Browse entries in the PDBbind-CN Database
HEADER 6NRG_COMPLEX COMPND 6NRG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 17 LYS SER LYS LEU PRO LYS PRO VAL GLN ASP LEU ILE LYS SEQRES 2 A 17 MET ILE PHE GLY SEQRES 1 A 223 ASP PRO ILE ASP VAL ASN TYR GLU LYS LEU LYS THR ASP SEQRES 2 A 223 ILE LYS VAL VAL ASP ARG ASP SER GLU GLU ALA GLU ILE SEQRES 3 A 223 ILE ARG LYS TYR VAL LYS ASN THR HIS ALA THR THR HIS SEQRES 4 A 223 ASN ALA TYR ASP LEU GLU VAL ILE ASP ILE PHE LYS ILE SEQRES 5 A 223 GLU ARG GLU GLY GLU CYS GLN ARG TYR LYS PRO PHE LYS SEQRES 6 A 223 GLN LEU HIS ASN ARG ARG LEU LEU TRP HIS GLY SER ARG SEQRES 7 A 223 THR THR ASN PHE ALA GLY ILE LEU SER GLN GLY LEU ARG SEQRES 8 A 223 ILE ALA PRO PRO GLU ALA PRO VAL THR GLY TYR MET PHE SEQRES 9 A 223 GLY LYS GLY ILE TYR PHE ALA ASP MET VAL SER LYS SER SEQRES 10 A 223 ALA ASN TYR CYS HIS THR SER GLN GLY ASP PRO ILE GLY SEQRES 11 A 223 LEU ILE LEU LEU GLY GLU VAL ALA LEU GLY ASN MET TYR SEQRES 12 A 223 GLU LEU LYS HIS ALA SER HIS ILE SER LYS LEU PRO LYS SEQRES 13 A 223 GLY LYS HIS SER VAL LYS GLY LEU GLY LYS THR THR PRO SEQRES 14 A 223 ASP PRO SER ALA ASN ILE SER LEU ASP GLY VAL ASP VAL SEQRES 15 A 223 PRO LEU GLY THR GLY ILE SER SER GLY VAL ASN ASP THR SEQRES 16 A 223 SER LEU LEU TYR ASN GLU TYR ILE VAL TYR ASP ILE ALA SEQRES 17 A 223 GLN VAL ASN LEU LYS TYR LEU LEU LYS LEU LYS PHE ASN SEQRES 18 A 223 PHE LYS HET KYY A 388 36 ATOM 1 N LYS A 764 -2.129 -16.918 30.816 1.00 75.38 N ATOM 2 CA LYS A 764 -1.715 -15.493 30.966 1.00 73.12 C ATOM 3 C LYS A 764 -0.228 -15.439 31.336 1.00 63.05 C ATOM 4 O LYS A 764 0.257 -16.264 32.097 1.00 61.43 O ATOM 5 CB LYS A 764 -2.562 -14.783 32.031 1.00 83.77 C ATOM 6 CG LYS A 764 -3.929 -14.287 31.560 1.00 98.05 C ATOM 7 CD LYS A 764 -3.922 -13.495 30.245 1.00105.82 C ATOM 8 CE LYS A 764 -2.858 -12.409 30.161 1.00111.81 C ATOM 9 NZ LYS A 764 -2.933 -11.458 31.302 1.00117.79 N ATOM 10 HZ1 LYS A 764 -3.865 -10.997 31.307 1.00 0.00 H ATOM 11 HZ2 LYS A 764 -2.796 -11.976 32.193 1.00 0.00 H ATOM 12 HZ3 LYS A 764 -2.190 -10.738 31.201 1.00 0.00 H ATOM 13 HN3 LYS A 764 -1.973 -17.419 31.714 1.00 0.00 H ATOM 14 HN2 LYS A 764 -1.565 -17.365 30.065 1.00 0.00 H ATOM 15 HN1 LYS A 764 -3.137 -16.960 30.565 1.00 0.00 H ATOM 16 N SER A 765 0.471 -14.442 30.792 1.00 54.38 N ATOM 17 CA SER A 765 1.897 -14.266 30.989 1.00 49.34 C ATOM 18 C SER A 765 2.207 -13.600 32.345 1.00 48.60 C ATOM 19 O SER A 765 1.520 -12.697 32.747 1.00 43.62 O ATOM 20 CB SER A 765 2.440 -13.448 29.849 1.00 50.55 C ATOM 21 OG SER A 765 3.742 -13.006 30.124 1.00 46.73 O ATOM 22 HG SER A 765 4.332 -13.788 30.264 1.00 0.00 H ATOM 23 H SER A 765 -0.033 -13.755 30.195 1.00 0.00 H ATOM 24 N LYS A 766 3.320 -13.991 32.982 1.00 48.83 N ATOM 25 CA LYS A 766 3.814 -13.344 34.208 1.00 47.17 C ATOM 26 C LYS A 766 4.997 -12.417 33.929 1.00 43.81 C ATOM 27 O LYS A 766 5.682 -12.013 34.867 1.00 40.01 O ATOM 28 CB LYS A 766 4.228 -14.397 35.242 1.00 49.64 C ATOM 29 CG LYS A 766 3.072 -15.089 35.931 1.00 55.20 C ATOM 30 CD LYS A 766 3.511 -16.005 37.055 1.00 57.93 C ATOM 31 CE LYS A 766 2.359 -16.686 37.746 1.00 62.60 C ATOM 32 NZ LYS A 766 1.588 -15.722 38.564 1.00 70.83 N ATOM 33 HZ1 LYS A 766 2.211 -15.305 39.285 1.00 0.00 H ATOM 34 HZ2 LYS A 766 1.213 -14.970 37.951 1.00 0.00 H ATOM 35 HZ3 LYS A 766 0.800 -16.216 39.029 1.00 0.00 H ATOM 36 H LYS A 766 3.860 -14.789 32.591 1.00 0.00 H ATOM 37 N LEU A 767 5.280 -12.112 32.649 1.00 37.05 N ATOM 38 CA LEU A 767 6.316 -11.224 32.294 1.00 37.67 C ATOM 39 C LEU A 767 5.772 -9.801 32.326 1.00 36.48 C ATOM 40 O LEU A 767 4.582 -9.575 32.117 1.00 37.94 O ATOM 41 CB LEU A 767 6.837 -11.547 30.890 1.00 38.21 C ATOM 42 CG LEU A 767 7.505 -12.909 30.727 1.00 39.42 C ATOM 43 CD1 LEU A 767 7.712 -13.196 29.250 1.00 38.74 C ATOM 44 CD2 LEU A 767 8.834 -12.943 31.461 1.00 40.19 C ATOM 45 H LEU A 767 4.713 -12.548 31.894 1.00 0.00 H ATOM 46 N PRO A 768 6.656 -8.817 32.588 1.00 36.97 N ATOM 47 CA PRO A 768 6.298 -7.406 32.503 1.00 37.12 C ATOM 48 C PRO A 768 5.815 -7.083 31.082 1.00 38.63 C ATOM 49 O PRO A 768 6.298 -7.646 30.121 1.00 34.62 O ATOM 50 CB PRO A 768 7.608 -6.666 32.798 1.00 38.30 C ATOM 51 CG PRO A 768 8.411 -7.661 33.625 1.00 43.14 C ATOM 52 CD PRO A 768 8.028 -9.016 33.071 1.00 39.37 C ATOM 53 N LYS A 769 4.877 -6.143 30.981 1.00 38.69 N ATOM 54 CA LYS A 769 4.245 -5.856 29.702 1.00 41.36 C ATOM 55 C LYS A 769 5.259 -5.499 28.618 1.00 39.54 C ATOM 56 O LYS A 769 5.143 -6.003 27.505 1.00 39.02 O ATOM 57 CB LYS A 769 3.213 -4.743 29.875 1.00 43.30 C ATOM 58 CG LYS A 769 2.461 -4.384 28.601 1.00 49.56 C ATOM 59 CD LYS A 769 1.522 -5.483 28.142 1.00 57.83 C ATOM 60 CE LYS A 769 0.322 -4.946 27.386 1.00 63.05 C ATOM 61 NZ LYS A 769 0.738 -3.959 26.359 1.00 64.61 N ATOM 62 HZ1 LYS A 769 1.225 -3.164 26.821 1.00 0.00 H ATOM 63 HZ2 LYS A 769 1.382 -4.416 25.682 1.00 0.00 H ATOM 64 HZ3 LYS A 769 -0.102 -3.608 25.857 1.00 0.00 H ATOM 65 H LYS A 769 4.593 -5.608 31.826 1.00 0.00 H ATOM 66 N PRO A 770 6.297 -4.650 28.837 1.00 37.88 N ATOM 67 CA PRO A 770 7.249 -4.393 27.762 1.00 35.30 C ATOM 68 C PRO A 770 7.949 -5.645 27.214 1.00 35.01 C ATOM 69 O PRO A 770 8.271 -5.666 26.023 1.00 34.57 O ATOM 70 CB PRO A 770 8.286 -3.446 28.378 1.00 35.19 C ATOM 71 CG PRO A 770 7.546 -2.781 29.515 1.00 36.03 C ATOM 72 CD PRO A 770 6.526 -3.784 30.009 1.00 38.09 C ATOM 73 N VAL A 771 8.237 -6.633 28.086 1.00 33.21 N ATOM 74 CA VAL A 771 8.843 -7.877 27.674 1.00 33.64 C ATOM 75 C VAL A 771 7.821 -8.692 26.865 1.00 33.50 C ATOM 76 O VAL A 771 8.179 -9.282 25.857 1.00 34.37 O ATOM 77 CB VAL A 771 9.395 -8.681 28.868 1.00 33.61 C ATOM 78 CG1 VAL A 771 10.049 -9.980 28.405 1.00 33.64 C ATOM 79 CG2 VAL A 771 10.382 -7.825 29.656 1.00 34.06 C ATOM 80 H VAL A 771 8.014 -6.494 29.092 1.00 0.00 H ATOM 81 N GLN A 772 6.578 -8.755 27.335 1.00 35.81 N ATOM 82 CA GLN A 772 5.495 -9.420 26.583 1.00 38.07 C ATOM 83 C GLN A 772 5.472 -8.866 25.150 1.00 39.73 C ATOM 84 O GLN A 772 5.426 -9.630 24.176 1.00 38.45 O ATOM 85 CB GLN A 772 4.142 -9.185 27.241 1.00 40.73 C ATOM 86 CG GLN A 772 3.984 -9.889 28.582 1.00 42.67 C ATOM 87 CD GLN A 772 2.554 -9.819 29.066 1.00 47.31 C ATOM 88 OE1 GLN A 772 1.623 -9.681 28.275 1.00 50.48 O ATOM 89 NE2 GLN A 772 2.364 -9.940 30.371 1.00 45.95 N ATOM 90 HE22 GLN A 772 3.179 -10.055 31.007 1.00 0.00 H ATOM 91 HE21 GLN A 772 1.400 -9.920 30.760 1.00 0.00 H ATOM 92 H GLN A 772 6.363 -8.324 28.257 1.00 0.00 H ATOM 93 N ASP A 773 5.529 -7.532 25.034 1.00 35.38 N ATOM 94 CA ASP A 773 5.397 -6.862 23.717 1.00 39.36 C ATOM 95 C ASP A 773 6.634 -7.158 22.849 1.00 40.16 C ATOM 96 O ASP A 773 6.494 -7.345 21.636 1.00 39.31 O ATOM 97 CB ASP A 773 5.124 -5.363 23.882 1.00 40.25 C ATOM 98 CG ASP A 773 3.740 -5.030 24.440 1.00 47.57 C ATOM 99 OD1 ASP A 773 2.861 -5.902 24.416 1.00 51.33 O ATOM 100 OD2 ASP A 773 3.547 -3.892 24.894 1.00 54.53 O ATOM 101 H ASP A 773 5.669 -6.953 25.887 1.00 0.00 H ATOM 102 N LEU A 774 7.830 -7.230 23.465 1.00 33.94 N ATOM 103 CA LEU A 774 9.034 -7.622 22.780 1.00 33.79 C ATOM 104 C LEU A 774 8.886 -9.034 22.196 1.00 36.32 C ATOM 105 O LEU A 774 9.236 -9.278 21.042 1.00 34.02 O ATOM 106 CB LEU A 774 10.208 -7.589 23.754 1.00 33.79 C ATOM 107 CG LEU A 774 11.551 -8.021 23.177 1.00 34.63 C ATOM 108 CD1 LEU A 774 12.009 -7.068 22.071 1.00 36.25 C ATOM 109 CD2 LEU A 774 12.575 -8.087 24.294 1.00 33.35 C ATOM 110 H LEU A 774 7.886 -6.993 24.476 1.00 0.00 H ATOM 111 N ILE A 775 8.356 -9.959 22.996 1.00 33.62 N ATOM 112 CA ILE A 775 8.232 -11.355 22.580 1.00 36.10 C ATOM 113 C ILE A 775 7.249 -11.447 21.406 1.00 38.36 C ATOM 114 O ILE A 775 7.483 -12.191 20.446 1.00 40.44 O ATOM 115 CB ILE A 775 7.782 -12.252 23.752 1.00 39.81 C ATOM 116 CG1 ILE A 775 8.840 -12.350 24.845 1.00 38.52 C ATOM 117 CG2 ILE A 775 7.321 -13.631 23.279 1.00 41.96 C ATOM 118 CD1 ILE A 775 10.230 -12.604 24.372 1.00 40.36 C ATOM 119 H ILE A 775 8.022 -9.680 23.941 1.00 0.00 H ATOM 120 N LYS A 776 6.162 -10.682 21.477 1.00 38.53 N ATOM 121 CA LYS A 776 5.181 -10.659 20.390 1.00 42.87 C ATOM 122 C LYS A 776 5.848 -10.188 19.093 1.00 43.04 C ATOM 123 O LYS A 776 5.558 -10.726 18.024 1.00 45.75 O ATOM 124 CB LYS A 776 3.990 -9.758 20.744 1.00 42.94 C ATOM 125 CG LYS A 776 3.043 -10.339 21.781 1.00 49.25 C ATOM 126 CD LYS A 776 1.871 -9.439 22.067 1.00 52.66 C ATOM 127 CE LYS A 776 1.272 -9.725 23.429 1.00 62.92 C ATOM 128 NZ LYS A 776 -0.046 -9.074 23.599 1.00 68.34 N ATOM 129 HZ1 LYS A 776 0.062 -8.044 23.499 1.00 0.00 H ATOM 130 HZ2 LYS A 776 -0.702 -9.427 22.873 1.00 0.00 H ATOM 131 HZ3 LYS A 776 -0.421 -9.295 24.544 1.00 0.00 H ATOM 132 H LYS A 776 6.007 -10.091 22.318 1.00 0.00 H ATOM 133 N MET A 777 6.732 -9.193 19.200 1.00 41.87 N ATOM 134 CA MET A 777 7.421 -8.617 18.048 1.00 42.37 C ATOM 135 C MET A 777 8.380 -9.655 17.448 1.00 42.85 C ATOM 136 O MET A 777 8.404 -9.864 16.223 1.00 44.50 O ATOM 137 CB MET A 777 8.195 -7.366 18.472 1.00 42.50 C ATOM 138 CG MET A 777 8.513 -6.420 17.342 1.00 46.05 C ATOM 139 SD MET A 777 9.243 -4.905 17.998 1.00 49.60 S ATOM 140 CE MET A 777 10.271 -4.422 16.612 1.00 43.58 C ATOM 141 H MET A 777 6.939 -8.811 20.145 1.00 0.00 H ATOM 142 N ILE A 778 9.183 -10.288 18.317 1.00 36.96 N ATOM 143 CA ILE A 778 10.211 -11.260 17.896 1.00 39.04 C ATOM 144 C ILE A 778 9.563 -12.490 17.242 1.00 40.03 C ATOM 145 O ILE A 778 10.132 -13.030 16.292 1.00 42.83 O ATOM 146 CB ILE A 778 11.105 -11.654 19.087 1.00 37.68 C ATOM 147 CG1 ILE A 778 12.005 -10.492 19.501 1.00 38.02 C ATOM 148 CG2 ILE A 778 11.901 -12.921 18.817 1.00 39.25 C ATOM 149 CD1 ILE A 778 12.791 -10.745 20.777 1.00 35.18 C ATOM 150 H ILE A 778 9.076 -10.085 19.331 1.00 0.00 H ATOM 151 N PHE A 779 8.427 -12.969 17.763 1.00 41.36 N ATOM 152 CA PHE A 779 7.843 -14.247 17.311 1.00 42.67 C ATOM 153 C PHE A 779 6.690 -14.006 16.323 1.00 51.49 C ATOM 154 O PHE A 779 6.096 -14.961 15.855 1.00 56.77 O ATOM 155 CB PHE A 779 7.410 -15.111 18.503 1.00 43.47 C ATOM 156 CG PHE A 779 8.558 -15.785 19.208 1.00 41.75 C ATOM 157 CD1 PHE A 779 9.238 -15.145 20.233 1.00 40.73 C ATOM 158 CD2 PHE A 779 8.993 -17.041 18.809 1.00 44.52 C ATOM 159 CE1 PHE A 779 10.338 -15.740 20.833 1.00 40.53 C ATOM 160 CE2 PHE A 779 10.078 -17.644 19.427 1.00 45.79 C ATOM 161 CZ PHE A 779 10.734 -17.002 20.452 1.00 42.05 C ATOM 162 H PHE A 779 7.943 -12.426 18.506 1.00 0.00 H ATOM 163 N GLY A 780 6.390 -12.741 16.002 1.00 59.00 N ATOM 164 CA GLY A 780 5.426 -12.389 14.939 1.00 66.75 C ATOM 165 C GLY A 780 4.073 -11.993 15.502 1.00 70.69 C ATOM 166 O GLY A 780 3.306 -12.841 15.958 1.00 83.78 O ATOM 167 H GLY A 780 6.856 -11.972 16.524 1.00 0.00 H TER 168 GLY A 780 ATOM 169 N ASP A 788 2.197 -20.678 20.220 1.00 72.42 N ATOM 170 CA ASP A 788 2.696 -20.965 21.558 1.00 65.68 C ATOM 171 C ASP A 788 2.408 -19.779 22.478 1.00 56.94 C ATOM 172 O ASP A 788 2.381 -18.633 22.037 1.00 55.41 O ATOM 173 CB ASP A 788 4.193 -21.293 21.521 1.00 67.01 C ATOM 174 CG ASP A 788 4.495 -22.779 21.399 1.00 72.85 C ATOM 175 OD1 ASP A 788 3.648 -23.581 21.840 1.00 77.16 O ATOM 176 OD2 ASP A 788 5.575 -23.126 20.872 1.00 67.74 O ATOM 177 HN3 ASP A 788 2.670 -19.829 19.849 1.00 0.00 H ATOM 178 HN2 ASP A 788 1.171 -20.514 20.262 1.00 0.00 H ATOM 179 HN1 ASP A 788 2.395 -21.487 19.597 1.00 0.00 H ATOM 180 N PRO A 789 2.196 -20.007 23.792 1.00 53.73 N ATOM 181 CA PRO A 789 2.009 -18.905 24.734 1.00 52.63 C ATOM 182 C PRO A 789 3.262 -18.030 24.829 1.00 47.26 C ATOM 183 O PRO A 789 4.368 -18.498 24.522 1.00 46.60 O ATOM 184 CB PRO A 789 1.725 -19.579 26.094 1.00 53.37 C ATOM 185 CG PRO A 789 1.379 -21.015 25.751 1.00 55.98 C ATOM 186 CD PRO A 789 2.085 -21.321 24.448 1.00 52.79 C ATOM 187 N ILE A 790 3.050 -16.761 25.202 1.00 45.02 N ATOM 188 CA ILE A 790 4.115 -15.769 25.345 1.00 43.95 C ATOM 189 C ILE A 790 5.248 -16.317 26.221 1.00 41.09 C ATOM 190 O ILE A 790 6.403 -16.136 25.867 1.00 39.12 O ATOM 191 CB ILE A 790 3.557 -14.443 25.899 1.00 46.21 C ATOM 192 CG1 ILE A 790 2.722 -13.703 24.851 1.00 52.44 C ATOM 193 CG2 ILE A 790 4.655 -13.552 26.460 1.00 43.42 C ATOM 194 CD1 ILE A 790 1.818 -12.629 25.442 1.00 58.08 C ATOM 195 H ILE A 790 2.073 -16.465 25.401 1.00 0.00 H ATOM 196 N ASP A 791 4.922 -16.941 27.362 1.00 41.99 N ATOM 197 CA ASP A 791 5.966 -17.334 28.305 1.00 45.91 C ATOM 198 C ASP A 791 6.715 -18.560 27.762 1.00 43.51 C ATOM 199 O ASP A 791 7.896 -18.708 28.016 1.00 40.27 O ATOM 200 CB ASP A 791 5.408 -17.515 29.725 1.00 45.45 C ATOM 201 CG ASP A 791 4.946 -16.220 30.394 1.00 47.22 C ATOM 202 OD1 ASP A 791 5.092 -15.140 29.801 1.00 45.16 O ATOM 203 OD2 ASP A 791 4.426 -16.294 31.512 1.00 52.95 O ATOM 204 H ASP A 791 3.925 -17.145 27.576 1.00 0.00 H ATOM 205 N VAL A 792 6.039 -19.418 26.990 1.00 44.53 N ATOM 206 CA VAL A 792 6.730 -20.523 26.321 1.00 44.73 C ATOM 207 C VAL A 792 7.711 -19.980 25.259 1.00 45.06 C ATOM 208 O VAL A 792 8.859 -20.438 25.183 1.00 45.55 O ATOM 209 CB VAL A 792 5.727 -21.532 25.727 1.00 49.69 C ATOM 210 CG1 VAL A 792 6.433 -22.583 24.873 1.00 53.08 C ATOM 211 CG2 VAL A 792 4.878 -22.195 26.812 1.00 53.28 C ATOM 212 H VAL A 792 5.014 -19.300 26.864 1.00 0.00 H ATOM 213 N ASN A 793 7.303 -18.979 24.464 1.00 43.13 N ATOM 214 CA ASN A 793 8.202 -18.363 23.472 1.00 40.86 C ATOM 215 C ASN A 793 9.401 -17.685 24.172 1.00 39.04 C ATOM 216 O ASN A 793 10.536 -17.769 23.700 1.00 38.68 O ATOM 217 CB ASN A 793 7.443 -17.415 22.526 1.00 42.31 C ATOM 218 CG ASN A 793 6.656 -18.180 21.480 1.00 48.05 C ATOM 219 OD1 ASN A 793 7.036 -19.297 21.151 1.00 48.75 O ATOM 220 ND2 ASN A 793 5.553 -17.623 20.991 1.00 46.90 N ATOM 221 HD22 ASN A 793 5.270 -16.671 21.300 1.00 0.00 H ATOM 222 HD21 ASN A 793 4.973 -18.139 20.299 1.00 0.00 H ATOM 223 H ASN A 793 6.327 -18.629 24.550 1.00 0.00 H ATOM 224 N TYR A 794 9.151 -17.029 25.316 1.00 36.23 N ATOM 225 CA TYR A 794 10.222 -16.392 26.092 1.00 33.66 C ATOM 226 C TYR A 794 11.288 -17.442 26.422 1.00 32.36 C ATOM 227 O TYR A 794 12.460 -17.155 26.228 1.00 33.55 O ATOM 228 CB TYR A 794 9.685 -15.735 27.373 1.00 35.18 C ATOM 229 CG TYR A 794 10.722 -15.151 28.309 1.00 34.34 C ATOM 230 CD1 TYR A 794 11.231 -13.872 28.129 1.00 35.10 C ATOM 231 CD2 TYR A 794 11.187 -15.882 29.394 1.00 37.47 C ATOM 232 CE1 TYR A 794 12.190 -13.348 28.990 1.00 33.71 C ATOM 233 CE2 TYR A 794 12.163 -15.379 30.249 1.00 37.12 C ATOM 234 CZ TYR A 794 12.657 -14.105 30.055 1.00 35.43 C ATOM 235 OH TYR A 794 13.584 -13.598 30.924 1.00 34.07 O ATOM 236 HH TYR A 794 14.389 -14.174 30.919 1.00 0.00 H ATOM 237 H TYR A 794 8.172 -16.970 25.662 1.00 0.00 H ATOM 238 N GLU A 795 10.875 -18.633 26.879 1.00 34.44 N ATOM 239 CA GLU A 795 11.810 -19.647 27.353 1.00 37.60 C ATOM 240 C GLU A 795 12.675 -20.160 26.190 1.00 39.04 C ATOM 241 O GLU A 795 13.861 -20.450 26.409 1.00 38.87 O ATOM 242 CB GLU A 795 11.118 -20.747 28.164 1.00 44.59 C ATOM 243 CG GLU A 795 10.658 -20.235 29.528 1.00 49.43 C ATOM 244 CD GLU A 795 10.495 -21.248 30.652 1.00 61.76 C ATOM 245 OE1 GLU A 795 9.955 -22.350 30.398 1.00 66.73 O ATOM 246 OE2 GLU A 795 10.900 -20.920 31.794 1.00 67.51 O ATOM 247 H GLU A 795 9.856 -18.840 26.896 1.00 0.00 H ATOM 248 N LYS A 796 12.141 -20.156 24.960 1.00 38.91 N ATOM 249 CA LYS A 796 12.915 -20.574 23.772 1.00 41.78 C ATOM 250 C LYS A 796 14.120 -19.669 23.522 1.00 38.46 C ATOM 251 O LYS A 796 15.061 -20.088 22.830 1.00 39.94 O ATOM 252 CB LYS A 796 12.051 -20.563 22.506 1.00 42.72 C ATOM 253 CG LYS A 796 10.944 -21.600 22.474 1.00 46.76 C ATOM 254 CD LYS A 796 10.070 -21.489 21.245 1.00 52.58 C ATOM 255 CE LYS A 796 8.877 -22.421 21.302 1.00 56.98 C ATOM 256 NZ LYS A 796 7.760 -21.953 20.444 1.00 62.21 N ATOM 257 HZ1 LYS A 796 7.452 -21.012 20.761 1.00 0.00 H ATOM 258 HZ2 LYS A 796 8.082 -21.899 19.457 1.00 0.00 H ATOM 259 HZ3 LYS A 796 6.966 -22.621 20.515 1.00 0.00 H ATOM 260 H LYS A 796 11.154 -19.850 24.838 1.00 0.00 H ATOM 261 N LEU A 797 14.107 -18.419 24.029 1.00 35.64 N ATOM 262 CA LEU A 797 15.178 -17.510 23.784 1.00 33.29 C ATOM 263 C LEU A 797 16.391 -17.810 24.676 1.00 33.05 C ATOM 264 O LEU A 797 17.483 -17.286 24.376 1.00 32.26 O ATOM 265 CB LEU A 797 14.713 -16.069 23.994 1.00 34.53 C ATOM 266 CG LEU A 797 13.576 -15.610 23.084 1.00 35.18 C ATOM 267 CD1 LEU A 797 13.127 -14.209 23.474 1.00 37.36 C ATOM 268 CD2 LEU A 797 14.024 -15.645 21.621 1.00 38.73 C ATOM 269 H LEU A 797 13.300 -18.112 24.610 1.00 0.00 H ATOM 270 N LYS A 798 16.202 -18.567 25.768 1.00 34.48 N ATOM 271 CA LYS A 798 17.312 -18.964 26.680 1.00 36.38 C ATOM 272 C LYS A 798 18.101 -17.719 27.122 1.00 32.74 C ATOM 273 O LYS A 798 19.343 -17.735 27.143 1.00 31.72 O ATOM 274 CB LYS A 798 18.241 -19.969 25.982 1.00 42.24 C ATOM 275 CG LYS A 798 17.566 -21.219 25.423 1.00 51.77 C ATOM 276 CD LYS A 798 17.087 -22.186 26.483 1.00 63.37 C ATOM 277 CE LYS A 798 16.984 -23.615 25.978 1.00 71.24 C ATOM 278 NZ LYS A 798 16.884 -24.583 27.094 1.00 77.12 N ATOM 279 HZ1 LYS A 798 17.730 -24.507 27.694 1.00 0.00 H ATOM 280 HZ2 LYS A 798 16.037 -24.372 27.659 1.00 0.00 H ATOM 281 HZ3 LYS A 798 16.815 -25.547 26.710 1.00 0.00 H ATOM 282 H LYS A 798 15.238 -18.891 25.988 1.00 0.00 H ATOM 283 N THR A 799 17.370 -16.628 27.390 1.00 31.23 N ATOM 284 CA THR A 799 17.927 -15.297 27.686 1.00 30.22 C ATOM 285 C THR A 799 17.109 -14.636 28.808 1.00 31.75 C ATOM 286 O THR A 799 15.890 -14.513 28.739 1.00 34.54 O ATOM 287 CB THR A 799 17.944 -14.386 26.442 1.00 31.94 C ATOM 288 OG1 THR A 799 18.708 -14.962 25.383 1.00 34.61 O ATOM 289 CG2 THR A 799 18.547 -13.031 26.719 1.00 29.87 C ATOM 290 HG1 THR A 799 18.313 -15.833 25.129 1.00 0.00 H ATOM 291 H THR A 799 16.335 -16.729 27.389 1.00 0.00 H ATOM 292 N ASP A 800 17.799 -14.159 29.842 1.00 30.60 N ATOM 293 CA ASP A 800 17.160 -13.354 30.863 1.00 30.60 C ATOM 294 C ASP A 800 16.985 -11.939 30.315 1.00 29.78 C ATOM 295 O ASP A 800 17.937 -11.382 29.791 1.00 30.07 O ATOM 296 CB ASP A 800 17.968 -13.338 32.162 1.00 33.75 C ATOM 297 CG ASP A 800 17.249 -12.582 33.265 1.00 41.32 C ATOM 298 OD1 ASP A 800 16.197 -13.067 33.711 1.00 43.25 O ATOM 299 OD2 ASP A 800 17.715 -11.476 33.621 1.00 50.81 O ATOM 300 H ASP A 800 18.815 -14.368 29.918 1.00 0.00 H ATOM 301 N ILE A 801 15.755 -11.401 30.376 1.00 28.74 N ATOM 302 CA ILE A 801 15.440 -10.106 29.808 1.00 28.78 C ATOM 303 C ILE A 801 14.848 -9.229 30.906 1.00 31.41 C ATOM 304 O ILE A 801 13.834 -9.580 31.513 1.00 35.61 O ATOM 305 CB ILE A 801 14.489 -10.205 28.591 1.00 29.64 C ATOM 306 CG1 ILE A 801 15.040 -11.149 27.517 1.00 31.49 C ATOM 307 CG2 ILE A 801 14.231 -8.816 28.019 1.00 31.02 C ATOM 308 CD1 ILE A 801 14.163 -11.297 26.308 1.00 33.09 C ATOM 309 H ILE A 801 14.999 -11.936 30.850 1.00 0.00 H ATOM 310 N LYS A 802 15.500 -8.087 31.176 1.00 28.85 N ATOM 311 CA LYS A 802 15.047 -7.175 32.212 1.00 33.03 C ATOM 312 C LYS A 802 14.818 -5.790 31.593 1.00 31.88 C ATOM 313 O LYS A 802 15.626 -5.314 30.795 1.00 33.04 O ATOM 314 CB LYS A 802 16.069 -7.108 33.351 1.00 35.54 C ATOM 315 CG LYS A 802 16.110 -8.336 34.254 1.00 38.58 C ATOM 316 CD LYS A 802 14.826 -8.570 35.031 1.00 44.03 C ATOM 317 CE LYS A 802 14.719 -9.978 35.572 1.00 45.51 C ATOM 318 NZ LYS A 802 14.733 -10.961 34.463 1.00 44.34 N ATOM 319 HZ1 LYS A 802 13.928 -10.779 33.830 1.00 0.00 H ATOM 320 HZ2 LYS A 802 15.622 -10.869 33.931 1.00 0.00 H ATOM 321 HZ3 LYS A 802 14.659 -11.922 34.853 1.00 0.00 H ATOM 322 H LYS A 802 16.352 -7.849 30.629 1.00 0.00 H ATOM 323 N VAL A 803 13.708 -5.156 31.989 1.00 31.17 N ATOM 324 CA VAL A 803 13.456 -3.772 31.577 1.00 33.34 C ATOM 325 C VAL A 803 14.379 -2.837 32.360 1.00 33.31 C ATOM 326 O VAL A 803 14.430 -2.909 33.570 1.00 34.98 O ATOM 327 CB VAL A 803 11.989 -3.382 31.829 1.00 40.02 C ATOM 328 CG1 VAL A 803 11.761 -1.909 31.519 1.00 44.11 C ATOM 329 CG2 VAL A 803 11.045 -4.267 31.053 1.00 39.69 C ATOM 330 H VAL A 803 13.020 -5.649 32.593 1.00 0.00 H ATOM 331 N VAL A 804 15.093 -1.953 31.654 1.00 32.52 N ATOM 332 CA VAL A 804 15.896 -0.932 32.269 1.00 34.62 C ATOM 333 C VAL A 804 15.003 0.266 32.615 1.00 37.21 C ATOM 334 O VAL A 804 14.260 0.742 31.765 1.00 41.14 O ATOM 335 CB VAL A 804 17.053 -0.543 31.337 1.00 33.62 C ATOM 336 CG1 VAL A 804 17.843 0.629 31.876 1.00 34.46 C ATOM 337 CG2 VAL A 804 17.971 -1.740 31.081 1.00 35.45 C ATOM 338 H VAL A 804 15.066 -2.007 30.616 1.00 0.00 H ATOM 339 N ASP A 805 15.106 0.714 33.874 1.00 37.39 N ATOM 340 CA ASP A 805 14.439 1.905 34.427 1.00 43.59 C ATOM 341 C ASP A 805 14.831 3.125 33.579 1.00 42.54 C ATOM 342 O ASP A 805 16.016 3.396 33.349 1.00 39.13 O ATOM 343 CB ASP A 805 14.799 2.128 35.906 1.00 45.99 C ATOM 344 CG ASP A 805 14.479 0.995 36.895 1.00 56.47 C ATOM 345 OD1 ASP A 805 13.432 0.317 36.737 1.00 53.54 O ATOM 346 OD2 ASP A 805 15.268 0.814 37.861 1.00 56.77 O ATOM 347 H ASP A 805 15.713 0.170 34.520 1.00 0.00 H ATOM 348 N ARG A 806 13.830 3.864 33.112 1.00 45.69 N ATOM 349 CA ARG A 806 14.074 5.058 32.309 1.00 46.56 C ATOM 350 C ARG A 806 14.941 6.072 33.080 1.00 45.96 C ATOM 351 O ARG A 806 15.683 6.815 32.466 1.00 47.75 O ATOM 352 CB ARG A 806 12.735 5.650 31.861 1.00 51.63 C ATOM 353 CG ARG A 806 12.839 6.999 31.159 1.00 62.99 C ATOM 354 CD ARG A 806 11.815 8.020 31.645 1.00 72.55 C ATOM 355 NE ARG A 806 12.427 9.295 32.018 1.00 84.00 N ATOM 356 CZ ARG A 806 12.678 9.694 33.268 1.00 83.70 C ATOM 357 NH1 ARG A 806 12.403 8.912 34.296 1.00 74.05 N ATOM 358 NH2 ARG A 806 13.204 10.885 33.488 1.00 92.76 N ATOM 359 HE ARG A 806 12.688 9.943 31.248 1.00 0.00 H ATOM 360 HH12 ARG A 806 12.604 9.236 35.264 1.00 0.00 H ATOM 361 HH11 ARG A 806 11.986 7.973 34.138 1.00 0.00 H ATOM 362 HH22 ARG A 806 13.399 11.195 34.461 1.00 0.00 H ATOM 363 HH21 ARG A 806 13.423 11.513 32.688 1.00 0.00 H ATOM 364 H ARG A 806 12.851 3.585 33.324 1.00 0.00 H ATOM 365 N ASP A 807 14.854 6.107 34.415 1.00 46.35 N ATOM 366 CA ASP A 807 15.461 7.166 35.221 1.00 51.61 C ATOM 367 C ASP A 807 16.915 6.838 35.609 1.00 52.48 C ATOM 368 O ASP A 807 17.578 7.664 36.261 1.00 61.39 O ATOM 369 CB ASP A 807 14.539 7.459 36.419 1.00 57.48 C ATOM 370 CG ASP A 807 15.178 8.002 37.687 1.00 68.52 C ATOM 371 OD1 ASP A 807 16.285 8.568 37.587 1.00 72.25 O ATOM 372 OD2 ASP A 807 14.528 7.887 38.776 1.00 61.84 O ATOM 373 H ASP A 807 14.333 5.349 34.900 1.00 0.00 H ATOM 374 N SER A 808 17.445 5.698 35.156 1.00 43.97 N ATOM 375 CA SER A 808 18.682 5.153 35.659 1.00 44.36 C ATOM 376 C SER A 808 19.863 5.791 34.920 1.00 46.22 C ATOM 377 O SER A 808 19.686 6.293 33.823 1.00 41.80 O ATOM 378 CB SER A 808 18.706 3.648 35.494 1.00 41.33 C ATOM 379 OG SER A 808 18.721 3.273 34.116 1.00 39.53 O ATOM 380 HG SER A 808 17.910 3.625 33.671 1.00 0.00 H ATOM 381 H SER A 808 16.943 5.180 34.407 1.00 0.00 H ATOM 382 N GLU A 809 21.055 5.674 35.518 1.00 51.15 N ATOM 383 CA GLU A 809 22.338 6.033 34.889 1.00 52.95 C ATOM 384 C GLU A 809 22.509 5.303 33.547 1.00 48.90 C ATOM 385 O GLU A 809 22.887 5.933 32.551 1.00 41.98 O ATOM 386 CB GLU A 809 23.515 5.663 35.798 1.00 64.30 C ATOM 387 CG GLU A 809 23.578 6.440 37.104 1.00 72.96 C ATOM 388 CD GLU A 809 24.524 7.631 37.114 1.00 84.16 C ATOM 389 OE1 GLU A 809 25.294 7.786 36.142 1.00 89.30 O ATOM 390 OE2 GLU A 809 24.487 8.403 38.096 1.00 90.33 O ATOM 391 H GLU A 809 21.077 5.306 36.490 1.00 0.00 H ATOM 392 N GLU A 810 22.301 3.975 33.536 1.00 41.10 N ATOM 393 CA GLU A 810 22.378 3.160 32.323 1.00 43.06 C ATOM 394 C GLU A 810 21.497 3.714 31.193 1.00 38.61 C ATOM 395 O GLU A 810 21.931 3.807 30.071 1.00 36.01 O ATOM 396 CB GLU A 810 21.875 1.738 32.555 1.00 44.89 C ATOM 397 CG GLU A 810 22.862 0.839 33.235 1.00 51.64 C ATOM 398 CD GLU A 810 22.200 -0.478 33.604 1.00 47.85 C ATOM 399 OE1 GLU A 810 21.270 -0.460 34.428 1.00 51.42 O ATOM 400 OE2 GLU A 810 22.600 -1.500 33.047 1.00 42.24 O ATOM 401 H GLU A 810 22.074 3.503 34.435 1.00 0.00 H ATOM 402 N ALA A 811 20.221 3.982 31.481 1.00 36.98 N ATOM 403 CA ALA A 811 19.317 4.486 30.440 1.00 36.39 C ATOM 404 C ALA A 811 19.794 5.848 29.899 1.00 36.38 C ATOM 405 O ALA A 811 19.744 6.074 28.668 1.00 35.66 O ATOM 406 CB ALA A 811 17.916 4.566 30.954 1.00 35.03 C ATOM 407 H ALA A 811 19.866 3.833 32.447 1.00 0.00 H ATOM 408 N GLU A 812 20.263 6.737 30.793 1.00 38.31 N ATOM 409 CA GLU A 812 20.751 8.087 30.400 1.00 40.88 C ATOM 410 C GLU A 812 21.935 7.955 29.424 1.00 37.41 C ATOM 411 O GLU A 812 21.993 8.656 28.382 1.00 37.21 O ATOM 412 CB GLU A 812 21.182 8.888 31.635 1.00 45.35 C ATOM 413 CG GLU A 812 20.063 9.208 32.620 1.00 57.20 C ATOM 414 CD GLU A 812 20.500 9.894 33.914 1.00 66.07 C ATOM 415 OE1 GLU A 812 21.700 10.252 34.033 1.00 72.24 O ATOM 416 OE2 GLU A 812 19.639 10.079 34.806 1.00 68.12 O ATOM 417 H GLU A 812 20.285 6.471 31.798 1.00 0.00 H ATOM 418 N ILE A 813 22.880 7.055 29.740 1.00 35.55 N ATOM 419 CA ILE A 813 24.056 6.795 28.904 1.00 35.02 C ATOM 420 C ILE A 813 23.630 6.285 27.518 1.00 34.23 C ATOM 421 O ILE A 813 24.175 6.701 26.477 1.00 33.52 O ATOM 422 CB ILE A 813 25.008 5.818 29.633 1.00 36.06 C ATOM 423 CG1 ILE A 813 25.702 6.541 30.798 1.00 43.69 C ATOM 424 CG2 ILE A 813 25.990 5.167 28.667 1.00 35.92 C ATOM 425 CD1 ILE A 813 26.396 5.636 31.800 1.00 43.84 C ATOM 426 H ILE A 813 22.772 6.515 30.622 1.00 0.00 H ATOM 427 N ILE A 814 22.730 5.291 27.499 1.00 33.34 N ATOM 428 CA ILE A 814 22.300 4.681 26.269 1.00 29.62 C ATOM 429 C ILE A 814 21.534 5.711 25.414 1.00 32.61 C ATOM 430 O ILE A 814 21.750 5.769 24.214 1.00 32.35 O ATOM 431 CB ILE A 814 21.480 3.409 26.566 1.00 30.88 C ATOM 432 CG1 ILE A 814 22.391 2.323 27.140 1.00 31.47 C ATOM 433 CG2 ILE A 814 20.753 2.921 25.321 1.00 32.45 C ATOM 434 CD1 ILE A 814 21.639 1.150 27.736 1.00 33.35 C ATOM 435 H ILE A 814 22.332 4.952 28.398 1.00 0.00 H ATOM 436 N ARG A 815 20.633 6.491 26.013 1.00 31.39 N ATOM 437 CA ARG A 815 19.928 7.536 25.240 1.00 34.88 C ATOM 438 C ARG A 815 20.944 8.516 24.633 1.00 36.95 C ATOM 439 O ARG A 815 20.743 8.972 23.498 1.00 37.32 O ATOM 440 CB ARG A 815 18.891 8.301 26.072 1.00 40.63 C ATOM 441 CG ARG A 815 17.628 7.504 26.372 1.00 44.22 C ATOM 442 CD ARG A 815 16.564 8.384 26.988 1.00 46.71 C ATOM 443 NE ARG A 815 16.967 8.925 28.278 1.00 47.15 N ATOM 444 CZ ARG A 815 16.652 8.395 29.455 1.00 53.05 C ATOM 445 NH1 ARG A 815 15.945 7.276 29.510 1.00 48.20 N ATOM 446 NH2 ARG A 815 17.024 9.000 30.570 1.00 57.26 N ATOM 447 HE ARG A 815 17.544 9.790 28.278 1.00 0.00 H ATOM 448 HH12 ARG A 815 15.699 6.861 30.431 1.00 0.00 H ATOM 449 HH11 ARG A 815 15.636 6.812 28.632 1.00 0.00 H ATOM 450 HH22 ARG A 815 16.779 8.587 31.492 1.00 0.00 H ATOM 451 HH21 ARG A 815 17.562 9.889 30.525 1.00 0.00 H ATOM 452 H ARG A 815 20.426 6.364 27.024 1.00 0.00 H ATOM 453 N LYS A 816 21.974 8.901 25.401 1.00 36.86 N ATOM 454 CA LYS A 816 22.996 9.870 24.898 1.00 37.05 C ATOM 455 C LYS A 816 23.762 9.253 23.716 1.00 35.88 C ATOM 456 O LYS A 816 24.094 9.931 22.750 1.00 35.47 O ATOM 457 CB LYS A 816 23.992 10.264 25.993 1.00 39.59 C ATOM 458 CG LYS A 816 24.957 11.372 25.590 1.00 48.38 C ATOM 459 CD LYS A 816 25.574 12.081 26.764 1.00 55.85 C ATOM 460 CE LYS A 816 26.249 13.376 26.368 1.00 61.88 C ATOM 461 NZ LYS A 816 26.685 14.132 27.562 1.00 66.24 N ATOM 462 HZ1 LYS A 816 25.858 14.353 28.152 1.00 0.00 H ATOM 463 HZ2 LYS A 816 27.358 13.557 28.108 1.00 0.00 H ATOM 464 HZ3 LYS A 816 27.145 15.016 27.263 1.00 0.00 H ATOM 465 H LYS A 816 22.064 8.519 26.364 1.00 0.00 H ATOM 466 N TYR A 817 24.061 7.963 23.816 1.00 31.56 N ATOM 467 CA TYR A 817 24.793 7.231 22.759 1.00 29.84 C ATOM 468 C TYR A 817 23.968 7.269 21.465 1.00 30.41 C ATOM 469 O TYR A 817 24.499 7.522 20.376 1.00 31.71 O ATOM 470 CB TYR A 817 25.120 5.817 23.250 1.00 28.29 C ATOM 471 CG TYR A 817 26.154 4.987 22.509 1.00 27.36 C ATOM 472 CD1 TYR A 817 26.956 5.470 21.479 1.00 27.41 C ATOM 473 CD2 TYR A 817 26.349 3.668 22.887 1.00 25.99 C ATOM 474 CE1 TYR A 817 27.887 4.666 20.839 1.00 25.82 C ATOM 475 CE2 TYR A 817 27.319 2.869 22.297 1.00 25.83 C ATOM 476 CZ TYR A 817 28.068 3.354 21.243 1.00 26.32 C ATOM 477 OH TYR A 817 29.003 2.550 20.643 1.00 26.02 O ATOM 478 HH TYR A 817 29.678 2.275 21.313 1.00 0.00 H ATOM 479 H TYR A 817 23.769 7.447 24.671 1.00 0.00 H ATOM 480 N VAL A 818 22.664 7.030 21.592 1.00 29.34 N ATOM 481 CA VAL A 818 21.751 7.112 20.434 1.00 32.83 C ATOM 482 C VAL A 818 21.713 8.543 19.874 1.00 35.80 C ATOM 483 O VAL A 818 21.821 8.743 18.659 1.00 38.32 O ATOM 484 CB VAL A 818 20.332 6.639 20.777 1.00 31.23 C ATOM 485 CG1 VAL A 818 19.395 6.847 19.595 1.00 33.81 C ATOM 486 CG2 VAL A 818 20.311 5.184 21.226 1.00 32.22 C ATOM 487 H VAL A 818 22.281 6.780 22.526 1.00 0.00 H ATOM 488 N LYS A 819 21.527 9.537 20.751 1.00 35.16 N ATOM 489 CA LYS A 819 21.394 10.920 20.317 1.00 37.67 C ATOM 490 C LYS A 819 22.681 11.384 19.621 1.00 39.10 C ATOM 491 O LYS A 819 22.618 11.998 18.558 1.00 41.21 O ATOM 492 CB LYS A 819 21.065 11.829 21.505 1.00 40.90 C ATOM 493 CG LYS A 819 20.946 13.311 21.166 1.00 47.54 C ATOM 494 CD LYS A 819 20.669 14.194 22.371 1.00 54.91 C ATOM 495 CE LYS A 819 20.800 15.667 22.056 1.00 64.39 C ATOM 496 NZ LYS A 819 19.839 16.061 20.999 1.00 71.42 N ATOM 497 HZ1 LYS A 819 20.030 15.513 20.136 1.00 0.00 H ATOM 498 HZ2 LYS A 819 18.870 15.870 21.325 1.00 0.00 H ATOM 499 HZ3 LYS A 819 19.945 17.076 20.797 1.00 0.00 H ATOM 500 H LYS A 819 21.476 9.316 21.766 1.00 0.00 H ATOM 501 N ASN A 820 23.853 11.073 20.188 1.00 35.51 N ATOM 502 CA ASN A 820 25.100 11.730 19.755 1.00 36.11 C ATOM 503 C ASN A 820 25.708 11.089 18.497 1.00 34.00 C ATOM 504 O ASN A 820 26.472 11.748 17.804 1.00 36.18 O ATOM 505 CB ASN A 820 26.151 11.753 20.864 1.00 36.74 C ATOM 506 CG ASN A 820 25.888 12.788 21.929 1.00 39.99 C ATOM 507 OD1 ASN A 820 24.944 13.571 21.834 1.00 43.12 O ATOM 508 ND2 ASN A 820 26.726 12.797 22.952 1.00 44.53 N ATOM 509 HD22 ASN A 820 27.510 12.115 22.988 1.00 0.00 H ATOM 510 HD21 ASN A 820 26.601 13.486 23.720 1.00 0.00 H ATOM 511 H ASN A 820 23.884 10.359 20.943 1.00 0.00 H ATOM 512 N THR A 821 25.424 9.803 18.228 1.00 32.56 N ATOM 513 CA THR A 821 26.155 9.057 17.199 1.00 34.64 C ATOM 514 C THR A 821 25.284 8.729 15.978 1.00 34.07 C ATOM 515 O THR A 821 25.609 7.821 15.188 1.00 33.22 O ATOM 516 CB THR A 821 26.808 7.797 17.773 1.00 31.03 C ATOM 517 OG1 THR A 821 25.823 6.811 18.073 1.00 30.67 O ATOM 518 CG2 THR A 821 27.688 8.110 18.965 1.00 31.98 C ATOM 519 HG1 THR A 821 25.187 7.174 18.739 1.00 0.00 H ATOM 520 H THR A 821 24.669 9.327 18.762 1.00 0.00 H ATOM 521 N HIS A 822 24.208 9.482 15.790 1.00 33.49 N ATOM 522 CA HIS A 822 23.458 9.392 14.539 1.00 37.58 C ATOM 523 C HIS A 822 24.197 10.168 13.449 1.00 38.44 C ATOM 524 O HIS A 822 24.369 11.376 13.572 1.00 40.33 O ATOM 525 CB HIS A 822 22.040 9.903 14.740 1.00 39.62 C ATOM 526 CG HIS A 822 21.123 9.582 13.608 1.00 41.00 C ATOM 527 ND1 HIS A 822 19.870 9.063 13.815 1.00 42.82 N ATOM 528 CD2 HIS A 822 21.276 9.698 12.271 1.00 41.41 C ATOM 529 CE1 HIS A 822 19.279 8.882 12.648 1.00 48.74 C ATOM 530 NE2 HIS A 822 20.123 9.260 11.676 1.00 43.76 N ATOM 531 H HIS A 822 23.897 10.138 16.535 1.00 0.00 H ATOM 532 N ALA A 823 24.575 9.478 12.365 1.00 36.61 N ATOM 533 CA ALA A 823 25.442 10.047 11.312 1.00 39.10 C ATOM 534 C ALA A 823 24.693 11.088 10.477 1.00 41.96 C ATOM 535 O ALA A 823 23.516 10.915 10.171 1.00 42.09 O ATOM 536 CB ALA A 823 25.972 8.946 10.428 1.00 39.93 C ATOM 537 H ALA A 823 24.244 8.498 12.260 1.00 0.00 H ATOM 538 N THR A 824 25.396 12.156 10.073 1.00 43.47 N ATOM 539 CA THR A 824 24.754 13.250 9.312 1.00 48.46 C ATOM 540 C THR A 824 24.254 12.752 7.949 1.00 47.22 C ATOM 541 O THR A 824 23.334 13.357 7.381 1.00 49.57 O ATOM 542 CB THR A 824 25.682 14.456 9.103 1.00 54.68 C ATOM 543 OG1 THR A 824 26.817 14.020 8.359 1.00 51.80 O ATOM 544 CG2 THR A 824 26.106 15.115 10.397 1.00 59.37 C ATOM 545 HG1 THR A 824 27.429 14.785 8.214 1.00 0.00 H ATOM 546 H THR A 824 26.409 12.216 10.298 1.00 0.00 H ATOM 547 N THR A 825 24.881 11.706 7.392 1.00 42.69 N ATOM 548 CA THR A 825 24.508 11.186 6.059 1.00 46.68 C ATOM 549 C THR A 825 23.337 10.192 6.137 1.00 45.26 C ATOM 550 O THR A 825 22.808 9.816 5.106 1.00 50.76 O ATOM 551 CB THR A 825 25.704 10.578 5.314 1.00 46.52 C ATOM 552 OG1 THR A 825 26.157 9.416 6.016 1.00 43.89 O ATOM 553 CG2 THR A 825 26.840 11.565 5.139 1.00 48.90 C ATOM 554 HG1 THR A 825 26.431 9.672 6.932 1.00 0.00 H ATOM 555 H THR A 825 25.654 11.246 7.914 1.00 0.00 H ATOM 556 N HIS A 826 22.934 9.763 7.342 1.00 43.13 N ATOM 557 CA HIS A 826 21.770 8.872 7.516 1.00 41.97 C ATOM 558 C HIS A 826 20.549 9.716 7.873 1.00 43.56 C ATOM 559 O HIS A 826 19.933 9.528 8.908 1.00 45.46 O ATOM 560 CB HIS A 826 22.090 7.769 8.542 1.00 39.61 C ATOM 561 CG HIS A 826 23.270 6.925 8.173 1.00 36.58 C ATOM 562 ND1 HIS A 826 24.119 6.381 9.127 1.00 34.67 N ATOM 563 CD2 HIS A 826 23.780 6.578 6.968 1.00 37.85 C ATOM 564 CE1 HIS A 826 25.078 5.703 8.518 1.00 35.39 C ATOM 565 NE2 HIS A 826 24.908 5.835 7.185 1.00 36.25 N ATOM 566 H HIS A 826 23.461 10.069 8.185 1.00 0.00 H ATOM 567 N ASN A 827 20.189 10.636 6.968 1.00 45.26 N ATOM 568 CA ASN A 827 19.209 11.665 7.266 1.00 48.26 C ATOM 569 C ASN A 827 17.805 11.282 6.760 1.00 51.04 C ATOM 570 O ASN A 827 16.921 12.121 6.778 1.00 57.89 O ATOM 571 CB ASN A 827 19.665 13.019 6.709 1.00 53.11 C ATOM 572 CG ASN A 827 19.702 13.063 5.197 1.00 58.11 C ATOM 573 OD1 ASN A 827 19.765 12.029 4.540 1.00 56.26 O ATOM 574 ND2 ASN A 827 19.669 14.261 4.633 1.00 62.27 N ATOM 575 HD22 ASN A 827 19.616 15.114 5.226 1.00 0.00 H ATOM 576 HD21 ASN A 827 19.697 14.349 3.597 1.00 0.00 H ATOM 577 H ASN A 827 20.625 10.612 6.024 1.00 0.00 H ATOM 578 N ALA A 828 17.572 10.034 6.332 1.00 49.94 N ATOM 579 CA ALA A 828 16.195 9.589 5.933 1.00 53.53 C ATOM 580 C ALA A 828 15.262 9.455 7.148 1.00 52.22 C ATOM 581 O ALA A 828 14.041 9.398 6.976 1.00 52.69 O ATOM 582 CB ALA A 828 16.254 8.277 5.186 1.00 55.16 C ATOM 583 H ALA A 828 18.362 9.360 6.275 1.00 0.00 H ATOM 584 N TYR A 829 15.822 9.342 8.365 1.00 49.58 N ATOM 585 CA TYR A 829 15.003 9.139 9.569 1.00 47.50 C ATOM 586 C TYR A 829 15.704 9.694 10.817 1.00 45.57 C ATOM 587 O TYR A 829 16.900 9.951 10.818 1.00 48.01 O ATOM 588 CB TYR A 829 14.746 7.644 9.771 1.00 47.68 C ATOM 589 CG TYR A 829 16.010 6.838 9.952 1.00 42.64 C ATOM 590 CD1 TYR A 829 16.607 6.698 11.197 1.00 42.18 C ATOM 591 CD2 TYR A 829 16.608 6.203 8.878 1.00 43.09 C ATOM 592 CE1 TYR A 829 17.763 5.958 11.363 1.00 39.66 C ATOM 593 CE2 TYR A 829 17.790 5.497 9.021 1.00 40.33 C ATOM 594 CZ TYR A 829 18.356 5.350 10.271 1.00 39.87 C ATOM 595 OH TYR A 829 19.518 4.647 10.404 1.00 39.16 O ATOM 596 HH TYR A 829 19.379 3.719 10.088 1.00 0.00 H ATOM 597 H TYR A 829 16.856 9.399 8.457 1.00 0.00 H ATOM 598 N ASP A 830 14.939 9.849 11.900 1.00 49.69 N ATOM 599 CA ASP A 830 15.549 9.970 13.214 1.00 52.08 C ATOM 600 C ASP A 830 14.996 8.847 14.102 1.00 42.64 C ATOM 601 O ASP A 830 14.004 8.181 13.763 1.00 47.22 O ATOM 602 CB ASP A 830 15.391 11.378 13.795 1.00 58.90 C ATOM 603 CG ASP A 830 13.964 11.855 13.822 1.00 67.44 C ATOM 604 OD1 ASP A 830 13.220 11.372 14.690 1.00 80.75 O ATOM 605 OD2 ASP A 830 13.610 12.692 12.958 1.00 84.88 O ATOM 606 H ASP A 830 13.904 9.883 11.803 1.00 0.00 H ATOM 607 N LEU A 831 15.653 8.655 15.240 1.00 42.39 N ATOM 608 CA LEU A 831 15.406 7.510 16.114 1.00 40.27 C ATOM 609 C LEU A 831 14.816 7.993 17.436 1.00 44.77 C ATOM 610 O LEU A 831 15.249 8.992 17.996 1.00 46.97 O ATOM 611 CB LEU A 831 16.726 6.782 16.364 1.00 38.97 C ATOM 612 CG LEU A 831 17.309 6.078 15.141 1.00 38.10 C ATOM 613 CD1 LEU A 831 18.686 5.527 15.449 1.00 36.96 C ATOM 614 CD2 LEU A 831 16.383 4.976 14.650 1.00 36.90 C ATOM 615 H LEU A 831 16.374 9.349 15.521 1.00 0.00 H ATOM 616 N GLU A 832 13.825 7.242 17.908 1.00 43.07 N ATOM 617 CA GLU A 832 13.249 7.397 19.219 1.00 48.50 C ATOM 618 C GLU A 832 13.385 6.046 19.935 1.00 42.65 C ATOM 619 O GLU A 832 12.967 5.038 19.400 1.00 43.93 O ATOM 620 CB GLU A 832 11.803 7.839 19.048 1.00 56.32 C ATOM 621 CG GLU A 832 10.987 7.823 20.322 1.00 62.94 C ATOM 622 CD GLU A 832 9.602 8.416 20.142 1.00 67.83 C ATOM 623 OE1 GLU A 832 9.344 9.014 19.071 1.00 70.23 O ATOM 624 OE2 GLU A 832 8.785 8.261 21.060 1.00 73.64 O ATOM 625 H GLU A 832 13.442 6.496 17.292 1.00 0.00 H ATOM 626 N VAL A 833 13.979 6.053 21.128 1.00 39.73 N ATOM 627 CA VAL A 833 14.071 4.844 21.954 1.00 40.69 C ATOM 628 C VAL A 833 12.718 4.630 22.651 1.00 41.37 C ATOM 629 O VAL A 833 12.247 5.513 23.350 1.00 43.41 O ATOM 630 CB VAL A 833 15.231 4.937 22.967 1.00 39.41 C ATOM 631 CG1 VAL A 833 15.335 3.654 23.783 1.00 39.97 C ATOM 632 CG2 VAL A 833 16.563 5.250 22.298 1.00 40.99 C ATOM 633 H VAL A 833 14.389 6.940 21.483 1.00 0.00 H ATOM 634 N ILE A 834 12.084 3.470 22.414 1.00 39.32 N ATOM 635 CA ILE A 834 10.827 3.105 23.055 1.00 40.06 C ATOM 636 C ILE A 834 11.093 2.363 24.374 1.00 39.09 C ATOM 637 O ILE A 834 10.521 2.714 25.407 1.00 42.82 O ATOM 638 CB ILE A 834 9.938 2.261 22.117 1.00 41.83 C ATOM 639 CG1 ILE A 834 9.697 2.978 20.787 1.00 47.47 C ATOM 640 CG2 ILE A 834 8.636 1.864 22.817 1.00 42.83 C ATOM 641 CD1 ILE A 834 8.858 2.195 19.800 1.00 55.58 C ATOM 642 H ILE A 834 12.510 2.801 21.742 1.00 0.00 H ATOM 643 N ASP A 835 11.917 1.313 24.323 1.00 38.58 N ATOM 644 CA ASP A 835 12.226 0.501 25.511 1.00 39.37 C ATOM 645 C ASP A 835 13.697 0.099 25.433 1.00 35.84 C ATOM 646 O ASP A 835 14.228 -0.095 24.328 1.00 32.84 O ATOM 647 CB ASP A 835 11.387 -0.786 25.612 1.00 40.75 C ATOM 648 CG ASP A 835 9.886 -0.618 25.781 1.00 50.06 C ATOM 649 OD1 ASP A 835 9.455 -0.003 26.789 1.00 46.74 O ATOM 650 OD2 ASP A 835 9.147 -1.178 24.935 1.00 49.00 O ATOM 651 H ASP A 835 12.355 1.061 23.414 1.00 0.00 H ATOM 652 N ILE A 836 14.344 0.019 26.598 1.00 33.09 N ATOM 653 CA ILE A 836 15.682 -0.524 26.749 1.00 30.82 C ATOM 654 C ILE A 836 15.586 -1.765 27.637 1.00 28.89 C ATOM 655 O ILE A 836 15.037 -1.700 28.723 1.00 31.00 O ATOM 656 CB ILE A 836 16.630 0.497 27.406 1.00 31.36 C ATOM 657 CG1 ILE A 836 16.681 1.829 26.647 1.00 35.71 C ATOM 658 CG2 ILE A 836 18.004 -0.131 27.585 1.00 32.18 C ATOM 659 CD1 ILE A 836 17.343 2.960 27.404 1.00 38.19 C ATOM 660 H ILE A 836 13.860 0.367 27.450 1.00 0.00 H ATOM 661 N PHE A 837 16.150 -2.880 27.167 1.00 27.43 N ATOM 662 CA PHE A 837 16.230 -4.121 27.937 1.00 27.63 C ATOM 663 C PHE A 837 17.689 -4.456 28.226 1.00 27.28 C ATOM 664 O PHE A 837 18.537 -4.275 27.351 1.00 27.38 O ATOM 665 CB PHE A 837 15.603 -5.267 27.147 1.00 28.83 C ATOM 666 CG PHE A 837 14.176 -4.982 26.765 1.00 27.63 C ATOM 667 CD1 PHE A 837 13.139 -5.269 27.629 1.00 31.91 C ATOM 668 CD2 PHE A 837 13.882 -4.411 25.535 1.00 32.20 C ATOM 669 CE1 PHE A 837 11.831 -4.999 27.277 1.00 34.01 C ATOM 670 CE2 PHE A 837 12.568 -4.140 25.186 1.00 34.21 C ATOM 671 CZ PHE A 837 11.550 -4.428 26.056 1.00 35.89 C ATOM 672 H PHE A 837 16.552 -2.866 26.208 1.00 0.00 H ATOM 673 N LYS A 838 17.952 -5.019 29.412 1.00 27.72 N ATOM 674 CA LYS A 838 19.238 -5.616 29.714 1.00 28.18 C ATOM 675 C LYS A 838 19.103 -7.135 29.535 1.00 28.14 C ATOM 676 O LYS A 838 18.129 -7.716 30.007 1.00 28.03 O ATOM 677 CB LYS A 838 19.706 -5.246 31.122 1.00 30.88 C ATOM 678 CG LYS A 838 21.173 -5.557 31.384 1.00 36.19 C ATOM 679 CD LYS A 838 21.741 -4.804 32.576 1.00 42.58 C ATOM 680 CE LYS A 838 23.217 -5.092 32.784 1.00 46.48 C ATOM 681 NZ LYS A 838 23.709 -4.424 34.012 1.00 48.95 N ATOM 682 HZ1 LYS A 838 23.574 -3.397 33.924 1.00 0.00 H ATOM 683 HZ2 LYS A 838 23.177 -4.776 34.833 1.00 0.00 H ATOM 684 HZ3 LYS A 838 24.720 -4.633 34.137 1.00 0.00 H ATOM 685 H LYS A 838 17.210 -5.028 30.140 1.00 0.00 H ATOM 686 N ILE A 839 20.079 -7.757 28.861 1.00 25.21 N ATOM 687 CA ILE A 839 19.980 -9.158 28.490 1.00 25.77 C ATOM 688 C ILE A 839 21.180 -9.958 28.978 1.00 27.99 C ATOM 689 O ILE A 839 22.287 -9.462 29.044 1.00 27.62 O ATOM 690 CB ILE A 839 19.725 -9.331 26.983 1.00 28.63 C ATOM 691 CG1 ILE A 839 20.773 -8.634 26.120 1.00 28.31 C ATOM 692 CG2 ILE A 839 18.308 -8.871 26.623 1.00 30.60 C ATOM 693 CD1 ILE A 839 20.719 -9.038 24.652 1.00 31.77 C ATOM 694 H ILE A 839 20.931 -7.222 28.596 1.00 0.00 H ATOM 695 N GLU A 840 20.909 -11.224 29.346 1.00 28.45 N ATOM 696 CA GLU A 840 21.945 -12.156 29.798 1.00 28.34 C ATOM 697 C GLU A 840 21.622 -13.512 29.183 1.00 28.92 C ATOM 698 O GLU A 840 20.704 -14.171 29.642 1.00 31.37 O ATOM 699 CB GLU A 840 21.999 -12.285 31.318 1.00 30.54 C ATOM 700 CG GLU A 840 23.057 -13.271 31.833 1.00 36.26 C ATOM 701 CD GLU A 840 24.503 -12.812 31.769 1.00 41.33 C ATOM 702 OE1 GLU A 840 24.760 -11.643 31.384 1.00 39.14 O ATOM 703 OE2 GLU A 840 25.389 -13.643 32.108 1.00 40.83 O ATOM 704 H GLU A 840 19.924 -11.554 29.308 1.00 0.00 H ATOM 705 N ARG A 841 22.363 -13.886 28.135 1.00 28.61 N ATOM 706 CA ARG A 841 22.122 -15.211 27.528 1.00 28.19 C ATOM 707 C ARG A 841 22.600 -16.327 28.458 1.00 30.31 C ATOM 708 O ARG A 841 23.631 -16.204 29.105 1.00 30.99 O ATOM 709 CB ARG A 841 22.837 -15.286 26.170 1.00 28.84 C ATOM 710 CG ARG A 841 22.309 -14.281 25.147 1.00 29.02 C ATOM 711 CD ARG A 841 23.034 -14.397 23.807 1.00 30.86 C ATOM 712 NE ARG A 841 22.940 -15.767 23.303 1.00 32.18 N ATOM 713 CZ ARG A 841 23.900 -16.677 23.377 1.00 35.99 C ATOM 714 NH1 ARG A 841 25.086 -16.333 23.847 1.00 37.43 N ATOM 715 NH2 ARG A 841 23.650 -17.938 23.053 1.00 35.57 N ATOM 716 HE ARG A 841 22.047 -16.049 22.850 1.00 0.00 H ATOM 717 HH12 ARG A 841 25.846 -17.040 23.909 1.00 0.00 H ATOM 718 HH11 ARG A 841 25.260 -15.355 24.155 1.00 0.00 H ATOM 719 HH22 ARG A 841 24.406 -18.650 23.112 1.00 0.00 H ATOM 720 HH21 ARG A 841 22.698 -18.215 22.740 1.00 0.00 H ATOM 721 H ARG A 841 23.096 -13.255 27.754 1.00 0.00 H ATOM 722 N GLU A 842 21.872 -17.448 28.458 1.00 30.98 N ATOM 723 CA GLU A 842 22.311 -18.665 29.144 1.00 33.09 C ATOM 724 C GLU A 842 23.712 -19.041 28.633 1.00 32.20 C ATOM 725 O GLU A 842 23.970 -19.009 27.437 1.00 33.79 O ATOM 726 CB GLU A 842 21.247 -19.745 28.933 1.00 37.53 C ATOM 727 CG GLU A 842 21.562 -21.083 29.529 1.00 44.76 C ATOM 728 CD GLU A 842 20.499 -22.097 29.114 1.00 52.70 C ATOM 729 OE1 GLU A 842 19.291 -21.792 29.274 1.00 60.96 O ATOM 730 OE2 GLU A 842 20.871 -23.142 28.576 1.00 64.23 O ATOM 731 H GLU A 842 20.963 -17.456 27.954 1.00 0.00 H ATOM 732 N GLY A 843 24.651 -19.264 29.566 1.00 34.77 N ATOM 733 CA GLY A 843 26.010 -19.710 29.226 1.00 35.48 C ATOM 734 C GLY A 843 27.010 -18.601 28.975 1.00 32.90 C ATOM 735 O GLY A 843 28.220 -18.857 28.812 1.00 34.89 O ATOM 736 H GLY A 843 24.408 -19.116 30.566 1.00 0.00 H ATOM 737 N GLU A 844 26.523 -17.358 28.877 1.00 32.72 N ATOM 738 CA GLU A 844 27.346 -16.261 28.471 1.00 31.98 C ATOM 739 C GLU A 844 28.471 -16.034 29.482 1.00 29.30 C ATOM 740 O GLU A 844 29.603 -15.740 29.073 1.00 32.32 O ATOM 741 CB GLU A 844 26.557 -14.957 28.353 1.00 33.63 C ATOM 742 CG GLU A 844 27.284 -13.954 27.483 1.00 33.14 C ATOM 743 CD GLU A 844 27.097 -14.212 26.001 1.00 38.96 C ATOM 744 OE1 GLU A 844 26.034 -13.843 25.452 1.00 38.80 O ATOM 745 OE2 GLU A 844 28.023 -14.756 25.401 1.00 41.79 O ATOM 746 H GLU A 844 25.522 -17.186 29.101 1.00 0.00 H ATOM 747 N CYS A 845 28.157 -16.154 30.771 1.00 30.40 N ATOM 748 CA CYS A 845 29.141 -15.831 31.822 1.00 32.65 C ATOM 749 C CYS A 845 30.400 -16.682 31.608 1.00 33.00 C ATOM 750 O CYS A 845 31.499 -16.168 31.534 1.00 34.46 O ATOM 751 CB CYS A 845 28.552 -15.993 33.209 1.00 35.57 C ATOM 752 SG CYS A 845 29.596 -15.379 34.567 1.00 40.38 S ATOM 753 H CYS A 845 27.207 -16.479 31.040 1.00 0.00 H ATOM 754 N GLN A 846 30.219 -18.003 31.480 1.00 31.76 N ATOM 755 CA GLN A 846 31.359 -18.914 31.249 1.00 35.64 C ATOM 756 C GLN A 846 32.004 -18.724 29.865 1.00 33.38 C ATOM 757 O GLN A 846 33.253 -18.822 29.731 1.00 35.17 O ATOM 758 CB GLN A 846 30.891 -20.362 31.411 1.00 39.74 C ATOM 759 CG GLN A 846 30.523 -20.744 32.833 1.00 48.20 C ATOM 760 CD GLN A 846 31.748 -21.038 33.652 1.00 60.37 C ATOM 761 OE1 GLN A 846 32.860 -20.641 33.300 1.00 68.96 O ATOM 762 NE2 GLN A 846 31.554 -21.757 34.743 1.00 63.17 N ATOM 763 HE22 GLN A 846 30.595 -22.068 34.997 1.00 0.00 H ATOM 764 HE21 GLN A 846 32.361 -22.012 35.348 1.00 0.00 H ATOM 765 H GLN A 846 29.258 -18.395 31.544 1.00 0.00 H ATOM 766 N ARG A 847 31.206 -18.483 28.816 1.00 33.07 N ATOM 767 CA ARG A 847 31.759 -18.430 27.469 1.00 33.86 C ATOM 768 C ARG A 847 32.663 -17.206 27.313 1.00 31.45 C ATOM 769 O ARG A 847 33.724 -17.276 26.655 1.00 33.36 O ATOM 770 CB ARG A 847 30.683 -18.374 26.379 1.00 35.16 C ATOM 771 CG ARG A 847 31.289 -18.413 24.981 1.00 38.63 C ATOM 772 CD ARG A 847 30.277 -18.473 23.854 1.00 37.97 C ATOM 773 NE ARG A 847 29.660 -17.190 23.596 1.00 37.20 N ATOM 774 CZ ARG A 847 28.877 -16.935 22.552 1.00 36.86 C ATOM 775 NH1 ARG A 847 28.668 -17.886 21.651 1.00 34.28 N ATOM 776 NH2 ARG A 847 28.328 -15.739 22.415 1.00 34.57 N ATOM 777 HE ARG A 847 29.840 -16.418 24.270 1.00 0.00 H ATOM 778 HH12 ARG A 847 28.058 -17.699 20.830 1.00 0.00 H ATOM 779 HH11 ARG A 847 29.114 -18.818 21.766 1.00 0.00 H ATOM 780 HH22 ARG A 847 27.715 -15.538 21.599 1.00 0.00 H ATOM 781 HH21 ARG A 847 28.509 -14.999 23.123 1.00 0.00 H ATOM 782 H ARG A 847 30.188 -18.333 28.964 1.00 0.00 H ATOM 783 N TYR A 848 32.234 -16.078 27.904 1.00 31.01 N ATOM 784 CA TYR A 848 32.939 -14.812 27.770 1.00 30.03 C ATOM 785 C TYR A 848 34.147 -14.696 28.723 1.00 33.14 C ATOM 786 O TYR A 848 35.011 -13.859 28.486 1.00 32.54 O ATOM 787 CB TYR A 848 31.951 -13.653 27.952 1.00 29.25 C ATOM 788 CG TYR A 848 32.495 -12.280 27.619 1.00 28.52 C ATOM 789 CD1 TYR A 848 32.852 -11.934 26.329 1.00 30.40 C ATOM 790 CD2 TYR A 848 32.658 -11.322 28.616 1.00 31.13 C ATOM 791 CE1 TYR A 848 33.337 -10.667 26.014 1.00 27.68 C ATOM 792 CE2 TYR A 848 33.139 -10.055 28.315 1.00 31.07 C ATOM 793 CZ TYR A 848 33.514 -9.739 27.025 1.00 30.79 C ATOM 794 OH TYR A 848 34.042 -8.511 26.714 1.00 32.03 O ATOM 795 HH TYR A 848 33.386 -7.804 26.939 1.00 0.00 H ATOM 796 H TYR A 848 31.367 -16.111 28.478 1.00 0.00 H ATOM 797 N LYS A 849 34.225 -15.537 29.762 1.00 33.68 N ATOM 798 CA LYS A 849 35.175 -15.356 30.871 1.00 36.79 C ATOM 799 C LYS A 849 36.607 -15.197 30.359 1.00 40.07 C ATOM 800 O LYS A 849 37.310 -14.324 30.850 1.00 41.79 O ATOM 801 CB LYS A 849 35.060 -16.501 31.888 1.00 41.87 C ATOM 802 CG LYS A 849 35.820 -16.265 33.188 1.00 46.86 C ATOM 803 CD LYS A 849 35.285 -17.079 34.373 1.00 52.46 C ATOM 804 CE LYS A 849 35.354 -18.566 34.125 1.00 52.77 C ATOM 805 NZ LYS A 849 35.455 -19.323 35.395 1.00 53.40 N ATOM 806 HZ1 LYS A 849 36.315 -19.033 35.903 1.00 0.00 H ATOM 807 HZ2 LYS A 849 34.620 -19.125 35.983 1.00 0.00 H ATOM 808 HZ3 LYS A 849 35.500 -20.341 35.188 1.00 0.00 H ATOM 809 H LYS A 849 33.585 -16.356 29.786 1.00 0.00 H ATOM 810 N PRO A 850 37.099 -15.983 29.372 1.00 39.76 N ATOM 811 CA PRO A 850 38.473 -15.827 28.892 1.00 41.79 C ATOM 812 C PRO A 850 38.743 -14.428 28.308 1.00 42.49 C ATOM 813 O PRO A 850 39.879 -13.992 28.283 1.00 50.73 O ATOM 814 CB PRO A 850 38.610 -16.873 27.776 1.00 44.18 C ATOM 815 CG PRO A 850 37.484 -17.858 28.026 1.00 48.40 C ATOM 816 CD PRO A 850 36.374 -17.031 28.636 1.00 43.10 C ATOM 817 N PHE A 851 37.699 -13.753 27.823 1.00 34.27 N ATOM 818 CA PHE A 851 37.868 -12.464 27.154 1.00 34.39 C ATOM 819 C PHE A 851 37.529 -11.298 28.085 1.00 39.49 C ATOM 820 O PHE A 851 37.864 -10.148 27.759 1.00 39.01 O ATOM 821 CB PHE A 851 36.995 -12.393 25.896 1.00 31.92 C ATOM 822 CG PHE A 851 37.515 -13.305 24.823 1.00 33.76 C ATOM 823 CD1 PHE A 851 38.684 -12.987 24.148 1.00 37.00 C ATOM 824 CD2 PHE A 851 36.876 -14.492 24.521 1.00 36.04 C ATOM 825 CE1 PHE A 851 39.215 -13.858 23.207 1.00 41.16 C ATOM 826 CE2 PHE A 851 37.397 -15.343 23.565 1.00 39.72 C ATOM 827 CZ PHE A 851 38.562 -15.025 22.910 1.00 37.91 C ATOM 828 H PHE A 851 36.744 -14.153 27.923 1.00 0.00 H ATOM 829 N LYS A 852 36.892 -11.599 29.232 1.00 42.02 N ATOM 830 CA LYS A 852 36.372 -10.532 30.100 1.00 41.52 C ATOM 831 C LYS A 852 37.540 -9.730 30.692 1.00 41.66 C ATOM 832 O LYS A 852 37.329 -8.597 31.085 1.00 45.99 O ATOM 833 CB LYS A 852 35.447 -11.086 31.192 1.00 41.27 C ATOM 834 CG LYS A 852 34.822 -10.055 32.130 1.00 40.40 C ATOM 835 CD LYS A 852 33.923 -9.042 31.440 1.00 39.12 C ATOM 836 CE LYS A 852 33.267 -8.034 32.367 1.00 37.16 C ATOM 837 NZ LYS A 852 32.302 -7.175 31.641 1.00 28.40 N ATOM 838 HZ1 LYS A 852 32.799 -6.656 30.889 1.00 0.00 H ATOM 839 HZ2 LYS A 852 31.559 -7.769 31.221 1.00 0.00 H ATOM 840 HZ3 LYS A 852 31.874 -6.499 32.305 1.00 0.00 H ATOM 841 H LYS A 852 36.767 -12.594 29.507 1.00 0.00 H ATOM 842 N GLN A 853 38.759 -10.294 30.706 1.00 40.35 N ATOM 843 CA GLN A 853 39.933 -9.621 31.256 1.00 44.41 C ATOM 844 C GLN A 853 40.832 -9.037 30.152 1.00 43.15 C ATOM 845 O GLN A 853 41.866 -8.446 30.449 1.00 43.65 O ATOM 846 CB GLN A 853 40.750 -10.587 32.115 1.00 52.14 C ATOM 847 CG GLN A 853 39.995 -11.101 33.333 1.00 54.02 C ATOM 848 CD GLN A 853 40.924 -11.656 34.384 1.00 56.32 C ATOM 849 OE1 GLN A 853 41.730 -10.940 34.981 1.00 55.65 O ATOM 850 NE2 GLN A 853 40.804 -12.948 34.631 1.00 63.14 N ATOM 851 HE22 GLN A 853 40.111 -13.516 34.104 1.00 0.00 H ATOM 852 HE21 GLN A 853 41.403 -13.397 35.353 1.00 0.00 H ATOM 853 H GLN A 853 38.872 -11.249 30.309 1.00 0.00 H ATOM 854 N LEU A 854 40.452 -9.189 28.878 1.00 38.17 N ATOM 855 CA LEU A 854 41.220 -8.556 27.769 1.00 37.48 C ATOM 856 C LEU A 854 41.021 -7.038 27.851 1.00 34.90 C ATOM 857 O LEU A 854 39.964 -6.561 28.256 1.00 35.21 O ATOM 858 CB LEU A 854 40.729 -9.134 26.436 1.00 38.01 C ATOM 859 CG LEU A 854 41.526 -8.814 25.176 1.00 36.93 C ATOM 860 CD1 LEU A 854 42.961 -9.289 25.258 1.00 41.15 C ATOM 861 CD2 LEU A 854 40.820 -9.422 23.952 1.00 37.07 C ATOM 862 H LEU A 854 39.609 -9.757 28.659 1.00 0.00 H ATOM 863 N HIS A 855 42.055 -6.280 27.482 1.00 33.44 N ATOM 864 CA HIS A 855 41.958 -4.824 27.375 1.00 34.90 C ATOM 865 C HIS A 855 41.124 -4.428 26.150 1.00 32.07 C ATOM 866 O HIS A 855 40.865 -5.237 25.237 1.00 30.95 O ATOM 867 CB HIS A 855 43.347 -4.197 27.292 1.00 36.82 C ATOM 868 CG HIS A 855 44.074 -4.584 26.049 1.00 36.56 C ATOM 869 ND1 HIS A 855 44.670 -5.829 25.906 1.00 38.26 N ATOM 870 CD2 HIS A 855 44.319 -3.905 24.911 1.00 35.35 C ATOM 871 CE1 HIS A 855 45.243 -5.891 24.715 1.00 38.21 C ATOM 872 NE2 HIS A 855 45.061 -4.726 24.099 1.00 37.04 N ATOM 873 H HIS A 855 42.962 -6.740 27.263 1.00 0.00 H ATOM 874 N ASN A 856 40.657 -3.173 26.160 1.00 30.41 N ATOM 875 CA ASN A 856 39.943 -2.565 25.035 1.00 30.59 C ATOM 876 C ASN A 856 38.619 -3.313 24.784 1.00 27.88 C ATOM 877 O ASN A 856 38.359 -3.873 23.714 1.00 29.84 O ATOM 878 CB ASN A 856 40.829 -2.476 23.789 1.00 32.57 C ATOM 879 CG ASN A 856 40.182 -1.737 22.638 1.00 33.72 C ATOM 880 OD1 ASN A 856 39.353 -0.851 22.847 1.00 34.78 O ATOM 881 ND2 ASN A 856 40.582 -2.068 21.414 1.00 30.53 N ATOM 882 HD22 ASN A 856 41.285 -2.823 21.283 1.00 0.00 H ATOM 883 HD21 ASN A 856 40.192 -1.572 20.587 1.00 0.00 H ATOM 884 H ASN A 856 40.810 -2.599 27.013 1.00 0.00 H ATOM 885 N ARG A 857 37.746 -3.289 25.790 1.00 27.43 N ATOM 886 CA ARG A 857 36.386 -3.816 25.660 1.00 26.59 C ATOM 887 C ARG A 857 35.449 -2.619 25.476 1.00 25.14 C ATOM 888 O ARG A 857 35.493 -1.686 26.323 1.00 27.62 O ATOM 889 CB ARG A 857 36.024 -4.634 26.903 1.00 28.69 C ATOM 890 CG ARG A 857 36.947 -5.829 27.098 1.00 33.59 C ATOM 891 CD ARG A 857 36.605 -6.660 28.309 1.00 34.57 C ATOM 892 NE ARG A 857 37.194 -6.040 29.467 1.00 37.85 N ATOM 893 CZ ARG A 857 36.551 -5.381 30.414 1.00 43.48 C ATOM 894 NH1 ARG A 857 35.235 -5.263 30.398 1.00 44.00 N ATOM 895 NH2 ARG A 857 37.256 -4.839 31.389 1.00 47.52 N ATOM 896 HE ARG A 857 38.226 -6.119 29.568 1.00 0.00 H ATOM 897 HH12 ARG A 857 34.751 -4.739 31.155 1.00 0.00 H ATOM 898 HH11 ARG A 857 34.684 -5.694 29.629 1.00 0.00 H ATOM 899 HH22 ARG A 857 36.776 -4.314 32.148 1.00 0.00 H ATOM 900 HH21 ARG A 857 38.291 -4.937 31.398 1.00 0.00 H ATOM 901 H ARG A 857 38.041 -2.881 26.700 1.00 0.00 H ATOM 902 N ARG A 858 34.623 -2.654 24.430 1.00 24.22 N ATOM 903 CA ARG A 858 33.878 -1.476 23.996 1.00 25.34 C ATOM 904 C ARG A 858 32.414 -1.871 23.806 1.00 26.37 C ATOM 905 O ARG A 858 32.140 -2.985 23.323 1.00 26.58 O ATOM 906 CB ARG A 858 34.525 -0.975 22.699 1.00 28.81 C ATOM 907 CG ARG A 858 34.184 0.449 22.310 1.00 34.08 C ATOM 908 CD ARG A 858 35.135 1.016 21.251 1.00 35.84 C ATOM 909 NE ARG A 858 36.560 0.982 21.583 1.00 33.82 N ATOM 910 CZ ARG A 858 37.546 1.415 20.791 1.00 37.32 C ATOM 911 NH1 ARG A 858 37.268 2.028 19.647 1.00 33.98 N ATOM 912 NH2 ARG A 858 38.807 1.261 21.148 1.00 37.93 N ATOM 913 HE ARG A 858 36.827 0.590 22.509 1.00 0.00 H ATOM 914 HH12 ARG A 858 38.040 2.362 19.035 1.00 0.00 H ATOM 915 HH11 ARG A 858 36.278 2.174 19.362 1.00 0.00 H ATOM 916 HH22 ARG A 858 39.569 1.601 20.526 1.00 0.00 H ATOM 917 HH21 ARG A 858 39.039 0.800 22.051 1.00 0.00 H ATOM 918 H ARG A 858 34.506 -3.546 23.908 1.00 0.00 H ATOM 919 N LEU A 859 31.500 -0.939 24.113 1.00 25.22 N ATOM 920 CA LEU A 859 30.088 -1.152 23.937 1.00 24.41 C ATOM 921 C LEU A 859 29.673 -0.638 22.562 1.00 25.13 C ATOM 922 O LEU A 859 29.798 0.555 22.293 1.00 26.42 O ATOM 923 CB LEU A 859 29.330 -0.450 25.060 1.00 27.34 C ATOM 924 CG LEU A 859 27.883 -0.906 25.247 1.00 26.90 C ATOM 925 CD1 LEU A 859 27.783 -2.305 25.881 1.00 27.22 C ATOM 926 CD2 LEU A 859 27.126 0.116 26.081 1.00 30.31 C ATOM 927 H LEU A 859 31.824 -0.027 24.493 1.00 0.00 H ATOM 928 N LEU A 860 29.268 -1.561 21.690 1.00 23.36 N ATOM 929 CA LEU A 860 29.098 -1.292 20.269 1.00 24.87 C ATOM 930 C LEU A 860 27.732 -1.785 19.780 1.00 26.59 C ATOM 931 O LEU A 860 27.110 -2.711 20.339 1.00 24.61 O ATOM 932 CB LEU A 860 30.260 -1.904 19.475 1.00 24.65 C ATOM 933 CG LEU A 860 31.668 -1.361 19.747 1.00 25.49 C ATOM 934 CD1 LEU A 860 32.698 -2.235 19.028 1.00 26.73 C ATOM 935 CD2 LEU A 860 31.795 0.082 19.308 1.00 25.96 C ATOM 936 H LEU A 860 29.064 -2.518 22.041 1.00 0.00 H ATOM 937 N TRP A 861 27.274 -1.161 18.696 1.00 24.94 N ATOM 938 CA TRP A 861 25.959 -1.437 18.068 1.00 25.09 C ATOM 939 C TRP A 861 26.010 -2.649 17.125 1.00 26.00 C ATOM 940 O TRP A 861 26.958 -2.813 16.358 1.00 25.67 O ATOM 941 CB TRP A 861 25.488 -0.210 17.286 1.00 25.69 C ATOM 942 CG TRP A 861 25.309 1.020 18.120 1.00 25.59 C ATOM 943 CD1 TRP A 861 26.133 2.102 18.141 1.00 28.29 C ATOM 944 CD2 TRP A 861 24.230 1.311 19.022 1.00 27.56 C ATOM 945 NE1 TRP A 861 25.649 3.041 18.998 1.00 28.61 N ATOM 946 CE2 TRP A 861 24.506 2.576 19.579 1.00 28.16 C ATOM 947 CE3 TRP A 861 23.085 0.627 19.441 1.00 27.69 C ATOM 948 CZ2 TRP A 861 23.662 3.176 20.503 1.00 27.77 C ATOM 949 CZ3 TRP A 861 22.265 1.209 20.378 1.00 28.59 C ATOM 950 CH2 TRP A 861 22.551 2.478 20.889 1.00 29.02 C ATOM 951 HE1 TRP A 861 26.083 3.968 19.181 1.00 0.00 H ATOM 952 H TRP A 861 27.877 -0.433 18.262 1.00 0.00 H ATOM 953 N HIS A 862 24.885 -3.393 17.069 1.00 24.21 N ATOM 954 CA HIS A 862 24.622 -4.391 16.029 1.00 24.86 C ATOM 955 C HIS A 862 23.131 -4.367 15.679 1.00 25.22 C ATOM 956 O HIS A 862 22.323 -4.641 16.541 1.00 27.11 O ATOM 957 CB HIS A 862 25.053 -5.807 16.437 1.00 24.30 C ATOM 958 CG HIS A 862 24.874 -6.815 15.355 1.00 23.57 C ATOM 959 ND1 HIS A 862 25.878 -7.137 14.460 1.00 26.37 N ATOM 960 CD2 HIS A 862 23.790 -7.539 14.977 1.00 26.52 C ATOM 961 CE1 HIS A 862 25.422 -8.015 13.599 1.00 26.74 C ATOM 962 NE2 HIS A 862 24.145 -8.294 13.893 1.00 28.26 N ATOM 963 H HIS A 862 24.165 -3.250 17.805 1.00 0.00 H ATOM 964 N GLY A 863 22.819 -4.053 14.414 1.00 26.15 N ATOM 965 CA GLY A 863 21.469 -4.080 13.894 1.00 26.92 C ATOM 966 C GLY A 863 21.207 -5.314 13.040 1.00 28.76 C ATOM 967 O GLY A 863 22.118 -5.841 12.416 1.00 29.53 O ATOM 968 H GLY A 863 23.588 -3.775 13.772 1.00 0.00 H ATOM 969 N SER A 864 19.930 -5.745 12.987 1.00 30.38 N ATOM 970 CA SER A 864 19.498 -6.877 12.222 1.00 29.56 C ATOM 971 C SER A 864 17.986 -6.781 12.005 1.00 31.85 C ATOM 972 O SER A 864 17.318 -6.127 12.787 1.00 33.24 O ATOM 973 CB SER A 864 19.880 -8.165 12.928 1.00 30.52 C ATOM 974 OG SER A 864 19.855 -9.266 12.044 1.00 34.42 O ATOM 975 HG SER A 864 20.496 -9.110 11.306 1.00 0.00 H ATOM 976 H SER A 864 19.216 -5.224 13.535 1.00 0.00 H ATOM 977 N ARG A 865 17.483 -7.473 10.979 1.00 32.75 N ATOM 978 CA ARG A 865 16.048 -7.603 10.767 1.00 36.16 C ATOM 979 C ARG A 865 15.410 -8.268 11.993 1.00 36.16 C ATOM 980 O ARG A 865 15.978 -9.174 12.598 1.00 35.11 O ATOM 981 CB ARG A 865 15.759 -8.428 9.511 1.00 40.42 C ATOM 982 CG ARG A 865 16.115 -7.729 8.209 1.00 47.78 C ATOM 983 CD ARG A 865 15.853 -8.647 7.033 1.00 54.28 C ATOM 984 NE ARG A 865 15.935 -7.958 5.755 1.00 70.02 N ATOM 985 CZ ARG A 865 17.064 -7.704 5.110 1.00 72.25 C ATOM 986 NH1 ARG A 865 18.226 -8.014 5.663 1.00 75.02 N ATOM 987 NH2 ARG A 865 17.029 -7.138 3.914 1.00 73.03 N ATOM 988 HE ARG A 865 15.046 -7.643 5.317 1.00 0.00 H ATOM 989 HH12 ARG A 865 19.112 -7.815 5.157 1.00 0.00 H ATOM 990 HH11 ARG A 865 18.253 -8.457 6.604 1.00 0.00 H ATOM 991 HH22 ARG A 865 17.915 -6.938 3.407 1.00 0.00 H ATOM 992 HH21 ARG A 865 16.116 -6.893 3.481 1.00 0.00 H ATOM 993 H ARG A 865 18.135 -7.932 10.312 1.00 0.00 H ATOM 994 N THR A 866 14.186 -7.850 12.305 1.00 35.72 N ATOM 995 CA THR A 866 13.457 -8.338 13.468 1.00 35.80 C ATOM 996 C THR A 866 13.332 -9.870 13.407 1.00 36.55 C ATOM 997 O THR A 866 13.466 -10.532 14.438 1.00 36.68 O ATOM 998 CB THR A 866 12.112 -7.611 13.580 1.00 38.54 C ATOM 999 OG1 THR A 866 12.434 -6.246 13.866 1.00 39.87 O ATOM 1000 CG2 THR A 866 11.221 -8.191 14.664 1.00 40.48 C ATOM 1001 HG1 THR A 866 12.984 -5.877 13.130 1.00 0.00 H ATOM 1002 H THR A 866 13.730 -7.144 11.692 1.00 0.00 H ATOM 1003 N THR A 867 13.106 -10.426 12.207 1.00 38.38 N ATOM 1004 CA THR A 867 12.917 -11.872 11.997 1.00 39.45 C ATOM 1005 C THR A 867 14.156 -12.701 12.398 1.00 39.23 C ATOM 1006 O THR A 867 14.050 -13.934 12.515 1.00 41.90 O ATOM 1007 CB THR A 867 12.518 -12.201 10.547 1.00 44.76 C ATOM 1008 OG1 THR A 867 13.446 -11.615 9.632 1.00 47.22 O ATOM 1009 CG2 THR A 867 11.127 -11.723 10.210 1.00 51.28 C ATOM 1010 HG1 THR A 867 13.450 -10.632 9.752 1.00 0.00 H ATOM 1011 H THR A 867 13.062 -9.800 11.377 1.00 0.00 H ATOM 1012 N ASN A 868 15.313 -12.063 12.593 1.00 35.71 N ATOM 1013 CA ASN A 868 16.552 -12.755 12.991 1.00 34.01 C ATOM 1014 C ASN A 868 16.717 -12.848 14.518 1.00 33.20 C ATOM 1015 O ASN A 868 17.556 -13.591 14.999 1.00 33.61 O ATOM 1016 CB ASN A 868 17.783 -12.077 12.390 1.00 34.01 C ATOM 1017 CG ASN A 868 17.853 -12.189 10.881 1.00 36.84 C ATOM 1018 OD1 ASN A 868 17.362 -13.149 10.295 1.00 41.87 O ATOM 1019 ND2 ASN A 868 18.492 -11.226 10.253 1.00 38.02 N ATOM 1020 HD22 ASN A 868 18.892 -10.431 10.791 1.00 0.00 H ATOM 1021 HD21 ASN A 868 18.597 -11.260 9.219 1.00 0.00 H ATOM 1022 H ASN A 868 15.341 -11.032 12.458 1.00 0.00 H ATOM 1023 N PHE A 869 15.929 -12.103 15.304 1.00 36.26 N ATOM 1024 CA PHE A 869 16.247 -11.951 16.747 1.00 33.72 C ATOM 1025 C PHE A 869 15.969 -13.225 17.574 1.00 32.34 C ATOM 1026 O PHE A 869 16.677 -13.447 18.578 1.00 34.00 O ATOM 1027 CB PHE A 869 15.532 -10.729 17.323 1.00 33.62 C ATOM 1028 CG PHE A 869 16.396 -9.506 17.211 1.00 30.70 C ATOM 1029 CD1 PHE A 869 16.517 -8.841 16.001 1.00 30.59 C ATOM 1030 CD2 PHE A 869 17.183 -9.102 18.274 1.00 32.26 C ATOM 1031 CE1 PHE A 869 17.341 -7.738 15.883 1.00 33.10 C ATOM 1032 CE2 PHE A 869 18.038 -8.017 18.137 1.00 33.71 C ATOM 1033 CZ PHE A 869 18.103 -7.331 16.945 1.00 32.00 C ATOM 1034 H PHE A 869 15.094 -11.630 14.904 1.00 0.00 H ATOM 1035 N ALA A 870 15.003 -14.067 17.198 1.00 37.10 N ATOM 1036 CA ALA A 870 14.799 -15.332 17.945 1.00 35.75 C ATOM 1037 C ALA A 870 16.075 -16.186 17.876 1.00 38.31 C ATOM 1038 O ALA A 870 16.540 -16.729 18.889 1.00 34.19 O ATOM 1039 CB ALA A 870 13.583 -16.088 17.451 1.00 40.02 C ATOM 1040 H ALA A 870 14.397 -13.837 16.385 1.00 0.00 H ATOM 1041 N GLY A 871 16.677 -16.254 16.683 1.00 34.78 N ATOM 1042 CA GLY A 871 17.937 -16.949 16.468 1.00 37.55 C ATOM 1043 C GLY A 871 19.112 -16.276 17.159 1.00 32.46 C ATOM 1044 O GLY A 871 19.965 -16.948 17.721 1.00 35.79 O ATOM 1045 H GLY A 871 16.223 -15.788 15.871 1.00 0.00 H ATOM 1046 N ILE A 872 19.209 -14.942 17.078 1.00 32.65 N ATOM 1047 CA ILE A 872 20.307 -14.212 17.689 1.00 31.16 C ATOM 1048 C ILE A 872 20.310 -14.411 19.215 1.00 30.60 C ATOM 1049 O ILE A 872 21.362 -14.646 19.795 1.00 30.15 O ATOM 1050 CB ILE A 872 20.259 -12.718 17.305 1.00 31.64 C ATOM 1051 CG1 ILE A 872 20.611 -12.539 15.824 1.00 32.59 C ATOM 1052 CG2 ILE A 872 21.161 -11.883 18.193 1.00 33.68 C ATOM 1053 CD1 ILE A 872 20.409 -11.109 15.312 1.00 34.22 C ATOM 1054 H ILE A 872 18.477 -14.413 16.562 1.00 0.00 H ATOM 1055 N LEU A 873 19.150 -14.316 19.860 1.00 29.62 N ATOM 1056 CA LEU A 873 19.142 -14.424 21.322 1.00 32.45 C ATOM 1057 C LEU A 873 19.416 -15.871 21.763 1.00 31.66 C ATOM 1058 O LEU A 873 20.202 -16.111 22.700 1.00 32.12 O ATOM 1059 CB LEU A 873 17.827 -13.864 21.859 1.00 31.94 C ATOM 1060 CG LEU A 873 17.671 -12.357 21.668 1.00 32.61 C ATOM 1061 CD1 LEU A 873 16.330 -11.878 22.187 1.00 37.39 C ATOM 1062 CD2 LEU A 873 18.834 -11.608 22.305 1.00 31.55 C ATOM 1063 H LEU A 873 18.264 -14.168 19.336 1.00 0.00 H ATOM 1064 N SER A 874 18.820 -16.838 21.078 1.00 32.02 N ATOM 1065 CA SER A 874 19.000 -18.230 21.501 1.00 33.13 C ATOM 1066 C SER A 874 20.422 -18.721 21.207 1.00 37.17 C ATOM 1067 O SER A 874 20.969 -19.469 22.025 1.00 40.02 O ATOM 1068 CB SER A 874 17.945 -19.151 20.940 1.00 38.46 C ATOM 1069 OG SER A 874 17.986 -19.223 19.526 1.00 39.58 O ATOM 1070 HG SER A 874 17.838 -18.321 19.146 1.00 0.00 H ATOM 1071 H SER A 874 18.232 -16.611 20.251 1.00 0.00 H ATOM 1072 N GLN A 875 21.000 -18.358 20.052 1.00 31.12 N ATOM 1073 CA GLN A 875 22.270 -18.956 19.605 1.00 34.69 C ATOM 1074 C GLN A 875 23.440 -17.969 19.753 1.00 31.39 C ATOM 1075 O GLN A 875 24.616 -18.353 19.610 1.00 33.12 O ATOM 1076 CB GLN A 875 22.173 -19.446 18.152 1.00 38.80 C ATOM 1077 CG GLN A 875 21.051 -20.443 17.890 1.00 44.03 C ATOM 1078 CD GLN A 875 21.150 -21.694 18.730 1.00 54.89 C ATOM 1079 OE1 GLN A 875 22.236 -22.187 19.029 1.00 65.22 O ATOM 1080 NE2 GLN A 875 20.005 -22.211 19.143 1.00 61.28 N ATOM 1081 HE22 GLN A 875 19.105 -21.767 18.870 1.00 0.00 H ATOM 1082 HE21 GLN A 875 20.004 -23.062 19.741 1.00 0.00 H ATOM 1083 H GLN A 875 20.541 -17.638 19.459 1.00 0.00 H ATOM 1084 N GLY A 876 23.128 -16.700 20.014 1.00 29.73 N ATOM 1085 CA GLY A 876 24.060 -15.579 19.959 1.00 30.48 C ATOM 1086 C GLY A 876 24.354 -15.195 18.516 1.00 30.41 C ATOM 1087 O GLY A 876 23.907 -15.892 17.571 1.00 31.78 O ATOM 1088 H GLY A 876 22.144 -16.493 20.277 1.00 0.00 H ATOM 1089 N LEU A 877 25.137 -14.132 18.354 1.00 30.24 N ATOM 1090 CA LEU A 877 25.616 -13.719 17.024 1.00 28.55 C ATOM 1091 C LEU A 877 26.592 -14.786 16.535 1.00 29.82 C ATOM 1092 O LEU A 877 27.456 -15.266 17.297 1.00 29.56 O ATOM 1093 CB LEU A 877 26.271 -12.349 17.085 1.00 28.67 C ATOM 1094 CG LEU A 877 25.317 -11.193 17.341 1.00 28.61 C ATOM 1095 CD1 LEU A 877 26.063 -9.890 17.527 1.00 29.89 C ATOM 1096 CD2 LEU A 877 24.288 -11.068 16.231 1.00 31.59 C ATOM 1097 H LEU A 877 25.418 -13.578 19.188 1.00 0.00 H ATOM 1098 N ARG A 878 26.446 -15.122 15.259 1.00 28.77 N ATOM 1099 CA ARG A 878 27.196 -16.186 14.622 1.00 31.07 C ATOM 1100 C ARG A 878 27.853 -15.634 13.356 1.00 33.53 C ATOM 1101 O ARG A 878 27.431 -14.621 12.807 1.00 35.16 O ATOM 1102 CB ARG A 878 26.253 -17.351 14.337 1.00 36.73 C ATOM 1103 CG ARG A 878 25.855 -18.132 15.585 1.00 40.55 C ATOM 1104 CD ARG A 878 24.839 -19.220 15.289 1.00 53.97 C ATOM 1105 NE ARG A 878 23.573 -18.666 14.809 1.00 64.12 N ATOM 1106 CZ ARG A 878 22.493 -19.387 14.510 1.00 73.57 C ATOM 1107 NH1 ARG A 878 22.530 -20.708 14.589 1.00 75.97 N ATOM 1108 NH2 ARG A 878 21.376 -18.777 14.152 1.00 75.59 N ATOM 1109 HE ARG A 878 23.511 -17.634 14.693 1.00 0.00 H ATOM 1110 HH12 ARG A 878 21.685 -21.267 14.355 1.00 0.00 H ATOM 1111 HH11 ARG A 878 23.404 -21.187 14.885 1.00 0.00 H ATOM 1112 HH22 ARG A 878 20.531 -19.336 13.918 1.00 0.00 H ATOM 1113 HH21 ARG A 878 21.343 -17.739 14.105 1.00 0.00 H ATOM 1114 H ARG A 878 25.757 -14.594 14.686 1.00 0.00 H ATOM 1115 N ILE A 879 28.922 -16.291 12.927 1.00 36.92 N ATOM 1116 CA ILE A 879 29.563 -15.937 11.690 1.00 35.70 C ATOM 1117 C ILE A 879 28.752 -16.555 10.540 1.00 37.97 C ATOM 1118 O ILE A 879 28.357 -17.730 10.626 1.00 40.60 O ATOM 1119 CB ILE A 879 31.027 -16.409 11.744 1.00 38.15 C ATOM 1120 CG1 ILE A 879 31.769 -15.700 12.887 1.00 41.19 C ATOM 1121 CG2 ILE A 879 31.714 -16.230 10.402 1.00 38.65 C ATOM 1122 CD1 ILE A 879 33.113 -16.280 13.201 1.00 47.83 C ATOM 1123 H ILE A 879 29.303 -17.075 13.495 1.00 0.00 H ATOM 1124 N ALA A 880 28.545 -15.785 9.456 1.00 37.63 N ATOM 1125 CA ALA A 880 27.919 -16.294 8.214 1.00 42.41 C ATOM 1126 C ALA A 880 28.640 -17.562 7.770 1.00 42.21 C ATOM 1127 O ALA A 880 29.866 -17.644 7.805 1.00 42.50 O ATOM 1128 CB ALA A 880 27.954 -15.250 7.126 1.00 45.49 C ATOM 1129 H ALA A 880 28.838 -14.788 9.492 1.00 0.00 H ATOM 1130 N PRO A 881 27.905 -18.600 7.321 1.00 42.94 N ATOM 1131 CA PRO A 881 28.537 -19.852 6.909 1.00 47.98 C ATOM 1132 C PRO A 881 29.241 -19.720 5.559 1.00 50.91 C ATOM 1133 O PRO A 881 29.029 -18.748 4.833 1.00 50.60 O ATOM 1134 CB PRO A 881 27.342 -20.809 6.833 1.00 52.16 C ATOM 1135 CG PRO A 881 26.186 -19.914 6.434 1.00 51.11 C ATOM 1136 CD PRO A 881 26.446 -18.612 7.159 1.00 45.86 C ATOM 1137 N PRO A 882 30.119 -20.685 5.208 1.00 54.74 N ATOM 1138 CA PRO A 882 30.839 -20.661 3.932 1.00 60.43 C ATOM 1139 C PRO A 882 29.968 -20.455 2.679 1.00 59.54 C ATOM 1140 O PRO A 882 30.430 -19.858 1.727 1.00 59.42 O ATOM 1141 CB PRO A 882 31.508 -22.043 3.851 1.00 63.43 C ATOM 1142 CG PRO A 882 31.609 -22.524 5.289 1.00 62.30 C ATOM 1143 CD PRO A 882 30.500 -21.829 6.050 1.00 56.06 C ATOM 1144 N GLU A 883 28.712 -20.909 2.710 1.00 60.28 N ATOM 1145 CA GLU A 883 27.853 -20.904 1.521 1.00 68.15 C ATOM 1146 C GLU A 883 27.209 -19.522 1.296 1.00 64.34 C ATOM 1147 O GLU A 883 26.742 -19.249 0.197 1.00 68.87 O ATOM 1148 CB GLU A 883 26.798 -22.014 1.602 1.00 73.45 C ATOM 1149 CG GLU A 883 25.935 -21.981 2.854 1.00 77.36 C ATOM 1150 CD GLU A 883 26.349 -22.903 3.996 1.00 80.01 C ATOM 1151 OE1 GLU A 883 27.568 -23.205 4.124 1.00 68.93 O ATOM 1152 OE2 GLU A 883 25.445 -23.303 4.777 1.00 75.53 O ATOM 1153 H GLU A 883 28.331 -21.277 3.605 1.00 0.00 H ATOM 1154 N ALA A 884 27.180 -18.658 2.313 1.00 56.95 N ATOM 1155 CA ALA A 884 26.609 -17.306 2.186 1.00 56.13 C ATOM 1156 C ALA A 884 27.567 -16.431 1.376 1.00 61.67 C ATOM 1157 O ALA A 884 28.777 -16.661 1.410 1.00 57.09 O ATOM 1158 CB ALA A 884 26.366 -16.716 3.557 1.00 58.18 C ATOM 1159 H ALA A 884 27.575 -18.950 3.229 1.00 0.00 H ATOM 1160 N PRO A 885 27.089 -15.409 0.623 1.00 60.85 N ATOM 1161 CA PRO A 885 27.996 -14.517 -0.111 1.00 56.42 C ATOM 1162 C PRO A 885 28.832 -13.656 0.844 1.00 50.52 C ATOM 1163 O PRO A 885 28.390 -13.398 1.981 1.00 48.11 O ATOM 1164 CB PRO A 885 27.062 -13.661 -0.981 1.00 60.81 C ATOM 1165 CG PRO A 885 25.759 -14.445 -1.002 1.00 62.26 C ATOM 1166 CD PRO A 885 25.677 -15.093 0.367 1.00 61.35 C ATOM 1167 N VAL A 886 30.033 -13.257 0.390 1.00 46.35 N ATOM 1168 CA VAL A 886 30.939 -12.389 1.155 1.00 42.30 C ATOM 1169 C VAL A 886 30.630 -10.918 0.833 1.00 47.52 C ATOM 1170 O VAL A 886 31.225 -10.004 1.437 1.00 44.38 O ATOM 1171 CB VAL A 886 32.426 -12.703 0.880 1.00 42.65 C ATOM 1172 CG1 VAL A 886 32.904 -12.095 -0.435 1.00 46.43 C ATOM 1173 CG2 VAL A 886 33.322 -12.272 2.035 1.00 41.95 C ATOM 1174 H VAL A 886 30.336 -13.579 -0.551 1.00 0.00 H ATOM 1175 N THR A 887 29.705 -10.697 -0.103 1.00 51.75 N ATOM 1176 CA THR A 887 29.294 -9.346 -0.443 1.00 56.51 C ATOM 1177 C THR A 887 28.601 -8.733 0.786 1.00 50.82 C ATOM 1178 O THR A 887 27.794 -9.372 1.506 1.00 58.01 O ATOM 1179 CB THR A 887 28.439 -9.285 -1.717 1.00 62.09 C ATOM 1180 OG1 THR A 887 29.079 -8.367 -2.607 1.00 67.38 O ATOM 1181 CG2 THR A 887 27.006 -8.863 -1.468 1.00 62.39 C ATOM 1182 HG1 THR A 887 29.132 -7.476 -2.178 1.00 0.00 H ATOM 1183 H THR A 887 29.272 -11.504 -0.596 1.00 0.00 H ATOM 1184 N GLY A 888 28.953 -7.483 1.039 1.00 50.72 N ATOM 1185 CA GLY A 888 28.504 -6.813 2.243 1.00 46.67 C ATOM 1186 C GLY A 888 29.468 -6.950 3.410 1.00 42.06 C ATOM 1187 O GLY A 888 29.270 -6.273 4.435 1.00 41.58 O ATOM 1188 H GLY A 888 29.560 -6.974 0.365 1.00 0.00 H ATOM 1189 N TYR A 889 30.517 -7.777 3.296 1.00 36.37 N ATOM 1190 CA TYR A 889 31.489 -7.976 4.395 1.00 33.70 C ATOM 1191 C TYR A 889 32.912 -7.552 3.983 1.00 39.12 C ATOM 1192 O TYR A 889 33.667 -8.375 3.442 1.00 43.56 O ATOM 1193 CB TYR A 889 31.590 -9.443 4.811 1.00 34.99 C ATOM 1194 CG TYR A 889 30.349 -10.031 5.432 1.00 34.06 C ATOM 1195 CD1 TYR A 889 29.974 -9.719 6.727 1.00 35.90 C ATOM 1196 CD2 TYR A 889 29.578 -10.935 4.728 1.00 38.44 C ATOM 1197 CE1 TYR A 889 28.852 -10.282 7.307 1.00 39.92 C ATOM 1198 CE2 TYR A 889 28.454 -11.509 5.297 1.00 41.71 C ATOM 1199 CZ TYR A 889 28.104 -11.192 6.593 1.00 39.23 C ATOM 1200 OH TYR A 889 26.998 -11.772 7.134 1.00 47.73 O ATOM 1201 HH TYR A 889 26.204 -11.532 6.594 1.00 0.00 H ATOM 1202 H TYR A 889 30.653 -8.296 2.405 1.00 0.00 H ATOM 1203 N MET A 890 33.315 -6.319 4.315 1.00 31.91 N ATOM 1204 CA MET A 890 34.532 -5.848 3.663 1.00 32.68 C ATOM 1205 C MET A 890 35.780 -6.496 4.279 1.00 32.17 C ATOM 1206 O MET A 890 36.837 -6.462 3.633 1.00 31.43 O ATOM 1207 CB MET A 890 34.641 -4.324 3.653 1.00 35.05 C ATOM 1208 CG MET A 890 34.977 -3.720 4.963 1.00 37.69 C ATOM 1209 SD MET A 890 34.875 -1.921 4.828 1.00 41.18 S ATOM 1210 CE MET A 890 36.129 -1.613 3.588 1.00 38.48 C ATOM 1211 H MET A 890 32.792 -5.733 4.996 1.00 0.00 H ATOM 1212 N PHE A 891 35.657 -7.155 5.436 1.00 30.05 N ATOM 1213 CA PHE A 891 36.810 -7.768 6.076 1.00 31.13 C ATOM 1214 C PHE A 891 36.594 -9.269 6.238 1.00 31.69 C ATOM 1215 O PHE A 891 37.232 -9.910 7.077 1.00 34.31 O ATOM 1216 CB PHE A 891 37.129 -7.060 7.389 1.00 30.97 C ATOM 1217 CG PHE A 891 37.480 -5.613 7.168 1.00 29.83 C ATOM 1218 CD1 PHE A 891 38.620 -5.258 6.473 1.00 29.36 C ATOM 1219 CD2 PHE A 891 36.638 -4.616 7.614 1.00 31.87 C ATOM 1220 CE1 PHE A 891 38.929 -3.926 6.254 1.00 31.36 C ATOM 1221 CE2 PHE A 891 36.925 -3.286 7.365 1.00 33.62 C ATOM 1222 CZ PHE A 891 38.072 -2.941 6.691 1.00 32.02 C ATOM 1223 H PHE A 891 34.722 -7.230 5.885 1.00 0.00 H ATOM 1224 N GLY A 892 35.738 -9.811 5.377 1.00 31.33 N ATOM 1225 CA GLY A 892 35.415 -11.237 5.382 1.00 30.95 C ATOM 1226 C GLY A 892 34.387 -11.564 6.441 1.00 32.79 C ATOM 1227 O GLY A 892 33.954 -10.699 7.193 1.00 32.59 O ATOM 1228 H GLY A 892 35.281 -9.197 4.673 1.00 0.00 H ATOM 1229 N LYS A 893 34.047 -12.842 6.513 1.00 33.45 N ATOM 1230 CA LYS A 893 32.957 -13.258 7.391 1.00 36.34 C ATOM 1231 C LYS A 893 33.443 -13.177 8.840 1.00 37.13 C ATOM 1232 O LYS A 893 34.485 -13.675 9.209 1.00 36.64 O ATOM 1233 CB LYS A 893 32.469 -14.630 6.940 1.00 38.12 C ATOM 1234 CG LYS A 893 31.678 -14.578 5.631 1.00 39.81 C ATOM 1235 CD LYS A 893 31.518 -15.908 4.988 1.00 44.71 C ATOM 1236 CE LYS A 893 30.784 -15.849 3.668 1.00 44.86 C ATOM 1237 NZ LYS A 893 30.772 -17.192 3.048 1.00 49.90 N ATOM 1238 HZ1 LYS A 893 31.750 -17.507 2.887 1.00 0.00 H ATOM 1239 HZ2 LYS A 893 30.291 -17.861 3.682 1.00 0.00 H ATOM 1240 HZ3 LYS A 893 30.267 -17.149 2.140 1.00 0.00 H ATOM 1241 H LYS A 893 34.556 -13.549 5.945 1.00 0.00 H ATOM 1242 N GLY A 894 32.680 -12.456 9.641 1.00 32.75 N ATOM 1243 CA GLY A 894 32.950 -12.284 11.043 1.00 30.19 C ATOM 1244 C GLY A 894 31.719 -11.698 11.670 1.00 29.39 C ATOM 1245 O GLY A 894 30.651 -11.699 11.043 1.00 33.07 O ATOM 1246 H GLY A 894 31.842 -11.989 9.238 1.00 0.00 H ATOM 1247 N ILE A 895 31.857 -11.160 12.880 1.00 27.64 N ATOM 1248 CA ILE A 895 30.738 -10.492 13.540 1.00 26.02 C ATOM 1249 C ILE A 895 31.051 -8.993 13.560 1.00 26.80 C ATOM 1250 O ILE A 895 32.098 -8.591 14.074 1.00 25.56 O ATOM 1251 CB ILE A 895 30.498 -11.058 14.952 1.00 25.23 C ATOM 1252 CG1 ILE A 895 30.421 -12.587 14.951 1.00 26.51 C ATOM 1253 CG2 ILE A 895 29.260 -10.445 15.563 1.00 25.34 C ATOM 1254 CD1 ILE A 895 30.194 -13.170 16.308 1.00 27.23 C ATOM 1255 H ILE A 895 32.776 -11.216 13.363 1.00 0.00 H ATOM 1256 N TYR A 896 30.145 -8.200 12.984 1.00 23.81 N ATOM 1257 CA TYR A 896 30.373 -6.783 12.669 1.00 25.07 C ATOM 1258 C TYR A 896 29.589 -5.867 13.609 1.00 26.32 C ATOM 1259 O TYR A 896 28.435 -6.098 13.921 1.00 25.34 O ATOM 1260 CB TYR A 896 29.942 -6.502 11.226 1.00 26.07 C ATOM 1261 CG TYR A 896 30.938 -6.939 10.182 1.00 27.15 C ATOM 1262 CD1 TYR A 896 31.240 -8.278 9.978 1.00 25.86 C ATOM 1263 CD2 TYR A 896 31.583 -5.999 9.384 1.00 26.55 C ATOM 1264 CE1 TYR A 896 32.182 -8.666 9.042 1.00 28.41 C ATOM 1265 CE2 TYR A 896 32.515 -6.384 8.432 1.00 27.45 C ATOM 1266 CZ TYR A 896 32.787 -7.721 8.241 1.00 28.14 C ATOM 1267 OH TYR A 896 33.721 -8.091 7.326 1.00 29.64 O ATOM 1268 HH TYR A 896 33.795 -9.078 7.312 1.00 0.00 H ATOM 1269 H TYR A 896 29.220 -8.610 12.743 1.00 0.00 H ATOM 1270 N PHE A 897 30.227 -4.780 14.046 1.00 22.37 N ATOM 1271 CA PHE A 897 29.633 -3.799 14.952 1.00 23.37 C ATOM 1272 C PHE A 897 29.964 -2.386 14.448 1.00 25.16 C ATOM 1273 O PHE A 897 30.985 -2.186 13.739 1.00 24.51 O ATOM 1274 CB PHE A 897 30.203 -3.967 16.368 1.00 23.68 C ATOM 1275 CG PHE A 897 29.937 -5.309 16.986 1.00 24.28 C ATOM 1276 CD1 PHE A 897 30.767 -6.386 16.735 1.00 26.30 C ATOM 1277 CD2 PHE A 897 28.808 -5.501 17.761 1.00 27.39 C ATOM 1278 CE1 PHE A 897 30.495 -7.623 17.301 1.00 27.58 C ATOM 1279 CE2 PHE A 897 28.528 -6.745 18.309 1.00 27.78 C ATOM 1280 CZ PHE A 897 29.351 -7.801 18.059 1.00 27.06 C ATOM 1281 H PHE A 897 31.203 -4.622 13.724 1.00 0.00 H ATOM 1282 N ALA A 898 29.181 -1.404 14.883 1.00 24.97 N ATOM 1283 CA ALA A 898 29.444 0.031 14.590 1.00 26.46 C ATOM 1284 C ALA A 898 29.542 0.801 15.903 1.00 28.08 C ATOM 1285 O ALA A 898 28.955 0.392 16.924 1.00 26.48 O ATOM 1286 CB ALA A 898 28.354 0.620 13.731 1.00 27.38 C ATOM 1287 H ALA A 898 28.347 -1.650 15.454 1.00 0.00 H ATOM 1288 N ASP A 899 30.175 1.979 15.846 1.00 24.93 N ATOM 1289 CA ASP A 899 30.164 2.944 16.957 1.00 26.78 C ATOM 1290 C ASP A 899 29.233 4.131 16.659 1.00 26.98 C ATOM 1291 O ASP A 899 29.078 5.014 17.516 1.00 28.86 O ATOM 1292 CB ASP A 899 31.584 3.375 17.348 1.00 26.65 C ATOM 1293 CG ASP A 899 32.399 4.069 16.254 1.00 27.10 C ATOM 1294 OD1 ASP A 899 31.779 4.632 15.311 1.00 27.37 O ATOM 1295 OD2 ASP A 899 33.650 4.107 16.411 1.00 27.93 O ATOM 1296 H ASP A 899 30.697 2.223 14.980 1.00 0.00 H ATOM 1297 N MET A 900 28.579 4.114 15.491 1.00 28.38 N ATOM 1298 CA MET A 900 27.566 5.063 15.139 1.00 29.38 C ATOM 1299 C MET A 900 26.225 4.329 15.044 1.00 29.51 C ATOM 1300 O MET A 900 26.025 3.440 14.195 1.00 29.12 O ATOM 1301 CB MET A 900 27.859 5.769 13.799 1.00 32.60 C ATOM 1302 CG MET A 900 29.194 6.522 13.722 1.00 32.25 C ATOM 1303 SD MET A 900 29.297 8.068 14.650 1.00 35.14 S ATOM 1304 CE MET A 900 28.319 9.173 13.629 1.00 37.15 C ATOM 1305 H MET A 900 28.819 3.372 14.803 1.00 0.00 H ATOM 1306 N VAL A 901 25.269 4.751 15.868 1.00 28.72 N ATOM 1307 CA VAL A 901 24.001 4.051 15.974 1.00 29.13 C ATOM 1308 C VAL A 901 23.338 3.870 14.593 1.00 30.62 C ATOM 1309 O VAL A 901 22.792 2.805 14.292 1.00 28.70 O ATOM 1310 CB VAL A 901 23.039 4.722 16.980 1.00 29.54 C ATOM 1311 CG1 VAL A 901 22.533 6.096 16.525 1.00 31.83 C ATOM 1312 CG2 VAL A 901 21.858 3.812 17.278 1.00 30.35 C ATOM 1313 H VAL A 901 25.433 5.599 16.447 1.00 0.00 H ATOM 1314 N SER A 902 23.365 4.896 13.745 1.00 28.96 N ATOM 1315 CA SER A 902 22.591 4.846 12.507 1.00 31.32 C ATOM 1316 C SER A 902 23.212 3.852 11.511 1.00 30.05 C ATOM 1317 O SER A 902 22.494 3.274 10.712 1.00 29.88 O ATOM 1318 CB SER A 902 22.445 6.219 11.902 1.00 32.33 C ATOM 1319 OG SER A 902 23.721 6.836 11.734 1.00 34.80 O ATOM 1320 HG SER A 902 24.279 6.280 11.134 1.00 0.00 H ATOM 1321 H SER A 902 23.939 5.735 13.964 1.00 0.00 H ATOM 1322 N LYS A 903 24.538 3.663 11.553 1.00 29.46 N ATOM 1323 CA LYS A 903 25.192 2.716 10.667 1.00 30.01 C ATOM 1324 C LYS A 903 24.608 1.316 10.920 1.00 28.37 C ATOM 1325 O LYS A 903 24.329 0.577 9.961 1.00 31.85 O ATOM 1326 CB LYS A 903 26.715 2.713 10.859 1.00 29.26 C ATOM 1327 CG LYS A 903 27.448 1.706 9.986 1.00 29.45 C ATOM 1328 CD LYS A 903 28.933 2.004 9.850 1.00 29.25 C ATOM 1329 CE LYS A 903 29.645 0.947 9.029 1.00 30.43 C ATOM 1330 NZ LYS A 903 31.046 1.341 8.755 1.00 28.60 N ATOM 1331 HZ1 LYS A 903 31.056 2.237 8.227 1.00 0.00 H ATOM 1332 HZ2 LYS A 903 31.553 1.462 9.655 1.00 0.00 H ATOM 1333 HZ3 LYS A 903 31.509 0.600 8.192 1.00 0.00 H ATOM 1334 H LYS A 903 25.109 4.204 12.233 1.00 0.00 H ATOM 1335 N SER A 904 24.449 0.952 12.206 1.00 28.01 N ATOM 1336 CA SER A 904 23.846 -0.334 12.593 1.00 27.76 C ATOM 1337 C SER A 904 22.320 -0.323 12.357 1.00 28.42 C ATOM 1338 O SER A 904 21.745 -1.318 11.883 1.00 29.52 O ATOM 1339 CB SER A 904 24.178 -0.709 14.025 1.00 26.12 C ATOM 1340 OG SER A 904 25.511 -1.181 14.153 1.00 27.08 O ATOM 1341 HG SER A 904 25.632 -1.983 13.586 1.00 0.00 H ATOM 1342 H SER A 904 24.764 1.603 12.954 1.00 0.00 H ATOM 1343 N ALA A 905 21.652 0.797 12.649 1.00 28.32 N ATOM 1344 CA ALA A 905 20.164 0.908 12.544 1.00 30.20 C ATOM 1345 C ALA A 905 19.715 0.673 11.107 1.00 32.17 C ATOM 1346 O ALA A 905 18.601 0.207 10.855 1.00 32.90 O ATOM 1347 CB ALA A 905 19.647 2.243 13.036 1.00 32.79 C ATOM 1348 H ALA A 905 22.191 1.629 12.963 1.00 0.00 H ATOM 1349 N ASN A 906 20.583 1.027 10.154 1.00 32.02 N ATOM 1350 CA ASN A 906 20.320 0.821 8.739 1.00 34.87 C ATOM 1351 C ASN A 906 20.082 -0.673 8.429 1.00 34.63 C ATOM 1352 O ASN A 906 19.357 -0.995 7.487 1.00 37.07 O ATOM 1353 CB ASN A 906 21.432 1.415 7.877 1.00 34.12 C ATOM 1354 CG ASN A 906 21.413 2.931 7.830 1.00 37.61 C ATOM 1355 OD1 ASN A 906 20.385 3.568 8.092 1.00 36.71 O ATOM 1356 ND2 ASN A 906 22.552 3.510 7.482 1.00 35.97 N ATOM 1357 HD22 ASN A 906 23.388 2.928 7.272 1.00 0.00 H ATOM 1358 HD21 ASN A 906 22.610 4.546 7.419 1.00 0.00 H ATOM 1359 H ASN A 906 21.482 1.467 10.436 1.00 0.00 H ATOM 1360 N TYR A 907 20.678 -1.576 9.213 1.00 32.49 N ATOM 1361 CA TYR A 907 20.533 -3.021 8.980 1.00 32.65 C ATOM 1362 C TYR A 907 19.223 -3.573 9.570 1.00 36.44 C ATOM 1363 O TYR A 907 18.935 -4.765 9.404 1.00 38.56 O ATOM 1364 CB TYR A 907 21.758 -3.756 9.510 1.00 32.85 C ATOM 1365 CG TYR A 907 22.989 -3.544 8.671 1.00 34.58 C ATOM 1366 CD1 TYR A 907 23.223 -4.302 7.540 1.00 38.16 C ATOM 1367 CD2 TYR A 907 23.897 -2.539 8.982 1.00 32.88 C ATOM 1368 CE1 TYR A 907 24.341 -4.070 6.748 1.00 39.70 C ATOM 1369 CE2 TYR A 907 25.008 -2.299 8.201 1.00 34.65 C ATOM 1370 CZ TYR A 907 25.244 -3.078 7.089 1.00 36.74 C ATOM 1371 OH TYR A 907 26.367 -2.813 6.349 1.00 39.70 O ATOM 1372 HH TYR A 907 26.414 -3.441 5.586 1.00 0.00 H ATOM 1373 H TYR A 907 21.260 -1.248 10.010 1.00 0.00 H ATOM 1374 N CYS A 908 18.411 -2.728 10.222 1.00 34.01 N ATOM 1375 CA CYS A 908 17.105 -3.188 10.743 1.00 35.87 C ATOM 1376 C CYS A 908 16.098 -3.347 9.591 1.00 38.70 C ATOM 1377 O CYS A 908 15.125 -4.073 9.722 1.00 43.66 O ATOM 1378 CB CYS A 908 16.552 -2.249 11.815 1.00 37.60 C ATOM 1379 SG CYS A 908 17.634 -2.056 13.256 1.00 36.06 S ATOM 1380 H CYS A 908 18.702 -1.740 10.363 1.00 0.00 H ATOM 1381 N HIS A 909 16.347 -2.636 8.482 1.00 43.73 N ATOM 1382 CA HIS A 909 15.523 -2.624 7.256 1.00 49.45 C ATOM 1383 C HIS A 909 14.050 -2.325 7.584 1.00 50.59 C ATOM 1384 O HIS A 909 13.136 -2.994 7.099 1.00 53.09 O ATOM 1385 CB HIS A 909 15.735 -3.921 6.459 1.00 53.51 C ATOM 1386 CG HIS A 909 17.102 -4.031 5.856 1.00 56.80 C ATOM 1387 ND1 HIS A 909 17.453 -3.376 4.691 1.00 66.63 N ATOM 1388 CD2 HIS A 909 18.197 -4.724 6.236 1.00 62.78 C ATOM 1389 CE1 HIS A 909 18.702 -3.653 4.386 1.00 64.50 C ATOM 1390 NE2 HIS A 909 19.186 -4.475 5.317 1.00 64.35 N ATOM 1391 H HIS A 909 17.198 -2.038 8.485 1.00 0.00 H ATOM 1392 N THR A 910 13.842 -1.287 8.406 1.00 46.86 N ATOM 1393 CA THR A 910 12.531 -0.739 8.690 1.00 46.21 C ATOM 1394 C THR A 910 12.082 0.175 7.534 1.00 47.94 C ATOM 1395 O THR A 910 12.883 0.565 6.685 1.00 50.00 O ATOM 1396 CB THR A 910 12.551 0.041 10.007 1.00 46.96 C ATOM 1397 OG1 THR A 910 13.582 1.022 9.904 1.00 48.50 O ATOM 1398 CG2 THR A 910 12.793 -0.846 11.213 1.00 45.20 C ATOM 1399 HG1 THR A 910 14.451 0.572 9.753 1.00 0.00 H ATOM 1400 H THR A 910 14.667 -0.851 8.865 1.00 0.00 H ATOM 1401 N SER A 911 10.806 0.546 7.554 1.00 52.56 N ATOM 1402 CA SER A 911 10.171 1.420 6.532 1.00 55.58 C ATOM 1403 C SER A 911 9.041 2.219 7.188 1.00 58.09 C ATOM 1404 O SER A 911 8.731 2.008 8.357 1.00 53.08 O ATOM 1405 CB SER A 911 9.655 0.603 5.377 1.00 59.70 C ATOM 1406 OG SER A 911 8.724 -0.365 5.838 1.00 61.83 O ATOM 1407 HG SER A 911 8.393 -0.895 5.070 1.00 0.00 H ATOM 1408 H SER A 911 10.212 0.202 8.336 1.00 0.00 H ATOM 1409 N GLN A 912 8.413 3.122 6.426 1.00 59.56 N ATOM 1410 CA GLN A 912 7.259 3.878 6.905 1.00 64.51 C ATOM 1411 C GLN A 912 6.151 2.909 7.324 1.00 64.14 C ATOM 1412 O GLN A 912 5.523 3.102 8.352 1.00 67.77 O ATOM 1413 CB GLN A 912 6.713 4.821 5.832 1.00 71.27 C ATOM 1414 CG GLN A 912 7.656 5.963 5.486 1.00 76.87 C ATOM 1415 CD GLN A 912 7.039 6.900 4.475 1.00 79.08 C ATOM 1416 OE1 GLN A 912 5.823 6.963 4.325 1.00 82.10 O ATOM 1417 NE2 GLN A 912 7.882 7.637 3.771 1.00 80.56 N ATOM 1418 HE22 GLN A 912 8.906 7.552 3.931 1.00 0.00 H ATOM 1419 HE21 GLN A 912 7.521 8.302 3.058 1.00 0.00 H ATOM 1420 H GLN A 912 8.758 3.291 5.460 1.00 0.00 H ATOM 1421 N GLY A 913 5.930 1.874 6.506 1.00 66.68 N ATOM 1422 CA GLY A 913 4.881 0.894 6.738 1.00 69.59 C ATOM 1423 C GLY A 913 5.176 -0.016 7.920 1.00 69.66 C ATOM 1424 O GLY A 913 4.255 -0.633 8.454 1.00 69.05 O ATOM 1425 H GLY A 913 6.535 1.765 5.667 1.00 0.00 H ATOM 1426 N ASP A 914 6.454 -0.080 8.327 1.00 65.51 N ATOM 1427 CA ASP A 914 6.973 -1.031 9.307 1.00 63.60 C ATOM 1428 C ASP A 914 8.107 -0.369 10.098 1.00 57.58 C ATOM 1429 O ASP A 914 9.272 -0.739 9.946 1.00 53.38 O ATOM 1430 CB ASP A 914 7.426 -2.294 8.568 1.00 67.86 C ATOM 1431 CG ASP A 914 7.900 -3.422 9.464 1.00 72.02 C ATOM 1432 OD1 ASP A 914 7.408 -3.511 10.612 1.00 77.47 O ATOM 1433 OD2 ASP A 914 8.769 -4.193 9.009 1.00 78.73 O ATOM 1434 H ASP A 914 7.125 0.599 7.913 1.00 0.00 H ATOM 1435 N PRO A 915 7.805 0.650 10.940 1.00 52.21 N ATOM 1436 CA PRO A 915 8.823 1.573 11.446 1.00 49.30 C ATOM 1437 C PRO A 915 9.476 1.227 12.797 1.00 47.42 C ATOM 1438 O PRO A 915 10.265 2.031 13.315 1.00 47.69 O ATOM 1439 CB PRO A 915 8.019 2.881 11.579 1.00 53.91 C ATOM 1440 CG PRO A 915 6.609 2.426 11.949 1.00 53.02 C ATOM 1441 CD PRO A 915 6.448 1.042 11.352 1.00 54.02 C ATOM 1442 N ILE A 916 9.149 0.059 13.357 1.00 43.45 N ATOM 1443 CA ILE A 916 9.722 -0.349 14.645 1.00 44.39 C ATOM 1444 C ILE A 916 10.808 -1.384 14.371 1.00 41.28 C ATOM 1445 O ILE A 916 10.570 -2.347 13.656 1.00 43.97 O ATOM 1446 CB ILE A 916 8.641 -0.898 15.598 1.00 47.37 C ATOM 1447 CG1 ILE A 916 7.424 0.022 15.692 1.00 55.38 C ATOM 1448 CG2 ILE A 916 9.257 -1.154 16.961 1.00 44.23 C ATOM 1449 CD1 ILE A 916 7.757 1.435 16.107 1.00 56.80 C ATOM 1450 H ILE A 916 8.478 -0.571 12.873 1.00 0.00 H ATOM 1451 N GLY A 917 11.994 -1.167 14.944 1.00 37.10 N ATOM 1452 CA GLY A 917 13.092 -2.102 14.791 1.00 36.89 C ATOM 1453 C GLY A 917 13.738 -2.445 16.121 1.00 37.03 C ATOM 1454 O GLY A 917 13.500 -1.778 17.119 1.00 36.05 O ATOM 1455 H GLY A 917 12.134 -0.308 15.513 1.00 0.00 H ATOM 1456 N LEU A 918 14.632 -3.442 16.088 1.00 31.50 N ATOM 1457 CA LEU A 918 15.417 -3.871 17.261 1.00 30.12 C ATOM 1458 C LEU A 918 16.907 -3.715 16.955 1.00 30.11 C ATOM 1459 O LEU A 918 17.364 -3.994 15.845 1.00 32.32 O ATOM 1460 CB LEU A 918 15.090 -5.327 17.603 1.00 31.60 C ATOM 1461 CG LEU A 918 13.634 -5.636 17.952 1.00 35.30 C ATOM 1462 CD1 LEU A 918 13.425 -7.135 18.140 1.00 35.49 C ATOM 1463 CD2 LEU A 918 13.190 -4.895 19.206 1.00 38.20 C ATOM 1464 H LEU A 918 14.781 -3.940 15.187 1.00 0.00 H ATOM 1465 N ILE A 919 17.649 -3.257 17.958 1.00 27.93 N ATOM 1466 CA ILE A 919 19.087 -3.098 17.837 1.00 27.10 C ATOM 1467 C ILE A 919 19.736 -3.609 19.128 1.00 28.02 C ATOM 1468 O ILE A 919 19.158 -3.517 20.212 1.00 28.88 O ATOM 1469 CB ILE A 919 19.457 -1.638 17.501 1.00 31.34 C ATOM 1470 CG1 ILE A 919 20.879 -1.490 16.967 1.00 29.65 C ATOM 1471 CG2 ILE A 919 19.203 -0.702 18.669 1.00 33.17 C ATOM 1472 CD1 ILE A 919 21.093 -0.165 16.249 1.00 32.09 C ATOM 1473 H ILE A 919 17.186 -3.005 18.855 1.00 0.00 H ATOM 1474 N LEU A 920 20.967 -4.106 19.014 1.00 25.72 N ATOM 1475 CA LEU A 920 21.719 -4.598 20.148 1.00 27.12 C ATOM 1476 C LEU A 920 22.888 -3.682 20.514 1.00 28.41 C ATOM 1477 O LEU A 920 23.498 -3.004 19.636 1.00 26.50 O ATOM 1478 CB LEU A 920 22.278 -5.984 19.796 1.00 24.48 C ATOM 1479 CG LEU A 920 21.281 -7.123 19.672 1.00 29.28 C ATOM 1480 CD1 LEU A 920 21.834 -8.240 18.787 1.00 28.97 C ATOM 1481 CD2 LEU A 920 20.883 -7.663 21.041 1.00 31.24 C ATOM 1482 H LEU A 920 21.405 -4.142 18.071 1.00 0.00 H ATOM 1483 N LEU A 921 23.209 -3.681 21.811 1.00 24.93 N ATOM 1484 CA LEU A 921 24.506 -3.244 22.309 1.00 24.71 C ATOM 1485 C LEU A 921 25.238 -4.466 22.870 1.00 26.61 C ATOM 1486 O LEU A 921 24.770 -5.147 23.786 1.00 26.27 O ATOM 1487 CB LEU A 921 24.356 -2.157 23.368 1.00 26.27 C ATOM 1488 CG LEU A 921 23.986 -0.766 22.859 1.00 26.77 C ATOM 1489 CD1 LEU A 921 23.461 0.128 23.986 1.00 29.79 C ATOM 1490 CD2 LEU A 921 25.186 -0.101 22.178 1.00 27.95 C ATOM 1491 H LEU A 921 22.499 -4.008 22.497 1.00 0.00 H ATOM 1492 N GLY A 922 26.444 -4.685 22.368 1.00 25.86 N ATOM 1493 CA GLY A 922 27.311 -5.733 22.885 1.00 26.00 C ATOM 1494 C GLY A 922 28.575 -5.135 23.459 1.00 27.43 C ATOM 1495 O GLY A 922 29.124 -4.195 22.901 1.00 26.25 O ATOM 1496 H GLY A 922 26.780 -4.092 21.583 1.00 0.00 H ATOM 1497 N GLU A 923 29.060 -5.743 24.537 1.00 25.00 N ATOM 1498 CA GLU A 923 30.407 -5.537 24.995 1.00 24.39 C ATOM 1499 C GLU A 923 31.259 -6.446 24.111 1.00 26.96 C ATOM 1500 O GLU A 923 31.072 -7.662 24.138 1.00 26.69 O ATOM 1501 CB GLU A 923 30.532 -5.922 26.464 1.00 26.48 C ATOM 1502 CG GLU A 923 31.966 -5.985 26.970 1.00 28.57 C ATOM 1503 CD GLU A 923 32.123 -6.507 28.393 1.00 31.39 C ATOM 1504 OE1 GLU A 923 31.090 -6.727 29.081 1.00 30.15 O ATOM 1505 OE2 GLU A 923 33.285 -6.729 28.808 1.00 30.73 O ATOM 1506 H GLU A 923 28.443 -6.391 25.068 1.00 0.00 H ATOM 1507 N VAL A 924 32.200 -5.868 23.386 1.00 23.84 N ATOM 1508 CA VAL A 924 33.044 -6.604 22.446 1.00 23.39 C ATOM 1509 C VAL A 924 34.484 -6.516 22.940 1.00 27.29 C ATOM 1510 O VAL A 924 34.986 -5.427 23.135 1.00 25.81 O ATOM 1511 CB VAL A 924 32.918 -6.066 21.010 1.00 25.23 C ATOM 1512 CG1 VAL A 924 33.685 -6.943 20.046 1.00 26.12 C ATOM 1513 CG2 VAL A 924 31.457 -5.950 20.584 1.00 26.93 C ATOM 1514 H VAL A 924 32.347 -4.844 23.488 1.00 0.00 H ATOM 1515 N ALA A 925 35.128 -7.671 23.118 1.00 25.25 N ATOM 1516 CA ALA A 925 36.507 -7.744 23.587 1.00 26.12 C ATOM 1517 C ALA A 925 37.440 -7.602 22.376 1.00 26.10 C ATOM 1518 O ALA A 925 37.762 -8.569 21.709 1.00 30.48 O ATOM 1519 CB ALA A 925 36.735 -9.024 24.378 1.00 28.28 C ATOM 1520 H ALA A 925 34.625 -8.558 22.913 1.00 0.00 H ATOM 1521 N LEU A 926 37.848 -6.361 22.082 1.00 27.35 N ATOM 1522 CA LEU A 926 38.600 -6.049 20.879 1.00 26.07 C ATOM 1523 C LEU A 926 40.112 -6.265 21.042 1.00 26.72 C ATOM 1524 O LEU A 926 40.799 -6.516 20.044 1.00 28.04 O ATOM 1525 CB LEU A 926 38.334 -4.594 20.478 1.00 25.76 C ATOM 1526 CG LEU A 926 36.896 -4.244 20.107 1.00 26.84 C ATOM 1527 CD1 LEU A 926 36.726 -2.731 20.039 1.00 29.88 C ATOM 1528 CD2 LEU A 926 36.497 -4.902 18.782 1.00 29.00 C ATOM 1529 H LEU A 926 37.617 -5.590 22.741 1.00 0.00 H ATOM 1530 N GLY A 927 40.655 -6.072 22.261 1.00 27.22 N ATOM 1531 CA GLY A 927 42.066 -6.211 22.498 1.00 28.47 C ATOM 1532 C GLY A 927 42.885 -5.370 21.531 1.00 28.47 C ATOM 1533 O GLY A 927 42.584 -4.206 21.283 1.00 30.71 O ATOM 1534 H GLY A 927 40.034 -5.815 23.054 1.00 0.00 H ATOM 1535 N ASN A 928 43.909 -5.971 20.935 1.00 28.97 N ATOM 1536 CA ASN A 928 44.765 -5.245 19.981 1.00 29.04 C ATOM 1537 C ASN A 928 44.084 -5.285 18.615 1.00 29.02 C ATOM 1538 O ASN A 928 43.863 -6.372 18.054 1.00 27.57 O ATOM 1539 CB ASN A 928 46.156 -5.858 19.915 1.00 30.13 C ATOM 1540 CG ASN A 928 46.954 -5.683 21.197 1.00 36.94 C ATOM 1541 OD1 ASN A 928 46.812 -4.682 21.916 1.00 34.56 O ATOM 1542 ND2 ASN A 928 47.809 -6.648 21.494 1.00 42.29 N ATOM 1543 HD22 ASN A 928 47.901 -7.473 20.867 1.00 0.00 H ATOM 1544 HD21 ASN A 928 48.389 -6.582 22.355 1.00 0.00 H ATOM 1545 H ASN A 928 44.109 -6.970 21.145 1.00 0.00 H ATOM 1546 N MET A 929 43.718 -4.121 18.076 1.00 26.87 N ATOM 1547 CA MET A 929 42.993 -4.053 16.806 1.00 28.13 C ATOM 1548 C MET A 929 43.942 -3.968 15.600 1.00 28.57 C ATOM 1549 O MET A 929 44.914 -3.237 15.616 1.00 28.16 O ATOM 1550 CB MET A 929 42.065 -2.840 16.785 1.00 26.85 C ATOM 1551 CG MET A 929 41.080 -2.859 17.944 1.00 28.01 C ATOM 1552 SD MET A 929 39.972 -1.441 18.025 1.00 29.33 S ATOM 1553 CE MET A 929 41.102 -0.073 18.243 1.00 33.33 C ATOM 1554 H MET A 929 43.954 -3.238 18.572 1.00 0.00 H ATOM 1555 N TYR A 930 43.656 -4.789 14.587 1.00 26.35 N ATOM 1556 CA TYR A 930 44.267 -4.730 13.281 1.00 28.84 C ATOM 1557 C TYR A 930 43.503 -3.687 12.459 1.00 27.14 C ATOM 1558 O TYR A 930 42.368 -3.951 12.037 1.00 25.71 O ATOM 1559 CB TYR A 930 44.265 -6.115 12.618 1.00 27.21 C ATOM 1560 CG TYR A 930 45.031 -6.249 11.326 1.00 27.32 C ATOM 1561 CD1 TYR A 930 46.160 -5.487 11.039 1.00 27.87 C ATOM 1562 CD2 TYR A 930 44.720 -7.263 10.427 1.00 28.59 C ATOM 1563 CE1 TYR A 930 46.901 -5.683 9.888 1.00 28.64 C ATOM 1564 CE2 TYR A 930 45.456 -7.473 9.276 1.00 28.99 C ATOM 1565 CZ TYR A 930 46.557 -6.685 9.001 1.00 31.91 C ATOM 1566 OH TYR A 930 47.288 -6.900 7.875 1.00 32.16 O ATOM 1567 HH TYR A 930 47.652 -7.821 7.890 1.00 0.00 H ATOM 1568 H TYR A 930 42.940 -5.525 14.751 1.00 0.00 H ATOM 1569 N GLU A 931 44.096 -2.498 12.276 1.00 26.27 N ATOM 1570 CA GLU A 931 43.359 -1.332 11.771 1.00 25.99 C ATOM 1571 C GLU A 931 43.530 -1.201 10.262 1.00 26.52 C ATOM 1572 O GLU A 931 44.646 -1.046 9.780 1.00 29.47 O ATOM 1573 CB GLU A 931 43.783 -0.055 12.517 1.00 29.23 C ATOM 1574 CG GLU A 931 43.482 -0.123 14.009 1.00 30.45 C ATOM 1575 CD GLU A 931 43.612 1.167 14.819 1.00 37.50 C ATOM 1576 OE1 GLU A 931 44.079 2.154 14.270 1.00 34.18 O ATOM 1577 OE2 GLU A 931 43.209 1.173 16.002 1.00 47.15 O ATOM 1578 H GLU A 931 45.107 -2.399 12.498 1.00 0.00 H ATOM 1579 N LEU A 932 42.423 -1.307 9.512 1.00 27.00 N ATOM 1580 CA LEU A 932 42.491 -1.325 8.048 1.00 28.04 C ATOM 1581 C LEU A 932 41.540 -0.281 7.445 1.00 26.88 C ATOM 1582 O LEU A 932 40.591 0.175 8.101 1.00 29.21 O ATOM 1583 CB LEU A 932 42.116 -2.725 7.553 1.00 28.02 C ATOM 1584 CG LEU A 932 42.991 -3.889 8.023 1.00 31.25 C ATOM 1585 CD1 LEU A 932 42.402 -5.205 7.529 1.00 33.71 C ATOM 1586 CD2 LEU A 932 44.408 -3.746 7.499 1.00 32.68 C ATOM 1587 H LEU A 932 41.497 -1.378 9.979 1.00 0.00 H ATOM 1588 N LYS A 933 41.846 0.108 6.203 1.00 27.21 N ATOM 1589 CA LYS A 933 41.168 1.207 5.515 1.00 28.82 C ATOM 1590 C LYS A 933 40.513 0.782 4.198 1.00 34.31 C ATOM 1591 O LYS A 933 39.729 1.534 3.654 1.00 34.96 O ATOM 1592 CB LYS A 933 42.185 2.318 5.245 1.00 33.41 C ATOM 1593 CG LYS A 933 42.715 2.923 6.528 1.00 34.73 C ATOM 1594 CD LYS A 933 43.417 4.235 6.335 1.00 38.52 C ATOM 1595 CE LYS A 933 44.721 4.132 5.591 1.00 38.54 C ATOM 1596 NZ LYS A 933 45.314 5.480 5.396 1.00 39.26 N ATOM 1597 HZ1 LYS A 933 44.656 6.071 4.848 1.00 0.00 H ATOM 1598 HZ2 LYS A 933 45.486 5.919 6.323 1.00 0.00 H ATOM 1599 HZ3 LYS A 933 46.213 5.391 4.881 1.00 0.00 H ATOM 1600 H LYS A 933 42.604 -0.396 5.700 1.00 0.00 H ATOM 1601 N HIS A 934 40.832 -0.413 3.708 1.00 31.52 N ATOM 1602 CA HIS A 934 40.320 -0.906 2.430 1.00 32.60 C ATOM 1603 C HIS A 934 40.018 -2.384 2.607 1.00 31.33 C ATOM 1604 O HIS A 934 40.637 -3.049 3.433 1.00 32.75 O ATOM 1605 CB HIS A 934 41.315 -0.716 1.288 1.00 35.88 C ATOM 1606 CG HIS A 934 41.740 0.698 1.108 1.00 37.87 C ATOM 1607 ND1 HIS A 934 40.863 1.660 0.646 1.00 40.17 N ATOM 1608 CD2 HIS A 934 42.900 1.323 1.409 1.00 40.80 C ATOM 1609 CE1 HIS A 934 41.495 2.818 0.595 1.00 44.71 C ATOM 1610 NE2 HIS A 934 42.747 2.642 1.072 1.00 42.00 N ATOM 1611 H HIS A 934 41.472 -1.022 4.257 1.00 0.00 H ATOM 1612 N ALA A 935 39.066 -2.871 1.814 1.00 33.53 N ATOM 1613 CA ALA A 935 38.557 -4.207 1.948 1.00 33.86 C ATOM 1614 C ALA A 935 39.707 -5.206 1.808 1.00 30.63 C ATOM 1615 O ALA A 935 40.550 -5.101 0.932 1.00 32.96 O ATOM 1616 CB ALA A 935 37.496 -4.465 0.908 1.00 36.81 C ATOM 1617 H ALA A 935 38.676 -2.260 1.068 1.00 0.00 H ATOM 1618 N SER A 936 39.667 -6.213 2.680 1.00 31.82 N ATOM 1619 CA SER A 936 40.709 -7.199 2.752 1.00 36.49 C ATOM 1620 C SER A 936 40.141 -8.418 3.478 1.00 35.35 C ATOM 1621 O SER A 936 39.811 -8.309 4.654 1.00 37.33 O ATOM 1622 CB SER A 936 41.908 -6.637 3.486 1.00 38.76 C ATOM 1623 OG SER A 936 42.982 -7.561 3.418 1.00 47.87 O ATOM 1624 HG SER A 936 43.765 -7.191 3.899 1.00 0.00 H ATOM 1625 H SER A 936 38.857 -6.287 3.328 1.00 0.00 H ATOM 1626 N HIS A 937 40.036 -9.549 2.781 1.00 37.43 N ATOM 1627 CA HIS A 937 39.470 -10.724 3.418 1.00 41.30 C ATOM 1628 C HIS A 937 40.598 -11.531 4.073 1.00 41.20 C ATOM 1629 O HIS A 937 41.109 -12.434 3.491 1.00 43.33 O ATOM 1630 CB HIS A 937 38.672 -11.534 2.396 1.00 44.56 C ATOM 1631 CG HIS A 937 37.503 -10.796 1.836 1.00 45.75 C ATOM 1632 ND1 HIS A 937 36.909 -11.166 0.642 1.00 54.20 N ATOM 1633 CD2 HIS A 937 36.865 -9.680 2.240 1.00 46.74 C ATOM 1634 CE1 HIS A 937 35.915 -10.342 0.385 1.00 48.94 C ATOM 1635 NE2 HIS A 937 35.879 -9.420 1.334 1.00 47.51 N ATOM 1636 H HIS A 937 40.356 -9.589 1.792 1.00 0.00 H ATOM 1637 N ILE A 938 40.954 -11.178 5.310 1.00 42.77 N ATOM 1638 CA ILE A 938 42.229 -11.635 5.879 1.00 45.51 C ATOM 1639 C ILE A 938 42.125 -13.125 6.246 1.00 42.32 C ATOM 1640 O ILE A 938 41.118 -13.555 6.777 1.00 40.98 O ATOM 1641 CB ILE A 938 42.626 -10.756 7.082 1.00 44.92 C ATOM 1642 CG1 ILE A 938 41.619 -10.855 8.228 1.00 45.59 C ATOM 1643 CG2 ILE A 938 42.823 -9.308 6.642 1.00 43.27 C ATOM 1644 CD1 ILE A 938 42.144 -10.295 9.526 1.00 47.21 C ATOM 1645 H ILE A 938 40.324 -10.574 5.876 1.00 0.00 H ATOM 1646 N SER A 939 43.191 -13.875 5.976 1.00 45.64 N ATOM 1647 CA SER A 939 43.203 -15.339 6.194 1.00 50.52 C ATOM 1648 C SER A 939 43.406 -15.674 7.682 1.00 49.95 C ATOM 1649 O SER A 939 43.024 -16.736 8.132 1.00 47.27 O ATOM 1650 CB SER A 939 44.232 -16.012 5.323 1.00 54.44 C ATOM 1651 OG SER A 939 45.506 -15.396 5.431 1.00 54.31 O ATOM 1652 HG SER A 939 46.150 -15.867 4.845 1.00 0.00 H ATOM 1653 H SER A 939 44.045 -13.417 5.599 1.00 0.00 H ATOM 1654 N LYS A 940 44.008 -14.754 8.443 1.00 42.44 N ATOM 1655 CA LYS A 940 44.369 -14.970 9.850 1.00 42.78 C ATOM 1656 C LYS A 940 44.653 -13.596 10.461 1.00 38.56 C ATOM 1657 O LYS A 940 45.069 -12.701 9.745 1.00 39.64 O ATOM 1658 CB LYS A 940 45.628 -15.839 9.937 1.00 50.37 C ATOM 1659 CG LYS A 940 46.883 -15.147 9.404 1.00 56.58 C ATOM 1660 CD LYS A 940 47.994 -16.052 8.923 1.00 63.06 C ATOM 1661 CE LYS A 940 48.966 -15.302 8.038 1.00 62.57 C ATOM 1662 NZ LYS A 940 50.186 -16.091 7.741 1.00 73.20 N ATOM 1663 HZ1 LYS A 940 50.673 -16.322 8.630 1.00 0.00 H ATOM 1664 HZ2 LYS A 940 49.919 -16.970 7.253 1.00 0.00 H ATOM 1665 HZ3 LYS A 940 50.818 -15.533 7.132 1.00 0.00 H ATOM 1666 H LYS A 940 44.233 -13.834 8.014 1.00 0.00 H ATOM 1667 N LEU A 941 44.423 -13.442 11.765 1.00 34.04 N ATOM 1668 CA LEU A 941 44.828 -12.230 12.438 1.00 34.18 C ATOM 1669 C LEU A 941 46.339 -12.286 12.635 1.00 34.42 C ATOM 1670 O LEU A 941 46.934 -13.332 12.920 1.00 34.79 O ATOM 1671 CB LEU A 941 44.109 -12.074 13.778 1.00 31.43 C ATOM 1672 CG LEU A 941 42.638 -11.705 13.702 1.00 34.93 C ATOM 1673 CD1 LEU A 941 41.948 -11.943 15.036 1.00 36.62 C ATOM 1674 CD2 LEU A 941 42.503 -10.268 13.270 1.00 36.66 C ATOM 1675 H LEU A 941 43.950 -14.198 12.300 1.00 0.00 H ATOM 1676 N PRO A 942 47.040 -11.159 12.449 1.00 31.09 N ATOM 1677 CA PRO A 942 48.454 -11.091 12.791 1.00 33.37 C ATOM 1678 C PRO A 942 48.706 -11.379 14.273 1.00 33.40 C ATOM 1679 O PRO A 942 47.809 -11.268 15.103 1.00 32.01 O ATOM 1680 CB PRO A 942 48.853 -9.636 12.487 1.00 33.43 C ATOM 1681 CG PRO A 942 47.798 -9.153 11.510 1.00 32.35 C ATOM 1682 CD PRO A 942 46.544 -9.891 11.887 1.00 29.53 C ATOM 1683 N LYS A 943 49.956 -11.747 14.547 1.00 37.50 N ATOM 1684 CA LYS A 943 50.434 -12.109 15.880 1.00 41.34 C ATOM 1685 C LYS A 943 50.101 -10.987 16.871 1.00 37.81 C ATOM 1686 O LYS A 943 50.416 -9.819 16.632 1.00 36.43 O ATOM 1687 CB LYS A 943 51.946 -12.327 15.821 1.00 45.97 C ATOM 1688 CG LYS A 943 52.594 -12.749 17.128 1.00 56.28 C ATOM 1689 CD LYS A 943 52.192 -14.128 17.593 1.00 62.38 C ATOM 1690 CE LYS A 943 52.993 -14.581 18.797 1.00 67.46 C ATOM 1691 NZ LYS A 943 52.727 -15.999 19.134 1.00 71.99 N ATOM 1692 HZ1 LYS A 943 51.717 -16.119 19.350 1.00 0.00 H ATOM 1693 HZ2 LYS A 943 52.984 -16.600 18.325 1.00 0.00 H ATOM 1694 HZ3 LYS A 943 53.294 -16.269 19.963 1.00 0.00 H ATOM 1695 H LYS A 943 50.637 -11.779 13.761 1.00 0.00 H ATOM 1696 N GLY A 944 49.424 -11.354 17.960 1.00 36.81 N ATOM 1697 CA GLY A 944 49.035 -10.414 19.025 1.00 37.76 C ATOM 1698 C GLY A 944 47.765 -9.620 18.753 1.00 35.34 C ATOM 1699 O GLY A 944 47.332 -8.860 19.632 1.00 37.05 O ATOM 1700 H GLY A 944 49.157 -12.354 18.062 1.00 0.00 H ATOM 1701 N LYS A 945 47.138 -9.759 17.570 1.00 31.03 N ATOM 1702 CA LYS A 945 45.930 -9.012 17.266 1.00 29.92 C ATOM 1703 C LYS A 945 44.695 -9.866 17.576 1.00 30.03 C ATOM 1704 O LYS A 945 44.732 -11.103 17.399 1.00 33.32 O ATOM 1705 CB LYS A 945 45.864 -8.602 15.794 1.00 28.34 C ATOM 1706 CG LYS A 945 46.967 -7.660 15.344 1.00 31.40 C ATOM 1707 CD LYS A 945 46.806 -6.306 15.948 1.00 31.44 C ATOM 1708 CE LYS A 945 47.695 -5.291 15.256 1.00 31.61 C ATOM 1709 NZ LYS A 945 47.650 -3.962 15.917 1.00 32.18 N ATOM 1710 HZ1 LYS A 945 46.675 -3.601 15.902 1.00 0.00 H ATOM 1711 HZ2 LYS A 945 47.971 -4.055 16.902 1.00 0.00 H ATOM 1712 HZ3 LYS A 945 48.273 -3.302 15.409 1.00 0.00 H ATOM 1713 H LYS A 945 47.526 -10.413 16.861 1.00 0.00 H ATOM 1714 N HIS A 946 43.653 -9.204 18.068 1.00 27.63 N ATOM 1715 CA HIS A 946 42.406 -9.888 18.516 1.00 28.66 C ATOM 1716 C HIS A 946 41.187 -9.568 17.651 1.00 29.26 C ATOM 1717 O HIS A 946 40.126 -10.177 17.821 1.00 28.22 O ATOM 1718 CB HIS A 946 42.139 -9.585 20.003 1.00 30.13 C ATOM 1719 CG HIS A 946 43.295 -9.869 20.900 1.00 33.66 C ATOM 1720 ND1 HIS A 946 44.229 -8.891 21.263 1.00 32.09 N ATOM 1721 CD2 HIS A 946 43.700 -11.012 21.514 1.00 36.19 C ATOM 1722 CE1 HIS A 946 45.152 -9.428 22.043 1.00 35.38 C ATOM 1723 NE2 HIS A 946 44.862 -10.743 22.204 1.00 38.81 N ATOM 1724 H HIS A 946 43.709 -8.168 18.144 1.00 0.00 H ATOM 1725 N SER A 947 41.254 -8.518 16.834 1.00 26.16 N ATOM 1726 CA SER A 947 40.096 -7.999 16.144 1.00 25.30 C ATOM 1727 C SER A 947 40.560 -7.132 14.967 1.00 24.85 C ATOM 1728 O SER A 947 41.747 -6.829 14.875 1.00 26.17 O ATOM 1729 CB SER A 947 39.212 -7.173 17.041 1.00 27.06 C ATOM 1730 OG SER A 947 39.911 -6.027 17.519 1.00 27.22 O ATOM 1731 HG SER A 947 40.707 -6.317 18.032 1.00 0.00 H ATOM 1732 H SER A 947 42.174 -8.055 16.688 1.00 0.00 H ATOM 1733 N VAL A 948 39.608 -6.789 14.093 1.00 24.33 N ATOM 1734 CA VAL A 948 39.862 -5.792 13.012 1.00 25.59 C ATOM 1735 C VAL A 948 39.013 -4.557 13.322 1.00 27.41 C ATOM 1736 O VAL A 948 37.848 -4.638 13.734 1.00 25.11 O ATOM 1737 CB VAL A 948 39.528 -6.366 11.620 1.00 26.19 C ATOM 1738 CG1 VAL A 948 39.341 -5.284 10.565 1.00 29.35 C ATOM 1739 CG2 VAL A 948 40.572 -7.371 11.199 1.00 27.79 C ATOM 1740 H VAL A 948 38.668 -7.228 14.168 1.00 0.00 H ATOM 1741 N LYS A 949 39.588 -3.386 13.058 1.00 25.92 N ATOM 1742 CA LYS A 949 38.847 -2.155 13.039 1.00 26.32 C ATOM 1743 C LYS A 949 39.017 -1.499 11.669 1.00 24.12 C ATOM 1744 O LYS A 949 40.140 -1.299 11.201 1.00 27.77 O ATOM 1745 CB LYS A 949 39.321 -1.155 14.092 1.00 25.98 C ATOM 1746 CG LYS A 949 38.517 0.139 14.098 1.00 27.13 C ATOM 1747 CD LYS A 949 39.093 1.191 15.021 1.00 27.54 C ATOM 1748 CE LYS A 949 38.293 2.477 14.998 1.00 31.88 C ATOM 1749 NZ LYS A 949 39.033 3.533 15.746 1.00 32.30 N ATOM 1750 HZ1 LYS A 949 39.171 3.227 16.730 1.00 0.00 H ATOM 1751 HZ2 LYS A 949 39.958 3.690 15.297 1.00 0.00 H ATOM 1752 HZ3 LYS A 949 38.484 4.416 15.731 1.00 0.00 H ATOM 1753 H LYS A 949 40.608 -3.361 12.859 1.00 0.00 H ATOM 1754 N GLY A 950 37.891 -1.254 10.989 1.00 24.51 N ATOM 1755 CA GLY A 950 37.904 -0.469 9.780 1.00 26.92 C ATOM 1756 C GLY A 950 37.840 1.001 10.135 1.00 27.56 C ATOM 1757 O GLY A 950 36.925 1.378 10.891 1.00 27.52 O ATOM 1758 H GLY A 950 36.990 -1.637 11.339 1.00 0.00 H ATOM 1759 N LEU A 951 38.790 1.815 9.633 1.00 26.33 N ATOM 1760 CA LEU A 951 38.850 3.250 9.993 1.00 28.38 C ATOM 1761 C LEU A 951 38.012 4.101 9.037 1.00 27.67 C ATOM 1762 O LEU A 951 38.314 4.202 7.871 1.00 30.33 O ATOM 1763 CB LEU A 951 40.296 3.746 9.952 1.00 28.32 C ATOM 1764 CG LEU A 951 41.313 3.014 10.822 1.00 30.48 C ATOM 1765 CD1 LEU A 951 42.691 3.675 10.709 1.00 32.23 C ATOM 1766 CD2 LEU A 951 40.866 2.932 12.245 1.00 31.61 C ATOM 1767 H LEU A 951 39.497 1.426 8.977 1.00 0.00 H ATOM 1768 N GLY A 952 37.015 4.797 9.591 1.00 26.43 N ATOM 1769 CA GLY A 952 36.182 5.713 8.871 1.00 27.81 C ATOM 1770 C GLY A 952 36.715 7.136 8.865 1.00 28.20 C ATOM 1771 O GLY A 952 37.587 7.525 9.663 1.00 29.78 O ATOM 1772 H GLY A 952 36.833 4.666 10.606 1.00 0.00 H ATOM 1773 N LYS A 953 36.104 7.946 7.990 1.00 29.98 N ATOM 1774 CA LYS A 953 36.332 9.405 7.909 1.00 31.20 C ATOM 1775 C LYS A 953 35.751 10.155 9.115 1.00 30.23 C ATOM 1776 O LYS A 953 36.184 11.322 9.368 1.00 29.77 O ATOM 1777 CB LYS A 953 35.668 9.967 6.648 1.00 36.13 C ATOM 1778 CG LYS A 953 36.200 9.421 5.332 1.00 43.26 C ATOM 1779 CD LYS A 953 37.565 9.917 4.996 1.00 43.73 C ATOM 1780 CE LYS A 953 37.598 11.379 4.617 1.00 51.32 C ATOM 1781 NZ LYS A 953 38.987 11.852 4.387 1.00 52.00 N ATOM 1782 HZ1 LYS A 953 39.544 11.725 5.256 1.00 0.00 H ATOM 1783 HZ2 LYS A 953 39.416 11.302 3.615 1.00 0.00 H ATOM 1784 HZ3 LYS A 953 38.971 12.859 4.129 1.00 0.00 H ATOM 1785 H LYS A 953 35.426 7.522 7.325 1.00 0.00 H ATOM 1786 N THR A 954 34.715 9.588 9.765 1.00 30.66 N ATOM 1787 CA THR A 954 34.054 10.188 10.903 1.00 30.78 C ATOM 1788 C THR A 954 34.125 9.234 12.104 1.00 31.07 C ATOM 1789 O THR A 954 33.991 8.027 11.932 1.00 31.06 O ATOM 1790 CB THR A 954 32.595 10.540 10.575 1.00 33.81 C ATOM 1791 OG1 THR A 954 32.591 11.570 9.592 1.00 36.32 O ATOM 1792 CG2 THR A 954 31.802 10.997 11.780 1.00 40.11 C ATOM 1793 HG1 THR A 954 33.054 11.249 8.778 1.00 0.00 H ATOM 1794 H THR A 954 34.371 8.666 9.429 1.00 0.00 H ATOM 1795 N THR A 955 34.361 9.807 13.293 1.00 30.62 N ATOM 1796 CA THR A 955 34.473 9.047 14.545 1.00 32.93 C ATOM 1797 C THR A 955 33.679 9.773 15.626 1.00 31.60 C ATOM 1798 O THR A 955 33.653 10.999 15.644 1.00 33.01 O ATOM 1799 CB THR A 955 35.946 8.890 14.957 1.00 33.57 C ATOM 1800 OG1 THR A 955 35.988 8.071 16.135 1.00 33.33 O ATOM 1801 CG2 THR A 955 36.653 10.193 15.239 1.00 31.96 C ATOM 1802 HG1 THR A 955 35.473 8.509 16.859 1.00 0.00 H ATOM 1803 H THR A 955 34.470 10.841 13.331 1.00 0.00 H ATOM 1804 N PRO A 956 33.046 9.057 16.584 1.00 30.18 N ATOM 1805 CA PRO A 956 32.624 9.699 17.831 1.00 30.84 C ATOM 1806 C PRO A 956 33.862 10.345 18.455 1.00 29.44 C ATOM 1807 O PRO A 956 34.955 9.789 18.368 1.00 33.48 O ATOM 1808 CB PRO A 956 32.106 8.545 18.705 1.00 32.07 C ATOM 1809 CG PRO A 956 31.766 7.461 17.713 1.00 29.82 C ATOM 1810 CD PRO A 956 32.721 7.630 16.545 1.00 30.36 C ATOM 1811 N ASP A 957 33.708 11.555 19.007 1.00 34.20 N ATOM 1812 CA ASP A 957 34.833 12.284 19.580 1.00 36.36 C ATOM 1813 C ASP A 957 35.439 11.470 20.723 1.00 36.92 C ATOM 1814 O ASP A 957 34.773 11.225 21.722 1.00 37.21 O ATOM 1815 CB ASP A 957 34.387 13.672 20.020 1.00 38.82 C ATOM 1816 CG ASP A 957 35.492 14.551 20.587 1.00 43.61 C ATOM 1817 OD1 ASP A 957 36.611 14.052 20.820 1.00 42.29 O ATOM 1818 OD2 ASP A 957 35.226 15.738 20.755 1.00 49.02 O ATOM 1819 H ASP A 957 32.762 11.986 19.028 1.00 0.00 H ATOM 1820 N PRO A 958 36.708 11.005 20.626 1.00 40.47 N ATOM 1821 CA PRO A 958 37.267 10.132 21.665 1.00 45.82 C ATOM 1822 C PRO A 958 37.415 10.796 23.041 1.00 47.22 C ATOM 1823 O PRO A 958 37.388 10.117 24.062 1.00 44.35 O ATOM 1824 CB PRO A 958 38.640 9.687 21.142 1.00 45.28 C ATOM 1825 CG PRO A 958 38.684 10.129 19.691 1.00 49.38 C ATOM 1826 CD PRO A 958 37.631 11.204 19.503 1.00 43.90 C ATOM 1827 N SER A 959 37.516 12.130 23.072 1.00 46.02 N ATOM 1828 CA SER A 959 37.588 12.853 24.328 1.00 48.72 C ATOM 1829 C SER A 959 36.339 12.603 25.184 1.00 47.57 C ATOM 1830 O SER A 959 36.370 12.826 26.384 1.00 50.23 O ATOM 1831 CB SER A 959 37.790 14.337 24.077 1.00 51.87 C ATOM 1832 OG SER A 959 36.559 14.943 23.701 1.00 60.21 O ATOM 1833 HG SER A 959 36.222 14.517 22.874 1.00 0.00 H ATOM 1834 H SER A 959 37.543 12.660 22.177 1.00 0.00 H ATOM 1835 N ALA A 960 35.238 12.147 24.570 1.00 45.17 N ATOM 1836 CA ALA A 960 33.945 12.031 25.244 1.00 42.35 C ATOM 1837 C ALA A 960 33.669 10.595 25.720 1.00 39.89 C ATOM 1838 O ALA A 960 32.607 10.342 26.304 1.00 41.54 O ATOM 1839 CB ALA A 960 32.839 12.508 24.332 1.00 42.21 C ATOM 1840 H ALA A 960 35.306 11.864 23.572 1.00 0.00 H ATOM 1841 N ASN A 961 34.592 9.659 25.464 1.00 36.97 N ATOM 1842 CA ASN A 961 34.404 8.269 25.928 1.00 37.49 C ATOM 1843 C ASN A 961 34.139 8.284 27.442 1.00 35.50 C ATOM 1844 O ASN A 961 34.746 9.074 28.190 1.00 38.05 O ATOM 1845 CB ASN A 961 35.619 7.383 25.645 1.00 37.40 C ATOM 1846 CG ASN A 961 35.839 7.041 24.189 1.00 43.38 C ATOM 1847 OD1 ASN A 961 35.049 7.380 23.318 1.00 38.42 O ATOM 1848 ND2 ASN A 961 36.941 6.364 23.913 1.00 43.33 N ATOM 1849 HD22 ASN A 961 37.590 6.092 24.679 1.00 0.00 H ATOM 1850 HD21 ASN A 961 37.159 6.103 22.930 1.00 0.00 H ATOM 1851 H ASN A 961 35.450 9.913 24.933 1.00 0.00 H ATOM 1852 N ILE A 962 33.197 7.449 27.894 1.00 36.95 N ATOM 1853 CA ILE A 962 32.957 7.189 29.311 1.00 37.72 C ATOM 1854 C ILE A 962 33.007 5.682 29.543 1.00 37.90 C ATOM 1855 O ILE A 962 33.044 4.927 28.599 1.00 38.09 O ATOM 1856 CB ILE A 962 31.632 7.803 29.797 1.00 40.55 C ATOM 1857 CG1 ILE A 962 30.414 7.258 29.065 1.00 40.11 C ATOM 1858 CG2 ILE A 962 31.694 9.318 29.698 1.00 45.10 C ATOM 1859 CD1 ILE A 962 29.804 6.035 29.702 1.00 44.47 C ATOM 1860 H ILE A 962 32.602 6.957 27.197 1.00 0.00 H ATOM 1861 N SER A 963 33.010 5.306 30.823 1.00 40.00 N ATOM 1862 CA SER A 963 33.081 3.919 31.273 1.00 41.56 C ATOM 1863 C SER A 963 31.727 3.528 31.867 1.00 39.89 C ATOM 1864 O SER A 963 31.226 4.216 32.740 1.00 42.33 O ATOM 1865 CB SER A 963 34.205 3.795 32.283 1.00 46.54 C ATOM 1866 OG SER A 963 34.411 2.450 32.661 1.00 58.29 O ATOM 1867 HG SER A 963 33.582 2.092 33.067 1.00 0.00 H ATOM 1868 H SER A 963 32.958 6.050 31.548 1.00 0.00 H ATOM 1869 N LEU A 964 31.143 2.424 31.391 1.00 37.30 N ATOM 1870 CA LEU A 964 29.927 1.869 31.963 1.00 37.32 C ATOM 1871 C LEU A 964 30.246 0.440 32.416 1.00 37.74 C ATOM 1872 O LEU A 964 30.453 -0.449 31.579 1.00 35.23 O ATOM 1873 CB LEU A 964 28.790 1.894 30.936 1.00 36.19 C ATOM 1874 CG LEU A 964 27.468 1.269 31.389 1.00 39.77 C ATOM 1875 CD1 LEU A 964 26.883 1.993 32.593 1.00 45.50 C ATOM 1876 CD2 LEU A 964 26.452 1.225 30.251 1.00 38.04 C ATOM 1877 H LEU A 964 31.576 1.942 30.578 1.00 0.00 H ATOM 1878 N ASP A 965 30.330 0.249 33.736 1.00 41.37 N ATOM 1879 CA ASP A 965 30.594 -1.076 34.302 1.00 42.97 C ATOM 1880 C ASP A 965 31.896 -1.647 33.726 1.00 39.89 C ATOM 1881 O ASP A 965 31.978 -2.838 33.395 1.00 40.75 O ATOM 1882 CB ASP A 965 29.422 -2.013 34.012 1.00 44.25 C ATOM 1883 CG ASP A 965 28.157 -1.605 34.745 1.00 58.26 C ATOM 1884 OD1 ASP A 965 28.269 -1.170 35.915 1.00 64.33 O ATOM 1885 OD2 ASP A 965 27.070 -1.731 34.149 1.00 59.73 O ATOM 1886 H ASP A 965 30.205 1.059 34.376 1.00 0.00 H ATOM 1887 N GLY A 966 32.914 -0.796 33.598 1.00 40.80 N ATOM 1888 CA GLY A 966 34.249 -1.229 33.151 1.00 42.66 C ATOM 1889 C GLY A 966 34.394 -1.340 31.637 1.00 38.11 C ATOM 1890 O GLY A 966 35.469 -1.669 31.154 1.00 39.69 O ATOM 1891 H GLY A 966 32.760 0.208 33.821 1.00 0.00 H ATOM 1892 N VAL A 967 33.342 -1.013 30.878 1.00 32.91 N ATOM 1893 CA VAL A 967 33.355 -1.086 29.402 1.00 32.49 C ATOM 1894 C VAL A 967 33.332 0.340 28.828 1.00 34.18 C ATOM 1895 O VAL A 967 32.587 1.172 29.288 1.00 31.25 O ATOM 1896 CB VAL A 967 32.144 -1.879 28.899 1.00 30.97 C ATOM 1897 CG1 VAL A 967 32.120 -2.015 27.382 1.00 30.52 C ATOM 1898 CG2 VAL A 967 32.062 -3.251 29.570 1.00 31.32 C ATOM 1899 H VAL A 967 32.473 -0.692 31.350 1.00 0.00 H ATOM 1900 N ASP A 968 34.147 0.587 27.812 1.00 31.85 N ATOM 1901 CA ASP A 968 34.233 1.912 27.179 1.00 32.70 C ATOM 1902 C ASP A 968 33.001 2.147 26.299 1.00 29.18 C ATOM 1903 O ASP A 968 32.635 1.280 25.477 1.00 30.14 O ATOM 1904 CB ASP A 968 35.530 2.016 26.377 1.00 32.86 C ATOM 1905 CG ASP A 968 36.791 1.893 27.232 1.00 41.83 C ATOM 1906 OD1 ASP A 968 36.829 2.491 28.322 1.00 44.23 O ATOM 1907 OD2 ASP A 968 37.725 1.161 26.817 1.00 41.48 O ATOM 1908 H ASP A 968 34.746 -0.182 27.450 1.00 0.00 H ATOM 1909 N VAL A 969 32.411 3.343 26.418 1.00 28.55 N ATOM 1910 CA VAL A 969 31.267 3.707 25.609 1.00 27.49 C ATOM 1911 C VAL A 969 31.624 4.933 24.777 1.00 29.24 C ATOM 1912 O VAL A 969 31.770 6.012 25.329 1.00 31.35 O ATOM 1913 CB VAL A 969 30.027 3.979 26.472 1.00 29.57 C ATOM 1914 CG1 VAL A 969 28.812 4.273 25.596 1.00 30.89 C ATOM 1915 CG2 VAL A 969 29.737 2.832 27.446 1.00 31.49 C ATOM 1916 H VAL A 969 32.783 4.027 27.108 1.00 0.00 H ATOM 1917 N PRO A 970 31.742 4.789 23.446 1.00 29.65 N ATOM 1918 CA PRO A 970 32.115 5.919 22.596 1.00 32.33 C ATOM 1919 C PRO A 970 30.929 6.786 22.154 1.00 33.45 C ATOM 1920 O PRO A 970 30.538 6.724 20.997 1.00 33.04 O ATOM 1921 CB PRO A 970 32.760 5.199 21.416 1.00 31.26 C ATOM 1922 CG PRO A 970 31.992 3.910 21.278 1.00 31.70 C ATOM 1923 CD PRO A 970 31.647 3.515 22.707 1.00 29.32 C ATOM 1924 N LEU A 971 30.367 7.550 23.092 1.00 33.33 N ATOM 1925 CA LEU A 971 29.098 8.258 22.847 1.00 35.88 C ATOM 1926 C LEU A 971 29.351 9.730 22.483 1.00 35.50 C ATOM 1927 O LEU A 971 28.433 10.532 22.508 1.00 39.16 O ATOM 1928 CB LEU A 971 28.152 8.095 24.045 1.00 36.53 C ATOM 1929 CG LEU A 971 28.717 8.346 25.442 1.00 35.78 C ATOM 1930 CD1 LEU A 971 29.284 9.751 25.574 1.00 37.87 C ATOM 1931 CD2 LEU A 971 27.631 8.102 26.494 1.00 38.41 C ATOM 1932 H LEU A 971 30.834 7.648 24.016 1.00 0.00 H ATOM 1933 N GLY A 972 30.595 10.071 22.113 1.00 36.80 N ATOM 1934 CA GLY A 972 30.910 11.428 21.593 1.00 35.85 C ATOM 1935 C GLY A 972 30.147 11.738 20.309 1.00 36.46 C ATOM 1936 O GLY A 972 29.804 10.820 19.551 1.00 34.98 O ATOM 1937 H GLY A 972 31.358 9.369 22.192 1.00 0.00 H ATOM 1938 N THR A 973 29.854 13.024 20.053 1.00 40.21 N ATOM 1939 CA THR A 973 29.277 13.399 18.751 1.00 40.24 C ATOM 1940 C THR A 973 30.318 13.127 17.660 1.00 39.66 C ATOM 1941 O THR A 973 31.536 13.146 17.907 1.00 36.80 O ATOM 1942 CB THR A 973 28.704 14.828 18.700 1.00 44.78 C ATOM 1943 OG1 THR A 973 29.745 15.778 18.891 1.00 51.82 O ATOM 1944 CG2 THR A 973 27.624 15.063 19.731 1.00 47.05 C ATOM 1945 HG1 THR A 973 30.169 15.628 19.773 1.00 0.00 H ATOM 1946 H THR A 973 30.034 13.753 20.773 1.00 0.00 H ATOM 1947 N GLY A 974 29.818 12.820 16.464 1.00 39.56 N ATOM 1948 CA GLY A 974 30.655 12.515 15.322 1.00 41.23 C ATOM 1949 C GLY A 974 31.514 13.698 14.916 1.00 38.44 C ATOM 1950 O GLY A 974 31.031 14.827 14.735 1.00 40.58 O ATOM 1951 H GLY A 974 28.785 12.798 16.346 1.00 0.00 H ATOM 1952 N ILE A 975 32.821 13.453 14.721 1.00 36.94 N ATOM 1953 CA ILE A 975 33.762 14.443 14.242 1.00 36.29 C ATOM 1954 C ILE A 975 34.629 13.816 13.146 1.00 34.63 C ATOM 1955 O ILE A 975 34.690 12.613 13.012 1.00 33.01 O ATOM 1956 CB ILE A 975 34.648 15.017 15.368 1.00 39.94 C ATOM 1957 CG1 ILE A 975 35.552 13.949 15.996 1.00 36.93 C ATOM 1958 CG2 ILE A 975 33.797 15.728 16.408 1.00 44.82 C ATOM 1959 CD1 ILE A 975 36.590 14.514 16.929 1.00 38.33 C ATOM 1960 H ILE A 975 33.177 12.497 14.926 1.00 0.00 H ATOM 1961 N SER A 976 35.311 14.669 12.388 1.00 35.93 N ATOM 1962 CA SER A 976 36.297 14.213 11.423 1.00 35.83 C ATOM 1963 C SER A 976 37.390 13.432 12.172 1.00 36.18 C ATOM 1964 O SER A 976 37.934 13.915 13.156 1.00 36.00 O ATOM 1965 CB SER A 976 36.924 15.338 10.647 1.00 42.68 C ATOM 1966 OG SER A 976 37.924 14.793 9.787 1.00 41.88 O ATOM 1967 HG SER A 976 37.506 14.145 9.166 1.00 0.00 H ATOM 1968 H SER A 976 35.134 15.689 12.488 1.00 0.00 H ATOM 1969 N SER A 977 37.704 12.235 11.675 1.00 33.61 N ATOM 1970 CA SER A 977 38.738 11.388 12.253 1.00 32.51 C ATOM 1971 C SER A 977 40.142 11.838 11.820 1.00 33.36 C ATOM 1972 O SER A 977 41.132 11.441 12.413 1.00 34.57 O ATOM 1973 CB SER A 977 38.496 9.966 11.838 1.00 31.12 C ATOM 1974 OG SER A 977 38.789 9.804 10.465 1.00 31.18 O ATOM 1975 HG SER A 977 38.626 8.863 10.203 1.00 0.00 H ATOM 1976 H SER A 977 37.189 11.892 10.839 1.00 0.00 H ATOM 1977 N GLY A 978 40.232 12.584 10.725 1.00 31.27 N ATOM 1978 CA GLY A 978 41.472 12.947 10.110 1.00 32.32 C ATOM 1979 C GLY A 978 42.161 11.815 9.369 1.00 32.77 C ATOM 1980 O GLY A 978 43.352 11.960 8.966 1.00 35.91 O ATOM 1981 H GLY A 978 39.351 12.924 10.290 1.00 0.00 H ATOM 1982 N VAL A 979 41.462 10.701 9.176 1.00 31.31 N ATOM 1983 CA VAL A 979 41.965 9.618 8.359 1.00 31.11 C ATOM 1984 C VAL A 979 41.700 9.942 6.890 1.00 33.36 C ATOM 1985 O VAL A 979 40.578 10.282 6.528 1.00 36.30 O ATOM 1986 CB VAL A 979 41.313 8.294 8.757 1.00 30.20 C ATOM 1987 CG1 VAL A 979 41.758 7.170 7.820 1.00 30.95 C ATOM 1988 CG2 VAL A 979 41.603 7.926 10.206 1.00 29.36 C ATOM 1989 H VAL A 979 40.528 10.605 9.624 1.00 0.00 H ATOM 1990 N ASN A 980 42.743 9.822 6.066 1.00 34.67 N ATOM 1991 CA ASN A 980 42.624 9.980 4.612 1.00 39.17 C ATOM 1992 C ASN A 980 42.939 8.639 3.953 1.00 38.17 C ATOM 1993 O ASN A 980 43.522 7.757 4.596 1.00 36.92 O ATOM 1994 CB ASN A 980 43.540 11.095 4.111 1.00 41.90 C ATOM 1995 CG ASN A 980 43.104 12.454 4.620 1.00 48.02 C ATOM 1996 OD1 ASN A 980 43.914 13.232 5.122 1.00 61.44 O ATOM 1997 ND2 ASN A 980 41.826 12.748 4.494 1.00 48.40 N ATOM 1998 HD22 ASN A 980 41.174 12.061 4.063 1.00 0.00 H ATOM 1999 HD21 ASN A 980 41.469 13.667 4.825 1.00 0.00 H ATOM 2000 H ASN A 980 43.677 9.608 6.470 1.00 0.00 H ATOM 2001 N ASP A 981 42.510 8.484 2.699 1.00 40.30 N ATOM 2002 CA ASP A 981 42.771 7.281 1.893 1.00 42.86 C ATOM 2003 C ASP A 981 42.102 6.067 2.558 1.00 37.60 C ATOM 2004 O ASP A 981 42.797 5.118 2.951 1.00 39.89 O ATOM 2005 CB ASP A 981 44.270 7.014 1.733 1.00 47.82 C ATOM 2006 CG ASP A 981 44.589 5.793 0.881 1.00 56.57 C ATOM 2007 OD1 ASP A 981 43.877 5.572 -0.122 1.00 60.36 O ATOM 2008 OD2 ASP A 981 45.530 5.056 1.250 1.00 62.94 O ATOM 2009 H ASP A 981 41.961 9.255 2.268 1.00 0.00 H ATOM 2010 N THR A 982 40.783 6.162 2.775 1.00 36.23 N ATOM 2011 CA THR A 982 39.981 5.073 3.326 1.00 34.34 C ATOM 2012 C THR A 982 38.692 4.930 2.510 1.00 37.13 C ATOM 2013 O THR A 982 38.177 5.890 1.949 1.00 35.32 O ATOM 2014 CB THR A 982 39.633 5.270 4.811 1.00 33.56 C ATOM 2015 OG1 THR A 982 38.766 4.218 5.235 1.00 31.47 O ATOM 2016 CG2 THR A 982 38.960 6.596 5.097 1.00 35.18 C ATOM 2017 HG1 THR A 982 38.541 4.343 6.191 1.00 0.00 H ATOM 2018 H THR A 982 40.307 7.056 2.539 1.00 0.00 H ATOM 2019 N SER A 983 38.193 3.696 2.468 1.00 33.88 N ATOM 2020 CA SER A 983 36.963 3.346 1.800 1.00 34.25 C ATOM 2021 C SER A 983 35.724 3.546 2.691 1.00 34.72 C ATOM 2022 O SER A 983 34.605 3.398 2.191 1.00 36.00 O ATOM 2023 CB SER A 983 37.037 1.913 1.330 1.00 35.05 C ATOM 2024 OG SER A 983 38.001 1.782 0.313 1.00 39.08 O ATOM 2025 HG SER A 983 38.039 0.839 0.015 1.00 0.00 H ATOM 2026 H SER A 983 38.722 2.939 2.946 1.00 0.00 H ATOM 2027 N LEU A 984 35.883 3.904 3.972 1.00 29.92 N ATOM 2028 CA LEU A 984 34.762 3.911 4.925 1.00 29.79 C ATOM 2029 C LEU A 984 34.395 5.328 5.372 1.00 30.72 C ATOM 2030 O LEU A 984 35.275 6.102 5.750 1.00 30.45 O ATOM 2031 CB LEU A 984 35.138 3.085 6.161 1.00 33.53 C ATOM 2032 CG LEU A 984 35.179 1.575 5.976 1.00 32.40 C ATOM 2033 CD1 LEU A 984 35.841 0.915 7.163 1.00 36.23 C ATOM 2034 CD2 LEU A 984 33.762 1.025 5.798 1.00 39.26 C ATOM 2035 H LEU A 984 36.828 4.186 4.303 1.00 0.00 H ATOM 2036 N LEU A 985 33.100 5.636 5.388 1.00 29.51 N ATOM 2037 CA LEU A 985 32.619 6.908 5.990 1.00 33.66 C ATOM 2038 C LEU A 985 32.690 6.839 7.523 1.00 30.68 C ATOM 2039 O LEU A 985 32.929 7.861 8.184 1.00 32.42 O ATOM 2040 CB LEU A 985 31.191 7.218 5.520 1.00 34.51 C ATOM 2041 CG LEU A 985 31.045 7.525 4.036 1.00 37.86 C ATOM 2042 CD1 LEU A 985 29.581 7.706 3.670 1.00 43.40 C ATOM 2043 CD2 LEU A 985 31.850 8.761 3.659 1.00 42.09 C ATOM 2044 H LEU A 985 32.413 4.976 4.972 1.00 0.00 H ATOM 2045 N TYR A 986 32.427 5.655 8.096 1.00 27.88 N ATOM 2046 CA TYR A 986 32.321 5.433 9.552 1.00 28.19 C ATOM 2047 C TYR A 986 33.113 4.169 9.921 1.00 28.41 C ATOM 2048 O TYR A 986 33.323 3.255 9.085 1.00 28.61 O ATOM 2049 CB TYR A 986 30.845 5.347 9.986 1.00 28.27 C ATOM 2050 CG TYR A 986 30.012 6.486 9.450 1.00 30.00 C ATOM 2051 CD1 TYR A 986 30.165 7.766 9.964 1.00 31.66 C ATOM 2052 CD2 TYR A 986 29.135 6.326 8.389 1.00 31.69 C ATOM 2053 CE1 TYR A 986 29.499 8.853 9.424 1.00 33.61 C ATOM 2054 CE2 TYR A 986 28.455 7.405 7.842 1.00 32.61 C ATOM 2055 CZ TYR A 986 28.627 8.677 8.366 1.00 35.29 C ATOM 2056 OH TYR A 986 27.987 9.769 7.836 1.00 37.80 O ATOM 2057 HH TYR A 986 28.254 9.879 6.889 1.00 0.00 H ATOM 2058 H TYR A 986 32.288 4.836 7.471 1.00 0.00 H ATOM 2059 N ASN A 987 33.570 4.130 11.171 1.00 27.62 N ATOM 2060 CA ASN A 987 34.272 2.955 11.724 1.00 25.29 C ATOM 2061 C ASN A 987 33.397 1.693 11.627 1.00 26.97 C ATOM 2062 O ASN A 987 32.166 1.760 11.563 1.00 27.18 O ATOM 2063 CB ASN A 987 34.722 3.204 13.156 1.00 26.96 C ATOM 2064 CG ASN A 987 35.656 4.382 13.311 1.00 26.20 C ATOM 2065 OD1 ASN A 987 36.483 4.636 12.421 1.00 29.69 O ATOM 2066 ND2 ASN A 987 35.571 5.040 14.462 1.00 28.04 N ATOM 2067 HD22 ASN A 987 34.851 4.771 15.163 1.00 0.00 H ATOM 2068 HD21 ASN A 987 36.224 5.824 14.662 1.00 0.00 H ATOM 2069 H ASN A 987 33.427 4.960 11.782 1.00 0.00 H ATOM 2070 N GLU A 988 34.062 0.532 11.635 1.00 26.31 N ATOM 2071 CA GLU A 988 33.407 -0.742 11.975 1.00 26.29 C ATOM 2072 C GLU A 988 34.413 -1.642 12.681 1.00 25.29 C ATOM 2073 O GLU A 988 35.622 -1.440 12.589 1.00 26.94 O ATOM 2074 CB GLU A 988 32.742 -1.390 10.759 1.00 27.49 C ATOM 2075 CG GLU A 988 33.628 -1.571 9.560 1.00 28.85 C ATOM 2076 CD GLU A 988 32.834 -1.959 8.325 1.00 33.41 C ATOM 2077 OE1 GLU A 988 31.897 -1.207 7.920 1.00 32.00 O ATOM 2078 OE2 GLU A 988 33.164 -3.005 7.757 1.00 33.42 O ATOM 2079 H GLU A 988 35.074 0.529 11.393 1.00 0.00 H ATOM 2080 N TYR A 989 33.867 -2.617 13.427 1.00 24.88 N ATOM 2081 CA TYR A 989 34.657 -3.470 14.287 1.00 25.12 C ATOM 2082 C TYR A 989 34.246 -4.909 14.019 1.00 27.40 C ATOM 2083 O TYR A 989 33.062 -5.183 13.955 1.00 26.46 O ATOM 2084 CB TYR A 989 34.449 -3.097 15.749 1.00 24.35 C ATOM 2085 CG TYR A 989 34.712 -1.655 16.089 1.00 23.27 C ATOM 2086 CD1 TYR A 989 33.753 -0.685 15.870 1.00 25.45 C ATOM 2087 CD2 TYR A 989 35.897 -1.285 16.718 1.00 25.83 C ATOM 2088 CE1 TYR A 989 33.979 0.633 16.222 1.00 25.17 C ATOM 2089 CE2 TYR A 989 36.141 0.033 17.055 1.00 27.98 C ATOM 2090 CZ TYR A 989 35.181 0.994 16.793 1.00 26.75 C ATOM 2091 OH TYR A 989 35.427 2.286 17.188 1.00 29.58 O ATOM 2092 HH TYR A 989 34.659 2.858 16.937 1.00 0.00 H ATOM 2093 H TYR A 989 32.838 -2.764 13.384 1.00 0.00 H ATOM 2094 N ILE A 990 35.229 -5.788 13.848 1.00 23.20 N ATOM 2095 CA ILE A 990 34.997 -7.198 13.480 1.00 22.80 C ATOM 2096 C ILE A 990 35.743 -8.109 14.452 1.00 26.22 C ATOM 2097 O ILE A 990 36.969 -7.989 14.654 1.00 25.39 O ATOM 2098 CB ILE A 990 35.389 -7.482 12.025 1.00 26.46 C ATOM 2099 CG1 ILE A 990 34.655 -6.575 11.024 1.00 29.54 C ATOM 2100 CG2 ILE A 990 35.114 -8.943 11.687 1.00 28.24 C ATOM 2101 CD1 ILE A 990 35.215 -5.180 10.878 1.00 31.65 C ATOM 2102 H ILE A 990 36.209 -5.466 13.980 1.00 0.00 H ATOM 2103 N VAL A 991 35.032 -9.123 14.970 1.00 25.88 N ATOM 2104 CA VAL A 991 35.710 -10.197 15.676 1.00 26.94 C ATOM 2105 C VAL A 991 35.397 -11.504 14.939 1.00 26.88 C ATOM 2106 O VAL A 991 34.338 -11.606 14.299 1.00 27.58 O ATOM 2107 CB VAL A 991 35.326 -10.286 17.169 1.00 26.91 C ATOM 2108 CG1 VAL A 991 35.851 -9.087 17.942 1.00 26.65 C ATOM 2109 CG2 VAL A 991 33.837 -10.449 17.361 1.00 27.17 C ATOM 2110 H VAL A 991 33.997 -9.140 14.866 1.00 0.00 H ATOM 2111 N TYR A 992 36.287 -12.488 15.082 1.00 26.14 N ATOM 2112 CA TYR A 992 36.224 -13.726 14.318 1.00 26.84 C ATOM 2113 C TYR A 992 36.014 -14.945 15.244 1.00 30.33 C ATOM 2114 O TYR A 992 36.064 -16.073 14.775 1.00 32.24 O ATOM 2115 CB TYR A 992 37.481 -13.850 13.456 1.00 30.01 C ATOM 2116 CG TYR A 992 37.650 -12.732 12.461 1.00 29.13 C ATOM 2117 CD1 TYR A 992 37.010 -12.755 11.239 1.00 31.50 C ATOM 2118 CD2 TYR A 992 38.409 -11.628 12.774 1.00 32.08 C ATOM 2119 CE1 TYR A 992 37.150 -11.724 10.327 1.00 33.25 C ATOM 2120 CE2 TYR A 992 38.568 -10.583 11.875 1.00 32.40 C ATOM 2121 CZ TYR A 992 37.931 -10.627 10.646 1.00 34.96 C ATOM 2122 OH TYR A 992 38.080 -9.599 9.755 1.00 32.00 O ATOM 2123 HH TYR A 992 37.559 -9.795 8.936 1.00 0.00 H ATOM 2124 H TYR A 992 37.059 -12.365 15.768 1.00 0.00 H ATOM 2125 N ASP A 993 35.805 -14.705 16.542 1.00 28.61 N ATOM 2126 CA ASP A 993 35.547 -15.743 17.561 1.00 29.03 C ATOM 2127 C ASP A 993 34.267 -15.300 18.256 1.00 27.81 C ATOM 2128 O ASP A 993 34.222 -14.212 18.843 1.00 30.08 O ATOM 2129 CB ASP A 993 36.738 -15.905 18.521 1.00 32.21 C ATOM 2130 CG ASP A 993 36.554 -16.992 19.564 1.00 37.23 C ATOM 2131 OD1 ASP A 993 35.384 -17.355 19.862 1.00 34.13 O ATOM 2132 OD2 ASP A 993 37.578 -17.497 20.050 1.00 37.69 O ATOM 2133 H ASP A 993 35.826 -13.714 16.858 1.00 0.00 H ATOM 2134 N ILE A 994 33.221 -16.123 18.165 1.00 31.51 N ATOM 2135 CA ILE A 994 31.912 -15.768 18.676 1.00 30.24 C ATOM 2136 C ILE A 994 31.958 -15.524 20.197 1.00 30.63 C ATOM 2137 O ILE A 994 31.125 -14.764 20.717 1.00 29.91 O ATOM 2138 CB ILE A 994 30.856 -16.827 18.295 1.00 35.46 C ATOM 2139 CG1 ILE A 994 31.160 -18.203 18.892 1.00 37.55 C ATOM 2140 CG2 ILE A 994 30.679 -16.867 16.777 1.00 38.68 C ATOM 2141 CD1 ILE A 994 30.153 -19.273 18.531 1.00 45.34 C ATOM 2142 H ILE A 994 33.349 -17.050 17.712 1.00 0.00 H ATOM 2143 N ALA A 995 32.955 -16.084 20.887 1.00 28.92 N ATOM 2144 CA ALA A 995 33.077 -15.922 22.331 1.00 28.68 C ATOM 2145 C ALA A 995 33.527 -14.505 22.725 1.00 30.44 C ATOM 2146 O ALA A 995 33.420 -14.196 23.911 1.00 30.49 O ATOM 2147 CB ALA A 995 34.019 -16.928 22.921 1.00 32.87 C ATOM 2148 H ALA A 995 33.664 -16.651 20.380 1.00 0.00 H ATOM 2149 N GLN A 996 33.959 -13.658 21.768 1.00 27.47 N ATOM 2150 CA GLN A 996 34.451 -12.307 22.097 1.00 27.54 C ATOM 2151 C GLN A 996 33.301 -11.305 22.278 1.00 29.18 C ATOM 2152 O GLN A 996 33.553 -10.113 22.525 1.00 27.29 O ATOM 2153 CB GLN A 996 35.399 -11.786 21.007 1.00 28.70 C ATOM 2154 CG GLN A 996 36.789 -12.328 21.147 1.00 30.44 C ATOM 2155 CD GLN A 996 37.668 -11.975 19.981 1.00 31.20 C ATOM 2156 OE1 GLN A 996 37.767 -12.754 19.043 1.00 32.06 O ATOM 2157 NE2 GLN A 996 38.309 -10.810 20.063 1.00 27.31 N ATOM 2158 HE22 GLN A 996 38.174 -10.200 20.894 1.00 0.00 H ATOM 2159 HE21 GLN A 996 38.944 -10.511 19.296 1.00 0.00 H ATOM 2160 H GLN A 996 33.945 -13.965 20.774 1.00 0.00 H ATOM 2161 N VAL A 997 32.050 -11.757 22.156 1.00 25.84 N ATOM 2162 CA VAL A 997 30.865 -10.916 22.215 1.00 26.09 C ATOM 2163 C VAL A 997 30.061 -11.263 23.466 1.00 26.29 C ATOM 2164 O VAL A 997 29.681 -12.407 23.664 1.00 28.09 O ATOM 2165 CB VAL A 997 29.984 -11.091 20.960 1.00 26.92 C ATOM 2166 CG1 VAL A 997 28.762 -10.201 21.008 1.00 27.08 C ATOM 2167 CG2 VAL A 997 30.760 -10.878 19.665 1.00 28.30 C ATOM 2168 H VAL A 997 31.914 -12.778 22.009 1.00 0.00 H ATOM 2169 N ASN A 998 29.747 -10.233 24.254 1.00 26.09 N ATOM 2170 CA ASN A 998 28.834 -10.293 25.406 1.00 24.72 C ATOM 2171 C ASN A 998 27.645 -9.359 25.133 1.00 25.96 C ATOM 2172 O ASN A 998 27.701 -8.155 25.411 1.00 26.84 O ATOM 2173 CB ASN A 998 29.558 -9.891 26.700 1.00 27.22 C ATOM 2174 CG ASN A 998 28.615 -9.699 27.867 1.00 28.25 C ATOM 2175 OD1 ASN A 998 27.561 -10.343 27.884 1.00 29.00 O ATOM 2176 ND2 ASN A 998 28.989 -8.861 28.842 1.00 27.04 N ATOM 2177 HD22 ASN A 998 29.890 -8.347 28.769 1.00 0.00 H ATOM 2178 HD21 ASN A 998 28.378 -8.724 29.673 1.00 0.00 H ATOM 2179 H ASN A 998 30.183 -9.314 24.036 1.00 0.00 H ATOM 2180 N LEU A 999 26.573 -9.898 24.547 1.00 25.06 N ATOM 2181 CA LEU A 999 25.388 -9.081 24.291 1.00 23.76 C ATOM 2182 C LEU A 999 24.828 -8.614 25.629 1.00 26.35 C ATOM 2183 O LEU A 999 24.614 -9.444 26.564 1.00 25.61 O ATOM 2184 CB LEU A 999 24.373 -9.938 23.527 1.00 26.22 C ATOM 2185 CG LEU A 999 24.740 -10.274 22.087 1.00 26.75 C ATOM 2186 CD1 LEU A 999 23.648 -11.110 21.427 1.00 30.87 C ATOM 2187 CD2 LEU A 999 25.000 -9.014 21.286 1.00 27.55 C ATOM 2188 H LEU A 999 26.581 -10.901 24.272 1.00 0.00 H ATOM 2189 N LYS A1000 24.531 -7.311 25.722 1.00 25.21 N ATOM 2190 CA LYS A1000 24.217 -6.722 27.011 1.00 25.95 C ATOM 2191 C LYS A1000 22.891 -5.962 27.012 1.00 25.82 C ATOM 2192 O LYS A1000 22.183 -5.965 28.060 1.00 26.64 O ATOM 2193 CB LYS A1000 25.344 -5.777 27.454 1.00 29.16 C ATOM 2194 CG LYS A1000 25.320 -5.402 28.919 1.00 38.69 C ATOM 2195 CD LYS A1000 26.528 -4.602 29.405 1.00 36.36 C ATOM 2196 CE LYS A1000 27.836 -5.267 29.040 1.00 35.50 C ATOM 2197 NZ LYS A1000 28.848 -5.053 30.111 1.00 39.69 N ATOM 2198 HZ1 LYS A1000 29.010 -4.033 30.234 1.00 0.00 H ATOM 2199 HZ2 LYS A1000 28.499 -5.460 31.002 1.00 0.00 H ATOM 2200 HZ3 LYS A1000 29.739 -5.517 29.842 1.00 0.00 H ATOM 2201 H LYS A1000 24.525 -6.719 24.867 1.00 0.00 H ATOM 2202 N TYR A1001 22.596 -5.233 25.926 1.00 26.05 N ATOM 2203 CA TYR A1001 21.344 -4.502 25.857 1.00 26.61 C ATOM 2204 C TYR A1001 20.655 -4.734 24.510 1.00 28.14 C ATOM 2205 O TYR A1001 21.280 -4.985 23.490 1.00 26.03 O ATOM 2206 CB TYR A1001 21.516 -2.992 26.096 1.00 27.00 C ATOM 2207 CG TYR A1001 22.168 -2.599 27.394 1.00 25.86 C ATOM 2208 CD1 TYR A1001 21.444 -2.525 28.581 1.00 29.95 C ATOM 2209 CD2 TYR A1001 23.512 -2.291 27.441 1.00 27.80 C ATOM 2210 CE1 TYR A1001 22.040 -2.161 29.777 1.00 29.90 C ATOM 2211 CE2 TYR A1001 24.131 -1.935 28.627 1.00 29.80 C ATOM 2212 CZ TYR A1001 23.396 -1.885 29.802 1.00 29.27 C ATOM 2213 OH TYR A1001 23.998 -1.534 30.973 1.00 33.79 O ATOM 2214 HH TYR A1001 23.330 -1.550 31.704 1.00 0.00 H ATOM 2215 H TYR A1001 23.266 -5.191 25.131 1.00 0.00 H ATOM 2216 N LEU A1002 19.318 -4.658 24.550 1.00 26.43 N ATOM 2217 CA LEU A1002 18.463 -4.721 23.383 1.00 28.52 C ATOM 2218 C LEU A1002 17.528 -3.502 23.433 1.00 30.05 C ATOM 2219 O LEU A1002 16.865 -3.286 24.449 1.00 29.37 O ATOM 2220 CB LEU A1002 17.705 -6.053 23.459 1.00 30.03 C ATOM 2221 CG LEU A1002 16.700 -6.349 22.351 1.00 30.98 C ATOM 2222 CD1 LEU A1002 17.373 -6.400 20.993 1.00 30.03 C ATOM 2223 CD2 LEU A1002 15.987 -7.667 22.623 1.00 31.83 C ATOM 2224 H LEU A1002 18.865 -4.547 25.479 1.00 0.00 H ATOM 2225 N LEU A1003 17.502 -2.677 22.360 1.00 27.59 N ATOM 2226 CA LEU A1003 16.635 -1.505 22.304 1.00 29.31 C ATOM 2227 C LEU A1003 15.539 -1.715 21.258 1.00 30.12 C ATOM 2228 O LEU A1003 15.815 -2.196 20.157 1.00 30.80 O ATOM 2229 CB LEU A1003 17.428 -0.264 21.904 1.00 29.16 C ATOM 2230 CG LEU A1003 18.354 0.358 22.939 1.00 32.91 C ATOM 2231 CD1 LEU A1003 19.471 -0.562 23.336 1.00 34.07 C ATOM 2232 CD2 LEU A1003 18.920 1.661 22.386 1.00 33.38 C ATOM 2233 H LEU A1003 18.120 -2.885 21.550 1.00 0.00 H ATOM 2234 N LYS A1004 14.318 -1.287 21.598 1.00 29.77 N ATOM 2235 CA LYS A1004 13.225 -1.210 20.664 1.00 32.48 C ATOM 2236 C LYS A1004 13.167 0.245 20.185 1.00 35.33 C ATOM 2237 O LYS A1004 13.026 1.138 21.010 1.00 34.54 O ATOM 2238 CB LYS A1004 11.922 -1.643 21.334 1.00 37.06 C ATOM 2239 CG LYS A1004 10.706 -1.674 20.421 1.00 42.73 C ATOM 2240 CD LYS A1004 9.509 -2.277 21.168 1.00 46.69 C ATOM 2241 CE LYS A1004 8.144 -1.779 20.788 1.00 57.41 C ATOM 2242 NZ LYS A1004 7.129 -2.446 21.643 1.00 59.89 N ATOM 2243 HZ1 LYS A1004 7.179 -3.475 21.500 1.00 0.00 H ATOM 2244 HZ2 LYS A1004 7.318 -2.224 22.641 1.00 0.00 H ATOM 2245 HZ3 LYS A1004 6.181 -2.105 21.384 1.00 0.00 H ATOM 2246 H LYS A1004 14.151 -0.996 22.582 1.00 0.00 H ATOM 2247 N LEU A1005 13.391 0.457 18.883 1.00 34.41 N ATOM 2248 CA LEU A1005 13.534 1.799 18.285 1.00 37.00 C ATOM 2249 C LEU A1005 12.332 2.123 17.400 1.00 39.38 C ATOM 2250 O LEU A1005 11.922 1.285 16.618 1.00 39.34 O ATOM 2251 CB LEU A1005 14.760 1.832 17.379 1.00 40.33 C ATOM 2252 CG LEU A1005 16.103 1.665 18.060 1.00 42.32 C ATOM 2253 CD1 LEU A1005 17.200 1.706 17.013 1.00 48.69 C ATOM 2254 CD2 LEU A1005 16.297 2.753 19.106 1.00 45.05 C ATOM 2255 H LEU A1005 13.469 -0.370 18.257 1.00 0.00 H ATOM 2256 N LYS A1006 11.893 3.386 17.458 1.00 41.14 N ATOM 2257 CA LYS A1006 10.952 3.951 16.503 1.00 43.32 C ATOM 2258 C LYS A1006 11.756 4.739 15.466 1.00 43.26 C ATOM 2259 O LYS A1006 12.557 5.600 15.831 1.00 42.18 O ATOM 2260 CB LYS A1006 9.935 4.839 17.229 1.00 49.00 C ATOM 2261 CG LYS A1006 9.055 5.709 16.339 1.00 55.64 C ATOM 2262 CD LYS A1006 8.121 4.918 15.460 1.00 61.26 C ATOM 2263 CE LYS A1006 7.176 5.788 14.654 1.00 69.60 C ATOM 2264 NZ LYS A1006 6.238 6.550 15.513 1.00 69.35 N ATOM 2265 HZ1 LYS A1006 5.666 5.886 16.073 1.00 0.00 H ATOM 2266 HZ2 LYS A1006 6.779 7.168 16.151 1.00 0.00 H ATOM 2267 HZ3 LYS A1006 5.614 7.128 14.915 1.00 0.00 H ATOM 2268 H LYS A1006 12.243 3.995 18.225 1.00 0.00 H ATOM 2269 N PHE A1007 11.574 4.392 14.184 1.00 42.88 N ATOM 2270 CA PHE A1007 12.173 5.117 13.075 1.00 43.12 C ATOM 2271 C PHE A1007 11.155 6.148 12.562 1.00 44.78 C ATOM 2272 O PHE A1007 10.046 5.795 12.122 1.00 49.93 O ATOM 2273 CB PHE A1007 12.596 4.175 11.941 1.00 43.35 C ATOM 2274 CG PHE A1007 13.801 3.306 12.199 1.00 39.08 C ATOM 2275 CD1 PHE A1007 13.742 2.272 13.129 1.00 37.93 C ATOM 2276 CD2 PHE A1007 14.980 3.477 11.481 1.00 39.02 C ATOM 2277 CE1 PHE A1007 14.838 1.456 13.358 1.00 37.75 C ATOM 2278 CE2 PHE A1007 16.075 2.656 11.713 1.00 37.54 C ATOM 2279 CZ PHE A1007 15.993 1.640 12.633 1.00 34.64 C ATOM 2280 H PHE A1007 10.977 3.567 13.973 1.00 0.00 H ATOM 2281 N ASN A1008 11.511 7.430 12.684 1.00 46.49 N ATOM 2282 CA ASN A1008 10.645 8.532 12.243 1.00 51.40 C ATOM 2283 C ASN A1008 11.179 9.025 10.903 1.00 52.36 C ATOM 2284 O ASN A1008 12.139 9.800 10.878 1.00 52.07 O ATOM 2285 CB ASN A1008 10.600 9.660 13.275 1.00 55.88 C ATOM 2286 CG ASN A1008 9.882 9.240 14.540 1.00 60.38 C ATOM 2287 OD1 ASN A1008 8.721 8.844 14.491 1.00 61.78 O ATOM 2288 ND2 ASN A1008 10.568 9.294 15.669 1.00 62.71 N ATOM 2289 HD22 ASN A1008 11.550 9.636 15.665 1.00 0.00 H ATOM 2290 HD21 ASN A1008 10.126 8.994 16.561 1.00 0.00 H ATOM 2291 H ASN A1008 12.434 7.656 13.106 1.00 0.00 H ATOM 2292 N PHE A1009 10.597 8.502 9.812 1.00 52.55 N ATOM 2293 CA PHE A1009 11.060 8.829 8.458 1.00 57.55 C ATOM 2294 C PHE A1009 10.663 10.264 8.099 1.00 60.10 C ATOM 2295 O PHE A1009 9.612 10.725 8.484 1.00 60.11 O ATOM 2296 CB PHE A1009 10.553 7.797 7.452 1.00 58.88 C ATOM 2297 CG PHE A1009 11.163 6.437 7.669 1.00 55.85 C ATOM 2298 CD1 PHE A1009 12.421 6.129 7.174 1.00 55.92 C ATOM 2299 CD2 PHE A1009 10.501 5.486 8.428 1.00 55.93 C ATOM 2300 CE1 PHE A1009 12.989 4.885 7.408 1.00 53.20 C ATOM 2301 CE2 PHE A1009 11.071 4.246 8.659 1.00 53.85 C ATOM 2302 CZ PHE A1009 12.314 3.945 8.150 1.00 49.98 C ATOM 2303 H PHE A1009 9.797 7.848 9.929 1.00 0.00 H ATOM 2304 N LYS A1010 11.556 10.948 7.376 1.00 64.17 N ATOM 2305 CA LYS A1010 11.386 12.340 6.934 1.00 75.84 C ATOM 2306 C LYS A1010 11.166 12.357 5.418 1.00 79.29 C ATOM 2307 O LYS A1010 10.262 11.693 4.924 1.00 81.16 O ATOM 2308 CB LYS A1010 12.610 13.175 7.328 1.00 76.83 C ATOM 2309 CG LYS A1010 12.806 13.326 8.832 1.00 78.17 C ATOM 2310 CD LYS A1010 14.000 14.159 9.217 1.00 79.24 C ATOM 2311 CE LYS A1010 15.286 13.364 9.247 1.00 77.37 C ATOM 2312 NZ LYS A1010 16.471 14.247 9.156 1.00 79.27 N ATOM 2313 HZ1 LYS A1010 16.435 14.783 8.265 1.00 0.00 H ATOM 2314 HZ2 LYS A1010 16.472 14.907 9.960 1.00 0.00 H ATOM 2315 HZ3 LYS A1010 17.335 13.669 9.179 1.00 0.00 H ATOM 2316 H LYS A1010 12.434 10.460 7.107 1.00 0.00 H TER 2317 LYS A1010 HETATM 2318 O HOH 1 30.369 -9.042 32.097 1.00 40.31 O HETATM 2319 O HOH 2 1.131 -16.414 40.834 1.00 51.31 O HETATM 2320 O HOH 3 25.517 -13.154 5.803 1.00 51.34 O HETATM 2321 O HOH 4 41.737 12.737 1.157 1.00 53.82 O HETATM 2322 O HOH 5 37.599 -11.789 -1.619 1.00 53.65 O HETATM 2323 O HOH 6 26.568 -2.110 31.783 1.00 37.44 O HETATM 2324 O HOH 7 27.717 -0.746 6.571 1.00 43.68 O HETATM 2325 O HOH 8 26.908 -12.674 23.412 1.00 33.29 O HETATM 2326 O HOH 9 41.867 -12.794 36.909 1.00 56.07 O HETATM 2327 O HOH 10 45.949 2.470 12.596 1.00 31.92 O HETATM 2328 O HOH 11 25.815 7.590 4.263 1.00 45.87 O HETATM 2329 O HOH 12 37.624 -19.049 22.106 1.00 53.34 O HETATM 2330 O HOH 13 27.828 -12.791 32.020 1.00 33.88 O HETATM 2331 O HOH 14 11.766 -11.131 31.669 1.00 47.88 O HETATM 2332 O HOH 15 45.105 -7.626 27.752 1.00 51.62 O HETATM 2333 O HOH 16 26.943 3.554 7.244 1.00 50.87 O HETATM 2334 O HOH 17 32.289 10.419 7.258 1.00 38.19 O HETATM 2335 O HOH 18 41.830 3.754 15.642 1.00 37.53 O HETATM 2336 O HOH 19 46.879 -11.229 8.542 1.00 46.26 O HETATM 2337 O HOH 20 25.238 -9.884 29.490 1.00 33.72 O HETATM 2338 O HOH 21 25.262 -16.238 31.656 1.00 35.82 O HETATM 2339 O HOH 22 47.202 -9.304 6.790 1.00 34.79 O HETATM 2340 O HOH 23 37.533 0.451 24.282 1.00 39.99 O HETATM 2341 O HOH 24 14.736 -15.138 32.763 1.00 35.24 O HETATM 2342 O HOH 25 28.844 -21.429 28.457 1.00 40.28 O HETATM 2343 O HOH 26 38.580 -1.190 27.752 1.00 41.19 O HETATM 2344 O HOH 27 26.788 5.223 5.071 1.00 43.80 O HETATM 2345 O HOH 28 14.471 -16.725 27.955 1.00 35.08 O HETATM 2346 O HOH 29 47.388 5.308 3.695 1.00 47.26 O HETATM 2347 O HOH 30 33.168 1.846 34.971 1.00 53.59 O HETATM 2348 O HOH 31 33.292 9.000 22.062 1.00 35.41 O HETATM 2349 O HOH 32 31.735 -4.324 5.775 1.00 31.08 O HETATM 2350 O HOH 33 35.040 -19.402 25.644 1.00 42.62 O HETATM 2351 O HOH 34 38.703 -12.211 16.570 1.00 27.97 O HETATM 2352 O HOH 35 30.781 -6.734 -1.287 1.00 68.23 O HETATM 2353 O HOH 36 26.962 12.269 15.194 1.00 46.10 O HETATM 2354 O HOH 37 37.799 4.849 21.613 1.00 45.81 O HETATM 2355 O HOH 38 27.175 -4.456 4.344 1.00 46.14 O HETATM 2356 O HOH 39 8.180 -13.088 34.988 1.00 49.12 O HETATM 2357 O HOH 40 20.775 -17.793 24.763 1.00 36.47 O HETATM 2358 O HOH 41 23.603 -8.908 32.361 1.00 51.25 O HETATM 2359 O HOH 42 38.579 -12.555 6.686 1.00 47.76 O HETATM 2360 O HOH 43 29.429 -13.124 9.047 1.00 42.78 O HETATM 2361 O HOH 44 31.050 12.225 27.547 1.00 48.67 O HETATM 2362 O HOH 45 30.539 3.249 13.192 1.00 26.54 O HETATM 2363 O HOH 46 32.492 6.007 13.028 1.00 28.61 O HETATM 2364 O HOH 47 22.542 -16.015 15.193 1.00 48.09 O HETATM 2365 O HOH 48 13.110 -5.683 10.661 1.00 39.72 O HETATM 2366 O HOH 49 18.561 12.116 11.120 1.00 53.63 O HETATM 2367 O HOH 50 32.299 -13.623 32.186 1.00 33.32 O HETATM 2368 O HOH 51 30.743 -14.924 24.996 1.00 33.08 O HETATM 2369 O HOH 52 47.309 -1.793 9.830 1.00 33.06 O HETATM 2370 O HOH 53 27.081 -17.124 19.354 1.00 36.85 O HETATM 2371 O HOH 54 8.575 -3.725 24.005 1.00 41.27 O HETATM 2372 O HOH 55 28.742 -2.284 30.335 1.00 38.14 O HETATM 2373 O HOH 56 15.321 -15.820 14.115 1.00 38.67 O HETATM 2374 O HOH 57 38.614 6.487 12.036 1.00 30.26 O HETATM 2375 O HOH 58 30.018 11.266 6.648 1.00 47.80 O HETATM 2376 O HOH 59 22.671 -9.995 12.240 1.00 37.86 O HETATM 2377 O HOH 60 24.391 -12.195 26.999 1.00 29.75 O HETATM 2378 O HOH 61 41.049 -3.517 -1.330 1.00 35.82 O HETATM 2379 O HOH 62 24.841 1.436 7.337 1.00 33.90 O HETATM 2380 O HOH 63 28.762 -13.900 19.381 1.00 34.70 O HETATM 2381 O HOH 64 22.322 -20.008 25.386 1.00 42.42 O HETATM 2382 O HOH 65 36.407 5.280 28.403 1.00 55.46 O HETATM 2383 O HOH 66 37.764 -1.012 -0.021 1.00 37.91 O HETATM 2384 O HOH 67 48.481 -4.032 18.617 1.00 50.42 O HETATM 2385 O HOH 68 11.956 -6.450 33.792 1.00 43.68 O HETATM 2386 O HOH 69 43.459 -15.628 13.279 1.00 44.58 O HETATM 2387 O HOH 70 12.811 -13.137 15.388 1.00 37.82 O HETATM 2388 O HOH 71 22.641 -7.664 10.313 1.00 38.31 O HETATM 2389 O HOH 72 5.136 -2.183 26.513 1.00 50.28 O HETATM 2390 O HOH 73 14.889 -4.847 13.575 1.00 33.93 O HETATM 2391 O HOH 74 11.313 3.116 34.205 1.00 50.35 O HETATM 2392 O HOH 75 44.599 -1.699 19.298 1.00 38.76 O HETATM 2393 O HOH 76 9.917 -23.050 25.692 1.00 52.11 O HETATM 2394 O HOH 77 18.117 10.051 15.860 1.00 55.90 O HETATM 2395 O HOH 78 19.009 -15.356 13.263 1.00 53.50 O HETATM 2396 O HOH 79 33.512 7.291 32.846 1.00 48.87 O HETATM 2397 O HOH 80 26.536 -13.181 20.685 1.00 33.10 O HETATM 2398 O HOH 81 24.100 -14.244 13.835 1.00 41.97 O HETATM 2399 O HOH 82 41.480 -10.060 0.340 1.00 34.39 O HETATM 2400 O HOH 83 45.333 -0.518 16.991 1.00 62.03 O HETATM 2401 O HOH 84 18.371 -11.458 7.369 1.00 46.35 O HETATM 2402 O HOH 85 41.395 -1.509 28.418 1.00 52.14 O HETATM 2403 O HOH 86 13.190 1.067 29.078 1.00 40.18 O HETATM 2404 O HOH 87 35.164 -14.664 4.528 1.00 43.49 O HETATM 2405 O HOH 88 19.308 -9.412 32.279 1.00 43.06 O HETATM 2406 O HOH 89 19.240 -8.485 8.847 1.00 46.94 O HETATM 2407 O HOH 90 29.799 2.385 35.695 1.00 53.37 O HETATM 2408 O HOH 91 27.697 -19.396 32.115 1.00 40.73 O HETATM 2409 O HOH 92 26.255 -18.435 25.657 1.00 42.79 O HETATM 2410 O HOH 93 2.209 -17.176 28.512 1.00 45.38 O HETATM 2411 O HOH 94 23.779 -19.449 32.395 1.00 49.60 O HETATM 2412 O HOH 95 38.617 12.416 8.056 1.00 40.89 O HETATM 2413 O HOH 96 16.588 0.567 8.697 1.00 47.40 O HETATM 2414 O HOH 97 29.592 -18.898 14.194 1.00 35.47 O HETATM 2415 O HOH 98 17.937 9.415 22.578 1.00 53.94 O HETATM 2416 O HOH 99 21.172 4.614 38.310 1.00 56.32 O HETATM 2417 O HOH 100 14.459 5.677 27.458 1.00 64.56 O HETATM 2418 O HOH 101 42.950 7.052 17.877 1.00 43.07 O HETATM 2419 O HOH 102 28.206 12.281 11.120 1.00 41.50 O HETATM 2420 O HOH 103 20.108 5.376 5.712 1.00 64.93 O HETATM 2421 O HOH 104 44.194 -0.973 4.673 1.00 42.64 O HETATM 2422 O HOH 105 17.079 -0.459 35.830 1.00 48.35 O HETATM 2423 O HOH 106 34.183 13.896 8.529 1.00 52.37 O HETATM 2424 O HOH 107 43.628 -3.360 3.635 1.00 49.41 O HETATM 2425 O HOH 108 4.067 -15.042 21.487 1.00 61.23 O HETATM 2426 O HOH 109 30.875 14.934 22.169 1.00 51.75 O HETATM 2427 O HOH 110 35.182 17.671 12.772 1.00 47.14 O HETATM 2428 O HOH 111 21.916 2.179 35.955 1.00 48.57 O HETATM 2429 O HOH 112 9.663 -11.957 13.471 1.00 57.09 O HETATM 2430 O HOH 113 45.725 -8.452 4.431 1.00 56.27 O HETATM 2431 O HOH 114 19.381 7.656 5.543 1.00 59.06 O HETATM 2432 O HOH 115 12.104 -8.627 9.899 1.00 47.52 O HETATM 2433 O HOH 116 33.973 -18.720 16.662 1.00 40.65 O HETATM 2434 O HOH 117 48.696 -14.264 18.735 1.00 54.88 O HETATM 2435 O HOH 118 0.224 -16.101 26.287 1.00 60.38 O HETATM 2436 O HOH 119 20.760 -16.246 31.966 1.00 48.36 O HETATM 2437 O HOH 120 15.509 8.694 22.087 1.00 56.43 O HETATM 2438 O HOH 121 28.257 -11.891 30.652 1.00 42.09 O HETATM 2439 O HOH 122 33.195 0.455 2.311 1.00 64.08 O HETATM 2440 O HOH 123 12.382 -9.619 7.254 1.00 62.55 O HETATM 2441 O HOH 124 38.165 -2.306 28.896 1.00 53.80 O HETATM 2442 O HOH 125 40.181 -15.050 19.554 1.00 62.66 O HETATM 2443 O HOH 126 17.413 9.728 20.491 1.00 70.07 O HETATM 2444 O HOH 127 34.969 7.229 2.381 1.00 57.50 O HETATM 2445 O HOH 128 35.414 8.751 1.203 1.00 64.63 O HETATM 2446 O HOH 129 33.061 -12.646 35.321 1.00 57.83 O HETATM 2447 O HOH 130 29.005 -17.964 -2.528 1.00 57.01 O HETATM 2448 O HOH 131 16.087 -17.078 31.581 1.00 48.70 O HETATM 2449 O HOH 132 30.334 -11.660 31.411 1.00 35.15 O HETATM 2450 O HOH 133 13.276 3.683 27.998 1.00 58.93 O HETATM 2451 O HOH 134 41.550 -13.625 19.667 1.00 50.28 O HETATM 2452 O HOH 135 16.411 2.253 7.330 1.00 64.60 O HETATM 2453 O HOH 136 26.812 -19.897 24.757 1.00 57.05 O HETATM 2454 O HOH 137 40.627 -14.386 10.681 1.00 59.59 O HETATM 2455 O HOH 138 10.494 -16.987 15.180 1.00 66.32 O HETATM 2456 O HOH 139 42.618 -13.636 25.191 1.00 59.26 O HETATM 2457 O HOH 140 23.105 -12.032 12.424 1.00 58.73 O HETATM 2458 O HOH 141 19.745 7.916 3.036 1.00 69.22 O HETATM 2459 O HOH 142 39.944 -14.822 15.858 1.00 54.12 O HETATM 2460 O HOH 143 27.970 -14.400 -4.446 1.00 45.28 O HETATM 2461 O HOH 144 43.688 -7.378 -1.111 1.00 50.26 O HETATM 2462 O HOH 145 21.271 -8.698 33.610 1.00 44.92 O HETATM 2463 O HOH 146 39.363 -15.606 10.634 1.00 45.29 O HETATM 2464 O HOH 147 32.276 -19.759 14.928 1.00 50.05 O HETATM 2465 C10 KYY A 148 24.874 -7.468 7.621 1.00 -0.06 C HETATM 2466 C11 KYY A 148 23.842 -8.331 7.302 1.00 -0.05 C HETATM 2467 C12 KYY A 148 23.960 -9.230 6.241 1.00 0.07 C HETATM 2468 C14 KYY A 148 25.152 -9.204 5.526 1.00 0.15 C HETATM 2469 F KYY A 148 25.318 -10.056 4.488 1.00 -0.18 F HETATM 2470 C15 KYY A 148 26.190 -8.359 5.821 1.00 -0.02 C HETATM 2471 C9 KYY A 148 26.063 -7.473 6.891 1.00 -0.03 C HETATM 2472 C8 KYY A 148 27.217 -6.623 7.115 1.00 -0.01 C HETATM 2473 C7 KYY A 148 27.417 -5.630 7.979 1.00 0.18 C HETATM 2474 O2 KYY A 148 26.671 -5.440 9.129 1.00 -0.23 O HETATM 2475 C16 KYY A 148 27.213 -4.378 9.829 1.00 0.16 C HETATM 2476 C1 KYY A 148 26.816 -3.878 11.072 1.00 0.09 C HETATM 2477 C2 KYY A 148 27.598 -2.881 11.662 1.00 -0.04 C HETATM 2478 C3 KYY A 148 28.718 -2.376 11.007 1.00 -0.06 C HETATM 2479 C4 KYY A 148 29.071 -2.848 9.749 1.00 -0.05 C HETATM 2480 C5 KYY A 148 28.315 -3.851 9.158 1.00 0.08 C HETATM 2481 C6 KYY A 148 28.488 -4.634 7.921 1.00 0.20 C HETATM 2482 O1 KYY A 148 29.340 -4.497 6.999 1.00 -0.37 O HETATM 2483 H6 KYY A 148 29.930 -2.436 9.233 1.00 0.07 H HETATM 2484 H5 KYY A 148 29.319 -1.609 11.482 1.00 0.06 H HETATM 2485 H4 KYY A 148 27.330 -2.497 12.640 1.00 0.07 H HETATM 2486 C KYY A 148 25.572 -4.307 11.796 1.00 0.20 C HETATM 2487 O KYY A 148 25.159 -3.634 12.752 1.00 -0.39 O HETATM 2488 N KYY A 148 24.946 -5.416 11.381 1.00 -0.30 N HETATM 2489 H9 KYY A 148 24.116 -5.725 11.845 1.00 0.18 H HETATM 2490 H10 KYY A 148 25.309 -5.935 10.607 1.00 0.18 H HETATM 2491 H3 KYY A 148 28.065 -6.833 6.465 1.00 0.06 H HETATM 2492 H8 KYY A 148 27.099 -8.379 5.230 1.00 0.06 H HETATM 2493 C13 KYY A 148 22.841 -10.140 5.968 1.00 0.18 C HETATM 2494 N4 KYY A 148 22.817 -11.065 5.005 1.00 -0.21 N HETATM 2495 N3 KYY A 148 21.652 -11.740 5.076 1.00 -0.14 N HETATM 2496 N2 KYY A 148 20.995 -11.224 6.063 1.00 -0.07 N HETATM 2497 N1 KYY A 148 21.703 -10.221 6.642 1.00 -0.15 N HETATM 2498 H7 KYY A 148 21.414 -9.641 7.443 1.00 0.27 H HETATM 2499 H2 KYY A 148 22.928 -8.309 7.884 1.00 0.06 H HETATM 2500 H1 KYY A 148 24.758 -6.778 8.449 1.00 0.06 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 169 170 177 178 179 CONECT 177 169 CONECT 178 169 CONECT 179 169 CONECT 2465 2466 2471 2500 CONECT 2466 2465 2467 2499 CONECT 2467 2466 2468 2493 CONECT 2468 2467 2469 2470 CONECT 2469 2468 CONECT 2470 2468 2471 2492 CONECT 2471 2465 2470 2472 CONECT 2472 2471 2473 2491 CONECT 2473 2472 2474 2481 CONECT 2474 2473 2475 CONECT 2475 2474 2476 2480 CONECT 2476 2475 2477 2486 CONECT 2477 2476 2478 2485 CONECT 2478 2477 2479 2484 CONECT 2479 2478 2480 2483 CONECT 2480 2475 2479 2481 CONECT 2481 2473 2480 2482 CONECT 2482 2481 CONECT 2483 2479 CONECT 2484 2478 CONECT 2485 2477 CONECT 2486 2476 2487 2488 CONECT 2487 2486 CONECT 2488 2486 2489 2490 CONECT 2489 2488 CONECT 2490 2488 CONECT 2491 2472 CONECT 2492 2470 CONECT 2493 2467 2494 2497 CONECT 2494 2493 2495 CONECT 2495 2494 2496 CONECT 2496 2495 2497 CONECT 2497 2493 2496 2498 CONECT 2498 2497 CONECT 2499 2466 CONECT 2500 2465 MASTER 0 0 0 0 0 0 0 0 2498 2 44 20 END
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Structure:
Ligand 2D
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Related entries of code: 6nrg
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6bhv
RCSB PDB
PDBbind
271aa, >6BHV_1|Chains... *
6nrj
RCSB PDB
PDBbind
271aa, >6NRJ_1|Chain... at 100%
6nri
RCSB PDB
PDBbind
271aa, >6NRI_1|Chain... at 100%
6nrh
RCSB PDB
PDBbind
271aa, >6NRH_1|Chain... at 100%
6nrf
RCSB PDB
PDBbind
271aa, >6NRF_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6nrg
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human PARP-1 ART domain
Ligand Name
KYY
EC.Number
E.C.2.4.2.30
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
IC50=56nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 5330-5357
Ligand Properties
Formula
C
1
7
H
1
0
FN
5
O
3
Molecular Weight
351.291
Exact Mass
351.077
No. of atoms
36
No. of bonds
39
Polar Surface Area
123.85
LOGP Value
1.86 (
Computed with XLOGP3
)
2.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
Fc1cc(ccc1c1nnn[nH]1)/C=C/1\Oc2c(C1=O)cccc2C(=O)N
InChI String
InChI=1S/C17H10FN5O3/c18-12-6-8(4-5-9(12)17-20-22-23-21-17)7-13-14(24)10-2-1-3-11(16(19)25)15(10)26-13/h1-7H,(H2,19,25)(H,20,21,22,23)/b13-7-
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):
P09874
Entrez Gene ID
NCBI Entrez Gene ID:
142
ASD
Information of known allosteric effects of PDB entries
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