATOM 194 CG PHE A 833 -1.908 33.423 4.911 1.00 70.22 C ATOM 195 CD1 PHE A 833 -2.422 34.572 5.495 1.00 73.90 C ATOM 196 CD2 PHE A 833 -2.108 33.207 3.559 1.00 69.84 C ATOM 197 CE1 PHE A 833 -3.154 35.470 4.745 1.00 75.66 C ATOM 198 CE2 PHE A 833 -2.829 34.094 2.808 1.00 71.27 C ATOM 199 CZ PHE A 833 -3.356 35.228 3.395 1.00 73.73 C ATOM 200 H PHE A 833 -0.498 30.585 8.007 1.00 0.00 H ATOM 201 N GLY A 834 -1.758 29.632 5.697 1.00 64.77 N ATOM 202 CA GLY A 834 -2.289 28.426 5.072 1.00 63.15 C ATOM 203 C GLY A 834 -1.366 27.237 5.249 1.00 60.53 C ATOM 204 O GLY A 834 -0.666 27.131 6.256 1.00 61.06 O ATOM 205 H GLY A 834 -0.737 29.822 5.638 1.00 0.00 H ATOM 206 N SER A 835 -1.372 26.348 4.259 1.00 56.98 N ATOM 207 CA SER A 835 -0.574 25.128 4.276 1.00 53.64 C ATOM 208 C SER A 835 0.353 25.112 3.070 1.00 49.18 C ATOM 209 O SER A 835 -0.058 25.480 1.972 1.00 48.91 O ATOM 210 CB SER A 835 -1.500 23.910 4.245 1.00 55.57 C ATOM 211 OG SER A 835 -0.939 22.837 3.507 1.00 54.00 O ATOM 212 HG SER A 835 -0.778 23.128 2.575 1.00 0.00 H ATOM 213 H SER A 835 -1.976 26.533 3.432 1.00 0.00 H ATOM 214 N VAL A 836 1.603 24.699 3.280 1.00 45.70 N ATOM 215 CA VAL A 836 2.547 24.506 2.184 1.00 42.09 C ATOM 216 C VAL A 836 2.841 23.020 2.035 1.00 41.21 C ATOM 217 O VAL A 836 3.072 22.325 3.025 1.00 41.04 O ATOM 218 CB VAL A 836 3.869 25.264 2.401 1.00 39.52 C ATOM 219 CG1 VAL A 836 4.803 25.037 1.223 1.00 36.82 C ATOM 220 CG2 VAL A 836 3.605 26.740 2.571 1.00 39.37 C ATOM 221 H VAL A 836 1.915 24.509 4.254 1.00 0.00 H ATOM 222 N GLU A 837 2.840 22.556 0.788 1.00 39.66 N ATOM 223 CA GLU A 837 3.035 21.150 0.467 1.00 40.05 C ATOM 224 C GLU A 837 4.158 20.984 -0.541 1.00 37.69 C ATOM 225 O GLU A 837 4.290 21.770 -1.478 1.00 36.82 O ATOM 226 CB GLU A 837 1.751 20.557 -0.121 1.00 41.76 C ATOM 227 CG GLU A 837 0.622 20.381 0.886 1.00 45.75 C ATOM 228 CD GLU A 837 -0.642 19.782 0.274 1.00 48.65 C ATOM 229 OE1 GLU A 837 -0.829 19.892 -0.957 1.00 49.81 O ATOM 230 OE2 GLU A 837 -1.458 19.206 1.029 1.00 54.25 O ATOM 231 H GLU A 837 2.693 23.228 0.008 1.00 0.00 H ATOM 232 N LEU A 838 4.964 19.949 -0.344 1.00 37.10 N ATOM 233 CA LEU A 838 5.958 19.555 -1.327 1.00 35.45 C ATOM 234 C LEU A 838 5.259 18.726 -2.400 1.00 35.11 C ATOM 235 O LEU A 838 4.545 17.770 -2.091 1.00 35.40 O ATOM 236 CB LEU A 838 7.082 18.755 -0.660 1.00 35.37 C ATOM 237 CG LEU A 838 8.099 18.067 -1.568 1.00 35.27 C ATOM 238 CD1 LEU A 838 8.767 19.059 -2.509 1.00 34.21 C ATOM 239 CD2 LEU A 838 9.123 17.350 -0.710 1.00 35.46 C ATOM 240 H LEU A 838 4.882 19.405 0.538 1.00 0.00 H ATOM 241 N CYS A 839 5.449 19.121 -3.656 1.00 35.04 N ATOM 242 CA CYS A 839 4.905 18.402 -4.802 1.00 36.92 C ATOM 243 C CYS A 839 5.963 18.279 -5.885 1.00 36.70 C ATOM 244 O CYS A 839 6.951 19.023 -5.894 1.00 35.34 O ATOM 245 CB CYS A 839 3.698 19.141 -5.387 1.00 37.76 C ATOM 246 SG CYS A 839 2.274 19.281 -4.302 1.00 42.18 S ATOM 247 H CYS A 839 6.010 19.980 -3.828 1.00 0.00 H ATOM 248 N ARG A 840 5.752 17.334 -6.797 1.00 38.42 N ATOM 249 CA ARG A 840 6.540 17.258 -8.019 1.00 39.70 C ATOM 250 C ARG A 840 5.622 17.565 -9.189 1.00 41.46 C ATOM 251 O ARG A 840 4.673 16.826 -9.448 1.00 43.85 O ATOM 252 CB ARG A 840 7.173 15.872 -8.190 1.00 40.62 C ATOM 253 CG ARG A 840 8.188 15.804 -9.329 1.00 42.50 C ATOM 254 CD ARG A 840 8.664 14.384 -9.618 1.00 45.07 C ATOM 255 NE ARG A 840 9.191 13.707 -8.431 1.00 45.26 N ATOM 256 CZ ARG A 840 10.391 13.918 -7.886 1.00 42.87 C ATOM 257 NH1 ARG A 840 10.747 13.232 -6.806 1.00 43.16 N ATOM 258 NH2 ARG A 840 11.235 14.806 -8.399 1.00 40.92 N ATOM 259 HE ARG A 840 8.578 13.002 -7.974 1.00 0.00 H ATOM 260 HH12 ARG A 840 11.680 13.389 -6.374 1.00 0.00 H ATOM 261 HH11 ARG A 840 10.093 12.537 -6.392 1.00 0.00 H ATOM 262 HH22 ARG A 840 12.165 14.954 -7.958 1.00 0.00 H ATOM 263 HH21 ARG A 840 10.966 15.353 -9.242 1.00 0.00 H ATOM 264 H ARG A 840 5.004 16.630 -6.633 1.00 0.00 H ATOM 265 N TYR A 841 5.888 18.666 -9.884 1.00 41.80 N ATOM 266 CA TYR A 841 5.176 18.952 -11.120 1.00 44.34 C ATOM 267 C TYR A 841 5.741 18.043 -12.204 1.00 46.81 C ATOM 268 O TYR A 841 6.846 18.267 -12.704 1.00 46.20 O ATOM 269 CB TYR A 841 5.305 20.418 -11.525 1.00 43.36 C ATOM 270 CG TYR A 841 4.401 20.776 -12.680 1.00 46.45 C ATOM 271 CD1 TYR A 841 3.017 20.713 -12.542 1.00 48.88 C ATOM 272 CD2 TYR A 841 4.923 21.165 -13.914 1.00 49.27 C ATOM 273 CE1 TYR A 841 2.176 21.036 -13.594 1.00 51.86 C ATOM 274 CE2 TYR A 841 4.085 21.489 -14.976 1.00 51.54 C ATOM 275 CZ TYR A 841 2.714 21.422 -14.806 1.00 53.08 C ATOM 276 OH TYR A 841 1.871 21.741 -15.840 1.00 56.07 O ATOM 277 HH TYR A 841 0.932 21.638 -15.543 1.00 0.00 H ATOM 278 H TYR A 841 6.612 19.329 -9.541 1.00 0.00 H ATOM 279 N ASP A 842 4.967 17.025 -12.562 1.00 49.43 N ATOM 280 CA ASP A 842 5.459 15.913 -13.356 1.00 53.28 C ATOM 281 C ASP A 842 4.537 15.650 -14.558 1.00 57.63 C ATOM 282 O ASP A 842 3.844 14.628 -14.605 1.00 59.94 O ATOM 283 CB ASP A 842 5.560 14.677 -12.450 1.00 53.19 C ATOM 284 CG ASP A 842 6.394 13.572 -13.054 1.00 55.59 C ATOM 285 OD1 ASP A 842 7.541 13.841 -13.470 1.00 57.00 O ATOM 286 OD2 ASP A 842 5.904 12.425 -13.101 1.00 60.15 O ATOM 287 H ASP A 842 3.971 17.024 -12.262 1.00 0.00 H ATOM 288 N PRO A 843 4.529 16.578 -15.537 1.00 58.91 N ATOM 289 CA PRO A 843 3.643 16.442 -16.695 1.00 63.52 C ATOM 290 C PRO A 843 3.921 15.202 -17.557 1.00 68.25 C ATOM 291 O PRO A 843 2.979 14.585 -18.059 1.00 72.22 O ATOM 292 CB PRO A 843 3.885 17.736 -17.488 1.00 63.31 C ATOM 293 CG PRO A 843 5.174 18.264 -17.014 1.00 59.08 C ATOM 294 CD PRO A 843 5.343 17.806 -15.606 1.00 56.63 C ATOM 295 N LEU A 844 5.192 14.834 -17.708 1.00 68.94 N ATOM 296 CA LEU A 844 5.574 13.694 -18.557 1.00 73.65 C ATOM 297 C LEU A 844 5.224 12.340 -17.928 1.00 74.58 C ATOM 298 O LEU A 844 5.029 11.358 -18.644 1.00 78.56 O ATOM 299 CB LEU A 844 7.072 13.743 -18.886 1.00 74.00 C ATOM 300 CG LEU A 844 7.597 15.033 -19.530 1.00 74.98 C ATOM 301 CD1 LEU A 844 9.111 14.968 -19.693 1.00 75.40 C ATOM 302 CD2 LEU A 844 6.916 15.312 -20.868 1.00 79.99 C ATOM 303 H LEU A 844 5.935 15.367 -17.212 1.00 0.00 H ATOM 304 N GLY A 845 5.156 12.293 -16.597 1.00 71.39 N ATOM 305 CA GLY A 845 4.744 11.086 -15.873 1.00 72.05 C ATOM 306 C GLY A 845 5.871 10.140 -15.486 1.00 72.40 C ATOM 307 O GLY A 845 5.613 9.067 -14.940 1.00 73.14 O ATOM 308 H GLY A 845 5.404 13.144 -16.052 1.00 0.00 H ATOM 309 N ASP A 846 7.119 10.542 -15.734 1.00 72.31 N ATOM 310 CA ASP A 846 8.283 9.671 -15.503 1.00 72.91 C ATOM 311 C ASP A 846 8.838 9.795 -14.084 1.00 69.35 C ATOM 312 O ASP A 846 9.788 9.098 -13.729 1.00 69.93 O ATOM 313 CB ASP A 846 9.430 9.998 -16.471 1.00 74.95 C ATOM 314 CG ASP A 846 8.955 10.402 -17.851 1.00 79.37 C ATOM 315 OD1 ASP A 846 8.288 9.586 -18.518 1.00 85.05 O ATOM 316 OD2 ASP A 846 9.272 11.535 -18.273 1.00 80.01 O ATOM 317 H ASP A 846 7.274 11.502 -16.103 1.00 0.00 H ATOM 318 N ASN A 847 8.254 10.689 -13.287 1.00 66.28 N ATOM 319 CA ASN A 847 8.818 11.102 -12.000 1.00 62.02 C ATOM 320 C ASN A 847 10.154 11.839 -12.176 1.00 60.69 C ATOM 321 O ASN A 847 10.981 11.866 -11.264 1.00 59.12 O ATOM 322 CB ASN A 847 8.968 9.904 -11.050 1.00 62.31 C ATOM 323 CG ASN A 847 8.658 10.261 -9.610 1.00 60.72 C ATOM 324 OD1 ASN A 847 7.560 10.715 -9.298 1.00 62.17 O ATOM 325 ND2 ASN A 847 9.623 10.052 -8.724 1.00 59.12 N ATOM 326 HD22 ASN A 847 10.538 9.666 -9.033 1.00 0.00 H ATOM 327 HD21 ASN A 847 9.465 10.274 -7.720 1.00 0.00 H ATOM 328 H ASN A 847 7.355 11.114 -13.593 1.00 0.00 H ATOM 329 N THR A 848 10.342 12.442 -13.352 1.00 61.79 N ATOM 330 CA THR A 848 11.529 13.244 -13.662 1.00 60.23 C ATOM 331 C THR A 848 11.282 14.730 -13.405 1.00 56.74 C ATOM 332 O THR A 848 12.213 15.534 -13.463 1.00 56.72 O ATOM 333 CB THR A 848 11.964 13.071 -15.143 1.00 64.71 C ATOM 334 OG1 THR A 848 10.825 13.179 -16.010 1.00 66.60 O ATOM 335 CG2 THR A 848 12.625 11.721 -15.353 1.00 67.31 C ATOM 336 HG1 THR A 848 11.115 13.067 -16.950 1.00 0.00 H ATOM 337 H THR A 848 9.611 12.338 -14.084 1.00 0.00 H ATOM 338 N GLY A 849 10.032 15.090 -13.116 1.00 54.42 N ATOM 339 CA GLY A 849 9.634 16.486 -12.955 1.00 51.41 C ATOM 340 C GLY A 849 10.311 17.209 -11.806 1.00 47.32 C ATOM 341 O GLY A 849 10.910 16.587 -10.933 1.00 45.97 O ATOM 342 H GLY A 849 9.312 14.348 -13.001 1.00 0.00 H ATOM 343 N ALA A 850 10.213 18.534 -11.817 1.00 45.13 N ATOM 344 CA ALA A 850 10.859 19.369 -10.813 1.00 42.47 C ATOM 345 C ALA A 850 10.023 19.427 -9.535 1.00 40.37 C ATOM 346 O ALA A 850 8.795 19.478 -9.592 1.00 41.29 O ATOM 347 CB ALA A 850 11.079 20.768 -11.362 1.00 42.09 C ATOM 348 H ALA A 850 9.656 18.990 -12.568 1.00 0.00 H ATOM 349 N LEU A 851 10.694 19.420 -8.386 1.00 38.03 N ATOM 350 CA LEU A 851 10.017 19.578 -7.099 1.00 35.47 C ATOM 351 C LEU A 851 9.616 21.033 -6.932 1.00 33.40 C ATOM 352 O LEU A 851 10.352 21.938 -7.325 1.00 32.91 O ATOM 353 CB LEU A 851 10.918 19.148 -5.932 1.00 34.39 C ATOM 354 CG LEU A 851 11.274 17.660 -5.845 1.00 35.53 C ATOM 355 CD1 LEU A 851 12.226 17.409 -4.685 1.00 36.83 C ATOM 356 CD2 LEU A 851 10.032 16.795 -5.698 1.00 37.42 C ATOM 357 H LEU A 851 11.727 19.299 -8.403 1.00 0.00 H ATOM 358 N VAL A 852 8.434 21.248 -6.366 1.00 32.59 N ATOM 359 CA VAL A 852 7.914 22.591 -6.132 1.00 30.73 C ATOM 360 C VAL A 852 7.220 22.666 -4.776 1.00 29.86 C ATOM 361 O VAL A 852 6.717 21.664 -4.272 1.00 28.89 O ATOM 362 CB VAL A 852 6.918 23.018 -7.231 1.00 30.65 C ATOM 363 CG1 VAL A 852 7.617 23.087 -8.587 1.00 31.84 C ATOM 364 CG2 VAL A 852 5.718 22.076 -7.284 1.00 30.29 C ATOM 365 H VAL A 852 7.859 20.430 -6.079 1.00 0.00 H ATOM 366 N ALA A 853 7.209 23.860 -4.193 1.00 29.32 N ATOM 367 CA ALA A 853 6.463 24.109 -2.972 1.00 30.39 C ATOM 368 C ALA A 853 5.154 24.783 -3.358 1.00 31.18 C ATOM 369 O ALA A 853 5.153 25.782 -4.082 1.00 30.90 O ATOM 370 CB ALA A 853 7.266 24.988 -2.017 1.00 29.46 C ATOM 371 H ALA A 853 7.749 24.638 -4.623 1.00 0.00 H ATOM 372 N VAL A 854 4.045 24.232 -2.872 1.00 32.66 N ATOM 373 CA VAL A 854 2.716 24.695 -3.250 1.00 34.08 C ATOM 374 C VAL A 854 1.946 25.129 -2.009 1.00 35.74 C ATOM 375 O VAL A 854 1.695 24.314 -1.125 1.00 37.06 O ATOM 376 CB VAL A 854 1.927 23.590 -3.981 1.00 35.73 C ATOM 377 CG1 VAL A 854 0.687 24.176 -4.644 1.00 38.73 C ATOM 378 CG2 VAL A 854 2.808 22.890 -5.022 1.00 35.37 C ATOM 379 H VAL A 854 4.129 23.444 -2.199 1.00 0.00 H ATOM 380 N LYS A 855 1.577 26.409 -1.953 1.00 36.16 N ATOM 381 CA LYS A 855 0.810 26.963 -0.837 1.00 38.25 C ATOM 382 C LYS A 855 -0.672 27.114 -1.192 1.00 40.62 C ATOM 383 O LYS A 855 -1.007 27.499 -2.310 1.00 40.55 O ATOM 384 CB LYS A 855 1.379 28.326 -0.429 1.00 37.74 C ATOM 385 CG LYS A 855 0.594 29.016 0.685 1.00 39.08 C ATOM 386 CD LYS A 855 1.394 30.126 1.343 1.00 38.46 C ATOM 387 CE LYS A 855 0.518 30.942 2.276 1.00 43.12 C ATOM 388 NZ LYS A 855 1.263 32.032 2.962 1.00 44.32 N ATOM 389 HZ1 LYS A 855 2.033 31.621 3.527 1.00 0.00 H ATOM 390 HZ2 LYS A 855 1.660 32.679 2.251 1.00 0.00 H ATOM 391 HZ3 LYS A 855 0.615 32.555 3.585 1.00 0.00 H ATOM 392 H LYS A 855 1.846 27.040 -2.735 1.00 0.00 H ATOM 393 N GLN A 856 -1.550 26.808 -0.239 1.00 43.63 N ATOM 394 CA GLN A 856 -2.994 27.021 -0.404 1.00 47.86 C ATOM 395 C GLN A 856 -3.721 27.211 0.932 1.00 50.51 C ATOM 396 O GLN A 856 -3.151 26.988 2.000 1.00 50.30 O ATOM 397 CB GLN A 856 -3.660 25.898 -1.226 1.00 50.30 C ATOM 398 CG GLN A 856 -2.851 24.616 -1.448 1.00 53.06 C ATOM 399 CD GLN A 856 -2.484 23.890 -0.171 1.00 59.06 C ATOM 400 OE1 GLN A 856 -1.329 23.511 0.024 1.00 57.88 O ATOM 401 NE2 GLN A 856 -3.465 23.687 0.704 1.00 65.03 N ATOM 402 HE22 GLN A 856 -4.426 24.026 0.496 1.00 0.00 H ATOM 403 HE21 GLN A 856 -3.271 23.190 1.597 1.00 0.00 H ATOM 404 H GLN A 856 -1.201 26.404 0.654 1.00 0.00 H ATOM 405 N LEU A 857 -4.979 27.637 0.850 1.00 54.14 N ATOM 406 CA LEU A 857 -5.818 27.867 2.029 1.00 58.62 C ATOM 407 C LEU A 857 -6.850 26.760 2.193 1.00 62.32 C ATOM 408 O LEU A 857 -7.128 26.014 1.254 1.00 61.89 O ATOM 409 CB LEU A 857 -6.553 29.201 1.908 1.00 59.75 C ATOM 410 CG LEU A 857 -5.735 30.442 1.556 1.00 56.72 C ATOM 411 CD1 LEU A 857 -6.671 31.632 1.473 1.00 59.62 C ATOM 412 CD2 LEU A 857 -4.634 30.695 2.570 1.00 55.71 C ATOM 413 H LEU A 857 -5.384 27.814 -0.091 1.00 0.00 H ATOM 414 N GLN A 858 -7.429 26.676 3.389 1.00 67.26 N ATOM 415 CA GLN A 858 -8.491 25.706 3.679 1.00 71.74 C ATOM 416 C GLN A 858 -9.250 26.073 4.953 1.00 75.58 C ATOM 417 O GLN A 858 -10.014 27.040 4.977 1.00 77.95 O ATOM 418 CB GLN A 858 -7.909 24.288 3.789 1.00 71.28 C ATOM 419 CG GLN A 858 -6.872 24.104 4.898 1.00 71.74 C ATOM 420 CD GLN A 858 -5.637 23.332 4.440 1.00 68.77 C ATOM 421 OE1 GLN A 858 -4.923 23.762 3.533 1.00 68.34 O ATOM 422 NE2 GLN A 858 -5.378 22.194 5.075 1.00 71.00 N ATOM 423 HE22 GLN A 858 -6.008 21.868 5.836 1.00 0.00 H ATOM 424 HE21 GLN A 858 -4.545 21.629 4.812 1.00 0.00 H ATOM 425 H GLN A 858 -7.118 27.320 4.144 1.00 0.00 H TER 426 GLN A 858 ATOM 427 N GLY A 861 -11.638 31.571 4.923 1.00 78.67 N ATOM 428 CA GLY A 861 -12.478 32.764 4.967 1.00 82.35 C ATOM 429 C GLY A 861 -12.097 33.818 3.935 1.00 79.45 C ATOM 430 O GLY A 861 -10.988 33.788 3.395 1.00 74.50 O ATOM 431 HN3 GLY A 861 -10.649 31.838 5.102 1.00 0.00 H ATOM 432 HN2 GLY A 861 -11.714 31.129 3.985 1.00 0.00 H ATOM 433 HN1 GLY A 861 -11.954 30.899 5.651 1.00 0.00 H ATOM 434 N PRO A 862 -13.010 34.772 3.664 1.00 82.59 N ATOM 435 CA PRO A 862 -12.782 35.806 2.641 1.00 80.12 C ATOM 436 C PRO A 862 -11.604 36.738 2.944 1.00 77.26 C ATOM 437 O PRO A 862 -10.936 37.212 2.021 1.00 73.64 O ATOM 438 CB PRO A 862 -14.091 36.608 2.642 1.00 85.06 C ATOM 439 CG PRO A 862 -15.081 35.774 3.368 1.00 90.19 C ATOM 440 CD PRO A 862 -14.313 34.941 4.330 1.00 88.65 C ATOM 441 N ASP A 863 -11.358 36.986 4.229 1.00 79.37 N ATOM 442 CA ASP A 863 -10.321 37.922 4.666 1.00 77.65 C ATOM 443 C ASP A 863 -8.913 37.432 4.310 1.00 72.64 C ATOM 444 O ASP A 863 -8.063 38.227 3.903 1.00 69.94 O ATOM 445 CB ASP A 863 -10.434 38.169 6.179 1.00 82.41 C ATOM 446 CG ASP A 863 -10.219 39.625 6.552 1.00 85.33 C ATOM 447 OD1 ASP A 863 -11.178 40.258 7.047 1.00 87.41 O ATOM 448 OD2 ASP A 863 -9.099 40.137 6.341 1.00 84.93 O ATOM 449 H ASP A 863 -11.925 36.496 4.950 1.00 0.00 H ATOM 450 N GLN A 864 -8.675 36.129 4.461 1.00 71.58 N ATOM 451 CA GLN A 864 -7.382 35.538 4.106 1.00 66.74 C ATOM 452 C GLN A 864 -7.301 35.146 2.626 1.00 63.13 C ATOM 453 O GLN A 864 -6.208 35.072 2.072 1.00 59.09 O ATOM 454 CB GLN A 864 -7.018 34.347 5.012 1.00 68.02 C ATOM 455 CG GLN A 864 -8.036 33.218 5.094 1.00 73.00 C ATOM 456 CD GLN A 864 -8.979 33.353 6.281 1.00 82.37 C ATOM 457 OE1 GLN A 864 -9.782 34.287 6.355 1.00 84.77 O ATOM 458 NE2 GLN A 864 -8.890 32.411 7.215 1.00 85.25 N ATOM 459 HE22 GLN A 864 -8.198 31.641 7.113 1.00 0.00 H ATOM 460 HE21 GLN A 864 -9.512 32.444 8.048 1.00 0.00 H ATOM 461 H GLN A 864 -9.425 35.517 4.840 1.00 0.00 H ATOM 462 N GLN A 865 -8.445 34.895 1.990 1.00 64.53 N ATOM 463 CA GLN A 865 -8.495 34.710 0.529 1.00 62.04 C ATOM 464 C GLN A 865 -8.072 36.002 -0.196 1.00 59.31 C ATOM 465 O GLN A 865 -7.489 35.966 -1.280 1.00 56.09 O ATOM 466 CB GLN A 865 -9.904 34.283 0.087 1.00 65.45 C ATOM 467 CG GLN A 865 -10.264 32.835 0.448 1.00 67.75 C ATOM 468 CD GLN A 865 -11.770 32.573 0.515 1.00 73.03 C ATOM 469 OE1 GLN A 865 -12.574 33.311 -0.056 1.00 75.94 O ATOM 470 NE2 GLN A 865 -12.152 31.510 1.217 1.00 74.84 N ATOM 471 HE22 GLN A 865 -11.441 30.912 1.684 1.00 0.00 H ATOM 472 HE21 GLN A 865 -13.162 31.276 1.299 1.00 0.00 H ATOM 473 H GLN A 865 -9.326 34.828 2.539 1.00 0.00 H ATOM 474 N ARG A 866 -8.367 37.136 0.431 1.00 60.48 N ATOM 475 CA ARG A 866 -7.991 38.452 -0.068 1.00 58.76 C ATOM 476 C ARG A 866 -6.498 38.704 0.113 1.00 54.71 C ATOM 477 O ARG A 866 -5.806 39.124 -0.821 1.00 50.97 O ATOM 478 CB ARG A 866 -8.789 39.500 0.704 1.00 62.61 C ATOM 479 CG ARG A 866 -8.669 40.917 0.210 1.00 62.65 C ATOM 480 CD ARG A 866 -9.647 41.827 0.948 1.00 68.08 C ATOM 481 NE ARG A 866 -10.998 41.261 0.941 1.00 71.16 N ATOM 482 CZ ARG A 866 -11.691 40.876 2.015 1.00 76.55 C ATOM 483 NH1 ARG A 866 -12.904 40.358 1.851 1.00 78.22 N ATOM 484 NH2 ARG A 866 -11.210 41.015 3.250 1.00 78.08 N ATOM 485 HE ARG A 866 -11.459 41.149 0.016 1.00 0.00 H ATOM 486 HH12 ARG A 866 -13.456 40.054 2.678 1.00 0.00 H ATOM 487 HH11 ARG A 866 -13.301 40.257 0.895 1.00 0.00 H ATOM 488 HH22 ARG A 866 -11.775 40.705 4.066 1.00 0.00 H ATOM 489 HH21 ARG A 866 -10.269 41.434 3.398 1.00 0.00 H ATOM 490 H ARG A 866 -8.894 37.081 1.326 1.00 0.00 H ATOM 491 N ASP A 867 -6.008 38.449 1.324 1.00 54.62 N ATOM 492 CA ASP A 867 -4.586 38.607 1.635 1.00 51.65 C ATOM 493 C ASP A 867 -3.715 37.634 0.834 1.00 47.82 C ATOM 494 O ASP A 867 -2.556 37.939 0.535 1.00 45.78 O ATOM 495 CB ASP A 867 -4.335 38.435 3.141 1.00 53.71 C ATOM 496 CG ASP A 867 -4.794 39.632 3.954 1.00 58.96 C ATOM 497 OD1 ASP A 867 -4.392 40.769 3.631 1.00 60.79 O ATOM 498 OD2 ASP A 867 -5.552 39.436 4.929 1.00 66.47 O ATOM 499 H ASP A 867 -6.655 38.128 2.072 1.00 0.00 H ATOM 500 N PHE A 868 -4.274 36.472 0.492 1.00 47.02 N ATOM 501 CA PHE A 868 -3.577 35.475 -0.324 1.00 44.38 C ATOM 502 C PHE A 868 -3.370 35.980 -1.750 1.00 42.77 C ATOM 503 O PHE A 868 -2.285 35.832 -2.317 1.00 39.52 O ATOM 504 CB PHE A 868 -4.373 34.166 -0.347 1.00 45.05 C ATOM 505 CG PHE A 868 -3.656 33.014 -0.996 1.00 42.90 C ATOM 506 CD1 PHE A 868 -2.344 32.697 -0.656 1.00 40.81 C ATOM 507 CD2 PHE A 868 -4.313 32.216 -1.923 1.00 42.98 C ATOM 508 CE1 PHE A 868 -1.699 31.624 -1.246 1.00 38.68 C ATOM 509 CE2 PHE A 868 -3.675 31.140 -2.517 1.00 41.98 C ATOM 510 CZ PHE A 868 -2.369 30.841 -2.181 1.00 39.75 C ATOM 511 H PHE A 868 -5.240 36.266 0.817 1.00 0.00 H ATOM 512 N GLN A 869 -4.413 36.580 -2.321 1.00 44.87 N ATOM 513 CA GLN A 869 -4.329 37.146 -3.666 1.00 45.17 C ATOM 514 C GLN A 869 -3.288 38.260 -3.748 1.00 43.34 C ATOM 515 O GLN A 869 -2.642 38.423 -4.776 1.00 42.11 O ATOM 516 CB GLN A 869 -5.700 37.643 -4.132 1.00 47.89 C ATOM 517 CG GLN A 869 -6.647 36.501 -4.505 1.00 51.93 C ATOM 518 CD GLN A 869 -8.096 36.928 -4.605 1.00 56.77 C ATOM 519 OE1 GLN A 869 -8.399 38.088 -4.875 1.00 64.48 O ATOM 520 NE2 GLN A 869 -9.004 35.982 -4.395 1.00 63.92 N ATOM 521 HE22 GLN A 869 -8.702 35.013 -4.169 1.00 0.00 H ATOM 522 HE21 GLN A 869 -10.017 36.210 -4.457 1.00 0.00 H ATOM 523 H GLN A 869 -5.309 36.647 -1.797 1.00 0.00 H ATOM 524 N ARG A 870 -3.125 39.015 -2.665 1.00 44.54 N ATOM 525 CA ARG A 870 -2.085 40.041 -2.583 1.00 44.13 C ATOM 526 C ARG A 870 -0.706 39.397 -2.501 1.00 40.73 C ATOM 527 O ARG A 870 0.199 39.776 -3.243 1.00 39.06 O ATOM 528 CB ARG A 870 -2.310 40.952 -1.370 1.00 45.97 C ATOM 529 CG ARG A 870 -3.515 41.872 -1.509 1.00 53.00 C ATOM 530 CD ARG A 870 -4.165 42.198 -0.165 1.00 58.81 C ATOM 531 NE ARG A 870 -3.419 43.190 0.604 1.00 64.37 N ATOM 532 CZ ARG A 870 -3.445 44.502 0.382 1.00 69.40 C ATOM 533 NH1 ARG A 870 -4.174 45.014 -0.606 1.00 72.27 N ATOM 534 NH2 ARG A 870 -2.729 45.313 1.153 1.00 71.02 N ATOM 535 HE ARG A 870 -2.823 42.846 1.383 1.00 0.00 H ATOM 536 HH12 ARG A 870 -4.184 46.041 -0.767 1.00 0.00 H ATOM 537 HH11 ARG A 870 -4.734 44.387 -1.218 1.00 0.00 H ATOM 538 HH22 ARG A 870 -2.745 46.339 0.985 1.00 0.00 H ATOM 539 HH21 ARG A 870 -2.152 44.922 1.925 1.00 0.00 H ATOM 540 H ARG A 870 -3.756 38.872 -1.851 1.00 0.00 H ATOM 541 N GLU A 871 -0.561 38.422 -1.603 1.00 40.12 N ATOM 542 CA GLU A 871 0.706 37.713 -1.401 1.00 37.93 C ATOM 543 C GLU A 871 1.226 37.106 -2.699 1.00 35.23 C ATOM 544 O GLU A 871 2.420 37.141 -2.961 1.00 34.26 O ATOM 545 CB GLU A 871 0.547 36.608 -0.347 1.00 38.44 C ATOM 546 CG GLU A 871 1.780 35.711 -0.177 1.00 37.38 C ATOM 547 CD GLU A 871 1.547 34.516 0.736 1.00 38.91 C ATOM 548 OE1 GLU A 871 0.442 34.391 1.312 1.00 45.60 O ATOM 549 OE2 GLU A 871 2.476 33.691 0.872 1.00 39.87 O ATOM 550 H GLU A 871 -1.381 38.153 -1.022 1.00 0.00 H ATOM 551 N ILE A 872 0.329 36.534 -3.496 1.00 35.44 N ATOM 552 CA ILE A 872 0.701 35.957 -4.785 1.00 33.77 C ATOM 553 C ILE A 872 1.298 37.042 -5.680 1.00 32.74 C ATOM 554 O ILE A 872 2.356 36.842 -6.281 1.00 31.54 O ATOM 555 CB ILE A 872 -0.514 35.277 -5.480 1.00 34.78 C ATOM 556 CG1 ILE A 872 -0.862 33.974 -4.759 1.00 35.98 C ATOM 557 CG2 ILE A 872 -0.216 34.984 -6.948 1.00 34.94 C ATOM 558 CD1 ILE A 872 -2.206 33.380 -5.144 1.00 37.90 C ATOM 559 H ILE A 872 -0.665 36.496 -3.193 1.00 0.00 H ATOM 560 N GLN A 873 0.626 38.192 -5.747 1.00 32.72 N ATOM 561 CA GLN A 873 1.078 39.296 -6.589 1.00 33.22 C ATOM 562 C GLN A 873 2.395 39.919 -6.091 1.00 32.64 C ATOM 563 O GLN A 873 3.235 40.318 -6.902 1.00 31.46 O ATOM 564 CB GLN A 873 -0.019 40.361 -6.718 1.00 33.91 C ATOM 565 CG GLN A 873 -1.278 39.883 -7.452 1.00 34.39 C ATOM 566 CD GLN A 873 -1.038 39.545 -8.920 1.00 34.78 C ATOM 567 OE1 GLN A 873 -1.684 38.658 -9.477 1.00 34.64 O ATOM 568 NE2 GLN A 873 -0.106 40.252 -9.550 1.00 33.14 N ATOM 569 HE22 GLN A 873 0.417 40.993 -9.041 1.00 0.00 H ATOM 570 HE21 GLN A 873 0.101 40.064 -10.552 1.00 0.00 H ATOM 571 H GLN A 873 -0.242 38.305 -5.185 1.00 0.00 H ATOM 572 N ILE A 874 2.579 39.993 -4.772 1.00 33.09 N ATOM 573 CA ILE A 874 3.819 40.523 -4.200 1.00 33.00 C ATOM 574 C ILE A 874 5.013 39.638 -4.561 1.00 33.11 C ATOM 575 O ILE A 874 6.007 40.126 -5.105 1.00 31.97 O ATOM 576 CB ILE A 874 3.725 40.701 -2.664 1.00 34.77 C ATOM 577 CG1 ILE A 874 2.741 41.830 -2.330 1.00 36.08 C ATOM 578 CG2 ILE A 874 5.100 41.043 -2.069 1.00 33.91 C ATOM 579 CD1 ILE A 874 2.339 41.897 -0.880 1.00 36.99 C ATOM 580 H ILE A 874 1.825 39.667 -4.135 1.00 0.00 H ATOM 581 N LEU A 875 4.905 38.341 -4.275 1.00 33.34 N ATOM 582 CA LEU A 875 5.984 37.391 -4.567 1.00 32.15 C ATOM 583 C LEU A 875 6.274 37.349 -6.068 1.00 32.26 C ATOM 584 O LEU A 875 7.421 37.183 -6.491 1.00 31.62 O ATOM 585 CB LEU A 875 5.619 35.979 -4.085 1.00 32.34 C ATOM 586 CG LEU A 875 6.622 35.130 -3.289 1.00 33.07 C ATOM 587 CD1 LEU A 875 6.634 33.699 -3.823 1.00 32.45 C ATOM 588 CD2 LEU A 875 8.032 35.687 -3.275 1.00 34.65 C ATOM 589 H LEU A 875 4.031 37.992 -3.832 1.00 0.00 H ATOM 590 N LYS A 876 5.217 37.491 -6.863 1.00 32.42 N ATOM 591 CA LYS A 876 5.331 37.483 -8.313 1.00 32.44 C ATOM 592 C LYS A 876 6.175 38.653 -8.806 1.00 32.95 C ATOM 593 O LYS A 876 6.963 38.505 -9.739 1.00 34.79 O ATOM 594 CB LYS A 876 3.938 37.534 -8.938 1.00 33.89 C ATOM 595 CG LYS A 876 3.904 37.568 -10.451 1.00 35.19 C ATOM 596 CD LYS A 876 2.484 37.398 -10.947 1.00 35.75 C ATOM 597 CE LYS A 876 2.406 37.501 -12.453 1.00 38.62 C ATOM 598 NZ LYS A 876 1.023 37.243 -12.921 1.00 42.53 N ATOM 599 HZ1 LYS A 876 0.733 36.287 -12.632 1.00 0.00 H ATOM 600 HZ2 LYS A 876 0.380 37.944 -12.500 1.00 0.00 H ATOM 601 HZ3 LYS A 876 0.989 37.318 -13.958 1.00 0.00 H ATOM 602 H LYS A 876 4.278 37.612 -6.433 1.00 0.00 H ATOM 603 N ALA A 877 6.010 39.812 -8.177 1.00 33.01 N ATOM 604 CA ALA A 877 6.691 41.031 -8.619 1.00 32.60 C ATOM 605 C ALA A 877 8.112 41.177 -8.057 1.00 31.14 C ATOM 606 O ALA A 877 8.913 41.927 -8.610 1.00 30.66 O ATOM 607 CB ALA A 877 5.862 42.248 -8.268 1.00 32.94 C ATOM 608 H ALA A 877 5.381 39.854 -7.350 1.00 0.00 H ATOM 609 N LEU A 878 8.421 40.469 -6.970 1.00 31.10 N ATOM 610 CA LEU A 878 9.747 40.548 -6.348 1.00 30.88 C ATOM 611 C LEU A 878 10.738 39.649 -7.076 1.00 31.36 C ATOM 612 O LEU A 878 10.441 38.483 -7.340 1.00 30.86 O ATOM 613 CB LEU A 878 9.688 40.159 -4.870 1.00 30.64 C ATOM 614 CG LEU A 878 8.847 41.041 -3.939 1.00 31.85 C ATOM 615 CD1 LEU A 878 8.693 40.376 -2.581 1.00 31.29 C ATOM 616 CD2 LEU A 878 9.432 42.442 -3.785 1.00 33.32 C ATOM 617 H LEU A 878 7.702 39.844 -6.552 1.00 0.00 H ATOM 618 N HIS A 879 11.913 40.201 -7.392 1.00 32.99 N ATOM 619 CA HIS A 879 12.973 39.482 -8.108 1.00 32.84 C ATOM 620 C HIS A 879 14.326 39.698 -7.438 1.00 32.46 C ATOM 621 O HIS A 879 14.935 40.758 -7.556 1.00 33.32 O ATOM 622 CB HIS A 879 13.039 39.938 -9.572 1.00 34.99 C ATOM 623 CG HIS A 879 11.800 39.629 -10.356 1.00 37.66 C ATOM 624 ND1 HIS A 879 10.917 40.603 -10.771 1.00 40.34 N ATOM 625 CD2 HIS A 879 11.291 38.451 -10.789 1.00 36.97 C ATOM 626 CE1 HIS A 879 9.922 40.039 -11.432 1.00 39.90 C ATOM 627 NE2 HIS A 879 10.123 38.734 -11.454 1.00 37.78 N ATOM 628 H HIS A 879 12.085 41.189 -7.117 1.00 0.00 H ATOM 629 N SER A 880 14.798 38.677 -6.740 1.00 32.68 N ATOM 630 CA SER A 880 16.031 38.776 -5.966 1.00 33.12 C ATOM 631 C SER A 880 16.568 37.387 -5.704 1.00 32.60 C ATOM 632 O SER A 880 15.798 36.445 -5.540 1.00 30.93 O ATOM 633 CB SER A 880 15.766 39.486 -4.634 1.00 32.10 C ATOM 634 OG SER A 880 16.826 39.280 -3.715 1.00 33.92 O ATOM 635 HG SER A 880 17.667 39.635 -4.098 1.00 0.00 H ATOM 636 H SER A 880 14.275 37.778 -6.743 1.00 0.00 H ATOM 637 N ASP A 881 17.891 37.268 -5.651 1.00 34.84 N ATOM 638 CA ASP A 881 18.538 36.000 -5.329 1.00 36.33 C ATOM 639 C ASP A 881 18.210 35.532 -3.912 1.00 34.59 C ATOM 640 O ASP A 881 18.368 34.356 -3.614 1.00 34.01 O ATOM 641 CB ASP A 881 20.065 36.117 -5.459 1.00 41.61 C ATOM 642 CG ASP A 881 20.531 36.254 -6.898 1.00 47.14 C ATOM 643 OD1 ASP A 881 19.739 36.714 -7.748 1.00 51.50 O ATOM 644 OD2 ASP A 881 21.702 35.907 -7.174 1.00 55.02 O ATOM 645 H ASP A 881 18.482 38.102 -5.844 1.00 0.00 H ATOM 646 N PHE A 882 17.774 36.449 -3.046 1.00 34.75 N ATOM 647 CA PHE A 882 17.567 36.155 -1.622 1.00 34.74 C ATOM 648 C PHE A 882 16.087 36.195 -1.198 1.00 33.91 C ATOM 649 O PHE A 882 15.771 36.342 -0.010 1.00 33.19 O ATOM 650 CB PHE A 882 18.411 37.119 -0.790 1.00 35.36 C ATOM 651 CG PHE A 882 19.823 37.256 -1.292 1.00 36.64 C ATOM 652 CD1 PHE A 882 20.713 36.196 -1.184 1.00 37.95 C ATOM 653 CD2 PHE A 882 20.253 38.425 -1.904 1.00 37.89 C ATOM 654 CE1 PHE A 882 22.014 36.306 -1.660 1.00 38.13 C ATOM 655 CE2 PHE A 882 21.551 38.540 -2.378 1.00 40.81 C ATOM 656 CZ PHE A 882 22.430 37.481 -2.256 1.00 38.49 C ATOM 657 H PHE A 882 17.573 37.409 -3.393 1.00 0.00 H ATOM 658 N ILE A 883 15.193 36.044 -2.176 1.00 33.00 N ATOM 659 CA ILE A 883 13.752 35.917 -1.934 1.00 32.68 C ATOM 660 C ILE A 883 13.228 34.725 -2.737 1.00 32.11 C ATOM 661 O ILE A 883 13.551 34.596 -3.921 1.00 30.57 O ATOM 662 CB ILE A 883 13.010 37.206 -2.338 1.00 32.00 C ATOM 663 CG1 ILE A 883 13.379 38.329 -1.364 1.00 33.98 C ATOM 664 CG2 ILE A 883 11.504 36.981 -2.356 1.00 31.21 C ATOM 665 CD1 ILE A 883 12.921 39.699 -1.791 1.00 34.46 C ATOM 666 H ILE A 883 15.534 36.015 -3.158 1.00 0.00 H ATOM 667 N VAL A 884 12.422 33.866 -2.103 1.00 32.81 N ATOM 668 CA VAL A 884 11.928 32.646 -2.772 1.00 32.53 C ATOM 669 C VAL A 884 11.327 33.019 -4.109 1.00 31.50 C ATOM 670 O VAL A 884 10.602 34.008 -4.218 1.00 31.29 O ATOM 671 CB VAL A 884 10.812 31.870 -2.016 1.00 32.85 C ATOM 672 CG1 VAL A 884 10.866 30.387 -2.392 1.00 34.22 C ATOM 673 CG2 VAL A 884 10.925 32.011 -0.539 1.00 38.00 C ATOM 674 H VAL A 884 12.138 34.061 -1.122 1.00 0.00 H ATOM 675 N LYS A 885 11.615 32.213 -5.119 1.00 31.84 N ATOM 676 CA LYS A 885 11.155 32.503 -6.464 1.00 33.34 C ATOM 677 C LYS A 885 9.705 32.038 -6.631 1.00 31.93 C ATOM 678 O LYS A 885 9.354 30.906 -6.286 1.00 30.74 O ATOM 679 CB LYS A 885 12.076 31.840 -7.495 1.00 34.51 C ATOM 680 CG LYS A 885 12.564 32.775 -8.596 1.00 40.55 C ATOM 681 CD LYS A 885 13.885 32.296 -9.197 1.00 42.01 C ATOM 682 CE LYS A 885 13.675 31.091 -10.104 1.00 48.35 C ATOM 683 NZ LYS A 885 14.950 30.583 -10.694 1.00 51.26 N ATOM 684 HZ1 LYS A 885 15.392 31.335 -11.260 1.00 0.00 H ATOM 685 HZ2 LYS A 885 15.595 30.298 -9.930 1.00 0.00 H ATOM 686 HZ3 LYS A 885 14.747 29.764 -11.302 1.00 0.00 H ATOM 687 H LYS A 885 12.180 31.358 -4.945 1.00 0.00 H ATOM 688 N TYR A 886 8.867 32.950 -7.112 1.00 30.83 N ATOM 689 CA TYR A 886 7.548 32.615 -7.631 1.00 31.58 C ATOM 690 C TYR A 886 7.729 31.861 -8.935 1.00 32.99 C ATOM 691 O TYR A 886 8.613 32.190 -9.733 1.00 33.47 O ATOM 692 CB TYR A 886 6.758 33.901 -7.883 1.00 30.65 C ATOM 693 CG TYR A 886 5.448 33.759 -8.633 1.00 32.01 C ATOM 694 CD1 TYR A 886 4.247 33.565 -7.950 1.00 31.14 C ATOM 695 CD2 TYR A 886 5.398 33.881 -10.021 1.00 32.68 C ATOM 696 CE1 TYR A 886 3.039 33.469 -8.627 1.00 32.33 C ATOM 697 CE2 TYR A 886 4.187 33.786 -10.711 1.00 33.54 C ATOM 698 CZ TYR A 886 3.015 33.582 -10.006 1.00 34.15 C ATOM 699 OH TYR A 886 1.820 33.481 -10.677 1.00 35.68 O ATOM 700 HH TYR A 886 1.088 33.337 -10.026 1.00 0.00 H ATOM 701 H TYR A 886 9.166 33.946 -7.118 1.00 0.00 H ATOM 702 N ARG A 887 6.898 30.846 -9.150 1.00 34.07 N ATOM 703 CA ARG A 887 6.899 30.124 -10.417 1.00 36.01 C ATOM 704 C ARG A 887 5.538 30.125 -11.120 1.00 37.18 C ATOM 705 O ARG A 887 5.478 30.132 -12.350 1.00 39.15 O ATOM 706 CB ARG A 887 7.444 28.708 -10.212 1.00 36.49 C ATOM 707 CG ARG A 887 8.975 28.695 -10.109 1.00 37.73 C ATOM 708 CD ARG A 887 9.577 27.312 -10.222 1.00 41.04 C ATOM 709 NE ARG A 887 9.057 26.558 -11.365 1.00 46.64 N ATOM 710 CZ ARG A 887 9.383 25.297 -11.638 1.00 46.23 C ATOM 711 NH1 ARG A 887 10.252 24.643 -10.873 1.00 46.17 N ATOM 712 NH2 ARG A 887 8.845 24.692 -12.691 1.00 51.67 N ATOM 713 HE ARG A 887 8.391 27.038 -12.003 1.00 0.00 H ATOM 714 HH12 ARG A 887 10.501 23.658 -11.094 1.00 0.00 H ATOM 715 HH11 ARG A 887 10.683 25.117 -10.054 1.00 0.00 H ATOM 716 HH22 ARG A 887 9.096 23.707 -12.909 1.00 0.00 H ATOM 717 HH21 ARG A 887 8.173 25.204 -13.297 1.00 0.00 H ATOM 718 H ARG A 887 6.235 30.562 -8.401 1.00 0.00 H ATOM 719 N GLY A 888 4.449 30.122 -10.360 1.00 36.18 N ATOM 720 CA GLY A 888 3.125 30.218 -10.959 1.00 37.58 C ATOM 721 C GLY A 888 1.988 29.901 -10.008 1.00 37.64 C ATOM 722 O GLY A 888 2.157 29.908 -8.786 1.00 35.85 O ATOM 723 H GLY A 888 4.543 30.050 -9.327 1.00 0.00 H ATOM 724 N VAL A 889 0.826 29.619 -10.592 1.00 39.88 N ATOM 725 CA VAL A 889 -0.379 29.299 -9.842 1.00 41.65 C ATOM 726 C VAL A 889 -1.080 28.091 -10.453 1.00 45.01 C ATOM 727 O VAL A 889 -0.916 27.800 -11.641 1.00 45.48 O ATOM 728 CB VAL A 889 -1.367 30.494 -9.800 1.00 42.09 C ATOM 729 CG1 VAL A 889 -0.773 31.646 -9.015 1.00 39.68 C ATOM 730 CG2 VAL A 889 -1.760 30.949 -11.213 1.00 43.79 C ATOM 731 H VAL A 889 0.777 29.628 -11.631 1.00 0.00 H ATOM 732 N SER A 890 -1.861 27.395 -9.633 1.00 47.28 N ATOM 733 CA SER A 890 -2.655 26.268 -10.099 1.00 51.15 C ATOM 734 C SER A 890 -4.126 26.471 -9.744 1.00 54.39 C ATOM 735 O SER A 890 -4.461 26.740 -8.587 1.00 53.06 O ATOM 736 CB SER A 890 -2.136 24.958 -9.498 1.00 50.83 C ATOM 737 OG SER A 890 -2.807 23.837 -10.059 1.00 54.82 O ATOM 738 HG SER A 890 -2.656 23.819 -11.037 1.00 0.00 H ATOM 739 H SER A 890 -1.906 27.664 -8.629 1.00 0.00 H ATOM 740 N TYR A 891 -4.989 26.352 -10.755 1.00 59.12 N ATOM 741 CA TYR A 891 -6.437 26.410 -10.576 1.00 63.03 C ATOM 742 C TYR A 891 -6.992 24.994 -10.510 1.00 65.97 C ATOM 743 O TYR A 891 -8.064 24.766 -9.959 1.00 68.93 O ATOM 744 CB TYR A 891 -7.096 27.156 -11.733 1.00 67.54 C ATOM 745 CG TYR A 891 -6.602 28.573 -11.934 1.00 66.50 C ATOM 746 CD1 TYR A 891 -6.686 29.512 -10.909 1.00 66.08 C ATOM 747 CD2 TYR A 891 -6.076 28.984 -13.159 1.00 68.71 C ATOM 748 CE1 TYR A 891 -6.241 30.823 -11.093 1.00 65.21 C ATOM 749 CE2 TYR A 891 -5.631 30.292 -13.354 1.00 67.08 C ATOM 750 CZ TYR A 891 -5.717 31.207 -12.315 1.00 65.97 C ATOM 751 OH TYR A 891 -5.282 32.504 -12.490 1.00 64.15 O ATOM 752 HH TYR A 891 -5.418 33.012 -11.652 1.00 0.00 H ATOM 753 H TYR A 891 -4.613 26.212 -11.714 1.00 0.00 H TER 754 TYR A 891 ATOM 755 N GLN A 896 -11.380 24.841 -9.308 1.00 81.96 N ATOM 756 CA GLN A 896 -11.981 26.057 -8.767 1.00 82.43 C ATOM 757 C GLN A 896 -11.373 26.418 -7.402 1.00 79.79 C ATOM 758 O GLN A 896 -12.088 26.566 -6.406 1.00 82.58 O ATOM 759 CB GLN A 896 -13.496 25.877 -8.652 1.00 88.16 C ATOM 760 CG GLN A 896 -14.272 27.191 -8.541 1.00 90.22 C ATOM 761 CD GLN A 896 -15.676 27.014 -7.989 1.00 94.88 C ATOM 762 OE1 GLN A 896 -16.019 25.961 -7.447 1.00 96.41 O ATOM 763 NE2 GLN A 896 -16.495 28.052 -8.120 1.00 96.40 N ATOM 764 HE22 GLN A 896 -16.163 28.921 -8.585 1.00 0.00 H ATOM 765 HE21 GLN A 896 -17.468 27.995 -7.758 1.00 0.00 H ATOM 766 HN3 GLN A 896 -11.546 24.052 -8.651 1.00 0.00 H ATOM 767 HN2 GLN A 896 -10.357 24.985 -9.427 1.00 0.00 H ATOM 768 HN1 GLN A 896 -11.811 24.623 -10.229 1.00 0.00 H ATOM 769 N SER A 897 -10.048 26.566 -7.373 1.00 74.23 N ATOM 770 CA SER A 897 -9.308 26.791 -6.129 1.00 70.61 C ATOM 771 C SER A 897 -7.869 27.247 -6.415 1.00 66.09 C ATOM 772 O SER A 897 -7.150 26.612 -7.192 1.00 65.91 O ATOM 773 CB SER A 897 -9.283 25.511 -5.292 1.00 71.83 C ATOM 774 OG SER A 897 -8.654 25.737 -4.045 1.00 72.28 O ATOM 775 HG SER A 897 -8.650 24.897 -3.522 1.00 0.00 H ATOM 776 H SER A 897 -9.520 26.520 -8.268 1.00 0.00 H ATOM 777 N LEU A 898 -7.448 28.321 -5.753 1.00 61.37 N ATOM 778 CA LEU A 898 -6.199 29.003 -6.080 1.00 56.23 C ATOM 779 C LEU A 898 -5.029 28.503 -5.232 1.00 52.18 C ATOM 780 O LEU A 898 -5.081 28.562 -4.003 1.00 52.04 O ATOM 781 CB LEU A 898 -6.384 30.505 -5.869 1.00 56.10 C ATOM 782 CG LEU A 898 -5.259 31.441 -6.307 1.00 53.70 C ATOM 783 CD1 LEU A 898 -5.064 31.385 -7.815 1.00 52.86 C ATOM 784 CD2 LEU A 898 -5.574 32.852 -5.857 1.00 52.96 C ATOM 785 H LEU A 898 -8.030 28.689 -4.973 1.00 0.00 H ATOM 786 N ARG A 899 -3.980 28.018 -5.898 1.00 48.70 N ATOM 787 CA ARG A 899 -2.768 27.526 -5.232 1.00 45.45 C ATOM 788 C ARG A 899 -1.548 28.284 -5.761 1.00 40.98 C ATOM 789 O ARG A 899 -1.501 28.651 -6.935 1.00 39.64 O ATOM 790 CB ARG A 899 -2.585 26.022 -5.466 1.00 45.59 C ATOM 791 CG ARG A 899 -3.770 25.149 -5.042 1.00 50.67 C ATOM 792 CD ARG A 899 -3.532 23.672 -5.372 1.00 52.53 C ATOM 793 NE ARG A 899 -2.562 23.054 -4.466 1.00 55.40 N ATOM 794 CZ ARG A 899 -1.990 21.863 -4.656 1.00 55.90 C ATOM 795 NH1 ARG A 899 -2.267 21.136 -5.732 1.00 57.18 N ATOM 796 NH2 ARG A 899 -1.120 21.401 -3.763 1.00 53.77 N ATOM 797 HE ARG A 899 -2.299 23.583 -3.610 1.00 0.00 H ATOM 798 HH12 ARG A 899 -1.813 20.210 -5.865 1.00 0.00 H ATOM 799 HH11 ARG A 899 -2.938 21.493 -6.442 1.00 0.00 H ATOM 800 HH22 ARG A 899 -0.671 20.474 -3.906 1.00 0.00 H ATOM 801 HH21 ARG A 899 -0.888 21.967 -2.922 1.00 0.00 H ATOM 802 H ARG A 899 -4.023 27.987 -6.937 1.00 0.00 H ATOM 803 N LEU A 900 -0.567 28.509 -4.886 1.00 38.18 N ATOM 804 CA LEU A 900 0.644 29.268 -5.220 1.00 35.72 C ATOM 805 C LEU A 900 1.851 28.335 -5.365 1.00 33.84 C ATOM 806 O LEU A 900 2.264 27.710 -4.389 1.00 32.51 O ATOM 807 CB LEU A 900 0.922 30.315 -4.132 1.00 34.97 C ATOM 808 CG LEU A 900 2.295 31.000 -4.117 1.00 33.42 C ATOM 809 CD1 LEU A 900 2.586 31.678 -5.442 1.00 32.36 C ATOM 810 CD2 LEU A 900 2.371 32.008 -2.972 1.00 32.45 C ATOM 811 H LEU A 900 -0.665 28.129 -3.923 1.00 0.00 H ATOM 812 N VAL A 901 2.416 28.266 -6.573 1.00 32.12 N ATOM 813 CA VAL A 901 3.559 27.399 -6.858 1.00 31.95 C ATOM 814 C VAL A 901 4.876 28.181 -6.773 1.00 30.16 C ATOM 815 O VAL A 901 5.050 29.205 -7.439 1.00 29.89 O ATOM 816 CB VAL A 901 3.434 26.744 -8.262 1.00 33.15 C ATOM 817 CG1 VAL A 901 4.592 25.787 -8.521 1.00 32.37 C ATOM 818 CG2 VAL A 901 2.114 26.007 -8.388 1.00 33.91 C ATOM 819 H VAL A 901 2.028 28.851 -7.341 1.00 0.00 H ATOM 820 N MET A 902 5.797 27.679 -5.952 1.00 29.66 N ATOM 821 CA MET A 902 7.107 28.298 -5.743 1.00 29.24 C ATOM 822 C MET A 902 8.208 27.257 -5.943 1.00 30.33 C ATOM 823 O MET A 902 7.964 26.048 -5.834 1.00 31.82 O ATOM 824 CB MET A 902 7.204 28.861 -4.322 1.00 28.50 C ATOM 825 CG MET A 902 6.177 29.940 -3.975 1.00 28.41 C ATOM 826 SD MET A 902 6.027 30.243 -2.191 1.00 30.01 S ATOM 827 CE MET A 902 5.197 28.757 -1.637 1.00 27.48 C ATOM 828 H MET A 902 5.575 26.805 -5.434 1.00 0.00 H ATOM 829 N GLU A 903 9.420 27.723 -6.234 1.00 30.36 N ATOM 830 CA GLU A 903 10.586 26.838 -6.291 1.00 31.17 C ATOM 831 C GLU A 903 10.743 26.104 -4.958 1.00 30.68 C ATOM 832 O GLU A 903 10.418 26.650 -3.914 1.00 28.87 O ATOM 833 CB GLU A 903 11.868 27.625 -6.611 1.00 31.22 C ATOM 834 CG GLU A 903 12.265 28.664 -5.556 1.00 32.95 C ATOM 835 CD GLU A 903 13.654 29.253 -5.764 1.00 33.50 C ATOM 836 OE1 GLU A 903 14.397 28.777 -6.649 1.00 39.07 O ATOM 837 OE2 GLU A 903 14.001 30.205 -5.031 1.00 33.05 O ATOM 838 H GLU A 903 9.542 28.738 -6.425 1.00 0.00 H ATOM 839 N TYR A 904 11.234 24.869 -5.004 1.00 32.42 N ATOM 840 CA TYR A 904 11.500 24.099 -3.791 1.00 32.57 C ATOM 841 C TYR A 904 12.972 24.215 -3.388 1.00 33.28 C ATOM 842 O TYR A 904 13.868 23.915 -4.176 1.00 35.13 O ATOM 843 CB TYR A 904 11.126 22.629 -3.988 1.00 32.95 C ATOM 844 CG TYR A 904 11.383 21.778 -2.760 1.00 33.61 C ATOM 845 CD1 TYR A 904 10.773 22.077 -1.543 1.00 31.42 C ATOM 846 CD2 TYR A 904 12.230 20.676 -2.816 1.00 33.00 C ATOM 847 CE1 TYR A 904 11.003 21.301 -0.414 1.00 33.71 C ATOM 848 CE2 TYR A 904 12.463 19.895 -1.697 1.00 34.80 C ATOM 849 CZ TYR A 904 11.850 20.213 -0.497 1.00 34.10 C ATOM 850 OH TYR A 904 12.088 19.439 0.613 1.00 34.93 O ATOM 851 HH TYR A 904 11.577 19.799 1.381 1.00 0.00 H ATOM 852 H TYR A 904 11.434 24.439 -5.930 1.00 0.00 H ATOM 853 N LEU A 905 13.205 24.657 -2.156 1.00 40.22 N ATOM 854 CA LEU A 905 14.546 24.742 -1.582 1.00 38.81 C ATOM 855 C LEU A 905 14.755 23.532 -0.663 1.00 40.54 C ATOM 856 O LEU A 905 14.267 23.521 0.463 1.00 40.19 O ATOM 857 CB LEU A 905 14.695 26.050 -0.809 1.00 37.20 C ATOM 858 CG LEU A 905 15.080 27.302 -1.610 1.00 36.34 C ATOM 859 CD1 LEU A 905 14.380 27.388 -2.952 1.00 38.32 C ATOM 860 CD2 LEU A 905 14.798 28.550 -0.786 1.00 34.67 C ATOM 861 H LEU A 905 12.396 24.956 -1.574 1.00 0.00 H ATOM 862 N PRO A 906 15.495 22.512 -1.135 1.00 43.11 N ATOM 863 CA PRO A 906 15.465 21.188 -0.499 1.00 44.58 C ATOM 864 C PRO A 906 16.162 21.071 0.859 1.00 43.78 C ATOM 865 O PRO A 906 15.902 20.120 1.593 1.00 46.17 O ATOM 866 CB PRO A 906 16.168 20.304 -1.526 1.00 46.22 C ATOM 867 CG PRO A 906 17.128 21.219 -2.186 1.00 45.20 C ATOM 868 CD PRO A 906 16.437 22.545 -2.269 1.00 43.73 C ATOM 869 N SER A 907 17.032 22.019 1.190 1.00 41.83 N ATOM 870 CA SER A 907 17.689 22.024 2.492 1.00 42.07 C ATOM 871 C SER A 907 16.753 22.550 3.581 1.00 41.83 C ATOM 872 O SER A 907 17.078 22.495 4.771 1.00 42.22 O ATOM 873 CB SER A 907 18.975 22.842 2.437 1.00 40.77 C ATOM 874 OG SER A 907 19.897 22.232 1.554 1.00 40.86 O ATOM 875 HG SER A 907 20.728 22.769 1.524 1.00 0.00 H ATOM 876 H SER A 907 17.249 22.773 0.507 1.00 0.00 H ATOM 877 N GLY A 908 15.602 23.074 3.164 1.00 41.00 N ATOM 878 CA GLY A 908 14.520 23.392 4.077 1.00 41.18 C ATOM 879 C GLY A 908 14.682 24.695 4.830 1.00 39.76 C ATOM 880 O GLY A 908 15.322 25.641 4.365 1.00 37.35 O ATOM 881 H GLY A 908 15.474 23.262 2.149 1.00 0.00 H ATOM 882 N CYS A 909 14.079 24.729 6.008 1.00 41.81 N ATOM 883 CA CYS A 909 14.038 25.917 6.837 1.00 40.02 C ATOM 884 C CYS A 909 15.395 26.141 7.494 1.00 39.03 C ATOM 885 O CYS A 909 16.078 25.182 7.847 1.00 39.90 O ATOM 886 CB CYS A 909 12.951 25.740 7.896 1.00 42.01 C ATOM 887 SG CYS A 909 12.722 27.128 8.973 1.00 46.64 S ATOM 888 H CYS A 909 13.614 23.865 6.354 1.00 0.00 H ATOM 889 N LEU A 910 15.776 27.408 7.650 1.00 36.88 N ATOM 890 CA LEU A 910 17.044 27.784 8.277 1.00 36.25 C ATOM 891 C LEU A 910 17.093 27.403 9.758 1.00 37.98 C ATOM 892 O LEU A 910 18.126 26.960 10.260 1.00 37.82 O ATOM 893 CB LEU A 910 17.264 29.290 8.141 1.00 34.61 C ATOM 894 CG LEU A 910 18.606 29.835 8.627 1.00 33.55 C ATOM 895 CD1 LEU A 910 19.733 29.343 7.736 1.00 32.54 C ATOM 896 CD2 LEU A 910 18.585 31.341 8.674 1.00 32.54 C ATOM 897 H LEU A 910 15.145 28.162 7.312 1.00 0.00 H ATOM 898 N ARG A 911 15.975 27.590 10.455 1.00 39.43 N ATOM 899 CA ARG A 911 15.873 27.232 11.864 1.00 41.23 C ATOM 900 C ARG A 911 16.345 25.799 12.087 1.00 42.59 C ATOM 901 O ARG A 911 17.244 25.556 12.888 1.00 43.52 O ATOM 902 CB ARG A 911 14.426 27.392 12.347 1.00 42.92 C ATOM 903 CG ARG A 911 14.214 27.143 13.843 1.00 44.83 C ATOM 904 CD ARG A 911 12.758 27.352 14.258 1.00 48.89 C ATOM 905 NE ARG A 911 11.952 26.142 14.070 1.00 56.11 N ATOM 906 CZ ARG A 911 11.255 25.833 12.974 1.00 58.45 C ATOM 907 NH1 ARG A 911 11.232 26.638 11.916 1.00 59.97 N ATOM 908 NH2 ARG A 911 10.568 24.698 12.934 1.00 60.42 N ATOM 909 HE ARG A 911 11.920 25.465 14.859 1.00 0.00 H ATOM 910 HH12 ARG A 911 10.681 26.375 11.074 1.00 0.00 H ATOM 911 HH11 ARG A 911 11.765 27.531 11.930 1.00 0.00 H ATOM 912 HH22 ARG A 911 10.023 24.450 12.084 1.00 0.00 H ATOM 913 HH21 ARG A 911 10.575 24.057 13.753 1.00 0.00 H ATOM 914 H ARG A 911 15.148 28.005 9.979 1.00 0.00 H ATOM 915 N ASP A 912 15.742 24.862 11.358 1.00 43.29 N ATOM 916 CA ASP A 912 16.085 23.444 11.469 1.00 44.82 C ATOM 917 C ASP A 912 17.503 23.163 10.968 1.00 43.20 C ATOM 918 O ASP A 912 18.243 22.383 11.574 1.00 42.64 O ATOM 919 CB ASP A 912 15.085 22.587 10.686 1.00 47.30 C ATOM 920 CG ASP A 912 13.655 22.751 11.181 1.00 51.23 C ATOM 921 OD1 ASP A 912 13.400 22.511 12.381 1.00 56.95 O ATOM 922 OD2 ASP A 912 12.783 23.116 10.366 1.00 54.97 O ATOM 923 H ASP A 912 15.001 25.148 10.686 1.00 0.00 H ATOM 924 N PHE A 913 17.868 23.806 9.861 1.00 40.54 N ATOM 925 CA PHE A 913 19.196 23.654 9.266 1.00 40.86 C ATOM 926 C PHE A 913 20.299 23.979 10.278 1.00 40.99 C ATOM 927 O PHE A 913 21.235 23.196 10.459 1.00 42.29 O ATOM 928 CB PHE A 913 19.327 24.556 8.031 1.00 38.56 C ATOM 929 CG PHE A 913 20.570 24.313 7.222 1.00 38.77 C ATOM 930 CD1 PHE A 913 20.598 23.321 6.255 1.00 39.86 C ATOM 931 CD2 PHE A 913 21.707 25.089 7.413 1.00 38.50 C ATOM 932 CE1 PHE A 913 21.742 23.100 5.499 1.00 41.41 C ATOM 933 CE2 PHE A 913 22.860 24.870 6.657 1.00 38.01 C ATOM 934 CZ PHE A 913 22.877 23.876 5.705 1.00 38.36 C ATOM 935 H PHE A 913 17.183 24.440 9.402 1.00 0.00 H ATOM 936 N LEU A 914 20.169 25.125 10.944 1.00 39.66 N ATOM 937 CA LEU A 914 21.165 25.571 11.917 1.00 40.35 C ATOM 938 C LEU A 914 21.317 24.608 13.093 1.00 42.59 C ATOM 939 O LEU A 914 22.435 24.354 13.538 1.00 43.61 O ATOM 940 CB LEU A 914 20.830 26.973 12.429 1.00 39.11 C ATOM 941 CG LEU A 914 20.968 28.091 11.393 1.00 36.61 C ATOM 942 CD1 LEU A 914 20.348 29.378 11.907 1.00 36.63 C ATOM 943 CD2 LEU A 914 22.427 28.307 11.006 1.00 35.40 C ATOM 944 H LEU A 914 19.335 25.720 10.767 1.00 0.00 H ATOM 945 N GLN A 915 20.200 24.072 13.580 1.00 44.21 N ATOM 946 CA GLN A 915 20.220 23.093 14.670 1.00 46.88 C ATOM 947 C GLN A 915 20.875 21.787 14.236 1.00 49.06 C ATOM 948 O GLN A 915 21.641 21.192 14.991 1.00 51.12 O ATOM 949 CB GLN A 915 18.802 22.805 15.174 1.00 47.25 C ATOM 950 CG GLN A 915 18.132 23.986 15.857 1.00 46.99 C ATOM 951 CD GLN A 915 16.696 23.694 16.257 1.00 49.08 C ATOM 952 OE1 GLN A 915 15.760 24.310 15.749 1.00 48.86 O ATOM 953 NE2 GLN A 915 16.516 22.744 17.166 1.00 54.73 N ATOM 954 HE22 GLN A 915 17.336 22.248 17.570 1.00 0.00 H ATOM 955 HE21 GLN A 915 15.555 22.495 17.475 1.00 0.00 H ATOM 956 H GLN A 915 19.286 24.357 13.175 1.00 0.00 H ATOM 957 N ARG A 916 20.575 21.349 13.016 1.00 49.91 N ATOM 958 CA ARG A 916 21.095 20.083 12.504 1.00 51.84 C ATOM 959 C ARG A 916 22.603 20.141 12.242 1.00 50.78 C ATOM 960 O ARG A 916 23.349 19.287 12.719 1.00 51.30 O ATOM 961 CB ARG A 916 20.355 19.682 11.219 1.00 51.79 C ATOM 962 CG ARG A 916 20.582 18.235 10.797 1.00 55.18 C ATOM 963 CD ARG A 916 19.695 17.841 9.619 1.00 59.24 C ATOM 964 NE ARG A 916 18.268 17.897 9.944 1.00 64.56 N ATOM 965 CZ ARG A 916 17.609 16.991 10.672 1.00 68.53 C ATOM 966 NH1 ARG A 916 18.233 15.932 11.183 1.00 69.79 N ATOM 967 NH2 ARG A 916 16.309 17.152 10.899 1.00 69.47 N ATOM 968 HE ARG A 916 17.725 18.706 9.579 1.00 0.00 H ATOM 969 HH12 ARG A 916 17.702 15.238 11.747 1.00 0.00 H ATOM 970 HH11 ARG A 916 19.251 15.799 11.018 1.00 0.00 H ATOM 971 HH22 ARG A 916 15.789 16.451 11.465 1.00 0.00 H ATOM 972 HH21 ARG A 916 15.812 17.979 10.511 1.00 0.00 H ATOM 973 H ARG A 916 19.954 21.923 12.411 1.00 0.00 H ATOM 974 N HIS A 917 23.041 21.157 11.501 1.00 48.62 N ATOM 975 CA HIS A 917 24.422 21.232 11.017 1.00 48.98 C ATOM 976 C HIS A 917 25.277 22.236 11.777 1.00 48.61 C ATOM 977 O HIS A 917 26.214 22.792 11.215 1.00 48.45 O ATOM 978 CB HIS A 917 24.428 21.575 9.524 1.00 47.43 C ATOM 979 CG HIS A 917 23.587 20.655 8.699 1.00 46.91 C ATOM 980 ND1 HIS A 917 23.922 19.336 8.485 1.00 48.29 N ATOM 981 CD2 HIS A 917 22.413 20.856 8.057 1.00 45.02 C ATOM 982 CE1 HIS A 917 22.995 18.765 7.739 1.00 48.71 C ATOM 983 NE2 HIS A 917 22.068 19.666 7.465 1.00 48.99 N ATOM 984 H HIS A 917 22.381 21.923 11.258 1.00 0.00 H ATOM 985 N ARG A 918 24.970 22.443 13.055 1.00 50.16 N ATOM 986 CA ARG A 918 25.701 23.392 13.899 1.00 50.37 C ATOM 987 C ARG A 918 27.208 23.144 13.905 1.00 51.80 C ATOM 988 O ARG A 918 27.997 24.091 13.897 1.00 51.61 O ATOM 989 CB ARG A 918 25.171 23.331 15.337 1.00 51.95 C ATOM 990 CG ARG A 918 25.925 24.208 16.331 1.00 52.46 C ATOM 991 CD ARG A 918 25.205 24.284 17.678 1.00 54.90 C ATOM 992 NE ARG A 918 25.726 25.371 18.506 1.00 55.64 N ATOM 993 CZ ARG A 918 26.856 25.323 19.209 1.00 60.09 C ATOM 994 NH1 ARG A 918 27.605 24.227 19.214 1.00 63.35 N ATOM 995 NH2 ARG A 918 27.235 26.382 19.921 1.00 60.22 N ATOM 996 HE ARG A 918 25.171 26.250 18.549 1.00 0.00 H ATOM 997 HH12 ARG A 918 28.485 24.201 19.767 1.00 0.00 H ATOM 998 HH11 ARG A 918 27.311 23.394 18.665 1.00 0.00 H ATOM 999 HH22 ARG A 918 28.117 26.350 20.472 1.00 0.00 H ATOM 1000 HH21 ARG A 918 26.650 27.242 19.926 1.00 0.00 H ATOM 1001 H ARG A 918 24.180 21.910 13.471 1.00 0.00 H ATOM 1002 N ALA A 919 27.597 21.871 13.918 1.00 54.09 N ATOM 1003 CA ALA A 919 29.002 21.483 14.073 1.00 56.05 C ATOM 1004 C ALA A 919 29.899 21.933 12.918 1.00 55.40 C ATOM 1005 O ALA A 919 31.106 22.098 13.102 1.00 57.05 O ATOM 1006 CB ALA A 919 29.114 19.966 14.268 1.00 58.34 C ATOM 1007 H ALA A 919 26.879 21.126 13.815 1.00 0.00 H ATOM 1008 N ARG A 920 29.310 22.144 11.742 1.00 54.02 N ATOM 1009 CA ARG A 920 30.072 22.475 10.535 1.00 53.91 C ATOM 1010 C ARG A 920 29.745 23.872 9.985 1.00 50.95 C ATOM 1011 O ARG A 920 29.936 24.133 8.796 1.00 51.22 O ATOM 1012 CB ARG A 920 29.852 21.398 9.461 1.00 55.00 C ATOM 1013 CG ARG A 920 28.391 21.134 9.108 1.00 56.15 C ATOM 1014 CD ARG A 920 28.238 20.028 8.069 1.00 57.88 C ATOM 1015 NE ARG A 920 28.675 20.455 6.739 1.00 59.11 N ATOM 1016 CZ ARG A 920 29.839 20.140 6.168 1.00 61.39 C ATOM 1017 NH1 ARG A 920 30.113 20.600 4.953 1.00 61.51 N ATOM 1018 NH2 ARG A 920 30.729 19.364 6.783 1.00 62.40 N ATOM 1019 HE ARG A 920 28.023 21.054 6.193 1.00 0.00 H ATOM 1020 HH12 ARG A 920 31.017 20.361 4.498 1.00 0.00 H ATOM 1021 HH11 ARG A 920 29.423 21.199 4.456 1.00 0.00 H ATOM 1022 HH22 ARG A 920 31.629 19.134 6.316 1.00 0.00 H ATOM 1023 HH21 ARG A 920 30.524 18.988 7.731 1.00 0.00 H ATOM 1024 H ARG A 920 28.274 22.071 11.678 1.00 0.00 H ATOM 1025 N LEU A 921 29.281 24.771 10.852 1.00 49.12 N ATOM 1026 CA LEU A 921 28.953 26.144 10.455 1.00 46.82 C ATOM 1027 C LEU A 921 29.607 27.162 11.396 1.00 46.38 C ATOM 1028 O LEU A 921 29.059 27.478 12.455 1.00 47.07 O ATOM 1029 CB LEU A 921 27.436 26.350 10.459 1.00 45.61 C ATOM 1030 CG LEU A 921 26.584 25.528 9.491 1.00 47.07 C ATOM 1031 CD1 LEU A 921 25.119 25.608 9.899 1.00 47.59 C ATOM 1032 CD2 LEU A 921 26.756 25.995 8.058 1.00 47.98 C ATOM 1033 H LEU A 921 29.147 24.489 11.844 1.00 0.00 H ATOM 1034 N ASP A 922 30.772 27.675 11.007 1.00 45.74 N ATOM 1035 CA ASP A 922 31.483 28.678 11.814 1.00 45.16 C ATOM 1036 C ASP A 922 30.850 30.070 11.682 1.00 43.06 C ATOM 1037 O ASP A 922 29.867 30.251 10.957 1.00 41.53 O ATOM 1038 CB ASP A 922 32.985 28.707 11.472 1.00 46.19 C ATOM 1039 CG ASP A 922 33.267 28.959 9.992 1.00 47.00 C ATOM 1040 OD1 ASP A 922 34.318 28.478 9.514 1.00 49.78 O ATOM 1041 OD2 ASP A 922 32.459 29.625 9.308 1.00 44.31 O ATOM 1042 H ASP A 922 31.190 27.358 10.109 1.00 0.00 H ATOM 1043 N ALA A 923 31.418 31.043 12.392 1.00 42.61 N ATOM 1044 CA ALA A 923 30.920 32.422 12.393 1.00 40.71 C ATOM 1045 C ALA A 923 30.893 33.058 11.007 1.00 39.52 C ATOM 1046 O ALA A 923 29.983 33.824 10.686 1.00 37.99 O ATOM 1047 CB ALA A 923 31.761 33.277 13.333 1.00 41.29 C ATOM 1048 H ALA A 923 32.251 30.815 12.971 1.00 0.00 H ATOM 1049 N SER A 924 31.905 32.756 10.198 1.00 40.98 N ATOM 1050 CA SER A 924 32.006 33.304 8.850 1.00 40.34 C ATOM 1051 C SER A 924 30.794 32.932 8.006 1.00 38.63 C ATOM 1052 O SER A 924 30.307 33.741 7.222 1.00 37.59 O ATOM 1053 CB SER A 924 33.285 32.814 8.170 1.00 41.82 C ATOM 1054 OG SER A 924 34.429 33.197 8.918 1.00 47.32 O ATOM 1055 HG SER A 924 35.245 32.871 8.462 1.00 0.00 H ATOM 1056 H SER A 924 32.646 32.110 10.537 1.00 0.00 H ATOM 1057 N ARG A 925 30.309 31.709 8.179 1.00 39.12 N ATOM 1058 CA ARG A 925 29.163 31.230 7.429 1.00 38.06 C ATOM 1059 C ARG A 925 27.862 31.848 7.935 1.00 36.59 C ATOM 1060 O ARG A 925 26.956 32.118 7.146 1.00 36.09 O ATOM 1061 CB ARG A 925 29.101 29.699 7.481 1.00 40.20 C ATOM 1062 CG ARG A 925 27.940 29.071 6.724 1.00 41.21 C ATOM 1063 CD ARG A 925 27.936 29.413 5.239 1.00 47.02 C ATOM 1064 NE ARG A 925 28.755 28.484 4.459 1.00 51.33 N ATOM 1065 CZ ARG A 925 29.983 28.729 4.008 1.00 54.55 C ATOM 1066 NH1 ARG A 925 30.615 27.796 3.304 1.00 56.20 N ATOM 1067 NH2 ARG A 925 30.588 29.891 4.245 1.00 58.41 N ATOM 1068 HE ARG A 925 28.343 27.555 4.239 1.00 0.00 H ATOM 1069 HH12 ARG A 925 31.575 27.976 2.946 1.00 0.00 H ATOM 1070 HH11 ARG A 925 30.150 26.886 3.111 1.00 0.00 H ATOM 1071 HH22 ARG A 925 31.548 30.061 3.883 1.00 0.00 H ATOM 1072 HH21 ARG A 925 30.101 30.629 4.792 1.00 0.00 H ATOM 1073 H ARG A 925 30.762 31.077 8.870 1.00 0.00 H ATOM 1074 N LEU A 926 27.766 32.074 9.242 1.00 36.07 N ATOM 1075 CA LEU A 926 26.605 32.757 9.804 1.00 34.91 C ATOM 1076 C LEU A 926 26.534 34.192 9.298 1.00 33.86 C ATOM 1077 O LEU A 926 25.457 34.676 8.952 1.00 32.52 O ATOM 1078 CB LEU A 926 26.634 32.739 11.333 1.00 35.26 C ATOM 1079 CG LEU A 926 26.597 31.360 11.993 1.00 35.32 C ATOM 1080 CD1 LEU A 926 26.731 31.513 13.489 1.00 35.70 C ATOM 1081 CD2 LEU A 926 25.322 30.600 11.641 1.00 35.51 C ATOM 1082 H LEU A 926 28.530 31.759 9.873 1.00 0.00 H ATOM 1083 N LEU A 927 27.680 34.867 9.254 1.00 34.85 N ATOM 1084 CA LEU A 927 27.748 36.219 8.686 1.00 34.91 C ATOM 1085 C LEU A 927 27.305 36.241 7.230 1.00 33.41 C ATOM 1086 O LEU A 927 26.652 37.193 6.794 1.00 32.53 O ATOM 1087 CB LEU A 927 29.159 36.812 8.800 1.00 37.11 C ATOM 1088 CG LEU A 927 29.426 37.692 10.025 1.00 40.46 C ATOM 1089 CD1 LEU A 927 30.915 37.993 10.146 1.00 44.71 C ATOM 1090 CD2 LEU A 927 28.625 38.985 9.945 1.00 40.45 C ATOM 1091 H LEU A 927 28.545 34.428 9.630 1.00 0.00 H ATOM 1092 N LEU A 928 27.658 35.196 6.483 1.00 33.25 N ATOM 1093 CA LEU A 928 27.248 35.090 5.081 1.00 33.52 C ATOM 1094 C LEU A 928 25.722 35.066 4.951 1.00 31.96 C ATOM 1095 O LEU A 928 25.169 35.716 4.068 1.00 30.97 O ATOM 1096 CB LEU A 928 27.857 33.854 4.414 1.00 33.06 C ATOM 1097 CG LEU A 928 27.339 33.504 3.015 1.00 34.62 C ATOM 1098 CD1 LEU A 928 27.536 34.646 2.018 1.00 36.05 C ATOM 1099 CD2 LEU A 928 28.029 32.258 2.525 1.00 37.27 C ATOM 1100 H LEU A 928 28.236 34.441 6.904 1.00 0.00 H ATOM 1101 N TYR A 929 25.059 34.315 5.830 1.00 31.24 N ATOM 1102 CA TYR A 929 23.597 34.255 5.845 1.00 30.78 C ATOM 1103 C TYR A 929 23.014 35.617 6.222 1.00 30.40 C ATOM 1104 O TYR A 929 22.092 36.102 5.568 1.00 30.31 O ATOM 1105 CB TYR A 929 23.084 33.175 6.815 1.00 29.32 C ATOM 1106 CG TYR A 929 23.568 31.753 6.548 1.00 29.39 C ATOM 1107 CD1 TYR A 929 23.909 31.321 5.261 1.00 29.67 C ATOM 1108 CD2 TYR A 929 23.656 30.830 7.589 1.00 30.14 C ATOM 1109 CE1 TYR A 929 24.339 30.007 5.030 1.00 30.38 C ATOM 1110 CE2 TYR A 929 24.084 29.524 7.370 1.00 30.81 C ATOM 1111 CZ TYR A 929 24.424 29.113 6.091 1.00 32.20 C ATOM 1112 OH TYR A 929 24.849 27.813 5.882 1.00 31.15 O ATOM 1113 HH TYR A 929 25.051 27.683 4.921 1.00 0.00 H ATOM 1114 H TYR A 929 25.595 33.756 6.524 1.00 0.00 H ATOM 1115 N SER A 930 23.566 36.223 7.272 1.00 31.36 N ATOM 1116 CA SER A 930 23.153 37.555 7.735 1.00 30.55 C ATOM 1117 C SER A 930 23.196 38.575 6.603 1.00 29.67 C ATOM 1118 O SER A 930 22.261 39.340 6.409 1.00 30.39 O ATOM 1119 CB SER A 930 24.075 38.035 8.859 1.00 30.99 C ATOM 1120 OG SER A 930 24.279 37.018 9.823 1.00 36.99 O ATOM 1121 HG SER A 930 24.693 36.231 9.388 1.00 0.00 H ATOM 1122 H SER A 930 24.324 35.731 7.787 1.00 0.00 H ATOM 1123 N SER A 931 24.305 38.576 5.875 1.00 29.90 N ATOM 1124 CA SER A 931 24.507 39.461 4.736 1.00 29.32 C ATOM 1125 C SER A 931 23.495 39.210 3.613 1.00 28.72 C ATOM 1126 O SER A 931 22.981 40.157 3.016 1.00 29.87 O ATOM 1127 CB SER A 931 25.928 39.282 4.204 1.00 29.21 C ATOM 1128 OG SER A 931 26.083 39.903 2.945 1.00 33.73 O ATOM 1129 HG SER A 931 27.011 39.771 2.625 1.00 0.00 H ATOM 1130 H SER A 931 25.066 37.914 6.129 1.00 0.00 H ATOM 1131 N GLN A 932 23.216 37.941 3.328 1.00 28.66 N ATOM 1132 CA GLN A 932 22.282 37.575 2.260 1.00 28.39 C ATOM 1133 C GLN A 932 20.858 37.993 2.591 1.00 28.56 C ATOM 1134 O GLN A 932 20.133 38.481 1.724 1.00 28.71 O ATOM 1135 CB GLN A 932 22.331 36.074 2.002 1.00 28.49 C ATOM 1136 CG GLN A 932 23.590 35.627 1.283 1.00 29.06 C ATOM 1137 CD GLN A 932 23.694 34.123 1.149 1.00 29.43 C ATOM 1138 OE1 GLN A 932 22.938 33.377 1.766 1.00 30.66 O ATOM 1139 NE2 GLN A 932 24.640 33.670 0.342 1.00 26.30 N ATOM 1140 HE22 GLN A 932 25.258 34.338 -0.161 1.00 0.00 H ATOM 1141 HE21 GLN A 932 24.765 32.646 0.211 1.00 0.00 H ATOM 1142 H GLN A 932 23.674 37.187 3.879 1.00 0.00 H ATOM 1143 N ILE A 933 20.470 37.799 3.849 1.00 28.94 N ATOM 1144 CA ILE A 933 19.165 38.232 4.348 1.00 28.81 C ATOM 1145 C ILE A 933 19.079 39.757 4.319 1.00 28.53 C ATOM 1146 O ILE A 933 18.089 40.324 3.864 1.00 28.77 O ATOM 1147 CB ILE A 933 18.916 37.703 5.784 1.00 28.68 C ATOM 1148 CG1 ILE A 933 18.818 36.172 5.773 1.00 28.48 C ATOM 1149 CG2 ILE A 933 17.636 38.290 6.374 1.00 29.66 C ATOM 1150 CD1 ILE A 933 19.134 35.524 7.106 1.00 30.99 C ATOM 1151 H ILE A 933 21.121 37.320 4.504 1.00 0.00 H ATOM 1152 N CYS A 934 20.133 40.412 4.792 1.00 29.42 N ATOM 1153 CA CYS A 934 20.214 41.874 4.770 1.00 29.34 C ATOM 1154 C CYS A 934 20.000 42.435 3.360 1.00 28.60 C ATOM 1155 O CYS A 934 19.274 43.409 3.182 1.00 27.90 O ATOM 1156 CB CYS A 934 21.561 42.332 5.330 1.00 28.63 C ATOM 1157 SG CYS A 934 21.692 44.096 5.627 1.00 33.46 S ATOM 1158 H CYS A 934 20.926 39.870 5.191 1.00 0.00 H ATOM 1159 N LYS A 935 20.626 41.809 2.365 1.00 29.56 N ATOM 1160 CA LYS A 935 20.463 42.208 0.957 1.00 30.46 C ATOM 1161 C LYS A 935 19.061 41.917 0.424 1.00 29.84 C ATOM 1162 O LYS A 935 18.524 42.685 -0.376 1.00 30.44 O ATOM 1163 CB LYS A 935 21.502 41.518 0.067 1.00 31.58 C ATOM 1164 CG LYS A 935 22.788 42.293 -0.073 1.00 33.57 C ATOM 1165 CD LYS A 935 23.940 41.391 -0.468 1.00 35.78 C ATOM 1166 CE LYS A 935 25.217 42.189 -0.681 1.00 37.37 C ATOM 1167 NZ LYS A 935 26.413 41.406 -0.280 1.00 42.91 N ATOM 1168 HZ1 LYS A 935 26.341 41.157 0.727 1.00 0.00 H ATOM 1169 HZ2 LYS A 935 26.465 40.538 -0.850 1.00 0.00 H ATOM 1170 HZ3 LYS A 935 27.268 41.977 -0.437 1.00 0.00 H ATOM 1171 H LYS A 935 21.252 41.010 2.591 1.00 0.00 H ATOM 1172 N GLY A 936 18.481 40.800 0.856 1.00 29.30 N ATOM 1173 CA GLY A 936 17.084 40.496 0.564 1.00 29.41 C ATOM 1174 C GLY A 936 16.160 41.547 1.152 1.00 29.13 C ATOM 1175 O GLY A 936 15.215 41.991 0.496 1.00 29.30 O ATOM 1176 H GLY A 936 19.039 40.125 1.417 1.00 0.00 H ATOM 1177 N MET A 937 16.443 41.956 2.386 1.00 28.44 N ATOM 1178 CA MET A 937 15.628 42.960 3.063 1.00 29.39 C ATOM 1179 C MET A 937 15.827 44.345 2.478 1.00 29.43 C ATOM 1180 O MET A 937 14.873 45.112 2.360 1.00 30.30 O ATOM 1181 CB MET A 937 15.911 42.977 4.568 1.00 29.06 C ATOM 1182 CG MET A 937 15.338 41.777 5.308 1.00 29.53 C ATOM 1183 SD MET A 937 13.600 41.473 4.932 1.00 31.38 S ATOM 1184 CE MET A 937 12.831 42.848 5.771 1.00 33.64 C ATOM 1185 H MET A 937 17.264 41.551 2.880 1.00 0.00 H ATOM 1186 N GLU A 938 17.061 44.669 2.114 1.00 30.81 N ATOM 1187 CA GLU A 938 17.339 45.933 1.436 1.00 31.79 C ATOM 1188 C GLU A 938 16.515 46.058 0.156 1.00 31.67 C ATOM 1189 O GLU A 938 16.019 47.139 -0.162 1.00 34.01 O ATOM 1190 CB GLU A 938 18.822 46.053 1.104 1.00 31.52 C ATOM 1191 CG GLU A 938 19.216 47.416 0.565 1.00 34.35 C ATOM 1192 CD GLU A 938 20.707 47.543 0.313 1.00 38.42 C ATOM 1193 OE1 GLU A 938 21.163 48.682 0.063 1.00 45.66 O ATOM 1194 OE2 GLU A 938 21.421 46.512 0.361 1.00 42.27 O ATOM 1195 H GLU A 938 17.843 44.013 2.314 1.00 0.00 H ATOM 1196 N TYR A 939 16.372 44.949 -0.568 1.00 29.95 N ATOM 1197 CA TYR A 939 15.589 44.934 -1.797 1.00 30.93 C ATOM 1198 C TYR A 939 14.105 45.166 -1.500 1.00 30.91 C ATOM 1199 O TYR A 939 13.476 45.992 -2.145 1.00 32.58 O ATOM 1200 CB TYR A 939 15.807 43.625 -2.569 1.00 29.50 C ATOM 1201 CG TYR A 939 14.905 43.461 -3.774 1.00 30.15 C ATOM 1202 CD1 TYR A 939 15.158 44.143 -4.967 1.00 30.06 C ATOM 1203 CD2 TYR A 939 13.796 42.626 -3.720 1.00 28.59 C ATOM 1204 CE1 TYR A 939 14.320 43.992 -6.076 1.00 30.76 C ATOM 1205 CE2 TYR A 939 12.960 42.467 -4.813 1.00 29.66 C ATOM 1206 CZ TYR A 939 13.220 43.151 -5.984 1.00 31.32 C ATOM 1207 OH TYR A 939 12.373 42.976 -7.054 1.00 32.88 O ATOM 1208 HH TYR A 939 12.686 43.527 -7.815 1.00 0.00 H ATOM 1209 H TYR A 939 16.831 44.072 -0.248 1.00 0.00 H ATOM 1210 N LEU A 940 13.556 44.452 -0.521 1.00 30.54 N ATOM 1211 CA LEU A 940 12.155 44.640 -0.122 1.00 31.52 C ATOM 1212 C LEU A 940 11.839 46.094 0.179 1.00 31.80 C ATOM 1213 O LEU A 940 10.835 46.624 -0.296 1.00 32.77 O ATOM 1214 CB LEU A 940 11.811 43.810 1.117 1.00 31.69 C ATOM 1215 CG LEU A 940 11.625 42.304 0.974 1.00 33.77 C ATOM 1216 CD1 LEU A 940 11.008 41.779 2.262 1.00 37.59 C ATOM 1217 CD2 LEU A 940 10.754 41.947 -0.217 1.00 35.20 C ATOM 1218 H LEU A 940 14.133 43.743 -0.026 1.00 0.00 H ATOM 1219 N GLY A 941 12.702 46.728 0.969 1.00 30.65 N ATOM 1220 CA GLY A 941 12.554 48.137 1.311 1.00 31.88 C ATOM 1221 C GLY A 941 12.440 49.024 0.087 1.00 33.28 C ATOM 1222 O GLY A 941 11.617 49.941 0.052 1.00 36.20 O ATOM 1223 H GLY A 941 13.510 46.200 1.356 1.00 0.00 H ATOM 1224 N SER A 942 13.256 48.748 -0.926 1.00 32.17 N ATOM 1225 CA SER A 942 13.212 49.510 -2.176 1.00 33.59 C ATOM 1226 C SER A 942 11.974 49.213 -3.024 1.00 34.20 C ATOM 1227 O SER A 942 11.650 49.975 -3.930 1.00 34.59 O ATOM 1228 CB SER A 942 14.447 49.216 -3.001 1.00 32.28 C ATOM 1229 OG SER A 942 14.527 47.834 -3.293 1.00 31.83 O ATOM 1230 HG SER A 942 14.574 47.321 -2.447 1.00 0.00 H ATOM 1231 H SER A 942 13.942 47.972 -0.828 1.00 0.00 H ATOM 1232 N ARG A 943 11.312 48.091 -2.750 1.00 34.01 N ATOM 1233 CA ARG A 943 10.001 47.808 -3.333 1.00 35.71 C ATOM 1234 C ARG A 943 8.887 48.250 -2.386 1.00 36.79 C ATOM 1235 O ARG A 943 7.719 47.932 -2.606 1.00 38.29 O ATOM 1236 CB ARG A 943 9.869 46.322 -3.677 1.00 34.06 C ATOM 1237 CG ARG A 943 11.027 45.766 -4.514 1.00 34.80 C ATOM 1238 CD ARG A 943 11.163 46.432 -5.891 1.00 37.25 C ATOM 1239 NE ARG A 943 10.227 45.856 -6.858 1.00 40.22 N ATOM 1240 CZ ARG A 943 9.064 46.388 -7.226 1.00 44.35 C ATOM 1241 NH1 ARG A 943 8.317 45.746 -8.111 1.00 46.41 N ATOM 1242 NH2 ARG A 943 8.637 47.546 -6.730 1.00 53.04 N ATOM 1243 HE ARG A 943 10.494 44.951 -7.296 1.00 0.00 H ATOM 1244 HH12 ARG A 943 7.405 46.147 -8.410 1.00 0.00 H ATOM 1245 HH11 ARG A 943 8.642 44.841 -8.507 1.00 0.00 H ATOM 1246 HH22 ARG A 943 7.724 47.938 -7.036 1.00 0.00 H ATOM 1247 HH21 ARG A 943 9.217 48.060 -6.036 1.00 0.00 H ATOM 1248 H ARG A 943 11.739 47.397 -2.104 1.00 0.00 H ATOM 1249 N ARG A 944 9.262 49.001 -1.348 1.00 37.24 N ATOM 1250 CA ARG A 944 8.326 49.569 -0.382 1.00 38.61 C ATOM 1251 C ARG A 944 7.461 48.484 0.249 1.00 37.56 C ATOM 1252 O ARG A 944 6.263 48.656 0.452 1.00 39.51 O ATOM 1253 CB ARG A 944 7.478 50.658 -1.048 1.00 41.39 C ATOM 1254 CG ARG A 944 8.302 51.592 -1.941 1.00 43.14 C ATOM 1255 CD ARG A 944 7.578 52.873 -2.302 1.00 46.48 C ATOM 1256 NE ARG A 944 7.646 53.849 -1.215 1.00 50.85 N ATOM 1257 CZ ARG A 944 6.720 54.022 -0.273 1.00 52.51 C ATOM 1258 NH1 ARG A 944 6.906 54.943 0.665 1.00 51.44 N ATOM 1259 NH2 ARG A 944 5.611 53.289 -0.254 1.00 55.33 N ATOM 1260 HE ARG A 944 8.487 54.459 -1.174 1.00 0.00 H ATOM 1261 HH12 ARG A 944 6.188 55.085 1.404 1.00 0.00 H ATOM 1262 HH11 ARG A 944 7.769 55.523 0.661 1.00 0.00 H ATOM 1263 HH22 ARG A 944 4.901 53.440 0.490 1.00 0.00 H ATOM 1264 HH21 ARG A 944 5.454 52.565 -0.983 1.00 0.00 H ATOM 1265 H ARG A 944 10.276 49.192 -1.220 1.00 0.00 H ATOM 1266 N CYS A 945 8.099 47.365 0.563 1.00 36.53 N ATOM 1267 CA CYS A 945 7.424 46.193 1.072 1.00 35.64 C ATOM 1268 C CYS A 945 7.937 45.872 2.467 1.00 33.87 C ATOM 1269 O CYS A 945 9.142 45.840 2.695 1.00 31.88 O ATOM 1270 CB CYS A 945 7.681 45.022 0.137 1.00 35.16 C ATOM 1271 SG CYS A 945 6.998 43.482 0.722 1.00 39.30 S ATOM 1272 H CYS A 945 9.131 47.329 0.437 1.00 0.00 H ATOM 1273 N VAL A 946 7.012 45.649 3.395 1.00 35.06 N ATOM 1274 CA VAL A 946 7.346 45.340 4.781 1.00 34.40 C ATOM 1275 C VAL A 946 6.956 43.889 5.046 1.00 33.98 C ATOM 1276 O VAL A 946 5.777 43.544 4.983 1.00 36.14 O ATOM 1277 CB VAL A 946 6.592 46.271 5.759 1.00 35.91 C ATOM 1278 CG1 VAL A 946 6.974 45.972 7.215 1.00 36.57 C ATOM 1279 CG2 VAL A 946 6.876 47.730 5.429 1.00 35.82 C ATOM 1280 H VAL A 946 6.010 45.697 3.122 1.00 0.00 H ATOM 1281 N HIS A 947 7.946 43.051 5.343 1.00 32.20 N ATOM 1282 CA HIS A 947 7.722 41.621 5.560 1.00 32.83 C ATOM 1283 C HIS A 947 6.815 41.338 6.756 1.00 34.94 C ATOM 1284 O HIS A 947 5.941 40.469 6.679 1.00 36.40 O ATOM 1285 CB HIS A 947 9.053 40.895 5.761 1.00 31.86 C ATOM 1286 CG HIS A 947 8.939 39.405 5.690 1.00 31.74 C ATOM 1287 ND1 HIS A 947 8.686 38.623 6.795 1.00 31.01 N ATOM 1288 CD2 HIS A 947 9.035 38.554 4.642 1.00 33.37 C ATOM 1289 CE1 HIS A 947 8.631 37.355 6.433 1.00 32.31 C ATOM 1290 NE2 HIS A 947 8.837 37.285 5.131 1.00 34.84 N ATOM 1291 H HIS A 947 8.913 43.425 5.424 1.00 0.00 H ATOM 1292 N ARG A 948 7.047 42.059 7.855 1.00 34.86 N ATOM 1293 CA ARG A 948 6.245 41.961 9.089 1.00 36.88 C ATOM 1294 C ARG A 948 6.431 40.672 9.897 1.00 36.58 C ATOM 1295 O ARG A 948 5.926 40.576 11.011 1.00 38.55 O ATOM 1296 CB ARG A 948 4.744 42.198 8.823 1.00 38.70 C ATOM 1297 CG ARG A 948 4.370 43.657 8.593 1.00 41.16 C ATOM 1298 CD ARG A 948 2.857 43.892 8.673 1.00 45.40 C ATOM 1299 NE ARG A 948 2.319 43.544 9.992 1.00 50.89 N ATOM 1300 CZ ARG A 948 1.413 42.599 10.245 1.00 52.24 C ATOM 1301 NH1 ARG A 948 1.027 42.392 11.498 1.00 56.12 N ATOM 1302 NH2 ARG A 948 0.874 41.868 9.275 1.00 53.48 N ATOM 1303 HE ARG A 948 2.677 44.084 10.805 1.00 0.00 H ATOM 1304 HH12 ARG A 948 0.321 41.658 11.710 1.00 0.00 H ATOM 1305 HH11 ARG A 948 1.430 42.964 12.268 1.00 0.00 H ATOM 1306 HH22 ARG A 948 0.170 41.138 9.504 1.00 0.00 H ATOM 1307 HH21 ARG A 948 1.157 42.026 8.287 1.00 0.00 H ATOM 1308 H ARG A 948 7.841 42.730 7.840 1.00 0.00 H ATOM 1309 N ASP A 949 7.142 39.688 9.353 1.00 35.96 N ATOM 1310 CA ASP A 949 7.395 38.440 10.073 1.00 35.74 C ATOM 1311 C ASP A 949 8.769 37.875 9.747 1.00 33.42 C ATOM 1312 O ASP A 949 8.926 36.666 9.556 1.00 33.65 O ATOM 1313 CB ASP A 949 6.305 37.407 9.757 1.00 38.11 C ATOM 1314 CG ASP A 949 6.301 36.231 10.730 1.00 39.48 C ATOM 1315 OD1 ASP A 949 6.978 36.294 11.777 1.00 42.60 O ATOM 1316 OD2 ASP A 949 5.617 35.234 10.441 1.00 43.33 O ATOM 1317 H ASP A 949 7.527 39.809 8.394 1.00 0.00 H ATOM 1318 N LEU A 950 9.767 38.748 9.689 1.00 32.26 N ATOM 1319 CA LEU A 950 11.132 38.302 9.469 1.00 31.68 C ATOM 1320 C LEU A 950 11.583 37.492 10.681 1.00 31.81 C ATOM 1321 O LEU A 950 11.597 38.000 11.802 1.00 33.26 O ATOM 1322 CB LEU A 950 12.068 39.486 9.230 1.00 30.50 C ATOM 1323 CG LEU A 950 13.486 39.143 8.767 1.00 29.40 C ATOM 1324 CD1 LEU A 950 13.466 38.363 7.465 1.00 31.43 C ATOM 1325 CD2 LEU A 950 14.300 40.416 8.612 1.00 30.53 C ATOM 1326 H LEU A 950 9.570 39.763 9.802 1.00 0.00 H ATOM 1327 N ALA A 951 11.913 36.224 10.439 1.00 31.97 N ATOM 1328 CA ALA A 951 12.379 35.307 11.478 1.00 33.39 C ATOM 1329 C ALA A 951 13.015 34.076 10.837 1.00 33.78 C ATOM 1330 O ALA A 951 12.710 33.747 9.694 1.00 34.97 O ATOM 1331 CB ALA A 951 11.226 34.892 12.389 1.00 34.56 C ATOM 1332 H ALA A 951 11.835 35.870 9.464 1.00 0.00 H ATOM 1333 N ALA A 952 13.884 33.394 11.583 1.00 34.60 N ATOM 1334 CA ALA A 952 14.603 32.223 11.076 1.00 34.30 C ATOM 1335 C ALA A 952 13.658 31.148 10.546 1.00 35.72 C ATOM 1336 O ALA A 952 13.948 30.498 9.539 1.00 36.35 O ATOM 1337 CB ALA A 952 15.498 31.645 12.155 1.00 35.21 C ATOM 1338 H ALA A 952 14.058 33.705 12.560 1.00 0.00 H ATOM 1339 N ARG A 953 12.521 30.969 11.210 1.00 37.03 N ATOM 1340 CA ARG A 953 11.517 30.013 10.735 1.00 39.26 C ATOM 1341 C ARG A 953 10.976 30.346 9.334 1.00 37.57 C ATOM 1342 O ARG A 953 10.462 29.462 8.652 1.00 38.10 O ATOM 1343 CB ARG A 953 10.354 29.906 11.722 1.00 41.20 C ATOM 1344 CG ARG A 953 9.493 31.140 11.770 1.00 42.70 C ATOM 1345 CD ARG A 953 8.375 31.030 12.777 1.00 46.67 C ATOM 1346 NE ARG A 953 7.777 32.346 12.968 1.00 49.25 N ATOM 1347 CZ ARG A 953 8.298 33.313 13.720 1.00 52.20 C ATOM 1348 NH1 ARG A 953 7.677 34.477 13.806 1.00 54.94 N ATOM 1349 NH2 ARG A 953 9.432 33.128 14.389 1.00 53.55 N ATOM 1350 HE ARG A 953 6.879 32.543 12.482 1.00 0.00 H ATOM 1351 HH12 ARG A 953 8.077 35.238 14.391 1.00 0.00 H ATOM 1352 HH11 ARG A 953 6.788 34.632 13.288 1.00 0.00 H ATOM 1353 HH22 ARG A 953 9.823 33.896 14.971 1.00 0.00 H ATOM 1354 HH21 ARG A 953 9.928 32.216 14.330 1.00 0.00 H ATOM 1355 H ARG A 953 12.341 31.514 12.077 1.00 0.00 H ATOM 1356 N ASN A 954 11.069 31.613 8.925 1.00 35.40 N ATOM 1357 CA ASN A 954 10.626 32.040 7.592 1.00 35.34 C ATOM 1358 C ASN A 954 11.774 32.259 6.599 1.00 33.95 C ATOM 1359 O ASN A 954 11.555 32.782 5.502 1.00 33.63 O ATOM 1360 CB ASN A 954 9.765 33.306 7.694 1.00 35.14 C ATOM 1361 CG ASN A 954 8.403 33.039 8.318 1.00 37.27 C ATOM 1362 OD1 ASN A 954 7.800 31.979 8.110 1.00 37.44 O ATOM 1363 ND2 ASN A 954 7.905 34.010 9.082 1.00 35.00 N ATOM 1364 HD22 ASN A 954 8.447 34.885 9.230 1.00 0.00 H ATOM 1365 HD21 ASN A 954 6.974 33.893 9.531 1.00 0.00 H ATOM 1366 H ASN A 954 11.469 32.322 9.572 1.00 0.00 H ATOM 1367 N ILE A 955 12.989 31.859 6.980 1.00 33.23 N ATOM 1368 CA ILE A 955 14.129 31.856 6.061 1.00 32.14 C ATOM 1369 C ILE A 955 14.343 30.429 5.557 1.00 32.23 C ATOM 1370 O ILE A 955 14.200 29.470 6.312 1.00 32.73 O ATOM 1371 CB ILE A 955 15.432 32.360 6.730 1.00 31.53 C ATOM 1372 CG1 ILE A 955 15.209 33.693 7.456 1.00 31.81 C ATOM 1373 CG2 ILE A 955 16.549 32.512 5.691 1.00 30.88 C ATOM 1374 CD1 ILE A 955 14.734 34.830 6.568 1.00 33.00 C ATOM 1375 H ILE A 955 13.130 31.540 7.960 1.00 0.00 H ATOM 1376 N LEU A 956 14.685 30.300 4.280 1.00 31.17 N ATOM 1377 CA LEU A 956 14.857 28.995 3.655 1.00 31.89 C ATOM 1378 C LEU A 956 16.282 28.855 3.158 1.00 30.77 C ATOM 1379 O LEU A 956 16.939 29.843 2.843 1.00 29.59 O ATOM 1380 CB LEU A 956 13.878 28.826 2.496 1.00 31.76 C ATOM 1381 CG LEU A 956 12.394 28.929 2.855 1.00 32.74 C ATOM 1382 CD1 LEU A 956 11.555 28.908 1.583 1.00 35.53 C ATOM 1383 CD2 LEU A 956 11.963 27.810 3.793 1.00 32.69 C ATOM 1384 H LEU A 956 14.835 31.156 3.709 1.00 0.00 H ATOM 1385 N VAL A 957 16.756 27.619 3.094 1.00 31.85 N ATOM 1386 CA VAL A 957 18.128 27.350 2.699 1.00 32.67 C ATOM 1387 C VAL A 957 18.144 26.810 1.271 1.00 33.55 C ATOM 1388 O VAL A 957 17.613 25.738 1.006 1.00 33.87 O ATOM 1389 CB VAL A 957 18.788 26.351 3.665 1.00 33.62 C ATOM 1390 CG1 VAL A 957 20.255 26.198 3.343 1.00 33.99 C ATOM 1391 CG2 VAL A 957 18.615 26.819 5.113 1.00 33.42 C ATOM 1392 H VAL A 957 16.131 26.823 3.332 1.00 0.00 H ATOM 1393 N GLU A 958 18.737 27.579 0.360 1.00 34.56 N ATOM 1394 CA GLU A 958 18.918 27.167 -1.033 1.00 35.24 C ATOM 1395 C GLU A 958 20.073 26.176 -1.123 1.00 36.80 C ATOM 1396 O GLU A 958 19.976 25.155 -1.808 1.00 39.24 O ATOM 1397 CB GLU A 958 19.178 28.400 -1.916 1.00 35.25 C ATOM 1398 CG GLU A 958 19.800 28.135 -3.292 1.00 37.33 C ATOM 1399 CD GLU A 958 18.888 27.395 -4.244 1.00 43.06 C ATOM 1400 OE1 GLU A 958 19.284 27.221 -5.418 1.00 48.02 O ATOM 1401 OE2 GLU A 958 17.778 26.992 -3.833 1.00 46.82 O ATOM 1402 H GLU A 958 19.087 28.514 0.651 1.00 0.00 H ATOM 1403 N SER A 959 21.168 26.500 -0.438 1.00 35.64 N ATOM 1404 CA SER A 959 22.310 25.603 -0.298 1.00 36.91 C ATOM 1405 C SER A 959 23.059 25.973 0.979 1.00 36.32 C ATOM 1406 O SER A 959 22.674 26.907 1.680 1.00 34.33 O ATOM 1407 CB SER A 959 23.241 25.710 -1.510 1.00 37.28 C ATOM 1408 OG SER A 959 24.071 26.858 -1.426 1.00 35.32 O ATOM 1409 HG SER A 959 24.659 26.898 -2.222 1.00 0.00 H ATOM 1410 H SER A 959 21.211 27.434 0.017 1.00 0.00 H ATOM 1411 N GLU A 960 24.137 25.263 1.282 1.00 38.08 N ATOM 1412 CA GLU A 960 24.912 25.593 2.478 1.00 38.43 C ATOM 1413 C GLU A 960 25.538 26.992 2.396 1.00 36.19 C ATOM 1414 O GLU A 960 25.931 27.557 3.417 1.00 33.52 O ATOM 1415 CB GLU A 960 25.987 24.539 2.760 1.00 39.80 C ATOM 1416 CG GLU A 960 26.449 24.566 4.211 1.00 41.20 C ATOM 1417 CD GLU A 960 27.252 23.363 4.623 1.00 44.67 C ATOM 1418 OE1 GLU A 960 27.548 22.498 3.777 1.00 49.29 O ATOM 1419 OE2 GLU A 960 27.590 23.286 5.819 1.00 51.77 O ATOM 1420 H GLU A 960 24.431 24.474 0.671 1.00 0.00 H ATOM 1421 N ALA A 961 25.602 27.553 1.187 1.00 35.95 N ATOM 1422 CA ALA A 961 26.180 28.877 0.973 1.00 35.91 C ATOM 1423 C ALA A 961 25.150 29.936 0.568 1.00 33.59 C ATOM 1424 O ALA A 961 25.526 31.025 0.155 1.00 34.30 O ATOM 1425 CB ALA A 961 27.275 28.782 -0.085 1.00 37.60 C ATOM 1426 H ALA A 961 25.228 27.030 0.370 1.00 0.00 H ATOM 1427 N HIS A 962 23.861 29.636 0.703 1.00 33.35 N ATOM 1428 CA HIS A 962 22.818 30.504 0.153 1.00 32.34 C ATOM 1429 C HIS A 962 21.479 30.341 0.885 1.00 30.22 C ATOM 1430 O HIS A 962 20.956 29.230 0.986 1.00 30.89 O ATOM 1431 CB HIS A 962 22.656 30.202 -1.345 1.00 32.68 C ATOM 1432 CG HIS A 962 21.844 31.215 -2.091 1.00 33.51 C ATOM 1433 ND1 HIS A 962 21.393 31.001 -3.376 1.00 36.36 N ATOM 1434 CD2 HIS A 962 21.391 32.440 -1.734 1.00 36.96 C ATOM 1435 CE1 HIS A 962 20.704 32.053 -3.782 1.00 38.22 C ATOM 1436 NE2 HIS A 962 20.688 32.941 -2.804 1.00 38.09 N ATOM 1437 H HIS A 962 23.589 28.769 1.209 1.00 0.00 H ATOM 1438 N VAL A 963 20.933 31.447 1.390 1.00 28.42 N ATOM 1439 CA VAL A 963 19.603 31.446 2.019 1.00 28.79 C ATOM 1440 C VAL A 963 18.659 32.445 1.339 1.00 28.87 C ATOM 1441 O VAL A 963 19.112 33.372 0.674 1.00 29.38 O ATOM 1442 CB VAL A 963 19.669 31.732 3.545 1.00 28.00 C ATOM 1443 CG1 VAL A 963 20.508 30.669 4.257 1.00 26.60 C ATOM 1444 CG2 VAL A 963 20.212 33.135 3.837 1.00 27.16 C ATOM 1445 H VAL A 963 21.464 32.340 1.338 1.00 0.00 H ATOM 1446 N LYS A 964 17.351 32.234 1.503 1.00 29.71 N ATOM 1447 CA LYS A 964 16.323 33.094 0.905 1.00 28.67 C ATOM 1448 C LYS A 964 15.195 33.385 1.890 1.00 28.87 C ATOM 1449 O LYS A 964 14.825 32.527 2.690 1.00 29.49 O ATOM 1450 CB LYS A 964 15.724 32.441 -0.337 1.00 29.75 C ATOM 1451 CG LYS A 964 16.696 32.242 -1.484 1.00 30.92 C ATOM 1452 CD LYS A 964 15.961 32.021 -2.794 1.00 29.67 C ATOM 1453 CE LYS A 964 16.870 31.413 -3.852 1.00 30.69 C ATOM 1454 NZ LYS A 964 16.304 31.563 -5.229 1.00 32.87 N ATOM 1455 HZ1 LYS A 964 15.382 31.084 -5.278 1.00 0.00 H ATOM 1456 HZ2 LYS A 964 16.183 32.573 -5.445 1.00 0.00 H ATOM 1457 HZ3 LYS A 964 16.955 31.135 -5.918 1.00 0.00 H ATOM 1458 H LYS A 964 17.047 31.424 2.080 1.00 0.00 H ATOM 1459 N ILE A 965 14.652 34.598 1.812 1.00 29.09 N ATOM 1460 CA ILE A 965 13.501 35.003 2.623 1.00 29.43 C ATOM 1461 C ILE A 965 12.213 34.440 2.017 1.00 30.10 C ATOM 1462 O ILE A 965 12.042 34.458 0.804 1.00 29.46 O ATOM 1463 CB ILE A 965 13.390 36.543 2.706 1.00 29.55 C ATOM 1464 CG1 ILE A 965 14.638 37.129 3.374 1.00 28.56 C ATOM 1465 CG2 ILE A 965 12.128 36.964 3.470 1.00 31.12 C ATOM 1466 CD1 ILE A 965 14.867 38.569 3.047 1.00 28.28 C ATOM 1467 H ILE A 965 15.062 35.286 1.148 1.00 0.00 H ATOM 1468 N ALA A 966 11.315 33.956 2.873 1.00 30.94 N ATOM 1469 CA ALA A 966 10.046 33.375 2.436 1.00 31.97 C ATOM 1470 C ALA A 966 8.871 33.891 3.255 1.00 32.78 C ATOM 1471 O ALA A 966 9.043 34.692 4.171 1.00 32.57 O ATOM 1472 CB ALA A 966 10.115 31.861 2.523 1.00 32.28 C ATOM 1473 H ALA A 966 11.524 33.993 3.891 1.00 0.00 H ATOM 1474 N ASP A 967 7.678 33.426 2.893 1.00 35.93 N ATOM 1475 CA ASP A 967 6.425 33.717 3.606 1.00 37.15 C ATOM 1476 C ASP A 967 6.087 35.207 3.624 1.00 36.93 C ATOM 1477 O ASP A 967 6.487 35.943 4.527 1.00 37.01 O ATOM 1478 CB ASP A 967 6.451 33.140 5.030 1.00 38.33 C ATOM 1479 CG ASP A 967 5.057 32.942 5.612 1.00 42.23 C ATOM 1480 OD1 ASP A 967 4.056 33.294 4.943 1.00 43.89 O ATOM 1481 OD2 ASP A 967 4.965 32.425 6.748 1.00 48.49 O ATOM 1482 H ASP A 967 7.628 32.817 2.051 1.00 0.00 H ATOM 1483 N PHE A 968 5.342 35.637 2.612 1.00 37.31 N ATOM 1484 CA PHE A 968 4.907 37.019 2.496 1.00 37.31 C ATOM 1485 C PHE A 968 3.400 37.148 2.733 1.00 39.35 C ATOM 1486 O PHE A 968 2.756 38.070 2.227 1.00 41.25 O ATOM 1487 CB PHE A 968 5.313 37.565 1.125 1.00 36.90 C ATOM 1488 CG PHE A 968 6.794 37.758 0.978 1.00 33.04 C ATOM 1489 CD1 PHE A 968 7.632 36.670 0.745 1.00 34.17 C ATOM 1490 CD2 PHE A 968 7.355 39.022 1.092 1.00 32.74 C ATOM 1491 CE1 PHE A 968 9.008 36.843 0.622 1.00 32.72 C ATOM 1492 CE2 PHE A 968 8.721 39.208 0.970 1.00 31.37 C ATOM 1493 CZ PHE A 968 9.554 38.114 0.731 1.00 32.11 C ATOM 1494 H PHE A 968 5.059 34.960 1.875 1.00 0.00 H ATOM 1495 N GLY A 969 2.851 36.231 3.530 1.00 40.25 N ATOM 1496 CA GLY A 969 1.432 36.245 3.883 1.00 42.21 C ATOM 1497 C GLY A 969 1.020 37.412 4.758 1.00 41.99 C ATOM 1498 O GLY A 969 -0.108 37.883 4.674 1.00 44.04 O ATOM 1499 H GLY A 969 3.455 35.477 3.915 1.00 0.00 H ATOM 1500 N LEU A 970 1.933 37.876 5.605 1.00 41.18 N ATOM 1501 CA LEU A 970 1.686 39.055 6.438 1.00 41.71 C ATOM 1502 C LEU A 970 2.296 40.318 5.839 1.00 39.74 C ATOM 1503 O LEU A 970 2.282 41.368 6.470 1.00 39.27 O ATOM 1504 CB LEU A 970 2.244 38.835 7.847 1.00 41.07 C ATOM 1505 CG LEU A 970 1.728 37.603 8.595 1.00 42.29 C ATOM 1506 CD1 LEU A 970 2.290 37.572 10.010 1.00 40.99 C ATOM 1507 CD2 LEU A 970 0.215 37.574 8.628 1.00 42.97 C ATOM 1508 H LEU A 970 2.849 37.388 5.678 1.00 0.00 H ATOM 1509 N ALA A 971 2.818 40.222 4.619 1.00 39.81 N ATOM 1510 CA ALA A 971 3.548 41.332 4.013 1.00 39.44 C ATOM 1511 C ALA A 971 2.611 42.477 3.650 1.00 41.89 C ATOM 1512 O ALA A 971 1.501 42.256 3.163 1.00 43.80 O ATOM 1513 CB ALA A 971 4.314 40.865 2.790 1.00 38.45 C ATOM 1514 H ALA A 971 2.704 39.337 4.085 1.00 0.00 H ATOM 1515 N LYS A 972 3.068 43.699 3.913 1.00 41.87 N ATOM 1516 CA LYS A 972 2.304 44.904 3.618 1.00 43.72 C ATOM 1517 C LYS A 972 3.123 45.800 2.706 1.00 43.09 C ATOM 1518 O LYS A 972 4.350 45.851 2.813 1.00 42.94 O ATOM 1519 CB LYS A 972 1.968 45.655 4.911 1.00 45.88 C ATOM 1520 CG LYS A 972 1.105 44.868 5.898 1.00 48.07 C ATOM 1521 CD LYS A 972 -0.344 44.751 5.440 1.00 51.10 C ATOM 1522 CE LYS A 972 -1.169 43.933 6.433 1.00 52.95 C ATOM 1523 NZ LYS A 972 -2.642 44.059 6.223 1.00 55.58 N ATOM 1524 HZ1 LYS A 972 -2.922 45.055 6.328 1.00 0.00 H ATOM 1525 HZ2 LYS A 972 -2.884 43.729 5.267 1.00 0.00 H ATOM 1526 HZ3 LYS A 972 -3.142 43.481 6.928 1.00 0.00 H ATOM 1527 H LYS A 972 4.008 43.798 4.346 1.00 0.00 H ATOM 1528 N LEU A 973 2.442 46.490 1.797 1.00 44.45 N ATOM 1529 CA LEU A 973 3.080 47.472 0.934 1.00 44.20 C ATOM 1530 C LEU A 973 2.784 48.849 1.488 1.00 45.68 C ATOM 1531 O LEU A 973 1.623 49.212 1.674 1.00 47.85 O ATOM 1532 CB LEU A 973 2.570 47.364 -0.506 1.00 45.15 C ATOM 1533 CG LEU A 973 2.990 46.108 -1.278 1.00 42.96 C ATOM 1534 CD1 LEU A 973 2.317 46.094 -2.621 1.00 43.74 C ATOM 1535 CD2 LEU A 973 4.501 46.032 -1.440 1.00 42.52 C ATOM 1536 H LEU A 973 1.420 46.323 1.700 1.00 0.00 H ATOM 1537 N LEU A 974 3.838 49.608 1.764 1.00 45.21 N ATOM 1538 CA LEU A 974 3.688 50.946 2.308 1.00 47.10 C ATOM 1539 C LEU A 974 2.898 51.795 1.322 1.00 50.01 C ATOM 1540 O LEU A 974 3.120 51.693 0.114 1.00 51.15 O ATOM 1541 CB LEU A 974 5.060 51.576 2.564 1.00 45.46 C ATOM 1542 CG LEU A 974 5.883 50.949 3.693 1.00 44.41 C ATOM 1543 CD1 LEU A 974 7.316 51.451 3.672 1.00 42.68 C ATOM 1544 CD2 LEU A 974 5.239 51.230 5.043 1.00 46.39 C ATOM 1545 H LEU A 974 4.793 49.236 1.587 1.00 0.00 H ATOM 1546 N PRO A 975 1.962 52.624 1.823 1.00 53.02 N ATOM 1547 CA PRO A 975 1.296 53.551 0.914 1.00 55.62 C ATOM 1548 C PRO A 975 2.333 54.437 0.242 1.00 56.26 C ATOM 1549 O PRO A 975 3.360 54.753 0.844 1.00 55.32 O ATOM 1550 CB PRO A 975 0.390 54.375 1.831 1.00 57.63 C ATOM 1551 CG PRO A 975 0.227 53.563 3.061 1.00 57.66 C ATOM 1552 CD PRO A 975 1.477 52.760 3.209 1.00 54.04 C ATOM 1553 N LEU A 976 2.058 54.851 -0.987 1.00 58.70 N ATOM 1554 CA LEU A 976 3.053 55.548 -1.805 1.00 59.07 C ATOM 1555 C LEU A 976 3.448 56.930 -1.244 1.00 61.13 C ATOM 1556 O LEU A 976 4.376 57.561 -1.752 1.00 61.80 O ATOM 1557 CB LEU A 976 2.546 55.663 -3.253 1.00 61.21 C ATOM 1558 CG LEU A 976 2.223 54.328 -3.951 1.00 60.36 C ATOM 1559 CD1 LEU A 976 1.231 54.510 -5.094 1.00 62.32 C ATOM 1560 CD2 LEU A 976 3.495 53.642 -4.440 1.00 57.74 C ATOM 1561 H LEU A 976 1.111 54.676 -1.380 1.00 0.00 H ATOM 1562 N ASP A 977 2.751 57.383 -0.197 1.00 62.67 N ATOM 1563 CA ASP A 977 3.040 58.663 0.464 1.00 64.04 C ATOM 1564 C ASP A 977 3.358 58.519 1.966 1.00 63.12 C ATOM 1565 O ASP A 977 3.338 59.508 2.703 1.00 64.39 O ATOM 1566 CB ASP A 977 1.859 59.629 0.263 1.00 67.45 C ATOM 1567 CG ASP A 977 0.554 59.110 0.859 1.00 68.20 C ATOM 1568 OD1 ASP A 977 0.458 57.903 1.167 1.00 63.05 O ATOM 1569 OD2 ASP A 977 -0.386 59.920 1.011 1.00 72.52 O ATOM 1570 H ASP A 977 1.968 56.803 0.166 1.00 0.00 H ATOM 1571 N LYS A 978 3.657 57.297 2.410 1.00 60.89 N ATOM 1572 CA LYS A 978 3.858 57.003 3.834 1.00 60.29 C ATOM 1573 C LYS A 978 4.988 55.992 4.050 1.00 57.44 C ATOM 1574 O LYS A 978 5.105 55.020 3.309 1.00 55.92 O ATOM 1575 CB LYS A 978 2.564 56.451 4.445 1.00 61.75 C ATOM 1576 CG LYS A 978 1.454 57.481 4.643 1.00 66.01 C ATOM 1577 CD LYS A 978 1.690 58.321 5.893 1.00 68.03 C ATOM 1578 CE LYS A 978 0.598 59.363 6.096 1.00 71.62 C ATOM 1579 NZ LYS A 978 0.740 60.515 5.164 1.00 74.42 N ATOM 1580 HZ1 LYS A 978 1.659 60.975 5.321 1.00 0.00 H ATOM 1581 HZ2 LYS A 978 0.684 60.175 4.183 1.00 0.00 H ATOM 1582 HZ3 LYS A 978 -0.025 61.198 5.339 1.00 0.00 H ATOM 1583 H LYS A 978 3.751 56.524 1.721 1.00 0.00 H ATOM 1584 N ASP A 979 5.804 56.221 5.079 1.00 57.26 N ATOM 1585 CA ASP A 979 6.904 55.313 5.433 1.00 55.06 C ATOM 1586 C ASP A 979 6.511 54.293 6.511 1.00 53.54 C ATOM 1587 O ASP A 979 7.362 53.550 7.002 1.00 51.47 O ATOM 1588 CB ASP A 979 8.130 56.117 5.901 1.00 55.38 C ATOM 1589 CG ASP A 979 8.719 56.994 4.800 1.00 58.69 C ATOM 1590 OD1 ASP A 979 9.390 57.990 5.145 1.00 62.01 O ATOM 1591 OD2 ASP A 979 8.517 56.695 3.598 1.00 58.69 O ATOM 1592 H ASP A 979 5.656 57.075 5.653 1.00 0.00 H HETATM 1593 N PTR A 980 5.231 54.257 6.876 1.00 55.03 N HETATM 1594 CA PTR A 980 4.728 53.299 7.862 1.00 55.36 C HETATM 1595 C PTR A 980 3.324 52.836 7.499 1.00 56.81 C HETATM 1596 O PTR A 980 2.662 53.435 6.648 1.00 57.25 O HETATM 1597 CB PTR A 980 4.701 53.887 9.281 1.00 56.63 C HETATM 1598 CG PTR A 980 3.727 55.033 9.471 1.00 59.29 C HETATM 1599 CD2 PTR A 980 2.534 54.849 10.163 1.00 60.99 C HETATM 1600 CE2 PTR A 980 1.634 55.890 10.335 1.00 64.82 C HETATM 1601 CZ PTR A 980 1.914 57.136 9.801 1.00 66.56 C HETATM 1602 OH PTR A 980 1.129 58.081 9.952 1.00 70.86 O HETATM 1603 P PTR A 980 -0.410 58.062 9.459 1.00 76.58 P HETATM 1604 O3P PTR A 980 -0.901 59.512 9.269 1.00 79.16 O HETATM 1605 O2P PTR A 980 -1.225 57.391 10.496 1.00 78.14 O HETATM 1606 O1P PTR A 980 -0.547 57.288 8.137 1.00 74.98 O HETATM 1607 CE1 PTR A 980 3.097 57.345 9.111 1.00 62.86 C HETATM 1608 CD1 PTR A 980 3.989 56.296 8.943 1.00 59.67 C HETATM 1609 H PTR A 980 4.567 54.932 6.446 1.00 0.00 H HETATM 1610 N PTR A 981 2.884 51.763 8.150 1.00 57.87 N HETATM 1611 CA PTR A 981 1.533 51.238 7.975 1.00 59.98 C HETATM 1612 C PTR A 981 1.006 50.688 9.299 1.00 60.70 C HETATM 1613 O PTR A 981 1.669 49.886 9.953 1.00 59.02 O HETATM 1614 CB PTR A 981 1.488 50.133 6.912 1.00 60.76 C HETATM 1615 CG PTR A 981 0.083 49.645 6.634 1.00 62.91 C HETATM 1616 CD2 PTR A 981 -0.334 48.383 7.051 1.00 65.50 C HETATM 1617 CE2 PTR A 981 -1.628 47.943 6.822 1.00 67.45 C HETATM 1618 CZ PTR A 981 -2.525 48.771 6.174 1.00 70.44 C HETATM 1619 OH PTR A 981 -3.681 48.394 5.979 1.00 72.89 O HETATM 1620 P PTR A 981 -4.081 47.377 4.799 1.00 73.27 P HETATM 1621 O3P PTR A 981 -2.813 46.872 4.084 1.00 67.07 O HETATM 1622 O2P PTR A 981 -4.845 46.187 5.412 1.00 72.61 O HETATM 1623 O1P PTR A 981 -4.960 48.111 3.856 1.00 71.44 O HETATM 1624 CE1 PTR A 981 -2.140 50.036 5.767 1.00 70.40 C HETATM 1625 CD1 PTR A 981 -0.846 50.468 6.003 1.00 67.90 C HETATM 1626 H PTR A 981 3.527 51.279 8.809 1.00 0.00 H ATOM 1627 N VAL A 982 -0.189 51.120 9.690 1.00 64.03 N ATOM 1628 CA VAL A 982 -0.818 50.639 10.918 1.00 65.93 C ATOM 1629 C VAL A 982 -1.687 49.426 10.586 1.00 67.02 C ATOM 1630 O VAL A 982 -2.324 49.388 9.536 1.00 67.83 O ATOM 1631 CB VAL A 982 -1.666 51.735 11.591 1.00 68.44 C ATOM 1632 CG1 VAL A 982 -2.153 51.272 12.961 1.00 69.54 C ATOM 1633 CG2 VAL A 982 -0.864 53.027 11.726 1.00 67.39 C ATOM 1634 H VAL A 982 -0.690 51.820 9.106 1.00 0.00 H ATOM 1635 N VAL A 983 -1.708 48.446 11.487 1.00 68.16 N ATOM 1636 CA VAL A 983 -2.387 47.166 11.245 1.00 69.54 C ATOM 1637 C VAL A 983 -3.536 46.903 12.236 1.00 73.09 C ATOM 1638 O VAL A 983 -3.471 47.315 13.392 1.00 74.42 O ATOM 1639 CB VAL A 983 -1.343 46.001 11.230 1.00 67.67 C ATOM 1640 CG1 VAL A 983 -1.522 45.029 12.407 1.00 69.76 C ATOM 1641 CG2 VAL A 983 -1.373 45.271 9.890 1.00 67.15 C ATOM 1642 H VAL A 983 -1.225 48.592 12.397 1.00 0.00 H ATOM 1643 N ARG A 984 -4.578 46.218 11.757 1.00 75.84 N ATOM 1644 CA ARG A 984 -5.779 45.874 12.545 1.00 79.25 C ATOM 1645 C ARG A 984 -5.585 45.948 14.061 1.00 80.15 C ATOM 1646 O ARG A 984 -6.503 45.662 14.831 1.00 82.30 O ATOM 1647 CB ARG A 984 -6.282 44.472 12.157 1.00 80.48 C ATOM 1648 CG ARG A 984 -5.248 43.346 12.310 1.00 79.08 C ATOM 1649 CD ARG A 984 -5.274 42.689 13.693 1.00 81.69 C ATOM 1650 NE ARG A 984 -4.018 42.004 14.012 1.00 79.12 N ATOM 1651 CZ ARG A 984 -3.776 41.353 15.151 1.00 79.13 C ATOM 1652 NH1 ARG A 984 -4.704 41.281 16.104 1.00 81.01 N ATOM 1653 NH2 ARG A 984 -2.598 40.764 15.339 1.00 75.31 N ATOM 1654 HE ARG A 984 -3.261 42.027 13.299 1.00 0.00 H ATOM 1655 HH12 ARG A 984 -4.503 40.771 16.988 1.00 0.00 H ATOM 1656 HH11 ARG A 984 -5.629 41.735 15.964 1.00 0.00 H ATOM 1657 HH22 ARG A 984 -2.406 40.256 16.226 1.00 0.00 H ATOM 1658 HH21 ARG A 984 -1.869 40.812 14.599 1.00 0.00 H ATOM 1659 H ARG A 984 -4.541 45.907 10.765 1.00 0.00 H TER 1660 ARG A 984 ATOM 1661 N PRO A 990 3.525 35.824 17.005 1.00 61.81 N ATOM 1662 CA PRO A 990 4.583 35.708 18.002 1.00 60.04 C ATOM 1663 C PRO A 990 5.231 37.055 18.302 1.00 58.41 C ATOM 1664 O PRO A 990 5.814 37.685 17.414 1.00 57.35 O ATOM 1665 CB PRO A 990 5.586 34.745 17.355 1.00 58.89 C ATOM 1666 CG PRO A 990 5.201 34.656 15.898 1.00 58.93 C ATOM 1667 CD PRO A 990 4.019 35.537 15.650 1.00 60.29 C ATOM 1668 HN2 PRO A 990 3.145 36.792 17.027 1.00 0.00 H ATOM 1669 HN1 PRO A 990 2.768 35.150 17.237 1.00 0.00 H ATOM 1670 N ILE A 991 5.142 37.466 19.562 1.00 58.34 N ATOM 1671 CA ILE A 991 5.492 38.827 19.979 1.00 56.58 C ATOM 1672 C ILE A 991 6.994 39.103 20.163 1.00 53.34 C ATOM 1673 O ILE A 991 7.404 40.260 20.248 1.00 53.26 O ATOM 1674 CB ILE A 991 4.755 39.197 21.289 1.00 59.16 C ATOM 1675 CG1 ILE A 991 5.130 38.234 22.428 1.00 60.13 C ATOM 1676 CG2 ILE A 991 3.252 39.177 21.057 1.00 61.59 C ATOM 1677 CD1 ILE A 991 4.700 38.705 23.796 1.00 62.77 C ATOM 1678 H ILE A 991 4.810 36.794 20.283 1.00 0.00 H ATOM 1679 N PHE A 992 7.810 38.056 20.211 1.00 50.59 N ATOM 1680 CA PHE A 992 9.220 38.207 20.577 1.00 49.22 C ATOM 1681 C PHE A 992 10.118 38.714 19.437 1.00 45.90 C ATOM 1682 O PHE A 992 11.314 38.913 19.631 1.00 44.56 O ATOM 1683 CB PHE A 992 9.744 36.889 21.152 1.00 49.39 C ATOM 1684 CG PHE A 992 8.939 36.391 22.322 1.00 53.24 C ATOM 1685 CD1 PHE A 992 8.986 37.056 23.545 1.00 54.55 C ATOM 1686 CD2 PHE A 992 8.113 35.279 22.197 1.00 53.59 C ATOM 1687 CE1 PHE A 992 8.240 36.615 24.624 1.00 56.26 C ATOM 1688 CE2 PHE A 992 7.364 34.833 23.271 1.00 56.28 C ATOM 1689 CZ PHE A 992 7.429 35.500 24.490 1.00 58.03 C ATOM 1690 H PHE A 992 7.440 37.111 19.984 1.00 0.00 H ATOM 1691 N TRP A 993 9.533 38.929 18.262 1.00 44.91 N ATOM 1692 CA TRP A 993 10.227 39.527 17.124 1.00 42.48 C ATOM 1693 C TRP A 993 9.726 40.937 16.824 1.00 42.25 C ATOM 1694 O TRP A 993 10.260 41.603 15.942 1.00 41.10 O ATOM 1695 CB TRP A 993 10.027 38.655 15.885 1.00 40.65 C ATOM 1696 CG TRP A 993 10.870 37.436 15.875 1.00 40.01 C ATOM 1697 CD1 TRP A 993 11.990 37.235 15.131 1.00 38.09 C ATOM 1698 CD2 TRP A 993 10.672 36.240 16.639 1.00 41.13 C ATOM 1699 NE1 TRP A 993 12.504 35.990 15.379 1.00 39.27 N ATOM 1700 CE2 TRP A 993 11.717 35.356 16.302 1.00 40.82 C ATOM 1701 CE3 TRP A 993 9.715 35.828 17.572 1.00 44.52 C ATOM 1702 CZ2 TRP A 993 11.835 34.081 16.865 1.00 41.23 C ATOM 1703 CZ3 TRP A 993 9.834 34.556 18.134 1.00 45.19 C ATOM 1704 CH2 TRP A 993 10.889 33.701 17.776 1.00 42.89 C ATOM 1705 HE1 TRP A 993 13.356 35.590 14.937 1.00 0.00 H ATOM 1706 H TRP A 993 8.535 38.659 18.148 1.00 0.00 H ATOM 1707 N TYR A 994 8.708 41.389 17.554 1.00 44.46 N ATOM 1708 CA TYR A 994 8.054 42.665 17.268 1.00 45.45 C ATOM 1709 C TYR A 994 8.805 43.839 17.875 1.00 44.77 C ATOM 1710 O TYR A 994 9.295 43.762 19.001 1.00 45.32 O ATOM 1711 CB TYR A 994 6.618 42.658 17.805 1.00 50.50 C ATOM 1712 CG TYR A 994 5.569 42.071 16.879 1.00 52.60 C ATOM 1713 CD1 TYR A 994 5.912 41.252 15.802 1.00 52.19 C ATOM 1714 CD2 TYR A 994 4.218 42.321 17.103 1.00 57.67 C ATOM 1715 CE1 TYR A 994 4.937 40.722 14.966 1.00 53.41 C ATOM 1716 CE2 TYR A 994 3.239 41.791 16.278 1.00 57.37 C ATOM 1717 CZ TYR A 994 3.605 40.994 15.213 1.00 55.84 C ATOM 1718 OH TYR A 994 2.635 40.471 14.397 1.00 58.50 O ATOM 1719 HH TYR A 994 3.060 39.927 13.687 1.00 0.00 H ATOM 1720 H TYR A 994 8.368 40.816 18.353 1.00 0.00 H ATOM 1721 N ALA A 995 8.879 44.933 17.121 1.00 43.77 N ATOM 1722 CA ALA A 995 9.441 46.175 17.626 1.00 43.40 C ATOM 1723 C ALA A 995 8.445 46.799 18.612 1.00 45.42 C ATOM 1724 O ALA A 995 7.254 46.496 18.547 1.00 46.80 O ATOM 1725 CB ALA A 995 9.735 47.124 16.478 1.00 42.46 C ATOM 1726 H ALA A 995 8.525 44.899 16.144 1.00 0.00 H ATOM 1727 N PRO A 996 8.927 47.659 19.535 1.00 45.43 N ATOM 1728 CA PRO A 996 8.078 48.270 20.562 1.00 47.47 C ATOM 1729 C PRO A 996 6.828 48.974 20.029 1.00 48.22 C ATOM 1730 O PRO A 996 5.729 48.716 20.518 1.00 49.81 O ATOM 1731 CB PRO A 996 9.018 49.280 21.233 1.00 47.58 C ATOM 1732 CG PRO A 996 10.357 48.722 21.035 1.00 45.62 C ATOM 1733 CD PRO A 996 10.329 48.091 19.677 1.00 44.25 C ATOM 1734 N GLU A 997 7.000 49.850 19.041 1.00 47.43 N ATOM 1735 CA GLU A 997 5.872 50.578 18.447 1.00 48.77 C ATOM 1736 C GLU A 997 4.846 49.653 17.780 1.00 48.48 C ATOM 1737 O GLU A 997 3.669 50.002 17.680 1.00 51.34 O ATOM 1738 CB GLU A 997 6.349 51.660 17.459 1.00 47.86 C ATOM 1739 CG GLU A 997 6.953 51.158 16.145 1.00 44.62 C ATOM 1740 CD GLU A 997 8.404 50.754 16.265 1.00 43.44 C ATOM 1741 OE1 GLU A 997 8.927 50.733 17.398 1.00 43.06 O ATOM 1742 OE2 GLU A 997 9.023 50.456 15.221 1.00 39.84 O ATOM 1743 H GLU A 997 7.960 50.023 18.680 1.00 0.00 H ATOM 1744 N SER A 998 5.292 48.484 17.327 1.00 46.55 N ATOM 1745 CA SER A 998 4.387 47.476 16.775 1.00 47.19 C ATOM 1746 C SER A 998 3.547 46.856 17.890 1.00 50.13 C ATOM 1747 O SER A 998 2.331 46.707 17.752 1.00 52.78 O ATOM 1748 CB SER A 998 5.167 46.387 16.038 1.00 44.32 C ATOM 1749 OG SER A 998 6.070 46.950 15.103 1.00 41.64 O ATOM 1750 HG SER A 998 5.566 47.483 14.439 1.00 0.00 H ATOM 1751 H SER A 998 6.311 48.282 17.366 1.00 0.00 H ATOM 1752 N LEU A 999 4.196 46.508 18.998 1.00 49.79 N ATOM 1753 CA LEU A 999 3.492 45.977 20.162 1.00 51.96 C ATOM 1754 C LEU A 999 2.477 46.989 20.695 1.00 54.58 C ATOM 1755 O LEU A 999 1.317 46.651 20.907 1.00 56.73 O ATOM 1756 CB LEU A 999 4.483 45.618 21.275 1.00 52.16 C ATOM 1757 CG LEU A 999 5.505 44.511 21.006 1.00 50.45 C ATOM 1758 CD1 LEU A 999 6.602 44.538 22.061 1.00 50.70 C ATOM 1759 CD2 LEU A 999 4.831 43.150 20.965 1.00 51.58 C ATOM 1760 H LEU A 999 5.230 46.617 19.036 1.00 0.00 H ATOM 1761 N SER A1000 2.922 48.230 20.888 1.00 54.66 N ATOM 1762 CA SER A1000 2.119 49.253 21.557 1.00 58.05 C ATOM 1763 C SER A1000 1.043 49.877 20.665 1.00 59.57 C ATOM 1764 O SER A1000 -0.100 50.029 21.096 1.00 62.10 O ATOM 1765 CB SER A1000 3.024 50.357 22.114 1.00 57.42 C ATOM 1766 OG SER A1000 3.695 51.042 21.075 1.00 55.50 O ATOM 1767 HG SER A1000 3.029 51.455 20.470 1.00 0.00 H ATOM 1768 H SER A1000 3.874 48.480 20.551 1.00 0.00 H ATOM 1769 N ASP A1001 1.413 50.239 19.436 1.00 58.25 N ATOM 1770 CA ASP A1001 0.526 51.001 18.542 1.00 59.33 C ATOM 1771 C ASP A1001 0.222 50.306 17.211 1.00 57.92 C ATOM 1772 O ASP A1001 -0.347 50.923 16.311 1.00 58.48 O ATOM 1773 CB ASP A1001 1.138 52.377 18.259 1.00 59.11 C ATOM 1774 CG ASP A1001 1.341 53.197 19.518 1.00 61.87 C ATOM 1775 OD1 ASP A1001 0.335 53.652 20.107 1.00 65.35 O ATOM 1776 OD2 ASP A1001 2.511 53.399 19.910 1.00 61.69 O ATOM 1777 H ASP A1001 2.360 49.974 19.098 1.00 0.00 H ATOM 1778 N ASN A1002 0.599 49.036 17.082 1.00 56.38 N ATOM 1779 CA ASN A1002 0.363 48.267 15.852 1.00 55.04 C ATOM 1780 C ASN A1002 0.966 48.915 14.595 1.00 52.96 C ATOM 1781 O ASN A1002 0.460 48.727 13.485 1.00 52.09 O ATOM 1782 CB ASN A1002 -1.139 48.017 15.659 1.00 57.89 C ATOM 1783 CG ASN A1002 -1.792 47.375 16.878 1.00 62.11 C ATOM 1784 OD1 ASN A1002 -2.840 47.826 17.349 1.00 65.50 O ATOM 1785 ND2 ASN A1002 -1.176 46.317 17.390 1.00 62.41 N ATOM 1786 HD22 ASN A1002 -0.294 45.971 16.961 1.00 0.00 H ATOM 1787 HD21 ASN A1002 -1.575 45.834 18.220 1.00 0.00 H ATOM 1788 H ASN A1002 1.078 48.571 17.880 1.00 0.00 H ATOM 1789 N ILE A1003 2.056 49.661 14.780 1.00 51.76 N ATOM 1790 CA ILE A1003 2.731 50.363 13.689 1.00 49.91 C ATOM 1791 C ILE A1003 3.829 49.479 13.120 1.00 46.88 C ATOM 1792 O ILE A1003 4.620 48.910 13.872 1.00 45.00 O ATOM 1793 CB ILE A1003 3.372 51.684 14.170 1.00 50.49 C ATOM 1794 CG1 ILE A1003 2.301 52.617 14.748 1.00 53.81 C ATOM 1795 CG2 ILE A1003 4.118 52.372 13.021 1.00 48.93 C ATOM 1796 CD1 ILE A1003 2.851 53.829 15.478 1.00 54.65 C ATOM 1797 H ILE A1003 2.443 49.747 15.742 1.00 0.00 H ATOM 1798 N PHE A1004 3.876 49.377 11.793 1.00 45.64 N ATOM 1799 CA PHE A1004 4.893 48.580 11.110 1.00 42.80 C ATOM 1800 C PHE A1004 5.562 49.389 10.005 1.00 41.46 C ATOM 1801 O PHE A1004 4.957 50.289 9.431 1.00 42.63 O ATOM 1802 CB PHE A1004 4.272 47.297 10.555 1.00 42.16 C ATOM 1803 CG PHE A1004 3.872 46.317 11.620 1.00 42.71 C ATOM 1804 CD1 PHE A1004 2.621 46.391 12.217 1.00 44.94 C ATOM 1805 CD2 PHE A1004 4.755 45.329 12.043 1.00 41.64 C ATOM 1806 CE1 PHE A1004 2.250 45.489 13.210 1.00 45.52 C ATOM 1807 CE2 PHE A1004 4.392 44.425 13.034 1.00 42.66 C ATOM 1808 CZ PHE A1004 3.135 44.503 13.616 1.00 43.47 C ATOM 1809 H PHE A1004 3.166 49.881 11.224 1.00 0.00 H ATOM 1810 N SER A1005 6.821 49.070 9.729 1.00 39.76 N ATOM 1811 CA SER A1005 7.614 49.814 8.752 1.00 39.66 C ATOM 1812 C SER A1005 8.875 49.037 8.390 1.00 37.66 C ATOM 1813 O SER A1005 9.111 47.951 8.918 1.00 36.42 O ATOM 1814 CB SER A1005 8.002 51.189 9.317 1.00 40.76 C ATOM 1815 OG SER A1005 8.888 51.061 10.419 1.00 39.12 O ATOM 1816 HG SER A1005 9.120 51.961 10.761 1.00 0.00 H ATOM 1817 H SER A1005 7.257 48.265 10.223 1.00 0.00 H ATOM 1818 N ARG A1006 9.689 49.597 7.498 1.00 37.19 N ATOM 1819 CA ARG A1006 10.991 49.005 7.196 1.00 36.19 C ATOM 1820 C ARG A1006 11.850 48.965 8.455 1.00 35.51 C ATOM 1821 O ARG A1006 12.644 48.053 8.636 1.00 35.42 O ATOM 1822 CB ARG A1006 11.735 49.800 6.131 1.00 36.52 C ATOM 1823 CG ARG A1006 11.057 49.904 4.769 1.00 37.64 C ATOM 1824 CD ARG A1006 11.955 50.728 3.850 1.00 39.68 C ATOM 1825 NE ARG A1006 11.292 51.217 2.644 1.00 41.34 N ATOM 1826 CZ ARG A1006 10.790 52.442 2.486 1.00 41.64 C ATOM 1827 NH1 ARG A1006 10.235 52.766 1.328 1.00 45.44 N ATOM 1828 NH2 ARG A1006 10.816 53.340 3.466 1.00 42.54 N ATOM 1829 HE ARG A1006 11.205 50.557 1.845 1.00 0.00 H ATOM 1830 HH12 ARG A1006 9.839 53.718 1.189 1.00 0.00 H ATOM 1831 HH11 ARG A1006 10.195 52.069 0.557 1.00 0.00 H ATOM 1832 HH22 ARG A1006 10.417 54.288 3.313 1.00 0.00 H ATOM 1833 HH21 ARG A1006 11.236 53.094 4.385 1.00 0.00 H ATOM 1834 H ARG A1006 9.395 50.467 7.010 1.00 0.00 H ATOM 1835 N GLN A1007 11.677 49.961 9.320 1.00 36.63 N ATOM 1836 CA GLN A1007 12.427 50.052 10.570 1.00 36.07 C ATOM 1837 C GLN A1007 11.992 48.995 11.590 1.00 35.54 C ATOM 1838 O GLN A1007 12.817 48.519 12.365 1.00 34.34 O ATOM 1839 CB GLN A1007 12.310 51.452 11.173 1.00 37.91 C ATOM 1840 CG GLN A1007 13.065 52.530 10.405 1.00 40.48 C ATOM 1841 CD GLN A1007 12.340 53.027 9.163 1.00 46.03 C ATOM 1842 OE1 GLN A1007 11.225 52.599 8.849 1.00 46.50 O ATOM 1843 NE2 GLN A1007 12.975 53.945 8.449 1.00 48.63 N ATOM 1844 HE22 GLN A1007 13.913 54.279 8.748 1.00 0.00 H ATOM 1845 HE21 GLN A1007 12.535 54.332 7.590 1.00 0.00 H ATOM 1846 H GLN A1007 10.982 50.702 9.098 1.00 0.00 H ATOM 1847 N SER A1008 10.711 48.624 11.592 1.00 35.73 N ATOM 1848 CA SER A1008 10.252 47.496 12.408 1.00 35.93 C ATOM 1849 C SER A1008 10.808 46.177 11.863 1.00 34.85 C ATOM 1850 O SER A1008 11.034 45.235 12.623 1.00 35.19 O ATOM 1851 CB SER A1008 8.722 47.445 12.492 1.00 37.85 C ATOM 1852 OG SER A1008 8.137 47.049 11.264 1.00 38.81 O ATOM 1853 HG SER A1008 8.387 47.695 10.557 1.00 0.00 H ATOM 1854 H SER A1008 10.027 49.143 11.005 1.00 0.00 H ATOM 1855 N ASP A1009 11.034 46.112 10.550 1.00 33.90 N ATOM 1856 CA ASP A1009 11.721 44.969 9.944 1.00 32.12 C ATOM 1857 C ASP A1009 13.184 44.891 10.416 1.00 31.69 C ATOM 1858 O ASP A1009 13.715 43.796 10.639 1.00 31.69 O ATOM 1859 CB ASP A1009 11.665 45.041 8.406 1.00 31.77 C ATOM 1860 CG ASP A1009 10.413 44.395 7.812 1.00 32.75 C ATOM 1861 OD1 ASP A1009 9.625 43.765 8.555 1.00 32.27 O ATOM 1862 OD2 ASP A1009 10.226 44.514 6.578 1.00 30.29 O ATOM 1863 H ASP A1009 10.714 46.892 9.941 1.00 0.00 H ATOM 1864 N VAL A1010 13.825 46.050 10.567 1.00 31.20 N ATOM 1865 CA VAL A1010 15.204 46.121 11.071 1.00 30.84 C ATOM 1866 C VAL A1010 15.311 45.561 12.493 1.00 31.42 C ATOM 1867 O VAL A1010 16.224 44.787 12.791 1.00 30.17 O ATOM 1868 CB VAL A1010 15.751 47.571 11.044 1.00 30.93 C ATOM 1869 CG1 VAL A1010 17.100 47.660 11.757 1.00 31.75 C ATOM 1870 CG2 VAL A1010 15.880 48.066 9.608 1.00 29.74 C ATOM 1871 H VAL A1010 13.333 46.933 10.320 1.00 0.00 H ATOM 1872 N TRP A1011 14.386 45.964 13.365 1.00 32.32 N ATOM 1873 CA TRP A1011 14.300 45.408 14.718 1.00 33.15 C ATOM 1874 C TRP A1011 14.272 43.880 14.670 1.00 32.89 C ATOM 1875 O TRP A1011 15.026 43.218 15.384 1.00 33.94 O ATOM 1876 CB TRP A1011 13.052 45.927 15.448 1.00 34.71 C ATOM 1877 CG TRP A1011 12.866 45.355 16.840 1.00 35.45 C ATOM 1878 CD1 TRP A1011 12.422 44.101 17.164 1.00 35.61 C ATOM 1879 CD2 TRP A1011 13.115 46.023 18.082 1.00 35.18 C ATOM 1880 NE1 TRP A1011 12.384 43.949 18.530 1.00 37.27 N ATOM 1881 CE2 TRP A1011 12.806 45.113 19.116 1.00 37.21 C ATOM 1882 CE3 TRP A1011 13.564 47.303 18.421 1.00 37.18 C ATOM 1883 CZ2 TRP A1011 12.936 45.444 20.469 1.00 39.36 C ATOM 1884 CZ3 TRP A1011 13.695 47.633 19.769 1.00 39.31 C ATOM 1885 CH2 TRP A1011 13.383 46.705 20.773 1.00 39.73 C ATOM 1886 HE1 TRP A1011 12.084 43.091 19.035 1.00 0.00 H ATOM 1887 H TRP A1011 13.705 46.695 13.076 1.00 0.00 H ATOM 1888 N SER A1012 13.399 43.337 13.826 1.00 32.13 N ATOM 1889 CA SER A1012 13.250 41.894 13.677 1.00 31.98 C ATOM 1890 C SER A1012 14.508 41.247 13.100 1.00 30.64 C ATOM 1891 O SER A1012 14.841 40.114 13.446 1.00 30.46 O ATOM 1892 CB SER A1012 12.038 41.569 12.792 1.00 32.68 C ATOM 1893 OG SER A1012 10.830 42.036 13.375 1.00 33.18 O ATOM 1894 HG SER A1012 10.701 41.603 14.256 1.00 0.00 H ATOM 1895 H SER A1012 12.801 43.964 13.251 1.00 0.00 H ATOM 1896 N PHE A1013 15.200 41.962 12.218 1.00 30.70 N ATOM 1897 CA PHE A1013 16.484 41.490 11.692 1.00 29.70 C ATOM 1898 C PHE A1013 17.496 41.292 12.824 1.00 29.98 C ATOM 1899 O PHE A1013 18.245 40.316 12.827 1.00 30.23 O ATOM 1900 CB PHE A1013 17.034 42.452 10.643 1.00 28.43 C ATOM 1901 CG PHE A1013 18.331 42.000 10.034 1.00 28.61 C ATOM 1902 CD1 PHE A1013 18.371 40.884 9.210 1.00 27.81 C ATOM 1903 CD2 PHE A1013 19.510 42.690 10.279 1.00 28.55 C ATOM 1904 CE1 PHE A1013 19.561 40.461 8.651 1.00 28.34 C ATOM 1905 CE2 PHE A1013 20.705 42.270 9.719 1.00 27.62 C ATOM 1906 CZ PHE A1013 20.730 41.155 8.904 1.00 26.62 C ATOM 1907 H PHE A1013 14.822 42.875 11.895 1.00 0.00 H ATOM 1908 N GLY A1014 17.496 42.204 13.794 1.00 31.25 N ATOM 1909 CA GLY A1014 18.326 42.054 14.991 1.00 32.46 C ATOM 1910 C GLY A1014 18.054 40.753 15.730 1.00 32.99 C ATOM 1911 O GLY A1014 18.969 40.132 16.269 1.00 32.96 O ATOM 1912 H GLY A1014 16.891 43.045 13.699 1.00 0.00 H ATOM 1913 N VAL A1015 16.790 40.338 15.742 1.00 33.16 N ATOM 1914 CA VAL A1015 16.399 39.078 16.366 1.00 34.30 C ATOM 1915 C VAL A1015 16.861 37.862 15.544 1.00 34.16 C ATOM 1916 O VAL A1015 17.236 36.846 16.129 1.00 34.86 O ATOM 1917 CB VAL A1015 14.870 39.018 16.639 1.00 35.79 C ATOM 1918 CG1 VAL A1015 14.480 37.708 17.332 1.00 36.29 C ATOM 1919 CG2 VAL A1015 14.439 40.209 17.496 1.00 36.84 C ATOM 1920 H VAL A1015 16.060 40.928 15.294 1.00 0.00 H ATOM 1921 N VAL A1016 16.865 37.951 14.210 1.00 32.80 N ATOM 1922 CA VAL A1016 17.361 36.814 13.415 1.00 32.42 C ATOM 1923 C VAL A1016 18.889 36.699 13.544 1.00 31.74 C ATOM 1924 O VAL A1016 19.428 35.595 13.545 1.00 32.97 O ATOM 1925 CB VAL A1016 16.897 36.794 11.900 1.00 31.63 C ATOM 1926 CG1 VAL A1016 15.555 37.487 11.700 1.00 32.09 C ATOM 1927 CG2 VAL A1016 17.952 37.361 10.962 1.00 33.35 C ATOM 1928 H VAL A1016 16.522 38.813 13.739 1.00 0.00 H ATOM 1929 N LEU A1017 19.583 37.830 13.653 1.00 31.46 N ATOM 1930 CA LEU A1017 21.013 37.804 13.965 1.00 31.75 C ATOM 1931 C LEU A1017 21.229 37.015 15.248 1.00 33.13 C ATOM 1932 O LEU A1017 22.109 36.155 15.306 1.00 34.06 O ATOM 1933 CB LEU A1017 21.587 39.214 14.125 1.00 32.06 C ATOM 1934 CG LEU A1017 21.825 40.035 12.857 1.00 33.15 C ATOM 1935 CD1 LEU A1017 22.234 41.446 13.237 1.00 34.11 C ATOM 1936 CD2 LEU A1017 22.881 39.396 11.963 1.00 32.72 C ATOM 1937 H LEU A1017 19.104 38.743 13.515 1.00 0.00 H ATOM 1938 N TYR A1018 20.412 37.302 16.264 1.00 32.69 N ATOM 1939 CA TYR A1018 20.448 36.556 17.522 1.00 33.95 C ATOM 1940 C TYR A1018 20.191 35.066 17.296 1.00 34.54 C ATOM 1941 O TYR A1018 20.882 34.217 17.871 1.00 35.94 O ATOM 1942 CB TYR A1018 19.432 37.113 18.537 1.00 34.19 C ATOM 1943 CG TYR A1018 19.387 36.316 19.819 1.00 35.04 C ATOM 1944 CD1 TYR A1018 18.580 35.192 19.932 1.00 35.60 C ATOM 1945 CD2 TYR A1018 20.176 36.666 20.906 1.00 36.05 C ATOM 1946 CE1 TYR A1018 18.548 34.448 21.097 1.00 38.64 C ATOM 1947 CE2 TYR A1018 20.151 35.925 22.078 1.00 38.31 C ATOM 1948 CZ TYR A1018 19.337 34.819 22.169 1.00 38.81 C ATOM 1949 OH TYR A1018 19.312 34.083 23.332 1.00 40.94 O ATOM 1950 HH TYR A1018 18.680 33.328 23.230 1.00 0.00 H ATOM 1951 H TYR A1018 19.729 38.079 16.158 1.00 0.00 H ATOM 1952 N GLU A1019 19.189 34.752 16.477 1.00 34.05 N ATOM 1953 CA GLU A1019 18.873 33.360 16.154 1.00 34.52 C ATOM 1954 C GLU A1019 20.027 32.674 15.422 1.00 33.73 C ATOM 1955 O GLU A1019 20.365 31.531 15.726 1.00 35.64 O ATOM 1956 CB GLU A1019 17.607 33.268 15.301 1.00 33.91 C ATOM 1957 CG GLU A1019 16.314 33.569 16.028 1.00 34.44 C ATOM 1958 CD GLU A1019 15.102 33.361 15.137 1.00 36.07 C ATOM 1959 OE1 GLU A1019 14.828 34.219 14.269 1.00 35.69 O ATOM 1960 OE2 GLU A1019 14.424 32.327 15.296 1.00 40.90 O ATOM 1961 H GLU A1019 18.618 35.513 16.057 1.00 0.00 H ATOM 1962 N LEU A1020 20.617 33.366 14.451 1.00 32.87 N ATOM 1963 CA LEU A1020 21.753 32.825 13.691 1.00 32.94 C ATOM 1964 C LEU A1020 22.901 32.438 14.621 1.00 33.98 C ATOM 1965 O LEU A1020 23.440 31.334 14.534 1.00 34.56 O ATOM 1966 CB LEU A1020 22.254 33.838 12.653 1.00 31.04 C ATOM 1967 CG LEU A1020 21.413 33.995 11.379 1.00 32.67 C ATOM 1968 CD1 LEU A1020 21.719 35.299 10.688 1.00 33.24 C ATOM 1969 CD2 LEU A1020 21.655 32.854 10.413 1.00 35.63 C ATOM 1970 H LEU A1020 20.264 34.317 14.223 1.00 0.00 H ATOM 1971 N PHE A1021 23.254 33.346 15.523 1.00 34.02 N ATOM 1972 CA PHE A1021 24.418 33.155 16.381 1.00 36.00 C ATOM 1973 C PHE A1021 24.130 32.403 17.694 1.00 37.41 C ATOM 1974 O PHE A1021 25.029 32.231 18.510 1.00 39.39 O ATOM 1975 CB PHE A1021 25.096 34.505 16.636 1.00 36.13 C ATOM 1976 CG PHE A1021 25.889 35.005 15.460 1.00 35.14 C ATOM 1977 CD1 PHE A1021 25.292 35.778 14.477 1.00 33.46 C ATOM 1978 CD2 PHE A1021 27.232 34.687 15.332 1.00 35.74 C ATOM 1979 CE1 PHE A1021 26.025 36.233 13.390 1.00 32.84 C ATOM 1980 CE2 PHE A1021 27.971 35.139 14.248 1.00 36.35 C ATOM 1981 CZ PHE A1021 27.368 35.915 13.278 1.00 33.42 C ATOM 1982 H PHE A1021 22.688 34.213 15.620 1.00 0.00 H ATOM 1983 N THR A1022 22.887 31.964 17.889 1.00 37.43 N ATOM 1984 CA THR A1022 22.566 30.921 18.872 1.00 39.60 C ATOM 1985 C THR A1022 22.264 29.584 18.176 1.00 40.22 C ATOM 1986 O THR A1022 21.896 28.607 18.831 1.00 40.93 O ATOM 1987 CB THR A1022 21.340 31.292 19.729 1.00 40.00 C ATOM 1988 OG1 THR A1022 20.225 31.588 18.877 1.00 37.73 O ATOM 1989 CG2 THR A1022 21.647 32.484 20.611 1.00 39.57 C ATOM 1990 HG1 THR A1022 20.455 32.349 18.287 1.00 0.00 H ATOM 1991 H THR A1022 22.116 32.375 17.325 1.00 0.00 H ATOM 1992 N TYR A1023 22.420 29.553 16.851 1.00 39.40 N ATOM 1993 CA TYR A1023 22.114 28.377 16.034 1.00 40.31 C ATOM 1994 C TYR A1023 20.660 27.901 16.191 1.00 40.61 C ATOM 1995 O TYR A1023 20.370 26.712 16.058 1.00 41.04 O ATOM 1996 CB TYR A1023 23.114 27.249 16.328 1.00 42.44 C ATOM 1997 CG TYR A1023 24.526 27.570 15.887 1.00 42.45 C ATOM 1998 CD1 TYR A1023 24.910 27.417 14.556 1.00 41.48 C ATOM 1999 CD2 TYR A1023 25.477 28.026 16.798 1.00 43.12 C ATOM 2000 CE1 TYR A1023 26.205 27.708 14.144 1.00 42.19 C ATOM 2001 CE2 TYR A1023 26.772 28.318 16.400 1.00 42.60 C ATOM 2002 CZ TYR A1023 27.131 28.157 15.072 1.00 43.72 C ATOM 2003 OH TYR A1023 28.414 28.446 14.670 1.00 44.29 O ATOM 2004 HH TYR A1023 28.500 28.277 13.698 1.00 0.00 H ATOM 2005 H TYR A1023 22.777 30.406 16.375 1.00 0.00 H ATOM 2006 N CYS A1024 19.756 28.850 16.444 1.00 40.42 N ATOM 2007 CA CYS A1024 18.343 28.572 16.727 1.00 41.77 C ATOM 2008 C CYS A1024 18.153 27.508 17.816 1.00 45.19 C ATOM 2009 O CYS A1024 17.249 26.670 17.736 1.00 46.67 O ATOM 2010 CB CYS A1024 17.594 28.191 15.443 1.00 40.89 C ATOM 2011 SG CYS A1024 17.452 29.549 14.254 1.00 36.52 S ATOM 2012 H CYS A1024 20.070 29.841 16.440 1.00 0.00 H ATOM 2013 N ASP A1025 19.008 27.555 18.835 1.00 46.82 N ATOM 2014 CA ASP A1025 18.882 26.666 19.978 1.00 49.81 C ATOM 2015 C ASP A1025 17.594 27.007 20.720 1.00 51.23 C ATOM 2016 O ASP A1025 17.328 28.173 21.003 1.00 50.42 O ATOM 2017 CB ASP A1025 20.087 26.810 20.912 1.00 50.94 C ATOM 2018 CG ASP A1025 20.150 25.714 21.958 1.00 53.83 C ATOM 2019 OD1 ASP A1025 19.243 25.642 22.814 1.00 57.85 O ATOM 2020 OD2 ASP A1025 21.116 24.925 21.926 1.00 57.46 O ATOM 2021 H ASP A1025 19.786 28.245 18.813 1.00 0.00 H ATOM 2022 N LYS A1026 16.811 25.978 21.030 1.00 53.97 N ATOM 2023 CA LYS A1026 15.511 26.144 21.683 1.00 56.11 C ATOM 2024 C LYS A1026 15.654 26.676 23.105 1.00 56.79 C ATOM 2025 O LYS A1026 14.908 27.562 23.520 1.00 55.83 O ATOM 2026 CB LYS A1026 14.763 24.808 21.738 1.00 58.67 C ATOM 2027 CG LYS A1026 14.525 24.158 20.386 1.00 58.85 C ATOM 2028 CD LYS A1026 13.760 22.848 20.537 1.00 62.21 C ATOM 2029 CE LYS A1026 13.862 21.987 19.284 1.00 62.87 C ATOM 2030 NZ LYS A1026 13.612 22.770 18.038 1.00 61.82 N ATOM 2031 HZ1 LYS A1026 12.656 23.178 18.073 1.00 0.00 H ATOM 2032 HZ2 LYS A1026 14.314 23.534 17.963 1.00 0.00 H ATOM 2033 HZ3 LYS A1026 13.692 22.142 17.213 1.00 0.00 H ATOM 2034 H LYS A1026 17.135 25.017 20.799 1.00 0.00 H ATOM 2035 N SER A1027 16.618 26.126 23.840 1.00 58.14 N ATOM 2036 CA SER A1027 16.794 26.439 25.257 1.00 60.70 C ATOM 2037 C SER A1027 17.197 27.894 25.519 1.00 58.86 C ATOM 2038 O SER A1027 16.973 28.407 26.618 1.00 60.40 O ATOM 2039 CB SER A1027 17.807 25.480 25.898 1.00 62.72 C ATOM 2040 OG SER A1027 19.105 25.648 25.350 1.00 63.66 O ATOM 2041 HG SER A1027 19.077 25.469 24.377 1.00 0.00 H ATOM 2042 H SER A1027 17.268 25.450 23.391 1.00 0.00 H ATOM 2043 N CYS A1028 17.783 28.553 24.519 1.00 55.99 N ATOM 2044 CA CYS A1028 18.076 29.986 24.605 1.00 54.27 C ATOM 2045 C CYS A1028 17.507 30.766 23.413 1.00 50.81 C ATOM 2046 O CYS A1028 18.148 31.681 22.891 1.00 48.91 O ATOM 2047 CB CYS A1028 19.584 30.212 24.722 1.00 54.07 C ATOM 2048 SG CYS A1028 20.511 29.599 23.318 1.00 54.17 S ATOM 2049 H CYS A1028 18.039 28.036 23.654 1.00 0.00 H ATOM 2050 N SER A1029 16.289 30.414 23.010 1.00 50.34 N ATOM 2051 CA SER A1029 15.586 31.102 21.923 1.00 48.39 C ATOM 2052 C SER A1029 15.131 32.488 22.385 1.00 47.86 C ATOM 2053 O SER A1029 15.250 32.810 23.563 1.00 49.87 O ATOM 2054 CB SER A1029 14.380 30.267 21.468 1.00 49.00 C ATOM 2055 OG SER A1029 13.387 30.186 22.478 1.00 48.78 O ATOM 2056 HG SER A1029 13.070 31.097 22.701 1.00 0.00 H ATOM 2057 H SER A1029 15.817 29.619 23.485 1.00 0.00 H ATOM 2058 N PRO A1030 14.631 33.326 21.459 1.00 46.84 N ATOM 2059 CA PRO A1030 14.065 34.611 21.884 1.00 46.82 C ATOM 2060 C PRO A1030 12.959 34.489 22.938 1.00 49.68 C ATOM 2061 O PRO A1030 12.932 35.274 23.888 1.00 51.01 O ATOM 2062 CB PRO A1030 13.514 35.193 20.581 1.00 44.68 C ATOM 2063 CG PRO A1030 14.369 34.580 19.520 1.00 43.55 C ATOM 2064 CD PRO A1030 14.605 33.183 19.991 1.00 44.33 C ATOM 2065 N SER A1031 12.070 33.509 22.777 1.00 50.88 N ATOM 2066 CA SER A1031 10.977 33.290 23.730 1.00 53.34 C ATOM 2067 C SER A1031 11.490 32.879 25.108 1.00 55.18 C ATOM 2068 O SER A1031 11.114 33.476 26.112 1.00 57.51 O ATOM 2069 CB SER A1031 10.005 32.231 23.203 1.00 54.70 C ATOM 2070 OG SER A1031 10.683 31.031 22.885 1.00 55.62 O ATOM 2071 HG SER A1031 11.363 31.212 22.189 1.00 0.00 H ATOM 2072 H SER A1031 12.154 32.882 21.952 1.00 0.00 H ATOM 2073 N ALA A1032 12.356 31.870 25.147 1.00 54.87 N ATOM 2074 CA ALA A1032 12.921 31.376 26.405 1.00 56.64 C ATOM 2075 C ALA A1032 13.652 32.464 27.199 1.00 56.58 C ATOM 2076 O ALA A1032 13.617 32.463 28.431 1.00 58.25 O ATOM 2077 CB ALA A1032 13.857 30.204 26.140 1.00 56.02 C ATOM 2078 H ALA A1032 12.641 31.417 24.255 1.00 0.00 H ATOM 2079 N GLU A1033 14.312 33.385 26.498 1.00 54.14 N ATOM 2080 CA GLU A1033 15.014 34.489 27.165 1.00 54.78 C ATOM 2081 C GLU A1033 14.055 35.566 27.654 1.00 55.94 C ATOM 2082 O GLU A1033 14.151 36.007 28.800 1.00 58.03 O ATOM 2083 CB GLU A1033 16.072 35.121 26.257 1.00 52.42 C ATOM 2084 CG GLU A1033 17.505 34.882 26.714 1.00 54.13 C ATOM 2085 CD GLU A1033 17.957 33.451 26.565 1.00 55.15 C ATOM 2086 OE1 GLU A1033 18.652 32.939 27.467 1.00 53.34 O ATOM 2087 OE2 GLU A1033 17.625 32.845 25.531 1.00 56.69 O ATOM 2088 H GLU A1033 14.330 33.321 25.460 1.00 0.00 H ATOM 2089 N PHE A1034 13.141 35.993 26.786 1.00 55.04 N ATOM 2090 CA PHE A1034 12.162 37.018 27.155 1.00 56.71 C ATOM 2091 C PHE A1034 11.175 36.525 28.212 1.00 60.35 C ATOM 2092 O PHE A1034 10.743 37.304 29.064 1.00 63.70 O ATOM 2093 CB PHE A1034 11.403 37.539 25.928 1.00 54.81 C ATOM 2094 CG PHE A1034 12.113 38.646 25.199 1.00 52.28 C ATOM 2095 CD1 PHE A1034 12.469 39.813 25.859 1.00 53.62 C ATOM 2096 CD2 PHE A1034 12.412 38.531 23.849 1.00 51.51 C ATOM 2097 CE1 PHE A1034 13.116 40.838 25.188 1.00 51.86 C ATOM 2098 CE2 PHE A1034 13.056 39.556 23.176 1.00 47.72 C ATOM 2099 CZ PHE A1034 13.408 40.709 23.849 1.00 48.24 C ATOM 2100 H PHE A1034 13.122 35.591 25.827 1.00 0.00 H ATOM 2101 N LEU A1035 10.814 35.245 28.158 1.00 61.66 N ATOM 2102 CA LEU A1035 9.971 34.649 29.198 1.00 65.25 C ATOM 2103 C LEU A1035 10.713 34.638 30.534 1.00 67.28 C ATOM 2104 O LEU A1035 10.159 35.033 31.559 1.00 70.09 O ATOM 2105 CB LEU A1035 9.537 33.230 28.814 1.00 65.95 C ATOM 2106 CG LEU A1035 8.510 33.122 27.678 1.00 64.46 C ATOM 2107 CD1 LEU A1035 8.511 31.723 27.077 1.00 63.71 C ATOM 2108 CD2 LEU A1035 7.112 33.501 28.159 1.00 66.05 C ATOM 2109 H LEU A1035 11.136 34.657 27.363 1.00 0.00 H ATOM 2110 N ARG A1036 11.972 34.201 30.505 1.00 66.80 N ATOM 2111 CA ARG A1036 12.835 34.192 31.692 1.00 68.54 C ATOM 2112 C ARG A1036 12.997 35.605 32.267 1.00 69.06 C ATOM 2113 O ARG A1036 13.004 35.792 33.485 1.00 71.97 O ATOM 2114 CB ARG A1036 14.199 33.583 31.345 1.00 67.16 C ATOM 2115 CG ARG A1036 15.117 33.302 32.538 1.00 69.22 C ATOM 2116 CD ARG A1036 16.108 34.429 32.809 1.00 68.80 C ATOM 2117 NE ARG A1036 16.891 34.775 31.625 1.00 65.67 N ATOM 2118 CZ ARG A1036 17.764 35.779 31.563 1.00 64.55 C ATOM 2119 NH1 ARG A1036 17.999 36.546 32.624 1.00 63.72 N ATOM 2120 NH2 ARG A1036 18.418 36.012 30.431 1.00 63.66 N ATOM 2121 HE ARG A1036 16.757 34.197 30.771 1.00 0.00 H ATOM 2122 HH12 ARG A1036 18.684 37.326 32.560 1.00 0.00 H ATOM 2123 HH11 ARG A1036 17.498 36.365 33.517 1.00 0.00 H ATOM 2124 HH22 ARG A1036 19.101 36.795 30.377 1.00 0.00 H ATOM 2125 HH21 ARG A1036 18.247 35.412 29.599 1.00 0.00 H ATOM 2126 H ARG A1036 12.358 33.852 29.605 1.00 0.00 H ATOM 2127 N MET A1037 13.126 36.590 31.384 1.00 66.62 N ATOM 2128 CA MET A1037 13.096 37.992 31.782 1.00 67.08 C ATOM 2129 C MET A1037 11.642 38.428 31.941 1.00 67.72 C ATOM 2130 O MET A1037 11.295 39.136 32.882 1.00 69.25 O ATOM 2131 CB MET A1037 13.790 38.867 30.734 1.00 64.03 C ATOM 2132 CG MET A1037 15.282 38.600 30.563 1.00 63.56 C ATOM 2133 SD MET A1037 15.964 39.345 29.062 1.00 61.74 S ATOM 2134 CE MET A1037 17.697 39.465 29.498 1.00 62.71 C ATOM 2135 H MET A1037 13.252 36.353 30.379 1.00 0.00 H TER 2136 MET A1037 ATOM 2137 N PRO A1045 -0.095 40.659 32.147 1.00 87.73 N ATOM 2138 CA PRO A1045 -0.292 40.316 30.741 1.00 85.19 C ATOM 2139 C PRO A1045 1.036 40.216 29.991 1.00 81.30 C ATOM 2140 O PRO A1045 1.896 41.085 30.147 1.00 80.66 O ATOM 2141 CB PRO A1045 -1.135 41.481 30.211 1.00 85.86 C ATOM 2142 CG PRO A1045 -1.855 42.000 31.405 1.00 89.82 C ATOM 2143 CD PRO A1045 -0.928 41.800 32.566 1.00 90.36 C ATOM 2144 HN2 PRO A1045 0.905 40.902 32.295 1.00 0.00 H ATOM 2145 HN1 PRO A1045 -0.340 39.834 32.730 1.00 0.00 H ATOM 2146 N ALA A1046 1.184 39.174 29.173 1.00 79.16 N ATOM 2147 CA ALA A1046 2.462 38.849 28.527 1.00 74.67 C ATOM 2148 C ALA A1046 2.945 39.911 27.537 1.00 71.37 C ATOM 2149 O ALA A1046 4.131 40.241 27.513 1.00 69.54 O ATOM 2150 CB ALA A1046 2.370 37.493 27.834 1.00 74.08 C ATOM 2151 H ALA A1046 0.361 38.567 28.985 1.00 0.00 H ATOM 2152 N LEU A1047 2.036 40.431 26.715 1.00 70.81 N ATOM 2153 CA LEU A1047 2.384 41.481 25.751 1.00 68.02 C ATOM 2154 C LEU A1047 2.844 42.741 26.483 1.00 68.16 C ATOM 2155 O LEU A1047 3.872 43.323 26.139 1.00 65.69 O ATOM 2156 CB LEU A1047 1.194 41.791 24.833 1.00 68.70 C ATOM 2157 CG LEU A1047 1.450 42.706 23.625 1.00 66.96 C ATOM 2158 CD1 LEU A1047 0.518 42.347 22.468 1.00 67.43 C ATOM 2159 CD2 LEU A1047 1.308 44.184 23.978 1.00 68.31 C ATOM 2160 H LEU A1047 1.056 40.085 26.757 1.00 0.00 H ATOM 2161 N SER A1048 2.081 43.146 27.497 1.00 71.38 N ATOM 2162 CA SER A1048 2.420 44.312 28.317 1.00 72.18 C ATOM 2163 C SER A1048 3.703 44.104 29.123 1.00 70.94 C ATOM 2164 O SER A1048 4.445 45.053 29.372 1.00 69.98 O ATOM 2165 CB SER A1048 1.270 44.640 29.267 1.00 76.43 C ATOM 2166 OG SER A1048 0.062 44.807 28.551 1.00 78.08 O ATOM 2167 HG SER A1048 -0.669 45.019 29.184 1.00 0.00 H ATOM 2168 H SER A1048 1.213 42.615 27.714 1.00 0.00 H ATOM 2169 N ARG A1049 3.946 42.862 29.535 1.00 71.15 N ATOM 2170 CA ARG A1049 5.189 42.481 30.214 1.00 70.33 C ATOM 2171 C ARG A1049 6.412 42.729 29.331 1.00 65.98 C ATOM 2172 O ARG A1049 7.357 43.414 29.738 1.00 64.32 O ATOM 2173 CB ARG A1049 5.139 41.000 30.612 1.00 71.96 C ATOM 2174 CG ARG A1049 4.509 40.729 31.973 1.00 79.02 C ATOM 2175 CD ARG A1049 5.568 40.387 33.001 1.00 82.18 C ATOM 2176 NE ARG A1049 6.612 41.408 33.045 1.00 82.39 N ATOM 2177 CZ ARG A1049 7.846 41.224 33.512 1.00 82.06 C ATOM 2178 NH1 ARG A1049 8.235 40.044 33.995 1.00 83.62 N ATOM 2179 NH2 ARG A1049 8.701 42.237 33.492 1.00 78.76 N ATOM 2180 HE ARG A1049 6.373 42.353 32.683 1.00 0.00 H ATOM 2181 HH12 ARG A1049 9.203 39.923 34.354 1.00 0.00 H ATOM 2182 HH11 ARG A1049 7.570 39.244 34.012 1.00 0.00 H ATOM 2183 HH22 ARG A1049 9.668 42.109 33.853 1.00 0.00 H ATOM 2184 HH21 ARG A1049 8.405 43.160 33.115 1.00 0.00 H ATOM 2185 H ARG A1049 3.225 42.131 29.369 1.00 0.00 H ATOM 2186 N LEU A1050 6.381 42.163 28.126 1.00 62.98 N ATOM 2187 CA LEU A1050 7.462 42.319 27.153 1.00 59.46 C ATOM 2188 C LEU A1050 7.690 43.796 26.824 1.00 58.10 C ATOM 2189 O LEU A1050 8.828 44.267 26.794 1.00 55.60 O ATOM 2190 CB LEU A1050 7.139 41.529 25.874 1.00 57.67 C ATOM 2191 CG LEU A1050 8.175 41.488 24.744 1.00 54.12 C ATOM 2192 CD1 LEU A1050 9.467 40.844 25.210 1.00 53.46 C ATOM 2193 CD2 LEU A1050 7.626 40.736 23.545 1.00 53.14 C ATOM 2194 H LEU A1050 5.555 41.587 27.866 1.00 0.00 H ATOM 2195 N LEU A1051 6.601 44.523 26.597 1.00 59.31 N ATOM 2196 CA LEU A1051 6.681 45.928 26.215 1.00 59.49 C ATOM 2197 C LEU A1051 7.285 46.803 27.321 1.00 61.12 C ATOM 2198 O LEU A1051 8.127 47.660 27.044 1.00 60.39 O ATOM 2199 CB LEU A1051 5.296 46.440 25.820 1.00 60.69 C ATOM 2200 CG LEU A1051 5.206 47.851 25.240 1.00 61.00 C ATOM 2201 CD1 LEU A1051 6.105 48.029 24.017 1.00 57.99 C ATOM 2202 CD2 LEU A1051 3.756 48.158 24.898 1.00 63.81 C ATOM 2203 H LEU A1051 5.666 44.078 26.694 1.00 0.00 H ATOM 2204 N GLU A1052 6.859 46.587 28.565 1.00 63.94 N ATOM 2205 CA GLU A1052 7.433 47.298 29.716 1.00 65.65 C ATOM 2206 C GLU A1052 8.922 46.989 29.861 1.00 63.69 C ATOM 2207 O GLU A1052 9.713 47.854 30.248 1.00 63.81 O ATOM 2208 CB GLU A1052 6.708 46.915 31.013 1.00 68.77 C ATOM 2209 CG GLU A1052 7.248 47.620 32.263 1.00 71.38 C ATOM 2210 CD GLU A1052 6.459 47.301 33.530 1.00 76.13 C ATOM 2211 OE1 GLU A1052 5.777 46.254 33.579 1.00 78.76 O ATOM 2212 OE2 GLU A1052 6.531 48.103 34.487 1.00 79.59 O ATOM 2213 H GLU A1052 6.099 45.896 28.726 1.00 0.00 H ATOM 2214 N LEU A1053 9.284 45.745 29.557 1.00 62.11 N ATOM 2215 CA LEU A1053 10.667 45.282 29.635 1.00 60.27 C ATOM 2216 C LEU A1053 11.526 45.928 28.540 1.00 57.06 C ATOM 2217 O LEU A1053 12.672 46.311 28.784 1.00 55.81 O ATOM 2218 CB LEU A1053 10.700 43.757 29.509 1.00 59.84 C ATOM 2219 CG LEU A1053 11.953 43.018 29.970 1.00 59.43 C ATOM 2220 CD1 LEU A1053 12.060 43.021 31.483 1.00 61.26 C ATOM 2221 CD2 LEU A1053 11.931 41.595 29.442 1.00 58.88 C ATOM 2222 H LEU A1053 8.551 45.074 29.251 1.00 0.00 H ATOM 2223 N LEU A1054 10.968 46.051 27.338 1.00 55.00 N ATOM 2224 CA LEU A1054 11.668 46.726 26.249 1.00 53.13 C ATOM 2225 C LEU A1054 11.807 48.225 26.524 1.00 54.23 C ATOM 2226 O LEU A1054 12.881 48.791 26.341 1.00 53.75 O ATOM 2227 CB LEU A1054 10.966 46.489 24.910 1.00 51.21 C ATOM 2228 CG LEU A1054 11.050 45.066 24.348 1.00 50.10 C ATOM 2229 CD1 LEU A1054 10.147 44.926 23.131 1.00 48.55 C ATOM 2230 CD2 LEU A1054 12.485 44.679 23.996 1.00 48.66 C ATOM 2231 H LEU A1054 10.019 45.660 27.172 1.00 0.00 H ATOM 2232 N GLU A1055 10.735 48.863 26.980 1.00 56.54 N ATOM 2233 CA GLU A1055 10.780 50.298 27.288 1.00 57.72 C ATOM 2234 C GLU A1055 11.843 50.621 28.345 1.00 58.62 C ATOM 2235 O GLU A1055 12.475 51.676 28.292 1.00 59.34 O ATOM 2236 CB GLU A1055 9.397 50.808 27.707 1.00 60.08 C ATOM 2237 CG GLU A1055 8.412 50.878 26.536 1.00 60.09 C ATOM 2238 CD GLU A1055 6.974 51.164 26.953 1.00 63.57 C ATOM 2239 OE1 GLU A1055 6.685 51.242 28.168 1.00 66.00 O ATOM 2240 OE2 GLU A1055 6.125 51.309 26.048 1.00 65.31 O ATOM 2241 H GLU A1055 9.849 48.337 27.121 1.00 0.00 H ATOM 2242 N GLU A1056 12.060 49.692 29.274 1.00 59.17 N ATOM 2243 CA GLU A1056 13.138 49.805 30.265 1.00 59.47 C ATOM 2244 C GLU A1056 14.556 49.644 29.682 1.00 56.91 C ATOM 2245 O GLU A1056 15.538 49.801 30.402 1.00 57.83 O ATOM 2246 CB GLU A1056 12.933 48.776 31.383 1.00 60.78 C ATOM 2247 CG GLU A1056 11.875 49.174 32.399 1.00 64.99 C ATOM 2248 CD GLU A1056 11.630 48.101 33.446 1.00 66.93 C ATOM 2249 OE1 GLU A1056 11.940 46.920 33.177 1.00 66.53 O ATOM 2250 OE2 GLU A1056 11.126 48.441 34.540 1.00 67.94 O ATOM 2251 H GLU A1056 11.443 48.855 29.299 1.00 0.00 H ATOM 2252 N GLY A1057 14.668 49.317 28.396 1.00 54.90 N ATOM 2253 CA GLY A1057 15.971 49.196 27.734 1.00 52.17 C ATOM 2254 C GLY A1057 16.627 47.830 27.878 1.00 51.11 C ATOM 2255 O GLY A1057 17.801 47.663 27.539 1.00 49.75 O ATOM 2256 H GLY A1057 13.804 49.142 27.844 1.00 0.00 H ATOM 2257 N GLN A1058 15.877 46.852 28.382 1.00 51.62 N ATOM 2258 CA GLN A1058 16.368 45.480 28.471 1.00 50.56 C ATOM 2259 C GLN A1058 16.201 44.786 27.132 1.00 47.80 C ATOM 2260 O GLN A1058 15.192 44.968 26.451 1.00 46.77 O ATOM 2261 CB GLN A1058 15.624 44.699 29.548 1.00 52.16 C ATOM 2262 CG GLN A1058 15.916 45.188 30.944 1.00 55.38 C ATOM 2263 CD GLN A1058 15.420 44.240 32.012 1.00 57.87 C ATOM 2264 OE1 GLN A1058 14.943 44.674 33.060 1.00 60.11 O ATOM 2265 NE2 GLN A1058 15.534 42.937 31.756 1.00 54.41 N ATOM 2266 HE22 GLN A1058 15.944 42.618 30.855 1.00 0.00 H ATOM 2267 HE21 GLN A1058 15.213 42.239 32.457 1.00 0.00 H ATOM 2268 H GLN A1058 14.918 47.071 28.720 1.00 0.00 H ATOM 2269 N ARG A1059 17.194 43.979 26.774 1.00 46.60 N ATOM 2270 CA ARG A1059 17.257 43.338 25.468 1.00 44.24 C ATOM 2271 C ARG A1059 17.744 41.902 25.607 1.00 44.22 C ATOM 2272 O ARG A1059 18.260 41.516 26.653 1.00 46.61 O ATOM 2273 CB ARG A1059 18.221 44.110 24.567 1.00 42.26 C ATOM 2274 CG ARG A1059 17.831 45.560 24.301 1.00 42.15 C ATOM 2275 CD ARG A1059 16.641 45.648 23.367 1.00 41.73 C ATOM 2276 NE ARG A1059 16.362 47.025 22.963 1.00 41.36 N ATOM 2277 CZ ARG A1059 15.613 47.884 23.651 1.00 43.31 C ATOM 2278 NH1 ARG A1059 15.416 49.110 23.185 1.00 44.22 N ATOM 2279 NH2 ARG A1059 15.060 47.534 24.802 1.00 46.11 N ATOM 2280 HE ARG A1059 16.780 47.359 22.071 1.00 0.00 H ATOM 2281 HH12 ARG A1059 14.831 49.782 23.721 1.00 0.00 H ATOM 2282 HH11 ARG A1059 15.846 49.399 22.283 1.00 0.00 H ATOM 2283 HH22 ARG A1059 14.477 48.216 25.328 1.00 0.00 H ATOM 2284 HH21 ARG A1059 15.208 46.577 25.180 1.00 0.00 H ATOM 2285 H ARG A1059 17.959 43.797 27.455 1.00 0.00 H ATOM 2286 N LEU A1060 17.585 41.114 24.548 1.00 43.07 N ATOM 2287 CA LEU A1060 18.172 39.781 24.502 1.00 43.15 C ATOM 2288 C LEU A1060 19.673 39.922 24.728 1.00 43.55 C ATOM 2289 O LEU A1060 20.252 40.953 24.382 1.00 43.92 O ATOM 2290 CB LEU A1060 17.901 39.106 23.154 1.00 41.30 C ATOM 2291 CG LEU A1060 16.443 38.715 22.895 1.00 40.91 C ATOM 2292 CD1 LEU A1060 16.173 38.539 21.408 1.00 39.10 C ATOM 2293 CD2 LEU A1060 16.074 37.451 23.661 1.00 42.72 C ATOM 2294 H LEU A1060 17.031 41.456 23.737 1.00 0.00 H ATOM 2295 N PRO A1061 20.310 38.898 25.316 1.00 44.72 N ATOM 2296 CA PRO A1061 21.727 39.036 25.623 1.00 45.88 C ATOM 2297 C PRO A1061 22.594 38.741 24.408 1.00 44.58 C ATOM 2298 O PRO A1061 22.102 38.213 23.409 1.00 43.06 O ATOM 2299 CB PRO A1061 21.947 37.987 26.716 1.00 47.70 C ATOM 2300 CG PRO A1061 20.949 36.912 26.408 1.00 47.53 C ATOM 2301 CD PRO A1061 19.781 37.581 25.717 1.00 46.23 C ATOM 2302 N ALA A1062 23.873 39.094 24.489 1.00 45.41 N ATOM 2303 CA ALA A1062 24.824 38.711 23.460 1.00 45.09 C ATOM 2304 C ALA A1062 24.839 37.186 23.404 1.00 46.19 C ATOM 2305 O ALA A1062 25.024 36.538 24.438 1.00 47.43 O ATOM 2306 CB ALA A1062 26.211 39.245 23.778 1.00 45.17 C ATOM 2307 H ALA A1062 24.198 39.654 25.303 1.00 0.00 H ATOM 2308 N PRO A1063 24.595 36.603 22.214 1.00 45.84 N ATOM 2309 CA PRO A1063 24.739 35.151 22.110 1.00 46.98 C ATOM 2310 C PRO A1063 26.160 34.711 22.448 1.00 48.73 C ATOM 2311 O PRO A1063 27.110 35.451 22.183 1.00 47.64 O ATOM 2312 CB PRO A1063 24.439 34.860 20.633 1.00 45.18 C ATOM 2313 CG PRO A1063 23.665 36.029 20.150 1.00 44.35 C ATOM 2314 CD PRO A1063 24.165 37.207 20.940 1.00 44.39 C ATOM 2315 N PRO A1064 26.311 33.520 23.040 1.00 51.24 N ATOM 2316 CA PRO A1064 27.664 33.026 23.258 1.00 53.58 C ATOM 2317 C PRO A1064 28.389 32.820 21.927 1.00 53.71 C ATOM 2318 O PRO A1064 27.778 32.362 20.954 1.00 53.31 O ATOM 2319 CB PRO A1064 27.443 31.683 23.955 1.00 55.19 C ATOM 2320 CG PRO A1064 26.044 31.721 24.476 1.00 54.84 C ATOM 2321 CD PRO A1064 25.286 32.581 23.531 1.00 52.20 C ATOM 2322 N ALA A1065 29.670 33.169 21.882 1.00 55.04 N ATOM 2323 CA ALA A1065 30.464 33.035 20.657 1.00 55.22 C ATOM 2324 C ALA A1065 29.836 33.771 19.458 1.00 54.14 C ATOM 2325 O ALA A1065 29.848 33.279 18.325 1.00 53.49 O ATOM 2326 CB ALA A1065 30.697 31.558 20.334 1.00 56.50 C ATOM 2327 H ALA A1065 30.122 33.547 22.739 1.00 0.00 H ATOM 2328 N CYS A1066 29.269 34.943 19.738 1.00 53.84 N ATOM 2329 CA CYS A1066 28.881 35.910 18.721 1.00 51.34 C ATOM 2330 C CYS A1066 29.935 37.010 18.782 1.00 52.44 C ATOM 2331 O CYS A1066 30.210 37.528 19.868 1.00 54.09 O ATOM 2332 CB CYS A1066 27.500 36.496 19.033 1.00 50.69 C ATOM 2333 SG CYS A1066 27.027 37.983 18.081 1.00 49.68 S ATOM 2334 H CYS A1066 29.094 35.180 20.735 1.00 0.00 H ATOM 2335 N PRO A1067 30.553 37.354 17.635 1.00 52.17 N ATOM 2336 CA PRO A1067 31.542 38.437 17.656 1.00 52.26 C ATOM 2337 C PRO A1067 30.943 39.724 18.217 1.00 51.67 C ATOM 2338 O PRO A1067 29.798 40.056 17.899 1.00 50.35 O ATOM 2339 CB PRO A1067 31.915 38.613 16.178 1.00 51.70 C ATOM 2340 CG PRO A1067 31.572 37.321 15.534 1.00 52.16 C ATOM 2341 CD PRO A1067 30.390 36.779 16.288 1.00 51.12 C ATOM 2342 N ALA A1068 31.707 40.427 19.053 1.00 52.24 N ATOM 2343 CA ALA A1068 31.220 41.635 19.729 1.00 51.79 C ATOM 2344 C ALA A1068 30.620 42.640 18.754 1.00 49.61 C ATOM 2345 O ALA A1068 29.598 43.254 19.045 1.00 49.30 O ATOM 2346 CB ALA A1068 32.346 42.289 20.533 1.00 53.50 C ATOM 2347 H ALA A1068 32.681 40.109 19.232 1.00 0.00 H ATOM 2348 N GLU A1069 31.258 42.790 17.597 1.00 49.05 N ATOM 2349 CA GLU A1069 30.834 43.756 16.586 1.00 47.98 C ATOM 2350 C GLU A1069 29.436 43.449 16.066 1.00 45.29 C ATOM 2351 O GLU A1069 28.655 44.363 15.797 1.00 44.79 O ATOM 2352 CB GLU A1069 31.819 43.778 15.412 1.00 49.23 C ATOM 2353 CG GLU A1069 33.202 44.342 15.748 1.00 53.45 C ATOM 2354 CD GLU A1069 34.169 43.317 16.325 1.00 57.58 C ATOM 2355 OE1 GLU A1069 33.861 42.103 16.321 1.00 57.22 O ATOM 2356 OE2 GLU A1069 35.250 43.738 16.787 1.00 62.73 O ATOM 2357 H GLU A1069 32.090 42.197 17.404 1.00 0.00 H ATOM 2358 N VAL A1070 29.130 42.161 15.926 1.00 43.88 N ATOM 2359 CA VAL A1070 27.811 41.718 15.473 1.00 42.11 C ATOM 2360 C VAL A1070 26.765 42.026 16.540 1.00 41.57 C ATOM 2361 O VAL A1070 25.656 42.464 16.223 1.00 40.27 O ATOM 2362 CB VAL A1070 27.790 40.205 15.146 1.00 41.60 C ATOM 2363 CG1 VAL A1070 26.392 39.761 14.722 1.00 39.77 C ATOM 2364 CG2 VAL A1070 28.804 39.877 14.049 1.00 42.08 C ATOM 2365 H VAL A1070 29.852 41.446 16.146 1.00 0.00 H ATOM 2366 N HIS A1071 27.126 41.801 17.801 1.00 41.90 N ATOM 2367 CA HIS A1071 26.248 42.125 18.924 1.00 42.76 C ATOM 2368 C HIS A1071 25.906 43.615 18.974 1.00 42.53 C ATOM 2369 O HIS A1071 24.775 43.989 19.288 1.00 41.61 O ATOM 2370 CB HIS A1071 26.880 41.697 20.248 1.00 43.93 C ATOM 2371 CG HIS A1071 26.034 42.009 21.435 1.00 44.52 C ATOM 2372 ND1 HIS A1071 24.711 41.638 21.513 1.00 44.34 N ATOM 2373 CD2 HIS A1071 26.311 42.668 22.585 1.00 47.45 C ATOM 2374 CE1 HIS A1071 24.208 42.048 22.664 1.00 45.80 C ATOM 2375 NE2 HIS A1071 25.158 42.676 23.332 1.00 48.09 N ATOM 2376 H HIS A1071 28.059 41.383 17.993 1.00 0.00 H ATOM 2377 N GLU A1072 26.890 44.455 18.666 1.00 42.88 N ATOM 2378 CA GLU A1072 26.673 45.899 18.575 1.00 43.22 C ATOM 2379 C GLU A1072 25.706 46.283 17.442 1.00 41.07 C ATOM 2380 O GLU A1072 24.978 47.264 17.566 1.00 41.33 O ATOM 2381 CB GLU A1072 28.006 46.636 18.400 1.00 43.94 C ATOM 2382 CG GLU A1072 28.941 46.534 19.601 1.00 47.15 C ATOM 2383 CD GLU A1072 28.380 47.189 20.849 1.00 48.41 C ATOM 2384 OE1 GLU A1072 27.719 48.239 20.725 1.00 48.57 O ATOM 2385 OE2 GLU A1072 28.603 46.656 21.955 1.00 50.27 O ATOM 2386 H GLU A1072 27.841 44.075 18.485 1.00 0.00 H ATOM 2387 N LEU A1073 25.699 45.524 16.345 1.00 39.59 N ATOM 2388 CA LEU A1073 24.754 45.784 15.251 1.00 38.85 C ATOM 2389 C LEU A1073 23.336 45.411 15.665 1.00 38.17 C ATOM 2390 O LEU A1073 22.388 46.130 15.345 1.00 37.48 O ATOM 2391 CB LEU A1073 25.137 45.024 13.974 1.00 38.45 C ATOM 2392 CG LEU A1073 26.441 45.424 13.279 1.00 40.87 C ATOM 2393 CD1 LEU A1073 26.716 44.487 12.114 1.00 41.65 C ATOM 2394 CD2 LEU A1073 26.411 46.871 12.806 1.00 41.08 C ATOM 2395 H LEU A1073 26.373 44.736 16.263 1.00 0.00 H ATOM 2396 N MET A1074 23.195 44.286 16.371 1.00 38.21 N ATOM 2397 CA MET A1074 21.907 43.891 16.942 1.00 37.67 C ATOM 2398 C MET A1074 21.377 45.001 17.828 1.00 38.09 C ATOM 2399 O MET A1074 20.203 45.355 17.748 1.00 38.88 O ATOM 2400 CB MET A1074 22.023 42.623 17.786 1.00 38.46 C ATOM 2401 CG MET A1074 22.415 41.357 17.047 1.00 38.31 C ATOM 2402 SD MET A1074 22.525 40.000 18.234 1.00 40.19 S ATOM 2403 CE MET A1074 23.670 38.894 17.426 1.00 40.50 C ATOM 2404 H MET A1074 24.023 43.674 16.519 1.00 0.00 H ATOM 2405 N LYS A1075 22.244 45.543 18.679 1.00 38.94 N ATOM 2406 CA LYS A1075 21.841 46.593 19.617 1.00 40.27 C ATOM 2407 C LYS A1075 21.365 47.849 18.884 1.00 39.72 C ATOM 2408 O LYS A1075 20.405 48.490 19.311 1.00 40.77 O ATOM 2409 CB LYS A1075 22.974 46.927 20.602 1.00 41.69 C ATOM 2410 CG LYS A1075 23.193 45.857 21.680 1.00 42.65 C ATOM 2411 CD LYS A1075 23.999 46.380 22.875 1.00 43.95 C ATOM 2412 CE LYS A1075 25.480 46.479 22.564 1.00 44.82 C ATOM 2413 NZ LYS A1075 26.233 47.257 23.590 1.00 45.08 N ATOM 2414 HZ1 LYS A1075 25.852 48.223 23.639 1.00 0.00 H ATOM 2415 HZ2 LYS A1075 26.132 46.796 24.517 1.00 0.00 H ATOM 2416 HZ3 LYS A1075 27.239 47.293 23.327 1.00 0.00 H ATOM 2417 H LYS A1075 23.230 45.214 18.678 1.00 0.00 H ATOM 2418 N LEU A1076 22.029 48.189 17.781 1.00 38.43 N ATOM 2419 CA LEU A1076 21.591 49.304 16.935 1.00 38.01 C ATOM 2420 C LEU A1076 20.255 48.989 16.263 1.00 36.27 C ATOM 2421 O LEU A1076 19.397 49.866 16.137 1.00 36.90 O ATOM 2422 CB LEU A1076 22.650 49.642 15.879 1.00 37.97 C ATOM 2423 CG LEU A1076 23.947 50.278 16.393 1.00 40.15 C ATOM 2424 CD1 LEU A1076 24.985 50.317 15.280 1.00 39.85 C ATOM 2425 CD2 LEU A1076 23.711 51.671 16.947 1.00 41.05 C ATOM 2426 H LEU A1076 22.878 47.651 17.513 1.00 0.00 H ATOM 2427 N CYS A1077 20.082 47.738 15.837 1.00 34.47 N ATOM 2428 CA CYS A1077 18.806 47.285 15.280 1.00 33.19 C ATOM 2429 C CYS A1077 17.669 47.413 16.296 1.00 33.62 C ATOM 2430 O CYS A1077 16.526 47.649 15.910 1.00 33.99 O ATOM 2431 CB CYS A1077 18.901 45.838 14.784 1.00 31.97 C ATOM 2432 SG CYS A1077 19.875 45.626 13.272 1.00 34.52 S ATOM 2433 H CYS A1077 20.874 47.067 15.902 1.00 0.00 H ATOM 2434 N TRP A1078 17.986 47.259 17.583 1.00 34.43 N ATOM 2435 CA TRP A1078 17.001 47.426 18.657 1.00 34.97 C ATOM 2436 C TRP A1078 17.081 48.807 19.330 1.00 36.78 C ATOM 2437 O TRP A1078 17.022 48.909 20.551 1.00 37.77 O ATOM 2438 CB TRP A1078 17.164 46.335 19.721 1.00 34.50 C ATOM 2439 CG TRP A1078 17.164 44.939 19.192 1.00 33.44 C ATOM 2440 CD1 TRP A1078 16.389 44.441 18.191 1.00 31.85 C ATOM 2441 CD2 TRP A1078 17.973 43.852 19.653 1.00 33.22 C ATOM 2442 NE1 TRP A1078 16.673 43.114 17.989 1.00 31.48 N ATOM 2443 CE2 TRP A1078 17.641 42.726 18.873 1.00 30.04 C ATOM 2444 CE3 TRP A1078 18.955 43.724 20.642 1.00 33.13 C ATOM 2445 CZ2 TRP A1078 18.246 41.485 19.056 1.00 30.86 C ATOM 2446 CZ3 TRP A1078 19.558 42.494 20.822 1.00 34.03 C ATOM 2447 CH2 TRP A1078 19.202 41.388 20.032 1.00 33.12 C ATOM 2448 HE1 TRP A1078 16.224 42.502 17.278 1.00 0.00 H ATOM 2449 H TRP A1078 18.965 47.012 17.833 1.00 0.00 H ATOM 2450 N ALA A1079 17.214 49.869 18.539 1.00 37.59 N ATOM 2451 CA ALA A1079 17.170 51.226 19.085 1.00 39.00 C ATOM 2452 C ALA A1079 15.718 51.546 19.456 1.00 40.63 C ATOM 2453 O ALA A1079 14.802 51.168 18.732 1.00 39.96 O ATOM 2454 CB ALA A1079 17.704 52.227 18.078 1.00 38.19 C ATOM 2455 H ALA A1079 17.351 49.732 17.517 1.00 0.00 H ATOM 2456 N PRO A1080 15.496 52.216 20.599 1.00 42.57 N ATOM 2457 CA PRO A1080 14.111 52.495 21.007 1.00 44.40 C ATOM 2458 C PRO A1080 13.264 53.149 19.905 1.00 44.73 C ATOM 2459 O PRO A1080 12.142 52.706 19.637 1.00 43.43 O ATOM 2460 CB PRO A1080 14.279 53.454 22.193 1.00 45.67 C ATOM 2461 CG PRO A1080 15.628 53.151 22.736 1.00 45.53 C ATOM 2462 CD PRO A1080 16.477 52.733 21.570 1.00 43.30 C ATOM 2463 N SER A1081 13.811 54.191 19.282 1.00 45.44 N ATOM 2464 CA SER A1081 13.113 54.941 18.243 1.00 46.34 C ATOM 2465 C SER A1081 13.419 54.363 16.859 1.00 43.71 C ATOM 2466 O SER A1081 14.577 54.090 16.553 1.00 42.29 O ATOM 2467 CB SER A1081 13.533 56.411 18.288 1.00 48.56 C ATOM 2468 OG SER A1081 12.821 57.172 17.328 1.00 52.67 O ATOM 2469 HG SER A1081 13.110 58.117 17.377 1.00 0.00 H ATOM 2470 H SER A1081 14.774 54.482 19.546 1.00 0.00 H ATOM 2471 N PRO A1082 12.384 54.180 16.017 1.00 44.17 N ATOM 2472 CA PRO A1082 12.579 53.678 14.647 1.00 43.04 C ATOM 2473 C PRO A1082 13.632 54.437 13.845 1.00 43.43 C ATOM 2474 O PRO A1082 14.403 53.817 13.111 1.00 43.01 O ATOM 2475 CB PRO A1082 11.206 53.873 14.001 1.00 43.25 C ATOM 2476 CG PRO A1082 10.248 53.858 15.121 1.00 44.43 C ATOM 2477 CD PRO A1082 10.959 54.423 16.311 1.00 45.22 C ATOM 2478 N GLN A1083 13.659 55.763 13.994 1.00 45.76 N ATOM 2479 CA GLN A1083 14.556 56.624 13.212 1.00 47.00 C ATOM 2480 C GLN A1083 16.035 56.510 13.596 1.00 46.17 C ATOM 2481 O GLN A1083 16.901 56.946 12.835 1.00 46.86 O ATOM 2482 CB GLN A1083 14.123 58.097 13.296 1.00 49.86 C ATOM 2483 CG GLN A1083 14.115 58.695 14.711 1.00 53.44 C ATOM 2484 CD GLN A1083 14.200 60.219 14.724 1.00 56.63 C ATOM 2485 OE1 GLN A1083 13.968 60.883 13.711 1.00 61.72 O ATOM 2486 NE2 GLN A1083 14.531 60.778 15.883 1.00 61.12 N ATOM 2487 HE22 GLN A1083 14.719 60.181 16.714 1.00 0.00 H ATOM 2488 HE21 GLN A1083 14.602 61.813 15.960 1.00 0.00 H ATOM 2489 H GLN A1083 13.022 56.202 14.689 1.00 0.00 H ATOM 2490 N ASP A1084 16.314 55.951 14.774 1.00 45.59 N ATOM 2491 CA ASP A1084 17.688 55.760 15.251 1.00 44.77 C ATOM 2492 C ASP A1084 18.266 54.400 14.855 1.00 42.81 C ATOM 2493 O ASP A1084 19.444 54.139 15.088 1.00 42.70 O ATOM 2494 CB ASP A1084 17.748 55.909 16.775 1.00 46.41 C ATOM 2495 CG ASP A1084 17.415 57.314 17.241 1.00 47.83 C ATOM 2496 OD1 ASP A1084 17.395 58.236 16.403 1.00 47.70 O ATOM 2497 OD2 ASP A1084 17.181 57.496 18.450 1.00 49.48 O ATOM 2498 H ASP A1084 15.527 55.638 15.378 1.00 0.00 H ATOM 2499 N ARG A1085 17.436 53.534 14.273 1.00 41.10 N ATOM 2500 CA ARG A1085 17.899 52.242 13.770 1.00 38.26 C ATOM 2501 C ARG A1085 18.563 52.441 12.414 1.00 37.69 C ATOM 2502 O ARG A1085 18.123 53.284 11.627 1.00 38.25 O ATOM 2503 CB ARG A1085 16.732 51.261 13.626 1.00 37.20 C ATOM 2504 CG ARG A1085 16.062 50.903 14.936 1.00 37.16 C ATOM 2505 CD ARG A1085 14.708 50.244 14.731 1.00 36.25 C ATOM 2506 NE ARG A1085 13.901 50.347 15.944 1.00 37.18 N ATOM 2507 CZ ARG A1085 12.584 50.160 16.012 1.00 35.85 C ATOM 2508 NH1 ARG A1085 11.962 50.295 17.175 1.00 34.68 N ATOM 2509 NH2 ARG A1085 11.886 49.829 14.935 1.00 34.83 N ATOM 2510 HE ARG A1085 14.395 50.586 16.827 1.00 0.00 H ATOM 2511 HH12 ARG A1085 10.934 50.150 17.235 1.00 0.00 H ATOM 2512 HH11 ARG A1085 12.502 50.546 18.028 1.00 0.00 H ATOM 2513 HH22 ARG A1085 10.858 49.687 15.005 1.00 0.00 H ATOM 2514 HH21 ARG A1085 12.366 49.712 14.020 1.00 0.00 H ATOM 2515 H ARG A1085 16.431 53.785 14.174 1.00 0.00 H ATOM 2516 N PRO A1086 19.618 51.659 12.128 1.00 36.33 N ATOM 2517 CA PRO A1086 20.258 51.760 10.825 1.00 35.16 C ATOM 2518 C PRO A1086 19.385 51.149 9.745 1.00 33.55 C ATOM 2519 O PRO A1086 18.637 50.215 10.018 1.00 33.63 O ATOM 2520 CB PRO A1086 21.538 50.944 11.001 1.00 34.59 C ATOM 2521 CG PRO A1086 21.209 49.956 12.052 1.00 34.70 C ATOM 2522 CD PRO A1086 20.261 50.643 12.982 1.00 35.03 C ATOM 2523 N SER A1087 19.473 51.678 8.532 1.00 33.45 N ATOM 2524 CA SER A1087 18.796 51.068 7.396 1.00 32.98 C ATOM 2525 C SER A1087 19.504 49.772 7.008 1.00 31.86 C ATOM 2526 O SER A1087 20.689 49.574 7.322 1.00 29.84 O ATOM 2527 CB SER A1087 18.778 52.022 6.203 1.00 33.91 C ATOM 2528 OG SER A1087 20.067 52.144 5.629 1.00 34.14 O ATOM 2529 HG SER A1087 20.027 52.766 4.860 1.00 0.00 H ATOM 2530 H SER A1087 20.034 52.542 8.390 1.00 0.00 H ATOM 2531 N PHE A1088 18.782 48.893 6.317 1.00 31.12 N ATOM 2532 CA PHE A1088 19.384 47.669 5.801 1.00 30.26 C ATOM 2533 C PHE A1088 20.593 47.979 4.915 1.00 30.34 C ATOM 2534 O PHE A1088 21.569 47.238 4.928 1.00 30.87 O ATOM 2535 CB PHE A1088 18.357 46.820 5.050 1.00 30.48 C ATOM 2536 CG PHE A1088 17.400 46.089 5.956 1.00 29.55 C ATOM 2537 CD1 PHE A1088 17.851 45.075 6.788 1.00 28.95 C ATOM 2538 CD2 PHE A1088 16.052 46.412 5.977 1.00 30.67 C ATOM 2539 CE1 PHE A1088 16.974 44.399 7.635 1.00 28.67 C ATOM 2540 CE2 PHE A1088 15.168 45.739 6.824 1.00 32.12 C ATOM 2541 CZ PHE A1088 15.634 44.728 7.651 1.00 29.24 C ATOM 2542 H PHE A1088 17.774 49.082 6.143 1.00 0.00 H ATOM 2543 N SER A1089 20.530 49.091 4.184 1.00 30.86 N ATOM 2544 CA SER A1089 21.624 49.534 3.312 1.00 31.98 C ATOM 2545 C SER A1089 22.904 49.909 4.070 1.00 32.92 C ATOM 2546 O SER A1089 24.004 49.797 3.526 1.00 33.12 O ATOM 2547 CB SER A1089 21.168 50.734 2.481 1.00 32.40 C ATOM 2548 OG SER A1089 19.936 50.457 1.835 1.00 33.82 O ATOM 2549 HG SER A1089 19.245 50.257 2.516 1.00 0.00 H ATOM 2550 H SER A1089 19.668 49.670 4.234 1.00 0.00 H ATOM 2551 N ALA A1090 22.753 50.383 5.306 1.00 32.56 N ATOM 2552 CA ALA A1090 23.893 50.717 6.159 1.00 33.03 C ATOM 2553 C ALA A1090 24.431 49.466 6.853 1.00 32.39 C ATOM 2554 O ALA A1090 25.637 49.341 7.075 1.00 34.33 O ATOM 2555 CB ALA A1090 23.495 51.757 7.192 1.00 34.07 C ATOM 2556 H ALA A1090 21.791 50.520 5.677 1.00 0.00 H ATOM 2557 N LEU A1091 23.528 48.551 7.200 1.00 30.91 N ATOM 2558 CA LEU A1091 23.898 47.288 7.830 1.00 30.53 C ATOM 2559 C LEU A1091 24.727 46.392 6.916 1.00 30.03 C ATOM 2560 O LEU A1091 25.710 45.797 7.360 1.00 30.06 O ATOM 2561 CB LEU A1091 22.646 46.525 8.290 1.00 30.34 C ATOM 2562 CG LEU A1091 21.975 47.038 9.568 1.00 32.51 C ATOM 2563 CD1 LEU A1091 20.619 46.357 9.778 1.00 30.15 C ATOM 2564 CD2 LEU A1091 22.889 46.828 10.773 1.00 32.02 C ATOM 2565 H LEU A1091 22.523 48.744 7.015 1.00 0.00 H ATOM 2566 N GLY A1092 24.322 46.298 5.648 1.00 29.51 N ATOM 2567 CA GLY A1092 24.958 45.401 4.677 1.00 28.33 C ATOM 2568 C GLY A1092 26.475 45.450 4.665 1.00 29.07 C ATOM 2569 O GLY A1092 27.134 44.435 4.899 1.00 28.99 O ATOM 2570 H GLY A1092 23.522 46.885 5.335 1.00 0.00 H ATOM 2571 N PRO A1093 27.045 46.631 4.391 1.00 29.81 N ATOM 2572 CA PRO A1093 28.492 46.773 4.402 1.00 32.15 C ATOM 2573 C PRO A1093 29.129 46.493 5.760 1.00 32.95 C ATOM 2574 O PRO A1093 30.251 45.992 5.809 1.00 34.84 O ATOM 2575 CB PRO A1093 28.704 48.235 3.997 1.00 32.93 C ATOM 2576 CG PRO A1093 27.460 48.617 3.299 1.00 31.29 C ATOM 2577 CD PRO A1093 26.384 47.887 4.014 1.00 30.40 C ATOM 2578 N GLN A1094 28.426 46.816 6.845 1.00 33.35 N ATOM 2579 CA GLN A1094 28.933 46.542 8.194 1.00 33.86 C ATOM 2580 C GLN A1094 29.002 45.037 8.456 1.00 33.94 C ATOM 2581 O GLN A1094 29.940 44.564 9.087 1.00 36.58 O ATOM 2582 CB GLN A1094 28.091 47.248 9.263 1.00 32.62 C ATOM 2583 CG GLN A1094 28.242 48.769 9.257 1.00 34.18 C ATOM 2584 CD GLN A1094 27.464 49.448 10.377 1.00 35.18 C ATOM 2585 OE1 GLN A1094 27.930 49.525 11.517 1.00 34.98 O ATOM 2586 NE2 GLN A1094 26.279 49.958 10.050 1.00 29.06 N ATOM 2587 HE22 GLN A1094 25.926 49.869 9.076 1.00 0.00 H ATOM 2588 HE21 GLN A1094 25.706 50.445 10.769 1.00 0.00 H ATOM 2589 H GLN A1094 27.498 47.272 6.733 1.00 0.00 H ATOM 2590 N LEU A1095 28.028 44.285 7.953 1.00 32.86 N ATOM 2591 CA LEU A1095 28.066 42.831 8.060 1.00 33.31 C ATOM 2592 C LEU A1095 29.150 42.215 7.167 1.00 35.21 C ATOM 2593 O LEU A1095 29.879 41.331 7.607 1.00 36.02 O ATOM 2594 CB LEU A1095 26.703 42.226 7.715 1.00 31.98 C ATOM 2595 CG LEU A1095 25.559 42.504 8.695 1.00 30.75 C ATOM 2596 CD1 LEU A1095 24.251 42.080 8.085 1.00 28.97 C ATOM 2597 CD2 LEU A1095 25.778 41.794 10.018 1.00 31.65 C ATOM 2598 H LEU A1095 27.225 44.741 7.475 1.00 0.00 H ATOM 2599 N ASP A1096 29.256 42.687 5.926 1.00 36.13 N ATOM 2600 CA ASP A1096 30.211 42.129 4.953 1.00 38.27 C ATOM 2601 C ASP A1096 31.682 42.347 5.329 1.00 40.63 C ATOM 2602 O ASP A1096 32.534 41.520 5.003 1.00 42.20 O ATOM 2603 CB ASP A1096 29.970 42.714 3.547 1.00 38.66 C ATOM 2604 CG ASP A1096 28.624 42.319 2.961 1.00 39.02 C ATOM 2605 OD1 ASP A1096 27.942 43.188 2.377 1.00 41.42 O ATOM 2606 OD2 ASP A1096 28.242 41.140 3.082 1.00 42.07 O ATOM 2607 H ASP A1096 28.644 43.476 5.634 1.00 0.00 H ATOM 2608 N MET A1097 31.978 43.453 6.005 1.00 41.84 N ATOM 2609 CA MET A1097 33.360 43.852 6.257 1.00 44.77 C ATOM 2610 C MET A1097 33.920 43.425 7.628 1.00 46.26 C ATOM 2611 O MET A1097 35.035 43.811 7.991 1.00 48.27 O ATOM 2612 CB MET A1097 33.486 45.365 6.059 1.00 45.34 C ATOM 2613 CG MET A1097 33.279 45.787 4.608 1.00 46.66 C ATOM 2614 SD MET A1097 33.688 47.515 4.287 1.00 50.03 S ATOM 2615 CE MET A1097 32.346 48.291 5.154 1.00 47.79 C ATOM 2616 H MET A1097 31.205 44.049 6.364 1.00 0.00 H ATOM 2617 N LEU A1098 33.171 42.621 8.380 1.00 46.15 N ATOM 2618 CA LEU A1098 33.691 42.041 9.626 1.00 47.16 C ATOM 2619 C LEU A1098 34.630 40.867 9.352 1.00 49.14 C ATOM 2620 O LEU A1098 34.375 40.040 8.476 1.00 48.48 O ATOM 2621 CB LEU A1098 32.553 41.577 10.531 1.00 46.28 C ATOM 2622 CG LEU A1098 31.692 42.685 11.136 1.00 46.78 C ATOM 2623 CD1 LEU A1098 30.513 42.087 11.887 1.00 46.43 C ATOM 2624 CD2 LEU A1098 32.508 43.596 12.043 1.00 49.00 C ATOM 2625 H LEU A1098 32.200 42.399 8.080 1.00 0.00 H TER 2626 LEU A1098 HETATM 2627 O HOH 1 11.028 46.003 4.684 1.00 24.03 O HETATM 2628 O HOH 2 22.064 42.695 24.775 1.00 52.56 O HETATM 2629 O HOH 3 3.652 39.762 11.844 1.00 36.02 O HETATM 2630 O HOH 4 18.331 41.329 -4.004 1.00 31.75 O HETATM 2631 O HOH 5 9.651 52.459 6.361 1.00 36.71 O HETATM 2632 O HOH 6 2.458 40.788 -9.417 1.00 24.60 O HETATM 2633 O HOH 7 17.757 50.315 3.335 1.00 23.64 O HETATM 2634 O HOH 8 12.872 44.271 -9.316 1.00 31.77 O HETATM 2635 O HOH 9 5.063 38.111 5.804 1.00 32.88 O HETATM 2636 O HOH 10 9.936 35.811 -6.091 1.00 25.45 O HETATM 2637 O HOH 11 -2.720 60.760 7.724 1.00 55.18 O HETATM 2638 O HOH 12 19.446 48.079 21.814 1.00 33.26 O HETATM 2639 O HOH 13 29.357 46.951 15.279 1.00 41.47 O HETATM 2640 O HOH 14 25.303 49.275 19.975 1.00 33.69 O HETATM 2641 O HOH 15 7.561 11.468 -6.669 1.00 40.73 O HETATM 2642 O HOH 16 32.880 29.972 14.451 1.00 33.58 O HETATM 2643 O HOH 17 19.571 39.383 -6.225 1.00 35.81 O HETATM 2644 O HOH 18 17.239 42.129 -6.661 1.00 43.93 O HETATM 2645 O HOH 19 12.527 36.493 -5.789 1.00 27.21 O HETATM 2646 O HOH 20 21.736 25.574 -5.233 1.00 43.63 O HETATM 2647 O HOH 21 24.946 43.107 2.327 1.00 35.63 O HETATM 2648 O HOH 22 13.464 47.060 4.208 1.00 18.75 O HETATM 2649 O HOH 23 13.823 19.222 -8.027 1.00 28.71 O HETATM 2650 O HOH 24 13.127 24.289 -12.229 1.00 36.55 O HETATM 2651 O HOH 25 16.182 42.365 21.917 1.00 42.23 O HETATM 2652 O HOH 26 14.397 15.685 -7.972 1.00 35.00 O HETATM 2653 O HOH 27 22.856 35.300 -10.235 1.00 46.20 O HETATM 2654 O HOH 28 31.984 36.444 6.158 1.00 46.29 O HETATM 2655 O HOH 29 8.290 15.951 -16.454 1.00 39.36 O HETATM 2656 C2 GYW A 30 10.212 26.066 0.001 1.00 0.15 C HETATM 2657 C4 GYW A 30 9.725 27.026 -0.858 1.00 -0.01 C HETATM 2658 C6 GYW A 30 8.729 27.868 -0.388 1.00 -0.03 C HETATM 2659 C5 GYW A 30 8.250 27.723 0.907 1.00 0.14 C HETATM 2660 C3 GYW A 30 8.770 26.740 1.740 1.00 0.13 C HETATM 2661 N1 GYW A 30 9.743 25.942 1.248 1.00 -0.18 N HETATM 2662 C7 GYW A 30 10.405 24.929 1.814 1.00 0.13 C HETATM 2663 C8 GYW A 30 11.305 24.447 0.886 1.00 -0.01 C HETATM 2664 N9 GYW A 30 11.171 25.166 -0.244 1.00 -0.33 N HETATM 2665 H4 GYW A 30 12.004 23.626 1.041 1.00 0.06 H HETATM 2666 C12 GYW A 30 10.285 24.387 3.181 1.00 0.10 C HETATM 2667 N14 GYW A 30 10.920 23.200 3.539 1.00 -0.31 N HETATM 2668 C13 GYW A 30 10.821 22.692 4.826 1.00 0.03 C HETATM 2669 C15 GYW A 30 10.081 23.398 5.761 1.00 0.14 C HETATM 2670 C16 GYW A 30 9.469 24.572 5.406 1.00 0.18 C HETATM 2671 N20 GYW A 30 8.786 25.113 6.510 1.00 -0.18 N HETATM 2672 C19 GYW A 30 9.040 24.187 7.516 1.00 0.32 C HETATM 2673 O21 GYW A 30 8.601 24.312 8.639 1.00 -0.39 O HETATM 2674 N18 GYW A 30 9.834 23.115 7.123 1.00 -0.19 N HETATM 2675 C22 GYW A 30 10.252 21.976 7.970 1.00 0.08 C HETATM 2676 C23 GYW A 30 11.710 21.517 7.805 1.00 0.07 C HETATM 2677 O24 GYW A 30 12.609 22.618 7.738 1.00 -0.39 O HETATM 2678 H13 GYW A 30 12.546 23.126 8.538 1.00 0.21 H HETATM 2679 H5 GYW A 30 11.796 20.931 6.878 1.00 0.06 H HETATM 2680 H6 GYW A 30 11.984 20.886 8.664 1.00 0.06 H HETATM 2681 H11 GYW A 30 10.107 22.266 9.021 1.00 0.06 H HETATM 2682 H12 GYW A 30 9.601 21.122 7.732 1.00 0.06 H HETATM 2683 C25 GYW A 30 7.965 26.327 6.692 1.00 0.08 C HETATM 2684 C30 GYW A 30 8.807 27.558 6.364 1.00 0.00 C HETATM 2685 C29 GYW A 30 7.906 28.795 6.450 1.00 0.05 C HETATM 2686 O28 GYW A 30 6.852 28.684 5.493 1.00 -0.38 O HETATM 2687 C27 GYW A 30 5.975 27.594 5.790 1.00 0.05 C HETATM 2688 C26 GYW A 30 6.739 26.258 5.763 1.00 0.00 C HETATM 2689 H18 GYW A 30 7.073 26.051 4.736 1.00 0.03 H HETATM 2690 H19 GYW A 30 6.072 25.451 6.101 1.00 0.03 H HETATM 2691 H7 GYW A 30 5.169 27.564 5.042 1.00 0.06 H HETATM 2692 H8 GYW A 30 5.541 27.742 6.790 1.00 0.06 H HETATM 2693 H16 GYW A 30 7.478 28.867 7.461 1.00 0.06 H HETATM 2694 H17 GYW A 30 8.500 29.696 6.239 1.00 0.06 H HETATM 2695 H9 GYW A 30 9.218 27.467 5.348 1.00 0.03 H HETATM 2696 H10 GYW A 30 9.632 27.648 7.086 1.00 0.03 H HETATM 2697 H15 GYW A 30 7.626 26.387 7.737 1.00 0.06 H HETATM 2698 N17 GYW A 30 9.557 25.087 4.132 1.00 -0.27 N HETATM 2699 H14 GYW A 30 11.312 21.763 5.094 1.00 0.07 H HETATM 2700 H1 GYW A 30 8.405 26.616 2.758 1.00 0.15 H HETATM 2701 C10 GYW A 30 7.222 28.599 1.362 1.00 0.09 C HETATM 2702 N11 GYW A 30 6.385 29.314 1.726 1.00 -0.35 N HETATM 2703 H3 GYW A 30 8.322 28.644 -1.035 1.00 0.07 H HETATM 2704 H2 GYW A 30 10.109 27.120 -1.873 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 427 428 431 432 433 CONECT 431 427 CONECT 432 427 CONECT 433 427 CONECT 755 756 766 767 768 CONECT 766 755 CONECT 767 755 CONECT 768 755 CONECT 1593 1586 1594 1609 CONECT 1594 1593 1595 1597 CONECT 1595 1594 1596 1610 CONECT 1596 1595 CONECT 1597 1594 1598 CONECT 1598 1597 1599 1608 CONECT 1599 1598 1600 CONECT 1600 1599 1601 CONECT 1601 1600 1602 1607 CONECT 1602 1601 1603 CONECT 1603 1602 1604 1605 1606 CONECT 1604 1603 CONECT 1605 1603 CONECT 1606 1603 CONECT 1607 1601 1608 CONECT 1608 1598 1607 CONECT 1609 1593 CONECT 1610 1595 1611 1626 CONECT 1611 1610 1612 1614 CONECT 1612 1611 1613 1627 CONECT 1613 1612 CONECT 1614 1611 1615 CONECT 1615 1614 1616 1625 CONECT 1616 1615 1617 CONECT 1617 1616 1618 CONECT 1618 1617 1619 1624 CONECT 1619 1618 1620 CONECT 1620 1619 1621 1622 1623 CONECT 1621 1620 CONECT 1622 1620 CONECT 1623 1620 CONECT 1624 1618 1625 CONECT 1625 1615 1624 CONECT 1626 1610 CONECT 1661 1662 1667 1668 1669 CONECT 1668 1661 CONECT 1669 1661 CONECT 2137 2138 2143 2144 2145 CONECT 2144 2137 CONECT 2145 2137 CONECT 2656 2657 2661 2664 CONECT 2657 2656 2658 2704 CONECT 2658 2657 2659 2703 CONECT 2659 2658 2660 2701 CONECT 2660 2659 2661 2700 CONECT 2661 2656 2660 2662 CONECT 2662 2661 2663 2666 CONECT 2663 2662 2664 2665 CONECT 2664 2656 2663 CONECT 2665 2663 CONECT 2666 2662 2667 2698 CONECT 2667 2666 2668 CONECT 2668 2667 2669 2699 CONECT 2669 2668 2670 2674 CONECT 2670 2669 2671 2698 CONECT 2671 2670 2672 2683 CONECT 2672 2671 2673 2674 CONECT 2673 2672 CONECT 2674 2669 2672 2675 CONECT 2675 2674 2676 2681 2682 CONECT 2676 2675 2677 2679 2680 CONECT 2677 2676 2678 CONECT 2678 2677 CONECT 2679 2676 CONECT 2680 2676 CONECT 2681 2675 CONECT 2682 2675 CONECT 2683 2671 2684 2688 2697 CONECT 2684 2683 2685 2695 2696 CONECT 2685 2684 2686 2693 2694 CONECT 2686 2685 2687 CONECT 2687 2686 2688 2691 2692 CONECT 2688 2683 2687 2689 2690 CONECT 2689 2688 CONECT 2690 2688 CONECT 2691 2687 CONECT 2692 2687 CONECT 2693 2685 CONECT 2694 2685 CONECT 2695 2684 CONECT 2696 2684 CONECT 2697 2683 CONECT 2698 2666 2670 CONECT 2699 2668 CONECT 2700 2660 CONECT 2701 2659 2702 CONECT 2702 2701 CONECT 2703 2658 CONECT 2704 2657 MASTER 0 0 0 0 0 0 0 0 2699 5 101 23 END
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Structure:
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Related entries of code: 6hzv
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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PDBbind
327aa, >3LXK_1|Chain... *
3lxl
RCSB PDB
PDBbind
327aa, >3LXL_1|Chain... at 100%
3pjc
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PDBbind
315aa, >3PJC_1|Chain... at 99%
3zc6
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PDBbind
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3zep
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PDBbind
288aa, >3ZEP_1|Chains... at 99%
4hvd
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PDBbind
314aa, >4HVD_1|Chain... at 99%
4hvg
RCSB PDB
PDBbind
314aa, >4HVG_1|Chain... at 99%
4hvh
RCSB PDB
PDBbind
314aa, >4HVH_1|Chain... at 99%
4hvi
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PDBbind
314aa, >4HVI_1|Chain... at 99%
4i6q
RCSB PDB
PDBbind
314aa, >4I6Q_1|Chain... at 99%
4qps
RCSB PDB
PDBbind
293aa, >4QPS_1|Chains... at 99%
4qt1
RCSB PDB
PDBbind
314aa, >4QT1_1|Chain... at 99%
4rio
RCSB PDB
PDBbind
293aa, >4RIO_1|Chain... at 98%
4z16
RCSB PDB
PDBbind
316aa, >4Z16_1|Chains... at 98%
5lwm
RCSB PDB
PDBbind
294aa, >5LWM_1|Chain... at 98%
5lwn
RCSB PDB
PDBbind
294aa, >5LWN_1|Chain... at 98%
5toz
RCSB PDB
PDBbind
321aa, >5TOZ_1|Chain... at 100%
5tts
RCSB PDB
PDBbind
321aa, >5TTS_1|Chain... at 100%
5ttu
RCSB PDB
PDBbind
321aa, >5TTU_1|Chain... at 100%
5ttv
RCSB PDB
PDBbind
321aa, >5TTV_1|Chain... at 100%
5vo6
RCSB PDB
PDBbind
293aa, >5VO6_1|Chain... at 98%
5w86
RCSB PDB
PDBbind
287aa, >5W86_1|Chains... at 99%
5wfj
RCSB PDB
PDBbind
293aa, >5WFJ_1|Chain... at 98%
6aak
RCSB PDB
PDBbind
287aa, >6AAK_1|Chains... at 99%
6da4
RCSB PDB
PDBbind
321aa, >6DA4_1|Chain... at 100%
6db3
RCSB PDB
PDBbind
321aa, >6DB3_1|Chain... at 100%
6db4
RCSB PDB
PDBbind
321aa, >6DB4_1|Chain... at 100%
6dud
RCSB PDB
PDBbind
321aa, >6DUD_1|Chain... at 100%
6gl9
RCSB PDB
PDBbind
294aa, >6GL9_1|Chains... at 98%
6gla
RCSB PDB
PDBbind
294aa, >6GLA_1|Chains... at 98%
6glb
RCSB PDB
PDBbind
294aa, >6GLB_1|Chains... at 98%
6ny4
RCSB PDB
PDBbind
293aa, >6NY4_1|Chain... at 98%
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
6hzv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
JAK3
Ligand Name
GYW
EC.Number
E.C.-.-.-.-
Resolution
2.46(Å)
Affinity (Kd/Ki/IC50)
IC50=6nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 9045-9060
Ligand Properties
Formula
C
2
0
H
1
9
N
7
O
3
Molecular Weight
405.410
Exact Mass
405.155
No. of atoms
49
No. of bonds
53
Polar Surface Area
123.26
LOGP Value
0.52 (
Computed with XLOGP3
)
1.12 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
OCCn1c(=O)n(c2c1cnc(n2)c1cnc2n1cc(C#N)cc2)C1CCOCC1
InChI String
InChI=1S/C20H19N7O3/c21-9-13-1-2-17-22-10-15(26(17)12-13)18-23-11-16-19(24-18)27(14-3-7-30-8-4-14)20(29)25(16)5-6-28/h1-2,10-12,14,28H,3-8H2
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P52333
Entrez Gene ID
NCBI Entrez Gene ID:
3718
ASD
Information of known allosteric effects of PDB entries
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