Browse entries in the PDBbind-CN Database
HEADER 6NRI_COMPLEX COMPND 6NRI_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 224 GLY ASP PRO ILE ASP VAL ASN TYR GLU LYS LEU LYS THR SEQRES 2 A 224 ASP ILE LYS VAL VAL ASP ARG ASP SER GLU GLU ALA GLU SEQRES 3 A 224 ILE ILE ARG LYS TYR VAL LYS ASN THR HIS ALA THR THR SEQRES 4 A 224 HIS ASN ALA TYR ASP LEU GLU VAL ILE ASP ILE PHE LYS SEQRES 5 A 224 ILE GLU ARG GLU GLY GLU CYS GLN ARG TYR LYS PRO PHE SEQRES 6 A 224 LYS GLN LEU HIS ASN ARG ARG LEU LEU TRP HIS GLY SER SEQRES 7 A 224 ARG THR THR ASN PHE ALA GLY ILE LEU SER GLN GLY LEU SEQRES 8 A 224 ARG ILE ALA PRO PRO GLU ALA PRO VAL THR GLY TYR MET SEQRES 9 A 224 PHE GLY LYS GLY ILE TYR PHE ALA ASP MET VAL SER LYS SEQRES 10 A 224 SER ALA ASN TYR CYS HIS THR SER GLN GLY ASP PRO ILE SEQRES 11 A 224 GLY LEU ILE LEU LEU GLY GLU VAL ALA LEU GLY ASN MET SEQRES 12 A 224 TYR GLU LEU LYS HIS ALA SER HIS ILE SER LYS LEU PRO SEQRES 13 A 224 LYS GLY LYS HIS SER VAL LYS GLY LEU GLY LYS THR THR SEQRES 14 A 224 PRO ASP PRO SER ALA ASN ILE SER LEU ASP GLY VAL ASP SEQRES 15 A 224 VAL PRO LEU GLY THR GLY ILE SER SER GLY VAL ASN ASP SEQRES 16 A 224 THR SER LEU LEU TYR ASN GLU TYR ILE VAL TYR ASP ILE SEQRES 17 A 224 ALA GLN VAL ASN LEU LYS TYR LEU LEU LYS LEU LYS PHE SEQRES 18 A 224 ASN PHE LYS HET KYM A 298 53 ATOM 1 N LYS A 764 -1.543 -15.340 33.549 1.00 80.84 N ATOM 2 CA LYS A 764 -0.731 -16.513 33.941 1.00 79.01 C ATOM 3 C LYS A 764 0.772 -16.207 33.859 1.00 72.82 C ATOM 4 O LYS A 764 1.523 -16.916 34.466 1.00 74.97 O ATOM 5 CB LYS A 764 -1.100 -17.742 33.102 1.00 82.84 C ATOM 6 CG LYS A 764 -1.468 -18.980 33.921 1.00 87.86 C ATOM 7 CD LYS A 764 -2.677 -19.767 33.403 1.00 93.39 C ATOM 8 CE LYS A 764 -2.623 -20.079 31.917 1.00 94.46 C ATOM 9 NZ LYS A 764 -1.248 -20.405 31.456 1.00 92.00 N ATOM 10 HZ1 LYS A 764 -0.622 -19.595 31.638 1.00 0.00 H ATOM 11 HZ2 LYS A 764 -0.899 -21.237 31.972 1.00 0.00 H ATOM 12 HZ3 LYS A 764 -1.265 -20.610 30.437 1.00 0.00 H ATOM 13 HN3 LYS A 764 -1.313 -15.072 32.571 1.00 0.00 H ATOM 14 HN2 LYS A 764 -1.332 -14.545 34.186 1.00 0.00 H ATOM 15 HN1 LYS A 764 -2.553 -15.581 33.616 1.00 0.00 H ATOM 16 N SER A 765 1.233 -15.187 33.126 1.00 68.67 N ATOM 17 CA SER A 765 2.696 -14.855 33.178 1.00 64.85 C ATOM 18 C SER A 765 3.017 -14.153 34.507 1.00 63.36 C ATOM 19 O SER A 765 2.277 -13.317 34.940 1.00 63.50 O ATOM 20 CB SER A 765 3.162 -14.008 32.023 1.00 62.32 C ATOM 21 OG SER A 765 4.539 -13.625 32.168 1.00 57.50 O ATOM 22 HG SER A 765 5.104 -14.437 32.208 1.00 0.00 H ATOM 23 H SER A 765 0.587 -14.632 32.529 1.00 0.00 H ATOM 24 N LYS A 766 4.169 -14.478 35.102 1.00 63.61 N ATOM 25 CA LYS A 766 4.623 -13.871 36.357 1.00 62.25 C ATOM 26 C LYS A 766 5.766 -12.891 36.082 1.00 57.93 C ATOM 27 O LYS A 766 6.377 -12.375 37.009 1.00 57.26 O ATOM 28 CB LYS A 766 5.031 -14.977 37.330 1.00 63.60 C ATOM 29 CG LYS A 766 3.864 -15.706 37.976 1.00 66.66 C ATOM 30 CD LYS A 766 4.314 -16.850 38.845 1.00 69.83 C ATOM 31 CE LYS A 766 3.190 -17.574 39.538 1.00 73.00 C ATOM 32 NZ LYS A 766 2.469 -16.643 40.427 1.00 76.77 N ATOM 33 HZ1 LYS A 766 3.127 -16.266 41.139 1.00 0.00 H ATOM 34 HZ2 LYS A 766 2.079 -15.860 39.864 1.00 0.00 H ATOM 35 HZ3 LYS A 766 1.695 -17.149 40.902 1.00 0.00 H ATOM 36 H LYS A 766 4.772 -15.196 34.653 1.00 0.00 H ATOM 37 N LEU A 767 6.024 -12.622 34.800 1.00 54.28 N ATOM 38 CA LEU A 767 7.052 -11.697 34.406 1.00 53.08 C ATOM 39 C LEU A 767 6.514 -10.269 34.430 1.00 53.35 C ATOM 40 O LEU A 767 5.340 -10.034 34.151 1.00 52.40 O ATOM 41 CB LEU A 767 7.560 -12.037 33.007 1.00 50.61 C ATOM 42 CG LEU A 767 8.401 -13.308 32.902 1.00 51.60 C ATOM 43 CD1 LEU A 767 8.606 -13.665 31.438 1.00 50.84 C ATOM 44 CD2 LEU A 767 9.769 -13.145 33.578 1.00 51.10 C ATOM 45 H LEU A 767 5.464 -13.096 34.063 1.00 0.00 H ATOM 46 N PRO A 768 7.383 -9.273 34.711 1.00 53.37 N ATOM 47 CA PRO A 768 7.017 -7.864 34.560 1.00 56.16 C ATOM 48 C PRO A 768 6.520 -7.632 33.124 1.00 55.99 C ATOM 49 O PRO A 768 7.070 -8.242 32.187 1.00 53.17 O ATOM 50 CB PRO A 768 8.334 -7.110 34.810 1.00 56.47 C ATOM 51 CG PRO A 768 9.177 -8.094 35.610 1.00 56.47 C ATOM 52 CD PRO A 768 8.803 -9.452 35.053 1.00 53.87 C ATOM 53 N LYS A 769 5.498 -6.779 32.965 1.00 58.32 N ATOM 54 CA LYS A 769 4.832 -6.565 31.670 1.00 60.19 C ATOM 55 C LYS A 769 5.829 -6.220 30.553 1.00 57.34 C ATOM 56 O LYS A 769 5.717 -6.764 29.467 1.00 58.31 O ATOM 57 CB LYS A 769 3.763 -5.481 31.784 1.00 64.65 C ATOM 58 CG LYS A 769 2.948 -5.285 30.515 1.00 69.27 C ATOM 59 CD LYS A 769 2.254 -3.946 30.436 1.00 75.56 C ATOM 60 CE LYS A 769 2.314 -3.331 29.049 1.00 79.21 C ATOM 61 NZ LYS A 769 1.720 -4.219 28.015 1.00 80.38 N ATOM 62 HZ1 LYS A 769 2.240 -5.119 27.993 1.00 0.00 H ATOM 63 HZ2 LYS A 769 0.722 -4.399 28.246 1.00 0.00 H ATOM 64 HZ3 LYS A 769 1.784 -3.757 27.085 1.00 0.00 H ATOM 65 H LYS A 769 5.161 -6.246 33.792 1.00 0.00 H ATOM 66 N PRO A 770 6.806 -5.301 30.726 1.00 54.94 N ATOM 67 CA PRO A 770 7.737 -4.982 29.644 1.00 54.25 C ATOM 68 C PRO A 770 8.516 -6.194 29.123 1.00 52.57 C ATOM 69 O PRO A 770 8.812 -6.268 27.921 1.00 52.08 O ATOM 70 CB PRO A 770 8.678 -3.943 30.255 1.00 53.89 C ATOM 71 CG PRO A 770 7.864 -3.327 31.365 1.00 54.47 C ATOM 72 CD PRO A 770 7.014 -4.451 31.911 1.00 54.66 C ATOM 73 N VAL A 771 8.775 -7.153 30.013 1.00 51.30 N ATOM 74 CA VAL A 771 9.470 -8.379 29.655 1.00 49.56 C ATOM 75 C VAL A 771 8.511 -9.284 28.873 1.00 49.48 C ATOM 76 O VAL A 771 8.914 -9.926 27.920 1.00 48.11 O ATOM 77 CB VAL A 771 10.057 -9.111 30.887 1.00 49.16 C ATOM 78 CG1 VAL A 771 10.828 -10.360 30.481 1.00 46.23 C ATOM 79 CG2 VAL A 771 10.959 -8.206 31.710 1.00 50.47 C ATOM 80 H VAL A 771 8.469 -7.019 30.998 1.00 0.00 H ATOM 81 N GLN A 772 7.253 -9.363 29.310 1.00 51.51 N ATOM 82 CA GLN A 772 6.252 -10.151 28.594 1.00 54.16 C ATOM 83 C GLN A 772 6.131 -9.655 27.147 1.00 53.82 C ATOM 84 O GLN A 772 6.097 -10.459 26.252 1.00 54.49 O ATOM 85 CB GLN A 772 4.865 -10.061 29.219 1.00 55.20 C ATOM 86 CG GLN A 772 4.773 -10.670 30.597 1.00 56.89 C ATOM 87 CD GLN A 772 3.363 -10.657 31.107 1.00 58.61 C ATOM 88 OE1 GLN A 772 3.110 -10.263 32.234 1.00 62.13 O ATOM 89 NE2 GLN A 772 2.432 -11.080 30.275 1.00 61.30 N ATOM 90 HE22 GLN A 772 2.695 -11.407 29.323 1.00 0.00 H ATOM 91 HE21 GLN A 772 1.435 -11.087 30.570 1.00 0.00 H ATOM 92 H GLN A 772 6.980 -8.855 30.175 1.00 0.00 H ATOM 93 N ASP A 773 6.034 -8.334 26.961 1.00 54.60 N ATOM 94 CA ASP A 773 5.901 -7.719 25.623 1.00 55.15 C ATOM 95 C ASP A 773 7.187 -7.959 24.828 1.00 53.72 C ATOM 96 O ASP A 773 7.107 -8.213 23.644 1.00 55.03 O ATOM 97 CB ASP A 773 5.548 -6.233 25.704 1.00 54.58 C ATOM 98 CG ASP A 773 4.243 -5.962 26.434 1.00 56.34 C ATOM 99 OD1 ASP A 773 3.424 -6.898 26.567 1.00 56.28 O ATOM 100 OD2 ASP A 773 4.049 -4.820 26.846 1.00 57.63 O ATOM 101 H ASP A 773 6.053 -7.712 27.794 1.00 0.00 H ATOM 102 N LEU A 774 8.354 -7.932 25.488 1.00 50.57 N ATOM 103 CA LEU A 774 9.587 -8.340 24.809 1.00 51.06 C ATOM 104 C LEU A 774 9.427 -9.780 24.302 1.00 52.79 C ATOM 105 O LEU A 774 9.668 -10.059 23.135 1.00 53.52 O ATOM 106 CB LEU A 774 10.795 -8.234 25.744 1.00 50.19 C ATOM 107 CG LEU A 774 12.124 -8.669 25.133 1.00 48.98 C ATOM 108 CD1 LEU A 774 12.534 -7.712 24.009 1.00 49.28 C ATOM 109 CD2 LEU A 774 13.213 -8.762 26.197 1.00 47.53 C ATOM 110 H LEU A 774 8.384 -7.622 26.480 1.00 0.00 H ATOM 111 N ILE A 775 9.003 -10.690 25.182 1.00 53.81 N ATOM 112 CA ILE A 775 8.921 -12.085 24.820 1.00 54.44 C ATOM 113 C ILE A 775 7.999 -12.248 23.608 1.00 57.57 C ATOM 114 O ILE A 775 8.329 -13.005 22.702 1.00 60.10 O ATOM 115 CB ILE A 775 8.468 -12.970 25.997 1.00 54.34 C ATOM 116 CG1 ILE A 775 9.470 -12.974 27.153 1.00 54.82 C ATOM 117 CG2 ILE A 775 8.188 -14.383 25.514 1.00 54.98 C ATOM 118 CD1 ILE A 775 10.913 -12.853 26.725 1.00 54.39 C ATOM 119 H ILE A 775 8.729 -10.390 26.139 1.00 0.00 H ATOM 120 N LYS A 776 6.851 -11.561 23.619 1.00 60.16 N ATOM 121 CA LYS A 776 5.828 -11.675 22.562 1.00 64.26 C ATOM 122 C LYS A 776 6.434 -11.275 21.211 1.00 62.31 C ATOM 123 O LYS A 776 6.255 -11.974 20.206 1.00 64.63 O ATOM 124 CB LYS A 776 4.605 -10.793 22.852 1.00 65.60 C ATOM 125 CG LYS A 776 3.647 -11.342 23.894 1.00 69.23 C ATOM 126 CD LYS A 776 2.314 -10.623 23.915 1.00 74.54 C ATOM 127 CE LYS A 776 1.793 -10.373 25.315 1.00 76.50 C ATOM 128 NZ LYS A 776 0.355 -10.015 25.293 1.00 80.75 N ATOM 129 HZ1 LYS A 776 0.223 -9.151 24.729 1.00 0.00 H ATOM 130 HZ2 LYS A 776 -0.188 -10.794 24.869 1.00 0.00 H ATOM 131 HZ3 LYS A 776 0.025 -9.849 26.265 1.00 0.00 H ATOM 132 H LYS A 776 6.671 -10.914 24.413 1.00 0.00 H ATOM 133 N MET A 777 7.120 -10.130 21.219 1.00 60.40 N ATOM 134 CA MET A 777 7.824 -9.569 20.077 1.00 62.74 C ATOM 135 C MET A 777 8.857 -10.576 19.524 1.00 61.48 C ATOM 136 O MET A 777 8.927 -10.825 18.317 1.00 57.97 O ATOM 137 CB MET A 777 8.506 -8.267 20.510 1.00 61.94 C ATOM 138 CG MET A 777 9.645 -7.836 19.619 1.00 64.81 C ATOM 139 SD MET A 777 9.968 -6.051 19.666 1.00 65.76 S ATOM 140 CE MET A 777 9.420 -5.660 21.322 1.00 68.51 C ATOM 141 H MET A 777 7.154 -9.598 22.112 1.00 0.00 H ATOM 142 N ILE A 778 9.647 -11.173 20.425 1.00 59.49 N ATOM 143 CA ILE A 778 10.718 -12.078 20.035 1.00 57.48 C ATOM 144 C ILE A 778 10.165 -13.384 19.464 1.00 57.25 C ATOM 145 O ILE A 778 10.815 -13.979 18.624 1.00 54.63 O ATOM 146 CB ILE A 778 11.667 -12.355 21.209 1.00 56.37 C ATOM 147 CG1 ILE A 778 12.500 -11.115 21.533 1.00 52.97 C ATOM 148 CG2 ILE A 778 12.523 -13.585 20.911 1.00 57.29 C ATOM 149 CD1 ILE A 778 13.452 -11.306 22.672 1.00 50.67 C ATOM 150 H ILE A 778 9.490 -10.984 21.436 1.00 0.00 H ATOM 151 N PHE A 779 8.998 -13.842 19.925 1.00 59.29 N ATOM 152 CA PHE A 779 8.477 -15.149 19.465 1.00 63.08 C ATOM 153 C PHE A 779 7.228 -14.975 18.583 1.00 67.99 C ATOM 154 O PHE A 779 6.211 -15.576 18.851 1.00 74.12 O ATOM 155 CB PHE A 779 8.186 -16.046 20.672 1.00 62.10 C ATOM 156 CG PHE A 779 9.400 -16.586 21.386 1.00 61.64 C ATOM 157 CD1 PHE A 779 9.964 -17.799 21.014 1.00 61.44 C ATOM 158 CD2 PHE A 779 9.959 -15.907 22.467 1.00 60.07 C ATOM 159 CE1 PHE A 779 11.066 -18.307 21.692 1.00 60.31 C ATOM 160 CE2 PHE A 779 11.076 -16.405 23.128 1.00 57.69 C ATOM 161 CZ PHE A 779 11.622 -17.609 22.747 1.00 58.69 C ATOM 162 H PHE A 779 8.454 -13.279 20.609 1.00 0.00 H ATOM 163 N GLY A 780 7.297 -14.146 17.538 1.00 71.94 N ATOM 164 CA GLY A 780 6.191 -14.006 16.566 1.00 79.44 C ATOM 165 C GLY A 780 5.065 -13.127 17.095 1.00 83.35 C ATOM 166 O GLY A 780 4.374 -13.473 18.064 1.00 88.22 O ATOM 167 H GLY A 780 8.158 -13.579 17.403 1.00 0.00 H TER 168 GLY A 780 ATOM 169 N GLY A 787 2.663 -19.948 20.018 1.00 87.55 N ATOM 170 CA GLY A 787 1.716 -20.942 20.530 1.00 88.35 C ATOM 171 C GLY A 787 1.892 -21.184 22.025 1.00 87.06 C ATOM 172 O GLY A 787 0.911 -21.423 22.737 1.00 88.56 O ATOM 173 HN3 GLY A 787 3.635 -20.281 20.181 1.00 0.00 H ATOM 174 HN2 GLY A 787 2.517 -19.045 20.513 1.00 0.00 H ATOM 175 HN1 GLY A 787 2.507 -19.815 18.998 1.00 0.00 H ATOM 176 N ASP A 788 3.143 -21.093 22.507 1.00 82.97 N ATOM 177 CA ASP A 788 3.526 -21.475 23.887 1.00 80.07 C ATOM 178 C ASP A 788 3.300 -20.309 24.855 1.00 75.75 C ATOM 179 O ASP A 788 3.391 -19.141 24.474 1.00 72.60 O ATOM 180 CB ASP A 788 4.982 -21.955 23.940 1.00 78.91 C ATOM 181 CG ASP A 788 5.200 -23.352 23.378 1.00 81.42 C ATOM 182 OD1 ASP A 788 6.356 -23.714 23.144 1.00 80.76 O ATOM 183 OD2 ASP A 788 4.209 -24.068 23.186 1.00 86.85 O ATOM 184 H ASP A 788 3.886 -20.733 21.875 1.00 0.00 H ATOM 185 N PRO A 789 3.008 -20.577 26.150 1.00 72.96 N ATOM 186 CA PRO A 789 2.945 -19.508 27.150 1.00 71.27 C ATOM 187 C PRO A 789 4.242 -18.683 27.236 1.00 66.61 C ATOM 188 O PRO A 789 5.349 -19.171 26.997 1.00 61.97 O ATOM 189 CB PRO A 789 2.659 -20.230 28.476 1.00 71.99 C ATOM 190 CG PRO A 789 2.029 -21.547 28.049 1.00 75.41 C ATOM 191 CD PRO A 789 2.673 -21.891 26.719 1.00 74.79 C ATOM 192 N ILE A 790 4.058 -17.411 27.578 1.00 65.16 N ATOM 193 CA ILE A 790 5.105 -16.425 27.642 1.00 62.09 C ATOM 194 C ILE A 790 6.260 -16.945 28.501 1.00 59.36 C ATOM 195 O ILE A 790 7.425 -16.828 28.140 1.00 56.89 O ATOM 196 CB ILE A 790 4.524 -15.104 28.170 1.00 62.40 C ATOM 197 CG1 ILE A 790 3.734 -14.389 27.071 1.00 63.55 C ATOM 198 CG2 ILE A 790 5.619 -14.221 28.751 1.00 60.83 C ATOM 199 CD1 ILE A 790 2.810 -13.300 27.581 1.00 66.08 C ATOM 200 H ILE A 790 3.092 -17.108 27.815 1.00 0.00 H ATOM 201 N ASP A 791 5.925 -17.506 29.648 1.00 60.38 N ATOM 202 CA ASP A 791 6.911 -17.803 30.649 1.00 61.87 C ATOM 203 C ASP A 791 7.794 -18.963 30.171 1.00 62.62 C ATOM 204 O ASP A 791 8.991 -18.961 30.458 1.00 59.76 O ATOM 205 CB ASP A 791 6.245 -18.024 32.015 1.00 64.33 C ATOM 206 CG ASP A 791 5.925 -16.738 32.769 1.00 64.03 C ATOM 207 OD1 ASP A 791 5.564 -16.848 33.948 1.00 66.54 O ATOM 208 OD2 ASP A 791 6.027 -15.634 32.178 1.00 62.53 O ATOM 209 H ASP A 791 4.928 -17.737 29.830 1.00 0.00 H ATOM 210 N VAL A 792 7.209 -19.922 29.437 1.00 65.33 N ATOM 211 CA VAL A 792 7.960 -21.069 28.875 1.00 66.05 C ATOM 212 C VAL A 792 8.886 -20.602 27.743 1.00 63.46 C ATOM 213 O VAL A 792 9.979 -21.150 27.611 1.00 64.32 O ATOM 214 CB VAL A 792 7.041 -22.211 28.390 1.00 72.48 C ATOM 215 CG1 VAL A 792 5.909 -21.712 27.523 1.00 75.42 C ATOM 216 CG2 VAL A 792 7.794 -23.303 27.634 1.00 72.75 C ATOM 217 H VAL A 792 6.187 -19.858 29.255 1.00 0.00 H ATOM 218 N ASN A 793 8.439 -19.651 26.910 1.00 60.77 N ATOM 219 CA ASN A 793 9.287 -19.085 25.863 1.00 60.00 C ATOM 220 C ASN A 793 10.427 -18.293 26.500 1.00 57.27 C ATOM 221 O ASN A 793 11.523 -18.291 25.956 1.00 56.18 O ATOM 222 CB ASN A 793 8.534 -18.187 24.877 1.00 60.86 C ATOM 223 CG ASN A 793 7.738 -18.973 23.855 1.00 65.64 C ATOM 224 OD1 ASN A 793 8.082 -20.110 23.537 1.00 67.69 O ATOM 225 ND2 ASN A 793 6.656 -18.393 23.359 1.00 66.12 N ATOM 226 HD22 ASN A 793 6.401 -17.429 23.655 1.00 0.00 H ATOM 227 HD21 ASN A 793 6.061 -18.901 22.674 1.00 0.00 H ATOM 228 H ASN A 793 7.463 -19.307 27.012 1.00 0.00 H ATOM 229 N TYR A 794 10.153 -17.612 27.627 1.00 55.28 N ATOM 230 CA TYR A 794 11.185 -16.894 28.356 1.00 55.77 C ATOM 231 C TYR A 794 12.320 -17.858 28.706 1.00 56.27 C ATOM 232 O TYR A 794 13.487 -17.549 28.483 1.00 50.05 O ATOM 233 CB TYR A 794 10.635 -16.231 29.626 1.00 56.42 C ATOM 234 CG TYR A 794 11.671 -15.563 30.497 1.00 53.88 C ATOM 235 CD1 TYR A 794 12.115 -14.271 30.240 1.00 53.52 C ATOM 236 CD2 TYR A 794 12.199 -16.209 31.605 1.00 55.98 C ATOM 237 CE1 TYR A 794 13.056 -13.638 31.046 1.00 50.85 C ATOM 238 CE2 TYR A 794 13.144 -15.591 32.419 1.00 55.31 C ATOM 239 CZ TYR A 794 13.569 -14.297 32.148 1.00 52.62 C ATOM 240 OH TYR A 794 14.485 -13.701 32.966 1.00 49.91 O ATOM 241 HH TYR A 794 14.677 -12.788 32.634 1.00 0.00 H ATOM 242 H TYR A 794 9.177 -17.599 27.986 1.00 0.00 H ATOM 243 N GLU A 795 11.945 -19.027 29.239 1.00 59.96 N ATOM 244 CA GLU A 795 12.897 -20.029 29.713 1.00 63.46 C ATOM 245 C GLU A 795 13.781 -20.510 28.560 1.00 62.37 C ATOM 246 O GLU A 795 14.955 -20.741 28.784 1.00 62.38 O ATOM 247 CB GLU A 795 12.170 -21.175 30.421 1.00 68.20 C ATOM 248 CG GLU A 795 11.548 -20.748 31.747 1.00 75.58 C ATOM 249 CD GLU A 795 12.475 -20.551 32.956 1.00 82.27 C ATOM 250 OE1 GLU A 795 13.180 -19.484 33.044 1.00 75.74 O ATOM 251 OE2 GLU A 795 12.465 -21.456 33.849 1.00 87.23 O ATOM 252 H GLU A 795 10.929 -19.232 29.320 1.00 0.00 H ATOM 253 N LYS A 796 13.223 -20.598 27.344 1.00 61.86 N ATOM 254 CA LYS A 796 13.965 -21.004 26.136 1.00 63.93 C ATOM 255 C LYS A 796 15.154 -20.075 25.861 1.00 59.80 C ATOM 256 O LYS A 796 16.150 -20.513 25.307 1.00 61.47 O ATOM 257 CB LYS A 796 13.067 -21.023 24.891 1.00 65.95 C ATOM 258 CG LYS A 796 12.059 -22.163 24.871 1.00 69.66 C ATOM 259 CD LYS A 796 11.080 -22.086 23.716 1.00 72.94 C ATOM 260 CE LYS A 796 10.004 -23.152 23.778 1.00 78.16 C ATOM 261 NZ LYS A 796 9.029 -22.997 22.673 1.00 80.15 N ATOM 262 HZ1 LYS A 796 8.575 -22.064 22.741 1.00 0.00 H ATOM 263 HZ2 LYS A 796 9.524 -23.078 21.762 1.00 0.00 H ATOM 264 HZ3 LYS A 796 8.306 -23.741 22.743 1.00 0.00 H ATOM 265 H LYS A 796 12.213 -20.368 27.248 1.00 0.00 H ATOM 266 N LEU A 797 15.038 -18.792 26.225 1.00 56.92 N ATOM 267 CA LEU A 797 16.111 -17.831 25.998 1.00 54.00 C ATOM 268 C LEU A 797 17.329 -18.099 26.883 1.00 52.77 C ATOM 269 O LEU A 797 18.439 -17.636 26.563 1.00 51.68 O ATOM 270 CB LEU A 797 15.583 -16.433 26.278 1.00 53.60 C ATOM 271 CG LEU A 797 14.419 -15.990 25.410 1.00 54.89 C ATOM 272 CD1 LEU A 797 13.991 -14.585 25.787 1.00 56.17 C ATOM 273 CD2 LEU A 797 14.779 -16.065 23.943 1.00 56.00 C ATOM 274 H LEU A 797 14.160 -18.472 26.681 1.00 0.00 H ATOM 275 N LYS A 798 17.135 -18.803 27.998 1.00 54.11 N ATOM 276 CA LYS A 798 18.248 -19.119 28.881 1.00 58.57 C ATOM 277 C LYS A 798 19.023 -17.826 29.207 1.00 55.16 C ATOM 278 O LYS A 798 20.279 -17.819 29.248 1.00 51.23 O ATOM 279 CB LYS A 798 19.153 -20.152 28.199 1.00 62.48 C ATOM 280 CG LYS A 798 18.543 -21.538 28.060 1.00 70.17 C ATOM 281 CD LYS A 798 18.367 -22.240 29.396 1.00 75.95 C ATOM 282 CE LYS A 798 17.240 -23.260 29.419 1.00 81.24 C ATOM 283 NZ LYS A 798 17.435 -24.309 28.388 1.00 82.69 N ATOM 284 HZ1 LYS A 798 17.461 -23.868 27.447 1.00 0.00 H ATOM 285 HZ2 LYS A 798 18.332 -24.805 28.565 1.00 0.00 H ATOM 286 HZ3 LYS A 798 16.648 -24.987 28.432 1.00 0.00 H ATOM 287 H LYS A 798 16.178 -19.130 28.240 1.00 0.00 H ATOM 288 N THR A 799 18.264 -16.746 29.440 1.00 51.37 N ATOM 289 CA THR A 799 18.788 -15.382 29.607 1.00 51.03 C ATOM 290 C THR A 799 18.022 -14.686 30.749 1.00 50.84 C ATOM 291 O THR A 799 16.773 -14.617 30.714 1.00 49.50 O ATOM 292 CB THR A 799 18.706 -14.610 28.286 1.00 50.37 C ATOM 293 OG1 THR A 799 19.508 -15.261 27.294 1.00 50.66 O ATOM 294 CG2 THR A 799 19.187 -13.182 28.417 1.00 50.90 C ATOM 295 HG1 THR A 799 19.176 -16.183 27.156 1.00 0.00 H ATOM 296 H THR A 799 17.235 -16.882 29.507 1.00 0.00 H ATOM 297 N ASP A 800 18.743 -14.222 31.785 1.00 47.61 N ATOM 298 CA ASP A 800 18.115 -13.380 32.828 1.00 48.51 C ATOM 299 C ASP A 800 17.849 -12.000 32.219 1.00 47.65 C ATOM 300 O ASP A 800 18.750 -11.395 31.636 1.00 42.85 O ATOM 301 CB ASP A 800 18.954 -13.265 34.097 1.00 49.48 C ATOM 302 CG ASP A 800 18.262 -12.432 35.162 1.00 50.44 C ATOM 303 OD1 ASP A 800 17.327 -12.938 35.793 1.00 52.66 O ATOM 304 OD2 ASP A 800 18.621 -11.272 35.303 1.00 53.29 O ATOM 305 H ASP A 800 19.754 -14.457 31.854 1.00 0.00 H ATOM 306 N ILE A 801 16.599 -11.534 32.298 1.00 47.25 N ATOM 307 CA ILE A 801 16.230 -10.259 31.660 1.00 48.25 C ATOM 308 C ILE A 801 15.604 -9.361 32.722 1.00 51.16 C ATOM 309 O ILE A 801 14.652 -9.786 33.337 1.00 52.04 O ATOM 310 CB ILE A 801 15.246 -10.458 30.503 1.00 46.79 C ATOM 311 CG1 ILE A 801 15.738 -11.519 29.516 1.00 46.47 C ATOM 312 CG2 ILE A 801 14.951 -9.123 29.823 1.00 46.03 C ATOM 313 CD1 ILE A 801 14.826 -11.680 28.310 1.00 47.03 C ATOM 314 H ILE A 801 15.879 -12.078 32.816 1.00 0.00 H ATOM 315 N LYS A 802 16.140 -8.148 32.920 1.00 51.72 N ATOM 316 CA LYS A 802 15.581 -7.206 33.914 1.00 54.28 C ATOM 317 C LYS A 802 15.351 -5.868 33.231 1.00 52.60 C ATOM 318 O LYS A 802 16.122 -5.480 32.364 1.00 50.97 O ATOM 319 CB LYS A 802 16.480 -7.082 35.149 1.00 57.87 C ATOM 320 CG LYS A 802 16.818 -8.419 35.784 1.00 61.41 C ATOM 321 CD LYS A 802 16.618 -8.522 37.277 1.00 68.69 C ATOM 322 CE LYS A 802 17.849 -8.111 38.067 1.00 71.68 C ATOM 323 NZ LYS A 802 18.749 -9.256 38.335 1.00 71.57 N ATOM 324 HZ1 LYS A 802 18.238 -9.976 38.884 1.00 0.00 H ATOM 325 HZ2 LYS A 802 19.065 -9.666 37.433 1.00 0.00 H ATOM 326 HZ3 LYS A 802 19.574 -8.927 38.876 1.00 0.00 H ATOM 327 H LYS A 802 16.969 -7.862 32.361 1.00 0.00 H ATOM 328 N VAL A 803 14.229 -5.232 33.578 1.00 54.39 N ATOM 329 CA VAL A 803 13.918 -3.873 33.150 1.00 53.61 C ATOM 330 C VAL A 803 14.893 -2.959 33.893 1.00 53.55 C ATOM 331 O VAL A 803 15.065 -3.109 35.098 1.00 54.12 O ATOM 332 CB VAL A 803 12.460 -3.477 33.464 1.00 56.38 C ATOM 333 CG1 VAL A 803 12.113 -2.113 32.872 1.00 57.08 C ATOM 334 CG2 VAL A 803 11.464 -4.516 32.986 1.00 57.06 C ATOM 335 H VAL A 803 13.544 -5.730 34.182 1.00 0.00 H ATOM 336 N VAL A 804 15.568 -2.070 33.158 1.00 52.05 N ATOM 337 CA VAL A 804 16.367 -1.039 33.747 1.00 51.80 C ATOM 338 C VAL A 804 15.409 0.110 34.017 1.00 54.91 C ATOM 339 O VAL A 804 14.616 0.402 33.151 1.00 53.56 O ATOM 340 CB VAL A 804 17.503 -0.559 32.832 1.00 50.67 C ATOM 341 CG1 VAL A 804 18.294 0.558 33.492 1.00 53.45 C ATOM 342 CG2 VAL A 804 18.415 -1.684 32.410 1.00 50.53 C ATOM 343 H VAL A 804 15.511 -2.130 32.121 1.00 0.00 H ATOM 344 N ASP A 805 15.467 0.737 35.200 1.00 58.42 N ATOM 345 CA ASP A 805 14.540 1.853 35.480 1.00 61.36 C ATOM 346 C ASP A 805 14.857 3.009 34.515 1.00 59.48 C ATOM 347 O ASP A 805 16.009 3.357 34.317 1.00 58.25 O ATOM 348 CB ASP A 805 14.573 2.298 36.944 1.00 65.99 C ATOM 349 CG ASP A 805 13.530 3.371 37.227 1.00 70.04 C ATOM 350 OD1 ASP A 805 12.315 3.043 37.115 1.00 73.93 O ATOM 351 OD2 ASP A 805 13.931 4.540 37.491 1.00 71.22 O ATOM 352 H ASP A 805 16.160 0.440 35.916 1.00 0.00 H ATOM 353 N ARG A 806 13.810 3.551 33.888 1.00 65.36 N ATOM 354 CA ARG A 806 13.876 4.725 32.964 1.00 69.73 C ATOM 355 C ARG A 806 14.761 5.839 33.557 1.00 71.18 C ATOM 356 O ARG A 806 15.552 6.418 32.829 1.00 74.70 O ATOM 357 CB ARG A 806 12.461 5.254 32.672 1.00 74.37 C ATOM 358 CG ARG A 806 12.260 5.803 31.265 1.00 76.90 C ATOM 359 CD ARG A 806 11.255 6.951 31.185 1.00 82.34 C ATOM 360 NE ARG A 806 11.769 8.236 31.682 1.00 86.55 N ATOM 361 CZ ARG A 806 12.675 8.995 31.061 1.00 85.53 C ATOM 362 NH1 ARG A 806 13.046 8.725 29.822 1.00 83.44 N ATOM 363 NH2 ARG A 806 13.233 10.009 31.694 1.00 87.44 N ATOM 364 HE ARG A 806 11.397 8.581 32.590 1.00 0.00 H ATOM 365 HH12 ARG A 806 13.753 9.323 29.349 1.00 0.00 H ATOM 366 HH11 ARG A 806 12.631 7.914 29.320 1.00 0.00 H ATOM 367 HH22 ARG A 806 13.939 10.600 31.209 1.00 0.00 H ATOM 368 HH21 ARG A 806 12.967 10.218 32.678 1.00 0.00 H ATOM 369 H ARG A 806 12.877 3.124 34.055 1.00 0.00 H ATOM 370 N ASP A 807 14.643 6.118 34.867 1.00 70.46 N ATOM 371 CA ASP A 807 15.275 7.289 35.506 1.00 72.66 C ATOM 372 C ASP A 807 16.530 6.890 36.287 1.00 72.47 C ATOM 373 O ASP A 807 16.879 7.554 37.252 1.00 77.50 O ATOM 374 CB ASP A 807 14.350 7.989 36.511 1.00 77.45 C ATOM 375 CG ASP A 807 12.935 8.259 36.024 1.00 80.14 C ATOM 376 OD1 ASP A 807 12.771 8.914 34.954 1.00 80.28 O ATOM 377 OD2 ASP A 807 12.001 7.811 36.724 1.00 84.00 O ATOM 378 H ASP A 807 14.078 5.477 35.460 1.00 0.00 H ATOM 379 N SER A 808 17.185 5.807 35.876 1.00 70.22 N ATOM 380 CA SER A 808 18.454 5.358 36.441 1.00 69.60 C ATOM 381 C SER A 808 19.628 5.955 35.657 1.00 71.62 C ATOM 382 O SER A 808 19.470 6.469 34.547 1.00 71.64 O ATOM 383 CB SER A 808 18.532 3.856 36.417 1.00 66.40 C ATOM 384 OG SER A 808 18.543 3.385 35.073 1.00 63.77 O ATOM 385 HG SER A 808 17.714 3.674 34.616 1.00 0.00 H ATOM 386 H SER A 808 16.768 5.247 35.106 1.00 0.00 H ATOM 387 N GLU A 809 20.819 5.821 36.239 1.00 72.02 N ATOM 388 CA GLU A 809 22.067 6.323 35.674 1.00 72.37 C ATOM 389 C GLU A 809 22.434 5.522 34.414 1.00 67.70 C ATOM 390 O GLU A 809 22.934 6.087 33.426 1.00 64.38 O ATOM 391 CB GLU A 809 23.145 6.265 36.766 1.00 76.99 C ATOM 392 CG GLU A 809 24.572 6.307 36.262 1.00 78.53 C ATOM 393 CD GLU A 809 25.581 6.870 37.245 1.00 84.39 C ATOM 394 OE1 GLU A 809 26.566 7.475 36.782 1.00 86.37 O ATOM 395 OE2 GLU A 809 25.376 6.720 38.469 1.00 93.64 O ATOM 396 H GLU A 809 20.862 5.328 37.153 1.00 0.00 H ATOM 397 N GLU A 810 22.219 4.199 34.467 1.00 65.21 N ATOM 398 CA GLU A 810 22.464 3.336 33.343 1.00 61.42 C ATOM 399 C GLU A 810 21.611 3.808 32.164 1.00 57.48 C ATOM 400 O GLU A 810 22.105 3.953 31.065 1.00 55.01 O ATOM 401 CB GLU A 810 22.069 1.890 33.638 1.00 62.31 C ATOM 402 CG GLU A 810 22.963 1.168 34.611 1.00 67.03 C ATOM 403 CD GLU A 810 22.494 -0.268 34.828 1.00 69.21 C ATOM 404 OE1 GLU A 810 21.577 -0.471 35.665 1.00 70.55 O ATOM 405 OE2 GLU A 810 23.020 -1.184 34.131 1.00 64.18 O ATOM 406 H GLU A 810 21.863 3.783 35.351 1.00 0.00 H ATOM 407 N ALA A 811 20.312 4.000 32.418 1.00 55.10 N ATOM 408 CA ALA A 811 19.358 4.313 31.384 1.00 54.17 C ATOM 409 C ALA A 811 19.711 5.655 30.741 1.00 55.59 C ATOM 410 O ALA A 811 19.572 5.805 29.540 1.00 57.68 O ATOM 411 CB ALA A 811 17.964 4.335 31.947 1.00 55.51 C ATOM 412 H ALA A 811 19.977 3.920 33.399 1.00 0.00 H ATOM 413 N GLU A 812 20.196 6.596 31.557 1.00 56.93 N ATOM 414 CA GLU A 812 20.617 7.918 31.097 1.00 60.50 C ATOM 415 C GLU A 812 21.817 7.805 30.163 1.00 55.94 C ATOM 416 O GLU A 812 21.825 8.396 29.117 1.00 55.15 O ATOM 417 CB GLU A 812 20.981 8.837 32.263 1.00 65.76 C ATOM 418 CG GLU A 812 19.863 9.813 32.605 1.00 71.20 C ATOM 419 CD GLU A 812 19.833 10.339 34.032 1.00 74.43 C ATOM 420 OE1 GLU A 812 20.658 9.884 34.857 1.00 75.59 O ATOM 421 OE2 GLU A 812 18.968 11.187 34.316 1.00 79.84 O ATOM 422 H GLU A 812 20.278 6.377 32.570 1.00 0.00 H ATOM 423 N ILE A 813 22.826 7.049 30.582 1.00 55.05 N ATOM 424 CA ILE A 813 23.996 6.845 29.764 1.00 53.94 C ATOM 425 C ILE A 813 23.588 6.176 28.439 1.00 52.08 C ATOM 426 O ILE A 813 24.017 6.573 27.348 1.00 50.12 O ATOM 427 CB ILE A 813 25.033 6.045 30.568 1.00 54.37 C ATOM 428 CG1 ILE A 813 25.780 6.986 31.514 1.00 56.97 C ATOM 429 CG2 ILE A 813 25.987 5.249 29.676 1.00 52.92 C ATOM 430 CD1 ILE A 813 26.570 6.280 32.591 1.00 58.37 C ATOM 431 H ILE A 813 22.771 6.596 31.517 1.00 0.00 H ATOM 432 N ILE A 814 22.732 5.157 28.526 1.00 50.23 N ATOM 433 CA ILE A 814 22.358 4.440 27.337 1.00 48.53 C ATOM 434 C ILE A 814 21.567 5.350 26.374 1.00 49.13 C ATOM 435 O ILE A 814 21.792 5.277 25.168 1.00 46.34 O ATOM 436 CB ILE A 814 21.618 3.151 27.706 1.00 48.09 C ATOM 437 CG1 ILE A 814 22.582 2.160 28.367 1.00 47.95 C ATOM 438 CG2 ILE A 814 20.948 2.550 26.483 1.00 46.82 C ATOM 439 CD1 ILE A 814 21.904 0.954 28.944 1.00 48.63 C ATOM 440 H ILE A 814 22.337 4.883 29.448 1.00 0.00 H ATOM 441 N ARG A 815 20.642 6.166 26.901 1.00 50.63 N ATOM 442 CA ARG A 815 19.833 7.039 26.067 1.00 55.67 C ATOM 443 C ARG A 815 20.729 8.080 25.386 1.00 54.83 C ATOM 444 O ARG A 815 20.450 8.493 24.274 1.00 53.10 O ATOM 445 CB ARG A 815 18.702 7.692 26.863 1.00 61.77 C ATOM 446 CG ARG A 815 17.521 6.758 27.105 1.00 62.90 C ATOM 447 CD ARG A 815 16.290 7.509 27.566 1.00 68.01 C ATOM 448 NE ARG A 815 16.649 8.522 28.558 1.00 71.69 N ATOM 449 CZ ARG A 815 16.622 8.349 29.879 1.00 72.44 C ATOM 450 NH1 ARG A 815 17.074 9.316 30.663 1.00 70.82 N ATOM 451 NH2 ARG A 815 16.138 7.226 30.397 1.00 69.30 N ATOM 452 HE ARG A 815 16.950 9.452 28.204 1.00 0.00 H ATOM 453 HH12 ARG A 815 17.060 9.197 31.696 1.00 0.00 H ATOM 454 HH11 ARG A 815 17.443 10.194 30.246 1.00 0.00 H ATOM 455 HH22 ARG A 815 16.119 7.095 31.429 1.00 0.00 H ATOM 456 HH21 ARG A 815 15.778 6.477 29.771 1.00 0.00 H ATOM 457 H ARG A 815 20.500 6.174 27.931 1.00 0.00 H ATOM 458 N LYS A 816 21.820 8.455 26.057 1.00 54.68 N ATOM 459 CA LYS A 816 22.786 9.406 25.555 1.00 54.75 C ATOM 460 C LYS A 816 23.597 8.808 24.397 1.00 53.30 C ATOM 461 O LYS A 816 23.850 9.458 23.383 1.00 53.71 O ATOM 462 CB LYS A 816 23.679 9.805 26.725 1.00 57.10 C ATOM 463 CG LYS A 816 24.789 10.776 26.375 1.00 59.47 C ATOM 464 CD LYS A 816 25.267 11.550 27.577 1.00 63.83 C ATOM 465 CE LYS A 816 26.719 11.949 27.456 1.00 66.56 C ATOM 466 NZ LYS A 816 26.908 13.366 27.836 1.00 70.67 N ATOM 467 HZ1 LYS A 816 26.340 13.971 27.209 1.00 0.00 H ATOM 468 HZ2 LYS A 816 26.603 13.503 28.821 1.00 0.00 H ATOM 469 HZ3 LYS A 816 27.913 13.617 27.745 1.00 0.00 H ATOM 470 H LYS A 816 21.985 8.039 26.996 1.00 0.00 H ATOM 471 N TYR A 817 24.035 7.563 24.575 1.00 50.97 N ATOM 472 CA TYR A 817 24.767 6.815 23.556 1.00 49.66 C ATOM 473 C TYR A 817 23.948 6.800 22.261 1.00 49.04 C ATOM 474 O TYR A 817 24.491 6.977 21.154 1.00 48.42 O ATOM 475 CB TYR A 817 25.024 5.396 24.071 1.00 48.70 C ATOM 476 CG TYR A 817 26.105 4.594 23.395 1.00 47.38 C ATOM 477 CD1 TYR A 817 26.746 5.014 22.232 1.00 48.79 C ATOM 478 CD2 TYR A 817 26.451 3.352 23.904 1.00 47.57 C ATOM 479 CE1 TYR A 817 27.754 4.259 21.649 1.00 47.71 C ATOM 480 CE2 TYR A 817 27.443 2.576 23.323 1.00 44.22 C ATOM 481 CZ TYR A 817 28.097 3.029 22.195 1.00 44.96 C ATOM 482 OH TYR A 817 29.049 2.236 21.620 1.00 42.33 O ATOM 483 HH TYR A 817 29.771 2.062 22.274 1.00 0.00 H ATOM 484 H TYR A 817 23.846 7.099 25.487 1.00 0.00 H ATOM 485 N VAL A 818 22.641 6.597 22.425 1.00 48.77 N ATOM 486 CA VAL A 818 21.715 6.515 21.321 1.00 51.66 C ATOM 487 C VAL A 818 21.649 7.895 20.673 1.00 52.92 C ATOM 488 O VAL A 818 21.735 8.008 19.455 1.00 54.79 O ATOM 489 CB VAL A 818 20.305 6.047 21.742 1.00 51.40 C ATOM 490 CG1 VAL A 818 19.283 6.234 20.629 1.00 52.16 C ATOM 491 CG2 VAL A 818 20.296 4.595 22.199 1.00 50.92 C ATOM 492 H VAL A 818 22.272 6.493 23.392 1.00 0.00 H ATOM 493 N LYS A 819 21.461 8.910 21.524 1.00 55.15 N ATOM 494 CA LYS A 819 21.231 10.270 21.124 1.00 57.35 C ATOM 495 C LYS A 819 22.397 10.775 20.270 1.00 56.09 C ATOM 496 O LYS A 819 22.200 11.377 19.241 1.00 59.95 O ATOM 497 CB LYS A 819 21.030 11.153 22.359 1.00 60.76 C ATOM 498 CG LYS A 819 20.762 12.608 22.002 1.00 66.26 C ATOM 499 CD LYS A 819 20.438 13.513 23.154 1.00 70.95 C ATOM 500 CE LYS A 819 20.292 14.945 22.687 1.00 76.48 C ATOM 501 NZ LYS A 819 19.620 15.777 23.710 1.00 81.75 N ATOM 502 HZ1 LYS A 819 18.673 15.392 23.901 1.00 0.00 H ATOM 503 HZ2 LYS A 819 20.182 15.769 24.585 1.00 0.00 H ATOM 504 HZ3 LYS A 819 19.535 16.753 23.360 1.00 0.00 H ATOM 505 H LYS A 819 21.483 8.700 22.542 1.00 0.00 H ATOM 506 N ASN A 820 23.618 10.522 20.729 1.00 55.32 N ATOM 507 CA ASN A 820 24.807 11.185 20.242 1.00 54.54 C ATOM 508 C ASN A 820 25.447 10.437 19.070 1.00 51.58 C ATOM 509 O ASN A 820 26.223 11.017 18.359 1.00 51.74 O ATOM 510 CB ASN A 820 25.863 11.272 21.350 1.00 55.23 C ATOM 511 CG ASN A 820 25.586 12.328 22.402 1.00 56.49 C ATOM 512 OD1 ASN A 820 24.648 13.111 22.302 1.00 59.42 O ATOM 513 ND2 ASN A 820 26.419 12.356 23.422 1.00 55.30 N ATOM 514 HD22 ASN A 820 27.203 11.675 23.472 1.00 0.00 H ATOM 515 HD21 ASN A 820 26.292 13.059 24.178 1.00 0.00 H ATOM 516 H ASN A 820 23.724 9.809 21.479 1.00 0.00 H ATOM 517 N THR A 821 25.164 9.144 18.912 1.00 50.06 N ATOM 518 CA THR A 821 25.926 8.280 17.981 1.00 48.68 C ATOM 519 C THR A 821 25.047 7.889 16.785 1.00 50.23 C ATOM 520 O THR A 821 25.378 6.952 16.017 1.00 49.26 O ATOM 521 CB THR A 821 26.496 7.046 18.691 1.00 44.79 C ATOM 522 OG1 THR A 821 25.438 6.103 18.837 1.00 40.14 O ATOM 523 HG1 THR A 821 24.711 6.505 19.375 1.00 0.00 H ATOM 524 H THR A 821 24.384 8.729 19.460 1.00 0.00 H ATOM 525 N HIS A 822 23.956 8.635 16.583 1.00 51.65 N ATOM 526 CA HIS A 822 23.121 8.508 15.384 1.00 54.27 C ATOM 527 C HIS A 822 23.776 9.293 14.241 1.00 54.11 C ATOM 528 O HIS A 822 23.916 10.473 14.336 1.00 54.90 O ATOM 529 CB HIS A 822 21.688 8.997 15.641 1.00 56.59 C ATOM 530 CG HIS A 822 20.732 8.637 14.556 1.00 57.08 C ATOM 531 ND1 HIS A 822 19.567 7.937 14.809 1.00 57.42 N ATOM 532 CD2 HIS A 822 20.770 8.857 13.226 1.00 57.57 C ATOM 533 CE1 HIS A 822 18.914 7.759 13.685 1.00 59.23 C ATOM 534 NE2 HIS A 822 19.635 8.312 12.693 1.00 59.70 N ATOM 535 H HIS A 822 23.689 9.334 17.305 1.00 0.00 H ATOM 536 N ALA A 823 24.199 8.586 13.190 1.00 54.22 N ATOM 537 CA ALA A 823 24.950 9.142 12.080 1.00 56.05 C ATOM 538 C ALA A 823 24.056 10.059 11.238 1.00 59.08 C ATOM 539 O ALA A 823 22.872 9.783 11.051 1.00 62.39 O ATOM 540 CB ALA A 823 25.500 8.032 11.221 1.00 54.74 C ATOM 541 H ALA A 823 23.976 7.571 13.166 1.00 0.00 H ATOM 542 N THR A 824 24.659 11.128 10.708 1.00 60.43 N ATOM 543 CA THR A 824 23.965 12.163 9.919 1.00 64.79 C ATOM 544 C THR A 824 23.531 11.613 8.558 1.00 66.27 C ATOM 545 O THR A 824 22.667 12.158 7.931 1.00 73.78 O ATOM 546 CB THR A 824 24.888 13.363 9.703 1.00 64.43 C ATOM 547 OG1 THR A 824 26.040 12.812 9.061 1.00 63.40 O ATOM 548 CG2 THR A 824 25.235 14.051 11.004 1.00 63.72 C ATOM 549 HG1 THR A 824 26.695 13.533 8.884 1.00 0.00 H ATOM 550 H THR A 824 25.682 11.237 10.862 1.00 0.00 H ATOM 551 N THR A 825 24.186 10.536 8.133 1.00 66.80 N ATOM 552 CA THR A 825 23.925 9.825 6.897 1.00 66.87 C ATOM 553 C THR A 825 22.661 8.966 7.056 1.00 67.24 C ATOM 554 O THR A 825 22.068 8.594 6.059 1.00 67.37 O ATOM 555 CB THR A 825 25.217 9.082 6.503 1.00 66.34 C ATOM 556 OG1 THR A 825 25.807 9.956 5.533 1.00 66.73 O ATOM 557 CG2 THR A 825 25.061 7.674 5.961 1.00 64.01 C ATOM 558 HG1 THR A 825 26.657 9.564 5.211 1.00 0.00 H ATOM 559 H THR A 825 24.950 10.173 8.739 1.00 0.00 H ATOM 560 N HIS A 826 22.267 8.649 8.299 1.00 63.45 N ATOM 561 CA HIS A 826 21.153 7.741 8.561 1.00 62.82 C ATOM 562 C HIS A 826 19.906 8.534 8.975 1.00 64.10 C ATOM 563 O HIS A 826 19.384 8.353 10.037 1.00 64.64 O ATOM 564 CB HIS A 826 21.567 6.691 9.601 1.00 58.07 C ATOM 565 CG HIS A 826 22.742 5.889 9.163 1.00 57.11 C ATOM 566 ND1 HIS A 826 23.603 5.277 10.051 1.00 52.01 N ATOM 567 CD2 HIS A 826 23.213 5.612 7.927 1.00 57.23 C ATOM 568 CE1 HIS A 826 24.547 4.641 9.380 1.00 52.09 C ATOM 569 NE2 HIS A 826 24.336 4.843 8.070 1.00 53.99 N ATOM 570 H HIS A 826 22.774 9.065 9.106 1.00 0.00 H ATOM 571 N ASN A 827 19.400 9.376 8.081 1.00 68.28 N ATOM 572 CA ASN A 827 18.416 10.371 8.476 1.00 71.49 C ATOM 573 C ASN A 827 17.019 10.003 7.951 1.00 72.85 C ATOM 574 O ASN A 827 16.127 10.845 7.923 1.00 75.47 O ATOM 575 CB ASN A 827 18.861 11.762 8.025 1.00 74.15 C ATOM 576 CG ASN A 827 18.980 11.856 6.524 1.00 77.17 C ATOM 577 OD1 ASN A 827 19.376 10.897 5.878 1.00 77.24 O ATOM 578 ND2 ASN A 827 18.629 12.999 5.959 1.00 84.83 N ATOM 579 HD22 ASN A 827 18.297 13.790 6.548 1.00 0.00 H ATOM 580 HD21 ASN A 827 18.685 13.107 4.926 1.00 0.00 H ATOM 581 H ASN A 827 19.710 9.323 7.090 1.00 0.00 H ATOM 582 N ALA A 828 16.813 8.738 7.576 1.00 71.16 N ATOM 583 CA ALA A 828 15.495 8.250 7.162 1.00 73.89 C ATOM 584 C ALA A 828 14.586 8.029 8.385 1.00 73.79 C ATOM 585 O ALA A 828 13.374 7.871 8.236 1.00 75.97 O ATOM 586 CB ALA A 828 15.661 6.981 6.365 1.00 73.30 C ATOM 587 H ALA A 828 17.616 8.077 7.578 1.00 0.00 H ATOM 588 N TYR A 829 15.176 8.015 9.587 1.00 71.16 N ATOM 589 CA TYR A 829 14.451 7.825 10.822 1.00 70.47 C ATOM 590 C TYR A 829 15.222 8.416 12.009 1.00 69.43 C ATOM 591 O TYR A 829 16.458 8.583 11.940 1.00 68.85 O ATOM 592 CB TYR A 829 14.230 6.330 11.077 1.00 70.86 C ATOM 593 CG TYR A 829 15.501 5.530 11.222 1.00 68.85 C ATOM 594 CD1 TYR A 829 16.139 5.425 12.446 1.00 66.93 C ATOM 595 CD2 TYR A 829 16.064 4.867 10.143 1.00 68.76 C ATOM 596 CE1 TYR A 829 17.314 4.705 12.593 1.00 64.65 C ATOM 597 CE2 TYR A 829 17.231 4.127 10.281 1.00 66.65 C ATOM 598 CZ TYR A 829 17.874 4.063 11.505 1.00 64.37 C ATOM 599 OH TYR A 829 19.040 3.354 11.653 1.00 60.62 O ATOM 600 HH TYR A 829 19.730 3.726 11.048 1.00 0.00 H ATOM 601 H TYR A 829 16.206 8.147 9.634 1.00 0.00 H ATOM 602 N ASP A 830 14.463 8.691 13.079 1.00 68.42 N ATOM 603 CA ASP A 830 14.918 8.962 14.446 1.00 67.20 C ATOM 604 C ASP A 830 14.704 7.722 15.317 1.00 62.86 C ATOM 605 O ASP A 830 13.825 6.931 15.057 1.00 62.77 O ATOM 606 CB ASP A 830 14.094 10.059 15.123 1.00 72.64 C ATOM 607 CG ASP A 830 14.435 11.444 14.615 1.00 80.48 C ATOM 608 OD1 ASP A 830 15.596 11.634 14.185 1.00 85.27 O ATOM 609 OD2 ASP A 830 13.545 12.316 14.643 1.00 81.87 O ATOM 610 H ASP A 830 13.435 8.715 12.922 1.00 0.00 H ATOM 611 N LEU A 831 15.459 7.625 16.407 1.00 58.71 N ATOM 612 CA LEU A 831 15.345 6.525 17.323 1.00 58.17 C ATOM 613 C LEU A 831 14.846 7.022 18.672 1.00 62.98 C ATOM 614 O LEU A 831 15.349 8.005 19.190 1.00 63.72 O ATOM 615 CB LEU A 831 16.721 5.891 17.502 1.00 54.93 C ATOM 616 CG LEU A 831 17.196 5.046 16.332 1.00 53.69 C ATOM 617 CD1 LEU A 831 18.621 4.582 16.580 1.00 53.19 C ATOM 618 CD2 LEU A 831 16.262 3.861 16.106 1.00 53.08 C ATOM 619 H LEU A 831 16.156 8.371 16.603 1.00 0.00 H ATOM 620 N GLU A 832 13.896 6.281 19.245 1.00 66.69 N ATOM 621 CA GLU A 832 13.468 6.467 20.609 1.00 67.56 C ATOM 622 C GLU A 832 13.595 5.133 21.353 1.00 62.45 C ATOM 623 O GLU A 832 13.085 4.122 20.918 1.00 59.96 O ATOM 624 CB GLU A 832 12.020 6.937 20.653 1.00 73.37 C ATOM 625 CG GLU A 832 11.856 8.444 20.571 1.00 81.39 C ATOM 626 CD GLU A 832 10.666 8.936 21.379 1.00 86.61 C ATOM 627 OE1 GLU A 832 10.056 8.092 22.102 1.00 85.46 O ATOM 628 OE2 GLU A 832 10.357 10.150 21.301 1.00 89.65 O ATOM 629 H GLU A 832 13.443 5.534 18.681 1.00 0.00 H ATOM 630 N VAL A 833 14.254 5.177 22.507 1.00 59.26 N ATOM 631 CA VAL A 833 14.398 4.035 23.370 1.00 56.73 C ATOM 632 C VAL A 833 13.074 3.790 24.101 1.00 55.61 C ATOM 633 O VAL A 833 12.675 4.618 24.869 1.00 56.79 O ATOM 634 CB VAL A 833 15.553 4.272 24.358 1.00 55.72 C ATOM 635 CG1 VAL A 833 15.738 3.100 25.314 1.00 53.93 C ATOM 636 CG2 VAL A 833 16.839 4.579 23.619 1.00 55.79 C ATOM 637 H VAL A 833 14.685 6.077 22.799 1.00 0.00 H ATOM 638 N ILE A 834 12.402 2.659 23.853 1.00 56.97 N ATOM 639 CA ILE A 834 11.142 2.329 24.583 1.00 58.48 C ATOM 640 C ILE A 834 11.483 1.676 25.925 1.00 59.27 C ATOM 641 O ILE A 834 11.104 2.169 26.975 1.00 62.92 O ATOM 642 CB ILE A 834 10.217 1.436 23.741 1.00 59.80 C ATOM 643 CG1 ILE A 834 9.739 2.176 22.495 1.00 62.53 C ATOM 644 CG2 ILE A 834 9.045 0.926 24.569 1.00 60.61 C ATOM 645 CD1 ILE A 834 9.331 1.255 21.377 1.00 65.30 C ATOM 646 H ILE A 834 12.765 1.997 23.138 1.00 0.00 H ATOM 647 N ASP A 835 12.197 0.552 25.871 1.00 56.15 N ATOM 648 CA ASP A 835 12.610 -0.163 27.054 1.00 53.00 C ATOM 649 C ASP A 835 14.085 -0.524 26.900 1.00 51.77 C ATOM 650 O ASP A 835 14.587 -0.771 25.789 1.00 50.24 O ATOM 651 CB ASP A 835 11.832 -1.461 27.256 1.00 54.64 C ATOM 652 CG ASP A 835 10.387 -1.272 27.663 1.00 56.43 C ATOM 653 OD1 ASP A 835 9.518 -1.857 26.978 1.00 57.46 O ATOM 654 OD2 ASP A 835 10.152 -0.581 28.673 1.00 58.13 O ATOM 655 H ASP A 835 12.467 0.176 24.940 1.00 0.00 H ATOM 656 N ILE A 836 14.754 -0.514 28.042 1.00 49.46 N ATOM 657 CA ILE A 836 16.103 -0.963 28.213 1.00 48.14 C ATOM 658 C ILE A 836 16.024 -2.210 29.084 1.00 46.28 C ATOM 659 O ILE A 836 15.454 -2.151 30.162 1.00 47.15 O ATOM 660 CB ILE A 836 16.959 0.128 28.876 1.00 47.86 C ATOM 661 CG1 ILE A 836 16.924 1.435 28.077 1.00 50.85 C ATOM 662 CG2 ILE A 836 18.383 -0.365 29.082 1.00 47.94 C ATOM 663 CD1 ILE A 836 17.654 2.590 28.742 1.00 51.45 C ATOM 664 H ILE A 836 14.260 -0.151 28.882 1.00 0.00 H ATOM 665 N PHE A 837 16.627 -3.301 28.619 1.00 45.23 N ATOM 666 CA PHE A 837 16.702 -4.528 29.380 1.00 45.64 C ATOM 667 C PHE A 837 18.164 -4.835 29.683 1.00 46.14 C ATOM 668 O PHE A 837 18.988 -4.756 28.799 1.00 48.67 O ATOM 669 CB PHE A 837 16.059 -5.669 28.601 1.00 44.54 C ATOM 670 CG PHE A 837 14.591 -5.473 28.357 1.00 44.89 C ATOM 671 CD1 PHE A 837 13.669 -5.720 29.363 1.00 45.19 C ATOM 672 CD2 PHE A 837 14.144 -4.993 27.141 1.00 44.62 C ATOM 673 CE1 PHE A 837 12.315 -5.538 29.141 1.00 46.18 C ATOM 674 CE2 PHE A 837 12.789 -4.775 26.937 1.00 47.32 C ATOM 675 CZ PHE A 837 11.880 -5.059 27.928 1.00 46.68 C ATOM 676 H PHE A 837 17.060 -3.270 27.674 1.00 0.00 H ATOM 677 N LYS A 838 18.467 -5.162 30.939 1.00 47.74 N ATOM 678 CA LYS A 838 19.753 -5.740 31.261 1.00 49.85 C ATOM 679 C LYS A 838 19.639 -7.264 31.147 1.00 47.62 C ATOM 680 O LYS A 838 18.733 -7.859 31.710 1.00 44.77 O ATOM 681 CB LYS A 838 20.204 -5.379 32.678 1.00 53.83 C ATOM 682 CG LYS A 838 21.643 -5.792 32.979 1.00 56.64 C ATOM 683 CD LYS A 838 22.141 -5.460 34.372 1.00 64.19 C ATOM 684 CE LYS A 838 21.768 -4.058 34.802 1.00 69.47 C ATOM 685 NZ LYS A 838 22.545 -3.612 35.985 1.00 79.30 N ATOM 686 HZ1 LYS A 838 22.362 -4.255 36.781 1.00 0.00 H ATOM 687 HZ2 LYS A 838 23.559 -3.622 35.756 1.00 0.00 H ATOM 688 HZ3 LYS A 838 22.257 -2.647 36.244 1.00 0.00 H ATOM 689 H LYS A 838 17.772 -5.000 31.695 1.00 0.00 H ATOM 690 N ILE A 839 20.617 -7.885 30.497 1.00 44.13 N ATOM 691 CA ILE A 839 20.520 -9.290 30.159 1.00 46.80 C ATOM 692 C ILE A 839 21.796 -10.030 30.571 1.00 46.46 C ATOM 693 O ILE A 839 22.883 -9.531 30.410 1.00 47.45 O ATOM 694 CB ILE A 839 20.257 -9.479 28.659 1.00 46.98 C ATOM 695 CG1 ILE A 839 21.373 -8.875 27.804 1.00 46.46 C ATOM 696 CG2 ILE A 839 18.898 -8.931 28.277 1.00 46.18 C ATOM 697 CD1 ILE A 839 21.122 -8.977 26.329 1.00 47.77 C ATOM 698 H ILE A 839 21.468 -7.352 30.226 1.00 0.00 H ATOM 699 N GLU A 840 21.614 -11.255 31.062 1.00 48.14 N ATOM 700 CA GLU A 840 22.682 -12.150 31.483 1.00 53.33 C ATOM 701 C GLU A 840 22.432 -13.520 30.853 1.00 49.06 C ATOM 702 O GLU A 840 21.631 -14.285 31.349 1.00 48.20 O ATOM 703 CB GLU A 840 22.688 -12.345 33.005 1.00 59.94 C ATOM 704 CG GLU A 840 23.089 -11.120 33.798 1.00 71.90 C ATOM 705 CD GLU A 840 24.516 -11.132 34.338 1.00 82.24 C ATOM 706 OE1 GLU A 840 25.014 -12.230 34.688 1.00 88.18 O ATOM 707 OE2 GLU A 840 25.132 -10.038 34.413 1.00 89.64 O ATOM 708 H GLU A 840 20.636 -11.597 31.151 1.00 0.00 H ATOM 709 N ARG A 841 23.143 -13.827 29.779 1.00 46.88 N ATOM 710 CA ARG A 841 23.084 -15.173 29.194 1.00 47.86 C ATOM 711 C ARG A 841 23.735 -16.185 30.137 1.00 49.04 C ATOM 712 O ARG A 841 24.825 -15.946 30.647 1.00 52.77 O ATOM 713 CB ARG A 841 23.767 -15.203 27.830 1.00 45.60 C ATOM 714 CG ARG A 841 22.979 -14.524 26.724 1.00 43.94 C ATOM 715 CD ARG A 841 23.662 -14.762 25.389 1.00 43.11 C ATOM 716 NE ARG A 841 23.557 -16.185 25.053 1.00 45.89 N ATOM 717 CZ ARG A 841 24.538 -17.073 25.149 1.00 46.22 C ATOM 718 NH1 ARG A 841 25.794 -16.676 25.259 1.00 46.25 N ATOM 719 NH2 ARG A 841 24.240 -18.354 25.141 1.00 47.10 N ATOM 720 HE ARG A 841 22.636 -16.527 24.711 1.00 0.00 H ATOM 721 HH12 ARG A 841 26.557 -17.379 25.334 1.00 0.00 H ATOM 722 HH11 ARG A 841 26.019 -15.661 25.271 1.00 0.00 H ATOM 723 HH22 ARG A 841 24.996 -19.064 25.215 1.00 0.00 H ATOM 724 HH21 ARG A 841 23.248 -18.657 25.060 1.00 0.00 H ATOM 725 H ARG A 841 23.752 -13.105 29.344 1.00 0.00 H ATOM 726 N GLU A 842 23.038 -17.303 30.373 1.00 52.61 N ATOM 727 CA GLU A 842 23.592 -18.428 31.071 1.00 54.36 C ATOM 728 C GLU A 842 24.906 -18.818 30.403 1.00 54.10 C ATOM 729 O GLU A 842 24.990 -18.855 29.168 1.00 50.01 O ATOM 730 CB GLU A 842 22.688 -19.653 31.015 1.00 60.20 C ATOM 731 CG GLU A 842 21.444 -19.526 31.862 1.00 65.12 C ATOM 732 CD GLU A 842 20.606 -20.792 31.920 1.00 68.53 C ATOM 733 OE1 GLU A 842 19.413 -20.680 32.257 1.00 70.85 O ATOM 734 OE2 GLU A 842 21.159 -21.878 31.632 1.00 72.10 O ATOM 735 H GLU A 842 22.055 -17.359 30.037 1.00 0.00 H ATOM 736 N GLY A 843 25.915 -19.069 31.245 1.00 54.58 N ATOM 737 CA GLY A 843 27.212 -19.520 30.805 1.00 57.11 C ATOM 738 C GLY A 843 28.113 -18.403 30.327 1.00 55.61 C ATOM 739 O GLY A 843 29.307 -18.592 30.224 1.00 61.09 O ATOM 740 H GLY A 843 25.757 -18.933 32.264 1.00 0.00 H ATOM 741 N GLU A 844 27.583 -17.211 30.055 1.00 55.70 N ATOM 742 CA GLU A 844 28.436 -16.237 29.399 1.00 52.26 C ATOM 743 C GLU A 844 29.479 -15.666 30.372 1.00 52.40 C ATOM 744 O GLU A 844 30.621 -15.374 29.956 1.00 50.26 O ATOM 745 CB GLU A 844 27.606 -15.157 28.721 1.00 52.78 C ATOM 746 CG GLU A 844 28.143 -14.793 27.349 1.00 52.20 C ATOM 747 CD GLU A 844 27.332 -13.711 26.650 1.00 49.38 C ATOM 748 OE1 GLU A 844 27.038 -12.696 27.317 1.00 50.07 O ATOM 749 OE2 GLU A 844 26.964 -13.906 25.468 1.00 46.21 O ATOM 750 H GLU A 844 26.598 -16.988 30.303 1.00 0.00 H ATOM 751 N CYS A 845 29.120 -15.484 31.649 1.00 53.26 N ATOM 752 CA CYS A 845 30.073 -14.932 32.604 1.00 54.25 C ATOM 753 C CYS A 845 31.339 -15.812 32.605 1.00 55.47 C ATOM 754 O CYS A 845 32.468 -15.355 32.414 1.00 53.57 O ATOM 755 CB CYS A 845 29.464 -14.810 33.998 1.00 56.16 C ATOM 756 SG CYS A 845 30.673 -14.253 35.237 1.00 57.13 S ATOM 757 H CYS A 845 28.160 -15.737 31.960 1.00 0.00 H ATOM 758 N GLN A 846 31.127 -17.110 32.752 1.00 56.94 N ATOM 759 CA GLN A 846 32.205 -18.091 32.716 1.00 61.45 C ATOM 760 C GLN A 846 32.964 -18.059 31.378 1.00 58.09 C ATOM 761 O GLN A 846 34.169 -18.138 31.383 1.00 59.83 O ATOM 762 CB GLN A 846 31.625 -19.481 32.956 1.00 65.03 C ATOM 763 CG GLN A 846 32.645 -20.448 33.515 1.00 73.22 C ATOM 764 CD GLN A 846 31.899 -21.506 34.280 1.00 80.26 C ATOM 765 OE1 GLN A 846 30.893 -21.211 34.935 1.00 81.17 O ATOM 766 NE2 GLN A 846 32.381 -22.740 34.192 1.00 86.53 N ATOM 767 HE22 GLN A 846 33.232 -22.926 33.625 1.00 0.00 H ATOM 768 HE21 GLN A 846 31.907 -23.520 34.690 1.00 0.00 H ATOM 769 H GLN A 846 30.153 -17.443 32.899 1.00 0.00 H ATOM 770 N ARG A 847 32.251 -17.932 30.252 1.00 54.58 N ATOM 771 CA ARG A 847 32.839 -17.990 28.911 1.00 55.17 C ATOM 772 C ARG A 847 33.747 -16.779 28.642 1.00 55.40 C ATOM 773 O ARG A 847 34.793 -16.908 27.979 1.00 53.26 O ATOM 774 CB ARG A 847 31.733 -18.033 27.851 1.00 55.41 C ATOM 775 CG ARG A 847 32.234 -18.245 26.426 1.00 57.07 C ATOM 776 CD ARG A 847 31.099 -18.322 25.409 1.00 57.26 C ATOM 777 NE ARG A 847 30.511 -17.024 25.134 1.00 55.08 N ATOM 778 CZ ARG A 847 29.651 -16.765 24.157 1.00 57.14 C ATOM 779 NH1 ARG A 847 29.261 -17.735 23.349 1.00 57.51 N ATOM 780 NH2 ARG A 847 29.181 -15.535 23.996 1.00 54.05 N ATOM 781 HE ARG A 847 30.785 -16.234 25.752 1.00 0.00 H ATOM 782 HH12 ARG A 847 28.587 -17.534 22.583 1.00 0.00 H ATOM 783 HH11 ARG A 847 29.628 -18.699 23.479 1.00 0.00 H ATOM 784 HH22 ARG A 847 28.507 -15.332 23.230 1.00 0.00 H ATOM 785 HH21 ARG A 847 29.486 -14.774 24.635 1.00 0.00 H ATOM 786 H ARG A 847 31.225 -17.784 30.333 1.00 0.00 H ATOM 787 N TYR A 848 33.333 -15.613 29.155 1.00 53.09 N ATOM 788 CA TYR A 848 33.967 -14.320 28.897 1.00 52.03 C ATOM 789 C TYR A 848 35.231 -14.179 29.755 1.00 55.88 C ATOM 790 O TYR A 848 36.182 -13.500 29.373 1.00 57.45 O ATOM 791 CB TYR A 848 32.957 -13.191 29.146 1.00 49.41 C ATOM 792 CG TYR A 848 33.480 -11.817 28.796 1.00 50.28 C ATOM 793 CD1 TYR A 848 33.780 -11.477 27.479 1.00 46.93 C ATOM 794 CD2 TYR A 848 33.626 -10.835 29.768 1.00 48.63 C ATOM 795 CE1 TYR A 848 34.264 -10.214 27.152 1.00 47.95 C ATOM 796 CE2 TYR A 848 34.105 -9.571 29.453 1.00 50.00 C ATOM 797 CZ TYR A 848 34.444 -9.261 28.145 1.00 49.19 C ATOM 798 OH TYR A 848 34.926 -8.017 27.835 1.00 50.04 O ATOM 799 HH TYR A 848 34.251 -7.334 28.075 1.00 0.00 H ATOM 800 H TYR A 848 32.502 -15.628 29.781 1.00 0.00 H ATOM 801 N LYS A 849 35.255 -14.912 30.868 1.00 59.20 N ATOM 802 CA LYS A 849 36.241 -14.799 31.912 1.00 64.68 C ATOM 803 C LYS A 849 37.670 -14.703 31.375 1.00 63.72 C ATOM 804 O LYS A 849 38.429 -13.870 31.865 1.00 64.77 O ATOM 805 CB LYS A 849 36.083 -15.967 32.897 1.00 72.07 C ATOM 806 CG LYS A 849 36.524 -15.655 34.323 1.00 78.77 C ATOM 807 CD LYS A 849 36.159 -16.718 35.358 1.00 86.82 C ATOM 808 CE LYS A 849 37.070 -17.933 35.335 1.00 91.85 C ATOM 809 NZ LYS A 849 36.446 -19.071 34.615 1.00 94.06 N ATOM 810 HZ1 LYS A 849 35.558 -19.335 35.089 1.00 0.00 H ATOM 811 HZ2 LYS A 849 36.247 -18.791 33.633 1.00 0.00 H ATOM 812 HZ3 LYS A 849 37.097 -19.882 34.620 1.00 0.00 H ATOM 813 H LYS A 849 34.504 -15.620 30.992 1.00 0.00 H ATOM 814 N PRO A 850 38.136 -15.516 30.394 1.00 61.79 N ATOM 815 CA PRO A 850 39.492 -15.332 29.861 1.00 62.70 C ATOM 816 C PRO A 850 39.791 -13.904 29.358 1.00 59.31 C ATOM 817 O PRO A 850 40.939 -13.505 29.361 1.00 58.34 O ATOM 818 CB PRO A 850 39.577 -16.333 28.695 1.00 63.61 C ATOM 819 CG PRO A 850 38.553 -17.390 29.053 1.00 63.29 C ATOM 820 CD PRO A 850 37.431 -16.630 29.744 1.00 61.14 C ATOM 821 N PHE A 851 38.753 -13.128 29.014 1.00 54.21 N ATOM 822 CA PHE A 851 38.918 -11.828 28.355 1.00 53.12 C ATOM 823 C PHE A 851 38.502 -10.652 29.256 1.00 53.41 C ATOM 824 O PHE A 851 38.660 -9.512 28.846 1.00 52.68 O ATOM 825 CB PHE A 851 38.118 -11.817 27.048 1.00 50.01 C ATOM 826 CG PHE A 851 38.529 -12.879 26.057 1.00 51.27 C ATOM 827 CD1 PHE A 851 39.673 -12.722 25.277 1.00 51.98 C ATOM 828 CD2 PHE A 851 37.778 -14.038 25.889 1.00 53.07 C ATOM 829 CE1 PHE A 851 40.071 -13.704 24.371 1.00 52.04 C ATOM 830 CE2 PHE A 851 38.172 -15.016 24.978 1.00 54.20 C ATOM 831 CZ PHE A 851 39.319 -14.846 24.216 1.00 53.42 C ATOM 832 H PHE A 851 37.791 -13.462 29.223 1.00 0.00 H ATOM 833 N LYS A 852 38.009 -10.928 30.471 1.00 54.93 N ATOM 834 CA LYS A 852 37.364 -9.936 31.338 1.00 57.31 C ATOM 835 C LYS A 852 38.395 -8.896 31.794 1.00 61.55 C ATOM 836 O LYS A 852 38.013 -7.783 32.185 1.00 63.69 O ATOM 837 CB LYS A 852 36.677 -10.589 32.554 1.00 60.08 C ATOM 838 CG LYS A 852 37.538 -10.656 33.821 1.00 62.74 C ATOM 839 CD LYS A 852 37.213 -11.759 34.859 1.00 62.51 C ATOM 840 CE LYS A 852 38.401 -12.096 35.752 1.00 63.69 C ATOM 841 NZ LYS A 852 38.013 -12.912 36.928 1.00 66.12 N ATOM 842 HZ1 LYS A 852 37.320 -12.387 37.499 1.00 0.00 H ATOM 843 HZ2 LYS A 852 37.591 -13.806 36.604 1.00 0.00 H ATOM 844 HZ3 LYS A 852 38.856 -13.113 37.502 1.00 0.00 H ATOM 845 H LYS A 852 38.088 -11.904 30.820 1.00 0.00 H ATOM 846 N GLN A 853 39.684 -9.260 31.781 1.00 65.43 N ATOM 847 CA GLN A 853 40.747 -8.333 32.165 1.00 68.76 C ATOM 848 C GLN A 853 41.499 -7.811 30.933 1.00 67.74 C ATOM 849 O GLN A 853 42.376 -6.943 31.072 1.00 66.45 O ATOM 850 CB GLN A 853 41.739 -8.991 33.114 1.00 74.98 C ATOM 851 CG GLN A 853 41.760 -8.362 34.498 1.00 82.08 C ATOM 852 CD GLN A 853 41.057 -9.201 35.537 1.00 84.09 C ATOM 853 OE1 GLN A 853 41.690 -9.946 36.276 1.00 89.50 O ATOM 854 NE2 GLN A 853 39.741 -9.076 35.609 1.00 83.82 N ATOM 855 HE22 GLN A 853 39.244 -8.432 34.962 1.00 0.00 H ATOM 856 HE21 GLN A 853 39.205 -9.622 36.313 1.00 0.00 H ATOM 857 H GLN A 853 39.935 -10.227 31.490 1.00 0.00 H ATOM 858 N LEU A 854 41.169 -8.330 29.745 1.00 60.65 N ATOM 859 CA LEU A 854 41.794 -7.856 28.561 1.00 59.25 C ATOM 860 C LEU A 854 41.578 -6.349 28.514 1.00 56.85 C ATOM 861 O LEU A 854 40.553 -5.857 28.982 1.00 56.96 O ATOM 862 CB LEU A 854 41.200 -8.520 27.315 1.00 57.49 C ATOM 863 CG LEU A 854 42.078 -8.412 26.071 1.00 55.80 C ATOM 864 CD1 LEU A 854 43.473 -8.965 26.346 1.00 55.14 C ATOM 865 CD2 LEU A 854 41.439 -9.122 24.890 1.00 55.56 C ATOM 866 H LEU A 854 40.453 -9.082 29.688 1.00 0.00 H ATOM 867 N HIS A 855 42.582 -5.631 28.016 1.00 56.18 N ATOM 868 CA HIS A 855 42.427 -4.217 27.805 1.00 55.38 C ATOM 869 C HIS A 855 41.486 -3.952 26.634 1.00 52.98 C ATOM 870 O HIS A 855 41.118 -4.856 25.831 1.00 50.29 O ATOM 871 CB HIS A 855 43.763 -3.537 27.552 1.00 57.57 C ATOM 872 CG HIS A 855 44.447 -3.984 26.308 1.00 58.01 C ATOM 873 ND1 HIS A 855 45.075 -5.197 26.215 1.00 59.56 N ATOM 874 CD2 HIS A 855 44.657 -3.358 25.135 1.00 58.47 C ATOM 875 CE1 HIS A 855 45.649 -5.305 25.042 1.00 60.09 C ATOM 876 NE2 HIS A 855 45.411 -4.196 24.364 1.00 59.54 N ATOM 877 H HIS A 855 43.482 -6.094 27.779 1.00 0.00 H ATOM 878 N ASN A 856 41.086 -2.685 26.567 1.00 52.01 N ATOM 879 CA ASN A 856 40.298 -2.161 25.500 1.00 49.70 C ATOM 880 C ASN A 856 39.023 -3.000 25.346 1.00 50.44 C ATOM 881 O ASN A 856 38.791 -3.653 24.290 1.00 49.44 O ATOM 882 CB ASN A 856 41.123 -2.082 24.214 1.00 50.59 C ATOM 883 CG ASN A 856 40.318 -1.455 23.117 1.00 50.38 C ATOM 884 OD1 ASN A 856 39.409 -0.675 23.415 1.00 56.58 O ATOM 885 ND2 ASN A 856 40.571 -1.868 21.887 1.00 46.96 N ATOM 886 HD22 ASN A 856 41.356 -2.527 21.711 1.00 0.00 H ATOM 887 HD21 ASN A 856 39.985 -1.533 21.095 1.00 0.00 H ATOM 888 H ASN A 856 41.363 -2.041 27.335 1.00 0.00 H ATOM 889 N ARG A 857 38.204 -2.984 26.410 1.00 48.16 N ATOM 890 CA ARG A 857 36.874 -3.555 26.409 1.00 45.05 C ATOM 891 C ARG A 857 35.875 -2.412 26.211 1.00 43.62 C ATOM 892 O ARG A 857 35.947 -1.421 26.881 1.00 45.19 O ATOM 893 CB ARG A 857 36.616 -4.309 27.710 1.00 46.21 C ATOM 894 CG ARG A 857 37.472 -5.558 27.885 1.00 48.69 C ATOM 895 CD ARG A 857 37.385 -6.193 29.273 1.00 51.51 C ATOM 896 NE ARG A 857 38.046 -5.411 30.328 1.00 54.76 N ATOM 897 CZ ARG A 857 37.406 -4.691 31.249 1.00 54.89 C ATOM 898 NH1 ARG A 857 36.088 -4.714 31.298 1.00 55.00 N ATOM 899 NH2 ARG A 857 38.080 -3.925 32.089 1.00 56.70 N ATOM 900 HE ARG A 857 39.086 -5.420 30.358 1.00 0.00 H ATOM 901 HH12 ARG A 857 35.584 -4.154 32.015 1.00 0.00 H ATOM 902 HH11 ARG A 857 35.552 -5.292 30.620 1.00 0.00 H ATOM 903 HH22 ARG A 857 37.573 -3.366 32.805 1.00 0.00 H ATOM 904 HH21 ARG A 857 39.118 -3.881 32.034 1.00 0.00 H ATOM 905 H ARG A 857 38.545 -2.536 27.284 1.00 0.00 H ATOM 906 N ARG A 858 34.957 -2.558 25.261 1.00 41.52 N ATOM 907 CA ARG A 858 34.126 -1.434 24.846 1.00 45.26 C ATOM 908 C ARG A 858 32.673 -1.886 24.730 1.00 41.01 C ATOM 909 O ARG A 858 32.390 -3.002 24.331 1.00 41.15 O ATOM 910 CB ARG A 858 34.612 -0.853 23.509 1.00 48.73 C ATOM 911 CG ARG A 858 36.101 -0.535 23.501 1.00 60.03 C ATOM 912 CD ARG A 858 36.440 0.942 23.356 1.00 66.59 C ATOM 913 NE ARG A 858 36.213 1.304 21.969 1.00 65.67 N ATOM 914 CZ ARG A 858 36.528 2.471 21.437 1.00 67.66 C ATOM 915 NH1 ARG A 858 37.023 3.439 22.187 1.00 73.39 N ATOM 916 NH2 ARG A 858 36.337 2.659 20.149 1.00 63.17 N ATOM 917 HE ARG A 858 35.771 0.594 21.350 1.00 0.00 H ATOM 918 HH12 ARG A 858 37.268 4.355 21.759 1.00 0.00 H ATOM 919 HH11 ARG A 858 37.168 3.286 23.205 1.00 0.00 H ATOM 920 HH22 ARG A 858 36.580 3.572 19.715 1.00 0.00 H ATOM 921 HH21 ARG A 858 35.943 1.894 19.565 1.00 0.00 H ATOM 922 H ARG A 858 34.830 -3.485 24.808 1.00 0.00 H ATOM 923 N LEU A 859 31.756 -0.969 25.026 1.00 40.47 N ATOM 924 CA LEU A 859 30.342 -1.250 24.943 1.00 41.59 C ATOM 925 C LEU A 859 29.867 -0.812 23.567 1.00 42.51 C ATOM 926 O LEU A 859 29.831 0.393 23.305 1.00 45.79 O ATOM 927 CB LEU A 859 29.610 -0.505 26.059 1.00 43.11 C ATOM 928 CG LEU A 859 28.156 -0.909 26.241 1.00 43.98 C ATOM 929 CD1 LEU A 859 28.071 -2.280 26.865 1.00 43.64 C ATOM 930 CD2 LEU A 859 27.398 0.119 27.067 1.00 45.93 C ATOM 931 H LEU A 859 32.066 -0.023 25.326 1.00 0.00 H ATOM 932 N LEU A 860 29.528 -1.790 22.705 1.00 41.43 N ATOM 933 CA LEU A 860 29.275 -1.538 21.278 1.00 41.42 C ATOM 934 C LEU A 860 27.918 -2.108 20.855 1.00 41.35 C ATOM 935 O LEU A 860 27.360 -3.009 21.503 1.00 40.62 O ATOM 936 CB LEU A 860 30.391 -2.164 20.439 1.00 42.24 C ATOM 937 CG LEU A 860 31.791 -1.649 20.747 1.00 44.61 C ATOM 938 CD1 LEU A 860 32.842 -2.500 20.067 1.00 46.29 C ATOM 939 CD2 LEU A 860 31.932 -0.197 20.340 1.00 45.13 C ATOM 940 H LEU A 860 29.442 -2.763 23.063 1.00 0.00 H ATOM 941 N TRP A 861 27.394 -1.567 19.742 1.00 40.25 N ATOM 942 CA TRP A 861 26.051 -1.917 19.243 1.00 41.50 C ATOM 943 C TRP A 861 26.138 -3.162 18.368 1.00 41.21 C ATOM 944 O TRP A 861 27.101 -3.336 17.632 1.00 41.79 O ATOM 945 CB TRP A 861 25.411 -0.765 18.447 1.00 41.24 C ATOM 946 CG TRP A 861 25.290 0.515 19.213 1.00 42.31 C ATOM 947 CD1 TRP A 861 26.080 1.619 19.107 1.00 45.28 C ATOM 948 CD2 TRP A 861 24.300 0.841 20.198 1.00 42.92 C ATOM 949 NE1 TRP A 861 25.681 2.592 19.984 1.00 44.82 N ATOM 950 CE2 TRP A 861 24.573 2.148 20.650 1.00 44.74 C ATOM 951 CE3 TRP A 861 23.213 0.156 20.742 1.00 43.21 C ATOM 952 CZ2 TRP A 861 23.799 2.770 21.619 1.00 43.58 C ATOM 953 CZ3 TRP A 861 22.449 0.767 21.706 1.00 43.69 C ATOM 954 CH2 TRP A 861 22.742 2.059 22.138 1.00 44.97 C ATOM 955 HE1 TRP A 861 26.143 3.514 20.120 1.00 0.00 H ATOM 956 H TRP A 861 27.958 -0.873 19.211 1.00 0.00 H ATOM 957 N HIS A 862 25.066 -3.949 18.398 1.00 40.58 N ATOM 958 CA HIS A 862 24.834 -4.974 17.422 1.00 41.25 C ATOM 959 C HIS A 862 23.342 -5.067 17.139 1.00 41.97 C ATOM 960 O HIS A 862 22.571 -5.379 18.056 1.00 42.51 O ATOM 961 CB HIS A 862 25.349 -6.333 17.883 1.00 41.37 C ATOM 962 CG HIS A 862 25.192 -7.363 16.822 1.00 42.97 C ATOM 963 ND1 HIS A 862 26.208 -7.664 15.937 1.00 45.73 N ATOM 964 CD2 HIS A 862 24.129 -8.108 16.446 1.00 43.51 C ATOM 965 CE1 HIS A 862 25.785 -8.587 15.083 1.00 43.71 C ATOM 966 NE2 HIS A 862 24.517 -8.885 15.385 1.00 43.82 N ATOM 967 H HIS A 862 24.369 -3.816 19.159 1.00 0.00 H ATOM 968 N GLY A 863 22.966 -4.778 15.888 1.00 41.63 N ATOM 969 CA GLY A 863 21.589 -4.826 15.454 1.00 43.27 C ATOM 970 C GLY A 863 21.323 -6.088 14.663 1.00 44.55 C ATOM 971 O GLY A 863 22.209 -6.581 13.978 1.00 49.04 O ATOM 972 H GLY A 863 23.696 -4.507 15.199 1.00 0.00 H ATOM 973 N SER A 864 20.102 -6.609 14.765 1.00 46.97 N ATOM 974 CA SER A 864 19.670 -7.763 13.965 1.00 49.40 C ATOM 975 C SER A 864 18.140 -7.762 13.858 1.00 49.80 C ATOM 976 O SER A 864 17.469 -7.016 14.560 1.00 48.59 O ATOM 977 CB SER A 864 20.185 -9.037 14.575 1.00 49.06 C ATOM 978 OG SER A 864 19.964 -10.138 13.717 1.00 50.91 O ATOM 979 HG SER A 864 18.993 -10.236 13.551 1.00 0.00 H ATOM 980 H SER A 864 19.430 -6.184 15.435 1.00 0.00 H ATOM 981 N ARG A 865 17.609 -8.587 12.957 1.00 52.47 N ATOM 982 CA ARG A 865 16.172 -8.695 12.770 1.00 57.18 C ATOM 983 C ARG A 865 15.571 -9.258 14.051 1.00 56.23 C ATOM 984 O ARG A 865 16.159 -10.125 14.683 1.00 56.30 O ATOM 985 CB ARG A 865 15.738 -9.698 11.695 1.00 60.71 C ATOM 986 CG ARG A 865 16.592 -9.759 10.441 1.00 66.07 C ATOM 987 CD ARG A 865 16.260 -8.691 9.428 1.00 67.87 C ATOM 988 NE ARG A 865 15.765 -9.191 8.150 1.00 71.31 N ATOM 989 CZ ARG A 865 16.340 -8.926 6.978 1.00 73.30 C ATOM 990 NH1 ARG A 865 15.598 -8.520 5.969 1.00 72.45 N ATOM 991 NH2 ARG A 865 17.655 -8.971 6.844 1.00 75.91 N ATOM 992 HE ARG A 865 14.914 -9.789 8.154 1.00 0.00 H ATOM 993 HH12 ARG A 865 16.039 -8.311 5.051 1.00 0.00 H ATOM 994 HH11 ARG A 865 14.571 -8.408 6.090 1.00 0.00 H ATOM 995 HH22 ARG A 865 18.091 -8.762 5.923 1.00 0.00 H ATOM 996 HH21 ARG A 865 18.253 -9.215 7.659 1.00 0.00 H ATOM 997 H ARG A 865 18.240 -9.170 12.371 1.00 0.00 H ATOM 998 N THR A 866 14.352 -8.832 14.354 1.00 58.22 N ATOM 999 CA THR A 866 13.620 -9.318 15.524 1.00 59.48 C ATOM 1000 C THR A 866 13.595 -10.858 15.559 1.00 58.10 C ATOM 1001 O THR A 866 13.781 -11.445 16.613 1.00 58.24 O ATOM 1002 CB THR A 866 12.243 -8.654 15.570 1.00 58.52 C ATOM 1003 OG1 THR A 866 12.516 -7.260 15.678 1.00 57.10 O ATOM 1004 CG2 THR A 866 11.390 -9.117 16.726 1.00 59.34 C ATOM 1005 HG1 THR A 866 13.040 -6.966 14.891 1.00 0.00 H ATOM 1006 H THR A 866 13.900 -8.127 13.738 1.00 0.00 H ATOM 1007 N THR A 867 13.428 -11.496 14.399 1.00 57.65 N ATOM 1008 CA THR A 867 13.260 -12.952 14.298 1.00 60.78 C ATOM 1009 C THR A 867 14.543 -13.717 14.659 1.00 59.60 C ATOM 1010 O THR A 867 14.482 -14.934 14.872 1.00 60.40 O ATOM 1011 CB THR A 867 12.748 -13.304 12.899 1.00 62.65 C ATOM 1012 OG1 THR A 867 13.642 -12.656 11.993 1.00 61.59 O ATOM 1013 CG2 THR A 867 11.328 -12.829 12.673 1.00 61.97 C ATOM 1014 HG1 THR A 867 13.363 -12.846 11.063 1.00 0.00 H ATOM 1015 H THR A 867 13.416 -10.935 13.523 1.00 0.00 H ATOM 1016 N ASN A 868 15.682 -13.015 14.753 1.00 56.92 N ATOM 1017 CA ASN A 868 16.970 -13.613 15.101 1.00 54.03 C ATOM 1018 C ASN A 868 17.160 -13.659 16.618 1.00 52.26 C ATOM 1019 O ASN A 868 18.065 -14.334 17.085 1.00 48.86 O ATOM 1020 CB ASN A 868 18.128 -12.858 14.440 1.00 53.90 C ATOM 1021 CG ASN A 868 18.107 -12.988 12.925 1.00 57.24 C ATOM 1022 OD1 ASN A 868 18.486 -12.064 12.208 1.00 55.85 O ATOM 1023 ND2 ASN A 868 17.649 -14.128 12.432 1.00 55.78 N ATOM 1024 HD22 ASN A 868 17.338 -14.885 13.074 1.00 0.00 H ATOM 1025 HD21 ASN A 868 17.600 -14.267 11.402 1.00 0.00 H ATOM 1026 H ASN A 868 15.647 -11.992 14.569 1.00 0.00 H ATOM 1027 N PHE A 869 16.336 -12.924 17.379 1.00 51.24 N ATOM 1028 CA PHE A 869 16.670 -12.622 18.777 1.00 50.98 C ATOM 1029 C PHE A 869 16.474 -13.822 19.705 1.00 51.00 C ATOM 1030 O PHE A 869 17.200 -13.933 20.698 1.00 49.00 O ATOM 1031 CB PHE A 869 15.955 -11.363 19.269 1.00 51.38 C ATOM 1032 CG PHE A 869 16.818 -10.157 19.019 1.00 50.58 C ATOM 1033 CD1 PHE A 869 17.773 -9.773 19.945 1.00 50.26 C ATOM 1034 CD2 PHE A 869 16.780 -9.505 17.797 1.00 50.58 C ATOM 1035 CE1 PHE A 869 18.615 -8.704 19.678 1.00 50.57 C ATOM 1036 CE2 PHE A 869 17.634 -8.452 17.532 1.00 48.08 C ATOM 1037 CZ PHE A 869 18.556 -8.059 18.464 1.00 48.25 C ATOM 1038 H PHE A 869 15.449 -12.563 16.974 1.00 0.00 H ATOM 1039 N ALA A 870 15.548 -14.726 19.377 1.00 52.12 N ATOM 1040 CA ALA A 870 15.407 -15.975 20.125 1.00 52.81 C ATOM 1041 C ALA A 870 16.733 -16.743 20.085 1.00 53.56 C ATOM 1042 O ALA A 870 17.259 -17.129 21.120 1.00 57.24 O ATOM 1043 CB ALA A 870 14.271 -16.793 19.559 1.00 54.32 C ATOM 1044 H ALA A 870 14.914 -14.538 18.574 1.00 0.00 H ATOM 1045 N GLY A 871 17.275 -16.925 18.871 1.00 55.41 N ATOM 1046 CA GLY A 871 18.565 -17.597 18.644 1.00 53.25 C ATOM 1047 C GLY A 871 19.702 -16.879 19.331 1.00 50.88 C ATOM 1048 O GLY A 871 20.534 -17.497 19.992 1.00 50.89 O ATOM 1049 H GLY A 871 16.754 -16.571 18.043 1.00 0.00 H ATOM 1050 N ILE A 872 19.716 -15.555 19.194 1.00 48.81 N ATOM 1051 CA ILE A 872 20.829 -14.740 19.653 1.00 49.30 C ATOM 1052 C ILE A 872 20.942 -14.843 21.172 1.00 50.04 C ATOM 1053 O ILE A 872 22.043 -15.027 21.711 1.00 52.11 O ATOM 1054 CB ILE A 872 20.659 -13.283 19.192 1.00 49.29 C ATOM 1055 CG1 ILE A 872 20.951 -13.170 17.694 1.00 50.97 C ATOM 1056 CG2 ILE A 872 21.526 -12.364 20.017 1.00 48.44 C ATOM 1057 CD1 ILE A 872 20.647 -11.819 17.104 1.00 50.35 C ATOM 1058 H ILE A 872 18.903 -15.088 18.743 1.00 0.00 H ATOM 1059 N LEU A 873 19.808 -14.717 21.859 1.00 50.71 N ATOM 1060 CA LEU A 873 19.800 -14.786 23.315 1.00 50.18 C ATOM 1061 C LEU A 873 20.079 -16.224 23.780 1.00 51.07 C ATOM 1062 O LEU A 873 20.903 -16.444 24.664 1.00 47.95 O ATOM 1063 CB LEU A 873 18.471 -14.242 23.839 1.00 50.27 C ATOM 1064 CG LEU A 873 18.254 -12.749 23.620 1.00 48.93 C ATOM 1065 CD1 LEU A 873 16.939 -12.332 24.234 1.00 52.41 C ATOM 1066 CD2 LEU A 873 19.380 -11.927 24.218 1.00 49.31 C ATOM 1067 H LEU A 873 18.914 -14.567 21.349 1.00 0.00 H ATOM 1068 N SER A 874 19.467 -17.210 23.129 1.00 51.90 N ATOM 1069 CA SER A 874 19.634 -18.588 23.597 1.00 55.63 C ATOM 1070 C SER A 874 21.063 -19.084 23.351 1.00 53.62 C ATOM 1071 O SER A 874 21.591 -19.790 24.177 1.00 55.82 O ATOM 1072 CB SER A 874 18.580 -19.536 23.032 1.00 56.07 C ATOM 1073 OG SER A 874 18.674 -19.615 21.634 1.00 59.70 O ATOM 1074 HG SER A 874 18.535 -18.716 21.244 1.00 0.00 H ATOM 1075 H SER A 874 18.877 -17.005 22.298 1.00 0.00 H ATOM 1076 N GLN A 875 21.695 -18.660 22.257 1.00 51.66 N ATOM 1077 CA GLN A 875 22.991 -19.211 21.852 1.00 52.86 C ATOM 1078 C GLN A 875 24.097 -18.151 21.823 1.00 49.04 C ATOM 1079 O GLN A 875 25.215 -18.503 21.512 1.00 49.77 O ATOM 1080 CB GLN A 875 22.892 -19.856 20.467 1.00 55.55 C ATOM 1081 CG GLN A 875 21.775 -20.887 20.389 1.00 61.35 C ATOM 1082 CD GLN A 875 22.109 -22.079 19.530 1.00 66.15 C ATOM 1083 OE1 GLN A 875 22.901 -21.994 18.597 1.00 71.97 O ATOM 1084 NE2 GLN A 875 21.498 -23.211 19.834 1.00 70.88 N ATOM 1085 HE22 GLN A 875 20.833 -23.245 20.633 1.00 0.00 H ATOM 1086 HE21 GLN A 875 21.683 -24.068 19.275 1.00 0.00 H ATOM 1087 H GLN A 875 21.257 -17.918 21.675 1.00 0.00 H ATOM 1088 N GLY A 876 23.789 -16.882 22.125 1.00 47.06 N ATOM 1089 CA GLY A 876 24.747 -15.773 21.999 1.00 46.75 C ATOM 1090 C GLY A 876 24.928 -15.337 20.548 1.00 46.52 C ATOM 1091 O GLY A 876 24.461 -15.983 19.612 1.00 48.58 O ATOM 1092 H GLY A 876 22.829 -16.672 22.464 1.00 0.00 H ATOM 1093 N LEU A 877 25.622 -14.219 20.352 1.00 45.35 N ATOM 1094 CA LEU A 877 26.031 -13.827 19.033 1.00 44.73 C ATOM 1095 C LEU A 877 27.026 -14.866 18.544 1.00 46.96 C ATOM 1096 O LEU A 877 27.905 -15.269 19.310 1.00 46.32 O ATOM 1097 CB LEU A 877 26.686 -12.454 19.098 1.00 42.23 C ATOM 1098 CG LEU A 877 25.688 -11.326 19.328 1.00 41.50 C ATOM 1099 CD1 LEU A 877 26.383 -9.977 19.427 1.00 40.59 C ATOM 1100 CD2 LEU A 877 24.654 -11.335 18.214 1.00 41.00 C ATOM 1101 H LEU A 877 25.872 -13.621 21.165 1.00 0.00 H ATOM 1102 N ARG A 878 26.857 -15.287 17.290 1.00 49.27 N ATOM 1103 CA ARG A 878 27.725 -16.277 16.682 1.00 54.98 C ATOM 1104 C ARG A 878 28.300 -15.699 15.390 1.00 54.96 C ATOM 1105 O ARG A 878 27.739 -14.781 14.813 1.00 53.56 O ATOM 1106 CB ARG A 878 26.948 -17.571 16.440 1.00 58.59 C ATOM 1107 CG ARG A 878 26.908 -18.478 17.659 1.00 64.07 C ATOM 1108 CD ARG A 878 25.606 -19.223 17.807 1.00 69.06 C ATOM 1109 NE ARG A 878 25.022 -19.656 16.550 1.00 75.66 N ATOM 1110 CZ ARG A 878 23.734 -19.949 16.380 1.00 79.68 C ATOM 1111 NH1 ARG A 878 22.815 -19.439 17.188 1.00 77.59 N ATOM 1112 NH2 ARG A 878 23.379 -20.789 15.423 1.00 81.45 N ATOM 1113 HE ARG A 878 25.652 -19.743 15.727 1.00 0.00 H ATOM 1114 HH12 ARG A 878 21.811 -19.673 17.048 1.00 0.00 H ATOM 1115 HH11 ARG A 878 23.098 -18.805 17.962 1.00 0.00 H ATOM 1116 HH22 ARG A 878 22.376 -21.024 15.283 1.00 0.00 H ATOM 1117 HH21 ARG A 878 24.103 -21.215 14.810 1.00 0.00 H ATOM 1118 H ARG A 878 26.076 -14.892 16.729 1.00 0.00 H ATOM 1119 N ILE A 879 29.444 -16.248 14.985 1.00 53.70 N ATOM 1120 CA ILE A 879 30.037 -15.962 13.712 1.00 56.35 C ATOM 1121 C ILE A 879 29.172 -16.610 12.623 1.00 61.09 C ATOM 1122 O ILE A 879 28.748 -17.742 12.793 1.00 63.37 O ATOM 1123 CB ILE A 879 31.478 -16.504 13.707 1.00 55.66 C ATOM 1124 CG1 ILE A 879 32.337 -15.778 14.749 1.00 55.83 C ATOM 1125 CG2 ILE A 879 32.070 -16.425 12.317 1.00 55.94 C ATOM 1126 CD1 ILE A 879 33.674 -16.427 15.041 1.00 57.09 C ATOM 1127 H ILE A 879 29.928 -16.914 15.621 1.00 0.00 H ATOM 1128 N ALA A 880 28.974 -15.926 11.488 1.00 67.40 N ATOM 1129 CA ALA A 880 28.337 -16.550 10.286 1.00 66.99 C ATOM 1130 C ALA A 880 29.014 -17.871 9.953 1.00 76.90 C ATOM 1131 O ALA A 880 30.241 -17.952 9.935 1.00 80.80 O ATOM 1132 CB ALA A 880 28.428 -15.623 9.115 1.00 67.01 C ATOM 1133 H ALA A 880 29.272 -14.931 11.441 1.00 0.00 H ATOM 1134 N PRO A 881 28.245 -18.934 9.616 1.00 87.17 N ATOM 1135 CA PRO A 881 28.817 -20.272 9.461 1.00 92.38 C ATOM 1136 C PRO A 881 29.813 -20.308 8.308 1.00 93.22 C ATOM 1137 O PRO A 881 29.687 -19.527 7.367 1.00 89.10 O ATOM 1138 CB PRO A 881 27.616 -21.186 9.166 1.00 95.88 C ATOM 1139 CG PRO A 881 26.564 -20.235 8.619 1.00 97.27 C ATOM 1140 CD PRO A 881 26.807 -18.902 9.307 1.00 87.57 C ATOM 1141 N PRO A 882 30.777 -21.260 8.322 1.00 97.26 N ATOM 1142 CA PRO A 882 31.894 -21.262 7.375 1.00100.85 C ATOM 1143 C PRO A 882 31.483 -21.072 5.905 1.00101.91 C ATOM 1144 O PRO A 882 32.265 -20.528 5.125 1.00 99.83 O ATOM 1145 CB PRO A 882 32.547 -22.652 7.548 1.00102.82 C ATOM 1146 CG PRO A 882 31.545 -23.466 8.354 1.00102.22 C ATOM 1147 CD PRO A 882 30.802 -22.446 9.196 1.00 99.15 C ATOM 1148 N GLU A 883 30.263 -21.510 5.561 1.00101.50 N ATOM 1149 CA GLU A 883 29.825 -21.677 4.176 1.00102.49 C ATOM 1150 C GLU A 883 28.852 -20.558 3.754 1.00101.75 C ATOM 1151 O GLU A 883 28.461 -20.532 2.577 1.00107.85 O ATOM 1152 CB GLU A 883 29.225 -23.081 3.982 1.00102.97 C ATOM 1153 CG GLU A 883 27.758 -23.233 4.395 1.00101.70 C ATOM 1154 CD GLU A 883 27.440 -23.443 5.888 1.00 97.82 C ATOM 1155 OE1 GLU A 883 26.226 -23.444 6.258 1.00 91.02 O ATOM 1156 OE2 GLU A 883 28.393 -23.620 6.676 1.00 95.96 O ATOM 1157 H GLU A 883 29.592 -21.744 6.321 1.00 0.00 H ATOM 1158 N ALA A 884 28.451 -19.658 4.674 1.00 92.38 N ATOM 1159 CA ALA A 884 27.552 -18.536 4.323 1.00 89.64 C ATOM 1160 C ALA A 884 28.296 -17.567 3.399 1.00 90.27 C ATOM 1161 O ALA A 884 29.524 -17.551 3.401 1.00 87.70 O ATOM 1162 CB ALA A 884 27.052 -17.842 5.566 1.00 87.29 C ATOM 1163 H ALA A 884 28.782 -19.755 5.655 1.00 0.00 H ATOM 1164 N PRO A 885 27.610 -16.776 2.533 1.00 92.26 N ATOM 1165 CA PRO A 885 28.290 -15.794 1.685 1.00 88.60 C ATOM 1166 C PRO A 885 28.795 -14.543 2.424 1.00 84.32 C ATOM 1167 O PRO A 885 28.208 -14.093 3.412 1.00 82.60 O ATOM 1168 CB PRO A 885 27.239 -15.397 0.636 1.00 92.70 C ATOM 1169 CG PRO A 885 26.199 -16.493 0.722 1.00 95.13 C ATOM 1170 CD PRO A 885 26.183 -16.885 2.187 1.00 94.97 C ATOM 1171 N VAL A 886 29.864 -13.980 1.857 1.00 78.64 N ATOM 1172 CA VAL A 886 30.788 -13.059 2.494 1.00 74.19 C ATOM 1173 C VAL A 886 30.367 -11.605 2.226 1.00 68.86 C ATOM 1174 O VAL A 886 30.783 -10.698 2.926 1.00 60.72 O ATOM 1175 CB VAL A 886 32.220 -13.335 1.982 1.00 72.12 C ATOM 1176 CG1 VAL A 886 32.505 -12.653 0.646 1.00 71.88 C ATOM 1177 CG2 VAL A 886 33.272 -12.955 3.002 1.00 69.99 C ATOM 1178 H VAL A 886 30.053 -14.224 0.864 1.00 0.00 H ATOM 1179 N THR A 887 29.596 -11.396 1.159 1.00 72.13 N ATOM 1180 CA THR A 887 29.110 -10.085 0.783 1.00 71.87 C ATOM 1181 C THR A 887 28.376 -9.579 2.033 1.00 69.60 C ATOM 1182 O THR A 887 27.712 -10.349 2.752 1.00 72.12 O ATOM 1183 CB THR A 887 28.316 -10.181 -0.538 1.00 76.58 C ATOM 1184 OG1 THR A 887 28.621 -9.113 -1.440 1.00 75.86 O ATOM 1185 CG2 THR A 887 26.821 -10.211 -0.327 1.00 77.14 C ATOM 1186 HG1 THR A 887 28.089 -9.220 -2.268 1.00 0.00 H ATOM 1187 H THR A 887 29.332 -12.211 0.570 1.00 0.00 H ATOM 1188 N GLY A 888 28.589 -8.316 2.368 1.00 63.51 N ATOM 1189 CA GLY A 888 28.023 -7.787 3.577 1.00 62.80 C ATOM 1190 C GLY A 888 29.032 -7.671 4.698 1.00 58.78 C ATOM 1191 O GLY A 888 28.757 -6.972 5.657 1.00 55.81 O ATOM 1192 H GLY A 888 29.167 -7.706 1.755 1.00 0.00 H ATOM 1193 N TYR A 889 30.195 -8.322 4.551 1.00 55.42 N ATOM 1194 CA TYR A 889 31.179 -8.432 5.641 1.00 55.64 C ATOM 1195 C TYR A 889 32.545 -8.014 5.099 1.00 54.74 C ATOM 1196 O TYR A 889 33.110 -8.696 4.261 1.00 57.25 O ATOM 1197 CB TYR A 889 31.245 -9.865 6.189 1.00 54.82 C ATOM 1198 CG TYR A 889 29.987 -10.366 6.850 1.00 53.48 C ATOM 1199 CD1 TYR A 889 29.596 -9.857 8.067 1.00 51.63 C ATOM 1200 CD2 TYR A 889 29.177 -11.324 6.260 1.00 55.99 C ATOM 1201 CE1 TYR A 889 28.452 -10.298 8.702 1.00 54.49 C ATOM 1202 CE2 TYR A 889 28.024 -11.779 6.884 1.00 57.60 C ATOM 1203 CZ TYR A 889 27.676 -11.280 8.124 1.00 55.68 C ATOM 1204 OH TYR A 889 26.551 -11.672 8.787 1.00 61.63 O ATOM 1205 HH TYR A 889 26.495 -11.193 9.652 1.00 0.00 H ATOM 1206 H TYR A 889 30.410 -8.765 3.635 1.00 0.00 H ATOM 1207 N MET A 890 33.071 -6.897 5.596 1.00 52.76 N ATOM 1208 CA MET A 890 34.264 -6.325 5.025 1.00 53.74 C ATOM 1209 C MET A 890 35.527 -7.059 5.465 1.00 50.21 C ATOM 1210 O MET A 890 36.563 -6.927 4.844 1.00 49.62 O ATOM 1211 CB MET A 890 34.409 -4.879 5.475 1.00 58.41 C ATOM 1212 CG MET A 890 33.498 -3.963 4.712 1.00 62.47 C ATOM 1213 SD MET A 890 34.117 -2.275 4.632 1.00 68.88 S ATOM 1214 CE MET A 890 35.694 -2.348 5.476 1.00 63.28 C ATOM 1215 H MET A 890 32.615 -6.431 6.407 1.00 0.00 H ATOM 1216 N PHE A 891 35.461 -7.768 6.586 1.00 50.51 N ATOM 1217 CA PHE A 891 36.675 -8.298 7.167 1.00 52.62 C ATOM 1218 C PHE A 891 36.507 -9.759 7.542 1.00 51.29 C ATOM 1219 O PHE A 891 37.083 -10.223 8.521 1.00 50.31 O ATOM 1220 CB PHE A 891 37.056 -7.491 8.404 1.00 51.01 C ATOM 1221 CG PHE A 891 37.263 -6.035 8.110 1.00 50.03 C ATOM 1222 CD1 PHE A 891 38.349 -5.627 7.350 1.00 50.07 C ATOM 1223 CD2 PHE A 891 36.367 -5.088 8.576 1.00 49.92 C ATOM 1224 CE1 PHE A 891 38.553 -4.283 7.100 1.00 51.43 C ATOM 1225 CE2 PHE A 891 36.587 -3.744 8.325 1.00 50.21 C ATOM 1226 CZ PHE A 891 37.681 -3.348 7.596 1.00 49.92 C ATOM 1227 H PHE A 891 34.543 -7.941 7.043 1.00 0.00 H ATOM 1228 N GLY A 892 35.737 -10.473 6.736 1.00 54.55 N ATOM 1229 CA GLY A 892 35.587 -11.892 6.952 1.00 56.67 C ATOM 1230 C GLY A 892 34.493 -12.162 7.959 1.00 55.26 C ATOM 1231 O GLY A 892 33.859 -11.254 8.484 1.00 53.72 O ATOM 1232 H GLY A 892 35.240 -10.012 5.947 1.00 0.00 H ATOM 1233 N LYS A 893 34.274 -13.445 8.197 1.00 59.25 N ATOM 1234 CA LYS A 893 33.278 -13.905 9.100 1.00 61.45 C ATOM 1235 C LYS A 893 33.796 -13.701 10.524 1.00 55.79 C ATOM 1236 O LYS A 893 34.756 -14.339 10.937 1.00 57.02 O ATOM 1237 CB LYS A 893 32.941 -15.364 8.782 1.00 67.97 C ATOM 1238 CG LYS A 893 32.117 -15.558 7.517 1.00 72.55 C ATOM 1239 CD LYS A 893 32.122 -16.999 7.063 1.00 81.66 C ATOM 1240 CE LYS A 893 31.258 -17.281 5.849 1.00 86.74 C ATOM 1241 NZ LYS A 893 31.325 -16.198 4.839 1.00 87.35 N ATOM 1242 HZ1 LYS A 893 30.998 -15.308 5.265 1.00 0.00 H ATOM 1243 HZ2 LYS A 893 32.307 -16.088 4.515 1.00 0.00 H ATOM 1244 HZ3 LYS A 893 30.717 -16.441 4.031 1.00 0.00 H ATOM 1245 H LYS A 893 34.857 -14.149 7.701 1.00 0.00 H ATOM 1246 N GLY A 894 33.129 -12.795 11.245 1.00 50.30 N ATOM 1247 CA GLY A 894 33.336 -12.557 12.663 1.00 47.10 C ATOM 1248 C GLY A 894 32.057 -12.028 13.279 1.00 44.33 C ATOM 1249 O GLY A 894 30.984 -12.103 12.701 1.00 43.94 O ATOM 1250 H GLY A 894 32.412 -12.221 10.757 1.00 0.00 H ATOM 1251 N ILE A 895 32.149 -11.469 14.474 1.00 44.31 N ATOM 1252 CA ILE A 895 30.990 -10.815 15.031 1.00 44.55 C ATOM 1253 C ILE A 895 31.229 -9.315 14.906 1.00 41.98 C ATOM 1254 O ILE A 895 32.236 -8.821 15.376 1.00 42.25 O ATOM 1255 CB ILE A 895 30.698 -11.263 16.474 1.00 44.69 C ATOM 1256 CG1 ILE A 895 30.781 -12.786 16.624 1.00 47.57 C ATOM 1257 CG2 ILE A 895 29.344 -10.716 16.903 1.00 43.35 C ATOM 1258 CD1 ILE A 895 30.699 -13.293 18.045 1.00 48.96 C ATOM 1259 H ILE A 895 33.043 -11.500 15.004 1.00 0.00 H ATOM 1260 N TYR A 896 30.282 -8.629 14.264 1.00 42.32 N ATOM 1261 CA TYR A 896 30.389 -7.218 13.906 1.00 42.70 C ATOM 1262 C TYR A 896 29.624 -6.306 14.880 1.00 41.61 C ATOM 1263 O TYR A 896 28.485 -6.534 15.183 1.00 42.77 O ATOM 1264 CB TYR A 896 29.873 -7.043 12.480 1.00 42.68 C ATOM 1265 CG TYR A 896 30.870 -7.485 11.438 1.00 44.29 C ATOM 1266 CD1 TYR A 896 31.226 -8.822 11.296 1.00 44.44 C ATOM 1267 CD2 TYR A 896 31.458 -6.570 10.589 1.00 42.71 C ATOM 1268 CE1 TYR A 896 32.136 -9.230 10.329 1.00 46.08 C ATOM 1269 CE2 TYR A 896 32.371 -6.961 9.627 1.00 42.76 C ATOM 1270 CZ TYR A 896 32.721 -8.294 9.495 1.00 45.39 C ATOM 1271 OH TYR A 896 33.622 -8.664 8.528 1.00 48.25 O ATOM 1272 HH TYR A 896 33.762 -9.643 8.566 1.00 0.00 H ATOM 1273 H TYR A 896 29.411 -9.132 14.001 1.00 0.00 H ATOM 1274 N PHE A 897 30.266 -5.213 15.277 1.00 40.86 N ATOM 1275 CA PHE A 897 29.682 -4.193 16.141 1.00 41.64 C ATOM 1276 C PHE A 897 29.958 -2.780 15.617 1.00 41.68 C ATOM 1277 O PHE A 897 30.899 -2.553 14.891 1.00 42.75 O ATOM 1278 CB PHE A 897 30.295 -4.297 17.531 1.00 40.08 C ATOM 1279 CG PHE A 897 30.074 -5.617 18.214 1.00 38.63 C ATOM 1280 CD1 PHE A 897 30.936 -6.682 17.994 1.00 39.70 C ATOM 1281 CD2 PHE A 897 29.008 -5.799 19.081 1.00 40.57 C ATOM 1282 CE1 PHE A 897 30.750 -7.887 18.644 1.00 37.93 C ATOM 1283 CE2 PHE A 897 28.817 -7.016 19.724 1.00 39.58 C ATOM 1284 CZ PHE A 897 29.689 -8.052 19.504 1.00 39.53 C ATOM 1285 H PHE A 897 31.244 -5.076 14.952 1.00 0.00 H ATOM 1286 N ALA A 898 29.094 -1.830 15.973 1.00 43.70 N ATOM 1287 CA ALA A 898 29.307 -0.438 15.645 1.00 41.58 C ATOM 1288 C ALA A 898 29.429 0.368 16.938 1.00 41.60 C ATOM 1289 O ALA A 898 28.939 -0.063 17.989 1.00 41.31 O ATOM 1290 CB ALA A 898 28.166 0.056 14.789 1.00 43.46 C ATOM 1291 H ALA A 898 28.240 -2.098 16.503 1.00 0.00 H ATOM 1292 N ASP A 899 30.022 1.560 16.829 1.00 39.74 N ATOM 1293 CA ASP A 899 29.972 2.561 17.899 1.00 40.52 C ATOM 1294 C ASP A 899 28.957 3.653 17.553 1.00 43.99 C ATOM 1295 O ASP A 899 28.786 4.555 18.314 1.00 46.26 O ATOM 1296 CB ASP A 899 31.350 3.148 18.213 1.00 39.90 C ATOM 1297 CG ASP A 899 32.121 3.738 17.044 1.00 40.62 C ATOM 1298 OD1 ASP A 899 31.493 4.079 16.028 1.00 40.11 O ATOM 1299 OD2 ASP A 899 33.374 3.821 17.166 1.00 41.57 O ATOM 1300 H ASP A 899 30.537 1.786 15.954 1.00 0.00 H ATOM 1301 N MET A 900 28.318 3.568 16.379 1.00 44.06 N ATOM 1302 CA MET A 900 27.272 4.476 15.996 1.00 46.08 C ATOM 1303 C MET A 900 25.952 3.707 16.016 1.00 46.01 C ATOM 1304 O MET A 900 25.750 2.770 15.254 1.00 48.78 O ATOM 1305 CB MET A 900 27.486 5.049 14.592 1.00 47.29 C ATOM 1306 CG MET A 900 28.760 5.836 14.399 1.00 48.77 C ATOM 1307 SD MET A 900 28.804 7.413 15.255 1.00 53.00 S ATOM 1308 CE MET A 900 27.701 8.409 14.247 1.00 55.36 C ATOM 1309 H MET A 900 28.590 2.813 15.717 1.00 0.00 H ATOM 1310 N VAL A 901 25.044 4.090 16.907 1.00 47.52 N ATOM 1311 CA VAL A 901 23.815 3.311 17.101 1.00 46.66 C ATOM 1312 C VAL A 901 23.133 3.069 15.746 1.00 45.79 C ATOM 1313 O VAL A 901 22.564 2.025 15.561 1.00 46.61 O ATOM 1314 CB VAL A 901 22.837 3.979 18.094 1.00 46.87 C ATOM 1315 CG1 VAL A 901 22.297 5.310 17.573 1.00 48.80 C ATOM 1316 CG2 VAL A 901 21.677 3.059 18.460 1.00 44.70 C ATOM 1317 H VAL A 901 25.205 4.948 17.471 1.00 0.00 H ATOM 1318 N SER A 902 23.116 4.067 14.850 1.00 47.15 N ATOM 1319 CA SER A 902 22.309 3.984 13.618 1.00 49.42 C ATOM 1320 C SER A 902 22.882 2.931 12.655 1.00 47.66 C ATOM 1321 O SER A 902 22.146 2.268 11.891 1.00 49.52 O ATOM 1322 CB SER A 902 22.206 5.329 12.939 1.00 51.71 C ATOM 1323 OG SER A 902 23.507 5.844 12.680 1.00 52.65 O ATOM 1324 HG SER A 902 23.997 5.218 12.091 1.00 0.00 H ATOM 1325 H SER A 902 23.685 4.919 15.028 1.00 0.00 H ATOM 1326 N LYS A 903 24.209 2.817 12.642 1.00 46.65 N ATOM 1327 CA LYS A 903 24.871 1.847 11.779 1.00 47.27 C ATOM 1328 C LYS A 903 24.353 0.440 12.128 1.00 45.45 C ATOM 1329 O LYS A 903 24.026 -0.349 11.249 1.00 44.61 O ATOM 1330 CB LYS A 903 26.391 1.975 11.921 1.00 46.59 C ATOM 1331 CG LYS A 903 27.163 0.980 11.079 1.00 46.39 C ATOM 1332 CD LYS A 903 28.575 1.381 10.840 1.00 46.17 C ATOM 1333 CE LYS A 903 29.342 0.295 10.122 1.00 44.10 C ATOM 1334 NZ LYS A 903 30.724 0.728 9.854 1.00 43.92 N ATOM 1335 HZ1 LYS A 903 30.710 1.581 9.259 1.00 0.00 H ATOM 1336 HZ2 LYS A 903 31.200 0.939 10.754 1.00 0.00 H ATOM 1337 HZ3 LYS A 903 31.234 -0.032 9.360 1.00 0.00 H ATOM 1338 H LYS A 903 24.782 3.430 13.257 1.00 0.00 H ATOM 1339 N SER A 904 24.250 0.161 13.428 1.00 42.32 N ATOM 1340 CA SER A 904 23.739 -1.116 13.878 1.00 45.44 C ATOM 1341 C SER A 904 22.218 -1.199 13.722 1.00 46.33 C ATOM 1342 O SER A 904 21.701 -2.265 13.470 1.00 46.35 O ATOM 1343 CB SER A 904 24.151 -1.386 15.290 1.00 42.29 C ATOM 1344 OG SER A 904 25.455 -1.933 15.317 1.00 42.53 O ATOM 1345 HG SER A 904 25.467 -2.781 14.806 1.00 0.00 H ATOM 1346 H SER A 904 24.541 0.872 14.129 1.00 0.00 H ATOM 1347 N ALA A 905 21.516 -0.084 13.949 1.00 48.69 N ATOM 1348 CA ALA A 905 20.055 -0.056 13.951 1.00 49.16 C ATOM 1349 C ALA A 905 19.516 -0.337 12.537 1.00 49.89 C ATOM 1350 O ALA A 905 18.452 -0.897 12.385 1.00 48.78 O ATOM 1351 CB ALA A 905 19.585 1.276 14.479 1.00 49.41 C ATOM 1352 H ALA A 905 22.031 0.801 14.132 1.00 0.00 H ATOM 1353 N ASN A 906 20.280 0.062 11.510 1.00 51.27 N ATOM 1354 CA ASN A 906 19.991 -0.256 10.117 1.00 52.79 C ATOM 1355 C ASN A 906 19.797 -1.772 9.966 1.00 53.01 C ATOM 1356 O ASN A 906 18.954 -2.195 9.219 1.00 54.70 O ATOM 1357 CB ASN A 906 21.082 0.261 9.165 1.00 53.07 C ATOM 1358 CG ASN A 906 21.090 1.778 9.021 1.00 54.10 C ATOM 1359 OD1 ASN A 906 20.085 2.434 9.297 1.00 54.38 O ATOM 1360 ND2 ASN A 906 22.201 2.341 8.560 1.00 49.92 N ATOM 1361 HD22 ASN A 906 23.029 1.752 8.338 1.00 0.00 H ATOM 1362 HD21 ASN A 906 22.243 3.371 8.421 1.00 0.00 H ATOM 1363 H ASN A 906 21.126 0.630 11.719 1.00 0.00 H ATOM 1364 N TYR A 907 20.564 -2.589 10.700 1.00 51.03 N ATOM 1365 CA TYR A 907 20.488 -4.046 10.500 1.00 52.91 C ATOM 1366 C TYR A 907 19.259 -4.665 11.191 1.00 55.23 C ATOM 1367 O TYR A 907 19.081 -5.891 11.123 1.00 54.69 O ATOM 1368 CB TYR A 907 21.800 -4.704 10.923 1.00 49.14 C ATOM 1369 CG TYR A 907 22.930 -4.416 9.974 1.00 49.64 C ATOM 1370 CD1 TYR A 907 23.053 -5.097 8.773 1.00 51.92 C ATOM 1371 CD2 TYR A 907 23.844 -3.414 10.248 1.00 47.58 C ATOM 1372 CE1 TYR A 907 24.078 -4.810 7.882 1.00 52.53 C ATOM 1373 CE2 TYR A 907 24.891 -3.142 9.394 1.00 48.51 C ATOM 1374 CZ TYR A 907 25.009 -3.835 8.200 1.00 52.45 C ATOM 1375 OH TYR A 907 26.043 -3.540 7.354 1.00 52.47 O ATOM 1376 HH TYR A 907 25.987 -4.118 6.552 1.00 0.00 H ATOM 1377 H TYR A 907 21.213 -2.195 11.411 1.00 0.00 H ATOM 1378 N CYS A 908 18.411 -3.831 11.823 1.00 54.84 N ATOM 1379 CA CYS A 908 17.128 -4.297 12.390 1.00 54.12 C ATOM 1380 C CYS A 908 16.103 -4.546 11.273 1.00 57.83 C ATOM 1381 O CYS A 908 15.171 -5.335 11.456 1.00 58.90 O ATOM 1382 CB CYS A 908 16.563 -3.294 13.389 1.00 52.81 C ATOM 1383 SG CYS A 908 17.604 -3.090 14.858 1.00 50.91 S ATOM 1384 H CYS A 908 18.667 -2.827 11.915 1.00 0.00 H ATOM 1385 N HIS A 909 16.298 -3.880 10.128 1.00 58.88 N ATOM 1386 CA HIS A 909 15.451 -3.991 8.949 1.00 64.02 C ATOM 1387 C HIS A 909 14.009 -3.714 9.365 1.00 66.60 C ATOM 1388 O HIS A 909 13.079 -4.390 8.954 1.00 68.07 O ATOM 1389 CB HIS A 909 15.688 -5.322 8.218 1.00 68.69 C ATOM 1390 CG HIS A 909 17.019 -5.389 7.528 1.00 71.92 C ATOM 1391 ND1 HIS A 909 17.221 -4.911 6.233 1.00 77.57 N ATOM 1392 CD2 HIS A 909 18.220 -5.853 7.943 1.00 71.32 C ATOM 1393 CE1 HIS A 909 18.490 -5.072 5.897 1.00 76.13 C ATOM 1394 NE2 HIS A 909 19.123 -5.649 6.931 1.00 68.50 N ATOM 1395 H HIS A 909 17.114 -3.237 10.077 1.00 0.00 H ATOM 1396 N THR A 910 13.884 -2.680 10.202 1.00 67.44 N ATOM 1397 CA THR A 910 12.645 -2.072 10.669 1.00 68.12 C ATOM 1398 C THR A 910 12.033 -1.246 9.519 1.00 69.40 C ATOM 1399 O THR A 910 12.745 -0.807 8.650 1.00 68.11 O ATOM 1400 CB THR A 910 12.995 -1.283 11.940 1.00 66.53 C ATOM 1401 OG1 THR A 910 12.944 -2.170 13.062 1.00 66.51 O ATOM 1402 CG2 THR A 910 12.065 -0.129 12.200 1.00 73.54 C ATOM 1403 HG1 THR A 910 13.168 -1.670 13.887 1.00 0.00 H ATOM 1404 H THR A 910 14.768 -2.264 10.559 1.00 0.00 H ATOM 1405 N SER A 911 10.714 -1.027 9.527 1.00 72.51 N ATOM 1406 CA SER A 911 10.037 -0.215 8.485 1.00 77.44 C ATOM 1407 C SER A 911 8.885 0.600 9.085 1.00 80.21 C ATOM 1408 O SER A 911 8.482 0.352 10.221 1.00 76.34 O ATOM 1409 CB SER A 911 9.518 -1.090 7.379 1.00 76.89 C ATOM 1410 OG SER A 911 8.586 -2.020 7.905 1.00 76.20 O ATOM 1411 HG SER A 911 8.246 -2.595 7.174 1.00 0.00 H ATOM 1412 H SER A 911 10.142 -1.440 10.291 1.00 0.00 H ATOM 1413 N GLN A 912 8.360 1.547 8.288 1.00 84.61 N ATOM 1414 CA GLN A 912 7.137 2.338 8.618 1.00 87.24 C ATOM 1415 C GLN A 912 6.084 1.405 9.223 1.00 85.32 C ATOM 1416 O GLN A 912 5.523 1.681 10.303 1.00 81.78 O ATOM 1417 CB GLN A 912 6.505 2.997 7.384 1.00 93.42 C ATOM 1418 CG GLN A 912 7.358 4.073 6.711 1.00 97.50 C ATOM 1419 CD GLN A 912 8.278 3.547 5.625 1.00 98.80 C ATOM 1420 OE1 GLN A 912 9.342 2.966 5.886 1.00 91.96 O ATOM 1421 NE2 GLN A 912 7.868 3.761 4.381 1.00103.59 N ATOM 1422 HE22 GLN A 912 6.968 4.253 4.207 1.00 0.00 H ATOM 1423 HE21 GLN A 912 8.447 3.437 3.580 1.00 0.00 H ATOM 1424 H GLN A 912 8.836 1.741 7.384 1.00 0.00 H ATOM 1425 N GLY A 913 5.859 0.296 8.499 1.00 85.83 N ATOM 1426 CA GLY A 913 4.833 -0.684 8.808 1.00 86.60 C ATOM 1427 C GLY A 913 5.171 -1.497 10.041 1.00 84.41 C ATOM 1428 O GLY A 913 4.285 -1.967 10.728 1.00 86.71 O ATOM 1429 H GLY A 913 6.457 0.129 7.665 1.00 0.00 H ATOM 1430 N ASP A 914 6.465 -1.664 10.310 1.00 82.96 N ATOM 1431 CA ASP A 914 6.936 -2.404 11.475 1.00 82.16 C ATOM 1432 C ASP A 914 8.027 -1.579 12.162 1.00 76.13 C ATOM 1433 O ASP A 914 9.204 -1.804 11.921 1.00 74.36 O ATOM 1434 CB ASP A 914 7.397 -3.794 11.027 1.00 84.18 C ATOM 1435 CG ASP A 914 7.997 -4.656 12.125 1.00 84.49 C ATOM 1436 OD1 ASP A 914 7.594 -4.503 13.305 1.00 86.12 O ATOM 1437 OD2 ASP A 914 8.880 -5.464 11.790 1.00 87.25 O ATOM 1438 H ASP A 914 7.167 -1.250 9.664 1.00 0.00 H ATOM 1439 N PRO A 915 7.682 -0.573 13.005 1.00 73.73 N ATOM 1440 CA PRO A 915 8.634 0.469 13.396 1.00 69.96 C ATOM 1441 C PRO A 915 9.427 0.199 14.683 1.00 65.81 C ATOM 1442 O PRO A 915 10.200 1.048 15.099 1.00 64.67 O ATOM 1443 CB PRO A 915 7.705 1.683 13.578 1.00 72.20 C ATOM 1444 CG PRO A 915 6.395 1.086 14.101 1.00 72.94 C ATOM 1445 CD PRO A 915 6.347 -0.344 13.590 1.00 74.01 C ATOM 1446 N ILE A 916 9.233 -0.988 15.271 1.00 64.54 N ATOM 1447 CA ILE A 916 9.830 -1.394 16.532 1.00 59.54 C ATOM 1448 C ILE A 916 10.909 -2.434 16.208 1.00 57.07 C ATOM 1449 O ILE A 916 10.656 -3.396 15.489 1.00 58.32 O ATOM 1450 CB ILE A 916 8.763 -1.952 17.509 1.00 60.94 C ATOM 1451 CG1 ILE A 916 7.480 -1.112 17.578 1.00 64.14 C ATOM 1452 CG2 ILE A 916 9.335 -2.153 18.901 1.00 60.32 C ATOM 1453 CD1 ILE A 916 7.671 0.283 18.129 1.00 63.91 C ATOM 1454 H ILE A 916 8.610 -1.668 14.791 1.00 0.00 H ATOM 1455 N GLY A 917 12.105 -2.238 16.763 1.00 52.64 N ATOM 1456 CA GLY A 917 13.191 -3.172 16.604 1.00 52.89 C ATOM 1457 C GLY A 917 13.957 -3.365 17.894 1.00 51.59 C ATOM 1458 O GLY A 917 13.683 -2.715 18.914 1.00 51.42 O ATOM 1459 H GLY A 917 12.260 -1.381 17.331 1.00 0.00 H ATOM 1460 N LEU A 918 14.925 -4.277 17.835 1.00 51.29 N ATOM 1461 CA LEU A 918 15.744 -4.634 18.963 1.00 49.42 C ATOM 1462 C LEU A 918 17.221 -4.510 18.579 1.00 50.64 C ATOM 1463 O LEU A 918 17.640 -4.923 17.486 1.00 50.39 O ATOM 1464 CB LEU A 918 15.421 -6.079 19.339 1.00 51.01 C ATOM 1465 CG LEU A 918 13.996 -6.366 19.790 1.00 54.89 C ATOM 1466 CD1 LEU A 918 13.765 -7.870 19.829 1.00 56.61 C ATOM 1467 CD2 LEU A 918 13.708 -5.733 21.153 1.00 53.62 C ATOM 1468 H LEU A 918 15.098 -4.756 16.928 1.00 0.00 H ATOM 1469 N ILE A 919 18.019 -4.033 19.532 1.00 51.17 N ATOM 1470 CA ILE A 919 19.429 -3.829 19.367 1.00 47.57 C ATOM 1471 C ILE A 919 20.128 -4.209 20.669 1.00 44.99 C ATOM 1472 O ILE A 919 19.553 -4.055 21.715 1.00 45.12 O ATOM 1473 CB ILE A 919 19.692 -2.372 18.999 1.00 49.72 C ATOM 1474 CG1 ILE A 919 21.118 -2.175 18.498 1.00 49.51 C ATOM 1475 CG2 ILE A 919 19.368 -1.464 20.182 1.00 51.16 C ATOM 1476 CD1 ILE A 919 21.262 -0.925 17.680 1.00 53.93 C ATOM 1477 H ILE A 919 17.595 -3.794 20.451 1.00 0.00 H ATOM 1478 N LEU A 920 21.349 -4.735 20.556 1.00 43.10 N ATOM 1479 CA LEU A 920 22.113 -5.156 21.688 1.00 42.54 C ATOM 1480 C LEU A 920 23.198 -4.118 21.972 1.00 43.81 C ATOM 1481 O LEU A 920 23.654 -3.387 21.075 1.00 42.53 O ATOM 1482 CB LEU A 920 22.767 -6.506 21.380 1.00 42.78 C ATOM 1483 CG LEU A 920 21.803 -7.680 21.312 1.00 45.54 C ATOM 1484 CD1 LEU A 920 22.377 -8.770 20.423 1.00 46.46 C ATOM 1485 CD2 LEU A 920 21.460 -8.203 22.700 1.00 44.57 C ATOM 1486 H LEU A 920 21.761 -4.843 19.607 1.00 0.00 H ATOM 1487 N LEU A 921 23.606 -4.088 23.238 1.00 42.03 N ATOM 1488 CA LEU A 921 24.840 -3.526 23.634 1.00 42.72 C ATOM 1489 C LEU A 921 25.626 -4.663 24.274 1.00 42.42 C ATOM 1490 O LEU A 921 25.173 -5.282 25.226 1.00 46.58 O ATOM 1491 CB LEU A 921 24.619 -2.383 24.623 1.00 41.55 C ATOM 1492 CG LEU A 921 24.209 -1.042 24.033 1.00 43.23 C ATOM 1493 CD1 LEU A 921 23.681 -0.130 25.119 1.00 45.26 C ATOM 1494 CD2 LEU A 921 25.333 -0.370 23.279 1.00 41.26 C ATOM 1495 H LEU A 921 22.989 -4.497 23.969 1.00 0.00 H ATOM 1496 N GLY A 922 26.769 -4.971 23.680 1.00 43.14 N ATOM 1497 CA GLY A 922 27.666 -5.960 24.220 1.00 44.08 C ATOM 1498 C GLY A 922 28.942 -5.312 24.713 1.00 42.99 C ATOM 1499 O GLY A 922 29.413 -4.315 24.152 1.00 43.91 O ATOM 1500 H GLY A 922 27.026 -4.484 22.798 1.00 0.00 H ATOM 1501 N GLU A 923 29.484 -5.879 25.789 1.00 42.21 N ATOM 1502 CA GLU A 923 30.841 -5.669 26.149 1.00 41.31 C ATOM 1503 C GLU A 923 31.736 -6.529 25.241 1.00 42.63 C ATOM 1504 O GLU A 923 31.573 -7.760 25.151 1.00 44.77 O ATOM 1505 CB GLU A 923 31.057 -6.016 27.609 1.00 41.95 C ATOM 1506 CG GLU A 923 32.477 -5.759 28.006 1.00 43.08 C ATOM 1507 CD GLU A 923 32.762 -6.123 29.435 1.00 44.16 C ATOM 1508 OE1 GLU A 923 31.789 -6.233 30.194 1.00 45.09 O ATOM 1509 OE2 GLU A 923 33.964 -6.271 29.759 1.00 45.55 O ATOM 1510 H GLU A 923 28.895 -6.495 26.384 1.00 0.00 H ATOM 1511 N VAL A 924 32.647 -5.868 24.523 1.00 41.02 N ATOM 1512 CA VAL A 924 33.470 -6.547 23.556 1.00 42.26 C ATOM 1513 C VAL A 924 34.926 -6.358 23.927 1.00 41.78 C ATOM 1514 O VAL A 924 35.396 -5.223 24.028 1.00 42.21 O ATOM 1515 CB VAL A 924 33.241 -6.034 22.134 1.00 40.46 C ATOM 1516 CG1 VAL A 924 34.073 -6.849 21.155 1.00 39.83 C ATOM 1517 CG2 VAL A 924 31.763 -6.049 21.780 1.00 39.91 C ATOM 1518 H VAL A 924 32.764 -4.844 24.665 1.00 0.00 H ATOM 1519 N ALA A 925 35.607 -7.486 24.107 1.00 42.25 N ATOM 1520 CA ALA A 925 37.014 -7.509 24.492 1.00 43.76 C ATOM 1521 C ALA A 925 37.857 -7.352 23.228 1.00 41.21 C ATOM 1522 O ALA A 925 38.096 -8.304 22.544 1.00 43.18 O ATOM 1523 CB ALA A 925 37.308 -8.786 25.229 1.00 45.51 C ATOM 1524 H ALA A 925 35.115 -8.392 23.967 1.00 0.00 H ATOM 1525 N LEU A 926 38.243 -6.116 22.912 1.00 42.08 N ATOM 1526 CA LEU A 926 38.883 -5.841 21.646 1.00 43.42 C ATOM 1527 C LEU A 926 40.388 -6.049 21.736 1.00 44.86 C ATOM 1528 O LEU A 926 40.989 -6.338 20.709 1.00 49.33 O ATOM 1529 CB LEU A 926 38.572 -4.421 21.173 1.00 40.86 C ATOM 1530 CG LEU A 926 37.107 -4.187 20.850 1.00 39.86 C ATOM 1531 CD1 LEU A 926 36.826 -2.720 20.818 1.00 40.05 C ATOM 1532 CD2 LEU A 926 36.705 -4.834 19.532 1.00 41.62 C ATOM 1533 H LEU A 926 38.082 -5.340 23.585 1.00 0.00 H ATOM 1534 N GLY A 927 40.973 -5.897 22.936 1.00 45.37 N ATOM 1535 CA GLY A 927 42.396 -5.973 23.105 1.00 44.63 C ATOM 1536 C GLY A 927 43.143 -5.120 22.083 1.00 45.57 C ATOM 1537 O GLY A 927 42.855 -3.945 21.879 1.00 46.25 O ATOM 1538 H GLY A 927 40.376 -5.719 23.769 1.00 0.00 H ATOM 1539 N ASN A 928 44.155 -5.715 21.470 1.00 46.96 N ATOM 1540 CA ASN A 928 44.967 -5.082 20.481 1.00 45.92 C ATOM 1541 C ASN A 928 44.230 -5.239 19.153 1.00 46.14 C ATOM 1542 O ASN A 928 44.035 -6.383 18.689 1.00 45.15 O ATOM 1543 CB ASN A 928 46.336 -5.751 20.409 1.00 50.59 C ATOM 1544 CG ASN A 928 47.224 -5.511 21.611 1.00 52.94 C ATOM 1545 OD1 ASN A 928 47.119 -4.497 22.285 1.00 55.44 O ATOM 1546 ND2 ASN A 928 48.154 -6.411 21.845 1.00 56.13 N ATOM 1547 HD22 ASN A 928 48.214 -7.263 21.251 1.00 0.00 H ATOM 1548 HD21 ASN A 928 48.829 -6.271 22.624 1.00 0.00 H ATOM 1549 H ASN A 928 44.371 -6.700 21.724 1.00 0.00 H ATOM 1550 N MET A 929 43.812 -4.108 18.587 1.00 42.06 N ATOM 1551 CA MET A 929 43.009 -4.011 17.421 1.00 41.04 C ATOM 1552 C MET A 929 43.901 -3.941 16.187 1.00 41.91 C ATOM 1553 O MET A 929 44.887 -3.250 16.169 1.00 42.05 O ATOM 1554 CB MET A 929 42.149 -2.754 17.475 1.00 42.39 C ATOM 1555 CG MET A 929 41.131 -2.816 18.588 1.00 44.09 C ATOM 1556 SD MET A 929 40.067 -1.376 18.680 1.00 46.31 S ATOM 1557 CE MET A 929 41.269 -0.065 18.866 1.00 47.49 C ATOM 1558 H MET A 929 44.100 -3.217 19.040 1.00 0.00 H ATOM 1559 N TYR A 930 43.532 -4.725 15.175 1.00 44.71 N ATOM 1560 CA TYR A 930 44.094 -4.657 13.842 1.00 43.65 C ATOM 1561 C TYR A 930 43.245 -3.673 13.046 1.00 43.01 C ATOM 1562 O TYR A 930 42.132 -3.982 12.697 1.00 40.58 O ATOM 1563 CB TYR A 930 44.091 -6.059 13.229 1.00 44.25 C ATOM 1564 CG TYR A 930 44.876 -6.234 11.961 1.00 45.07 C ATOM 1565 CD1 TYR A 930 46.030 -5.519 11.719 1.00 46.73 C ATOM 1566 CD2 TYR A 930 44.494 -7.183 11.028 1.00 47.52 C ATOM 1567 CE1 TYR A 930 46.751 -5.690 10.553 1.00 46.81 C ATOM 1568 CE2 TYR A 930 45.231 -7.412 9.879 1.00 47.86 C ATOM 1569 CZ TYR A 930 46.360 -6.657 9.647 1.00 48.78 C ATOM 1570 OH TYR A 930 47.084 -6.870 8.525 1.00 53.46 O ATOM 1571 HH TYR A 930 47.856 -6.251 8.510 1.00 0.00 H ATOM 1572 H TYR A 930 42.791 -5.433 15.354 1.00 0.00 H ATOM 1573 N GLU A 931 43.814 -2.492 12.789 1.00 44.15 N ATOM 1574 CA GLU A 931 43.108 -1.351 12.333 1.00 44.03 C ATOM 1575 C GLU A 931 43.286 -1.209 10.819 1.00 43.98 C ATOM 1576 O GLU A 931 44.385 -0.967 10.329 1.00 44.46 O ATOM 1577 CB GLU A 931 43.611 -0.117 13.093 1.00 43.05 C ATOM 1578 CG GLU A 931 43.198 -0.135 14.566 1.00 43.65 C ATOM 1579 CD GLU A 931 43.477 1.128 15.379 1.00 46.42 C ATOM 1580 OE1 GLU A 931 43.785 2.180 14.794 1.00 46.97 O ATOM 1581 OE2 GLU A 931 43.421 1.049 16.612 1.00 54.98 O ATOM 1582 H GLU A 931 44.840 -2.404 12.933 1.00 0.00 H ATOM 1583 N LEU A 932 42.168 -1.315 10.102 1.00 43.63 N ATOM 1584 CA LEU A 932 42.182 -1.406 8.641 1.00 45.98 C ATOM 1585 C LEU A 932 41.199 -0.388 8.076 1.00 45.09 C ATOM 1586 O LEU A 932 40.206 -0.058 8.698 1.00 43.98 O ATOM 1587 CB LEU A 932 41.795 -2.825 8.218 1.00 46.87 C ATOM 1588 CG LEU A 932 42.715 -3.932 8.725 1.00 49.37 C ATOM 1589 CD1 LEU A 932 42.220 -5.295 8.264 1.00 51.26 C ATOM 1590 CD2 LEU A 932 44.144 -3.691 8.273 1.00 49.66 C ATOM 1591 H LEU A 932 41.254 -1.334 10.597 1.00 0.00 H ATOM 1592 N LYS A 933 41.514 0.101 6.887 1.00 48.89 N ATOM 1593 CA LYS A 933 40.721 1.096 6.223 1.00 51.72 C ATOM 1594 C LYS A 933 39.954 0.461 5.071 1.00 52.78 C ATOM 1595 O LYS A 933 38.940 1.016 4.646 1.00 55.38 O ATOM 1596 CB LYS A 933 41.618 2.203 5.679 1.00 56.70 C ATOM 1597 CG LYS A 933 42.500 2.873 6.712 1.00 60.18 C ATOM 1598 CD LYS A 933 43.342 3.977 6.120 1.00 64.44 C ATOM 1599 CE LYS A 933 44.721 4.019 6.742 1.00 63.77 C ATOM 1600 NZ LYS A 933 45.378 5.318 6.483 1.00 63.44 N ATOM 1601 HZ1 LYS A 933 45.469 5.460 5.457 1.00 0.00 H ATOM 1602 HZ2 LYS A 933 44.804 6.083 6.891 1.00 0.00 H ATOM 1603 HZ3 LYS A 933 46.322 5.321 6.920 1.00 0.00 H ATOM 1604 H LYS A 933 42.371 -0.250 6.415 1.00 0.00 H ATOM 1605 N HIS A 934 40.454 -0.679 4.566 1.00 52.67 N ATOM 1606 CA HIS A 934 39.874 -1.311 3.377 1.00 52.67 C ATOM 1607 C HIS A 934 39.575 -2.786 3.640 1.00 52.23 C ATOM 1608 O HIS A 934 40.250 -3.454 4.455 1.00 46.83 O ATOM 1609 CB HIS A 934 40.787 -1.150 2.160 1.00 54.02 C ATOM 1610 CG HIS A 934 41.131 0.271 1.866 1.00 56.81 C ATOM 1611 ND1 HIS A 934 40.192 1.187 1.460 1.00 62.16 N ATOM 1612 CD2 HIS A 934 42.300 0.936 1.932 1.00 57.97 C ATOM 1613 CE1 HIS A 934 40.779 2.349 1.244 1.00 62.61 C ATOM 1614 NE2 HIS A 934 42.064 2.219 1.542 1.00 60.09 N ATOM 1615 H HIS A 934 41.272 -1.124 5.029 1.00 0.00 H ATOM 1616 N ALA A 935 38.557 -3.263 2.915 1.00 50.97 N ATOM 1617 CA ALA A 935 38.045 -4.602 3.005 1.00 51.58 C ATOM 1618 C ALA A 935 39.202 -5.584 2.828 1.00 50.80 C ATOM 1619 O ALA A 935 40.015 -5.450 1.912 1.00 50.34 O ATOM 1620 CB ALA A 935 36.959 -4.822 1.963 1.00 54.46 C ATOM 1621 H ALA A 935 38.103 -2.618 2.237 1.00 0.00 H ATOM 1622 N SER A 936 39.256 -6.557 3.728 1.00 50.80 N ATOM 1623 CA SER A 936 40.245 -7.613 3.696 1.00 54.14 C ATOM 1624 C SER A 936 39.689 -8.810 4.465 1.00 54.60 C ATOM 1625 O SER A 936 39.334 -8.670 5.636 1.00 54.79 O ATOM 1626 CB SER A 936 41.547 -7.137 4.294 1.00 52.32 C ATOM 1627 OG SER A 936 42.526 -8.166 4.225 1.00 54.51 O ATOM 1628 HG SER A 936 43.373 -7.841 4.620 1.00 0.00 H ATOM 1629 H SER A 936 38.553 -6.561 4.494 1.00 0.00 H ATOM 1630 N HIS A 937 39.615 -9.959 3.803 1.00 58.25 N ATOM 1631 CA HIS A 937 39.067 -11.168 4.395 1.00 62.41 C ATOM 1632 C HIS A 937 40.134 -11.789 5.299 1.00 61.37 C ATOM 1633 O HIS A 937 40.937 -12.583 4.882 1.00 61.26 O ATOM 1634 CB HIS A 937 38.540 -12.134 3.319 1.00 66.77 C ATOM 1635 CG HIS A 937 37.285 -11.654 2.655 1.00 71.48 C ATOM 1636 ND1 HIS A 937 36.550 -10.575 3.145 1.00 70.17 N ATOM 1637 CD2 HIS A 937 36.623 -12.096 1.556 1.00 74.38 C ATOM 1638 CE1 HIS A 937 35.499 -10.378 2.378 1.00 70.12 C ATOM 1639 NE2 HIS A 937 35.517 -11.296 1.394 1.00 71.36 N ATOM 1640 H HIS A 937 39.963 -9.995 2.823 1.00 0.00 H ATOM 1641 N ILE A 938 40.106 -11.380 6.561 1.00 64.00 N ATOM 1642 CA ILE A 938 41.056 -11.809 7.579 1.00 67.61 C ATOM 1643 C ILE A 938 40.774 -13.272 7.947 1.00 67.92 C ATOM 1644 O ILE A 938 39.744 -13.559 8.548 1.00 67.13 O ATOM 1645 CB ILE A 938 40.951 -10.853 8.789 1.00 66.90 C ATOM 1646 CG1 ILE A 938 41.529 -9.474 8.452 1.00 66.50 C ATOM 1647 CG2 ILE A 938 41.584 -11.432 10.040 1.00 67.90 C ATOM 1648 CD1 ILE A 938 42.863 -9.523 7.753 1.00 69.46 C ATOM 1649 H ILE A 938 39.360 -10.712 6.841 1.00 0.00 H ATOM 1650 N SER A 939 41.703 -14.157 7.554 1.00 71.21 N ATOM 1651 CA SER A 939 41.690 -15.608 7.851 1.00 73.55 C ATOM 1652 C SER A 939 42.332 -15.919 9.209 1.00 72.63 C ATOM 1653 O SER A 939 42.006 -16.912 9.825 1.00 76.89 O ATOM 1654 CB SER A 939 42.402 -16.368 6.778 1.00 74.00 C ATOM 1655 OG SER A 939 43.650 -15.763 6.504 1.00 79.47 O ATOM 1656 HG SER A 939 44.114 -16.273 5.793 1.00 0.00 H ATOM 1657 H SER A 939 42.500 -13.793 6.993 1.00 0.00 H ATOM 1658 N LYS A 940 43.276 -15.080 9.638 1.00 70.12 N ATOM 1659 CA LYS A 940 44.015 -15.254 10.890 1.00 66.10 C ATOM 1660 C LYS A 940 44.511 -13.878 11.341 1.00 59.02 C ATOM 1661 O LYS A 940 45.125 -13.206 10.581 1.00 56.01 O ATOM 1662 CB LYS A 940 45.221 -16.172 10.660 1.00 70.27 C ATOM 1663 CG LYS A 940 45.928 -16.655 11.923 1.00 73.23 C ATOM 1664 CD LYS A 940 47.358 -17.103 11.695 1.00 77.32 C ATOM 1665 CE LYS A 940 48.015 -17.638 12.954 1.00 82.06 C ATOM 1666 NZ LYS A 940 49.123 -18.579 12.643 1.00 87.45 N ATOM 1667 HZ1 LYS A 940 48.750 -19.385 12.101 1.00 0.00 H ATOM 1668 HZ2 LYS A 940 49.847 -18.087 12.081 1.00 0.00 H ATOM 1669 HZ3 LYS A 940 49.545 -18.921 13.530 1.00 0.00 H ATOM 1670 H LYS A 940 43.500 -14.253 9.048 1.00 0.00 H ATOM 1671 N LEU A 941 44.243 -13.491 12.580 1.00 54.12 N ATOM 1672 CA LEU A 941 44.744 -12.245 13.118 1.00 53.11 C ATOM 1673 C LEU A 941 46.271 -12.278 13.219 1.00 52.55 C ATOM 1674 O LEU A 941 46.860 -13.318 13.534 1.00 55.07 O ATOM 1675 CB LEU A 941 44.111 -11.998 14.489 1.00 53.88 C ATOM 1676 CG LEU A 941 42.651 -11.564 14.463 1.00 53.24 C ATOM 1677 CD1 LEU A 941 42.057 -11.646 15.850 1.00 57.02 C ATOM 1678 CD2 LEU A 941 42.490 -10.156 13.922 1.00 54.92 C ATOM 1679 H LEU A 941 43.655 -14.101 13.183 1.00 0.00 H ATOM 1680 N PRO A 942 46.957 -11.149 12.922 1.00 50.03 N ATOM 1681 CA PRO A 942 48.375 -11.004 13.222 1.00 52.75 C ATOM 1682 C PRO A 942 48.650 -11.299 14.706 1.00 51.30 C ATOM 1683 O PRO A 942 47.801 -11.025 15.564 1.00 50.47 O ATOM 1684 CB PRO A 942 48.675 -9.520 12.908 1.00 51.85 C ATOM 1685 CG PRO A 942 47.590 -9.097 11.946 1.00 50.09 C ATOM 1686 CD PRO A 942 46.385 -9.904 12.375 1.00 49.94 C ATOM 1687 N LYS A 943 49.855 -11.776 14.995 1.00 54.79 N ATOM 1688 CA LYS A 943 50.232 -12.148 16.364 1.00 58.72 C ATOM 1689 C LYS A 943 50.008 -10.937 17.281 1.00 54.76 C ATOM 1690 O LYS A 943 50.376 -9.785 16.924 1.00 48.95 O ATOM 1691 CB LYS A 943 51.693 -12.604 16.444 1.00 65.10 C ATOM 1692 CG LYS A 943 52.196 -13.489 15.310 1.00 70.40 C ATOM 1693 CD LYS A 943 51.553 -14.868 15.238 1.00 74.68 C ATOM 1694 CE LYS A 943 52.288 -15.801 14.287 1.00 76.55 C ATOM 1695 NZ LYS A 943 53.737 -15.889 14.599 1.00 76.65 N ATOM 1696 HZ1 LYS A 943 54.165 -14.944 14.522 1.00 0.00 H ATOM 1697 HZ2 LYS A 943 53.861 -16.249 15.567 1.00 0.00 H ATOM 1698 HZ3 LYS A 943 54.197 -16.535 13.926 1.00 0.00 H ATOM 1699 H LYS A 943 50.551 -11.889 14.230 1.00 0.00 H ATOM 1700 N GLY A 944 49.345 -11.200 18.410 1.00 51.37 N ATOM 1701 CA GLY A 944 49.120 -10.226 19.463 1.00 51.16 C ATOM 1702 C GLY A 944 47.840 -9.436 19.274 1.00 51.18 C ATOM 1703 O GLY A 944 47.496 -8.613 20.118 1.00 53.68 O ATOM 1704 H GLY A 944 48.967 -12.160 18.543 1.00 0.00 H ATOM 1705 N LYS A 945 47.146 -9.626 18.145 1.00 49.95 N ATOM 1706 CA LYS A 945 45.927 -8.893 17.884 1.00 46.99 C ATOM 1707 C LYS A 945 44.732 -9.721 18.354 1.00 46.22 C ATOM 1708 O LYS A 945 44.733 -10.913 18.189 1.00 47.87 O ATOM 1709 CB LYS A 945 45.789 -8.610 16.391 1.00 47.64 C ATOM 1710 CG LYS A 945 46.872 -7.714 15.837 1.00 48.04 C ATOM 1711 CD LYS A 945 46.860 -6.370 16.484 1.00 45.24 C ATOM 1712 CE LYS A 945 47.707 -5.384 15.723 1.00 46.12 C ATOM 1713 NZ LYS A 945 47.504 -4.000 16.225 1.00 44.94 N ATOM 1714 HZ1 LYS A 945 46.505 -3.735 16.113 1.00 0.00 H ATOM 1715 HZ2 LYS A 945 47.765 -3.956 17.231 1.00 0.00 H ATOM 1716 HZ3 LYS A 945 48.101 -3.344 15.681 1.00 0.00 H ATOM 1717 H LYS A 945 47.489 -10.313 17.443 1.00 0.00 H ATOM 1718 N HIS A 946 43.688 -9.063 18.870 1.00 45.76 N ATOM 1719 CA HIS A 946 42.519 -9.776 19.403 1.00 47.00 C ATOM 1720 C HIS A 946 41.246 -9.457 18.618 1.00 44.46 C ATOM 1721 O HIS A 946 40.215 -10.069 18.852 1.00 46.86 O ATOM 1722 CB HIS A 946 42.315 -9.438 20.891 1.00 45.98 C ATOM 1723 CG HIS A 946 43.549 -9.567 21.696 1.00 45.00 C ATOM 1724 ND1 HIS A 946 44.410 -8.515 21.860 1.00 45.51 N ATOM 1725 CD2 HIS A 946 44.090 -10.623 22.344 1.00 47.25 C ATOM 1726 CE1 HIS A 946 45.435 -8.905 22.601 1.00 48.36 C ATOM 1727 NE2 HIS A 946 45.258 -10.196 22.914 1.00 47.10 N ATOM 1728 H HIS A 946 43.704 -8.023 18.894 1.00 0.00 H ATOM 1729 N SER A 947 41.327 -8.490 17.718 1.00 44.23 N ATOM 1730 CA SER A 947 40.164 -7.930 17.018 1.00 43.37 C ATOM 1731 C SER A 947 40.635 -7.112 15.811 1.00 42.38 C ATOM 1732 O SER A 947 41.816 -6.826 15.682 1.00 44.06 O ATOM 1733 CB SER A 947 39.335 -7.065 17.928 1.00 42.53 C ATOM 1734 OG SER A 947 40.074 -5.934 18.336 1.00 40.60 O ATOM 1735 HG SER A 947 40.886 -6.229 18.820 1.00 0.00 H ATOM 1736 H SER A 947 42.267 -8.105 17.494 1.00 0.00 H ATOM 1737 N VAL A 948 39.675 -6.779 14.943 1.00 42.57 N ATOM 1738 CA VAL A 948 39.832 -5.879 13.835 1.00 42.14 C ATOM 1739 C VAL A 948 38.949 -4.667 14.120 1.00 42.74 C ATOM 1740 O VAL A 948 37.806 -4.796 14.559 1.00 44.36 O ATOM 1741 CB VAL A 948 39.459 -6.513 12.484 1.00 42.39 C ATOM 1742 CG1 VAL A 948 39.293 -5.464 11.391 1.00 44.36 C ATOM 1743 CG2 VAL A 948 40.465 -7.556 12.032 1.00 41.83 C ATOM 1744 H VAL A 948 38.737 -7.207 15.081 1.00 0.00 H ATOM 1745 N LYS A 949 39.498 -3.484 13.864 1.00 41.03 N ATOM 1746 CA LYS A 949 38.692 -2.292 13.776 1.00 43.14 C ATOM 1747 C LYS A 949 38.803 -1.714 12.373 1.00 39.99 C ATOM 1748 O LYS A 949 39.886 -1.395 11.942 1.00 41.09 O ATOM 1749 CB LYS A 949 39.181 -1.244 14.777 1.00 45.08 C ATOM 1750 CG LYS A 949 38.274 -0.031 14.906 1.00 44.34 C ATOM 1751 CD LYS A 949 38.855 0.963 15.868 1.00 43.37 C ATOM 1752 CE LYS A 949 38.166 2.287 15.743 1.00 43.23 C ATOM 1753 NZ LYS A 949 38.582 3.167 16.831 1.00 45.22 N ATOM 1754 HZ1 LYS A 949 38.330 2.733 17.742 1.00 0.00 H ATOM 1755 HZ2 LYS A 949 39.611 3.309 16.786 1.00 0.00 H ATOM 1756 HZ3 LYS A 949 38.100 4.084 16.737 1.00 0.00 H ATOM 1757 H LYS A 949 40.526 -3.417 13.725 1.00 0.00 H ATOM 1758 N GLY A 950 37.666 -1.606 11.691 1.00 41.53 N ATOM 1759 CA GLY A 950 37.536 -0.824 10.459 1.00 41.77 C ATOM 1760 C GLY A 950 37.456 0.659 10.809 1.00 43.42 C ATOM 1761 O GLY A 950 36.549 1.054 11.546 1.00 43.40 O ATOM 1762 H GLY A 950 36.826 -2.102 12.051 1.00 0.00 H ATOM 1763 N LEU A 951 38.403 1.462 10.311 1.00 42.83 N ATOM 1764 CA LEU A 951 38.483 2.910 10.630 1.00 44.05 C ATOM 1765 C LEU A 951 37.529 3.730 9.750 1.00 43.25 C ATOM 1766 O LEU A 951 37.715 3.843 8.555 1.00 44.01 O ATOM 1767 CB LEU A 951 39.915 3.391 10.429 1.00 45.78 C ATOM 1768 CG LEU A 951 40.956 2.693 11.289 1.00 45.06 C ATOM 1769 CD1 LEU A 951 42.319 3.309 11.062 1.00 48.21 C ATOM 1770 CD2 LEU A 951 40.574 2.756 12.751 1.00 45.34 C ATOM 1771 H LEU A 951 39.115 1.054 9.672 1.00 0.00 H ATOM 1772 N GLY A 952 36.505 4.307 10.376 1.00 42.68 N ATOM 1773 CA GLY A 952 35.600 5.240 9.736 1.00 45.09 C ATOM 1774 C GLY A 952 36.190 6.640 9.639 1.00 47.67 C ATOM 1775 O GLY A 952 37.105 7.043 10.385 1.00 47.19 O ATOM 1776 H GLY A 952 36.347 4.076 11.377 1.00 0.00 H ATOM 1777 N LYS A 953 35.632 7.393 8.698 1.00 51.44 N ATOM 1778 CA LYS A 953 35.881 8.805 8.520 1.00 55.77 C ATOM 1779 C LYS A 953 35.307 9.594 9.697 1.00 52.74 C ATOM 1780 O LYS A 953 35.823 10.653 10.029 1.00 50.39 O ATOM 1781 CB LYS A 953 35.228 9.309 7.231 1.00 61.47 C ATOM 1782 CG LYS A 953 35.850 8.771 5.951 1.00 71.03 C ATOM 1783 CD LYS A 953 35.960 9.809 4.815 1.00 79.43 C ATOM 1784 CE LYS A 953 37.078 10.831 4.993 1.00 84.30 C ATOM 1785 NZ LYS A 953 38.361 10.228 5.452 1.00 82.45 N ATOM 1786 HZ1 LYS A 953 38.214 9.761 6.369 1.00 0.00 H ATOM 1787 HZ2 LYS A 953 38.684 9.529 4.753 1.00 0.00 H ATOM 1788 HZ3 LYS A 953 39.077 10.975 5.553 1.00 0.00 H ATOM 1789 H LYS A 953 34.968 6.933 8.042 1.00 0.00 H ATOM 1790 N THR A 954 34.186 9.108 10.246 1.00 49.54 N ATOM 1791 CA THR A 954 33.580 9.720 11.413 1.00 52.65 C ATOM 1792 C THR A 954 33.730 8.789 12.613 1.00 51.55 C ATOM 1793 O THR A 954 33.618 7.556 12.493 1.00 51.02 O ATOM 1794 CB THR A 954 32.108 10.072 11.181 1.00 53.88 C ATOM 1795 OG1 THR A 954 32.057 10.890 10.016 1.00 53.10 O ATOM 1796 CG2 THR A 954 31.499 10.821 12.343 1.00 55.79 C ATOM 1797 HG1 THR A 954 31.117 11.140 9.831 1.00 0.00 H ATOM 1798 H THR A 954 33.738 8.269 9.824 1.00 0.00 H ATOM 1799 N THR A 955 33.993 9.394 13.769 1.00 53.17 N ATOM 1800 CA THR A 955 34.165 8.642 15.005 1.00 52.07 C ATOM 1801 C THR A 955 33.521 9.404 16.160 1.00 55.13 C ATOM 1802 O THR A 955 33.585 10.628 16.193 1.00 56.10 O ATOM 1803 CB THR A 955 35.643 8.323 15.262 1.00 50.44 C ATOM 1804 OG1 THR A 955 35.642 7.500 16.431 1.00 54.96 O ATOM 1805 CG2 THR A 955 36.526 9.526 15.487 1.00 52.68 C ATOM 1806 HG1 THR A 955 35.238 7.999 17.184 1.00 0.00 H ATOM 1807 H THR A 955 34.078 10.430 13.791 1.00 0.00 H ATOM 1808 N PRO A 956 32.901 8.726 17.153 1.00 56.62 N ATOM 1809 CA PRO A 956 32.527 9.391 18.392 1.00 55.72 C ATOM 1810 C PRO A 956 33.768 10.097 18.943 1.00 56.71 C ATOM 1811 O PRO A 956 34.879 9.617 18.819 1.00 55.34 O ATOM 1812 CB PRO A 956 32.069 8.241 19.291 1.00 56.11 C ATOM 1813 CG PRO A 956 31.540 7.213 18.306 1.00 57.49 C ATOM 1814 CD PRO A 956 32.536 7.295 17.164 1.00 58.30 C ATOM 1815 N ASP A 957 33.564 11.265 19.525 1.00 58.80 N ATOM 1816 CA ASP A 957 34.663 12.052 20.023 1.00 62.23 C ATOM 1817 C ASP A 957 35.420 11.244 21.078 1.00 61.80 C ATOM 1818 O ASP A 957 34.897 11.021 22.157 1.00 62.12 O ATOM 1819 CB ASP A 957 34.129 13.366 20.584 1.00 64.04 C ATOM 1820 CG ASP A 957 35.223 14.339 20.954 1.00 66.55 C ATOM 1821 OD1 ASP A 957 36.379 14.082 20.601 1.00 70.23 O ATOM 1822 OD2 ASP A 957 34.897 15.332 21.585 1.00 70.21 O ATOM 1823 H ASP A 957 32.593 11.623 19.626 1.00 0.00 H ATOM 1824 N PRO A 958 36.666 10.787 20.817 1.00 64.03 N ATOM 1825 CA PRO A 958 37.409 9.972 21.787 1.00 65.88 C ATOM 1826 C PRO A 958 37.603 10.607 23.177 1.00 67.45 C ATOM 1827 O PRO A 958 37.720 9.898 24.156 1.00 69.55 O ATOM 1828 CB PRO A 958 38.797 9.782 21.154 1.00 66.48 C ATOM 1829 CG PRO A 958 38.608 10.093 19.678 1.00 65.40 C ATOM 1830 CD PRO A 958 37.452 11.068 19.606 1.00 65.94 C ATOM 1831 N SER A 959 37.597 11.941 23.253 1.00 68.62 N ATOM 1832 CA SER A 959 37.725 12.646 24.524 1.00 70.05 C ATOM 1833 C SER A 959 36.433 12.566 25.347 1.00 69.55 C ATOM 1834 O SER A 959 36.447 12.894 26.514 1.00 70.44 O ATOM 1835 CB SER A 959 38.141 14.082 24.307 1.00 74.51 C ATOM 1836 OG SER A 959 37.725 14.548 23.033 1.00 74.78 O ATOM 1837 HG SER A 959 36.739 14.490 22.968 1.00 0.00 H ATOM 1838 H SER A 959 37.498 12.495 22.378 1.00 0.00 H ATOM 1839 N ALA A 960 35.319 12.139 24.745 1.00 67.89 N ATOM 1840 CA ALA A 960 34.009 12.128 25.445 1.00 67.80 C ATOM 1841 C ALA A 960 33.639 10.710 25.928 1.00 63.67 C ATOM 1842 O ALA A 960 32.533 10.477 26.414 1.00 60.63 O ATOM 1843 CB ALA A 960 32.961 12.696 24.524 1.00 66.86 C ATOM 1844 H ALA A 960 35.371 11.806 23.761 1.00 0.00 H ATOM 1845 N ASN A 961 34.584 9.772 25.818 1.00 63.83 N ATOM 1846 CA ASN A 961 34.413 8.413 26.337 1.00 64.32 C ATOM 1847 C ASN A 961 34.092 8.466 27.838 1.00 64.81 C ATOM 1848 O ASN A 961 34.485 9.354 28.559 1.00 70.92 O ATOM 1849 CB ASN A 961 35.625 7.519 26.070 1.00 63.53 C ATOM 1850 CG ASN A 961 35.672 6.979 24.658 1.00 64.37 C ATOM 1851 OD1 ASN A 961 35.164 7.587 23.718 1.00 66.85 O ATOM 1852 ND2 ASN A 961 36.324 5.846 24.485 1.00 67.38 N ATOM 1853 HD22 ASN A 961 36.742 5.357 25.302 1.00 0.00 H ATOM 1854 HD21 ASN A 961 36.420 5.442 23.532 1.00 0.00 H ATOM 1855 H ASN A 961 35.477 10.017 25.345 1.00 0.00 H ATOM 1856 N ILE A 962 33.312 7.490 28.270 1.00 63.88 N ATOM 1857 CA ILE A 962 32.818 7.378 29.599 1.00 65.07 C ATOM 1858 C ILE A 962 33.083 5.924 29.983 1.00 62.72 C ATOM 1859 O ILE A 962 33.285 5.072 29.105 1.00 61.05 O ATOM 1860 CB ILE A 962 31.323 7.780 29.627 1.00 68.11 C ATOM 1861 CG1 ILE A 962 31.089 9.043 30.462 1.00 73.87 C ATOM 1862 CG2 ILE A 962 30.411 6.633 30.053 1.00 67.61 C ATOM 1863 CD1 ILE A 962 29.610 9.409 30.669 1.00 78.71 C ATOM 1864 H ILE A 962 33.040 6.752 27.590 1.00 0.00 H ATOM 1865 N SER A 963 33.129 5.649 31.275 1.00 63.05 N ATOM 1866 CA SER A 963 33.318 4.298 31.774 1.00 67.08 C ATOM 1867 C SER A 963 32.053 3.868 32.515 1.00 66.45 C ATOM 1868 O SER A 963 31.619 4.564 33.397 1.00 68.16 O ATOM 1869 CB SER A 963 34.523 4.193 32.664 1.00 69.60 C ATOM 1870 OG SER A 963 34.657 2.860 33.133 1.00 70.15 O ATOM 1871 HG SER A 963 35.452 2.796 33.719 1.00 0.00 H ATOM 1872 H SER A 963 33.026 6.427 31.958 1.00 0.00 H ATOM 1873 N LEU A 964 31.470 2.745 32.095 1.00 63.71 N ATOM 1874 CA LEU A 964 30.334 2.109 32.755 1.00 65.58 C ATOM 1875 C LEU A 964 30.770 0.701 33.164 1.00 65.95 C ATOM 1876 O LEU A 964 31.027 -0.150 32.300 1.00 62.10 O ATOM 1877 CB LEU A 964 29.132 2.032 31.802 1.00 62.87 C ATOM 1878 CG LEU A 964 27.874 1.405 32.408 1.00 63.47 C ATOM 1879 CD1 LEU A 964 27.347 2.269 33.555 1.00 65.40 C ATOM 1880 CD2 LEU A 964 26.791 1.178 31.363 1.00 61.67 C ATOM 1881 H LEU A 964 31.850 2.292 31.240 1.00 0.00 H ATOM 1882 N ASP A 965 30.893 0.491 34.478 1.00 69.76 N ATOM 1883 CA ASP A 965 31.309 -0.757 35.052 1.00 68.52 C ATOM 1884 C ASP A 965 32.678 -1.162 34.490 1.00 65.89 C ATOM 1885 O ASP A 965 32.900 -2.330 34.238 1.00 66.70 O ATOM 1886 CB ASP A 965 30.234 -1.821 34.807 1.00 72.61 C ATOM 1887 CG ASP A 965 28.976 -1.604 35.636 1.00 79.79 C ATOM 1888 OD1 ASP A 965 27.908 -1.290 35.049 1.00 78.00 O ATOM 1889 OD2 ASP A 965 29.075 -1.745 36.874 1.00 85.83 O ATOM 1890 H ASP A 965 30.675 1.278 35.122 1.00 0.00 H ATOM 1891 N GLY A 966 33.580 -0.187 34.293 1.00 66.88 N ATOM 1892 CA GLY A 966 34.950 -0.422 33.783 1.00 65.73 C ATOM 1893 C GLY A 966 34.989 -0.834 32.316 1.00 65.30 C ATOM 1894 O GLY A 966 35.962 -1.435 31.859 1.00 69.63 O ATOM 1895 H GLY A 966 33.300 0.790 34.511 1.00 0.00 H ATOM 1896 N VAL A 967 33.923 -0.505 31.576 1.00 60.58 N ATOM 1897 CA VAL A 967 33.826 -0.706 30.121 1.00 56.12 C ATOM 1898 C VAL A 967 33.722 0.685 29.464 1.00 53.60 C ATOM 1899 O VAL A 967 32.908 1.497 29.883 1.00 52.27 O ATOM 1900 CB VAL A 967 32.619 -1.610 29.782 1.00 50.89 C ATOM 1901 CG1 VAL A 967 32.458 -1.830 28.298 1.00 47.45 C ATOM 1902 CG2 VAL A 967 32.702 -2.947 30.498 1.00 52.35 C ATOM 1903 H VAL A 967 33.108 -0.079 32.062 1.00 0.00 H ATOM 1904 N ASP A 968 34.556 0.956 28.450 1.00 54.06 N ATOM 1905 CA ASP A 968 34.517 2.225 27.696 1.00 56.43 C ATOM 1906 C ASP A 968 33.248 2.274 26.835 1.00 54.74 C ATOM 1907 O ASP A 968 32.933 1.303 26.133 1.00 51.69 O ATOM 1908 CB ASP A 968 35.732 2.395 26.778 1.00 60.38 C ATOM 1909 CG ASP A 968 37.045 2.459 27.540 1.00 65.74 C ATOM 1910 OD1 ASP A 968 38.004 1.773 27.112 1.00 66.00 O ATOM 1911 OD2 ASP A 968 37.087 3.173 28.584 1.00 67.40 O ATOM 1912 H ASP A 968 35.262 0.241 28.183 1.00 0.00 H ATOM 1913 N VAL A 969 32.532 3.396 26.943 1.00 52.06 N ATOM 1914 CA VAL A 969 31.385 3.730 26.146 1.00 51.29 C ATOM 1915 C VAL A 969 31.737 4.945 25.299 1.00 49.65 C ATOM 1916 O VAL A 969 31.903 6.045 25.826 1.00 49.96 O ATOM 1917 CB VAL A 969 30.159 4.016 27.024 1.00 53.78 C ATOM 1918 CG1 VAL A 969 28.915 4.214 26.169 1.00 54.01 C ATOM 1919 CG2 VAL A 969 29.950 2.922 28.058 1.00 53.62 C ATOM 1920 H VAL A 969 32.829 4.085 27.663 1.00 0.00 H ATOM 1921 N PRO A 970 31.880 4.771 23.968 1.00 49.63 N ATOM 1922 CA PRO A 970 32.206 5.879 23.066 1.00 49.34 C ATOM 1923 C PRO A 970 30.928 6.598 22.611 1.00 48.48 C ATOM 1924 O PRO A 970 30.498 6.450 21.455 1.00 49.65 O ATOM 1925 CB PRO A 970 32.898 5.150 21.915 1.00 49.46 C ATOM 1926 CG PRO A 970 32.130 3.817 21.828 1.00 48.47 C ATOM 1927 CD PRO A 970 31.704 3.499 23.249 1.00 48.07 C ATOM 1928 N LEU A 971 30.346 7.372 23.528 1.00 48.39 N ATOM 1929 CA LEU A 971 29.073 8.006 23.292 1.00 50.92 C ATOM 1930 C LEU A 971 29.226 9.488 22.937 1.00 50.25 C ATOM 1931 O LEU A 971 28.241 10.195 22.908 1.00 54.46 O ATOM 1932 CB LEU A 971 28.159 7.840 24.509 1.00 52.63 C ATOM 1933 CG LEU A 971 28.745 8.091 25.894 1.00 53.54 C ATOM 1934 CD1 LEU A 971 29.259 9.528 26.056 1.00 54.93 C ATOM 1935 CD2 LEU A 971 27.669 7.789 26.927 1.00 53.37 C ATOM 1936 H LEU A 971 30.824 7.522 24.439 1.00 0.00 H ATOM 1937 N GLY A 972 30.444 9.952 22.672 1.00 50.24 N ATOM 1938 CA GLY A 972 30.638 11.330 22.185 1.00 53.25 C ATOM 1939 C GLY A 972 29.985 11.516 20.831 1.00 53.00 C ATOM 1940 O GLY A 972 29.844 10.544 20.080 1.00 55.26 O ATOM 1941 H GLY A 972 31.270 9.335 22.810 1.00 0.00 H ATOM 1942 N THR A 973 29.563 12.742 20.524 1.00 55.72 N ATOM 1943 CA THR A 973 29.076 13.080 19.186 1.00 57.50 C ATOM 1944 C THR A 973 30.210 12.815 18.186 1.00 57.71 C ATOM 1945 O THR A 973 31.374 12.852 18.545 1.00 56.39 O ATOM 1946 CB THR A 973 28.525 14.508 19.115 1.00 60.44 C ATOM 1947 OG1 THR A 973 29.628 15.392 19.241 1.00 65.83 O ATOM 1948 CG2 THR A 973 27.515 14.839 20.192 1.00 61.43 C ATOM 1949 HG1 THR A 973 29.306 16.327 19.199 1.00 0.00 H ATOM 1950 H THR A 973 29.580 13.480 21.256 1.00 0.00 H ATOM 1951 N GLY A 974 29.835 12.471 16.952 1.00 59.69 N ATOM 1952 CA GLY A 974 30.764 12.085 15.895 1.00 58.93 C ATOM 1953 C GLY A 974 31.533 13.287 15.376 1.00 62.66 C ATOM 1954 O GLY A 974 30.978 14.362 15.185 1.00 68.03 O ATOM 1955 H GLY A 974 28.819 12.479 16.730 1.00 0.00 H ATOM 1956 N ILE A 975 32.840 13.109 15.216 1.00 59.07 N ATOM 1957 CA ILE A 975 33.716 14.103 14.693 1.00 59.77 C ATOM 1958 C ILE A 975 34.493 13.442 13.562 1.00 56.83 C ATOM 1959 O ILE A 975 34.492 12.246 13.419 1.00 53.95 O ATOM 1960 CB ILE A 975 34.666 14.626 15.784 1.00 62.81 C ATOM 1961 CG1 ILE A 975 35.543 13.500 16.354 1.00 61.11 C ATOM 1962 CG2 ILE A 975 33.867 15.335 16.868 1.00 65.05 C ATOM 1963 CD1 ILE A 975 36.641 13.967 17.280 1.00 63.72 C ATOM 1964 H ILE A 975 33.247 12.191 15.488 1.00 0.00 H ATOM 1965 N SER A 976 35.200 14.246 12.798 1.00 57.94 N ATOM 1966 CA SER A 976 36.051 13.704 11.809 1.00 57.19 C ATOM 1967 C SER A 976 37.192 12.947 12.502 1.00 54.64 C ATOM 1968 O SER A 976 37.791 13.449 13.431 1.00 57.64 O ATOM 1969 CB SER A 976 36.556 14.796 10.911 1.00 58.79 C ATOM 1970 OG SER A 976 37.704 14.331 10.237 1.00 60.75 O ATOM 1971 HG SER A 976 38.047 15.043 9.641 1.00 0.00 H ATOM 1972 H SER A 976 35.133 15.276 12.921 1.00 0.00 H ATOM 1973 N SER A 977 37.473 11.732 12.027 1.00 52.28 N ATOM 1974 CA SER A 977 38.456 10.874 12.592 1.00 49.89 C ATOM 1975 C SER A 977 39.858 11.385 12.253 1.00 51.27 C ATOM 1976 O SER A 977 40.816 11.115 12.986 1.00 52.79 O ATOM 1977 CB SER A 977 38.251 9.466 12.116 1.00 49.05 C ATOM 1978 OG SER A 977 38.651 9.296 10.757 1.00 49.36 O ATOM 1979 HG SER A 977 38.499 8.356 10.485 1.00 0.00 H ATOM 1980 H SER A 977 36.944 11.394 11.198 1.00 0.00 H ATOM 1981 N GLY A 978 39.955 12.137 11.154 1.00 51.79 N ATOM 1982 CA GLY A 978 41.196 12.477 10.515 1.00 54.09 C ATOM 1983 C GLY A 978 41.896 11.271 9.904 1.00 53.51 C ATOM 1984 O GLY A 978 43.075 11.304 9.647 1.00 54.51 O ATOM 1985 H GLY A 978 39.076 12.500 10.734 1.00 0.00 H ATOM 1986 N VAL A 979 41.183 10.167 9.706 1.00 52.31 N ATOM 1987 CA VAL A 979 41.758 9.091 8.959 1.00 52.06 C ATOM 1988 C VAL A 979 41.457 9.362 7.486 1.00 55.62 C ATOM 1989 O VAL A 979 40.286 9.480 7.112 1.00 59.18 O ATOM 1990 CB VAL A 979 41.238 7.712 9.392 1.00 48.47 C ATOM 1991 CG1 VAL A 979 41.882 6.621 8.557 1.00 49.37 C ATOM 1992 CG2 VAL A 979 41.472 7.473 10.867 1.00 46.55 C ATOM 1993 H VAL A 979 40.220 10.086 10.089 1.00 0.00 H ATOM 1994 N ASN A 980 42.526 9.434 6.685 1.00 56.18 N ATOM 1995 CA ASN A 980 42.456 9.655 5.262 1.00 61.98 C ATOM 1996 C ASN A 980 42.392 8.333 4.476 1.00 62.05 C ATOM 1997 O ASN A 980 42.918 7.297 4.916 1.00 61.76 O ATOM 1998 CB ASN A 980 43.651 10.484 4.788 1.00 64.83 C ATOM 1999 CG ASN A 980 43.506 11.943 5.151 1.00 69.67 C ATOM 2000 OD1 ASN A 980 42.427 12.385 5.555 1.00 69.25 O ATOM 2001 ND2 ASN A 980 44.579 12.701 4.980 1.00 76.63 N ATOM 2002 HD22 ASN A 980 45.465 12.278 4.637 1.00 0.00 H ATOM 2003 HD21 ASN A 980 44.535 13.719 5.189 1.00 0.00 H ATOM 2004 H ASN A 980 43.466 9.324 7.116 1.00 0.00 H ATOM 2005 N ASP A 981 41.759 8.429 3.295 1.00 65.71 N ATOM 2006 CA ASP A 981 41.694 7.357 2.318 1.00 67.28 C ATOM 2007 C ASP A 981 41.155 6.095 3.011 1.00 66.45 C ATOM 2008 O ASP A 981 41.781 5.041 2.965 1.00 68.48 O ATOM 2009 CB ASP A 981 43.065 7.142 1.660 1.00 68.00 C ATOM 2010 CG ASP A 981 43.744 8.415 1.169 1.00 68.18 C ATOM 2011 OD1 ASP A 981 44.934 8.579 1.462 1.00 67.71 O ATOM 2012 OD2 ASP A 981 43.077 9.234 0.506 1.00 68.02 O ATOM 2013 H ASP A 981 41.286 9.327 3.066 1.00 0.00 H ATOM 2014 N THR A 982 40.018 6.242 3.692 1.00 65.24 N ATOM 2015 CA THR A 982 39.354 5.110 4.281 1.00 65.67 C ATOM 2016 C THR A 982 38.045 4.912 3.524 1.00 62.10 C ATOM 2017 O THR A 982 37.433 5.852 3.120 1.00 61.49 O ATOM 2018 CB THR A 982 39.138 5.251 5.791 1.00 66.47 C ATOM 2019 OG1 THR A 982 38.609 3.986 6.216 1.00 68.99 O ATOM 2020 CG2 THR A 982 38.209 6.391 6.139 1.00 66.33 C ATOM 2021 HG1 THR A 982 38.445 4.009 7.192 1.00 0.00 H ATOM 2022 H THR A 982 39.605 7.190 3.799 1.00 0.00 H ATOM 2023 N SER A 983 37.661 3.650 3.338 1.00 59.19 N ATOM 2024 CA SER A 983 36.491 3.321 2.564 1.00 57.09 C ATOM 2025 C SER A 983 35.242 3.300 3.440 1.00 52.02 C ATOM 2026 O SER A 983 34.140 3.265 2.943 1.00 53.08 O ATOM 2027 CB SER A 983 36.697 2.027 1.847 1.00 56.93 C ATOM 2028 OG SER A 983 36.937 1.006 2.763 1.00 57.88 O ATOM 2029 HG SER A 983 37.748 1.220 3.289 1.00 0.00 H ATOM 2030 H SER A 983 38.220 2.883 3.762 1.00 0.00 H ATOM 2031 N LEU A 984 35.433 3.350 4.749 1.00 50.74 N ATOM 2032 CA LEU A 984 34.351 3.307 5.705 1.00 50.49 C ATOM 2033 C LEU A 984 33.991 4.736 6.131 1.00 51.07 C ATOM 2034 O LEU A 984 34.884 5.544 6.385 1.00 51.14 O ATOM 2035 CB LEU A 984 34.815 2.502 6.919 1.00 51.01 C ATOM 2036 CG LEU A 984 34.713 0.976 6.825 1.00 50.03 C ATOM 2037 CD1 LEU A 984 35.379 0.341 8.014 1.00 48.22 C ATOM 2038 CD2 LEU A 984 33.259 0.508 6.755 1.00 52.48 C ATOM 2039 H LEU A 984 36.407 3.424 5.106 1.00 0.00 H ATOM 2040 N LEU A 985 32.690 5.025 6.200 1.00 50.03 N ATOM 2041 CA LEU A 985 32.163 6.218 6.831 1.00 53.31 C ATOM 2042 C LEU A 985 32.308 6.146 8.353 1.00 50.38 C ATOM 2043 O LEU A 985 32.550 7.161 8.990 1.00 50.44 O ATOM 2044 CB LEU A 985 30.686 6.382 6.460 1.00 54.52 C ATOM 2045 CG LEU A 985 30.419 6.801 5.016 1.00 60.69 C ATOM 2046 CD1 LEU A 985 28.917 6.899 4.760 1.00 63.08 C ATOM 2047 CD2 LEU A 985 31.121 8.118 4.674 1.00 61.71 C ATOM 2048 H LEU A 985 32.016 4.356 5.777 1.00 0.00 H ATOM 2049 N TYR A 986 32.044 4.970 8.933 1.00 50.84 N ATOM 2050 CA TYR A 986 31.945 4.829 10.377 1.00 49.23 C ATOM 2051 C TYR A 986 32.736 3.601 10.774 1.00 48.05 C ATOM 2052 O TYR A 986 32.940 2.723 9.954 1.00 46.08 O ATOM 2053 CB TYR A 986 30.491 4.741 10.861 1.00 47.95 C ATOM 2054 CG TYR A 986 29.606 5.756 10.200 1.00 49.28 C ATOM 2055 CD1 TYR A 986 29.812 7.108 10.437 1.00 50.63 C ATOM 2056 CD2 TYR A 986 28.655 5.389 9.252 1.00 49.38 C ATOM 2057 CE1 TYR A 986 29.063 8.074 9.792 1.00 51.91 C ATOM 2058 CE2 TYR A 986 27.892 6.349 8.603 1.00 52.17 C ATOM 2059 CZ TYR A 986 28.098 7.698 8.878 1.00 53.46 C ATOM 2060 OH TYR A 986 27.375 8.672 8.250 1.00 57.10 O ATOM 2061 HH TYR A 986 27.665 9.560 8.578 1.00 0.00 H ATOM 2062 H TYR A 986 31.905 4.132 8.333 1.00 0.00 H ATOM 2063 N ASN A 987 33.178 3.595 12.036 1.00 47.41 N ATOM 2064 CA ASN A 987 33.961 2.525 12.536 1.00 45.33 C ATOM 2065 C ASN A 987 33.109 1.264 12.493 1.00 43.04 C ATOM 2066 O ASN A 987 31.870 1.294 12.500 1.00 43.28 O ATOM 2067 CB ASN A 987 34.435 2.739 13.974 1.00 44.30 C ATOM 2068 CG ASN A 987 35.358 3.924 14.171 1.00 47.78 C ATOM 2069 OD1 ASN A 987 36.262 4.160 13.365 1.00 45.35 O ATOM 2070 ND2 ASN A 987 35.142 4.655 15.262 1.00 44.85 N ATOM 2071 HD22 ASN A 987 34.364 4.409 15.907 1.00 0.00 H ATOM 2072 HD21 ASN A 987 35.751 5.472 15.470 1.00 0.00 H ATOM 2073 H ASN A 987 32.943 4.391 12.663 1.00 0.00 H ATOM 2074 N GLU A 988 33.797 0.139 12.491 1.00 43.11 N ATOM 2075 CA GLU A 988 33.175 -1.102 12.896 1.00 43.43 C ATOM 2076 C GLU A 988 34.238 -1.943 13.579 1.00 41.69 C ATOM 2077 O GLU A 988 35.413 -1.714 13.385 1.00 42.22 O ATOM 2078 CB GLU A 988 32.501 -1.835 11.738 1.00 41.98 C ATOM 2079 CG GLU A 988 33.383 -2.161 10.558 1.00 42.58 C ATOM 2080 CD GLU A 988 32.589 -2.511 9.300 1.00 43.15 C ATOM 2081 OE1 GLU A 988 31.696 -1.739 8.939 1.00 43.21 O ATOM 2082 OE2 GLU A 988 32.852 -3.557 8.687 1.00 45.82 O ATOM 2083 H GLU A 988 34.794 0.144 12.196 1.00 0.00 H ATOM 2084 N TYR A 989 33.778 -2.867 14.419 1.00 41.99 N ATOM 2085 CA TYR A 989 34.644 -3.670 15.215 1.00 41.99 C ATOM 2086 C TYR A 989 34.224 -5.130 15.075 1.00 41.22 C ATOM 2087 O TYR A 989 33.046 -5.434 15.143 1.00 41.47 O ATOM 2088 CB TYR A 989 34.537 -3.282 16.680 1.00 41.53 C ATOM 2089 CG TYR A 989 34.729 -1.831 16.992 1.00 43.15 C ATOM 2090 CD1 TYR A 989 33.706 -0.926 16.812 1.00 42.97 C ATOM 2091 CD2 TYR A 989 35.904 -1.389 17.568 1.00 44.29 C ATOM 2092 CE1 TYR A 989 33.867 0.404 17.138 1.00 44.14 C ATOM 2093 CE2 TYR A 989 36.073 -0.069 17.921 1.00 44.22 C ATOM 2094 CZ TYR A 989 35.049 0.829 17.714 1.00 45.95 C ATOM 2095 OH TYR A 989 35.219 2.133 18.054 1.00 42.86 O ATOM 2096 HH TYR A 989 34.395 2.638 17.842 1.00 0.00 H ATOM 2097 H TYR A 989 32.750 -3.008 14.497 1.00 0.00 H ATOM 2098 N ILE A 990 35.221 -6.003 14.926 1.00 41.33 N ATOM 2099 CA ILE A 990 35.033 -7.410 14.595 1.00 40.09 C ATOM 2100 C ILE A 990 35.889 -8.259 15.536 1.00 40.04 C ATOM 2101 O ILE A 990 37.075 -7.975 15.729 1.00 40.79 O ATOM 2102 CB ILE A 990 35.367 -7.716 13.123 1.00 44.16 C ATOM 2103 CG1 ILE A 990 34.636 -6.802 12.126 1.00 44.84 C ATOM 2104 CG2 ILE A 990 35.076 -9.180 12.816 1.00 44.47 C ATOM 2105 CD1 ILE A 990 35.300 -5.488 11.845 1.00 45.49 C ATOM 2106 H ILE A 990 36.194 -5.658 15.054 1.00 0.00 H ATOM 2107 N VAL A 991 35.244 -9.249 16.174 1.00 40.17 N ATOM 2108 CA VAL A 991 35.931 -10.292 16.935 1.00 41.88 C ATOM 2109 C VAL A 991 35.628 -11.639 16.262 1.00 42.81 C ATOM 2110 O VAL A 991 34.637 -11.788 15.567 1.00 40.90 O ATOM 2111 CB VAL A 991 35.553 -10.281 18.429 1.00 43.09 C ATOM 2112 CG1 VAL A 991 36.013 -8.997 19.114 1.00 44.67 C ATOM 2113 CG2 VAL A 991 34.067 -10.493 18.656 1.00 42.50 C ATOM 2114 H VAL A 991 34.206 -9.275 16.125 1.00 0.00 H ATOM 2115 N TYR A 992 36.574 -12.575 16.383 1.00 43.25 N ATOM 2116 CA TYR A 992 36.566 -13.807 15.602 1.00 46.82 C ATOM 2117 C TYR A 992 36.421 -14.997 16.550 1.00 47.78 C ATOM 2118 O TYR A 992 36.484 -16.105 16.136 1.00 49.83 O ATOM 2119 CB TYR A 992 37.831 -13.873 14.732 1.00 49.10 C ATOM 2120 CG TYR A 992 37.878 -12.795 13.676 1.00 47.76 C ATOM 2121 CD1 TYR A 992 38.485 -11.592 13.929 1.00 49.19 C ATOM 2122 CD2 TYR A 992 37.241 -12.944 12.457 1.00 48.05 C ATOM 2123 CE1 TYR A 992 38.505 -10.571 12.995 1.00 49.44 C ATOM 2124 CE2 TYR A 992 37.238 -11.936 11.509 1.00 48.14 C ATOM 2125 CZ TYR A 992 37.909 -10.753 11.762 1.00 48.79 C ATOM 2126 OH TYR A 992 37.920 -9.729 10.856 1.00 47.31 O ATOM 2127 HH TYR A 992 38.327 -10.043 10.010 1.00 0.00 H ATOM 2128 H TYR A 992 37.347 -12.419 17.061 1.00 0.00 H ATOM 2129 N ASP A 993 36.207 -14.713 17.832 1.00 49.44 N ATOM 2130 CA ASP A 993 35.998 -15.711 18.870 1.00 50.22 C ATOM 2131 C ASP A 993 34.761 -15.268 19.658 1.00 49.54 C ATOM 2132 O ASP A 993 34.724 -14.162 20.142 1.00 47.23 O ATOM 2133 CB ASP A 993 37.251 -15.841 19.734 1.00 50.36 C ATOM 2134 CG ASP A 993 37.142 -16.897 20.814 1.00 53.17 C ATOM 2135 OD1 ASP A 993 36.007 -17.232 21.210 1.00 55.00 O ATOM 2136 OD2 ASP A 993 38.184 -17.352 21.265 1.00 57.00 O ATOM 2137 H ASP A 993 36.188 -13.711 18.111 1.00 0.00 H ATOM 2138 N ILE A 994 33.753 -16.140 19.737 1.00 49.22 N ATOM 2139 CA ILE A 994 32.448 -15.806 20.316 1.00 49.74 C ATOM 2140 C ILE A 994 32.592 -15.438 21.801 1.00 48.46 C ATOM 2141 O ILE A 994 31.743 -14.741 22.346 1.00 48.85 O ATOM 2142 CB ILE A 994 31.433 -16.964 20.105 1.00 52.40 C ATOM 2143 CG1 ILE A 994 31.809 -18.251 20.853 1.00 56.66 C ATOM 2144 CG2 ILE A 994 31.214 -17.234 18.622 1.00 52.20 C ATOM 2145 CD1 ILE A 994 30.779 -19.381 20.731 1.00 57.03 C ATOM 2146 H ILE A 994 33.901 -17.102 19.370 1.00 0.00 H ATOM 2147 N ALA A 995 33.645 -15.956 22.442 1.00 47.90 N ATOM 2148 CA ALA A 995 33.901 -15.782 23.844 1.00 49.07 C ATOM 2149 C ALA A 995 34.311 -14.340 24.187 1.00 50.10 C ATOM 2150 O ALA A 995 34.260 -13.972 25.358 1.00 51.12 O ATOM 2151 CB ALA A 995 34.962 -16.773 24.291 1.00 51.30 C ATOM 2152 H ALA A 995 34.322 -16.521 21.890 1.00 0.00 H ATOM 2153 N GLN A 996 34.676 -13.527 23.183 1.00 48.37 N ATOM 2154 CA GLN A 996 35.072 -12.130 23.399 1.00 46.41 C ATOM 2155 C GLN A 996 33.857 -11.205 23.543 1.00 46.60 C ATOM 2156 O GLN A 996 34.022 -10.014 23.605 1.00 47.00 O ATOM 2157 CB GLN A 996 35.974 -11.651 22.260 1.00 44.55 C ATOM 2158 CG GLN A 996 37.367 -12.253 22.360 1.00 45.92 C ATOM 2159 CD GLN A 996 38.234 -11.932 21.173 1.00 45.12 C ATOM 2160 OE1 GLN A 996 38.520 -12.809 20.376 1.00 48.70 O ATOM 2161 NE2 GLN A 996 38.710 -10.703 21.080 1.00 39.26 N ATOM 2162 HE22 GLN A 996 38.439 -9.986 21.783 1.00 0.00 H ATOM 2163 HE21 GLN A 996 39.356 -10.453 20.304 1.00 0.00 H ATOM 2164 H GLN A 996 34.678 -13.902 22.213 1.00 0.00 H ATOM 2165 N VAL A 997 32.642 -11.751 23.589 1.00 43.82 N ATOM 2166 CA VAL A 997 31.474 -10.931 23.668 1.00 43.94 C ATOM 2167 C VAL A 997 30.702 -11.308 24.933 1.00 45.42 C ATOM 2168 O VAL A 997 30.402 -12.474 25.117 1.00 46.02 O ATOM 2169 CB VAL A 997 30.590 -11.118 22.428 1.00 43.82 C ATOM 2170 CG1 VAL A 997 29.295 -10.362 22.592 1.00 43.96 C ATOM 2171 CG2 VAL A 997 31.289 -10.760 21.115 1.00 42.44 C ATOM 2172 H VAL A 997 32.543 -12.786 23.567 1.00 0.00 H ATOM 2173 N ASN A 998 30.418 -10.306 25.779 1.00 44.50 N ATOM 2174 CA ASN A 998 29.531 -10.415 26.924 1.00 44.24 C ATOM 2175 C ASN A 998 28.382 -9.429 26.712 1.00 46.11 C ATOM 2176 O ASN A 998 28.565 -8.204 26.882 1.00 42.86 O ATOM 2177 CB ASN A 998 30.290 -10.133 28.220 1.00 47.89 C ATOM 2178 CG ASN A 998 29.602 -10.580 29.497 1.00 48.58 C ATOM 2179 OD1 ASN A 998 29.980 -10.125 30.564 1.00 50.79 O ATOM 2180 ND2 ASN A 998 28.676 -11.518 29.428 1.00 45.11 N ATOM 2181 HD22 ASN A 998 28.376 -11.885 28.502 1.00 0.00 H ATOM 2182 HD21 ASN A 998 28.247 -11.890 30.299 1.00 0.00 H ATOM 2183 H ASN A 998 30.866 -9.384 25.602 1.00 0.00 H ATOM 2184 N LEU A 999 27.217 -9.946 26.297 1.00 44.59 N ATOM 2185 CA LEU A 999 26.032 -9.105 26.068 1.00 45.65 C ATOM 2186 C LEU A 999 25.593 -8.439 27.375 1.00 46.58 C ATOM 2187 O LEU A 999 25.669 -9.050 28.407 1.00 47.38 O ATOM 2188 CB LEU A 999 24.920 -9.974 25.503 1.00 45.46 C ATOM 2189 CG LEU A 999 25.210 -10.600 24.143 1.00 45.14 C ATOM 2190 CD1 LEU A 999 23.961 -11.260 23.597 1.00 47.30 C ATOM 2191 CD2 LEU A 999 25.723 -9.556 23.167 1.00 46.73 C ATOM 2192 H LEU A 999 27.149 -10.971 26.132 1.00 0.00 H ATOM 2193 N LYS A1000 25.160 -7.170 27.322 1.00 45.58 N ATOM 2194 CA LYS A1000 24.811 -6.466 28.583 1.00 44.60 C ATOM 2195 C LYS A1000 23.387 -5.925 28.555 1.00 41.84 C ATOM 2196 O LYS A1000 22.658 -6.010 29.529 1.00 42.53 O ATOM 2197 CB LYS A1000 25.789 -5.330 28.840 1.00 44.41 C ATOM 2198 CG LYS A1000 27.220 -5.800 29.077 1.00 48.68 C ATOM 2199 CD LYS A1000 27.389 -6.567 30.379 1.00 51.00 C ATOM 2200 CE LYS A1000 28.852 -6.782 30.721 1.00 58.75 C ATOM 2201 NZ LYS A1000 29.043 -7.560 31.974 1.00 60.01 N ATOM 2202 HZ1 LYS A1000 28.602 -7.051 32.767 1.00 0.00 H ATOM 2203 HZ2 LYS A1000 28.600 -8.495 31.871 1.00 0.00 H ATOM 2204 HZ3 LYS A1000 30.060 -7.676 32.157 1.00 0.00 H ATOM 2205 H LYS A1000 25.070 -6.684 26.407 1.00 0.00 H ATOM 2206 N TYR A1001 23.014 -5.321 27.439 1.00 42.86 N ATOM 2207 CA TYR A1001 21.727 -4.693 27.316 1.00 43.63 C ATOM 2208 C TYR A1001 21.062 -5.084 25.997 1.00 44.33 C ATOM 2209 O TYR A1001 21.714 -5.338 24.970 1.00 44.42 O ATOM 2210 CB TYR A1001 21.866 -3.179 27.425 1.00 43.48 C ATOM 2211 CG TYR A1001 22.565 -2.722 28.677 1.00 44.34 C ATOM 2212 CD1 TYR A1001 21.872 -2.610 29.863 1.00 44.88 C ATOM 2213 CD2 TYR A1001 23.910 -2.382 28.671 1.00 43.75 C ATOM 2214 CE1 TYR A1001 22.497 -2.189 31.023 1.00 47.11 C ATOM 2215 CE2 TYR A1001 24.546 -1.944 29.821 1.00 44.70 C ATOM 2216 CZ TYR A1001 23.836 -1.843 31.000 1.00 47.17 C ATOM 2217 OH TYR A1001 24.437 -1.382 32.131 1.00 47.89 O ATOM 2218 HH TYR A1001 23.782 -1.378 32.873 1.00 0.00 H ATOM 2219 H TYR A1001 23.668 -5.300 26.631 1.00 0.00 H ATOM 2220 N LEU A1002 19.736 -5.092 26.053 1.00 46.36 N ATOM 2221 CA LEU A1002 18.898 -5.207 24.892 1.00 47.14 C ATOM 2222 C LEU A1002 17.910 -4.039 24.919 1.00 46.44 C ATOM 2223 O LEU A1002 17.232 -3.841 25.898 1.00 45.24 O ATOM 2224 CB LEU A1002 18.170 -6.551 24.962 1.00 48.46 C ATOM 2225 CG LEU A1002 17.236 -6.853 23.795 1.00 48.50 C ATOM 2226 CD1 LEU A1002 18.022 -6.883 22.498 1.00 49.79 C ATOM 2227 CD2 LEU A1002 16.530 -8.170 24.022 1.00 51.35 C ATOM 2228 H LEU A1002 19.281 -5.011 26.985 1.00 0.00 H ATOM 2229 N LEU A1003 17.889 -3.253 23.849 1.00 47.49 N ATOM 2230 CA LEU A1003 17.019 -2.124 23.776 1.00 49.56 C ATOM 2231 C LEU A1003 15.917 -2.466 22.786 1.00 51.21 C ATOM 2232 O LEU A1003 16.178 -3.042 21.722 1.00 51.17 O ATOM 2233 CB LEU A1003 17.760 -0.882 23.287 1.00 49.52 C ATOM 2234 CG LEU A1003 18.619 -0.148 24.298 1.00 49.81 C ATOM 2235 CD1 LEU A1003 19.608 -1.080 24.944 1.00 50.17 C ATOM 2236 CD2 LEU A1003 19.326 1.013 23.632 1.00 50.46 C ATOM 2237 H LEU A1003 18.519 -3.464 23.049 1.00 0.00 H ATOM 2238 N LYS A1004 14.699 -2.118 23.185 1.00 49.76 N ATOM 2239 CA LYS A1004 13.579 -2.051 22.312 1.00 52.04 C ATOM 2240 C LYS A1004 13.486 -0.610 21.814 1.00 50.70 C ATOM 2241 O LYS A1004 13.295 0.299 22.615 1.00 50.78 O ATOM 2242 CB LYS A1004 12.345 -2.507 23.092 1.00 53.28 C ATOM 2243 CG LYS A1004 11.023 -2.462 22.350 1.00 58.26 C ATOM 2244 CD LYS A1004 9.894 -2.882 23.272 1.00 60.98 C ATOM 2245 CE LYS A1004 8.510 -2.681 22.712 1.00 64.22 C ATOM 2246 NZ LYS A1004 7.527 -3.498 23.460 1.00 67.31 N ATOM 2247 HZ1 LYS A1004 7.782 -4.503 23.381 1.00 0.00 H ATOM 2248 HZ2 LYS A1004 7.533 -3.215 24.461 1.00 0.00 H ATOM 2249 HZ3 LYS A1004 6.578 -3.348 23.061 1.00 0.00 H ATOM 2250 H LYS A1004 14.557 -1.882 24.188 1.00 0.00 H ATOM 2251 N LEU A1005 13.668 -0.420 20.506 1.00 51.01 N ATOM 2252 CA LEU A1005 13.731 0.903 19.916 1.00 55.46 C ATOM 2253 C LEU A1005 12.507 1.167 19.047 1.00 56.71 C ATOM 2254 O LEU A1005 12.045 0.290 18.332 1.00 58.54 O ATOM 2255 CB LEU A1005 14.951 1.012 19.012 1.00 58.06 C ATOM 2256 CG LEU A1005 16.310 0.815 19.658 1.00 57.87 C ATOM 2257 CD1 LEU A1005 17.387 0.947 18.589 1.00 58.90 C ATOM 2258 CD2 LEU A1005 16.522 1.811 20.780 1.00 60.08 C ATOM 2259 H LEU A1005 13.768 -1.250 19.888 1.00 0.00 H ATOM 2260 N LYS A1006 12.055 2.420 19.081 1.00 59.66 N ATOM 2261 CA LYS A1006 11.093 2.978 18.150 1.00 61.02 C ATOM 2262 C LYS A1006 11.861 3.693 17.034 1.00 58.85 C ATOM 2263 O LYS A1006 12.707 4.532 17.321 1.00 59.39 O ATOM 2264 CB LYS A1006 10.172 3.958 18.891 1.00 65.80 C ATOM 2265 CG LYS A1006 9.110 4.667 18.056 1.00 67.98 C ATOM 2266 CD LYS A1006 8.067 3.735 17.492 1.00 69.99 C ATOM 2267 CE LYS A1006 7.127 4.399 16.502 1.00 74.75 C ATOM 2268 NZ LYS A1006 5.885 4.874 17.159 1.00 78.94 N ATOM 2269 HZ1 LYS A1006 5.391 4.066 17.589 1.00 0.00 H ATOM 2270 HZ2 LYS A1006 6.127 5.566 17.896 1.00 0.00 H ATOM 2271 HZ3 LYS A1006 5.269 5.321 16.451 1.00 0.00 H ATOM 2272 H LYS A1006 12.419 3.043 19.830 1.00 0.00 H ATOM 2273 N PHE A1007 11.575 3.318 15.785 1.00 58.03 N ATOM 2274 CA PHE A1007 12.033 4.004 14.594 1.00 61.99 C ATOM 2275 C PHE A1007 10.894 4.904 14.091 1.00 66.56 C ATOM 2276 O PHE A1007 9.799 4.406 13.796 1.00 68.49 O ATOM 2277 CB PHE A1007 12.431 2.998 13.502 1.00 62.69 C ATOM 2278 CG PHE A1007 13.661 2.160 13.768 1.00 59.11 C ATOM 2279 CD1 PHE A1007 13.683 1.220 14.794 1.00 59.86 C ATOM 2280 CD2 PHE A1007 14.788 2.291 12.977 1.00 57.53 C ATOM 2281 CE1 PHE A1007 14.816 0.452 15.033 1.00 56.72 C ATOM 2282 CE2 PHE A1007 15.914 1.516 13.209 1.00 55.87 C ATOM 2283 CZ PHE A1007 15.929 0.596 14.232 1.00 54.52 C ATOM 2284 H PHE A1007 10.981 2.474 15.658 1.00 0.00 H ATOM 2285 N ASN A1008 11.130 6.221 14.073 1.00 68.68 N ATOM 2286 CA ASN A1008 10.219 7.195 13.466 1.00 72.42 C ATOM 2287 C ASN A1008 10.826 7.571 12.121 1.00 72.40 C ATOM 2288 O ASN A1008 11.939 8.034 12.102 1.00 70.34 O ATOM 2289 CB ASN A1008 10.036 8.456 14.314 1.00 74.50 C ATOM 2290 CG ASN A1008 9.645 8.155 15.744 1.00 76.38 C ATOM 2291 OD1 ASN A1008 10.383 8.473 16.681 1.00 76.18 O ATOM 2292 ND2 ASN A1008 8.502 7.508 15.918 1.00 77.70 N ATOM 2293 HD22 ASN A1008 7.914 7.262 15.097 1.00 0.00 H ATOM 2294 HD21 ASN A1008 8.193 7.247 16.876 1.00 0.00 H ATOM 2295 H ASN A1008 12.005 6.571 14.512 1.00 0.00 H ATOM 2296 N PHE A1009 10.060 7.405 11.040 1.00 75.49 N ATOM 2297 CA PHE A1009 10.568 7.475 9.672 1.00 77.28 C ATOM 2298 C PHE A1009 10.378 8.876 9.063 1.00 83.42 C ATOM 2299 O PHE A1009 9.459 9.585 9.413 1.00 84.62 O ATOM 2300 CB PHE A1009 9.943 6.332 8.871 1.00 74.79 C ATOM 2301 CG PHE A1009 10.667 5.036 9.125 1.00 70.84 C ATOM 2302 CD1 PHE A1009 11.835 4.738 8.435 1.00 68.84 C ATOM 2303 CD2 PHE A1009 10.255 4.174 10.129 1.00 67.21 C ATOM 2304 CE1 PHE A1009 12.534 3.569 8.700 1.00 65.60 C ATOM 2305 CE2 PHE A1009 10.949 3.002 10.385 1.00 64.03 C ATOM 2306 CZ PHE A1009 12.077 2.694 9.666 1.00 63.38 C ATOM 2307 H PHE A1009 9.047 7.216 11.179 1.00 0.00 H ATOM 2308 N LYS A1010 11.293 9.240 8.149 1.00 88.21 N ATOM 2309 CA LYS A1010 11.384 10.552 7.481 1.00 94.63 C ATOM 2310 C LYS A1010 10.049 10.914 6.824 1.00 98.39 C ATOM 2311 O LYS A1010 9.185 10.065 6.674 1.00101.27 O ATOM 2312 CB LYS A1010 12.504 10.526 6.430 1.00 98.68 C ATOM 2313 CG LYS A1010 12.565 11.708 5.458 1.00104.12 C ATOM 2314 CD LYS A1010 12.039 11.413 4.055 1.00107.51 C ATOM 2315 CE LYS A1010 11.411 12.613 3.373 1.00112.90 C ATOM 2316 NZ LYS A1010 9.987 12.786 3.755 1.00114.71 N ATOM 2317 HZ1 LYS A1010 9.451 11.938 3.482 1.00 0.00 H ATOM 2318 HZ2 LYS A1010 9.920 12.924 4.784 1.00 0.00 H ATOM 2319 HZ3 LYS A1010 9.597 13.617 3.267 1.00 0.00 H ATOM 2320 H LYS A1010 12.005 8.529 7.887 1.00 0.00 H TER 2321 LYS A1010 HETATM 2322 O HOH 1 27.596 -1.948 7.999 1.00 54.88 O HETATM 2323 O HOH 2 42.592 -3.628 4.323 1.00 48.18 O HETATM 2324 O HOH 3 2.250 -16.409 42.791 1.00 48.45 O HETATM 2325 O HOH 4 51.812 -9.248 15.090 1.00 45.68 O HETATM 2326 O HOH 5 21.232 -7.322 6.471 1.00 68.87 O HETATM 2327 O HOH 6 18.138 8.612 23.448 1.00 54.03 O HETATM 2328 O HOH 7 21.403 -17.930 27.049 1.00 50.12 O HETATM 2329 O HOH 8 33.835 -11.019 4.901 1.00 83.63 O HETATM 2330 O HOH 9 40.174 -4.009 -0.145 1.00 51.65 O HETATM 2331 O HOH 10 7.677 -9.690 16.450 1.00 54.24 O HETATM 2332 O HOH 11 31.594 -8.319 31.623 1.00 45.07 O HETATM 2333 O HOH 12 36.239 -18.866 27.243 1.00 57.81 O HETATM 2334 O HOH 13 15.887 -16.451 16.382 1.00 54.79 O HETATM 2335 O HOH 14 23.261 -16.696 17.457 1.00 60.61 O HETATM 2336 O HOH 15 29.369 -14.159 21.487 1.00 43.78 O HETATM 2337 O HOH 16 27.938 -17.260 21.142 1.00 46.03 O HETATM 2338 O HOH 17 25.015 -11.955 28.805 1.00 44.25 O HETATM 2339 O HOH 18 19.759 -9.426 33.830 1.00 49.38 O HETATM 2340 O HOH 19 26.602 -5.485 5.499 1.00 51.46 O HETATM 2341 O HOH 20 33.206 8.974 22.629 1.00 51.65 O HETATM 2342 O HOH 21 26.658 -15.475 32.589 1.00 56.48 O HETATM 2343 O HOH 22 30.245 2.601 14.123 1.00 40.52 O HETATM 2344 O HOH 23 27.055 -13.259 22.899 1.00 43.71 O HETATM 2345 O HOH 24 15.547 -16.973 30.064 1.00 48.66 O HETATM 2346 O HOH 25 22.001 -15.951 33.392 1.00 54.02 O HETATM 2347 O HOH 26 31.443 -5.025 6.965 1.00 47.07 O HETATM 2348 O HOH 27 24.410 0.595 8.680 1.00 51.99 O HETATM 2349 O HOH 28 32.169 5.527 13.885 1.00 43.33 O HETATM 2350 O HOH 29 38.922 -12.080 17.651 1.00 44.97 O HETATM 2351 O HOH 30 38.141 6.045 12.656 1.00 45.54 O HETATM 2352 O HOH 31 46.943 -1.792 10.383 1.00 46.79 O HETATM 2353 O HOH 32 8.948 -4.471 25.911 1.00 51.46 O HETATM 2354 O HOH 33 24.719 -14.603 15.788 1.00 48.81 O HETATM 2355 O HOH 34 31.660 -14.593 26.264 1.00 53.58 O HETATM 2356 O HOH 35 38.663 -0.619 28.242 1.00 65.52 O HETATM 2357 O HOH 36 40.811 -10.636 1.426 1.00 51.70 O HETATM 2358 O HOH 37 13.269 -6.870 12.742 1.00 47.41 O HETATM 2359 O HOH 38 28.561 -18.028 33.392 1.00 53.44 O HETATM 2360 O HOH 39 27.033 -18.394 27.282 1.00 56.13 O HETATM 2361 O HOH 40 45.878 2.594 12.931 1.00 37.57 O HETATM 2362 O HOH 41 22.824 -19.787 27.576 1.00 63.62 O HETATM 2363 O HOH 42 14.996 -5.616 15.325 1.00 44.18 O HETATM 2364 O HOH 43 22.773 -8.561 11.945 1.00 59.41 O HETATM 2365 O HOH 44 20.413 10.919 28.737 1.00 63.15 O HETATM 2366 O HOH 45 12.752 -6.617 35.736 1.00 56.43 O HETATM 2367 O HOH 46 30.043 -18.925 16.115 1.00 49.63 O HETATM 2368 O HOH 47 25.841 -9.196 11.452 1.00 77.75 O HETATM 2369 O HOH 48 34.206 -18.723 18.277 1.00 51.08 O HETATM 2370 O HOH 49 43.895 -0.880 5.317 1.00 50.05 O HETATM 2371 O HOH 50 41.853 -0.140 28.069 1.00 67.44 O HETATM 2372 O HOH 51 27.554 11.117 11.826 1.00 51.24 O HETATM 2373 O HOH 52 19.634 -9.015 10.563 1.00 65.70 O HETATM 2374 O HOH 53 40.119 -14.920 11.698 1.00 67.22 O HETATM 2375 O HOH 54 6.728 -20.573 20.389 1.00 69.52 O HETATM 2376 O HOH 55 52.793 -6.925 14.587 1.00 58.15 O HETATM 2377 O HOH 56 45.461 -0.263 3.397 1.00 60.87 O HETATM 2378 O2 KYM A 57 21.165 -9.711 6.774 1.00 -0.39 O HETATM 2379 C13 KYM A 57 22.174 -10.325 7.060 1.00 0.21 C HETATM 2380 N1 KYM A 57 22.282 -11.654 6.852 1.00 -0.25 N HETATM 2381 C17 KYM A 57 23.354 -12.469 7.421 1.00 0.11 C HETATM 2382 C16 KYM A 57 22.569 -13.093 8.539 1.00 0.15 C HETATM 2383 N3 KYM A 57 22.934 -13.284 9.783 1.00 -0.29 N HETATM 2384 N4 KYM A 57 21.853 -13.873 10.439 1.00 -0.29 N HETATM 2385 C18 KYM A 57 20.888 -14.013 9.556 1.00 0.14 C HETATM 2386 C19 KYM A 57 19.547 -14.633 9.809 1.00 0.08 C HETATM 2387 C21 KYM A 57 19.063 -15.745 8.916 1.00 -0.05 C HETATM 2388 C20 KYM A 57 19.423 -16.044 10.319 1.00 -0.05 C HETATM 2389 H5 KYM A 57 19.525 -16.763 11.131 1.00 0.06 H HETATM 2390 H4 KYM A 57 18.707 -16.083 7.944 1.00 0.06 H HETATM 2391 H3 KYM A 57 18.849 -13.860 10.163 1.00 0.07 H HETATM 2392 N2 KYM A 57 21.282 -13.526 8.331 1.00 -0.21 N HETATM 2393 C15 KYM A 57 20.558 -13.418 7.046 1.00 0.08 C HETATM 2394 C14 KYM A 57 21.282 -12.442 6.116 1.00 0.06 C HETATM 2395 H8 KYM A 57 21.787 -13.011 5.321 1.00 0.06 H HETATM 2396 H9 KYM A 57 20.545 -11.759 5.668 1.00 0.06 H HETATM 2397 H6 KYM A 57 19.537 -13.053 7.233 1.00 0.06 H HETATM 2398 H7 KYM A 57 20.512 -14.408 6.570 1.00 0.06 H HETATM 2399 H1 KYM A 57 24.191 -11.858 7.790 1.00 0.08 H HETATM 2400 H2 KYM A 57 23.732 -13.217 6.709 1.00 0.08 H HETATM 2401 C12 KYM A 57 23.380 -9.565 7.511 1.00 0.05 C HETATM 2402 C11 KYM A 57 24.494 -9.519 6.677 1.00 -0.05 C HETATM 2403 C10 KYM A 57 25.605 -8.774 7.023 1.00 -0.05 C HETATM 2404 C9 KYM A 57 25.636 -8.021 8.198 1.00 -0.03 C HETATM 2405 C23 KYM A 57 24.521 -8.088 9.041 1.00 -0.05 C HETATM 2406 C22 KYM A 57 23.415 -8.851 8.706 1.00 -0.05 C HETATM 2407 H12 KYM A 57 22.568 -8.893 9.381 1.00 0.07 H HETATM 2408 H13 KYM A 57 24.523 -7.533 9.972 1.00 0.06 H HETATM 2409 C8 KYM A 57 26.836 -7.216 8.387 1.00 -0.01 C HETATM 2410 C7 KYM A 57 27.169 -6.320 9.319 1.00 0.18 C HETATM 2411 C6 KYM A 57 28.286 -5.378 9.248 1.00 0.20 C HETATM 2412 O1 KYM A 57 29.125 -5.302 8.351 1.00 -0.37 O HETATM 2413 C5 KYM A 57 28.136 -4.549 10.463 1.00 0.08 C HETATM 2414 C24 KYM A 57 27.019 -5.017 11.144 1.00 0.16 C HETATM 2415 O3 KYM A 57 26.437 -6.070 10.464 1.00 -0.23 O HETATM 2416 C1 KYM A 57 26.663 -4.474 12.383 1.00 0.09 C HETATM 2417 C KYM A 57 25.504 -4.928 13.207 1.00 0.20 C HETATM 2418 O KYM A 57 25.167 -4.269 14.205 1.00 -0.39 O HETATM 2419 N KYM A 57 24.870 -6.042 12.831 1.00 -0.30 N HETATM 2420 H15 KYM A 57 24.089 -6.376 13.360 1.00 0.18 H HETATM 2421 H16 KYM A 57 25.176 -6.542 12.021 1.00 0.18 H HETATM 2422 C2 KYM A 57 27.457 -3.460 12.921 1.00 -0.04 C HETATM 2423 C3 KYM A 57 28.578 -3.011 12.250 1.00 -0.06 C HETATM 2424 C4 KYM A 57 28.923 -3.546 11.020 1.00 -0.05 C HETATM 2425 H17 KYM A 57 29.800 -3.186 10.495 1.00 0.07 H HETATM 2426 H18 KYM A 57 29.192 -2.234 12.690 1.00 0.06 H HETATM 2427 H19 KYM A 57 27.191 -3.020 13.875 1.00 0.07 H HETATM 2428 H14 KYM A 57 27.602 -7.374 7.629 1.00 0.06 H HETATM 2429 H11 KYM A 57 26.470 -8.774 6.369 1.00 0.06 H HETATM 2430 H10 KYM A 57 24.490 -10.074 5.746 1.00 0.07 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 169 170 173 174 175 CONECT 173 169 CONECT 174 169 CONECT 175 169 CONECT 2378 2379 CONECT 2379 2378 2380 2401 CONECT 2380 2379 2381 2394 CONECT 2381 2380 2382 2399 2400 CONECT 2382 2381 2383 2392 CONECT 2383 2382 2384 CONECT 2384 2383 2385 CONECT 2385 2384 2386 2392 CONECT 2386 2385 2387 2388 2391 CONECT 2387 2386 2388 2390 CONECT 2388 2386 2387 2389 CONECT 2389 2388 CONECT 2390 2387 CONECT 2391 2386 CONECT 2392 2382 2385 2393 CONECT 2393 2392 2394 2397 2398 CONECT 2394 2380 2393 2395 2396 CONECT 2395 2394 CONECT 2396 2394 CONECT 2397 2393 CONECT 2398 2393 CONECT 2399 2381 CONECT 2400 2381 CONECT 2401 2379 2402 2406 CONECT 2402 2401 2403 2430 CONECT 2403 2402 2404 2429 CONECT 2404 2403 2405 2409 CONECT 2405 2404 2406 2408 CONECT 2406 2401 2405 2407 CONECT 2407 2406 CONECT 2408 2405 CONECT 2409 2404 2410 2428 CONECT 2410 2409 2411 2415 CONECT 2411 2410 2412 2413 CONECT 2412 2411 CONECT 2413 2411 2414 2424 CONECT 2414 2413 2415 2416 CONECT 2415 2410 2414 CONECT 2416 2414 2417 2422 CONECT 2417 2416 2418 2419 CONECT 2418 2417 CONECT 2419 2417 2420 2421 CONECT 2420 2419 CONECT 2421 2419 CONECT 2422 2416 2423 2427 CONECT 2423 2422 2424 2426 CONECT 2424 2413 2423 2425 CONECT 2425 2424 CONECT 2426 2423 CONECT 2427 2422 CONECT 2428 2409 CONECT 2429 2403 CONECT 2430 2402 MASTER 0 0 0 0 0 0 0 0 2428 2 61 20 END
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Related entries of code: 6nri
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%
6nrh
RCSB PDB
PDBbind
271aa, >6NRH_1|Chain... at 100%
6nrg
RCSB PDB
PDBbind
271aa, >6NRG_1|Chain... at 100%
6nrf
RCSB PDB
PDBbind
271aa, >6NRF_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6nri
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human PARP-1 ART domain
Ligand Name
KYM
EC.Number
E.C.2.4.2.30
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
IC50=27nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 5330-5357
Ligand Properties
Formula
C
2
5
H
1
9
N
5
O
4
Molecular Weight
453.449
Exact Mass
453.144
No. of atoms
53
No. of bonds
58
Polar Surface Area
120.41
LOGP Value
1.33 (
Computed with XLOGP3
)
2.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 6
Canonical SMILES
O=C(N1CCn2c(C1)nnc2[C@@H]1C=C1)c1ccc(cc1)/C=C/1\Oc2c(C1=O)cccc2C(=O)N
InChI String
InChI=1S/C25H19N5O4/c26-23(32)18-3-1-2-17-21(31)19(34-22(17)18)12-14-4-6-16(7-5-14)25(33)29-10-11-30-20(13-29)27-28-24(30)15-8-9-15/h1-9,12,15H,10-11,13H2,(H2,26,32)/b19-12-
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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