Browse entries in the PDBbind-CN Database
HEADER 4NXR_COMPLEX COMPND 4NXR_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 94 GLY ALA MET GLY LYS VAL THR HIS SER ILE HIS ILE GLU SEQRES 2 A 94 LYS SER ASP THR ALA ALA ASP THR TYR GLY PHE SER LEU SEQRES 3 A 94 SER SER VAL GLU GLU ASP GLY ILE ARG ARG LEU TYR VAL SEQRES 4 A 94 ASN SER VAL LYS GLU THR GLY LEU ALA SER LYS LYS GLY SEQRES 5 A 94 LEU LYS ALA GLY ASP GLU ILE LEU GLU ILE ASN ASN ARG SEQRES 6 A 94 ALA ALA ASP ALA LEU ASN SER SER MET MET GLU ASP PHE SEQRES 7 A 94 PHE SER GLN PRO SER VAL GLY LEU LEU VAL ARG THR TYR SEQRES 8 A 94 PRO GLU LEU HET ASN A 194 146 ATOM 1 N GLY A 837 16.975 -25.338 -16.540 1.00 16.06 N ATOM 2 CA GLY A 837 17.267 -23.987 -17.005 1.00 18.88 C ATOM 3 C GLY A 837 16.275 -23.455 -18.012 1.00 20.41 C ATOM 4 O GLY A 837 15.428 -24.202 -18.505 1.00 18.37 O ATOM 5 HN3 GLY A 837 16.979 -25.991 -17.350 1.00 0.00 H ATOM 6 HN2 GLY A 837 16.039 -25.353 -16.087 1.00 0.00 H ATOM 7 HN1 GLY A 837 17.699 -25.631 -15.853 1.00 0.00 H ATOM 8 N ALA A 838 16.371 -22.164 -18.320 1.00 19.32 N ATOM 9 CA ALA A 838 15.407 -21.540 -19.228 1.00 15.78 C ATOM 10 C ALA A 838 15.591 -22.040 -20.662 1.00 21.66 C ATOM 11 O ALA A 838 16.543 -21.648 -21.339 1.00 22.34 O ATOM 12 CB ALA A 838 15.530 -20.025 -19.180 1.00 10.80 C ATOM 13 H ALA A 838 17.138 -21.593 -17.912 1.00 0.00 H ATOM 14 N MET A 839 14.695 -22.917 -21.112 1.00 16.02 N ATOM 15 CA MET A 839 14.653 -23.310 -22.520 1.00 15.63 C ATOM 16 C MET A 839 13.378 -22.771 -23.171 1.00 17.85 C ATOM 17 O MET A 839 13.418 -21.760 -23.896 1.00 16.86 O ATOM 18 CB MET A 839 14.756 -24.836 -22.670 1.00 16.13 C ATOM 19 CG MET A 839 16.120 -25.396 -22.270 1.00 18.59 C ATOM 20 SD MET A 839 16.279 -27.161 -22.631 1.00 29.31 S ATOM 21 CE MET A 839 16.345 -27.150 -24.429 1.00 20.23 C ATOM 22 H MET A 839 14.010 -23.331 -20.448 1.00 0.00 H ATOM 23 N GLY A 840 12.245 -23.417 -22.904 1.00 13.39 N ATOM 24 CA GLY A 840 10.981 -22.960 -23.465 1.00 9.14 C ATOM 25 C GLY A 840 10.283 -22.040 -22.480 1.00 11.47 C ATOM 26 O GLY A 840 10.621 -22.003 -21.296 1.00 8.25 O ATOM 27 H GLY A 840 12.263 -24.256 -22.289 1.00 0.00 H ATOM 28 N LYS A 841 9.315 -21.278 -22.973 1.00 7.35 N ATOM 29 CA LYS A 841 8.524 -20.418 -22.112 1.00 7.05 C ATOM 30 C LYS A 841 7.429 -21.214 -21.412 1.00 7.34 C ATOM 31 O LYS A 841 6.969 -22.237 -21.930 1.00 7.22 O ATOM 32 CB LYS A 841 7.898 -19.293 -22.918 1.00 5.90 C ATOM 33 CG LYS A 841 8.915 -18.330 -23.497 1.00 11.04 C ATOM 34 CD LYS A 841 8.243 -17.329 -24.438 1.00 9.89 C ATOM 35 CE LYS A 841 9.237 -16.249 -24.857 1.00 13.91 C ATOM 36 NZ LYS A 841 8.654 -15.367 -25.906 1.00 20.91 N ATOM 37 HZ1 LYS A 841 8.409 -15.938 -26.740 1.00 0.00 H ATOM 38 HZ2 LYS A 841 7.798 -14.908 -25.535 1.00 0.00 H ATOM 39 HZ3 LYS A 841 9.350 -14.642 -26.173 1.00 0.00 H ATOM 40 H LYS A 841 9.120 -21.297 -23.994 1.00 0.00 H ATOM 41 N VAL A 842 6.996 -20.724 -20.258 1.00 5.76 N ATOM 42 CA VAL A 842 5.921 -21.371 -19.513 1.00 7.57 C ATOM 43 C VAL A 842 4.753 -20.409 -19.348 1.00 7.42 C ATOM 44 O VAL A 842 4.946 -19.241 -19.018 1.00 7.06 O ATOM 45 CB VAL A 842 6.419 -21.857 -18.144 1.00 7.32 C ATOM 46 CG1 VAL A 842 5.276 -22.442 -17.321 1.00 6.23 C ATOM 47 CG2 VAL A 842 7.538 -22.892 -18.346 1.00 6.83 C ATOM 48 H VAL A 842 7.432 -19.860 -19.876 1.00 0.00 H ATOM 49 N THR A 843 3.544 -20.897 -19.607 1.00 7.26 N ATOM 50 CA THR A 843 2.353 -20.056 -19.538 1.00 5.29 C ATOM 51 C THR A 843 1.511 -20.457 -18.349 1.00 5.83 C ATOM 52 O THR A 843 1.223 -21.639 -18.168 1.00 5.79 O ATOM 53 CB THR A 843 1.514 -20.175 -20.816 1.00 6.09 C ATOM 54 OG1 THR A 843 2.275 -19.695 -21.923 1.00 7.41 O ATOM 55 CG2 THR A 843 0.232 -19.372 -20.713 1.00 7.90 C ATOM 56 HG1 THR A 843 3.099 -20.236 -22.014 1.00 0.00 H ATOM 57 H THR A 843 3.445 -21.900 -19.864 1.00 0.00 H ATOM 58 N HIS A 844 1.135 -19.484 -17.523 1.00 6.07 N ATOM 59 CA HIS A 844 0.263 -19.776 -16.395 1.00 7.40 C ATOM 60 C HIS A 844 -0.713 -18.629 -16.133 1.00 7.03 C ATOM 61 O HIS A 844 -0.506 -17.492 -16.574 1.00 6.28 O ATOM 62 CB HIS A 844 1.093 -20.093 -15.142 1.00 5.94 C ATOM 63 CG HIS A 844 1.971 -18.963 -14.679 1.00 6.69 C ATOM 64 ND1 HIS A 844 1.633 -18.147 -13.625 1.00 7.92 N ATOM 65 CD2 HIS A 844 3.188 -18.548 -15.106 1.00 7.43 C ATOM 66 CE1 HIS A 844 2.597 -17.256 -13.432 1.00 10.09 C ATOM 67 NE2 HIS A 844 3.556 -17.488 -14.311 1.00 10.59 N ATOM 68 H HIS A 844 1.465 -18.511 -17.684 1.00 0.00 H ATOM 69 N SER A 845 -1.796 -18.935 -15.434 1.00 4.56 N ATOM 70 CA SER A 845 -2.794 -17.929 -15.131 1.00 7.54 C ATOM 71 C SER A 845 -2.979 -17.792 -13.637 1.00 7.98 C ATOM 72 O SER A 845 -2.835 -18.767 -12.884 1.00 6.27 O ATOM 73 CB SER A 845 -4.128 -18.270 -15.771 1.00 5.65 C ATOM 74 OG SER A 845 -4.617 -19.466 -15.203 1.00 13.51 O ATOM 75 HG SER A 845 -4.735 -19.343 -14.228 1.00 0.00 H ATOM 76 H SER A 845 -1.932 -19.910 -15.098 1.00 0.00 H ATOM 77 N ILE A 846 -3.303 -16.572 -13.226 1.00 5.18 N ATOM 78 CA ILE A 846 -3.564 -16.254 -11.829 1.00 5.48 C ATOM 79 C ILE A 846 -4.755 -15.331 -11.735 1.00 7.66 C ATOM 80 O ILE A 846 -5.085 -14.626 -12.678 1.00 4.23 O ATOM 81 CB ILE A 846 -2.366 -15.583 -11.151 1.00 9.80 C ATOM 82 CG1 ILE A 846 -2.018 -14.274 -11.877 1.00 7.56 C ATOM 83 CG2 ILE A 846 -1.175 -16.551 -11.107 1.00 8.26 C ATOM 84 CD1 ILE A 846 -0.913 -13.463 -11.184 1.00 11.58 C ATOM 85 H ILE A 846 -3.373 -15.811 -13.931 1.00 0.00 H ATOM 86 N HIS A 847 -5.410 -15.357 -10.586 1.00 6.90 N ATOM 87 CA HIS A 847 -6.521 -14.461 -10.322 1.00 7.42 C ATOM 88 C HIS A 847 -6.191 -13.749 -9.025 1.00 9.12 C ATOM 89 O HIS A 847 -5.924 -14.403 -8.015 1.00 9.64 O ATOM 90 CB HIS A 847 -7.843 -15.233 -10.227 1.00 8.26 C ATOM 91 CG HIS A 847 -8.977 -14.423 -9.667 1.00 11.49 C ATOM 92 ND1 HIS A 847 -9.811 -13.665 -10.456 1.00 12.34 N ATOM 93 CD2 HIS A 847 -9.406 -14.256 -8.394 1.00 13.12 C ATOM 94 CE1 HIS A 847 -10.707 -13.061 -9.695 1.00 15.12 C ATOM 95 NE2 HIS A 847 -10.478 -13.396 -8.438 1.00 11.85 N ATOM 96 H HIS A 847 -5.122 -16.037 -9.853 1.00 0.00 H ATOM 97 N ILE A 848 -6.141 -12.420 -9.045 1.00 4.45 N ATOM 98 CA ILE A 848 -5.718 -11.720 -7.838 1.00 7.38 C ATOM 99 C ILE A 848 -6.806 -10.752 -7.360 1.00 9.04 C ATOM 100 O ILE A 848 -7.542 -10.197 -8.169 1.00 5.18 O ATOM 101 CB ILE A 848 -4.373 -10.978 -8.056 1.00 6.88 C ATOM 102 CG1 ILE A 848 -4.428 -10.145 -9.323 1.00 7.17 C ATOM 103 CG2 ILE A 848 -3.222 -11.993 -8.171 1.00 10.28 C ATOM 104 CD1 ILE A 848 -3.172 -9.351 -9.614 1.00 10.60 C ATOM 105 H ILE A 848 -6.398 -11.892 -9.903 1.00 0.00 H ATOM 106 N GLU A 849 -6.912 -10.584 -6.042 1.00 4.60 N ATOM 107 CA GLU A 849 -7.946 -9.730 -5.450 1.00 6.97 C ATOM 108 C GLU A 849 -7.343 -8.669 -4.531 1.00 7.61 C ATOM 109 O GLU A 849 -6.472 -8.967 -3.716 1.00 7.32 O ATOM 110 CB GLU A 849 -8.958 -10.591 -4.685 1.00 9.83 C ATOM 111 CG GLU A 849 -9.544 -11.700 -5.568 1.00 10.63 C ATOM 112 CD GLU A 849 -10.686 -12.455 -4.919 1.00 21.65 C ATOM 113 OE1 GLU A 849 -11.459 -13.106 -5.661 1.00 22.96 O ATOM 114 OE2 GLU A 849 -10.815 -12.395 -3.681 1.00 19.14 O ATOM 115 H GLU A 849 -6.242 -11.073 -5.415 1.00 0.00 H ATOM 116 N LYS A 850 -7.812 -7.430 -4.654 1.00 7.71 N ATOM 117 CA LYS A 850 -7.299 -6.363 -3.808 1.00 7.25 C ATOM 118 C LYS A 850 -7.527 -6.635 -2.315 1.00 9.79 C ATOM 119 O LYS A 850 -6.737 -6.170 -1.483 1.00 11.05 O ATOM 120 CB LYS A 850 -7.924 -5.020 -4.207 1.00 9.74 C ATOM 121 CG LYS A 850 -7.369 -4.475 -5.527 1.00 6.88 C ATOM 122 CD LYS A 850 -8.041 -3.170 -5.909 1.00 14.92 C ATOM 123 CE LYS A 850 -7.628 -2.704 -7.309 1.00 11.45 C ATOM 124 NZ LYS A 850 -8.572 -1.628 -7.799 1.00 10.55 N ATOM 125 HZ1 LYS A 850 -9.539 -2.008 -7.837 1.00 0.00 H ATOM 126 HZ2 LYS A 850 -8.542 -0.819 -7.147 1.00 0.00 H ATOM 127 HZ3 LYS A 850 -8.282 -1.320 -8.749 1.00 0.00 H ATOM 128 H LYS A 850 -8.549 -7.223 -5.358 1.00 0.00 H ATOM 129 N SER A 851 -8.568 -7.400 -1.969 1.00 8.80 N ATOM 130 CA SER A 851 -8.836 -7.703 -0.549 1.00 9.78 C ATOM 131 C SER A 851 -7.797 -8.656 0.079 1.00 12.85 C ATOM 132 O SER A 851 -7.771 -8.852 1.305 1.00 11.90 O ATOM 133 CB SER A 851 -10.249 -8.271 -0.378 1.00 8.77 C ATOM 134 OG SER A 851 -10.489 -9.369 -1.246 1.00 10.31 O ATOM 135 HG SER A 851 -10.385 -9.074 -2.185 1.00 0.00 H ATOM 136 H SER A 851 -9.193 -7.784 -2.706 1.00 0.00 H ATOM 137 N ASP A 852 -6.926 -9.220 -0.751 1.00 8.70 N ATOM 138 CA ASP A 852 -5.831 -10.051 -0.274 1.00 9.95 C ATOM 139 C ASP A 852 -4.538 -9.254 -0.126 1.00 15.29 C ATOM 140 O ASP A 852 -3.460 -9.830 0.062 1.00 14.73 O ATOM 141 CB ASP A 852 -5.600 -11.221 -1.222 1.00 9.80 C ATOM 142 CG ASP A 852 -6.758 -12.203 -1.226 1.00 14.71 C ATOM 143 OD1 ASP A 852 -7.384 -12.377 -0.152 1.00 15.95 O ATOM 144 OD2 ASP A 852 -7.047 -12.789 -2.298 1.00 10.62 O ATOM 145 H ASP A 852 -7.030 -9.063 -1.774 1.00 0.00 H ATOM 146 N THR A 853 -4.633 -7.933 -0.231 1.00 10.72 N ATOM 147 CA THR A 853 -3.455 -7.087 -0.119 1.00 10.37 C ATOM 148 C THR A 853 -3.594 -6.165 1.074 1.00 14.51 C ATOM 149 O THR A 853 -4.700 -5.940 1.565 1.00 8.91 O ATOM 150 CB THR A 853 -3.231 -6.234 -1.378 1.00 11.09 C ATOM 151 OG1 THR A 853 -4.192 -5.172 -1.415 1.00 10.45 O ATOM 152 CG2 THR A 853 -3.343 -7.087 -2.659 1.00 9.72 C ATOM 153 HG1 THR A 853 -5.105 -5.555 -1.434 1.00 0.00 H ATOM 154 H THR A 853 -5.563 -7.498 -0.396 1.00 0.00 H ATOM 155 N ALA A 854 -2.473 -5.617 1.531 1.00 11.33 N ATOM 156 CA ALA A 854 -2.495 -4.737 2.695 1.00 11.98 C ATOM 157 C ALA A 854 -3.098 -3.383 2.379 1.00 16.21 C ATOM 158 O ALA A 854 -3.808 -2.803 3.203 1.00 16.10 O ATOM 159 CB ALA A 854 -1.090 -4.552 3.244 1.00 12.85 C ATOM 160 H ALA A 854 -1.571 -5.817 1.054 1.00 0.00 H ATOM 161 N ALA A 855 -2.813 -2.868 1.186 1.00 14.55 N ATOM 162 CA ALA A 855 -3.162 -1.486 0.886 1.00 13.09 C ATOM 163 C ALA A 855 -3.810 -1.322 -0.478 1.00 15.65 C ATOM 164 O ALA A 855 -3.639 -0.287 -1.121 1.00 18.39 O ATOM 165 CB ALA A 855 -1.916 -0.600 0.990 1.00 14.58 C ATOM 166 H ALA A 855 -2.341 -3.453 0.467 1.00 0.00 H ATOM 167 N ASP A 856 -4.559 -2.339 -0.903 1.00 13.26 N ATOM 168 CA ASP A 856 -5.340 -2.292 -2.133 1.00 13.81 C ATOM 169 C ASP A 856 -4.462 -2.107 -3.358 1.00 18.03 C ATOM 170 O ASP A 856 -4.903 -1.550 -4.367 1.00 19.19 O ATOM 171 CB ASP A 856 -6.396 -1.177 -2.075 1.00 19.21 C ATOM 172 CG ASP A 856 -7.792 -1.708 -1.794 1.00 27.91 C ATOM 173 OD1 ASP A 856 -7.919 -2.799 -1.182 1.00 29.27 O ATOM 174 OD2 ASP A 856 -8.767 -1.038 -2.193 1.00 38.22 O ATOM 175 H ASP A 856 -4.588 -3.207 -0.330 1.00 0.00 H ATOM 176 N THR A 857 -3.211 -2.550 -3.272 1.00 11.77 N ATOM 177 CA THR A 857 -2.347 -2.547 -4.441 1.00 12.18 C ATOM 178 C THR A 857 -1.738 -3.938 -4.569 1.00 9.59 C ATOM 179 O THR A 857 -1.382 -4.554 -3.571 1.00 9.04 O ATOM 180 CB THR A 857 -1.241 -1.456 -4.376 1.00 15.19 C ATOM 181 OG1 THR A 857 -0.213 -1.844 -3.461 1.00 21.19 O ATOM 182 CG2 THR A 857 -1.818 -0.102 -3.948 1.00 17.90 C ATOM 183 HG1 THR A 857 -0.603 -1.963 -2.559 1.00 0.00 H ATOM 184 H THR A 857 -2.849 -2.901 -2.363 1.00 0.00 H ATOM 185 N TYR A 858 -1.681 -4.436 -5.801 1.00 6.30 N ATOM 186 CA TYR A 858 -1.152 -5.775 -6.101 1.00 7.72 C ATOM 187 C TYR A 858 0.365 -5.811 -6.048 1.00 8.47 C ATOM 188 O TYR A 858 0.971 -6.862 -5.884 1.00 8.49 O ATOM 189 CB TYR A 858 -1.594 -6.233 -7.493 1.00 6.86 C ATOM 190 CG TYR A 858 -3.094 -6.290 -7.741 1.00 7.52 C ATOM 191 CD1 TYR A 858 -3.908 -7.129 -6.990 1.00 8.27 C ATOM 192 CD2 TYR A 858 -3.680 -5.545 -8.765 1.00 7.16 C ATOM 193 CE1 TYR A 858 -5.268 -7.210 -7.232 1.00 7.69 C ATOM 194 CE2 TYR A 858 -5.045 -5.612 -9.012 1.00 8.21 C ATOM 195 CZ TYR A 858 -5.833 -6.456 -8.239 1.00 9.13 C ATOM 196 OH TYR A 858 -7.196 -6.537 -8.472 1.00 12.07 O ATOM 197 HH TYR A 858 -7.605 -5.644 -8.345 1.00 0.00 H ATOM 198 H TYR A 858 -2.027 -3.851 -6.589 1.00 0.00 H ATOM 199 N GLY A 859 0.991 -4.660 -6.234 1.00 6.57 N ATOM 200 CA GLY A 859 2.436 -4.592 -6.122 1.00 6.65 C ATOM 201 C GLY A 859 3.164 -5.011 -7.389 1.00 9.74 C ATOM 202 O GLY A 859 4.202 -5.683 -7.329 1.00 6.45 O ATOM 203 H GLY A 859 0.447 -3.803 -6.461 1.00 0.00 H ATOM 204 N PHE A 860 2.623 -4.616 -8.539 1.00 5.06 N ATOM 205 CA PHE A 860 3.363 -4.737 -9.798 1.00 5.72 C ATOM 206 C PHE A 860 2.920 -3.668 -10.776 1.00 6.24 C ATOM 207 O PHE A 860 1.920 -2.982 -10.555 1.00 6.36 O ATOM 208 CB PHE A 860 3.200 -6.132 -10.413 1.00 5.65 C ATOM 209 CG PHE A 860 1.843 -6.396 -11.041 1.00 5.78 C ATOM 210 CD1 PHE A 860 0.719 -6.591 -10.254 1.00 4.80 C ATOM 211 CD2 PHE A 860 1.715 -6.504 -12.417 1.00 5.07 C ATOM 212 CE1 PHE A 860 -0.511 -6.862 -10.834 1.00 6.57 C ATOM 213 CE2 PHE A 860 0.490 -6.772 -13.008 1.00 6.11 C ATOM 214 CZ PHE A 860 -0.625 -6.952 -12.214 1.00 5.81 C ATOM 215 H PHE A 860 1.663 -4.216 -8.544 1.00 0.00 H ATOM 216 N SER A 861 3.671 -3.498 -11.852 1.00 6.67 N ATOM 217 CA SER A 861 3.227 -2.568 -12.861 1.00 7.86 C ATOM 218 C SER A 861 3.108 -3.306 -14.195 1.00 9.08 C ATOM 219 O SER A 861 3.641 -4.404 -14.334 1.00 7.84 O ATOM 220 CB SER A 861 4.181 -1.368 -12.949 1.00 9.96 C ATOM 221 OG SER A 861 5.421 -1.736 -13.497 1.00 13.44 O ATOM 222 HG SER A 861 6.010 -0.942 -13.540 1.00 0.00 H ATOM 223 H SER A 861 4.561 -4.023 -11.968 1.00 0.00 H ATOM 224 N LEU A 862 2.370 -2.725 -15.140 1.00 6.93 N ATOM 225 CA LEU A 862 2.261 -3.264 -16.499 1.00 9.75 C ATOM 226 C LEU A 862 2.832 -2.239 -17.453 1.00 9.75 C ATOM 227 O LEU A 862 2.388 -1.080 -17.444 1.00 9.81 O ATOM 228 CB LEU A 862 0.809 -3.565 -16.901 1.00 7.09 C ATOM 229 CG LEU A 862 -0.056 -4.603 -16.184 1.00 9.75 C ATOM 230 CD1 LEU A 862 -0.578 -4.055 -14.863 1.00 9.40 C ATOM 231 CD2 LEU A 862 -1.220 -5.003 -17.056 1.00 8.54 C ATOM 232 H LEU A 862 1.851 -1.855 -14.904 1.00 0.00 H ATOM 233 N SER A 863 3.803 -2.662 -18.259 1.00 8.21 N ATOM 234 CA SER A 863 4.455 -1.810 -19.250 1.00 8.55 C ATOM 235 C SER A 863 3.827 -2.011 -20.613 1.00 8.53 C ATOM 236 O SER A 863 3.827 -3.113 -21.136 1.00 9.37 O ATOM 237 CB SER A 863 5.953 -2.117 -19.341 1.00 9.87 C ATOM 238 OG SER A 863 6.636 -1.848 -18.123 1.00 10.80 O ATOM 239 HG SER A 863 6.533 -0.891 -17.893 1.00 0.00 H ATOM 240 H SER A 863 4.114 -3.651 -18.179 1.00 0.00 H ATOM 241 N SER A 864 3.293 -0.945 -21.188 1.00 7.84 N ATOM 242 CA SER A 864 2.799 -1.020 -22.541 1.00 8.79 C ATOM 243 C SER A 864 3.922 -0.607 -23.473 1.00 12.09 C ATOM 244 O SER A 864 4.420 0.518 -23.383 1.00 9.81 O ATOM 245 CB SER A 864 1.572 -0.132 -22.734 1.00 11.60 C ATOM 246 OG SER A 864 1.195 -0.116 -24.106 1.00 11.22 O ATOM 247 HG SER A 864 1.943 0.239 -24.649 1.00 0.00 H ATOM 248 H SER A 864 3.229 -0.050 -20.662 1.00 0.00 H ATOM 249 N VAL A 865 4.336 -1.516 -24.356 1.00 10.00 N ATOM 250 CA VAL A 865 5.472 -1.230 -25.216 1.00 12.60 C ATOM 251 C VAL A 865 5.198 -1.547 -26.679 1.00 16.22 C ATOM 252 O VAL A 865 4.315 -2.339 -27.011 1.00 13.18 O ATOM 253 CB VAL A 865 6.740 -2.011 -24.790 1.00 13.50 C ATOM 254 CG1 VAL A 865 7.012 -1.863 -23.292 1.00 11.81 C ATOM 255 CG2 VAL A 865 6.624 -3.479 -25.175 1.00 14.33 C ATOM 256 H VAL A 865 3.846 -2.430 -24.429 1.00 0.00 H ATOM 257 N GLU A 866 5.954 -0.888 -27.550 1.00 19.57 N ATOM 258 CA GLU A 866 6.028 -1.267 -28.954 1.00 19.68 C ATOM 259 C GLU A 866 7.377 -1.917 -29.133 1.00 17.30 C ATOM 260 O GLU A 866 8.409 -1.302 -28.878 1.00 23.12 O ATOM 261 CB GLU A 866 5.866 -0.062 -29.883 1.00 23.22 C ATOM 262 CG GLU A 866 6.064 -0.376 -31.371 1.00 23.20 C ATOM 263 CD GLU A 866 7.468 -0.018 -31.853 1.00 31.90 C ATOM 264 OE1 GLU A 866 8.005 1.021 -31.406 1.00 36.56 O ATOM 265 OE2 GLU A 866 8.041 -0.780 -32.663 1.00 31.74 O ATOM 266 H GLU A 866 6.511 -0.075 -27.218 1.00 0.00 H ATOM 267 N GLU A 867 7.362 -3.176 -29.541 1.00 20.18 N ATOM 268 CA GLU A 867 8.578 -3.965 -29.618 1.00 21.86 C ATOM 269 C GLU A 867 8.697 -4.535 -31.024 1.00 22.10 C ATOM 270 O GLU A 867 7.924 -5.418 -31.402 1.00 16.68 O ATOM 271 CB GLU A 867 8.555 -5.084 -28.565 1.00 19.63 C ATOM 272 CG GLU A 867 9.917 -5.636 -28.206 1.00 22.76 C ATOM 273 CD GLU A 867 9.832 -6.778 -27.215 1.00 21.84 C ATOM 274 OE1 GLU A 867 8.720 -7.028 -26.685 1.00 17.36 O ATOM 275 OE2 GLU A 867 10.870 -7.437 -26.984 1.00 19.88 O ATOM 276 H GLU A 867 6.457 -3.611 -29.813 1.00 0.00 H ATOM 277 N ASP A 868 9.646 -4.012 -31.798 1.00 25.30 N ATOM 278 CA ASP A 868 9.789 -4.394 -33.200 1.00 25.47 C ATOM 279 C ASP A 868 8.463 -4.263 -33.937 1.00 26.78 C ATOM 280 O ASP A 868 8.053 -5.173 -34.659 1.00 28.03 O ATOM 281 CB ASP A 868 10.314 -5.826 -33.327 1.00 25.28 C ATOM 282 CG ASP A 868 11.554 -6.068 -32.493 1.00 25.58 C ATOM 283 OD1 ASP A 868 12.373 -5.134 -32.340 1.00 34.09 O ATOM 284 OD2 ASP A 868 11.707 -7.195 -31.984 1.00 32.07 O ATOM 285 H ASP A 868 10.302 -3.314 -31.394 1.00 0.00 H ATOM 286 N GLY A 869 7.785 -3.138 -33.729 1.00 29.05 N ATOM 287 CA GLY A 869 6.545 -2.853 -34.429 1.00 24.99 C ATOM 288 C GLY A 869 5.321 -3.536 -33.852 1.00 27.03 C ATOM 289 O GLY A 869 4.220 -3.331 -34.341 1.00 27.70 O ATOM 290 H GLY A 869 8.152 -2.444 -33.047 1.00 0.00 H ATOM 291 N ILE A 870 5.503 -4.347 -32.815 1.00 25.88 N ATOM 292 CA ILE A 870 4.386 -5.086 -32.228 1.00 21.51 C ATOM 293 C ILE A 870 4.041 -4.589 -30.825 1.00 17.77 C ATOM 294 O ILE A 870 4.932 -4.386 -29.998 1.00 18.09 O ATOM 295 CB ILE A 870 4.696 -6.587 -32.170 1.00 24.03 C ATOM 296 CG1 ILE A 870 4.906 -7.126 -33.588 1.00 21.62 C ATOM 297 CG2 ILE A 870 3.580 -7.332 -31.441 1.00 12.41 C ATOM 298 CD1 ILE A 870 5.953 -8.215 -33.670 1.00 26.30 C ATOM 299 H ILE A 870 6.456 -4.458 -32.414 1.00 0.00 H ATOM 300 N ARG A 871 2.754 -4.396 -30.553 1.00 14.99 N ATOM 301 CA ARG A 871 2.330 -3.942 -29.231 1.00 17.57 C ATOM 302 C ARG A 871 2.269 -5.096 -28.226 1.00 16.51 C ATOM 303 O ARG A 871 1.625 -6.124 -28.474 1.00 20.24 O ATOM 304 CB ARG A 871 0.977 -3.233 -29.326 1.00 19.17 C ATOM 305 CG ARG A 871 1.045 -1.992 -30.217 1.00 26.36 C ATOM 306 CD ARG A 871 0.352 -0.791 -29.587 1.00 38.11 C ATOM 307 NE ARG A 871 0.882 -0.501 -28.256 1.00 40.08 N ATOM 308 CZ ARG A 871 1.845 0.384 -28.002 1.00 30.06 C ATOM 309 NH1 ARG A 871 2.396 1.089 -28.989 1.00 24.94 N ATOM 310 NH2 ARG A 871 2.254 0.566 -26.753 1.00 18.96 N ATOM 311 HE ARG A 871 0.479 -1.022 -27.451 1.00 0.00 H ATOM 312 HH12 ARG A 871 3.147 1.777 -28.780 1.00 0.00 H ATOM 313 HH11 ARG A 871 2.075 0.951 -29.969 1.00 0.00 H ATOM 314 HH22 ARG A 871 3.005 1.255 -26.547 1.00 0.00 H ATOM 315 HH21 ARG A 871 1.823 0.020 -25.980 1.00 0.00 H ATOM 316 H ARG A 871 2.041 -4.570 -31.290 1.00 0.00 H ATOM 317 N ARG A 872 2.960 -4.933 -27.098 1.00 11.75 N ATOM 318 CA ARG A 872 2.986 -5.971 -26.073 1.00 9.85 C ATOM 319 C ARG A 872 2.733 -5.392 -24.687 1.00 9.65 C ATOM 320 O ARG A 872 2.891 -4.198 -24.468 1.00 9.60 O ATOM 321 CB ARG A 872 4.322 -6.707 -26.097 1.00 12.89 C ATOM 322 CG ARG A 872 4.568 -7.472 -27.395 1.00 15.05 C ATOM 323 CD ARG A 872 5.663 -8.511 -27.212 1.00 16.09 C ATOM 324 NE ARG A 872 6.106 -9.047 -28.495 1.00 19.17 N ATOM 325 CZ ARG A 872 5.591 -10.125 -29.074 1.00 25.16 C ATOM 326 NH1 ARG A 872 4.609 -10.795 -28.484 1.00 29.95 N ATOM 327 NH2 ARG A 872 6.059 -10.535 -30.246 1.00 28.43 N ATOM 328 HE ARG A 872 6.876 -8.552 -28.988 1.00 0.00 H ATOM 329 HH12 ARG A 872 4.208 -11.639 -28.940 1.00 0.00 H ATOM 330 HH11 ARG A 872 4.241 -10.476 -27.565 1.00 0.00 H ATOM 331 HH22 ARG A 872 5.656 -11.379 -30.700 1.00 0.00 H ATOM 332 HH21 ARG A 872 6.829 -10.012 -30.710 1.00 0.00 H ATOM 333 H ARG A 872 3.490 -4.051 -26.946 1.00 0.00 H ATOM 334 N LEU A 873 2.297 -6.235 -23.761 1.00 7.85 N ATOM 335 CA LEU A 873 2.141 -5.823 -22.381 1.00 6.47 C ATOM 336 C LEU A 873 3.069 -6.683 -21.555 1.00 6.24 C ATOM 337 O LEU A 873 3.057 -7.899 -21.673 1.00 7.32 O ATOM 338 CB LEU A 873 0.697 -5.985 -21.894 1.00 6.98 C ATOM 339 CG LEU A 873 -0.365 -4.912 -22.140 1.00 17.79 C ATOM 340 CD1 LEU A 873 -1.733 -5.388 -21.622 1.00 12.32 C ATOM 341 CD2 LEU A 873 0.020 -3.614 -21.464 1.00 9.01 C ATOM 342 H LEU A 873 2.062 -7.212 -24.031 1.00 0.00 H ATOM 343 N TYR A 874 3.869 -6.048 -20.719 1.00 6.03 N ATOM 344 CA TYR A 874 4.798 -6.758 -19.858 1.00 6.96 C ATOM 345 C TYR A 874 4.546 -6.456 -18.386 1.00 10.83 C ATOM 346 O TYR A 874 4.182 -5.334 -18.036 1.00 7.86 O ATOM 347 CB TYR A 874 6.234 -6.373 -20.204 1.00 5.85 C ATOM 348 CG TYR A 874 6.777 -7.006 -21.464 1.00 7.98 C ATOM 349 CD1 TYR A 874 7.230 -8.319 -21.462 1.00 7.88 C ATOM 350 CD2 TYR A 874 6.868 -6.280 -22.644 1.00 10.48 C ATOM 351 CE1 TYR A 874 7.736 -8.899 -22.604 1.00 7.86 C ATOM 352 CE2 TYR A 874 7.380 -6.853 -23.792 1.00 7.51 C ATOM 353 CZ TYR A 874 7.816 -8.164 -23.763 1.00 10.06 C ATOM 354 OH TYR A 874 8.342 -8.746 -24.899 1.00 9.11 O ATOM 355 HH TYR A 874 9.139 -8.236 -25.191 1.00 0.00 H ATOM 356 H TYR A 874 3.833 -5.010 -20.676 1.00 0.00 H ATOM 357 N VAL A 875 4.765 -7.460 -17.540 1.00 5.73 N ATOM 358 CA VAL A 875 4.879 -7.261 -16.108 1.00 7.49 C ATOM 359 C VAL A 875 6.180 -6.530 -15.831 1.00 7.32 C ATOM 360 O VAL A 875 7.205 -6.844 -16.425 1.00 5.29 O ATOM 361 CB VAL A 875 4.881 -8.611 -15.328 1.00 6.43 C ATOM 362 CG1 VAL A 875 5.086 -8.369 -13.839 1.00 6.47 C ATOM 363 CG2 VAL A 875 3.598 -9.385 -15.583 1.00 7.08 C ATOM 364 H VAL A 875 4.858 -8.424 -17.920 1.00 0.00 H ATOM 365 N ASN A 876 6.129 -5.569 -14.916 1.00 7.94 N ATOM 366 CA ASN A 876 7.304 -4.822 -14.475 1.00 8.95 C ATOM 367 C ASN A 876 7.137 -4.469 -12.991 1.00 10.26 C ATOM 368 O ASN A 876 6.057 -4.696 -12.407 1.00 11.96 O ATOM 369 CB ASN A 876 7.476 -3.557 -15.322 1.00 8.57 C ATOM 370 CG ASN A 876 8.924 -3.190 -15.547 1.00 15.11 C ATOM 371 OD1 ASN A 876 9.806 -3.576 -14.781 1.00 13.87 O ATOM 372 ND2 ASN A 876 9.180 -2.440 -16.615 1.00 14.23 N ATOM 373 HD22 ASN A 876 8.403 -2.136 -17.236 1.00 0.00 H ATOM 374 HD21 ASN A 876 10.158 -2.157 -16.830 1.00 0.00 H ATOM 375 H ASN A 876 5.208 -5.337 -14.493 1.00 0.00 H ATOM 376 N SER A 877 8.200 -3.952 -12.375 1.00 10.15 N ATOM 377 CA SER A 877 8.134 -3.355 -11.031 1.00 10.15 C ATOM 378 C SER A 877 7.422 -4.216 -9.997 1.00 11.18 C ATOM 379 O SER A 877 6.519 -3.726 -9.305 1.00 9.98 O ATOM 380 CB SER A 877 7.436 -1.996 -11.081 1.00 13.75 C ATOM 381 OG SER A 877 7.869 -1.239 -12.194 1.00 23.12 O ATOM 382 HG SER A 877 7.662 -1.732 -13.027 1.00 0.00 H ATOM 383 H SER A 877 9.117 -3.971 -12.866 1.00 0.00 H ATOM 384 N VAL A 878 7.829 -5.482 -9.894 1.00 7.95 N ATOM 385 CA VAL A 878 7.252 -6.391 -8.920 1.00 9.39 C ATOM 386 C VAL A 878 7.823 -6.146 -7.520 1.00 10.81 C ATOM 387 O VAL A 878 9.001 -6.412 -7.262 1.00 9.23 O ATOM 388 CB VAL A 878 7.493 -7.864 -9.322 1.00 8.18 C ATOM 389 CG1 VAL A 878 6.796 -8.802 -8.345 1.00 5.90 C ATOM 390 CG2 VAL A 878 7.000 -8.113 -10.740 1.00 8.30 C ATOM 391 H VAL A 878 8.578 -5.827 -10.527 1.00 0.00 H ATOM 392 N LYS A 879 6.984 -5.643 -6.615 1.00 10.46 N ATOM 393 CA LYS A 879 7.410 -5.420 -5.245 1.00 9.76 C ATOM 394 C LYS A 879 7.680 -6.746 -4.548 1.00 13.53 C ATOM 395 O LYS A 879 6.862 -7.670 -4.594 1.00 12.13 O ATOM 396 CB LYS A 879 6.360 -4.624 -4.464 1.00 9.24 C ATOM 397 CG LYS A 879 6.158 -3.194 -4.986 1.00 13.44 C ATOM 398 CD LYS A 879 5.093 -2.455 -4.165 1.00 14.69 C ATOM 399 CE LYS A 879 4.735 -1.121 -4.789 1.00 15.93 C ATOM 400 NZ LYS A 879 3.623 -0.479 -4.031 1.00 21.92 N ATOM 401 HZ1 LYS A 879 2.788 -1.099 -4.050 1.00 0.00 H ATOM 402 HZ2 LYS A 879 3.920 -0.326 -3.046 1.00 0.00 H ATOM 403 HZ3 LYS A 879 3.388 0.434 -4.470 1.00 0.00 H ATOM 404 H LYS A 879 6.010 -5.407 -6.894 1.00 0.00 H ATOM 405 N GLU A 880 8.828 -6.836 -3.889 1.00 12.34 N ATOM 406 CA GLU A 880 9.128 -8.001 -3.073 1.00 15.79 C ATOM 407 C GLU A 880 8.110 -8.099 -1.941 1.00 16.25 C ATOM 408 O GLU A 880 7.795 -7.099 -1.293 1.00 19.00 O ATOM 409 CB GLU A 880 10.547 -7.910 -2.522 1.00 17.68 C ATOM 410 CG GLU A 880 11.341 -9.195 -2.586 1.00 18.02 C ATOM 411 CD GLU A 880 12.750 -8.989 -2.051 1.00 21.97 C ATOM 412 OE1 GLU A 880 13.510 -9.967 -1.944 1.00 27.09 O ATOM 413 OE2 GLU A 880 13.102 -7.831 -1.752 1.00 28.53 O ATOM 414 H GLU A 880 9.521 -6.064 -3.957 1.00 0.00 H ATOM 415 N THR A 881 7.592 -9.306 -1.728 1.00 19.06 N ATOM 416 CA THR A 881 6.580 -9.603 -0.707 1.00 15.47 C ATOM 417 C THR A 881 5.191 -9.023 -1.009 1.00 14.24 C ATOM 418 O THR A 881 4.302 -9.106 -0.168 1.00 12.78 O ATOM 419 CB THR A 881 7.006 -9.118 0.725 1.00 18.50 C ATOM 420 OG1 THR A 881 6.864 -7.697 0.825 1.00 19.62 O ATOM 421 CG2 THR A 881 8.444 -9.521 1.047 1.00 15.71 C ATOM 422 HG1 THR A 881 7.440 -7.261 0.149 1.00 0.00 H ATOM 423 H THR A 881 7.926 -10.090 -2.324 1.00 0.00 H ATOM 424 N GLY A 882 4.998 -8.455 -2.200 1.00 10.57 N ATOM 425 CA GLY A 882 3.671 -8.044 -2.635 1.00 7.96 C ATOM 426 C GLY A 882 2.874 -9.223 -3.179 1.00 7.75 C ATOM 427 O GLY A 882 3.429 -10.305 -3.385 1.00 7.33 O ATOM 428 H GLY A 882 5.811 -8.303 -2.830 1.00 0.00 H ATOM 429 N LEU A 883 1.574 -9.029 -3.412 1.00 6.28 N ATOM 430 CA LEU A 883 0.711 -10.128 -3.846 1.00 7.66 C ATOM 431 C LEU A 883 1.151 -10.730 -5.189 1.00 7.77 C ATOM 432 O LEU A 883 1.119 -11.946 -5.361 1.00 9.58 O ATOM 433 CB LEU A 883 -0.745 -9.672 -3.940 1.00 6.63 C ATOM 434 CG LEU A 883 -1.725 -10.797 -4.291 1.00 7.74 C ATOM 435 CD1 LEU A 883 -1.582 -11.979 -3.311 1.00 9.70 C ATOM 436 CD2 LEU A 883 -3.171 -10.276 -4.335 1.00 9.38 C ATOM 437 H LEU A 883 1.168 -8.080 -3.283 1.00 0.00 H ATOM 438 N ALA A 884 1.554 -9.880 -6.131 1.00 5.44 N ATOM 439 CA ALA A 884 1.987 -10.347 -7.448 1.00 6.86 C ATOM 440 C ALA A 884 3.217 -11.231 -7.323 1.00 8.84 C ATOM 441 O ALA A 884 3.341 -12.256 -8.000 1.00 9.31 O ATOM 442 CB ALA A 884 2.270 -9.156 -8.380 1.00 7.50 C ATOM 443 H ALA A 884 1.561 -8.860 -5.926 1.00 0.00 H ATOM 444 N SER A 885 4.117 -10.836 -6.432 1.00 6.83 N ATOM 445 CA SER A 885 5.301 -11.623 -6.134 1.00 8.21 C ATOM 446 C SER A 885 4.937 -12.988 -5.548 1.00 8.36 C ATOM 447 O SER A 885 5.480 -14.016 -5.960 1.00 10.41 O ATOM 448 CB SER A 885 6.201 -10.863 -5.163 1.00 8.72 C ATOM 449 OG SER A 885 7.455 -11.498 -5.084 1.00 19.46 O ATOM 450 HG SER A 885 8.035 -11.002 -4.454 1.00 0.00 H ATOM 451 H SER A 885 3.970 -9.936 -5.932 1.00 0.00 H ATOM 452 N LYS A 886 4.007 -12.996 -4.598 1.00 8.41 N ATOM 453 CA LYS A 886 3.489 -14.245 -4.031 1.00 11.88 C ATOM 454 C LYS A 886 2.918 -15.167 -5.099 1.00 16.28 C ATOM 455 O LYS A 886 3.035 -16.390 -5.014 1.00 11.56 O ATOM 456 CB LYS A 886 2.405 -13.956 -2.991 1.00 10.22 C ATOM 457 CG LYS A 886 2.916 -13.316 -1.717 1.00 10.12 C ATOM 458 CD LYS A 886 1.756 -13.034 -0.762 1.00 10.96 C ATOM 459 CE LYS A 886 2.241 -12.324 0.489 1.00 14.32 C ATOM 460 NZ LYS A 886 3.147 -13.183 1.297 1.00 13.69 N ATOM 461 HZ1 LYS A 886 2.640 -14.044 1.586 1.00 0.00 H ATOM 462 HZ2 LYS A 886 3.977 -13.443 0.726 1.00 0.00 H ATOM 463 HZ3 LYS A 886 3.455 -12.661 2.142 1.00 0.00 H ATOM 464 H LYS A 886 3.636 -12.090 -4.247 1.00 0.00 H ATOM 465 N LYS A 887 2.291 -14.570 -6.105 1.00 11.93 N ATOM 466 CA LYS A 887 1.649 -15.338 -7.156 1.00 11.04 C ATOM 467 C LYS A 887 2.645 -15.729 -8.248 1.00 12.29 C ATOM 468 O LYS A 887 2.284 -16.406 -9.218 1.00 13.77 O ATOM 469 CB LYS A 887 0.465 -14.542 -7.721 1.00 11.37 C ATOM 470 CG LYS A 887 -0.786 -14.573 -6.808 1.00 19.26 C ATOM 471 CD LYS A 887 -1.489 -15.950 -6.862 1.00 21.46 C ATOM 472 CE LYS A 887 -2.618 -16.119 -5.817 1.00 30.18 C ATOM 473 NZ LYS A 887 -3.794 -15.195 -5.973 1.00 21.30 N ATOM 474 HZ1 LYS A 887 -3.471 -14.209 -5.898 1.00 0.00 H ATOM 475 HZ2 LYS A 887 -4.232 -15.347 -6.904 1.00 0.00 H ATOM 476 HZ3 LYS A 887 -4.489 -15.391 -5.225 1.00 0.00 H ATOM 477 H LYS A 887 2.259 -13.531 -6.141 1.00 0.00 H ATOM 478 N GLY A 888 3.903 -15.324 -8.073 1.00 9.82 N ATOM 479 CA GLY A 888 4.983 -15.749 -8.944 1.00 11.56 C ATOM 480 C GLY A 888 5.212 -14.912 -10.200 1.00 10.96 C ATOM 481 O GLY A 888 5.893 -15.354 -11.117 1.00 11.70 O ATOM 482 H GLY A 888 4.118 -14.681 -7.284 1.00 0.00 H ATOM 483 N LEU A 889 4.656 -13.703 -10.251 1.00 11.71 N ATOM 484 CA LEU A 889 4.941 -12.795 -11.364 1.00 10.56 C ATOM 485 C LEU A 889 6.373 -12.288 -11.304 1.00 8.95 C ATOM 486 O LEU A 889 6.897 -12.036 -10.227 1.00 10.06 O ATOM 487 CB LEU A 889 3.979 -11.604 -11.362 1.00 7.60 C ATOM 488 CG LEU A 889 2.508 -11.901 -11.621 1.00 12.26 C ATOM 489 CD1 LEU A 889 1.772 -10.590 -11.901 1.00 7.40 C ATOM 490 CD2 LEU A 889 2.366 -12.893 -12.771 1.00 9.67 C ATOM 491 H LEU A 889 4.012 -13.400 -9.492 1.00 0.00 H ATOM 492 N LYS A 890 6.994 -12.121 -12.468 1.00 8.48 N ATOM 493 CA LYS A 890 8.344 -11.587 -12.569 1.00 9.45 C ATOM 494 C LYS A 890 8.367 -10.434 -13.542 1.00 9.44 C ATOM 495 O LYS A 890 7.635 -10.454 -14.523 1.00 7.49 O ATOM 496 CB LYS A 890 9.334 -12.641 -13.065 1.00 10.25 C ATOM 497 CG LYS A 890 9.187 -14.018 -12.503 1.00 12.85 C ATOM 498 CD LYS A 890 10.220 -14.928 -13.170 1.00 13.43 C ATOM 499 CE LYS A 890 10.006 -16.374 -12.826 1.00 11.38 C ATOM 500 NZ LYS A 890 8.739 -16.888 -13.405 1.00 9.89 N ATOM 501 HZ1 LYS A 890 7.940 -16.338 -13.031 1.00 0.00 H ATOM 502 HZ2 LYS A 890 8.770 -16.796 -14.440 1.00 0.00 H ATOM 503 HZ3 LYS A 890 8.623 -17.889 -13.148 1.00 0.00 H ATOM 504 H LYS A 890 6.494 -12.383 -13.342 1.00 0.00 H ATOM 505 N ALA A 891 9.227 -9.447 -13.302 1.00 6.12 N ATOM 506 CA ALA A 891 9.403 -8.375 -14.274 1.00 9.60 C ATOM 507 C ALA A 891 9.890 -8.963 -15.591 1.00 10.30 C ATOM 508 O ALA A 891 10.804 -9.775 -15.599 1.00 14.29 O ATOM 509 CB ALA A 891 10.385 -7.331 -13.764 1.00 11.98 C ATOM 510 H ALA A 891 9.775 -9.441 -12.418 1.00 0.00 H ATOM 511 N GLY A 892 9.271 -8.571 -16.699 1.00 8.03 N ATOM 512 CA GLY A 892 9.643 -9.115 -17.990 1.00 11.86 C ATOM 513 C GLY A 892 8.711 -10.211 -18.470 1.00 7.36 C ATOM 514 O GLY A 892 8.732 -10.561 -19.655 1.00 8.68 O ATOM 515 H GLY A 892 8.510 -7.865 -16.639 1.00 0.00 H ATOM 516 N ASP A 893 7.899 -10.758 -17.566 1.00 8.22 N ATOM 517 CA ASP A 893 6.836 -11.688 -17.980 1.00 8.98 C ATOM 518 C ASP A 893 5.945 -11.017 -19.008 1.00 7.95 C ATOM 519 O ASP A 893 5.564 -9.863 -18.827 1.00 8.69 O ATOM 520 CB ASP A 893 5.956 -12.126 -16.803 1.00 7.32 C ATOM 521 CG ASP A 893 6.639 -13.118 -15.881 1.00 9.76 C ATOM 522 OD1 ASP A 893 7.790 -13.529 -16.158 1.00 7.93 O ATOM 523 OD2 ASP A 893 5.987 -13.500 -14.884 1.00 11.96 O ATOM 524 H ASP A 893 8.017 -10.526 -16.559 1.00 0.00 H ATOM 525 N GLU A 894 5.591 -11.731 -20.071 1.00 7.99 N ATOM 526 CA GLU A 894 4.670 -11.168 -21.036 1.00 6.99 C ATOM 527 C GLU A 894 3.216 -11.435 -20.623 1.00 8.88 C ATOM 528 O GLU A 894 2.862 -12.557 -20.246 1.00 6.96 O ATOM 529 CB GLU A 894 4.937 -11.726 -22.437 1.00 8.94 C ATOM 530 CG GLU A 894 3.996 -11.109 -23.475 1.00 11.72 C ATOM 531 CD GLU A 894 4.308 -11.519 -24.892 1.00 15.23 C ATOM 532 OE1 GLU A 894 5.169 -12.409 -25.084 1.00 16.44 O ATOM 533 OE2 GLU A 894 3.678 -10.950 -25.807 1.00 17.21 O ATOM 534 H GLU A 894 5.973 -12.688 -20.209 1.00 0.00 H ATOM 535 N ILE A 895 2.374 -10.407 -20.680 1.00 6.45 N ATOM 536 CA ILE A 895 0.947 -10.602 -20.389 1.00 5.42 C ATOM 537 C ILE A 895 0.228 -10.922 -21.699 1.00 4.78 C ATOM 538 O ILE A 895 0.193 -10.109 -22.623 1.00 5.97 O ATOM 539 CB ILE A 895 0.340 -9.374 -19.690 1.00 5.70 C ATOM 540 CG1 ILE A 895 1.032 -9.182 -18.341 1.00 8.06 C ATOM 541 CG2 ILE A 895 -1.173 -9.535 -19.492 1.00 4.55 C ATOM 542 CD1 ILE A 895 0.936 -7.781 -17.789 1.00 12.18 C ATOM 543 H ILE A 895 2.727 -9.462 -20.931 1.00 0.00 H ATOM 544 N LEU A 896 -0.299 -12.139 -21.772 1.00 4.30 N ATOM 545 CA LEU A 896 -0.986 -12.650 -22.962 1.00 6.88 C ATOM 546 C LEU A 896 -2.478 -12.325 -22.957 1.00 8.55 C ATOM 547 O LEU A 896 -3.077 -12.072 -24.013 1.00 8.93 O ATOM 548 CB LEU A 896 -0.792 -14.168 -23.063 1.00 5.66 C ATOM 549 CG LEU A 896 0.673 -14.631 -23.088 1.00 6.89 C ATOM 550 CD1 LEU A 896 0.742 -16.156 -23.238 1.00 7.33 C ATOM 551 CD2 LEU A 896 1.468 -13.924 -24.182 1.00 8.82 C ATOM 552 H LEU A 896 -0.220 -12.761 -20.942 1.00 0.00 H ATOM 553 N GLU A 897 -3.078 -12.351 -21.770 1.00 5.65 N ATOM 554 CA GLU A 897 -4.500 -12.049 -21.603 1.00 5.42 C ATOM 555 C GLU A 897 -4.752 -11.338 -20.289 1.00 5.31 C ATOM 556 O GLU A 897 -4.070 -11.575 -19.296 1.00 5.09 O ATOM 557 CB GLU A 897 -5.374 -13.310 -21.624 1.00 6.91 C ATOM 558 CG GLU A 897 -5.320 -14.139 -22.882 1.00 10.85 C ATOM 559 CD GLU A 897 -6.207 -15.369 -22.792 1.00 16.42 C ATOM 560 OE1 GLU A 897 -6.781 -15.618 -21.714 1.00 19.35 O ATOM 561 OE2 GLU A 897 -6.333 -16.077 -23.805 1.00 21.29 O ATOM 562 H GLU A 897 -2.516 -12.595 -20.930 1.00 0.00 H ATOM 563 N ILE A 898 -5.751 -10.477 -20.291 1.00 2.79 N ATOM 564 CA ILE A 898 -6.299 -9.942 -19.057 1.00 3.58 C ATOM 565 C ILE A 898 -7.785 -10.173 -19.114 1.00 5.13 C ATOM 566 O ILE A 898 -8.429 -9.777 -20.098 1.00 6.07 O ATOM 567 CB ILE A 898 -6.023 -8.437 -18.891 1.00 5.35 C ATOM 568 CG1 ILE A 898 -4.514 -8.160 -18.951 1.00 5.00 C ATOM 569 CG2 ILE A 898 -6.639 -7.939 -17.593 1.00 6.74 C ATOM 570 CD1 ILE A 898 -4.142 -6.713 -18.728 1.00 8.12 C ATOM 571 H ILE A 898 -6.157 -10.173 -21.199 1.00 0.00 H ATOM 572 N ASN A 899 -8.327 -10.808 -18.076 1.00 5.69 N ATOM 573 CA ASN A 899 -9.750 -11.134 -18.025 1.00 7.06 C ATOM 574 C ASN A 899 -10.250 -11.783 -19.320 1.00 9.52 C ATOM 575 O ASN A 899 -11.231 -11.334 -19.900 1.00 7.86 O ATOM 576 CB ASN A 899 -10.581 -9.878 -17.719 1.00 6.28 C ATOM 577 CG ASN A 899 -10.247 -9.269 -16.367 1.00 7.19 C ATOM 578 OD1 ASN A 899 -9.798 -9.958 -15.447 1.00 5.28 O ATOM 579 ND2 ASN A 899 -10.499 -7.975 -16.231 1.00 8.23 N ATOM 580 HD22 ASN A 899 -10.877 -7.432 -17.033 1.00 0.00 H ATOM 581 HD21 ASN A 899 -10.318 -7.503 -15.322 1.00 0.00 H ATOM 582 H ASN A 899 -7.719 -11.080 -17.278 1.00 0.00 H ATOM 583 N ASN A 900 -9.546 -12.820 -19.771 1.00 12.12 N ATOM 584 CA ASN A 900 -9.935 -13.609 -20.945 1.00 11.04 C ATOM 585 C ASN A 900 -9.889 -12.875 -22.272 1.00 11.97 C ATOM 586 O ASN A 900 -10.423 -13.366 -23.260 1.00 13.60 O ATOM 587 CB ASN A 900 -11.342 -14.186 -20.752 1.00 12.15 C ATOM 588 CG ASN A 900 -11.483 -14.919 -19.443 1.00 15.81 C ATOM 589 OD1 ASN A 900 -12.254 -14.516 -18.576 1.00 17.95 O ATOM 590 ND2 ASN A 900 -10.727 -15.990 -19.284 1.00 14.15 N ATOM 591 HD22 ASN A 900 -10.089 -16.294 -20.047 1.00 0.00 H ATOM 592 HD21 ASN A 900 -10.770 -16.530 -18.396 1.00 0.00 H ATOM 593 H ASN A 900 -8.676 -13.084 -19.265 1.00 0.00 H ATOM 594 N ARG A 901 -9.250 -11.712 -22.298 1.00 9.20 N ATOM 595 CA ARG A 901 -9.068 -10.963 -23.532 1.00 8.83 C ATOM 596 C ARG A 901 -7.598 -10.859 -23.883 1.00 11.90 C ATOM 597 O ARG A 901 -6.780 -10.528 -23.028 1.00 9.18 O ATOM 598 CB ARG A 901 -9.681 -9.569 -23.414 1.00 9.45 C ATOM 599 CG ARG A 901 -11.197 -9.607 -23.301 1.00 10.89 C ATOM 600 CD ARG A 901 -11.744 -8.268 -22.895 1.00 10.12 C ATOM 601 NE ARG A 901 -13.201 -8.277 -22.773 1.00 13.98 N ATOM 602 CZ ARG A 901 -14.043 -8.019 -23.773 1.00 14.81 C ATOM 603 NH1 ARG A 901 -13.585 -7.745 -24.994 1.00 13.79 N ATOM 604 NH2 ARG A 901 -15.352 -8.052 -23.553 1.00 16.71 N ATOM 605 HE ARG A 901 -13.608 -8.500 -21.842 1.00 0.00 H ATOM 606 HH12 ARG A 901 -14.252 -7.545 -25.767 1.00 0.00 H ATOM 607 HH11 ARG A 901 -12.561 -7.731 -25.174 1.00 0.00 H ATOM 608 HH22 ARG A 901 -16.015 -7.852 -24.329 1.00 0.00 H ATOM 609 HH21 ARG A 901 -15.714 -8.278 -22.605 1.00 0.00 H ATOM 610 H ARG A 901 -8.869 -11.325 -21.411 1.00 0.00 H ATOM 611 N ALA A 902 -7.266 -11.134 -25.145 1.00 11.14 N ATOM 612 CA ALA A 902 -5.880 -11.051 -25.606 1.00 10.33 C ATOM 613 C ALA A 902 -5.331 -9.659 -25.389 1.00 14.06 C ATOM 614 O ALA A 902 -6.054 -8.676 -25.547 1.00 13.68 O ATOM 615 CB ALA A 902 -5.782 -11.431 -27.082 1.00 15.07 C ATOM 616 H ALA A 902 -8.009 -11.414 -25.817 1.00 0.00 H ATOM 617 N ALA A 903 -4.055 -9.566 -25.028 1.00 10.23 N ATOM 618 CA ALA A 903 -3.433 -8.268 -24.770 1.00 15.83 C ATOM 619 C ALA A 903 -3.532 -7.319 -25.967 1.00 16.96 C ATOM 620 O ALA A 903 -3.709 -6.114 -25.798 1.00 18.47 O ATOM 621 CB ALA A 903 -1.980 -8.445 -24.382 1.00 10.05 C ATOM 622 H ALA A 903 -3.489 -10.432 -24.927 1.00 0.00 H ATOM 623 N ASP A 904 -3.418 -7.864 -27.172 1.00 13.77 N ATOM 624 CA ASP A 904 -3.427 -7.034 -28.373 1.00 20.09 C ATOM 625 C ASP A 904 -4.845 -6.640 -28.767 1.00 18.56 C ATOM 626 O ASP A 904 -5.053 -5.937 -29.748 1.00 22.49 O ATOM 627 CB ASP A 904 -2.753 -7.764 -29.531 1.00 22.74 C ATOM 628 CG ASP A 904 -3.422 -9.080 -29.844 1.00 31.08 C ATOM 629 OD1 ASP A 904 -2.894 -10.133 -29.425 1.00 38.66 O ATOM 630 OD2 ASP A 904 -4.488 -9.066 -30.494 1.00 36.15 O ATOM 631 H ASP A 904 -3.321 -8.896 -27.262 1.00 0.00 H ATOM 632 N ALA A 905 -5.823 -7.099 -28.003 1.00 15.61 N ATOM 633 CA ALA A 905 -7.200 -6.705 -28.252 1.00 14.75 C ATOM 634 C ALA A 905 -7.672 -5.730 -27.177 1.00 18.52 C ATOM 635 O ALA A 905 -8.855 -5.390 -27.125 1.00 21.36 O ATOM 636 CB ALA A 905 -8.115 -7.926 -28.306 1.00 18.69 C ATOM 637 H ALA A 905 -5.605 -7.746 -27.219 1.00 0.00 H ATOM 638 N LEU A 906 -6.750 -5.276 -26.329 1.00 15.03 N ATOM 639 CA LEU A 906 -7.102 -4.292 -25.307 1.00 14.34 C ATOM 640 C LEU A 906 -6.874 -2.862 -25.789 1.00 19.24 C ATOM 641 O LEU A 906 -6.184 -2.635 -26.778 1.00 21.36 O ATOM 642 CB LEU A 906 -6.305 -4.547 -24.029 1.00 13.01 C ATOM 643 CG LEU A 906 -6.475 -5.959 -23.464 1.00 14.48 C ATOM 644 CD1 LEU A 906 -5.641 -6.145 -22.191 1.00 12.73 C ATOM 645 CD2 LEU A 906 -7.952 -6.222 -23.188 1.00 15.12 C ATOM 646 H LEU A 906 -5.772 -5.624 -26.395 1.00 0.00 H ATOM 647 N ASN A 907 -7.485 -1.901 -25.104 1.00 12.22 N ATOM 648 CA ASN A 907 -7.154 -0.496 -25.296 1.00 12.11 C ATOM 649 C ASN A 907 -7.070 0.156 -23.923 1.00 13.26 C ATOM 650 O ASN A 907 -7.301 -0.516 -22.914 1.00 10.72 O ATOM 651 CB ASN A 907 -8.181 0.201 -26.191 1.00 10.61 C ATOM 652 CG ASN A 907 -9.604 -0.025 -25.725 1.00 11.82 C ATOM 653 OD1 ASN A 907 -9.939 0.282 -24.587 1.00 14.25 O ATOM 654 ND2 ASN A 907 -10.444 -0.568 -26.601 1.00 15.65 N ATOM 655 HD22 ASN A 907 -10.113 -0.812 -27.556 1.00 0.00 H ATOM 656 HD21 ASN A 907 -11.432 -0.749 -26.331 1.00 0.00 H ATOM 657 H ASN A 907 -8.218 -2.159 -24.413 1.00 0.00 H ATOM 658 N SER A 908 -6.749 1.446 -23.870 1.00 10.98 N ATOM 659 CA SER A 908 -6.482 2.070 -22.581 1.00 16.11 C ATOM 660 C SER A 908 -7.768 2.216 -21.777 1.00 8.51 C ATOM 661 O SER A 908 -7.737 2.158 -20.553 1.00 10.62 O ATOM 662 CB SER A 908 -5.794 3.429 -22.756 1.00 19.45 C ATOM 663 OG SER A 908 -6.600 4.319 -23.506 1.00 24.40 O ATOM 664 HG SER A 908 -6.770 3.933 -24.402 1.00 0.00 H ATOM 665 H SER A 908 -6.689 2.006 -24.744 1.00 0.00 H ATOM 666 N SER A 909 -8.895 2.401 -22.459 1.00 10.73 N ATOM 667 CA SER A 909 -10.198 2.465 -21.775 1.00 9.53 C ATOM 668 C SER A 909 -10.511 1.156 -21.034 1.00 9.21 C ATOM 669 O SER A 909 -11.002 1.167 -19.907 1.00 9.25 O ATOM 670 CB SER A 909 -11.323 2.787 -22.769 1.00 10.58 C ATOM 671 OG SER A 909 -11.044 3.992 -23.481 1.00 15.11 O ATOM 672 HG SER A 909 -11.782 4.178 -24.114 1.00 0.00 H ATOM 673 H SER A 909 -8.855 2.502 -23.493 1.00 0.00 H ATOM 674 N MET A 910 -10.209 0.030 -21.666 1.00 8.58 N ATOM 675 CA MET A 910 -10.416 -1.276 -21.041 1.00 9.00 C ATOM 676 C MET A 910 -9.442 -1.525 -19.889 1.00 8.89 C ATOM 677 O MET A 910 -9.825 -2.085 -18.849 1.00 7.53 O ATOM 678 CB MET A 910 -10.289 -2.384 -22.089 1.00 9.73 C ATOM 679 CG MET A 910 -11.318 -2.283 -23.211 1.00 12.81 C ATOM 680 SD MET A 910 -11.038 -3.513 -24.522 1.00 20.31 S ATOM 681 CE MET A 910 -11.381 -4.975 -23.587 1.00 18.76 C ATOM 682 H MET A 910 -9.816 0.077 -22.628 1.00 0.00 H ATOM 683 N MET A 911 -8.189 -1.115 -20.085 1.00 7.72 N ATOM 684 CA MET A 911 -7.153 -1.237 -19.060 1.00 11.32 C ATOM 685 C MET A 911 -7.566 -0.521 -17.780 1.00 7.91 C ATOM 686 O MET A 911 -7.464 -1.063 -16.682 1.00 5.75 O ATOM 687 CB MET A 911 -5.823 -0.656 -19.567 1.00 9.20 C ATOM 688 CG MET A 911 -5.197 -1.420 -20.712 1.00 15.15 C ATOM 689 SD MET A 911 -4.593 -3.034 -20.190 1.00 16.18 S ATOM 690 CE MET A 911 -3.253 -2.529 -19.116 1.00 14.44 C ATOM 691 H MET A 911 -7.939 -0.692 -21.002 1.00 0.00 H ATOM 692 N GLU A 912 -8.010 0.722 -17.926 1.00 7.44 N ATOM 693 CA GLU A 912 -8.375 1.507 -16.762 1.00 5.74 C ATOM 694 C GLU A 912 -9.600 0.908 -16.086 1.00 7.05 C ATOM 695 O GLU A 912 -9.675 0.834 -14.867 1.00 7.85 O ATOM 696 CB GLU A 912 -8.618 2.959 -17.165 1.00 9.08 C ATOM 697 CG GLU A 912 -7.339 3.671 -17.582 1.00 7.61 C ATOM 698 CD GLU A 912 -7.590 5.083 -18.050 1.00 9.13 C ATOM 699 OE1 GLU A 912 -8.750 5.538 -17.947 1.00 11.99 O ATOM 700 OE2 GLU A 912 -6.628 5.733 -18.530 1.00 13.44 O ATOM 701 H GLU A 912 -8.096 1.134 -18.877 1.00 0.00 H ATOM 702 N ASP A 913 -10.558 0.457 -16.885 1.00 7.27 N ATOM 703 CA ASP A 913 -11.753 -0.161 -16.329 1.00 6.59 C ATOM 704 C ASP A 913 -11.354 -1.417 -15.555 1.00 6.66 C ATOM 705 O ASP A 913 -11.777 -1.612 -14.413 1.00 7.20 O ATOM 706 CB ASP A 913 -12.758 -0.478 -17.451 1.00 8.01 C ATOM 707 CG ASP A 913 -14.207 -0.632 -16.948 1.00 11.47 C ATOM 708 OD1 ASP A 913 -14.543 -0.200 -15.835 1.00 12.96 O ATOM 709 OD2 ASP A 913 -15.025 -1.179 -17.697 1.00 17.45 O ATOM 710 H ASP A 913 -10.455 0.546 -17.916 1.00 0.00 H ATOM 711 N PHE A 914 -10.524 -2.261 -16.165 1.00 7.05 N ATOM 712 CA PHE A 914 -10.111 -3.520 -15.531 1.00 6.78 C ATOM 713 C PHE A 914 -9.391 -3.310 -14.195 1.00 4.95 C ATOM 714 O PHE A 914 -9.661 -4.021 -13.227 1.00 7.39 O ATOM 715 CB PHE A 914 -9.204 -4.343 -16.467 1.00 7.66 C ATOM 716 CG PHE A 914 -9.932 -4.978 -17.627 1.00 8.34 C ATOM 717 CD1 PHE A 914 -11.316 -4.947 -17.701 1.00 9.06 C ATOM 718 CD2 PHE A 914 -9.225 -5.605 -18.651 1.00 13.98 C ATOM 719 CE1 PHE A 914 -11.989 -5.532 -18.773 1.00 12.86 C ATOM 720 CE2 PHE A 914 -9.897 -6.199 -19.730 1.00 11.15 C ATOM 721 CZ PHE A 914 -11.282 -6.158 -19.786 1.00 10.41 C ATOM 722 H PHE A 914 -10.161 -2.024 -17.110 1.00 0.00 H ATOM 723 N PHE A 915 -8.479 -2.342 -14.129 1.00 4.68 N ATOM 724 CA PHE A 915 -7.685 -2.195 -12.912 1.00 6.42 C ATOM 725 C PHE A 915 -8.335 -1.260 -11.882 1.00 7.96 C ATOM 726 O PHE A 915 -7.802 -1.056 -10.797 1.00 6.85 O ATOM 727 CB PHE A 915 -6.258 -1.777 -13.283 1.00 7.80 C ATOM 728 CG PHE A 915 -5.469 -2.923 -13.866 1.00 8.39 C ATOM 729 CD1 PHE A 915 -4.956 -3.912 -13.041 1.00 8.08 C ATOM 730 CD2 PHE A 915 -5.326 -3.065 -15.229 1.00 9.59 C ATOM 731 CE1 PHE A 915 -4.276 -4.998 -13.570 1.00 9.36 C ATOM 732 CE2 PHE A 915 -4.655 -4.142 -15.762 1.00 9.51 C ATOM 733 CZ PHE A 915 -4.126 -5.115 -14.931 1.00 9.18 C ATOM 734 H PHE A 915 -8.334 -1.699 -14.933 1.00 0.00 H ATOM 735 N SER A 916 -9.523 -0.763 -12.217 1.00 5.62 N ATOM 736 CA SER A 916 -10.405 -0.104 -11.266 1.00 8.75 C ATOM 737 C SER A 916 -11.215 -1.134 -10.462 1.00 7.44 C ATOM 738 O SER A 916 -11.709 -0.835 -9.375 1.00 10.02 O ATOM 739 CB SER A 916 -11.357 0.853 -12.000 1.00 9.08 C ATOM 740 OG SER A 916 -12.129 1.635 -11.084 1.00 12.03 O ATOM 741 HG SER A 916 -12.669 1.034 -10.513 1.00 0.00 H ATOM 742 H SER A 916 -9.836 -0.850 -13.205 1.00 0.00 H ATOM 743 N GLN A 917 -11.358 -2.344 -10.999 1.00 5.99 N ATOM 744 CA GLN A 917 -12.150 -3.391 -10.342 1.00 8.89 C ATOM 745 C GLN A 917 -11.433 -3.984 -9.126 1.00 7.63 C ATOM 746 O GLN A 917 -10.209 -3.858 -8.993 1.00 7.93 O ATOM 747 CB GLN A 917 -12.495 -4.509 -11.340 1.00 7.88 C ATOM 748 CG GLN A 917 -13.216 -4.038 -12.590 1.00 7.94 C ATOM 749 CD GLN A 917 -14.334 -3.064 -12.286 1.00 13.79 C ATOM 750 OE1 GLN A 917 -15.231 -3.359 -11.498 1.00 15.10 O ATOM 751 NE2 GLN A 917 -14.279 -1.889 -12.902 1.00 7.82 N ATOM 752 HE22 GLN A 917 -13.501 -1.683 -13.561 1.00 0.00 H ATOM 753 HE21 GLN A 917 -15.014 -1.175 -12.726 1.00 0.00 H ATOM 754 H GLN A 917 -10.897 -2.553 -11.907 1.00 0.00 H ATOM 755 N PRO A 918 -12.199 -4.614 -8.219 1.00 6.23 N ATOM 756 CA PRO A 918 -11.648 -5.228 -6.997 1.00 9.30 C ATOM 757 C PRO A 918 -10.794 -6.465 -7.274 1.00 6.62 C ATOM 758 O PRO A 918 -10.109 -6.939 -6.366 1.00 6.97 O ATOM 759 CB PRO A 918 -12.894 -5.630 -6.206 1.00 9.46 C ATOM 760 CG PRO A 918 -14.017 -4.831 -6.788 1.00 9.91 C ATOM 761 CD PRO A 918 -13.676 -4.568 -8.208 1.00 9.63 C ATOM 762 N SER A 919 -10.836 -6.986 -8.498 1.00 6.16 N ATOM 763 CA SER A 919 -10.028 -8.158 -8.848 1.00 6.46 C ATOM 764 C SER A 919 -9.728 -8.209 -10.340 1.00 8.64 C ATOM 765 O SER A 919 -10.326 -7.483 -11.136 1.00 6.39 O ATOM 766 CB SER A 919 -10.730 -9.453 -8.418 1.00 9.31 C ATOM 767 OG SER A 919 -11.901 -9.656 -9.182 1.00 6.93 O ATOM 768 HG SER A 919 -12.518 -8.894 -9.047 1.00 0.00 H ATOM 769 H SER A 919 -11.451 -6.555 -9.217 1.00 0.00 H ATOM 770 N VAL A 920 -8.808 -9.087 -10.718 1.00 6.42 N ATOM 771 CA VAL A 920 -8.369 -9.159 -12.100 1.00 5.97 C ATOM 772 C VAL A 920 -7.723 -10.526 -12.356 1.00 8.08 C ATOM 773 O VAL A 920 -7.115 -11.129 -11.456 1.00 9.86 O ATOM 774 CB VAL A 920 -7.392 -8.003 -12.429 1.00 6.57 C ATOM 775 CG1 VAL A 920 -6.106 -8.142 -11.620 1.00 7.27 C ATOM 776 CG2 VAL A 920 -7.100 -7.936 -13.913 1.00 5.64 C ATOM 777 H VAL A 920 -8.396 -9.733 -10.015 1.00 0.00 H ATOM 778 N GLY A 921 -7.895 -11.030 -13.573 1.00 5.54 N ATOM 779 CA GLY A 921 -7.273 -12.276 -13.972 1.00 6.20 C ATOM 780 C GLY A 921 -6.262 -12.016 -15.074 1.00 8.23 C ATOM 781 O GLY A 921 -6.477 -11.159 -15.934 1.00 6.16 O ATOM 782 H GLY A 921 -8.490 -10.518 -14.255 1.00 0.00 H ATOM 783 N LEU A 922 -5.165 -12.768 -15.043 1.00 6.70 N ATOM 784 CA LEU A 922 -4.070 -12.607 -15.982 1.00 4.77 C ATOM 785 C LEU A 922 -3.573 -13.946 -16.511 1.00 5.65 C ATOM 786 O LEU A 922 -3.471 -14.924 -15.765 1.00 6.61 O ATOM 787 CB LEU A 922 -2.903 -11.880 -15.311 1.00 7.19 C ATOM 788 CG LEU A 922 -3.169 -10.544 -14.617 1.00 9.89 C ATOM 789 CD1 LEU A 922 -2.013 -10.215 -13.672 1.00 15.39 C ATOM 790 CD2 LEU A 922 -3.300 -9.485 -15.661 1.00 10.05 C ATOM 791 H LEU A 922 -5.089 -13.505 -14.313 1.00 0.00 H ATOM 792 N LEU A 923 -3.254 -13.978 -17.798 1.00 5.08 N ATOM 793 CA LEU A 923 -2.542 -15.098 -18.388 1.00 4.28 C ATOM 794 C LEU A 923 -1.162 -14.574 -18.727 1.00 5.45 C ATOM 795 O LEU A 923 -1.046 -13.603 -19.480 1.00 6.02 O ATOM 796 CB LEU A 923 -3.242 -15.625 -19.643 1.00 5.04 C ATOM 797 CG LEU A 923 -2.580 -16.859 -20.278 1.00 5.83 C ATOM 798 CD1 LEU A 923 -2.860 -18.103 -19.428 1.00 5.10 C ATOM 799 CD2 LEU A 923 -3.055 -17.071 -21.720 1.00 5.98 C ATOM 800 H LEU A 923 -3.522 -13.176 -18.404 1.00 0.00 H ATOM 801 N VAL A 924 -0.113 -15.175 -18.173 1.00 5.33 N ATOM 802 CA VAL A 924 1.222 -14.647 -18.431 1.00 5.53 C ATOM 803 C VAL A 924 2.162 -15.715 -18.949 1.00 5.29 C ATOM 804 O VAL A 924 1.948 -16.909 -18.747 1.00 6.13 O ATOM 805 CB VAL A 924 1.859 -14.006 -17.174 1.00 7.93 C ATOM 806 CG1 VAL A 924 0.897 -13.028 -16.493 1.00 9.73 C ATOM 807 CG2 VAL A 924 2.331 -15.067 -16.209 1.00 7.92 C ATOM 808 H VAL A 924 -0.243 -16.009 -17.565 1.00 0.00 H ATOM 809 N ARG A 925 3.218 -15.273 -19.619 1.00 5.43 N ATOM 810 CA ARG A 925 4.191 -16.198 -20.167 1.00 5.34 C ATOM 811 C ARG A 925 5.569 -15.825 -19.648 1.00 6.86 C ATOM 812 O ARG A 925 5.972 -14.666 -19.730 1.00 6.79 O ATOM 813 CB ARG A 925 4.160 -16.181 -21.696 1.00 6.44 C ATOM 814 CG ARG A 925 4.979 -17.307 -22.317 1.00 7.01 C ATOM 815 CD ARG A 925 4.551 -17.561 -23.748 1.00 8.34 C ATOM 816 NE ARG A 925 4.742 -16.389 -24.599 1.00 11.80 N ATOM 817 CZ ARG A 925 4.087 -16.192 -25.743 1.00 19.45 C ATOM 818 NH1 ARG A 925 4.309 -15.098 -26.468 1.00 15.36 N ATOM 819 NH2 ARG A 925 3.198 -17.093 -26.155 1.00 16.11 N ATOM 820 HE ARG A 925 5.427 -15.668 -24.295 1.00 0.00 H ATOM 821 HH12 ARG A 925 3.794 -14.952 -27.360 1.00 0.00 H ATOM 822 HH11 ARG A 925 4.998 -14.390 -26.143 1.00 0.00 H ATOM 823 HH22 ARG A 925 2.683 -16.946 -27.047 1.00 0.00 H ATOM 824 HH21 ARG A 925 3.018 -17.944 -25.585 1.00 0.00 H ATOM 825 H ARG A 925 3.350 -14.250 -19.753 1.00 0.00 H ATOM 826 N THR A 926 6.295 -16.811 -19.130 1.00 7.11 N ATOM 827 CA THR A 926 7.510 -16.530 -18.373 1.00 6.91 C ATOM 828 C THR A 926 8.603 -17.528 -18.707 1.00 7.83 C ATOM 829 O THR A 926 8.354 -18.528 -19.381 1.00 9.10 O ATOM 830 CB THR A 926 7.224 -16.569 -16.846 1.00 8.04 C ATOM 831 OG1 THR A 926 8.320 -15.997 -16.117 1.00 9.26 O ATOM 832 CG2 THR A 926 6.992 -18.005 -16.376 1.00 8.35 C ATOM 833 HG1 THR A 926 8.447 -15.056 -16.398 1.00 0.00 H ATOM 834 H THR A 926 5.992 -17.797 -19.266 1.00 0.00 H ATOM 835 N TYR A 927 9.818 -17.237 -18.245 1.00 8.89 N ATOM 836 CA TYR A 927 10.901 -18.216 -18.201 1.00 9.27 C ATOM 837 C TYR A 927 11.165 -18.574 -16.747 1.00 8.56 C ATOM 838 O TYR A 927 10.918 -17.758 -15.868 1.00 7.50 O ATOM 839 CB TYR A 927 12.180 -17.656 -18.831 1.00 8.88 C ATOM 840 CG TYR A 927 12.210 -17.620 -20.346 1.00 10.07 C ATOM 841 CD1 TYR A 927 12.301 -18.799 -21.097 1.00 11.21 C ATOM 842 CD2 TYR A 927 12.210 -16.413 -21.021 1.00 13.52 C ATOM 843 CE1 TYR A 927 12.361 -18.755 -22.488 1.00 14.00 C ATOM 844 CE2 TYR A 927 12.267 -16.360 -22.405 1.00 17.76 C ATOM 845 CZ TYR A 927 12.345 -17.525 -23.131 1.00 14.13 C ATOM 846 OH TYR A 927 12.407 -17.451 -24.507 1.00 18.19 O ATOM 847 HH TYR A 927 12.459 -18.365 -24.883 1.00 0.00 H ATOM 848 H TYR A 927 10.003 -16.273 -17.901 1.00 0.00 H ATOM 849 N PRO A 928 11.690 -19.789 -16.487 1.00 10.94 N ATOM 850 CA PRO A 928 12.176 -20.070 -15.132 1.00 11.73 C ATOM 851 C PRO A 928 13.123 -18.961 -14.694 1.00 9.50 C ATOM 852 O PRO A 928 13.847 -18.445 -15.535 1.00 9.29 O ATOM 853 CB PRO A 928 12.933 -21.396 -15.276 1.00 9.13 C ATOM 854 CG PRO A 928 12.471 -21.986 -16.534 1.00 9.61 C ATOM 855 CD PRO A 928 12.022 -20.868 -17.432 1.00 9.76 C ATOM 856 N GLU A 929 13.077 -18.585 -13.424 1.00 9.50 N ATOM 857 CA GLU A 929 13.903 -17.511 -12.880 1.00 15.34 C ATOM 858 C GLU A 929 15.380 -17.774 -13.137 1.00 15.96 C ATOM 859 O GLU A 929 16.182 -16.856 -13.355 1.00 18.02 O ATOM 860 CB GLU A 929 13.633 -17.390 -11.387 1.00 15.89 C ATOM 861 CG GLU A 929 13.866 -16.038 -10.773 1.00 23.09 C ATOM 862 CD GLU A 929 13.626 -16.061 -9.273 1.00 24.85 C ATOM 863 OE1 GLU A 929 14.567 -16.422 -8.531 1.00 28.90 O ATOM 864 OE2 GLU A 929 12.501 -15.734 -8.838 1.00 27.76 O ATOM 865 H GLU A 929 12.422 -19.078 -12.785 1.00 0.00 H ATOM 866 N LEU A 930 15.725 -19.052 -13.125 1.00 12.25 N ATOM 867 CA LEU A 930 17.088 -19.499 -13.356 1.00 13.69 C ATOM 868 C LEU A 930 17.048 -20.942 -13.842 1.00 21.05 C ATOM 869 O LEU A 930 16.279 -21.760 -13.305 1.00 16.53 O ATOM 870 CB LEU A 930 17.919 -19.386 -12.071 1.00 15.31 C ATOM 871 CG LEU A 930 19.434 -19.383 -12.187 1.00 14.86 C ATOM 872 CD1 LEU A 930 19.886 -18.104 -12.874 1.00 10.80 C ATOM 873 CD2 LEU A 930 20.046 -19.505 -10.804 1.00 11.67 C ATOM 874 OXT LEU A 930 17.761 -21.312 -14.777 1.00 19.00 O ATOM 875 H LEU A 930 14.990 -19.765 -12.943 1.00 0.00 H TER 876 LEU A 930 HETATM 877 O HOH 1 -10.563 -6.503 -13.607 1.00 7.30 O HETATM 878 O HOH 2 5.948 -15.866 -13.777 1.00 6.20 O HETATM 879 O HOH 3 -10.866 -7.319 -3.784 1.00 9.76 O HETATM 880 O HOH 4 0.484 -6.241 -2.589 1.00 8.73 O HETATM 881 O HOH 5 1.664 -8.932 -24.721 1.00 6.81 O HETATM 882 O HOH 6 19.323 -20.011 -16.265 1.00 13.43 O HETATM 883 O HOH 7 4.502 -7.921 -5.573 1.00 7.51 O HETATM 884 O HOH 8 -4.437 4.966 -19.345 1.00 13.92 O HETATM 885 O HOH 9 -12.464 3.155 -19.146 1.00 12.60 O HETATM 886 O HOH 10 -15.826 -6.084 -10.628 1.00 9.29 O HETATM 887 O HOH 11 6.772 -12.904 -2.364 1.00 14.02 O HETATM 888 O HOH 12 -8.342 -4.758 -10.461 1.00 9.87 O HETATM 889 O HOH 13 -13.288 -9.405 -19.945 1.00 12.00 O HETATM 890 O HOH 14 -1.128 -3.391 -0.794 1.00 12.79 O HETATM 891 O HOH 15 10.371 -4.474 -3.765 1.00 17.66 O HETATM 892 O HOH 16 -8.628 -14.501 -16.959 1.00 14.46 O HETATM 893 O HOH 17 2.690 -4.614 -2.567 1.00 15.80 O HETATM 894 O HOH 18 12.114 -4.081 -15.870 1.00 15.55 O HETATM 895 O HOH 19 -5.888 -12.800 -4.438 1.00 10.86 O HETATM 896 O HOH 20 -13.474 -8.129 -17.373 1.00 13.87 O HETATM 897 O HOH 21 -11.119 -7.239 -26.220 1.00 14.75 O HETATM 898 O HOH 22 7.262 -17.511 -10.763 1.00 16.21 O HETATM 899 O HOH 23 -11.169 5.343 -19.252 1.00 14.71 O HETATM 900 O HOH 24 -5.789 2.714 -26.260 1.00 22.63 O HETATM 901 O HOH 25 -0.051 -6.647 0.204 1.00 11.62 O HETATM 902 O HOH 26 -7.275 -14.296 -19.000 1.00 12.25 O HETATM 903 O HOH 27 12.070 -15.119 -16.007 1.00 17.45 O HETATM 904 O HOH 28 -9.110 3.735 -25.083 1.00 13.47 O HETATM 905 O HOH 29 10.894 -9.687 -21.205 1.00 15.41 O HETATM 906 O HOH 30 8.933 -21.518 -25.851 1.00 22.87 O HETATM 907 O HOH 31 7.887 -14.541 -21.900 1.00 17.93 O HETATM 908 O HOH 32 14.868 -21.784 -11.009 1.00 16.41 O HETATM 909 O HOH 33 -11.417 -1.605 -6.625 1.00 15.67 O HETATM 910 O HOH 34 5.125 -1.378 -8.629 1.00 18.50 O HETATM 911 O HOH 35 1.230 -19.637 -24.536 1.00 15.07 O HETATM 912 O HOH 36 16.689 -18.178 -8.544 1.00 19.99 O HETATM 913 O HOH 37 -10.836 6.178 -21.937 1.00 18.07 O HETATM 914 O HOH 38 4.307 -10.228 2.098 1.00 24.20 O HETATM 915 O HOH 39 10.807 -9.711 -10.963 1.00 21.76 O HETATM 916 O HOH 40 4.277 -21.258 -22.881 1.00 13.80 O HETATM 917 O HOH 41 -6.822 -4.165 0.721 1.00 19.07 O HETATM 918 O HOH 42 10.647 -8.616 -7.011 1.00 17.23 O HETATM 919 O HOH 43 -1.978 -10.464 -27.444 1.00 25.44 O HETATM 920 O HOH 44 -10.094 -4.226 -0.442 1.00 23.04 O HETATM 921 O HOH 45 -11.286 -4.762 -2.347 1.00 22.76 O HETATM 922 O HOH 46 13.322 -3.324 -34.833 1.00 24.63 O HETATM 923 O HOH 47 14.504 -15.878 -5.924 1.00 27.49 O HETATM 924 O HOH 48 -14.131 -7.779 -9.559 1.00 21.98 O HETATM 925 O HOH 49 -13.890 -12.844 -3.504 1.00 29.09 O HETATM 926 O HOH 50 -10.062 -14.263 -13.236 1.00 21.75 O HETATM 927 O HOH 51 6.426 -14.223 -24.137 1.00 12.54 O HETATM 928 O HOH 52 4.715 -4.983 -0.862 1.00 21.82 O HETATM 929 O HOH 53 -9.316 -11.699 -27.195 1.00 22.40 O HETATM 930 O HOH 54 -2.278 -12.690 -26.663 1.00 23.01 O HETATM 931 O HOH 55 -5.299 -0.161 -9.918 1.00 16.09 O HETATM 932 O HOH 56 12.094 -12.701 -19.066 1.00 21.45 O HETATM 933 O HOH 57 0.341 -8.832 -27.067 1.00 29.04 O HETATM 934 O HOH 58 6.681 0.355 -7.028 1.00 28.63 O HETATM 935 O HOH 59 -9.631 -2.600 -28.633 1.00 24.89 O HETATM 936 O HOH 60 4.143 -17.823 -3.181 1.00 25.36 O HETATM 937 O HOH 61 -1.361 -19.123 -24.509 1.00 21.36 O HETATM 938 O HOH 62 -10.918 -10.057 -27.117 1.00 27.10 O HETATM 939 O HOH 63 8.230 -18.751 -8.731 1.00 24.98 O HETATM 940 O HOH 64 -12.012 -14.938 -3.078 1.00 31.75 O HETATM 941 O HOH 65 17.391 -4.435 -36.182 1.00 27.67 O HETATM 942 O HOH 66 -7.058 -1.096 -29.390 1.00 28.80 O HETATM 943 O HOH 67 4.461 -18.571 -6.758 1.00 26.10 O HETATM 944 O HOH 68 8.892 -11.732 -2.692 1.00 24.23 O HETATM 945 O HOH 69 -7.824 -16.760 -16.218 1.00 22.56 O HETATM 946 O HOH 70 7.816 -12.523 -31.732 1.00 34.91 O HETATM 947 O HOH 71 -13.215 -13.142 -23.902 1.00 24.86 O HETATM 948 O HOH 72 -15.249 -15.409 -3.417 1.00 33.32 O HETATM 949 O HOH 73 -10.744 -16.746 -16.908 1.00 18.77 O HETATM 950 O HOH 74 9.279 -13.317 -20.719 1.00 23.23 O HETATM 951 O HOH 75 11.157 -12.563 -21.570 1.00 27.12 O HETATM 952 O HOH 76 12.680 -9.786 -6.415 1.00 20.88 O HETATM 953 O HOH 77 -14.867 -12.495 -0.773 1.00 25.40 O HETATM 954 O HOH 78 11.008 -14.122 -26.969 1.00 33.70 O HETATM 955 O HOH 79 12.874 -12.332 -7.235 1.00 31.03 O HETATM 956 O HOH 80 8.622 -24.642 -26.973 1.00 30.32 O HETATM 957 O HOH 81 7.617 2.536 -8.121 1.00 24.35 O HETATM 958 O HOH 82 19.422 -5.326 -35.429 1.00 26.91 O HETATM 959 O HOH 83 7.633 -15.547 -3.654 1.00 25.02 O HETATM 960 O HOH 84 9.738 -11.190 -9.089 1.00 24.81 O HETATM 961 O HOH 85 6.555 -16.948 -5.003 1.00 29.66 O HETATM 962 O HOH 86 9.958 -14.186 -17.645 1.00 19.57 O HETATM 963 O HOH 87 -13.149 -6.481 -15.202 1.00 22.76 O HETATM 964 O HOH 88 -12.197 -3.921 -28.966 1.00 34.63 O HETATM 965 O HOH 89 13.904 -9.340 -4.522 1.00 25.88 O HETATM 966 O HOH 90 -3.536 1.707 -10.167 1.00 11.24 O HETATM 967 O HOH 91 4.697 7.993 -22.483 1.00 10.55 O HETATM 968 O HOH 92 2.368 -1.003 -7.770 1.00 11.36 O HETATM 969 O HOH 93 7.123 7.322 -23.747 1.00 18.40 O HETATM 970 O HOH 94 -4.503 -1.733 -7.793 1.00 15.06 O HETATM 971 O HOH 95 -0.648 2.336 -7.614 1.00 22.47 O HETATM 972 O HOH 96 -3.142 1.464 -6.642 1.00 30.04 O HETATM 973 O HOH 97 -2.676 1.795 -22.521 1.00 21.61 O HETATM 974 O HOH 98 11.066 3.817 -23.121 1.00 24.29 O HETATM 975 O HOH 99 7.530 6.060 -26.426 1.00 32.69 O HETATM 976 N ASN A 100 10.934 0.547 -26.236 1.00 0.24 N HETATM 977 CA ASN A 100 10.037 1.696 -26.383 1.00 0.08 C HETATM 978 C ASN A 100 8.790 1.570 -25.529 1.00 0.23 C HETATM 979 O ASN A 100 7.775 1.040 -25.974 1.00 -0.39 O HETATM 980 N ASN A 100 8.864 2.073 -24.306 1.00 -0.26 N HETATM 981 CA ASN A 100 7.734 2.020 -23.396 1.00 0.13 C HETATM 982 C ASN A 100 6.868 3.279 -23.576 1.00 0.20 C HETATM 983 O ASN A 100 7.387 4.393 -23.581 1.00 -0.39 O HETATM 984 N ASN A 100 5.561 3.138 -23.756 1.00 -0.26 N HETATM 985 CA ASN A 100 4.767 4.361 -23.858 1.00 0.14 C HETATM 986 C ASN A 100 3.820 4.598 -22.681 1.00 0.21 C HETATM 987 O ASN A 100 3.279 5.685 -22.546 1.00 -0.39 O HETATM 988 N ASN A 100 3.648 3.607 -21.813 1.00 -0.26 N HETATM 989 CA ASN A 100 2.886 3.820 -20.578 1.00 0.13 C HETATM 990 C ASN A 100 3.222 2.747 -19.546 1.00 0.20 C HETATM 991 O ASN A 100 3.536 1.606 -19.889 1.00 -0.39 O HETATM 992 N ASN A 100 3.150 3.131 -18.277 1.00 -0.26 N HETATM 993 CA ASN A 100 3.351 2.207 -17.174 1.00 0.13 C HETATM 994 C ASN A 100 2.127 2.312 -16.251 1.00 0.20 C HETATM 995 O ASN A 100 1.786 3.412 -15.821 1.00 -0.39 O HETATM 996 N ASN A 100 1.440 1.200 -15.985 1.00 -0.26 N HETATM 997 CA ASN A 100 0.312 1.208 -15.042 1.00 0.14 C HETATM 998 C ASN A 100 0.820 0.690 -13.703 1.00 0.21 C HETATM 999 O ASN A 100 1.403 -0.376 -13.655 1.00 -0.39 O HETATM 1000 N ASN A 100 0.643 1.430 -12.617 1.00 -0.26 N HETATM 1001 CA ASN A 100 1.121 0.934 -11.328 1.00 0.14 C HETATM 1002 C ASN A 100 -0.070 0.430 -10.542 1.00 0.21 C HETATM 1003 O ASN A 100 -0.929 1.220 -10.142 1.00 -0.39 O HETATM 1004 N ASN A 100 -0.146 -0.882 -10.328 1.00 -0.27 N HETATM 1005 CA ASN A 100 -1.361 -1.454 -9.756 1.00 0.10 C HETATM 1006 C ASN A 100 -1.113 -2.267 -8.480 1.00 0.06 C HETATM 1007 O ASN A 100 -2.089 -2.675 -7.842 1.00 -0.57 O HETATM 1008 OXT ASN A 100 0.020 -2.510 -8.033 1.00 -0.57 O HETATM 1009 CB ASN A 100 -2.099 -2.330 -10.797 1.00 -0.01 C HETATM 1010 CG1 ASN A 100 -2.544 -1.476 -11.980 1.00 -0.06 C HETATM 1011 H66 ASN A 100 -3.067 -2.108 -12.713 1.00 0.02 H HETATM 1012 H67 ASN A 100 -1.663 -1.018 -12.454 1.00 0.02 H HETATM 1013 H68 ASN A 100 -3.223 -0.686 -11.627 1.00 0.02 H HETATM 1014 CG2 ASN A 100 -1.215 -3.459 -11.280 1.00 -0.06 C HETATM 1015 H69 ASN A 100 -0.898 -4.070 -10.422 1.00 0.02 H HETATM 1016 H70 ASN A 100 -0.328 -3.042 -11.780 1.00 0.02 H HETATM 1017 H71 ASN A 100 -1.775 -4.086 -11.989 1.00 0.02 H HETATM 1018 H65 ASN A 100 -2.990 -2.763 -10.319 1.00 0.03 H HETATM 1019 H64 ASN A 100 -2.021 -0.616 -9.489 1.00 0.07 H HETATM 1020 H63 ASN A 100 0.627 -1.474 -10.558 1.00 0.19 H HETATM 1021 CB ASN A 100 1.866 2.023 -10.549 1.00 0.02 C HETATM 1022 CG ASN A 100 3.207 2.408 -11.152 1.00 -0.05 C HETATM 1023 CD1 ASN A 100 3.300 3.408 -12.125 1.00 -0.07 C HETATM 1024 CE1 ASN A 100 4.535 3.761 -12.681 1.00 -0.04 C HETATM 1025 CZ ASN A 100 5.691 3.124 -12.264 1.00 0.08 C HETATM 1026 CE2 ASN A 100 5.624 2.129 -11.297 1.00 -0.04 C HETATM 1027 CD2 ASN A 100 4.380 1.772 -10.749 1.00 -0.07 C HETATM 1028 H59 ASN A 100 4.332 0.989 -10.001 1.00 0.05 H HETATM 1029 H61 ASN A 100 6.528 1.630 -10.966 1.00 0.05 H HETATM 1030 OH ASN A 100 6.916 3.478 -12.822 1.00 -0.34 O HETATM 1031 H62 ASN A 100 6.784 4.168 -13.461 1.00 0.25 H HETATM 1032 H60 ASN A 100 4.586 4.534 -13.439 1.00 0.05 H HETATM 1033 H58 ASN A 100 2.402 3.918 -12.454 1.00 0.05 H HETATM 1034 H56 ASN A 100 2.039 1.659 -9.525 1.00 0.05 H HETATM 1035 H57 ASN A 100 1.231 2.921 -10.517 1.00 0.05 H HETATM 1036 H55 ASN A 100 1.814 0.098 -11.504 1.00 0.08 H HETATM 1037 H54 ASN A 100 0.187 2.318 -12.679 1.00 0.19 H HETATM 1038 CB ASN A 100 -0.850 0.332 -15.529 1.00 0.02 C HETATM 1039 CG ASN A 100 -1.616 0.825 -16.740 1.00 -0.05 C HETATM 1040 CD1 ASN A 100 -1.200 0.501 -18.024 1.00 -0.07 C HETATM 1041 CE1 ASN A 100 -1.890 0.939 -19.136 1.00 -0.04 C HETATM 1042 CZ ASN A 100 -3.027 1.689 -18.983 1.00 0.08 C HETATM 1043 CE2 ASN A 100 -3.479 2.026 -17.724 1.00 -0.04 C HETATM 1044 CD2 ASN A 100 -2.765 1.592 -16.601 1.00 -0.07 C HETATM 1045 H50 ASN A 100 -3.114 1.858 -15.610 1.00 0.05 H HETATM 1046 H52 ASN A 100 -4.378 2.621 -17.606 1.00 0.05 H HETATM 1047 OH ASN A 100 -3.690 2.110 -20.111 1.00 -0.34 O HETATM 1048 H53 ASN A 100 -3.239 1.786 -20.882 1.00 0.25 H HETATM 1049 H51 ASN A 100 -1.533 0.690 -20.129 1.00 0.05 H HETATM 1050 H49 ASN A 100 -0.314 -0.109 -18.156 1.00 0.05 H HETATM 1051 H47 ASN A 100 -1.565 0.236 -14.699 1.00 0.05 H HETATM 1052 H48 ASN A 100 -0.440 -0.658 -15.775 1.00 0.05 H HETATM 1053 H46 ASN A 100 -0.050 2.240 -14.924 1.00 0.08 H HETATM 1054 H45 ASN A 100 1.697 0.345 -16.435 1.00 0.19 H HETATM 1055 CB ASN A 100 4.646 2.564 -16.445 1.00 -0.00 C HETATM 1056 CG ASN A 100 5.119 1.617 -15.377 1.00 0.00 C HETATM 1057 CD ASN A 100 5.785 0.400 -15.948 1.00 0.04 C HETATM 1058 OE1 ASN A 100 6.917 0.088 -15.562 1.00 -0.57 O HETATM 1059 OE2 ASN A 100 5.153 -0.279 -16.765 1.00 -0.57 O HETATM 1060 H43 ASN A 100 4.253 1.298 -14.778 1.00 0.04 H HETATM 1061 H44 ASN A 100 5.838 2.143 -14.731 1.00 0.04 H HETATM 1062 H41 ASN A 100 4.500 3.547 -15.974 1.00 0.03 H HETATM 1063 H42 ASN A 100 5.442 2.634 -17.201 1.00 0.03 H HETATM 1064 H40 ASN A 100 3.429 1.179 -17.558 1.00 0.08 H HETATM 1065 H39 ASN A 100 2.950 4.090 -18.073 1.00 0.19 H HETATM 1066 CB ASN A 100 1.364 3.846 -20.850 1.00 -0.01 C HETATM 1067 CG ASN A 100 0.497 4.094 -19.607 1.00 -0.04 C HETATM 1068 CD ASN A 100 -0.973 4.311 -19.963 1.00 -0.01 C HETATM 1069 CE ASN A 100 -1.198 5.734 -20.456 1.00 -0.04 C HETATM 1070 NZ ASN A 100 -2.577 5.903 -21.002 1.00 0.22 N HETATM 1071 H36 ASN A 100 -2.698 6.852 -21.320 1.00 0.20 H HETATM 1072 H37 ASN A 100 -3.251 5.702 -20.280 1.00 0.20 H HETATM 1073 H38 ASN A 100 -2.713 5.269 -21.774 1.00 0.20 H HETATM 1074 H34 ASN A 100 -0.468 5.959 -21.248 1.00 0.08 H HETATM 1075 H35 ASN A 100 -1.056 6.431 -19.617 1.00 0.08 H HETATM 1076 H32 ASN A 100 -1.591 4.135 -19.070 1.00 0.03 H HETATM 1077 H33 ASN A 100 -1.262 3.604 -20.754 1.00 0.03 H HETATM 1078 H30 ASN A 100 0.871 4.988 -19.087 1.00 0.03 H HETATM 1079 H31 ASN A 100 0.575 3.222 -18.941 1.00 0.03 H HETATM 1080 H28 ASN A 100 1.076 2.876 -21.281 1.00 0.03 H HETATM 1081 H29 ASN A 100 1.159 4.646 -21.577 1.00 0.03 H HETATM 1082 H27 ASN A 100 3.175 4.797 -20.165 1.00 0.08 H HETATM 1083 H26 ASN A 100 4.042 2.708 -22.003 1.00 0.19 H HETATM 1084 CB ASN A 100 3.992 4.397 -25.171 1.00 0.04 C HETATM 1085 CG ASN A 100 3.375 3.082 -25.512 1.00 0.04 C HETATM 1086 OD1 ASN A 100 2.739 2.487 -24.616 1.00 -0.57 O HETATM 1087 OD2 ASN A 100 3.539 2.637 -26.677 1.00 -0.57 O HETATM 1088 H24 ASN A 100 4.682 4.682 -25.979 1.00 0.05 H HETATM 1089 H25 ASN A 100 3.194 5.149 -25.088 1.00 0.05 H HETATM 1090 H23 ASN A 100 5.478 5.200 -23.869 1.00 0.08 H HETATM 1091 H22 ASN A 100 5.138 2.234 -23.819 1.00 0.19 H HETATM 1092 CB ASN A 100 8.251 1.885 -21.961 1.00 -0.01 C HETATM 1093 CG ASN A 100 7.239 1.435 -20.959 1.00 -0.04 C HETATM 1094 CD ASN A 100 7.784 1.590 -19.546 1.00 -0.01 C HETATM 1095 CE ASN A 100 8.985 0.714 -19.282 1.00 -0.04 C HETATM 1096 NZ ASN A 100 9.420 0.987 -17.877 1.00 0.22 N HETATM 1097 H19 ASN A 100 10.224 0.420 -17.658 1.00 0.20 H HETATM 1098 H20 ASN A 100 8.669 0.764 -17.243 1.00 0.20 H HETATM 1099 H21 ASN A 100 9.661 1.961 -17.783 1.00 0.20 H HETATM 1100 H17 ASN A 100 9.795 0.961 -19.984 1.00 0.08 H HETATM 1101 H18 ASN A 100 8.713 -0.346 -19.395 1.00 0.08 H HETATM 1102 H15 ASN A 100 6.991 1.323 -18.832 1.00 0.03 H HETATM 1103 H16 ASN A 100 8.075 2.640 -19.395 1.00 0.03 H HETATM 1104 H13 ASN A 100 6.996 0.378 -21.140 1.00 0.03 H HETATM 1105 H14 ASN A 100 6.329 2.044 -21.065 1.00 0.03 H HETATM 1106 H11 ASN A 100 8.631 2.867 -21.643 1.00 0.03 H HETATM 1107 H12 ASN A 100 9.075 1.156 -21.963 1.00 0.03 H HETATM 1108 H10 ASN A 100 7.122 1.137 -23.634 1.00 0.08 H HETATM 1109 H9 ASN A 100 9.717 2.498 -24.003 1.00 0.19 H HETATM 1110 CB ASN A 100 9.609 1.880 -27.839 1.00 0.10 C HETATM 1111 CG ASN A 100 10.754 2.239 -28.739 1.00 0.18 C HETATM 1112 OD1 ASN A 100 10.943 1.645 -29.807 1.00 -0.40 O HETATM 1113 ND2 ASN A 100 11.533 3.221 -28.320 1.00 -0.30 N HETATM 1114 H7 ASN A 100 12.315 3.510 -28.873 1.00 0.18 H HETATM 1115 H8 ASN A 100 11.341 3.675 -27.450 1.00 0.18 H HETATM 1116 H5 ASN A 100 8.859 2.683 -27.886 1.00 0.06 H HETATM 1117 H6 ASN A 100 9.162 0.940 -28.196 1.00 0.06 H HETATM 1118 H4 ASN A 100 10.586 2.594 -26.063 1.00 0.11 H HETATM 1119 H1 ASN A 100 11.745 0.677 -26.821 1.00 0.20 H HETATM 1120 H2 ASN A 100 10.451 -0.294 -26.513 1.00 0.20 H HETATM 1121 H3 ASN A 100 11.223 0.467 -25.274 1.00 0.20 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 976 977 1119 1120 1121 CONECT 977 976 978 1110 1118 CONECT 978 977 979 980 CONECT 979 978 CONECT 980 978 981 1109 CONECT 981 980 982 1092 1108 CONECT 982 981 983 984 CONECT 983 982 CONECT 984 982 985 1091 CONECT 985 984 986 1084 1090 CONECT 986 985 987 988 CONECT 987 986 CONECT 988 986 989 1083 CONECT 989 988 990 1066 1082 CONECT 990 989 991 992 CONECT 991 990 CONECT 992 990 993 1065 CONECT 993 992 994 1055 1064 CONECT 994 993 995 996 CONECT 995 994 CONECT 996 994 997 1054 CONECT 997 996 998 1038 1053 CONECT 998 997 999 1000 CONECT 999 998 CONECT 1000 998 1001 1037 CONECT 1001 1000 1002 1021 1036 CONECT 1002 1001 1003 1004 CONECT 1003 1002 CONECT 1004 1002 1005 1020 CONECT 1005 1004 1006 1009 1019 CONECT 1006 1005 1007 1008 CONECT 1007 1006 CONECT 1008 1006 CONECT 1009 1005 1010 1014 1018 CONECT 1010 1009 1011 1012 1013 CONECT 1011 1010 CONECT 1012 1010 CONECT 1013 1010 CONECT 1014 1009 1015 1016 1017 CONECT 1015 1014 CONECT 1016 1014 CONECT 1017 1014 CONECT 1018 1009 CONECT 1019 1005 CONECT 1020 1004 CONECT 1021 1001 1022 1034 1035 CONECT 1022 1021 1023 1027 CONECT 1023 1022 1024 1033 CONECT 1024 1023 1025 1032 CONECT 1025 1024 1026 1030 CONECT 1026 1025 1027 1029 CONECT 1027 1022 1026 1028 CONECT 1028 1027 CONECT 1029 1026 CONECT 1030 1025 1031 CONECT 1031 1030 CONECT 1032 1024 CONECT 1033 1023 CONECT 1034 1021 CONECT 1035 1021 CONECT 1036 1001 CONECT 1037 1000 CONECT 1038 997 1039 1051 1052 CONECT 1039 1038 1040 1044 CONECT 1040 1039 1041 1050 CONECT 1041 1040 1042 1049 CONECT 1042 1041 1043 1047 CONECT 1043 1042 1044 1046 CONECT 1044 1039 1043 1045 CONECT 1045 1044 CONECT 1046 1043 CONECT 1047 1042 1048 CONECT 1048 1047 CONECT 1049 1041 CONECT 1050 1040 CONECT 1051 1038 CONECT 1052 1038 CONECT 1053 997 CONECT 1054 996 CONECT 1055 993 1056 1062 1063 CONECT 1056 1055 1057 1060 1061 CONECT 1057 1056 1058 1059 CONECT 1058 1057 CONECT 1059 1057 CONECT 1060 1056 CONECT 1061 1056 CONECT 1062 1055 CONECT 1063 1055 CONECT 1064 993 CONECT 1065 992 CONECT 1066 989 1067 1080 1081 CONECT 1067 1066 1068 1078 1079 CONECT 1068 1067 1069 1076 1077 CONECT 1069 1068 1070 1074 1075 CONECT 1070 1069 1071 1072 1073 CONECT 1071 1070 CONECT 1072 1070 CONECT 1073 1070 CONECT 1074 1069 CONECT 1075 1069 CONECT 1076 1068 CONECT 1077 1068 CONECT 1078 1067 CONECT 1079 1067 CONECT 1080 1066 CONECT 1081 1066 CONECT 1082 989 CONECT 1083 988 CONECT 1084 985 1085 1088 1089 CONECT 1085 1084 1086 1087 CONECT 1086 1085 CONECT 1087 1085 CONECT 1088 1084 CONECT 1089 1084 CONECT 1090 985 CONECT 1091 984 CONECT 1092 981 1093 1106 1107 CONECT 1093 1092 1094 1104 1105 CONECT 1094 1093 1095 1102 1103 CONECT 1095 1094 1096 1100 1101 CONECT 1096 1095 1097 1098 1099 CONECT 1097 1096 CONECT 1098 1096 CONECT 1099 1096 CONECT 1100 1095 CONECT 1101 1095 CONECT 1102 1094 CONECT 1103 1094 CONECT 1104 1093 CONECT 1105 1093 CONECT 1106 1092 CONECT 1107 1092 CONECT 1108 981 CONECT 1109 980 CONECT 1110 977 1111 1116 1117 CONECT 1111 1110 1112 1113 CONECT 1112 1111 CONECT 1113 1111 1114 1115 CONECT 1114 1113 CONECT 1115 1113 CONECT 1116 1110 CONECT 1117 1110 CONECT 1118 977 CONECT 1119 976 CONECT 1120 976 CONECT 1121 976 MASTER 0 0 0 0 0 0 0 0 1120 1 150 8 END
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Related entries of code: 4nxr
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3kze
RCSB PDB
PDBbind
94aa, >3KZE_1|Chains... *
4gvc
RCSB PDB
PDBbind
94aa, >4GVC_1|Chain... at 100%
4gvd
RCSB PDB
PDBbind
94aa, >4GVD_1|Chains... at 100%
4nxq
RCSB PDB
PDBbind
94aa, >4NXQ_1|Chains... at 95%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1fo0
RCSB PDB
PDBbind
8-mer
1fzj
RCSB PDB
PDBbind
8-mer
1fzm
RCSB PDB
PDBbind
8-mer
1g6r
RCSB PDB
PDBbind
8-mer
1g7q
RCSB PDB
PDBbind
8-mer
1leg
RCSB PDB
PDBbind
8-mer
1lek
RCSB PDB
PDBbind
8-mer
1nlp
RCSB PDB
PDBbind
8-mer
1nzl
RCSB PDB
PDBbind
8-mer
1nzv
RCSB PDB
PDBbind
8-mer
1obx
RCSB PDB
PDBbind
8-mer
1okx
RCSB PDB
PDBbind
8-mer
1p2g
RCSB PDB
PDBbind
8-mer
1pig
RCSB PDB
PDBbind
8-mer
1pz5
RCSB PDB
PDBbind
8-mer
1qja
RCSB PDB
PDBbind
8-mer
1qjb
RCSB PDB
PDBbind
8-mer
1qr3
RCSB PDB
PDBbind
8-mer
1sle
RCSB PDB
PDBbind
8-mer
1tps
RCSB PDB
PDBbind
8-mer
2c1n
RCSB PDB
PDBbind
8-mer
2clv
RCSB PDB
PDBbind
8-mer
2er0
RCSB PDB
PDBbind
8-mer
2er9
RCSB PDB
PDBbind
8-mer
2fo4
RCSB PDB
PDBbind
8-mer
2h6k
RCSB PDB
PDBbind
8-mer
2kbs
RCSB PDB
PDBbind
8-mer
2qbw
RCSB PDB
PDBbind
8-mer
2r03
RCSB PDB
PDBbind
8-mer
2r9b
RCSB PDB
PDBbind
8-mer
2rly
RCSB PDB
PDBbind
8-mer
2rt5
RCSB PDB
PDBbind
8-mer
2v88
RCSB PDB
PDBbind
8-mer
2w16
RCSB PDB
PDBbind
8-mer
2w3o
RCSB PDB
PDBbind
8-mer
2ynn
RCSB PDB
PDBbind
8-mer
2zpk
RCSB PDB
PDBbind
8-mer
3agm
RCSB PDB
PDBbind
8-mer
3av9
RCSB PDB
PDBbind
8-mer
3ava
RCSB PDB
PDBbind
8-mer
3avb
RCSB PDB
PDBbind
8-mer
3avf
RCSB PDB
PDBbind
8-mer
3avg
RCSB PDB
PDBbind
8-mer
3avh
RCSB PDB
PDBbind
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3avi
RCSB PDB
PDBbind
8-mer
3avj
RCSB PDB
PDBbind
8-mer
3avk
RCSB PDB
PDBbind
8-mer
3avl
RCSB PDB
PDBbind
8-mer
3avm
RCSB PDB
PDBbind
8-mer
3avn
RCSB PDB
PDBbind
8-mer
3drf
RCSB PDB
PDBbind
8-mer
3ds9
RCSB PDB
PDBbind
8-mer
3eyu
RCSB PDB
PDBbind
8-mer
3h85
RCSB PDB
PDBbind
8-mer
3i91
RCSB PDB
PDBbind
8-mer
3jvk
RCSB PDB
PDBbind
8-mer
3kze
RCSB PDB
PDBbind
8-mer
3muk
RCSB PDB
PDBbind
8-mer
3n5e
RCSB PDB
PDBbind
8-mer
3nf3
RCSB PDB
PDBbind
8-mer
3omc
RCSB PDB
PDBbind
8-mer
3omg
RCSB PDB
PDBbind
8-mer
3p9l
RCSB PDB
PDBbind
8-mer
3p9m
RCSB PDB
PDBbind
8-mer
3pab
RCSB PDB
PDBbind
8-mer
3qg6
RCSB PDB
PDBbind
8-mer
3rdv
RCSB PDB
PDBbind
8-mer
3rwh
RCSB PDB
PDBbind
8-mer
3rwj
RCSB PDB
PDBbind
8-mer
3unn
RCSB PDB
PDBbind
8-mer
3uqp
RCSB PDB
PDBbind
8-mer
3uri
RCSB PDB
PDBbind
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3uyr
RCSB PDB
PDBbind
8-mer
3zev
RCSB PDB
PDBbind
8-mer
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RCSB PDB
PDBbind
8-mer
3zyr
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PDBbind
8-mer
4aa1
RCSB PDB
PDBbind
8-mer
4aph
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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4dv9
RCSB PDB
PDBbind
8-mer
4e67
RCSB PDB
PDBbind
8-mer
4eoy
RCSB PDB
PDBbind
8-mer
4ep2
RCSB PDB
PDBbind
8-mer
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RCSB PDB
PDBbind
8-mer
4ezr
RCSB PDB
PDBbind
8-mer
4fmo
RCSB PDB
PDBbind
8-mer
4fn5
RCSB PDB
PDBbind
8-mer
4gpk
RCSB PDB
PDBbind
8-mer
4gvc
RCSB PDB
PDBbind
8-mer
4gvd
RCSB PDB
PDBbind
8-mer
4gvu
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PDBbind
8-mer
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RCSB PDB
PDBbind
8-mer
4h75
RCSB PDB
PDBbind
8-mer
4ii9
RCSB PDB
PDBbind
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4jiz
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PDBbind
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RCSB PDB
PDBbind
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4lkm
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PDBbind
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PDBbind
8-mer
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PDBbind
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4o2f
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
8-mer
5emb
RCSB PDB
PDBbind
8-mer
5fjx
RCSB PDB
PDBbind
8-mer
5fpi
RCSB PDB
PDBbind
8-mer
5gmv
RCSB PDB
PDBbind
8-mer
5hjb
RCSB PDB
PDBbind
8-mer
5i25
RCSB PDB
PDBbind
8-mer
5iok
RCSB PDB
PDBbind
8-mer
5iql
RCSB PDB
PDBbind
8-mer
5jjm
RCSB PDB
PDBbind
8-mer
5mgx
RCSB PDB
PDBbind
8-mer
5n70
RCSB PDB
PDBbind
8-mer
5svi
RCSB PDB
PDBbind
8-mer
5sxm
RCSB PDB
PDBbind
8-mer
5t6p
RCSB PDB
PDBbind
8-mer
5t78
RCSB PDB
PDBbind
8-mer
5teg
RCSB PDB
PDBbind
8-mer
5tkj
RCSB PDB
PDBbind
8-mer
5tkk
RCSB PDB
PDBbind
8-mer
5vwi
RCSB PDB
PDBbind
8-mer
5vwk
RCSB PDB
PDBbind
8-mer
5wou
RCSB PDB
PDBbind
8-mer
5wtt
RCSB PDB
PDBbind
8-mer
5xjm
RCSB PDB
PDBbind
8-mer
5xn3
RCSB PDB
PDBbind
8-mer
5yba
RCSB PDB
PDBbind
8-mer
6cdm
RCSB PDB
PDBbind
8-mer
6cdo
RCSB PDB
PDBbind
8-mer
6cdp
RCSB PDB
PDBbind
8-mer
6e86
RCSB PDB
PDBbind
8-mer
6eww
RCSB PDB
PDBbind
8-mer
6fau
RCSB PDB
PDBbind
8-mer
6fav
RCSB PDB
PDBbind
8-mer
6faw
RCSB PDB
PDBbind
8-mer
6fbw
RCSB PDB
PDBbind
8-mer
6fby
RCSB PDB
PDBbind
8-mer
6fel
RCSB PDB
PDBbind
8-mer
6fi4
RCSB PDB
PDBbind
8-mer
6fi5
RCSB PDB
PDBbind
8-mer
6fmp
RCSB PDB
PDBbind
8-mer
6fx1
RCSB PDB
PDBbind
8-mer
6hpg
RCSB PDB
PDBbind
8-mer
6min
RCSB PDB
PDBbind
8-mer
6miq
RCSB PDB
PDBbind
8-mer
6q3q
RCSB PDB
PDBbind
8-mer
6r0x
RCSB PDB
PDBbind
8-mer
6qk8
RCSB PDB
PDBbind
8-mer
6q4q
RCSB PDB
PDBbind
8-mer
6mtv
RCSB PDB
PDBbind
8-mer
6mtu
RCSB PDB
PDBbind
8-mer
6ms1
RCSB PDB
PDBbind
8-mer
6mqe
RCSB PDB
PDBbind
8-mer
6mqc
RCSB PDB
PDBbind
8-mer
6jax
RCSB PDB
PDBbind
8-mer
6hmt
RCSB PDB
PDBbind
8-mer
6hhp
RCSB PDB
PDBbind
8-mer
6dtn
RCSB PDB
PDBbind
8-mer
6dql
RCSB PDB
PDBbind
8-mer
6do1
RCSB PDB
PDBbind
8-mer
Entry Information
PDB ID
4nxr
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
T-lymphoma invasion and metastasis-inducing protein 1
Ligand Name
8-mer
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=46uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Structure Vol. 24: pp. 2053-2066
Ligand Properties
Formula
C
4
8
H
7
4
N
1
1
O
1
6
Molecular Weight
1061.170
Exact Mass
1060.530
No. of atoms
149
No. of bonds
150
Polar Surface Area
482.07
LOGP Value
-5.50 (
Computed with XLOGP3
)
-1.90 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 41
No. of Nitrogen and Oxygen Atoms: 27
No. of Rings: 2
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCCC[NH3+])CC(=O)O
InChI String
InChI=1S/C48H71N11O16/c1-25(2)40(48(74)75)59-47(73)35(22-27-11-15-29(61)16-12-27)57-45(71)34(21-26-9-13-28(60)14-10-26)56-44(70)33(17-18-38(63)64)55-42(68)32(8-4-6-20-50)54-46(72)36(24-39(65)66)58-43(69)31(7-3-5-19-49)53-41(67)30(51)23-37(52)62/h9-16,25,30-36,40,60-61H,3-8,17-24,49-51H2,1-2H3,(H2,52,62)(H,53,67)(H,54,72)(H,55,68)(H,56,70)(H,57,71)(H,58,69)(H,59,73)(H,63,64)(H,65,66)(H,74,75)/p+3/t30-,31-,32-,33-,34-,35-,36-,40-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P58401
Q13009
Entrez Gene ID
NCBI Entrez Gene ID:
9379
7074
ASD
Information of known allosteric effects of PDB entries
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