Browse entries in the PDBbind-CN Database
HEADER 6NRH_COMPLEX COMPND 6NRH_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 KYP A 452 57 ATOM 1 N LYS A 764 -1.809 -17.021 30.787 1.00 68.03 N ATOM 2 CA LYS A 764 -1.306 -15.615 30.690 1.00 60.20 C ATOM 3 C LYS A 764 0.134 -15.530 31.217 1.00 53.99 C ATOM 4 O LYS A 764 0.539 -16.243 32.125 1.00 59.17 O ATOM 5 CB LYS A 764 -2.217 -14.655 31.461 1.00 67.05 C ATOM 6 CG LYS A 764 -2.014 -14.621 32.971 1.00 68.21 C ATOM 7 CD LYS A 764 -3.166 -13.975 33.706 1.00 74.36 C ATOM 8 CE LYS A 764 -3.253 -12.481 33.471 1.00 77.76 C ATOM 9 NZ LYS A 764 -4.616 -11.974 33.755 1.00 75.70 N ATOM 10 HZ1 LYS A 764 -5.298 -12.450 33.131 1.00 0.00 H ATOM 11 HZ2 LYS A 764 -4.857 -12.170 34.748 1.00 0.00 H ATOM 12 HZ3 LYS A 764 -4.645 -10.948 33.585 1.00 0.00 H ATOM 13 HN3 LYS A 764 -1.791 -17.327 31.781 1.00 0.00 H ATOM 14 HN2 LYS A 764 -1.201 -17.645 30.220 1.00 0.00 H ATOM 15 HN1 LYS A 764 -2.784 -17.065 30.427 1.00 0.00 H ATOM 16 N SER A 765 0.881 -14.594 30.643 1.00 39.36 N ATOM 17 CA SER A 765 2.276 -14.396 30.911 1.00 35.85 C ATOM 18 C SER A 765 2.506 -13.762 32.294 1.00 31.31 C ATOM 19 O SER A 765 1.758 -12.896 32.694 1.00 31.67 O ATOM 20 CB SER A 765 2.844 -13.532 29.828 1.00 38.10 C ATOM 21 OG SER A 765 4.184 -13.186 30.107 1.00 38.65 O ATOM 22 HG SER A 765 4.729 -14.010 30.175 1.00 0.00 H ATOM 23 H SER A 765 0.424 -13.963 29.954 1.00 0.00 H ATOM 24 N LYS A 766 3.617 -14.141 32.956 1.00 31.22 N ATOM 25 CA LYS A 766 4.075 -13.494 34.190 1.00 29.67 C ATOM 26 C LYS A 766 5.273 -12.585 33.913 1.00 27.07 C ATOM 27 O LYS A 766 5.914 -12.110 34.853 1.00 28.03 O ATOM 28 CB LYS A 766 4.381 -14.525 35.279 1.00 32.11 C ATOM 29 CG LYS A 766 3.143 -15.212 35.830 1.00 40.18 C ATOM 30 CD LYS A 766 3.412 -16.061 37.032 1.00 43.57 C ATOM 31 CE LYS A 766 2.148 -16.436 37.782 1.00 55.54 C ATOM 32 NZ LYS A 766 1.405 -15.236 38.261 1.00 57.31 N ATOM 33 HZ1 LYS A 766 2.012 -14.687 38.902 1.00 0.00 H ATOM 34 HZ2 LYS A 766 1.137 -14.648 37.446 1.00 0.00 H ATOM 35 HZ3 LYS A 766 0.549 -15.539 38.768 1.00 0.00 H ATOM 36 H LYS A 766 4.176 -14.930 32.574 1.00 0.00 H ATOM 37 N LEU A 767 5.558 -12.334 32.633 1.00 28.63 N ATOM 38 CA LEU A 767 6.602 -11.406 32.273 1.00 27.98 C ATOM 39 C LEU A 767 6.093 -9.970 32.273 1.00 27.65 C ATOM 40 O LEU A 767 4.936 -9.692 31.984 1.00 28.15 O ATOM 41 CB LEU A 767 7.142 -11.739 30.887 1.00 28.43 C ATOM 42 CG LEU A 767 7.851 -13.084 30.751 1.00 30.02 C ATOM 43 CD1 LEU A 767 8.046 -13.436 29.290 1.00 32.75 C ATOM 44 CD2 LEU A 767 9.201 -13.058 31.445 1.00 30.31 C ATOM 45 H LEU A 767 5.019 -12.815 31.884 1.00 0.00 H ATOM 46 N PRO A 768 6.977 -8.992 32.534 1.00 26.13 N ATOM 47 CA PRO A 768 6.592 -7.582 32.409 1.00 26.17 C ATOM 48 C PRO A 768 6.159 -7.283 30.974 1.00 26.29 C ATOM 49 O PRO A 768 6.678 -7.865 30.036 1.00 27.64 O ATOM 50 CB PRO A 768 7.888 -6.838 32.758 1.00 29.34 C ATOM 51 CG PRO A 768 8.658 -7.815 33.622 1.00 31.24 C ATOM 52 CD PRO A 768 8.345 -9.171 33.036 1.00 28.34 C ATOM 53 N LYS A 769 5.190 -6.378 30.827 1.00 26.56 N ATOM 54 CA LYS A 769 4.568 -6.060 29.540 1.00 27.57 C ATOM 55 C LYS A 769 5.626 -5.762 28.476 1.00 27.01 C ATOM 56 O LYS A 769 5.527 -6.238 27.361 1.00 27.31 O ATOM 57 CB LYS A 769 3.576 -4.908 29.725 1.00 29.87 C ATOM 58 CG LYS A 769 2.836 -4.474 28.468 1.00 34.50 C ATOM 59 CD LYS A 769 1.996 -5.574 27.870 1.00 37.18 C ATOM 60 CE LYS A 769 0.917 -5.050 26.943 1.00 40.41 C ATOM 61 NZ LYS A 769 1.468 -4.075 25.973 1.00 42.37 N ATOM 62 HZ1 LYS A 769 1.882 -3.272 26.488 1.00 0.00 H ATOM 63 HZ2 LYS A 769 2.203 -4.536 25.399 1.00 0.00 H ATOM 64 HZ3 LYS A 769 0.705 -3.735 25.353 1.00 0.00 H ATOM 65 H LYS A 769 4.858 -5.871 31.672 1.00 0.00 H ATOM 66 N PRO A 770 6.677 -4.944 28.735 1.00 27.72 N ATOM 67 CA PRO A 770 7.607 -4.643 27.644 1.00 27.87 C ATOM 68 C PRO A 770 8.313 -5.912 27.144 1.00 26.64 C ATOM 69 O PRO A 770 8.618 -6.024 25.964 1.00 26.59 O ATOM 70 CB PRO A 770 8.568 -3.621 28.253 1.00 28.56 C ATOM 71 CG PRO A 770 7.774 -3.015 29.384 1.00 30.62 C ATOM 72 CD PRO A 770 6.971 -4.164 29.950 1.00 28.92 C ATOM 73 N VAL A 771 8.567 -6.864 28.052 1.00 24.49 N ATOM 74 CA VAL A 771 9.175 -8.123 27.638 1.00 25.29 C ATOM 75 C VAL A 771 8.182 -8.956 26.823 1.00 25.82 C ATOM 76 O VAL A 771 8.553 -9.545 25.812 1.00 26.33 O ATOM 77 CB VAL A 771 9.748 -8.899 28.840 1.00 25.54 C ATOM 78 CG1 VAL A 771 10.372 -10.208 28.413 1.00 25.79 C ATOM 79 CG2 VAL A 771 10.736 -8.035 29.593 1.00 26.74 C ATOM 80 H VAL A 771 8.330 -6.705 29.052 1.00 0.00 H ATOM 81 N GLN A 772 6.921 -9.023 27.266 1.00 26.10 N ATOM 82 CA GLN A 772 5.896 -9.704 26.475 1.00 28.29 C ATOM 83 C GLN A 772 5.847 -9.128 25.048 1.00 27.58 C ATOM 84 O GLN A 772 5.797 -9.855 24.070 1.00 29.44 O ATOM 85 CB GLN A 772 4.518 -9.543 27.102 1.00 29.77 C ATOM 86 CG GLN A 772 4.345 -10.142 28.485 1.00 31.54 C ATOM 87 CD GLN A 772 2.921 -9.982 28.968 1.00 34.67 C ATOM 88 OE1 GLN A 772 1.979 -9.792 28.180 1.00 41.12 O ATOM 89 NE2 GLN A 772 2.746 -10.045 30.278 1.00 39.37 N ATOM 90 HE22 GLN A 772 3.561 -10.206 30.904 1.00 0.00 H ATOM 91 HE21 GLN A 772 1.794 -9.934 30.681 1.00 0.00 H ATOM 92 H GLN A 772 6.669 -8.589 28.177 1.00 0.00 H ATOM 93 N ASP A 773 5.862 -7.799 24.934 1.00 27.47 N ATOM 94 CA ASP A 773 5.786 -7.154 23.633 1.00 28.94 C ATOM 95 C ASP A 773 7.020 -7.486 22.780 1.00 26.96 C ATOM 96 O ASP A 773 6.910 -7.655 21.542 1.00 30.04 O ATOM 97 CB ASP A 773 5.505 -5.661 23.787 1.00 32.73 C ATOM 98 CG ASP A 773 4.096 -5.379 24.316 1.00 36.11 C ATOM 99 OD1 ASP A 773 3.222 -6.317 24.323 1.00 42.84 O ATOM 100 OD2 ASP A 773 3.850 -4.237 24.704 1.00 41.56 O ATOM 101 H ASP A 773 5.929 -7.214 25.791 1.00 0.00 H ATOM 102 N LEU A 774 8.182 -7.592 23.429 1.00 25.86 N ATOM 103 CA LEU A 774 9.417 -7.967 22.734 1.00 25.43 C ATOM 104 C LEU A 774 9.310 -9.388 22.178 1.00 26.82 C ATOM 105 O LEU A 774 9.674 -9.627 21.006 1.00 28.71 O ATOM 106 CB LEU A 774 10.603 -7.833 23.684 1.00 26.78 C ATOM 107 CG LEU A 774 11.941 -8.304 23.122 1.00 27.14 C ATOM 108 CD1 LEU A 774 12.443 -7.399 21.995 1.00 27.51 C ATOM 109 CD2 LEU A 774 12.950 -8.389 24.251 1.00 28.28 C ATOM 110 H LEU A 774 8.212 -7.404 24.451 1.00 0.00 H ATOM 111 N ILE A 775 8.792 -10.309 22.997 1.00 26.10 N ATOM 112 CA ILE A 775 8.665 -11.686 22.569 1.00 27.06 C ATOM 113 C ILE A 775 7.706 -11.779 21.375 1.00 27.20 C ATOM 114 O ILE A 775 7.975 -12.501 20.405 1.00 29.76 O ATOM 115 CB ILE A 775 8.225 -12.566 23.748 1.00 28.71 C ATOM 116 CG1 ILE A 775 9.271 -12.603 24.861 1.00 33.24 C ATOM 117 CG2 ILE A 775 7.839 -13.949 23.266 1.00 29.99 C ATOM 118 CD1 ILE A 775 10.634 -12.971 24.432 1.00 36.69 C ATOM 119 H ILE A 775 8.478 -10.034 23.949 1.00 0.00 H ATOM 120 N LYS A 776 6.583 -11.055 21.436 1.00 29.02 N ATOM 121 CA LYS A 776 5.632 -11.054 20.346 1.00 30.28 C ATOM 122 C LYS A 776 6.283 -10.564 19.054 1.00 32.03 C ATOM 123 O LYS A 776 5.994 -11.106 17.975 1.00 33.50 O ATOM 124 CB LYS A 776 4.408 -10.205 20.693 1.00 33.82 C ATOM 125 CG LYS A 776 3.460 -10.859 21.677 1.00 40.56 C ATOM 126 CD LYS A 776 2.210 -10.012 21.902 1.00 47.13 C ATOM 127 CE LYS A 776 1.100 -10.737 22.622 1.00 56.26 C ATOM 128 NZ LYS A 776 0.117 -9.785 23.190 1.00 66.21 N ATOM 129 HZ1 LYS A 776 0.596 -9.156 23.866 1.00 0.00 H ATOM 130 HZ2 LYS A 776 -0.299 -9.219 22.423 1.00 0.00 H ATOM 131 HZ3 LYS A 776 -0.634 -10.314 23.679 1.00 0.00 H ATOM 132 H LYS A 776 6.390 -10.482 22.282 1.00 0.00 H ATOM 133 N MET A 777 7.156 -9.556 19.167 1.00 30.15 N ATOM 134 CA MET A 777 7.875 -8.985 18.020 1.00 30.74 C ATOM 135 C MET A 777 8.848 -10.015 17.420 1.00 28.96 C ATOM 136 O MET A 777 8.895 -10.217 16.196 1.00 33.20 O ATOM 137 CB MET A 777 8.629 -7.724 18.445 1.00 33.59 C ATOM 138 CG MET A 777 8.936 -6.794 17.302 1.00 34.72 C ATOM 139 SD MET A 777 9.731 -5.292 17.888 1.00 38.12 S ATOM 140 CE MET A 777 10.809 -4.935 16.498 1.00 32.58 C ATOM 141 H MET A 777 7.334 -9.158 20.111 1.00 0.00 H ATOM 142 N ILE A 778 9.615 -10.677 18.286 1.00 28.51 N ATOM 143 CA ILE A 778 10.652 -11.635 17.870 1.00 29.21 C ATOM 144 C ILE A 778 10.014 -12.864 17.223 1.00 31.15 C ATOM 145 O ILE A 778 10.556 -13.410 16.247 1.00 33.56 O ATOM 146 CB ILE A 778 11.549 -11.997 19.063 1.00 29.14 C ATOM 147 CG1 ILE A 778 12.399 -10.792 19.460 1.00 28.72 C ATOM 148 CG2 ILE A 778 12.411 -13.215 18.766 1.00 30.17 C ATOM 149 CD1 ILE A 778 13.191 -11.023 20.728 1.00 29.37 C ATOM 150 H ILE A 778 9.474 -10.509 19.303 1.00 0.00 H ATOM 151 N PHE A 779 8.891 -13.329 17.777 1.00 30.66 N ATOM 152 CA PHE A 779 8.284 -14.603 17.290 1.00 33.61 C ATOM 153 C PHE A 779 7.164 -14.368 16.272 1.00 39.41 C ATOM 154 O PHE A 779 6.704 -15.321 15.652 1.00 45.83 O ATOM 155 CB PHE A 779 7.852 -15.466 18.470 1.00 32.47 C ATOM 156 CG PHE A 779 9.012 -16.098 19.197 1.00 29.70 C ATOM 157 CD1 PHE A 779 9.512 -17.329 18.805 1.00 33.32 C ATOM 158 CD2 PHE A 779 9.658 -15.428 20.222 1.00 29.48 C ATOM 159 CE1 PHE A 779 10.587 -17.901 19.462 1.00 35.40 C ATOM 160 CE2 PHE A 779 10.752 -15.995 20.860 1.00 30.77 C ATOM 161 CZ PHE A 779 11.206 -17.238 20.492 1.00 33.27 C ATOM 162 H PHE A 779 8.438 -12.802 18.550 1.00 0.00 H ATOM 163 N GLY A 780 6.784 -13.111 16.056 1.00 45.29 N ATOM 164 CA GLY A 780 5.906 -12.734 14.948 1.00 53.57 C ATOM 165 C GLY A 780 4.470 -13.172 15.186 1.00 62.92 C ATOM 166 O GLY A 780 4.061 -13.387 16.332 1.00 67.75 O ATOM 167 H GLY A 780 7.124 -12.368 16.699 1.00 0.00 H TER 168 GLY A 780 ATOM 169 N ASP A 788 2.832 -20.796 20.232 1.00 61.00 N ATOM 170 CA ASP A 788 3.139 -21.138 21.616 1.00 52.71 C ATOM 171 C ASP A 788 2.847 -19.936 22.509 1.00 43.92 C ATOM 172 O ASP A 788 2.852 -18.797 22.044 1.00 46.15 O ATOM 173 CB ASP A 788 4.601 -21.584 21.753 1.00 53.68 C ATOM 174 CG ASP A 788 4.826 -23.036 21.358 1.00 66.30 C ATOM 175 OD1 ASP A 788 3.876 -23.833 21.506 1.00 75.20 O ATOM 176 OD2 ASP A 788 5.947 -23.362 20.909 1.00 77.45 O ATOM 177 HN3 ASP A 788 3.420 -19.991 19.936 1.00 0.00 H ATOM 178 HN2 ASP A 788 1.827 -20.540 20.154 1.00 0.00 H ATOM 179 HN1 ASP A 788 3.031 -21.614 19.622 1.00 0.00 H ATOM 180 N PRO A 789 2.613 -20.147 23.825 1.00 43.23 N ATOM 181 CA PRO A 789 2.419 -19.044 24.757 1.00 41.37 C ATOM 182 C PRO A 789 3.692 -18.206 24.865 1.00 36.94 C ATOM 183 O PRO A 789 4.793 -18.706 24.642 1.00 35.38 O ATOM 184 CB PRO A 789 2.097 -19.712 26.109 1.00 44.24 C ATOM 185 CG PRO A 789 1.730 -21.137 25.763 1.00 48.77 C ATOM 186 CD PRO A 789 2.488 -21.454 24.491 1.00 45.43 C ATOM 187 N ILE A 790 3.505 -16.938 25.231 1.00 34.47 N ATOM 188 CA ILE A 790 4.590 -16.000 25.382 1.00 32.11 C ATOM 189 C ILE A 790 5.700 -16.602 26.255 1.00 30.42 C ATOM 190 O ILE A 790 6.855 -16.466 25.932 1.00 29.77 O ATOM 191 CB ILE A 790 4.060 -14.679 25.954 1.00 33.16 C ATOM 192 CG1 ILE A 790 3.165 -13.969 24.934 1.00 37.23 C ATOM 193 CG2 ILE A 790 5.189 -13.781 26.429 1.00 33.05 C ATOM 194 CD1 ILE A 790 2.399 -12.796 25.503 1.00 42.46 C ATOM 195 H ILE A 790 2.535 -16.611 25.416 1.00 0.00 H ATOM 196 N ASP A 791 5.352 -17.166 27.417 1.00 31.52 N ATOM 197 CA ASP A 791 6.398 -17.536 28.384 1.00 32.62 C ATOM 198 C ASP A 791 7.168 -18.757 27.840 1.00 30.81 C ATOM 199 O ASP A 791 8.347 -18.930 28.121 1.00 31.26 O ATOM 200 CB ASP A 791 5.822 -17.675 29.808 1.00 35.49 C ATOM 201 CG ASP A 791 5.415 -16.344 30.447 1.00 39.11 C ATOM 202 OD1 ASP A 791 5.543 -15.310 29.786 1.00 39.09 O ATOM 203 OD2 ASP A 791 4.955 -16.339 31.613 1.00 42.48 O ATOM 204 H ASP A 791 4.350 -17.342 27.635 1.00 0.00 H ATOM 205 N VAL A 792 6.513 -19.601 27.031 1.00 32.17 N ATOM 206 CA VAL A 792 7.213 -20.717 26.365 1.00 33.74 C ATOM 207 C VAL A 792 8.190 -20.177 25.298 1.00 33.12 C ATOM 208 O VAL A 792 9.347 -20.640 25.200 1.00 33.37 O ATOM 209 CB VAL A 792 6.205 -21.707 25.766 1.00 37.87 C ATOM 210 CG1 VAL A 792 6.891 -22.769 24.910 1.00 40.55 C ATOM 211 CG2 VAL A 792 5.352 -22.340 26.860 1.00 39.94 C ATOM 212 H VAL A 792 5.494 -19.467 26.870 1.00 0.00 H ATOM 213 N ASN A 793 7.759 -19.182 24.512 1.00 31.08 N ATOM 214 CA ASN A 793 8.650 -18.555 23.528 1.00 29.27 C ATOM 215 C ASN A 793 9.809 -17.833 24.228 1.00 29.34 C ATOM 216 O ASN A 793 10.942 -17.931 23.763 1.00 28.53 O ATOM 217 CB ASN A 793 7.882 -17.645 22.572 1.00 31.55 C ATOM 218 CG ASN A 793 7.109 -18.414 21.522 1.00 33.23 C ATOM 219 OD1 ASN A 793 7.412 -19.578 21.224 1.00 38.18 O ATOM 220 ND2 ASN A 793 6.113 -17.767 20.944 1.00 37.11 N ATOM 221 HD22 ASN A 793 5.894 -16.790 21.226 1.00 0.00 H ATOM 222 HD21 ASN A 793 5.548 -18.234 20.207 1.00 0.00 H ATOM 223 H ASN A 793 6.778 -18.848 24.600 1.00 0.00 H ATOM 224 N TYR A 794 9.550 -17.170 25.354 1.00 27.46 N ATOM 225 CA TYR A 794 10.634 -16.582 26.144 1.00 26.55 C ATOM 226 C TYR A 794 11.721 -17.617 26.454 1.00 26.10 C ATOM 227 O TYR A 794 12.908 -17.351 26.242 1.00 25.88 O ATOM 228 CB TYR A 794 10.078 -15.966 27.427 1.00 26.35 C ATOM 229 CG TYR A 794 11.099 -15.386 28.364 1.00 24.76 C ATOM 230 CD1 TYR A 794 11.643 -14.132 28.140 1.00 26.80 C ATOM 231 CD2 TYR A 794 11.574 -16.101 29.441 1.00 27.62 C ATOM 232 CE1 TYR A 794 12.599 -13.604 28.990 1.00 26.86 C ATOM 233 CE2 TYR A 794 12.540 -15.589 30.297 1.00 27.02 C ATOM 234 CZ TYR A 794 13.053 -14.332 30.076 1.00 24.74 C ATOM 235 OH TYR A 794 13.977 -13.789 30.926 1.00 25.58 O ATOM 236 HH TYR A 794 14.781 -14.366 30.949 1.00 0.00 H ATOM 237 H TYR A 794 8.566 -17.069 25.676 1.00 0.00 H ATOM 238 N GLU A 795 11.324 -18.792 26.949 1.00 27.02 N ATOM 239 CA GLU A 795 12.313 -19.771 27.407 1.00 28.57 C ATOM 240 C GLU A 795 13.130 -20.287 26.212 1.00 27.94 C ATOM 241 O GLU A 795 14.299 -20.643 26.393 1.00 28.70 O ATOM 242 CB GLU A 795 11.610 -20.849 28.241 1.00 33.33 C ATOM 243 CG GLU A 795 11.174 -20.307 29.597 1.00 39.57 C ATOM 244 CD GLU A 795 11.023 -21.286 30.745 1.00 48.47 C ATOM 245 OE1 GLU A 795 10.895 -22.486 30.473 1.00 55.43 O ATOM 246 OE2 GLU A 795 11.006 -20.833 31.927 1.00 54.94 O ATOM 247 H GLU A 795 10.310 -19.013 27.010 1.00 0.00 H ATOM 248 N LYS A 796 12.571 -20.274 24.992 1.00 27.68 N ATOM 249 CA LYS A 796 13.329 -20.709 23.799 1.00 29.19 C ATOM 250 C LYS A 796 14.533 -19.801 23.507 1.00 29.10 C ATOM 251 O LYS A 796 15.477 -20.206 22.823 1.00 30.35 O ATOM 252 CB LYS A 796 12.440 -20.723 22.555 1.00 32.20 C ATOM 253 CG LYS A 796 11.366 -21.798 22.532 1.00 36.20 C ATOM 254 CD LYS A 796 10.415 -21.593 21.378 1.00 36.85 C ATOM 255 CE LYS A 796 9.213 -22.505 21.420 1.00 44.18 C ATOM 256 NZ LYS A 796 8.205 -22.098 20.412 1.00 50.23 N ATOM 257 HZ1 LYS A 796 7.894 -21.125 20.608 1.00 0.00 H ATOM 258 HZ2 LYS A 796 8.628 -22.144 19.463 1.00 0.00 H ATOM 259 HZ3 LYS A 796 7.389 -22.740 20.461 1.00 0.00 H ATOM 260 H LYS A 796 11.588 -19.953 24.884 1.00 0.00 H ATOM 261 N LEU A 797 14.497 -18.565 24.004 1.00 26.75 N ATOM 262 CA LEU A 797 15.594 -17.640 23.775 1.00 25.52 C ATOM 263 C LEU A 797 16.808 -17.954 24.660 1.00 25.93 C ATOM 264 O LEU A 797 17.886 -17.466 24.369 1.00 26.76 O ATOM 265 CB LEU A 797 15.125 -16.209 24.032 1.00 28.23 C ATOM 266 CG LEU A 797 13.998 -15.728 23.130 1.00 27.33 C ATOM 267 CD1 LEU A 797 13.554 -14.328 23.524 1.00 29.22 C ATOM 268 CD2 LEU A 797 14.386 -15.771 21.664 1.00 30.69 C ATOM 269 H LEU A 797 13.674 -18.259 24.562 1.00 0.00 H ATOM 270 N LYS A 798 16.623 -18.706 25.744 1.00 26.59 N ATOM 271 CA LYS A 798 17.732 -19.101 26.648 1.00 26.77 C ATOM 272 C LYS A 798 18.524 -17.839 27.042 1.00 24.45 C ATOM 273 O LYS A 798 19.756 -17.852 27.142 1.00 25.53 O ATOM 274 CB LYS A 798 18.623 -20.163 25.989 1.00 29.60 C ATOM 275 CG LYS A 798 17.874 -21.367 25.451 1.00 38.81 C ATOM 276 CD LYS A 798 17.426 -22.302 26.535 1.00 48.99 C ATOM 277 CE LYS A 798 16.979 -23.644 25.985 1.00 57.08 C ATOM 278 NZ LYS A 798 16.969 -24.694 27.030 1.00 61.84 N ATOM 279 HZ1 LYS A 798 17.927 -24.804 27.419 1.00 0.00 H ATOM 280 HZ2 LYS A 798 16.315 -24.419 27.790 1.00 0.00 H ATOM 281 HZ3 LYS A 798 16.658 -25.594 26.612 1.00 0.00 H ATOM 282 H LYS A 798 15.660 -19.030 25.966 1.00 0.00 H ATOM 283 N THR A 799 17.787 -16.767 27.369 1.00 24.80 N ATOM 284 CA THR A 799 18.366 -15.452 27.661 1.00 24.73 C ATOM 285 C THR A 799 17.554 -14.788 28.780 1.00 24.13 C ATOM 286 O THR A 799 16.329 -14.724 28.701 1.00 26.38 O ATOM 287 CB THR A 799 18.338 -14.539 26.424 1.00 26.86 C ATOM 288 OG1 THR A 799 19.088 -15.129 25.372 1.00 26.62 O ATOM 289 CG2 THR A 799 18.974 -13.197 26.685 1.00 26.77 C ATOM 290 HG1 THR A 799 18.694 -16.007 25.140 1.00 0.00 H ATOM 291 H THR A 799 16.754 -16.874 27.418 1.00 0.00 H ATOM 292 N ASP A 800 18.229 -14.328 29.823 1.00 23.37 N ATOM 293 CA ASP A 800 17.573 -13.523 30.844 1.00 23.64 C ATOM 294 C ASP A 800 17.358 -12.127 30.263 1.00 23.94 C ATOM 295 O ASP A 800 18.296 -11.557 29.724 1.00 24.76 O ATOM 296 CB ASP A 800 18.395 -13.413 32.119 1.00 24.93 C ATOM 297 CG ASP A 800 17.666 -12.683 33.220 1.00 29.65 C ATOM 298 OD1 ASP A 800 16.639 -13.228 33.742 1.00 32.50 O ATOM 299 OD2 ASP A 800 18.093 -11.572 33.528 1.00 36.08 O ATOM 300 H ASP A 800 19.242 -14.545 29.914 1.00 0.00 H ATOM 301 N ILE A 801 16.117 -11.618 30.324 1.00 23.19 N ATOM 302 CA ILE A 801 15.802 -10.291 29.793 1.00 23.85 C ATOM 303 C ILE A 801 15.189 -9.438 30.903 1.00 24.60 C ATOM 304 O ILE A 801 14.195 -9.830 31.526 1.00 29.52 O ATOM 305 CB ILE A 801 14.872 -10.375 28.568 1.00 23.42 C ATOM 306 CG1 ILE A 801 15.402 -11.355 27.513 1.00 24.68 C ATOM 307 CG2 ILE A 801 14.594 -8.985 28.029 1.00 26.06 C ATOM 308 CD1 ILE A 801 14.502 -11.541 26.330 1.00 28.22 C ATOM 309 H ILE A 801 15.360 -12.182 30.760 1.00 0.00 H ATOM 310 N LYS A 802 15.812 -8.290 31.167 1.00 24.27 N ATOM 311 CA LYS A 802 15.322 -7.370 32.171 1.00 24.96 C ATOM 312 C LYS A 802 15.091 -6.009 31.525 1.00 25.49 C ATOM 313 O LYS A 802 15.902 -5.549 30.719 1.00 27.55 O ATOM 314 CB LYS A 802 16.356 -7.184 33.288 1.00 30.60 C ATOM 315 CG LYS A 802 16.668 -8.409 34.123 1.00 36.31 C ATOM 316 CD LYS A 802 17.695 -8.132 35.223 1.00 43.61 C ATOM 317 CE LYS A 802 18.099 -9.389 35.972 1.00 52.67 C ATOM 318 NZ LYS A 802 18.914 -9.073 37.170 1.00 59.30 N ATOM 319 HZ1 LYS A 802 19.778 -8.572 36.878 1.00 0.00 H ATOM 320 HZ2 LYS A 802 18.363 -8.470 37.813 1.00 0.00 H ATOM 321 HZ3 LYS A 802 19.171 -9.956 37.656 1.00 0.00 H ATOM 322 H LYS A 802 16.674 -8.049 30.637 1.00 0.00 H ATOM 323 N VAL A 803 14.000 -5.362 31.906 1.00 25.90 N ATOM 324 CA VAL A 803 13.758 -3.999 31.470 1.00 26.50 C ATOM 325 C VAL A 803 14.665 -3.060 32.273 1.00 24.90 C ATOM 326 O VAL A 803 14.692 -3.102 33.510 1.00 30.41 O ATOM 327 CB VAL A 803 12.292 -3.591 31.650 1.00 28.36 C ATOM 328 CG1 VAL A 803 12.066 -2.182 31.139 1.00 34.41 C ATOM 329 CG2 VAL A 803 11.316 -4.549 30.988 1.00 31.09 C ATOM 330 H VAL A 803 13.310 -5.835 32.524 1.00 0.00 H ATOM 331 N VAL A 804 15.369 -2.183 31.555 1.00 24.91 N ATOM 332 CA VAL A 804 16.196 -1.147 32.176 1.00 27.36 C ATOM 333 C VAL A 804 15.290 0.039 32.501 1.00 28.82 C ATOM 334 O VAL A 804 14.580 0.543 31.615 1.00 31.37 O ATOM 335 CB VAL A 804 17.372 -0.769 31.260 1.00 28.32 C ATOM 336 CG1 VAL A 804 18.122 0.433 31.770 1.00 29.15 C ATOM 337 CG2 VAL A 804 18.332 -1.931 31.054 1.00 28.02 C ATOM 338 H VAL A 804 15.329 -2.237 30.517 1.00 0.00 H ATOM 339 N ASP A 805 15.358 0.492 33.763 1.00 33.32 N ATOM 340 CA ASP A 805 14.610 1.623 34.248 1.00 36.72 C ATOM 341 C ASP A 805 14.980 2.855 33.400 1.00 34.93 C ATOM 342 O ASP A 805 16.145 3.172 33.204 1.00 32.96 O ATOM 343 CB ASP A 805 14.896 1.883 35.744 1.00 40.18 C ATOM 344 CG ASP A 805 14.571 0.784 36.769 1.00 48.29 C ATOM 345 OD1 ASP A 805 13.556 0.079 36.591 1.00 54.68 O ATOM 346 OD2 ASP A 805 15.312 0.679 37.806 1.00 52.89 O ATOM 347 H ASP A 805 15.987 -0.002 34.428 1.00 0.00 H ATOM 348 N ARG A 806 13.973 3.565 32.893 1.00 38.26 N ATOM 349 CA ARG A 806 14.124 4.829 32.171 1.00 42.85 C ATOM 350 C ARG A 806 15.042 5.791 32.946 1.00 41.69 C ATOM 351 O ARG A 806 15.881 6.462 32.391 1.00 43.60 O ATOM 352 CB ARG A 806 12.730 5.451 32.019 1.00 45.80 C ATOM 353 CG ARG A 806 12.676 6.800 31.318 1.00 49.93 C ATOM 354 CD ARG A 806 11.679 7.744 31.970 1.00 48.78 C ATOM 355 NE ARG A 806 12.336 8.838 32.676 1.00 49.44 N ATOM 356 CZ ARG A 806 12.527 8.893 33.985 1.00 49.36 C ATOM 357 NH1 ARG A 806 11.982 7.984 34.777 1.00 56.68 N ATOM 358 NH2 ARG A 806 13.266 9.860 34.496 1.00 53.14 N ATOM 359 HE ARG A 806 12.681 9.637 32.107 1.00 0.00 H ATOM 360 HH12 ARG A 806 12.135 8.031 35.805 1.00 0.00 H ATOM 361 HH11 ARG A 806 11.401 7.222 34.372 1.00 0.00 H ATOM 362 HH22 ARG A 806 13.420 9.909 35.523 1.00 0.00 H ATOM 363 HH21 ARG A 806 13.694 10.573 33.871 1.00 0.00 H ATOM 364 H ARG A 806 13.010 3.194 33.020 1.00 0.00 H ATOM 365 N ASP A 807 14.841 5.858 34.270 1.00 42.06 N ATOM 366 CA ASP A 807 15.426 6.887 35.151 1.00 47.59 C ATOM 367 C ASP A 807 16.914 6.647 35.475 1.00 47.03 C ATOM 368 O ASP A 807 17.563 7.501 36.073 1.00 54.77 O ATOM 369 CB ASP A 807 14.552 6.992 36.418 1.00 54.07 C ATOM 370 CG ASP A 807 15.117 7.829 37.549 1.00 58.64 C ATOM 371 OD1 ASP A 807 16.121 8.515 37.305 1.00 63.30 O ATOM 372 OD2 ASP A 807 14.532 7.795 38.672 1.00 59.27 O ATOM 373 H ASP A 807 14.232 5.136 34.705 1.00 0.00 H ATOM 374 N SER A 808 17.486 5.535 35.031 1.00 37.34 N ATOM 375 CA SER A 808 18.756 4.984 35.520 1.00 35.73 C ATOM 376 C SER A 808 19.954 5.587 34.781 1.00 35.73 C ATOM 377 O SER A 808 19.819 6.050 33.658 1.00 37.68 O ATOM 378 CB SER A 808 18.750 3.476 35.353 1.00 37.60 C ATOM 379 OG SER A 808 18.829 3.087 33.975 1.00 33.25 O ATOM 380 HG SER A 808 18.052 3.456 33.484 1.00 0.00 H ATOM 381 H SER A 808 16.996 5.012 34.277 1.00 0.00 H ATOM 382 N GLU A 809 21.137 5.469 35.395 1.00 38.84 N ATOM 383 CA GLU A 809 22.396 5.904 34.776 1.00 40.08 C ATOM 384 C GLU A 809 22.639 5.138 33.461 1.00 36.70 C ATOM 385 O GLU A 809 23.014 5.740 32.457 1.00 36.28 O ATOM 386 CB GLU A 809 23.573 5.748 35.746 1.00 49.90 C ATOM 387 CG GLU A 809 23.543 6.742 36.901 1.00 61.48 C ATOM 388 CD GLU A 809 24.877 7.385 37.261 1.00 68.94 C ATOM 389 OE1 GLU A 809 25.761 7.469 36.372 1.00 81.27 O ATOM 390 OE2 GLU A 809 25.029 7.811 38.423 1.00 77.03 O ATOM 391 H GLU A 809 21.166 5.053 36.348 1.00 0.00 H ATOM 392 N GLU A 810 22.413 3.815 33.461 1.00 34.40 N ATOM 393 CA GLU A 810 22.564 2.997 32.263 1.00 33.81 C ATOM 394 C GLU A 810 21.691 3.525 31.116 1.00 31.39 C ATOM 395 O GLU A 810 22.144 3.624 29.973 1.00 29.58 O ATOM 396 CB GLU A 810 22.124 1.554 32.499 1.00 38.14 C ATOM 397 CG GLU A 810 23.158 0.684 33.134 1.00 42.09 C ATOM 398 CD GLU A 810 22.529 -0.641 33.519 1.00 45.96 C ATOM 399 OE1 GLU A 810 21.560 -0.642 34.321 1.00 51.84 O ATOM 400 OE2 GLU A 810 22.969 -1.655 32.997 1.00 44.33 O ATOM 401 H GLU A 810 22.120 3.357 34.347 1.00 0.00 H ATOM 402 N ALA A 811 20.420 3.816 31.418 1.00 30.56 N ATOM 403 CA ALA A 811 19.490 4.267 30.387 1.00 29.23 C ATOM 404 C ALA A 811 19.928 5.632 29.842 1.00 29.66 C ATOM 405 O ALA A 811 19.871 5.866 28.629 1.00 28.96 O ATOM 406 CB ALA A 811 18.084 4.287 30.908 1.00 30.84 C ATOM 407 H ALA A 811 20.091 3.720 32.400 1.00 0.00 H ATOM 408 N GLU A 812 20.413 6.497 30.735 1.00 31.54 N ATOM 409 CA GLU A 812 20.895 7.834 30.340 1.00 31.71 C ATOM 410 C GLU A 812 22.064 7.699 29.351 1.00 29.51 C ATOM 411 O GLU A 812 22.119 8.349 28.306 1.00 31.27 O ATOM 412 CB GLU A 812 21.303 8.657 31.565 1.00 38.90 C ATOM 413 CG GLU A 812 20.150 9.044 32.462 1.00 46.29 C ATOM 414 CD GLU A 812 20.545 9.825 33.711 1.00 55.97 C ATOM 415 OE1 GLU A 812 21.770 10.063 33.922 1.00 66.48 O ATOM 416 OE2 GLU A 812 19.632 10.217 34.464 1.00 68.12 O ATOM 417 H GLU A 812 20.452 6.221 31.737 1.00 0.00 H ATOM 418 N ILE A 813 23.004 6.817 29.684 1.00 28.11 N ATOM 419 CA ILE A 813 24.188 6.615 28.875 1.00 28.30 C ATOM 420 C ILE A 813 23.769 6.074 27.493 1.00 27.55 C ATOM 421 O ILE A 813 24.256 6.502 26.471 1.00 27.69 O ATOM 422 CB ILE A 813 25.178 5.688 29.608 1.00 28.83 C ATOM 423 CG1 ILE A 813 25.847 6.425 30.770 1.00 33.46 C ATOM 424 CG2 ILE A 813 26.184 5.103 28.622 1.00 29.65 C ATOM 425 CD1 ILE A 813 26.531 5.532 31.781 1.00 36.46 C ATOM 426 H ILE A 813 22.884 6.256 30.552 1.00 0.00 H ATOM 427 N ILE A 814 22.881 5.074 27.483 1.00 25.78 N ATOM 428 CA ILE A 814 22.478 4.447 26.242 1.00 25.32 C ATOM 429 C ILE A 814 21.729 5.445 25.356 1.00 27.17 C ATOM 430 O ILE A 814 21.972 5.481 24.129 1.00 25.89 O ATOM 431 CB ILE A 814 21.691 3.148 26.533 1.00 24.55 C ATOM 432 CG1 ILE A 814 22.637 2.081 27.100 1.00 25.94 C ATOM 433 CG2 ILE A 814 20.970 2.661 25.282 1.00 26.21 C ATOM 434 CD1 ILE A 814 21.929 0.891 27.716 1.00 27.23 C ATOM 435 H ILE A 814 22.474 4.742 28.380 1.00 0.00 H ATOM 436 N ARG A 815 20.810 6.224 25.946 1.00 27.09 N ATOM 437 CA ARG A 815 20.100 7.238 25.164 1.00 28.95 C ATOM 438 C ARG A 815 21.079 8.262 24.574 1.00 28.88 C ATOM 439 O ARG A 815 20.927 8.677 23.428 1.00 29.86 O ATOM 440 CB ARG A 815 19.038 7.938 26.006 1.00 31.12 C ATOM 441 CG ARG A 815 17.778 7.118 26.239 1.00 36.14 C ATOM 442 CD ARG A 815 16.692 7.986 26.867 1.00 42.28 C ATOM 443 NE ARG A 815 17.107 8.626 28.120 1.00 47.63 N ATOM 444 CZ ARG A 815 16.910 8.123 29.343 1.00 49.26 C ATOM 445 NH1 ARG A 815 16.333 6.943 29.495 1.00 48.69 N ATOM 446 NH2 ARG A 815 17.301 8.796 30.417 1.00 58.29 N ATOM 447 HE ARG A 815 17.593 9.543 28.052 1.00 0.00 H ATOM 448 HH12 ARG A 815 16.182 6.557 30.449 1.00 0.00 H ATOM 449 HH11 ARG A 815 16.030 6.401 28.661 1.00 0.00 H ATOM 450 HH22 ARG A 815 17.144 8.399 31.365 1.00 0.00 H ATOM 451 HH21 ARG A 815 17.764 9.721 30.311 1.00 0.00 H ATOM 452 H ARG A 815 20.602 6.108 26.958 1.00 0.00 H ATOM 453 N LYS A 816 22.120 8.615 25.329 1.00 28.25 N ATOM 454 CA LYS A 816 23.115 9.567 24.833 1.00 30.68 C ATOM 455 C LYS A 816 23.904 8.964 23.659 1.00 28.10 C ATOM 456 O LYS A 816 24.244 9.652 22.692 1.00 28.72 O ATOM 457 CB LYS A 816 24.058 9.968 25.953 1.00 29.70 C ATOM 458 CG LYS A 816 25.053 11.050 25.574 1.00 33.88 C ATOM 459 CD LYS A 816 25.764 11.642 26.774 1.00 38.69 C ATOM 460 CE LYS A 816 26.603 12.848 26.401 1.00 45.49 C ATOM 461 NZ LYS A 816 27.094 13.562 27.602 1.00 50.22 N ATOM 462 HZ1 LYS A 816 26.283 13.887 28.166 1.00 0.00 H ATOM 463 HZ2 LYS A 816 27.679 12.918 28.172 1.00 0.00 H ATOM 464 HZ3 LYS A 816 27.664 14.381 27.308 1.00 0.00 H ATOM 465 H LYS A 816 22.226 8.209 26.281 1.00 0.00 H ATOM 466 N TYR A 817 24.215 7.669 23.756 1.00 25.86 N ATOM 467 CA TYR A 817 24.949 6.966 22.706 1.00 24.59 C ATOM 468 C TYR A 817 24.124 7.000 21.412 1.00 25.39 C ATOM 469 O TYR A 817 24.640 7.290 20.337 1.00 26.54 O ATOM 470 CB TYR A 817 25.273 5.552 23.198 1.00 24.17 C ATOM 471 CG TYR A 817 26.302 4.742 22.441 1.00 23.71 C ATOM 472 CD1 TYR A 817 27.084 5.247 21.407 1.00 23.56 C ATOM 473 CD2 TYR A 817 26.552 3.448 22.864 1.00 23.37 C ATOM 474 CE1 TYR A 817 28.073 4.474 20.797 1.00 21.94 C ATOM 475 CE2 TYR A 817 27.501 2.657 22.242 1.00 22.49 C ATOM 476 CZ TYR A 817 28.267 3.166 21.209 1.00 20.89 C ATOM 477 OH TYR A 817 29.215 2.385 20.597 1.00 22.27 O ATOM 478 HH TYR A 817 29.884 2.095 21.266 1.00 0.00 H ATOM 479 H TYR A 817 23.926 7.144 24.606 1.00 0.00 H ATOM 480 N VAL A 818 22.808 6.763 21.526 1.00 25.03 N ATOM 481 CA VAL A 818 21.912 6.801 20.355 1.00 26.39 C ATOM 482 C VAL A 818 21.834 8.226 19.792 1.00 27.47 C ATOM 483 O VAL A 818 21.908 8.422 18.589 1.00 29.69 O ATOM 484 CB VAL A 818 20.508 6.281 20.715 1.00 27.80 C ATOM 485 CG1 VAL A 818 19.503 6.503 19.596 1.00 30.46 C ATOM 486 CG2 VAL A 818 20.523 4.820 21.132 1.00 26.70 C ATOM 487 H VAL A 818 22.410 6.547 22.462 1.00 0.00 H ATOM 488 N LYS A 819 21.716 9.215 20.684 1.00 28.51 N ATOM 489 CA LYS A 819 21.546 10.588 20.261 1.00 29.65 C ATOM 490 C LYS A 819 22.798 11.063 19.510 1.00 30.31 C ATOM 491 O LYS A 819 22.710 11.684 18.452 1.00 35.91 O ATOM 492 CB LYS A 819 21.279 11.500 21.463 1.00 33.03 C ATOM 493 CG LYS A 819 21.164 12.976 21.103 1.00 40.71 C ATOM 494 CD LYS A 819 21.037 13.922 22.288 1.00 47.24 C ATOM 495 CE LYS A 819 20.921 15.373 21.864 1.00 55.10 C ATOM 496 NZ LYS A 819 20.490 16.224 22.993 1.00 65.42 N ATOM 497 HZ1 LYS A 819 19.562 15.901 23.334 1.00 0.00 H ATOM 498 HZ2 LYS A 819 21.187 16.156 23.762 1.00 0.00 H ATOM 499 HZ3 LYS A 819 20.419 17.211 22.674 1.00 0.00 H ATOM 500 H LYS A 819 21.747 8.993 21.700 1.00 0.00 H ATOM 501 N ASN A 820 23.974 10.755 20.055 1.00 29.07 N ATOM 502 CA ASN A 820 25.194 11.431 19.629 1.00 29.55 C ATOM 503 C ASN A 820 25.828 10.770 18.399 1.00 28.82 C ATOM 504 O ASN A 820 26.610 11.400 17.706 1.00 29.87 O ATOM 505 CB ASN A 820 26.253 11.434 20.732 1.00 31.02 C ATOM 506 CG ASN A 820 26.033 12.510 21.772 1.00 30.89 C ATOM 507 OD1 ASN A 820 25.108 13.330 21.676 1.00 35.55 O ATOM 508 ND2 ASN A 820 26.874 12.490 22.793 1.00 35.30 N ATOM 509 HD22 ASN A 820 27.634 11.781 22.827 1.00 0.00 H ATOM 510 HD21 ASN A 820 26.775 13.183 23.562 1.00 0.00 H ATOM 511 H ASN A 820 24.023 10.024 20.793 1.00 0.00 H ATOM 512 N THR A 821 25.496 9.516 18.114 1.00 27.94 N ATOM 513 CA THR A 821 26.254 8.771 17.093 1.00 26.31 C ATOM 514 C THR A 821 25.396 8.407 15.871 1.00 27.55 C ATOM 515 O THR A 821 25.703 7.467 15.119 1.00 28.74 O ATOM 516 CB THR A 821 26.943 7.526 17.673 1.00 26.05 C ATOM 517 OG1 THR A 821 25.995 6.506 18.011 1.00 26.18 O ATOM 518 CG2 THR A 821 27.812 7.866 18.870 1.00 26.26 C ATOM 519 HG1 THR A 821 25.362 6.856 18.687 1.00 0.00 H ATOM 520 H THR A 821 24.703 9.061 18.610 1.00 0.00 H ATOM 521 N HIS A 822 24.338 9.174 15.635 1.00 29.91 N ATOM 522 CA HIS A 822 23.606 9.063 14.393 1.00 31.36 C ATOM 523 C HIS A 822 24.369 9.832 13.312 1.00 31.35 C ATOM 524 O HIS A 822 24.590 11.030 13.465 1.00 36.94 O ATOM 525 CB HIS A 822 22.192 9.610 14.551 1.00 35.12 C ATOM 526 CG HIS A 822 21.285 9.193 13.441 1.00 35.30 C ATOM 527 ND1 HIS A 822 20.100 8.537 13.678 1.00 38.69 N ATOM 528 CD2 HIS A 822 21.389 9.318 12.099 1.00 34.39 C ATOM 529 CE1 HIS A 822 19.504 8.280 12.533 1.00 39.08 C ATOM 530 NE2 HIS A 822 20.271 8.743 11.546 1.00 34.18 N ATOM 531 H HIS A 822 24.032 9.863 16.352 1.00 0.00 H ATOM 532 N ALA A 823 24.768 9.138 12.241 1.00 31.99 N ATOM 533 CA ALA A 823 25.632 9.729 11.202 1.00 32.15 C ATOM 534 C ALA A 823 24.866 10.774 10.387 1.00 32.87 C ATOM 535 O ALA A 823 23.709 10.588 10.061 1.00 33.66 O ATOM 536 CB ALA A 823 26.171 8.646 10.301 1.00 33.66 C ATOM 537 H ALA A 823 24.459 8.150 12.137 1.00 0.00 H ATOM 538 N THR A 824 25.575 11.822 9.950 1.00 36.39 N ATOM 539 CA THR A 824 24.960 12.867 9.145 1.00 40.55 C ATOM 540 C THR A 824 24.438 12.324 7.805 1.00 38.80 C ATOM 541 O THR A 824 23.455 12.871 7.270 1.00 44.67 O ATOM 542 CB THR A 824 25.926 14.038 8.903 1.00 43.44 C ATOM 543 OG1 THR A 824 27.048 13.574 8.149 1.00 45.59 O ATOM 544 CG2 THR A 824 26.398 14.678 10.191 1.00 45.31 C ATOM 545 HG1 THR A 824 27.511 12.860 8.654 1.00 0.00 H ATOM 546 H THR A 824 26.585 11.891 10.190 1.00 0.00 H ATOM 547 N THR A 825 25.095 11.297 7.239 1.00 36.53 N ATOM 548 CA THR A 825 24.695 10.793 5.907 1.00 38.78 C ATOM 549 C THR A 825 23.513 9.814 5.997 1.00 38.13 C ATOM 550 O THR A 825 22.977 9.403 4.963 1.00 39.36 O ATOM 551 CB THR A 825 25.876 10.155 5.169 1.00 39.44 C ATOM 552 OG1 THR A 825 26.317 9.017 5.911 1.00 40.11 O ATOM 553 CG2 THR A 825 27.012 11.135 4.947 1.00 40.50 C ATOM 554 HG1 THR A 825 26.600 9.304 6.816 1.00 0.00 H ATOM 555 H THR A 825 25.890 10.853 7.741 1.00 0.00 H ATOM 556 N HIS A 826 23.127 9.411 7.214 1.00 34.86 N ATOM 557 CA HIS A 826 22.021 8.473 7.402 1.00 36.24 C ATOM 558 C HIS A 826 20.758 9.271 7.749 1.00 38.54 C ATOM 559 O HIS A 826 20.185 9.140 8.805 1.00 38.84 O ATOM 560 CB HIS A 826 22.382 7.425 8.464 1.00 33.31 C ATOM 561 CG HIS A 826 23.563 6.579 8.106 1.00 31.94 C ATOM 562 ND1 HIS A 826 24.377 6.010 9.065 1.00 31.54 N ATOM 563 CD2 HIS A 826 24.077 6.229 6.904 1.00 32.90 C ATOM 564 CE1 HIS A 826 25.341 5.338 8.468 1.00 31.08 C ATOM 565 NE2 HIS A 826 25.180 5.451 7.131 1.00 30.62 N ATOM 566 H HIS A 826 23.628 9.775 8.049 1.00 0.00 H ATOM 567 N ASN A 827 20.314 10.083 6.799 1.00 41.59 N ATOM 568 CA ASN A 827 19.363 11.155 7.106 1.00 41.94 C ATOM 569 C ASN A 827 17.945 10.778 6.656 1.00 43.19 C ATOM 570 O ASN A 827 17.064 11.627 6.694 1.00 48.53 O ATOM 571 CB ASN A 827 19.830 12.495 6.532 1.00 48.57 C ATOM 572 CG ASN A 827 19.966 12.480 5.028 1.00 53.24 C ATOM 573 OD1 ASN A 827 20.073 11.420 4.422 1.00 51.90 O ATOM 574 ND2 ASN A 827 19.961 13.649 4.416 1.00 63.19 N ATOM 575 HD22 ASN A 827 19.868 14.525 4.969 1.00 0.00 H ATOM 576 HD21 ASN A 827 20.050 13.694 3.381 1.00 0.00 H ATOM 577 H ASN A 827 20.646 9.957 5.821 1.00 0.00 H ATOM 578 N ALA A 828 17.726 9.528 6.234 1.00 40.44 N ATOM 579 CA ALA A 828 16.390 9.045 5.831 1.00 44.15 C ATOM 580 C ALA A 828 15.448 8.881 7.037 1.00 42.50 C ATOM 581 O ALA A 828 14.228 8.830 6.853 1.00 46.26 O ATOM 582 CB ALA A 828 16.521 7.739 5.087 1.00 45.36 C ATOM 583 H ALA A 828 18.529 8.869 6.188 1.00 0.00 H ATOM 584 N TYR A 829 16.007 8.785 8.254 1.00 38.99 N ATOM 585 CA TYR A 829 15.223 8.558 9.469 1.00 39.09 C ATOM 586 C TYR A 829 15.942 9.159 10.685 1.00 39.68 C ATOM 587 O TYR A 829 17.176 9.358 10.679 1.00 39.65 O ATOM 588 CB TYR A 829 14.980 7.058 9.662 1.00 37.03 C ATOM 589 CG TYR A 829 16.245 6.254 9.838 1.00 35.36 C ATOM 590 CD1 TYR A 829 16.848 6.144 11.076 1.00 34.29 C ATOM 591 CD2 TYR A 829 16.858 5.636 8.763 1.00 38.05 C ATOM 592 CE1 TYR A 829 18.026 5.437 11.241 1.00 31.60 C ATOM 593 CE2 TYR A 829 18.034 4.919 8.914 1.00 37.28 C ATOM 594 CZ TYR A 829 18.626 4.820 10.159 1.00 34.43 C ATOM 595 OH TYR A 829 19.789 4.117 10.332 1.00 34.85 O ATOM 596 HH TYR A 829 20.500 4.514 9.769 1.00 0.00 H ATOM 597 H TYR A 829 17.040 8.876 8.337 1.00 0.00 H ATOM 598 N ASP A 830 15.162 9.444 11.735 1.00 41.37 N ATOM 599 CA ASP A 830 15.712 9.613 13.076 1.00 43.13 C ATOM 600 C ASP A 830 15.234 8.449 13.948 1.00 40.18 C ATOM 601 O ASP A 830 14.322 7.706 13.571 1.00 40.49 O ATOM 602 CB ASP A 830 15.380 10.985 13.664 1.00 50.16 C ATOM 603 CG ASP A 830 13.900 11.277 13.747 1.00 59.69 C ATOM 604 OD1 ASP A 830 13.218 10.570 14.517 1.00 69.29 O ATOM 605 OD2 ASP A 830 13.445 12.218 13.042 1.00 71.13 O ATOM 606 H ASP A 830 14.137 9.548 11.591 1.00 0.00 H ATOM 607 N LEU A 831 15.921 8.266 15.081 1.00 36.63 N ATOM 608 CA LEU A 831 15.706 7.139 15.997 1.00 35.11 C ATOM 609 C LEU A 831 15.169 7.631 17.341 1.00 38.15 C ATOM 610 O LEU A 831 15.656 8.608 17.894 1.00 41.96 O ATOM 611 CB LEU A 831 17.040 6.421 16.195 1.00 34.32 C ATOM 612 CG LEU A 831 17.573 5.711 14.958 1.00 32.36 C ATOM 613 CD1 LEU A 831 18.963 5.186 15.245 1.00 33.71 C ATOM 614 CD2 LEU A 831 16.637 4.579 14.540 1.00 32.79 C ATOM 615 H LEU A 831 16.651 8.964 15.328 1.00 0.00 H ATOM 616 N GLU A 832 14.195 6.876 17.860 1.00 36.77 N ATOM 617 CA GLU A 832 13.667 7.030 19.211 1.00 37.28 C ATOM 618 C GLU A 832 13.783 5.683 19.926 1.00 36.18 C ATOM 619 O GLU A 832 13.412 4.656 19.368 1.00 35.79 O ATOM 620 CB GLU A 832 12.203 7.471 19.193 1.00 40.87 C ATOM 621 CG GLU A 832 11.971 8.807 18.517 1.00 42.76 C ATOM 622 CD GLU A 832 10.559 9.348 18.675 1.00 47.79 C ATOM 623 OE1 GLU A 832 9.730 9.144 17.758 1.00 48.52 O ATOM 624 OE2 GLU A 832 10.294 9.973 19.716 1.00 53.26 O ATOM 625 H GLU A 832 13.787 6.130 17.261 1.00 0.00 H ATOM 626 N VAL A 833 14.322 5.702 21.145 1.00 34.86 N ATOM 627 CA VAL A 833 14.428 4.487 21.937 1.00 31.61 C ATOM 628 C VAL A 833 13.065 4.254 22.611 1.00 34.74 C ATOM 629 O VAL A 833 12.577 5.130 23.348 1.00 38.82 O ATOM 630 CB VAL A 833 15.555 4.580 22.980 1.00 34.63 C ATOM 631 CG1 VAL A 833 15.629 3.331 23.843 1.00 36.39 C ATOM 632 CG2 VAL A 833 16.903 4.863 22.334 1.00 36.46 C ATOM 633 H VAL A 833 14.672 6.600 21.536 1.00 0.00 H ATOM 634 N ILE A 834 12.461 3.089 22.348 1.00 30.78 N ATOM 635 CA ILE A 834 11.183 2.712 22.967 1.00 32.16 C ATOM 636 C ILE A 834 11.463 2.010 24.299 1.00 31.50 C ATOM 637 O ILE A 834 10.981 2.449 25.358 1.00 35.99 O ATOM 638 CB ILE A 834 10.331 1.828 22.036 1.00 35.86 C ATOM 639 CG1 ILE A 834 10.041 2.541 20.714 1.00 37.71 C ATOM 640 CG2 ILE A 834 9.046 1.415 22.747 1.00 34.92 C ATOM 641 CD1 ILE A 834 9.359 1.668 19.680 1.00 43.64 C ATOM 642 H ILE A 834 12.911 2.428 21.683 1.00 0.00 H ATOM 643 N ASP A 835 12.245 0.929 24.234 1.00 28.80 N ATOM 644 CA ASP A 835 12.569 0.129 25.416 1.00 30.19 C ATOM 645 C ASP A 835 14.054 -0.240 25.352 1.00 27.10 C ATOM 646 O ASP A 835 14.587 -0.481 24.270 1.00 27.21 O ATOM 647 CB ASP A 835 11.749 -1.166 25.509 1.00 30.66 C ATOM 648 CG ASP A 835 10.250 -1.023 25.702 1.00 32.99 C ATOM 649 OD1 ASP A 835 9.828 -0.333 26.666 1.00 39.60 O ATOM 650 OD2 ASP A 835 9.499 -1.623 24.888 1.00 42.29 O ATOM 651 H ASP A 835 12.637 0.646 23.313 1.00 0.00 H ATOM 652 N ILE A 836 14.678 -0.336 26.527 1.00 25.84 N ATOM 653 CA ILE A 836 16.029 -0.838 26.686 1.00 25.36 C ATOM 654 C ILE A 836 15.940 -2.085 27.565 1.00 23.17 C ATOM 655 O ILE A 836 15.377 -2.009 28.688 1.00 25.78 O ATOM 656 CB ILE A 836 16.958 0.200 27.341 1.00 27.16 C ATOM 657 CG1 ILE A 836 16.946 1.552 26.611 1.00 30.05 C ATOM 658 CG2 ILE A 836 18.360 -0.374 27.487 1.00 28.13 C ATOM 659 CD1 ILE A 836 17.653 2.667 27.358 1.00 31.79 C ATOM 660 H ILE A 836 14.165 -0.033 27.379 1.00 0.00 H ATOM 661 N PHE A 837 16.527 -3.191 27.093 1.00 24.47 N ATOM 662 CA PHE A 837 16.594 -4.415 27.862 1.00 23.84 C ATOM 663 C PHE A 837 18.054 -4.775 28.132 1.00 22.32 C ATOM 664 O PHE A 837 18.899 -4.621 27.259 1.00 24.06 O ATOM 665 CB PHE A 837 15.941 -5.573 27.096 1.00 23.75 C ATOM 666 CG PHE A 837 14.520 -5.296 26.676 1.00 23.93 C ATOM 667 CD1 PHE A 837 13.462 -5.565 27.531 1.00 24.78 C ATOM 668 CD2 PHE A 837 14.243 -4.779 25.428 1.00 26.56 C ATOM 669 CE1 PHE A 837 12.155 -5.309 27.146 1.00 26.11 C ATOM 670 CE2 PHE A 837 12.935 -4.511 25.052 1.00 28.31 C ATOM 671 CZ PHE A 837 11.896 -4.799 25.903 1.00 27.38 C ATOM 672 H PHE A 837 16.949 -3.170 26.143 1.00 0.00 H ATOM 673 N LYS A 838 18.315 -5.264 29.346 1.00 21.76 N ATOM 674 CA LYS A 838 19.580 -5.822 29.718 1.00 23.70 C ATOM 675 C LYS A 838 19.449 -7.320 29.535 1.00 23.49 C ATOM 676 O LYS A 838 18.469 -7.911 30.006 1.00 24.81 O ATOM 677 CB LYS A 838 19.955 -5.486 31.163 1.00 24.76 C ATOM 678 CG LYS A 838 21.375 -5.872 31.569 1.00 31.41 C ATOM 679 CD LYS A 838 21.914 -5.144 32.795 1.00 39.04 C ATOM 680 CE LYS A 838 23.429 -5.259 32.909 1.00 45.53 C ATOM 681 NZ LYS A 838 23.954 -4.468 34.045 1.00 52.05 N ATOM 682 HZ1 LYS A 838 23.710 -3.466 33.910 1.00 0.00 H ATOM 683 HZ2 LYS A 838 23.531 -4.813 34.931 1.00 0.00 H ATOM 684 HZ3 LYS A 838 24.988 -4.572 34.090 1.00 0.00 H ATOM 685 H LYS A 838 17.559 -5.238 30.060 1.00 0.00 H ATOM 686 N ILE A 839 20.422 -7.921 28.846 1.00 22.08 N ATOM 687 CA ILE A 839 20.308 -9.323 28.488 1.00 22.42 C ATOM 688 C ILE A 839 21.532 -10.105 28.970 1.00 23.41 C ATOM 689 O ILE A 839 22.627 -9.591 28.994 1.00 23.79 O ATOM 690 CB ILE A 839 20.063 -9.515 26.983 1.00 23.38 C ATOM 691 CG1 ILE A 839 21.161 -8.879 26.143 1.00 24.38 C ATOM 692 CG2 ILE A 839 18.686 -9.013 26.543 1.00 26.19 C ATOM 693 CD1 ILE A 839 21.104 -9.260 24.673 1.00 26.43 C ATOM 694 H ILE A 839 21.266 -7.382 28.564 1.00 0.00 H ATOM 695 N GLU A 840 21.291 -11.386 29.316 1.00 22.78 N ATOM 696 CA GLU A 840 22.324 -12.326 29.696 1.00 23.74 C ATOM 697 C GLU A 840 21.982 -13.692 29.108 1.00 22.85 C ATOM 698 O GLU A 840 21.088 -14.387 29.595 1.00 24.58 O ATOM 699 CB GLU A 840 22.474 -12.424 31.211 1.00 27.54 C ATOM 700 CG GLU A 840 23.599 -13.344 31.668 1.00 32.24 C ATOM 701 CD GLU A 840 25.001 -12.769 31.681 1.00 37.16 C ATOM 702 OE1 GLU A 840 25.117 -11.542 31.510 1.00 40.82 O ATOM 703 OE2 GLU A 840 25.992 -13.548 31.914 1.00 43.23 O ATOM 704 H GLU A 840 20.305 -11.718 29.309 1.00 0.00 H ATOM 705 N ARG A 841 22.676 -14.045 28.023 1.00 23.09 N ATOM 706 CA ARG A 841 22.525 -15.363 27.420 1.00 23.80 C ATOM 707 C ARG A 841 23.035 -16.448 28.360 1.00 23.44 C ATOM 708 O ARG A 841 24.053 -16.306 28.979 1.00 25.34 O ATOM 709 CB ARG A 841 23.297 -15.441 26.105 1.00 24.01 C ATOM 710 CG ARG A 841 22.696 -14.610 24.996 1.00 25.12 C ATOM 711 CD ARG A 841 23.410 -14.794 23.674 1.00 28.46 C ATOM 712 NE ARG A 841 23.328 -16.165 23.229 1.00 31.54 N ATOM 713 CZ ARG A 841 24.328 -17.057 23.256 1.00 29.45 C ATOM 714 NH1 ARG A 841 25.576 -16.666 23.464 1.00 35.24 N ATOM 715 NH2 ARG A 841 24.056 -18.345 23.095 1.00 33.60 N ATOM 716 HE ARG A 841 22.413 -16.489 22.855 1.00 0.00 H ATOM 717 HH12 ARG A 841 26.344 -17.367 23.483 1.00 0.00 H ATOM 718 HH11 ARG A 841 25.788 -15.658 23.608 1.00 0.00 H ATOM 719 HH22 ARG A 841 24.825 -19.045 23.114 1.00 0.00 H ATOM 720 HH21 ARG A 841 23.074 -18.655 22.949 1.00 0.00 H ATOM 721 H ARG A 841 23.339 -13.365 27.599 1.00 0.00 H ATOM 722 N GLU A 842 22.283 -17.550 28.415 1.00 24.04 N ATOM 723 CA GLU A 842 22.732 -18.733 29.149 1.00 26.50 C ATOM 724 C GLU A 842 24.162 -19.105 28.733 1.00 27.64 C ATOM 725 O GLU A 842 24.456 -19.188 27.558 1.00 30.08 O ATOM 726 CB GLU A 842 21.771 -19.904 28.921 1.00 28.18 C ATOM 727 CG GLU A 842 22.117 -21.183 29.666 1.00 34.32 C ATOM 728 CD GLU A 842 20.976 -22.174 29.711 1.00 45.21 C ATOM 729 OE1 GLU A 842 20.470 -22.516 28.642 1.00 49.55 O ATOM 730 OE2 GLU A 842 20.566 -22.548 30.828 1.00 59.14 O ATOM 731 H GLU A 842 21.364 -17.568 27.929 1.00 0.00 H ATOM 732 N GLY A 843 25.037 -19.320 29.730 1.00 29.22 N ATOM 733 CA GLY A 843 26.392 -19.780 29.490 1.00 32.83 C ATOM 734 C GLY A 843 27.372 -18.687 29.069 1.00 35.80 C ATOM 735 O GLY A 843 28.555 -18.951 28.866 1.00 35.46 O ATOM 736 H GLY A 843 24.732 -19.150 30.710 1.00 0.00 H ATOM 737 N GLU A 844 26.895 -17.454 28.905 1.00 37.96 N ATOM 738 CA GLU A 844 27.718 -16.355 28.404 1.00 38.72 C ATOM 739 C GLU A 844 28.901 -16.043 29.327 1.00 36.34 C ATOM 740 O GLU A 844 30.016 -15.818 28.829 1.00 37.58 O ATOM 741 CB GLU A 844 26.853 -15.113 28.243 1.00 41.48 C ATOM 742 CG GLU A 844 27.546 -14.057 27.433 1.00 41.61 C ATOM 743 CD GLU A 844 27.360 -14.153 25.930 1.00 51.10 C ATOM 744 OE1 GLU A 844 27.915 -15.098 25.369 1.00 53.70 O ATOM 745 OE2 GLU A 844 26.707 -13.229 25.312 1.00 40.55 O ATOM 746 H GLU A 844 25.900 -17.266 29.142 1.00 0.00 H ATOM 747 N CYS A 845 28.658 -16.040 30.646 1.00 35.44 N ATOM 748 CA CYS A 845 29.679 -15.706 31.627 1.00 38.84 C ATOM 749 C CYS A 845 30.883 -16.630 31.414 1.00 35.81 C ATOM 750 O CYS A 845 31.981 -16.138 31.204 1.00 34.88 O ATOM 751 CB CYS A 845 29.124 -15.764 33.050 1.00 40.28 C ATOM 752 SG CYS A 845 30.222 -15.101 34.326 1.00 44.02 S ATOM 753 H CYS A 845 27.704 -16.286 30.980 1.00 0.00 H ATOM 754 N GLN A 846 30.654 -17.953 31.398 1.00 32.28 N ATOM 755 CA GLN A 846 31.751 -18.906 31.233 1.00 31.52 C ATOM 756 C GLN A 846 32.364 -18.826 29.823 1.00 29.12 C ATOM 757 O GLN A 846 33.558 -18.972 29.704 1.00 29.49 O ATOM 758 CB GLN A 846 31.280 -20.320 31.585 1.00 35.98 C ATOM 759 CG GLN A 846 31.076 -20.499 33.090 1.00 41.04 C ATOM 760 CD GLN A 846 30.934 -21.940 33.512 1.00 47.34 C ATOM 761 OE1 GLN A 846 31.922 -22.666 33.697 1.00 55.20 O ATOM 762 NE2 GLN A 846 29.691 -22.357 33.695 1.00 54.54 N ATOM 763 HE22 GLN A 846 28.895 -21.709 33.526 1.00 0.00 H ATOM 764 HE21 GLN A 846 29.510 -23.332 34.007 1.00 0.00 H ATOM 765 H GLN A 846 29.681 -18.305 31.505 1.00 0.00 H ATOM 766 N ARG A 847 31.581 -18.563 28.767 1.00 28.51 N ATOM 767 CA ARG A 847 32.153 -18.486 27.404 1.00 31.34 C ATOM 768 C ARG A 847 33.079 -17.264 27.282 1.00 29.01 C ATOM 769 O ARG A 847 34.085 -17.292 26.605 1.00 30.45 O ATOM 770 CB ARG A 847 31.097 -18.431 26.290 1.00 31.70 C ATOM 771 CG ARG A 847 31.732 -18.567 24.904 1.00 36.06 C ATOM 772 CD ARG A 847 30.770 -18.687 23.737 1.00 37.26 C ATOM 773 NE ARG A 847 30.141 -17.413 23.486 1.00 35.15 N ATOM 774 CZ ARG A 847 29.326 -17.133 22.471 1.00 34.31 C ATOM 775 NH1 ARG A 847 28.937 -18.087 21.639 1.00 37.34 N ATOM 776 NH2 ARG A 847 28.881 -15.891 22.335 1.00 35.22 N ATOM 777 HE ARG A 847 30.342 -16.645 24.158 1.00 0.00 H ATOM 778 HH12 ARG A 847 28.300 -17.860 20.849 1.00 0.00 H ATOM 779 HH11 ARG A 847 29.268 -19.063 21.776 1.00 0.00 H ATOM 780 HH22 ARG A 847 28.243 -15.650 21.549 1.00 0.00 H ATOM 781 HH21 ARG A 847 29.170 -15.158 23.014 1.00 0.00 H ATOM 782 H ARG A 847 30.562 -18.412 28.907 1.00 0.00 H ATOM 783 N TYR A 848 32.680 -16.150 27.893 1.00 30.86 N ATOM 784 CA TYR A 848 33.389 -14.892 27.683 1.00 28.82 C ATOM 785 C TYR A 848 34.610 -14.837 28.606 1.00 31.98 C ATOM 786 O TYR A 848 35.482 -14.032 28.402 1.00 31.12 O ATOM 787 CB TYR A 848 32.420 -13.729 27.883 1.00 27.40 C ATOM 788 CG TYR A 848 32.984 -12.363 27.572 1.00 24.84 C ATOM 789 CD1 TYR A 848 33.312 -11.982 26.260 1.00 24.04 C ATOM 790 CD2 TYR A 848 33.090 -11.421 28.577 1.00 27.15 C ATOM 791 CE1 TYR A 848 33.783 -10.701 25.990 1.00 28.57 C ATOM 792 CE2 TYR A 848 33.557 -10.141 28.310 1.00 29.25 C ATOM 793 CZ TYR A 848 33.908 -9.781 27.015 1.00 30.38 C ATOM 794 OH TYR A 848 34.453 -8.544 26.752 1.00 27.34 O ATOM 795 HH TYR A 848 33.815 -7.838 27.025 1.00 0.00 H ATOM 796 H TYR A 848 31.855 -16.177 28.526 1.00 0.00 H ATOM 797 N LYS A 849 34.636 -15.690 29.635 1.00 31.87 N ATOM 798 CA LYS A 849 35.644 -15.621 30.685 1.00 42.00 C ATOM 799 C LYS A 849 37.050 -15.435 30.116 1.00 37.87 C ATOM 800 O LYS A 849 37.777 -14.580 30.621 1.00 44.78 O ATOM 801 CB LYS A 849 35.577 -16.858 31.581 1.00 48.22 C ATOM 802 CG LYS A 849 36.446 -16.770 32.822 1.00 54.28 C ATOM 803 CD LYS A 849 36.550 -18.067 33.600 1.00 60.42 C ATOM 804 CE LYS A 849 35.218 -18.699 33.948 1.00 64.96 C ATOM 805 NZ LYS A 849 35.374 -19.732 34.999 1.00 67.96 N ATOM 806 HZ1 LYS A 849 36.017 -20.476 34.659 1.00 0.00 H ATOM 807 HZ2 LYS A 849 35.769 -19.296 35.856 1.00 0.00 H ATOM 808 HZ3 LYS A 849 34.445 -20.147 35.216 1.00 0.00 H ATOM 809 H LYS A 849 33.909 -16.431 29.688 1.00 0.00 H ATOM 810 N PRO A 850 37.498 -16.200 29.085 1.00 39.07 N ATOM 811 CA PRO A 850 38.872 -16.075 28.600 1.00 39.07 C ATOM 812 C PRO A 850 39.233 -14.711 27.988 1.00 37.63 C ATOM 813 O PRO A 850 40.422 -14.463 27.772 1.00 47.62 O ATOM 814 CB PRO A 850 39.018 -17.149 27.505 1.00 43.67 C ATOM 815 CG PRO A 850 37.826 -18.065 27.679 1.00 46.16 C ATOM 816 CD PRO A 850 36.758 -17.251 28.370 1.00 40.11 C ATOM 817 N PHE A 851 38.232 -13.857 27.742 1.00 33.77 N ATOM 818 CA PHE A 851 38.430 -12.542 27.143 1.00 32.34 C ATOM 819 C PHE A 851 38.030 -11.392 28.080 1.00 34.85 C ATOM 820 O PHE A 851 38.286 -10.209 27.773 1.00 37.96 O ATOM 821 CB PHE A 851 37.640 -12.452 25.827 1.00 32.31 C ATOM 822 CG PHE A 851 38.121 -13.384 24.745 1.00 32.83 C ATOM 823 CD1 PHE A 851 39.305 -13.137 24.067 1.00 36.04 C ATOM 824 CD2 PHE A 851 37.415 -14.532 24.422 1.00 37.90 C ATOM 825 CE1 PHE A 851 39.753 -13.995 23.071 1.00 42.47 C ATOM 826 CE2 PHE A 851 37.878 -15.402 23.441 1.00 37.84 C ATOM 827 CZ PHE A 851 39.039 -15.127 22.761 1.00 41.41 C ATOM 828 H PHE A 851 37.264 -14.146 27.991 1.00 0.00 H ATOM 829 N LYS A 852 37.417 -11.746 29.212 1.00 36.13 N ATOM 830 CA LYS A 852 36.807 -10.815 30.165 1.00 37.76 C ATOM 831 C LYS A 852 37.872 -9.840 30.686 1.00 37.50 C ATOM 832 O LYS A 852 37.526 -8.702 31.066 1.00 39.42 O ATOM 833 CB LYS A 852 36.124 -11.611 31.291 1.00 39.59 C ATOM 834 CG LYS A 852 35.877 -10.879 32.610 1.00 39.04 C ATOM 835 CD LYS A 852 34.499 -10.268 32.750 1.00 42.20 C ATOM 836 CE LYS A 852 34.427 -8.803 32.379 1.00 42.02 C ATOM 837 NZ LYS A 852 34.354 -8.615 30.911 1.00 33.24 N ATOM 838 HZ1 LYS A 852 35.201 -9.025 30.468 1.00 0.00 H ATOM 839 HZ2 LYS A 852 33.504 -9.089 30.544 1.00 0.00 H ATOM 840 HZ3 LYS A 852 34.306 -7.599 30.695 1.00 0.00 H ATOM 841 H LYS A 852 37.369 -12.761 29.435 1.00 0.00 H ATOM 842 N GLN A 853 39.152 -10.290 30.722 1.00 35.09 N ATOM 843 CA GLN A 853 40.250 -9.480 31.203 1.00 41.14 C ATOM 844 C GLN A 853 41.117 -8.880 30.079 1.00 40.19 C ATOM 845 O GLN A 853 42.063 -8.146 30.389 1.00 46.43 O ATOM 846 CB GLN A 853 41.190 -10.295 32.088 1.00 46.52 C ATOM 847 CG GLN A 853 40.485 -11.090 33.175 1.00 51.21 C ATOM 848 CD GLN A 853 41.460 -11.558 34.225 1.00 50.95 C ATOM 849 OE1 GLN A 853 42.031 -10.761 34.974 1.00 64.61 O ATOM 850 NE2 GLN A 853 41.668 -12.863 34.278 1.00 59.60 N ATOM 851 HE22 GLN A 853 41.163 -13.497 33.626 1.00 0.00 H ATOM 852 HE21 GLN A 853 42.336 -13.255 34.972 1.00 0.00 H ATOM 853 H GLN A 853 39.351 -11.255 30.391 1.00 0.00 H ATOM 854 N LEU A 854 40.847 -9.193 28.800 1.00 37.78 N ATOM 855 CA LEU A 854 41.584 -8.572 27.672 1.00 34.73 C ATOM 856 C LEU A 854 41.342 -7.063 27.719 1.00 32.50 C ATOM 857 O LEU A 854 40.295 -6.619 28.141 1.00 36.23 O ATOM 858 CB LEU A 854 41.076 -9.182 26.359 1.00 34.60 C ATOM 859 CG LEU A 854 41.829 -8.839 25.082 1.00 33.91 C ATOM 860 CD1 LEU A 854 43.287 -9.271 25.139 1.00 35.61 C ATOM 861 CD2 LEU A 854 41.132 -9.464 23.877 1.00 32.29 C ATOM 862 H LEU A 854 40.102 -9.889 28.596 1.00 0.00 H ATOM 863 N HIS A 855 42.338 -6.282 27.319 1.00 30.96 N ATOM 864 CA HIS A 855 42.199 -4.859 27.247 1.00 29.37 C ATOM 865 C HIS A 855 41.326 -4.465 26.050 1.00 27.33 C ATOM 866 O HIS A 855 41.044 -5.262 25.146 1.00 27.14 O ATOM 867 CB HIS A 855 43.576 -4.194 27.163 1.00 31.59 C ATOM 868 CG HIS A 855 44.332 -4.574 25.936 1.00 31.89 C ATOM 869 ND1 HIS A 855 44.899 -5.825 25.783 1.00 33.44 N ATOM 870 CD2 HIS A 855 44.620 -3.884 24.811 1.00 31.83 C ATOM 871 CE1 HIS A 855 45.520 -5.886 24.623 1.00 34.21 C ATOM 872 NE2 HIS A 855 45.361 -4.710 24.004 1.00 32.62 N ATOM 873 H HIS A 855 43.244 -6.716 27.051 1.00 0.00 H ATOM 874 N ASN A 856 40.872 -3.220 26.083 1.00 26.72 N ATOM 875 CA ASN A 856 40.160 -2.611 24.973 1.00 25.45 C ATOM 876 C ASN A 856 38.845 -3.351 24.727 1.00 23.96 C ATOM 877 O ASN A 856 38.565 -3.879 23.649 1.00 26.70 O ATOM 878 CB ASN A 856 41.030 -2.554 23.724 1.00 25.59 C ATOM 879 CG ASN A 856 40.418 -1.771 22.598 1.00 26.81 C ATOM 880 OD1 ASN A 856 39.587 -0.870 22.826 1.00 28.48 O ATOM 881 ND2 ASN A 856 40.841 -2.103 21.394 1.00 25.32 N ATOM 882 HD22 ASN A 856 41.537 -2.867 21.280 1.00 0.00 H ATOM 883 HD21 ASN A 856 40.478 -1.601 20.559 1.00 0.00 H ATOM 884 H ASN A 856 41.033 -2.655 26.941 1.00 0.00 H ATOM 885 N ARG A 857 38.015 -3.340 25.758 1.00 22.97 N ATOM 886 CA ARG A 857 36.679 -3.877 25.673 1.00 22.44 C ATOM 887 C ARG A 857 35.730 -2.696 25.454 1.00 21.96 C ATOM 888 O ARG A 857 35.750 -1.719 26.230 1.00 25.34 O ATOM 889 CB ARG A 857 36.353 -4.681 26.935 1.00 24.40 C ATOM 890 CG ARG A 857 37.287 -5.853 27.186 1.00 29.20 C ATOM 891 CD ARG A 857 36.944 -6.661 28.431 1.00 32.71 C ATOM 892 NE ARG A 857 37.548 -6.050 29.598 1.00 44.24 N ATOM 893 CZ ARG A 857 36.905 -5.377 30.548 1.00 47.15 C ATOM 894 NH1 ARG A 857 35.585 -5.430 30.643 1.00 49.14 N ATOM 895 NH2 ARG A 857 37.603 -4.653 31.409 1.00 54.50 N ATOM 896 HE ARG A 857 38.578 -6.147 29.702 1.00 0.00 H ATOM 897 HH12 ARG A 857 35.096 -4.898 31.391 1.00 0.00 H ATOM 898 HH11 ARG A 857 35.038 -6.003 29.970 1.00 0.00 H ATOM 899 HH22 ARG A 857 37.114 -4.121 32.157 1.00 0.00 H ATOM 900 HH21 ARG A 857 38.640 -4.616 31.337 1.00 0.00 H ATOM 901 H ARG A 857 38.337 -2.931 26.658 1.00 0.00 H ATOM 902 N ARG A 858 34.926 -2.770 24.375 1.00 21.29 N ATOM 903 CA ARG A 858 34.134 -1.634 23.934 1.00 20.83 C ATOM 904 C ARG A 858 32.669 -2.053 23.748 1.00 21.01 C ATOM 905 O ARG A 858 32.385 -3.183 23.319 1.00 22.52 O ATOM 906 CB ARG A 858 34.775 -1.090 22.653 1.00 21.37 C ATOM 907 CG ARG A 858 34.352 0.313 22.255 1.00 22.24 C ATOM 908 CD ARG A 858 35.239 0.863 21.145 1.00 27.50 C ATOM 909 NE ARG A 858 36.653 0.850 21.502 1.00 31.11 N ATOM 910 CZ ARG A 858 37.626 1.287 20.703 1.00 32.27 C ATOM 911 NH1 ARG A 858 37.310 1.882 19.563 1.00 37.22 N ATOM 912 NH2 ARG A 858 38.895 1.173 21.069 1.00 38.40 N ATOM 913 HE ARG A 858 36.918 0.477 22.436 1.00 0.00 H ATOM 914 HH12 ARG A 858 38.060 2.227 18.931 1.00 0.00 H ATOM 915 HH11 ARG A 858 36.311 2.004 19.299 1.00 0.00 H ATOM 916 HH22 ARG A 858 39.650 1.516 20.441 1.00 0.00 H ATOM 917 HH21 ARG A 858 39.136 0.741 21.984 1.00 0.00 H ATOM 918 H ARG A 858 34.871 -3.663 23.844 1.00 0.00 H ATOM 919 N LEU A 859 31.754 -1.114 24.044 1.00 20.47 N ATOM 920 CA LEU A 859 30.303 -1.348 23.909 1.00 19.92 C ATOM 921 C LEU A 859 29.888 -0.841 22.532 1.00 20.22 C ATOM 922 O LEU A 859 29.962 0.371 22.276 1.00 21.38 O ATOM 923 CB LEU A 859 29.549 -0.630 25.017 1.00 21.81 C ATOM 924 CG LEU A 859 28.116 -1.079 25.216 1.00 22.59 C ATOM 925 CD1 LEU A 859 28.099 -2.467 25.821 1.00 23.39 C ATOM 926 CD2 LEU A 859 27.353 -0.102 26.075 1.00 24.55 C ATOM 927 H LEU A 859 32.081 -0.186 24.381 1.00 0.00 H ATOM 928 N LEU A 860 29.523 -1.763 21.651 1.00 19.68 N ATOM 929 CA LEU A 860 29.337 -1.486 20.244 1.00 19.54 C ATOM 930 C LEU A 860 27.979 -2.000 19.758 1.00 19.91 C ATOM 931 O LEU A 860 27.425 -2.936 20.319 1.00 20.50 O ATOM 932 CB LEU A 860 30.484 -2.083 19.433 1.00 20.11 C ATOM 933 CG LEU A 860 31.880 -1.550 19.744 1.00 20.67 C ATOM 934 CD1 LEU A 860 32.946 -2.384 19.042 1.00 22.43 C ATOM 935 CD2 LEU A 860 32.034 -0.087 19.361 1.00 22.55 C ATOM 936 H LEU A 860 29.363 -2.733 21.989 1.00 0.00 H ATOM 937 N TRP A 861 27.514 -1.392 18.655 1.00 19.36 N ATOM 938 CA TRP A 861 26.221 -1.672 18.056 1.00 20.17 C ATOM 939 C TRP A 861 26.295 -2.861 17.099 1.00 20.19 C ATOM 940 O TRP A 861 27.264 -3.015 16.339 1.00 20.93 O ATOM 941 CB TRP A 861 25.729 -0.465 17.263 1.00 21.39 C ATOM 942 CG TRP A 861 25.561 0.781 18.068 1.00 23.02 C ATOM 943 CD1 TRP A 861 26.365 1.884 18.072 1.00 23.91 C ATOM 944 CD2 TRP A 861 24.512 1.047 19.014 1.00 22.42 C ATOM 945 NE1 TRP A 861 25.860 2.825 18.912 1.00 24.34 N ATOM 946 CE2 TRP A 861 24.730 2.341 19.519 1.00 23.93 C ATOM 947 CE3 TRP A 861 23.395 0.335 19.449 1.00 23.29 C ATOM 948 CZ2 TRP A 861 23.902 2.910 20.472 1.00 25.17 C ATOM 949 CZ3 TRP A 861 22.568 0.907 20.375 1.00 24.47 C ATOM 950 CH2 TRP A 861 22.822 2.172 20.884 1.00 25.50 C ATOM 951 HE1 TRP A 861 26.268 3.768 19.070 1.00 0.00 H ATOM 952 H TRP A 861 28.117 -0.676 18.202 1.00 0.00 H ATOM 953 N HIS A 862 25.196 -3.625 17.067 1.00 19.95 N ATOM 954 CA HIS A 862 24.976 -4.617 16.014 1.00 19.96 C ATOM 955 C HIS A 862 23.495 -4.654 15.665 1.00 20.16 C ATOM 956 O HIS A 862 22.662 -4.990 16.527 1.00 21.31 O ATOM 957 CB HIS A 862 25.452 -6.009 16.430 1.00 20.25 C ATOM 958 CG HIS A 862 25.252 -7.027 15.346 1.00 20.45 C ATOM 959 ND1 HIS A 862 26.250 -7.359 14.438 1.00 21.24 N ATOM 960 CD2 HIS A 862 24.188 -7.818 15.029 1.00 21.42 C ATOM 961 CE1 HIS A 862 25.787 -8.265 13.586 1.00 22.40 C ATOM 962 NE2 HIS A 862 24.520 -8.538 13.916 1.00 23.24 N ATOM 963 H HIS A 862 24.479 -3.510 17.811 1.00 0.00 H ATOM 964 N GLY A 863 23.178 -4.307 14.412 1.00 20.69 N ATOM 965 CA GLY A 863 21.804 -4.398 13.946 1.00 22.38 C ATOM 966 C GLY A 863 21.571 -5.604 13.061 1.00 22.40 C ATOM 967 O GLY A 863 22.481 -6.115 12.416 1.00 23.54 O ATOM 968 H GLY A 863 23.920 -3.970 13.767 1.00 0.00 H ATOM 969 N SER A 864 20.311 -6.054 13.020 1.00 23.68 N ATOM 970 CA SER A 864 19.932 -7.238 12.248 1.00 25.10 C ATOM 971 C SER A 864 18.419 -7.179 12.028 1.00 25.07 C ATOM 972 O SER A 864 17.722 -6.485 12.767 1.00 25.96 O ATOM 973 CB SER A 864 20.334 -8.510 12.964 1.00 25.66 C ATOM 974 OG SER A 864 20.407 -9.617 12.073 1.00 27.44 O ATOM 975 HG SER A 864 21.079 -9.430 11.370 1.00 0.00 H ATOM 976 H SER A 864 19.578 -5.546 13.554 1.00 0.00 H ATOM 977 N ARG A 865 17.925 -7.895 11.008 1.00 25.81 N ATOM 978 CA ARG A 865 16.479 -8.000 10.804 1.00 26.90 C ATOM 979 C ARG A 865 15.836 -8.634 12.033 1.00 27.53 C ATOM 980 O ARG A 865 16.409 -9.550 12.651 1.00 26.16 O ATOM 981 CB ARG A 865 16.156 -8.835 9.568 1.00 30.19 C ATOM 982 CG ARG A 865 16.539 -8.163 8.260 1.00 35.30 C ATOM 983 CD ARG A 865 16.239 -9.077 7.087 1.00 41.96 C ATOM 984 NE ARG A 865 16.720 -8.557 5.815 1.00 49.26 N ATOM 985 CZ ARG A 865 16.018 -7.756 5.028 1.00 50.92 C ATOM 986 NH1 ARG A 865 14.768 -7.466 5.345 1.00 59.52 N ATOM 987 NH2 ARG A 865 16.559 -7.245 3.933 1.00 56.01 N ATOM 988 HE ARG A 865 17.674 -8.832 5.505 1.00 0.00 H ATOM 989 HH12 ARG A 865 14.209 -6.838 4.733 1.00 0.00 H ATOM 990 HH11 ARG A 865 14.344 -7.866 6.206 1.00 0.00 H ATOM 991 HH22 ARG A 865 16.000 -6.617 3.321 1.00 0.00 H ATOM 992 HH21 ARG A 865 17.543 -7.472 3.685 1.00 0.00 H ATOM 993 H ARG A 865 18.574 -8.380 10.356 1.00 0.00 H ATOM 994 N THR A 866 14.630 -8.168 12.355 1.00 27.60 N ATOM 995 CA THR A 866 13.879 -8.671 13.486 1.00 26.55 C ATOM 996 C THR A 866 13.744 -10.201 13.430 1.00 28.15 C ATOM 997 O THR A 866 13.857 -10.843 14.471 1.00 30.64 O ATOM 998 CB THR A 866 12.514 -7.985 13.541 1.00 30.95 C ATOM 999 OG1 THR A 866 12.771 -6.599 13.744 1.00 33.20 O ATOM 1000 CG2 THR A 866 11.615 -8.555 14.619 1.00 33.65 C ATOM 1001 HG1 THR A 866 11.912 -6.108 13.787 1.00 0.00 H ATOM 1002 H THR A 866 14.212 -7.415 11.772 1.00 0.00 H ATOM 1003 N THR A 867 13.513 -10.769 12.228 1.00 29.95 N ATOM 1004 CA THR A 867 13.322 -12.209 12.039 1.00 31.95 C ATOM 1005 C THR A 867 14.568 -13.021 12.429 1.00 31.34 C ATOM 1006 O THR A 867 14.472 -14.229 12.560 1.00 34.67 O ATOM 1007 CB THR A 867 12.920 -12.526 10.591 1.00 37.02 C ATOM 1008 OG1 THR A 867 13.871 -11.958 9.691 1.00 40.55 O ATOM 1009 CG2 THR A 867 11.543 -12.009 10.226 1.00 43.48 C ATOM 1010 HG1 THR A 867 13.897 -10.976 9.817 1.00 0.00 H ATOM 1011 H THR A 867 13.468 -10.152 11.392 1.00 0.00 H ATOM 1012 N ASN A 868 15.727 -12.369 12.629 1.00 28.76 N ATOM 1013 CA ASN A 868 16.940 -13.066 13.019 1.00 27.59 C ATOM 1014 C ASN A 868 17.104 -13.166 14.541 1.00 27.62 C ATOM 1015 O ASN A 868 17.964 -13.893 15.029 1.00 26.11 O ATOM 1016 CB ASN A 868 18.172 -12.396 12.432 1.00 28.88 C ATOM 1017 CG ASN A 868 18.243 -12.469 10.927 1.00 31.04 C ATOM 1018 OD1 ASN A 868 17.720 -13.400 10.313 1.00 37.10 O ATOM 1019 ND2 ASN A 868 18.943 -11.509 10.331 1.00 33.02 N ATOM 1020 HD22 ASN A 868 19.364 -10.745 10.897 1.00 0.00 H ATOM 1021 HD21 ASN A 868 19.069 -11.522 9.299 1.00 0.00 H ATOM 1022 H ASN A 868 15.756 -11.337 12.501 1.00 0.00 H ATOM 1023 N PHE A 869 16.326 -12.420 15.319 1.00 26.72 N ATOM 1024 CA PHE A 869 16.648 -12.272 16.746 1.00 25.18 C ATOM 1025 C PHE A 869 16.364 -13.524 17.577 1.00 26.40 C ATOM 1026 O PHE A 869 17.057 -13.747 18.563 1.00 26.77 O ATOM 1027 CB PHE A 869 15.966 -11.036 17.322 1.00 26.37 C ATOM 1028 CG PHE A 869 16.863 -9.835 17.188 1.00 25.60 C ATOM 1029 CD1 PHE A 869 16.955 -9.146 15.991 1.00 25.86 C ATOM 1030 CD2 PHE A 869 17.684 -9.460 18.225 1.00 27.58 C ATOM 1031 CE1 PHE A 869 17.818 -8.070 15.865 1.00 27.04 C ATOM 1032 CE2 PHE A 869 18.557 -8.397 18.092 1.00 29.49 C ATOM 1033 CZ PHE A 869 18.621 -7.707 16.914 1.00 27.27 C ATOM 1034 H PHE A 869 15.493 -11.943 14.920 1.00 0.00 H ATOM 1035 N ALA A 870 15.410 -14.369 17.179 1.00 27.99 N ATOM 1036 CA ALA A 870 15.221 -15.604 17.942 1.00 28.81 C ATOM 1037 C ALA A 870 16.506 -16.448 17.903 1.00 27.58 C ATOM 1038 O ALA A 870 16.952 -16.991 18.941 1.00 28.58 O ATOM 1039 CB ALA A 870 14.050 -16.387 17.413 1.00 31.21 C ATOM 1040 H ALA A 870 14.818 -14.156 16.351 1.00 0.00 H ATOM 1041 N GLY A 871 17.114 -16.533 16.720 1.00 27.72 N ATOM 1042 CA GLY A 871 18.368 -17.254 16.566 1.00 28.15 C ATOM 1043 C GLY A 871 19.542 -16.551 17.227 1.00 26.24 C ATOM 1044 O GLY A 871 20.411 -17.195 17.837 1.00 27.94 O ATOM 1045 H GLY A 871 16.684 -16.075 15.891 1.00 0.00 H ATOM 1046 N ILE A 872 19.592 -15.227 17.121 1.00 25.01 N ATOM 1047 CA ILE A 872 20.695 -14.480 17.709 1.00 25.19 C ATOM 1048 C ILE A 872 20.708 -14.647 19.228 1.00 23.59 C ATOM 1049 O ILE A 872 21.769 -14.841 19.823 1.00 25.31 O ATOM 1050 CB ILE A 872 20.652 -12.999 17.308 1.00 26.20 C ATOM 1051 CG1 ILE A 872 20.962 -12.822 15.827 1.00 27.89 C ATOM 1052 CG2 ILE A 872 21.599 -12.200 18.188 1.00 25.68 C ATOM 1053 CD1 ILE A 872 20.662 -11.419 15.303 1.00 28.50 C ATOM 1054 H ILE A 872 18.838 -14.721 16.614 1.00 0.00 H ATOM 1055 N LEU A 873 19.546 -14.557 19.878 1.00 24.62 N ATOM 1056 CA LEU A 873 19.538 -14.672 21.326 1.00 24.79 C ATOM 1057 C LEU A 873 19.777 -16.121 21.762 1.00 25.52 C ATOM 1058 O LEU A 873 20.532 -16.353 22.714 1.00 27.64 O ATOM 1059 CB LEU A 873 18.229 -14.097 21.869 1.00 25.37 C ATOM 1060 CG LEU A 873 18.057 -12.591 21.665 1.00 26.12 C ATOM 1061 CD1 LEU A 873 16.704 -12.121 22.180 1.00 29.40 C ATOM 1062 CD2 LEU A 873 19.188 -11.786 22.287 1.00 28.40 C ATOM 1063 H LEU A 873 18.659 -14.407 19.356 1.00 0.00 H ATOM 1064 N SER A 874 19.176 -17.089 21.058 1.00 25.62 N ATOM 1065 CA SER A 874 19.358 -18.496 21.451 1.00 27.62 C ATOM 1066 C SER A 874 20.776 -19.012 21.155 1.00 29.13 C ATOM 1067 O SER A 874 21.285 -19.788 21.980 1.00 32.72 O ATOM 1068 CB SER A 874 18.282 -19.378 20.855 1.00 33.81 C ATOM 1069 OG SER A 874 18.314 -19.379 19.450 1.00 33.50 O ATOM 1070 HG SER A 874 18.176 -18.457 19.117 1.00 0.00 H ATOM 1071 H SER A 874 18.584 -16.848 20.238 1.00 0.00 H ATOM 1072 N GLN A 875 21.404 -18.593 20.041 1.00 27.07 N ATOM 1073 CA GLN A 875 22.694 -19.169 19.624 1.00 27.70 C ATOM 1074 C GLN A 875 23.838 -18.161 19.735 1.00 26.24 C ATOM 1075 O GLN A 875 25.002 -18.569 19.612 1.00 28.30 O ATOM 1076 CB GLN A 875 22.675 -19.674 18.179 1.00 27.41 C ATOM 1077 CG GLN A 875 21.595 -20.706 17.894 1.00 29.59 C ATOM 1078 CD GLN A 875 21.686 -21.970 18.722 1.00 32.91 C ATOM 1079 OE1 GLN A 875 22.762 -22.472 19.026 1.00 36.97 O ATOM 1080 NE2 GLN A 875 20.535 -22.506 19.086 1.00 38.49 N ATOM 1081 HE22 GLN A 875 19.640 -22.053 18.810 1.00 0.00 H ATOM 1082 HE21 GLN A 875 20.523 -23.381 19.648 1.00 0.00 H ATOM 1083 H GLN A 875 20.969 -17.846 19.462 1.00 0.00 H ATOM 1084 N GLY A 876 23.515 -16.886 19.978 1.00 24.83 N ATOM 1085 CA GLY A 876 24.477 -15.815 19.964 1.00 25.28 C ATOM 1086 C GLY A 876 24.765 -15.390 18.535 1.00 25.13 C ATOM 1087 O GLY A 876 24.341 -16.046 17.574 1.00 27.17 O ATOM 1088 H GLY A 876 22.522 -16.658 20.187 1.00 0.00 H ATOM 1089 N LEU A 877 25.506 -14.289 18.386 1.00 23.45 N ATOM 1090 CA LEU A 877 25.991 -13.896 17.077 1.00 21.89 C ATOM 1091 C LEU A 877 26.986 -14.951 16.585 1.00 23.06 C ATOM 1092 O LEU A 877 27.847 -15.421 17.344 1.00 25.24 O ATOM 1093 CB LEU A 877 26.648 -12.524 17.141 1.00 23.94 C ATOM 1094 CG LEU A 877 25.706 -11.361 17.414 1.00 23.59 C ATOM 1095 CD1 LEU A 877 26.463 -10.057 17.595 1.00 23.72 C ATOM 1096 CD2 LEU A 877 24.687 -11.184 16.302 1.00 25.83 C ATOM 1097 H LEU A 877 25.738 -13.708 19.217 1.00 0.00 H ATOM 1098 N ARG A 878 26.860 -15.290 15.316 1.00 25.84 N ATOM 1099 CA ARG A 878 27.649 -16.327 14.702 1.00 26.80 C ATOM 1100 C ARG A 878 28.269 -15.791 13.416 1.00 27.83 C ATOM 1101 O ARG A 878 27.795 -14.857 12.804 1.00 30.97 O ATOM 1102 CB ARG A 878 26.789 -17.551 14.388 1.00 30.81 C ATOM 1103 CG ARG A 878 26.267 -18.278 15.620 1.00 36.08 C ATOM 1104 CD ARG A 878 25.214 -19.324 15.244 1.00 46.40 C ATOM 1105 NE ARG A 878 23.938 -18.662 14.956 1.00 56.14 N ATOM 1106 CZ ARG A 878 22.858 -19.236 14.427 1.00 61.85 C ATOM 1107 NH1 ARG A 878 22.919 -20.475 13.965 1.00 69.30 N ATOM 1108 NH2 ARG A 878 21.715 -18.565 14.379 1.00 56.96 N ATOM 1109 HE ARG A 878 23.869 -17.650 15.186 1.00 0.00 H ATOM 1110 HH12 ARG A 878 22.073 -20.919 13.553 1.00 0.00 H ATOM 1111 HH11 ARG A 878 23.813 -21.005 14.014 1.00 0.00 H ATOM 1112 HH22 ARG A 878 20.869 -19.008 13.967 1.00 0.00 H ATOM 1113 HH21 ARG A 878 21.665 -17.596 14.753 1.00 0.00 H ATOM 1114 H ARG A 878 26.161 -14.787 14.734 1.00 0.00 H ATOM 1115 N ILE A 879 29.361 -16.425 13.022 1.00 27.51 N ATOM 1116 CA ILE A 879 29.984 -16.120 11.776 1.00 28.05 C ATOM 1117 C ILE A 879 29.200 -16.791 10.651 1.00 28.86 C ATOM 1118 O ILE A 879 28.830 -17.972 10.752 1.00 32.89 O ATOM 1119 CB ILE A 879 31.451 -16.554 11.840 1.00 30.19 C ATOM 1120 CG1 ILE A 879 32.165 -15.774 12.948 1.00 35.05 C ATOM 1121 CG2 ILE A 879 32.143 -16.391 10.496 1.00 33.07 C ATOM 1122 CD1 ILE A 879 33.508 -16.312 13.304 1.00 40.18 C ATOM 1123 H ILE A 879 29.773 -17.160 13.632 1.00 0.00 H ATOM 1124 N ALA A 880 29.023 -16.055 9.549 1.00 29.22 N ATOM 1125 CA ALA A 880 28.351 -16.564 8.379 1.00 30.14 C ATOM 1126 C ALA A 880 29.064 -17.821 7.903 1.00 31.92 C ATOM 1127 O ALA A 880 30.294 -17.892 7.916 1.00 31.34 O ATOM 1128 CB ALA A 880 28.312 -15.520 7.289 1.00 31.22 C ATOM 1129 H ALA A 880 29.383 -15.079 9.535 1.00 0.00 H ATOM 1130 N PRO A 881 28.322 -18.853 7.465 1.00 33.55 N ATOM 1131 CA PRO A 881 28.944 -20.088 7.004 1.00 34.91 C ATOM 1132 C PRO A 881 29.549 -19.959 5.611 1.00 33.86 C ATOM 1133 O PRO A 881 29.356 -18.953 4.933 1.00 34.85 O ATOM 1134 CB PRO A 881 27.772 -21.065 7.005 1.00 37.64 C ATOM 1135 CG PRO A 881 26.566 -20.187 6.679 1.00 37.37 C ATOM 1136 CD PRO A 881 26.859 -18.857 7.337 1.00 34.90 C ATOM 1137 N PRO A 882 30.360 -20.955 5.191 1.00 35.41 N ATOM 1138 CA PRO A 882 31.022 -20.929 3.889 1.00 37.83 C ATOM 1139 C PRO A 882 30.061 -20.655 2.725 1.00 39.76 C ATOM 1140 O PRO A 882 30.451 -20.004 1.786 1.00 43.14 O ATOM 1141 CB PRO A 882 31.628 -22.335 3.776 1.00 42.45 C ATOM 1142 CG PRO A 882 31.867 -22.760 5.202 1.00 40.44 C ATOM 1143 CD PRO A 882 30.773 -22.098 6.014 1.00 37.78 C ATOM 1144 N GLU A 883 28.830 -21.185 2.812 1.00 43.62 N ATOM 1145 CA GLU A 883 27.848 -21.120 1.717 1.00 50.48 C ATOM 1146 C GLU A 883 27.245 -19.711 1.564 1.00 46.65 C ATOM 1147 O GLU A 883 26.572 -19.438 0.590 1.00 53.34 O ATOM 1148 CB GLU A 883 26.733 -22.162 1.910 1.00 56.17 C ATOM 1149 CG GLU A 883 26.032 -22.109 3.269 1.00 59.83 C ATOM 1150 CD GLU A 883 26.494 -23.111 4.326 1.00 64.62 C ATOM 1151 OE1 GLU A 883 27.748 -23.368 4.408 1.00 51.41 O ATOM 1152 OE2 GLU A 883 25.602 -23.635 5.084 1.00 59.31 O ATOM 1153 H GLU A 883 28.558 -21.664 3.694 1.00 0.00 H ATOM 1154 N ALA A 884 27.447 -18.822 2.538 1.00 37.67 N ATOM 1155 CA ALA A 884 26.935 -17.444 2.443 1.00 37.10 C ATOM 1156 C ALA A 884 27.870 -16.593 1.581 1.00 34.17 C ATOM 1157 O ALA A 884 29.086 -16.740 1.648 1.00 38.89 O ATOM 1158 CB ALA A 884 26.802 -16.861 3.823 1.00 39.42 C ATOM 1159 H ALA A 884 27.979 -19.109 3.385 1.00 0.00 H ATOM 1160 N PRO A 885 27.359 -15.630 0.783 1.00 35.48 N ATOM 1161 CA PRO A 885 28.240 -14.713 0.061 1.00 34.56 C ATOM 1162 C PRO A 885 29.073 -13.859 1.024 1.00 33.17 C ATOM 1163 O PRO A 885 28.607 -13.544 2.144 1.00 35.33 O ATOM 1164 CB PRO A 885 27.291 -13.837 -0.758 1.00 37.64 C ATOM 1165 CG PRO A 885 26.039 -14.663 -0.856 1.00 41.17 C ATOM 1166 CD PRO A 885 25.942 -15.388 0.476 1.00 40.48 C ATOM 1167 N VAL A 886 30.295 -13.526 0.588 1.00 30.76 N ATOM 1168 CA VAL A 886 31.182 -12.671 1.349 1.00 30.40 C ATOM 1169 C VAL A 886 30.887 -11.200 1.035 1.00 35.61 C ATOM 1170 O VAL A 886 31.529 -10.310 1.594 1.00 34.09 O ATOM 1171 CB VAL A 886 32.647 -13.005 1.063 1.00 28.66 C ATOM 1172 CG1 VAL A 886 33.110 -12.467 -0.281 1.00 29.12 C ATOM 1173 CG2 VAL A 886 33.547 -12.512 2.175 1.00 31.12 C ATOM 1174 H VAL A 886 30.618 -13.894 -0.329 1.00 0.00 H ATOM 1175 N THR A 887 29.954 -10.995 0.107 1.00 37.55 N ATOM 1176 CA THR A 887 29.404 -9.738 -0.201 1.00 44.51 C ATOM 1177 C THR A 887 28.824 -9.081 1.074 1.00 40.89 C ATOM 1178 O THR A 887 27.970 -9.625 1.870 1.00 48.38 O ATOM 1179 CB THR A 887 28.391 -9.795 -1.345 1.00 48.12 C ATOM 1180 OG1 THR A 887 28.757 -10.864 -2.211 1.00 45.48 O ATOM 1181 CG2 THR A 887 28.355 -8.499 -2.120 1.00 52.73 C ATOM 1182 HG1 THR A 887 28.111 -10.917 -2.960 1.00 0.00 H ATOM 1183 H THR A 887 29.609 -11.819 -0.425 1.00 0.00 H ATOM 1184 N GLY A 888 29.331 -7.893 1.291 1.00 37.66 N ATOM 1185 CA GLY A 888 28.963 -7.091 2.411 1.00 35.75 C ATOM 1186 C GLY A 888 29.967 -7.136 3.544 1.00 33.50 C ATOM 1187 O GLY A 888 29.834 -6.332 4.456 1.00 34.39 O ATOM 1188 H GLY A 888 30.031 -7.519 0.619 1.00 0.00 H ATOM 1189 N TYR A 889 30.958 -8.038 3.478 1.00 29.25 N ATOM 1190 CA TYR A 889 31.947 -8.232 4.561 1.00 28.07 C ATOM 1191 C TYR A 889 33.336 -7.796 4.101 1.00 29.30 C ATOM 1192 O TYR A 889 34.114 -8.585 3.554 1.00 33.73 O ATOM 1193 CB TYR A 889 32.018 -9.699 4.967 1.00 28.74 C ATOM 1194 CG TYR A 889 30.765 -10.264 5.583 1.00 29.16 C ATOM 1195 CD1 TYR A 889 30.413 -9.953 6.876 1.00 31.18 C ATOM 1196 CD2 TYR A 889 29.973 -11.162 4.900 1.00 28.44 C ATOM 1197 CE1 TYR A 889 29.317 -10.523 7.481 1.00 33.76 C ATOM 1198 CE2 TYR A 889 28.852 -11.727 5.487 1.00 29.89 C ATOM 1199 CZ TYR A 889 28.533 -11.418 6.791 1.00 31.56 C ATOM 1200 OH TYR A 889 27.461 -11.971 7.418 1.00 34.56 O ATOM 1201 HH TYR A 889 26.635 -11.737 6.925 1.00 0.00 H ATOM 1202 H TYR A 889 31.035 -8.629 2.625 1.00 0.00 H ATOM 1203 N MET A 890 33.683 -6.549 4.375 1.00 27.23 N ATOM 1204 CA MET A 890 34.875 -6.016 3.757 1.00 27.60 C ATOM 1205 C MET A 890 36.160 -6.651 4.316 1.00 26.34 C ATOM 1206 O MET A 890 37.200 -6.613 3.652 1.00 26.98 O ATOM 1207 CB MET A 890 34.852 -4.500 3.844 1.00 32.16 C ATOM 1208 CG MET A 890 35.413 -3.948 5.052 1.00 35.78 C ATOM 1209 SD MET A 890 35.241 -2.152 5.005 1.00 40.47 S ATOM 1210 CE MET A 890 36.501 -1.626 3.858 1.00 35.29 C ATOM 1211 H MET A 890 33.111 -5.967 5.020 1.00 0.00 H ATOM 1212 N PHE A 891 36.090 -7.260 5.509 1.00 23.76 N ATOM 1213 CA PHE A 891 37.253 -7.904 6.136 1.00 24.81 C ATOM 1214 C PHE A 891 37.042 -9.404 6.297 1.00 25.31 C ATOM 1215 O PHE A 891 37.745 -10.064 7.078 1.00 28.01 O ATOM 1216 CB PHE A 891 37.584 -7.198 7.449 1.00 25.08 C ATOM 1217 CG PHE A 891 37.875 -5.737 7.229 1.00 24.98 C ATOM 1218 CD1 PHE A 891 38.984 -5.330 6.510 1.00 25.36 C ATOM 1219 CD2 PHE A 891 36.986 -4.778 7.688 1.00 28.15 C ATOM 1220 CE1 PHE A 891 39.215 -3.983 6.292 1.00 24.61 C ATOM 1221 CE2 PHE A 891 37.245 -3.431 7.500 1.00 30.80 C ATOM 1222 CZ PHE A 891 38.350 -3.041 6.791 1.00 27.64 C ATOM 1223 H PHE A 891 35.178 -7.277 6.009 1.00 0.00 H ATOM 1224 N GLY A 892 36.151 -9.948 5.466 1.00 24.89 N ATOM 1225 CA GLY A 892 35.874 -11.361 5.480 1.00 29.06 C ATOM 1226 C GLY A 892 34.833 -11.707 6.525 1.00 26.56 C ATOM 1227 O GLY A 892 34.358 -10.856 7.279 1.00 27.15 O ATOM 1228 H GLY A 892 35.645 -9.338 4.793 1.00 0.00 H ATOM 1229 N LYS A 893 34.417 -12.968 6.531 1.00 26.60 N ATOM 1230 CA LYS A 893 33.345 -13.358 7.427 1.00 27.71 C ATOM 1231 C LYS A 893 33.843 -13.254 8.867 1.00 25.63 C ATOM 1232 O LYS A 893 34.907 -13.767 9.229 1.00 28.39 O ATOM 1233 CB LYS A 893 32.838 -14.749 7.060 1.00 28.97 C ATOM 1234 CG LYS A 893 32.039 -14.731 5.754 1.00 30.93 C ATOM 1235 CD LYS A 893 31.820 -16.092 5.183 1.00 32.66 C ATOM 1236 CE LYS A 893 31.170 -16.052 3.819 1.00 36.32 C ATOM 1237 NZ LYS A 893 31.038 -17.410 3.245 1.00 38.71 N ATOM 1238 HZ1 LYS A 893 31.981 -17.838 3.150 1.00 0.00 H ATOM 1239 HZ2 LYS A 893 30.452 -17.995 3.874 1.00 0.00 H ATOM 1240 HZ3 LYS A 893 30.588 -17.347 2.309 1.00 0.00 H ATOM 1241 H LYS A 893 34.855 -13.669 5.900 1.00 0.00 H ATOM 1242 N GLY A 894 33.018 -12.611 9.685 1.00 25.89 N ATOM 1243 CA GLY A 894 33.288 -12.410 11.087 1.00 24.66 C ATOM 1244 C GLY A 894 32.074 -11.791 11.732 1.00 23.46 C ATOM 1245 O GLY A 894 31.006 -11.803 11.119 1.00 24.29 O ATOM 1246 H GLY A 894 32.131 -12.233 9.294 1.00 0.00 H ATOM 1247 N ILE A 895 32.225 -11.307 12.964 1.00 21.50 N ATOM 1248 CA ILE A 895 31.130 -10.625 13.629 1.00 21.55 C ATOM 1249 C ILE A 895 31.432 -9.127 13.647 1.00 20.86 C ATOM 1250 O ILE A 895 32.481 -8.708 14.156 1.00 21.33 O ATOM 1251 CB ILE A 895 30.852 -11.166 15.043 1.00 22.43 C ATOM 1252 CG1 ILE A 895 30.701 -12.683 15.047 1.00 24.46 C ATOM 1253 CG2 ILE A 895 29.618 -10.488 15.611 1.00 22.17 C ATOM 1254 CD1 ILE A 895 30.696 -13.266 16.422 1.00 25.46 C ATOM 1255 H ILE A 895 33.136 -11.419 13.454 1.00 0.00 H ATOM 1256 N TYR A 896 30.526 -8.369 13.012 1.00 20.61 N ATOM 1257 CA TYR A 896 30.709 -6.957 12.724 1.00 19.88 C ATOM 1258 C TYR A 896 29.903 -6.061 13.670 1.00 19.96 C ATOM 1259 O TYR A 896 28.722 -6.313 13.916 1.00 22.24 O ATOM 1260 CB TYR A 896 30.289 -6.662 11.272 1.00 20.99 C ATOM 1261 CG TYR A 896 31.291 -7.111 10.235 1.00 22.32 C ATOM 1262 CD1 TYR A 896 31.634 -8.446 10.075 1.00 22.29 C ATOM 1263 CD2 TYR A 896 31.891 -6.184 9.397 1.00 22.79 C ATOM 1264 CE1 TYR A 896 32.614 -8.826 9.166 1.00 23.19 C ATOM 1265 CE2 TYR A 896 32.849 -6.551 8.471 1.00 21.98 C ATOM 1266 CZ TYR A 896 33.191 -7.883 8.330 1.00 21.54 C ATOM 1267 OH TYR A 896 34.164 -8.241 7.427 1.00 24.17 O ATOM 1268 HH TYR A 896 34.288 -9.223 7.449 1.00 0.00 H ATOM 1269 H TYR A 896 29.639 -8.819 12.708 1.00 0.00 H ATOM 1270 N PHE A 897 30.520 -4.936 14.032 1.00 19.09 N ATOM 1271 CA PHE A 897 29.959 -3.954 14.927 1.00 20.03 C ATOM 1272 C PHE A 897 30.277 -2.546 14.447 1.00 19.76 C ATOM 1273 O PHE A 897 31.300 -2.334 13.782 1.00 20.76 O ATOM 1274 CB PHE A 897 30.504 -4.092 16.352 1.00 20.13 C ATOM 1275 CG PHE A 897 30.238 -5.425 16.992 1.00 19.23 C ATOM 1276 CD1 PHE A 897 31.094 -6.497 16.800 1.00 21.10 C ATOM 1277 CD2 PHE A 897 29.118 -5.607 17.778 1.00 20.19 C ATOM 1278 CE1 PHE A 897 30.826 -7.724 17.391 1.00 20.83 C ATOM 1279 CE2 PHE A 897 28.828 -6.840 18.343 1.00 21.61 C ATOM 1280 CZ PHE A 897 29.673 -7.897 18.127 1.00 21.55 C ATOM 1281 H PHE A 897 31.468 -4.755 13.644 1.00 0.00 H ATOM 1282 N ALA A 898 29.439 -1.590 14.880 1.00 19.80 N ATOM 1283 CA ALA A 898 29.696 -0.166 14.628 1.00 21.27 C ATOM 1284 C ALA A 898 29.754 0.617 15.935 1.00 20.75 C ATOM 1285 O ALA A 898 29.200 0.188 16.935 1.00 21.84 O ATOM 1286 CB ALA A 898 28.621 0.395 13.713 1.00 21.57 C ATOM 1287 H ALA A 898 28.586 -1.865 15.407 1.00 0.00 H ATOM 1288 N ASP A 899 30.408 1.795 15.869 1.00 20.83 N ATOM 1289 CA ASP A 899 30.348 2.773 16.963 1.00 22.20 C ATOM 1290 C ASP A 899 29.393 3.923 16.632 1.00 23.35 C ATOM 1291 O ASP A 899 29.197 4.799 17.479 1.00 26.35 O ATOM 1292 CB ASP A 899 31.737 3.280 17.368 1.00 21.14 C ATOM 1293 CG ASP A 899 32.571 3.935 16.273 1.00 23.01 C ATOM 1294 OD1 ASP A 899 31.991 4.421 15.273 1.00 25.09 O ATOM 1295 OD2 ASP A 899 33.814 4.000 16.475 1.00 24.75 O ATOM 1296 H ASP A 899 30.969 2.016 15.022 1.00 0.00 H ATOM 1297 N MET A 900 28.744 3.871 15.463 1.00 22.95 N ATOM 1298 CA MET A 900 27.712 4.833 15.086 1.00 24.00 C ATOM 1299 C MET A 900 26.377 4.088 14.995 1.00 23.43 C ATOM 1300 O MET A 900 26.237 3.133 14.202 1.00 24.39 O ATOM 1301 CB MET A 900 28.039 5.491 13.735 1.00 27.67 C ATOM 1302 CG MET A 900 29.354 6.223 13.692 1.00 28.70 C ATOM 1303 SD MET A 900 29.367 7.813 14.548 1.00 32.33 S ATOM 1304 CE MET A 900 28.347 8.841 13.498 1.00 34.48 C ATOM 1305 H MET A 900 28.985 3.112 14.794 1.00 0.00 H ATOM 1306 N VAL A 901 25.429 4.465 15.856 1.00 23.69 N ATOM 1307 CA VAL A 901 24.183 3.709 15.962 1.00 24.07 C ATOM 1308 C VAL A 901 23.537 3.538 14.573 1.00 24.50 C ATOM 1309 O VAL A 901 22.970 2.481 14.279 1.00 25.22 O ATOM 1310 CB VAL A 901 23.212 4.379 16.954 1.00 24.54 C ATOM 1311 CG1 VAL A 901 22.722 5.745 16.471 1.00 26.77 C ATOM 1312 CG2 VAL A 901 22.026 3.466 17.246 1.00 24.50 C ATOM 1313 H VAL A 901 25.578 5.302 16.455 1.00 0.00 H ATOM 1314 N SER A 902 23.550 4.582 13.730 1.00 25.00 N ATOM 1315 CA SER A 902 22.823 4.522 12.470 1.00 25.69 C ATOM 1316 C SER A 902 23.458 3.535 11.481 1.00 26.30 C ATOM 1317 O SER A 902 22.755 2.966 10.633 1.00 26.03 O ATOM 1318 CB SER A 902 22.672 5.899 11.872 1.00 26.63 C ATOM 1319 OG SER A 902 23.932 6.515 11.673 1.00 28.32 O ATOM 1320 HG SER A 902 24.475 5.962 11.057 1.00 0.00 H ATOM 1321 H SER A 902 24.083 5.440 13.978 1.00 0.00 H ATOM 1322 N LYS A 903 24.780 3.364 11.546 1.00 24.26 N ATOM 1323 CA LYS A 903 25.439 2.433 10.644 1.00 23.79 C ATOM 1324 C LYS A 903 24.873 1.033 10.925 1.00 24.45 C ATOM 1325 O LYS A 903 24.627 0.279 10.006 1.00 24.53 O ATOM 1326 CB LYS A 903 26.958 2.548 10.790 1.00 23.40 C ATOM 1327 CG LYS A 903 27.702 1.516 9.966 1.00 24.21 C ATOM 1328 CD LYS A 903 29.148 1.823 9.782 1.00 24.17 C ATOM 1329 CE LYS A 903 29.888 0.758 9.001 1.00 24.78 C ATOM 1330 NZ LYS A 903 31.294 1.155 8.757 1.00 25.20 N ATOM 1331 HZ1 LYS A 903 31.313 2.041 8.213 1.00 0.00 H ATOM 1332 HZ2 LYS A 903 31.776 1.296 9.668 1.00 0.00 H ATOM 1333 HZ3 LYS A 903 31.776 0.406 8.220 1.00 0.00 H ATOM 1334 H LYS A 903 25.339 3.897 12.242 1.00 0.00 H ATOM 1335 N SER A 904 24.740 0.678 12.203 1.00 23.07 N ATOM 1336 CA SER A 904 24.143 -0.598 12.567 1.00 22.35 C ATOM 1337 C SER A 904 22.629 -0.630 12.324 1.00 23.36 C ATOM 1338 O SER A 904 22.119 -1.658 11.886 1.00 23.85 O ATOM 1339 CB SER A 904 24.458 -0.958 13.993 1.00 22.00 C ATOM 1340 OG SER A 904 25.797 -1.417 14.161 1.00 22.62 O ATOM 1341 HG SER A 904 25.940 -2.224 13.605 1.00 0.00 H ATOM 1342 H SER A 904 25.068 1.322 12.951 1.00 0.00 H ATOM 1343 N ALA A 905 21.920 0.460 12.645 1.00 24.03 N ATOM 1344 CA ALA A 905 20.472 0.503 12.519 1.00 25.47 C ATOM 1345 C ALA A 905 20.064 0.269 11.053 1.00 26.32 C ATOM 1346 O ALA A 905 18.973 -0.248 10.788 1.00 27.28 O ATOM 1347 CB ALA A 905 19.952 1.811 13.070 1.00 27.06 C ATOM 1348 H ALA A 905 22.421 1.302 12.995 1.00 0.00 H ATOM 1349 N ASN A 906 20.909 0.691 10.082 1.00 25.24 N ATOM 1350 CA ASN A 906 20.629 0.424 8.657 1.00 28.36 C ATOM 1351 C ASN A 906 20.426 -1.083 8.406 1.00 28.21 C ATOM 1352 O ASN A 906 19.684 -1.477 7.491 1.00 30.97 O ATOM 1353 CB ASN A 906 21.723 0.994 7.762 1.00 28.99 C ATOM 1354 CG ASN A 906 21.713 2.508 7.731 1.00 29.51 C ATOM 1355 OD1 ASN A 906 20.673 3.147 7.994 1.00 31.48 O ATOM 1356 ND2 ASN A 906 22.857 3.080 7.372 1.00 31.21 N ATOM 1357 HD22 ASN A 906 23.690 2.492 7.166 1.00 0.00 H ATOM 1358 HD21 ASN A 906 22.920 4.115 7.297 1.00 0.00 H ATOM 1359 H ASN A 906 21.770 1.212 10.345 1.00 0.00 H ATOM 1360 N TYR A 907 21.110 -1.924 9.190 1.00 26.82 N ATOM 1361 CA TYR A 907 21.061 -3.379 8.986 1.00 26.23 C ATOM 1362 C TYR A 907 19.769 -4.009 9.556 1.00 28.76 C ATOM 1363 O TYR A 907 19.545 -5.228 9.414 1.00 29.98 O ATOM 1364 CB TYR A 907 22.324 -4.048 9.539 1.00 27.23 C ATOM 1365 CG TYR A 907 23.541 -3.815 8.689 1.00 26.37 C ATOM 1366 CD1 TYR A 907 23.839 -4.624 7.606 1.00 28.97 C ATOM 1367 CD2 TYR A 907 24.377 -2.734 8.929 1.00 26.21 C ATOM 1368 CE1 TYR A 907 24.949 -4.383 6.810 1.00 31.97 C ATOM 1369 CE2 TYR A 907 25.486 -2.478 8.141 1.00 26.98 C ATOM 1370 CZ TYR A 907 25.775 -3.303 7.072 1.00 29.19 C ATOM 1371 OH TYR A 907 26.855 -3.078 6.256 1.00 31.67 O ATOM 1372 HH TYR A 907 26.888 -3.776 5.554 1.00 0.00 H ATOM 1373 H TYR A 907 21.690 -1.539 9.962 1.00 0.00 H ATOM 1374 N CYS A 908 18.926 -3.209 10.213 1.00 26.79 N ATOM 1375 CA CYS A 908 17.604 -3.685 10.661 1.00 27.89 C ATOM 1376 C CYS A 908 16.641 -3.828 9.477 1.00 31.39 C ATOM 1377 O CYS A 908 15.695 -4.590 9.574 1.00 33.33 O ATOM 1378 CB CYS A 908 16.999 -2.752 11.706 1.00 27.26 C ATOM 1379 SG CYS A 908 18.014 -2.559 13.198 1.00 28.65 S ATOM 1380 H CYS A 908 19.208 -2.228 10.413 1.00 0.00 H ATOM 1381 N HIS A 909 16.907 -3.093 8.382 1.00 31.23 N ATOM 1382 CA HIS A 909 16.069 -3.066 7.180 1.00 35.33 C ATOM 1383 C HIS A 909 14.609 -2.768 7.541 1.00 37.79 C ATOM 1384 O HIS A 909 13.664 -3.376 7.021 1.00 40.36 O ATOM 1385 CB HIS A 909 16.233 -4.365 6.385 1.00 37.05 C ATOM 1386 CG HIS A 909 17.607 -4.532 5.835 1.00 38.31 C ATOM 1387 ND1 HIS A 909 18.045 -3.816 4.732 1.00 45.00 N ATOM 1388 CD2 HIS A 909 18.629 -5.334 6.206 1.00 40.80 C ATOM 1389 CE1 HIS A 909 19.292 -4.154 4.460 1.00 45.15 C ATOM 1390 NE2 HIS A 909 19.672 -5.095 5.344 1.00 44.56 N ATOM 1391 H HIS A 909 17.765 -2.505 8.389 1.00 0.00 H ATOM 1392 N THR A 910 14.421 -1.779 8.410 1.00 36.03 N ATOM 1393 CA THR A 910 13.095 -1.279 8.666 1.00 36.64 C ATOM 1394 C THR A 910 12.627 -0.422 7.484 1.00 39.50 C ATOM 1395 O THR A 910 13.406 -0.076 6.587 1.00 45.28 O ATOM 1396 CB THR A 910 13.060 -0.524 9.995 1.00 39.53 C ATOM 1397 OG1 THR A 910 14.045 0.509 9.947 1.00 39.35 O ATOM 1398 CG2 THR A 910 13.364 -1.447 11.148 1.00 37.43 C ATOM 1399 HG1 THR A 910 14.938 0.105 9.808 1.00 0.00 H ATOM 1400 H THR A 910 15.235 -1.365 8.907 1.00 0.00 H ATOM 1401 N SER A 911 11.335 -0.104 7.495 1.00 45.60 N ATOM 1402 CA SER A 911 10.692 0.711 6.462 1.00 50.09 C ATOM 1403 C SER A 911 9.540 1.503 7.085 1.00 49.89 C ATOM 1404 O SER A 911 9.147 1.237 8.225 1.00 49.48 O ATOM 1405 CB SER A 911 10.190 -0.162 5.341 1.00 51.09 C ATOM 1406 OG SER A 911 9.255 -1.106 5.844 1.00 55.20 O ATOM 1407 HG SER A 911 8.930 -1.675 5.102 1.00 0.00 H ATOM 1408 H SER A 911 10.750 -0.453 8.280 1.00 0.00 H ATOM 1409 N GLN A 912 8.992 2.455 6.327 1.00 55.60 N ATOM 1410 CA GLN A 912 7.857 3.250 6.786 1.00 61.52 C ATOM 1411 C GLN A 912 6.729 2.307 7.238 1.00 60.97 C ATOM 1412 O GLN A 912 6.076 2.578 8.238 1.00 53.80 O ATOM 1413 CB GLN A 912 7.388 4.217 5.688 1.00 69.22 C ATOM 1414 CG GLN A 912 6.586 5.406 6.215 1.00 75.78 C ATOM 1415 CD GLN A 912 5.821 6.141 5.139 1.00 81.93 C ATOM 1416 OE1 GLN A 912 5.282 5.544 4.208 1.00 85.12 O ATOM 1417 NE2 GLN A 912 5.748 7.457 5.267 1.00 79.74 N ATOM 1418 HE22 GLN A 912 6.216 7.928 6.067 1.00 0.00 H ATOM 1419 HE21 GLN A 912 5.222 8.019 4.567 1.00 0.00 H ATOM 1420 H GLN A 912 9.385 2.636 5.381 1.00 0.00 H ATOM 1421 N GLY A 913 6.512 1.210 6.487 1.00 60.27 N ATOM 1422 CA GLY A 913 5.430 0.262 6.743 1.00 62.70 C ATOM 1423 C GLY A 913 5.710 -0.674 7.911 1.00 61.33 C ATOM 1424 O GLY A 913 4.788 -1.328 8.418 1.00 65.07 O ATOM 1425 H GLY A 913 7.147 1.028 5.684 1.00 0.00 H ATOM 1426 N ASP A 914 6.983 -0.741 8.324 1.00 57.14 N ATOM 1427 CA ASP A 914 7.483 -1.640 9.349 1.00 56.11 C ATOM 1428 C ASP A 914 8.596 -0.917 10.107 1.00 49.16 C ATOM 1429 O ASP A 914 9.788 -1.225 9.930 1.00 48.30 O ATOM 1430 CB ASP A 914 7.969 -2.940 8.701 1.00 59.48 C ATOM 1431 CG ASP A 914 8.469 -3.982 9.685 1.00 63.78 C ATOM 1432 OD1 ASP A 914 7.880 -4.084 10.782 1.00 73.36 O ATOM 1433 OD2 ASP A 914 9.442 -4.684 9.342 1.00 72.28 O ATOM 1434 H ASP A 914 7.667 -0.099 7.875 1.00 0.00 H ATOM 1435 N PRO A 915 8.255 0.122 10.908 1.00 42.47 N ATOM 1436 CA PRO A 915 9.251 1.083 11.385 1.00 40.29 C ATOM 1437 C PRO A 915 9.873 0.808 12.762 1.00 38.78 C ATOM 1438 O PRO A 915 10.603 1.643 13.277 1.00 41.83 O ATOM 1439 CB PRO A 915 8.418 2.370 11.418 1.00 42.63 C ATOM 1440 CG PRO A 915 7.039 1.909 11.840 1.00 44.53 C ATOM 1441 CD PRO A 915 6.889 0.501 11.296 1.00 44.08 C ATOM 1442 N ILE A 916 9.586 -0.359 13.344 1.00 34.53 N ATOM 1443 CA ILE A 916 10.156 -0.730 14.632 1.00 34.84 C ATOM 1444 C ILE A 916 11.240 -1.775 14.371 1.00 33.26 C ATOM 1445 O ILE A 916 11.006 -2.749 13.655 1.00 36.05 O ATOM 1446 CB ILE A 916 9.095 -1.271 15.610 1.00 37.79 C ATOM 1447 CG1 ILE A 916 7.836 -0.408 15.658 1.00 42.35 C ATOM 1448 CG2 ILE A 916 9.714 -1.452 16.985 1.00 35.94 C ATOM 1449 CD1 ILE A 916 8.097 1.004 16.062 1.00 45.28 C ATOM 1450 H ILE A 916 8.940 -1.019 12.866 1.00 0.00 H ATOM 1451 N GLY A 917 12.413 -1.565 14.972 1.00 31.29 N ATOM 1452 CA GLY A 917 13.525 -2.473 14.799 1.00 30.94 C ATOM 1453 C GLY A 917 14.180 -2.811 16.119 1.00 30.48 C ATOM 1454 O GLY A 917 13.881 -2.190 17.151 1.00 30.47 O ATOM 1455 H GLY A 917 12.530 -0.729 15.579 1.00 0.00 H ATOM 1456 N LEU A 918 15.080 -3.800 16.070 1.00 26.74 N ATOM 1457 CA LEU A 918 15.834 -4.244 17.238 1.00 25.25 C ATOM 1458 C LEU A 918 17.332 -4.084 16.959 1.00 23.93 C ATOM 1459 O LEU A 918 17.797 -4.399 15.871 1.00 25.62 O ATOM 1460 CB LEU A 918 15.512 -5.711 17.552 1.00 26.63 C ATOM 1461 CG LEU A 918 14.073 -6.005 17.970 1.00 27.06 C ATOM 1462 CD1 LEU A 918 13.874 -7.493 18.151 1.00 28.37 C ATOM 1463 CD2 LEU A 918 13.711 -5.286 19.250 1.00 31.55 C ATOM 1464 H LEU A 918 15.250 -4.273 15.160 1.00 0.00 H ATOM 1465 N ILE A 919 18.063 -3.593 17.963 1.00 23.85 N ATOM 1466 CA ILE A 919 19.495 -3.425 17.837 1.00 23.37 C ATOM 1467 C ILE A 919 20.148 -3.889 19.132 1.00 22.10 C ATOM 1468 O ILE A 919 19.588 -3.708 20.189 1.00 25.54 O ATOM 1469 CB ILE A 919 19.849 -1.966 17.496 1.00 24.89 C ATOM 1470 CG1 ILE A 919 21.278 -1.794 16.985 1.00 25.85 C ATOM 1471 CG2 ILE A 919 19.569 -1.056 18.664 1.00 27.86 C ATOM 1472 CD1 ILE A 919 21.449 -0.447 16.298 1.00 27.07 C ATOM 1473 H ILE A 919 17.594 -3.326 18.852 1.00 0.00 H ATOM 1474 N LEU A 920 21.344 -4.475 19.006 1.00 20.98 N ATOM 1475 CA LEU A 920 22.109 -4.925 20.151 1.00 20.81 C ATOM 1476 C LEU A 920 23.227 -3.952 20.509 1.00 20.16 C ATOM 1477 O LEU A 920 23.814 -3.302 19.628 1.00 21.52 O ATOM 1478 CB LEU A 920 22.738 -6.284 19.825 1.00 20.97 C ATOM 1479 CG LEU A 920 21.752 -7.420 19.656 1.00 22.68 C ATOM 1480 CD1 LEU A 920 22.374 -8.527 18.805 1.00 25.98 C ATOM 1481 CD2 LEU A 920 21.306 -7.945 21.008 1.00 23.90 C ATOM 1482 H LEU A 920 21.738 -4.612 18.053 1.00 0.00 H ATOM 1483 N LEU A 921 23.545 -3.937 21.806 1.00 19.68 N ATOM 1484 CA LEU A 921 24.847 -3.450 22.298 1.00 19.79 C ATOM 1485 C LEU A 921 25.589 -4.645 22.887 1.00 21.42 C ATOM 1486 O LEU A 921 25.081 -5.328 23.762 1.00 21.55 O ATOM 1487 CB LEU A 921 24.646 -2.360 23.361 1.00 21.57 C ATOM 1488 CG LEU A 921 24.240 -1.001 22.827 1.00 21.94 C ATOM 1489 CD1 LEU A 921 23.728 -0.109 23.948 1.00 24.31 C ATOM 1490 CD2 LEU A 921 25.413 -0.344 22.095 1.00 23.08 C ATOM 1491 H LEU A 921 22.847 -4.282 22.496 1.00 0.00 H ATOM 1492 N GLY A 922 26.747 -4.905 22.310 1.00 20.47 N ATOM 1493 CA GLY A 922 27.645 -5.930 22.798 1.00 20.36 C ATOM 1494 C GLY A 922 28.894 -5.341 23.415 1.00 19.57 C ATOM 1495 O GLY A 922 29.436 -4.356 22.902 1.00 21.09 O ATOM 1496 H GLY A 922 27.025 -4.353 21.474 1.00 0.00 H ATOM 1497 N GLU A 923 29.357 -5.988 24.486 1.00 20.23 N ATOM 1498 CA GLU A 923 30.707 -5.790 24.962 1.00 19.99 C ATOM 1499 C GLU A 923 31.598 -6.660 24.081 1.00 20.84 C ATOM 1500 O GLU A 923 31.454 -7.887 24.061 1.00 22.63 O ATOM 1501 CB GLU A 923 30.821 -6.131 26.443 1.00 21.23 C ATOM 1502 CG GLU A 923 32.249 -6.188 26.929 1.00 23.44 C ATOM 1503 CD GLU A 923 32.440 -6.692 28.347 1.00 23.33 C ATOM 1504 OE1 GLU A 923 31.410 -6.929 29.050 1.00 27.75 O ATOM 1505 OE2 GLU A 923 33.644 -6.851 28.762 1.00 26.13 O ATOM 1506 H GLU A 923 28.732 -6.650 24.990 1.00 0.00 H ATOM 1507 N VAL A 924 32.515 -6.012 23.364 1.00 20.08 N ATOM 1508 CA VAL A 924 33.376 -6.715 22.433 1.00 20.65 C ATOM 1509 C VAL A 924 34.814 -6.591 22.920 1.00 20.18 C ATOM 1510 O VAL A 924 35.322 -5.467 23.138 1.00 20.99 O ATOM 1511 CB VAL A 924 33.225 -6.166 21.011 1.00 20.34 C ATOM 1512 CG1 VAL A 924 34.036 -6.980 20.038 1.00 21.95 C ATOM 1513 CG2 VAL A 924 31.759 -6.089 20.603 1.00 21.11 C ATOM 1514 H VAL A 924 32.615 -4.983 23.474 1.00 0.00 H ATOM 1515 N ALA A 925 35.472 -7.744 23.073 1.00 21.57 N ATOM 1516 CA ALA A 925 36.838 -7.797 23.577 1.00 22.78 C ATOM 1517 C ALA A 925 37.776 -7.620 22.377 1.00 21.84 C ATOM 1518 O ALA A 925 38.091 -8.564 21.695 1.00 23.80 O ATOM 1519 CB ALA A 925 37.108 -9.098 24.295 1.00 23.50 C ATOM 1520 H ALA A 925 34.993 -8.633 22.824 1.00 0.00 H ATOM 1521 N LEU A 926 38.185 -6.376 22.108 1.00 21.81 N ATOM 1522 CA LEU A 926 38.890 -6.048 20.871 1.00 22.25 C ATOM 1523 C LEU A 926 40.401 -6.245 21.027 1.00 21.95 C ATOM 1524 O LEU A 926 41.083 -6.510 20.044 1.00 24.01 O ATOM 1525 CB LEU A 926 38.607 -4.610 20.461 1.00 22.82 C ATOM 1526 CG LEU A 926 37.160 -4.306 20.079 1.00 22.23 C ATOM 1527 CD1 LEU A 926 36.989 -2.805 20.010 1.00 24.39 C ATOM 1528 CD2 LEU A 926 36.784 -4.962 18.767 1.00 23.47 C ATOM 1529 H LEU A 926 37.996 -5.621 22.798 1.00 0.00 H ATOM 1530 N GLY A 927 40.918 -6.058 22.237 1.00 23.03 N ATOM 1531 CA GLY A 927 42.363 -6.170 22.431 1.00 23.99 C ATOM 1532 C GLY A 927 43.154 -5.315 21.467 1.00 24.70 C ATOM 1533 O GLY A 927 42.854 -4.135 21.260 1.00 24.20 O ATOM 1534 H GLY A 927 40.298 -5.833 23.041 1.00 0.00 H ATOM 1535 N ASN A 928 44.230 -5.903 20.924 1.00 23.83 N ATOM 1536 CA ASN A 928 45.047 -5.203 19.959 1.00 24.29 C ATOM 1537 C ASN A 928 44.370 -5.289 18.583 1.00 23.39 C ATOM 1538 O ASN A 928 44.168 -6.358 18.013 1.00 25.28 O ATOM 1539 CB ASN A 928 46.443 -5.816 19.897 1.00 26.24 C ATOM 1540 CG ASN A 928 47.202 -5.613 21.184 1.00 28.08 C ATOM 1541 OD1 ASN A 928 47.024 -4.596 21.854 1.00 29.70 O ATOM 1542 ND2 ASN A 928 48.060 -6.566 21.512 1.00 37.18 N ATOM 1543 HD22 ASN A 928 48.165 -7.403 20.904 1.00 0.00 H ATOM 1544 HD21 ASN A 928 48.629 -6.478 22.378 1.00 0.00 H ATOM 1545 H ASN A 928 44.479 -6.874 21.201 1.00 0.00 H ATOM 1546 N MET A 929 44.012 -4.139 18.049 1.00 23.08 N ATOM 1547 CA MET A 929 43.262 -4.032 16.818 1.00 22.57 C ATOM 1548 C MET A 929 44.218 -3.942 15.619 1.00 21.63 C ATOM 1549 O MET A 929 45.164 -3.170 15.632 1.00 23.67 O ATOM 1550 CB MET A 929 42.347 -2.805 16.837 1.00 23.36 C ATOM 1551 CG MET A 929 41.344 -2.837 17.956 1.00 22.63 C ATOM 1552 SD MET A 929 40.254 -1.397 18.046 1.00 24.62 S ATOM 1553 CE MET A 929 41.408 -0.049 18.310 1.00 28.17 C ATOM 1554 H MET A 929 44.283 -3.263 18.539 1.00 0.00 H ATOM 1555 N TYR A 930 43.906 -4.711 14.577 1.00 22.35 N ATOM 1556 CA TYR A 930 44.544 -4.631 13.271 1.00 22.22 C ATOM 1557 C TYR A 930 43.743 -3.621 12.452 1.00 20.67 C ATOM 1558 O TYR A 930 42.595 -3.878 12.074 1.00 22.66 O ATOM 1559 CB TYR A 930 44.571 -6.008 12.614 1.00 22.75 C ATOM 1560 CG TYR A 930 45.366 -6.142 11.339 1.00 22.63 C ATOM 1561 CD1 TYR A 930 46.487 -5.377 11.075 1.00 23.09 C ATOM 1562 CD2 TYR A 930 45.040 -7.121 10.420 1.00 23.84 C ATOM 1563 CE1 TYR A 930 47.233 -5.566 9.923 1.00 23.54 C ATOM 1564 CE2 TYR A 930 45.783 -7.341 9.278 1.00 23.96 C ATOM 1565 CZ TYR A 930 46.891 -6.560 9.021 1.00 25.08 C ATOM 1566 OH TYR A 930 47.633 -6.793 7.891 1.00 28.39 O ATOM 1567 HH TYR A 930 48.387 -6.152 7.855 1.00 0.00 H ATOM 1568 H TYR A 930 43.154 -5.418 14.706 1.00 0.00 H ATOM 1569 N GLU A 931 44.315 -2.428 12.276 1.00 21.45 N ATOM 1570 CA GLU A 931 43.572 -1.279 11.771 1.00 21.22 C ATOM 1571 C GLU A 931 43.801 -1.165 10.269 1.00 21.24 C ATOM 1572 O GLU A 931 44.923 -0.952 9.822 1.00 24.18 O ATOM 1573 CB GLU A 931 43.977 -0.004 12.513 1.00 23.44 C ATOM 1574 CG GLU A 931 43.661 -0.041 13.993 1.00 25.11 C ATOM 1575 CD GLU A 931 43.816 1.223 14.810 1.00 30.32 C ATOM 1576 OE1 GLU A 931 44.377 2.165 14.308 1.00 32.21 O ATOM 1577 OE2 GLU A 931 43.338 1.246 15.968 1.00 39.68 O ATOM 1578 H GLU A 931 45.323 -2.314 12.506 1.00 0.00 H ATOM 1579 N LEU A 932 42.709 -1.271 9.503 1.00 21.86 N ATOM 1580 CA LEU A 932 42.763 -1.308 8.066 1.00 21.42 C ATOM 1581 C LEU A 932 41.838 -0.250 7.469 1.00 21.81 C ATOM 1582 O LEU A 932 40.876 0.183 8.111 1.00 23.22 O ATOM 1583 CB LEU A 932 42.373 -2.711 7.580 1.00 22.80 C ATOM 1584 CG LEU A 932 43.277 -3.856 8.033 1.00 24.34 C ATOM 1585 CD1 LEU A 932 42.679 -5.184 7.594 1.00 27.74 C ATOM 1586 CD2 LEU A 932 44.703 -3.699 7.510 1.00 26.01 C ATOM 1587 H LEU A 932 41.780 -1.329 9.967 1.00 0.00 H ATOM 1588 N LYS A 933 42.159 0.142 6.234 1.00 23.01 N ATOM 1589 CA LYS A 933 41.438 1.215 5.556 1.00 23.55 C ATOM 1590 C LYS A 933 40.794 0.767 4.239 1.00 24.90 C ATOM 1591 O LYS A 933 40.031 1.519 3.675 1.00 29.09 O ATOM 1592 CB LYS A 933 42.417 2.363 5.285 1.00 27.57 C ATOM 1593 CG LYS A 933 43.032 2.900 6.567 1.00 30.52 C ATOM 1594 CD LYS A 933 43.694 4.239 6.445 1.00 32.53 C ATOM 1595 CE LYS A 933 44.977 4.128 5.663 1.00 33.55 C ATOM 1596 NZ LYS A 933 45.545 5.462 5.464 1.00 32.34 N ATOM 1597 HZ1 LYS A 933 44.868 6.051 4.938 1.00 0.00 H ATOM 1598 HZ2 LYS A 933 45.739 5.896 6.389 1.00 0.00 H ATOM 1599 HZ3 LYS A 933 46.430 5.383 4.924 1.00 0.00 H ATOM 1600 H LYS A 933 42.944 -0.330 5.741 1.00 0.00 H ATOM 1601 N HIS A 934 41.123 -0.436 3.759 1.00 24.38 N ATOM 1602 CA HIS A 934 40.612 -0.968 2.489 1.00 25.60 C ATOM 1603 C HIS A 934 40.268 -2.435 2.674 1.00 23.97 C ATOM 1604 O HIS A 934 40.889 -3.129 3.479 1.00 25.17 O ATOM 1605 CB HIS A 934 41.615 -0.769 1.340 1.00 27.76 C ATOM 1606 CG HIS A 934 42.014 0.649 1.177 1.00 30.40 C ATOM 1607 ND1 HIS A 934 41.129 1.612 0.730 1.00 33.65 N ATOM 1608 CD2 HIS A 934 43.164 1.281 1.497 1.00 34.11 C ATOM 1609 CE1 HIS A 934 41.742 2.779 0.731 1.00 34.87 C ATOM 1610 NE2 HIS A 934 42.993 2.601 1.190 1.00 35.84 N ATOM 1611 H HIS A 934 41.775 -1.026 4.314 1.00 0.00 H ATOM 1612 N ALA A 935 39.316 -2.905 1.864 1.00 24.68 N ATOM 1613 CA ALA A 935 38.857 -4.277 1.987 1.00 25.51 C ATOM 1614 C ALA A 935 40.033 -5.255 1.870 1.00 24.44 C ATOM 1615 O ALA A 935 40.849 -5.174 0.957 1.00 26.22 O ATOM 1616 CB ALA A 935 37.808 -4.541 0.948 1.00 25.75 C ATOM 1617 H ALA A 935 38.901 -2.284 1.140 1.00 0.00 H ATOM 1618 N SER A 936 40.009 -6.278 2.717 1.00 23.96 N ATOM 1619 CA SER A 936 41.051 -7.300 2.765 1.00 25.34 C ATOM 1620 C SER A 936 40.494 -8.470 3.558 1.00 25.12 C ATOM 1621 O SER A 936 40.132 -8.283 4.712 1.00 26.88 O ATOM 1622 CB SER A 936 42.308 -6.793 3.410 1.00 29.74 C ATOM 1623 OG SER A 936 43.332 -7.772 3.319 1.00 36.09 O ATOM 1624 HG SER A 936 44.155 -7.427 3.747 1.00 0.00 H ATOM 1625 H SER A 936 39.210 -6.355 3.378 1.00 0.00 H ATOM 1626 N HIS A 937 40.321 -9.609 2.895 1.00 26.88 N ATOM 1627 CA HIS A 937 39.778 -10.757 3.562 1.00 28.93 C ATOM 1628 C HIS A 937 40.932 -11.530 4.198 1.00 31.71 C ATOM 1629 O HIS A 937 41.463 -12.466 3.619 1.00 37.92 O ATOM 1630 CB HIS A 937 39.009 -11.623 2.582 1.00 32.76 C ATOM 1631 CG HIS A 937 37.856 -10.920 1.974 1.00 33.18 C ATOM 1632 ND1 HIS A 937 37.185 -11.431 0.895 1.00 41.25 N ATOM 1633 CD2 HIS A 937 37.258 -9.754 2.280 1.00 37.37 C ATOM 1634 CE1 HIS A 937 36.195 -10.625 0.591 1.00 40.43 C ATOM 1635 NE2 HIS A 937 36.222 -9.595 1.425 1.00 39.71 N ATOM 1636 H HIS A 937 40.580 -9.668 1.890 1.00 0.00 H ATOM 1637 N ILE A 938 41.325 -11.095 5.380 1.00 35.95 N ATOM 1638 CA ILE A 938 42.577 -11.591 5.944 1.00 34.62 C ATOM 1639 C ILE A 938 42.418 -13.093 6.254 1.00 33.87 C ATOM 1640 O ILE A 938 41.384 -13.550 6.787 1.00 36.90 O ATOM 1641 CB ILE A 938 42.988 -10.755 7.169 1.00 37.38 C ATOM 1642 CG1 ILE A 938 41.916 -10.783 8.261 1.00 35.19 C ATOM 1643 CG2 ILE A 938 43.328 -9.311 6.781 1.00 36.58 C ATOM 1644 CD1 ILE A 938 42.450 -10.369 9.603 1.00 40.18 C ATOM 1645 H ILE A 938 40.749 -10.406 5.904 1.00 0.00 H ATOM 1646 N SER A 939 43.463 -13.864 5.928 1.00 37.62 N ATOM 1647 CA SER A 939 43.462 -15.324 6.152 1.00 41.14 C ATOM 1648 C SER A 939 43.577 -15.647 7.655 1.00 40.92 C ATOM 1649 O SER A 939 43.073 -16.652 8.122 1.00 47.97 O ATOM 1650 CB SER A 939 44.557 -15.979 5.344 1.00 45.90 C ATOM 1651 OG SER A 939 45.848 -15.529 5.762 1.00 51.24 O ATOM 1652 HG SER A 939 46.544 -15.974 5.216 1.00 0.00 H ATOM 1653 H SER A 939 44.302 -13.421 5.503 1.00 0.00 H ATOM 1654 N LYS A 940 44.201 -14.745 8.417 1.00 33.69 N ATOM 1655 CA LYS A 940 44.535 -14.968 9.812 1.00 35.33 C ATOM 1656 C LYS A 940 44.907 -13.613 10.414 1.00 30.67 C ATOM 1657 O LYS A 940 45.343 -12.727 9.693 1.00 35.25 O ATOM 1658 CB LYS A 940 45.676 -15.990 9.891 1.00 37.30 C ATOM 1659 CG LYS A 940 46.039 -16.485 11.281 1.00 39.86 C ATOM 1660 CD LYS A 940 47.062 -17.602 11.259 1.00 43.72 C ATOM 1661 CE LYS A 940 47.704 -17.873 12.602 1.00 44.07 C ATOM 1662 NZ LYS A 940 48.443 -19.159 12.584 1.00 50.31 N ATOM 1663 HZ1 LYS A 940 47.784 -19.933 12.365 1.00 0.00 H ATOM 1664 HZ2 LYS A 940 49.187 -19.120 11.858 1.00 0.00 H ATOM 1665 HZ3 LYS A 940 48.874 -19.323 13.516 1.00 0.00 H ATOM 1666 H LYS A 940 44.462 -13.834 7.988 1.00 0.00 H ATOM 1667 N LEU A 941 44.665 -13.433 11.718 1.00 29.34 N ATOM 1668 CA LEU A 941 45.092 -12.182 12.320 1.00 27.88 C ATOM 1669 C LEU A 941 46.601 -12.231 12.495 1.00 25.79 C ATOM 1670 O LEU A 941 47.160 -13.261 12.866 1.00 29.32 O ATOM 1671 CB LEU A 941 44.430 -11.974 13.676 1.00 28.32 C ATOM 1672 CG LEU A 941 42.968 -11.562 13.640 1.00 28.93 C ATOM 1673 CD1 LEU A 941 42.345 -11.824 15.004 1.00 32.38 C ATOM 1674 CD2 LEU A 941 42.845 -10.116 13.239 1.00 31.95 C ATOM 1675 H LEU A 941 44.187 -14.165 12.282 1.00 0.00 H ATOM 1676 N PRO A 942 47.301 -11.094 12.356 1.00 27.73 N ATOM 1677 CA PRO A 942 48.720 -11.040 12.721 1.00 27.69 C ATOM 1678 C PRO A 942 48.939 -11.444 14.187 1.00 27.48 C ATOM 1679 O PRO A 942 48.040 -11.270 15.020 1.00 28.06 O ATOM 1680 CB PRO A 942 49.066 -9.558 12.505 1.00 27.15 C ATOM 1681 CG PRO A 942 48.072 -9.107 11.463 1.00 26.54 C ATOM 1682 CD PRO A 942 46.782 -9.804 11.857 1.00 26.57 C ATOM 1683 N LYS A 943 50.137 -11.936 14.508 1.00 29.03 N ATOM 1684 CA LYS A 943 50.442 -12.341 15.869 1.00 32.43 C ATOM 1685 C LYS A 943 50.254 -11.144 16.814 1.00 30.98 C ATOM 1686 O LYS A 943 50.660 -10.016 16.529 1.00 31.44 O ATOM 1687 CB LYS A 943 51.836 -12.966 15.949 1.00 34.45 C ATOM 1688 CG LYS A 943 51.926 -14.350 15.325 1.00 38.90 C ATOM 1689 CD LYS A 943 53.309 -14.954 15.324 1.00 37.63 C ATOM 1690 CE LYS A 943 53.471 -15.980 14.221 1.00 36.06 C ATOM 1691 NZ LYS A 943 54.878 -16.393 14.081 1.00 34.17 N ATOM 1692 HZ1 LYS A 943 55.461 -15.563 13.851 1.00 0.00 H ATOM 1693 HZ2 LYS A 943 55.206 -16.811 14.975 1.00 0.00 H ATOM 1694 HZ3 LYS A 943 54.958 -17.096 13.318 1.00 0.00 H ATOM 1695 H LYS A 943 50.865 -12.031 13.771 1.00 0.00 H ATOM 1696 N GLY A 944 49.571 -11.415 17.932 1.00 31.25 N ATOM 1697 CA GLY A 944 49.334 -10.425 18.964 1.00 31.44 C ATOM 1698 C GLY A 944 48.109 -9.553 18.703 1.00 29.54 C ATOM 1699 O GLY A 944 47.781 -8.743 19.540 1.00 32.97 O ATOM 1700 H GLY A 944 49.195 -12.375 18.066 1.00 0.00 H ATOM 1701 N LYS A 945 47.445 -9.716 17.555 1.00 25.67 N ATOM 1702 CA LYS A 945 46.229 -8.958 17.241 1.00 24.93 C ATOM 1703 C LYS A 945 45.000 -9.826 17.566 1.00 24.68 C ATOM 1704 O LYS A 945 45.032 -11.053 17.372 1.00 28.51 O ATOM 1705 CB LYS A 945 46.138 -8.551 15.768 1.00 25.84 C ATOM 1706 CG LYS A 945 47.215 -7.601 15.273 1.00 27.54 C ATOM 1707 CD LYS A 945 47.149 -6.267 15.926 1.00 28.24 C ATOM 1708 CE LYS A 945 48.017 -5.245 15.227 1.00 28.84 C ATOM 1709 NZ LYS A 945 47.966 -3.950 15.930 1.00 30.34 N ATOM 1710 HZ1 LYS A 945 46.985 -3.604 15.946 1.00 0.00 H ATOM 1711 HZ2 LYS A 945 48.308 -4.072 16.905 1.00 0.00 H ATOM 1712 HZ3 LYS A 945 48.569 -3.263 15.433 1.00 0.00 H ATOM 1713 H LYS A 945 47.802 -10.403 16.861 1.00 0.00 H ATOM 1714 N HIS A 946 43.908 -9.169 17.997 1.00 23.59 N ATOM 1715 CA HIS A 946 42.690 -9.835 18.469 1.00 24.73 C ATOM 1716 C HIS A 946 41.451 -9.485 17.645 1.00 23.83 C ATOM 1717 O HIS A 946 40.416 -10.121 17.812 1.00 24.49 O ATOM 1718 CB HIS A 946 42.449 -9.486 19.948 1.00 26.67 C ATOM 1719 CG HIS A 946 43.626 -9.785 20.807 1.00 28.63 C ATOM 1720 ND1 HIS A 946 44.495 -8.794 21.236 1.00 27.44 N ATOM 1721 CD2 HIS A 946 44.112 -10.956 21.282 1.00 33.98 C ATOM 1722 CE1 HIS A 946 45.447 -9.349 21.974 1.00 32.60 C ATOM 1723 NE2 HIS A 946 45.244 -10.675 21.997 1.00 35.47 N ATOM 1724 H HIS A 946 43.929 -8.129 17.995 1.00 0.00 H ATOM 1725 N SER A 947 41.534 -8.446 16.820 1.00 21.86 N ATOM 1726 CA SER A 947 40.363 -7.931 16.129 1.00 20.71 C ATOM 1727 C SER A 947 40.842 -7.117 14.936 1.00 21.16 C ATOM 1728 O SER A 947 42.036 -6.775 14.867 1.00 22.36 O ATOM 1729 CB SER A 947 39.535 -7.083 17.056 1.00 21.66 C ATOM 1730 OG SER A 947 40.241 -5.959 17.509 1.00 22.83 O ATOM 1731 HG SER A 947 41.050 -6.254 17.998 1.00 0.00 H ATOM 1732 H SER A 947 42.457 -7.992 16.665 1.00 0.00 H ATOM 1733 N VAL A 948 39.912 -6.782 14.047 1.00 20.80 N ATOM 1734 CA VAL A 948 40.121 -5.772 13.009 1.00 20.66 C ATOM 1735 C VAL A 948 39.257 -4.548 13.296 1.00 20.71 C ATOM 1736 O VAL A 948 38.099 -4.648 13.702 1.00 21.34 O ATOM 1737 CB VAL A 948 39.825 -6.323 11.598 1.00 22.33 C ATOM 1738 CG1 VAL A 948 39.675 -5.200 10.557 1.00 24.53 C ATOM 1739 CG2 VAL A 948 40.864 -7.343 11.190 1.00 23.63 C ATOM 1740 H VAL A 948 38.990 -7.262 14.091 1.00 0.00 H ATOM 1741 N LYS A 949 39.857 -3.372 13.076 1.00 20.87 N ATOM 1742 CA LYS A 949 39.098 -2.118 13.029 1.00 21.06 C ATOM 1743 C LYS A 949 39.270 -1.505 11.644 1.00 20.52 C ATOM 1744 O LYS A 949 40.404 -1.255 11.204 1.00 22.58 O ATOM 1745 CB LYS A 949 39.551 -1.122 14.091 1.00 21.12 C ATOM 1746 CG LYS A 949 38.744 0.165 14.108 1.00 22.52 C ATOM 1747 CD LYS A 949 39.216 1.150 15.148 1.00 23.03 C ATOM 1748 CE LYS A 949 38.440 2.444 15.126 1.00 25.36 C ATOM 1749 NZ LYS A 949 39.021 3.446 16.047 1.00 32.02 N ATOM 1750 HZ1 LYS A 949 39.008 3.072 17.017 1.00 0.00 H ATOM 1751 HZ2 LYS A 949 40.002 3.647 15.765 1.00 0.00 H ATOM 1752 HZ3 LYS A 949 38.460 4.321 16.004 1.00 0.00 H ATOM 1753 H LYS A 949 40.887 -3.347 12.935 1.00 0.00 H ATOM 1754 N GLY A 950 38.145 -1.304 10.957 1.00 21.19 N ATOM 1755 CA GLY A 950 38.100 -0.492 9.754 1.00 21.95 C ATOM 1756 C GLY A 950 38.023 0.979 10.140 1.00 22.17 C ATOM 1757 O GLY A 950 37.141 1.331 10.911 1.00 22.99 O ATOM 1758 H GLY A 950 37.266 -1.746 11.296 1.00 0.00 H ATOM 1759 N LEU A 951 38.969 1.797 9.658 1.00 21.91 N ATOM 1760 CA LEU A 951 39.059 3.196 10.065 1.00 22.92 C ATOM 1761 C LEU A 951 38.238 4.070 9.127 1.00 23.51 C ATOM 1762 O LEU A 951 38.537 4.172 7.944 1.00 26.39 O ATOM 1763 CB LEU A 951 40.505 3.677 10.022 1.00 23.51 C ATOM 1764 CG LEU A 951 41.495 2.931 10.904 1.00 24.49 C ATOM 1765 CD1 LEU A 951 42.883 3.545 10.765 1.00 27.42 C ATOM 1766 CD2 LEU A 951 41.036 2.944 12.336 1.00 27.51 C ATOM 1767 H LEU A 951 39.659 1.424 8.975 1.00 0.00 H ATOM 1768 N GLY A 952 37.215 4.721 9.688 1.00 22.57 N ATOM 1769 CA GLY A 952 36.381 5.656 8.956 1.00 24.16 C ATOM 1770 C GLY A 952 36.920 7.077 8.913 1.00 23.85 C ATOM 1771 O GLY A 952 37.781 7.466 9.701 1.00 24.19 O ATOM 1772 H GLY A 952 37.007 4.550 10.693 1.00 0.00 H ATOM 1773 N LYS A 953 36.341 7.863 8.002 1.00 23.59 N ATOM 1774 CA LYS A 953 36.563 9.302 7.931 1.00 25.34 C ATOM 1775 C LYS A 953 35.974 10.053 9.133 1.00 25.24 C ATOM 1776 O LYS A 953 36.416 11.176 9.447 1.00 26.18 O ATOM 1777 CB LYS A 953 35.928 9.873 6.660 1.00 28.43 C ATOM 1778 CG LYS A 953 36.532 9.368 5.354 1.00 32.15 C ATOM 1779 CD LYS A 953 37.926 9.870 5.080 1.00 37.14 C ATOM 1780 CE LYS A 953 37.981 11.349 4.801 1.00 38.98 C ATOM 1781 NZ LYS A 953 39.372 11.779 4.519 1.00 41.61 N ATOM 1782 HZ1 LYS A 953 39.972 11.570 5.342 1.00 0.00 H ATOM 1783 HZ2 LYS A 953 39.730 11.266 3.688 1.00 0.00 H ATOM 1784 HZ3 LYS A 953 39.386 12.802 4.330 1.00 0.00 H ATOM 1785 H LYS A 953 35.700 7.427 7.309 1.00 0.00 H ATOM 1786 N THR A 954 34.936 9.484 9.760 1.00 25.75 N ATOM 1787 CA THR A 954 34.279 10.105 10.908 1.00 25.61 C ATOM 1788 C THR A 954 34.334 9.122 12.085 1.00 25.16 C ATOM 1789 O THR A 954 34.078 7.937 11.895 1.00 27.39 O ATOM 1790 CB THR A 954 32.826 10.488 10.561 1.00 29.05 C ATOM 1791 OG1 THR A 954 32.815 11.489 9.542 1.00 30.30 O ATOM 1792 CG2 THR A 954 32.036 10.983 11.754 1.00 32.94 C ATOM 1793 HG1 THR A 954 33.262 11.138 8.732 1.00 0.00 H ATOM 1794 H THR A 954 34.585 8.567 9.417 1.00 0.00 H ATOM 1795 N THR A 955 34.576 9.639 13.289 1.00 25.98 N ATOM 1796 CA THR A 955 34.666 8.831 14.504 1.00 26.08 C ATOM 1797 C THR A 955 33.952 9.574 15.620 1.00 28.04 C ATOM 1798 O THR A 955 33.991 10.800 15.662 1.00 28.14 O ATOM 1799 CB THR A 955 36.137 8.557 14.836 1.00 30.42 C ATOM 1800 OG1 THR A 955 36.244 7.704 15.973 1.00 32.60 O ATOM 1801 CG2 THR A 955 36.918 9.813 15.150 1.00 28.17 C ATOM 1802 HG1 THR A 955 37.200 7.539 16.171 1.00 0.00 H ATOM 1803 H THR A 955 34.707 10.668 13.368 1.00 0.00 H ATOM 1804 N PRO A 956 33.296 8.886 16.569 1.00 27.93 N ATOM 1805 CA PRO A 956 32.937 9.536 17.830 1.00 27.86 C ATOM 1806 C PRO A 956 34.177 10.205 18.439 1.00 27.01 C ATOM 1807 O PRO A 956 35.255 9.651 18.417 1.00 30.43 O ATOM 1808 CB PRO A 956 32.415 8.389 18.689 1.00 29.79 C ATOM 1809 CG PRO A 956 31.915 7.375 17.653 1.00 31.79 C ATOM 1810 CD PRO A 956 32.937 7.458 16.538 1.00 29.14 C ATOM 1811 N ASP A 957 34.004 11.434 18.930 1.00 30.01 N ATOM 1812 CA ASP A 957 35.081 12.179 19.526 1.00 32.94 C ATOM 1813 C ASP A 957 35.686 11.369 20.667 1.00 35.28 C ATOM 1814 O ASP A 957 35.017 11.146 21.670 1.00 39.29 O ATOM 1815 CB ASP A 957 34.579 13.525 20.039 1.00 36.14 C ATOM 1816 CG ASP A 957 35.650 14.431 20.610 1.00 40.96 C ATOM 1817 OD1 ASP A 957 36.774 13.949 20.902 1.00 43.28 O ATOM 1818 OD2 ASP A 957 35.353 15.604 20.748 1.00 47.29 O ATOM 1819 H ASP A 957 33.060 11.867 18.880 1.00 0.00 H ATOM 1820 N PRO A 958 36.964 10.926 20.583 1.00 42.15 N ATOM 1821 CA PRO A 958 37.512 10.047 21.620 1.00 46.96 C ATOM 1822 C PRO A 958 37.627 10.711 23.008 1.00 54.66 C ATOM 1823 O PRO A 958 37.685 10.007 24.014 1.00 53.67 O ATOM 1824 CB PRO A 958 38.892 9.598 21.102 1.00 49.71 C ATOM 1825 CG PRO A 958 39.193 10.471 19.903 1.00 50.18 C ATOM 1826 CD PRO A 958 37.900 11.148 19.471 1.00 44.59 C ATOM 1827 N SER A 959 37.638 12.050 23.061 1.00 55.82 N ATOM 1828 CA SER A 959 37.667 12.761 24.334 1.00 60.42 C ATOM 1829 C SER A 959 36.388 12.543 25.153 1.00 53.31 C ATOM 1830 O SER A 959 36.405 12.755 26.356 1.00 56.48 O ATOM 1831 CB SER A 959 37.913 14.229 24.120 1.00 59.41 C ATOM 1832 OG SER A 959 36.703 14.930 23.835 1.00 61.98 O ATOM 1833 HG SER A 959 36.294 14.559 23.014 1.00 0.00 H ATOM 1834 H SER A 959 37.626 12.594 22.175 1.00 0.00 H ATOM 1835 N ALA A 960 35.293 12.088 24.501 1.00 48.64 N ATOM 1836 CA ALA A 960 34.005 11.948 25.177 1.00 44.58 C ATOM 1837 C ALA A 960 33.748 10.501 25.625 1.00 39.65 C ATOM 1838 O ALA A 960 32.709 10.243 26.210 1.00 39.28 O ATOM 1839 CB ALA A 960 32.898 12.449 24.279 1.00 48.08 C ATOM 1840 H ALA A 960 35.370 11.832 23.496 1.00 0.00 H ATOM 1841 N ASN A 961 34.687 9.579 25.385 1.00 37.23 N ATOM 1842 CA ASN A 961 34.496 8.178 25.821 1.00 35.01 C ATOM 1843 C ASN A 961 34.205 8.152 27.329 1.00 35.53 C ATOM 1844 O ASN A 961 34.849 8.895 28.113 1.00 39.26 O ATOM 1845 CB ASN A 961 35.725 7.294 25.606 1.00 37.50 C ATOM 1846 CG ASN A 961 36.006 6.900 24.173 1.00 40.83 C ATOM 1847 OD1 ASN A 961 35.286 7.269 23.242 1.00 39.81 O ATOM 1848 ND2 ASN A 961 37.082 6.148 23.993 1.00 48.05 N ATOM 1849 HD22 ASN A 961 37.659 5.861 24.810 1.00 0.00 H ATOM 1850 HD21 ASN A 961 37.350 5.844 23.035 1.00 0.00 H ATOM 1851 H ASN A 961 35.559 9.849 24.887 1.00 0.00 H ATOM 1852 N ILE A 962 33.270 7.282 27.740 1.00 32.70 N ATOM 1853 CA ILE A 962 33.041 7.022 29.154 1.00 33.35 C ATOM 1854 C ILE A 962 33.129 5.522 29.399 1.00 31.99 C ATOM 1855 O ILE A 962 33.104 4.719 28.459 1.00 36.16 O ATOM 1856 CB ILE A 962 31.701 7.610 29.625 1.00 36.66 C ATOM 1857 CG1 ILE A 962 30.489 7.027 28.899 1.00 38.58 C ATOM 1858 CG2 ILE A 962 31.725 9.126 29.515 1.00 41.36 C ATOM 1859 CD1 ILE A 962 29.931 5.786 29.526 1.00 41.58 C ATOM 1860 H ILE A 962 32.695 6.782 27.032 1.00 0.00 H ATOM 1861 N SER A 963 33.210 5.157 30.679 1.00 34.38 N ATOM 1862 CA SER A 963 33.297 3.770 31.083 1.00 35.09 C ATOM 1863 C SER A 963 31.972 3.386 31.744 1.00 36.06 C ATOM 1864 O SER A 963 31.518 4.085 32.667 1.00 41.09 O ATOM 1865 CB SER A 963 34.476 3.595 32.033 1.00 40.83 C ATOM 1866 OG SER A 963 34.624 2.235 32.430 1.00 46.67 O ATOM 1867 HG SER A 963 33.801 1.935 32.891 1.00 0.00 H ATOM 1868 H SER A 963 33.211 5.894 31.412 1.00 0.00 H ATOM 1869 N LEU A 964 31.357 2.296 31.272 1.00 33.86 N ATOM 1870 CA LEU A 964 30.159 1.733 31.888 1.00 36.68 C ATOM 1871 C LEU A 964 30.497 0.309 32.336 1.00 36.86 C ATOM 1872 O LEU A 964 30.750 -0.560 31.496 1.00 33.42 O ATOM 1873 CB LEU A 964 28.997 1.761 30.887 1.00 35.34 C ATOM 1874 CG LEU A 964 27.688 1.118 31.356 1.00 38.50 C ATOM 1875 CD1 LEU A 964 27.137 1.839 32.579 1.00 43.85 C ATOM 1876 CD2 LEU A 964 26.662 1.110 30.231 1.00 38.66 C ATOM 1877 H LEU A 964 31.749 1.829 30.429 1.00 0.00 H ATOM 1878 N ASP A 965 30.602 0.103 33.656 1.00 38.70 N ATOM 1879 CA ASP A 965 30.866 -1.230 34.186 1.00 40.55 C ATOM 1880 C ASP A 965 32.160 -1.794 33.577 1.00 34.24 C ATOM 1881 O ASP A 965 32.222 -2.969 33.240 1.00 38.84 O ATOM 1882 CB ASP A 965 29.668 -2.151 33.910 1.00 43.25 C ATOM 1883 CG ASP A 965 28.431 -1.816 34.729 1.00 51.94 C ATOM 1884 OD1 ASP A 965 28.604 -1.526 35.930 1.00 58.78 O ATOM 1885 OD2 ASP A 965 27.308 -1.837 34.163 1.00 59.98 O ATOM 1886 H ASP A 965 30.494 0.904 34.311 1.00 0.00 H ATOM 1887 N GLY A 966 33.182 -0.947 33.417 1.00 37.42 N ATOM 1888 CA GLY A 966 34.516 -1.383 32.957 1.00 36.71 C ATOM 1889 C GLY A 966 34.633 -1.545 31.443 1.00 37.46 C ATOM 1890 O GLY A 966 35.671 -2.027 30.948 1.00 41.47 O ATOM 1891 H GLY A 966 33.031 0.061 33.625 1.00 0.00 H ATOM 1892 N VAL A 967 33.601 -1.118 30.703 1.00 30.88 N ATOM 1893 CA VAL A 967 33.553 -1.220 29.247 1.00 28.53 C ATOM 1894 C VAL A 967 33.517 0.203 28.678 1.00 28.68 C ATOM 1895 O VAL A 967 32.761 1.035 29.150 1.00 30.00 O ATOM 1896 CB VAL A 967 32.322 -2.031 28.788 1.00 25.95 C ATOM 1897 CG1 VAL A 967 32.271 -2.159 27.267 1.00 24.39 C ATOM 1898 CG2 VAL A 967 32.272 -3.404 29.431 1.00 28.12 C ATOM 1899 H VAL A 967 32.789 -0.690 31.193 1.00 0.00 H ATOM 1900 N ASP A 968 34.340 0.459 27.657 1.00 26.60 N ATOM 1901 CA ASP A 968 34.438 1.785 27.062 1.00 27.30 C ATOM 1902 C ASP A 968 33.207 1.983 26.167 1.00 25.21 C ATOM 1903 O ASP A 968 32.873 1.109 25.367 1.00 26.09 O ATOM 1904 CB ASP A 968 35.753 1.926 26.297 1.00 29.18 C ATOM 1905 CG ASP A 968 36.977 1.699 27.178 1.00 37.27 C ATOM 1906 OD1 ASP A 968 37.046 2.321 28.294 1.00 46.68 O ATOM 1907 OD2 ASP A 968 37.868 0.915 26.762 1.00 45.50 O ATOM 1908 H ASP A 968 34.927 -0.310 27.276 1.00 0.00 H ATOM 1909 N VAL A 969 32.586 3.162 26.291 1.00 24.66 N ATOM 1910 CA VAL A 969 31.449 3.566 25.499 1.00 24.31 C ATOM 1911 C VAL A 969 31.802 4.794 24.676 1.00 24.39 C ATOM 1912 O VAL A 969 31.925 5.894 25.232 1.00 27.72 O ATOM 1913 CB VAL A 969 30.221 3.847 26.366 1.00 26.69 C ATOM 1914 CG1 VAL A 969 29.016 4.097 25.464 1.00 27.08 C ATOM 1915 CG2 VAL A 969 29.954 2.700 27.341 1.00 26.04 C ATOM 1916 H VAL A 969 32.945 3.829 27.003 1.00 0.00 H ATOM 1917 N PRO A 970 31.927 4.652 23.337 1.00 24.89 N ATOM 1918 CA PRO A 970 32.360 5.766 22.490 1.00 26.39 C ATOM 1919 C PRO A 970 31.164 6.607 22.030 1.00 26.42 C ATOM 1920 O PRO A 970 30.801 6.595 20.844 1.00 28.01 O ATOM 1921 CB PRO A 970 33.036 5.005 21.337 1.00 27.89 C ATOM 1922 CG PRO A 970 32.175 3.787 21.163 1.00 26.63 C ATOM 1923 CD PRO A 970 31.831 3.380 22.587 1.00 25.49 C ATOM 1924 N LEU A 971 30.558 7.320 22.983 1.00 28.63 N ATOM 1925 CA LEU A 971 29.310 8.017 22.713 1.00 28.75 C ATOM 1926 C LEU A 971 29.516 9.491 22.343 1.00 31.21 C ATOM 1927 O LEU A 971 28.536 10.247 22.272 1.00 32.32 O ATOM 1928 CB LEU A 971 28.339 7.841 23.884 1.00 29.46 C ATOM 1929 CG LEU A 971 28.834 8.104 25.309 1.00 30.45 C ATOM 1930 CD1 LEU A 971 29.358 9.530 25.485 1.00 33.23 C ATOM 1931 CD2 LEU A 971 27.714 7.812 26.283 1.00 34.26 C ATOM 1932 H LEU A 971 30.984 7.378 23.930 1.00 0.00 H ATOM 1933 N GLY A 972 30.756 9.903 22.078 1.00 28.62 N ATOM 1934 CA GLY A 972 31.028 11.234 21.564 1.00 30.96 C ATOM 1935 C GLY A 972 30.336 11.519 20.231 1.00 31.01 C ATOM 1936 O GLY A 972 30.117 10.653 19.406 1.00 32.25 O ATOM 1937 H GLY A 972 31.551 9.253 22.244 1.00 0.00 H ATOM 1938 N THR A 973 29.983 12.790 20.003 1.00 31.01 N ATOM 1939 CA THR A 973 29.481 13.182 18.695 1.00 29.72 C ATOM 1940 C THR A 973 30.577 12.964 17.640 1.00 32.75 C ATOM 1941 O THR A 973 31.758 13.009 17.924 1.00 32.85 O ATOM 1942 CB THR A 973 28.933 14.616 18.674 1.00 32.20 C ATOM 1943 OG1 THR A 973 29.909 15.557 19.143 1.00 37.61 O ATOM 1944 CG2 THR A 973 27.651 14.750 19.471 1.00 32.66 C ATOM 1945 HG1 THR A 973 30.163 15.331 20.073 1.00 0.00 H ATOM 1946 H THR A 973 30.068 13.497 20.761 1.00 0.00 H ATOM 1947 N GLY A 974 30.129 12.679 16.418 1.00 36.51 N ATOM 1948 CA GLY A 974 31.020 12.392 15.310 1.00 36.39 C ATOM 1949 C GLY A 974 31.878 13.593 14.934 1.00 35.84 C ATOM 1950 O GLY A 974 31.382 14.704 14.776 1.00 43.68 O ATOM 1951 H GLY A 974 29.102 12.662 16.252 1.00 0.00 H ATOM 1952 N ILE A 975 33.179 13.347 14.765 1.00 31.55 N ATOM 1953 CA ILE A 975 34.131 14.336 14.298 1.00 31.71 C ATOM 1954 C ILE A 975 34.960 13.732 13.163 1.00 27.92 C ATOM 1955 O ILE A 975 35.043 12.529 12.999 1.00 28.93 O ATOM 1956 CB ILE A 975 35.055 14.833 15.429 1.00 33.93 C ATOM 1957 CG1 ILE A 975 35.967 13.722 15.962 1.00 33.31 C ATOM 1958 CG2 ILE A 975 34.250 15.503 16.534 1.00 40.33 C ATOM 1959 CD1 ILE A 975 36.973 14.198 16.980 1.00 37.68 C ATOM 1960 H ILE A 975 33.530 12.392 14.980 1.00 0.00 H ATOM 1961 N SER A 976 35.673 14.586 12.431 1.00 28.97 N ATOM 1962 CA SER A 976 36.626 14.102 11.460 1.00 27.52 C ATOM 1963 C SER A 976 37.714 13.302 12.180 1.00 28.02 C ATOM 1964 O SER A 976 38.279 13.754 13.136 1.00 30.41 O ATOM 1965 CB SER A 976 37.250 15.237 10.708 1.00 34.22 C ATOM 1966 OG SER A 976 38.204 14.739 9.805 1.00 36.75 O ATOM 1967 HG SER A 976 37.763 14.125 9.166 1.00 0.00 H ATOM 1968 H SER A 976 35.542 15.610 12.560 1.00 0.00 H ATOM 1969 N SER A 977 37.998 12.100 11.691 1.00 25.60 N ATOM 1970 CA SER A 977 39.014 11.264 12.270 1.00 25.83 C ATOM 1971 C SER A 977 40.427 11.720 11.885 1.00 26.49 C ATOM 1972 O SER A 977 41.396 11.327 12.514 1.00 26.97 O ATOM 1973 CB SER A 977 38.815 9.840 11.832 1.00 25.35 C ATOM 1974 OG SER A 977 39.084 9.736 10.440 1.00 24.60 O ATOM 1975 HG SER A 977 38.954 8.799 10.149 1.00 0.00 H ATOM 1976 H SER A 977 37.470 11.754 10.865 1.00 0.00 H ATOM 1977 N GLY A 978 40.545 12.456 10.780 1.00 24.70 N ATOM 1978 CA GLY A 978 41.798 12.790 10.219 1.00 24.96 C ATOM 1979 C GLY A 978 42.490 11.675 9.451 1.00 26.52 C ATOM 1980 O GLY A 978 43.668 11.825 9.050 1.00 28.15 O ATOM 1981 H GLY A 978 39.681 12.798 10.313 1.00 0.00 H ATOM 1982 N VAL A 979 41.795 10.559 9.245 1.00 24.99 N ATOM 1983 CA VAL A 979 42.287 9.470 8.415 1.00 23.94 C ATOM 1984 C VAL A 979 42.001 9.814 6.963 1.00 26.52 C ATOM 1985 O VAL A 979 40.871 10.186 6.623 1.00 29.21 O ATOM 1986 CB VAL A 979 41.636 8.131 8.794 1.00 24.53 C ATOM 1987 CG1 VAL A 979 42.075 7.015 7.862 1.00 25.68 C ATOM 1988 CG2 VAL A 979 41.909 7.782 10.246 1.00 24.57 C ATOM 1989 H VAL A 979 40.863 10.461 9.695 1.00 0.00 H ATOM 1990 N ASN A 980 43.051 9.743 6.146 1.00 26.06 N ATOM 1991 CA ASN A 980 42.957 9.905 4.716 1.00 29.40 C ATOM 1992 C ASN A 980 43.210 8.558 4.050 1.00 29.70 C ATOM 1993 O ASN A 980 43.771 7.633 4.667 1.00 31.70 O ATOM 1994 CB ASN A 980 43.909 10.994 4.209 1.00 31.98 C ATOM 1995 CG ASN A 980 43.558 12.356 4.782 1.00 37.09 C ATOM 1996 OD1 ASN A 980 42.380 12.722 4.884 1.00 42.17 O ATOM 1997 ND2 ASN A 980 44.565 13.112 5.172 1.00 45.83 N ATOM 1998 HD22 ASN A 980 45.542 12.770 5.070 1.00 0.00 H ATOM 1999 HD21 ASN A 980 44.383 14.050 5.581 1.00 0.00 H ATOM 2000 H ASN A 980 43.987 9.561 6.561 1.00 0.00 H ATOM 2001 N ASP A 981 42.830 8.462 2.781 1.00 35.26 N ATOM 2002 CA ASP A 981 43.093 7.236 1.984 1.00 36.56 C ATOM 2003 C ASP A 981 42.376 6.049 2.637 1.00 34.46 C ATOM 2004 O ASP A 981 43.019 5.030 2.971 1.00 35.91 O ATOM 2005 CB ASP A 981 44.608 6.993 1.853 1.00 41.60 C ATOM 2006 CG ASP A 981 44.989 5.758 1.049 1.00 51.47 C ATOM 2007 OD1 ASP A 981 44.244 5.426 0.103 1.00 53.35 O ATOM 2008 OD2 ASP A 981 46.023 5.115 1.401 1.00 59.40 O ATOM 2009 H ASP A 981 42.338 9.262 2.336 1.00 0.00 H ATOM 2010 N THR A 982 41.066 6.203 2.854 1.00 29.99 N ATOM 2011 CA THR A 982 40.228 5.130 3.431 1.00 26.93 C ATOM 2012 C THR A 982 38.922 4.958 2.628 1.00 27.89 C ATOM 2013 O THR A 982 38.325 5.923 2.075 1.00 31.48 O ATOM 2014 CB THR A 982 39.902 5.325 4.922 1.00 27.64 C ATOM 2015 OG1 THR A 982 39.045 4.257 5.316 1.00 27.71 O ATOM 2016 CG2 THR A 982 39.153 6.601 5.231 1.00 29.97 C ATOM 2017 HG1 THR A 982 38.817 4.355 6.274 1.00 0.00 H ATOM 2018 H THR A 982 40.620 7.110 2.608 1.00 0.00 H ATOM 2019 N SER A 983 38.488 3.696 2.556 1.00 27.11 N ATOM 2020 CA SER A 983 37.256 3.295 1.867 1.00 26.80 C ATOM 2021 C SER A 983 36.004 3.479 2.743 1.00 28.54 C ATOM 2022 O SER A 983 34.892 3.252 2.248 1.00 32.27 O ATOM 2023 CB SER A 983 37.341 1.856 1.437 1.00 29.67 C ATOM 2024 OG SER A 983 38.306 1.712 0.421 1.00 35.53 O ATOM 2025 HG SER A 983 38.354 0.762 0.145 1.00 0.00 H ATOM 2026 H SER A 983 39.056 2.955 3.015 1.00 0.00 H ATOM 2027 N LEU A 984 36.181 3.787 4.032 1.00 26.81 N ATOM 2028 CA LEU A 984 35.066 3.764 4.999 1.00 27.87 C ATOM 2029 C LEU A 984 34.678 5.179 5.414 1.00 25.09 C ATOM 2030 O LEU A 984 35.562 5.975 5.797 1.00 25.96 O ATOM 2031 CB LEU A 984 35.464 2.971 6.250 1.00 25.89 C ATOM 2032 CG LEU A 984 35.527 1.478 6.062 1.00 27.88 C ATOM 2033 CD1 LEU A 984 36.098 0.834 7.275 1.00 33.78 C ATOM 2034 CD2 LEU A 984 34.121 0.947 5.865 1.00 33.64 C ATOM 2035 H LEU A 984 37.131 4.050 4.363 1.00 0.00 H ATOM 2036 N LEU A 985 33.368 5.472 5.378 1.00 26.19 N ATOM 2037 CA LEU A 985 32.852 6.717 5.975 1.00 27.37 C ATOM 2038 C LEU A 985 32.948 6.665 7.514 1.00 25.40 C ATOM 2039 O LEU A 985 33.216 7.684 8.152 1.00 26.25 O ATOM 2040 CB LEU A 985 31.415 6.969 5.515 1.00 30.69 C ATOM 2041 CG LEU A 985 31.239 7.400 4.062 1.00 35.50 C ATOM 2042 CD1 LEU A 985 29.769 7.628 3.781 1.00 39.62 C ATOM 2043 CD2 LEU A 985 32.055 8.646 3.736 1.00 38.89 C ATOM 2044 H LEU A 985 32.708 4.811 4.922 1.00 0.00 H ATOM 2045 N TYR A 986 32.654 5.496 8.094 1.00 25.31 N ATOM 2046 CA TYR A 986 32.531 5.286 9.544 1.00 24.31 C ATOM 2047 C TYR A 986 33.314 4.038 9.938 1.00 23.27 C ATOM 2048 O TYR A 986 33.528 3.160 9.128 1.00 23.95 O ATOM 2049 CB TYR A 986 31.059 5.165 9.968 1.00 24.62 C ATOM 2050 CG TYR A 986 30.233 6.290 9.409 1.00 25.47 C ATOM 2051 CD1 TYR A 986 30.378 7.579 9.893 1.00 26.51 C ATOM 2052 CD2 TYR A 986 29.374 6.084 8.341 1.00 27.50 C ATOM 2053 CE1 TYR A 986 29.703 8.642 9.322 1.00 28.95 C ATOM 2054 CE2 TYR A 986 28.662 7.134 7.793 1.00 28.80 C ATOM 2055 CZ TYR A 986 28.827 8.417 8.280 1.00 30.04 C ATOM 2056 OH TYR A 986 28.149 9.453 7.694 1.00 32.64 O ATOM 2057 HH TYR A 986 27.175 9.289 7.762 1.00 0.00 H ATOM 2058 H TYR A 986 32.501 4.675 7.474 1.00 0.00 H ATOM 2059 N ASN A 987 33.710 3.985 11.205 1.00 23.04 N ATOM 2060 CA ASN A 987 34.465 2.847 11.688 1.00 22.13 C ATOM 2061 C ASN A 987 33.617 1.566 11.607 1.00 21.81 C ATOM 2062 O ASN A 987 32.373 1.586 11.603 1.00 22.70 O ATOM 2063 CB ASN A 987 34.868 3.061 13.137 1.00 22.31 C ATOM 2064 CG ASN A 987 35.823 4.214 13.353 1.00 23.01 C ATOM 2065 OD1 ASN A 987 36.661 4.504 12.498 1.00 23.26 O ATOM 2066 ND2 ASN A 987 35.707 4.837 14.512 1.00 23.66 N ATOM 2067 HD22 ASN A 987 34.976 4.541 15.190 1.00 0.00 H ATOM 2068 HD21 ASN A 987 36.346 5.623 14.746 1.00 0.00 H ATOM 2069 H ASN A 987 33.477 4.764 11.853 1.00 0.00 H ATOM 2070 N GLU A 988 34.301 0.420 11.626 1.00 21.26 N ATOM 2071 CA GLU A 988 33.654 -0.844 11.951 1.00 21.70 C ATOM 2072 C GLU A 988 34.680 -1.722 12.659 1.00 20.23 C ATOM 2073 O GLU A 988 35.873 -1.504 12.539 1.00 22.63 O ATOM 2074 CB GLU A 988 33.019 -1.516 10.738 1.00 24.02 C ATOM 2075 CG GLU A 988 33.931 -1.706 9.551 1.00 22.85 C ATOM 2076 CD GLU A 988 33.141 -2.108 8.309 1.00 24.96 C ATOM 2077 OE1 GLU A 988 32.223 -1.325 7.901 1.00 26.48 O ATOM 2078 OE2 GLU A 988 33.402 -3.196 7.777 1.00 27.75 O ATOM 2079 H GLU A 988 35.317 0.430 11.404 1.00 0.00 H ATOM 2080 N TYR A 989 34.161 -2.688 13.421 1.00 19.86 N ATOM 2081 CA TYR A 989 34.949 -3.531 14.271 1.00 20.00 C ATOM 2082 C TYR A 989 34.546 -4.973 14.001 1.00 19.95 C ATOM 2083 O TYR A 989 33.366 -5.285 13.977 1.00 21.07 O ATOM 2084 CB TYR A 989 34.717 -3.191 15.744 1.00 20.38 C ATOM 2085 CG TYR A 989 34.952 -1.754 16.102 1.00 19.89 C ATOM 2086 CD1 TYR A 989 33.985 -0.776 15.881 1.00 20.52 C ATOM 2087 CD2 TYR A 989 36.128 -1.375 16.707 1.00 21.57 C ATOM 2088 CE1 TYR A 989 34.200 0.541 16.247 1.00 22.27 C ATOM 2089 CE2 TYR A 989 36.353 -0.068 17.094 1.00 23.43 C ATOM 2090 CZ TYR A 989 35.380 0.898 16.876 1.00 23.25 C ATOM 2091 OH TYR A 989 35.589 2.192 17.287 1.00 27.85 O ATOM 2092 HH TYR A 989 34.800 2.743 17.054 1.00 0.00 H ATOM 2093 H TYR A 989 33.132 -2.836 13.396 1.00 0.00 H ATOM 2094 N ILE A 990 35.546 -5.855 13.873 1.00 19.60 N ATOM 2095 CA ILE A 990 35.319 -7.234 13.511 1.00 20.83 C ATOM 2096 C ILE A 990 36.094 -8.142 14.473 1.00 21.03 C ATOM 2097 O ILE A 990 37.294 -7.974 14.681 1.00 21.05 O ATOM 2098 CB ILE A 990 35.726 -7.516 12.055 1.00 21.98 C ATOM 2099 CG1 ILE A 990 34.989 -6.621 11.054 1.00 22.51 C ATOM 2100 CG2 ILE A 990 35.495 -8.987 11.726 1.00 24.06 C ATOM 2101 CD1 ILE A 990 35.515 -5.225 10.908 1.00 25.87 C ATOM 2102 H ILE A 990 36.521 -5.535 14.040 1.00 0.00 H ATOM 2103 N VAL A 991 35.395 -9.138 15.023 1.00 20.40 N ATOM 2104 CA VAL A 991 36.066 -10.246 15.682 1.00 20.58 C ATOM 2105 C VAL A 991 35.750 -11.537 14.925 1.00 21.40 C ATOM 2106 O VAL A 991 34.707 -11.659 14.277 1.00 22.86 O ATOM 2107 CB VAL A 991 35.699 -10.344 17.170 1.00 20.73 C ATOM 2108 CG1 VAL A 991 36.189 -9.135 17.922 1.00 21.86 C ATOM 2109 CG2 VAL A 991 34.209 -10.560 17.375 1.00 22.40 C ATOM 2110 H VAL A 991 34.356 -9.121 14.979 1.00 0.00 H ATOM 2111 N TYR A 992 36.676 -12.500 15.026 1.00 22.07 N ATOM 2112 CA TYR A 992 36.605 -13.750 14.298 1.00 22.17 C ATOM 2113 C TYR A 992 36.434 -14.945 15.237 1.00 24.17 C ATOM 2114 O TYR A 992 36.505 -16.074 14.770 1.00 28.12 O ATOM 2115 CB TYR A 992 37.855 -13.874 13.429 1.00 24.10 C ATOM 2116 CG TYR A 992 38.021 -12.757 12.434 1.00 22.96 C ATOM 2117 CD1 TYR A 992 37.366 -12.787 11.211 1.00 24.47 C ATOM 2118 CD2 TYR A 992 38.845 -11.680 12.705 1.00 25.79 C ATOM 2119 CE1 TYR A 992 37.506 -11.773 10.276 1.00 24.58 C ATOM 2120 CE2 TYR A 992 38.989 -10.656 11.785 1.00 27.04 C ATOM 2121 CZ TYR A 992 38.326 -10.699 10.572 1.00 25.01 C ATOM 2122 OH TYR A 992 38.521 -9.672 9.692 1.00 28.12 O ATOM 2123 HH TYR A 992 37.988 -9.835 8.874 1.00 0.00 H ATOM 2124 H TYR A 992 37.486 -12.342 15.659 1.00 0.00 H ATOM 2125 N ASP A 993 36.208 -14.688 16.533 1.00 24.07 N ATOM 2126 CA ASP A 993 35.934 -15.742 17.512 1.00 24.94 C ATOM 2127 C ASP A 993 34.678 -15.310 18.263 1.00 23.78 C ATOM 2128 O ASP A 993 34.642 -14.211 18.831 1.00 25.57 O ATOM 2129 CB ASP A 993 37.128 -15.932 18.448 1.00 27.03 C ATOM 2130 CG ASP A 993 36.983 -17.008 19.514 1.00 29.19 C ATOM 2131 OD1 ASP A 993 35.826 -17.370 19.851 1.00 29.00 O ATOM 2132 OD2 ASP A 993 38.047 -17.491 20.004 1.00 36.25 O ATOM 2133 H ASP A 993 36.228 -13.700 16.856 1.00 0.00 H ATOM 2134 N ILE A 994 33.633 -16.136 18.170 1.00 24.23 N ATOM 2135 CA ILE A 994 32.333 -15.816 18.741 1.00 24.99 C ATOM 2136 C ILE A 994 32.429 -15.567 20.260 1.00 24.22 C ATOM 2137 O ILE A 994 31.607 -14.845 20.807 1.00 26.19 O ATOM 2138 CB ILE A 994 31.282 -16.900 18.412 1.00 29.34 C ATOM 2139 CG1 ILE A 994 31.667 -18.255 18.993 1.00 32.12 C ATOM 2140 CG2 ILE A 994 31.029 -16.978 16.913 1.00 34.00 C ATOM 2141 CD1 ILE A 994 30.670 -19.339 18.704 1.00 38.33 C ATOM 2142 H ILE A 994 33.752 -17.041 17.671 1.00 0.00 H ATOM 2143 N ALA A 995 33.444 -16.115 20.931 1.00 25.19 N ATOM 2144 CA ALA A 995 33.609 -15.966 22.363 1.00 25.91 C ATOM 2145 C ALA A 995 34.051 -14.559 22.771 1.00 24.44 C ATOM 2146 O ALA A 995 34.002 -14.248 23.960 1.00 26.77 O ATOM 2147 CB ALA A 995 34.596 -16.994 22.875 1.00 28.90 C ATOM 2148 H ALA A 995 34.146 -16.673 20.404 1.00 0.00 H ATOM 2149 N GLN A 996 34.452 -13.714 21.810 1.00 22.93 N ATOM 2150 CA GLN A 996 34.892 -12.336 22.116 1.00 21.38 C ATOM 2151 C GLN A 996 33.719 -11.367 22.250 1.00 21.46 C ATOM 2152 O GLN A 996 33.957 -10.189 22.459 1.00 22.80 O ATOM 2153 CB GLN A 996 35.863 -11.815 21.050 1.00 23.79 C ATOM 2154 CG GLN A 996 37.260 -12.401 21.181 1.00 25.13 C ATOM 2155 CD GLN A 996 38.115 -12.045 19.997 1.00 24.27 C ATOM 2156 OE1 GLN A 996 38.277 -12.851 19.093 1.00 29.15 O ATOM 2157 NE2 GLN A 996 38.697 -10.858 20.021 1.00 23.32 N ATOM 2158 HE22 GLN A 996 38.524 -10.210 20.816 1.00 0.00 H ATOM 2159 HE21 GLN A 996 39.328 -10.572 19.245 1.00 0.00 H ATOM 2160 H GLN A 996 34.454 -14.037 20.821 1.00 0.00 H ATOM 2161 N VAL A 997 32.485 -11.856 22.173 1.00 20.73 N ATOM 2162 CA VAL A 997 31.308 -11.022 22.281 1.00 21.56 C ATOM 2163 C VAL A 997 30.505 -11.399 23.524 1.00 20.40 C ATOM 2164 O VAL A 997 30.115 -12.565 23.677 1.00 23.25 O ATOM 2165 CB VAL A 997 30.419 -11.202 21.032 1.00 22.42 C ATOM 2166 CG1 VAL A 997 29.195 -10.321 21.104 1.00 23.21 C ATOM 2167 CG2 VAL A 997 31.215 -10.922 19.766 1.00 24.50 C ATOM 2168 H VAL A 997 32.361 -12.879 22.029 1.00 0.00 H ATOM 2169 N ASN A 998 30.151 -10.382 24.318 1.00 20.45 N ATOM 2170 CA ASN A 998 29.249 -10.505 25.468 1.00 21.31 C ATOM 2171 C ASN A 998 28.050 -9.597 25.202 1.00 20.54 C ATOM 2172 O ASN A 998 28.135 -8.382 25.411 1.00 21.90 O ATOM 2173 CB ASN A 998 29.972 -10.159 26.774 1.00 23.42 C ATOM 2174 CG ASN A 998 29.049 -10.036 27.951 1.00 27.78 C ATOM 2175 OD1 ASN A 998 28.023 -10.706 27.959 1.00 31.36 O ATOM 2176 ND2 ASN A 998 29.384 -9.159 28.893 1.00 28.36 N ATOM 2177 HD22 ASN A 998 30.274 -8.627 28.815 1.00 0.00 H ATOM 2178 HD21 ASN A 998 28.756 -9.005 29.707 1.00 0.00 H ATOM 2179 H ASN A 998 30.541 -9.442 24.106 1.00 0.00 H ATOM 2180 N LEU A 999 26.949 -10.177 24.690 1.00 21.76 N ATOM 2181 CA LEU A 999 25.769 -9.318 24.413 1.00 20.52 C ATOM 2182 C LEU A 999 25.221 -8.781 25.737 1.00 20.83 C ATOM 2183 O LEU A 999 25.016 -9.529 26.675 1.00 23.02 O ATOM 2184 CB LEU A 999 24.711 -10.105 23.643 1.00 22.38 C ATOM 2185 CG LEU A 999 25.109 -10.539 22.233 1.00 24.04 C ATOM 2186 CD1 LEU A 999 23.994 -11.324 21.558 1.00 27.37 C ATOM 2187 CD2 LEU A 999 25.495 -9.351 21.367 1.00 25.40 C ATOM 2188 H LEU A 999 26.925 -11.198 24.494 1.00 0.00 H ATOM 2189 N LYS A1000 24.990 -7.464 25.796 1.00 19.89 N ATOM 2190 CA LYS A1000 24.646 -6.805 27.063 1.00 21.38 C ATOM 2191 C LYS A1000 23.269 -6.130 27.035 1.00 21.28 C ATOM 2192 O LYS A1000 22.570 -6.169 28.057 1.00 21.80 O ATOM 2193 CB LYS A1000 25.714 -5.772 27.444 1.00 23.08 C ATOM 2194 CG LYS A1000 27.024 -6.388 27.885 1.00 31.00 C ATOM 2195 CD LYS A1000 27.948 -5.447 28.590 1.00 38.31 C ATOM 2196 CE LYS A1000 27.519 -5.083 29.989 1.00 46.48 C ATOM 2197 NZ LYS A1000 28.727 -4.967 30.848 1.00 48.66 N ATOM 2198 HZ1 LYS A1000 29.231 -5.876 30.860 1.00 0.00 H ATOM 2199 HZ2 LYS A1000 29.352 -4.228 30.468 1.00 0.00 H ATOM 2200 HZ3 LYS A1000 28.440 -4.716 31.816 1.00 0.00 H ATOM 2201 H LYS A1000 25.055 -6.896 24.927 1.00 0.00 H ATOM 2202 N TYR A1001 22.926 -5.453 25.941 1.00 19.75 N ATOM 2203 CA TYR A1001 21.642 -4.756 25.868 1.00 20.88 C ATOM 2204 C TYR A1001 20.989 -5.025 24.517 1.00 21.11 C ATOM 2205 O TYR A1001 21.643 -5.270 23.510 1.00 21.00 O ATOM 2206 CB TYR A1001 21.770 -3.245 26.080 1.00 22.16 C ATOM 2207 CG TYR A1001 22.435 -2.834 27.365 1.00 22.48 C ATOM 2208 CD1 TYR A1001 21.723 -2.741 28.547 1.00 23.40 C ATOM 2209 CD2 TYR A1001 23.785 -2.540 27.402 1.00 23.79 C ATOM 2210 CE1 TYR A1001 22.325 -2.349 29.730 1.00 26.01 C ATOM 2211 CE2 TYR A1001 24.409 -2.155 28.575 1.00 25.45 C ATOM 2212 CZ TYR A1001 23.682 -2.071 29.751 1.00 24.68 C ATOM 2213 OH TYR A1001 24.309 -1.706 30.912 1.00 31.30 O ATOM 2214 HH TYR A1001 23.651 -1.695 31.652 1.00 0.00 H ATOM 2215 H TYR A1001 23.577 -5.419 25.131 1.00 0.00 H ATOM 2216 N LEU A1002 19.658 -4.948 24.530 1.00 22.36 N ATOM 2217 CA LEU A1002 18.841 -5.045 23.347 1.00 22.28 C ATOM 2218 C LEU A1002 17.882 -3.849 23.389 1.00 22.84 C ATOM 2219 O LEU A1002 17.221 -3.652 24.391 1.00 23.97 O ATOM 2220 CB LEU A1002 18.092 -6.383 23.381 1.00 22.20 C ATOM 2221 CG LEU A1002 17.142 -6.654 22.216 1.00 21.60 C ATOM 2222 CD1 LEU A1002 17.895 -6.699 20.904 1.00 23.76 C ATOM 2223 CD2 LEU A1002 16.367 -7.953 22.438 1.00 22.20 C ATOM 2224 H LEU A1002 19.183 -4.810 25.445 1.00 0.00 H ATOM 2225 N LEU A1003 17.878 -3.027 22.331 1.00 23.19 N ATOM 2226 CA LEU A1003 17.015 -1.869 22.256 1.00 22.95 C ATOM 2227 C LEU A1003 15.931 -2.110 21.211 1.00 23.76 C ATOM 2228 O LEU A1003 16.211 -2.606 20.117 1.00 24.45 O ATOM 2229 CB LEU A1003 17.797 -0.635 21.833 1.00 24.85 C ATOM 2230 CG LEU A1003 18.656 0.069 22.869 1.00 28.34 C ATOM 2231 CD1 LEU A1003 19.748 -0.810 23.399 1.00 31.19 C ATOM 2232 CD2 LEU A1003 19.217 1.344 22.272 1.00 29.49 C ATOM 2233 H LEU A1003 18.518 -3.229 21.536 1.00 0.00 H ATOM 2234 N LYS A1004 14.711 -1.703 21.565 1.00 26.15 N ATOM 2235 CA LYS A1004 13.612 -1.563 20.615 1.00 26.58 C ATOM 2236 C LYS A1004 13.564 -0.100 20.170 1.00 27.00 C ATOM 2237 O LYS A1004 13.357 0.812 21.017 1.00 29.92 O ATOM 2238 CB LYS A1004 12.299 -2.013 21.264 1.00 30.62 C ATOM 2239 CG LYS A1004 11.119 -2.087 20.308 1.00 33.62 C ATOM 2240 CD LYS A1004 9.890 -2.817 20.855 1.00 40.25 C ATOM 2241 CE LYS A1004 8.789 -1.952 21.390 1.00 46.30 C ATOM 2242 NZ LYS A1004 7.674 -2.819 21.848 1.00 46.54 N ATOM 2243 HZ1 LYS A1004 7.322 -3.381 21.047 1.00 0.00 H ATOM 2244 HZ2 LYS A1004 8.016 -3.456 22.596 1.00 0.00 H ATOM 2245 HZ3 LYS A1004 6.906 -2.226 22.221 1.00 0.00 H ATOM 2246 H LYS A1004 14.535 -1.475 22.564 1.00 0.00 H ATOM 2247 N LEU A1005 13.757 0.117 18.865 1.00 29.19 N ATOM 2248 CA LEU A1005 13.879 1.458 18.297 1.00 30.68 C ATOM 2249 C LEU A1005 12.702 1.736 17.364 1.00 31.08 C ATOM 2250 O LEU A1005 12.364 0.891 16.523 1.00 32.48 O ATOM 2251 CB LEU A1005 15.135 1.583 17.432 1.00 33.75 C ATOM 2252 CG LEU A1005 16.487 1.384 18.093 1.00 36.25 C ATOM 2253 CD1 LEU A1005 17.564 1.420 17.017 1.00 42.16 C ATOM 2254 CD2 LEU A1005 16.721 2.470 19.123 1.00 41.22 C ATOM 2255 H LEU A1005 13.823 -0.702 18.228 1.00 0.00 H ATOM 2256 N LYS A1006 12.178 2.963 17.449 1.00 33.83 N ATOM 2257 CA LYS A1006 11.277 3.520 16.454 1.00 37.78 C ATOM 2258 C LYS A1006 12.113 4.295 15.428 1.00 34.21 C ATOM 2259 O LYS A1006 12.918 5.156 15.798 1.00 36.22 O ATOM 2260 CB LYS A1006 10.232 4.394 17.155 1.00 41.75 C ATOM 2261 CG LYS A1006 9.288 5.186 16.259 1.00 46.52 C ATOM 2262 CD LYS A1006 8.390 4.346 15.391 1.00 51.96 C ATOM 2263 CE LYS A1006 7.521 5.174 14.454 1.00 58.13 C ATOM 2264 NZ LYS A1006 6.712 6.196 15.162 1.00 60.86 N ATOM 2265 HZ1 LYS A1006 6.083 5.727 15.844 1.00 0.00 H ATOM 2266 HZ2 LYS A1006 7.345 6.850 15.666 1.00 0.00 H ATOM 2267 HZ3 LYS A1006 6.143 6.726 14.471 1.00 0.00 H ATOM 2268 H LYS A1006 12.428 3.550 18.270 1.00 0.00 H ATOM 2269 N PHE A1007 11.921 3.955 14.147 1.00 37.12 N ATOM 2270 CA PHE A1007 12.490 4.656 13.023 1.00 37.50 C ATOM 2271 C PHE A1007 11.433 5.647 12.516 1.00 40.34 C ATOM 2272 O PHE A1007 10.346 5.243 12.116 1.00 42.36 O ATOM 2273 CB PHE A1007 12.889 3.684 11.908 1.00 37.05 C ATOM 2274 CG PHE A1007 14.063 2.790 12.201 1.00 34.00 C ATOM 2275 CD1 PHE A1007 13.976 1.806 13.169 1.00 32.57 C ATOM 2276 CD2 PHE A1007 15.242 2.903 11.475 1.00 34.41 C ATOM 2277 CE1 PHE A1007 15.060 0.980 13.429 1.00 32.17 C ATOM 2278 CE2 PHE A1007 16.323 2.072 11.735 1.00 32.59 C ATOM 2279 CZ PHE A1007 16.225 1.107 12.703 1.00 30.24 C ATOM 2280 H PHE A1007 11.321 3.129 13.950 1.00 0.00 H ATOM 2281 N ASN A1008 11.737 6.944 12.603 1.00 42.91 N ATOM 2282 CA ASN A1008 10.848 8.002 12.091 1.00 44.87 C ATOM 2283 C ASN A1008 11.392 8.444 10.733 1.00 46.29 C ATOM 2284 O ASN A1008 12.384 9.154 10.673 1.00 47.70 O ATOM 2285 CB ASN A1008 10.743 9.169 13.074 1.00 49.87 C ATOM 2286 CG ASN A1008 10.117 8.767 14.394 1.00 55.94 C ATOM 2287 OD1 ASN A1008 9.045 8.164 14.414 1.00 56.53 O ATOM 2288 ND2 ASN A1008 10.781 9.077 15.498 1.00 59.04 N ATOM 2289 HD22 ASN A1008 11.685 9.588 15.435 1.00 0.00 H ATOM 2290 HD21 ASN A1008 10.398 8.809 16.427 1.00 0.00 H ATOM 2291 H ASN A1008 12.636 7.218 13.049 1.00 0.00 H ATOM 2292 N PHE A1009 10.761 7.945 9.666 1.00 49.87 N ATOM 2293 CA PHE A1009 11.216 8.164 8.288 1.00 49.18 C ATOM 2294 C PHE A1009 10.806 9.562 7.819 1.00 55.73 C ATOM 2295 O PHE A1009 9.708 10.017 8.116 1.00 60.90 O ATOM 2296 CB PHE A1009 10.687 7.059 7.368 1.00 49.99 C ATOM 2297 CG PHE A1009 11.404 5.755 7.587 1.00 46.84 C ATOM 2298 CD1 PHE A1009 12.666 5.546 7.051 1.00 48.41 C ATOM 2299 CD2 PHE A1009 10.859 4.768 8.395 1.00 51.30 C ATOM 2300 CE1 PHE A1009 13.357 4.368 7.294 1.00 48.02 C ATOM 2301 CE2 PHE A1009 11.547 3.588 8.623 1.00 50.11 C ATOM 2302 CZ PHE A1009 12.794 3.389 8.074 1.00 48.09 C ATOM 2303 H PHE A1009 9.906 7.374 9.820 1.00 0.00 H ATOM 2304 N LYS A1010 11.712 10.208 7.078 1.00 58.77 N ATOM 2305 CA LYS A1010 11.539 11.581 6.575 1.00 63.14 C ATOM 2306 C LYS A1010 11.348 11.544 5.056 1.00 67.07 C ATOM 2307 O LYS A1010 10.270 11.210 4.579 1.00 72.22 O ATOM 2308 CB LYS A1010 12.746 12.446 6.960 1.00 70.49 C ATOM 2309 CG LYS A1010 12.759 12.923 8.408 1.00 74.34 C ATOM 2310 CD LYS A1010 14.050 13.603 8.822 1.00 73.45 C ATOM 2311 CE LYS A1010 15.143 12.617 9.178 1.00 73.34 C ATOM 2312 NZ LYS A1010 16.471 13.271 9.267 1.00 72.38 N ATOM 2313 HZ1 LYS A1010 16.706 13.701 8.350 1.00 0.00 H ATOM 2314 HZ2 LYS A1010 16.445 14.008 10.001 1.00 0.00 H ATOM 2315 HZ3 LYS A1010 17.190 12.561 9.513 1.00 0.00 H ATOM 2316 H LYS A1010 12.594 9.710 6.842 1.00 0.00 H TER 2317 LYS A1010 HETATM 2318 O HOH 1 27.083 -13.261 23.536 1.00 53.55 O HETATM 2319 O HOH 2 41.840 3.580 16.078 1.00 46.65 O HETATM 2320 O HOH 3 29.138 15.603 14.725 1.00 69.23 O HETATM 2321 O HOH 4 37.823 -12.032 -1.376 1.00 42.46 O HETATM 2322 O HOH 5 30.938 -7.236 -0.446 1.00 52.78 O HETATM 2323 O HOH 6 10.837 0.623 28.714 1.00 50.14 O HETATM 2324 O HOH 7 36.206 4.021 20.187 1.00 52.39 O HETATM 2325 O HOH 8 49.397 -14.745 12.116 1.00 47.14 O HETATM 2326 O HOH 9 10.998 -4.989 12.506 1.00 56.84 O HETATM 2327 O HOH 10 25.808 -13.235 5.984 1.00 44.43 O HETATM 2328 O HOH 11 33.517 -5.205 32.078 1.00 82.26 O HETATM 2329 O HOH 12 26.682 -2.428 31.786 1.00 41.31 O HETATM 2330 O HOH 13 32.292 -6.797 31.422 1.00 56.32 O HETATM 2331 O HOH 14 37.915 0.451 24.228 1.00 44.99 O HETATM 2332 O HOH 15 30.272 -1.956 6.375 1.00 45.82 O HETATM 2333 O HOH 16 38.943 -12.772 6.746 1.00 46.54 O HETATM 2334 O HOH 17 28.037 -0.805 6.379 1.00 45.11 O HETATM 2335 O HOH 18 6.189 4.828 9.465 1.00 63.87 O HETATM 2336 O HOH 19 28.094 -21.616 31.829 1.00 68.11 O HETATM 2337 O HOH 20 26.373 -12.459 2.838 1.00 83.86 O HETATM 2338 O HOH 21 23.894 12.100 16.198 1.00 54.75 O HETATM 2339 O HOH 22 25.650 -10.015 29.483 1.00 31.28 O HETATM 2340 O HOH 23 25.891 -16.135 31.674 1.00 48.89 O HETATM 2341 O HOH 24 46.317 2.466 12.599 1.00 28.49 O HETATM 2342 O HOH 25 38.947 15.303 20.406 1.00 63.85 O HETATM 2343 O HOH 26 33.454 1.559 34.671 1.00 47.45 O HETATM 2344 O HOH 27 29.797 9.958 16.901 1.00 60.95 O HETATM 2345 O HOH 28 32.464 10.290 7.232 1.00 35.00 O HETATM 2346 O HOH 29 38.541 5.983 15.551 1.00 38.72 O HETATM 2347 O HOH 30 21.928 -22.622 26.446 1.00 50.78 O HETATM 2348 O HOH 31 11.940 -11.212 31.649 1.00 41.26 O HETATM 2349 O HOH 32 7.624 -8.992 14.219 1.00 48.73 O HETATM 2350 O HOH 33 27.193 3.392 7.114 1.00 42.60 O HETATM 2351 O HOH 34 7.440 -2.473 12.843 1.00 63.59 O HETATM 2352 O HOH 35 24.047 -7.249 30.452 1.00 47.43 O HETATM 2353 O HOH 36 22.996 -16.192 15.214 1.00 43.28 O HETATM 2354 O HOH 37 26.206 7.112 4.057 1.00 45.71 O HETATM 2355 O HOH 38 31.056 12.057 27.263 1.00 48.32 O HETATM 2356 O HOH 39 15.110 -15.294 32.819 1.00 29.08 O HETATM 2357 O HOH 40 15.855 -22.722 22.008 1.00 49.15 O HETATM 2358 O HOH 41 40.677 -12.329 29.900 1.00 62.26 O HETATM 2359 O HOH 42 27.634 -4.713 4.284 1.00 38.91 O HETATM 2360 O HOH 43 5.299 -2.619 26.284 1.00 49.07 O HETATM 2361 O HOH 44 20.599 12.704 17.141 1.00 50.36 O HETATM 2362 O HOH 45 39.064 -12.206 16.607 1.00 24.23 O HETATM 2363 O HOH 46 32.554 -19.265 7.441 1.00 42.70 O HETATM 2364 O HOH 47 14.828 -11.276 34.142 1.00 43.56 O HETATM 2365 O HOH 48 14.930 -16.949 27.978 1.00 27.37 O HETATM 2366 O HOH 49 30.752 3.014 13.220 1.00 23.15 O HETATM 2367 O HOH 50 15.185 5.220 27.758 1.00 55.15 O HETATM 2368 O HOH 51 35.306 -19.945 20.486 1.00 52.08 O HETATM 2369 O HOH 52 7.158 -25.684 20.205 1.00 62.72 O HETATM 2370 O HOH 53 18.084 9.868 15.424 1.00 52.75 O HETATM 2371 O HOH 54 19.468 -9.668 32.169 1.00 31.19 O HETATM 2372 O HOH 55 14.867 -18.594 30.182 1.00 39.63 O HETATM 2373 O HOH 56 6.907 -1.379 24.119 1.00 57.21 O HETATM 2374 O HOH 57 28.893 -2.345 30.160 1.00 39.20 O HETATM 2375 O HOH 58 8.931 -4.091 23.893 1.00 35.85 O HETATM 2376 O HOH 59 36.719 -17.462 12.439 1.00 46.61 O HETATM 2377 O HOH 60 36.422 3.296 22.743 1.00 69.46 O HETATM 2378 O HOH 61 44.325 4.760 18.324 1.00 55.54 O HETATM 2379 O HOH 62 13.591 -5.991 10.589 1.00 35.16 O HETATM 2380 O HOH 63 32.712 5.829 13.048 1.00 24.49 O HETATM 2381 O HOH 64 32.092 -4.460 5.724 1.00 29.93 O HETATM 2382 O HOH 65 23.094 -10.104 12.172 1.00 33.38 O HETATM 2383 O HOH 66 45.557 -7.473 27.861 1.00 48.52 O HETATM 2384 O HOH 67 33.449 8.947 22.096 1.00 32.73 O HETATM 2385 O HOH 68 26.973 4.864 4.924 1.00 48.54 O HETATM 2386 O HOH 69 50.608 -7.429 17.417 1.00 44.93 O HETATM 2387 O HOH 70 18.390 -20.920 29.427 1.00 59.78 O HETATM 2388 O HOH 71 35.356 -19.508 25.611 1.00 45.10 O HETATM 2389 O HOH 72 21.240 -18.055 24.835 1.00 30.68 O HETATM 2390 O HOH 73 24.734 -12.314 26.997 1.00 26.32 O HETATM 2391 O HOH 74 20.871 10.774 27.933 1.00 44.73 O HETATM 2392 O HOH 75 7.178 0.643 3.870 1.00 68.05 O HETATM 2393 O HOH 76 27.480 -17.401 19.265 1.00 33.30 O HETATM 2394 O HOH 77 40.543 16.192 10.013 1.00 51.59 O HETATM 2395 O HOH 78 30.051 11.234 6.779 1.00 42.69 O HETATM 2396 O HOH 79 32.890 -13.628 31.931 1.00 35.67 O HETATM 2397 O HOH 80 41.189 -3.637 -1.319 1.00 28.94 O HETATM 2398 O HOH 81 29.771 -13.346 9.180 1.00 33.27 O HETATM 2399 O HOH 82 4.944 -6.481 19.983 1.00 41.71 O HETATM 2400 O HOH 83 36.893 13.596 7.648 1.00 48.35 O HETATM 2401 O HOH 84 43.598 -15.495 13.233 1.00 49.96 O HETATM 2402 O HOH 85 13.192 -13.482 15.369 1.00 35.19 O HETATM 2403 O HOH 86 10.275 -23.219 25.666 1.00 42.33 O HETATM 2404 O HOH 87 23.060 -7.814 10.280 1.00 30.93 O HETATM 2405 O HOH 88 34.254 13.743 8.746 1.00 48.96 O HETATM 2406 O HOH 89 18.719 11.668 11.001 1.00 49.19 O HETATM 2407 O HOH 90 47.761 5.231 3.761 1.00 38.28 O HETATM 2408 O HOH 91 36.523 5.080 28.316 1.00 56.41 O HETATM 2409 O HOH 92 38.692 6.412 12.145 1.00 26.87 O HETATM 2410 O HOH 93 46.345 11.206 8.457 1.00 39.33 O HETATM 2411 O HOH 94 41.057 9.441 14.582 1.00 36.93 O HETATM 2412 O HOH 95 29.236 -14.053 19.494 1.00 31.43 O HETATM 2413 O HOH 96 1.220 -11.535 35.111 1.00 40.85 O HETATM 2414 O HOH 97 21.154 -7.294 8.342 1.00 37.21 O HETATM 2415 O HOH 98 32.005 -21.261 -0.224 1.00 42.00 O HETATM 2416 O HOH 99 15.308 -5.136 13.576 1.00 26.90 O HETATM 2417 O HOH 100 37.956 -1.085 0.086 1.00 29.96 O HETATM 2418 O HOH 101 -0.102 -11.111 31.497 1.00 48.09 O HETATM 2419 O HOH 102 12.405 -6.585 33.917 1.00 36.33 O HETATM 2420 O HOH 103 29.186 -25.182 6.060 1.00 40.61 O HETATM 2421 O HOH 104 9.391 -23.694 28.379 1.00 55.31 O HETATM 2422 O HOH 105 13.440 0.667 29.007 1.00 36.31 O HETATM 2423 O HOH 106 21.738 -7.045 5.559 1.00 46.39 O HETATM 2424 O HOH 107 27.190 11.904 14.955 1.00 41.34 O HETATM 2425 O HOH 108 21.271 -16.169 31.828 1.00 35.40 O HETATM 2426 O HOH 109 45.905 1.739 9.861 1.00 30.68 O HETATM 2427 O HOH 110 29.965 2.152 35.559 1.00 53.74 O HETATM 2428 O HOH 111 41.572 -1.467 28.243 1.00 51.16 O HETATM 2429 O HOH 112 14.122 11.083 17.192 1.00 64.25 O HETATM 2430 O HOH 113 19.572 -9.240 8.690 1.00 42.05 O HETATM 2431 O HOH 114 25.129 1.101 7.302 1.00 31.34 O HETATM 2432 O HOH 115 15.739 -16.216 14.200 1.00 34.28 O HETATM 2433 O HOH 116 16.848 0.099 8.887 1.00 40.82 O HETATM 2434 O HOH 117 31.104 -15.002 24.839 1.00 34.11 O HETATM 2435 O HOH 118 17.236 -0.603 35.652 1.00 46.70 O HETATM 2436 O HOH 119 35.478 17.439 12.781 1.00 46.69 O HETATM 2437 O HOH 120 25.683 -14.728 10.848 1.00 55.33 O HETATM 2438 O HOH 121 28.804 11.683 28.962 1.00 50.90 O HETATM 2439 O HOH 122 28.303 11.844 10.886 1.00 39.17 O HETATM 2440 O HOH 123 18.309 0.350 5.733 1.00 58.05 O HETATM 2441 O HOH 124 21.193 4.677 38.170 1.00 53.47 O HETATM 2442 O HOH 125 38.636 -1.557 28.048 1.00 46.12 O HETATM 2443 O HOH 126 11.386 2.727 33.875 1.00 60.87 O HETATM 2444 O HOH 127 33.711 -8.519 0.475 1.00 44.37 O HETATM 2445 O HOH 128 3.847 -2.235 22.612 1.00 56.45 O HETATM 2446 O HOH 129 28.079 -19.074 32.125 1.00 46.15 O HETATM 2447 O HOH 130 18.255 9.041 22.352 1.00 38.75 O HETATM 2448 O HOH 131 43.784 -3.329 3.624 1.00 34.86 O HETATM 2449 O HOH 132 35.633 -14.833 4.663 1.00 38.46 O HETATM 2450 O HOH 133 15.467 8.124 22.272 1.00 52.04 O HETATM 2451 O HOH 134 22.051 1.941 35.653 1.00 48.15 O HETATM 2452 O HOH 135 41.703 -10.281 0.424 1.00 28.18 O HETATM 2453 O HOH 136 28.346 -12.382 30.634 1.00 50.28 O HETATM 2454 O HOH 137 1.460 -8.149 25.817 1.00 54.53 O HETATM 2455 O HOH 138 24.471 -14.431 13.861 1.00 37.46 O HETATM 2456 O HOH 139 30.612 14.578 22.236 1.00 51.23 O HETATM 2457 O HOH 140 33.639 7.245 32.694 1.00 50.44 O HETATM 2458 O HOH 141 44.886 -1.628 19.295 1.00 29.99 O HETATM 2459 O HOH 142 30.045 -19.002 14.259 1.00 34.60 O HETATM 2460 O HOH 143 26.852 -13.346 20.834 1.00 31.66 O HETATM 2461 O HOH 144 2.656 -17.153 28.611 1.00 40.52 O HETATM 2462 O HOH 145 48.598 -14.127 18.588 1.00 56.65 O HETATM 2463 O HOH 146 34.007 0.427 2.289 1.00 46.75 O HETATM 2464 O HOH 147 21.313 12.324 10.169 1.00 47.62 O HETATM 2465 O HOH 148 23.588 -12.535 12.497 1.00 59.03 O HETATM 2466 O HOH 149 12.545 -9.139 9.940 1.00 46.77 O HETATM 2467 O HOH 150 35.837 7.174 19.958 1.00 50.10 O HETATM 2468 O HOH 151 22.679 -20.160 25.368 1.00 43.48 O HETATM 2469 O HOH 152 32.843 15.977 22.332 1.00 60.11 O HETATM 2470 O HOH 153 44.605 -0.841 4.819 1.00 31.86 O HETATM 2471 O HOH 154 0.694 -16.437 26.129 1.00 54.84 O HETATM 2472 O HOH 155 19.553 7.283 5.463 1.00 53.95 O HETATM 2473 O HOH 156 19.700 -15.946 13.704 1.00 56.56 O HETATM 2474 O HOH 157 10.146 -11.985 13.625 1.00 58.62 O HETATM 2475 O HOH 158 26.826 -18.763 25.733 1.00 48.88 O HETATM 2476 O HOH 159 -0.066 -13.008 28.250 1.00 62.82 O HETATM 2477 O HOH 160 45.949 9.170 6.810 1.00 31.08 O HETATM 2478 O HOH 161 30.108 12.757 9.027 1.00 55.98 O HETATM 2479 O HOH 162 25.951 -18.919 11.024 1.00 60.61 O HETATM 2480 O HOH 163 12.650 4.279 35.675 1.00 50.80 O HETATM 2481 O HOH 164 39.014 12.283 8.136 1.00 37.05 O HETATM 2482 O HOH 165 36.744 -18.948 15.799 1.00 65.64 O HETATM 2483 O HOH 166 42.242 5.710 15.474 1.00 45.03 O HETATM 2484 O HOH 167 34.334 -18.729 16.666 1.00 34.99 O HETATM 2485 O HOH 168 17.901 9.817 19.668 1.00 44.31 O HETATM 2486 O HOH 169 40.627 -5.230 30.923 1.00 59.13 O HETATM 2487 O HOH 170 16.297 1.115 6.488 1.00 64.06 O HETATM 2488 O HOH 171 47.555 12.381 4.513 1.00 47.46 O HETATM 2489 O HOH 172 35.568 5.276 18.832 1.00 37.14 O HETATM 2490 O HOH 173 47.461 13.059 6.563 1.00 80.51 O HETATM 2491 O HOH 174 43.386 -6.410 -0.691 1.00 54.09 O HETATM 2492 O HOH 175 35.261 6.989 2.494 1.00 59.05 O HETATM 2493 O HOH 176 25.606 14.416 16.913 1.00 66.13 O HETATM 2494 O HOH 177 41.558 -13.536 19.352 1.00 49.86 O HETATM 2495 O HOH 178 24.301 14.382 4.323 1.00 61.30 O HETATM 2496 O HOH 179 12.856 -23.724 25.900 1.00 52.41 O HETATM 2497 O HOH 180 2.841 -5.640 20.944 1.00 68.63 O HETATM 2498 O HOH 181 30.689 -11.699 31.478 1.00 42.66 O HETATM 2499 O HOH 182 42.706 -13.365 25.323 1.00 53.89 O HETATM 2500 O HOH 183 20.801 11.947 25.547 1.00 49.73 O HETATM 2501 O HOH 184 39.638 7.251 14.810 1.00 35.52 O HETATM 2502 O HOH 185 32.637 15.963 11.007 1.00 63.29 O HETATM 2503 O HOH 186 8.395 -6.115 13.834 1.00 59.32 O HETATM 2504 O HOH 187 35.242 7.267 0.519 1.00 64.37 O HETATM 2505 O HOH 188 23.807 -16.874 11.376 1.00 67.05 O HETATM 2506 O HOH 189 11.165 -16.952 15.203 1.00 57.91 O HETATM 2507 O HOH 190 40.853 -14.187 10.481 1.00 58.59 O HETATM 2508 O HOH 191 23.325 -6.019 3.782 1.00 67.51 O HETATM 2509 O HOH 192 19.233 12.322 13.912 1.00 62.31 O HETATM 2510 O HOH 193 31.103 -11.664 33.355 1.00 76.60 O HETATM 2511 O HOH 194 41.377 -15.214 13.271 1.00 56.90 O HETATM 2512 O HOH 195 40.500 -14.608 16.031 1.00 48.57 O HETATM 2513 O HOH 196 9.259 0.440 30.758 1.00 55.12 O HETATM 2514 O HOH 197 4.516 -1.338 28.333 1.00 69.72 O HETATM 2515 O HOH 198 39.865 -15.519 10.626 1.00 50.68 O HETATM 2516 O HOH 199 34.178 -13.854 34.009 1.00 66.48 O HETATM 2517 O HOH 200 21.591 -9.051 33.643 1.00 48.54 O HETATM 2518 O HOH 201 40.932 6.838 14.060 1.00 38.30 O HETATM 2519 O HOH 202 6.173 -21.484 30.963 1.00 71.00 O HETATM 2520 O HOH 203 27.319 8.676 1.603 1.00 60.66 O HETATM 2521 O HOH 204 25.591 -6.058 3.027 1.00 58.41 O HETATM 2522 O HOH 205 43.501 -8.375 -1.157 1.00 51.88 O HETATM 2523 O HOH 206 33.449 12.082 5.091 1.00 52.54 O HETATM 2524 O HOH 207 5.959 1.345 24.570 1.00 57.77 O HETATM 2525 O HOH 208 9.598 -25.085 23.823 1.00 60.57 O HETATM 2526 O HOH 209 14.186 -10.045 36.345 1.00 52.80 O HETATM 2527 O HOH 210 30.028 12.325 4.197 1.00 52.56 O HETATM 2528 O HOH 211 32.613 -19.801 14.779 1.00 43.14 O HETATM 2529 O2 KYP A 212 23.073 -10.629 4.723 1.00 -0.39 O HETATM 2530 C13 KYP A 212 23.516 -10.637 5.838 1.00 0.20 C HETATM 2531 N1 KYP A 212 23.115 -11.557 6.745 1.00 -0.27 N HETATM 2532 C21 KYP A 212 22.162 -12.607 6.349 1.00 0.05 C HETATM 2533 C20 KYP A 212 21.008 -12.667 7.320 1.00 0.05 C HETATM 2534 N2 KYP A 212 21.521 -12.877 8.676 1.00 -0.27 N HETATM 2535 C16 KYP A 212 21.127 -13.891 9.486 1.00 0.20 C HETATM 2536 N4 KYP A 212 20.289 -14.804 8.951 1.00 -0.25 N HETATM 2537 C19 KYP A 212 19.958 -15.821 9.759 1.00 0.01 C HETATM 2538 C18 KYP A 212 20.424 -15.950 11.047 1.00 -0.02 C HETATM 2539 C17 KYP A 212 21.258 -14.945 11.496 1.00 0.01 C HETATM 2540 N3 KYP A 212 21.629 -13.898 10.742 1.00 -0.25 N HETATM 2541 H7 KYP A 212 21.633 -15.005 12.511 1.00 0.09 H HETATM 2542 H6 KYP A 212 20.152 -16.792 11.673 1.00 0.07 H HETATM 2543 H5 KYP A 212 19.287 -16.582 9.377 1.00 0.09 H HETATM 2544 C15 KYP A 212 22.435 -11.807 9.085 1.00 0.05 C HETATM 2545 C14 KYP A 212 23.592 -11.715 8.128 1.00 0.05 C HETATM 2546 H10 KYP A 212 24.214 -10.848 8.396 1.00 0.05 H HETATM 2547 H11 KYP A 212 24.193 -12.633 8.200 1.00 0.05 H HETATM 2548 H8 KYP A 212 22.815 -12.021 10.095 1.00 0.05 H HETATM 2549 H9 KYP A 212 21.893 -10.850 9.092 1.00 0.05 H HETATM 2550 H3 KYP A 212 20.342 -13.499 7.047 1.00 0.05 H HETATM 2551 H4 KYP A 212 20.448 -11.721 7.282 1.00 0.05 H HETATM 2552 H1 KYP A 212 22.677 -13.579 6.339 1.00 0.05 H HETATM 2553 H2 KYP A 212 21.777 -12.386 5.343 1.00 0.05 H HETATM 2554 C12 KYP A 212 24.561 -9.624 6.202 1.00 0.04 C HETATM 2555 C11 KYP A 212 24.380 -8.719 7.244 1.00 -0.05 C HETATM 2556 C10 KYP A 212 25.374 -7.814 7.577 1.00 -0.05 C HETATM 2557 C9 KYP A 212 26.594 -7.799 6.894 1.00 -0.03 C HETATM 2558 C23 KYP A 212 26.760 -8.696 5.847 1.00 -0.05 C HETATM 2559 C22 KYP A 212 25.763 -9.593 5.502 1.00 -0.05 C HETATM 2560 H14 KYP A 212 25.921 -10.279 4.677 1.00 0.07 H HETATM 2561 H15 KYP A 212 27.689 -8.694 5.288 1.00 0.06 H HETATM 2562 C8 KYP A 212 27.746 -6.995 7.274 1.00 0.03 C HETATM 2563 C7 KYP A 212 27.850 -5.932 8.077 1.00 0.17 C HETATM 2564 C6 KYP A 212 28.881 -4.906 7.998 1.00 0.16 C HETATM 2565 O1 KYP A 212 29.721 -4.740 7.053 1.00 -0.38 O HETATM 2566 C5 KYP A 212 28.684 -4.108 9.199 1.00 0.07 C HETATM 2567 C24 KYP A 212 27.576 -4.628 9.870 1.00 0.14 C HETATM 2568 O3 KYP A 212 27.082 -5.734 9.216 1.00 -0.28 O HETATM 2569 C1 KYP A 212 27.156 -4.091 11.084 1.00 0.09 C HETATM 2570 C KYP A 212 25.917 -4.518 11.822 1.00 0.20 C HETATM 2571 O KYP A 212 25.471 -3.820 12.775 1.00 -0.39 O HETATM 2572 N KYP A 212 25.271 -5.620 11.388 1.00 -0.30 N HETATM 2573 H19 KYP A 212 24.444 -5.932 11.856 1.00 0.18 H HETATM 2574 H20 KYP A 212 25.619 -6.125 10.598 1.00 0.18 H HETATM 2575 C2 KYP A 212 27.916 -3.052 11.630 1.00 -0.05 C HETATM 2576 C3 KYP A 212 29.041 -2.562 10.978 1.00 -0.06 C HETATM 2577 C4 KYP A 212 29.433 -3.075 9.758 1.00 -0.05 C HETATM 2578 H21 KYP A 212 30.304 -2.683 9.246 1.00 0.07 H HETATM 2579 H22 KYP A 212 29.619 -1.766 11.434 1.00 0.06 H HETATM 2580 H23 KYP A 212 27.622 -2.621 12.580 1.00 0.07 H HETATM 2581 H18 KYP A 212 27.157 -5.371 7.433 1.00 0.09 H HETATM 2582 H16 KYP A 212 28.146 -6.638 6.313 1.00 0.05 H HETATM 2583 H17 KYP A 212 28.442 -7.725 7.713 1.00 0.05 H HETATM 2584 H13 KYP A 212 25.203 -7.106 8.380 1.00 0.06 H HETATM 2585 H12 KYP A 212 23.450 -8.723 7.801 1.00 0.07 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 2529 2530 CONECT 2530 2529 2531 2554 CONECT 2531 2530 2532 2545 CONECT 2532 2531 2533 2552 2553 CONECT 2533 2532 2534 2550 2551 CONECT 2534 2533 2535 2544 CONECT 2535 2534 2536 2540 CONECT 2536 2535 2537 CONECT 2537 2536 2538 2543 CONECT 2538 2537 2539 2542 CONECT 2539 2538 2540 2541 CONECT 2540 2535 2539 CONECT 2541 2539 CONECT 2542 2538 CONECT 2543 2537 CONECT 2544 2534 2545 2548 2549 CONECT 2545 2531 2544 2546 2547 CONECT 2546 2545 CONECT 2547 2545 CONECT 2548 2544 CONECT 2549 2544 CONECT 2550 2533 CONECT 2551 2533 CONECT 2552 2532 CONECT 2553 2532 CONECT 2554 2530 2555 2559 CONECT 2555 2554 2556 2585 CONECT 2556 2555 2557 2584 CONECT 2557 2556 2558 2562 CONECT 2558 2557 2559 2561 CONECT 2559 2554 2558 2560 CONECT 2560 2559 CONECT 2561 2558 CONECT 2562 2557 2563 2582 2583 CONECT 2563 2562 2564 2568 2581 CONECT 2564 2563 2565 2566 CONECT 2565 2564 CONECT 2566 2564 2567 2577 CONECT 2567 2566 2568 2569 CONECT 2568 2563 2567 CONECT 2569 2567 2570 2575 CONECT 2570 2569 2571 2572 CONECT 2571 2570 CONECT 2572 2570 2573 2574 CONECT 2573 2572 CONECT 2574 2572 CONECT 2575 2569 2576 2580 CONECT 2576 2575 2577 2579 CONECT 2577 2566 2576 2578 CONECT 2578 2577 CONECT 2579 2576 CONECT 2580 2575 CONECT 2581 2563 CONECT 2582 2562 CONECT 2583 2562 CONECT 2584 2556 CONECT 2585 2555 MASTER 0 0 0 0 0 0 0 0 2583 2 65 20 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 6nrh
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%
6nrg
RCSB PDB
PDBbind
271aa, >6NRG_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
6nrh
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human PARP-1 ART domain
Ligand Name
KYP
EC.Number
E.C.2.4.2.30
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
IC50=55nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 5330-5357
Ligand Properties
Formula
C
2
5
H
2
3
N
5
O
4
Molecular Weight
457.481
Exact Mass
457.175
No. of atoms
57
No. of bonds
61
Polar Surface Area
118.72
LOGP Value
2.01 (
Computed with XLOGP3
)
2.43 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
Canonical SMILES
O=C(c1ccc(cc1)C[C@H]1Oc2c(C1=O)cccc2C(=O)N)N1CCN(CC1)c1ncccn1
InChI String
InChI=1S/C25H23N5O4/c26-23(32)19-4-1-3-18-21(31)20(34-22(18)19)15-16-5-7-17(8-6-16)24(33)29-11-13-30(14-12-29)25-27-9-2-10-28-25/h1-10,20H,11-15H2,(H2,26,32)/t20-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P09874
Entrez Gene ID
NCBI Entrez Gene ID:
142
ASD
Information of known allosteric effects of PDB entries
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