Browse entries in the PDBbind-CN Database
HEADER 6NRF_COMPLEX COMPND 6NRF_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 KYV A 347 60 ATOM 1 N LYS A 764 -1.583 -17.524 31.247 1.00 67.75 N ATOM 2 CA LYS A 764 -1.151 -16.129 30.899 1.00 65.06 C ATOM 3 C LYS A 764 0.250 -15.838 31.451 1.00 59.88 C ATOM 4 O LYS A 764 0.651 -16.442 32.456 1.00 63.10 O ATOM 5 CB LYS A 764 -2.120 -15.102 31.483 1.00 68.71 C ATOM 6 CG LYS A 764 -2.182 -15.068 33.005 1.00 72.01 C ATOM 7 CD LYS A 764 -3.196 -14.078 33.521 1.00 76.09 C ATOM 8 CE LYS A 764 -2.883 -12.653 33.106 1.00 76.68 C ATOM 9 NZ LYS A 764 -3.980 -11.733 33.484 1.00 79.94 N ATOM 10 HZ1 LYS A 764 -4.858 -12.031 33.014 1.00 0.00 H ATOM 11 HZ2 LYS A 764 -4.112 -11.758 34.515 1.00 0.00 H ATOM 12 HZ3 LYS A 764 -3.738 -10.766 33.187 1.00 0.00 H ATOM 13 HN3 LYS A 764 -1.601 -17.632 32.281 1.00 0.00 H ATOM 14 HN2 LYS A 764 -0.913 -18.206 30.837 1.00 0.00 H ATOM 15 HN1 LYS A 764 -2.534 -17.697 30.863 1.00 0.00 H ATOM 16 N SER A 765 0.935 -14.867 30.860 1.00 53.98 N ATOM 17 CA SER A 765 2.362 -14.579 31.120 1.00 49.78 C ATOM 18 C SER A 765 2.561 -13.891 32.477 1.00 47.78 C ATOM 19 O SER A 765 1.754 -13.020 32.807 1.00 45.89 O ATOM 20 CB SER A 765 2.909 -13.743 30.021 1.00 47.89 C ATOM 21 OG SER A 765 4.232 -13.372 30.321 1.00 47.26 O ATOM 22 HG SER A 765 4.787 -14.186 30.422 1.00 0.00 H ATOM 23 H SER A 765 0.436 -14.270 30.170 1.00 0.00 H ATOM 24 N LYS A 766 3.654 -14.226 33.171 1.00 45.35 N ATOM 25 CA LYS A 766 4.109 -13.571 34.427 1.00 45.68 C ATOM 26 C LYS A 766 5.324 -12.686 34.138 1.00 42.96 C ATOM 27 O LYS A 766 5.951 -12.208 35.083 1.00 42.16 O ATOM 28 CB LYS A 766 4.389 -14.624 35.505 1.00 48.23 C ATOM 29 CG LYS A 766 3.141 -15.305 36.051 1.00 50.46 C ATOM 30 CD LYS A 766 3.393 -16.103 37.311 1.00 53.79 C ATOM 31 CE LYS A 766 2.593 -17.384 37.366 1.00 55.92 C ATOM 32 NZ LYS A 766 1.171 -17.105 37.647 1.00 58.62 N ATOM 33 HZ1 LYS A 766 1.089 -16.619 38.563 1.00 0.00 H ATOM 34 HZ2 LYS A 766 0.783 -16.500 36.896 1.00 0.00 H ATOM 35 HZ3 LYS A 766 0.643 -18.000 37.680 1.00 0.00 H ATOM 36 H LYS A 766 4.233 -15.008 32.803 1.00 0.00 H ATOM 37 N LEU A 767 5.632 -12.449 32.864 1.00 42.30 N ATOM 38 CA LEU A 767 6.704 -11.523 32.459 1.00 41.04 C ATOM 39 C LEU A 767 6.125 -10.118 32.494 1.00 40.96 C ATOM 40 O LEU A 767 4.922 -9.939 32.319 1.00 38.08 O ATOM 41 CB LEU A 767 7.214 -11.872 31.057 1.00 41.50 C ATOM 42 CG LEU A 767 7.964 -13.194 30.934 1.00 42.62 C ATOM 43 CD1 LEU A 767 8.052 -13.615 29.483 1.00 42.03 C ATOM 44 CD2 LEU A 767 9.352 -13.092 31.552 1.00 42.56 C ATOM 45 H LEU A 767 5.092 -12.939 32.123 1.00 0.00 H ATOM 46 N PRO A 768 6.976 -9.099 32.744 1.00 41.64 N ATOM 47 CA PRO A 768 6.589 -7.705 32.557 1.00 42.36 C ATOM 48 C PRO A 768 6.132 -7.457 31.111 1.00 42.24 C ATOM 49 O PRO A 768 6.638 -8.088 30.180 1.00 39.00 O ATOM 50 CB PRO A 768 7.861 -6.916 32.890 1.00 42.96 C ATOM 51 CG PRO A 768 8.663 -7.851 33.782 1.00 43.64 C ATOM 52 CD PRO A 768 8.341 -9.239 33.270 1.00 42.29 C ATOM 53 N LYS A 769 5.184 -6.534 30.969 1.00 43.73 N ATOM 54 CA LYS A 769 4.477 -6.230 29.697 1.00 44.61 C ATOM 55 C LYS A 769 5.506 -5.928 28.607 1.00 40.55 C ATOM 56 O LYS A 769 5.440 -6.491 27.521 1.00 38.17 O ATOM 57 CB LYS A 769 3.451 -5.123 29.967 1.00 48.14 C ATOM 58 CG LYS A 769 2.751 -4.570 28.741 1.00 52.18 C ATOM 59 CD LYS A 769 1.868 -5.583 28.054 1.00 56.03 C ATOM 60 CE LYS A 769 0.787 -4.903 27.235 1.00 60.84 C ATOM 61 NZ LYS A 769 1.351 -3.809 26.397 1.00 61.01 N ATOM 62 HZ1 LYS A 769 1.798 -3.099 27.011 1.00 0.00 H ATOM 63 HZ2 LYS A 769 2.061 -4.203 25.747 1.00 0.00 H ATOM 64 HZ3 LYS A 769 0.587 -3.364 25.849 1.00 0.00 H ATOM 65 H LYS A 769 4.918 -5.984 31.811 1.00 0.00 H ATOM 66 N PRO A 770 6.526 -5.073 28.847 1.00 39.24 N ATOM 67 CA PRO A 770 7.496 -4.769 27.801 1.00 38.38 C ATOM 68 C PRO A 770 8.254 -5.998 27.278 1.00 37.75 C ATOM 69 O PRO A 770 8.580 -6.000 26.114 1.00 36.10 O ATOM 70 CB PRO A 770 8.432 -3.747 28.461 1.00 37.99 C ATOM 71 CG PRO A 770 7.584 -3.116 29.544 1.00 39.28 C ATOM 72 CD PRO A 770 6.723 -4.251 30.053 1.00 40.16 C ATOM 73 N VAL A 771 8.519 -6.989 28.132 1.00 37.47 N ATOM 74 CA VAL A 771 9.201 -8.251 27.733 1.00 38.30 C ATOM 75 C VAL A 771 8.195 -9.102 26.949 1.00 39.52 C ATOM 76 O VAL A 771 8.591 -9.721 25.958 1.00 36.77 O ATOM 77 CB VAL A 771 9.786 -9.011 28.947 1.00 40.24 C ATOM 78 CG1 VAL A 771 10.472 -10.314 28.532 1.00 39.65 C ATOM 79 CG2 VAL A 771 10.755 -8.138 29.742 1.00 39.44 C ATOM 80 H VAL A 771 8.235 -6.874 29.126 1.00 0.00 H ATOM 81 N GLN A 772 6.932 -9.139 27.374 1.00 40.29 N ATOM 82 CA GLN A 772 5.872 -9.841 26.605 1.00 42.60 C ATOM 83 C GLN A 772 5.848 -9.301 25.163 1.00 41.87 C ATOM 84 O GLN A 772 5.849 -10.106 24.222 1.00 44.02 O ATOM 85 CB GLN A 772 4.513 -9.667 27.282 1.00 44.32 C ATOM 86 CG GLN A 772 4.409 -10.402 28.606 1.00 45.82 C ATOM 87 CD GLN A 772 3.018 -10.312 29.174 1.00 48.46 C ATOM 88 OE1 GLN A 772 2.061 -10.044 28.460 1.00 48.53 O ATOM 89 NE2 GLN A 772 2.903 -10.551 30.468 1.00 52.08 N ATOM 90 HE22 GLN A 772 3.747 -10.775 31.033 1.00 0.00 H ATOM 91 HE21 GLN A 772 1.968 -10.516 30.922 1.00 0.00 H ATOM 92 H GLN A 772 6.683 -8.665 28.265 1.00 0.00 H ATOM 93 N ASP A 773 5.842 -7.983 25.001 1.00 40.20 N ATOM 94 CA ASP A 773 5.742 -7.308 23.683 1.00 41.89 C ATOM 95 C ASP A 773 7.012 -7.592 22.871 1.00 40.48 C ATOM 96 O ASP A 773 6.912 -7.747 21.661 1.00 40.78 O ATOM 97 CB ASP A 773 5.448 -5.822 23.886 1.00 42.38 C ATOM 98 CG ASP A 773 4.061 -5.591 24.467 1.00 46.08 C ATOM 99 OD1 ASP A 773 3.255 -6.551 24.487 1.00 48.65 O ATOM 100 OD2 ASP A 773 3.789 -4.462 24.898 1.00 48.50 O ATOM 101 H ASP A 773 5.912 -7.387 25.850 1.00 0.00 H ATOM 102 N LEU A 774 8.167 -7.662 23.523 1.00 38.58 N ATOM 103 CA LEU A 774 9.428 -8.045 22.851 1.00 38.04 C ATOM 104 C LEU A 774 9.271 -9.459 22.295 1.00 38.52 C ATOM 105 O LEU A 774 9.630 -9.661 21.126 1.00 37.54 O ATOM 106 CB LEU A 774 10.585 -7.964 23.846 1.00 37.94 C ATOM 107 CG LEU A 774 11.947 -8.381 23.295 1.00 37.29 C ATOM 108 CD1 LEU A 774 12.402 -7.422 22.198 1.00 38.27 C ATOM 109 CD2 LEU A 774 12.978 -8.458 24.408 1.00 36.35 C ATOM 110 H LEU A 774 8.185 -7.440 24.539 1.00 0.00 H ATOM 111 N ILE A 775 8.758 -10.387 23.110 1.00 39.38 N ATOM 112 CA ILE A 775 8.570 -11.820 22.746 1.00 40.89 C ATOM 113 C ILE A 775 7.653 -11.906 21.520 1.00 43.31 C ATOM 114 O ILE A 775 8.032 -12.605 20.558 1.00 42.98 O ATOM 115 CB ILE A 775 8.022 -12.638 23.932 1.00 42.35 C ATOM 116 CG1 ILE A 775 9.025 -12.728 25.086 1.00 43.62 C ATOM 117 CG2 ILE A 775 7.551 -14.015 23.489 1.00 42.74 C ATOM 118 CD1 ILE A 775 10.434 -13.016 24.661 1.00 44.25 C ATOM 119 H ILE A 775 8.470 -10.088 24.064 1.00 0.00 H ATOM 120 N LYS A 776 6.492 -11.245 21.572 1.00 45.88 N ATOM 121 CA LYS A 776 5.485 -11.208 20.472 1.00 48.84 C ATOM 122 C LYS A 776 6.141 -10.690 19.189 1.00 47.98 C ATOM 123 O LYS A 776 5.859 -11.239 18.120 1.00 47.20 O ATOM 124 CB LYS A 776 4.294 -10.314 20.820 1.00 50.82 C ATOM 125 CG LYS A 776 3.382 -10.865 21.900 1.00 55.88 C ATOM 126 CD LYS A 776 2.150 -10.012 22.138 1.00 58.95 C ATOM 127 CE LYS A 776 1.259 -10.587 23.216 1.00 61.02 C ATOM 128 NZ LYS A 776 -0.121 -10.045 23.153 1.00 64.87 N ATOM 129 HZ1 LYS A 776 -0.092 -9.012 23.274 1.00 0.00 H ATOM 130 HZ2 LYS A 776 -0.541 -10.275 22.230 1.00 0.00 H ATOM 131 HZ3 LYS A 776 -0.693 -10.469 23.911 1.00 0.00 H ATOM 132 H LYS A 776 6.275 -10.719 22.442 1.00 0.00 H ATOM 133 N MET A 777 6.976 -9.662 19.300 1.00 46.46 N ATOM 134 CA MET A 777 7.698 -9.068 18.144 1.00 47.18 C ATOM 135 C MET A 777 8.716 -10.075 17.576 1.00 46.07 C ATOM 136 O MET A 777 8.785 -10.199 16.350 1.00 48.38 O ATOM 137 CB MET A 777 8.394 -7.787 18.595 1.00 47.83 C ATOM 138 CG MET A 777 9.115 -7.069 17.493 1.00 49.46 C ATOM 139 SD MET A 777 9.932 -5.603 18.158 1.00 52.66 S ATOM 140 CE MET A 777 10.629 -4.955 16.640 1.00 55.28 C ATOM 141 H MET A 777 7.132 -9.252 20.243 1.00 0.00 H ATOM 142 N ILE A 778 9.447 -10.804 18.431 1.00 45.25 N ATOM 143 CA ILE A 778 10.540 -11.744 18.026 1.00 42.98 C ATOM 144 C ILE A 778 9.933 -12.992 17.392 1.00 44.77 C ATOM 145 O ILE A 778 10.473 -13.428 16.383 1.00 46.61 O ATOM 146 CB ILE A 778 11.484 -12.079 19.204 1.00 42.07 C ATOM 147 CG1 ILE A 778 12.351 -10.866 19.555 1.00 39.82 C ATOM 148 CG2 ILE A 778 12.354 -13.300 18.920 1.00 41.50 C ATOM 149 CD1 ILE A 778 13.170 -11.033 20.815 1.00 38.69 C ATOM 150 H ILE A 778 9.241 -10.710 19.446 1.00 0.00 H ATOM 151 N PHE A 779 8.826 -13.509 17.925 1.00 46.67 N ATOM 152 CA PHE A 779 8.203 -14.774 17.459 1.00 50.23 C ATOM 153 C PHE A 779 7.079 -14.509 16.445 1.00 56.01 C ATOM 154 O PHE A 779 6.718 -15.467 15.732 1.00 57.96 O ATOM 155 CB PHE A 779 7.783 -15.604 18.672 1.00 48.51 C ATOM 156 CG PHE A 779 8.970 -16.219 19.367 1.00 47.00 C ATOM 157 CD1 PHE A 779 9.486 -17.438 18.944 1.00 48.38 C ATOM 158 CD2 PHE A 779 9.616 -15.552 20.399 1.00 45.18 C ATOM 159 CE1 PHE A 779 10.595 -18.001 19.565 1.00 46.73 C ATOM 160 CE2 PHE A 779 10.726 -16.114 21.013 1.00 44.14 C ATOM 161 CZ PHE A 779 11.215 -17.334 20.594 1.00 44.36 C ATOM 162 H PHE A 779 8.374 -12.999 18.710 1.00 0.00 H ATOM 163 N GLY A 780 6.575 -13.272 16.353 1.00 60.42 N ATOM 164 CA GLY A 780 5.564 -12.832 15.367 1.00 63.52 C ATOM 165 C GLY A 780 4.312 -13.692 15.393 1.00 67.92 C ATOM 166 O GLY A 780 3.889 -14.036 16.510 1.00 72.11 O ATOM 167 H GLY A 780 6.923 -12.563 17.030 1.00 0.00 H TER 168 GLY A 780 ATOM 169 N ASP A 788 2.841 -20.746 20.246 1.00 72.27 N ATOM 170 CA ASP A 788 3.144 -21.213 21.627 1.00 69.07 C ATOM 171 C ASP A 788 2.845 -20.086 22.618 1.00 62.72 C ATOM 172 O ASP A 788 2.733 -18.930 22.231 1.00 60.11 O ATOM 173 CB ASP A 788 4.598 -21.695 21.721 1.00 70.78 C ATOM 174 CG ASP A 788 4.759 -23.206 21.827 1.00 73.04 C ATOM 175 OD1 ASP A 788 3.773 -23.878 22.173 1.00 76.72 O ATOM 176 OD2 ASP A 788 5.883 -23.695 21.590 1.00 74.51 O ATOM 177 HN3 ASP A 788 3.432 -19.920 20.023 1.00 0.00 H ATOM 178 HN2 ASP A 788 1.837 -20.483 20.183 1.00 0.00 H ATOM 179 HN1 ASP A 788 3.044 -21.510 19.571 1.00 0.00 H ATOM 180 N PRO A 789 2.675 -20.365 23.931 1.00 59.41 N ATOM 181 CA PRO A 789 2.466 -19.296 24.902 1.00 55.58 C ATOM 182 C PRO A 789 3.726 -18.432 25.010 1.00 50.94 C ATOM 183 O PRO A 789 4.813 -18.912 24.722 1.00 47.80 O ATOM 184 CB PRO A 789 2.164 -20.006 26.232 1.00 58.32 C ATOM 185 CG PRO A 789 1.887 -21.456 25.857 1.00 60.83 C ATOM 186 CD PRO A 789 2.619 -21.700 24.550 1.00 61.14 C ATOM 187 N ILE A 790 3.534 -17.182 25.424 1.00 48.16 N ATOM 188 CA ILE A 790 4.588 -16.132 25.515 1.00 45.39 C ATOM 189 C ILE A 790 5.740 -16.625 26.399 1.00 44.25 C ATOM 190 O ILE A 790 6.890 -16.446 25.997 1.00 42.76 O ATOM 191 CB ILE A 790 3.975 -14.816 26.017 1.00 44.31 C ATOM 192 CG1 ILE A 790 3.116 -14.171 24.926 1.00 46.49 C ATOM 193 CG2 ILE A 790 5.049 -13.861 26.519 1.00 42.64 C ATOM 194 CD1 ILE A 790 2.363 -12.941 25.387 1.00 47.55 C ATOM 195 H ILE A 790 2.569 -16.916 25.707 1.00 0.00 H ATOM 196 N ASP A 791 5.436 -17.235 27.544 1.00 47.26 N ATOM 197 CA ASP A 791 6.444 -17.678 28.544 1.00 48.19 C ATOM 198 C ASP A 791 7.223 -18.872 27.983 1.00 47.03 C ATOM 199 O ASP A 791 8.419 -18.962 28.266 1.00 45.21 O ATOM 200 CB ASP A 791 5.798 -17.913 29.918 1.00 50.10 C ATOM 201 CG ASP A 791 5.411 -16.611 30.608 1.00 51.04 C ATOM 202 OD1 ASP A 791 5.577 -15.552 29.981 1.00 50.29 O ATOM 203 OD2 ASP A 791 4.960 -16.654 31.775 1.00 57.00 O ATOM 204 H ASP A 791 4.432 -17.412 27.751 1.00 0.00 H ATOM 205 N VAL A 792 6.586 -19.734 27.188 1.00 48.93 N ATOM 206 CA VAL A 792 7.261 -20.903 26.550 1.00 49.18 C ATOM 207 C VAL A 792 8.254 -20.374 25.507 1.00 48.00 C ATOM 208 O VAL A 792 9.371 -20.908 25.436 1.00 49.89 O ATOM 209 CB VAL A 792 6.242 -21.896 25.949 1.00 51.59 C ATOM 210 CG1 VAL A 792 6.909 -22.973 25.104 1.00 52.08 C ATOM 211 CG2 VAL A 792 5.378 -22.529 27.027 1.00 53.22 C ATOM 212 H VAL A 792 5.573 -19.585 27.004 1.00 0.00 H ATOM 213 N ASN A 793 7.872 -19.337 24.756 1.00 46.18 N ATOM 214 CA ASN A 793 8.728 -18.707 23.716 1.00 45.03 C ATOM 215 C ASN A 793 9.899 -17.983 24.389 1.00 42.29 C ATOM 216 O ASN A 793 11.019 -18.009 23.827 1.00 40.28 O ATOM 217 CB ASN A 793 7.919 -17.770 22.810 1.00 46.05 C ATOM 218 CG ASN A 793 7.101 -18.518 21.774 1.00 48.37 C ATOM 219 OD1 ASN A 793 7.315 -19.710 21.563 1.00 49.56 O ATOM 220 ND2 ASN A 793 6.154 -17.839 21.145 1.00 46.26 N ATOM 221 HD22 ASN A 793 6.009 -16.831 21.356 1.00 0.00 H ATOM 222 HD21 ASN A 793 5.555 -18.314 20.440 1.00 0.00 H ATOM 223 H ASN A 793 6.920 -18.947 24.908 1.00 0.00 H ATOM 224 N TYR A 794 9.662 -17.362 25.546 1.00 41.45 N ATOM 225 CA TYR A 794 10.720 -16.711 26.364 1.00 40.39 C ATOM 226 C TYR A 794 11.826 -17.743 26.636 1.00 40.73 C ATOM 227 O TYR A 794 13.008 -17.448 26.387 1.00 40.89 O ATOM 228 CB TYR A 794 10.125 -16.081 27.631 1.00 39.06 C ATOM 229 CG TYR A 794 11.143 -15.462 28.554 1.00 38.04 C ATOM 230 CD1 TYR A 794 11.661 -14.204 28.309 1.00 35.13 C ATOM 231 CD2 TYR A 794 11.642 -16.162 29.644 1.00 38.79 C ATOM 232 CE1 TYR A 794 12.623 -13.646 29.136 1.00 35.01 C ATOM 233 CE2 TYR A 794 12.603 -15.615 30.482 1.00 37.62 C ATOM 234 CZ TYR A 794 13.104 -14.355 30.225 1.00 35.85 C ATOM 235 OH TYR A 794 14.044 -13.798 31.051 1.00 35.96 O ATOM 236 HH TYR A 794 14.850 -14.373 31.067 1.00 0.00 H ATOM 237 H TYR A 794 8.683 -17.331 25.895 1.00 0.00 H ATOM 238 N GLU A 795 11.464 -18.925 27.126 1.00 43.96 N ATOM 239 CA GLU A 795 12.455 -19.949 27.542 1.00 47.64 C ATOM 240 C GLU A 795 13.287 -20.387 26.336 1.00 45.38 C ATOM 241 O GLU A 795 14.487 -20.563 26.518 1.00 46.42 O ATOM 242 CB GLU A 795 11.766 -21.103 28.271 1.00 52.84 C ATOM 243 CG GLU A 795 11.240 -20.663 29.622 1.00 57.59 C ATOM 244 CD GLU A 795 10.918 -21.751 30.632 1.00 64.63 C ATOM 245 OE1 GLU A 795 10.182 -22.710 30.281 1.00 69.15 O ATOM 246 OE2 GLU A 795 11.395 -21.617 31.779 1.00 68.27 O ATOM 247 H GLU A 795 10.451 -19.140 27.221 1.00 0.00 H ATOM 248 N LYS A 796 12.715 -20.447 25.134 1.00 44.83 N ATOM 249 CA LYS A 796 13.474 -20.847 23.916 1.00 45.82 C ATOM 250 C LYS A 796 14.636 -19.875 23.636 1.00 42.94 C ATOM 251 O LYS A 796 15.616 -20.301 22.968 1.00 42.03 O ATOM 252 CB LYS A 796 12.538 -20.924 22.709 1.00 48.57 C ATOM 253 CG LYS A 796 11.492 -22.034 22.761 1.00 51.56 C ATOM 254 CD LYS A 796 10.671 -22.061 21.495 1.00 54.13 C ATOM 255 CE LYS A 796 9.390 -22.859 21.583 1.00 57.32 C ATOM 256 NZ LYS A 796 8.400 -22.353 20.599 1.00 58.68 N ATOM 257 HZ1 LYS A 796 8.193 -21.354 20.800 1.00 0.00 H ATOM 258 HZ2 LYS A 796 8.791 -22.441 19.639 1.00 0.00 H ATOM 259 HZ3 LYS A 796 7.525 -22.911 20.671 1.00 0.00 H ATOM 260 H LYS A 796 11.707 -20.207 25.043 1.00 0.00 H ATOM 261 N LEU A 797 14.563 -18.621 24.100 1.00 38.22 N ATOM 262 CA LEU A 797 15.657 -17.634 23.889 1.00 37.18 C ATOM 263 C LEU A 797 16.859 -17.937 24.796 1.00 37.43 C ATOM 264 O LEU A 797 17.948 -17.388 24.504 1.00 36.21 O ATOM 265 CB LEU A 797 15.146 -16.215 24.137 1.00 37.13 C ATOM 266 CG LEU A 797 13.965 -15.767 23.274 1.00 37.91 C ATOM 267 CD1 LEU A 797 13.456 -14.414 23.738 1.00 36.41 C ATOM 268 CD2 LEU A 797 14.346 -15.707 21.811 1.00 37.80 C ATOM 269 H LEU A 797 13.715 -18.327 24.625 1.00 0.00 H ATOM 270 N LYS A 798 16.689 -18.751 25.844 1.00 39.46 N ATOM 271 CA LYS A 798 17.775 -19.130 26.796 1.00 41.46 C ATOM 272 C LYS A 798 18.544 -17.870 27.210 1.00 38.88 C ATOM 273 O LYS A 798 19.790 -17.909 27.268 1.00 37.15 O ATOM 274 CB LYS A 798 18.746 -20.119 26.146 1.00 43.86 C ATOM 275 CG LYS A 798 18.141 -21.412 25.610 1.00 47.04 C ATOM 276 CD LYS A 798 17.343 -22.165 26.631 1.00 50.41 C ATOM 277 CE LYS A 798 17.078 -23.602 26.223 1.00 55.64 C ATOM 278 NZ LYS A 798 16.261 -24.294 27.249 1.00 57.59 N ATOM 279 HZ1 LYS A 798 16.769 -24.289 28.156 1.00 0.00 H ATOM 280 HZ2 LYS A 798 15.352 -23.801 27.357 1.00 0.00 H ATOM 281 HZ3 LYS A 798 16.091 -25.276 26.951 1.00 0.00 H ATOM 282 H LYS A 798 15.740 -19.145 26.006 1.00 0.00 H ATOM 283 N THR A 799 17.815 -16.781 27.461 1.00 38.29 N ATOM 284 CA THR A 799 18.370 -15.430 27.708 1.00 37.49 C ATOM 285 C THR A 799 17.578 -14.790 28.856 1.00 39.05 C ATOM 286 O THR A 799 16.333 -14.743 28.774 1.00 38.50 O ATOM 287 CB THR A 799 18.343 -14.573 26.431 1.00 36.53 C ATOM 288 OG1 THR A 799 19.164 -15.135 25.405 1.00 37.58 O ATOM 289 CG2 THR A 799 18.847 -13.168 26.651 1.00 36.05 C ATOM 290 HG1 THR A 799 18.836 -16.042 25.181 1.00 0.00 H ATOM 291 H THR A 799 16.781 -16.889 27.485 1.00 0.00 H ATOM 292 N ASP A 800 18.272 -14.299 29.886 1.00 39.03 N ATOM 293 CA ASP A 800 17.633 -13.489 30.953 1.00 39.38 C ATOM 294 C ASP A 800 17.398 -12.085 30.394 1.00 36.99 C ATOM 295 O ASP A 800 18.370 -11.476 29.897 1.00 36.17 O ATOM 296 CB ASP A 800 18.453 -13.493 32.242 1.00 40.79 C ATOM 297 CG ASP A 800 17.752 -12.750 33.364 1.00 41.18 C ATOM 298 OD1 ASP A 800 16.763 -13.257 33.865 1.00 43.18 O ATOM 299 OD2 ASP A 800 18.175 -11.649 33.667 1.00 43.25 O ATOM 300 H ASP A 800 19.293 -14.490 29.942 1.00 0.00 H ATOM 301 N ILE A 801 16.161 -11.601 30.468 1.00 36.08 N ATOM 302 CA ILE A 801 15.755 -10.279 29.913 1.00 35.88 C ATOM 303 C ILE A 801 15.154 -9.438 31.042 1.00 37.56 C ATOM 304 O ILE A 801 14.216 -9.917 31.701 1.00 36.84 O ATOM 305 CB ILE A 801 14.758 -10.427 28.751 1.00 36.01 C ATOM 306 CG1 ILE A 801 15.233 -11.468 27.733 1.00 36.80 C ATOM 307 CG2 ILE A 801 14.490 -9.063 28.122 1.00 35.42 C ATOM 308 CD1 ILE A 801 14.338 -11.630 26.515 1.00 38.20 C ATOM 309 H ILE A 801 15.436 -12.178 30.940 1.00 0.00 H ATOM 310 N LYS A 802 15.694 -8.229 31.234 1.00 38.26 N ATOM 311 CA LYS A 802 15.229 -7.244 32.233 1.00 40.19 C ATOM 312 C LYS A 802 14.972 -5.916 31.533 1.00 38.65 C ATOM 313 O LYS A 802 15.812 -5.504 30.693 1.00 34.79 O ATOM 314 CB LYS A 802 16.273 -7.070 33.333 1.00 44.90 C ATOM 315 CG LYS A 802 16.446 -8.299 34.204 1.00 50.35 C ATOM 316 CD LYS A 802 17.430 -8.107 35.334 1.00 56.10 C ATOM 317 CE LYS A 802 17.564 -9.349 36.195 1.00 61.09 C ATOM 318 NZ LYS A 802 18.810 -9.324 37.000 1.00 64.71 N ATOM 319 HZ1 LYS A 802 19.631 -9.275 36.364 1.00 0.00 H ATOM 320 HZ2 LYS A 802 18.802 -8.491 37.623 1.00 0.00 H ATOM 321 HZ3 LYS A 802 18.867 -10.188 37.575 1.00 0.00 H ATOM 322 H LYS A 802 16.502 -7.962 30.635 1.00 0.00 H ATOM 323 N VAL A 803 13.869 -5.264 31.893 1.00 37.85 N ATOM 324 CA VAL A 803 13.598 -3.858 31.482 1.00 38.65 C ATOM 325 C VAL A 803 14.568 -2.973 32.270 1.00 37.68 C ATOM 326 O VAL A 803 14.608 -3.088 33.499 1.00 38.38 O ATOM 327 CB VAL A 803 12.139 -3.441 31.746 1.00 40.26 C ATOM 328 CG1 VAL A 803 11.866 -2.048 31.200 1.00 41.78 C ATOM 329 CG2 VAL A 803 11.163 -4.438 31.166 1.00 41.49 C ATOM 330 H VAL A 803 13.169 -5.755 32.484 1.00 0.00 H ATOM 331 N VAL A 804 15.358 -2.161 31.589 1.00 37.86 N ATOM 332 CA VAL A 804 16.127 -1.061 32.233 1.00 40.61 C ATOM 333 C VAL A 804 15.133 0.085 32.484 1.00 43.75 C ATOM 334 O VAL A 804 14.370 0.427 31.564 1.00 46.44 O ATOM 335 CB VAL A 804 17.324 -0.640 31.361 1.00 40.65 C ATOM 336 CG1 VAL A 804 18.122 0.506 31.979 1.00 42.36 C ATOM 337 CG2 VAL A 804 18.246 -1.818 31.085 1.00 40.46 C ATOM 338 H VAL A 804 15.446 -2.296 30.562 1.00 0.00 H ATOM 339 N ASP A 805 15.113 0.645 33.687 1.00 46.94 N ATOM 340 CA ASP A 805 14.236 1.802 34.006 1.00 51.04 C ATOM 341 C ASP A 805 14.633 2.989 33.117 1.00 50.80 C ATOM 342 O ASP A 805 15.842 3.328 33.048 1.00 46.54 O ATOM 343 CB ASP A 805 14.288 2.198 35.479 1.00 54.32 C ATOM 344 CG ASP A 805 13.403 3.402 35.793 1.00 61.13 C ATOM 345 OD1 ASP A 805 12.162 3.223 35.832 1.00 63.34 O ATOM 346 OD2 ASP A 805 13.956 4.525 35.980 1.00 64.00 O ATOM 347 H ASP A 805 15.731 0.262 34.431 1.00 0.00 H ATOM 348 N ARG A 806 13.625 3.545 32.446 1.00 54.30 N ATOM 349 CA ARG A 806 13.620 4.838 31.717 1.00 59.57 C ATOM 350 C ARG A 806 14.561 5.854 32.395 1.00 60.18 C ATOM 351 O ARG A 806 15.356 6.470 31.680 1.00 61.22 O ATOM 352 CB ARG A 806 12.165 5.324 31.662 1.00 65.57 C ATOM 353 CG ARG A 806 11.809 6.158 30.440 1.00 70.88 C ATOM 354 CD ARG A 806 12.001 7.652 30.671 1.00 77.69 C ATOM 355 NE ARG A 806 12.431 8.323 29.448 1.00 80.86 N ATOM 356 CZ ARG A 806 12.951 9.548 29.373 1.00 84.58 C ATOM 357 NH1 ARG A 806 13.117 10.286 30.460 1.00 87.36 N ATOM 358 NH2 ARG A 806 13.308 10.029 28.193 1.00 84.30 N ATOM 359 HE ARG A 806 12.322 7.799 28.556 1.00 0.00 H ATOM 360 HH12 ARG A 806 13.524 11.240 30.384 1.00 0.00 H ATOM 361 HH11 ARG A 806 12.840 9.912 31.390 1.00 0.00 H ATOM 362 HH22 ARG A 806 13.715 10.983 28.122 1.00 0.00 H ATOM 363 HH21 ARG A 806 13.182 9.453 27.337 1.00 0.00 H ATOM 364 H ARG A 806 12.734 3.008 32.431 1.00 0.00 H ATOM 365 N ASP A 807 14.485 6.034 33.719 1.00 62.54 N ATOM 366 CA ASP A 807 15.131 7.173 34.430 1.00 65.48 C ATOM 367 C ASP A 807 16.450 6.756 35.085 1.00 63.83 C ATOM 368 O ASP A 807 17.007 7.572 35.835 1.00 69.75 O ATOM 369 CB ASP A 807 14.201 7.778 35.482 1.00 69.85 C ATOM 370 CG ASP A 807 12.903 8.328 34.916 1.00 73.20 C ATOM 371 OD1 ASP A 807 12.927 8.847 33.777 1.00 71.96 O ATOM 372 OD2 ASP A 807 11.877 8.245 35.630 1.00 79.25 O ATOM 373 H ASP A 807 13.947 5.343 34.281 1.00 0.00 H ATOM 374 N SER A 808 16.945 5.553 34.808 1.00 59.01 N ATOM 375 CA SER A 808 18.240 5.051 35.331 1.00 57.75 C ATOM 376 C SER A 808 19.390 5.747 34.594 1.00 59.94 C ATOM 377 O SER A 808 19.168 6.270 33.486 1.00 57.01 O ATOM 378 CB SER A 808 18.341 3.544 35.217 1.00 53.27 C ATOM 379 OG SER A 808 18.518 3.139 33.862 1.00 49.32 O ATOM 380 HG SER A 808 17.746 3.445 33.324 1.00 0.00 H ATOM 381 H SER A 808 16.392 4.927 34.188 1.00 0.00 H ATOM 382 N GLU A 809 20.573 5.739 35.206 1.00 62.52 N ATOM 383 CA GLU A 809 21.835 6.245 34.618 1.00 64.72 C ATOM 384 C GLU A 809 22.192 5.402 33.392 1.00 59.86 C ATOM 385 O GLU A 809 22.679 5.991 32.400 1.00 56.98 O ATOM 386 CB GLU A 809 22.955 6.202 35.661 1.00 70.52 C ATOM 387 CG GLU A 809 24.318 6.601 35.122 1.00 73.57 C ATOM 388 CD GLU A 809 25.399 6.684 36.186 1.00 79.15 C ATOM 389 OE1 GLU A 809 25.207 7.444 37.168 1.00 83.08 O ATOM 390 OE2 GLU A 809 26.423 5.974 36.040 1.00 80.50 O ATOM 391 H GLU A 809 20.614 5.348 36.169 1.00 0.00 H ATOM 392 N GLU A 810 22.020 4.078 33.485 1.00 56.55 N ATOM 393 CA GLU A 810 22.239 3.137 32.355 1.00 54.22 C ATOM 394 C GLU A 810 21.449 3.635 31.140 1.00 49.41 C ATOM 395 O GLU A 810 22.012 3.665 30.035 1.00 44.34 O ATOM 396 CB GLU A 810 21.760 1.723 32.685 1.00 56.85 C ATOM 397 CG GLU A 810 22.869 0.757 33.052 1.00 62.36 C ATOM 398 CD GLU A 810 22.365 -0.632 33.416 1.00 63.64 C ATOM 399 OE1 GLU A 810 21.392 -0.714 34.194 1.00 67.89 O ATOM 400 OE2 GLU A 810 22.930 -1.627 32.914 1.00 64.86 O ATOM 401 H GLU A 810 21.716 3.685 34.399 1.00 0.00 H ATOM 402 N ALA A 811 20.175 3.967 31.356 1.00 46.74 N ATOM 403 CA ALA A 811 19.230 4.399 30.306 1.00 46.78 C ATOM 404 C ALA A 811 19.707 5.736 29.721 1.00 46.42 C ATOM 405 O ALA A 811 19.723 5.848 28.485 1.00 43.44 O ATOM 406 CB ALA A 811 17.832 4.475 30.865 1.00 46.94 C ATOM 407 H ALA A 811 19.822 3.918 32.333 1.00 0.00 H ATOM 408 N GLU A 812 20.115 6.692 30.569 1.00 49.61 N ATOM 409 CA GLU A 812 20.625 8.023 30.127 1.00 51.86 C ATOM 410 C GLU A 812 21.804 7.811 29.169 1.00 47.20 C ATOM 411 O GLU A 812 21.809 8.412 28.093 1.00 45.22 O ATOM 412 CB GLU A 812 21.050 8.897 31.312 1.00 56.77 C ATOM 413 CG GLU A 812 19.891 9.426 32.144 1.00 63.14 C ATOM 414 CD GLU A 812 20.272 10.356 33.297 1.00 67.25 C ATOM 415 OE1 GLU A 812 21.469 10.697 33.427 1.00 69.04 O ATOM 416 OE2 GLU A 812 19.369 10.742 34.063 1.00 67.56 O ATOM 417 H GLU A 812 20.074 6.495 31.589 1.00 0.00 H ATOM 418 N ILE A 813 22.759 6.967 29.554 1.00 45.26 N ATOM 419 CA ILE A 813 23.999 6.688 28.773 1.00 43.11 C ATOM 420 C ILE A 813 23.605 6.082 27.424 1.00 40.77 C ATOM 421 O ILE A 813 24.120 6.541 26.379 1.00 39.87 O ATOM 422 CB ILE A 813 24.942 5.775 29.579 1.00 43.14 C ATOM 423 CG1 ILE A 813 25.596 6.558 30.716 1.00 48.02 C ATOM 424 CG2 ILE A 813 25.981 5.100 28.690 1.00 41.54 C ATOM 425 CD1 ILE A 813 26.203 5.691 31.786 1.00 49.64 C ATOM 426 H ILE A 813 22.632 6.470 30.459 1.00 0.00 H ATOM 427 N ILE A 814 22.725 5.084 27.434 1.00 38.30 N ATOM 428 CA ILE A 814 22.319 4.403 26.174 1.00 38.74 C ATOM 429 C ILE A 814 21.565 5.389 25.272 1.00 37.38 C ATOM 430 O ILE A 814 21.905 5.450 24.093 1.00 35.95 O ATOM 431 CB ILE A 814 21.558 3.102 26.462 1.00 38.97 C ATOM 432 CG1 ILE A 814 22.500 2.074 27.106 1.00 39.53 C ATOM 433 CG2 ILE A 814 20.933 2.572 25.179 1.00 38.43 C ATOM 434 CD1 ILE A 814 21.805 0.952 27.857 1.00 39.75 C ATOM 435 H ILE A 814 22.314 4.774 28.338 1.00 0.00 H ATOM 436 N ARG A 815 20.611 6.159 25.792 1.00 39.81 N ATOM 437 CA ARG A 815 19.872 7.165 24.975 1.00 41.34 C ATOM 438 C ARG A 815 20.850 8.207 24.416 1.00 41.71 C ATOM 439 O ARG A 815 20.643 8.655 23.277 1.00 42.65 O ATOM 440 CB ARG A 815 18.738 7.811 25.771 1.00 43.11 C ATOM 441 CG ARG A 815 17.529 6.907 25.962 1.00 43.13 C ATOM 442 CD ARG A 815 16.302 7.699 26.380 1.00 47.12 C ATOM 443 NE ARG A 815 16.560 8.441 27.607 1.00 49.77 N ATOM 444 CZ ARG A 815 16.402 7.951 28.834 1.00 50.79 C ATOM 445 NH1 ARG A 815 15.967 6.713 29.012 1.00 49.83 N ATOM 446 NH2 ARG A 815 16.680 8.706 29.881 1.00 54.22 N ATOM 447 HE ARG A 815 16.891 9.423 27.518 1.00 0.00 H ATOM 448 HH12 ARG A 815 15.846 6.338 29.974 1.00 0.00 H ATOM 449 HH11 ARG A 815 15.746 6.116 28.189 1.00 0.00 H ATOM 450 HH22 ARG A 815 16.558 8.328 30.842 1.00 0.00 H ATOM 451 HH21 ARG A 815 17.021 9.679 29.745 1.00 0.00 H ATOM 452 H ARG A 815 20.374 6.056 26.799 1.00 0.00 H ATOM 453 N LYS A 816 21.894 8.558 25.167 1.00 41.89 N ATOM 454 CA LYS A 816 22.939 9.510 24.716 1.00 42.65 C ATOM 455 C LYS A 816 23.776 8.888 23.587 1.00 40.21 C ATOM 456 O LYS A 816 24.189 9.626 22.660 1.00 40.49 O ATOM 457 CB LYS A 816 23.815 9.925 25.897 1.00 45.42 C ATOM 458 CG LYS A 816 24.838 11.002 25.555 1.00 49.17 C ATOM 459 CD LYS A 816 25.440 11.682 26.767 1.00 53.01 C ATOM 460 CE LYS A 816 26.505 12.691 26.392 1.00 56.67 C ATOM 461 NZ LYS A 816 26.837 13.567 27.540 1.00 60.89 N ATOM 462 HZ1 LYS A 816 25.984 14.079 27.842 1.00 0.00 H ATOM 463 HZ2 LYS A 816 27.190 12.986 28.327 1.00 0.00 H ATOM 464 HZ3 LYS A 816 27.569 14.248 27.254 1.00 0.00 H ATOM 465 H LYS A 816 21.980 8.144 26.117 1.00 0.00 H ATOM 466 N TYR A 817 24.059 7.588 23.668 1.00 37.24 N ATOM 467 CA TYR A 817 24.810 6.843 22.622 1.00 35.95 C ATOM 468 C TYR A 817 24.007 6.891 21.310 1.00 35.91 C ATOM 469 O TYR A 817 24.564 7.183 20.245 1.00 37.69 O ATOM 470 CB TYR A 817 25.075 5.420 23.113 1.00 35.00 C ATOM 471 CG TYR A 817 26.145 4.620 22.411 1.00 32.92 C ATOM 472 CD1 TYR A 817 26.963 5.165 21.433 1.00 33.64 C ATOM 473 CD2 TYR A 817 26.397 3.316 22.794 1.00 32.10 C ATOM 474 CE1 TYR A 817 27.960 4.424 20.818 1.00 31.51 C ATOM 475 CE2 TYR A 817 27.405 2.564 22.201 1.00 32.09 C ATOM 476 CZ TYR A 817 28.187 3.120 21.205 1.00 31.67 C ATOM 477 OH TYR A 817 29.167 2.387 20.599 1.00 32.33 O ATOM 478 HH TYR A 817 29.826 2.094 21.278 1.00 0.00 H ATOM 479 H TYR A 817 23.737 7.066 24.508 1.00 0.00 H ATOM 480 N VAL A 818 22.702 6.646 21.394 1.00 36.79 N ATOM 481 CA VAL A 818 21.767 6.700 20.233 1.00 37.78 C ATOM 482 C VAL A 818 21.748 8.126 19.658 1.00 38.37 C ATOM 483 O VAL A 818 21.922 8.280 18.444 1.00 39.19 O ATOM 484 CB VAL A 818 20.355 6.231 20.626 1.00 37.68 C ATOM 485 CG1 VAL A 818 19.353 6.455 19.498 1.00 38.71 C ATOM 486 CG2 VAL A 818 20.357 4.781 21.064 1.00 35.65 C ATOM 487 H VAL A 818 22.310 6.402 22.326 1.00 0.00 H ATOM 488 N LYS A 819 21.555 9.131 20.495 1.00 39.74 N ATOM 489 CA LYS A 819 21.402 10.535 20.041 1.00 43.87 C ATOM 490 C LYS A 819 22.679 11.000 19.327 1.00 43.72 C ATOM 491 O LYS A 819 22.557 11.677 18.281 1.00 45.05 O ATOM 492 CB LYS A 819 21.093 11.447 21.228 1.00 47.69 C ATOM 493 CG LYS A 819 20.932 12.924 20.886 1.00 52.18 C ATOM 494 CD LYS A 819 21.355 13.845 22.019 1.00 56.94 C ATOM 495 CE LYS A 819 21.301 15.320 21.670 1.00 60.37 C ATOM 496 NZ LYS A 819 19.962 15.685 21.156 1.00 61.68 N ATOM 497 HZ1 LYS A 819 19.756 15.128 20.302 1.00 0.00 H ATOM 498 HZ2 LYS A 819 19.246 15.484 21.883 1.00 0.00 H ATOM 499 HZ3 LYS A 819 19.946 16.698 20.923 1.00 0.00 H ATOM 500 H LYS A 819 21.509 8.929 21.514 1.00 0.00 H ATOM 501 N ASN A 820 23.854 10.658 19.857 1.00 40.85 N ATOM 502 CA ASN A 820 25.126 11.316 19.463 1.00 41.93 C ATOM 503 C ASN A 820 25.766 10.642 18.247 1.00 38.90 C ATOM 504 O ASN A 820 26.609 11.288 17.609 1.00 39.03 O ATOM 505 CB ASN A 820 26.145 11.318 20.599 1.00 41.77 C ATOM 506 CG ASN A 820 25.901 12.388 21.639 1.00 45.01 C ATOM 507 OD1 ASN A 820 26.634 12.443 22.623 1.00 46.58 O ATOM 508 ND2 ASN A 820 24.890 13.227 21.445 1.00 44.62 N ATOM 509 HD22 ASN A 820 24.297 13.139 20.595 1.00 0.00 H ATOM 510 HD21 ASN A 820 24.691 13.972 22.143 1.00 0.00 H ATOM 511 H ASN A 820 23.881 9.903 20.572 1.00 0.00 H ATOM 512 N THR A 821 25.438 9.382 17.968 1.00 38.65 N ATOM 513 CA THR A 821 26.162 8.549 16.964 1.00 36.54 C ATOM 514 C THR A 821 25.219 8.208 15.803 1.00 37.84 C ATOM 515 O THR A 821 25.469 7.203 15.091 1.00 37.41 O ATOM 516 CB THR A 821 26.793 7.333 17.647 1.00 34.67 C ATOM 517 OG1 THR A 821 25.762 6.412 18.020 1.00 33.11 O ATOM 518 CG2 THR A 821 27.613 7.727 18.859 1.00 36.01 C ATOM 519 HG1 THR A 821 25.135 6.856 18.645 1.00 0.00 H ATOM 520 H THR A 821 24.636 8.957 18.476 1.00 0.00 H ATOM 521 N HIS A 822 24.179 9.014 15.596 1.00 40.09 N ATOM 522 CA HIS A 822 23.357 8.966 14.361 1.00 42.65 C ATOM 523 C HIS A 822 24.148 9.718 13.287 1.00 42.72 C ATOM 524 O HIS A 822 24.384 10.900 13.482 1.00 43.71 O ATOM 525 CB HIS A 822 21.946 9.534 14.584 1.00 45.95 C ATOM 526 CG HIS A 822 20.964 9.037 13.577 1.00 48.34 C ATOM 527 ND1 HIS A 822 21.152 9.207 12.212 1.00 49.70 N ATOM 528 CD2 HIS A 822 19.804 8.359 13.723 1.00 48.00 C ATOM 529 CE1 HIS A 822 20.148 8.641 11.570 1.00 49.54 C ATOM 530 NE2 HIS A 822 19.307 8.116 12.476 1.00 49.49 N ATOM 531 H HIS A 822 23.932 9.707 16.331 1.00 0.00 H ATOM 532 N ALA A 823 24.605 9.015 12.249 1.00 41.10 N ATOM 533 CA ALA A 823 25.455 9.560 11.170 1.00 42.47 C ATOM 534 C ALA A 823 24.663 10.588 10.355 1.00 44.13 C ATOM 535 O ALA A 823 23.447 10.411 10.178 1.00 42.89 O ATOM 536 CB ALA A 823 25.959 8.434 10.308 1.00 40.69 C ATOM 537 H ALA A 823 24.344 8.010 12.195 1.00 0.00 H ATOM 538 N THR A 824 25.334 11.630 9.871 1.00 47.01 N ATOM 539 CA THR A 824 24.691 12.731 9.109 1.00 50.51 C ATOM 540 C THR A 824 24.172 12.186 7.770 1.00 49.77 C ATOM 541 O THR A 824 23.171 12.721 7.287 1.00 54.17 O ATOM 542 CB THR A 824 25.642 13.928 8.955 1.00 52.62 C ATOM 543 OG1 THR A 824 26.849 13.459 8.354 1.00 51.76 O ATOM 544 CG2 THR A 824 25.962 14.593 10.276 1.00 53.80 C ATOM 545 HG1 THR A 824 27.259 12.769 8.934 1.00 0.00 H ATOM 546 H THR A 824 26.360 11.676 10.034 1.00 0.00 H ATOM 547 N THR A 825 24.804 11.155 7.198 1.00 48.02 N ATOM 548 CA THR A 825 24.441 10.625 5.855 1.00 48.27 C ATOM 549 C THR A 825 23.245 9.669 5.965 1.00 47.79 C ATOM 550 O THR A 825 22.641 9.393 4.930 1.00 50.33 O ATOM 551 CB THR A 825 25.642 9.993 5.148 1.00 46.47 C ATOM 552 OG1 THR A 825 26.115 8.906 5.946 1.00 45.39 O ATOM 553 CG2 THR A 825 26.755 10.986 4.900 1.00 47.44 C ATOM 554 HG1 THR A 825 26.385 9.245 6.836 1.00 0.00 H ATOM 555 H THR A 825 25.585 10.703 7.715 1.00 0.00 H ATOM 556 N HIS A 826 22.875 9.235 7.169 1.00 45.63 N ATOM 557 CA HIS A 826 21.708 8.348 7.416 1.00 45.85 C ATOM 558 C HIS A 826 20.494 9.204 7.787 1.00 46.85 C ATOM 559 O HIS A 826 20.029 9.099 8.898 1.00 46.78 O ATOM 560 CB HIS A 826 22.064 7.312 8.487 1.00 41.90 C ATOM 561 CG HIS A 826 23.234 6.470 8.111 1.00 40.85 C ATOM 562 ND1 HIS A 826 24.039 5.849 9.046 1.00 39.58 N ATOM 563 CD2 HIS A 826 23.749 6.163 6.906 1.00 40.18 C ATOM 564 CE1 HIS A 826 25.002 5.197 8.423 1.00 38.80 C ATOM 565 NE2 HIS A 826 24.837 5.373 7.109 1.00 38.25 N ATOM 566 H HIS A 826 23.439 9.536 7.989 1.00 0.00 H ATOM 567 N ASN A 827 19.985 10.007 6.861 1.00 51.59 N ATOM 568 CA ASN A 827 18.978 11.059 7.169 1.00 54.01 C ATOM 569 C ASN A 827 17.593 10.643 6.667 1.00 54.75 C ATOM 570 O ASN A 827 16.681 11.474 6.748 1.00 57.38 O ATOM 571 CB ASN A 827 19.401 12.419 6.614 1.00 56.41 C ATOM 572 CG ASN A 827 19.639 12.385 5.126 1.00 58.92 C ATOM 573 OD1 ASN A 827 20.228 11.442 4.613 1.00 59.58 O ATOM 574 ND2 ASN A 827 19.184 13.412 4.429 1.00 65.42 N ATOM 575 HD22 ASN A 827 18.690 14.190 4.911 1.00 0.00 H ATOM 576 HD21 ASN A 827 19.320 13.442 3.398 1.00 0.00 H ATOM 577 H ASN A 827 20.304 9.896 5.877 1.00 0.00 H ATOM 578 N ALA A 828 17.417 9.394 6.231 1.00 53.48 N ATOM 579 CA ALA A 828 16.097 8.852 5.828 1.00 55.84 C ATOM 580 C ALA A 828 15.181 8.693 7.054 1.00 55.37 C ATOM 581 O ALA A 828 13.961 8.687 6.862 1.00 59.57 O ATOM 582 CB ALA A 828 16.270 7.539 5.106 1.00 55.13 C ATOM 583 H ALA A 828 18.247 8.770 6.171 1.00 0.00 H ATOM 584 N TYR A 829 15.731 8.548 8.266 1.00 52.36 N ATOM 585 CA TYR A 829 14.945 8.334 9.506 1.00 50.94 C ATOM 586 C TYR A 829 15.648 8.958 10.718 1.00 52.30 C ATOM 587 O TYR A 829 16.882 9.217 10.670 1.00 51.01 O ATOM 588 CB TYR A 829 14.728 6.838 9.752 1.00 49.37 C ATOM 589 CG TYR A 829 15.998 6.047 9.923 1.00 46.87 C ATOM 590 CD1 TYR A 829 16.609 5.931 11.163 1.00 44.84 C ATOM 591 CD2 TYR A 829 16.621 5.451 8.835 1.00 46.79 C ATOM 592 CE1 TYR A 829 17.788 5.220 11.321 1.00 43.23 C ATOM 593 CE2 TYR A 829 17.808 4.747 8.970 1.00 44.32 C ATOM 594 CZ TYR A 829 18.395 4.630 10.223 1.00 45.28 C ATOM 595 OH TYR A 829 19.565 3.941 10.380 1.00 42.58 O ATOM 596 HH TYR A 829 19.435 3.003 10.093 1.00 0.00 H ATOM 597 H TYR A 829 16.767 8.588 8.343 1.00 0.00 H ATOM 598 N ASP A 830 14.855 9.225 11.761 1.00 52.94 N ATOM 599 CA ASP A 830 15.316 9.506 13.147 1.00 52.81 C ATOM 600 C ASP A 830 14.974 8.279 14.001 1.00 50.85 C ATOM 601 O ASP A 830 14.039 7.550 13.609 1.00 49.88 O ATOM 602 CB ASP A 830 14.663 10.775 13.708 1.00 56.61 C ATOM 603 CG ASP A 830 15.323 12.068 13.253 1.00 59.56 C ATOM 604 OD1 ASP A 830 16.561 12.057 13.062 1.00 59.62 O ATOM 605 OD2 ASP A 830 14.598 13.073 13.092 1.00 62.40 O ATOM 606 H ASP A 830 13.829 9.237 11.589 1.00 0.00 H ATOM 607 N LEU A 831 15.697 8.083 15.105 1.00 48.87 N ATOM 608 CA LEU A 831 15.534 6.945 16.047 1.00 46.39 C ATOM 609 C LEU A 831 15.040 7.441 17.400 1.00 46.62 C ATOM 610 O LEU A 831 15.642 8.400 17.941 1.00 46.88 O ATOM 611 CB LEU A 831 16.887 6.262 16.229 1.00 44.56 C ATOM 612 CG LEU A 831 17.393 5.497 15.018 1.00 43.30 C ATOM 613 CD1 LEU A 831 18.815 5.019 15.269 1.00 42.32 C ATOM 614 CD2 LEU A 831 16.469 4.331 14.694 1.00 42.26 C ATOM 615 H LEU A 831 16.434 8.783 15.324 1.00 0.00 H ATOM 616 N GLU A 832 13.989 6.794 17.901 1.00 46.16 N ATOM 617 CA GLU A 832 13.496 6.943 19.293 1.00 46.73 C ATOM 618 C GLU A 832 13.619 5.582 19.987 1.00 44.70 C ATOM 619 O GLU A 832 13.188 4.574 19.385 1.00 39.11 O ATOM 620 CB GLU A 832 12.059 7.465 19.300 1.00 49.44 C ATOM 621 CG GLU A 832 11.959 8.951 19.001 1.00 52.07 C ATOM 622 CD GLU A 832 10.580 9.416 18.561 1.00 53.99 C ATOM 623 OE1 GLU A 832 9.733 8.554 18.252 1.00 54.26 O ATOM 624 OE2 GLU A 832 10.361 10.638 18.524 1.00 55.88 O ATOM 625 H GLU A 832 13.479 6.140 17.274 1.00 0.00 H ATOM 626 N VAL A 833 14.206 5.571 21.189 1.00 44.28 N ATOM 627 CA VAL A 833 14.339 4.333 22.008 1.00 43.31 C ATOM 628 C VAL A 833 12.997 4.097 22.709 1.00 43.35 C ATOM 629 O VAL A 833 12.598 4.939 23.512 1.00 46.49 O ATOM 630 CB VAL A 833 15.519 4.419 22.994 1.00 43.52 C ATOM 631 CG1 VAL A 833 15.664 3.142 23.799 1.00 43.62 C ATOM 632 CG2 VAL A 833 16.818 4.712 22.272 1.00 43.77 C ATOM 633 H VAL A 833 14.585 6.463 21.567 1.00 0.00 H ATOM 634 N ILE A 834 12.299 3.018 22.368 1.00 43.13 N ATOM 635 CA ILE A 834 11.024 2.614 23.031 1.00 43.47 C ATOM 636 C ILE A 834 11.365 1.929 24.364 1.00 42.39 C ATOM 637 O ILE A 834 10.991 2.460 25.428 1.00 39.76 O ATOM 638 CB ILE A 834 10.178 1.714 22.107 1.00 44.70 C ATOM 639 CG1 ILE A 834 9.685 2.461 20.864 1.00 47.87 C ATOM 640 CG2 ILE A 834 9.020 1.105 22.872 1.00 46.81 C ATOM 641 CD1 ILE A 834 9.287 1.557 19.714 1.00 48.33 C ATOM 642 H ILE A 834 12.661 2.422 21.596 1.00 0.00 H ATOM 643 N ASP A 835 12.059 0.793 24.306 1.00 40.54 N ATOM 644 CA ASP A 835 12.410 -0.023 25.498 1.00 41.01 C ATOM 645 C ASP A 835 13.904 -0.323 25.453 1.00 39.23 C ATOM 646 O ASP A 835 14.432 -0.539 24.342 1.00 40.20 O ATOM 647 CB ASP A 835 11.620 -1.333 25.529 1.00 42.70 C ATOM 648 CG ASP A 835 10.129 -1.160 25.787 1.00 47.80 C ATOM 649 OD1 ASP A 835 9.776 -0.376 26.701 1.00 48.78 O ATOM 650 OD2 ASP A 835 9.323 -1.824 25.073 1.00 49.88 O ATOM 651 H ASP A 835 12.373 0.458 23.373 1.00 0.00 H ATOM 652 N ILE A 836 14.555 -0.371 26.612 1.00 38.11 N ATOM 653 CA ILE A 836 15.946 -0.888 26.736 1.00 35.97 C ATOM 654 C ILE A 836 15.878 -2.139 27.599 1.00 35.55 C ATOM 655 O ILE A 836 15.326 -2.050 28.704 1.00 34.74 O ATOM 656 CB ILE A 836 16.906 0.138 27.361 1.00 37.07 C ATOM 657 CG1 ILE A 836 16.866 1.495 26.644 1.00 37.72 C ATOM 658 CG2 ILE A 836 18.312 -0.450 27.435 1.00 36.77 C ATOM 659 CD1 ILE A 836 17.488 2.627 27.434 1.00 38.39 C ATOM 660 H ILE A 836 14.072 -0.033 27.469 1.00 0.00 H ATOM 661 N PHE A 837 16.477 -3.228 27.127 1.00 33.76 N ATOM 662 CA PHE A 837 16.550 -4.511 27.862 1.00 34.41 C ATOM 663 C PHE A 837 18.011 -4.795 28.202 1.00 34.13 C ATOM 664 O PHE A 837 18.878 -4.697 27.332 1.00 34.28 O ATOM 665 CB PHE A 837 15.905 -5.636 27.052 1.00 32.57 C ATOM 666 CG PHE A 837 14.460 -5.381 26.724 1.00 33.42 C ATOM 667 CD1 PHE A 837 13.460 -5.667 27.642 1.00 34.12 C ATOM 668 CD2 PHE A 837 14.105 -4.820 25.513 1.00 34.32 C ATOM 669 CE1 PHE A 837 12.131 -5.419 27.345 1.00 35.64 C ATOM 670 CE2 PHE A 837 12.774 -4.561 25.219 1.00 35.27 C ATOM 671 CZ PHE A 837 11.789 -4.856 26.133 1.00 36.34 C ATOM 672 H PHE A 837 16.920 -3.176 26.187 1.00 0.00 H ATOM 673 N LYS A 838 18.251 -5.150 29.454 1.00 35.29 N ATOM 674 CA LYS A 838 19.514 -5.775 29.879 1.00 39.13 C ATOM 675 C LYS A 838 19.346 -7.270 29.606 1.00 35.92 C ATOM 676 O LYS A 838 18.296 -7.829 29.989 1.00 36.36 O ATOM 677 CB LYS A 838 19.828 -5.407 31.332 1.00 43.79 C ATOM 678 CG LYS A 838 21.192 -5.863 31.814 1.00 49.71 C ATOM 679 CD LYS A 838 21.695 -5.100 33.037 1.00 56.85 C ATOM 680 CE LYS A 838 23.153 -5.375 33.348 1.00 61.19 C ATOM 681 NZ LYS A 838 23.975 -5.399 32.112 1.00 63.05 N ATOM 682 HZ1 LYS A 838 23.625 -6.146 31.479 1.00 0.00 H ATOM 683 HZ2 LYS A 838 23.907 -4.478 31.634 1.00 0.00 H ATOM 684 HZ3 LYS A 838 24.967 -5.589 32.360 1.00 0.00 H ATOM 685 H LYS A 838 17.515 -4.980 30.169 1.00 0.00 H ATOM 686 N ILE A 839 20.310 -7.878 28.915 1.00 33.04 N ATOM 687 CA ILE A 839 20.225 -9.309 28.527 1.00 34.46 C ATOM 688 C ILE A 839 21.474 -10.059 28.987 1.00 36.14 C ATOM 689 O ILE A 839 22.559 -9.470 29.043 1.00 36.16 O ATOM 690 CB ILE A 839 19.981 -9.482 27.023 1.00 34.40 C ATOM 691 CG1 ILE A 839 21.040 -8.767 26.179 1.00 33.53 C ATOM 692 CG2 ILE A 839 18.564 -9.041 26.674 1.00 34.42 C ATOM 693 CD1 ILE A 839 20.961 -9.103 24.716 1.00 34.55 C ATOM 694 H ILE A 839 21.150 -7.332 28.638 1.00 0.00 H ATOM 695 N GLU A 840 21.275 -11.340 29.274 1.00 39.14 N ATOM 696 CA GLU A 840 22.291 -12.289 29.772 1.00 42.81 C ATOM 697 C GLU A 840 21.982 -13.644 29.127 1.00 39.69 C ATOM 698 O GLU A 840 21.055 -14.307 29.578 1.00 39.20 O ATOM 699 CB GLU A 840 22.233 -12.286 31.297 1.00 49.47 C ATOM 700 CG GLU A 840 23.169 -13.275 31.972 1.00 58.67 C ATOM 701 CD GLU A 840 24.609 -12.807 32.069 1.00 62.53 C ATOM 702 OE1 GLU A 840 25.077 -12.194 31.092 1.00 65.49 O ATOM 703 OE2 GLU A 840 25.253 -13.053 33.118 1.00 66.22 O ATOM 704 H GLU A 840 20.313 -11.710 29.135 1.00 0.00 H ATOM 705 N ARG A 841 22.643 -13.972 28.020 1.00 37.10 N ATOM 706 CA ARG A 841 22.509 -15.307 27.378 1.00 38.47 C ATOM 707 C ARG A 841 22.983 -16.360 28.385 1.00 38.95 C ATOM 708 O ARG A 841 24.017 -16.129 29.038 1.00 38.06 O ATOM 709 CB ARG A 841 23.289 -15.385 26.059 1.00 38.36 C ATOM 710 CG ARG A 841 22.634 -14.657 24.896 1.00 40.49 C ATOM 711 CD ARG A 841 23.303 -14.925 23.553 1.00 42.45 C ATOM 712 NE ARG A 841 23.285 -16.357 23.320 1.00 43.90 N ATOM 713 CZ ARG A 841 24.342 -17.162 23.327 1.00 47.04 C ATOM 714 NH1 ARG A 841 25.570 -16.683 23.464 1.00 47.13 N ATOM 715 NH2 ARG A 841 24.156 -18.458 23.145 1.00 49.50 N ATOM 716 HE ARG A 841 22.360 -16.793 23.130 1.00 0.00 H ATOM 717 HH12 ARG A 841 26.384 -17.331 23.467 1.00 0.00 H ATOM 718 HH11 ARG A 841 25.720 -15.659 23.569 1.00 0.00 H ATOM 719 HH22 ARG A 841 24.970 -19.105 23.147 1.00 0.00 H ATOM 720 HH21 ARG A 841 23.196 -18.830 23.000 1.00 0.00 H ATOM 721 H ARG A 841 23.276 -13.269 27.588 1.00 0.00 H ATOM 722 N GLU A 842 22.227 -17.448 28.529 1.00 39.88 N ATOM 723 CA GLU A 842 22.650 -18.653 29.285 1.00 46.13 C ATOM 724 C GLU A 842 24.098 -19.009 28.911 1.00 45.45 C ATOM 725 O GLU A 842 24.386 -19.131 27.713 1.00 41.65 O ATOM 726 CB GLU A 842 21.669 -19.780 28.973 1.00 49.92 C ATOM 727 CG GLU A 842 22.002 -21.115 29.594 1.00 55.28 C ATOM 728 CD GLU A 842 20.789 -22.032 29.596 1.00 60.72 C ATOM 729 OE1 GLU A 842 19.671 -21.551 29.931 1.00 64.28 O ATOM 730 OE2 GLU A 842 20.946 -23.205 29.244 1.00 65.53 O ATOM 731 H GLU A 842 21.286 -17.453 28.086 1.00 0.00 H ATOM 732 N GLY A 843 24.971 -19.095 29.916 1.00 48.98 N ATOM 733 CA GLY A 843 26.361 -19.574 29.822 1.00 52.66 C ATOM 734 C GLY A 843 27.290 -18.644 29.057 1.00 55.64 C ATOM 735 O GLY A 843 28.495 -18.944 29.026 1.00 53.07 O ATOM 736 H GLY A 843 24.639 -18.795 30.855 1.00 0.00 H ATOM 737 N GLU A 844 26.789 -17.571 28.429 1.00 58.94 N ATOM 738 CA GLU A 844 27.652 -16.640 27.651 1.00 58.44 C ATOM 739 C GLU A 844 28.724 -16.063 28.592 1.00 60.64 C ATOM 740 O GLU A 844 29.826 -15.752 28.061 1.00 61.26 O ATOM 741 CB GLU A 844 26.845 -15.549 26.938 1.00 58.46 C ATOM 742 CG GLU A 844 27.646 -14.760 25.912 1.00 54.95 C ATOM 743 CD GLU A 844 26.872 -13.689 25.147 1.00 55.67 C ATOM 744 OE1 GLU A 844 26.416 -12.735 25.793 1.00 58.63 O ATOM 745 OE2 GLU A 844 26.729 -13.796 23.903 1.00 51.12 O ATOM 746 H GLU A 844 25.768 -17.383 28.487 1.00 0.00 H ATOM 747 N CYS A 845 28.446 -15.962 29.908 1.00 57.10 N ATOM 748 CA CYS A 845 29.445 -15.609 30.961 1.00 56.80 C ATOM 749 C CYS A 845 30.658 -16.548 30.848 1.00 61.13 C ATOM 750 O CYS A 845 31.699 -16.066 30.340 1.00 62.39 O ATOM 751 CB CYS A 845 28.868 -15.642 32.376 1.00 56.66 C ATOM 752 SG CYS A 845 30.117 -15.802 33.692 1.00 68.61 S ATOM 753 H CYS A 845 27.468 -16.143 30.211 1.00 0.00 H ATOM 754 N GLN A 846 30.533 -17.813 31.303 1.00 59.03 N ATOM 755 CA GLN A 846 31.554 -18.896 31.184 1.00 58.73 C ATOM 756 C GLN A 846 32.229 -18.840 29.807 1.00 52.73 C ATOM 757 O GLN A 846 33.457 -19.024 29.772 1.00 49.84 O ATOM 758 CB GLN A 846 30.948 -20.295 31.348 1.00 63.26 C ATOM 759 CG GLN A 846 30.526 -20.641 32.767 1.00 69.17 C ATOM 760 CD GLN A 846 31.520 -21.528 33.470 1.00 75.78 C ATOM 761 OE1 GLN A 846 32.732 -21.399 33.300 1.00 81.86 O ATOM 762 NE2 GLN A 846 31.003 -22.452 34.266 1.00 83.51 N ATOM 763 HE22 GLN A 846 29.972 -22.523 34.379 1.00 0.00 H ATOM 764 HE21 GLN A 846 31.629 -23.106 34.778 1.00 0.00 H ATOM 765 H GLN A 846 29.642 -18.056 31.781 1.00 0.00 H ATOM 766 N ARG A 847 31.469 -18.626 28.724 1.00 49.14 N ATOM 767 CA ARG A 847 32.027 -18.582 27.341 1.00 52.14 C ATOM 768 C ARG A 847 32.970 -17.377 27.164 1.00 51.57 C ATOM 769 O ARG A 847 33.929 -17.476 26.380 1.00 51.68 O ATOM 770 CB ARG A 847 30.944 -18.554 26.256 1.00 52.87 C ATOM 771 CG ARG A 847 31.530 -18.707 24.852 1.00 56.31 C ATOM 772 CD ARG A 847 30.549 -18.728 23.691 1.00 56.60 C ATOM 773 NE ARG A 847 30.100 -17.397 23.322 1.00 53.72 N ATOM 774 CZ ARG A 847 29.195 -17.118 22.383 1.00 52.65 C ATOM 775 NH1 ARG A 847 28.637 -18.084 21.674 1.00 51.00 N ATOM 776 NH2 ARG A 847 28.855 -15.858 22.154 1.00 52.46 N ATOM 777 HE ARG A 847 30.519 -16.594 23.833 1.00 0.00 H ATOM 778 HH12 ARG A 847 27.933 -17.853 20.945 1.00 0.00 H ATOM 779 HH11 ARG A 847 28.902 -19.075 21.846 1.00 0.00 H ATOM 780 HH22 ARG A 847 28.150 -15.634 21.423 1.00 0.00 H ATOM 781 HH21 ARG A 847 29.293 -15.093 22.705 1.00 0.00 H ATOM 782 H ARG A 847 30.447 -18.485 28.853 1.00 0.00 H ATOM 783 N TYR A 848 32.722 -16.278 27.867 1.00 54.58 N ATOM 784 CA TYR A 848 33.426 -14.981 27.679 1.00 55.44 C ATOM 785 C TYR A 848 34.659 -14.916 28.593 1.00 55.68 C ATOM 786 O TYR A 848 35.550 -14.069 28.365 1.00 59.09 O ATOM 787 CB TYR A 848 32.411 -13.859 27.903 1.00 54.57 C ATOM 788 CG TYR A 848 32.896 -12.481 27.549 1.00 53.19 C ATOM 789 CD1 TYR A 848 33.240 -12.173 26.241 1.00 47.53 C ATOM 790 CD2 TYR A 848 32.977 -11.483 28.511 1.00 51.09 C ATOM 791 CE1 TYR A 848 33.659 -10.906 25.889 1.00 47.60 C ATOM 792 CE2 TYR A 848 33.421 -10.212 28.174 1.00 53.08 C ATOM 793 CZ TYR A 848 33.750 -9.920 26.856 1.00 50.82 C ATOM 794 OH TYR A 848 34.184 -8.677 26.495 1.00 47.72 O ATOM 795 HH TYR A 848 35.013 -8.461 26.992 1.00 0.00 H ATOM 796 H TYR A 848 31.985 -16.327 28.599 1.00 0.00 H ATOM 797 N LYS A 849 34.738 -15.845 29.543 1.00 54.78 N ATOM 798 CA LYS A 849 35.808 -15.950 30.568 1.00 59.53 C ATOM 799 C LYS A 849 37.208 -15.811 29.961 1.00 58.70 C ATOM 800 O LYS A 849 38.015 -15.069 30.504 1.00 61.77 O ATOM 801 CB LYS A 849 35.669 -17.273 31.324 1.00 63.07 C ATOM 802 CG LYS A 849 36.581 -17.438 32.535 1.00 67.29 C ATOM 803 CD LYS A 849 36.729 -18.873 33.006 1.00 70.07 C ATOM 804 CE LYS A 849 35.439 -19.665 32.962 1.00 71.40 C ATOM 805 NZ LYS A 849 35.585 -20.980 33.632 1.00 75.77 N ATOM 806 HZ1 LYS A 849 36.326 -21.531 33.154 1.00 0.00 H ATOM 807 HZ2 LYS A 849 35.848 -20.833 34.627 1.00 0.00 H ATOM 808 HZ3 LYS A 849 34.683 -21.495 33.583 1.00 0.00 H ATOM 809 H LYS A 849 33.984 -16.561 29.570 1.00 0.00 H ATOM 810 N PRO A 850 37.584 -16.519 28.867 1.00 56.24 N ATOM 811 CA PRO A 850 38.931 -16.393 28.303 1.00 56.94 C ATOM 812 C PRO A 850 39.322 -14.985 27.822 1.00 57.50 C ATOM 813 O PRO A 850 40.511 -14.764 27.677 1.00 59.93 O ATOM 814 CB PRO A 850 38.924 -17.317 27.074 1.00 55.94 C ATOM 815 CG PRO A 850 37.768 -18.273 27.329 1.00 56.84 C ATOM 816 CD PRO A 850 36.754 -17.468 28.110 1.00 55.14 C ATOM 817 N PHE A 851 38.341 -14.099 27.591 1.00 52.62 N ATOM 818 CA PHE A 851 38.517 -12.738 27.011 1.00 54.26 C ATOM 819 C PHE A 851 38.158 -11.651 28.040 1.00 56.61 C ATOM 820 O PHE A 851 38.326 -10.456 27.725 1.00 53.34 O ATOM 821 CB PHE A 851 37.699 -12.630 25.713 1.00 48.41 C ATOM 822 CG PHE A 851 38.245 -13.487 24.599 1.00 48.45 C ATOM 823 CD1 PHE A 851 39.431 -13.146 23.962 1.00 49.88 C ATOM 824 CD2 PHE A 851 37.636 -14.683 24.247 1.00 48.57 C ATOM 825 CE1 PHE A 851 39.960 -13.945 22.957 1.00 49.77 C ATOM 826 CE2 PHE A 851 38.173 -15.492 23.256 1.00 47.31 C ATOM 827 CZ PHE A 851 39.328 -15.119 22.608 1.00 49.97 C ATOM 828 H PHE A 851 37.373 -14.388 27.839 1.00 0.00 H ATOM 829 N LYS A 852 37.714 -12.054 29.239 1.00 62.90 N ATOM 830 CA LYS A 852 37.111 -11.187 30.300 1.00 63.15 C ATOM 831 C LYS A 852 38.009 -9.993 30.667 1.00 59.70 C ATOM 832 O LYS A 852 37.442 -8.904 30.973 1.00 55.50 O ATOM 833 CB LYS A 852 36.871 -11.983 31.596 1.00 71.42 C ATOM 834 CG LYS A 852 35.415 -12.253 31.974 1.00 74.39 C ATOM 835 CD LYS A 852 34.383 -11.232 31.478 1.00 73.44 C ATOM 836 CE LYS A 852 34.543 -9.822 32.017 1.00 73.42 C ATOM 837 NZ LYS A 852 34.306 -8.804 30.959 1.00 65.42 N ATOM 838 HZ1 LYS A 852 34.990 -8.942 30.188 1.00 0.00 H ATOM 839 HZ2 LYS A 852 33.339 -8.908 30.590 1.00 0.00 H ATOM 840 HZ3 LYS A 852 34.424 -7.853 31.362 1.00 0.00 H ATOM 841 H LYS A 852 37.797 -13.068 29.453 1.00 0.00 H ATOM 842 N GLN A 853 39.329 -10.205 30.722 1.00 54.66 N ATOM 843 CA GLN A 853 40.318 -9.192 31.175 1.00 60.46 C ATOM 844 C GLN A 853 41.261 -8.810 30.022 1.00 58.79 C ATOM 845 O GLN A 853 42.334 -8.242 30.301 1.00 58.05 O ATOM 846 CB GLN A 853 41.107 -9.742 32.363 1.00 67.61 C ATOM 847 CG GLN A 853 40.226 -10.429 33.402 1.00 71.10 C ATOM 848 CD GLN A 853 41.008 -11.116 34.491 1.00 75.95 C ATOM 849 OE1 GLN A 853 40.455 -11.470 35.531 1.00 84.73 O ATOM 850 NE2 GLN A 853 42.295 -11.322 34.259 1.00 75.29 N ATOM 851 HE22 GLN A 853 42.719 -11.005 33.364 1.00 0.00 H ATOM 852 HE21 GLN A 853 42.882 -11.801 34.972 1.00 0.00 H ATOM 853 H GLN A 853 39.685 -11.137 30.429 1.00 0.00 H ATOM 854 N LEU A 854 40.896 -9.126 28.771 1.00 52.87 N ATOM 855 CA LEU A 854 41.570 -8.556 27.579 1.00 49.06 C ATOM 856 C LEU A 854 41.293 -7.060 27.621 1.00 45.64 C ATOM 857 O LEU A 854 40.179 -6.697 27.983 1.00 44.34 O ATOM 858 CB LEU A 854 41.023 -9.184 26.296 1.00 45.95 C ATOM 859 CG LEU A 854 41.730 -8.771 25.009 1.00 45.24 C ATOM 860 CD1 LEU A 854 43.198 -9.158 25.042 1.00 47.00 C ATOM 861 CD2 LEU A 854 41.035 -9.380 23.798 1.00 43.86 C ATOM 862 H LEU A 854 40.112 -9.795 28.631 1.00 0.00 H ATOM 863 N HIS A 855 42.279 -6.237 27.295 1.00 43.41 N ATOM 864 CA HIS A 855 42.144 -4.756 27.234 1.00 42.23 C ATOM 865 C HIS A 855 41.229 -4.351 26.070 1.00 38.92 C ATOM 866 O HIS A 855 40.912 -5.187 25.193 1.00 38.85 O ATOM 867 CB HIS A 855 43.537 -4.118 27.136 1.00 43.99 C ATOM 868 CG HIS A 855 44.287 -4.542 25.915 1.00 43.36 C ATOM 869 ND1 HIS A 855 44.816 -5.814 25.776 1.00 44.20 N ATOM 870 CD2 HIS A 855 44.578 -3.885 24.771 1.00 42.11 C ATOM 871 CE1 HIS A 855 45.428 -5.910 24.607 1.00 44.51 C ATOM 872 NE2 HIS A 855 45.295 -4.740 23.970 1.00 42.28 N ATOM 873 H HIS A 855 43.205 -6.652 27.068 1.00 0.00 H ATOM 874 N ASN A 856 40.816 -3.090 26.050 1.00 38.16 N ATOM 875 CA ASN A 856 40.093 -2.472 24.916 1.00 36.62 C ATOM 876 C ASN A 856 38.789 -3.255 24.710 1.00 36.39 C ATOM 877 O ASN A 856 38.564 -3.851 23.655 1.00 36.94 O ATOM 878 CB ASN A 856 40.998 -2.381 23.684 1.00 35.52 C ATOM 879 CG ASN A 856 40.358 -1.626 22.547 1.00 35.02 C ATOM 880 OD1 ASN A 856 39.484 -0.787 22.775 1.00 35.46 O ATOM 881 ND2 ASN A 856 40.722 -1.980 21.325 1.00 32.44 N ATOM 882 HD22 ASN A 856 41.466 -2.694 21.190 1.00 0.00 H ATOM 883 HD21 ASN A 856 40.264 -1.544 20.499 1.00 0.00 H ATOM 884 H ASN A 856 41.013 -2.499 26.883 1.00 0.00 H ATOM 885 N ARG A 857 37.961 -3.255 25.729 1.00 38.76 N ATOM 886 CA ARG A 857 36.593 -3.809 25.690 1.00 39.10 C ATOM 887 C ARG A 857 35.655 -2.627 25.473 1.00 36.77 C ATOM 888 O ARG A 857 35.800 -1.632 26.188 1.00 37.13 O ATOM 889 CB ARG A 857 36.381 -4.621 26.966 1.00 42.78 C ATOM 890 CG ARG A 857 37.306 -5.828 27.015 1.00 46.70 C ATOM 891 CD ARG A 857 37.522 -6.409 28.386 1.00 51.09 C ATOM 892 NE ARG A 857 36.350 -6.205 29.196 1.00 56.26 N ATOM 893 CZ ARG A 857 36.332 -5.541 30.348 1.00 60.45 C ATOM 894 NH1 ARG A 857 35.189 -5.395 31.004 1.00 62.64 N ATOM 895 NH2 ARG A 857 37.453 -5.051 30.856 1.00 62.08 N ATOM 896 HE ARG A 857 35.453 -6.606 28.856 1.00 0.00 H ATOM 897 HH12 ARG A 857 35.169 -4.877 31.905 1.00 0.00 H ATOM 898 HH11 ARG A 857 34.312 -5.799 30.617 1.00 0.00 H ATOM 899 HH22 ARG A 857 37.432 -4.533 31.757 1.00 0.00 H ATOM 900 HH21 ARG A 857 38.354 -5.185 30.353 1.00 0.00 H ATOM 901 H ARG A 857 38.291 -2.837 26.623 1.00 0.00 H ATOM 902 N ARG A 858 34.760 -2.759 24.491 1.00 36.82 N ATOM 903 CA ARG A 858 34.011 -1.650 23.864 1.00 37.38 C ATOM 904 C ARG A 858 32.549 -2.061 23.715 1.00 33.48 C ATOM 905 O ARG A 858 32.303 -3.190 23.324 1.00 30.83 O ATOM 906 CB ARG A 858 34.638 -1.342 22.505 1.00 41.94 C ATOM 907 CG ARG A 858 34.792 0.139 22.228 1.00 51.66 C ATOM 908 CD ARG A 858 36.132 0.508 21.621 1.00 58.49 C ATOM 909 NE ARG A 858 36.261 1.955 21.675 1.00 66.26 N ATOM 910 CZ ARG A 858 36.912 2.706 20.801 1.00 71.84 C ATOM 911 NH1 ARG A 858 37.549 2.165 19.771 1.00 71.76 N ATOM 912 NH2 ARG A 858 36.926 4.016 20.976 1.00 76.62 N ATOM 913 HE ARG A 858 35.801 2.443 22.470 1.00 0.00 H ATOM 914 HH12 ARG A 858 38.055 2.772 19.095 1.00 0.00 H ATOM 915 HH11 ARG A 858 37.543 1.133 19.639 1.00 0.00 H ATOM 916 HH22 ARG A 858 37.431 4.625 20.302 1.00 0.00 H ATOM 917 HH21 ARG A 858 36.432 4.437 21.788 1.00 0.00 H ATOM 918 H ARG A 858 34.575 -3.720 24.139 1.00 0.00 H ATOM 919 N LEU A 859 31.630 -1.166 24.049 1.00 31.62 N ATOM 920 CA LEU A 859 30.175 -1.389 23.925 1.00 30.84 C ATOM 921 C LEU A 859 29.748 -0.888 22.546 1.00 31.54 C ATOM 922 O LEU A 859 29.738 0.329 22.335 1.00 31.44 O ATOM 923 CB LEU A 859 29.455 -0.649 25.055 1.00 31.65 C ATOM 924 CG LEU A 859 28.020 -1.111 25.304 1.00 31.60 C ATOM 925 CD1 LEU A 859 27.996 -2.526 25.877 1.00 31.45 C ATOM 926 CD2 LEU A 859 27.287 -0.142 26.219 1.00 33.55 C ATOM 927 H LEU A 859 31.953 -0.250 24.421 1.00 0.00 H ATOM 928 N LEU A 860 29.431 -1.807 21.639 1.00 30.97 N ATOM 929 CA LEU A 860 29.223 -1.505 20.205 1.00 29.80 C ATOM 930 C LEU A 860 27.872 -2.039 19.741 1.00 29.66 C ATOM 931 O LEU A 860 27.380 -3.025 20.319 1.00 28.19 O ATOM 932 CB LEU A 860 30.366 -2.124 19.402 1.00 29.55 C ATOM 933 CG LEU A 860 31.756 -1.600 19.747 1.00 30.82 C ATOM 934 CD1 LEU A 860 32.826 -2.402 19.046 1.00 31.21 C ATOM 935 CD2 LEU A 860 31.892 -0.124 19.402 1.00 30.83 C ATOM 936 H LEU A 860 29.323 -2.792 21.954 1.00 0.00 H ATOM 937 N TRP A 861 27.358 -1.431 18.677 1.00 28.11 N ATOM 938 CA TRP A 861 26.060 -1.766 18.052 1.00 28.07 C ATOM 939 C TRP A 861 26.187 -2.966 17.111 1.00 28.85 C ATOM 940 O TRP A 861 27.200 -3.088 16.381 1.00 27.55 O ATOM 941 CB TRP A 861 25.507 -0.563 17.292 1.00 28.42 C ATOM 942 CG TRP A 861 25.352 0.679 18.105 1.00 29.30 C ATOM 943 CD1 TRP A 861 26.132 1.796 18.055 1.00 30.36 C ATOM 944 CD2 TRP A 861 24.309 0.963 19.051 1.00 30.96 C ATOM 945 NE1 TRP A 861 25.667 2.739 18.924 1.00 30.92 N ATOM 946 CE2 TRP A 861 24.555 2.256 19.557 1.00 31.04 C ATOM 947 CE3 TRP A 861 23.227 0.239 19.555 1.00 30.96 C ATOM 948 CZ2 TRP A 861 23.743 2.844 20.518 1.00 32.31 C ATOM 949 CZ3 TRP A 861 22.415 0.825 20.499 1.00 32.07 C ATOM 950 CH2 TRP A 861 22.674 2.113 20.975 1.00 33.25 C ATOM 951 HE1 TRP A 861 26.091 3.676 19.080 1.00 0.00 H ATOM 952 H TRP A 861 27.911 -0.660 18.251 1.00 0.00 H ATOM 953 N HIS A 862 25.148 -3.805 17.108 1.00 28.22 N ATOM 954 CA HIS A 862 24.880 -4.798 16.049 1.00 29.31 C ATOM 955 C HIS A 862 23.386 -4.791 15.730 1.00 29.22 C ATOM 956 O HIS A 862 22.597 -5.092 16.626 1.00 30.04 O ATOM 957 CB HIS A 862 25.369 -6.179 16.452 1.00 29.63 C ATOM 958 CG HIS A 862 25.129 -7.197 15.384 1.00 29.94 C ATOM 959 ND1 HIS A 862 26.097 -7.545 14.461 1.00 30.21 N ATOM 960 CD2 HIS A 862 24.043 -7.938 15.090 1.00 30.78 C ATOM 961 CE1 HIS A 862 25.621 -8.489 13.669 1.00 30.74 C ATOM 962 NE2 HIS A 862 24.372 -8.755 14.040 1.00 31.83 N ATOM 963 H HIS A 862 24.483 -3.755 17.906 1.00 0.00 H ATOM 964 N GLY A 863 23.050 -4.434 14.496 1.00 30.83 N ATOM 965 CA GLY A 863 21.697 -4.489 13.931 1.00 33.11 C ATOM 966 C GLY A 863 21.501 -5.743 13.109 1.00 33.60 C ATOM 967 O GLY A 863 22.479 -6.231 12.494 1.00 33.64 O ATOM 968 H GLY A 863 23.810 -4.086 13.878 1.00 0.00 H ATOM 969 N SER A 864 20.268 -6.238 13.115 1.00 33.72 N ATOM 970 CA SER A 864 19.816 -7.412 12.338 1.00 35.83 C ATOM 971 C SER A 864 18.304 -7.331 12.161 1.00 35.48 C ATOM 972 O SER A 864 17.656 -6.626 12.959 1.00 34.37 O ATOM 973 CB SER A 864 20.207 -8.695 13.018 1.00 34.50 C ATOM 974 OG SER A 864 20.413 -9.702 12.051 1.00 37.93 O ATOM 975 HG SER A 864 21.136 -9.423 11.435 1.00 0.00 H ATOM 976 H SER A 864 19.564 -5.761 13.714 1.00 0.00 H ATOM 977 N ARG A 865 17.788 -8.024 11.147 1.00 37.55 N ATOM 978 CA ARG A 865 16.333 -8.196 10.915 1.00 41.75 C ATOM 979 C ARG A 865 15.706 -8.806 12.169 1.00 39.33 C ATOM 980 O ARG A 865 16.322 -9.702 12.807 1.00 36.63 O ATOM 981 CB ARG A 865 16.043 -9.120 9.730 1.00 47.12 C ATOM 982 CG ARG A 865 16.045 -8.434 8.372 1.00 55.35 C ATOM 983 CD ARG A 865 15.585 -9.393 7.280 1.00 60.60 C ATOM 984 NE ARG A 865 15.521 -8.762 5.973 1.00 65.74 N ATOM 985 CZ ARG A 865 16.575 -8.440 5.228 1.00 69.61 C ATOM 986 NH1 ARG A 865 17.805 -8.676 5.663 1.00 73.42 N ATOM 987 NH2 ARG A 865 16.397 -7.868 4.049 1.00 69.16 N ATOM 988 HE ARG A 865 14.579 -8.545 5.590 1.00 0.00 H ATOM 989 HH12 ARG A 865 18.623 -8.421 5.074 1.00 0.00 H ATOM 990 HH11 ARG A 865 17.952 -9.116 6.594 1.00 0.00 H ATOM 991 HH22 ARG A 865 17.219 -7.615 3.464 1.00 0.00 H ATOM 992 HH21 ARG A 865 15.435 -7.671 3.707 1.00 0.00 H ATOM 993 H ARG A 865 18.445 -8.472 10.477 1.00 0.00 H ATOM 994 N THR A 866 14.499 -8.358 12.480 1.00 39.61 N ATOM 995 CA THR A 866 13.733 -8.797 13.662 1.00 39.52 C ATOM 996 C THR A 866 13.599 -10.317 13.639 1.00 40.64 C ATOM 997 O THR A 866 13.742 -10.912 14.718 1.00 40.56 O ATOM 998 CB THR A 866 12.397 -8.068 13.707 1.00 40.22 C ATOM 999 OG1 THR A 866 12.790 -6.715 13.903 1.00 39.98 O ATOM 1000 CG2 THR A 866 11.498 -8.549 14.821 1.00 41.19 C ATOM 1001 HG1 THR A 866 13.361 -6.426 13.148 1.00 0.00 H ATOM 1002 H THR A 866 14.064 -7.653 11.852 1.00 0.00 H ATOM 1003 N THR A 867 13.367 -10.893 12.452 1.00 43.81 N ATOM 1004 CA THR A 867 13.144 -12.346 12.214 1.00 46.37 C ATOM 1005 C THR A 867 14.386 -13.163 12.601 1.00 45.11 C ATOM 1006 O THR A 867 14.269 -14.383 12.634 1.00 46.37 O ATOM 1007 CB THR A 867 12.774 -12.623 10.749 1.00 49.41 C ATOM 1008 OG1 THR A 867 13.706 -11.921 9.927 1.00 52.85 O ATOM 1009 CG2 THR A 867 11.369 -12.190 10.391 1.00 51.88 C ATOM 1010 HG1 THR A 867 13.491 -12.082 8.974 1.00 0.00 H ATOM 1011 H THR A 867 13.340 -10.268 11.621 1.00 0.00 H ATOM 1012 N ASN A 868 15.534 -12.523 12.853 1.00 42.68 N ATOM 1013 CA ASN A 868 16.812 -13.206 13.195 1.00 40.39 C ATOM 1014 C ASN A 868 16.982 -13.310 14.721 1.00 39.17 C ATOM 1015 O ASN A 868 17.859 -14.095 15.165 1.00 37.22 O ATOM 1016 CB ASN A 868 18.018 -12.497 12.568 1.00 39.61 C ATOM 1017 CG ASN A 868 18.019 -12.528 11.053 1.00 41.46 C ATOM 1018 OD1 ASN A 868 17.319 -13.338 10.449 1.00 42.69 O ATOM 1019 ND2 ASN A 868 18.800 -11.653 10.433 1.00 39.07 N ATOM 1020 HD22 ASN A 868 19.375 -10.986 10.986 1.00 0.00 H ATOM 1021 HD21 ASN A 868 18.837 -11.634 9.394 1.00 0.00 H ATOM 1022 H ASN A 868 15.533 -11.484 12.807 1.00 0.00 H ATOM 1023 N PHE A 869 16.201 -12.565 15.517 1.00 38.08 N ATOM 1024 CA PHE A 869 16.525 -12.355 16.955 1.00 37.35 C ATOM 1025 C PHE A 869 16.295 -13.607 17.798 1.00 36.06 C ATOM 1026 O PHE A 869 17.080 -13.771 18.739 1.00 36.85 O ATOM 1027 CB PHE A 869 15.853 -11.112 17.531 1.00 38.32 C ATOM 1028 CG PHE A 869 16.781 -9.940 17.384 1.00 35.56 C ATOM 1029 CD1 PHE A 869 16.836 -9.231 16.203 1.00 36.93 C ATOM 1030 CD2 PHE A 869 17.675 -9.632 18.386 1.00 36.59 C ATOM 1031 CE1 PHE A 869 17.736 -8.193 16.044 1.00 35.34 C ATOM 1032 CE2 PHE A 869 18.557 -8.579 18.233 1.00 35.85 C ATOM 1033 CZ PHE A 869 18.592 -7.872 17.059 1.00 35.55 C ATOM 1034 H PHE A 869 15.348 -12.123 15.120 1.00 0.00 H ATOM 1035 N ALA A 870 15.358 -14.484 17.449 1.00 37.14 N ATOM 1036 CA ALA A 870 15.172 -15.763 18.166 1.00 38.14 C ATOM 1037 C ALA A 870 16.451 -16.596 18.032 1.00 38.91 C ATOM 1038 O ALA A 870 16.859 -17.227 19.021 1.00 37.98 O ATOM 1039 CB ALA A 870 13.967 -16.511 17.641 1.00 39.11 C ATOM 1040 H ALA A 870 14.736 -14.263 16.645 1.00 0.00 H ATOM 1041 N GLY A 871 17.025 -16.656 16.827 1.00 40.35 N ATOM 1042 CA GLY A 871 18.296 -17.364 16.587 1.00 39.47 C ATOM 1043 C GLY A 871 19.441 -16.652 17.281 1.00 37.70 C ATOM 1044 O GLY A 871 20.288 -17.330 17.884 1.00 39.96 O ATOM 1045 H GLY A 871 16.557 -16.185 16.027 1.00 0.00 H ATOM 1046 N ILE A 872 19.485 -15.323 17.219 1.00 36.49 N ATOM 1047 CA ILE A 872 20.621 -14.551 17.812 1.00 37.33 C ATOM 1048 C ILE A 872 20.633 -14.710 19.343 1.00 37.52 C ATOM 1049 O ILE A 872 21.734 -14.946 19.920 1.00 38.22 O ATOM 1050 CB ILE A 872 20.587 -13.077 17.375 1.00 37.68 C ATOM 1051 CG1 ILE A 872 20.923 -12.942 15.885 1.00 39.42 C ATOM 1052 CG2 ILE A 872 21.509 -12.240 18.244 1.00 35.87 C ATOM 1053 CD1 ILE A 872 20.704 -11.543 15.336 1.00 39.59 C ATOM 1054 H ILE A 872 18.713 -14.810 16.748 1.00 0.00 H ATOM 1055 N LEU A 873 19.480 -14.600 20.002 1.00 37.36 N ATOM 1056 CA LEU A 873 19.436 -14.747 21.479 1.00 37.98 C ATOM 1057 C LEU A 873 19.685 -16.214 21.859 1.00 39.71 C ATOM 1058 O LEU A 873 20.501 -16.432 22.784 1.00 42.52 O ATOM 1059 CB LEU A 873 18.115 -14.196 22.022 1.00 37.60 C ATOM 1060 CG LEU A 873 17.910 -12.704 21.752 1.00 38.39 C ATOM 1061 CD1 LEU A 873 16.637 -12.200 22.398 1.00 39.52 C ATOM 1062 CD2 LEU A 873 19.112 -11.892 22.220 1.00 36.62 C ATOM 1063 H LEU A 873 18.603 -14.409 19.477 1.00 0.00 H ATOM 1064 N SER A 874 19.061 -17.184 21.176 1.00 38.98 N ATOM 1065 CA SER A 874 19.204 -18.616 21.532 1.00 41.53 C ATOM 1066 C SER A 874 20.629 -19.096 21.239 1.00 42.20 C ATOM 1067 O SER A 874 21.104 -19.898 22.037 1.00 43.18 O ATOM 1068 CB SER A 874 18.157 -19.503 20.892 1.00 44.05 C ATOM 1069 OG SER A 874 18.296 -19.546 19.485 1.00 46.34 O ATOM 1070 HG SER A 874 18.198 -18.632 19.117 1.00 0.00 H ATOM 1071 H SER A 874 18.457 -16.924 20.370 1.00 0.00 H ATOM 1072 N GLN A 875 21.294 -18.646 20.163 1.00 41.32 N ATOM 1073 CA GLN A 875 22.610 -19.232 19.749 1.00 44.16 C ATOM 1074 C GLN A 875 23.760 -18.226 19.927 1.00 39.99 C ATOM 1075 O GLN A 875 24.926 -18.652 19.851 1.00 41.22 O ATOM 1076 CB GLN A 875 22.617 -19.701 18.290 1.00 47.38 C ATOM 1077 CG GLN A 875 21.421 -20.554 17.879 1.00 52.25 C ATOM 1078 CD GLN A 875 21.265 -21.794 18.716 1.00 58.62 C ATOM 1079 OE1 GLN A 875 22.222 -22.529 18.957 1.00 65.18 O ATOM 1080 NE2 GLN A 875 20.040 -22.039 19.157 1.00 62.49 N ATOM 1081 HE22 GLN A 875 19.264 -21.386 18.926 1.00 0.00 H ATOM 1082 HE21 GLN A 875 19.854 -22.884 19.734 1.00 0.00 H ATOM 1083 H GLN A 875 20.886 -17.871 19.602 1.00 0.00 H ATOM 1084 N GLY A 876 23.466 -16.946 20.127 1.00 36.57 N ATOM 1085 CA GLY A 876 24.480 -15.882 20.095 1.00 35.10 C ATOM 1086 C GLY A 876 24.721 -15.424 18.673 1.00 36.40 C ATOM 1087 O GLY A 876 24.230 -16.105 17.728 1.00 36.71 O ATOM 1088 H GLY A 876 22.477 -16.686 20.314 1.00 0.00 H ATOM 1089 N LEU A 877 25.437 -14.313 18.507 1.00 34.43 N ATOM 1090 CA LEU A 877 25.903 -13.877 17.173 1.00 35.19 C ATOM 1091 C LEU A 877 26.891 -14.917 16.670 1.00 36.82 C ATOM 1092 O LEU A 877 27.759 -15.353 17.455 1.00 36.44 O ATOM 1093 CB LEU A 877 26.565 -12.505 17.234 1.00 35.51 C ATOM 1094 CG LEU A 877 25.602 -11.352 17.467 1.00 35.09 C ATOM 1095 CD1 LEU A 877 26.363 -10.055 17.673 1.00 35.35 C ATOM 1096 CD2 LEU A 877 24.629 -11.237 16.302 1.00 36.45 C ATOM 1097 H LEU A 877 25.675 -13.736 19.339 1.00 0.00 H ATOM 1098 N ARG A 878 26.747 -15.287 15.406 1.00 37.89 N ATOM 1099 CA ARG A 878 27.585 -16.327 14.774 1.00 43.68 C ATOM 1100 C ARG A 878 28.181 -15.772 13.481 1.00 42.05 C ATOM 1101 O ARG A 878 27.617 -14.856 12.883 1.00 41.30 O ATOM 1102 CB ARG A 878 26.744 -17.579 14.541 1.00 45.98 C ATOM 1103 CG ARG A 878 26.602 -18.444 15.784 1.00 51.73 C ATOM 1104 CD ARG A 878 25.668 -19.606 15.531 1.00 58.29 C ATOM 1105 NE ARG A 878 24.371 -19.082 15.113 1.00 64.37 N ATOM 1106 CZ ARG A 878 23.409 -19.782 14.514 1.00 71.86 C ATOM 1107 NH1 ARG A 878 23.572 -21.074 14.259 1.00 72.26 N ATOM 1108 NH2 ARG A 878 22.274 -19.178 14.194 1.00 72.36 N ATOM 1109 HE ARG A 878 24.182 -18.076 15.299 1.00 0.00 H ATOM 1110 HH12 ARG A 878 22.815 -21.611 13.791 1.00 0.00 H ATOM 1111 HH11 ARG A 878 24.457 -21.549 14.527 1.00 0.00 H ATOM 1112 HH22 ARG A 878 21.514 -19.713 13.726 1.00 0.00 H ATOM 1113 HH21 ARG A 878 22.143 -18.169 14.411 1.00 0.00 H ATOM 1114 H ARG A 878 26.012 -14.825 14.833 1.00 0.00 H ATOM 1115 N ILE A 879 29.325 -16.308 13.110 1.00 44.34 N ATOM 1116 CA ILE A 879 30.005 -16.008 11.830 1.00 43.04 C ATOM 1117 C ILE A 879 29.174 -16.661 10.725 1.00 43.99 C ATOM 1118 O ILE A 879 28.739 -17.806 10.905 1.00 42.32 O ATOM 1119 CB ILE A 879 31.452 -16.521 11.927 1.00 46.52 C ATOM 1120 CG1 ILE A 879 32.211 -15.759 13.021 1.00 46.27 C ATOM 1121 CG2 ILE A 879 32.159 -16.455 10.576 1.00 47.90 C ATOM 1122 CD1 ILE A 879 33.550 -16.373 13.396 1.00 49.45 C ATOM 1123 H ILE A 879 29.779 -16.984 13.757 1.00 0.00 H ATOM 1124 N ALA A 880 28.919 -15.937 9.637 1.00 45.11 N ATOM 1125 CA ALA A 880 28.214 -16.459 8.446 1.00 47.06 C ATOM 1126 C ALA A 880 28.860 -17.781 8.042 1.00 47.94 C ATOM 1127 O ALA A 880 30.078 -17.928 8.139 1.00 47.42 O ATOM 1128 CB ALA A 880 28.261 -15.447 7.331 1.00 48.94 C ATOM 1129 H ALA A 880 29.234 -14.946 9.624 1.00 0.00 H ATOM 1130 N PRO A 881 28.075 -18.792 7.608 1.00 50.18 N ATOM 1131 CA PRO A 881 28.645 -20.072 7.202 1.00 53.10 C ATOM 1132 C PRO A 881 29.422 -19.953 5.892 1.00 55.06 C ATOM 1133 O PRO A 881 29.200 -19.033 5.106 1.00 51.79 O ATOM 1134 CB PRO A 881 27.448 -21.016 7.013 1.00 55.30 C ATOM 1135 CG PRO A 881 26.208 -20.222 7.416 1.00 54.21 C ATOM 1136 CD PRO A 881 26.609 -18.761 7.491 1.00 51.77 C ATOM 1137 N PRO A 882 30.333 -20.906 5.599 1.00 60.22 N ATOM 1138 CA PRO A 882 31.151 -20.836 4.387 1.00 63.72 C ATOM 1139 C PRO A 882 30.320 -20.672 3.099 1.00 64.91 C ATOM 1140 O PRO A 882 30.789 -20.029 2.191 1.00 65.02 O ATOM 1141 CB PRO A 882 31.910 -22.175 4.367 1.00 67.41 C ATOM 1142 CG PRO A 882 31.839 -22.701 5.796 1.00 64.84 C ATOM 1143 CD PRO A 882 30.573 -22.125 6.388 1.00 62.13 C ATOM 1144 N GLU A 883 29.099 -21.211 3.072 1.00 67.88 N ATOM 1145 CA GLU A 883 28.211 -21.244 1.879 1.00 72.56 C ATOM 1146 C GLU A 883 27.308 -19.997 1.831 1.00 68.71 C ATOM 1147 O GLU A 883 26.372 -19.982 1.030 1.00 76.09 O ATOM 1148 CB GLU A 883 27.424 -22.568 1.842 1.00 77.68 C ATOM 1149 CG GLU A 883 26.280 -22.684 2.849 1.00 78.94 C ATOM 1150 CD GLU A 883 26.622 -23.182 4.248 1.00 79.20 C ATOM 1151 OE1 GLU A 883 27.825 -23.403 4.530 1.00 79.25 O ATOM 1152 OE2 GLU A 883 25.676 -23.340 5.063 1.00 76.21 O ATOM 1153 H GLU A 883 28.742 -21.640 3.950 1.00 0.00 H ATOM 1154 N ALA A 884 27.560 -18.969 2.635 1.00 65.25 N ATOM 1155 CA ALA A 884 26.891 -17.655 2.490 1.00 61.51 C ATOM 1156 C ALA A 884 27.814 -16.747 1.682 1.00 58.43 C ATOM 1157 O ALA A 884 29.022 -16.933 1.702 1.00 55.23 O ATOM 1158 CB ALA A 884 26.567 -17.073 3.842 1.00 59.15 C ATOM 1159 H ALA A 884 28.256 -19.092 3.398 1.00 0.00 H ATOM 1160 N PRO A 885 27.296 -15.765 0.915 1.00 57.25 N ATOM 1161 CA PRO A 885 28.169 -14.846 0.190 1.00 54.18 C ATOM 1162 C PRO A 885 29.013 -14.000 1.147 1.00 49.50 C ATOM 1163 O PRO A 885 28.547 -13.668 2.222 1.00 46.74 O ATOM 1164 CB PRO A 885 27.199 -13.987 -0.634 1.00 56.70 C ATOM 1165 CG PRO A 885 25.948 -14.837 -0.722 1.00 58.47 C ATOM 1166 CD PRO A 885 25.873 -15.531 0.623 1.00 56.91 C ATOM 1167 N VAL A 886 30.247 -13.692 0.733 1.00 47.83 N ATOM 1168 CA VAL A 886 31.173 -12.785 1.471 1.00 46.61 C ATOM 1169 C VAL A 886 30.800 -11.331 1.137 1.00 46.22 C ATOM 1170 O VAL A 886 31.437 -10.393 1.682 1.00 45.42 O ATOM 1171 CB VAL A 886 32.639 -13.100 1.131 1.00 44.68 C ATOM 1172 CG1 VAL A 886 33.023 -12.529 -0.224 1.00 45.54 C ATOM 1173 CG2 VAL A 886 33.587 -12.615 2.219 1.00 44.33 C ATOM 1174 H VAL A 886 30.581 -14.111 -0.158 1.00 0.00 H ATOM 1175 N THR A 887 29.811 -11.149 0.267 1.00 48.26 N ATOM 1176 CA THR A 887 29.273 -9.827 -0.121 1.00 52.02 C ATOM 1177 C THR A 887 28.723 -9.143 1.134 1.00 49.58 C ATOM 1178 O THR A 887 27.873 -9.769 1.835 1.00 50.45 O ATOM 1179 CB THR A 887 28.201 -9.945 -1.210 1.00 55.79 C ATOM 1180 OG1 THR A 887 28.375 -11.179 -1.908 1.00 63.18 O ATOM 1181 CG2 THR A 887 28.279 -8.804 -2.199 1.00 58.14 C ATOM 1182 HG1 THR A 887 27.684 -11.259 -2.612 1.00 0.00 H ATOM 1183 H THR A 887 29.388 -11.992 -0.170 1.00 0.00 H ATOM 1184 N GLY A 888 29.205 -7.925 1.395 1.00 46.18 N ATOM 1185 CA GLY A 888 28.790 -7.068 2.521 1.00 44.15 C ATOM 1186 C GLY A 888 29.812 -7.076 3.641 1.00 41.48 C ATOM 1187 O GLY A 888 29.652 -6.285 4.574 1.00 39.97 O ATOM 1188 H GLY A 888 29.932 -7.551 0.752 1.00 0.00 H ATOM 1189 N TYR A 889 30.810 -7.959 3.568 1.00 39.93 N ATOM 1190 CA TYR A 889 31.840 -8.163 4.621 1.00 39.77 C ATOM 1191 C TYR A 889 33.190 -7.695 4.091 1.00 38.48 C ATOM 1192 O TYR A 889 33.883 -8.479 3.433 1.00 40.58 O ATOM 1193 CB TYR A 889 31.937 -9.636 5.013 1.00 40.31 C ATOM 1194 CG TYR A 889 30.690 -10.215 5.621 1.00 39.83 C ATOM 1195 CD1 TYR A 889 30.252 -9.791 6.865 1.00 38.55 C ATOM 1196 CD2 TYR A 889 29.944 -11.170 4.956 1.00 40.03 C ATOM 1197 CE1 TYR A 889 29.136 -10.343 7.457 1.00 37.49 C ATOM 1198 CE2 TYR A 889 28.805 -11.708 5.521 1.00 40.33 C ATOM 1199 CZ TYR A 889 28.416 -11.308 6.784 1.00 39.86 C ATOM 1200 OH TYR A 889 27.298 -11.839 7.353 1.00 45.14 O ATOM 1201 HH TYR A 889 26.513 -11.637 6.785 1.00 0.00 H ATOM 1202 H TYR A 889 30.872 -8.547 2.713 1.00 0.00 H ATOM 1203 N MET A 890 33.569 -6.464 4.405 1.00 37.74 N ATOM 1204 CA MET A 890 34.802 -5.809 3.891 1.00 38.57 C ATOM 1205 C MET A 890 36.045 -6.543 4.387 1.00 37.03 C ATOM 1206 O MET A 890 37.080 -6.459 3.725 1.00 36.03 O ATOM 1207 CB MET A 890 34.871 -4.351 4.340 1.00 39.30 C ATOM 1208 CG MET A 890 34.061 -3.457 3.460 1.00 42.06 C ATOM 1209 SD MET A 890 34.378 -1.720 3.739 1.00 46.07 S ATOM 1210 CE MET A 890 36.150 -1.733 4.003 1.00 43.43 C ATOM 1211 H MET A 890 32.964 -5.920 5.053 1.00 0.00 H ATOM 1212 N PHE A 891 35.929 -7.244 5.517 1.00 35.69 N ATOM 1213 CA PHE A 891 37.078 -7.911 6.180 1.00 35.78 C ATOM 1214 C PHE A 891 36.852 -9.411 6.313 1.00 35.30 C ATOM 1215 O PHE A 891 37.572 -10.045 7.076 1.00 36.00 O ATOM 1216 CB PHE A 891 37.364 -7.208 7.509 1.00 35.36 C ATOM 1217 CG PHE A 891 37.681 -5.755 7.297 1.00 34.88 C ATOM 1218 CD1 PHE A 891 38.819 -5.396 6.593 1.00 34.26 C ATOM 1219 CD2 PHE A 891 36.826 -4.760 7.759 1.00 35.38 C ATOM 1220 CE1 PHE A 891 39.122 -4.061 6.380 1.00 36.28 C ATOM 1221 CE2 PHE A 891 37.138 -3.425 7.546 1.00 37.58 C ATOM 1222 CZ PHE A 891 38.273 -3.081 6.839 1.00 36.27 C ATOM 1223 H PHE A 891 34.989 -7.327 5.954 1.00 0.00 H ATOM 1224 N GLY A 892 35.963 -9.964 5.495 1.00 36.18 N ATOM 1225 CA GLY A 892 35.679 -11.404 5.487 1.00 37.18 C ATOM 1226 C GLY A 892 34.627 -11.749 6.523 1.00 37.58 C ATOM 1227 O GLY A 892 34.117 -10.842 7.243 1.00 35.82 O ATOM 1228 H GLY A 892 35.447 -9.351 4.833 1.00 0.00 H ATOM 1229 N LYS A 893 34.279 -13.020 6.583 1.00 39.61 N ATOM 1230 CA LYS A 893 33.260 -13.530 7.533 1.00 39.45 C ATOM 1231 C LYS A 893 33.775 -13.328 8.961 1.00 37.42 C ATOM 1232 O LYS A 893 34.887 -13.743 9.281 1.00 38.81 O ATOM 1233 CB LYS A 893 32.918 -14.964 7.141 1.00 41.28 C ATOM 1234 CG LYS A 893 32.073 -15.004 5.877 1.00 43.49 C ATOM 1235 CD LYS A 893 31.883 -16.358 5.306 1.00 47.58 C ATOM 1236 CE LYS A 893 31.119 -16.289 4.008 1.00 49.09 C ATOM 1237 NZ LYS A 893 30.874 -17.649 3.496 1.00 52.70 N ATOM 1238 HZ1 LYS A 893 31.784 -18.126 3.334 1.00 0.00 H ATOM 1239 HZ2 LYS A 893 30.319 -18.186 4.193 1.00 0.00 H ATOM 1240 HZ3 LYS A 893 30.347 -17.592 2.601 1.00 0.00 H ATOM 1241 H LYS A 893 34.738 -13.693 5.937 1.00 0.00 H ATOM 1242 N GLY A 894 32.965 -12.668 9.774 1.00 36.96 N ATOM 1243 CA GLY A 894 33.257 -12.393 11.189 1.00 36.41 C ATOM 1244 C GLY A 894 32.021 -11.828 11.828 1.00 34.28 C ATOM 1245 O GLY A 894 30.972 -11.852 11.162 1.00 33.26 O ATOM 1246 H GLY A 894 32.064 -12.322 9.387 1.00 0.00 H ATOM 1247 N ILE A 895 32.145 -11.326 13.053 1.00 32.86 N ATOM 1248 CA ILE A 895 31.024 -10.633 13.745 1.00 31.77 C ATOM 1249 C ILE A 895 31.319 -9.131 13.696 1.00 30.86 C ATOM 1250 O ILE A 895 32.395 -8.728 14.190 1.00 30.32 O ATOM 1251 CB ILE A 895 30.815 -11.175 15.171 1.00 30.12 C ATOM 1252 CG1 ILE A 895 31.009 -12.693 15.234 1.00 30.73 C ATOM 1253 CG2 ILE A 895 29.454 -10.752 15.692 1.00 29.25 C ATOM 1254 CD1 ILE A 895 30.491 -13.331 16.501 1.00 30.83 C ATOM 1255 H ILE A 895 33.057 -11.421 13.545 1.00 0.00 H ATOM 1256 N TYR A 896 30.402 -8.379 13.091 1.00 30.53 N ATOM 1257 CA TYR A 896 30.565 -6.952 12.723 1.00 31.52 C ATOM 1258 C TYR A 896 29.777 -6.082 13.701 1.00 31.14 C ATOM 1259 O TYR A 896 28.621 -6.408 14.032 1.00 31.81 O ATOM 1260 CB TYR A 896 30.131 -6.713 11.272 1.00 31.92 C ATOM 1261 CG TYR A 896 31.161 -7.132 10.258 1.00 33.15 C ATOM 1262 CD1 TYR A 896 31.494 -8.463 10.085 1.00 32.24 C ATOM 1263 CD2 TYR A 896 31.805 -6.198 9.457 1.00 33.73 C ATOM 1264 CE1 TYR A 896 32.456 -8.857 9.169 1.00 31.89 C ATOM 1265 CE2 TYR A 896 32.759 -6.583 8.529 1.00 32.96 C ATOM 1266 CZ TYR A 896 33.097 -7.913 8.391 1.00 31.66 C ATOM 1267 OH TYR A 896 34.029 -8.292 7.465 1.00 30.60 O ATOM 1268 HH TYR A 896 34.148 -9.274 7.501 1.00 0.00 H ATOM 1269 H TYR A 896 29.495 -8.831 12.857 1.00 0.00 H ATOM 1270 N PHE A 897 30.393 -4.976 14.112 1.00 29.30 N ATOM 1271 CA PHE A 897 29.806 -3.976 15.031 1.00 27.99 C ATOM 1272 C PHE A 897 30.130 -2.586 14.484 1.00 28.62 C ATOM 1273 O PHE A 897 31.134 -2.458 13.761 1.00 29.86 O ATOM 1274 CB PHE A 897 30.347 -4.148 16.456 1.00 26.76 C ATOM 1275 CG PHE A 897 30.128 -5.512 17.046 1.00 25.69 C ATOM 1276 CD1 PHE A 897 31.020 -6.542 16.801 1.00 26.47 C ATOM 1277 CD2 PHE A 897 29.022 -5.761 17.845 1.00 28.13 C ATOM 1278 CE1 PHE A 897 30.797 -7.803 17.328 1.00 27.19 C ATOM 1279 CE2 PHE A 897 28.794 -7.025 18.366 1.00 26.66 C ATOM 1280 CZ PHE A 897 29.677 -8.038 18.101 1.00 27.73 C ATOM 1281 H PHE A 897 31.357 -4.802 13.762 1.00 0.00 H ATOM 1282 N ALA A 898 29.322 -1.589 14.839 1.00 27.99 N ATOM 1283 CA ALA A 898 29.584 -0.160 14.557 1.00 29.69 C ATOM 1284 C ALA A 898 29.637 0.599 15.882 1.00 29.90 C ATOM 1285 O ALA A 898 29.092 0.101 16.884 1.00 28.80 O ATOM 1286 CB ALA A 898 28.524 0.410 13.633 1.00 29.76 C ATOM 1287 H ALA A 898 28.448 -1.831 15.349 1.00 0.00 H ATOM 1288 N ASP A 899 30.257 1.775 15.869 1.00 31.00 N ATOM 1289 CA ASP A 899 30.180 2.751 16.982 1.00 30.30 C ATOM 1290 C ASP A 899 29.156 3.841 16.634 1.00 31.84 C ATOM 1291 O ASP A 899 28.912 4.712 17.484 1.00 34.76 O ATOM 1292 CB ASP A 899 31.571 3.246 17.358 1.00 31.19 C ATOM 1293 CG ASP A 899 32.355 3.899 16.235 1.00 33.41 C ATOM 1294 OD1 ASP A 899 31.717 4.319 15.219 1.00 31.50 O ATOM 1295 OD2 ASP A 899 33.611 3.940 16.369 1.00 33.07 O ATOM 1296 H ASP A 899 30.826 2.023 15.034 1.00 0.00 H ATOM 1297 N MET A 900 28.543 3.774 15.455 1.00 32.79 N ATOM 1298 CA MET A 900 27.488 4.719 15.016 1.00 33.93 C ATOM 1299 C MET A 900 26.177 3.934 14.977 1.00 31.29 C ATOM 1300 O MET A 900 26.100 2.954 14.227 1.00 31.16 O ATOM 1301 CB MET A 900 27.787 5.315 13.635 1.00 37.03 C ATOM 1302 CG MET A 900 29.088 6.125 13.538 1.00 39.64 C ATOM 1303 SD MET A 900 29.150 7.652 14.520 1.00 45.05 S ATOM 1304 CE MET A 900 28.322 8.847 13.474 1.00 43.88 C ATOM 1305 H MET A 900 28.820 3.013 14.802 1.00 0.00 H ATOM 1306 N VAL A 901 25.216 4.299 15.820 1.00 31.91 N ATOM 1307 CA VAL A 901 23.929 3.562 15.963 1.00 33.16 C ATOM 1308 C VAL A 901 23.285 3.367 14.573 1.00 33.99 C ATOM 1309 O VAL A 901 22.792 2.237 14.300 1.00 37.57 O ATOM 1310 CB VAL A 901 22.981 4.265 16.960 1.00 34.35 C ATOM 1311 CG1 VAL A 901 22.457 5.589 16.426 1.00 36.59 C ATOM 1312 CG2 VAL A 901 21.813 3.377 17.350 1.00 33.98 C ATOM 1313 H VAL A 901 25.370 5.142 16.410 1.00 0.00 H ATOM 1314 N SER A 902 23.283 4.394 13.714 1.00 33.78 N ATOM 1315 CA SER A 902 22.541 4.383 12.425 1.00 35.23 C ATOM 1316 C SER A 902 23.192 3.376 11.471 1.00 35.39 C ATOM 1317 O SER A 902 22.458 2.705 10.714 1.00 35.01 O ATOM 1318 CB SER A 902 22.472 5.766 11.804 1.00 37.38 C ATOM 1319 OG SER A 902 23.772 6.342 11.694 1.00 37.70 O ATOM 1320 HG SER A 902 24.340 5.765 11.124 1.00 0.00 H ATOM 1321 H SER A 902 23.829 5.244 13.961 1.00 0.00 H ATOM 1322 N LYS A 903 24.520 3.242 11.523 1.00 33.72 N ATOM 1323 CA LYS A 903 25.230 2.306 10.621 1.00 32.53 C ATOM 1324 C LYS A 903 24.717 0.895 10.929 1.00 32.77 C ATOM 1325 O LYS A 903 24.433 0.157 9.985 1.00 33.01 O ATOM 1326 CB LYS A 903 26.747 2.446 10.758 1.00 32.38 C ATOM 1327 CG LYS A 903 27.543 1.354 10.053 1.00 31.73 C ATOM 1328 CD LYS A 903 28.981 1.744 9.795 1.00 31.33 C ATOM 1329 CE LYS A 903 29.794 0.615 9.205 1.00 29.53 C ATOM 1330 NZ LYS A 903 31.125 1.097 8.792 1.00 30.88 N ATOM 1331 HZ1 LYS A 903 31.015 1.844 8.077 1.00 0.00 H ATOM 1332 HZ2 LYS A 903 31.626 1.478 9.620 1.00 0.00 H ATOM 1333 HZ3 LYS A 903 31.669 0.307 8.389 1.00 0.00 H ATOM 1334 H LYS A 903 25.064 3.804 12.208 1.00 0.00 H ATOM 1335 N SER A 904 24.558 0.558 12.214 1.00 32.60 N ATOM 1336 CA SER A 904 24.009 -0.741 12.663 1.00 30.93 C ATOM 1337 C SER A 904 22.497 -0.791 12.405 1.00 32.48 C ATOM 1338 O SER A 904 22.027 -1.835 11.949 1.00 31.89 O ATOM 1339 CB SER A 904 24.351 -0.995 14.098 1.00 31.14 C ATOM 1340 OG SER A 904 25.619 -1.628 14.194 1.00 30.96 O ATOM 1341 HG SER A 904 25.594 -2.490 13.708 1.00 0.00 H ATOM 1342 H SER A 904 24.836 1.249 12.940 1.00 0.00 H ATOM 1343 N ALA A 905 21.758 0.289 12.692 1.00 32.57 N ATOM 1344 CA ALA A 905 20.277 0.328 12.568 1.00 32.97 C ATOM 1345 C ALA A 905 19.847 0.073 11.113 1.00 34.79 C ATOM 1346 O ALA A 905 18.768 -0.524 10.914 1.00 34.34 O ATOM 1347 CB ALA A 905 19.738 1.639 13.100 1.00 33.70 C ATOM 1348 H ALA A 905 22.247 1.147 13.019 1.00 0.00 H ATOM 1349 N ASN A 906 20.647 0.508 10.130 1.00 35.02 N ATOM 1350 CA ASN A 906 20.421 0.232 8.689 1.00 37.11 C ATOM 1351 C ASN A 906 20.283 -1.283 8.444 1.00 37.99 C ATOM 1352 O ASN A 906 19.537 -1.653 7.519 1.00 38.61 O ATOM 1353 CB ASN A 906 21.515 0.861 7.808 1.00 36.98 C ATOM 1354 CG ASN A 906 21.435 2.377 7.742 1.00 37.60 C ATOM 1355 OD1 ASN A 906 20.382 2.966 8.007 1.00 39.76 O ATOM 1356 ND2 ASN A 906 22.534 3.028 7.385 1.00 36.88 N ATOM 1357 HD22 ASN A 906 23.404 2.500 7.169 1.00 0.00 H ATOM 1358 HD21 ASN A 906 22.526 4.066 7.321 1.00 0.00 H ATOM 1359 H ASN A 906 21.478 1.075 10.393 1.00 0.00 H ATOM 1360 N TYR A 907 20.945 -2.143 9.226 1.00 36.49 N ATOM 1361 CA TYR A 907 20.880 -3.624 9.043 1.00 38.21 C ATOM 1362 C TYR A 907 19.595 -4.223 9.649 1.00 39.58 C ATOM 1363 O TYR A 907 19.377 -5.442 9.467 1.00 38.14 O ATOM 1364 CB TYR A 907 22.143 -4.286 9.589 1.00 36.67 C ATOM 1365 CG TYR A 907 23.337 -4.022 8.723 1.00 36.22 C ATOM 1366 CD1 TYR A 907 23.556 -4.773 7.577 1.00 37.73 C ATOM 1367 CD2 TYR A 907 24.215 -2.995 9.013 1.00 36.17 C ATOM 1368 CE1 TYR A 907 24.638 -4.519 6.750 1.00 38.93 C ATOM 1369 CE2 TYR A 907 25.297 -2.723 8.194 1.00 36.92 C ATOM 1370 CZ TYR A 907 25.518 -3.500 7.070 1.00 36.76 C ATOM 1371 OH TYR A 907 26.574 -3.235 6.251 1.00 37.83 O ATOM 1372 HH TYR A 907 26.580 -3.883 5.503 1.00 0.00 H ATOM 1373 H TYR A 907 21.532 -1.763 9.996 1.00 0.00 H ATOM 1374 N CYS A 908 18.737 -3.411 10.279 1.00 39.41 N ATOM 1375 CA CYS A 908 17.418 -3.866 10.809 1.00 41.58 C ATOM 1376 C CYS A 908 16.416 -4.046 9.666 1.00 43.54 C ATOM 1377 O CYS A 908 15.466 -4.818 9.854 1.00 42.11 O ATOM 1378 CB CYS A 908 16.852 -2.906 11.851 1.00 42.04 C ATOM 1379 SG CYS A 908 17.929 -2.698 13.292 1.00 39.82 S ATOM 1380 H CYS A 908 19.003 -2.414 10.405 1.00 0.00 H ATOM 1381 N HIS A 909 16.640 -3.377 8.525 1.00 46.99 N ATOM 1382 CA HIS A 909 15.770 -3.398 7.316 1.00 48.91 C ATOM 1383 C HIS A 909 14.321 -3.096 7.709 1.00 48.04 C ATOM 1384 O HIS A 909 13.410 -3.765 7.212 1.00 48.31 O ATOM 1385 CB HIS A 909 15.936 -4.717 6.550 1.00 51.07 C ATOM 1386 CG HIS A 909 17.256 -4.801 5.864 1.00 53.83 C ATOM 1387 ND1 HIS A 909 18.298 -5.577 6.351 1.00 55.00 N ATOM 1388 CD2 HIS A 909 17.727 -4.165 4.774 1.00 55.44 C ATOM 1389 CE1 HIS A 909 19.350 -5.432 5.573 1.00 55.22 C ATOM 1390 NE2 HIS A 909 19.027 -4.561 4.604 1.00 58.36 N ATOM 1391 H HIS A 909 17.498 -2.791 8.481 1.00 0.00 H ATOM 1392 N THR A 910 14.122 -2.098 8.566 1.00 46.72 N ATOM 1393 CA THR A 910 12.795 -1.505 8.853 1.00 48.45 C ATOM 1394 C THR A 910 12.363 -0.672 7.644 1.00 48.06 C ATOM 1395 O THR A 910 13.233 -0.255 6.869 1.00 49.39 O ATOM 1396 CB THR A 910 12.829 -0.697 10.156 1.00 48.27 C ATOM 1397 OG1 THR A 910 13.891 0.261 10.087 1.00 48.24 O ATOM 1398 CG2 THR A 910 13.016 -1.592 11.359 1.00 48.37 C ATOM 1399 HG1 THR A 910 14.753 -0.211 9.965 1.00 0.00 H ATOM 1400 H THR A 910 14.948 -1.711 9.065 1.00 0.00 H ATOM 1401 N SER A 911 11.065 -0.449 7.507 1.00 51.67 N ATOM 1402 CA SER A 911 10.423 0.402 6.471 1.00 55.19 C ATOM 1403 C SER A 911 9.330 1.237 7.141 1.00 57.33 C ATOM 1404 O SER A 911 9.013 0.944 8.308 1.00 56.24 O ATOM 1405 CB SER A 911 9.862 -0.462 5.370 1.00 56.16 C ATOM 1406 OG SER A 911 9.166 -1.564 5.934 1.00 55.67 O ATOM 1407 HG SER A 911 8.800 -2.128 5.208 1.00 0.00 H ATOM 1408 H SER A 911 10.434 -0.914 8.190 1.00 0.00 H ATOM 1409 N GLN A 912 8.767 2.222 6.437 1.00 61.04 N ATOM 1410 CA GLN A 912 7.665 3.075 6.958 1.00 64.71 C ATOM 1411 C GLN A 912 6.517 2.183 7.451 1.00 64.77 C ATOM 1412 O GLN A 912 5.894 2.557 8.472 1.00 60.54 O ATOM 1413 CB GLN A 912 7.159 4.066 5.904 1.00 70.71 C ATOM 1414 CG GLN A 912 6.255 5.143 6.498 1.00 74.77 C ATOM 1415 CD GLN A 912 5.498 5.939 5.464 1.00 80.34 C ATOM 1416 OE1 GLN A 912 6.083 6.660 4.660 1.00 83.08 O ATOM 1417 NE2 GLN A 912 4.178 5.834 5.497 1.00 83.48 N ATOM 1418 HE22 GLN A 912 3.723 5.211 6.195 1.00 0.00 H ATOM 1419 HE21 GLN A 912 3.596 6.374 4.825 1.00 0.00 H ATOM 1420 H GLN A 912 9.117 2.402 5.474 1.00 0.00 H ATOM 1421 N GLY A 913 6.265 1.061 6.761 1.00 66.31 N ATOM 1422 CA GLY A 913 5.177 0.104 7.055 1.00 68.10 C ATOM 1423 C GLY A 913 5.553 -0.915 8.123 1.00 67.68 C ATOM 1424 O GLY A 913 4.638 -1.568 8.660 1.00 68.32 O ATOM 1425 H GLY A 913 6.885 0.847 5.954 1.00 0.00 H ATOM 1426 N ASP A 914 6.847 -1.060 8.425 1.00 65.92 N ATOM 1427 CA ASP A 914 7.369 -1.921 9.524 1.00 64.03 C ATOM 1428 C ASP A 914 8.466 -1.144 10.259 1.00 58.30 C ATOM 1429 O ASP A 914 9.657 -1.442 10.120 1.00 52.64 O ATOM 1430 CB ASP A 914 7.829 -3.272 8.963 1.00 66.40 C ATOM 1431 CG ASP A 914 8.320 -4.253 10.015 1.00 67.81 C ATOM 1432 OD1 ASP A 914 7.860 -4.159 11.179 1.00 67.93 O ATOM 1433 OD2 ASP A 914 9.176 -5.092 9.666 1.00 68.63 O ATOM 1434 H ASP A 914 7.539 -0.535 7.853 1.00 0.00 H ATOM 1435 N PRO A 915 8.089 -0.089 11.021 1.00 54.03 N ATOM 1436 CA PRO A 915 9.040 0.930 11.464 1.00 52.25 C ATOM 1437 C PRO A 915 9.681 0.664 12.838 1.00 51.19 C ATOM 1438 O PRO A 915 10.370 1.546 13.352 1.00 50.50 O ATOM 1439 CB PRO A 915 8.136 2.171 11.487 1.00 53.44 C ATOM 1440 CG PRO A 915 6.793 1.641 11.954 1.00 54.29 C ATOM 1441 CD PRO A 915 6.713 0.217 11.441 1.00 54.80 C ATOM 1442 N ILE A 916 9.459 -0.527 13.406 1.00 49.41 N ATOM 1443 CA ILE A 916 10.042 -0.932 14.721 1.00 46.90 C ATOM 1444 C ILE A 916 11.138 -1.971 14.469 1.00 44.60 C ATOM 1445 O ILE A 916 10.875 -2.971 13.784 1.00 46.55 O ATOM 1446 CB ILE A 916 8.977 -1.474 15.699 1.00 48.17 C ATOM 1447 CG1 ILE A 916 7.673 -0.663 15.711 1.00 50.58 C ATOM 1448 CG2 ILE A 916 9.571 -1.589 17.090 1.00 47.16 C ATOM 1449 CD1 ILE A 916 7.846 0.803 16.023 1.00 51.43 C ATOM 1450 H ILE A 916 8.849 -1.206 12.907 1.00 0.00 H ATOM 1451 N GLY A 917 12.321 -1.758 15.037 1.00 40.72 N ATOM 1452 CA GLY A 917 13.437 -2.700 14.897 1.00 39.54 C ATOM 1453 C GLY A 917 14.094 -2.991 16.228 1.00 38.23 C ATOM 1454 O GLY A 917 13.807 -2.304 17.235 1.00 37.77 O ATOM 1455 H GLY A 917 12.460 -0.894 15.600 1.00 0.00 H ATOM 1456 N LEU A 918 14.976 -3.980 16.213 1.00 38.65 N ATOM 1457 CA LEU A 918 15.712 -4.463 17.395 1.00 35.99 C ATOM 1458 C LEU A 918 17.190 -4.290 17.100 1.00 35.44 C ATOM 1459 O LEU A 918 17.634 -4.703 15.994 1.00 33.89 O ATOM 1460 CB LEU A 918 15.381 -5.934 17.646 1.00 36.42 C ATOM 1461 CG LEU A 918 13.971 -6.241 18.132 1.00 38.44 C ATOM 1462 CD1 LEU A 918 13.823 -7.743 18.346 1.00 39.48 C ATOM 1463 CD2 LEU A 918 13.642 -5.476 19.408 1.00 39.34 C ATOM 1464 H LEU A 918 15.162 -4.448 15.303 1.00 0.00 H ATOM 1465 N ILE A 919 17.925 -3.750 18.070 1.00 34.63 N ATOM 1466 CA ILE A 919 19.395 -3.564 17.949 1.00 32.58 C ATOM 1467 C ILE A 919 20.083 -3.997 19.245 1.00 32.07 C ATOM 1468 O ILE A 919 19.528 -3.762 20.324 1.00 35.28 O ATOM 1469 CB ILE A 919 19.685 -2.110 17.562 1.00 34.10 C ATOM 1470 CG1 ILE A 919 21.122 -1.934 17.086 1.00 32.68 C ATOM 1471 CG2 ILE A 919 19.326 -1.159 18.693 1.00 34.38 C ATOM 1472 CD1 ILE A 919 21.334 -0.600 16.407 1.00 36.57 C ATOM 1473 H ILE A 919 17.453 -3.447 18.946 1.00 0.00 H ATOM 1474 N LEU A 920 21.272 -4.577 19.133 1.00 28.92 N ATOM 1475 CA LEU A 920 22.053 -5.072 20.293 1.00 29.13 C ATOM 1476 C LEU A 920 23.163 -4.085 20.631 1.00 29.18 C ATOM 1477 O LEU A 920 23.646 -3.405 19.720 1.00 30.81 O ATOM 1478 CB LEU A 920 22.644 -6.433 19.938 1.00 28.21 C ATOM 1479 CG LEU A 920 21.625 -7.558 19.814 1.00 29.99 C ATOM 1480 CD1 LEU A 920 22.162 -8.700 18.941 1.00 32.20 C ATOM 1481 CD2 LEU A 920 21.244 -8.076 21.192 1.00 30.64 C ATOM 1482 H LEU A 920 21.677 -4.690 18.182 1.00 0.00 H ATOM 1483 N LEU A 921 23.492 -3.984 21.916 1.00 30.25 N ATOM 1484 CA LEU A 921 24.807 -3.510 22.396 1.00 29.69 C ATOM 1485 C LEU A 921 25.577 -4.709 22.947 1.00 30.72 C ATOM 1486 O LEU A 921 25.123 -5.325 23.920 1.00 32.33 O ATOM 1487 CB LEU A 921 24.606 -2.432 23.456 1.00 29.51 C ATOM 1488 CG LEU A 921 24.211 -1.074 22.893 1.00 29.71 C ATOM 1489 CD1 LEU A 921 23.723 -0.165 24.009 1.00 30.36 C ATOM 1490 CD2 LEU A 921 25.362 -0.443 22.106 1.00 29.78 C ATOM 1491 H LEU A 921 22.781 -4.255 22.625 1.00 0.00 H ATOM 1492 N GLY A 922 26.714 -5.011 22.336 1.00 30.70 N ATOM 1493 CA GLY A 922 27.634 -6.041 22.828 1.00 31.18 C ATOM 1494 C GLY A 922 28.856 -5.408 23.447 1.00 30.55 C ATOM 1495 O GLY A 922 29.343 -4.382 22.921 1.00 31.34 O ATOM 1496 H GLY A 922 26.965 -4.494 21.469 1.00 0.00 H ATOM 1497 N GLU A 923 29.322 -6.008 24.533 1.00 29.93 N ATOM 1498 CA GLU A 923 30.698 -5.848 25.025 1.00 30.57 C ATOM 1499 C GLU A 923 31.585 -6.692 24.112 1.00 31.90 C ATOM 1500 O GLU A 923 31.402 -7.938 24.068 1.00 30.04 O ATOM 1501 CB GLU A 923 30.824 -6.287 26.472 1.00 31.23 C ATOM 1502 CG GLU A 923 32.222 -6.078 26.998 1.00 32.87 C ATOM 1503 CD GLU A 923 32.443 -6.681 28.360 1.00 32.96 C ATOM 1504 OE1 GLU A 923 31.452 -6.995 28.999 1.00 36.79 O ATOM 1505 OE2 GLU A 923 33.599 -6.825 28.764 1.00 32.81 O ATOM 1506 H GLU A 923 28.678 -6.626 25.067 1.00 0.00 H ATOM 1507 N VAL A 924 32.491 -6.030 23.393 1.00 30.87 N ATOM 1508 CA VAL A 924 33.386 -6.689 22.404 1.00 29.99 C ATOM 1509 C VAL A 924 34.804 -6.547 22.910 1.00 30.89 C ATOM 1510 O VAL A 924 35.250 -5.396 23.139 1.00 33.37 O ATOM 1511 CB VAL A 924 33.224 -6.109 20.991 1.00 29.56 C ATOM 1512 CG1 VAL A 924 33.966 -6.975 19.976 1.00 30.03 C ATOM 1513 CG2 VAL A 924 31.748 -5.972 20.618 1.00 29.37 C ATOM 1514 H VAL A 924 32.577 -5.003 23.530 1.00 0.00 H ATOM 1515 N ALA A 925 35.459 -7.681 23.099 1.00 31.75 N ATOM 1516 CA ALA A 925 36.857 -7.757 23.553 1.00 33.86 C ATOM 1517 C ALA A 925 37.745 -7.582 22.316 1.00 33.66 C ATOM 1518 O ALA A 925 38.004 -8.556 21.613 1.00 35.49 O ATOM 1519 CB ALA A 925 37.080 -9.047 24.304 1.00 34.48 C ATOM 1520 H ALA A 925 34.956 -8.572 22.916 1.00 0.00 H ATOM 1521 N LEU A 926 38.125 -6.338 22.027 1.00 33.72 N ATOM 1522 CA LEU A 926 38.844 -5.956 20.787 1.00 32.99 C ATOM 1523 C LEU A 926 40.351 -6.179 20.924 1.00 33.44 C ATOM 1524 O LEU A 926 40.989 -6.492 19.871 1.00 34.87 O ATOM 1525 CB LEU A 926 38.536 -4.494 20.463 1.00 33.78 C ATOM 1526 CG LEU A 926 37.084 -4.232 20.066 1.00 32.60 C ATOM 1527 CD1 LEU A 926 36.835 -2.744 19.934 1.00 33.96 C ATOM 1528 CD2 LEU A 926 36.724 -4.960 18.777 1.00 31.31 C ATOM 1529 H LEU A 926 37.904 -5.588 22.713 1.00 0.00 H ATOM 1530 N GLY A 927 40.898 -6.013 22.130 1.00 33.24 N ATOM 1531 CA GLY A 927 42.347 -6.132 22.397 1.00 35.23 C ATOM 1532 C GLY A 927 43.163 -5.304 21.414 1.00 35.32 C ATOM 1533 O GLY A 927 42.801 -4.148 21.152 1.00 35.42 O ATOM 1534 H GLY A 927 40.269 -5.787 22.927 1.00 0.00 H ATOM 1535 N ASN A 928 44.218 -5.871 20.849 1.00 36.14 N ATOM 1536 CA ASN A 928 45.045 -5.180 19.830 1.00 37.10 C ATOM 1537 C ASN A 928 44.314 -5.251 18.484 1.00 35.77 C ATOM 1538 O ASN A 928 44.116 -6.368 17.959 1.00 38.66 O ATOM 1539 CB ASN A 928 46.454 -5.761 19.786 1.00 39.58 C ATOM 1540 CG ASN A 928 47.178 -5.573 21.107 1.00 43.00 C ATOM 1541 OD1 ASN A 928 46.969 -4.574 21.784 1.00 44.34 O ATOM 1542 ND2 ASN A 928 48.017 -6.523 21.490 1.00 43.53 N ATOM 1543 HD22 ASN A 928 48.168 -7.357 20.887 1.00 0.00 H ATOM 1544 HD21 ASN A 928 48.525 -6.435 22.393 1.00 0.00 H ATOM 1545 H ASN A 928 44.477 -6.838 21.131 1.00 0.00 H ATOM 1546 N MET A 929 43.911 -4.096 17.966 1.00 32.87 N ATOM 1547 CA MET A 929 43.103 -3.988 16.738 1.00 32.95 C ATOM 1548 C MET A 929 44.038 -3.893 15.528 1.00 32.36 C ATOM 1549 O MET A 929 45.049 -3.172 15.604 1.00 32.62 O ATOM 1550 CB MET A 929 42.194 -2.768 16.819 1.00 32.76 C ATOM 1551 CG MET A 929 41.245 -2.843 17.991 1.00 33.16 C ATOM 1552 SD MET A 929 40.095 -1.436 18.029 1.00 33.81 S ATOM 1553 CE MET A 929 41.199 -0.047 18.280 1.00 33.44 C ATOM 1554 H MET A 929 44.181 -3.218 18.455 1.00 0.00 H ATOM 1555 N TYR A 930 43.759 -4.700 14.504 1.00 31.55 N ATOM 1556 CA TYR A 930 44.385 -4.627 13.162 1.00 32.82 C ATOM 1557 C TYR A 930 43.591 -3.581 12.396 1.00 31.18 C ATOM 1558 O TYR A 930 42.434 -3.866 12.028 1.00 31.37 O ATOM 1559 CB TYR A 930 44.402 -6.012 12.506 1.00 33.00 C ATOM 1560 CG TYR A 930 45.222 -6.158 11.249 1.00 34.40 C ATOM 1561 CD1 TYR A 930 46.355 -5.398 11.020 1.00 33.58 C ATOM 1562 CD2 TYR A 930 44.908 -7.140 10.324 1.00 35.38 C ATOM 1563 CE1 TYR A 930 47.111 -5.569 9.878 1.00 37.07 C ATOM 1564 CE2 TYR A 930 45.665 -7.342 9.186 1.00 35.64 C ATOM 1565 CZ TYR A 930 46.773 -6.549 8.959 1.00 37.89 C ATOM 1566 OH TYR A 930 47.536 -6.733 7.843 1.00 38.13 O ATOM 1567 HH TYR A 930 47.900 -7.654 7.841 1.00 0.00 H ATOM 1568 H TYR A 930 43.045 -5.440 14.659 1.00 0.00 H ATOM 1569 N GLU A 931 44.165 -2.388 12.248 1.00 31.96 N ATOM 1570 CA GLU A 931 43.452 -1.186 11.742 1.00 32.31 C ATOM 1571 C GLU A 931 43.640 -1.077 10.226 1.00 31.45 C ATOM 1572 O GLU A 931 44.772 -0.826 9.781 1.00 32.09 O ATOM 1573 CB GLU A 931 43.909 0.053 12.504 1.00 34.04 C ATOM 1574 CG GLU A 931 43.588 -0.025 13.996 1.00 36.71 C ATOM 1575 CD GLU A 931 43.847 1.236 14.813 1.00 38.52 C ATOM 1576 OE1 GLU A 931 44.334 2.206 14.260 1.00 41.03 O ATOM 1577 OE2 GLU A 931 43.551 1.245 16.005 1.00 44.88 O ATOM 1578 H GLU A 931 45.169 -2.292 12.501 1.00 0.00 H ATOM 1579 N LEU A 932 42.549 -1.247 9.475 1.00 30.62 N ATOM 1580 CA LEU A 932 42.538 -1.309 7.995 1.00 32.10 C ATOM 1581 C LEU A 932 41.603 -0.234 7.426 1.00 33.07 C ATOM 1582 O LEU A 932 40.634 0.143 8.098 1.00 31.66 O ATOM 1583 CB LEU A 932 42.115 -2.721 7.595 1.00 33.92 C ATOM 1584 CG LEU A 932 43.059 -3.831 8.065 1.00 34.73 C ATOM 1585 CD1 LEU A 932 42.512 -5.182 7.634 1.00 35.08 C ATOM 1586 CD2 LEU A 932 44.478 -3.624 7.533 1.00 35.56 C ATOM 1587 H LEU A 932 41.638 -1.343 9.967 1.00 0.00 H ATOM 1588 N LYS A 933 41.941 0.279 6.247 1.00 34.59 N ATOM 1589 CA LYS A 933 41.207 1.357 5.545 1.00 36.97 C ATOM 1590 C LYS A 933 40.542 0.812 4.283 1.00 35.72 C ATOM 1591 O LYS A 933 39.592 1.466 3.820 1.00 39.58 O ATOM 1592 CB LYS A 933 42.187 2.490 5.245 1.00 41.29 C ATOM 1593 CG LYS A 933 42.996 2.879 6.472 1.00 44.43 C ATOM 1594 CD LYS A 933 43.673 4.209 6.338 1.00 47.69 C ATOM 1595 CE LYS A 933 44.792 4.193 5.324 1.00 48.16 C ATOM 1596 NZ LYS A 933 45.513 5.480 5.362 1.00 51.05 N ATOM 1597 HZ1 LYS A 933 44.853 6.252 5.138 1.00 0.00 H ATOM 1598 HZ2 LYS A 933 45.909 5.626 6.312 1.00 0.00 H ATOM 1599 HZ3 LYS A 933 46.283 5.466 4.663 1.00 0.00 H ATOM 1600 H LYS A 933 42.787 -0.107 5.781 1.00 0.00 H ATOM 1601 N HIS A 934 40.967 -0.352 3.776 1.00 34.29 N ATOM 1602 CA HIS A 934 40.402 -0.944 2.532 1.00 35.59 C ATOM 1603 C HIS A 934 40.045 -2.410 2.743 1.00 35.10 C ATOM 1604 O HIS A 934 40.674 -3.065 3.605 1.00 34.37 O ATOM 1605 CB HIS A 934 41.374 -0.772 1.366 1.00 37.17 C ATOM 1606 CG HIS A 934 41.802 0.636 1.182 1.00 37.59 C ATOM 1607 ND1 HIS A 934 40.935 1.598 0.738 1.00 39.88 N ATOM 1608 CD2 HIS A 934 42.977 1.253 1.421 1.00 37.41 C ATOM 1609 CE1 HIS A 934 41.577 2.746 0.654 1.00 39.68 C ATOM 1610 NE2 HIS A 934 42.820 2.563 1.090 1.00 37.95 N ATOM 1611 H HIS A 934 41.724 -0.864 4.272 1.00 0.00 H ATOM 1612 N ALA A 935 39.101 -2.912 1.948 1.00 34.58 N ATOM 1613 CA ALA A 935 38.601 -4.298 2.063 1.00 33.90 C ATOM 1614 C ALA A 935 39.776 -5.262 1.900 1.00 34.21 C ATOM 1615 O ALA A 935 40.622 -5.055 1.006 1.00 34.81 O ATOM 1616 CB ALA A 935 37.510 -4.571 1.058 1.00 33.73 C ATOM 1617 H ALA A 935 38.697 -2.299 1.211 1.00 0.00 H ATOM 1618 N SER A 936 39.818 -6.276 2.752 1.00 35.02 N ATOM 1619 CA SER A 936 40.885 -7.304 2.806 1.00 37.22 C ATOM 1620 C SER A 936 40.351 -8.497 3.588 1.00 38.15 C ATOM 1621 O SER A 936 40.008 -8.316 4.766 1.00 38.73 O ATOM 1622 CB SER A 936 42.131 -6.760 3.433 1.00 37.05 C ATOM 1623 OG SER A 936 43.124 -7.774 3.449 1.00 41.89 O ATOM 1624 HG SER A 936 43.950 -7.419 3.863 1.00 0.00 H ATOM 1625 H SER A 936 39.040 -6.357 3.438 1.00 0.00 H ATOM 1626 N HIS A 937 40.206 -9.644 2.937 1.00 40.95 N ATOM 1627 CA HIS A 937 39.616 -10.870 3.531 1.00 43.01 C ATOM 1628 C HIS A 937 40.743 -11.661 4.183 1.00 45.07 C ATOM 1629 O HIS A 937 41.216 -12.624 3.582 1.00 47.31 O ATOM 1630 CB HIS A 937 38.856 -11.673 2.471 1.00 43.98 C ATOM 1631 CG HIS A 937 37.633 -10.965 1.995 1.00 43.62 C ATOM 1632 ND1 HIS A 937 36.890 -11.412 0.928 1.00 45.11 N ATOM 1633 CD2 HIS A 937 37.037 -9.834 2.424 1.00 42.22 C ATOM 1634 CE1 HIS A 937 35.863 -10.610 0.749 1.00 45.27 C ATOM 1635 NE2 HIS A 937 35.937 -9.630 1.647 1.00 44.10 N ATOM 1636 H HIS A 937 40.526 -9.687 1.948 1.00 0.00 H ATOM 1637 N ILE A 938 41.159 -11.235 5.366 1.00 47.88 N ATOM 1638 CA ILE A 938 42.346 -11.804 6.062 1.00 52.92 C ATOM 1639 C ILE A 938 42.030 -13.262 6.435 1.00 52.07 C ATOM 1640 O ILE A 938 40.965 -13.519 7.038 1.00 49.00 O ATOM 1641 CB ILE A 938 42.713 -10.934 7.280 1.00 54.97 C ATOM 1642 CG1 ILE A 938 41.723 -11.117 8.428 1.00 54.27 C ATOM 1643 CG2 ILE A 938 42.847 -9.463 6.899 1.00 53.82 C ATOM 1644 CD1 ILE A 938 42.030 -10.231 9.594 1.00 57.33 C ATOM 1645 H ILE A 938 40.632 -10.468 5.830 1.00 0.00 H ATOM 1646 N SER A 939 42.923 -14.187 6.089 1.00 55.23 N ATOM 1647 CA SER A 939 42.777 -15.629 6.419 1.00 57.57 C ATOM 1648 C SER A 939 43.073 -15.852 7.909 1.00 57.79 C ATOM 1649 O SER A 939 42.550 -16.824 8.484 1.00 62.34 O ATOM 1650 CB SER A 939 43.649 -16.463 5.537 1.00 58.50 C ATOM 1651 OG SER A 939 44.910 -15.843 5.354 1.00 59.34 O ATOM 1652 HG SER A 939 45.473 -16.409 4.768 1.00 0.00 H ATOM 1653 H SER A 939 43.766 -13.885 5.561 1.00 0.00 H ATOM 1654 N LYS A 940 43.839 -14.947 8.523 1.00 54.80 N ATOM 1655 CA LYS A 940 44.405 -15.107 9.885 1.00 53.28 C ATOM 1656 C LYS A 940 44.813 -13.723 10.393 1.00 47.27 C ATOM 1657 O LYS A 940 45.455 -12.985 9.619 1.00 45.93 O ATOM 1658 CB LYS A 940 45.607 -16.050 9.766 1.00 59.83 C ATOM 1659 CG LYS A 940 46.173 -16.640 11.049 1.00 65.31 C ATOM 1660 CD LYS A 940 47.667 -16.945 10.917 1.00 72.60 C ATOM 1661 CE LYS A 940 48.135 -18.182 11.659 1.00 78.76 C ATOM 1662 NZ LYS A 940 47.628 -18.229 13.051 1.00 81.22 N ATOM 1663 HZ1 LYS A 940 47.967 -17.394 13.570 1.00 0.00 H ATOM 1664 HZ2 LYS A 940 46.588 -18.234 13.040 1.00 0.00 H ATOM 1665 HZ3 LYS A 940 47.975 -19.092 13.516 1.00 0.00 H ATOM 1666 H LYS A 940 44.054 -14.068 8.010 1.00 0.00 H ATOM 1667 N LEU A 941 44.478 -13.373 11.634 1.00 40.33 N ATOM 1668 CA LEU A 941 44.953 -12.108 12.248 1.00 39.47 C ATOM 1669 C LEU A 941 46.467 -12.153 12.404 1.00 39.70 C ATOM 1670 O LEU A 941 47.027 -13.197 12.702 1.00 38.36 O ATOM 1671 CB LEU A 941 44.309 -11.918 13.615 1.00 40.85 C ATOM 1672 CG LEU A 941 42.830 -11.559 13.583 1.00 40.97 C ATOM 1673 CD1 LEU A 941 42.207 -11.829 14.941 1.00 42.04 C ATOM 1674 CD2 LEU A 941 42.646 -10.114 13.162 1.00 40.51 C ATOM 1675 H LEU A 941 43.866 -14.005 12.189 1.00 0.00 H ATOM 1676 N PRO A 942 47.179 -11.022 12.226 1.00 38.32 N ATOM 1677 CA PRO A 942 48.588 -10.962 12.594 1.00 40.56 C ATOM 1678 C PRO A 942 48.769 -11.397 14.052 1.00 40.60 C ATOM 1679 O PRO A 942 47.842 -11.260 14.823 1.00 41.88 O ATOM 1680 CB PRO A 942 48.964 -9.480 12.400 1.00 39.38 C ATOM 1681 CG PRO A 942 47.937 -8.956 11.402 1.00 38.36 C ATOM 1682 CD PRO A 942 46.680 -9.760 11.660 1.00 37.54 C ATOM 1683 N LYS A 943 49.954 -11.879 14.397 1.00 43.59 N ATOM 1684 CA LYS A 943 50.279 -12.337 15.771 1.00 46.28 C ATOM 1685 C LYS A 943 50.108 -11.134 16.708 1.00 43.72 C ATOM 1686 O LYS A 943 50.586 -10.019 16.360 1.00 42.26 O ATOM 1687 CB LYS A 943 51.683 -12.947 15.828 1.00 51.98 C ATOM 1688 CG LYS A 943 52.054 -13.895 14.691 1.00 56.24 C ATOM 1689 CD LYS A 943 51.734 -15.361 14.925 1.00 61.03 C ATOM 1690 CE LYS A 943 52.495 -16.286 13.986 1.00 64.53 C ATOM 1691 NZ LYS A 943 53.970 -16.162 14.123 1.00 65.26 N ATOM 1692 HZ1 LYS A 943 54.256 -15.186 13.908 1.00 0.00 H ATOM 1693 HZ2 LYS A 943 54.248 -16.399 15.097 1.00 0.00 H ATOM 1694 HZ3 LYS A 943 54.435 -16.815 13.460 1.00 0.00 H ATOM 1695 H LYS A 943 50.694 -11.939 13.668 1.00 0.00 H ATOM 1696 N GLY A 944 49.375 -11.331 17.802 1.00 42.29 N ATOM 1697 CA GLY A 944 49.148 -10.325 18.857 1.00 42.68 C ATOM 1698 C GLY A 944 47.945 -9.440 18.576 1.00 41.23 C ATOM 1699 O GLY A 944 47.671 -8.566 19.409 1.00 44.05 O ATOM 1700 H GLY A 944 48.929 -12.263 17.922 1.00 0.00 H ATOM 1701 N LYS A 945 47.253 -9.632 17.452 1.00 38.97 N ATOM 1702 CA LYS A 945 46.000 -8.899 17.130 1.00 38.23 C ATOM 1703 C LYS A 945 44.781 -9.764 17.476 1.00 37.69 C ATOM 1704 O LYS A 945 44.827 -10.985 17.238 1.00 37.56 O ATOM 1705 CB LYS A 945 45.964 -8.526 15.649 1.00 36.20 C ATOM 1706 CG LYS A 945 47.092 -7.614 15.209 1.00 36.17 C ATOM 1707 CD LYS A 945 47.020 -6.251 15.804 1.00 35.56 C ATOM 1708 CE LYS A 945 48.120 -5.351 15.295 1.00 36.12 C ATOM 1709 NZ LYS A 945 47.942 -3.953 15.750 1.00 35.73 N ATOM 1710 HZ1 LYS A 945 47.033 -3.589 15.400 1.00 0.00 H ATOM 1711 HZ2 LYS A 945 47.951 -3.924 16.790 1.00 0.00 H ATOM 1712 HZ3 LYS A 945 48.718 -3.368 15.379 1.00 0.00 H ATOM 1713 H LYS A 945 47.608 -10.329 16.767 1.00 0.00 H ATOM 1714 N HIS A 946 43.715 -9.141 17.980 1.00 37.48 N ATOM 1715 CA HIS A 946 42.506 -9.850 18.483 1.00 37.65 C ATOM 1716 C HIS A 946 41.285 -9.509 17.631 1.00 35.14 C ATOM 1717 O HIS A 946 40.287 -10.228 17.725 1.00 36.25 O ATOM 1718 CB HIS A 946 42.309 -9.510 19.963 1.00 39.06 C ATOM 1719 CG HIS A 946 43.532 -9.782 20.772 1.00 40.78 C ATOM 1720 ND1 HIS A 946 44.348 -8.767 21.242 1.00 40.64 N ATOM 1721 CD2 HIS A 946 44.087 -10.945 21.187 1.00 41.70 C ATOM 1722 CE1 HIS A 946 45.359 -9.294 21.905 1.00 41.70 C ATOM 1723 NE2 HIS A 946 45.220 -10.630 21.879 1.00 41.92 N ATOM 1724 H HIS A 946 43.729 -8.102 18.024 1.00 0.00 H ATOM 1725 N SER A 947 41.375 -8.468 16.813 1.00 32.59 N ATOM 1726 CA SER A 947 40.225 -7.904 16.076 1.00 31.98 C ATOM 1727 C SER A 947 40.714 -7.047 14.907 1.00 33.11 C ATOM 1728 O SER A 947 41.932 -6.699 14.867 1.00 31.63 O ATOM 1729 CB SER A 947 39.368 -7.073 16.992 1.00 32.95 C ATOM 1730 OG SER A 947 40.099 -5.959 17.494 1.00 31.18 O ATOM 1731 HG SER A 947 40.887 -6.283 17.999 1.00 0.00 H ATOM 1732 H SER A 947 42.307 -8.024 16.683 1.00 0.00 H ATOM 1733 N VAL A 948 39.779 -6.697 14.017 1.00 28.74 N ATOM 1734 CA VAL A 948 40.000 -5.716 12.930 1.00 29.97 C ATOM 1735 C VAL A 948 39.136 -4.504 13.254 1.00 30.39 C ATOM 1736 O VAL A 948 37.974 -4.683 13.659 1.00 28.74 O ATOM 1737 CB VAL A 948 39.688 -6.324 11.545 1.00 30.29 C ATOM 1738 CG1 VAL A 948 39.452 -5.273 10.485 1.00 30.00 C ATOM 1739 CG2 VAL A 948 40.761 -7.286 11.086 1.00 30.60 C ATOM 1740 H VAL A 948 38.841 -7.140 14.093 1.00 0.00 H ATOM 1741 N LYS A 949 39.707 -3.316 13.068 1.00 31.27 N ATOM 1742 CA LYS A 949 38.964 -2.042 13.025 1.00 30.87 C ATOM 1743 C LYS A 949 39.110 -1.473 11.621 1.00 32.87 C ATOM 1744 O LYS A 949 40.256 -1.221 11.214 1.00 32.94 O ATOM 1745 CB LYS A 949 39.481 -1.036 14.059 1.00 30.69 C ATOM 1746 CG LYS A 949 38.661 0.250 14.130 1.00 30.52 C ATOM 1747 CD LYS A 949 39.213 1.259 15.108 1.00 30.41 C ATOM 1748 CE LYS A 949 38.333 2.471 15.245 1.00 31.17 C ATOM 1749 NZ LYS A 949 38.884 3.407 16.240 1.00 34.32 N ATOM 1750 HZ1 LYS A 949 38.948 2.932 17.163 1.00 0.00 H ATOM 1751 HZ2 LYS A 949 39.832 3.712 15.940 1.00 0.00 H ATOM 1752 HZ3 LYS A 949 38.260 4.235 16.318 1.00 0.00 H ATOM 1753 H LYS A 949 40.739 -3.284 12.946 1.00 0.00 H ATOM 1754 N GLY A 950 37.991 -1.339 10.906 1.00 32.05 N ATOM 1755 CA GLY A 950 37.902 -0.558 9.669 1.00 31.26 C ATOM 1756 C GLY A 950 37.857 0.909 10.041 1.00 32.89 C ATOM 1757 O GLY A 950 36.961 1.275 10.842 1.00 30.19 O ATOM 1758 H GLY A 950 37.132 -1.817 11.246 1.00 0.00 H ATOM 1759 N LEU A 951 38.824 1.692 9.544 1.00 33.29 N ATOM 1760 CA LEU A 951 39.018 3.105 9.933 1.00 33.92 C ATOM 1761 C LEU A 951 38.112 3.986 9.069 1.00 34.78 C ATOM 1762 O LEU A 951 38.362 4.083 7.870 1.00 35.57 O ATOM 1763 CB LEU A 951 40.496 3.481 9.790 1.00 35.15 C ATOM 1764 CG LEU A 951 41.454 2.852 10.807 1.00 35.40 C ATOM 1765 CD1 LEU A 951 42.826 3.501 10.733 1.00 36.71 C ATOM 1766 CD2 LEU A 951 40.918 2.945 12.225 1.00 34.40 C ATOM 1767 H LEU A 951 39.475 1.282 8.844 1.00 0.00 H ATOM 1768 N GLY A 952 37.094 4.610 9.678 1.00 35.37 N ATOM 1769 CA GLY A 952 36.186 5.558 9.000 1.00 36.00 C ATOM 1770 C GLY A 952 36.709 6.985 9.000 1.00 37.40 C ATOM 1771 O GLY A 952 37.515 7.342 9.881 1.00 36.40 O ATOM 1772 H GLY A 952 36.934 4.415 10.687 1.00 0.00 H ATOM 1773 N LYS A 953 36.243 7.780 8.039 1.00 38.49 N ATOM 1774 CA LYS A 953 36.474 9.235 7.944 1.00 40.70 C ATOM 1775 C LYS A 953 35.886 9.953 9.164 1.00 38.15 C ATOM 1776 O LYS A 953 36.398 11.037 9.509 1.00 36.01 O ATOM 1777 CB LYS A 953 35.835 9.795 6.668 1.00 47.83 C ATOM 1778 CG LYS A 953 36.492 9.390 5.350 1.00 53.44 C ATOM 1779 CD LYS A 953 37.925 9.869 5.164 1.00 59.02 C ATOM 1780 CE LYS A 953 38.076 11.376 5.141 1.00 64.82 C ATOM 1781 NZ LYS A 953 39.181 11.809 4.252 1.00 69.09 N ATOM 1782 HZ1 LYS A 953 40.075 11.397 4.587 1.00 0.00 H ATOM 1783 HZ2 LYS A 953 38.991 11.486 3.282 1.00 0.00 H ATOM 1784 HZ3 LYS A 953 39.249 12.847 4.266 1.00 0.00 H ATOM 1785 H LYS A 953 35.668 7.339 7.293 1.00 0.00 H ATOM 1786 N THR A 954 34.803 9.429 9.741 1.00 35.90 N ATOM 1787 CA THR A 954 34.100 10.051 10.897 1.00 38.38 C ATOM 1788 C THR A 954 34.099 9.091 12.085 1.00 37.22 C ATOM 1789 O THR A 954 33.848 7.880 11.897 1.00 35.25 O ATOM 1790 CB THR A 954 32.668 10.479 10.547 1.00 39.63 C ATOM 1791 OG1 THR A 954 32.788 11.303 9.392 1.00 41.17 O ATOM 1792 CG2 THR A 954 31.986 11.256 11.655 1.00 40.25 C ATOM 1793 HG1 THR A 954 33.200 10.782 8.658 1.00 0.00 H ATOM 1794 H THR A 954 34.429 8.536 9.362 1.00 0.00 H ATOM 1795 N THR A 955 34.389 9.623 13.266 1.00 39.59 N ATOM 1796 CA THR A 955 34.580 8.827 14.503 1.00 38.66 C ATOM 1797 C THR A 955 33.925 9.581 15.652 1.00 39.60 C ATOM 1798 O THR A 955 33.991 10.810 15.707 1.00 40.19 O ATOM 1799 CB THR A 955 36.070 8.498 14.708 1.00 39.99 C ATOM 1800 OG1 THR A 955 36.176 7.517 15.745 1.00 40.91 O ATOM 1801 CG2 THR A 955 36.932 9.697 15.055 1.00 41.67 C ATOM 1802 HG1 THR A 955 35.790 7.880 16.581 1.00 0.00 H ATOM 1803 H THR A 955 34.488 10.656 13.328 1.00 0.00 H ATOM 1804 N PRO A 956 33.253 8.880 16.590 1.00 40.81 N ATOM 1805 CA PRO A 956 32.916 9.478 17.877 1.00 42.25 C ATOM 1806 C PRO A 956 34.175 10.119 18.466 1.00 41.60 C ATOM 1807 O PRO A 956 35.197 9.530 18.428 1.00 45.59 O ATOM 1808 CB PRO A 956 32.422 8.284 18.706 1.00 41.78 C ATOM 1809 CG PRO A 956 31.841 7.347 17.668 1.00 42.19 C ATOM 1810 CD PRO A 956 32.794 7.486 16.493 1.00 41.67 C ATOM 1811 N ASP A 957 34.055 11.344 18.945 1.00 46.76 N ATOM 1812 CA ASP A 957 35.113 12.101 19.650 1.00 49.83 C ATOM 1813 C ASP A 957 35.665 11.243 20.789 1.00 52.96 C ATOM 1814 O ASP A 957 34.966 11.009 21.777 1.00 52.41 O ATOM 1815 CB ASP A 957 34.488 13.403 20.135 1.00 52.54 C ATOM 1816 CG ASP A 957 35.443 14.383 20.781 1.00 53.84 C ATOM 1817 OD1 ASP A 957 36.635 14.061 20.926 1.00 54.71 O ATOM 1818 OD2 ASP A 957 34.965 15.455 21.131 1.00 55.40 O ATOM 1819 H ASP A 957 33.138 11.817 18.816 1.00 0.00 H ATOM 1820 N PRO A 958 36.931 10.767 20.711 1.00 58.39 N ATOM 1821 CA PRO A 958 37.504 9.903 21.752 1.00 59.49 C ATOM 1822 C PRO A 958 37.528 10.529 23.156 1.00 62.90 C ATOM 1823 O PRO A 958 37.475 9.798 24.125 1.00 65.27 O ATOM 1824 CB PRO A 958 38.948 9.651 21.295 1.00 60.12 C ATOM 1825 CG PRO A 958 38.929 9.947 19.803 1.00 60.69 C ATOM 1826 CD PRO A 958 37.883 11.031 19.620 1.00 60.70 C ATOM 1827 N SER A 959 37.583 11.859 23.235 1.00 63.05 N ATOM 1828 CA SER A 959 37.617 12.620 24.510 1.00 65.61 C ATOM 1829 C SER A 959 36.304 12.429 25.283 1.00 64.36 C ATOM 1830 O SER A 959 36.309 12.635 26.513 1.00 63.68 O ATOM 1831 CB SER A 959 37.904 14.085 24.260 1.00 69.01 C ATOM 1832 OG SER A 959 36.702 14.840 24.190 1.00 70.10 O ATOM 1833 HG SER A 959 36.210 14.756 25.045 1.00 0.00 H ATOM 1834 H SER A 959 37.603 12.398 22.346 1.00 0.00 H ATOM 1835 N ALA A 960 35.216 12.073 24.593 1.00 59.95 N ATOM 1836 CA ALA A 960 33.862 11.961 25.186 1.00 59.31 C ATOM 1837 C ALA A 960 33.559 10.508 25.574 1.00 54.17 C ATOM 1838 O ALA A 960 32.446 10.261 26.065 1.00 52.63 O ATOM 1839 CB ALA A 960 32.834 12.505 24.225 1.00 60.14 C ATOM 1840 H ALA A 960 35.326 11.862 23.581 1.00 0.00 H ATOM 1841 N ASN A 961 34.504 9.585 25.374 1.00 53.93 N ATOM 1842 CA ASN A 961 34.379 8.170 25.824 1.00 54.45 C ATOM 1843 C ASN A 961 34.051 8.141 27.315 1.00 54.64 C ATOM 1844 O ASN A 961 34.669 8.905 28.065 1.00 57.08 O ATOM 1845 CB ASN A 961 35.659 7.353 25.634 1.00 54.67 C ATOM 1846 CG ASN A 961 35.829 6.828 24.231 1.00 53.22 C ATOM 1847 OD1 ASN A 961 35.133 7.249 23.309 1.00 54.94 O ATOM 1848 ND2 ASN A 961 36.782 5.935 24.059 1.00 53.56 N ATOM 1849 HD22 ASN A 961 37.344 5.611 24.872 1.00 0.00 H ATOM 1850 HD21 ASN A 961 36.973 5.554 23.110 1.00 0.00 H ATOM 1851 H ASN A 961 35.373 9.869 24.878 1.00 0.00 H ATOM 1852 N ILE A 962 33.115 7.289 27.721 1.00 54.24 N ATOM 1853 CA ILE A 962 32.804 7.035 29.155 1.00 55.42 C ATOM 1854 C ILE A 962 32.860 5.526 29.382 1.00 55.23 C ATOM 1855 O ILE A 962 32.894 4.773 28.389 1.00 57.37 O ATOM 1856 CB ILE A 962 31.465 7.684 29.577 1.00 58.86 C ATOM 1857 CG1 ILE A 962 30.248 7.100 28.856 1.00 57.24 C ATOM 1858 CG2 ILE A 962 31.529 9.198 29.416 1.00 61.58 C ATOM 1859 CD1 ILE A 962 29.552 5.995 29.615 1.00 56.76 C ATOM 1860 H ILE A 962 32.572 6.773 27.000 1.00 0.00 H ATOM 1861 N SER A 963 32.893 5.122 30.648 1.00 56.31 N ATOM 1862 CA SER A 963 33.086 3.728 31.109 1.00 57.31 C ATOM 1863 C SER A 963 31.802 3.256 31.796 1.00 58.31 C ATOM 1864 O SER A 963 31.461 3.830 32.830 1.00 62.24 O ATOM 1865 CB SER A 963 34.282 3.648 32.026 1.00 59.20 C ATOM 1866 OG SER A 963 34.330 2.402 32.706 1.00 61.25 O ATOM 1867 HG SER A 963 33.509 2.292 33.248 1.00 0.00 H ATOM 1868 H SER A 963 32.772 5.850 31.381 1.00 0.00 H ATOM 1869 N LEU A 964 31.117 2.257 31.232 1.00 56.10 N ATOM 1870 CA LEU A 964 29.903 1.630 31.823 1.00 55.89 C ATOM 1871 C LEU A 964 30.210 0.172 32.192 1.00 58.25 C ATOM 1872 O LEU A 964 30.293 -0.660 31.272 1.00 56.47 O ATOM 1873 CB LEU A 964 28.762 1.709 30.805 1.00 52.25 C ATOM 1874 CG LEU A 964 27.410 1.178 31.286 1.00 52.28 C ATOM 1875 CD1 LEU A 964 26.879 2.017 32.451 1.00 54.42 C ATOM 1876 CD2 LEU A 964 26.399 1.126 30.148 1.00 48.61 C ATOM 1877 H LEU A 964 31.455 1.893 30.318 1.00 0.00 H ATOM 1878 N ASP A 965 30.373 -0.125 33.487 1.00 61.89 N ATOM 1879 CA ASP A 965 30.619 -1.494 34.022 1.00 63.38 C ATOM 1880 C ASP A 965 31.970 -2.004 33.516 1.00 58.68 C ATOM 1881 O ASP A 965 32.035 -3.170 33.088 1.00 55.99 O ATOM 1882 CB ASP A 965 29.503 -2.470 33.623 1.00 67.32 C ATOM 1883 CG ASP A 965 28.142 -2.121 34.201 1.00 73.65 C ATOM 1884 OD1 ASP A 965 28.082 -1.853 35.413 1.00 80.95 O ATOM 1885 OD2 ASP A 965 27.152 -2.126 33.438 1.00 81.91 O ATOM 1886 H ASP A 965 30.324 0.657 34.170 1.00 0.00 H ATOM 1887 N GLY A 966 32.993 -1.151 33.544 1.00 56.10 N ATOM 1888 CA GLY A 966 34.349 -1.461 33.051 1.00 56.97 C ATOM 1889 C GLY A 966 34.417 -1.607 31.535 1.00 54.09 C ATOM 1890 O GLY A 966 35.454 -2.110 31.038 1.00 55.33 O ATOM 1891 H GLY A 966 32.825 -0.204 33.939 1.00 0.00 H ATOM 1892 N VAL A 967 33.388 -1.171 30.801 1.00 48.82 N ATOM 1893 CA VAL A 967 33.378 -1.212 29.308 1.00 44.77 C ATOM 1894 C VAL A 967 33.371 0.217 28.744 1.00 43.12 C ATOM 1895 O VAL A 967 32.532 1.014 29.173 1.00 41.85 O ATOM 1896 CB VAL A 967 32.182 -2.034 28.799 1.00 42.33 C ATOM 1897 CG1 VAL A 967 32.202 -2.162 27.292 1.00 39.49 C ATOM 1898 CG2 VAL A 967 32.140 -3.402 29.474 1.00 42.70 C ATOM 1899 H VAL A 967 32.556 -0.786 31.292 1.00 0.00 H ATOM 1900 N ASP A 968 34.246 0.495 27.774 1.00 43.35 N ATOM 1901 CA ASP A 968 34.331 1.799 27.061 1.00 44.92 C ATOM 1902 C ASP A 968 33.104 1.975 26.158 1.00 41.86 C ATOM 1903 O ASP A 968 32.789 1.042 25.401 1.00 38.85 O ATOM 1904 CB ASP A 968 35.617 1.908 26.241 1.00 49.11 C ATOM 1905 CG ASP A 968 36.876 1.893 27.092 1.00 57.08 C ATOM 1906 OD1 ASP A 968 36.839 2.474 28.207 1.00 61.77 O ATOM 1907 OD2 ASP A 968 37.876 1.275 26.649 1.00 61.63 O ATOM 1908 H ASP A 968 34.915 -0.252 27.497 1.00 0.00 H ATOM 1909 N VAL A 969 32.449 3.133 26.268 1.00 39.96 N ATOM 1910 CA VAL A 969 31.278 3.555 25.453 1.00 38.77 C ATOM 1911 C VAL A 969 31.668 4.802 24.662 1.00 39.83 C ATOM 1912 O VAL A 969 31.774 5.899 25.229 1.00 40.91 O ATOM 1913 CB VAL A 969 30.034 3.809 26.320 1.00 38.63 C ATOM 1914 CG1 VAL A 969 28.790 3.987 25.455 1.00 38.76 C ATOM 1915 CG2 VAL A 969 29.820 2.706 27.341 1.00 39.30 C ATOM 1916 H VAL A 969 32.788 3.801 26.989 1.00 0.00 H ATOM 1917 N PRO A 970 31.903 4.653 23.337 1.00 37.82 N ATOM 1918 CA PRO A 970 32.272 5.771 22.473 1.00 37.94 C ATOM 1919 C PRO A 970 31.022 6.509 21.970 1.00 38.39 C ATOM 1920 O PRO A 970 30.696 6.418 20.789 1.00 36.47 O ATOM 1921 CB PRO A 970 33.023 5.053 21.344 1.00 37.27 C ATOM 1922 CG PRO A 970 32.244 3.756 21.177 1.00 36.47 C ATOM 1923 CD PRO A 970 31.805 3.390 22.582 1.00 36.44 C ATOM 1924 N LEU A 971 30.350 7.215 22.881 1.00 39.28 N ATOM 1925 CA LEU A 971 29.079 7.931 22.602 1.00 40.82 C ATOM 1926 C LEU A 971 29.349 9.400 22.249 1.00 42.00 C ATOM 1927 O LEU A 971 28.377 10.178 22.257 1.00 44.39 O ATOM 1928 CB LEU A 971 28.133 7.830 23.807 1.00 41.90 C ATOM 1929 CG LEU A 971 28.706 8.093 25.201 1.00 42.74 C ATOM 1930 CD1 LEU A 971 29.224 9.517 25.366 1.00 44.02 C ATOM 1931 CD2 LEU A 971 27.631 7.804 26.235 1.00 43.09 C ATOM 1932 H LEU A 971 30.739 7.267 23.844 1.00 0.00 H ATOM 1933 N GLY A 972 30.598 9.780 21.955 1.00 41.71 N ATOM 1934 CA GLY A 972 30.939 11.151 21.508 1.00 42.73 C ATOM 1935 C GLY A 972 30.294 11.465 20.168 1.00 42.19 C ATOM 1936 O GLY A 972 30.159 10.555 19.360 1.00 38.73 O ATOM 1937 H GLY A 972 31.364 9.082 22.044 1.00 0.00 H ATOM 1938 N THR A 973 29.878 12.709 19.926 1.00 45.79 N ATOM 1939 CA THR A 973 29.396 13.132 18.583 1.00 47.59 C ATOM 1940 C THR A 973 30.529 12.921 17.568 1.00 45.85 C ATOM 1941 O THR A 973 31.706 12.987 17.966 1.00 46.15 O ATOM 1942 CB THR A 973 28.822 14.550 18.606 1.00 51.18 C ATOM 1943 OG1 THR A 973 29.680 15.364 19.402 1.00 54.57 O ATOM 1944 CG2 THR A 973 27.422 14.592 19.175 1.00 53.33 C ATOM 1945 HG1 THR A 973 29.721 14.998 20.321 1.00 0.00 H ATOM 1946 H THR A 973 29.891 13.404 20.699 1.00 0.00 H ATOM 1947 N GLY A 974 30.163 12.607 16.325 1.00 45.82 N ATOM 1948 CA GLY A 974 31.078 12.353 15.197 1.00 44.70 C ATOM 1949 C GLY A 974 31.936 13.570 14.889 1.00 46.99 C ATOM 1950 O GLY A 974 31.394 14.693 14.800 1.00 50.70 O ATOM 1951 H GLY A 974 29.143 12.535 16.134 1.00 0.00 H ATOM 1952 N ILE A 975 33.245 13.355 14.798 1.00 44.93 N ATOM 1953 CA ILE A 975 34.247 14.336 14.311 1.00 46.19 C ATOM 1954 C ILE A 975 34.974 13.672 13.148 1.00 43.84 C ATOM 1955 O ILE A 975 34.929 12.450 13.024 1.00 42.30 O ATOM 1956 CB ILE A 975 35.229 14.761 15.422 1.00 48.50 C ATOM 1957 CG1 ILE A 975 36.009 13.580 16.003 1.00 49.14 C ATOM 1958 CG2 ILE A 975 34.507 15.519 16.519 1.00 51.32 C ATOM 1959 CD1 ILE A 975 37.157 13.996 16.908 1.00 51.69 C ATOM 1960 H ILE A 975 33.596 12.421 15.093 1.00 0.00 H ATOM 1961 N SER A 976 35.642 14.470 12.341 1.00 45.57 N ATOM 1962 CA SER A 976 36.623 13.980 11.357 1.00 44.58 C ATOM 1963 C SER A 976 37.693 13.165 12.101 1.00 41.68 C ATOM 1964 O SER A 976 38.239 13.662 13.073 1.00 41.18 O ATOM 1965 CB SER A 976 37.211 15.144 10.621 1.00 46.12 C ATOM 1966 OG SER A 976 38.032 14.650 9.582 1.00 48.50 O ATOM 1967 HG SER A 976 37.487 14.100 8.965 1.00 0.00 H ATOM 1968 H SER A 976 35.469 15.494 12.401 1.00 0.00 H ATOM 1969 N SER A 977 37.967 11.941 11.674 1.00 40.17 N ATOM 1970 CA SER A 977 39.044 11.088 12.246 1.00 40.11 C ATOM 1971 C SER A 977 40.427 11.621 11.836 1.00 41.45 C ATOM 1972 O SER A 977 41.406 11.315 12.526 1.00 42.33 O ATOM 1973 CB SER A 977 38.859 9.665 11.814 1.00 38.45 C ATOM 1974 OG SER A 977 39.047 9.542 10.409 1.00 38.82 O ATOM 1975 HG SER A 977 38.921 8.597 10.142 1.00 0.00 H ATOM 1976 H SER A 977 37.397 11.554 10.895 1.00 0.00 H ATOM 1977 N GLY A 978 40.512 12.404 10.756 1.00 42.27 N ATOM 1978 CA GLY A 978 41.792 12.793 10.133 1.00 42.90 C ATOM 1979 C GLY A 978 42.475 11.590 9.501 1.00 41.54 C ATOM 1980 O GLY A 978 43.670 11.663 9.254 1.00 42.18 O ATOM 1981 H GLY A 978 39.630 12.757 10.333 1.00 0.00 H ATOM 1982 N VAL A 979 41.755 10.490 9.280 1.00 39.38 N ATOM 1983 CA VAL A 979 42.281 9.348 8.483 1.00 40.83 C ATOM 1984 C VAL A 979 42.039 9.686 7.012 1.00 43.06 C ATOM 1985 O VAL A 979 40.899 10.008 6.666 1.00 46.44 O ATOM 1986 CB VAL A 979 41.635 7.997 8.850 1.00 38.84 C ATOM 1987 CG1 VAL A 979 42.083 6.909 7.890 1.00 38.36 C ATOM 1988 CG2 VAL A 979 41.926 7.597 10.289 1.00 37.53 C ATOM 1989 H VAL A 979 40.796 10.428 9.677 1.00 0.00 H ATOM 1990 N ASN A 980 43.084 9.622 6.198 1.00 44.99 N ATOM 1991 CA ASN A 980 43.018 9.899 4.742 1.00 49.81 C ATOM 1992 C ASN A 980 43.123 8.581 3.976 1.00 47.92 C ATOM 1993 O ASN A 980 43.663 7.626 4.549 1.00 48.16 O ATOM 1994 CB ASN A 980 44.109 10.891 4.346 1.00 52.72 C ATOM 1995 CG ASN A 980 43.864 12.267 4.936 1.00 56.83 C ATOM 1996 OD1 ASN A 980 44.815 12.977 5.271 1.00 60.45 O ATOM 1997 ND2 ASN A 980 42.600 12.651 5.069 1.00 54.50 N ATOM 1998 HD22 ASN A 980 41.830 12.018 4.772 1.00 0.00 H ATOM 1999 HD21 ASN A 980 42.380 13.585 5.470 1.00 0.00 H ATOM 2000 H ASN A 980 44.005 9.362 6.605 1.00 0.00 H ATOM 2001 N ASP A 981 42.627 8.539 2.741 1.00 51.79 N ATOM 2002 CA ASP A 981 42.746 7.353 1.852 1.00 57.52 C ATOM 2003 C ASP A 981 42.046 6.175 2.552 1.00 54.03 C ATOM 2004 O ASP A 981 42.734 5.180 2.885 1.00 57.67 O ATOM 2005 CB ASP A 981 44.225 7.097 1.518 1.00 62.98 C ATOM 2006 CG ASP A 981 44.534 5.783 0.804 1.00 69.71 C ATOM 2007 OD1 ASP A 981 43.716 5.357 -0.061 1.00 71.18 O ATOM 2008 OD2 ASP A 981 45.602 5.190 1.113 1.00 72.58 O ATOM 2009 H ASP A 981 42.131 9.379 2.380 1.00 0.00 H ATOM 2010 N THR A 982 40.758 6.322 2.866 1.00 49.91 N ATOM 2011 CA THR A 982 39.941 5.237 3.473 1.00 48.18 C ATOM 2012 C THR A 982 38.648 5.062 2.664 1.00 45.29 C ATOM 2013 O THR A 982 38.103 6.054 2.183 1.00 43.16 O ATOM 2014 CB THR A 982 39.708 5.440 4.983 1.00 47.41 C ATOM 2015 OG1 THR A 982 38.984 4.299 5.470 1.00 43.57 O ATOM 2016 CG2 THR A 982 38.970 6.720 5.310 1.00 47.13 C ATOM 2017 HG1 THR A 982 38.820 4.403 6.441 1.00 0.00 H ATOM 2018 H THR A 982 40.303 7.238 2.678 1.00 0.00 H ATOM 2019 N SER A 983 38.190 3.812 2.552 1.00 44.60 N ATOM 2020 CA SER A 983 36.946 3.388 1.857 1.00 43.68 C ATOM 2021 C SER A 983 35.723 3.691 2.716 1.00 40.41 C ATOM 2022 O SER A 983 34.641 3.702 2.166 1.00 42.06 O ATOM 2023 CB SER A 983 36.983 1.915 1.560 1.00 44.16 C ATOM 2024 OG SER A 983 38.092 1.613 0.739 1.00 50.14 O ATOM 2025 HG SER A 983 38.106 0.641 0.550 1.00 0.00 H ATOM 2026 H SER A 983 38.759 3.062 2.994 1.00 0.00 H ATOM 2027 N LEU A 984 35.893 3.849 4.027 1.00 37.70 N ATOM 2028 CA LEU A 984 34.768 3.808 4.987 1.00 38.40 C ATOM 2029 C LEU A 984 34.399 5.225 5.415 1.00 37.93 C ATOM 2030 O LEU A 984 35.327 6.004 5.749 1.00 37.38 O ATOM 2031 CB LEU A 984 35.186 2.966 6.197 1.00 38.86 C ATOM 2032 CG LEU A 984 35.221 1.458 5.957 1.00 40.12 C ATOM 2033 CD1 LEU A 984 35.938 0.762 7.099 1.00 40.92 C ATOM 2034 CD2 LEU A 984 33.805 0.908 5.794 1.00 41.53 C ATOM 2035 H LEU A 984 36.854 4.007 4.391 1.00 0.00 H ATOM 2036 N LEU A 985 33.100 5.528 5.458 1.00 36.86 N ATOM 2037 CA LEU A 985 32.583 6.780 6.079 1.00 38.14 C ATOM 2038 C LEU A 985 32.704 6.675 7.605 1.00 36.88 C ATOM 2039 O LEU A 985 33.104 7.683 8.229 1.00 35.75 O ATOM 2040 CB LEU A 985 31.143 7.037 5.635 1.00 38.81 C ATOM 2041 CG LEU A 985 30.983 7.421 4.165 1.00 42.65 C ATOM 2042 CD1 LEU A 985 29.519 7.653 3.802 1.00 42.67 C ATOM 2043 CD2 LEU A 985 31.819 8.656 3.837 1.00 45.51 C ATOM 2044 H LEU A 985 32.419 4.862 5.040 1.00 0.00 H ATOM 2045 N TYR A 986 32.453 5.486 8.162 1.00 35.47 N ATOM 2046 CA TYR A 986 32.331 5.219 9.622 1.00 34.61 C ATOM 2047 C TYR A 986 33.140 3.975 10.002 1.00 33.54 C ATOM 2048 O TYR A 986 33.362 3.086 9.182 1.00 35.50 O ATOM 2049 CB TYR A 986 30.849 5.095 9.997 1.00 35.66 C ATOM 2050 CG TYR A 986 30.035 6.204 9.382 1.00 35.83 C ATOM 2051 CD1 TYR A 986 30.250 7.510 9.772 1.00 35.38 C ATOM 2052 CD2 TYR A 986 29.114 5.967 8.364 1.00 37.29 C ATOM 2053 CE1 TYR A 986 29.551 8.561 9.197 1.00 38.10 C ATOM 2054 CE2 TYR A 986 28.404 7.010 7.779 1.00 37.61 C ATOM 2055 CZ TYR A 986 28.626 8.311 8.199 1.00 37.71 C ATOM 2056 OH TYR A 986 27.956 9.357 7.651 1.00 39.58 O ATOM 2057 HH TYR A 986 28.146 9.397 6.680 1.00 0.00 H ATOM 2058 H TYR A 986 32.332 4.677 7.520 1.00 0.00 H ATOM 2059 N ASN A 987 33.585 3.931 11.247 1.00 32.14 N ATOM 2060 CA ASN A 987 34.312 2.766 11.787 1.00 31.39 C ATOM 2061 C ASN A 987 33.442 1.513 11.690 1.00 31.93 C ATOM 2062 O ASN A 987 32.193 1.613 11.611 1.00 30.04 O ATOM 2063 CB ASN A 987 34.741 2.965 13.231 1.00 31.00 C ATOM 2064 CG ASN A 987 35.669 4.141 13.441 1.00 32.33 C ATOM 2065 OD1 ASN A 987 36.494 4.457 12.575 1.00 31.78 O ATOM 2066 ND2 ASN A 987 35.532 4.771 14.595 1.00 30.32 N ATOM 2067 HD22 ASN A 987 34.817 4.452 15.280 1.00 0.00 H ATOM 2068 HD21 ASN A 987 36.139 5.585 14.818 1.00 0.00 H ATOM 2069 H ASN A 987 33.416 4.748 11.868 1.00 0.00 H ATOM 2070 N GLU A 988 34.102 0.362 11.653 1.00 31.81 N ATOM 2071 CA GLU A 988 33.457 -0.928 11.982 1.00 32.38 C ATOM 2072 C GLU A 988 34.507 -1.789 12.669 1.00 32.50 C ATOM 2073 O GLU A 988 35.721 -1.504 12.543 1.00 32.65 O ATOM 2074 CB GLU A 988 32.816 -1.598 10.765 1.00 32.00 C ATOM 2075 CG GLU A 988 33.729 -1.748 9.566 1.00 32.46 C ATOM 2076 CD GLU A 988 32.966 -2.085 8.301 1.00 33.44 C ATOM 2077 OE1 GLU A 988 32.074 -1.290 7.920 1.00 32.64 O ATOM 2078 OE2 GLU A 988 33.250 -3.139 7.704 1.00 37.12 O ATOM 2079 H GLU A 988 35.106 0.367 11.384 1.00 0.00 H ATOM 2080 N TYR A 989 34.023 -2.725 13.467 1.00 30.34 N ATOM 2081 CA TYR A 989 34.856 -3.555 14.352 1.00 31.86 C ATOM 2082 C TYR A 989 34.446 -4.993 14.112 1.00 31.56 C ATOM 2083 O TYR A 989 33.234 -5.263 14.063 1.00 33.69 O ATOM 2084 CB TYR A 989 34.643 -3.178 15.813 1.00 29.61 C ATOM 2085 CG TYR A 989 34.854 -1.736 16.145 1.00 28.65 C ATOM 2086 CD1 TYR A 989 33.877 -0.794 15.894 1.00 28.62 C ATOM 2087 CD2 TYR A 989 36.011 -1.328 16.776 1.00 30.51 C ATOM 2088 CE1 TYR A 989 34.058 0.529 16.246 1.00 29.75 C ATOM 2089 CE2 TYR A 989 36.210 -0.012 17.147 1.00 29.90 C ATOM 2090 CZ TYR A 989 35.232 0.921 16.868 1.00 30.85 C ATOM 2091 OH TYR A 989 35.420 2.209 17.259 1.00 31.16 O ATOM 2092 HH TYR A 989 34.638 2.752 16.989 1.00 0.00 H ATOM 2093 H TYR A 989 32.995 -2.884 13.470 1.00 0.00 H ATOM 2094 N ILE A 990 35.430 -5.860 13.945 1.00 29.60 N ATOM 2095 CA ILE A 990 35.192 -7.268 13.580 1.00 28.73 C ATOM 2096 C ILE A 990 36.012 -8.189 14.497 1.00 31.14 C ATOM 2097 O ILE A 990 37.207 -7.946 14.713 1.00 32.06 O ATOM 2098 CB ILE A 990 35.501 -7.543 12.103 1.00 28.83 C ATOM 2099 CG1 ILE A 990 34.710 -6.642 11.154 1.00 28.82 C ATOM 2100 CG2 ILE A 990 35.261 -9.023 11.820 1.00 29.88 C ATOM 2101 CD1 ILE A 990 35.379 -5.310 10.848 1.00 29.06 C ATOM 2102 H ILE A 990 36.410 -5.536 14.076 1.00 0.00 H ATOM 2103 N VAL A 991 35.361 -9.221 15.024 1.00 30.73 N ATOM 2104 CA VAL A 991 36.026 -10.329 15.750 1.00 30.83 C ATOM 2105 C VAL A 991 35.688 -11.620 15.008 1.00 30.65 C ATOM 2106 O VAL A 991 34.627 -11.689 14.376 1.00 30.56 O ATOM 2107 CB VAL A 991 35.620 -10.341 17.234 1.00 30.57 C ATOM 2108 CG1 VAL A 991 36.189 -9.127 17.941 1.00 29.87 C ATOM 2109 CG2 VAL A 991 34.113 -10.447 17.431 1.00 29.75 C ATOM 2110 H VAL A 991 34.327 -9.253 14.921 1.00 0.00 H ATOM 2111 N TYR A 992 36.622 -12.554 15.006 1.00 33.91 N ATOM 2112 CA TYR A 992 36.538 -13.825 14.251 1.00 36.05 C ATOM 2113 C TYR A 992 36.401 -14.974 15.245 1.00 37.03 C ATOM 2114 O TYR A 992 36.543 -16.119 14.826 1.00 36.58 O ATOM 2115 CB TYR A 992 37.765 -13.993 13.353 1.00 38.04 C ATOM 2116 CG TYR A 992 37.944 -12.857 12.378 1.00 37.92 C ATOM 2117 CD1 TYR A 992 37.337 -12.870 11.131 1.00 38.30 C ATOM 2118 CD2 TYR A 992 38.662 -11.735 12.733 1.00 36.58 C ATOM 2119 CE1 TYR A 992 37.484 -11.820 10.233 1.00 37.60 C ATOM 2120 CE2 TYR A 992 38.847 -10.693 11.838 1.00 38.66 C ATOM 2121 CZ TYR A 992 38.249 -10.723 10.587 1.00 38.29 C ATOM 2122 OH TYR A 992 38.427 -9.669 9.738 1.00 36.10 O ATOM 2123 HH TYR A 992 37.940 -9.841 8.893 1.00 0.00 H ATOM 2124 H TYR A 992 37.476 -12.385 15.575 1.00 0.00 H ATOM 2125 N ASP A 993 36.114 -14.660 16.511 1.00 36.79 N ATOM 2126 CA ASP A 993 35.824 -15.679 17.551 1.00 38.35 C ATOM 2127 C ASP A 993 34.557 -15.235 18.291 1.00 37.11 C ATOM 2128 O ASP A 993 34.571 -14.158 18.870 1.00 36.25 O ATOM 2129 CB ASP A 993 37.065 -15.906 18.415 1.00 38.75 C ATOM 2130 CG ASP A 993 36.932 -16.994 19.471 1.00 41.26 C ATOM 2131 OD1 ASP A 993 35.797 -17.359 19.814 1.00 40.99 O ATOM 2132 OD2 ASP A 993 37.979 -17.452 19.948 1.00 45.97 O ATOM 2133 H ASP A 993 36.093 -13.656 16.781 1.00 0.00 H ATOM 2134 N ILE A 994 33.526 -16.079 18.274 1.00 37.37 N ATOM 2135 CA ILE A 994 32.174 -15.824 18.860 1.00 39.11 C ATOM 2136 C ILE A 994 32.298 -15.513 20.360 1.00 37.57 C ATOM 2137 O ILE A 994 31.435 -14.747 20.883 1.00 36.05 O ATOM 2138 CB ILE A 994 31.230 -17.020 18.598 1.00 39.91 C ATOM 2139 CG1 ILE A 994 31.682 -18.312 19.283 1.00 42.55 C ATOM 2140 CG2 ILE A 994 31.038 -17.239 17.110 1.00 41.29 C ATOM 2141 CD1 ILE A 994 30.792 -19.493 18.966 1.00 45.22 C ATOM 2142 H ILE A 994 33.675 -16.998 17.811 1.00 0.00 H ATOM 2143 N ALA A 995 33.337 -16.071 20.994 1.00 36.91 N ATOM 2144 CA ALA A 995 33.678 -15.929 22.428 1.00 38.02 C ATOM 2145 C ALA A 995 34.141 -14.503 22.788 1.00 37.23 C ATOM 2146 O ALA A 995 34.264 -14.217 23.991 1.00 39.84 O ATOM 2147 CB ALA A 995 34.748 -16.942 22.779 1.00 39.77 C ATOM 2148 H ALA A 995 33.969 -16.665 20.421 1.00 0.00 H ATOM 2149 N GLN A 996 34.458 -13.641 21.823 1.00 34.83 N ATOM 2150 CA GLN A 996 34.907 -12.255 22.124 1.00 33.76 C ATOM 2151 C GLN A 996 33.695 -11.333 22.315 1.00 32.83 C ATOM 2152 O GLN A 996 33.905 -10.111 22.536 1.00 31.81 O ATOM 2153 CB GLN A 996 35.843 -11.763 21.023 1.00 34.27 C ATOM 2154 CG GLN A 996 37.239 -12.345 21.178 1.00 36.01 C ATOM 2155 CD GLN A 996 38.136 -11.970 20.033 1.00 34.73 C ATOM 2156 OE1 GLN A 996 38.348 -12.768 19.135 1.00 37.75 O ATOM 2157 NE2 GLN A 996 38.656 -10.757 20.061 1.00 32.43 N ATOM 2158 HE22 GLN A 996 38.441 -10.117 20.852 1.00 0.00 H ATOM 2159 HE21 GLN A 996 39.281 -10.441 19.292 1.00 0.00 H ATOM 2160 H GLN A 996 34.390 -13.946 20.831 1.00 0.00 H ATOM 2161 N VAL A 997 32.482 -11.882 22.254 1.00 30.94 N ATOM 2162 CA VAL A 997 31.237 -11.073 22.305 1.00 30.96 C ATOM 2163 C VAL A 997 30.452 -11.475 23.545 1.00 31.84 C ATOM 2164 O VAL A 997 30.189 -12.670 23.740 1.00 30.13 O ATOM 2165 CB VAL A 997 30.409 -11.233 21.014 1.00 31.52 C ATOM 2166 CG1 VAL A 997 29.081 -10.495 21.081 1.00 31.39 C ATOM 2167 CG2 VAL A 997 31.221 -10.791 19.805 1.00 31.07 C ATOM 2168 H VAL A 997 32.404 -12.915 22.167 1.00 0.00 H ATOM 2169 N ASN A 998 30.067 -10.475 24.329 1.00 32.06 N ATOM 2170 CA ASN A 998 29.149 -10.634 25.477 1.00 33.90 C ATOM 2171 C ASN A 998 27.997 -9.656 25.244 1.00 31.99 C ATOM 2172 O ASN A 998 28.175 -8.462 25.490 1.00 31.89 O ATOM 2173 CB ASN A 998 29.913 -10.450 26.789 1.00 38.56 C ATOM 2174 CG ASN A 998 29.014 -10.404 28.005 1.00 44.88 C ATOM 2175 OD1 ASN A 998 29.315 -9.705 28.974 1.00 51.76 O ATOM 2176 ND2 ASN A 998 27.923 -11.150 27.957 1.00 42.38 N ATOM 2177 HD22 ASN A 998 27.720 -11.721 27.111 1.00 0.00 H ATOM 2178 HD21 ASN A 998 27.268 -11.166 28.765 1.00 0.00 H ATOM 2179 H ASN A 998 30.433 -9.523 24.123 1.00 0.00 H ATOM 2180 N LEU A 999 26.857 -10.150 24.768 1.00 31.18 N ATOM 2181 CA LEU A 999 25.663 -9.312 24.496 1.00 31.17 C ATOM 2182 C LEU A 999 25.163 -8.735 25.819 1.00 31.63 C ATOM 2183 O LEU A 999 24.966 -9.527 26.751 1.00 35.17 O ATOM 2184 CB LEU A 999 24.618 -10.183 23.792 1.00 32.81 C ATOM 2185 CG LEU A 999 25.008 -10.665 22.397 1.00 33.17 C ATOM 2186 CD1 LEU A 999 23.839 -11.371 21.739 1.00 34.22 C ATOM 2187 CD2 LEU A 999 25.495 -9.505 21.524 1.00 32.23 C ATOM 2188 H LEU A 999 26.800 -11.171 24.578 1.00 0.00 H ATOM 2189 N LYS A1000 25.011 -7.413 25.925 1.00 30.96 N ATOM 2190 CA LYS A1000 24.659 -6.730 27.204 1.00 33.70 C ATOM 2191 C LYS A1000 23.246 -6.129 27.148 1.00 32.32 C ATOM 2192 O LYS A1000 22.526 -6.203 28.163 1.00 33.67 O ATOM 2193 CB LYS A1000 25.647 -5.608 27.540 1.00 37.84 C ATOM 2194 CG LYS A1000 27.064 -6.042 27.917 1.00 43.32 C ATOM 2195 CD LYS A1000 27.193 -6.757 29.236 1.00 47.23 C ATOM 2196 CE LYS A1000 27.052 -5.858 30.454 1.00 55.28 C ATOM 2197 NZ LYS A1000 28.291 -5.088 30.757 1.00 59.96 N ATOM 2198 HZ1 LYS A1000 29.072 -5.749 30.941 1.00 0.00 H ATOM 2199 HZ2 LYS A1000 28.530 -4.484 29.945 1.00 0.00 H ATOM 2200 HZ3 LYS A1000 28.132 -4.495 31.596 1.00 0.00 H ATOM 2201 H LYS A1000 25.145 -6.830 25.074 1.00 0.00 H ATOM 2202 N TYR A1001 22.862 -5.514 26.034 1.00 30.63 N ATOM 2203 CA TYR A1001 21.552 -4.828 25.926 1.00 30.96 C ATOM 2204 C TYR A1001 20.912 -5.094 24.574 1.00 30.69 C ATOM 2205 O TYR A1001 21.575 -5.410 23.584 1.00 34.63 O ATOM 2206 CB TYR A1001 21.661 -3.320 26.133 1.00 31.13 C ATOM 2207 CG TYR A1001 22.343 -2.873 27.394 1.00 30.90 C ATOM 2208 CD1 TYR A1001 21.644 -2.711 28.579 1.00 32.53 C ATOM 2209 CD2 TYR A1001 23.702 -2.601 27.401 1.00 31.93 C ATOM 2210 CE1 TYR A1001 22.283 -2.291 29.738 1.00 33.76 C ATOM 2211 CE2 TYR A1001 24.357 -2.184 28.545 1.00 32.59 C ATOM 2212 CZ TYR A1001 23.637 -2.013 29.715 1.00 34.14 C ATOM 2213 OH TYR A1001 24.272 -1.582 30.835 1.00 39.02 O ATOM 2214 HH TYR A1001 23.620 -1.513 31.577 1.00 0.00 H ATOM 2215 H TYR A1001 23.500 -5.514 25.213 1.00 0.00 H ATOM 2216 N LEU A1002 19.598 -4.984 24.571 1.00 32.97 N ATOM 2217 CA LEU A1002 18.749 -5.101 23.373 1.00 31.36 C ATOM 2218 C LEU A1002 17.794 -3.921 23.438 1.00 31.94 C ATOM 2219 O LEU A1002 17.134 -3.755 24.482 1.00 35.13 O ATOM 2220 CB LEU A1002 18.025 -6.446 23.409 1.00 33.85 C ATOM 2221 CG LEU A1002 17.114 -6.768 22.222 1.00 35.10 C ATOM 2222 CD1 LEU A1002 17.847 -6.620 20.909 1.00 36.21 C ATOM 2223 CD2 LEU A1002 16.559 -8.174 22.347 1.00 36.88 C ATOM 2224 H LEU A1002 19.127 -4.801 25.480 1.00 0.00 H ATOM 2225 N LEU A1003 17.814 -3.084 22.412 1.00 32.03 N ATOM 2226 CA LEU A1003 16.943 -1.892 22.306 1.00 34.19 C ATOM 2227 C LEU A1003 15.839 -2.196 21.297 1.00 34.37 C ATOM 2228 O LEU A1003 16.134 -2.813 20.255 1.00 35.74 O ATOM 2229 CB LEU A1003 17.769 -0.683 21.859 1.00 34.26 C ATOM 2230 CG LEU A1003 18.594 0.002 22.944 1.00 35.17 C ATOM 2231 CD1 LEU A1003 19.557 -0.970 23.588 1.00 34.82 C ATOM 2232 CD2 LEU A1003 19.333 1.200 22.378 1.00 35.17 C ATOM 2233 H LEU A1003 18.480 -3.275 21.636 1.00 0.00 H ATOM 2234 N LYS A1004 14.622 -1.788 21.622 1.00 34.71 N ATOM 2235 CA LYS A1004 13.490 -1.693 20.668 1.00 36.24 C ATOM 2236 C LYS A1004 13.464 -0.250 20.179 1.00 36.28 C ATOM 2237 O LYS A1004 13.281 0.651 21.030 1.00 34.61 O ATOM 2238 CB LYS A1004 12.182 -2.074 21.351 1.00 38.15 C ATOM 2239 CG LYS A1004 11.010 -2.332 20.415 1.00 41.03 C ATOM 2240 CD LYS A1004 9.679 -2.145 21.099 1.00 45.03 C ATOM 2241 CE LYS A1004 8.736 -3.313 20.924 1.00 47.29 C ATOM 2242 NZ LYS A1004 7.517 -3.116 21.743 1.00 48.02 N ATOM 2243 HZ1 LYS A1004 7.783 -3.040 22.746 1.00 0.00 H ATOM 2244 HZ2 LYS A1004 7.037 -2.243 21.444 1.00 0.00 H ATOM 2245 HZ3 LYS A1004 6.878 -3.926 21.613 1.00 0.00 H ATOM 2246 H LYS A1004 14.448 -1.516 22.611 1.00 0.00 H ATOM 2247 N LEU A1005 13.709 -0.054 18.885 1.00 37.02 N ATOM 2248 CA LEU A1005 13.827 1.288 18.256 1.00 40.63 C ATOM 2249 C LEU A1005 12.606 1.584 17.394 1.00 41.15 C ATOM 2250 O LEU A1005 12.204 0.716 16.599 1.00 42.58 O ATOM 2251 CB LEU A1005 15.066 1.324 17.371 1.00 42.24 C ATOM 2252 CG LEU A1005 16.392 1.252 18.113 1.00 43.87 C ATOM 2253 CD1 LEU A1005 17.534 1.253 17.108 1.00 44.52 C ATOM 2254 CD2 LEU A1005 16.516 2.406 19.101 1.00 45.13 C ATOM 2255 H LEU A1005 13.825 -0.890 18.278 1.00 0.00 H ATOM 2256 N LYS A1006 12.068 2.787 17.540 1.00 44.45 N ATOM 2257 CA LYS A1006 11.125 3.389 16.570 1.00 45.93 C ATOM 2258 C LYS A1006 11.966 4.105 15.512 1.00 44.75 C ATOM 2259 O LYS A1006 12.810 4.952 15.895 1.00 43.66 O ATOM 2260 CB LYS A1006 10.154 4.337 17.282 1.00 49.03 C ATOM 2261 CG LYS A1006 9.154 5.063 16.392 1.00 52.96 C ATOM 2262 CD LYS A1006 8.346 4.140 15.503 1.00 55.37 C ATOM 2263 CE LYS A1006 7.527 4.880 14.465 1.00 60.67 C ATOM 2264 NZ LYS A1006 6.493 5.740 15.089 1.00 63.71 N ATOM 2265 HZ1 LYS A1006 5.849 5.151 15.654 1.00 0.00 H ATOM 2266 HZ2 LYS A1006 6.952 6.442 15.704 1.00 0.00 H ATOM 2267 HZ3 LYS A1006 5.955 6.229 14.345 1.00 0.00 H ATOM 2268 H LYS A1006 12.323 3.339 18.384 1.00 0.00 H ATOM 2269 N PHE A1007 11.785 3.742 14.243 1.00 44.65 N ATOM 2270 CA PHE A1007 12.354 4.476 13.087 1.00 45.93 C ATOM 2271 C PHE A1007 11.278 5.437 12.583 1.00 49.52 C ATOM 2272 O PHE A1007 10.205 4.959 12.182 1.00 51.70 O ATOM 2273 CB PHE A1007 12.780 3.529 11.967 1.00 44.82 C ATOM 2274 CG PHE A1007 13.935 2.621 12.293 1.00 43.08 C ATOM 2275 CD1 PHE A1007 13.793 1.587 13.202 1.00 42.11 C ATOM 2276 CD2 PHE A1007 15.145 2.755 11.641 1.00 43.23 C ATOM 2277 CE1 PHE A1007 14.848 0.732 13.476 1.00 41.37 C ATOM 2278 CE2 PHE A1007 16.200 1.900 11.917 1.00 41.83 C ATOM 2279 CZ PHE A1007 16.050 0.891 12.832 1.00 40.33 C ATOM 2280 H PHE A1007 11.212 2.895 14.052 1.00 0.00 H ATOM 2281 N ASN A1008 11.539 6.741 12.645 1.00 52.39 N ATOM 2282 CA ASN A1008 10.640 7.793 12.098 1.00 55.34 C ATOM 2283 C ASN A1008 11.169 8.182 10.713 1.00 56.34 C ATOM 2284 O ASN A1008 12.163 8.941 10.644 1.00 54.28 O ATOM 2285 CB ASN A1008 10.537 8.965 13.075 1.00 57.84 C ATOM 2286 CG ASN A1008 9.931 8.549 14.400 1.00 59.49 C ATOM 2287 OD1 ASN A1008 8.841 7.980 14.428 1.00 62.03 O ATOM 2288 ND2 ASN A1008 10.624 8.814 15.501 1.00 59.91 N ATOM 2289 HD22 ASN A1008 11.542 9.297 15.434 1.00 0.00 H ATOM 2290 HD21 ASN A1008 10.248 8.538 16.431 1.00 0.00 H ATOM 2291 H ASN A1008 12.423 7.042 13.103 1.00 0.00 H ATOM 2292 N PHE A1009 10.543 7.656 9.653 1.00 58.56 N ATOM 2293 CA PHE A1009 10.974 7.844 8.238 1.00 61.74 C ATOM 2294 C PHE A1009 10.555 9.235 7.751 1.00 64.33 C ATOM 2295 O PHE A1009 9.497 9.712 8.160 1.00 64.39 O ATOM 2296 CB PHE A1009 10.461 6.695 7.362 1.00 61.50 C ATOM 2297 CG PHE A1009 11.254 5.431 7.580 1.00 59.62 C ATOM 2298 CD1 PHE A1009 12.527 5.300 7.050 1.00 57.68 C ATOM 2299 CD2 PHE A1009 10.768 4.418 8.392 1.00 58.14 C ATOM 2300 CE1 PHE A1009 13.283 4.163 7.293 1.00 56.65 C ATOM 2301 CE2 PHE A1009 11.524 3.280 8.631 1.00 57.56 C ATOM 2302 CZ PHE A1009 12.779 3.153 8.083 1.00 54.65 C ATOM 2303 H PHE A1009 9.698 7.076 9.829 1.00 0.00 H ATOM 2304 N LYS A1010 11.396 9.878 6.936 1.00 69.32 N ATOM 2305 CA LYS A1010 11.157 11.250 6.405 1.00 76.34 C ATOM 2306 C LYS A1010 10.848 11.173 4.909 1.00 76.83 C ATOM 2307 O LYS A1010 9.736 11.547 4.535 1.00 83.23 O ATOM 2308 CB LYS A1010 12.359 12.150 6.708 1.00 79.34 C ATOM 2309 CG LYS A1010 12.567 12.458 8.189 1.00 80.58 C ATOM 2310 CD LYS A1010 13.267 13.784 8.458 1.00 83.47 C ATOM 2311 CE LYS A1010 14.775 13.706 8.329 1.00 82.32 C ATOM 2312 NZ LYS A1010 15.375 12.835 9.370 1.00 78.34 N ATOM 2313 HZ1 LYS A1010 15.147 13.214 10.311 1.00 0.00 H ATOM 2314 HZ2 LYS A1010 14.990 11.873 9.280 1.00 0.00 H ATOM 2315 HZ3 LYS A1010 16.407 12.809 9.246 1.00 0.00 H ATOM 2316 H LYS A1010 12.271 9.391 6.655 1.00 0.00 H TER 2317 LYS A1010 HETATM 2318 O HOH 1 24.586 -12.333 26.917 1.00 31.83 O HETATM 2319 O HOH 2 25.695 7.030 4.284 1.00 47.14 O HETATM 2320 O HOH 3 38.143 0.604 24.132 1.00 52.35 O HETATM 2321 O HOH 4 28.159 -1.446 6.573 1.00 51.00 O HETATM 2322 O HOH 5 37.686 -11.962 -1.292 1.00 58.21 O HETATM 2323 O HOH 6 36.238 4.849 28.391 1.00 66.10 O HETATM 2324 O HOH 7 30.447 -2.145 6.284 1.00 44.92 O HETATM 2325 O HOH 8 36.220 -8.827 27.902 1.00 71.21 O HETATM 2326 O HOH 9 31.054 -14.859 24.615 1.00 47.98 O HETATM 2327 O HOH 10 27.624 -4.802 4.398 1.00 39.15 O HETATM 2328 O HOH 11 13.563 -6.276 10.666 1.00 38.54 O HETATM 2329 O HOH 12 8.939 -4.145 24.096 1.00 39.00 O HETATM 2330 O HOH 13 32.797 -13.859 31.067 1.00 54.15 O HETATM 2331 O HOH 14 15.788 -22.776 22.288 1.00 51.15 O HETATM 2332 O HOH 15 40.950 -11.999 29.812 1.00 51.54 O HETATM 2333 O HOH 16 24.936 1.041 7.404 1.00 37.41 O HETATM 2334 O HOH 17 46.367 2.328 12.662 1.00 36.80 O HETATM 2335 O HOH 18 40.928 -3.769 -1.223 1.00 39.07 O HETATM 2336 O HOH 19 20.504 12.743 17.111 1.00 50.55 O HETATM 2337 O HOH 20 38.508 12.354 8.473 1.00 46.89 O HETATM 2338 O HOH 21 15.252 -15.321 32.779 1.00 40.65 O HETATM 2339 O HOH 22 38.913 -12.136 16.579 1.00 35.28 O HETATM 2340 O HOH 23 30.627 2.908 13.293 1.00 29.89 O HETATM 2341 O HOH 24 31.940 -4.529 5.899 1.00 36.19 O HETATM 2342 O HOH 25 32.427 10.069 7.079 1.00 41.73 O HETATM 2343 O HOH 26 27.285 -17.644 19.180 1.00 36.97 O HETATM 2344 O HOH 27 46.889 -11.031 8.514 1.00 46.61 O HETATM 2345 O HOH 28 15.030 -16.979 28.057 1.00 34.44 O HETATM 2346 O HOH 29 29.923 10.966 6.837 1.00 39.09 O HETATM 2347 O HOH 30 32.546 5.871 13.083 1.00 30.78 O HETATM 2348 O HOH 31 30.905 -7.246 -0.555 1.00 60.96 O HETATM 2349 O HOH 32 25.499 -10.042 29.545 1.00 40.64 O HETATM 2350 O HOH 33 33.210 8.980 22.064 1.00 40.49 O HETATM 2351 O HOH 34 38.482 6.238 12.168 1.00 30.48 O HETATM 2352 O HOH 35 29.690 -13.395 9.150 1.00 48.28 O HETATM 2353 O HOH 36 37.826 -1.026 0.224 1.00 38.29 O HETATM 2354 O HOH 37 25.608 -13.145 5.675 1.00 51.29 O HETATM 2355 O HOH 38 13.054 -13.456 15.409 1.00 45.67 O HETATM 2356 O HOH 39 35.551 17.160 12.769 1.00 55.38 O HETATM 2357 O HOH 40 19.509 -9.719 32.280 1.00 41.04 O HETATM 2358 O HOH 41 28.302 -2.224 30.248 1.00 52.26 O HETATM 2359 O HOH 42 47.490 -9.292 6.879 1.00 44.69 O HETATM 2360 O HOH 43 12.329 -6.458 33.815 1.00 44.85 O HETATM 2361 O HOH 44 21.144 -18.075 24.880 1.00 41.24 O HETATM 2362 O HOH 45 29.089 -14.163 19.580 1.00 37.52 O HETATM 2363 O HOH 46 20.942 -7.522 8.577 1.00 44.12 O HETATM 2364 O HOH 47 15.164 -5.320 13.774 1.00 30.30 O HETATM 2365 O HOH 48 18.380 11.500 11.052 1.00 50.77 O HETATM 2366 O HOH 49 15.621 -16.120 14.297 1.00 36.98 O HETATM 2367 O HOH 50 13.374 0.623 28.992 1.00 39.08 O HETATM 2368 O HOH 51 23.045 -10.528 12.317 1.00 44.24 O HETATM 2369 O HOH 52 17.705 9.971 15.437 1.00 51.64 O HETATM 2370 O HOH 53 24.357 -14.675 14.126 1.00 42.11 O HETATM 2371 O HOH 54 22.479 -17.983 11.684 1.00 62.80 O HETATM 2372 O HOH 55 19.572 -9.506 8.830 1.00 46.86 O HETATM 2373 O HOH 56 47.397 -1.768 9.871 1.00 35.03 O HETATM 2374 O HOH 57 23.683 -12.929 12.532 1.00 46.08 O HETATM 2375 O HOH 58 8.526 -13.311 34.980 1.00 52.74 O HETATM 2376 O HOH 59 22.966 -16.594 15.269 1.00 50.26 O HETATM 2377 O HOH 60 16.894 -0.309 35.654 1.00 46.06 O HETATM 2378 O HOH 61 38.573 -1.156 27.917 1.00 41.47 O HETATM 2379 O HOH 62 22.966 -8.131 10.424 1.00 34.47 O HETATM 2380 O HOH 63 28.044 11.665 10.783 1.00 37.46 O HETATM 2381 O HOH 64 34.037 13.885 9.192 1.00 57.95 O HETATM 2382 O HOH 65 21.392 -3.159 3.762 1.00 76.27 O HETATM 2383 O HOH 66 25.729 -14.577 10.726 1.00 64.28 O HETATM 2384 O HOH 67 47.630 -12.223 22.078 1.00 54.32 O HETATM 2385 O HOH 68 16.613 -0.078 9.027 1.00 39.34 O HETATM 2386 O HOH 69 41.521 -10.388 0.461 1.00 33.53 O HETATM 2387 O HOH 70 43.577 -3.226 3.567 1.00 42.84 O HETATM 2388 O HOH 71 26.856 -13.469 21.007 1.00 39.74 O HETATM 2389 O HOH 72 42.772 -15.181 13.179 1.00 55.18 O HETATM 2390 O HOH 73 17.867 8.709 22.326 1.00 38.66 O HETATM 2391 O HOH 74 50.596 -7.303 17.506 1.00 51.90 O HETATM 2392 O HOH 75 44.932 -1.656 19.268 1.00 39.38 O HETATM 2393 O HOH 76 26.896 -18.860 25.722 1.00 70.19 O HETATM 2394 O HOH 77 2.800 -17.662 28.913 1.00 49.01 O HETATM 2395 O HOH 78 30.123 -18.940 14.333 1.00 42.05 O HETATM 2396 O HOH 79 5.387 -2.445 26.472 1.00 46.30 O HETATM 2397 O HOH 80 30.568 14.451 22.304 1.00 48.47 O HETATM 2398 O HOH 81 33.333 7.274 32.735 1.00 57.14 O HETATM 2399 O HOH 82 7.055 5.079 9.701 1.00 56.06 O HETATM 2400 O HOH 83 49.322 -5.076 18.230 1.00 45.43 O HETATM 2401 O HOH 84 -0.144 -11.015 31.482 1.00 50.60 O HETATM 2402 O HOH 85 44.299 -0.941 4.719 1.00 40.15 O HETATM 2403 O HOH 86 20.935 12.183 10.099 1.00 47.34 O HETATM 2404 O HOH 87 17.897 9.607 19.666 1.00 51.25 O HETATM 2405 O HOH 88 19.279 7.009 5.560 1.00 55.17 O HETATM 2406 O HOH 89 15.646 7.991 22.539 1.00 47.73 O HETATM 2407 O HOH 90 24.922 -1.194 3.992 1.00 57.15 O HETATM 2408 O HOH 91 28.092 -19.196 32.750 1.00 57.50 O HETATM 2409 O HOH 92 35.399 7.727 1.874 1.00 56.88 O HETATM 2410 O HOH 93 34.336 -18.750 16.656 1.00 42.66 O HETATM 2411 O HOH 94 9.958 -11.964 13.422 1.00 56.35 O HETATM 2412 O HOH 95 23.679 3.278 3.893 1.00 51.11 O HETATM 2413 O HOH 96 24.215 -15.834 8.975 1.00 62.44 O HETATM 2414 O HOH 97 42.897 -13.393 25.329 1.00 53.96 O HETATM 2415 O HOH 98 16.955 -17.133 31.880 1.00 50.45 O HETATM 2416 O HOH 99 17.207 3.411 5.593 1.00 64.63 O HETATM 2417 O HOH 100 24.287 -15.652 6.518 1.00 63.43 O HETATM 2418 O HOH 101 24.653 -17.266 11.101 1.00 56.40 O HETATM 2419 O HOH 102 28.910 -18.460 -2.190 1.00 51.13 O HETATM 2420 O HOH 103 48.449 2.014 1.385 1.00 58.00 O HETATM 2421 O HOH 104 40.399 6.744 13.856 1.00 41.62 O HETATM 2422 O HOH 105 33.969 -14.330 33.906 1.00 47.35 O HETATM 2423 O HOH 106 34.224 11.962 5.028 1.00 59.78 O HETATM 2424 N1 KYV A 107 23.133 -11.642 6.669 1.00 -0.27 N HETATM 2425 C13 KYV A 107 23.402 -10.617 5.834 1.00 0.20 C HETATM 2426 C12 KYV A 107 24.442 -9.613 6.220 1.00 0.05 C HETATM 2427 C11 KYV A 107 24.289 -8.772 7.319 1.00 -0.05 C HETATM 2428 C10 KYV A 107 25.289 -7.882 7.674 1.00 -0.05 C HETATM 2429 C9 KYV A 107 26.477 -7.801 6.942 1.00 -0.03 C HETATM 2430 C8 KYV A 107 27.590 -6.897 7.214 1.00 -0.01 C HETATM 2431 C7 KYV A 107 27.741 -5.910 8.101 1.00 0.18 C HETATM 2432 C6 KYV A 107 28.759 -4.856 8.059 1.00 0.20 C HETATM 2433 O1 KYV A 107 29.574 -4.661 7.147 1.00 -0.37 O HETATM 2434 C5 KYV A 107 28.531 -4.086 9.301 1.00 0.08 C HETATM 2435 C4 KYV A 107 29.267 -3.089 9.941 1.00 -0.05 C HETATM 2436 C3 KYV A 107 28.891 -2.678 11.214 1.00 -0.06 C HETATM 2437 C2 KYV A 107 27.784 -3.237 11.840 1.00 -0.04 C HETATM 2438 C1 KYV A 107 27.032 -4.231 11.209 1.00 0.09 C HETATM 2439 C27 KYV A 107 27.449 -4.669 9.953 1.00 0.16 C HETATM 2440 O3 KYV A 107 26.972 -5.752 9.238 1.00 -0.23 O HETATM 2441 C KYV A 107 25.785 -4.714 11.886 1.00 0.20 C HETATM 2442 O KYV A 107 25.330 -4.095 12.857 1.00 -0.39 O HETATM 2443 N KYV A 107 25.191 -5.795 11.387 1.00 -0.30 N HETATM 2444 H22 KYV A 107 24.357 -6.148 11.811 1.00 0.18 H HETATM 2445 H23 KYV A 107 25.579 -6.255 10.588 1.00 0.18 H HETATM 2446 H4 KYV A 107 27.500 -2.898 12.830 1.00 0.07 H HETATM 2447 H2 KYV A 107 29.467 -1.914 11.723 1.00 0.06 H HETATM 2448 H6 KYV A 107 30.123 -2.640 9.451 1.00 0.07 H HETATM 2449 H3 KYV A 107 28.458 -7.057 6.576 1.00 0.06 H HETATM 2450 C26 KYV A 107 26.613 -8.638 5.832 1.00 -0.05 C HETATM 2451 C25 KYV A 107 25.613 -9.526 5.476 1.00 -0.05 C HETATM 2452 H20 KYV A 107 25.744 -10.161 4.607 1.00 0.07 H HETATM 2453 H21 KYV A 107 27.519 -8.591 5.238 1.00 0.06 H HETATM 2454 H5 KYV A 107 25.148 -7.237 8.534 1.00 0.06 H HETATM 2455 H7 KYV A 107 23.377 -8.814 7.903 1.00 0.07 H HETATM 2456 O2 KYV A 107 22.858 -10.514 4.757 1.00 -0.39 O HETATM 2457 C24 KYV A 107 23.777 -11.878 7.971 1.00 0.05 C HETATM 2458 C23 KYV A 107 22.732 -12.082 9.050 1.00 0.06 C HETATM 2459 N2 KYV A 107 21.850 -13.199 8.689 1.00 -0.26 N HETATM 2460 C16 KYV A 107 21.250 -14.004 9.649 1.00 0.22 C HETATM 2461 N3 KYV A 107 20.104 -14.636 9.493 1.00 -0.23 N HETATM 2462 C17 KYV A 107 19.884 -15.276 10.720 1.00 0.07 C HETATM 2463 C22 KYV A 107 20.937 -14.995 11.590 1.00 0.01 C HETATM 2464 N4 KYV A 107 21.801 -14.186 10.878 1.00 -0.31 N HETATM 2465 C21 KYV A 107 20.963 -15.489 12.889 1.00 -0.07 C HETATM 2466 C20 KYV A 107 19.907 -16.285 13.310 1.00 -0.08 C HETATM 2467 C19 KYV A 107 18.849 -16.575 12.454 1.00 -0.08 C HETATM 2468 C18 KYV A 107 18.826 -16.076 11.155 1.00 -0.04 C HETATM 2469 H15 KYV A 107 18.000 -16.305 10.492 1.00 0.05 H HETATM 2470 H14 KYV A 107 18.033 -17.197 12.803 1.00 0.05 H HETATM 2471 H13 KYV A 107 19.906 -16.686 14.317 1.00 0.05 H HETATM 2472 H12 KYV A 107 21.786 -15.259 13.556 1.00 0.05 H HETATM 2473 H1 KYV A 107 19.504 -14.655 8.656 1.00 0.23 H HETATM 2474 C15 KYV A 107 21.164 -12.918 7.421 1.00 0.06 C HETATM 2475 C14 KYV A 107 22.180 -12.701 6.306 1.00 0.05 C HETATM 2476 H18 KYV A 107 22.730 -13.637 6.132 1.00 0.05 H HETATM 2477 H19 KYV A 107 21.650 -12.410 5.387 1.00 0.05 H HETATM 2478 H16 KYV A 107 20.550 -12.012 7.534 1.00 0.05 H HETATM 2479 H17 KYV A 107 20.517 -13.769 7.162 1.00 0.05 H HETATM 2480 H10 KYV A 107 23.232 -12.306 10.004 1.00 0.05 H HETATM 2481 H11 KYV A 107 22.134 -11.165 9.156 1.00 0.05 H HETATM 2482 H8 KYV A 107 24.400 -11.009 8.230 1.00 0.05 H HETATM 2483 H9 KYV A 107 24.409 -12.776 7.905 1.00 0.05 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 2424 2425 2457 2475 CONECT 2425 2424 2426 2456 CONECT 2426 2425 2427 2451 CONECT 2427 2426 2428 2455 CONECT 2428 2427 2429 2454 CONECT 2429 2428 2430 2450 CONECT 2430 2429 2431 2449 CONECT 2431 2430 2432 2440 CONECT 2432 2431 2433 2434 CONECT 2433 2432 CONECT 2434 2432 2435 2439 CONECT 2435 2434 2436 2448 CONECT 2436 2435 2437 2447 CONECT 2437 2436 2438 2446 CONECT 2438 2437 2439 2441 CONECT 2439 2434 2438 2440 CONECT 2440 2431 2439 CONECT 2441 2438 2442 2443 CONECT 2442 2441 CONECT 2443 2441 2444 2445 CONECT 2444 2443 CONECT 2445 2443 CONECT 2446 2437 CONECT 2447 2436 CONECT 2448 2435 CONECT 2449 2430 CONECT 2450 2429 2451 2453 CONECT 2451 2426 2450 2452 CONECT 2452 2451 CONECT 2453 2450 CONECT 2454 2428 CONECT 2455 2427 CONECT 2456 2425 CONECT 2457 2424 2458 2482 2483 CONECT 2458 2457 2459 2480 2481 CONECT 2459 2458 2460 2474 CONECT 2460 2459 2461 2464 CONECT 2461 2460 2462 2473 CONECT 2462 2461 2463 2468 CONECT 2463 2462 2464 2465 CONECT 2464 2460 2463 CONECT 2465 2463 2466 2472 CONECT 2466 2465 2467 2471 CONECT 2467 2466 2468 2470 CONECT 2468 2462 2467 2469 CONECT 2469 2468 CONECT 2470 2467 CONECT 2471 2466 CONECT 2472 2465 CONECT 2473 2461 CONECT 2474 2459 2475 2478 2479 CONECT 2475 2424 2474 2476 2477 CONECT 2476 2475 CONECT 2477 2475 CONECT 2478 2474 CONECT 2479 2474 CONECT 2480 2458 CONECT 2481 2458 CONECT 2482 2457 CONECT 2483 2457 MASTER 0 0 0 0 0 0 0 0 2481 2 68 20 END
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Structure:
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Related entries of code: 6nrf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6bhv
RCSB PDB
PDBbind
271aa, >6BHV_1|Chains... *
6nrj
RCSB PDB
PDBbind
271aa, >6NRJ_1|Chain... at 100%
6nri
RCSB PDB
PDBbind
271aa, >6NRI_1|Chain... at 100%
6nrh
RCSB PDB
PDBbind
271aa, >6NRH_1|Chain... at 100%
6nrg
RCSB PDB
PDBbind
271aa, >6NRG_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
6nrf
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human PARP-1 ART domain
Ligand Name
KYV
EC.Number
E.C.2.4.2.30
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
IC50=18nM
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
8
H
2
3
N
5
O
4
Molecular Weight
493.513
Exact Mass
493.175
No. of atoms
60
No. of bonds
65
Polar Surface Area
121.62
LOGP Value
3.43 (
Computed with XLOGP3
)
3.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 6
Canonical SMILES
O=C(c1ccc(cc1)/C=C/1\Oc2c(C1=O)cccc2C(=O)N)N1CCN(CC1)c1nc2c([nH]1)cccc2
InChI String
InChI=1S/C28H23N5O4/c29-26(35)20-5-3-4-19-24(34)23(37-25(19)20)16-17-8-10-18(11-9-17)27(36)32-12-14-33(15-13-32)28-30-21-6-1-2-7-22(21)31-28/h1-11,16H,12-15H2,(H2,29,35)(H,30,31)/b23-16-
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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times since Nov 2007.
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